A0A5K4F185_SCHMA Loading...

Pleckstrin homology domain-containing family G member 7

AlphaFold DB , UniProt , Accession A0A5K4F185, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,232 aa.

						>A0A5K4F185_SCHMA|A0A5K4F185
MSKQSNYDSDSMHKSSPLNLLHKKKWNVLRTGVLWAQRFKSVKNTKSSEMTYTPLNNKSYNCSFPSQNYIMDNTTTTNSNTTNNTMNVTTYHYTPQRTLSSITKLNDKDYDYIDKLQKRNTVIKHYSSAKRLAKTFSSSINVNTVTSKSSDFESSNDLSKSPLLFSSRFQSSMYESNKDFKEVRFICEDSSRRNSVITNEIINNTDTTNNKQVVNTITHKTNYNENNSTINRKESVHNDSSENNMKTLIINGFWPGNPYSPLPSPDISILDSDLNESHFILDTEPTNDDKNLQRHESWQSLELDTVPSSSGTGDVESLSNKTVITTTPTATTTTTTTATSTMTNENNTEIIISKQDGQDNEQIDLASRRGRRSAIIDKKNLIGETEVENQETTTISQNVNKNLNETGQERPPLTSSVNSFRERQKKILRKQNTIADLSCRNQMANTNQDYELKRRGNVFMKLIERGTRSKDLNEALQSLKSSYFHDQYLESFRDSHWSQLDKSGNSENSMTDREVRRCEAVWELFKSELTFFTDHLMVLKNCFMEPLKKLQVDGYLMFVEPMHLFGNLDDLCYVSHTFCRELISNLSQESVSNEFGSTDVLLRPLKRWSEHSKDGEIYHNYCLNYDSALNYLDSLRKLEHFNEFEKWCEQDTRCRRLQLTDLLVAPMQHYMKIPLLLSSIRRYTACSAEQEMLTACLTKVENSLKSLEDKMRWLKNFERLQEIQSQLIWPSVSELEPRVFIPEFLRQSLIRQPCERLIANPKRQLLHEGFLTLNDGTKTIEIFAFLFDDFLLVTRIKKPPKKKSFSENPLTGRSITEGGVFVVYRQVIALDRFTIHDLGIVEATANGLRNAIVLVLITRFQQITGVYTLQAANELDKQRWIEKLRNSQQAFQEKLKRKLYGIDMDQHTNKHSKLINAKNKLSSQTSIADDYLSTSLSLGIKDSIDELNKSTDLCKGNITDQKNSELSLKKLIKSKTLQTEQQHQQGSGDDNPQEDDNSNELLNTTDSSQVTTVEVNYATVNNTVIVNIPDTNMNTKNLEPDNTLSGNTDYSSDESIPNNNKIRPNDNLSLHNKTPDYIIRNRHSLDPNFATLNISNTKYSDSIGITSTSSVTMNSPNTHIQITPVTEKQIVAPIFSPPSLLLFDRVTQHNEFPFEMTRQVQFSPPLSPILHAPCASLPLDITAQSVYDLPDRMLSQMNISDDSSKLNNLINKRSIKGYSASPPVNRKNDESN
					

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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	33.6	Very low	29.4	Very low	231 Å²	231	143.8 Å²	143.8	100%	1.138	77%	0.765	S	S	*	*				0	101.7	0	-66.7	165.8	78.8	0	0	106.8
2	S	27.6	Very low	29.2	Very low	100 Å²	100	146 Å²	146	70%	0.699	77%	0.771	S	S	*	*				65.7	117	79.3	66.2	0	0	0	0	112.6
3	K	32.5	Very low	29.3	Very low	178 Å²	178	148.1 Å²	148.1	77%	0.774	77%	0.774	S	S	*	*			cis	-155.8	154.3	6.8	-109.8	-178.3	179.7	178.9	0	111.6
4	Q	28.5	Very low	29.2	Very low	157 Å²	157	150.8 Å²	150.8	73%	0.734	78%	0.776	S	S	*	*				18.2	143.4	128.8	-72.3	163.1	-42.6	0	0	119.3
5	S	29.3	Very low	29.1	Very low	89 Å²	89	148.4 Å²	148.4	62%	0.622	78%	0.778	S	S	*	*			cis	179.1	165	2	48.3	0	0	0	0	114.1
6	N	28.4	Very low	29.1	Very low	126 Å²	126	145.3 Å²	145.3	67%	0.674	77%	0.772	S	S	*	*			trans	81.3	129.5	138.9	-78.7	6.5	0	0	0	122
7	Y	28.1	Very low	29.1	Very low	200 Å²	200	142.6 Å²	142.6	78%	0.784	77%	0.765	S	S	*	*			trans	46.1	129.5	145.4	-59.7	-69	0	0	0	119
8	D	29	Very low	29.2	Very low	150 Å²	150	138.1 Å²	138.1	80%	0.802	74%	0.741	S	S	*	*				-147.2	174.6	55.7	-124.4	-36.1	0	0	0	117.3
9	S	25.8	Very low	29.4	Very low	110 Å²	110	137.4 Å²	137.4	77%	0.769	74%	0.737	S	S	*	*			trans	-29.9	132.9	-175.8	63.2	0	0	0	0	119.1
10	D	30.9	Very low	29.4	Very low	160 Å²	160	136.6 Å²	136.6	86%	0.856	73%	0.731	S	S	*	*			trans	-127	160	161.7	-147.4	-25	0	0	0	111.7
11	S	29.8	Very low	29.5	Very low	81 Å²	81	133.5 Å²	133.5	57%	0.566	72%	0.715	S	S	*	*			trans	-82.8	140.4	-149.6	65.8	0	0	0	0	117.7	H13	S11-H13 PolarHBondContact O-N 3.36Å; S11-H13 VanDerWaalsContact O-N 3.15Å
12	M	26.4	Very low	29.7	Very low	170 Å²	170	126 Å²	126	84%	0.837	68%	0.677	S	S	*	*			trans	-79.7	86.9	171.5	-70.7	-159.6	88.8	0	0	113.1	K14	M12-K14 PolarHBondContact O-N 2.96Å
13	H	31	Very low	30.1	Very low	173 Å²	173	128.7 Å²	128.7	80%	0.801	68%	0.676	S	S	*	*			trans	-80.3	99.8	165.5	-88	-73.5	0	0	0	112.1	S11 S15	S11-H13 PolarHBondContact O-N 3.36Å; S11-H13 VanDerWaalsContact O-N 3.15Å; H13-S15 PolarHBondContact O-N 3.32Å
14	K	28.5	Very low	30.2	Very low	186 Å²	186	126.9 Å²	126.9	81%	0.809	67%	0.668	S	S	*	*			trans	-69.6	112.5	175.6	-69.5	179.4	178.9	175.4	0	111.8	M12	M12-K14 PolarHBondContact O-N 2.96Å
15	S	27.2	Very low	30.6	Very low	115 Å²	115	122.6 Å²	122.6	80%	0.804	65%	0.647	S	S	*	*			trans	-75	135.8	167.8	53.1	0	0	0	0	111.2	H13	H13-S15 PolarHBondContact O-N 3.32Å
16	S	28.6	Very low	31.4	Very low	98 Å²	98	121.7 Å²	121.7	69%	0.685	63%	0.63	S	S	*	*			trans	-80.6	129.5	-167	-63.6	0	0	0	0	113.5	L18	S16-L18 VanDerWaalsContact C-N 3.25Å; S16-L18 PolarHBondContact O-N 2.66Å; S16-L18 VanDerWaalsContact O-N 3.13Å
17	P	30.3	Very low	31.8	Very low	101 Å²	101	119 Å²	119	66%	0.656	62%	0.616	S	S	*	*			trans	-72.5	0.7	-176.9	-21.3	34	0	0	0	117.5	N19 L20	P17-N19 PolarHBondContact O-N 3.09Å; P17-L20 PolarHBondContact O-N 2.97Å; P17-L20 VanDerWaalsContact O-N 3.12Å
18	L	30.9	Very low	32.3	Very low	61 Å²	61	113.4 Å²	113.4	32%	0.319	60%	0.602	S	S	.	*	H	α-helix	trans	-56.6	-40.5	-160	-79.6	162.5	0	0	0	115.1	S16 L20 L21	S16-L18 VanDerWaalsContact C-N 3.25Å; S16-L18 PolarHBondContact O-N 2.66Å; S16-L18 VanDerWaalsContact O-N 3.13Å; L18-L20 VanDerWaalsContact C-N 3.26Å; L18-L20 PolarHBondContact O-N 2.96Å; L18-L21 WeakPolarHBondContact O-CA 3.37Å; L18-L21 WeakPolarHBondContact O-CB 3.44Å; L18-L21 PolarHBondContact O-N 3.39Å
19	N	31.8	Very low	33	Very low	125 Å²	125	108 Å²	108	67%	0.668	57%	0.572	S	S	*	*	H	α-helix	trans	-66.1	-23.6	-178.2	-77.6	-33.1	0	0	0	114.1	P17 L21	P17-N19 PolarHBondContact O-N 3.09Å; N19-L21 VanDerWaalsContact C-N 3.34Å
20	L	29.8	Very low	33.6	Very low	120 Å²	120	108.7 Å²	108.7	63%	0.628	56%	0.558	S	S	*	*	H	α-helix	trans	-82.1	-16.9	171.8	-127.4	75.2	0	0	0	112.4	P17 L18	P17-L20 PolarHBondContact O-N 2.97Å; P17-L20 VanDerWaalsContact O-N 3.12Å; L18-L20 VanDerWaalsContact C-N 3.26Å; L18-L20 PolarHBondContact O-N 2.96Å
21	L	30.9	Very low	34.2	Very low	73 Å²	73	104.9 Å²	104.9	38%	0.382	54%	0.541	S	S	.	.	H	α-helix	trans	-76.8	-31.7	-177.6	-131.1	76.1	0	0	0	112.4	L18 N19 K24 K25	L18-L21 WeakPolarHBondContact O-CA 3.37Å; L18-L21 WeakPolarHBondContact O-CB 3.44Å; L18-L21 PolarHBondContact O-N 3.39Å; N19-L21 VanDerWaalsContact C-N 3.34Å; L21-K24 CarbonylContact O-C 3.52Å; L21-K24 PolarHBondContact O-N 3.21Å; L21-K25 HydrophobicContact CD2-CD 4.49Å; L21-K25 PolarHBondContact O-N 3.34Å
22	H	37.7	Very low	34.6	Very low	73 Å²	73	102.7 Å²	102.7	34%	0.338	53%	0.531	S	S	.	.	H	α-helix	trans	-57.8	-55.5	176.4	-105.9	-126.7	0	0	0	111.8	K24 K25 W26 D626	H22-K24 PolarHBondContact O-N 3.25Å; H22-K24 VanDerWaalsContact O-N 3.14Å; H22-K25 PolarHBondContact O-N 3.37Å; H22-W26 VanDerWaalsContact O-CD1 3.24Å; H22-W26 PolarHBondContact O-N 3.07Å; H22-D626 IonicContact CE1-OD1 3.49Å; H22-D626 IonicContact CE1-OD2 3.51Å
23	K	36.2	Very low	35.4	Very low	156 Å²	156	97 Å²	97	68%	0.678	51%	0.506	S	S	*	.	H	α-helix	trans	-59.2	-27.5	177.7	-74.1	-168.2	175.6	-171.9	0	112.8	E1014	K23-E1014 IonicContact NZ-OE1 2.58Å
24	K	34.8	Very low	35.6	Very low	141 Å²	141	92.9 Å²	92.9	61%	0.613	49%	0.49	S	S	*	.	H	α-helix	trans	-84.6	-37.9	176.4	-71.9	-174.8	174.9	-177.7	0	114.2	L21 H22 N27 V28	L21-K24 CarbonylContact O-C 3.52Å; L21-K24 PolarHBondContact O-N 3.21Å; H22-K24 PolarHBondContact O-N 3.25Å; H22-K24 VanDerWaalsContact O-N 3.14Å; K24-N27 WeakPolarHBondContact O-CB 3.39Å; K24-N27 PolarHBondContact O-N 3.1Å; K24-V28 PolarHBondContact O-N 3.07Å
25	K	38.1	Very low	35.8	Very low	66 Å²	66	92 Å²	92	29%	0.287	48%	0.481	S	S	.	.	H	α-helix	trans	-69.9	-34.1	175.2	-81.2	-168.2	170.5	-173	0	111.6	L21 H22 N27 V28 D661	L21-K25 HydrophobicContact CD2-CD 4.49Å; L21-K25 PolarHBondContact O-N 3.34Å; H22-K25 PolarHBondContact O-N 3.37Å; K25-N27 VanDerWaalsContact C-N 3.28Å; K25-N27 PolarHBondContact O-N 3.45Å; K25-V28 VanDerWaalsContact O-CB 3.29Å; K25-V28 WeakPolarHBondContact O-CB 3.37Å; K25-V28 PolarHBondContact O-N 3.41Å; K25-D661 IonicContact NZ-OD1 3.54Å; K25-D661 PolarHBondContact NZ-OD1 3.5Å
26	W	46	Very low	36.2	Very low	71 Å²	71	87.7 Å²	87.7	27%	0.269	45%	0.453	S	S	.	.	H	α-helix	trans	-67	-26.8	171.2	-75.8	102.8	0	0	0	113.4	H22 V28 L29 R30 D626 M667 M711	H22-W26 VanDerWaalsContact O-CD1 3.24Å; H22-W26 PolarHBondContact O-N 3.07Å; W26-V28 PolarHBondContact O-N 3Å; W26-L29 HydrophobicContact CD2-CD1 4.4Å; W26-L29 HydrophobicContact CE3-CD1 3.75Å; W26-L29 HydrophobicContact CZ3-CD1 3.92Å; W26-L29 HydrophobicContact CZ3-CD2 4.34Å; W26-L29 PolarHBondContact O-N 3.34Å; W26-R30 PolarHBondContact O-N 3.17Å; W26-D626 WeakPolarHBondContact CZ2-OD1 3.46Å; W26-M667 HydrophobicContact CH2-CE 4.29Å; W26-M667 HydrophobicContact CZ3-CE 4.44Å; W26-M711 HydrophobicContact CH2-SD 4.2Å; W26-M711 HydrophobicContact CZ3-SD 4.24Å
27	N	36.6	Very low	36.6	Very low	70 Å²	70	88.6 Å²	88.6	37%	0.374	45%	0.446	S	S	.	.	H	α-helix	trans	-67	-23.2	167.3	-84.8	-16.5	0	0	0	112.6	K24 K25 R30 T31	K24-N27 WeakPolarHBondContact O-CB 3.39Å; K24-N27 PolarHBondContact O-N 3.1Å; K25-N27 VanDerWaalsContact C-N 3.28Å; K25-N27 PolarHBondContact O-N 3.45Å; N27-R30 PolarHBondContact O-N 3.25Å; N27-T31 WeakPolarHBondContact O-CB 3.5Å; N27-T31 WeakPolarHBondContact O-CG2 3.26Å; N27-T31 PolarHBondContact O-N 2.98Å; N27-T31 PolarHBondContact O-OG1 3.2Å
28	V	38.6	Very low	36.7	Very low	82 Å²	82	92.8 Å²	92.8	50%	0.497	45%	0.449	S	S	.	.	H	α-helix	trans	-68.8	-37.3	176.5	-178.2	0	0	0	0	111.8	K24 K25 W26 T31 G32	K24-V28 PolarHBondContact O-N 3.07Å; K25-V28 VanDerWaalsContact O-CB 3.29Å; K25-V28 WeakPolarHBondContact O-CB 3.37Å; K25-V28 PolarHBondContact O-N 3.41Å; W26-V28 PolarHBondContact O-N 3Å; V28-T31 WeakPolarHBondContact CA-OG1 3.49Å; V28-T31 PolarHBondContact O-OG1 3.21Å; V28-G32 WeakPolarHBondContact O-CA 3.32Å; V28-G32 PolarHBondContact O-N 3.15Å
29	L	43	Very low	36.8	Very low	35 Å²	35	95.4 Å²	95.4	18%	0.183	46%	0.458	C	S	.	.	H	α-helix	trans	-59.5	-52.2	169.1	-81.7	104.8	0	0	0	110.8	W26 T31 G32 V33 M667 M671	W26-L29 HydrophobicContact CD2-CD1 4.4Å; W26-L29 HydrophobicContact CE3-CD1 3.75Å; W26-L29 HydrophobicContact CZ3-CD1 3.92Å; W26-L29 HydrophobicContact CZ3-CD2 4.34Å; W26-L29 PolarHBondContact O-N 3.34Å; L29-T31 PolarHBondContact O-N 3.34Å; L29-G32 PolarHBondContact O-N 3.43Å; L29-G32 VanDerWaalsContact O-N 3.12Å; L29-V33 PolarHBondContact O-N 3.43Å; L29-M667 HydrophobicContact CD1-CE 3.78Å; L29-M667 HydrophobicContact CD2-CE 3.55Å; L29-M667 HydrophobicContact CG-CE 4.12Å; L29-M671 HydrophobicContact CD2-CE 3.84Å; L29-M671 HydrophobicContact CD2-SD 3.73Å; L29-M671 HydrophobicContact CG-CE 3.88Å; L29-M671 HydrophobicContact CG-SD 3.9Å
30	R	39.1	Very low	37.1	Very low	125 Å²	125	95.6 Å²	95.6	47%	0.472	45%	0.453	S	S	.	.	H	α-helix	trans	-65.9	-39.6	-175.5	-146.1	172.8	-162.8	136.2	3.8	112	W26 N27 L34 Y1017	W26-R30 PolarHBondContact O-N 3.17Å; N27-R30 PolarHBondContact O-N 3.25Å; R30-L34 WeakPolarHBondContact O-CB 3.34Å; R30-L34 WeakPolarHBondContact O-CD1 3.43Å; R30-L34 WeakPolarHBondContact O-CG 3.28Å; R30-L34 PolarHBondContact O-N 3.3Å; R30-Y1017 VanDerWaalsContact NH1-CE2 3.26Å; R30-Y1017 PolarHBondContact NH1-OH 2.83Å
31	T	43.9	Very low	37.3	Very low	80 Å²	80	94.6 Å²	94.6	49%	0.491	46%	0.456	S	S	.	.	H	α-helix	trans	-72.7	-28.6	173.3	57.2	0	0	0	0	112.5	N27 V28 L29 L34 W35	N27-T31 WeakPolarHBondContact O-CB 3.5Å; N27-T31 WeakPolarHBondContact O-CG2 3.26Å; N27-T31 PolarHBondContact O-N 2.98Å; N27-T31 PolarHBondContact O-OG1 3.2Å; V28-T31 WeakPolarHBondContact CA-OG1 3.49Å; V28-T31 PolarHBondContact O-OG1 3.21Å; L29-T31 PolarHBondContact O-N 3.34Å; T31-L34 CarbonylContact O-C 3.44Å; T31-W35 WeakPolarHBondContact O-CA 3.47Å; T31-W35 VanDerWaalsContact O-CB 3.26Å; T31-W35 WeakPolarHBondContact O-CB 3.5Å; T31-W35 PolarHBondContact O-N 3.42Å
32	G	37.6	Very low	37.4	Very low	35 Å²	35	95.7 Å²	95.7	36%	0.361	47%	0.465	S	S	.	.	H	α-helix	trans	-69.1	-48.7	176.3	0	0	0	0	0	112.4	V28 L29 L34 W35 A36	V28-G32 WeakPolarHBondContact O-CA 3.32Å; V28-G32 PolarHBondContact O-N 3.15Å; L29-G32 PolarHBondContact O-N 3.43Å; L29-G32 VanDerWaalsContact O-N 3.12Å; G32-L34 VanDerWaalsContact C-N 3.35Å; G32-W35 WeakPolarHBondContact O-CA 3.37Å; G32-W35 VanDerWaalsContact O-CB 3.3Å; G32-W35 WeakPolarHBondContact O-CB 3.14Å; G32-W35 PolarHBondContact O-N 3.2Å; G32-A36 PolarHBondContact O-N 3.43Å
33	V	42	Very low	37	Very low	51 Å²	51	98.9 Å²	98.9	31%	0.309	48%	0.478	S	S	.	.	H	α-helix	trans	-63	-41.7	172.3	176.4	0	0	0	0	110.7	L29 W35 A36 Q37	L29-V33 PolarHBondContact O-N 3.43Å; V33-W35 VanDerWaalsContact C-N 3.3Å; V33-W35 PolarHBondContact O-N 3.42Å; V33-A36 WeakPolarHBondContact O-CB 3.3Å; V33-A36 PolarHBondContact O-N 3.01Å; V33-Q37 WeakPolarHBondContact O-CG 3.29Å; V33-Q37 PolarHBondContact O-N 3.27Å
34	L	36.3	Very low	36.6	Very low	87 Å²	87	99.4 Å²	99.4	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-66.6	-27.8	171.6	-72.5	169.2	0	0	0	112.8	R30 T31 G32 R38	R30-L34 WeakPolarHBondContact O-CB 3.34Å; R30-L34 WeakPolarHBondContact O-CD1 3.43Å; R30-L34 WeakPolarHBondContact O-CG 3.28Å; R30-L34 PolarHBondContact O-N 3.3Å; T31-L34 CarbonylContact O-C 3.44Å; G32-L34 VanDerWaalsContact C-N 3.35Å; L34-R38 WeakPolarHBondContact O-CB 3.4Å; L34-R38 PolarHBondContact O-N 3.45Å
35	W	32.6	Very low	36.6	Very low	167 Å²	167	99.2 Å²	99.2	63%	0.633	50%	0.499	S	S	*	.	H	α-helix	trans	-67.9	-48	173.2	-131.4	56.2	0	0	0	109.6	T31 G32 V33 Q37 R38 F39	T31-W35 WeakPolarHBondContact O-CA 3.47Å; T31-W35 VanDerWaalsContact O-CB 3.26Å; T31-W35 WeakPolarHBondContact O-CB 3.5Å; T31-W35 PolarHBondContact O-N 3.42Å; G32-W35 WeakPolarHBondContact O-CA 3.37Å; G32-W35 VanDerWaalsContact O-CB 3.3Å; G32-W35 WeakPolarHBondContact O-CB 3.14Å; G32-W35 PolarHBondContact O-N 3.2Å; V33-W35 VanDerWaalsContact C-N 3.3Å; V33-W35 PolarHBondContact O-N 3.42Å; W35-Q37 VanDerWaalsContact C-N 3.34Å; W35-Q37 PolarHBondContact O-N 3.27Å; W35-R38 PolarHBondContact O-N 3.46Å; W35-F39 AromaticContact CD2-CD2 3.96Å; W35-F39 HydrophobicContact CD2-CD2 3.96Å; W35-F39 AromaticContact CD2-CE2 3.76Å; W35-F39 HydrophobicContact CD2-CE2 3.76Å; W35-F39 AromaticContact CE2-CE2 3.7Å; W35-F39 HydrophobicContact CE3-CD2 4.04Å; W35-F39 AromaticContact CE3-CE2 3.85Å; W35-F39 HydrophobicContact CE3-CE2 3.85Å; W35-F39 HydrophobicContact CG-CD2 4.32Å; W35-F39 HydrophobicContact CG-CE2 4.46Å; W35-F39 AromaticContact CH2-CE2 3.87Å; W35-F39 HydrophobicContact CH2-CE2 3.87Å; W35-F39 HydrophobicContact CH2-CZ 4.38Å; W35-F39 AromaticContact CZ2-CE2 3.77Å; W35-F39 HydrophobicContact CZ2-CE2 3.77Å; W35-F39 HydrophobicContact CZ2-CZ 4.46Å; W35-F39 HydrophobicContact CZ3-CD2 4.46Å; W35-F39 AromaticContact CZ3-CE2 3.9Å; W35-F39 HydrophobicContact CZ3-CE2 3.9Å; W35-F39 WeakPolarHBondContact O-CB 3.47Å; W35-F39 PolarHBondContact O-N 3.41Å
36	A	36	Very low	36.1	Very low	25 Å²	25	105.5 Å²	105.5	21%	0.207	53%	0.526	C	S	.	.	H	α-helix	trans	-55.5	-48.1	175.5	0	0	0	0	0	111.7	G32 V33 K40 L675	G32-A36 PolarHBondContact O-N 3.43Å; V33-A36 WeakPolarHBondContact O-CB 3.3Å; V33-A36 PolarHBondContact O-N 3.01Å; A36-K40 WeakPolarHBondContact O-CG 3.3Å; A36-K40 PolarHBondContact O-N 3.05Å; A36-L675 HydrophobicContact CB-CD2 3.68Å
37	Q	36.9	Very low	35.1	Very low	117 Å²	117	107.6 Å²	107.6	55%	0.547	55%	0.552	S	S	.	*	H	α-helix	trans	-69.4	-37.1	178.3	-70.8	175.3	-23.9	0	0	112.9	V33 W35 K40	V33-Q37 WeakPolarHBondContact O-CG 3.29Å; V33-Q37 PolarHBondContact O-N 3.27Å; W35-Q37 VanDerWaalsContact C-N 3.34Å; W35-Q37 PolarHBondContact O-N 3.27Å; Q37-K40 PolarHBondContact O-N 3.35Å
38	R	31.5	Very low	34.7	Very low	189 Å²	189	110.1 Å²	110.1	71%	0.713	58%	0.575	S	S	*	*	H	α-helix	trans	-77.5	-31.6	-179	-159.5	168.6	-169.4	134.5	-6.2	112.1	L34 W35 S41 V42	L34-R38 WeakPolarHBondContact O-CB 3.4Å; L34-R38 PolarHBondContact O-N 3.45Å; W35-R38 PolarHBondContact O-N 3.46Å; R38-S41 WeakPolarHBondContact O-CA 3.16Å; R38-S41 WeakPolarHBondContact O-CB 3.45Å; R38-S41 PolarHBondContact O-N 3.01Å; R38-V42 WeakPolarHBondContact O-CG2 3.03Å; R38-V42 PolarHBondContact O-N 3.13Å
39	F	34.3	Very low	34	Very low	116 Å²	116	115.1 Å²	115.1	51%	0.509	59%	0.593	S	S	.	*	H	α-helix	trans	-67.6	-33.7	168.6	-98.4	-83.5	0	0	0	112.8	W35 S41 V42	W35-F39 AromaticContact CD2-CD2 3.96Å; W35-F39 HydrophobicContact CD2-CD2 3.96Å; W35-F39 AromaticContact CD2-CE2 3.76Å; W35-F39 HydrophobicContact CD2-CE2 3.76Å; W35-F39 AromaticContact CE2-CE2 3.7Å; W35-F39 HydrophobicContact CE3-CD2 4.04Å; W35-F39 AromaticContact CE3-CE2 3.85Å; W35-F39 HydrophobicContact CE3-CE2 3.85Å; W35-F39 HydrophobicContact CG-CD2 4.32Å; W35-F39 HydrophobicContact CG-CE2 4.46Å; W35-F39 AromaticContact CH2-CE2 3.87Å; W35-F39 HydrophobicContact CH2-CE2 3.87Å; W35-F39 HydrophobicContact CH2-CZ 4.38Å; W35-F39 AromaticContact CZ2-CE2 3.77Å; W35-F39 HydrophobicContact CZ2-CE2 3.77Å; W35-F39 HydrophobicContact CZ2-CZ 4.46Å; W35-F39 HydrophobicContact CZ3-CD2 4.46Å; W35-F39 AromaticContact CZ3-CE2 3.9Å; W35-F39 HydrophobicContact CZ3-CE2 3.9Å; W35-F39 WeakPolarHBondContact O-CB 3.47Å; W35-F39 PolarHBondContact O-N 3.41Å; F39-S41 PolarHBondContact O-N 3.22Å; F39-S41 VanDerWaalsContact O-N 3.08Å; F39-V42 PolarHBondContact O-N 3.48Å
40	K	37	Very low	33.2	Very low	129 Å²	129	121.5 Å²	121.5	56%	0.561	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-14.1	168	-72.8	178.6	-175.7	178.9	0	112.5	A36 Q37 E701	A36-K40 WeakPolarHBondContact O-CG 3.3Å; A36-K40 PolarHBondContact O-N 3.05Å; Q37-K40 PolarHBondContact O-N 3.35Å; K40-E701 IonicContact NZ-OE1 3.44Å; K40-E701 PolarHBondContact NZ-OE1 3.47Å; K40-E701 IonicContact NZ-OE2 2.69Å
41	S	34.7	Very low	32.5	Very low	99 Å²	99	121.7 Å²	121.7	69%	0.692	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	-3	179.1	-173.8	0	0	0	0	115.9	R38 F39	R38-S41 WeakPolarHBondContact O-CA 3.16Å; R38-S41 WeakPolarHBondContact O-CB 3.45Å; R38-S41 PolarHBondContact O-N 3.01Å; F39-S41 PolarHBondContact O-N 3.22Å; F39-S41 VanDerWaalsContact O-N 3.08Å
42	V	32.6	Very low	31.7	Very low	96 Å²	96	127.8 Å²	127.8	58%	0.582	66%	0.655	S	S	*	*			trans	-119.5	70.6	-175.5	-175	0	0	0	0	111.1	R38 F39	R38-V42 WeakPolarHBondContact O-CG2 3.03Å; R38-V42 PolarHBondContact O-N 3.13Å; F39-V42 PolarHBondContact O-N 3.48Å
43	K	29.9	Very low	31.2	Very low	140 Å²	140	131.6 Å²	131.6	61%	0.609	67%	0.671	S	S	*	*			trans	-143.3	56.6	168.3	-73.2	-154	172.9	-155.9	0	112.3
44	N	28.1	Very low	30.3	Very low	166 Å²	166	135.2 Å²	135.2	89%	0.888	70%	0.695	S	S	*	*			trans	-157.7	61.5	169.3	-123.3	-12.2	0	0	0	114.6
45	T	33.1	Very low	30	Very low	137 Å²	137	139.3 Å²	139.3	84%	0.84	72%	0.717	S	S	*	*			trans	-143.1	121.6	165	46	0	0	0	0	109.1
46	K	28.1	Very low	29.6	Very low	199 Å²	199	137.3 Å²	137.3	87%	0.865	72%	0.719	S	S	*	*			trans	-93.5	152.9	172.1	-76.2	-169	173.6	-170.8	0	110.9
47	S	24.6	Very low	29.1	Very low	115 Å²	115	142.3 Å²	142.3	80%	0.804	74%	0.742	S	S	*	*			trans	46.6	104.3	146.9	60.1	0	0	0	0	119.5
48	S	28.5	Very low	28.7	Very low	122 Å²	122	146.1 Å²	146.1	85%	0.853	76%	0.756	S	S	*	*			trans	-148.9	149.1	130.4	48.1	0	0	0	0	108.6
49	E	23.9	Very low	28.4	Very low	188 Å²	188	141.9 Å²	141.9	88%	0.879	76%	0.756	S	S	*	*			trans	-77.7	147.5	-175	-63.5	137.5	111.3	0	0	112.3
50	M	27.2	Very low	28.1	Very low	168 Å²	168	146.3 Å²	146.3	83%	0.828	77%	0.771	S	S	*	*			trans	-150.1	114.8	146.4	-141.2	173.6	-166.6	0	0	110.8
51	T	23.1	Very low	27.4	Very low	130 Å²	130	147.4 Å²	147.4	80%	0.798	78%	0.783	S	S	*	*			trans	-77.2	134.1	175.6	36	0	0	0	0	110.9
52	Y	27.8	Very low	27	Very low	208 Å²	208	148.5 Å²	148.5	82%	0.816	79%	0.789	S	S	*	*			trans	-139.4	147.2	159	-97.9	-79.3	0	0	0	110.6
53	T	26.5	Very low	26.7	Very low	115 Å²	115	149.3 Å²	149.3	71%	0.706	80%	0.799	S	S	*	*			trans	-96.8	152.3	-158.7	43.3	0	0	0	0	114	L55	T53-L55 PolarHBondContact O-N 2.97Å
54	P	24.5	Very low	26.4	Very low	126 Å²	126	152.1 Å²	152.1	82%	0.818	81%	0.811	S	S	*	*			trans	-76.2	109	172.9	30.8	-32.8	0	0	0	110.6	N56	P54-N56 PolarHBondContact O-N 3Å
55	L	28.5	Very low	26.4	Very low	173 Å²	173	150 Å²	150	91%	0.906	81%	0.807	S	S	*	*			trans	-80.4	101.2	174	-104.7	167.2	0	0	0	110.8	T53	T53-L55 PolarHBondContact O-N 2.97Å
56	N	25.7	Very low	25.9	Very low	126 Å²	126	148.7 Å²	148.7	67%	0.674	80%	0.804	S	S	*	*			trans	-81.2	158.8	179.7	-164	8	0	0	0	112.2	P54	P54-N56 PolarHBondContact O-N 3Å
57	N	25.2	Very low	26	Very low	130 Å²	130	147.7 Å²	147.7	70%	0.695	80%	0.802	S	S	*	*			trans	51.4	101.3	163.3	-70.8	-30.1	0	0	0	118.9
58	K	29	Very low	26	Very low	196 Å²	196	149 Å²	149	85%	0.852	80%	0.8	S	S	*	*				-127.8	108.3	128.1	-82.3	-163.8	175.1	-179	0	110.5
59	S	23.2	Very low	26.1	Very low	101 Å²	101	153.9 Å²	153.9	71%	0.706	80%	0.801	S	S	*	*			trans	-70.5	131.9	174.4	36.9	0	0	0	0	111.2
60	Y	27.9	Very low	26.2	Very low	209 Å²	209	151.3 Å²	151.3	82%	0.82	79%	0.792	S	S	*	*			trans	-126.3	97.7	160.3	-84.7	-76.4	0	0	0	108.5	C62	Y60-C62 PolarHBondContact O-N 2.84Å
61	N	23.7	Very low	26.4	Very low	151 Å²	151	151 Å²	151	81%	0.807	79%	0.79	S	S	*	*			trans	-68.8	125.7	168.5	-73.6	-19.4	0	0	0	108.7
62	C	26.5	Very low	26.7	Very low	122 Å²	122	150.6 Å²	150.6	82%	0.824	78%	0.783	S	S	*	*			trans	-128.4	107.7	157.8	-85.8	0	0	0	0	107.2	Y60	Y60-C62 PolarHBondContact O-N 2.84Å
63	S	25.5	Very low	26.9	Very low	113 Å²	113	146.8 Å²	146.8	79%	0.79	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-72.6	134.7	-171.7	-51.8	0	0	0	0	111.5	P65	S63-P65 VanDerWaalsContact O-CD 3.31Å; S63-P65 WeakPolarHBondContact O-CD 3.49Å
64	F	23.8	Very low	27.1	Very low	199 Å²	199	147 Å²	147	87%	0.873	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-76.3	119.1	160	-82.5	-91.2	0	0	0	109.4
65	P	28.3	Very low	27.4	Very low	121 Å²	121	147.1 Å²	147.1	79%	0.786	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-75.7	137.7	162.3	32	-31.9	0	0	0	109.6	S63	S63-P65 VanDerWaalsContact O-CD 3.31Å; S63-P65 WeakPolarHBondContact O-CD 3.49Å
66	S	23.3	Very low	27.4	Very low	111 Å²	111	144.6 Å²	144.6	78%	0.776	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-76.2	147.6	178.8	-43.7	0	0	0	0	112
67	Q	29.4	Very low	27.7	Very low	178 Å²	178	145.5 Å²	145.5	83%	0.832	78%	0.78	S	S	*	*			trans	-137.1	91.2	158.7	-109.1	175	-6.6	0	0	110.3
68	N	24.9	Very low	27.9	Very low	143 Å²	143	147 Å²	147	77%	0.765	79%	0.787	S	S	*	*			trans	-68.2	139.9	156.4	-70.5	-27.6	0	0	0	108.1
69	Y	30.2	Very low	28.1	Very low	223 Å²	223	143.3 Å²	143.3	88%	0.875	79%	0.786	S	S	*	*			trans	-119	139.4	152.6	-111.1	-91.6	0	0	0	108.6
70	I	26.1	Very low	28.4	Very low	134 Å²	134	145.8 Å²	145.8	69%	0.687	79%	0.792	S	S	*	*			trans	-110	172.2	-173.1	-58.6	171.2	0	0	0	107.2
71	M	31.5	Very low	28.6	Very low	161 Å²	161	141.9 Å²	141.9	79%	0.793	79%	0.79	S	S	*	*			trans	91	133.9	171.6	-54.5	170.6	-178.4	0	0	114.6
72	D	30	Very low	28.9	Very low	122 Å²	122	141.2 Å²	141.2	65%	0.652	79%	0.792	S	S	*	*			cis	-161.7	171.8	-7.7	-114.5	-18.5	0	0	0	113.7
73	N	31	Very low	29	Very low	128 Å²	128	143.4 Å²	143.4	68%	0.684	80%	0.795	S	S	*	*			trans	72.1	105.7	157.4	-63.5	-31.1	0	0	0	120.5
74	T	30.4	Very low	29.2	Very low	119 Å²	119	145.1 Å²	145.1	73%	0.73	80%	0.795	S	S	*	*				32.1	142.2	109.1	63.5	0	0	0	0	119
75	T	31.4	Very low	29.5	Very low	130 Å²	130	141.7 Å²	141.7	80%	0.798	79%	0.791	S	S	*	*			cis	-155.1	161.1	33.2	-35.9	0	0	0	0	112.4
76	T	28.4	Very low	29.5	Very low	120 Å²	120	144.5 Å²	144.5	74%	0.736	80%	0.796	S	S	*	*			trans	-75.7	147	178.2	47.3	0	0	0	0	115.5
77	T	32.3	Very low	29.7	Very low	145 Å²	145	146.3 Å²	146.3	89%	0.89	80%	0.796	S	S	*	*			trans	-161	148.7	134.9	13	0	0	0	0	111
78	N	29.1	Very low	29.6	Very low	160 Å²	160	143.7 Å²	143.7	86%	0.856	79%	0.793	S	S	*	*			trans	-99.4	147.1	-177.4	-67.1	-18.4	0	0	0	112.8
79	S	33.5	Very low	29.6	Very low	119 Å²	119	142.1 Å²	142.1	83%	0.832	79%	0.788	S	S	*	*			trans	-158	130.7	149.2	58.7	0	0	0	0	110.5
80	N	29.5	Very low	29.4	Very low	153 Å²	153	135.6 Å²	135.6	82%	0.818	77%	0.772	S	S	*	*			trans	-86.1	169.2	-173.4	-84.6	-22.7	0	0	0	114.2
81	T	31	Very low	29.3	Very low	128 Å²	128	139.5 Å²	139.5	79%	0.785	78%	0.779	S	S	*	*			trans	63.6	108	157.5	31.1	0	0	0	0	118.8
82	T	31.3	Very low	29	Very low	137 Å²	137	139 Å²	139	84%	0.84	78%	0.775	S	S	*	*				-163.1	156.7	103	15.1	0	0	0	0	110.8	N84	T82-N84 PolarHBondContact O-N 2.63Å
83	N	27.8	Very low	28.8	Very low	167 Å²	167	143.4 Å²	143.4	89%	0.893	78%	0.784	S	S	*	*			trans	-69.2	119.8	177.4	-70.1	-27.7	0	0	0	110.2
84	N	30.7	Very low	28.5	Very low	149 Å²	149	141.4 Å²	141.4	80%	0.797	78%	0.776	S	S	*	*			trans	-135.5	115	163	-120.8	-32.8	0	0	0	108.7	T82 M86	T82-N84 PolarHBondContact O-N 2.63Å; N84-M86 PolarHBondContact O-N 3.02Å
85	T	29	Very low	28.2	Very low	127 Å²	127	140.7 Å²	140.7	78%	0.779	77%	0.774	S	S	*	*			trans	-63.1	103.7	176.3	43.8	0	0	0	0	109	N87	T85-N87 PolarHBondContact O-N 2.67Å
86	M	29.3	Very low	27.9	Very low	181 Å²	181	141.6 Å²	141.6	89%	0.892	77%	0.769	S	S	*	*			trans	-63.6	121.6	179.8	-86.6	-162.5	167.8	0	0	110.5	N84 V88	N84-M86 PolarHBondContact O-N 3.02Å; M86-V88 PolarHBondContact O-N 3.46Å
87	N	26.8	Very low	27.9	Very low	148 Å²	148	145.9 Å²	145.9	79%	0.791	77%	0.772	S	S	*	*			trans	-61.1	98.4	173	-70.9	-48.8	0	0	0	109.9	T85 T89	T85-N87 PolarHBondContact O-N 2.67Å; N87-T89 VanDerWaalsContact C-N 3.35Å; N87-T89 PolarHBondContact O-N 2.92Å
88	V	27.1	Very low	27.6	Very low	124 Å²	124	143.2 Å²	143.2	75%	0.752	76%	0.755	S	S	*	*			trans	-65.2	103.1	157.2	179.9	0	0	0	0	106	M86 T90	M86-V88 PolarHBondContact O-N 3.46Å; V88-T90 PolarHBondContact O-N 3.04Å
89	T	24.9	Very low	27.5	Very low	109 Å²	109	142.7 Å²	142.7	67%	0.669	75%	0.752	S	S	*	*			trans	-72.4	68.8	173.7	52.9	0	0	0	0	109.7	N87 Y91	N87-T89 VanDerWaalsContact C-N 3.35Å; N87-T89 PolarHBondContact O-N 2.92Å; T89-Y91 PolarHBondContact O-N 3.1Å
90	T	26.9	Very low	27.1	Very low	87 Å²	87	141.6 Å²	141.6	53%	0.534	74%	0.744	S	S	.	*			trans	-59.2	105.5	165.9	-61.3	0	0	0	0	107	V88 H92	V88-T90 PolarHBondContact O-N 3.04Å; T90-H92 PolarHBondContact O-N 3.08Å
91	Y	24.1	Very low	27	Very low	215 Å²	215	138.7 Å²	138.7	84%	0.843	74%	0.736	S	S	*	*			trans	-65.3	86.7	168.3	-81.1	-87.9	0	0	0	108.2	T89 Y93	T89-Y91 PolarHBondContact O-N 3.1Å; Y91-Y93 PolarHBondContact O-N 2.93Å
92	H	24.7	Very low	26.9	Very low	150 Å²	150	140 Å²	140	69%	0.694	74%	0.736	S	S	*	*			trans	-65.9	75.6	169.8	-96.4	-80.8	0	0	0	109	T90 T94	T90-H92 PolarHBondContact O-N 3.08Å; H92-T94 HydrophobicContact CB-CG2 4.48Å; H92-T94 PolarHBondContact O-N 3.22Å
93	Y	25.5	Very low	26.9	Very low	215 Å²	215	138.5 Å²	138.5	84%	0.843	73%	0.727	S	S	*	*			trans	-69.3	82.1	167.5	-160.9	-84.3	0	0	0	107.6	Y91 P95	Y91-Y93 PolarHBondContact O-N 2.93Å; Y93-P95 WeakPolarHBondContact O-CD 3.5Å
94	T	24.1	Very low	27.1	Very low	86 Å²	86	138.2 Å²	138.2	53%	0.528	72%	0.718	S	S	.	*			trans	-75.4	115.2	179.2	42.8	0	0	0	0	109	H92 Q96	H92-T94 HydrophobicContact CB-CG2 4.48Å; H92-T94 PolarHBondContact O-N 3.22Å; T94-Q96 HydrophobicContact CG2-CG 4.35Å; T94-Q96 PolarHBondContact O-N 3.48Å
95	P	26	Very low	27.3	Very low	105 Å²	105	135.1 Å²	135.1	68%	0.682	70%	0.701	S	S	*	*			trans	-73	58.8	157.5	34.7	-35.9	0	0	0	108.6	Y93 R97	Y93-P95 WeakPolarHBondContact O-CD 3.5Å; P95-R97 PolarHBondContact O-N 3.3Å
96	Q	25	Very low	27.6	Very low	149 Å²	149	133.7 Å²	133.7	70%	0.696	69%	0.689	S	S	*	*			trans	-69.8	71.8	169.5	-92.7	-73.3	8.3	0	0	108.5	T94	T94-Q96 HydrophobicContact CG2-CG 4.35Å; T94-Q96 PolarHBondContact O-N 3.48Å
97	R	27.8	Very low	28.1	Very low	209 Å²	209	130.5 Å²	130.5	79%	0.789	68%	0.675	S	S	*	*			trans	-128.5	64.5	172.6	-142.5	174	-173.9	-141.7	-11.2	108.6	P95 L99	P95-R97 PolarHBondContact O-N 3.3Å; R97-L99 PolarHBondContact O-N 2.88Å
98	T	25.8	Very low	28.9	Very low	90 Å²	90	131.6 Å²	131.6	55%	0.552	67%	0.673	S	S	*	*			trans	-40.8	120.9	167.5	47.3	0	0	0	0	110.2	S100	T98-S100 WeakPolarHBondContact CB-OG 3.36Å; T98-S100 PolarHBondContact O-N 3.17Å; T98-S100 PolarHBondContact OG1-OG 3.23Å
99	L	27.1	Very low	29.7	Very low	149 Å²	149	128.6 Å²	128.6	78%	0.78	65%	0.652	S	S	*	*	S	Bend	trans	-76.1	27.6	174.7	-91.5	166.5	0	0	0	112.5	R97 S101	R97-L99 PolarHBondContact O-N 2.88Å; L99-S101 PolarHBondContact O-N 3.42Å
100	S	25.4	Very low	30.5	Very low	95 Å²	95	130.8 Å²	130.8	66%	0.664	65%	0.65	S	S	*	*			trans	-86.4	44.2	172	59.7	0	0	0	0	111.4	T98	T98-S100 WeakPolarHBondContact CB-OG 3.36Å; T98-S100 PolarHBondContact O-N 3.17Å; T98-S100 PolarHBondContact OG1-OG 3.23Å
101	S	27.4	Very low	31.5	Very low	92 Å²	92	130.2 Å²	130.2	64%	0.643	64%	0.643	S	S	*	*			trans	-150	40.4	178	-75.8	0	0	0	0	112.6	L99 T103	L99-S101 PolarHBondContact O-N 3.42Å; S101-T103 PolarHBondContact O-N 2.91Å
102	I	29.3	Very low	32.6	Very low	155 Å²	155	126.5 Å²	126.5	80%	0.795	63%	0.629	S	S	*	*			trans	-72.9	76.9	147.9	-56.2	-178.7	0	0	0	106.6	K104	I102-K104 PolarHBondContact O-N 2.65Å; I102-K104 VanDerWaalsContact O-N 3.15Å
103	T	31.4	Very low	33.6	Very low	107 Å²	107	122.9 Å²	122.9	66%	0.656	61%	0.614	S	S	*	*			trans	-58.2	118.1	166.2	46.1	0	0	0	0	107.4	S101 L105	S101-T103 PolarHBondContact O-N 2.91Å; T103-L105 PolarHBondContact O-N 3.48Å
104	K	31.3	Very low	34.5	Very low	161 Å²	161	115.3 Å²	115.3	70%	0.7	59%	0.588	S	S	*	*			trans	-55.8	106	170.2	-69.5	178.6	178.7	177	0	107.8	I102 N106	I102-K104 PolarHBondContact O-N 2.65Å; I102-K104 VanDerWaalsContact O-N 3.15Å; K104-N106 PolarHBondContact O-N 2.8Å
105	L	34.8	Very low	36	Very low	84 Å²	84	115.6 Å²	115.6	44%	0.44	58%	0.582	S	S	.	*			trans	-57.6	112.7	167.7	-72.5	167.6	0	0	0	106.2	T103 D109 Y110 I113	T103-L105 PolarHBondContact O-N 3.48Å; L105-D109 HydrophobicContact CB-CB 4.18Å; L105-D109 HydrophobicContact CD2-CB 3.67Å; L105-Y110 HydrophobicContact CB-CD2 3.94Å; L105-Y110 HydrophobicContact CB-CE2 3.67Å; L105-Y110 HydrophobicContact CD1-CE2 4.06Å; L105-I113 HydrophobicContact CD2-CD1 4.45Å
106	N	34.6	Very low	36.8	Very low	97 Å²	97	113.7 Å²	113.7	52%	0.519	57%	0.565	S	S	.	*			trans	-69.5	164.2	176.1	-67.5	-79.4	0	0	0	108.9	K104 K108 D109 Y110	K104-N106 PolarHBondContact O-N 2.8Å; N106-K108 PolarHBondContact O-N 2.91Å; N106-D109 WeakPolarHBondContact CB-OD2 3.4Å; N106-D109 PolarHBondContact N-OD2 2.9Å; N106-D109 WeakPolarHBondContact O-CB 3.44Å; N106-D109 PolarHBondContact O-N 3.26Å; N106-Y110 PolarHBondContact O-N 2.8Å
107	D	40.8	Very low	37.5	Very low	114 Å²	114	112 Å²	112	61%	0.61	56%	0.557	S	S	*	*	H	α-helix	trans	-52.5	-31.2	176.8	-47.3	-62.5	0	0	0	112.1	D111 R371	D107-D111 WeakPolarHBondContact O-CB 3.25Å; D107-D111 PolarHBondContact O-N 2.75Å; D107-D111 VanDerWaalsContact O-N 3.14Å; D107-R371 IonicContact OD2-NH2 2.8Å; D107-R371 PolarHBondContact OD2-NH2 3.22Å
108	K	43.3	Very low	38.2	Very low	170 Å²	170	107.7 Å²	107.7	74%	0.739	55%	0.545	S	S	*	.	H	α-helix	trans	-70.1	-29.8	175.4	-67.1	-173.5	176.1	-176.8	0	114.3	N106 Y112	N106-K108 PolarHBondContact O-N 2.91Å; K108-Y112 VanDerWaalsContact O-CB 3.3Å; K108-Y112 WeakPolarHBondContact O-CB 3.44Å; K108-Y112 PolarHBondContact O-N 3.02Å
109	D	44.2	Very low	38.8	Very low	61 Å²	61	110.9 Å²	110.9	33%	0.326	55%	0.547	S	S	.	.	H	α-helix	trans	-76.9	-38.5	-179.6	-58.1	-49.7	0	0	0	110.4	L105 N106 Y112 I113	L105-D109 HydrophobicContact CB-CB 4.18Å; L105-D109 HydrophobicContact CD2-CB 3.67Å; N106-D109 WeakPolarHBondContact CB-OD2 3.4Å; N106-D109 PolarHBondContact N-OD2 2.9Å; N106-D109 WeakPolarHBondContact O-CB 3.44Å; N106-D109 PolarHBondContact O-N 3.26Å; D109-Y112 PolarHBondContact O-N 2.98Å; D109-I113 WeakPolarHBondContact O-CB 3.47Å; D109-I113 VanDerWaalsContact O-CG1 3.26Å; D109-I113 WeakPolarHBondContact O-CG1 3.45Å; D109-I113 PolarHBondContact O-N 3.25Å
110	Y	40.9	Very low	39.2	Very low	155 Å²	155	108.1 Å²	108.1	61%	0.608	53%	0.533	S	S	*	.	H	α-helix	trans	-61.4	-47.4	168.5	-86.2	-81.3	0	0	0	112.1	L105 N106 Y112 I113 D114	L105-Y110 HydrophobicContact CB-CD2 3.94Å; L105-Y110 HydrophobicContact CB-CE2 3.67Å; L105-Y110 HydrophobicContact CD1-CE2 4.06Å; N106-Y110 PolarHBondContact O-N 2.8Å; Y110-Y112 VanDerWaalsContact C-N 3.28Å; Y110-Y112 PolarHBondContact O-N 3.17Å; Y110-I113 PolarHBondContact O-N 3.11Å; Y110-D114 WeakPolarHBondContact O-CB 3.49Å; Y110-D114 PolarHBondContact O-N 3.31Å
111	D	48.8	Very low	39.9	Very low	75 Å²	75	107.7 Å²	107.7	40%	0.401	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-32.5	176.1	178.2	58.5	0	0	0	112.3	D107 K115	D107-D111 WeakPolarHBondContact O-CB 3.25Å; D107-D111 PolarHBondContact O-N 2.75Å; D107-D111 VanDerWaalsContact O-N 3.14Å; D111-K115 VanDerWaalsContact O-CB 3.29Å; D111-K115 WeakPolarHBondContact O-CB 3.45Å; D111-K115 VanDerWaalsContact O-CD 3.3Å; D111-K115 WeakPolarHBondContact O-CD 3.49Å; D111-K115 WeakPolarHBondContact O-CG 3.3Å; D111-K115 PolarHBondContact O-N 3.4Å; D111-K115 WeakPolarHBondContact OD1-CE 3.4Å; D111-K115 IonicContact OD1-NZ 3.02Å; D111-K115 PolarHBondContact OD1-NZ 2.81Å; D111-K115 WeakPolarHBondContact OD2-CE 3.44Å; D111-K115 IonicContact OD2-NZ 2.63Å; D111-K115 PolarHBondContact OD2-NZ 2.85Å
112	Y	47.3	Very low	40.5	Very low	137 Å²	137	107.8 Å²	107.8	54%	0.537	52%	0.523	S	S	.	.	H	α-helix	trans	-73	-38.3	172.1	-174.1	-110.6	0	0	0	113.2	K108 D109 Y110 K115 L116	K108-Y112 VanDerWaalsContact O-CB 3.3Å; K108-Y112 WeakPolarHBondContact O-CB 3.44Å; K108-Y112 PolarHBondContact O-N 3.02Å; D109-Y112 PolarHBondContact O-N 2.98Å; Y110-Y112 VanDerWaalsContact C-N 3.28Å; Y110-Y112 PolarHBondContact O-N 3.17Å; Y112-K115 PolarHBondContact O-N 3.02Å; Y112-L116 HydrophobicContact CD1-CD1 3.86Å; Y112-L116 HydrophobicContact CD1-CG 4.46Å; Y112-L116 HydrophobicContact CE1-CD1 3.42Å; Y112-L116 VanDerWaalsContact CE1-CD1 3.42Å; Y112-L116 HydrophobicContact CE1-CG 4.13Å; Y112-L116 WeakPolarHBondContact O-CB 3.29Å; Y112-L116 WeakPolarHBondContact O-CG 3.39Å; Y112-L116 PolarHBondContact O-N 3.2Å
113	I	45.8	Very low	41	Very low	74 Å²	74	105.5 Å²	105.5	38%	0.379	51%	0.511	S	S	.	.	H	α-helix	trans	-66.4	-43.5	175.3	-72.2	165.7	0	0	0	110.9	L105 D109 Y110 L116 Q117	L105-I113 HydrophobicContact CD2-CD1 4.45Å; D109-I113 WeakPolarHBondContact O-CB 3.47Å; D109-I113 VanDerWaalsContact O-CG1 3.26Å; D109-I113 WeakPolarHBondContact O-CG1 3.45Å; D109-I113 PolarHBondContact O-N 3.25Å; Y110-I113 PolarHBondContact O-N 3.11Å; I113-L116 CarbonylContact O-C 3.57Å; I113-L116 WeakPolarHBondContact O-CA 3.17Å; I113-L116 WeakPolarHBondContact O-CB 3.32Å; I113-L116 PolarHBondContact O-N 3.33Å; I113-L116 VanDerWaalsContact O-N 3.11Å; I113-Q117 PolarHBondContact O-N 2.86Å
114	D	43.9	Very low	41.1	Very low	56 Å²	56	107.4 Å²	107.4	30%	0.299	51%	0.51	S	S	.	.	H	α-helix	trans	-61.3	-44.4	172.6	171.2	61.2	0	0	0	111.4	Y110 L116 Q117 K118	Y110-D114 WeakPolarHBondContact O-CB 3.49Å; Y110-D114 PolarHBondContact O-N 3.31Å; D114-L116 VanDerWaalsContact C-N 3.25Å; D114-L116 PolarHBondContact O-N 3.19Å; D114-Q117 PolarHBondContact O-N 2.88Å; D114-K118 WeakPolarHBondContact O-CB 3.27Å; D114-K118 WeakPolarHBondContact O-CG 3.47Å; D114-K118 PolarHBondContact O-N 3.21Å; D114-K118 WeakPolarHBondContact OD1-CE 3.29Å; D114-K118 IonicContact OD1-NZ 2.92Å; D114-K118 PolarHBondContact OD1-NZ 3.39Å; D114-K118 WeakPolarHBondContact OD2-CE 3.41Å; D114-K118 IonicContact OD2-NZ 2.67Å; D114-K118 PolarHBondContact OD2-NZ 3.34Å
115	K	55.3	Low	41.5	Very low	93 Å²	93	106.8 Å²	106.8	40%	0.404	51%	0.509	S	S	.	.	H	α-helix	trans	-62.5	-29.2	172.6	-75.3	165.5	-174.1	167.5	0	113	D111 Y112 R119	D111-K115 VanDerWaalsContact O-CB 3.29Å; D111-K115 WeakPolarHBondContact O-CB 3.45Å; D111-K115 VanDerWaalsContact O-CD 3.3Å; D111-K115 WeakPolarHBondContact O-CD 3.49Å; D111-K115 WeakPolarHBondContact O-CG 3.3Å; D111-K115 PolarHBondContact O-N 3.4Å; D111-K115 WeakPolarHBondContact OD1-CE 3.4Å; D111-K115 IonicContact OD1-NZ 3.02Å; D111-K115 PolarHBondContact OD1-NZ 2.81Å; D111-K115 WeakPolarHBondContact OD2-CE 3.44Å; D111-K115 IonicContact OD2-NZ 2.63Å; D111-K115 PolarHBondContact OD2-NZ 2.85Å; Y112-K115 PolarHBondContact O-N 3.02Å; K115-R119 WeakPolarHBondContact O-CB 3.36Å; K115-R119 VanDerWaalsContact O-CG 3.32Å; K115-R119 WeakPolarHBondContact O-CG 3.36Å; K115-R119 PolarHBondContact O-N 3.14Å
116	L	41.9	Very low	41.4	Very low	64 Å²	64	110.8 Å²	110.8	34%	0.335	52%	0.52	S	S	.	.	H	α-helix	trans	-77.6	-37.1	172.4	-81.1	175.3	0	0	0	113	Y112 I113 D114 R119 N120	Y112-L116 HydrophobicContact CD1-CD1 3.86Å; Y112-L116 HydrophobicContact CD1-CG 4.46Å; Y112-L116 HydrophobicContact CE1-CD1 3.42Å; Y112-L116 VanDerWaalsContact CE1-CD1 3.42Å; Y112-L116 HydrophobicContact CE1-CG 4.13Å; Y112-L116 WeakPolarHBondContact O-CB 3.29Å; Y112-L116 WeakPolarHBondContact O-CG 3.39Å; Y112-L116 PolarHBondContact O-N 3.2Å; I113-L116 CarbonylContact O-C 3.57Å; I113-L116 WeakPolarHBondContact O-CA 3.17Å; I113-L116 WeakPolarHBondContact O-CB 3.32Å; I113-L116 PolarHBondContact O-N 3.33Å; I113-L116 VanDerWaalsContact O-N 3.11Å; D114-L116 VanDerWaalsContact C-N 3.25Å; D114-L116 PolarHBondContact O-N 3.19Å; L116-R119 PolarHBondContact O-N 3.16Å; L116-N120 WeakPolarHBondContact O-CB 3.43Å; L116-N120 PolarHBondContact O-N 2.89Å; L116-N120 PolarHBondContact O-ND2 3.21Å
117	Q	39.7	Very low	41.5	Very low	113 Å²	113	110 Å²	110	53%	0.528	52%	0.522	S	S	.	.	H	α-helix	trans	-64.9	-45.1	172.8	-74.9	-179.7	-50.5	0	0	110.5	I113 D114 R119 N120 T121	I113-Q117 PolarHBondContact O-N 2.86Å; D114-Q117 PolarHBondContact O-N 2.88Å; Q117-R119 PolarHBondContact O-N 2.84Å; Q117-N120 PolarHBondContact O-N 3.34Å; Q117-T121 PolarHBondContact O-N 3.3Å; Q117-T121 PolarHBondContact O-OG1 3.2Å; Q117-T121 VanDerWaalsContact O-OG1 3.13Å
118	K	43.8	Very low	41.3	Very low	119 Å²	119	108.6 Å²	108.6	52%	0.517	52%	0.521	S	S	.	.	H	α-helix	trans	-61.6	-38.3	173.6	-73.3	167.2	176.8	161.4	0	112.9	D114 T121 V122	D114-K118 WeakPolarHBondContact O-CB 3.27Å; D114-K118 WeakPolarHBondContact O-CG 3.47Å; D114-K118 PolarHBondContact O-N 3.21Å; D114-K118 WeakPolarHBondContact OD1-CE 3.29Å; D114-K118 IonicContact OD1-NZ 2.92Å; D114-K118 PolarHBondContact OD1-NZ 3.39Å; D114-K118 WeakPolarHBondContact OD2-CE 3.41Å; D114-K118 IonicContact OD2-NZ 2.67Å; D114-K118 PolarHBondContact OD2-NZ 3.34Å; K118-T121 PolarHBondContact O-OG1 2.87Å; K118-V122 VanDerWaalsContact O-CG2 3.28Å; K118-V122 WeakPolarHBondContact O-CG2 3.26Å; K118-V122 PolarHBondContact O-N 3.07Å
119	R	37.9	Very low	40.9	Very low	158 Å²	158	104 Å²	104	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-69.9	-39.2	173	-81	177.2	167.8	135.4	-2.9	113.2	K115 L116 Q117 V122 I123	K115-R119 WeakPolarHBondContact O-CB 3.36Å; K115-R119 VanDerWaalsContact O-CG 3.32Å; K115-R119 WeakPolarHBondContact O-CG 3.36Å; K115-R119 PolarHBondContact O-N 3.14Å; L116-R119 PolarHBondContact O-N 3.16Å; Q117-R119 PolarHBondContact O-N 2.84Å; R119-V122 PolarHBondContact O-N 3.45Å; R119-I123 WeakPolarHBondContact O-CB 3.46Å; R119-I123 WeakPolarHBondContact O-CD1 3.25Å; R119-I123 VanDerWaalsContact O-CG1 3.26Å; R119-I123 WeakPolarHBondContact O-CG1 3.19Å; R119-I123 PolarHBondContact O-N 3.26Å
120	N	35.5	Very low	40.5	Very low	91 Å²	91	108.8 Å²	108.8	49%	0.487	53%	0.532	S	S	.	.	H	α-helix	trans	-71.1	-31	180	-81.6	-73.1	0	0	0	113.4	L116 Q117 K124	L116-N120 WeakPolarHBondContact O-CB 3.43Å; L116-N120 PolarHBondContact O-N 2.89Å; L116-N120 PolarHBondContact O-ND2 3.21Å; Q117-N120 PolarHBondContact O-N 3.34Å; N120-K124 WeakPolarHBondContact O-CG 3.26Å; N120-K124 PolarHBondContact O-N 3.21Å
121	T	40.5	Very low	40.1	Very low	85 Å²	85	110.9 Å²	110.9	52%	0.521	54%	0.539	S	S	.	.	H	α-helix	trans	-68.5	-45.8	170.6	46.9	0	0	0	0	111.4	Q117 K118 I123 K124 H125	Q117-T121 PolarHBondContact O-N 3.3Å; Q117-T121 PolarHBondContact O-OG1 3.2Å; Q117-T121 VanDerWaalsContact O-OG1 3.13Å; K118-T121 PolarHBondContact O-OG1 2.87Å; T121-I123 PolarHBondContact O-N 3.4Å; T121-K124 PolarHBondContact O-N 3.3Å; T121-H125 PolarHBondContact O-CD2 3.02Å; T121-H125 PolarHBondContact O-N 3.38Å
122	V	39.9	Very low	39.5	Very low	95 Å²	95	114.3 Å²	114.3	58%	0.576	56%	0.557	S	S	*	*	H	α-helix	trans	-57.9	-45.8	175.5	169.6	0	0	0	0	112.1	K118 R119 K124 H125 Y126	K118-V122 VanDerWaalsContact O-CG2 3.28Å; K118-V122 WeakPolarHBondContact O-CG2 3.26Å; K118-V122 PolarHBondContact O-N 3.07Å; R119-V122 PolarHBondContact O-N 3.45Å; V122-K124 PolarHBondContact O-N 2.98Å; V122-H125 PolarHBondContact O-N 2.7Å; V122-Y126 PolarHBondContact O-N 3.39Å; V122-Y126 VanDerWaalsContact O-N 3.07Å
123	I	40.5	Very low	39	Very low	106 Å²	106	112.2 Å²	112.2	54%	0.544	57%	0.568	S	S	.	*	H	α-helix	trans	-66.2	-35.2	-179	-69.1	166	0	0	0	112.4	R119 T121 Y126 S127	R119-I123 WeakPolarHBondContact O-CB 3.46Å; R119-I123 WeakPolarHBondContact O-CD1 3.25Å; R119-I123 VanDerWaalsContact O-CG1 3.26Å; R119-I123 WeakPolarHBondContact O-CG1 3.19Å; R119-I123 PolarHBondContact O-N 3.26Å; T121-I123 PolarHBondContact O-N 3.4Å; I123-Y126 PolarHBondContact O-N 2.8Å; I123-S127 PolarHBondContact O-N 3.07Å; I123-S127 PolarHBondContact O-OG 3.23Å
124	K	33.1	Very low	38.4	Very low	148 Å²	148	117.8 Å²	117.8	64%	0.643	59%	0.589	S	S	*	*	H	α-helix	trans	-68.3	-34.1	175.2	-79.3	-178.2	176.3	179.5	0	113	N120 T121 V122 S127 S128	N120-K124 WeakPolarHBondContact O-CG 3.26Å; N120-K124 PolarHBondContact O-N 3.21Å; T121-K124 PolarHBondContact O-N 3.3Å; V122-K124 PolarHBondContact O-N 2.98Å; K124-S127 PolarHBondContact O-OG 2.93Å; K124-S128 PolarHBondContact O-OG 2.77Å
125	H	39.9	Very low	38	Very low	148 Å²	148	120 Å²	120	69%	0.685	61%	0.605	S	S	*	*	H	α-helix	trans	-70.8	-42	173.9	-86.3	-96.5	0	0	0	112.3	T121 V122 S127 S128 A129	T121-H125 PolarHBondContact O-CD2 3.02Å; T121-H125 PolarHBondContact O-N 3.38Å; V122-H125 PolarHBondContact O-N 2.7Å; H125-S127 VanDerWaalsContact C-N 3.35Å; H125-S127 PolarHBondContact O-N 3.08Å; H125-S128 PolarHBondContact O-N 3.3Å; H125-A129 PolarHBondContact O-N 3.4Å
126	Y	32.4	Very low	36.7	Very low	168 Å²	168	125.1 Å²	125.1	66%	0.659	63%	0.627	S	S	*	*	H	α-helix	trans	-67.9	-31	-174.7	-147.9	-95.5	0	0	0	113.9	V122 I123	V122-Y126 PolarHBondContact O-N 3.39Å; V122-Y126 VanDerWaalsContact O-N 3.07Å; I123-Y126 PolarHBondContact O-N 2.8Å
127	S	35.8	Very low	36.1	Very low	81 Å²	81	127.2 Å²	127.2	57%	0.566	65%	0.647	S	S	*	*	H	α-helix	trans	-77.4	-21.9	-179.2	53.6	0	0	0	0	114.6	I123 K124 H125	I123-S127 PolarHBondContact O-N 3.07Å; I123-S127 PolarHBondContact O-OG 3.23Å; K124-S127 PolarHBondContact O-OG 2.93Å; H125-S127 VanDerWaalsContact C-N 3.35Å; H125-S127 PolarHBondContact O-N 3.08Å
128	S	37.1	Very low	35.7	Very low	84 Å²	84	127.3 Å²	127.3	59%	0.587	66%	0.661	S	S	*	*	H	α-helix	trans	-88.3	-39.2	-179.9	-57.5	0	0	0	0	112.5	K124 H125 K130	K124-S128 PolarHBondContact O-OG 2.77Å; H125-S128 PolarHBondContact O-N 3.3Å; S128-K130 VanDerWaalsContact C-N 3.27Å; S128-K130 PolarHBondContact O-N 2.56Å
129	A	35	Very low	35.2	Very low	73 Å²	73	127.3 Å²	127.3	60%	0.603	68%	0.675	S	S	*	*	H	α-helix	trans	-61.6	-31.1	-177.6	0	0	0	0	0	113.8	H125 R131	H125-A129 PolarHBondContact O-N 3.4Å; A129-R131 VanDerWaalsContact C-N 3.32Å; A129-R131 PolarHBondContact O-N 2.93Å
130	K	35.8	Very low	34.7	Very low	161 Å²	161	126.9 Å²	126.9	70%	0.7	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	3.1	-171.9	-148.2	163.5	-172.9	168.4	0	115.2	S128	S128-K130 VanDerWaalsContact C-N 3.27Å; S128-K130 PolarHBondContact O-N 2.56Å
131	R	33.3	Very low	34.6	Very low	200 Å²	200	129.8 Å²	129.8	76%	0.755	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	-20.6	178.9	-87.7	-174.4	174.5	170.8	0.9	115.9	A129	A129-R131 VanDerWaalsContact C-N 3.32Å; A129-R131 PolarHBondContact O-N 2.93Å
132	L	36	Very low	34.1	Very low	146 Å²	146	130.5 Å²	130.5	76%	0.764	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-12.9	-179.3	-73.5	168.7	0	0	0	114	K134	L132-K134 VanDerWaalsContact C-N 3.3Å; L132-K134 PolarHBondContact O-N 2.86Å
133	A	36.2	Very low	33.7	Very low	93 Å²	93	133 Å²	133	77%	0.769	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	22.7	179.2	0	0	0	0	0	114.3
134	K	33.2	Very low	33.3	Very low	192 Å²	192	133.4 Å²	133.4	84%	0.835	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.8	11.9	-173.1	-113.8	-170.8	179.8	-167.6	0	116.6	L132	L132-K134 VanDerWaalsContact C-N 3.3Å; L132-K134 PolarHBondContact O-N 2.86Å
135	T	35.9	Very low	33.3	Very low	101 Å²	101	132.2 Å²	132.2	62%	0.62	73%	0.725	S	S	*	*	S	Bend	trans	-116.9	5.1	-177	42.8	0	0	0	0	114.8
136	F	28.2	Very low	32.9	Very low	202 Å²	202	131 Å²	131	89%	0.886	73%	0.729	S	S	*	*	S	Bend	trans	-121	61.2	175.3	-88.5	-81.2	0	0	0	112.2
137	S	28.2	Very low	33	Very low	107 Å²	107	127.4 Å²	127.4	75%	0.748	73%	0.728	S	S	*	*			trans	-170.4	148.4	161.1	-82	0	0	0	0	108.1
138	S	32.2	Very low	32.9	Very low	116 Å²	116	133.1 Å²	133.1	81%	0.811	74%	0.743	S	S	*	*			trans	67.5	133.3	-161.6	79.5	0	0	0	0	112.9
139	S	31.9	Very low	32.8	Very low	118 Å²	118	133.8 Å²	133.8	83%	0.825	75%	0.747	S	S	*	*			cis	-141.9	157	-2.3	-84.6	0	0	0	0	112.3
140	I	29.2	Very low	32.7	Very low	150 Å²	150	134.7 Å²	134.7	77%	0.769	75%	0.749	S	S	*	*			trans	-94.6	128.9	176.2	-62	168.1	0	0	0	109.4
141	N	31.9	Very low	32.6	Very low	151 Å²	151	133.9 Å²	133.9	81%	0.807	75%	0.753	S	S	*	*			trans	165.3	151.1	141.8	-88.8	-25.3	0	0	0	109.1
142	V	30.4	Very low	32.6	Very low	101 Å²	101	132 Å²	132	61%	0.612	75%	0.75	S	S	*	*			cis	153.7	136.5	-18.2	141.5	0	0	0	0	105.2
143	N	31.4	Very low	32.3	Very low	148 Å²	148	133 Å²	133	79%	0.791	75%	0.751	S	S	*	*			trans	66	153.9	166.5	-71.3	-0.3	0	0	0	118.6
144	T	31.9	Very low	32	Very low	113 Å²	113	133.2 Å²	133.2	69%	0.693	75%	0.747	S	S	*	*			cis	-152.8	162.4	-37.1	-41.3	0	0	0	0	105.3
145	V	33.3	Very low	31.9	Very low	123 Å²	123	129.5 Å²	129.5	75%	0.745	75%	0.745	S	S	*	*				174.4	148.9	90.4	164.7	0	0	0	0	108.6
146	T	31.1	Very low	31.6	Very low	124 Å²	124	132.3 Å²	132.3	76%	0.761	76%	0.756	S	S	*	*			trans	-40.2	169.6	172.4	64.8	0	0	0	0	117.3
147	S	34.8	Very low	31.7	Very low	92 Å²	92	130.5 Å²	130.5	64%	0.643	76%	0.756	S	S	*	*			cis	-168.8	149.9	35.4	63.1	0	0	0	0	117.5
148	K	34.6	Very low	31.6	Very low	200 Å²	200	132.8 Å²	132.8	87%	0.87	76%	0.759	S	S	*	*			trans	66.5	144.8	143.7	-71.5	170.4	-177.3	-178.1	0	118.7
149	S	33.9	Very low	31.5	Very low	98 Å²	98	132.1 Å²	132.1	69%	0.685	75%	0.754	S	S	*	*			cis	-162.6	148.3	-7	44	0	0	0	0	112.6
150	S	34.1	Very low	31.4	Very low	92 Å²	92	136.6 Å²	136.6	64%	0.643	76%	0.759	S	S	*	*			trans	52.9	131.8	146	61.7	0	0	0	0	122
151	D	33.2	Very low	31.2	Very low	145 Å²	145	134.8 Å²	134.8	78%	0.775	76%	0.759	S	S	*	*			cis	-161.7	-138.7	-15.5	-91.6	-44.6	0	0	0	105.2
152	F	32.5	Very low	31.2	Very low	160 Å²	160	133.6 Å²	133.6	70%	0.702	76%	0.76	S	S	*	*			cis	-161.4	129.1	-2.6	-155.6	-83.1	0	0	0	108.8
153	E	30.2	Very low	31	Very low	167 Å²	167	136.3 Å²	136.3	78%	0.78	77%	0.77	S	S	*	*			trans	54.5	142.8	169.4	-77.1	175.3	172.5	0	0	120.7
154	S	30.2	Very low	30.8	Very low	97 Å²	97	136.2 Å²	136.2	68%	0.678	77%	0.769	S	S	*	*			cis	-155.3	176	-6.7	67.7	0	0	0	0	111.4
155	S	30.2	Very low	30.6	Very low	114 Å²	114	141 Å²	141	80%	0.797	78%	0.781	S	S	*	*			trans	67.8	97.6	156.8	-51.1	0	0	0	0	118
156	N	29.8	Very low	30.2	Very low	160 Å²	160	139.7 Å²	139.7	86%	0.856	78%	0.777	S	S	*	*			trans	-144.8	116.5	168.3	-141.8	-12	0	0	0	109.6
157	D	30.1	Very low	30.2	Very low	164 Å²	164	139.5 Å²	139.5	88%	0.877	78%	0.781	S	S	*	*			trans	-104.4	122.2	-168.3	-149.9	-10.9	0	0	0	110.6
158	L	27.3	Very low	29.8	Very low	155 Å²	155	145.9 Å²	145.9	81%	0.812	79%	0.791	S	S	*	*			trans	-147.3	70.4	-162	-141.2	174.7	0	0	0	114.1
159	S	28.5	Very low	29.5	Very low	102 Å²	102	146.3 Å²	146.3	71%	0.713	79%	0.793	S	S	*	*			trans	-162.8	121.4	156.3	59.4	0	0	0	0	113.6
160	K	30.8	Very low	29.1	Very low	212 Å²	212	149.7 Å²	149.7	92%	0.922	80%	0.798	S	S	*	*			trans	-178.1	92	152.6	-103.9	151.2	-171.4	164.7	0	112.2
161	S	24.9	Very low	28.7	Very low	112 Å²	112	150.8 Å²	150.8	78%	0.783	81%	0.805	S	S	*	*			trans	-80	157.7	138.2	53.8	0	0	0	0	108.2
162	P	32.1	Very low	28.4	Very low	127 Å²	127	149.2 Å²	149.2	83%	0.825	81%	0.806	S	S	*	*				-140.9	-176.1	97.4	37.9	-23.4	0	0	0	113.7
163	L	26.4	Very low	28.2	Very low	158 Å²	158	149.8 Å²	149.8	83%	0.827	81%	0.813	S	S	*	*			trans	-110.1	160.6	-173.9	-84.2	168.4	0	0	0	112.6
164	L	25.9	Very low	27.9	Very low	146 Å²	146	152.2 Å²	152.2	76%	0.764	82%	0.816	S	S	*	*			trans	64.1	124.8	153.3	-69.1	158.9	0	0	0	119.5
165	F	28.6	Very low	27.7	Very low	213 Å²	213	155.3 Å²	155.3	93%	0.934	82%	0.82	S	S	*	*				-142.8	167	118.3	-130.2	-91.3	0	0	0	110.2
166	S	25.3	Very low	27.5	Very low	96 Å²	96	154.4 Å²	154.4	67%	0.671	81%	0.814	S	S	*	*			trans	-141.2	140.1	-167	174.1	0	0	0	0	112.6
167	S	31.6	Very low	27.4	Very low	120 Å²	120	154.7 Å²	154.7	84%	0.839	82%	0.816	S	S	*	*			trans	-152.8	139.5	157.7	56.7	0	0	0	0	111.3
168	R	26	Very low	27.3	Very low	225 Å²	225	155.4 Å²	155.4	85%	0.849	81%	0.811	S	S	*	*			trans	-82.9	159.4	176.4	-62.2	168.6	171.6	151.4	-6.4	110.3
169	F	28.7	Very low	27.2	Very low	210 Å²	210	154.7 Å²	154.7	92%	0.921	81%	0.808	S	S	*	*				-160.8	148.8	117.5	-117	-80.4	0	0	0	111.3
170	Q	25.2	Very low	27.2	Very low	169 Å²	169	158.8 Å²	158.8	79%	0.79	81%	0.813	S	S	*	*			trans	-114.3	153.9	175	-64.1	167.5	-92.1	0	0	109.6
171	S	25.8	Very low	27	Very low	114 Å²	114	157 Å²	157	80%	0.797	81%	0.805	S	S	*	*			trans	-179.6	141.5	134.3	-84.5	0	0	0	0	113
172	S	25.7	Very low	27	Very low	113 Å²	113	158.3 Å²	158.3	79%	0.79	80%	0.799	S	S	*	*			trans	59.8	156.6	165.6	84.6	0	0	0	0	117.7
173	M	27.9	Very low	26.7	Very low	171 Å²	171	157.3 Å²	157.3	84%	0.842	79%	0.79	S	S	*	*			cis	-123.9	147.3	-0.6	-68.4	178	-179.4	0	0	111.7
174	Y	24.3	Very low	26.6	Very low	218 Å²	218	157.3 Å²	157.3	86%	0.855	78%	0.78	S	S	*	*			trans	-76.4	134.9	142.7	-98.2	-117.3	0	0	0	107.3
175	E	26.2	Very low	26.6	Very low	162 Å²	162	159.9 Å²	159.9	76%	0.757	79%	0.785	S	S	*	*			trans	-173.5	163.3	132.4	-136.6	54.5	-92.2	0	0	112.2
176	S	27	Very low	26.4	Very low	96 Å²	96	155 Å²	155	67%	0.671	77%	0.767	S	S	*	*			trans	43.5	80.4	153	-65.4	0	0	0	0	119.2
177	N	27.2	Very low	26.5	Very low	166 Å²	166	154.8 Å²	154.8	89%	0.888	77%	0.765	S	S	*	*			trans	-101.3	60.3	150.2	-111.9	-67.3	0	0	0	111
178	K	27.1	Very low	26.2	Very low	178 Å²	178	154.9 Å²	154.9	77%	0.774	75%	0.752	S	S	*	*	S	Bend	trans	-135.4	157.6	160.4	-81.1	-173.6	174.9	179.5	0	107.8
179	D	26.5	Very low	26.2	Very low	141 Å²	141	151.2 Å²	151.2	75%	0.754	75%	0.749	S	S	*	*			trans	60	58.9	171.7	-59	-8.9	0	0	0	117.4	K181	D179-K181 PolarHBondContact O-N 3.02Å; D179-K181 VanDerWaalsContact O-N 3.16Å
180	F	27.6	Very low	26.1	Very low	188 Å²	188	147 Å²	147	83%	0.825	75%	0.746	S	S	*	*			trans	-81.8	74.1	148.1	-100.5	-79.4	0	0	0	110.6	V183	F180-V183 HydrophobicContact CD1-CG2 4.14Å; F180-V183 HydrophobicContact CE1-CG2 3.95Å
181	K	27.6	Very low	26.2	Very low	173 Å²	173	143.7 Å²	143.7	75%	0.752	74%	0.742	S	S	*	*			trans	-61.7	155.9	156.8	-82.2	-179.6	177.3	172.8	0	109.7	D179 V183	D179-K181 PolarHBondContact O-N 3.02Å; D179-K181 VanDerWaalsContact O-N 3.16Å; K181-V183 PolarHBondContact O-N 2.96Å
182	E	24.7	Very low	26.2	Very low	141 Å²	141	149 Å²	149	66%	0.659	74%	0.744	S	S	*	*			trans	-34.2	90.5	168.6	-168.6	-165.3	170.9	0	0	113.9	R184	E182-R184 VanDerWaalsContact CD-NE 3.27Å; E182-R184 HydrophobicContact CG-CG 3.97Å; E182-R184 PolarHBondContact O-N 3.36Å; E182-R184 WeakPolarHBondContact OE1-CG 3.32Å; E182-R184 IonicContact OE1-CZ 3.76Å; E182-R184 IonicContact OE1-NE 3.9Å; E182-R184 PolarHBondContact OE1-NE 2.79Å; E182-R184 IonicContact OE1-NH2 3.75Å; E182-R184 PolarHBondContact OE1-NH2 2.81Å; E182-R184 IonicContact OE2-CZ 2.99Å; E182-R184 IonicContact OE2-NE 3.63Å; E182-R184 PolarHBondContact OE2-NE 2.99Å; E182-R184 IonicContact OE2-NH2 2.73Å; E182-R184 PolarHBondContact OE2-NH2 3.05Å
183	V	25.4	Very low	26.3	Very low	105 Å²	105	154.7 Å²	154.7	64%	0.636	75%	0.748	S	S	*	*			trans	-73.7	82.9	166.7	-178.3	0	0	0	0	107.8	F180 K181 F185	F180-V183 HydrophobicContact CD1-CG2 4.14Å; F180-V183 HydrophobicContact CE1-CG2 3.95Å; K181-V183 PolarHBondContact O-N 2.96Å; V183-F185 PolarHBondContact O-N 2.84Å
184	R	24.8	Very low	26.3	Very low	159 Å²	159	153.3 Å²	153.3	60%	0.6	74%	0.744	S	S	*	*			trans	-56.4	129.3	158.6	-64.9	-177.6	-177	167.5	13.1	107.2	E182 I186	E182-R184 VanDerWaalsContact CD-NE 3.27Å; E182-R184 HydrophobicContact CG-CG 3.97Å; E182-R184 PolarHBondContact O-N 3.36Å; E182-R184 WeakPolarHBondContact OE1-CG 3.32Å; E182-R184 IonicContact OE1-CZ 3.76Å; E182-R184 IonicContact OE1-NE 3.9Å; E182-R184 PolarHBondContact OE1-NE 2.79Å; E182-R184 IonicContact OE1-NH2 3.75Å; E182-R184 PolarHBondContact OE1-NH2 2.81Å; E182-R184 IonicContact OE2-CZ 2.99Å; E182-R184 IonicContact OE2-NE 3.63Å; E182-R184 PolarHBondContact OE2-NE 2.99Å; E182-R184 IonicContact OE2-NH2 2.73Å; E182-R184 PolarHBondContact OE2-NH2 3.05Å; R184-I186 HydrophobicContact CB-CD1 4.39Å; R184-I186 HydrophobicContact CB-CG1 3.8Å; R184-I186 PolarHBondContact O-N 2.88Å
185	F	24.8	Very low	26.4	Very low	200 Å²	200	148.2 Å²	148.2	88%	0.877	74%	0.741	S	S	*	*			trans	-69.8	77.5	158.5	-89.6	-89.2	0	0	0	108.7	V183 C187	V183-F185 PolarHBondContact O-N 2.84Å; F185-C187 PolarHBondContact O-N 2.85Å; F185-C187 VanDerWaalsContact O-N 3.17Å
186	I	26	Very low	26.5	Very low	110 Å²	110	146.9 Å²	146.9	56%	0.564	74%	0.743	S	S	*	*			trans	-70.5	100.5	162.7	-63.3	177.8	0	0	0	105.4	R184 E188	R184-I186 HydrophobicContact CB-CD1 4.39Å; R184-I186 HydrophobicContact CB-CG1 3.8Å; R184-I186 PolarHBondContact O-N 2.88Å; I186-E188 HydrophobicContact CG2-CB 3.73Å; I186-E188 HydrophobicContact CG2-CG 3.71Å; I186-E188 WeakPolarHBondContact CG2-OE2 3.47Å; I186-E188 PolarHBondContact O-N 3.4Å
187	C	25.9	Very low	26.5	Very low	92 Å²	92	149.2 Å²	149.2	62%	0.622	75%	0.746	S	S	*	*			trans	-89.5	39.5	-180	-157.6	0	0	0	0	111.2	F185	F185-C187 PolarHBondContact O-N 2.85Å; F185-C187 VanDerWaalsContact O-N 3.17Å
188	E	26.3	Very low	26.5	Very low	122 Å²	122	148.1 Å²	148.1	57%	0.57	75%	0.746	S	S	*	*			trans	-96.7	131.5	-179.7	-62.2	178.1	141.8	0	0	110.1	I186	I186-E188 HydrophobicContact CG2-CB 3.73Å; I186-E188 HydrophobicContact CG2-CG 3.71Å; I186-E188 WeakPolarHBondContact CG2-OE2 3.47Å; I186-E188 PolarHBondContact O-N 3.4Å
189	D	26.1	Very low	26.6	Very low	147 Å²	147	145.7 Å²	145.7	79%	0.786	74%	0.742	S	S	*	*			trans	40.9	78.6	155.1	-64.1	-3.2	0	0	0	119.6
190	S	26.5	Very low	26.7	Very low	123 Å²	123	147 Å²	147	86%	0.86	74%	0.743	S	S	*	*			trans	-118.8	68.9	144	-74.1	0	0	0	0	110.2
191	S	27	Very low	26.7	Very low	99 Å²	99	145.6 Å²	145.6	69%	0.692	74%	0.743	S	S	*	*			trans	-149.7	43.9	174.6	-66.6	0	0	0	0	112.2
192	R	26.8	Very low	26.7	Very low	224 Å²	224	144 Å²	144	85%	0.845	74%	0.741	S	S	*	*			trans	-156.3	78.5	172.4	-109.6	171.1	-164	-164.8	4.6	113.6
193	R	27.4	Very low	27	Very low	233 Å²	233	143.3 Å²	143.3	88%	0.879	74%	0.742	S	S	*	*	S	Bend	trans	-173.1	141.9	143.5	-110.4	167.8	-76.5	-172.6	-1.8	109.8
194	N	27.7	Very low	27.1	Very low	143 Å²	143	144.7 Å²	144.7	77%	0.765	75%	0.745	S	S	*	*			trans	55.6	87.6	170.4	-51.7	10.8	0	0	0	113.4
195	S	25.6	Very low	27.4	Very low	111 Å²	111	142.5 Å²	142.5	78%	0.776	75%	0.75	S	S	*	*				45.1	92.4	52.5	82.5	0	0	0	0	114
196	V	28	Very low	27.6	Very low	133 Å²	133	139.6 Å²	139.6	81%	0.806	74%	0.744	S	S	*	*				-160.4	115.1	123.7	152.2	0	0	0	0	108.4
197	I	26.6	Very low	28	Very low	145 Å²	145	140.2 Å²	140.2	74%	0.744	75%	0.753	S	S	*	*			trans	32.3	111.8	146.2	-47.8	169.3	0	0	0	119.2
198	T	29.2	Very low	28.4	Very low	144 Å²	144	141.3 Å²	141.3	88%	0.883	76%	0.757	S	S	*	*			trans	-137.1	102.7	135.5	54.6	0	0	0	0	108.6
199	N	27.4	Very low	28.7	Very low	127 Å²	127	142 Å²	142	68%	0.679	77%	0.765	S	S	*	*			trans	-114.1	158.6	177.7	-111.8	43.3	0	0	0	111.2
200	E	30.1	Very low	29	Very low	168 Å²	168	140.5 Å²	140.5	79%	0.785	76%	0.756	S	S	*	*			trans	60.7	91.3	159.1	-73.4	143.3	-118.8	0	0	118.6
201	I	25.9	Very low	29.4	Very low	159 Å²	159	142.2 Å²	142.2	82%	0.815	75%	0.748	S	S	*	*			trans	-77.2	163.8	141.3	-51.6	173.8	0	0	0	107.7
202	I	29.1	Very low	29.7	Very low	138 Å²	138	145.5 Å²	145.5	71%	0.708	75%	0.753	S	S	*	*			trans	84.3	100.1	172.3	-44.8	170.6	0	0	0	111.9
203	N	30.4	Very low	29.9	Very low	127 Å²	127	140.3 Å²	140.3	68%	0.679	75%	0.745	S	S	*	*				-159.7	143.9	81.8	-96.9	-71	0	0	0	115.6
204	N	28.1	Very low	30.1	Very low	134 Å²	134	134.6 Å²	134.6	72%	0.717	74%	0.736	S	S	*	*			trans	77	144.9	136.7	-68	-15.2	0	0	0	125.3
205	T	31.6	Very low	30.1	Very low	114 Å²	114	134.6 Å²	134.6	70%	0.699	74%	0.736	S	S	*	*			trans	72.8	90.9	150	47.2	0	0	0	0	121.5
206	D	28.6	Very low	30.3	Very low	139 Å²	139	134.3 Å²	134.3	74%	0.743	73%	0.73	S	S	*	*				94.4	156.1	106.4	-69.4	-8	0	0	0	124.7
207	T	34.6	Very low	30.4	Very low	122 Å²	122	135 Å²	135	75%	0.748	73%	0.728	S	S	*	*			trans	76.3	75.3	163.2	46.8	0	0	0	0	120.7
208	T	33	Very low	30.5	Very low	116 Å²	116	133 Å²	133	71%	0.712	72%	0.722	S	S	*	*				57.5	132.7	113.4	58.6	0	0	0	0	123.3
209	N	32.5	Very low	30.7	Very low	137 Å²	137	135 Å²	135	73%	0.733	72%	0.721	S	S	*	*				113.8	129.2	126.5	-83	-19.3	0	0	0	121.9
210	N	33.8	Very low	30.8	Very low	115 Å²	115	138.2 Å²	138.2	62%	0.615	73%	0.729	S	S	*	*			trans	80	92.5	144.3	-70.4	-32.2	0	0	0	122.4
211	K	34.5	Very low	30.8	Very low	159 Å²	159	137.2 Å²	137.2	69%	0.691	74%	0.735	S	S	*	*				69.3	130.9	104.5	-78.9	-179	-176.7	175.7	0	121.3
212	Q	33.2	Very low	30.9	Very low	168 Å²	168	136.8 Å²	136.8	79%	0.785	73%	0.734	S	S	*	*			trans	73.2	153.9	135.9	-68.2	179.5	-46.8	0	0	117.4
213	V	31.2	Very low	30.9	Very low	114 Å²	114	141.5 Å²	141.5	69%	0.691	75%	0.745	S	S	*	*			cis	-159.8	131.3	-15.1	122.4	0	0	0	0	109.9
214	V	30.3	Very low	31	Very low	113 Å²	113	141.8 Å²	141.8	69%	0.685	75%	0.746	S	S	*	*			trans	51.1	130.1	136.3	-174.7	0	0	0	0	121.4
215	N	28.1	Very low	31.2	Very low	144 Å²	144	144.1 Å²	144.1	77%	0.77	75%	0.753	S	S	*	*			trans	88.6	117.6	144.9	-84	5.5	0	0	0	124.9
216	T	29.7	Very low	31.2	Very low	105 Å²	105	144.8 Å²	144.8	64%	0.644	75%	0.752	S	S	*	*				96.5	122.7	108	-64.8	0	0	0	0	123.5
217	I	30.1	Very low	31.4	Very low	147 Å²	147	145.4 Å²	145.4	75%	0.754	76%	0.755	S	S	*	*			trans	84.8	118.4	148	-79.5	168.2	0	0	0	122.7
218	T	29	Very low	31.2	Very low	103 Å²	103	144.2 Å²	144.2	63%	0.632	75%	0.752	S	S	*	*			trans	7.5	147.5	153	69.1	0	0	0	0	123.6
219	H	33.6	Very low	31.2	Very low	187 Å²	187	144.3 Å²	144.3	87%	0.866	75%	0.753	S	S	*	*				-166.3	171.9	104.4	-108.8	-84.3	0	0	0	113
220	K	28.6	Very low	31.2	Very low	194 Å²	194	144.4 Å²	144.4	84%	0.843	75%	0.752	S	S	*	*			trans	-107	157.7	-179.3	-65.8	177.8	177.6	176.2	0	112.4
221	T	31.9	Very low	30.8	Very low	146 Å²	146	145.8 Å²	145.8	90%	0.896	76%	0.759	S	S	*	*			trans	-156.7	156.1	143.3	4.5	0	0	0	0	112.7
222	N	27.2	Very low	30.5	Very low	150 Å²	150	149.6 Å²	149.6	80%	0.802	77%	0.769	S	S	*	*			trans	-100.6	159.3	175.1	-82.7	-5.7	0	0	0	111.1
223	Y	30	Very low	30.2	Very low	238 Å²	238	150.9 Å²	150.9	93%	0.933	77%	0.772	S	S	*	*			trans	-145.7	153.5	139.8	-100.5	-76.6	0	0	0	110.3
224	N	30.9	Very low	30.1	Very low	132 Å²	132	153.6 Å²	153.6	71%	0.706	78%	0.777	S	S	*	*			trans	-159.7	135.9	-172.2	175.3	82.4	0	0	0	109.9
225	E	33.1	Very low	29.9	Very low	184 Å²	184	153.1 Å²	153.1	86%	0.86	78%	0.779	S	S	*	*			trans	-149.7	158.9	178.1	-130.4	163.6	-138.8	0	0	112.6
226	N	30.5	Very low	30	Very low	128 Å²	128	152 Å²	152	68%	0.684	78%	0.777	S	S	*	*			trans	-121.5	164.7	-163.8	-52.2	-74	0	0	0	112.7
227	N	33.3	Very low	30	Very low	151 Å²	151	154.8 Å²	154.8	81%	0.807	78%	0.782	S	S	*	*			trans	162.4	125.1	134.3	-82.1	-24	0	0	0	111.9
228	S	31.3	Very low	29.8	Very low	98 Å²	98	153.7 Å²	153.7	69%	0.685	78%	0.778	S	S	*	*				78.7	140.1	103.1	84.4	0	0	0	0	115.9
229	T	32.7	Very low	29.7	Very low	118 Å²	118	155 Å²	155	72%	0.724	78%	0.781	S	S	*	*			cis	-173	155.9	0.5	12.1	0	0	0	0	113.2
230	I	31.2	Very low	29.5	Very low	138 Å²	138	150.6 Å²	150.6	71%	0.708	77%	0.771	S	S	*	*			trans	74.9	107.9	139.7	-67.1	164	0	0	0	123.5
231	N	25.7	Very low	29.4	Very low	144 Å²	144	146.2 Å²	146.2	77%	0.77	77%	0.765	S	S	*	*				38.7	119.7	125.6	-46.1	-26.7	0	0	0	126
232	R	29.5	Very low	29.2	Very low	239 Å²	239	147.3 Å²	147.3	90%	0.902	76%	0.76	S	S	*	*				169.6	136.2	120	-99.3	176.3	164.6	139.5	-5.6	108.8
233	K	25.9	Very low	29.1	Very low	196 Å²	196	146.1 Å²	146.1	85%	0.852	75%	0.754	S	S	*	*			cis	96.6	86.3	6.9	-151.8	-169.2	-169.6	-170.5	0	117.7
234	E	29.6	Very low	29.1	Very low	171 Å²	171	141.2 Å²	141.2	80%	0.799	74%	0.744	S	S	*	*			trans	-169.4	117.4	151.2	-99.5	148.5	-140.7	0	0	106
235	S	26.9	Very low	28.8	Very low	102 Å²	102	141.3 Å²	141.3	71%	0.713	74%	0.742	S	S	*	*				50.8	128.4	91	60.3	0	0	0	0	114.2
236	V	30.1	Very low	28.5	Very low	122 Å²	122	140.6 Å²	140.6	74%	0.739	74%	0.735	S	S	*	*				-151.4	161.8	55.7	159.7	0	0	0	0	113.2
237	H	28	Very low	28.3	Very low	162 Å²	162	140.2 Å²	140.2	75%	0.75	74%	0.738	S	S	*	*			trans	-11.8	150.3	159.2	-60.4	-49.3	0	0	0	119.2
238	N	26	Very low	27.9	Very low	125 Å²	125	140.3 Å²	140.3	67%	0.668	74%	0.738	S	S	*	*			cis	-159.5	168.6	1.8	-100	4	0	0	0	107.1
239	D	28.5	Very low	27.6	Very low	131 Å²	131	140.9 Å²	140.9	70%	0.701	73%	0.732	S	S	*	*			cis	-150.8	159.5	6.6	-131.3	-44.3	0	0	0	112.1
240	S	27.7	Very low	27.4	Very low	94 Å²	94	141.6 Å²	141.6	66%	0.657	73%	0.73	S	S	*	*			trans	29	99.5	165.1	67.2	0	0	0	0	121.8
241	S	28.6	Very low	27.2	Very low	102 Å²	102	142.1 Å²	142.1	71%	0.713	73%	0.734	S	S	*	*				45.3	113.8	129.6	63	0	0	0	0	120.3
242	E	26.5	Very low	27.3	Very low	169 Å²	169	138.9 Å²	138.9	79%	0.79	74%	0.735	S	S	*	*				64.7	125.1	63.6	-70.4	-149	90.9	0	0	117.6
243	N	25.8	Very low	27.2	Very low	124 Å²	124	135 Å²	135	66%	0.663	73%	0.725	S	S	*	*				37.7	110.1	129.6	-58.8	-41.9	0	0	0	119.7
244	N	28.5	Very low	27.3	Very low	135 Å²	135	136 Å²	136	72%	0.722	72%	0.723	S	S	*	*				-165.4	112.7	127.5	-96	-42.5	0	0	0	110.1
245	M	26	Very low	27	Very low	135 Å²	135	133.1 Å²	133.1	67%	0.665	72%	0.719	S	S	*	*				78.8	119.2	94	-86.4	-149.7	-85.5	0	0	116
246	K	26.5	Very low	27.1	Very low	168 Å²	168	131.1 Å²	131.1	73%	0.73	72%	0.715	S	S	*	*			trans	68.6	109.4	140.7	-63.9	168.8	-179.6	164.2	0	119.3
247	T	25.2	Very low	27	Very low	120 Å²	120	129.7 Å²	129.7	74%	0.736	70%	0.703	S	S	*	*				52.2	101	117.4	-44.5	0	0	0	0	118.5
248	L	26.5	Very low	27.2	Very low	153 Å²	153	126.2 Å²	126.2	80%	0.801	70%	0.695	S	S	*	*			trans	-154.5	130.7	140.1	-116.2	145.4	0	0	0	110.9	I250	L248-I250 HydrophobicContact CD2-CD1 3.8Å; L248-I250 HydrophobicContact CD2-CG1 3.94Å
249	I	25.1	Very low	27.9	Very low	111 Å²	111	124.5 Å²	124.5	57%	0.569	68%	0.68	S	S	*	*			trans	-105.1	105.9	-177.5	-63.7	145.4	0	0	0	107.2
250	I	28.3	Very low	27.9	Very low	132 Å²	132	121.9 Å²	121.9	68%	0.677	67%	0.672	S	S	*	*			trans	-139.6	114.4	175.4	-60.8	-175.7	0	0	0	111	L248	L248-I250 HydrophobicContact CD2-CD1 3.8Å; L248-I250 HydrophobicContact CD2-CG1 3.94Å
251	N	25.8	Very low	28	Very low	150 Å²	150	123.5 Å²	123.5	80%	0.802	68%	0.68	S	S	*	*			trans	22.3	103.1	147.4	-53.8	-0.6	0	0	0	118.3	F253	N251-F253 PolarHBondContact O-N 2.81Å
252	G	28.4	Very low	28.3	Very low	76 Å²	76	122 Å²	122	78%	0.784	66%	0.664	S	S	*	*			trans	-90.4	82	168.5	0	0	0	0	0	113
253	F	27.3	Very low	28.4	Very low	156 Å²	156	118.9 Å²	118.9	68%	0.684	66%	0.658	S	S	*	*			trans	-80.6	137.9	175	-151.8	-106.7	0	0	0	111.3	N251 P255 M443	N251-F253 PolarHBondContact O-N 2.81Å; F253-P255 VanDerWaalsContact O-CD 3.27Å; F253-P255 WeakPolarHBondContact O-CD 3.47Å; F253-M443 HydrophobicContact CD1-CE 4.42Å; F253-M443 HydrophobicContact CD1-SD 4.02Å; F253-M443 HydrophobicContact CD2-CE 4.12Å; F253-M443 HydrophobicContact CD2-SD 4.07Å; F253-M443 HydrophobicContact CE1-CE 3.97Å; F253-M443 HydrophobicContact CE1-SD 4.14Å; F253-M443 HydrophobicContact CE2-CE 3.65Å; F253-M443 HydrophobicContact CE2-SD 4.2Å; F253-M443 HydrophobicContact CG-CE 4.49Å; F253-M443 HydrophobicContact CG-SD 3.99Å; F253-M443 HydrophobicContact CZ-CE 3.57Å; F253-M443 HydrophobicContact CZ-SD 4.23Å
254	W	27.7	Very low	28.6	Very low	218 Å²	218	117 Å²	117	83%	0.826	65%	0.654	S	S	*	*			trans	-102.4	107.3	-178.7	-80.6	89	0	0	0	112.3	G256	W254-G256 PolarHBondContact O-N 3.24Å
255	P	24.5	Very low	28.8	Very low	110 Å²	110	113.7 Å²	113.7	71%	0.714	64%	0.64	S	S	*	*			trans	-84.8	101	158.2	32.1	-28.8	0	0	0	108.7	F253	F253-P255 VanDerWaalsContact O-CD 3.27Å; F253-P255 WeakPolarHBondContact O-CD 3.47Å
256	G	27.3	Very low	28.9	Very low	60 Å²	60	113 Å²	113	62%	0.619	64%	0.639	S	S	*	*	S	Bend	trans	177.9	80.6	-177.4	0	0	0	0	0	115.8	W254	W254-G256 PolarHBondContact O-N 3.24Å
257	N	29.4	Very low	29.1	Very low	93 Å²	93	109.9 Å²	109.9	50%	0.497	63%	0.63	S	S	.	*			trans	39.1	98.2	161.2	-172.5	29	0	0	0	117.7	Y259	N257-Y259 PolarHBondContact O-N 3.18Å; N257-Y259 WeakPolarHBondContact OD1-CB 3.18Å; N257-Y259 WeakPolarHBondContact OD1-CD2 3.24Å; N257-Y259 PolarHBondContact OD1-N 3.3Å
258	P	31.8	Very low	29.1	Very low	88 Å²	88	109.3 Å²	109.3	57%	0.571	63%	0.63	S	S	*	*	S	Bend	trans	-58.1	-26	170.7	-23.2	34.4	0	0	0	114.1	S260	P258-S260 PolarHBondContact O-N 2.89Å
259	Y	39.9	Very low	29.3	Very low	89 Å²	89	107.9 Å²	107.9	35%	0.349	62%	0.622	S	S	.	*			trans	-84.3	42.8	-172.6	-50.6	-71.3	0	0	0	113.3	N257 N624	N257-Y259 PolarHBondContact O-N 3.18Å; N257-Y259 WeakPolarHBondContact OD1-CB 3.18Å; N257-Y259 WeakPolarHBondContact OD1-CD2 3.24Å; N257-Y259 PolarHBondContact OD1-N 3.3Å; Y259-N624 HydrophobicContact CE1-CB 4.06Å; Y259-N624 PolarHBondContact OH-OD1 3.03Å
260	S	28.7	Very low	29.4	Very low	77 Å²	77	109.4 Å²	109.4	54%	0.538	63%	0.631	S	S	.	*	S	Bend	trans	-73.3	145.9	150.2	-58.7	0	0	0	0	107.8	P258 L262	P258-S260 PolarHBondContact O-N 2.89Å; S260-L262 PolarHBondContact O-N 3.21Å
261	P	29.7	Very low	29.4	Very low	128 Å²	128	111.3 Å²	111.3	83%	0.831	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-54.7	117.1	175.4	-24.7	34.3	0	0	0	109.7
262	L	35.6	Very low	29.4	Very low	70 Å²	70	108.4 Å²	108.4	37%	0.366	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-57.7	131.1	179.3	-73.2	172.7	0	0	0	108.2	S260 S264 L623 W713	S260-L262 PolarHBondContact O-N 3.21Å; L262-S264 PolarHBondContact O-N 2.72Å; L262-L623 HydrophobicContact CD1-CD1 4.48Å; L262-W713 HydrophobicContact CD1-CE3 4.3Å; L262-W713 HydrophobicContact CD1-CZ3 3.91Å; L262-W713 HydrophobicContact CD2-CH2 3.93Å; L262-W713 HydrophobicContact CD2-CZ3 3.68Å; L262-W713 HydrophobicContact CG-CZ3 4.38Å
263	P	29.1	Very low	29.5	Very low	104 Å²	104	112.1 Å²	112.1	68%	0.675	64%	0.636	S	S	*	*			trans	-63.9	106.3	172.7	26.8	-32	0	0	0	107.3
264	S	28.8	Very low	29.6	Very low	83 Å²	83	112.9 Å²	112.9	58%	0.58	65%	0.646	S	S	*	*			trans	-49.2	137.2	-178.9	-62.2	0	0	0	0	110	L262 D266	L262-S264 PolarHBondContact O-N 2.72Å; S264-D266 PolarHBondContact O-N 3.39Å
265	P	33.4	Very low	29.6	Very low	66 Å²	66	110.4 Å²	110.4	43%	0.429	65%	0.649	S	S	.	*			trans	-58.7	130.8	168.7	26.4	-32.8	0	0	0	108.2	I267	P265-I267 HydrophobicContact CB-CG1 4.24Å; P265-I267 HydrophobicContact CG-CD1 4.14Å; P265-I267 HydrophobicContact CG-CG1 4.21Å; P265-I267 PolarHBondContact O-N 2.8Å
266	D	27.3	Very low	29.7	Very low	121 Å²	121	114.5 Å²	114.5	65%	0.647	66%	0.659	S	S	*	*			trans	-68.5	76.2	176.9	-52.6	-74	0	0	0	109.9	S264 S268 K762	S264-D266 PolarHBondContact O-N 3.39Å; D266-S268 VanDerWaalsContact C-N 3.29Å; D266-S268 PolarHBondContact O-N 2.99Å; D266-S268 VanDerWaalsContact O-N 3.09Å; D266-K762 WeakPolarHBondContact OD2-CE 3.28Å; D266-K762 IonicContact OD2-NZ 2.93Å; D266-K762 PolarHBondContact OD2-NZ 3.08Å
267	I	30.9	Very low	29.7	Very low	103 Å²	103	116.9 Å²	116.9	53%	0.528	67%	0.666	S	S	.	*			trans	-81.9	82.3	173	-58.5	179.4	0	0	0	106.9	P265 I269	P265-I267 HydrophobicContact CB-CG1 4.24Å; P265-I267 HydrophobicContact CG-CD1 4.14Å; P265-I267 HydrophobicContact CG-CG1 4.21Å; P265-I267 PolarHBondContact O-N 2.8Å; I267-I269 HydrophobicContact CG2-CB 3.98Å; I267-I269 HydrophobicContact CG2-CD1 3.92Å; I267-I269 HydrophobicContact CG2-CG1 3.87Å; I267-I269 PolarHBondContact O-N 3.23Å
268	S	25.6	Very low	29.6	Very low	107 Å²	107	120.6 Å²	120.6	75%	0.748	68%	0.68	S	S	*	*			trans	-71.7	72.9	170	59.9	0	0	0	0	109.9	D266	D266-S268 VanDerWaalsContact C-N 3.29Å; D266-S268 PolarHBondContact O-N 2.99Å; D266-S268 VanDerWaalsContact O-N 3.09Å
269	I	30	Very low	29.4	Very low	123 Å²	123	125.6 Å²	125.6	63%	0.631	69%	0.693	S	S	*	*	S	Bend	trans	-143.7	112.4	177.1	-55.1	-179.7	0	0	0	108.4	I267	I267-I269 HydrophobicContact CG2-CB 3.98Å; I267-I269 HydrophobicContact CG2-CD1 3.92Å; I267-I269 HydrophobicContact CG2-CG1 3.87Å; I267-I269 PolarHBondContact O-N 3.23Å
270	L	28.6	Very low	28.7	Very low	143 Å²	143	126.5 Å²	126.5	75%	0.749	70%	0.703	S	S	*	*			trans	60	75.9	168.3	-61.1	169.4	0	0	0	116.4
271	D	26.8	Very low	28.8	Very low	172 Å²	172	130 Å²	130	92%	0.92	71%	0.714	S	S	*	*			trans	-123.2	46.2	162.1	-131	-9.7	0	0	0	109.7
272	S	27.5	Very low	28.6	Very low	89 Å²	89	130.7 Å²	130.7	62%	0.622	71%	0.711	S	S	*	*			trans	-141	44.3	-167.3	-60.3	0	0	0	0	113.4
273	D	29.2	Very low	28.3	Very low	155 Å²	155	133.2 Å²	133.2	83%	0.829	73%	0.73	S	S	*	*	S	Bend	trans	-154.5	29.9	176.9	-106.1	-26.1	0	0	0	114.7
274	L	30.6	Very low	28.3	Very low	172 Å²	172	136.5 Å²	136.5	90%	0.901	74%	0.736	S	S	*	*			trans	-135	62.5	175.2	-75.8	178.8	0	0	0	112.1
275	N	26.3	Very low	28.3	Very low	165 Å²	165	138.6 Å²	138.6	88%	0.882	75%	0.748	S	S	*	*	S	Bend	trans	-153.5	30.9	172.6	-128.2	-6.5	0	0	0	115.3
276	E	26.2	Very low	28.2	Very low	197 Å²	197	141.6 Å²	141.6	92%	0.921	77%	0.765	S	S	*	*			trans	-150.5	75.9	172.7	-128.6	166	-128.3	0	0	112.2
277	S	28.8	Very low	28.3	Very low	110 Å²	110	142.4 Å²	142.4	77%	0.769	77%	0.769	S	S	*	*			trans	-138.6	63.4	165	48.1	0	0	0	0	110.4	F279	S277-F279 PolarHBondContact O-N 3.19Å
278	H	26.7	Very low	28.3	Very low	170 Å²	170	144.6 Å²	144.6	79%	0.787	78%	0.782	S	S	*	*			trans	-71.3	78.1	174.8	-141.4	-72.4	0	0	0	109.3	I280	H278-I280 VanDerWaalsContact C-N 3.27Å; H278-I280 PolarHBondContact O-N 3.25Å
279	F	28.3	Very low	28.7	Very low	193 Å²	193	144.8 Å²	144.8	85%	0.846	78%	0.775	S	S	*	*			trans	-72.9	88.4	171.2	-110.7	-75.5	0	0	0	109.4	S277 L281	S277-F279 PolarHBondContact O-N 3.19Å; F279-L281 PolarHBondContact O-N 3.37Å
280	I	25.4	Very low	28.9	Very low	109 Å²	109	146.2 Å²	146.2	56%	0.559	78%	0.776	S	S	*	*			trans	-67.7	110.2	168.4	-62	171.6	0	0	0	107.2	H278 D282	H278-I280 VanDerWaalsContact C-N 3.27Å; H278-I280 PolarHBondContact O-N 3.25Å; I280-D282 HydrophobicContact CG2-CB 4.22Å; I280-D282 WeakPolarHBondContact CG2-OD2 3.32Å
281	L	29.5	Very low	28.8	Very low	149 Å²	149	145.7 Å²	145.7	78%	0.78	77%	0.774	S	S	*	*			trans	-119.2	73.9	154.6	-77.1	176.3	0	0	0	107.3	F279 T283	F279-L281 PolarHBondContact O-N 3.37Å; L281-T283 PolarHBondContact O-N 2.85Å
282	D	25	Very low	29	Very low	144 Å²	144	145.9 Å²	145.9	77%	0.77	77%	0.774	S	S	*	*			trans	-63.2	119.5	158.3	-69.5	-43.1	0	0	0	107.4	I280	I280-D282 HydrophobicContact CG2-CB 4.22Å; I280-D282 WeakPolarHBondContact CG2-OD2 3.32Å
283	T	30.6	Very low	29.1	Very low	123 Å²	123	148 Å²	148	76%	0.755	77%	0.774	S	S	*	*			trans	-148.3	106.5	167	-51.9	0	0	0	0	106.6	L281	L281-T283 PolarHBondContact O-N 2.85Å
284	E	28.3	Very low	29	Very low	173 Å²	173	150 Å²	150	81%	0.808	77%	0.771	S	S	*	*			trans	-66	145.8	-176.8	-65.2	-170.6	125.4	0	0	111.5	T286	E284-T286 PolarHBondContact O-N 3.3Å; E284-T286 VanDerWaalsContact O-N 3.11Å
285	P	28.2	Very low	28.9	Very low	126 Å²	126	149 Å²	149	82%	0.818	76%	0.761	S	S	*	*			trans	-78.3	95.2	176.7	31.7	-33.2	0	0	0	110.7
286	T	31.4	Very low	28.8	Very low	129 Å²	129	150 Å²	150	79%	0.791	76%	0.76	S	S	*	*			trans	-76.6	131.3	163.5	53.9	0	0	0	0	110.1	E284	E284-T286 PolarHBondContact O-N 3.3Å; E284-T286 VanDerWaalsContact O-N 3.11Å
287	N	29.3	Very low	28.9	Very low	139 Å²	139	144.8 Å²	144.8	74%	0.743	75%	0.746	S	S	*	*			trans	-58.5	157	172.8	-52	-61.6	0	0	0	110.4
288	D	32.6	Very low	28.7	Very low	148 Å²	148	150.6 Å²	150.6	79%	0.791	75%	0.751	S	S	*	*				-155.4	147.2	65.1	-78.4	-37.9	0	0	0	115.7
289	D	33.4	Very low	28.8	Very low	111 Å²	111	151.2 Å²	151.2	59%	0.594	75%	0.754	S	S	*	*			trans	35	111.3	145	-79.6	28.5	0	0	0	122.6
290	K	33.1	Very low	28.7	Very low	153 Å²	153	146.8 Å²	146.8	67%	0.665	75%	0.747	S	S	*	*				82.1	105.9	76.3	-76.6	-167.8	-158.2	82.1	0	113.8
291	N	28	Very low	28.9	Very low	133 Å²	133	148.8 Å²	148.8	71%	0.711	76%	0.758	S	S	*	*				151.8	110.3	115.7	-83.1	-61.3	0	0	0	113
292	L	31	Very low	28.9	Very low	175 Å²	175	149.6 Å²	149.6	92%	0.916	76%	0.758	S	S	*	*				-153.3	155.8	112.4	-140.4	64.1	0	0	0	111.2
293	Q	29.3	Very low	29.2	Very low	133 Å²	133	149.8 Å²	149.8	62%	0.621	76%	0.758	S	S	*	*			trans	-85.4	174.1	-173.5	-58.3	169.6	-8.6	0	0	109.9
294	R	27	Very low	29.2	Very low	199 Å²	199	150.7 Å²	150.7	75%	0.751	76%	0.758	S	S	*	*			cis	-167.1	138.9	30.6	-166.4	170.4	-85.4	-146.5	-4	113.6
295	H	29.4	Very low	29.4	Very low	151 Å²	151	147.9 Å²	147.9	70%	0.699	75%	0.753	S	S	*	*			trans	47.1	121.7	156.7	-76.6	-124.4	0	0	0	121.5	S297	H295-S297 PolarHBondContact ND1-OG 2.93Å; H295-S297 VanDerWaalsContact ND1-OG 3.08Å
296	E	22.7	Very low	29.7	Very low	184 Å²	184	148.1 Å²	148.1	86%	0.86	75%	0.752	S	S	*	*				-101.8	144.1	118.5	-75.7	-161.2	149.6	0	0	109
297	S	29	Very low	30	Very low	89 Å²	89	147.8 Å²	147.8	62%	0.622	75%	0.752	S	S	*	*			trans	-163.9	110.3	165.9	54.8	0	0	0	0	110.8	H295	H295-S297 PolarHBondContact ND1-OG 2.93Å; H295-S297 VanDerWaalsContact ND1-OG 3.08Å
298	W	24.6	Very low	30.1	Very low	231 Å²	231	146.8 Å²	146.8	88%	0.875	76%	0.756	S	S	*	*			trans	-84.6	135.4	171.6	-74.1	77.1	0	0	0	110.8
299	Q	28.6	Very low	30.3	Very low	183 Å²	183	145.6 Å²	145.6	86%	0.855	76%	0.759	S	S	*	*				177.4	124.4	124.4	-96.8	162.6	-1	0	0	113.7
300	S	25.9	Very low	30.4	Very low	101 Å²	101	146.4 Å²	146.4	71%	0.706	77%	0.773	S	S	*	*			trans	28.5	144.3	140.1	-47.6	0	0	0	0	123.9
301	L	29.7	Very low	30.5	Very low	150 Å²	150	142.3 Å²	142.3	79%	0.785	78%	0.775	S	S	*	*			trans	75.1	142.2	163.4	-55.2	153.3	0	0	0	114.4
302	E	30.4	Very low	30.9	Very low	166 Å²	166	143 Å²	143	78%	0.776	78%	0.784	S	S	*	*			cis	-146.3	-173.6	1.1	-137.4	153	-176.6	0	0	110.9
303	L	30.1	Very low	31.1	Very low	149 Å²	149	137.8 Å²	137.8	78%	0.78	77%	0.773	S	S	*	*			trans	-77.2	147.5	-171.4	-63.8	81.3	0	0	0	113.2
304	D	31.7	Very low	31.4	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	78%	0.78	S	S	*	*				178.6	137.2	100	-112.9	-42.4	0	0	0	117.9
305	T	31.3	Very low	31.9	Very low	114 Å²	114	134.6 Å²	134.6	70%	0.699	78%	0.779	S	S	*	*			trans	50.7	91.5	137	-60.8	0	0	0	0	123.5
306	V	35.4	Very low	32.1	Very low	132 Å²	132	135.2 Å²	135.2	80%	0.8	78%	0.782	S	S	*	*				19.8	140.8	109.8	168.3	0	0	0	0	118.1
307	P	36.8	Very low	32.6	Very low	122 Å²	122	130.7 Å²	130.7	79%	0.792	77%	0.771	S	S	*	*			cis	-144.3	-178.6	42.3	25.2	2.2	0	0	0	120.1
308	S	31.8	Very low	32.9	Very low	118 Å²	118	134.1 Å²	134.1	83%	0.825	78%	0.781	S	S	*	*			trans	-69.3	161.6	-178	53.2	0	0	0	0	119.9
309	S	36.5	Very low	33.2	Very low	123 Å²	123	126.8 Å²	126.8	86%	0.86	77%	0.765	S	S	*	*			trans	-133.8	172.5	151.9	65.9	0	0	0	0	110.5
310	S	35.8	Very low	33.4	Very low	127 Å²	127	124.7 Å²	124.7	89%	0.888	76%	0.76	S	S	*	*			trans	-161.2	143.3	-168.6	59.4	0	0	0	0	116.6
311	G	35.7	Very low	33.7	Very low	67 Å²	67	128.7 Å²	128.7	69%	0.691	77%	0.765	S	S	*	*			trans	136.9	157.2	160.2	0	0	0	0	0	115
312	T	36.8	Very low	33.8	Very low	149 Å²	149	128 Å²	128	91%	0.914	77%	0.767	S	S	*	*			cis	-176.5	135.7	-26.4	8.2	0	0	0	0	109.5
313	G	35.3	Very low	33.8	Very low	65 Å²	65	125.7 Å²	125.7	67%	0.67	76%	0.764	S	S	*	*			trans	77.2	167.1	158.9	0	0	0	0	0	119
314	D	35.4	Very low	34	Very low	147 Å²	147	126.5 Å²	126.5	79%	0.786	77%	0.767	S	S	*	*			cis	-169.8	150.1	-17	-122.4	-35.4	0	0	0	113.2
315	V	37.6	Very low	33.8	Very low	118 Å²	118	125.4 Å²	125.4	72%	0.715	77%	0.766	S	S	*	*			trans	47.2	165.7	161.8	-64.4	0	0	0	0	120.6
316	E	33.8	Very low	34	Very low	163 Å²	163	126.6 Å²	126.6	76%	0.762	77%	0.773	S	S	*	*			cis	-155.6	129.3	-13	-117.5	165.5	-172.3	0	0	106.7
317	S	32.4	Very low	33.7	Very low	90 Å²	90	126.2 Å²	126.2	63%	0.629	77%	0.771	S	S	*	*				93.4	175.7	89.1	88	0	0	0	0	116.4
318	L	34.7	Very low	33.8	Very low	160 Å²	160	125.7 Å²	125.7	84%	0.838	77%	0.768	S	S	*	*			trans	68.4	151.1	180	-60.1	155.7	0	0	0	117.1
319	S	31.5	Very low	33.8	Very low	78 Å²	78	126.5 Å²	126.5	55%	0.545	77%	0.768	S	S	.	*				-176.8	156.3	-65.7	54.3	0	0	0	0	109
320	N	33.8	Very low	33.8	Very low	138 Å²	138	124.3 Å²	124.3	74%	0.738	76%	0.757	S	S	*	*			trans	69.5	119.5	169.8	-54.9	-54.1	0	0	0	115.7
321	K	30.9	Very low	33.8	Very low	186 Å²	186	124.4 Å²	124.4	81%	0.809	75%	0.753	S	S	*	*				82.1	106.6	54.3	-177.7	-171.3	-174.4	-179.8	0	112.7
322	T	32.5	Very low	33.8	Very low	136 Å²	136	126.5 Å²	126.5	83%	0.834	75%	0.752	S	S	*	*			trans	179.8	150.6	131.6	-74.5	0	0	0	0	112
323	V	30	Very low	33.6	Very low	117 Å²	117	125.3 Å²	125.3	71%	0.709	75%	0.745	S	S	*	*			trans	-75.7	153.9	-177.3	172.6	0	0	0	0	113.1
324	I	35.1	Very low	33.6	Very low	165 Å²	165	127.7 Å²	127.7	85%	0.846	75%	0.747	S	S	*	*			trans	-171.4	152.2	134.8	-97.7	153.2	0	0	0	112
325	T	27.8	Very low	33.3	Very low	118 Å²	118	126.5 Å²	126.5	72%	0.724	75%	0.745	S	S	*	*			trans	-107.6	142.6	-169.4	-54.3	0	0	0	0	112.6
326	T	34.9	Very low	33.1	Very low	139 Å²	139	127.2 Å²	127.2	85%	0.853	75%	0.749	S	S	*	*			trans	-168	141.7	142.7	18.4	0	0	0	0	114.6
327	T	29.1	Very low	32.9	Very low	125 Å²	125	125.8 Å²	125.8	77%	0.767	75%	0.752	S	S	*	*			trans	-104.7	-174.6	158.2	50.9	0	0	0	0	107.9
328	P	38.9	Very low	32.9	Very low	110 Å²	110	126.1 Å²	126.1	71%	0.714	76%	0.76	S	S	*	*			cis	-149.5	176.3	16.9	45.5	-24	0	0	0	120.1
329	T	32.3	Very low	32.6	Very low	135 Å²	135	125 Å²	125	83%	0.828	76%	0.76	S	S	*	*			trans	39.5	130	140.4	-52.9	0	0	0	0	123.5
330	A	36.5	Very low	32.5	Very low	77 Å²	77	127.1 Å²	127.1	64%	0.636	78%	0.775	S	S	*	*				168.8	140.9	109.9	0	0	0	0	0	117.2
331	T	35.4	Very low	32.3	Very low	130 Å²	130	126.5 Å²	126.5	80%	0.798	78%	0.777	S	S	*	*			trans	53.3	144.1	142	45.3	0	0	0	0	123
332	T	34.9	Very low	32.4	Very low	111 Å²	111	124.9 Å²	124.9	68%	0.681	77%	0.774	S	S	*	*			cis	-167.7	159.4	-13.2	1	0	0	0	0	111.1
333	T	34	Very low	32.3	Very low	123 Å²	123	123.4 Å²	123.4	76%	0.755	77%	0.765	S	S	*	*			trans	62.2	152.8	152.9	51.1	0	0	0	0	119.4
334	T	33.6	Very low	32.5	Very low	116 Å²	116	124 Å²	124	71%	0.712	76%	0.764	S	S	*	*			cis	-159.3	143.5	3	1.5	0	0	0	0	112.5
335	T	30.9	Very low	32.4	Very low	121 Å²	121	122.9 Å²	122.9	74%	0.742	76%	0.755	S	S	*	*			trans	30.3	130.2	146.2	55.7	0	0	0	0	123.1
336	T	32.3	Very low	32.6	Very low	133 Å²	133	123.4 Å²	123.4	82%	0.816	75%	0.753	S	S	*	*				166.8	157.4	95.8	-50	0	0	0	0	111.9
337	T	29.3	Very low	32.5	Very low	133 Å²	133	123.7 Å²	123.7	82%	0.816	75%	0.75	S	S	*	*			trans	-74.7	171.5	173.3	45.7	0	0	0	0	112.7
338	A	32.6	Very low	32.6	Very low	97 Å²	97	125 Å²	125	80%	0.802	76%	0.757	S	S	*	*			cis	-162.5	-169.7	37.7	0	0	0	0	0	114.6
339	T	28.1	Very low	32.1	Very low	137 Å²	137	128.3 Å²	128.3	84%	0.84	76%	0.763	S	S	*	*			trans	-94.9	159.7	-169.1	47.4	0	0	0	0	116.6
340	S	30.6	Very low	32	Very low	123 Å²	123	130 Å²	130	86%	0.86	77%	0.766	S	S	*	*			trans	-148.4	152.7	161.7	-70.1	0	0	0	0	112.4
341	T	28.8	Very low	31.5	Very low	125 Å²	125	133.3 Å²	133.3	77%	0.767	77%	0.771	S	S	*	*			trans	-142.9	-169	179.5	52.7	0	0	0	0	111
342	M	32.7	Very low	31.3	Very low	152 Å²	152	134.2 Å²	134.2	75%	0.749	77%	0.769	S	S	*	*			trans	94.5	142.5	178.4	-58.3	-67.2	97.1	0	0	116.2
343	T	31.7	Very low	30.9	Very low	105 Å²	105	133.2 Å²	133.2	64%	0.644	77%	0.767	S	S	*	*			cis	-171.2	-171.2	-33.7	12.6	0	0	0	0	109.4
344	N	33.1	Very low	30.7	Very low	129 Å²	129	135.7 Å²	135.7	69%	0.69	77%	0.768	S	S	*	*			trans	84.1	142.3	157.1	-88.7	32.3	0	0	0	119.5
345	E	32.5	Very low	30.4	Very low	142 Å²	142	136.1 Å²	136.1	66%	0.664	76%	0.761	S	S	*	*			cis	-168.8	170	-6.7	-148.4	174.7	-129.4	0	0	113.9
346	N	33.3	Very low	30.3	Very low	129 Å²	129	137 Å²	137	69%	0.69	76%	0.761	S	S	*	*			trans	94.9	152.4	150.7	-69.1	-49.6	0	0	0	123.8
347	N	31	Very low	30.3	Very low	145 Å²	145	133.8 Å²	133.8	78%	0.775	76%	0.755	S	S	*	*			trans	-123.2	167.3	-156.4	-57.2	-60.6	0	0	0	115
348	T	32.5	Very low	30.5	Very low	151 Å²	151	135.8 Å²	135.8	93%	0.926	76%	0.755	S	S	*	*				-176.4	150.3	128.1	17.7	0	0	0	0	113.9
349	E	27.2	Very low	30.5	Very low	180 Å²	180	136.3 Å²	136.3	84%	0.841	74%	0.744	S	S	*	*			trans	-110.4	149.7	174.2	-56.2	176.6	109	0	0	112.1
350	I	30.7	Very low	30.6	Very low	171 Å²	171	136 Å²	136	88%	0.877	74%	0.738	S	S	*	*			trans	-142.8	150.8	153.9	-64.9	-169.8	0	0	0	110
351	I	27.3	Very low	30.8	Very low	147 Å²	147	137.5 Å²	137.5	75%	0.754	73%	0.731	S	S	*	*			trans	-107.1	169.1	-169.6	-55.8	154.4	0	0	0	110.8
352	I	30.3	Very low	30.9	Very low	148 Å²	148	138.8 Å²	138.8	76%	0.759	73%	0.728	S	S	*	*			trans	147.4	90.8	138	-70.8	157.8	0	0	0	115.2
353	S	25.7	Very low	30.8	Very low	90 Å²	90	138.7 Å²	138.7	63%	0.629	73%	0.729	S	S	*	*			trans	28.4	145.2	133	77.5	0	0	0	0	126.4
354	K	29.5	Very low	30.7	Very low	176 Å²	176	140.1 Å²	140.1	77%	0.765	73%	0.733	S	S	*	*			trans	77.4	158.9	138.8	-76.8	168.9	157.6	-139.8	0	118.5
355	Q	28	Very low	30.5	Very low	124 Å²	124	141.6 Å²	141.6	58%	0.579	74%	0.74	S	S	*	*			cis	-156.7	172	5	-135.7	171.7	-109.5	0	0	113.5
356	D	30	Very low	30.3	Very low	139 Å²	139	139.3 Å²	139.3	74%	0.743	75%	0.745	S	S	*	*			trans	63.1	149.4	156.2	-52.2	-34.9	0	0	0	120.3
357	G	31.4	Very low	30.4	Very low	66 Å²	66	138.2 Å²	138.2	68%	0.68	75%	0.748	S	S	*	*			cis	175.5	175.8	-6.9	0	0	0	0	0	113.9
358	Q	32.9	Very low	30.5	Very low	175 Å²	175	142.6 Å²	142.6	82%	0.818	75%	0.754	S	S	*	*			trans	69.5	147.3	166.2	-62.9	-166.1	-105.5	0	0	118.2
359	D	33.2	Very low	30.3	Very low	108 Å²	108	147.8 Å²	147.8	58%	0.578	76%	0.756	S	S	*	*			cis	-154.1	151.1	3.1	-113	-2.7	0	0	0	113
360	N	31	Very low	30.4	Very low	131 Å²	131	142.7 Å²	142.7	70%	0.701	75%	0.752	S	S	*	*			trans	41.8	141.5	142	-52.8	-36.5	0	0	0	121.7
361	E	33.3	Very low	30.5	Very low	155 Å²	155	144.8 Å²	144.8	72%	0.724	75%	0.749	S	S	*	*			cis	-168.4	-176.5	0.6	-127.5	-157.8	142.9	0	0	108.3
362	Q	31.1	Very low	30.9	Very low	151 Å²	151	149.9 Å²	149.9	71%	0.706	76%	0.759	S	S	*	*			cis	-144.3	-120	-0.4	-169	171.1	87.1	0	0	109.7
363	I	30.3	Very low	31	Very low	150 Å²	150	148.7 Å²	148.7	77%	0.769	76%	0.764	S	S	*	*			trans	-147.3	-166.9	-178.6	-10.2	175.4	0	0	0	108.4
364	D	29.5	Very low	31.3	Very low	136 Å²	136	147.6 Å²	147.6	73%	0.727	76%	0.761	S	S	*	*			cis	-149.4	-170.1	12.2	-162.9	9.7	0	0	0	112.2
365	L	30.1	Very low	31.7	Very low	159 Å²	159	147.4 Å²	147.4	83%	0.832	77%	0.766	S	S	*	*			trans	-94	151.1	-168.8	-62.6	153.9	0	0	0	116.1
366	A	28.7	Very low	31.9	Very low	94 Å²	94	148.6 Å²	148.6	78%	0.777	78%	0.775	S	S	*	*			trans	-164.6	150.8	145.3	0	0	0	0	0	114.5
367	S	34.2	Very low	32.1	Very low	107 Å²	107	149.2 Å²	149.2	75%	0.748	78%	0.778	S	S	*	*			trans	54.7	106	160.4	-67.6	0	0	0	0	119.6
368	R	33.1	Very low	32.2	Very low	237 Å²	237	155.1 Å²	155.1	89%	0.894	79%	0.785	S	S	*	*				66.8	111	83.6	-72.8	-175.9	170.8	-159.7	-1.6	116.3
369	R	29.1	Very low	32.3	Very low	259 Å²	259	155.9 Å²	155.9	98%	0.977	79%	0.786	S	S	*	*			trans	66.7	102.4	158.9	-64.1	-176.9	171.8	-172.1	-2.6	118.8
370	G	28.9	Very low	32.3	Very low	74 Å²	74	158.5 Å²	158.5	76%	0.763	80%	0.8	S	S	*	*			trans	134.1	137.9	141.7	0	0	0	0	0	117.3
371	R	32.5	Very low	32.3	Very low	215 Å²	215	160.7 Å²	160.7	81%	0.811	81%	0.81	S	S	*	*			trans	65.7	147	176.5	-62.7	-179.2	169.2	128.7	-5	116	D107	D107-R371 IonicContact OD2-NH2 2.8Å; D107-R371 PolarHBondContact OD2-NH2 3.22Å
372	R	35.6	Very low	32.3	Very low	253 Å²	253	161.5 Å²	161.5	96%	0.955	82%	0.818	S	S	*	*			trans	-108.6	138.3	165.7	-82	-174.8	172.3	-122.7	1.4	108.6
373	S	33.5	Very low	32.3	Very low	123 Å²	123	157 Å²	157	86%	0.86	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-78.4	163.6	-174.2	-55.5	0	0	0	0	113.4
374	A	32.4	Very low	32.2	Very low	68 Å²	68	159.6 Å²	159.6	56%	0.562	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-91	151.2	163.9	0	0	0	0	0	110.2
375	I	37.4	Very low	32.5	Very low	172 Å²	172	158.5 Å²	158.5	88%	0.882	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-78.7	142.3	171.8	-63	168	0	0	0	108.4
376	I	32.7	Very low	32.5	Very low	148 Å²	148	159.8 Å²	159.8	76%	0.759	82%	0.821	S	S	*	*			trans	-112	123.6	174.6	-62.6	173.9	0	0	0	107.4
377	D	33.8	Very low	32.5	Very low	152 Å²	152	161.1 Å²	161.1	81%	0.813	82%	0.819	S	S	*	*			trans	-92.5	142.4	173.8	-146.5	-28.4	0	0	0	110.5
378	K	33.6	Very low	32.3	Very low	190 Å²	190	164.7 Å²	164.7	83%	0.826	82%	0.824	S	S	*	*			trans	-119.2	85.8	-169.9	-78.1	-172.8	176.1	-177.9	0	111.9
379	K	35.2	Very low	32	Very low	192 Å²	192	159.7 Å²	159.7	84%	0.835	82%	0.815	S	S	*	*			trans	-139.1	156.1	159.1	-67.2	-167.5	178.6	-177.6	0	110.7
380	N	32.2	Very low	32	Very low	163 Å²	163	155.9 Å²	155.9	87%	0.872	81%	0.808	S	S	*	*			trans	70.2	70.7	-177.1	-56.3	-2.8	0	0	0	115.8
381	L	31.7	Very low	32	Very low	176 Å²	176	160.6 Å²	160.6	92%	0.921	81%	0.811	S	S	*	*			trans	-139.6	92	150.7	-163.5	75.5	0	0	0	110.6
382	I	32.1	Very low	31.9	Very low	172 Å²	172	155.9 Å²	155.9	88%	0.882	81%	0.806	S	S	*	*			trans	-141.3	136.9	165.9	-54.4	174.9	0	0	0	103.8
383	G	32.4	Very low	31.5	Very low	57 Å²	57	149.3 Å²	149.3	59%	0.588	79%	0.794	S	S	*	*			cis	160.4	64.7	0.5	0	0	0	0	0	109.7
384	E	27.8	Very low	31.3	Very low	205 Å²	205	149.2 Å²	149.2	96%	0.958	79%	0.789	S	S	*	*			trans	-81.2	114.2	173.3	-69.2	-179.7	165.5	0	0	108.8
385	T	34.5	Very low	31.2	Very low	113 Å²	113	153 Å²	153	69%	0.693	80%	0.798	S	S	*	*			trans	-125	117.5	-175.9	-54.3	0	0	0	0	110.6
386	E	30.8	Very low	30.6	Very low	185 Å²	185	149.8 Å²	149.8	86%	0.864	79%	0.791	S	S	*	*			trans	64.8	147.5	154.9	-67	170.3	162.9	0	0	120.3
387	V	29.5	Very low	30.7	Very low	122 Å²	122	152.1 Å²	152.1	74%	0.739	80%	0.798	S	S	*	*			trans	-112.3	118	176.2	172.2	0	0	0	0	106.8
388	E	28.5	Very low	30.6	Very low	182 Å²	182	151.8 Å²	151.8	85%	0.85	80%	0.797	S	S	*	*			trans	-95.2	135.1	170.3	-165.7	158.4	-135.7	0	0	110.2
389	N	26.9	Very low	30.7	Very low	133 Å²	133	149.6 Å²	149.6	71%	0.711	80%	0.799	S	S	*	*			trans	-117.4	111.3	-178.1	-82.5	-71.1	0	0	0	110.8
390	Q	30	Very low	30.7	Very low	178 Å²	178	145.8 Å²	145.8	83%	0.832	79%	0.787	S	S	*	*			trans	-165	141.3	154.8	-96.5	138.2	110.2	0	0	104.1
391	E	29.7	Very low	30.8	Very low	173 Å²	173	145.8 Å²	145.8	81%	0.808	78%	0.78	S	S	*	*			cis	-141.8	143.1	38.2	-65	-179.5	122.9	0	0	115.1
392	T	28.8	Very low	30.9	Very low	117 Å²	117	143.6 Å²	143.6	72%	0.718	77%	0.769	S	S	*	*			trans	58.8	129.4	136.1	62.7	0	0	0	0	125.4
393	T	28.5	Very low	31	Very low	114 Å²	114	141.6 Å²	141.6	70%	0.699	76%	0.759	S	S	*	*			trans	83.3	94.7	133.8	48.3	0	0	0	0	124.5
394	T	28.1	Very low	31	Very low	122 Å²	122	144.7 Å²	144.7	75%	0.748	76%	0.762	S	S	*	*				83.9	154.1	120.5	59.8	0	0	0	0	124
395	I	30.6	Very low	31.3	Very low	148 Å²	148	142 Å²	142	76%	0.759	75%	0.75	S	S	*	*			trans	67.5	99.7	167.3	-40.2	-172.9	0	0	0	114.9
396	S	25.8	Very low	31.2	Very low	104 Å²	104	143.4 Å²	143.4	73%	0.727	76%	0.758	S	S	*	*			cis	71.7	104.4	44	-49.6	0	0	0	0	116.5
397	Q	35.1	Very low	31.3	Very low	196 Å²	196	138 Å²	138	92%	0.916	75%	0.752	S	S	*	*			trans	-170.1	158.6	130.6	-105.9	171.6	37	0	0	115.2
398	N	29.9	Very low	31.6	Very low	146 Å²	146	142 Å²	142	78%	0.781	76%	0.763	S	S	*	*			trans	-78.7	154.2	-164.8	-59.4	-66.6	0	0	0	116.5
399	V	36.9	Very low	31.7	Very low	143 Å²	143	142.8 Å²	142.8	87%	0.867	77%	0.767	S	S	*	*			trans	-136.7	129.1	130.8	-173.7	0	0	0	0	112
400	N	35	Very low	31.6	Very low	112 Å²	112	147 Å²	147	60%	0.599	77%	0.773	S	S	*	*			trans	-45.8	167	170.3	-63.2	-71.8	0	0	0	117
401	K	35.3	Very low	31.8	Very low	163 Å²	163	144.4 Å²	144.4	71%	0.709	77%	0.771	S	S	*	*			cis	-174.6	157.9	-10.4	-108.4	170.5	-179.2	159	0	110.7
402	N	33.8	Very low	32	Very low	130 Å²	130	141.5 Å²	141.5	70%	0.695	77%	0.767	S	S	*	*			trans	66	151.5	144	-69.2	15.3	0	0	0	119.5
403	L	34.3	Very low	32	Very low	130 Å²	130	142.6 Å²	142.6	68%	0.681	77%	0.768	S	S	*	*			cis	-154.9	148.4	1.7	-112.2	155	0	0	0	109.6
404	N	32	Very low	32.1	Very low	122 Å²	122	144.3 Å²	144.3	65%	0.652	78%	0.779	S	S	*	*			trans	27	154.5	144.3	-62.9	21.7	0	0	0	122.2
405	E	33.9	Very low	32.2	Very low	150 Å²	150	143.1 Å²	143.1	70%	0.701	78%	0.775	S	S	*	*			cis	-163.5	161.9	14.2	-135.4	155.7	-110.5	0	0	113.1
406	T	32.8	Very low	32.3	Very low	141 Å²	141	140.1 Å²	140.1	87%	0.865	77%	0.768	S	S	*	*			trans	64.4	141.3	170.5	70.3	0	0	0	0	118.7
407	G	32.6	Very low	32.5	Very low	72 Å²	72	140.7 Å²	140.7	74%	0.742	77%	0.766	S	S	*	*			cis	-178.8	156.2	-10.2	0	0	0	0	0	114.1
408	Q	34.3	Very low	32.3	Very low	206 Å²	206	138.2 Å²	138.2	96%	0.963	76%	0.759	S	S	*	*			trans	70.9	156.9	175.8	-67.2	-173.1	-28.5	0	0	119.3
409	E	31.7	Very low	32.5	Very low	199 Å²	199	134.2 Å²	134.2	93%	0.93	74%	0.743	S	S	*	*			trans	-125.5	-176.7	-146.7	-66.1	-169.6	96.4	0	0	116.9
410	R	24.2	Very low	32.2	Very low	222 Å²	222	134 Å²	134	84%	0.838	73%	0.73	S	S	*	*			trans	-100.6	164.2	-167.1	-56.9	175.2	178.3	161.9	-1.4	114.6
411	P	34.9	Very low	32.2	Very low	123 Å²	123	137.7 Å²	137.7	80%	0.799	74%	0.736	S	S	*	*			trans	-107	162.8	130.9	34.2	-31.8	0	0	0	112.6
412	P	33.7	Very low	32.2	Very low	112 Å²	112	135.8 Å²	135.8	73%	0.727	73%	0.729	S	S	*	*			trans	-101	148.3	-150.4	37.1	-36.9	0	0	0	118.4
413	L	29.1	Very low	32.2	Very low	139 Å²	139	137.6 Å²	137.6	73%	0.728	73%	0.726	S	S	*	*			trans	35.3	97.9	137.1	-62.5	168.2	0	0	0	120.4
414	T	30.2	Very low	32.3	Very low	151 Å²	151	137.5 Å²	137.5	93%	0.926	72%	0.723	S	S	*	*				-134.7	105.4	127.3	44.1	0	0	0	0	108.9	S416	T414-S416 PolarHBondContact O-N 3.5Å
415	S	30.7	Very low	32.6	Very low	97 Å²	97	137.9 Å²	137.9	68%	0.678	72%	0.719	S	S	*	*			trans	-101.7	94.1	-159	53.6	0	0	0	0	115.3
416	S	31.4	Very low	32.6	Very low	85 Å²	85	137.6 Å²	137.6	59%	0.594	72%	0.715	S	S	*	*			trans	27.4	94.3	138.2	179.7	0	0	0	0	119.2	T414 S419	T414-S416 PolarHBondContact O-N 3.5Å; S416-S419 PolarHBondContact OG-OG 2.97Å
417	V	30.1	Very low	32.7	Very low	115 Å²	115	136.9 Å²	136.9	70%	0.697	71%	0.705	S	S	*	*	S	Bend	trans	-113.2	-37.8	157	-177.7	0	0	0	0	112
418	N	30.8	Very low	32.8	Very low	144 Å²	144	140.4 Å²	140.4	77%	0.77	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-10.8	-166.8	-70.7	-28.1	0	0	0	116.5
419	S	34.3	Very low	33	Very low	62 Å²	62	140 Å²	140	43%	0.434	70%	0.695	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.4	-14.6	-176.1	70.9	0	0	0	0	115	S416	S416-S419 PolarHBondContact OG-OG 2.97Å
420	F	30.8	Very low	33.3	Very low	139 Å²	139	138.7 Å²	138.7	61%	0.61	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-40.3	-179.6	-111	-98.6	0	0	0	113	E422 R423 Q424	F420-E422 PolarHBondContact O-N 3.11Å; F420-R423 PolarHBondContact O-N 3.34Å; F420-Q424 PolarHBondContact O-N 3.15Å
421	R	34.6	Very low	33.8	Very low	190 Å²	190	134.8 Å²	134.8	72%	0.717	68%	0.678	S	S	*	*	H	α-helix	trans	-63.3	-26.6	-176	-150.4	173.4	-167.8	-174	5.1	113.1	K425	R421-K425 WeakPolarHBondContact O-CD 3.42Å; R421-K425 VanDerWaalsContact O-CG 3.28Å; R421-K425 WeakPolarHBondContact O-CG 3.48Å
422	E	35.6	Very low	34	Very low	122 Å²	122	134.9 Å²	134.9	57%	0.57	67%	0.671	S	S	*	*	H	α-helix	trans	-79	-32.7	171.5	-69.2	-146	124.2	0	0	114.1	F420 K425 K426	F420-E422 PolarHBondContact O-N 3.11Å; E422-K425 PolarHBondContact O-N 3.43Å; E422-K426 PolarHBondContact O-N 2.93Å; E422-K426 IonicContact OE2-NZ 2.76Å
423	R	34	Very low	34.5	Very low	168 Å²	168	130.9 Å²	130.9	63%	0.634	65%	0.645	S	S	*	*	H	α-helix	trans	-71.9	-39	-173.8	-154.1	172.9	-64.4	-136.2	2.5	110.9	F420 K426 I427	F420-R423 PolarHBondContact O-N 3.34Å; R423-K426 PolarHBondContact O-N 3.17Å; R423-I427 PolarHBondContact O-N 3.4Å
424	Q	36.8	Very low	35	Very low	129 Å²	129	127.8 Å²	127.8	60%	0.603	63%	0.629	S	S	*	*	H	α-helix	trans	-66.4	-41.5	168.8	-74.1	179.5	-30.3	0	0	112.4	F420 K426 I427 L428	F420-Q424 PolarHBondContact O-N 3.15Å; Q424-K426 PolarHBondContact O-N 2.94Å; Q424-I427 PolarHBondContact O-N 3.14Å; Q424-L428 PolarHBondContact O-N 2.85Å
425	K	37.1	Very low	35.5	Very low	130 Å²	130	121.3 Å²	121.3	57%	0.565	59%	0.59	S	S	*	*	H	α-helix	trans	-62.7	-20.6	175.4	-76.9	178.3	179.2	-178.7	0	114.1	R421 E422	R421-K425 WeakPolarHBondContact O-CD 3.42Å; R421-K425 VanDerWaalsContact O-CG 3.28Å; R421-K425 WeakPolarHBondContact O-CG 3.48Å; E422-K425 PolarHBondContact O-N 3.43Å
426	K	34.8	Very low	36.1	Very low	144 Å²	144	120.4 Å²	120.4	63%	0.626	58%	0.578	S	S	*	*	H	α-helix	trans	-86.7	-19.4	171.8	-82	167.9	177.1	153.8	0	114	E422 R423 Q424	E422-K426 PolarHBondContact O-N 2.93Å; E422-K426 IonicContact OE2-NZ 2.76Å; R423-K426 PolarHBondContact O-N 3.17Å; Q424-K426 PolarHBondContact O-N 2.94Å
427	I	35.7	Very low	36.5	Very low	126 Å²	126	120.6 Å²	120.6	65%	0.646	57%	0.572	S	S	*	*	H	α-helix	trans	-83.1	-37.3	176.3	-73	169.7	0	0	0	111.2	R423 Q424 R429	R423-I427 PolarHBondContact O-N 3.4Å; Q424-I427 PolarHBondContact O-N 3.14Å; I427-R429 PolarHBondContact O-N 3.18Å
428	L	34.5	Very low	36.9	Very low	146 Å²	146	117.9 Å²	117.9	76%	0.764	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	15.5	177.3	-76.9	162.1	0	0	0	115	Q424	Q424-L428 PolarHBondContact O-N 2.85Å
429	R	38.6	Very low	37.4	Very low	198 Å²	198	115.1 Å²	115.1	75%	0.747	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.8	15.6	179.3	-70.6	-172.7	173.2	-175.6	-1.5	114.3	I427	I427-R429 PolarHBondContact O-N 3.18Å
430	K	36.8	Very low	37.5	Very low	170 Å²	170	121.7 Å²	121.7	74%	0.739	56%	0.564	S	S	*	*			trans	-147.1	56	174.8	-72.3	-162.4	173.8	-169.7	0	112.3
431	Q	34.8	Very low	37.9	Very low	140 Å²	140	121.2 Å²	121.2	65%	0.654	57%	0.568	S	S	*	*			trans	-76.4	115	147.6	-64.5	-172.5	8.1	0	0	105.5	T433	Q431-T433 PolarHBondContact O-N 3.17Å
432	N	40.4	Very low	38.2	Very low	125 Å²	125	119.9 Å²	119.9	67%	0.668	57%	0.57	S	S	*	*			trans	-69.6	127.2	171.8	-48	-72.1	0	0	0	106.6
433	T	42.5	Very low	38.1	Very low	28 Å²	28	120 Å²	120	17%	0.172	57%	0.572	C	S	.	*			trans	-62.9	149.2	-172.6	-40.8	0	0	0	0	109.3	Q431 A435 D436 M557 E560	Q431-T433 PolarHBondContact O-N 3.17Å; T433-A435 HydrophobicContact CG2-CB 3.69Å; T433-A435 PolarHBondContact O-N 3.21Å; T433-A435 VanDerWaalsContact O-N 3.14Å; T433-D436 PolarHBondContact N-OD2 3Å; T433-D436 WeakPolarHBondContact O-CB 3.4Å; T433-D436 PolarHBondContact O-N 2.7Å; T433-M557 WeakPolarHBondContact CG2-O 3.19Å; T433-E560 WeakPolarHBondContact CB-OE1 3.45Å; T433-E560 HydrophobicContact CG2-CG 4.06Å; T433-E560 WeakPolarHBondContact CG2-OE1 3.48Å; T433-E560 PolarHBondContact OG1-OE1 3.36Å
434	I	40.9	Very low	38	Very low	75 Å²	75	115.7 Å²	115.7	39%	0.385	57%	0.572	S	S	.	*	H	α-helix	trans	-60.6	-25	169.7	-63.6	177.3	0	0	0	110	L437 S438	I434-L437 PolarHBondContact O-N 2.84Å; I434-S438 WeakPolarHBondContact O-CB 3.34Å; I434-S438 PolarHBondContact O-N 3.44Å
435	A	40.8	Very low	37.7	Very low	15 Å²	15	117.1 Å²	117.1	12%	0.124	58%	0.584	C	S	.	*	H	α-helix	trans	-59.3	-42.3	167.6	0	0	0	0	0	114	T433 L437 S438 C439	T433-A435 HydrophobicContact CG2-CB 3.69Å; T433-A435 PolarHBondContact O-N 3.21Å; T433-A435 VanDerWaalsContact O-N 3.14Å; A435-L437 PolarHBondContact O-N 3.11Å; A435-L437 VanDerWaalsContact O-N 3.17Å; A435-S438 PolarHBondContact O-N 3.38Å; A435-S438 VanDerWaalsContact O-N 3.11Å; A435-C439 WeakPolarHBondContact O-CB 3.47Å; A435-C439 PolarHBondContact O-N 3.03Å; A435-C439 PolarHBondContact O-SG 3.48Å; A435-C439 VanDerWaalsContact O-SG 3.4Å
436	D	42.9	Very low	37.7	Very low	77 Å²	77	116.8 Å²	116.8	41%	0.412	59%	0.593	S	S	.	*	H	α-helix	trans	-56.8	-33.5	176.4	-77.6	-50.5	0	0	0	112.1	T433 R440	T433-D436 PolarHBondContact N-OD2 3Å; T433-D436 WeakPolarHBondContact O-CB 3.4Å; T433-D436 PolarHBondContact O-N 2.7Å; D436-R440 WeakPolarHBondContact O-CB 3.43Å
437	L	39.7	Very low	37.5	Very low	90 Å²	90	116.9 Å²	116.9	47%	0.471	60%	0.601	S	S	.	*	H	α-helix	trans	-83.3	-38.6	177.8	-63.5	172.3	0	0	0	111.6	I434 A435 N441	I434-L437 PolarHBondContact O-N 2.84Å; A435-L437 PolarHBondContact O-N 3.11Å; A435-L437 VanDerWaalsContact O-N 3.17Å; L437-N441 PolarHBondContact O-N 2.89Å; L437-N441 PolarHBondContact O-ND2 2.85Å
438	S	38.7	Very low	37.4	Very low	58 Å²	58	117.6 Å²	117.6	41%	0.406	60%	0.601	S	S	.	*	H	α-helix	trans	-67.1	-51.9	179	-172	0	0	0	0	112.5	I434 A435 R440 N441 Q442	I434-S438 WeakPolarHBondContact O-CB 3.34Å; I434-S438 PolarHBondContact O-N 3.44Å; A435-S438 PolarHBondContact O-N 3.38Å; A435-S438 VanDerWaalsContact O-N 3.11Å; S438-R440 PolarHBondContact O-N 2.98Å; S438-N441 WeakPolarHBondContact O-CB 3.28Å; S438-N441 PolarHBondContact O-N 2.9Å; S438-Q442 PolarHBondContact O-N 3.2Å
439	C	40.7	Very low	37.2	Very low	86 Å²	86	115.2 Å²	115.2	58%	0.581	59%	0.589	S	S	*	*	H	α-helix	trans	-60.7	-31.8	179.1	-65.4	0	0	0	0	111.9	A435 N441	A435-C439 WeakPolarHBondContact O-CB 3.47Å; A435-C439 PolarHBondContact O-N 3.03Å; A435-C439 PolarHBondContact O-SG 3.48Å; A435-C439 VanDerWaalsContact O-SG 3.4Å; C439-N441 VanDerWaalsContact C-N 3.34Å
440	R	36.3	Very low	37.1	Very low	199 Å²	199	115.9 Å²	115.9	75%	0.751	59%	0.593	S	S	*	*	H	α-helix	trans	-70.9	-26.3	175.3	-168.6	167.6	-173.1	165.5	1.8	113.7	D436 S438	D436-R440 WeakPolarHBondContact O-CB 3.43Å; S438-R440 PolarHBondContact O-N 2.98Å
441	N	38.9	Very low	37.2	Very low	129 Å²	129	115.6 Å²	115.6	69%	0.69	59%	0.594	S	S	*	*	H	α-helix	trans	-78.5	-21.9	178.4	-71.4	-25.6	0	0	0	113.3	L437 S438 C439 M443	L437-N441 PolarHBondContact O-N 2.89Å; L437-N441 PolarHBondContact O-ND2 2.85Å; S438-N441 WeakPolarHBondContact O-CB 3.28Å; S438-N441 PolarHBondContact O-N 2.9Å; C439-N441 VanDerWaalsContact C-N 3.34Å; N441-M443 VanDerWaalsContact C-N 3.25Å; N441-M443 PolarHBondContact O-N 3.48Å
442	Q	41.2	Very low	37.5	Very low	162 Å²	162	114 Å²	114	76%	0.757	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-6	177.9	-60.1	-168.3	21.7	0	0	113.6	S438	S438-Q442 PolarHBondContact O-N 3.2Å
443	M	34.5	Very low	37.3	Very low	124 Å²	124	113.8 Å²	113.8	61%	0.611	58%	0.583	S	S	*	*	S	Bend	trans	-111.2	44	-177.6	-65.2	-156.8	157.6	0	0	114	F253 N441	F253-M443 HydrophobicContact CD1-CE 4.42Å; F253-M443 HydrophobicContact CD1-SD 4.02Å; F253-M443 HydrophobicContact CD2-CE 4.12Å; F253-M443 HydrophobicContact CD2-SD 4.07Å; F253-M443 HydrophobicContact CE1-CE 3.97Å; F253-M443 HydrophobicContact CE1-SD 4.14Å; F253-M443 HydrophobicContact CE2-CE 3.65Å; F253-M443 HydrophobicContact CE2-SD 4.2Å; F253-M443 HydrophobicContact CG-CE 4.49Å; F253-M443 HydrophobicContact CG-SD 3.99Å; F253-M443 HydrophobicContact CZ-CE 3.57Å; F253-M443 HydrophobicContact CZ-SD 4.23Å; N441-M443 VanDerWaalsContact C-N 3.25Å; N441-M443 PolarHBondContact O-N 3.48Å
444	A	32.1	Very low	37	Very low	78 Å²	78	121.7 Å²	121.7	65%	0.645	61%	0.61	S	S	*	*			trans	-138.4	46.8	-175.6	0	0	0	0	0	114.3	T446	A444-T446 PolarHBondContact O-N 2.78Å
445	N	29.9	Very low	37.1	Very low	160 Å²	160	127.8 Å²	127.8	86%	0.856	63%	0.628	S	S	*	*			trans	-92.3	71.7	-174.1	-141	-19	0	0	0	113.2
446	T	36.6	Very low	37.1	Very low	122 Å²	122	128.6 Å²	128.6	75%	0.748	64%	0.638	S	S	*	*	S	Bend	trans	-170.9	116	157.3	7.8	0	0	0	0	113.3	A444	A444-T446 PolarHBondContact O-N 2.78Å
447	N	31.5	Very low	37.1	Very low	147 Å²	147	129.7 Å²	129.7	79%	0.786	64%	0.644	S	S	*	*	S	Bend	trans	51.2	57.6	156	-61.4	-0.5	0	0	0	119.6
448	Q	33.6	Very low	37.3	Very low	140 Å²	140	129.8 Å²	129.8	65%	0.654	65%	0.648	S	S	*	*			trans	-139.1	41.7	158.7	-73.9	-159.5	-14.1	0	0	113.4	Y450 L452	Q448-Y450 PolarHBondContact O-N 3.32Å; Q448-Y450 VanDerWaalsContact O-N 3.17Å; Q448-L452 HydrophobicContact CB-CD1 3.75Å
449	D	29.8	Very low	37.4	Very low	97 Å²	97	133 Å²	133	52%	0.519	66%	0.655	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.6	-7.3	-161.3	-107.7	-70.8	0	0	0	118.5	K453	D449-K453 WeakPolarHBondContact O-CD 3.46Å; D449-K453 PolarHBondContact O-NZ 2.86Å; D449-K453 IonicContact OD1-NZ 2.9Å; D449-K453 PolarHBondContact OD1-NZ 3.27Å
450	Y	35.7	Very low	37.5	Very low	212 Å²	212	133.2 Å²	133.2	83%	0.831	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.2	-24.5	-169.6	-77.8	-82.6	0	0	0	116.4	Q448	Q448-Y450 PolarHBondContact O-N 3.32Å; Q448-Y450 VanDerWaalsContact O-N 3.17Å
451	E	39	Very low	37.8	Very low	163 Å²	163	131.1 Å²	131.1	76%	0.762	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-39.8	174.1	-75.9	-147.9	116	0	0	113.2	K453 R454	E451-K453 VanDerWaalsContact C-N 3.3Å; E451-K453 PolarHBondContact O-N 2.98Å; E451-R454 WeakPolarHBondContact O-CB 3.18Å; E451-R454 PolarHBondContact O-N 3.15Å
452	L	41.6	Very low	38.3	Very low	106 Å²	106	130.5 Å²	130.5	56%	0.555	64%	0.641	S	S	*	*	H	α-helix	trans	-61.6	-37.1	-175.1	-76.4	164.4	0	0	0	112.4	Q448 R454 R455 G456	Q448-L452 HydrophobicContact CB-CD1 3.75Å; L452-R454 PolarHBondContact O-N 3.46Å; L452-R455 PolarHBondContact O-N 3.3Å; L452-R455 VanDerWaalsContact O-N 3.1Å; L452-G456 PolarHBondContact O-N 2.96Å
453	K	37	Very low	38.9	Very low	122 Å²	122	126.3 Å²	126.3	53%	0.53	62%	0.623	S	S	.	*	H	α-helix	trans	-55	-34.1	171.7	-76.7	-179.7	173.2	120.2	0	112.9	D449 E451 R455 N457	D449-K453 WeakPolarHBondContact O-CD 3.46Å; D449-K453 PolarHBondContact O-NZ 2.86Å; D449-K453 IonicContact OD1-NZ 2.9Å; D449-K453 PolarHBondContact OD1-NZ 3.27Å; E451-K453 VanDerWaalsContact C-N 3.3Å; E451-K453 PolarHBondContact O-N 2.98Å; K453-R455 VanDerWaalsContact C-N 3.35Å; K453-R455 PolarHBondContact O-N 2.65Å; K453-N457 VanDerWaalsContact O-CB 3.3Å; K453-N457 WeakPolarHBondContact O-CB 3.34Å; K453-N457 PolarHBondContact O-N 2.87Å; K453-N457 VanDerWaalsContact O-N 3.08Å; K453-N457 PolarHBondContact O-OD1 2.76Å
454	R	36.5	Very low	39.4	Very low	194 Å²	194	125.5 Å²	125.5	73%	0.732	62%	0.617	S	S	*	*	H	α-helix	trans	-76.8	-18.2	-179.2	-143.6	-173.8	-59.3	-174.2	4.3	113.7	E451 L452	E451-R454 WeakPolarHBondContact O-CB 3.18Å; E451-R454 PolarHBondContact O-N 3.15Å; L452-R454 PolarHBondContact O-N 3.46Å
455	R	41.7	Very low	39.6	Very low	202 Å²	202	130.2 Å²	130.2	76%	0.762	62%	0.619	S	S	*	*	H	α-helix	trans	-96.2	-37.5	170.9	-86.1	-175.3	165.9	154.1	1.4	113.1	L452 K453 N457 V458 F459	L452-R455 PolarHBondContact O-N 3.3Å; L452-R455 VanDerWaalsContact O-N 3.1Å; K453-R455 VanDerWaalsContact C-N 3.35Å; K453-R455 PolarHBondContact O-N 2.65Å; R455-N457 VanDerWaalsContact C-N 3.32Å; R455-N457 PolarHBondContact O-N 3.43Å; R455-V458 PolarHBondContact O-N 2.69Å; R455-F459 PolarHBondContact O-N 2.89Å
456	G	41.1	Very low	40.3	Very low	33 Å²	33	126.7 Å²	126.7	34%	0.34	62%	0.62	S	S	.	*	H	α-helix	trans	-53.2	-50.8	170.7	0	0	0	0	0	111.1	L452 V458 F459 M460	L452-G456 PolarHBondContact O-N 2.96Å; G456-V458 PolarHBondContact O-N 2.94Å; G456-F459 PolarHBondContact O-N 2.9Å; G456-M460 WeakPolarHBondContact O-CB 3.47Å; G456-M460 WeakPolarHBondContact O-CG 3.25Å; G456-M460 PolarHBondContact O-N 2.97Å
457	N	42.9	Very low	40.7	Very low	99 Å²	99	124.7 Å²	124.7	53%	0.529	61%	0.608	S	S	.	*	H	α-helix	trans	-68	-6.4	-178.2	-67.7	24.9	0	0	0	115.3	K453 R455 K461	K453-N457 VanDerWaalsContact O-CB 3.3Å; K453-N457 WeakPolarHBondContact O-CB 3.34Å; K453-N457 PolarHBondContact O-N 2.87Å; K453-N457 VanDerWaalsContact O-N 3.08Å; K453-N457 PolarHBondContact O-OD1 2.76Å; R455-N457 VanDerWaalsContact C-N 3.32Å; R455-N457 PolarHBondContact O-N 3.43Å; N457-K461 VanDerWaalsContact O-CB 3.29Å; N457-K461 WeakPolarHBondContact O-CB 3.22Å; N457-K461 WeakPolarHBondContact O-CD 3.35Å; N457-K461 WeakPolarHBondContact O-CG 3.38Å
458	V	43.5	Very low	41.8	Very low	93 Å²	93	122.2 Å²	122.2	56%	0.564	59%	0.588	S	S	*	*	H	α-helix	trans	-95.6	-39.1	172.7	177.2	0	0	0	0	110.9	R455 G456 L462	R455-V458 PolarHBondContact O-N 2.69Å; G456-V458 PolarHBondContact O-N 2.94Å; V458-L462 PolarHBondContact O-N 2.85Å
459	F	41.3	Very low	42.7	Very low	124 Å²	124	117.8 Å²	117.8	54%	0.544	57%	0.572	S	S	.	*	H	α-helix	trans	-75.8	-38.3	176	-152.4	-99.6	0	0	0	111.5	R455 G456 L462 I463	R455-F459 PolarHBondContact O-N 2.89Å; G456-F459 PolarHBondContact O-N 2.9Å; F459-L462 PolarHBondContact O-N 3.25Å; F459-I463 HydrophobicContact CD1-CD1 3.91Å; F459-I463 HydrophobicContact CE1-CD1 3.87Å; F459-I463 PolarHBondContact O-N 3.17Å
460	M	43	Very low	44	Very low	92 Å²	92	121.2 Å²	121.2	45%	0.453	58%	0.583	S	S	.	*	H	α-helix	trans	-59.4	-48.9	168.3	-73	-62.9	-66.8	0	0	110.5	G456 L462 I463 E464	G456-M460 WeakPolarHBondContact O-CB 3.47Å; G456-M460 WeakPolarHBondContact O-CG 3.25Å; G456-M460 PolarHBondContact O-N 2.97Å; M460-L462 PolarHBondContact O-N 2.73Å; M460-I463 CarbonylContact O-C 3.54Å; M460-I463 WeakPolarHBondContact O-CA 3.38Å; M460-I463 PolarHBondContact O-N 2.99Å; M460-E464 HydrophobicContact CB-CG 4.24Å; M460-E464 HydrophobicContact CE-CG 4.04Å; M460-E464 WeakPolarHBondContact CE-OE1 3.45Å; M460-E464 WeakPolarHBondContact O-CB 3.37Å; M460-E464 VanDerWaalsContact O-CG 3.24Å; M460-E464 WeakPolarHBondContact O-CG 3.44Å; M460-E464 PolarHBondContact O-N 3Å
461	K	42.5	Very low	45.7	Very low	154 Å²	154	113.7 Å²	113.7	67%	0.67	56%	0.556	S	S	*	*	H	α-helix	trans	-62.6	-12.4	176.6	-79.3	-174.4	175	-167.5	0	116.3	N457 E464	N457-K461 VanDerWaalsContact O-CB 3.29Å; N457-K461 WeakPolarHBondContact O-CB 3.22Å; N457-K461 WeakPolarHBondContact O-CD 3.35Å; N457-K461 WeakPolarHBondContact O-CG 3.38Å; K461-E464 PolarHBondContact N-OE2 3.43Å
462	L	48.7	Very low	47.4	Very low	117 Å²	117	106.1 Å²	106.1	61%	0.613	52%	0.521	S	S	*	.	H	α-helix	trans	-88.7	-15.1	170.2	-89.9	159.7	0	0	0	113.4	V458 F459 M460	V458-L462 PolarHBondContact O-N 2.85Å; F459-L462 PolarHBondContact O-N 3.25Å; M460-L462 PolarHBondContact O-N 2.73Å
463	I	53.9	Low	49	Very low	73 Å²	73	104 Å²	104	37%	0.374	51%	0.511	S	S	.	.	H	α-helix	trans	-104.4	-37.3	176.7	-63.1	172.7	0	0	0	110.6	F459 M460 R465	F459-I463 HydrophobicContact CD1-CD1 3.91Å; F459-I463 HydrophobicContact CE1-CD1 3.87Å; F459-I463 PolarHBondContact O-N 3.17Å; M460-I463 CarbonylContact O-C 3.54Å; M460-I463 WeakPolarHBondContact O-CA 3.38Å; M460-I463 PolarHBondContact O-N 2.99Å; I463-R465 PolarHBondContact O-N 2.93Å
464	E	46.5	Very low	50.9	Low	107 Å²	107	104.9 Å²	104.9	50%	0.5	52%	0.517	S	S	.	.			trans	-70.3	36.3	172.8	-61.7	168.1	148.8	0	0	112.9	M460 K461 G466	M460-E464 HydrophobicContact CB-CG 4.24Å; M460-E464 HydrophobicContact CE-CG 4.04Å; M460-E464 WeakPolarHBondContact CE-OE1 3.45Å; M460-E464 WeakPolarHBondContact O-CB 3.37Å; M460-E464 VanDerWaalsContact O-CG 3.24Å; M460-E464 WeakPolarHBondContact O-CG 3.44Å; M460-E464 PolarHBondContact O-N 3Å; K461-E464 PolarHBondContact N-OE2 3.43Å; E464-G466 VanDerWaalsContact C-N 3.27Å; E464-G466 PolarHBondContact O-N 3.32Å
465	R	35.7	Very low	52.7	Low	177 Å²	177	96.2 Å²	96.2	67%	0.668	49%	0.486	S	S	*	.			trans	-68.3	95.5	157.6	-100.5	-173.3	156	97	-3.5	106.9	I463 T467 R468	I463-R465 PolarHBondContact O-N 2.93Å; R465-T467 PolarHBondContact O-N 3.37Å; R465-R468 HydrophobicContact CB-CG 4.35Å; R465-R468 PolarHBondContact O-N 3.28Å
466	G	44	Very low	54.5	Low	86 Å²	86	86.7 Å²	86.7	89%	0.887	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	35.4	-178	0	0	0	0	0	115.7	E464	E464-G466 VanDerWaalsContact C-N 3.27Å; E464-G466 PolarHBondContact O-N 3.32Å
467	T	46.1	Very low	56	Low	81 Å²	81	92.7 Å²	92.7	50%	0.497	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-25.5	174.1	57	0	0	0	0	111.8	R465 S469 K470	R465-T467 PolarHBondContact O-N 3.37Å; T467-S469 VanDerWaalsContact C-N 3.29Å; T467-S469 PolarHBondContact O-N 2.74Å; T467-K470 PolarHBondContact O-N 2.95Å
468	R	53.2	Low	57.5	Low	95 Å²	95	91.8 Å²	91.8	36%	0.358	47%	0.471	S	S	.	.	H	α-helix	trans	-67.5	-10.9	-161.2	-59.4	-166.8	78.6	-163.5	-1.7	117.5	R465 K470 D471 L472	R465-R468 HydrophobicContact CB-CG 4.35Å; R465-R468 PolarHBondContact O-N 3.28Å; R468-K470 VanDerWaalsContact C-N 3.32Å; R468-D471 WeakPolarHBondContact CA-OD2 3.35Å; R468-L472 VanDerWaalsContact O-CB 3.31Å; R468-L472 WeakPolarHBondContact O-CB 3.25Å; R468-L472 PolarHBondContact O-N 2.88Å
469	S	53.6	Low	58.7	Low	47 Å²	47	87.7 Å²	87.7	33%	0.329	45%	0.446	S	S	.	.	H	α-helix	trans	-67.2	-34.6	168.7	160.1	0	0	0	0	111.1	T467 L472 N473 E643	T467-S469 VanDerWaalsContact C-N 3.29Å; T467-S469 PolarHBondContact O-N 2.74Å; S469-L472 PolarHBondContact O-N 3.12Å; S469-N473 PolarHBondContact O-N 2.92Å; S469-N473 PolarHBondContact O-ND2 2.97Å; S469-E643 PolarHBondContact OG-OE1 3.26Å
470	K	56.6	Low	59.7	Low	169 Å²	169	90.6 Å²	90.6	74%	0.735	46%	0.459	S	S	*	.	H	α-helix	trans	-65	-51.1	172.5	-66.3	-170.1	176.4	-172.7	0	110.6	T467 R468 L472 N473 E474	T467-K470 PolarHBondContact O-N 2.95Å; R468-K470 VanDerWaalsContact C-N 3.32Å; K470-L472 PolarHBondContact O-N 2.71Å; K470-N473 PolarHBondContact O-N 2.84Å; K470-N473 VanDerWaalsContact O-N 3.11Å; K470-E474 PolarHBondContact O-N 3.4Å
471	D	70.6	Confident	60.6	Low	53 Å²	53	87.9 Å²	87.9	28%	0.283	45%	0.449	S	S	.	.	H	α-helix	trans	-56.5	-37	178.4	-36.3	-6	0	0	0	111.9	R468 A475 Y555	R468-D471 WeakPolarHBondContact CA-OD2 3.35Å; D471-A475 WeakPolarHBondContact O-CB 3.29Å; D471-A475 PolarHBondContact O-N 3.22Å; D471-Y555 HydrophobicContact CB-CE1 4.35Å; D471-Y555 VanDerWaalsContact CB-OH 3.25Å; D471-Y555 WeakPolarHBondContact CB-OH 3.31Å; D471-Y555 PolarHBondContact O-OH 3.02Å
472	L	75.7	Confident	61.6	Low	4 Å²	4	82.5 Å²	82.5	2%	0.021	43%	0.43	C	S	.	.	H	α-helix	trans	-72.9	-41	176.3	-177.8	144.5	0	0	0	112.7	R468 S469 K470 E474 A475 L476 Y555 H640 E643	R468-L472 VanDerWaalsContact O-CB 3.31Å; R468-L472 WeakPolarHBondContact O-CB 3.25Å; R468-L472 PolarHBondContact O-N 2.88Å; S469-L472 PolarHBondContact O-N 3.12Å; K470-L472 PolarHBondContact O-N 2.71Å; L472-E474 VanDerWaalsContact C-N 3.31Å; L472-E474 PolarHBondContact O-N 2.86Å; L472-A475 PolarHBondContact O-N 2.93Å; L472-L476 HydrophobicContact CD2-CD1 3.6Å; L472-L476 HydrophobicContact CD2-CG 4.12Å; L472-L476 WeakPolarHBondContact O-CB 3.14Å; L472-L476 VanDerWaalsContact O-CG 3.3Å; L472-L476 WeakPolarHBondContact O-CG 3.05Å; L472-L476 PolarHBondContact O-N 3.05Å; L472-Y555 HydrophobicContact CB-CD1 4.04Å; L472-Y555 HydrophobicContact CB-CE1 4.07Å; L472-Y555 HydrophobicContact CD1-CD1 3.99Å; L472-Y555 HydrophobicContact CD1-CG 4.46Å; L472-Y555 HydrophobicContact CG-CD1 4.3Å; L472-H640 HydrophobicContact CD1-CB 3.93Å; L472-E643 HydrophobicContact CD2-CB 3.86Å
473	N	75.1	Confident	62.1	Low	62 Å²	62	84.8 Å²	84.8	33%	0.332	43%	0.432	S	S	.	.	H	α-helix	trans	-65.7	-35.8	175.2	-81.3	-84.9	0	0	0	111.7	S469 K470 L476 Q477 E643	S469-N473 PolarHBondContact O-N 2.92Å; S469-N473 PolarHBondContact O-ND2 2.97Å; K470-N473 PolarHBondContact O-N 2.84Å; K470-N473 VanDerWaalsContact O-N 3.11Å; N473-L476 PolarHBondContact O-N 2.77Å; N473-Q477 VanDerWaalsContact O-CG 3.29Å; N473-Q477 WeakPolarHBondContact O-CG 3.35Å; N473-Q477 PolarHBondContact O-N 2.91Å; N473-E643 PolarHBondContact ND2-OE1 3.16Å
474	E	75.7	Confident	62.4	Low	141 Å²	141	85.9 Å²	85.9	66%	0.659	43%	0.434	S	S	*	.	H	α-helix	trans	-66.8	-43.2	172	-171.7	170.1	-160.5	0	0	111.4	K470 L472 L476 Q477 S478	K470-E474 PolarHBondContact O-N 3.4Å; L472-E474 VanDerWaalsContact C-N 3.31Å; L472-E474 PolarHBondContact O-N 2.86Å; E474-L476 PolarHBondContact O-N 3.01Å; E474-Q477 PolarHBondContact O-N 3.06Å; E474-S478 PolarHBondContact O-N 3.18Å
475	A	76.2	Confident	62.9	Low	12 Å²	12	86.1 Å²	86.1	10%	0.099	44%	0.435	C	S	.	.	H	α-helix	trans	-59.2	-44.8	173.1	0	0	0	0	0	112.1	D471 L472 S478 L479 L550 Y555	D471-A475 WeakPolarHBondContact O-CB 3.29Å; D471-A475 PolarHBondContact O-N 3.22Å; L472-A475 PolarHBondContact O-N 2.93Å; A475-S478 PolarHBondContact O-N 3.04Å; A475-S478 PolarHBondContact O-OG 3.32Å; A475-L479 WeakPolarHBondContact O-CB 3.37Å; A475-L479 PolarHBondContact O-N 3.5Å; A475-L479 VanDerWaalsContact O-N 3.16Å; A475-L550 HydrophobicContact CB-CD2 4.2Å; A475-Y555 HydrophobicContact CB-CD2 4.06Å; A475-Y555 HydrophobicContact CB-CE2 3.71Å
476	L	77.6	Confident	64.1	Low	2 Å²	2	79.2 Å²	79.2	1%	0.01	41%	0.411	C	S	.	.	H	α-helix	trans	-60.5	-42.4	174.4	-72	175.1	0	0	0	112.4	L472 N473 E474 L479 L550 F644 W647	L472-L476 HydrophobicContact CD2-CD1 3.6Å; L472-L476 HydrophobicContact CD2-CG 4.12Å; L472-L476 WeakPolarHBondContact O-CB 3.14Å; L472-L476 VanDerWaalsContact O-CG 3.3Å; L472-L476 WeakPolarHBondContact O-CG 3.05Å; L472-L476 PolarHBondContact O-N 3.05Å; N473-L476 PolarHBondContact O-N 2.77Å; E474-L476 PolarHBondContact O-N 3.01Å; L476-L479 WeakPolarHBondContact O-CB 3.43Å; L476-L479 PolarHBondContact O-N 2.97Å; L476-L479 VanDerWaalsContact O-N 3.13Å; L476-L550 HydrophobicContact CD2-CD1 3.74Å; L476-L550 HydrophobicContact CD2-CD2 4.32Å; L476-F644 HydrophobicContact CD2-CD2 4.02Å; L476-W647 HydrophobicContact CB-CD2 4.39Å; L476-W647 HydrophobicContact CB-CG 4.17Å; L476-W647 HydrophobicContact CD1-CB 4Å; L476-W647 HydrophobicContact CD1-CG 4.12Å; L476-W647 HydrophobicContact CD2-CB 4.36Å; L476-W647 HydrophobicContact CD2-CD2 3.97Å; L476-W647 HydrophobicContact CD2-CE3 4.18Å; L476-W647 HydrophobicContact CD2-CG 4.06Å; L476-W647 HydrophobicContact CG-CG 4.35Å; L476-W647 VanDerWaalsContact O-CZ2 3.26Å; L476-W647 WeakPolarHBondContact O-CZ2 3.46Å; L476-W647 PolarHBondContact O-NE1 2.9Å
477	Q	74.5	Confident	64.9	Low	158 Å²	158	82.2 Å²	82.2	74%	0.738	40%	0.402	S	S	*	.	H	α-helix	trans	-68.8	-32.5	177	-71.8	172.5	35.4	0	0	112.8	N473 E474 L479	N473-Q477 VanDerWaalsContact O-CG 3.29Å; N473-Q477 WeakPolarHBondContact O-CG 3.35Å; N473-Q477 PolarHBondContact O-N 2.91Å; E474-Q477 PolarHBondContact O-N 3.06Å; Q477-L479 PolarHBondContact O-N 3.39Å
478	S	73.2	Confident	65.8	Low	80 Å²	80	82.8 Å²	82.8	56%	0.559	40%	0.396	S	S	*	.	H	α-helix	trans	-70.2	-15.6	171.9	84.5	0	0	0	0	113.4	E474 A475 K480	E474-S478 PolarHBondContact O-N 3.18Å; A475-S478 PolarHBondContact O-N 3.04Å; A475-S478 PolarHBondContact O-OG 3.32Å; S478-K480 PolarHBondContact O-N 2.93Å
479	L	69.9	Low	66.6	Low	7 Å²	7	78.4 Å²	78.4	4%	0.037	38%	0.38	C	S	.	.			trans	-80.1	83.3	-167.4	-143.3	80.3	0	0	0	111.4	A475 L476 Q477 S481 P546 K549 L550 W647	A475-L479 WeakPolarHBondContact O-CB 3.37Å; A475-L479 PolarHBondContact O-N 3.5Å; A475-L479 VanDerWaalsContact O-N 3.16Å; L476-L479 WeakPolarHBondContact O-CB 3.43Å; L476-L479 PolarHBondContact O-N 2.97Å; L476-L479 VanDerWaalsContact O-N 3.13Å; Q477-L479 PolarHBondContact O-N 3.39Å; L479-S481 PolarHBondContact O-N 3.07Å; L479-P546 HydrophobicContact CD2-CB 3.77Å; L479-K549 HydrophobicContact CD1-CB 4.5Å; L479-K549 HydrophobicContact CD1-CD 3.66Å; L479-K549 HydrophobicContact CD1-CG 3.93Å; L479-K549 HydrophobicContact CG-CD 4.01Å; L479-L550 HydrophobicContact CD1-CD2 3.89Å; L479-L550 HydrophobicContact CD1-CG 4.11Å; L479-L550 HydrophobicContact CD2-CD1 4.03Å; L479-L550 HydrophobicContact CD2-CD2 4.18Å; L479-L550 HydrophobicContact CD2-CG 3.83Å; L479-W647 HydrophobicContact CB-CH2 4.14Å; L479-W647 HydrophobicContact CB-CZ2 4.15Å; L479-W647 HydrophobicContact CD2-CH2 4.12Å; L479-W647 HydrophobicContact CD2-CZ3 4.31Å
480	K	62.3	Low	67	Low	186 Å²	186	79.1 Å²	79.1	81%	0.809	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-47	120	165.8	-67.9	-170.1	179.1	-174.3	0	110	S478 K549	S478-K480 PolarHBondContact O-N 2.93Å; K480-K549 PolarHBondContact O-NZ 3.29Å
481	S	60.5	Low	67.4	Low	35 Å²	35	74.4 Å²	74.4	25%	0.245	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-55.2	140.4	176.8	-60	0	0	0	0	111.3	L479 Y483	L479-S481 PolarHBondContact O-N 3.07Å; S481-Y483 VanDerWaalsContact O-CD2 3.23Å; S481-Y483 WeakPolarHBondContact O-CD2 3.16Å; S481-Y483 WeakPolarHBondContact O-CE2 3.39Å
482	S	64.2	Low	67	Low	40 Å²	40	73.5 Å²	73.5	28%	0.28	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-74.3	142.8	168.4	-169.2	0	0	0	0	109.5	E545 R653	S482-E545 VanDerWaalsContact CB-OE2 3.26Å; S482-E545 WeakPolarHBondContact CB-OE2 3.14Å; S482-E545 PolarHBondContact OG-OE2 2.87Å; S482-R653 PolarHBondContact O-NH1 3.36Å
483	Y	58.7	Low	66.4	Low	165 Å²	165	76.6 Å²	76.6	65%	0.647	37%	0.371	S	S	*	.			trans	-131	113.6	177	-68.4	-89.9	0	0	0	109.8	S481	S481-Y483 VanDerWaalsContact O-CD2 3.23Å; S481-Y483 WeakPolarHBondContact O-CD2 3.16Å; S481-Y483 WeakPolarHBondContact O-CE2 3.39Å
484	F	60.4	Low	65.9	Low	97 Å²	97	80.3 Å²	80.3	43%	0.425	39%	0.391	S	S	.	.			trans	-90	122.4	156.1	-174.8	-95.9	0	0	0	107.9	D486 F532 M537 N541	F484-D486 HydrophobicContact CE1-CB 3.7Å; F484-D486 HydrophobicContact CZ-CB 4.05Å; F484-F532 HydrophobicContact CD1-CE1 4.49Å; F484-F532 HydrophobicContact CD1-CZ 4.34Å; F484-F532 AromaticContact CE1-CE1 3.92Å; F484-F532 HydrophobicContact CE1-CE1 3.92Å; F484-F532 AromaticContact CE1-CZ 3.72Å; F484-F532 HydrophobicContact CE1-CZ 3.72Å; F484-F532 HydrophobicContact CZ-CZ 4.36Å; F484-M537 HydrophobicContact CB-SD 3.9Å; F484-M537 HydrophobicContact CD1-CG 4.05Å; F484-M537 HydrophobicContact CD1-SD 3.51Å; F484-M537 VanDerWaalsContact CD1-SD 3.51Å; F484-M537 HydrophobicContact CE1-SD 4.14Å; F484-M537 HydrophobicContact CG-SD 3.73Å; F484-N541 VanDerWaalsContact CB-ND2 3.29Å; F484-N541 WeakPolarHBondContact CB-ND2 3.4Å; F484-N541 PolarHBondContact N-ND2 2.76Å
485	H	56.9	Low	65.5	Low	111 Å²	111	74.6 Å²	74.6	51%	0.514	37%	0.367	S	S	.	.			trans	-132.6	96.3	175.8	178.4	64.6	0	0	0	107.9	Q487 E490	H485-Q487 PolarHBondContact O-N 2.94Å; H485-E490 IonicContact CE1-OE2 3.5Å; H485-E490 PolarHBondContact CE1-OE2 2.92Å; H485-E490 VanDerWaalsContact CE1-OE2 3.28Å; H485-E490 IonicContact CG-OE2 2.86Å; H485-E490 IonicContact ND1-OE2 2.66Å; H485-E490 PolarHBondContact ND1-OE2 2.84Å
486	D	61.6	Low	65.2	Low	32 Å²	32	78 Å²	78	17%	0.171	38%	0.38	C	S	.	.			trans	-83.5	90.6	167.5	-169.8	-24.2	0	0	0	107.6	F484 Y488 L489 E490 H576	F484-D486 HydrophobicContact CE1-CB 3.7Å; F484-D486 HydrophobicContact CZ-CB 4.05Å; D486-Y488 PolarHBondContact O-N 2.96Å; D486-Y488 WeakPolarHBondContact OD1-CB 3.42Å; D486-Y488 PolarHBondContact OD1-N 2.79Å; D486-L489 HydrophobicContact CB-CB 4.26Å; D486-L489 HydrophobicContact CB-CD1 4.34Å; D486-L489 HydrophobicContact CB-CG 4.4Å; D486-L489 PolarHBondContact O-N 3.28Å; D486-E490 PolarHBondContact O-N 2.87Å; D486-H576 IonicContact OD2-CD2 2.58Å; D486-H576 IonicContact OD2-CE1 3.63Å; D486-H576 IonicContact OD2-NE2 2.99Å; D486-H576 PolarHBondContact OD2-NE2 3.3Å
487	Q	60.4	Low	64.9	Low	149 Å²	149	78.5 Å²	78.5	70%	0.696	38%	0.382	S	S	*	.	H	α-helix	trans	-55.9	-23.9	-176	-166.4	174.8	24.5	0	0	112.9	H485	H485-Q487 PolarHBondContact O-N 2.94Å
488	Y	64.1	Low	64.3	Low	93 Å²	93	73.1 Å²	73.1	37%	0.365	36%	0.362	S	S	.	.	H	α-helix	trans	-82.1	-24.1	177.4	177	-101.2	0	0	0	113.5	D486 S491 F492 I583	D486-Y488 PolarHBondContact O-N 2.96Å; D486-Y488 WeakPolarHBondContact OD1-CB 3.42Å; D486-Y488 PolarHBondContact OD1-N 2.79Å; Y488-S491 PolarHBondContact O-OG 3.03Å; Y488-S491 VanDerWaalsContact O-OG 3.12Å; Y488-F492 HydrophobicContact CE2-CE2 4.24Å; Y488-F492 WeakPolarHBondContact O-CD2 3.46Å; Y488-F492 VanDerWaalsContact O-CE2 3.24Å; Y488-F492 WeakPolarHBondContact O-CE2 3.46Å; Y488-I583 HydrophobicContact CE1-CG2 3.62Å
489	L	70.3	Confident	63.7	Low	3 Å²	3	75 Å²	75	2%	0.016	36%	0.362	C	S	.	.	H	α-helix	trans	-89.9	-38.7	173	-71.2	-179.2	0	0	0	112.1	D486 S491 F492 L529 F532 C579 R580 I583	D486-L489 HydrophobicContact CB-CB 4.26Å; D486-L489 HydrophobicContact CB-CD1 4.34Å; D486-L489 HydrophobicContact CB-CG 4.4Å; D486-L489 PolarHBondContact O-N 3.28Å; L489-S491 PolarHBondContact O-N 2.98Å; L489-F492 PolarHBondContact O-N 3.03Å; L489-F492 VanDerWaalsContact O-N 3.15Å; L489-L529 HydrophobicContact CB-CD1 3.96Å; L489-F532 HydrophobicContact CD1-CD1 4.43Å; L489-F532 HydrophobicContact CD1-CE1 4.18Å; L489-C579 HydrophobicContact CD1-CB 4.07Å; L489-C579 HydrophobicContact CD2-CB 4.04Å; L489-R580 HydrophobicContact CD1-CG 4.03Å; L489-R580 HydrophobicContact CD2-CG 4.05Å; L489-R580 HydrophobicContact CG-CG 4.18Å; L489-I583 HydrophobicContact CD2-CG2 4.07Å
490	E	62.7	Low	63.2	Low	62 Å²	62	75.5 Å²	75.5	29%	0.29	36%	0.364	S	S	.	.	H	α-helix	trans	-69	-24.3	-176.1	-164.1	148.4	-151.1	0	0	112.4	H485 D486 F492 R493	H485-E490 IonicContact CE1-OE2 3.5Å; H485-E490 PolarHBondContact CE1-OE2 2.92Å; H485-E490 VanDerWaalsContact CE1-OE2 3.28Å; H485-E490 IonicContact CG-OE2 2.86Å; H485-E490 IonicContact ND1-OE2 2.66Å; H485-E490 PolarHBondContact ND1-OE2 2.84Å; D486-E490 PolarHBondContact O-N 2.87Å; E490-F492 PolarHBondContact O-N 3Å; E490-R493 WeakPolarHBondContact O-CB 3.49Å; E490-R493 PolarHBondContact O-N 2.85Å; E490-R493 IonicContact OE1-CZ 2.65Å; E490-R493 IonicContact OE1-NH1 2.78Å; E490-R493 PolarHBondContact OE1-NH1 2.94Å; E490-R493 IonicContact OE1-NH2 3.79Å
491	S	64.3	Low	62.9	Low	71 Å²	71	68 Å²	68	50%	0.497	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-23.3	171.5	56.1	0	0	0	0	114.7	Y488 L489	Y488-S491 PolarHBondContact O-OG 3.03Å; Y488-S491 VanDerWaalsContact O-OG 3.12Å; L489-S491 PolarHBondContact O-N 2.98Å
492	F	63.7	Low	62.5	Low	33 Å²	33	74.7 Å²	74.7	15%	0.145	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-1.8	179.9	-63	-75.9	0	0	0	113.9	Y488 L489 E490 D494 S495 L500 F525 I583	Y488-F492 HydrophobicContact CE2-CE2 4.24Å; Y488-F492 WeakPolarHBondContact O-CD2 3.46Å; Y488-F492 VanDerWaalsContact O-CE2 3.24Å; Y488-F492 WeakPolarHBondContact O-CE2 3.46Å; L489-F492 PolarHBondContact O-N 3.03Å; L489-F492 VanDerWaalsContact O-N 3.15Å; E490-F492 PolarHBondContact O-N 3Å; F492-D494 VanDerWaalsContact C-N 3.32Å; F492-D494 PolarHBondContact O-N 2.77Å; F492-S495 PolarHBondContact O-N 2.82Å; F492-L500 HydrophobicContact CE1-CD2 3.99Å; F492-F525 HydrophobicContact CB-CE1 4.05Å; F492-F525 HydrophobicContact CB-CZ 4.22Å; F492-I583 HydrophobicContact CD1-CD1 4Å; F492-I583 HydrophobicContact CD1-CG1 4.4Å; F492-I583 HydrophobicContact CD2-CD1 4.2Å; F492-I583 HydrophobicContact CD2-CG1 3.74Å; F492-I583 HydrophobicContact CE1-CD1 4.07Å; F492-I583 HydrophobicContact CE1-CG1 4.31Å; F492-I583 HydrophobicContact CE2-CD1 4.26Å; F492-I583 HydrophobicContact CE2-CG1 3.64Å; F492-I583 HydrophobicContact CG-CD1 4.06Å; F492-I583 HydrophobicContact CG-CG1 4.13Å; F492-I583 HydrophobicContact CZ-CD1 4.19Å; F492-I583 HydrophobicContact CZ-CG1 3.93Å
493	R	61.9	Low	61.6	Low	69 Å²	69	74.7 Å²	74.7	26%	0.26	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-46	-176.1	-167.8	-162.4	-142.1	147	10.9	112.2	E490 K526 D534	E490-R493 WeakPolarHBondContact O-CB 3.49Å; E490-R493 PolarHBondContact O-N 2.85Å; E490-R493 IonicContact OE1-CZ 2.65Å; E490-R493 IonicContact OE1-NH1 2.78Å; E490-R493 PolarHBondContact OE1-NH1 2.94Å; E490-R493 IonicContact OE1-NH2 3.79Å; R493-K526 PolarHBondContact O-NZ 2.87Å; R493-D534 IonicContact CZ-OD1 2.9Å; R493-D534 IonicContact NE-OD1 2.72Å; R493-D534 IonicContact NH2-OD1 3.8Å; R493-D534 PolarHBondContact NH2-OD1 2.87Å
494	D	63.9	Low	61	Low	141 Å²	141	70.8 Å²	70.8	75%	0.754	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	1.9	-177.5	-60.5	-47	0	0	0	112.9	F492	F492-D494 VanDerWaalsContact C-N 3.32Å; F492-D494 PolarHBondContact O-N 2.77Å
495	S	67.3	Low	60.1	Low	21 Å²	21	72.8 Å²	72.8	15%	0.147	38%	0.383	C	S	.	.			trans	-71.5	156.4	176.5	-72.3	0	0	0	0	113.8	F492 Q499 W522	F492-S495 PolarHBondContact O-N 2.82Å; S495-Q499 PolarHBondContact OG-OE1 2.58Å; S495-W522 PolarHBondContact O-NE1 3.15Å; S495-W522 VanDerWaalsContact O-NE1 3.13Å
496	H	71	Confident	59.8	Low	83 Å²	83	68.1 Å²	68.1	38%	0.384	36%	0.363	S	S	.	.			trans	-112.5	154.4	169	-166.4	-112.7	0	0	0	109.6	S498 Q499	H496-S498 PolarHBondContact ND1-OG 3.01Å; H496-S498 PolarHBondContact O-N 3.36Å; H496-Q499 WeakPolarHBondContact O-CB 3.22Å; H496-Q499 PolarHBondContact O-N 3.2Å
497	W	70.6	Confident	59.1	Low	13 Å²	13	73.4 Å²	73.4	5%	0.049	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-59.6	-34	-178.1	63.5	-99.1	0	0	0	112.4	Q499 L500 D501 V515 C518 W522 F595	W497-Q499 PolarHBondContact O-N 2.81Å; W497-Q499 VanDerWaalsContact O-N 3.08Å; W497-L500 WeakPolarHBondContact O-CB 3.49Å; W497-L500 PolarHBondContact O-N 2.92Å; W497-D501 PolarHBondContact O-N 2.82Å; W497-V515 HydrophobicContact CH2-CG1 4.33Å; W497-V515 HydrophobicContact CZ2-CG1 3.87Å; W497-C518 HydrophobicContact CD2-CB 4.19Å; W497-C518 HydrophobicContact CE3-CB 4.28Å; W497-W522 HydrophobicContact CB-CB 4.01Å; W497-W522 HydrophobicContact CB-CD2 3.87Å; W497-W522 HydrophobicContact CB-CE3 4.12Å; W497-W522 HydrophobicContact CB-CG 3.82Å; W497-W522 HydrophobicContact CG-CB 4.45Å; W497-F595 HydrophobicContact CB-CE1 3.87Å; W497-F595 HydrophobicContact CB-CZ 3.99Å; W497-F595 HydrophobicContact CE3-CD1 4.3Å; W497-F595 HydrophobicContact CE3-CE1 4.09Å
498	S	62.1	Low	58.5	Low	45 Å²	45	74.2 Å²	74.2	32%	0.315	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-69.7	1	175.8	60.5	0	0	0	0	114.9	H496	H496-S498 PolarHBondContact ND1-OG 3.01Å; H496-S498 PolarHBondContact O-N 3.36Å
499	Q	60.5	Low	58.1	Low	120 Å²	120	74.2 Å²	74.2	56%	0.561	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-92	-17.9	167.6	-61.8	175.9	-7.3	0	0	112.9	S495 H496 W497	S495-Q499 PolarHBondContact OG-OE1 2.58Å; H496-Q499 WeakPolarHBondContact O-CB 3.22Å; H496-Q499 PolarHBondContact O-N 3.2Å; W497-Q499 PolarHBondContact O-N 2.81Å; W497-Q499 VanDerWaalsContact O-N 3.08Å
500	L	60.4	Low	57.6	Low	16 Å²	16	76.8 Å²	76.8	8%	0.084	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-31.8	171.8	-77.3	162	0	0	0	111.3	F492 W497 K502 W522 I583 F595	F492-L500 HydrophobicContact CE1-CD2 3.99Å; W497-L500 WeakPolarHBondContact O-CB 3.49Å; W497-L500 PolarHBondContact O-N 2.92Å; L500-K502 PolarHBondContact O-N 3.05Å; L500-K502 VanDerWaalsContact O-N 3.11Å; L500-W522 HydrophobicContact CD1-CE3 4.35Å; L500-W522 HydrophobicContact CD1-CH2 3.66Å; L500-W522 HydrophobicContact CD1-CZ3 3.38Å; L500-I583 HydrophobicContact CD1-CD1 4.07Å; L500-F595 HydrophobicContact CB-CD2 4.35Å; L500-F595 HydrophobicContact CB-CE2 3.64Å; L500-F595 HydrophobicContact CB-CZ 4.24Å; L500-F595 HydrophobicContact CD1-CE2 4.07Å; L500-F595 HydrophobicContact CD1-CZ 4.28Å; L500-F595 HydrophobicContact CG-CE2 4.49Å
501	D	56.4	Low	58.3	Low	29 Å²	29	77.9 Å²	77.9	16%	0.155	43%	0.433	C	S	.	.			trans	-70.5	101.9	169.1	-167.8	-14.6	0	0	0	110.2	W497 S503 S506	W497-D501 PolarHBondContact O-N 2.82Å; D501-S503 WeakPolarHBondContact OD1-CA 3.4Å; D501-S503 WeakPolarHBondContact OD1-CB 3.46Å; D501-S503 PolarHBondContact OD1-N 3.11Å; D501-S503 PolarHBondContact OD1-OG 3.44Å; D501-S506 WeakPolarHBondContact OD2-CB 3.33Å; D501-S506 PolarHBondContact OD2-OG 3.47Å
502	K	52.2	Low	59.1	Low	176 Å²	176	79.9 Å²	79.9	77%	0.765	44%	0.438	S	S	*	.			trans	-83.3	-0.7	178	-68.1	173.5	-175.8	167.8	0	112.7	L500 G504	L500-K502 PolarHBondContact O-N 3.05Å; L500-K502 VanDerWaalsContact O-N 3.11Å; K502-G504 PolarHBondContact O-N 2.09Å
503	S	44.4	Very low	60	Low	40 Å²	40	83.4 Å²	83.4	28%	0.28	45%	0.45	S	S	.	.			trans	-83.5	101	172	76.3	0	0	0	0	109.4	D501 N505 S506	D501-S503 WeakPolarHBondContact OD1-CA 3.4Å; D501-S503 WeakPolarHBondContact OD1-CB 3.46Å; D501-S503 PolarHBondContact OD1-N 3.11Å; D501-S503 PolarHBondContact OD1-OG 3.44Å; S503-N505 PolarHBondContact O-N 3.44Å; S503-S506 PolarHBondContact O-N 3.28Å; S503-S506 WeakPolarHBondContact OG-CB 3.37Å
504	G	45.2	Very low	60.8	Low	82 Å²	82	81.2 Å²	81.2	85%	0.845	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	29.1	180	0	0	0	0	0	115.6	K502	K502-G504 PolarHBondContact O-N 2.09Å
505	N	43.3	Very low	61.7	Low	140 Å²	140	76.2 Å²	76.2	75%	0.749	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.9	-8	-174.2	-77.9	-32.9	0	0	0	113.7	S503	S503-N505 PolarHBondContact O-N 3.44Å
506	S	49.1	Very low	62.5	Low	13 Å²	13	79.8 Å²	79.8	9%	0.091	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-77.5	-23.8	-163	60.8	0	0	0	0	116.8	D501 S503 N508 S509 M510	D501-S506 WeakPolarHBondContact OD2-CB 3.33Å; D501-S506 PolarHBondContact OD2-OG 3.47Å; S503-S506 PolarHBondContact O-N 3.28Å; S503-S506 WeakPolarHBondContact OG-CB 3.37Å; S506-N508 PolarHBondContact O-N 2.91Å; S506-S509 WeakPolarHBondContact CA-OG 3.43Å; S506-S509 PolarHBondContact O-N 3.17Å; S506-S509 PolarHBondContact O-OG 3Å; S506-M510 PolarHBondContact O-N 2.9Å
507	E	48.3	Very low	63.1	Low	142 Å²	142	76.2 Å²	76.2	66%	0.664	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-59.7	-20	178	-68.9	-169.7	160.6	0	0	112.8
508	N	47.2	Very low	63.7	Low	166 Å²	166	75.8 Å²	75.8	89%	0.888	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-97.7	-4.5	174.9	-74.5	-29.8	0	0	0	114.6	S506	S506-N508 PolarHBondContact O-N 2.91Å
509	S	54.6	Low	64.9	Low	93 Å²	93	78 Å²	78	65%	0.65	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	-27.4	179.9	64.4	0	0	0	0	114	S506	S506-S509 WeakPolarHBondContact CA-OG 3.43Å; S506-S509 PolarHBondContact O-N 3.17Å; S506-S509 PolarHBondContact O-OG 3Å
510	M	61.2	Low	66.1	Low	57 Å²	57	72.7 Å²	72.7	28%	0.281	39%	0.391	S	S	.	.	S	Bend	trans	-74.7	139.4	177	-75	-60	-143.2	0	0	111.8	S506 E514 V515	S506-M510 PolarHBondContact O-N 2.9Å; M510-E514 HydrophobicContact CE-CG 3.84Å; M510-E514 HydrophobicContact SD-CB 4.34Å; M510-E514 HydrophobicContact SD-CG 3.56Å; M510-E514 VanDerWaalsContact SD-CG 3.56Å; M510-V515 HydrophobicContact CB-CG2 3.94Å
511	T	76.8	Confident	67.4	Low	86 Å²	86	72 Å²	72	53%	0.528	39%	0.388	S	S	.	.			trans	-72.5	153.8	178	73.6	0	0	0	0	112	R513 E514 V515	T511-R513 PolarHBondContact O-N 3.08Å; T511-E514 WeakPolarHBondContact O-CA 3.24Å; T511-E514 WeakPolarHBondContact O-CB 3.49Å; T511-E514 PolarHBondContact O-N 3.13Å; T511-E514 WeakPolarHBondContact OG1-CB 3.34Å; T511-E514 PolarHBondContact OG1-N 3.01Å; T511-V515 PolarHBondContact O-N 2.93Å
512	D	81.2	Confident	68.8	Low	112 Å²	112	71.2 Å²	71.2	60%	0.599	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-20.6	172.8	-150.8	56.2	0	0	0	114.2	R516	D512-R516 VanDerWaalsContact CG-NH2 3.33Å; D512-R516 WeakPolarHBondContact O-CD 3.47Å; D512-R516 WeakPolarHBondContact O-CG 3.33Å; D512-R516 VanDerWaalsContact O-CZ 3.27Å; D512-R516 PolarHBondContact O-NH1 3.47Å; D512-R516 IonicContact OD1-NH2 3.05Å; D512-R516 PolarHBondContact OD1-NH2 2.87Å; D512-R516 IonicContact OD2-CZ 3.56Å; D512-R516 IonicContact OD2-NH1 2.81Å; D512-R516 PolarHBondContact OD2-NH1 2.81Å; D512-R516 IonicContact OD2-NH2 2.71Å; D512-R516 PolarHBondContact OD2-NH2 3.14Å
513	R	82	Confident	70.6	Confident	107 Å²	107	67.2 Å²	67.2	40%	0.404	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-38.9	173.2	176.5	-179.8	-173.3	164.6	5	111.6	T511 R517 Y683 T684	T511-R513 PolarHBondContact O-N 3.08Å; R513-R517 PolarHBondContact O-N 3.26Å; R513-R517 VanDerWaalsContact O-N 3.14Å; R513-Y683 WeakPolarHBondContact CD-O 3.22Å; R513-Y683 WeakPolarHBondContact CG-O 3.19Å; R513-Y683 PolarHBondContact NE-O 3.42Å; R513-T684 PolarHBondContact NH2-O 3.36Å
514	E	79.6	Confident	72.8	Confident	24 Å²	24	65.3 Å²	65.3	11%	0.112	35%	0.353	C	S	.	.	H	α-helix	trans	-76	-44	-174.3	-169.8	45.2	-120.4	0	0	112	M510 T511 R516 R517 C518	M510-E514 HydrophobicContact CE-CG 3.84Å; M510-E514 HydrophobicContact SD-CB 4.34Å; M510-E514 HydrophobicContact SD-CG 3.56Å; M510-E514 VanDerWaalsContact SD-CG 3.56Å; T511-E514 WeakPolarHBondContact O-CA 3.24Å; T511-E514 WeakPolarHBondContact O-CB 3.49Å; T511-E514 PolarHBondContact O-N 3.13Å; T511-E514 WeakPolarHBondContact OG1-CB 3.34Å; T511-E514 PolarHBondContact OG1-N 3.01Å; E514-R516 PolarHBondContact O-N 3.05Å; E514-R517 VanDerWaalsContact CD-NH2 3.33Å; E514-R517 WeakPolarHBondContact O-CA 3.42Å; E514-R517 VanDerWaalsContact O-CB 3.24Å; E514-R517 WeakPolarHBondContact O-CB 3.33Å; E514-R517 PolarHBondContact O-N 3.5Å; E514-R517 IonicContact OE1-CZ 3.87Å; E514-R517 IonicContact OE1-NE 3.94Å; E514-R517 PolarHBondContact OE1-NE 2.86Å; E514-R517 IonicContact OE1-NH2 3.67Å; E514-R517 PolarHBondContact OE1-NH2 3.12Å; E514-R517 IonicContact OE2-CZ 3.63Å; E514-R517 IonicContact OE2-NE 2.68Å; E514-R517 PolarHBondContact OE2-NE 3.47Å; E514-R517 IonicContact OE2-NH2 2.71Å; E514-R517 PolarHBondContact OE2-NH2 2.88Å; E514-C518 PolarHBondContact O-N 3.38Å
515	V	82.4	Confident	74.8	Confident	36 Å²	36	61.4 Å²	61.4	22%	0.218	31%	0.313	C	S	.	.	H	α-helix	trans	-51.9	-46.3	170.5	176.8	0	0	0	0	110.7	W497 M510 T511 R517 C518 E519	W497-V515 HydrophobicContact CH2-CG1 4.33Å; W497-V515 HydrophobicContact CZ2-CG1 3.87Å; M510-V515 HydrophobicContact CB-CG2 3.94Å; T511-V515 PolarHBondContact O-N 2.93Å; V515-R517 VanDerWaalsContact C-N 3.27Å; V515-R517 PolarHBondContact O-N 3.25Å; V515-C518 PolarHBondContact O-N 3.12Å; V515-E519 WeakPolarHBondContact O-CG 3.4Å; V515-E519 PolarHBondContact O-N 2.92Å
516	R	84.8	Confident	77	Confident	96 Å²	96	58.5 Å²	58.5	36%	0.362	29%	0.294	S	S	.	.	H	α-helix	trans	-68.9	-21.3	177.1	-64.5	-179.9	-171.7	117	5.7	114.2	D512 E514 E519 A520 Y683	D512-R516 VanDerWaalsContact CG-NH2 3.33Å; D512-R516 WeakPolarHBondContact O-CD 3.47Å; D512-R516 WeakPolarHBondContact O-CG 3.33Å; D512-R516 VanDerWaalsContact O-CZ 3.27Å; D512-R516 PolarHBondContact O-NH1 3.47Å; D512-R516 IonicContact OD1-NH2 3.05Å; D512-R516 PolarHBondContact OD1-NH2 2.87Å; D512-R516 IonicContact OD2-CZ 3.56Å; D512-R516 IonicContact OD2-NH1 2.81Å; D512-R516 PolarHBondContact OD2-NH1 2.81Å; D512-R516 IonicContact OD2-NH2 2.71Å; D512-R516 PolarHBondContact OD2-NH2 3.14Å; E514-R516 PolarHBondContact O-N 3.05Å; R516-E519 WeakPolarHBondContact CA-OE2 3.47Å; R516-A520 WeakPolarHBondContact O-CB 3.34Å; R516-A520 PolarHBondContact O-N 3.45Å; R516-Y683 HydrophobicContact CB-CD1 3.66Å; R516-Y683 HydrophobicContact CB-CD2 4.04Å; R516-Y683 HydrophobicContact CB-CE1 3.68Å; R516-Y683 HydrophobicContact CB-CE2 4.08Å; R516-Y683 HydrophobicContact CB-CG 3.86Å; R516-Y683 HydrophobicContact CG-CE1 4.34Å; R516-Y683 WeakPolarHBondContact O-CD2 3.26Å
517	R	83.5	Confident	79	Confident	8 Å²	8	58.8 Å²	58.8	3%	0.03	30%	0.296	C	S	.	.	H	α-helix	trans	-73.2	-52.6	170.9	-165.9	173.3	69.8	95	13.1	109.3	R513 E514 V515 E519 A520 V521 G596 S597 T598	R513-R517 PolarHBondContact O-N 3.26Å; R513-R517 VanDerWaalsContact O-N 3.14Å; E514-R517 VanDerWaalsContact CD-NH2 3.33Å; E514-R517 WeakPolarHBondContact O-CA 3.42Å; E514-R517 VanDerWaalsContact O-CB 3.24Å; E514-R517 WeakPolarHBondContact O-CB 3.33Å; E514-R517 PolarHBondContact O-N 3.5Å; E514-R517 IonicContact OE1-CZ 3.87Å; E514-R517 IonicContact OE1-NE 3.94Å; E514-R517 PolarHBondContact OE1-NE 2.86Å; E514-R517 IonicContact OE1-NH2 3.67Å; E514-R517 PolarHBondContact OE1-NH2 3.12Å; E514-R517 IonicContact OE2-CZ 3.63Å; E514-R517 IonicContact OE2-NE 2.68Å; E514-R517 PolarHBondContact OE2-NE 3.47Å; E514-R517 IonicContact OE2-NH2 2.71Å; E514-R517 PolarHBondContact OE2-NH2 2.88Å; V515-R517 VanDerWaalsContact C-N 3.27Å; V515-R517 PolarHBondContact O-N 3.25Å; R517-E519 VanDerWaalsContact C-N 3.32Å; R517-E519 PolarHBondContact O-N 2.96Å; R517-A520 CarbonylContact O-C 3.6Å; R517-A520 PolarHBondContact O-N 2.85Å; R517-V521 WeakPolarHBondContact O-CG2 3.49Å; R517-V521 PolarHBondContact O-N 2.74Å; R517-G596 PolarHBondContact NH1-O 2.91Å; R517-G596 PolarHBondContact NH2-O 3Å; R517-G596 VanDerWaalsContact NH2-O 3.11Å; R517-S597 VanDerWaalsContact NH1-CA 3.32Å; R517-T598 VanDerWaalsContact NH1-N 3.12Å; R517-T598 PolarHBondContact NH1-OG1 3.29Å
518	C	83.4	Confident	81	Confident	3 Å²	3	52 Å²	52	2%	0.02	26%	0.264	C	S	.	.	H	α-helix	trans	-55.2	-43.8	174.8	-66.4	0	0	0	0	112.4	W497 E514 V515 A520 V521 W522 F595	W497-C518 HydrophobicContact CD2-CB 4.19Å; W497-C518 HydrophobicContact CE3-CB 4.28Å; E514-C518 PolarHBondContact O-N 3.38Å; V515-C518 PolarHBondContact O-N 3.12Å; C518-A520 PolarHBondContact O-N 3.01Å; C518-V521 PolarHBondContact O-N 2.87Å; C518-W522 WeakPolarHBondContact O-CB 3.17Å; C518-W522 PolarHBondContact O-N 3.21Å; C518-F595 HydrophobicContact CB-CD1 4.29Å; C518-F595 HydrophobicContact CB-CE1 4.14Å; C518-F595 PolarHBondContact SG-O 3.31Å; C518-F595 VanDerWaalsContact SG-O 3.36Å
519	E	86.2	Confident	83	Confident	93 Å²	93	44.3 Å²	44.3	44%	0.435	22%	0.223	S	C	.	.	H	α-helix	trans	-57.4	-44.9	171.7	-74	175.8	154.2	0	0	112.4	V515 R516 R517 W522 E523	V515-E519 WeakPolarHBondContact O-CG 3.4Å; V515-E519 PolarHBondContact O-N 2.92Å; R516-E519 WeakPolarHBondContact CA-OE2 3.47Å; R517-E519 VanDerWaalsContact C-N 3.32Å; R517-E519 PolarHBondContact O-N 2.96Å; E519-W522 PolarHBondContact O-N 2.64Å; E519-E523 PolarHBondContact O-N 3.3Å
520	A	86.9	Confident	84.7	Confident	7 Å²	7	42.3 Å²	42.3	6%	0.058	21%	0.207	C	C	.	.	H	α-helix	trans	-71.5	-33.4	179.6	0	0	0	0	0	112.9	R516 R517 C518 L524 I680 Y683	R516-A520 WeakPolarHBondContact O-CB 3.34Å; R516-A520 PolarHBondContact O-N 3.45Å; R517-A520 CarbonylContact O-C 3.6Å; R517-A520 PolarHBondContact O-N 2.85Å; C518-A520 PolarHBondContact O-N 3.01Å; A520-L524 PolarHBondContact O-N 3.09Å; A520-L524 VanDerWaalsContact O-N 3.12Å; A520-I680 HydrophobicContact CB-CG1 3.73Å; A520-Y683 HydrophobicContact CB-CD2 4.26Å
521	V	86	Confident	86.2	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-63.1	-44.8	169.6	178.8	0	0	0	0	110	R517 C518 L524 F525 L586 L601 I680	R517-V521 WeakPolarHBondContact O-CG2 3.49Å; R517-V521 PolarHBondContact O-N 2.74Å; C518-V521 PolarHBondContact O-N 2.87Å; V521-L524 WeakPolarHBondContact O-CB 3.49Å; V521-L524 PolarHBondContact O-N 2.88Å; V521-F525 PolarHBondContact O-N 2.96Å; V521-L586 HydrophobicContact CG1-CD1 4.42Å; V521-L586 HydrophobicContact CG1-CD2 4.05Å; V521-L601 HydrophobicContact CB-CD1 4.23Å; V521-L601 HydrophobicContact CG1-CD1 3.97Å; V521-L601 HydrophobicContact CG1-CD2 4.18Å; V521-L601 HydrophobicContact CG1-CG 4.04Å; V521-L601 HydrophobicContact CG2-CD1 3.48Å; V521-L601 VanDerWaalsContact CG2-CD1 3.48Å; V521-L601 HydrophobicContact CG2-CG 4.38Å; V521-I680 HydrophobicContact CG2-CG2 4.34Å
522	W	86.3	Confident	86.8	Confident	14 Å²	14	36 Å²	36	5%	0.053	17%	0.17	C	C	.	.	H	α-helix	trans	-68.9	-35.3	178.1	-160.3	-114.2	0	0	0	112.5	S495 W497 L500 C518 E519 L524 F525 K526 I583 L586	S495-W522 PolarHBondContact O-NE1 3.15Å; S495-W522 VanDerWaalsContact O-NE1 3.13Å; W497-W522 HydrophobicContact CB-CB 4.01Å; W497-W522 HydrophobicContact CB-CD2 3.87Å; W497-W522 HydrophobicContact CB-CE3 4.12Å; W497-W522 HydrophobicContact CB-CG 3.82Å; W497-W522 HydrophobicContact CG-CB 4.45Å; L500-W522 HydrophobicContact CD1-CE3 4.35Å; L500-W522 HydrophobicContact CD1-CH2 3.66Å; L500-W522 HydrophobicContact CD1-CZ3 3.38Å; C518-W522 WeakPolarHBondContact O-CB 3.17Å; C518-W522 PolarHBondContact O-N 3.21Å; E519-W522 PolarHBondContact O-N 2.64Å; W522-L524 VanDerWaalsContact C-N 3.34Å; W522-F525 HydrophobicContact CD2-CD1 4.35Å; W522-F525 AromaticContact CE3-CD1 3.9Å; W522-F525 HydrophobicContact CE3-CD1 3.9Å; W522-F525 AromaticContact CH2-CD1 3.72Å; W522-F525 HydrophobicContact CH2-CD1 3.72Å; W522-F525 AromaticContact CH2-CE1 3.7Å; W522-F525 HydrophobicContact CH2-CE1 3.7Å; W522-F525 HydrophobicContact CZ2-CD1 4.18Å; W522-F525 HydrophobicContact CZ2-CE1 4.25Å; W522-F525 AromaticContact CZ3-CD1 3.56Å; W522-F525 HydrophobicContact CZ3-CD1 3.56Å; W522-F525 AromaticContact CZ3-CE1 3.94Å; W522-F525 HydrophobicContact CZ3-CE1 3.94Å; W522-F525 HydrophobicContact CZ3-CG 4.44Å; W522-F525 PolarHBondContact O-N 3.03Å; W522-K526 WeakPolarHBondContact O-CB 3.36Å; W522-K526 PolarHBondContact O-N 2.92Å; W522-I583 HydrophobicContact CH2-CD1 4.39Å; W522-I583 HydrophobicContact CZ3-CD1 4.28Å; W522-L586 HydrophobicContact CZ3-CD1 4.47Å
523	E	90.2	Very high	87.2	Confident	91 Å²	91	31.9 Å²	31.9	43%	0.425	15%	0.149	S	C	.	.	H	α-helix	trans	-64	-39.9	173.5	-156.7	-150.3	145.2	0	0	111.2	E519 S527 K672 L676	E519-E523 PolarHBondContact O-N 3.3Å; E523-S527 WeakPolarHBondContact O-CB 3.49Å; E523-S527 PolarHBondContact O-N 3.01Å; E523-S527 PolarHBondContact O-OG 2.75Å; E523-K672 WeakPolarHBondContact OE1-CE 3.5Å; E523-K672 IonicContact OE1-NZ 3.98Å; E523-K672 PolarHBondContact OE1-NZ 2.81Å; E523-L676 HydrophobicContact CB-CD2 4.16Å; E523-L676 VanDerWaalsContact CD-CD2 3.49Å; E523-L676 HydrophobicContact CG-CD2 4.05Å; E523-L676 WeakPolarHBondContact OE1-CD2 3.4Å
524	L	90.1	Very high	87.4	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-60.2	-57.4	173.3	175.7	59.6	0	0	0	110.4	A520 V521 W522 K526 S527 E528 F578 L601 L605 I673 L676 L677 I680	A520-L524 PolarHBondContact O-N 3.09Å; A520-L524 VanDerWaalsContact O-N 3.12Å; V521-L524 WeakPolarHBondContact O-CB 3.49Å; V521-L524 PolarHBondContact O-N 2.88Å; W522-L524 VanDerWaalsContact C-N 3.34Å; L524-K526 PolarHBondContact O-N 2.72Å; L524-S527 PolarHBondContact O-N 3.07Å; L524-S527 PolarHBondContact O-OG 2.96Å; L524-E528 PolarHBondContact O-N 2.83Å; L524-F578 HydrophobicContact CD1-CE1 4.4Å; L524-F578 HydrophobicContact CD1-CZ 4.47Å; L524-F578 HydrophobicContact CD2-CZ 4.25Å; L524-F578 HydrophobicContact CG-CZ 4.33Å; L524-L601 HydrophobicContact CD2-CD2 4.1Å; L524-L605 HydrophobicContact CD2-CD2 4.41Å; L524-I673 HydrophobicContact CD1-CD1 4.1Å; L524-L676 HydrophobicContact CB-CB 4.49Å; L524-L676 HydrophobicContact CD1-CB 4.13Å; L524-L676 HydrophobicContact CD1-CD1 3.86Å; L524-L677 HydrophobicContact CD2-CD2 4.4Å; L524-I680 HydrophobicContact CB-CD1 4.08Å; L524-I680 HydrophobicContact CD2-CD1 3.62Å
525	F	88.6	Confident	87.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-55.6	-51	178.7	173.2	-111	0	0	0	112.7	F492 V521 W522 S527 E528 L529 L582 I583	F492-F525 HydrophobicContact CB-CE1 4.05Å; F492-F525 HydrophobicContact CB-CZ 4.22Å; V521-F525 PolarHBondContact O-N 2.96Å; W522-F525 HydrophobicContact CD2-CD1 4.35Å; W522-F525 AromaticContact CE3-CD1 3.9Å; W522-F525 HydrophobicContact CE3-CD1 3.9Å; W522-F525 AromaticContact CH2-CD1 3.72Å; W522-F525 HydrophobicContact CH2-CD1 3.72Å; W522-F525 AromaticContact CH2-CE1 3.7Å; W522-F525 HydrophobicContact CH2-CE1 3.7Å; W522-F525 HydrophobicContact CZ2-CD1 4.18Å; W522-F525 HydrophobicContact CZ2-CE1 4.25Å; W522-F525 AromaticContact CZ3-CD1 3.56Å; W522-F525 HydrophobicContact CZ3-CD1 3.56Å; W522-F525 AromaticContact CZ3-CE1 3.94Å; W522-F525 HydrophobicContact CZ3-CE1 3.94Å; W522-F525 HydrophobicContact CZ3-CG 4.44Å; W522-F525 PolarHBondContact O-N 3.03Å; F525-S527 VanDerWaalsContact C-N 3.31Å; F525-S527 PolarHBondContact O-N 2.92Å; F525-E528 PolarHBondContact O-N 3.02Å; F525-L529 HydrophobicContact CE1-CD2 4.06Å; F525-L529 HydrophobicContact CZ-CD2 3.97Å; F525-L529 WeakPolarHBondContact O-CB 3.42Å; F525-L529 PolarHBondContact O-N 3.35Å; F525-L582 HydrophobicContact CB-CD2 3.74Å; F525-L582 HydrophobicContact CB-CG 4.24Å; F525-L582 HydrophobicContact CD2-CB 4.35Å; F525-L582 HydrophobicContact CD2-CD2 4.01Å; F525-L582 HydrophobicContact CD2-CG 4.02Å; F525-L582 HydrophobicContact CG-CD2 4.36Å; F525-I583 HydrophobicContact CE1-CD1 4.09Å; F525-I583 HydrophobicContact CE2-CB 3.79Å; F525-I583 HydrophobicContact CE2-CD1 4.45Å; F525-I583 HydrophobicContact CE2-CG1 4.42Å; F525-I583 HydrophobicContact CZ-CB 3.93Å; F525-I583 HydrophobicContact CZ-CD1 3.93Å; F525-I583 HydrophobicContact CZ-CG1 4.06Å
526	K	87.8	Confident	88.3	Confident	78 Å²	78	26.8 Å²	26.8	34%	0.339	13%	0.128	S	C	.	.	H	α-helix	trans	-65.9	-33.6	-178.2	-172	158.8	-179.5	133.5	0	111.8	R493 W522 L524 T530	R493-K526 PolarHBondContact O-NZ 2.87Å; W522-K526 WeakPolarHBondContact O-CB 3.36Å; W522-K526 PolarHBondContact O-N 2.92Å; L524-K526 PolarHBondContact O-N 2.72Å; K526-T530 VanDerWaalsContact O-CB 3.25Å; K526-T530 WeakPolarHBondContact O-CB 3.25Å; K526-T530 PolarHBondContact O-N 3.05Å; K526-T530 PolarHBondContact O-OG1 2.99Å
527	S	91.3	Very high	88.5	Confident	20 Å²	20	23 Å²	23	14%	0.14	12%	0.115	C	C	.	.	H	α-helix	trans	-73.5	-32.6	175.5	74.3	0	0	0	0	113.5	E523 L524 F525 F531 L676	E523-S527 WeakPolarHBondContact O-CB 3.49Å; E523-S527 PolarHBondContact O-N 3.01Å; E523-S527 PolarHBondContact O-OG 2.75Å; L524-S527 PolarHBondContact O-N 3.07Å; L524-S527 PolarHBondContact O-OG 2.96Å; F525-S527 VanDerWaalsContact C-N 3.31Å; F525-S527 PolarHBondContact O-N 2.92Å; S527-F531 VanDerWaalsContact O-CB 3.28Å; S527-F531 WeakPolarHBondContact O-CB 3.44Å; S527-F531 PolarHBondContact O-N 3.11Å; S527-L676 WeakPolarHBondContact OG-CD1 3.46Å
528	E	90.9	Very high	88.8	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-67.4	-48.7	169.2	-166.8	73.2	-143.3	0	0	110.9	L524 F525 T530 F531 F532 S575 F578 C579 H669	L524-E528 PolarHBondContact O-N 2.83Å; F525-E528 PolarHBondContact O-N 3.02Å; E528-T530 VanDerWaalsContact C-N 3.3Å; E528-T530 PolarHBondContact O-N 3.38Å; E528-F531 CarbonylContact O-C 3.56Å; E528-F531 WeakPolarHBondContact O-CB 3.31Å; E528-F531 PolarHBondContact O-N 2.91Å; E528-F532 WeakPolarHBondContact O-CB 3.31Å; E528-F532 PolarHBondContact O-N 3.22Å; E528-S575 WeakPolarHBondContact OE1-CA 3.43Å; E528-S575 WeakPolarHBondContact OE1-CB 3.44Å; E528-S575 PolarHBondContact OE1-OG 3.27Å; E528-F578 HydrophobicContact CB-CD1 4.43Å; E528-F578 HydrophobicContact CB-CE1 4.4Å; E528-F578 HydrophobicContact CG-CD1 3.67Å; E528-F578 HydrophobicContact CG-CE1 4.11Å; E528-F578 WeakPolarHBondContact OE2-CD1 3.35Å; E528-C579 WeakPolarHBondContact CG-SG 3.36Å; E528-H669 IonicContact OE1-CE1 3.61Å; E528-H669 IonicContact OE1-NE2 2.71Å; E528-H669 IonicContact OE2-CE1 3.76Å; E528-H669 PolarHBondContact OE2-CE1 2.89Å; E528-H669 IonicContact OE2-NE2 3.76Å; E528-H669 PolarHBondContact OE2-NE2 3.42Å
529	L	90.1	Very high	89.1	Confident	4 Å²	4	22.8 Å²	22.8	2%	0.021	11%	0.114	C	C	.	.	H	α-helix	trans	-61.3	-38.7	179.7	-179.1	61.8	0	0	0	111.8	L489 F525 T533	L489-L529 HydrophobicContact CB-CD1 3.96Å; F525-L529 HydrophobicContact CE1-CD2 4.06Å; F525-L529 HydrophobicContact CZ-CD2 3.97Å; F525-L529 WeakPolarHBondContact O-CB 3.42Å; F525-L529 PolarHBondContact O-N 3.35Å; L529-T533 WeakPolarHBondContact O-CB 3.36Å; L529-T533 PolarHBondContact O-N 2.86Å; L529-T533 PolarHBondContact O-OG1 3.14Å
530	T	90.3	Very high	89.2	Confident	50 Å²	50	20.4 Å²	20.4	31%	0.307	10%	0.102	S	C	.	.	H	α-helix	trans	-63.5	-47.7	171.8	-58.9	0	0	0	0	110.7	K526 E528 D534	K526-T530 VanDerWaalsContact O-CB 3.25Å; K526-T530 WeakPolarHBondContact O-CB 3.25Å; K526-T530 PolarHBondContact O-N 3.05Å; K526-T530 PolarHBondContact O-OG1 2.99Å; E528-T530 VanDerWaalsContact C-N 3.3Å; E528-T530 PolarHBondContact O-N 3.38Å; T530-D534 HydrophobicContact CG2-CB 4.44Å; T530-D534 WeakPolarHBondContact O-CA 3.45Å; T530-D534 WeakPolarHBondContact O-CB 3.35Å; T530-D534 PolarHBondContact O-N 3.06Å
531	F	91	Very high	89.2	Confident	4 Å²	4	20.4 Å²	20.4	2%	0.018	10%	0.101	C	C	.	.	I	π-helix	trans	-62.4	-44.8	178.6	167.7	-123	0	0	0	112.7	S527 E528 H535 L536 S575 Y618 P666 H669	S527-F531 VanDerWaalsContact O-CB 3.28Å; S527-F531 WeakPolarHBondContact O-CB 3.44Å; S527-F531 PolarHBondContact O-N 3.11Å; E528-F531 CarbonylContact O-C 3.56Å; E528-F531 WeakPolarHBondContact O-CB 3.31Å; E528-F531 PolarHBondContact O-N 2.91Å; F531-H535 HydrophobicContact CD2-CB 4.12Å; F531-H535 AromaticContact CD2-ND1 3.91Å; F531-H535 WeakPolarHBondContact O-CB 3.5Å; F531-H535 PolarHBondContact O-N 3.28Å; F531-L536 HydrophobicContact CD1-CD1 4.26Å; F531-L536 HydrophobicContact CD2-CG 4.29Å; F531-L536 HydrophobicContact CE1-CD1 3.68Å; F531-L536 HydrophobicContact CE1-CD2 4.48Å; F531-L536 HydrophobicContact CE1-CG 4.1Å; F531-L536 HydrophobicContact CE2-CD1 4.26Å; F531-L536 HydrophobicContact CE2-CD2 3.75Å; F531-L536 HydrophobicContact CE2-CG 3.75Å; F531-L536 HydrophobicContact CZ-CD1 3.67Å; F531-L536 HydrophobicContact CZ-CD2 3.63Å; F531-L536 HydrophobicContact CZ-CG 3.66Å; F531-L536 PolarHBondContact O-N 2.87Å; F531-S575 WeakPolarHBondContact CE1-OG 3.46Å; F531-Y618 HydrophobicContact CE1-CE1 4.47Å; F531-P666 VanDerWaalsContact CE2-CA 3.47Å; F531-P666 HydrophobicContact CE2-CB 4Å; F531-P666 HydrophobicContact CE2-CG 3.91Å; F531-P666 HydrophobicContact CZ-CB 3.81Å; F531-P666 HydrophobicContact CZ-CG 4.07Å; F531-H669 HydrophobicContact CD1-CB 4.21Å; F531-H669 AromaticContact CD1-CD2 3.46Å; F531-H669 VanDerWaalsContact CD1-CD2 3.46Å; F531-H669 WeakPolarHBondContact CD1-CD2 3.48Å; F531-H669 AromaticContact CD1-CE1 3.57Å; F531-H669 AromaticContact CD1-CG 3.44Å; F531-H669 VanDerWaalsContact CD1-CG 3.44Å; F531-H669 AromaticContact CD1-ND1 3.51Å; F531-H669 AromaticContact CD1-NE2 3.56Å; F531-H669 HydrophobicContact CD2-CB 3.91Å; F531-H669 HydrophobicContact CE1-CB 4.35Å; F531-H669 AromaticContact CE1-CD2 3.42Å; F531-H669 VanDerWaalsContact CE1-CD2 3.42Å; F531-H669 WeakPolarHBondContact CE1-CD2 3.47Å; F531-H669 AromaticContact CE1-CG 3.76Å; F531-H669 AromaticContact CE1-NE2 3.8Å; F531-H669 HydrophobicContact CE2-CB 4.09Å; F531-H669 HydrophobicContact CG-CB 3.98Å; F531-H669 AromaticContact CG-CG 3.58Å; F531-H669 AromaticContact CG-ND1 3.58Å; F531-H669 HydrophobicContact CZ-CB 4.3Å
532	F	90.9	Very high	89.3	Confident	6 Å²	6	20.5 Å²	20.5	3%	0.026	10%	0.102	C	C	.	.	I	π-helix	trans	-63.2	-54.3	176.3	177	-106.3	0	0	0	111.8	F484 L489 E528 L536 M537 H576	F484-F532 HydrophobicContact CD1-CE1 4.49Å; F484-F532 HydrophobicContact CD1-CZ 4.34Å; F484-F532 AromaticContact CE1-CE1 3.92Å; F484-F532 HydrophobicContact CE1-CE1 3.92Å; F484-F532 AromaticContact CE1-CZ 3.72Å; F484-F532 HydrophobicContact CE1-CZ 3.72Å; F484-F532 HydrophobicContact CZ-CZ 4.36Å; L489-F532 HydrophobicContact CD1-CD1 4.43Å; L489-F532 HydrophobicContact CD1-CE1 4.18Å; E528-F532 WeakPolarHBondContact O-CB 3.31Å; E528-F532 PolarHBondContact O-N 3.22Å; F532-L536 HydrophobicContact CD2-CD1 4.46Å; F532-L536 WeakPolarHBondContact O-CB 3.48Å; F532-L536 PolarHBondContact O-N 2.97Å; F532-M537 HydrophobicContact CD1-CG 4.3Å; F532-M537 HydrophobicContact CD2-CE 4.36Å; F532-M537 HydrophobicContact CD2-CG 4.48Å; F532-M537 HydrophobicContact CE1-CG 3.88Å; F532-M537 HydrophobicContact CE1-SD 4.48Å; F532-M537 HydrophobicContact CE2-CE 3.63Å; F532-M537 HydrophobicContact CE2-CG 4.07Å; F532-M537 HydrophobicContact CE2-SD 4.12Å; F532-M537 HydrophobicContact CZ-CE 3.97Å; F532-M537 HydrophobicContact CZ-CG 3.75Å; F532-M537 HydrophobicContact CZ-SD 3.82Å; F532-M537 WeakPolarHBondContact O-CB 3.49Å; F532-M537 WeakPolarHBondContact O-CG 3.49Å; F532-M537 PolarHBondContact O-N 2.79Å; F532-H576 HydrophobicContact CD2-CB 4.3Å; F532-H576 AromaticContact CE1-CD2 3.84Å; F532-H576 HydrophobicContact CE2-CB 3.61Å; F532-H576 HydrophobicContact CZ-CB 3.85Å; F532-H576 AromaticContact CZ-CD2 3.51Å; F532-H576 AromaticContact CZ-CG 3.96Å
533	T	88	Confident	89.3	Confident	26 Å²	26	19.9 Å²	19.9	16%	0.16	10%	0.1	C	C	.	.	I	π-helix	trans	-76.1	-45.9	-171.6	-46.4	0	0	0	0	112	L529	L529-T533 WeakPolarHBondContact O-CB 3.36Å; L529-T533 PolarHBondContact O-N 2.86Å; L529-T533 PolarHBondContact O-OG1 3.14Å
534	D	86.7	Confident	89.2	Confident	10 Å²	10	15.7 Å²	15.7	5%	0.053	8%	0.081	C	C	.	.	I	π-helix	trans	-97.5	-13.3	-166.7	-51.9	-32.1	0	0	0	113	R493 T530 V538 R655	R493-D534 IonicContact CZ-OD1 2.9Å; R493-D534 IonicContact NE-OD1 2.72Å; R493-D534 IonicContact NH2-OD1 3.8Å; R493-D534 PolarHBondContact NH2-OD1 2.87Å; T530-D534 HydrophobicContact CG2-CB 4.44Å; T530-D534 WeakPolarHBondContact O-CA 3.45Å; T530-D534 WeakPolarHBondContact O-CB 3.35Å; T530-D534 PolarHBondContact O-N 3.06Å; D534-V538 VanDerWaalsContact O-CG2 3.27Å; D534-V538 WeakPolarHBondContact O-CG2 3.15Å; D534-R655 IonicContact OD1-CZ 3.3Å; D534-R655 IonicContact OD1-NH1 3.51Å; D534-R655 IonicContact OD1-NH2 3.1Å; D534-R655 PolarHBondContact OD1-NH2 3Å; D534-R655 IonicContact OD2-CZ 3.12Å; D534-R655 IonicContact OD2-NH1 2.7Å; D534-R655 PolarHBondContact OD2-NH1 3.31Å; D534-R655 IonicContact OD2-NH2 2.8Å; D534-R655 PolarHBondContact OD2-NH2 2.84Å
535	H	90.3	Very high	89.1	Confident	50 Å²	50	18.4 Å²	18.4	23%	0.231	9%	0.093	C	C	.	.	I	π-helix	trans	-117	-59.6	173.2	-50.4	140	0	0	0	112.5	F531 L539 L662 A665	F531-H535 HydrophobicContact CD2-CB 4.12Å; F531-H535 AromaticContact CD2-ND1 3.91Å; F531-H535 WeakPolarHBondContact O-CB 3.5Å; F531-H535 PolarHBondContact O-N 3.28Å; H535-L539 VanDerWaalsContact O-CB 3.24Å; H535-L539 WeakPolarHBondContact O-CB 3.49Å; H535-L539 PolarHBondContact O-N 2.81Å; H535-L662 HydrophobicContact CB-CD2 4.46Å; H535-A665 HydrophobicContact CB-CB 3.82Å
536	L	91.7	Very high	89	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.005	10%	0.095	C	C	.	.	I	π-helix	trans	-68.1	-48.7	-174.5	-64.4	-177.6	0	0	0	112.9	F531 F532 V538 L539 K540 L568 L571 P666	F531-L536 HydrophobicContact CD1-CD1 4.26Å; F531-L536 HydrophobicContact CD2-CG 4.29Å; F531-L536 HydrophobicContact CE1-CD1 3.68Å; F531-L536 HydrophobicContact CE1-CD2 4.48Å; F531-L536 HydrophobicContact CE1-CG 4.1Å; F531-L536 HydrophobicContact CE2-CD1 4.26Å; F531-L536 HydrophobicContact CE2-CD2 3.75Å; F531-L536 HydrophobicContact CE2-CG 3.75Å; F531-L536 HydrophobicContact CZ-CD1 3.67Å; F531-L536 HydrophobicContact CZ-CD2 3.63Å; F531-L536 HydrophobicContact CZ-CG 3.66Å; F531-L536 PolarHBondContact O-N 2.87Å; F532-L536 HydrophobicContact CD2-CD1 4.46Å; F532-L536 WeakPolarHBondContact O-CB 3.48Å; F532-L536 PolarHBondContact O-N 2.97Å; L536-V538 VanDerWaalsContact C-N 3.33Å; L536-L539 PolarHBondContact O-N 2.82Å; L536-K540 WeakPolarHBondContact O-CB 3.28Å; L536-K540 PolarHBondContact O-N 3.24Å; L536-L568 HydrophobicContact CD2-CD1 3.73Å; L536-L571 HydrophobicContact CD1-CB 4.36Å; L536-L571 HydrophobicContact CD2-CB 4.35Å; L536-P666 HydrophobicContact CD2-CG 3.98Å
537	M	88.4	Confident	89	Confident	15 Å²	15	14.9 Å²	14.9	7%	0.074	8%	0.078	C	C	.	.	H	α-helix	trans	-69.5	-30.4	178	-70.7	-59.6	97.7	0	0	112.3	F484 F532 K540 N541 C572	F484-M537 HydrophobicContact CB-SD 3.9Å; F484-M537 HydrophobicContact CD1-CG 4.05Å; F484-M537 HydrophobicContact CD1-SD 3.51Å; F484-M537 VanDerWaalsContact CD1-SD 3.51Å; F484-M537 HydrophobicContact CE1-SD 4.14Å; F484-M537 HydrophobicContact CG-SD 3.73Å; F532-M537 HydrophobicContact CD1-CG 4.3Å; F532-M537 HydrophobicContact CD2-CE 4.36Å; F532-M537 HydrophobicContact CD2-CG 4.48Å; F532-M537 HydrophobicContact CE1-CG 3.88Å; F532-M537 HydrophobicContact CE1-SD 4.48Å; F532-M537 HydrophobicContact CE2-CE 3.63Å; F532-M537 HydrophobicContact CE2-CG 4.07Å; F532-M537 HydrophobicContact CE2-SD 4.12Å; F532-M537 HydrophobicContact CZ-CE 3.97Å; F532-M537 HydrophobicContact CZ-CG 3.75Å; F532-M537 HydrophobicContact CZ-SD 3.82Å; F532-M537 WeakPolarHBondContact O-CB 3.49Å; F532-M537 WeakPolarHBondContact O-CG 3.49Å; F532-M537 PolarHBondContact O-N 2.79Å; M537-K540 HydrophobicContact CE-CB 4.46Å; M537-K540 HydrophobicContact CE-CD 4.06Å; M537-N541 WeakPolarHBondContact O-CB 3.47Å; M537-N541 PolarHBondContact O-N 3.38Å; M537-N541 PolarHBondContact O-ND2 3.18Å; M537-C572 HydrophobicContact CE-CB 3.72Å; M537-C572 WeakPolarHBondContact CE-SG 3.48Å
538	V	89.1	Confident	88.7	Confident	7 Å²	7	17.3 Å²	17.3	4%	0.042	9%	0.086	C	C	.	.	H	α-helix	trans	-65	-52.2	170.4	173.5	0	0	0	0	110.5	D534 L536 K540 N541 C542 F543 R653 C654 L662	D534-V538 VanDerWaalsContact O-CG2 3.27Å; D534-V538 WeakPolarHBondContact O-CG2 3.15Å; L536-V538 VanDerWaalsContact C-N 3.33Å; V538-K540 VanDerWaalsContact C-N 3.26Å; V538-K540 PolarHBondContact O-N 3.26Å; V538-N541 PolarHBondContact O-N 2.81Å; V538-C542 HydrophobicContact CG1-CB 4.38Å; V538-C542 WeakPolarHBondContact O-CA 3.28Å; V538-C542 WeakPolarHBondContact O-CB 3.35Å; V538-C542 PolarHBondContact O-N 2.95Å; V538-C542 PolarHBondContact O-SG 2.91Å; V538-C542 VanDerWaalsContact O-SG 3.36Å; V538-F543 HydrophobicContact CG1-CE2 4.49Å; V538-R653 HydrophobicContact CG2-CB 4.34Å; V538-R653 WeakPolarHBondContact CG2-O 3.34Å; V538-C654 HydrophobicContact CG1-CB 4.34Å; V538-L662 HydrophobicContact CG1-CD1 3.78Å; V538-L662 HydrophobicContact CG1-CD2 4.17Å
539	L	90.6	Very high	88.5	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.005	10%	0.104	C	C	.	.	I	π-helix	trans	-59.4	-37.4	179	-170	64	0	0	0	111.9	H535 L536 F543 M544 F565 L568 L659 L662 L663	H535-L539 VanDerWaalsContact O-CB 3.24Å; H535-L539 WeakPolarHBondContact O-CB 3.49Å; H535-L539 PolarHBondContact O-N 2.81Å; L536-L539 PolarHBondContact O-N 2.82Å; L539-F543 HydrophobicContact CD1-CD2 4.44Å; L539-F543 WeakPolarHBondContact O-CB 3.34Å; L539-M544 PolarHBondContact O-N 2.88Å; L539-F565 HydrophobicContact CD1-CD1 3.86Å; L539-F565 HydrophobicContact CD1-CE1 3.63Å; L539-F565 HydrophobicContact CD2-CD1 4.27Å; L539-F565 HydrophobicContact CG-CD1 3.89Å; L539-F565 HydrophobicContact CG-CE1 4.08Å; L539-L568 HydrophobicContact CB-CD2 4.24Å; L539-L568 HydrophobicContact CD2-CD1 4.03Å; L539-L568 HydrophobicContact CD2-CD2 3.94Å; L539-L568 HydrophobicContact CG-CD2 3.83Å; L539-L659 HydrophobicContact CD1-CD1 3.57Å; L539-L662 HydrophobicContact CD1-CB 4.11Å; L539-L663 HydrophobicContact CD1-CD2 4.22Å; L539-L663 HydrophobicContact CD1-CG 4.41Å; L539-L663 HydrophobicContact CD2-CD2 4.14Å
540	K	88.8	Confident	88.2	Confident	42 Å²	42	21.1 Å²	21.1	18%	0.183	10%	0.103	C	C	.	.	I	π-helix	trans	-71.1	-57	175.2	179.5	162.8	175.3	161.8	0	113.1	L536 M537 V538 M544 E545 L568 D569	L536-K540 WeakPolarHBondContact O-CB 3.28Å; L536-K540 PolarHBondContact O-N 3.24Å; M537-K540 HydrophobicContact CE-CB 4.46Å; M537-K540 HydrophobicContact CE-CD 4.06Å; V538-K540 VanDerWaalsContact C-N 3.26Å; V538-K540 PolarHBondContact O-N 3.26Å; K540-M544 HydrophobicContact CB-CE 4.26Å; K540-M544 HydrophobicContact CD-CE 4.07Å; K540-M544 HydrophobicContact CG-CE 3.73Å; K540-M544 PolarHBondContact O-N 2.81Å; K540-E545 WeakPolarHBondContact CE-OE1 3.24Å; K540-E545 HydrophobicContact CG-CG 4.25Å; K540-E545 IonicContact NZ-OE1 3.81Å; K540-E545 PolarHBondContact O-N 3.09Å; K540-L568 HydrophobicContact CB-CD2 4.3Å; K540-D569 WeakPolarHBondContact CE-OD1 2.98Å; K540-D569 IonicContact NZ-OD1 2.73Å; K540-D569 PolarHBondContact NZ-OD1 3.47Å
541	N	86.9	Confident	88	Confident	7 Å²	7	20.8 Å²	20.8	4%	0.037	10%	0.098	C	C	.	.	I	π-helix	trans	-87.5	-20.7	-166.6	-55.4	-33.9	0	0	0	114	F484 M537 V538 P546	F484-N541 VanDerWaalsContact CB-ND2 3.29Å; F484-N541 WeakPolarHBondContact CB-ND2 3.4Å; F484-N541 PolarHBondContact N-ND2 2.76Å; M537-N541 WeakPolarHBondContact O-CB 3.47Å; M537-N541 PolarHBondContact O-N 3.38Å; M537-N541 PolarHBondContact O-ND2 3.18Å; V538-N541 PolarHBondContact O-N 2.81Å; N541-P546 VanDerWaalsContact O-CD 3.25Å; N541-P546 WeakPolarHBondContact O-CD 3.11Å; N541-P546 WeakPolarHBondContact O-CG 3.36Å
542	C	86.9	Confident	87.6	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.02	13%	0.133	C	C	.	.	I	π-helix	trans	-99.1	-28.5	178.8	-46.4	0	0	0	0	112.3	V538 P546 C648 R653	V538-C542 HydrophobicContact CG1-CB 4.38Å; V538-C542 WeakPolarHBondContact O-CA 3.28Å; V538-C542 WeakPolarHBondContact O-CB 3.35Å; V538-C542 PolarHBondContact O-N 2.95Å; V538-C542 PolarHBondContact O-SG 2.91Å; V538-C542 VanDerWaalsContact O-SG 3.36Å; C542-P546 WeakPolarHBondContact O-CG 3.26Å; C542-C648 PolarHBondContact O-SG 2.9Å; C542-R653 VanDerWaalsContact SG-CZ 3.55Å; C542-R653 PolarHBondContact SG-NH2 3.01Å; C542-R653 VanDerWaalsContact SG-NH2 3.36Å
543	F	87.5	Confident	87.2	Confident	1 Å²	1	30 Å²	30	0%	0.004	15%	0.152	C	C	.	.	I	π-helix	trans	-115.2	-62.1	-180	-59.1	-98.9	0	0	0	112.7	V538 L539 E545 L547 F565 C648 L659 L662	V538-F543 HydrophobicContact CG1-CE2 4.49Å; L539-F543 HydrophobicContact CD1-CD2 4.44Å; L539-F543 WeakPolarHBondContact O-CB 3.34Å; F543-E545 PolarHBondContact O-N 3.29Å; F543-L547 WeakPolarHBondContact O-CB 3.36Å; F543-L547 PolarHBondContact O-N 2.93Å; F543-F565 HydrophobicContact CB-CE1 4.04Å; F543-F565 HydrophobicContact CB-CZ 3.79Å; F543-C648 HydrophobicContact CD1-CB 3.47Å; F543-C648 VanDerWaalsContact CD1-CB 3.47Å; F543-C648 HydrophobicContact CD2-CB 4.5Å; F543-C648 HydrophobicContact CE1-CB 3.24Å; F543-C648 HydrophobicContact CE2-CB 4.3Å; F543-C648 HydrophobicContact CG-CB 4.12Å; F543-C648 HydrophobicContact CZ-CB 3.7Å; F543-L659 HydrophobicContact CD1-CB 4.48Å; F543-L659 HydrophobicContact CD1-CD1 3.81Å; F543-L659 HydrophobicContact CD1-CD2 4.11Å; F543-L659 HydrophobicContact CD1-CG 4.35Å; F543-L659 HydrophobicContact CD2-CD1 4.45Å; F543-L659 HydrophobicContact CE1-CB 3.85Å; F543-L659 HydrophobicContact CE1-CD1 3.97Å; F543-L659 HydrophobicContact CE1-CD2 4.21Å; F543-L659 HydrophobicContact CE1-CG 4.22Å; F543-L659 HydrophobicContact CG-CD1 4.06Å; F543-L659 HydrophobicContact CZ-CB 4.22Å; F543-L659 HydrophobicContact CZ-CD1 4.38Å; F543-L662 HydrophobicContact CD2-CD1 4.27Å; F543-L662 HydrophobicContact CE2-CD1 3.46Å; F543-L662 VanDerWaalsContact CE2-CD1 3.46Å; F543-L662 HydrophobicContact CZ-CD1 4.05Å
544	M	87.3	Confident	86.8	Confident	4 Å²	4	30 Å²	30	2%	0.02	16%	0.157	C	C	.	.	I	π-helix	trans	-64.5	-43.1	-170.4	-176.4	175.5	57.8	0	0	113.8	L539 K540 K548 F565 L568	L539-M544 PolarHBondContact O-N 2.88Å; K540-M544 HydrophobicContact CB-CE 4.26Å; K540-M544 HydrophobicContact CD-CE 4.07Å; K540-M544 HydrophobicContact CG-CE 3.73Å; K540-M544 PolarHBondContact O-N 2.81Å; M544-K548 HydrophobicContact CG-CD 4.05Å; M544-K548 WeakPolarHBondContact O-CB 3.47Å; M544-K548 VanDerWaalsContact O-CG 3.24Å; M544-K548 WeakPolarHBondContact O-CG 3.2Å; M544-K548 PolarHBondContact O-N 2.58Å; M544-K548 PolarHBondContact SD-NZ 3.43Å; M544-F565 HydrophobicContact CB-CD2 3.77Å; M544-F565 HydrophobicContact CB-CE2 3.71Å; M544-F565 HydrophobicContact CB-CG 4.31Å; M544-F565 HydrophobicContact CB-CZ 4.19Å; M544-F565 HydrophobicContact CG-CD2 3.73Å; M544-F565 HydrophobicContact CG-CE2 4Å; M544-F565 HydrophobicContact CG-CG 4.46Å; M544-F565 HydrophobicContact SD-CB 4.38Å; M544-F565 HydrophobicContact SD-CD2 4.13Å; M544-F565 HydrophobicContact SD-CG 4.47Å; M544-L568 HydrophobicContact CE-CD2 3.94Å; M544-L568 HydrophobicContact CE-CG 4.36Å; M544-L568 HydrophobicContact SD-CD2 4.27Å
545	E	87.1	Confident	86.4	Confident	57 Å²	57	31.4 Å²	31.4	27%	0.266	16%	0.162	S	C	.	.	H	α-helix	trans	-76.6	-44.2	-178.4	-69.2	-176.2	178.7	0	0	113.2	S482 K540 F543 L547 K548 K549	S482-E545 VanDerWaalsContact CB-OE2 3.26Å; S482-E545 WeakPolarHBondContact CB-OE2 3.14Å; S482-E545 PolarHBondContact OG-OE2 2.87Å; K540-E545 WeakPolarHBondContact CE-OE1 3.24Å; K540-E545 HydrophobicContact CG-CG 4.25Å; K540-E545 IonicContact NZ-OE1 3.81Å; K540-E545 PolarHBondContact O-N 3.09Å; F543-E545 PolarHBondContact O-N 3.29Å; E545-L547 VanDerWaalsContact C-N 3.3Å; E545-L547 PolarHBondContact O-N 3.27Å; E545-K548 PolarHBondContact O-N 2.81Å; E545-K549 WeakPolarHBondContact O-CB 3.49Å; E545-K549 PolarHBondContact O-N 2.87Å
546	P	87.1	Confident	86	Confident	5 Å²	5	29.3 Å²	29.3	3%	0.032	15%	0.152	C	C	.	.	H	α-helix	trans	-53.5	-43.2	166.9	-34.4	42.8	0	0	0	113.5	L479 N541 C542 K549 L550 F644 W647	L479-P546 HydrophobicContact CD2-CB 3.77Å; N541-P546 VanDerWaalsContact O-CD 3.25Å; N541-P546 WeakPolarHBondContact O-CD 3.11Å; N541-P546 WeakPolarHBondContact O-CG 3.36Å; C542-P546 WeakPolarHBondContact O-CG 3.26Å; P546-K549 PolarHBondContact O-N 2.88Å; P546-L550 WeakPolarHBondContact O-CG 3.35Å; P546-L550 PolarHBondContact O-N 3.49Å; P546-F644 HydrophobicContact CB-CE2 4.14Å; P546-W647 HydrophobicContact CB-CZ3 4.23Å
547	L	87.5	Confident	85.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61	-49.7	174.4	179.9	65.2	0	0	0	112	F543 E545 K549 L550 Q551 L556 V559 P561 F565 F644	F543-L547 WeakPolarHBondContact O-CB 3.36Å; F543-L547 PolarHBondContact O-N 2.93Å; E545-L547 VanDerWaalsContact C-N 3.3Å; E545-L547 PolarHBondContact O-N 3.27Å; L547-K549 PolarHBondContact O-N 2.94Å; L547-L550 PolarHBondContact O-N 3.38Å; L547-Q551 WeakPolarHBondContact O-CB 3.27Å; L547-Q551 VanDerWaalsContact O-CG 3.28Å; L547-Q551 WeakPolarHBondContact O-CG 3.48Å; L547-Q551 PolarHBondContact O-N 3.09Å; L547-L556 HydrophobicContact CD1-CB 3.73Å; L547-L556 HydrophobicContact CD1-CD1 3.62Å; L547-L556 HydrophobicContact CD1-CG 4.32Å; L547-V559 HydrophobicContact CD1-CB 4.07Å; L547-V559 HydrophobicContact CD1-CG1 4.23Å; L547-V559 HydrophobicContact CD1-CG2 4.18Å; L547-V559 HydrophobicContact CD2-CB 4.23Å; L547-V559 HydrophobicContact CD2-CG1 3.61Å; L547-P561 HydrophobicContact CD2-CB 4.34Å; L547-P561 HydrophobicContact CD2-CG 3.88Å; L547-P561 HydrophobicContact CG-CG 4.42Å; L547-F565 HydrophobicContact CD2-CE2 4.04Å; L547-F644 HydrophobicContact CB-CE1 4.29Å; L547-F644 HydrophobicContact CB-CE2 4.46Å; L547-F644 HydrophobicContact CB-CZ 3.76Å; L547-F644 HydrophobicContact CD1-CE1 4.28Å; L547-F644 HydrophobicContact CD1-CZ 4.36Å
548	K	86.6	Confident	85.3	Confident	70 Å²	70	33.6 Å²	33.6	30%	0.304	17%	0.172	S	C	.	.	H	α-helix	trans	-58.6	-35.6	177.3	-76.2	166.9	179.3	171.5	0	111.9	M544 E545 V552 P561 D569	M544-K548 HydrophobicContact CG-CD 4.05Å; M544-K548 WeakPolarHBondContact O-CB 3.47Å; M544-K548 VanDerWaalsContact O-CG 3.24Å; M544-K548 WeakPolarHBondContact O-CG 3.2Å; M544-K548 PolarHBondContact O-N 2.58Å; M544-K548 PolarHBondContact SD-NZ 3.43Å; E545-K548 PolarHBondContact O-N 2.81Å; K548-V552 PolarHBondContact O-N 2.91Å; K548-P561 HydrophobicContact CG-CG 4.39Å; K548-D569 IonicContact NZ-OD2 2.73Å
549	K	84.9	Confident	85	Confident	84 Å²	84	33.4 Å²	33.4	37%	0.365	17%	0.171	S	C	.	.	H	α-helix	trans	-70.1	-51.6	176.9	-174.4	177.5	168.4	-170.5	0	111.8	L479 K480 E545 P546 L547 Q551 V552 D553	L479-K549 HydrophobicContact CD1-CB 4.5Å; L479-K549 HydrophobicContact CD1-CD 3.66Å; L479-K549 HydrophobicContact CD1-CG 3.93Å; L479-K549 HydrophobicContact CG-CD 4.01Å; K480-K549 PolarHBondContact O-NZ 3.29Å; E545-K549 WeakPolarHBondContact O-CB 3.49Å; E545-K549 PolarHBondContact O-N 2.87Å; P546-K549 PolarHBondContact O-N 2.88Å; L547-K549 PolarHBondContact O-N 2.94Å; K549-Q551 PolarHBondContact O-N 3.21Å; K549-Q551 VanDerWaalsContact O-N 3.12Å; K549-V552 WeakPolarHBondContact O-CA 3.42Å; K549-V552 WeakPolarHBondContact O-CB 3.38Å; K549-V552 PolarHBondContact O-N 3.11Å; K549-D553 PolarHBondContact O-N 3.46Å; K549-D553 VanDerWaalsContact O-N 3.14Å
550	L	85.2	Confident	84.8	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-55.7	-31.1	174.7	-71.9	165.5	0	0	0	112.7	A475 L476 L479 P546 L547 D553 G554 Y555 L556 F644	A475-L550 HydrophobicContact CB-CD2 4.2Å; L476-L550 HydrophobicContact CD2-CD1 3.74Å; L476-L550 HydrophobicContact CD2-CD2 4.32Å; L479-L550 HydrophobicContact CD1-CD2 3.89Å; L479-L550 HydrophobicContact CD1-CG 4.11Å; L479-L550 HydrophobicContact CD2-CD1 4.03Å; L479-L550 HydrophobicContact CD2-CD2 4.18Å; L479-L550 HydrophobicContact CD2-CG 3.83Å; P546-L550 WeakPolarHBondContact O-CG 3.35Å; P546-L550 PolarHBondContact O-N 3.49Å; L547-L550 PolarHBondContact O-N 3.38Å; L550-D553 CarbonylContact O-C 3.55Å; L550-D553 PolarHBondContact O-N 2.84Å; L550-G554 PolarHBondContact O-N 3.3Å; L550-G554 VanDerWaalsContact O-N 3.12Å; L550-Y555 CarbonylContact C-O 3.58Å; L550-Y555 WeakPolarHBondContact O-CA 3.47Å; L550-Y555 PolarHBondContact O-N 3.45Å; L550-L556 HydrophobicContact CB-CD1 4.5Å; L550-L556 HydrophobicContact CD1-CD1 3.85Å; L550-F644 HydrophobicContact CD1-CD2 3.47Å; L550-F644 VanDerWaalsContact CD1-CD2 3.47Å; L550-F644 HydrophobicContact CD1-CE2 3.59Å
551	Q	85.7	Confident	84.6	Confident	43 Å²	43	34.6 Å²	34.6	20%	0.201	18%	0.179	C	C	.	.	H	α-helix	trans	-72	-27.4	174.5	-73.8	179.7	-16.4	0	0	114.3	L547 K549 G554 Y555 L556 V559	L547-Q551 WeakPolarHBondContact O-CB 3.27Å; L547-Q551 VanDerWaalsContact O-CG 3.28Å; L547-Q551 WeakPolarHBondContact O-CG 3.48Å; L547-Q551 PolarHBondContact O-N 3.09Å; K549-Q551 PolarHBondContact O-N 3.21Å; K549-Q551 VanDerWaalsContact O-N 3.12Å; Q551-G554 PolarHBondContact O-N 3.46Å; Q551-Y555 WeakPolarHBondContact CA-O 3.48Å; Q551-Y555 WeakPolarHBondContact CG-O 3.35Å; Q551-L556 PolarHBondContact NE2-O 3.35Å; Q551-V559 PolarHBondContact NE2-O 3.32Å
552	V	83	Confident	84.6	Confident	125 Å²	125	40 Å²	40	76%	0.758	21%	0.205	S	C	*	.	H	α-helix	trans	-70.1	-37.8	167.3	176.4	0	0	0	0	110.2	K548 K549 G554	K548-V552 PolarHBondContact O-N 2.91Å; K549-V552 WeakPolarHBondContact O-CA 3.42Å; K549-V552 WeakPolarHBondContact O-CB 3.38Å; K549-V552 PolarHBondContact O-N 3.11Å; V552-G554 PolarHBondContact O-N 2.93Å
553	D	81.6	Confident	84.5	Confident	78 Å²	78	43.2 Å²	43.2	42%	0.417	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	0.2	176.6	-54.4	-39.9	0	0	0	113.5	K549 L550 Y555	K549-D553 PolarHBondContact O-N 3.46Å; K549-D553 VanDerWaalsContact O-N 3.14Å; L550-D553 CarbonylContact O-C 3.55Å; L550-D553 PolarHBondContact O-N 2.84Å; D553-Y555 HydrophobicContact CB-CD2 4.01Å; D553-Y555 HydrophobicContact CB-CE2 4.36Å
554	G	79	Confident	84.5	Confident	26 Å²	26	43.3 Å²	43.3	27%	0.268	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.1	15.6	175.5	0	0	0	0	0	115.6	L550 Q551 V552	L550-G554 PolarHBondContact O-N 3.3Å; L550-G554 VanDerWaalsContact O-N 3.12Å; Q551-G554 PolarHBondContact O-N 3.46Å; V552-G554 PolarHBondContact O-N 2.93Å
555	Y	80.1	Confident	84.6	Confident	39 Å²	39	43.1 Å²	43.1	15%	0.153	22%	0.22	C	C	.	.	S	Bend	trans	-101.4	159.6	172	-61.4	-78.9	0	0	0	111.2	D471 L472 A475 L550 Q551 D553 M557	D471-Y555 HydrophobicContact CB-CE1 4.35Å; D471-Y555 VanDerWaalsContact CB-OH 3.25Å; D471-Y555 WeakPolarHBondContact CB-OH 3.31Å; D471-Y555 PolarHBondContact O-OH 3.02Å; L472-Y555 HydrophobicContact CB-CD1 4.04Å; L472-Y555 HydrophobicContact CB-CE1 4.07Å; L472-Y555 HydrophobicContact CD1-CD1 3.99Å; L472-Y555 HydrophobicContact CD1-CG 4.46Å; L472-Y555 HydrophobicContact CG-CD1 4.3Å; A475-Y555 HydrophobicContact CB-CD2 4.06Å; A475-Y555 HydrophobicContact CB-CE2 3.71Å; L550-Y555 CarbonylContact C-O 3.58Å; L550-Y555 WeakPolarHBondContact O-CA 3.47Å; L550-Y555 PolarHBondContact O-N 3.45Å; Q551-Y555 WeakPolarHBondContact CA-O 3.48Å; Q551-Y555 WeakPolarHBondContact CG-O 3.35Å; D553-Y555 HydrophobicContact CB-CD2 4.01Å; D553-Y555 HydrophobicContact CB-CE2 4.36Å; Y555-M557 PolarHBondContact O-N 2.83Å
556	L	82.1	Confident	84.6	Confident	7 Å²	7	41.2 Å²	41.2	4%	0.037	22%	0.215	C	C	.	.	S	Bend	trans	50.6	23.4	176	-56.4	176.2	0	0	0	115.4	L547 L550 Q551 F558 V559 H640 F644	L547-L556 HydrophobicContact CD1-CB 3.73Å; L547-L556 HydrophobicContact CD1-CD1 3.62Å; L547-L556 HydrophobicContact CD1-CG 4.32Å; L550-L556 HydrophobicContact CB-CD1 4.5Å; L550-L556 HydrophobicContact CD1-CD1 3.85Å; Q551-L556 PolarHBondContact NE2-O 3.35Å; L556-F558 HydrophobicContact CD2-CE1 4.08Å; L556-F558 HydrophobicContact CD2-CE2 4.49Å; L556-F558 HydrophobicContact CD2-CZ 3.65Å; L556-F558 PolarHBondContact O-N 2.72Å; L556-V559 HydrophobicContact CB-CG2 4.09Å; L556-V559 WeakPolarHBondContact O-CB 3.21Å; L556-V559 WeakPolarHBondContact O-CG2 3.4Å; L556-V559 PolarHBondContact O-N 3.09Å; L556-H640 HydrophobicContact CD2-CB 4.16Å; L556-F644 HydrophobicContact CD1-CB 3.73Å; L556-F644 HydrophobicContact CD1-CD1 3.92Å; L556-F644 HydrophobicContact CD1-CD2 3.71Å; L556-F644 HydrophobicContact CD1-CE1 4.49Å; L556-F644 HydrophobicContact CD1-CE2 4.3Å; L556-F644 HydrophobicContact CD1-CG 3.49Å; L556-F644 VanDerWaalsContact CD1-CG 3.49Å
557	M	81.1	Confident	84.8	Confident	65 Å²	65	42.3 Å²	42.3	32%	0.32	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-6.7	-178.6	-61.2	-176.1	76.3	0	0	114.2	T433 Y555	T433-M557 WeakPolarHBondContact CG2-O 3.19Å; Y555-M557 PolarHBondContact O-N 2.83Å
558	F	83.8	Confident	84.9	Confident	40 Å²	40	42.4 Å²	42.4	18%	0.175	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-12.3	173.3	58.5	-99.2	0	0	0	113.2	L556 Y631 L635 L638 F641	L556-F558 HydrophobicContact CD2-CE1 4.08Å; L556-F558 HydrophobicContact CD2-CE2 4.49Å; L556-F558 HydrophobicContact CD2-CZ 3.65Å; L556-F558 PolarHBondContact O-N 2.72Å; F558-Y631 PolarHBondContact O-OH 3.4Å; F558-L635 HydrophobicContact CD2-CD2 3.96Å; F558-L635 HydrophobicContact CE2-CD2 4.07Å; F558-L638 HydrophobicContact CD2-CD1 3.52Å; F558-L638 HydrophobicContact CE2-CB 4.36Å; F558-L638 HydrophobicContact CE2-CD1 3.37Å; F558-L638 HydrophobicContact CE2-CG 4.5Å; F558-L638 HydrophobicContact CG-CD1 4.23Å; F558-L638 HydrophobicContact CZ-CB 4.35Å; F558-L638 HydrophobicContact CZ-CD1 3.97Å; F558-F641 HydrophobicContact CE2-CB 4.32Å; F558-F641 HydrophobicContact CZ-CB 4.38Å
559	V	83.1	Confident	85	Confident	3 Å²	3	42 Å²	42	2%	0.018	22%	0.223	C	C	.	.			trans	-85.9	136.8	177	-170.4	0	0	0	0	109.1	L547 Q551 L556 Y631 L635 F641	L547-V559 HydrophobicContact CD1-CB 4.07Å; L547-V559 HydrophobicContact CD1-CG1 4.23Å; L547-V559 HydrophobicContact CD1-CG2 4.18Å; L547-V559 HydrophobicContact CD2-CB 4.23Å; L547-V559 HydrophobicContact CD2-CG1 3.61Å; Q551-V559 PolarHBondContact NE2-O 3.32Å; L556-V559 HydrophobicContact CB-CG2 4.09Å; L556-V559 WeakPolarHBondContact O-CB 3.21Å; L556-V559 WeakPolarHBondContact O-CG2 3.4Å; L556-V559 PolarHBondContact O-N 3.09Å; V559-Y631 WeakPolarHBondContact CA-OH 3.2Å; V559-L635 HydrophobicContact CG1-CD1 3.8Å; V559-L635 HydrophobicContact CG2-CD1 4.47Å; V559-L635 HydrophobicContact CG2-CD2 4.14Å; V559-F641 HydrophobicContact CG1-CE2 4.38Å; V559-F641 HydrophobicContact CG2-CD2 3.82Å; V559-F641 HydrophobicContact CG2-CE2 4.22Å
560	E	86.3	Confident	85.3	Confident	48 Å²	48	42 Å²	42	22%	0.224	23%	0.227	C	C	.	.			trans	-111.4	104.7	174.7	-64.1	-163.5	172	0	0	109.9	T433 M562 H563 L564 Y631	T433-E560 WeakPolarHBondContact CB-OE1 3.45Å; T433-E560 HydrophobicContact CG2-CG 4.06Å; T433-E560 WeakPolarHBondContact CG2-OE1 3.48Å; T433-E560 PolarHBondContact OG1-OE1 3.36Å; E560-M562 PolarHBondContact O-N 3.29Å; E560-M562 VanDerWaalsContact O-N 3.09Å; E560-H563 HydrophobicContact CB-CB 4.39Å; E560-H563 PolarHBondContact O-N 3.11Å; E560-H563 IonicContact OE2-CE1 3.07Å; E560-H563 PolarHBondContact OE2-CE1 2.75Å; E560-H563 IonicContact OE2-ND1 3.25Å; E560-H563 PolarHBondContact OE2-ND1 3.03Å; E560-L564 PolarHBondContact O-N 2.89Å; E560-Y631 HydrophobicContact CB-CE1 4.49Å; E560-Y631 PolarHBondContact N-OH 3.16Å
561	P	84.9	Confident	85.6	Confident	20 Å²	20	42 Å²	42	13%	0.13	23%	0.226	C	C	.	.	H	α-helix	trans	-57.2	-31.1	-173	-26.4	33.3	0	0	0	113.9	L547 K548 L564 F565	L547-P561 HydrophobicContact CD2-CB 4.34Å; L547-P561 HydrophobicContact CD2-CG 3.88Å; L547-P561 HydrophobicContact CG-CG 4.42Å; K548-P561 HydrophobicContact CG-CG 4.39Å; P561-L564 PolarHBondContact O-N 2.98Å; P561-F565 HydrophobicContact CB-CD2 4.13Å; P561-F565 HydrophobicContact CB-CE2 4.45Å; P561-F565 WeakPolarHBondContact O-CB 3.16Å; P561-F565 VanDerWaalsContact O-CD2 3.26Å; P561-F565 WeakPolarHBondContact O-CD2 3.22Å; P561-F565 PolarHBondContact O-N 2.94Å
562	M	85.6	Confident	85.9	Confident	120 Å²	120	40.3 Å²	40.3	59%	0.591	22%	0.219	S	C	*	.	H	α-helix	trans	-70.6	-31.8	179.6	-62.4	-64.4	158.9	0	0	112.9	E560 G566	E560-M562 PolarHBondContact O-N 3.29Å; E560-M562 VanDerWaalsContact O-N 3.09Å; M562-G566 VanDerWaalsContact O-CA 3.24Å; M562-G566 WeakPolarHBondContact O-CA 3.41Å; M562-G566 PolarHBondContact O-N 3.3Å
563	H	85.8	Confident	86.2	Confident	72 Å²	72	40.3 Å²	40.3	33%	0.333	21%	0.207	S	C	.	.	H	α-helix	trans	-75	-36.2	175.1	-73.7	114.6	0	0	0	111.4	E560 N624 A628 Y631	E560-H563 HydrophobicContact CB-CB 4.39Å; E560-H563 PolarHBondContact O-N 3.11Å; E560-H563 IonicContact OE2-CE1 3.07Å; E560-H563 PolarHBondContact OE2-CE1 2.75Å; E560-H563 IonicContact OE2-ND1 3.25Å; E560-H563 PolarHBondContact OE2-ND1 3.03Å; H563-N624 PolarHBondContact O-ND2 2.94Å; H563-A628 WeakPolarHBondContact O-CB 3.26Å; H563-Y631 HydrophobicContact CB-CD1 3.75Å; H563-Y631 HydrophobicContact CB-CE1 3.79Å; H563-Y631 HydrophobicContact CB-CG 4.47Å
564	L	87.2	Confident	86.6	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-78.8	-40.9	-179.7	-175.3	59.3	0	0	0	113.8	E560 P561 Y631 L632 L635 F641 L663	E560-L564 PolarHBondContact O-N 2.89Å; P561-L564 PolarHBondContact O-N 2.98Å; L564-Y631 HydrophobicContact CB-CD1 4.32Å; L564-Y631 HydrophobicContact CB-CE1 4.47Å; L564-L632 HydrophobicContact CD1-CB 3.92Å; L564-L632 HydrophobicContact CD1-CD1 4.2Å; L564-L632 HydrophobicContact CD1-CG 4.46Å; L564-L635 HydrophobicContact CD2-CD1 4.39Å; L564-F641 HydrophobicContact CD2-CE2 4.42Å; L564-F641 HydrophobicContact CD2-CZ 4.27Å; L564-L663 HydrophobicContact CD1-CD1 4.16Å; L564-L663 WeakPolarHBondContact O-CD2 3.5Å
565	F	88.8	Confident	87.2	Confident	1 Å²	1	35.4 Å²	35.4	0%	0.004	17%	0.174	C	C	.	.	H	α-helix	trans	-107.9	-7.7	-174.4	-54.3	-65.5	0	0	0	114.3	L539 F543 M544 L547 P561 N567 L568 Y621 L659 L663	L539-F565 HydrophobicContact CD1-CD1 3.86Å; L539-F565 HydrophobicContact CD1-CE1 3.63Å; L539-F565 HydrophobicContact CD2-CD1 4.27Å; L539-F565 HydrophobicContact CG-CD1 3.89Å; L539-F565 HydrophobicContact CG-CE1 4.08Å; F543-F565 HydrophobicContact CB-CE1 4.04Å; F543-F565 HydrophobicContact CB-CZ 3.79Å; M544-F565 HydrophobicContact CB-CD2 3.77Å; M544-F565 HydrophobicContact CB-CE2 3.71Å; M544-F565 HydrophobicContact CB-CG 4.31Å; M544-F565 HydrophobicContact CB-CZ 4.19Å; M544-F565 HydrophobicContact CG-CD2 3.73Å; M544-F565 HydrophobicContact CG-CE2 4Å; M544-F565 HydrophobicContact CG-CG 4.46Å; M544-F565 HydrophobicContact SD-CB 4.38Å; M544-F565 HydrophobicContact SD-CD2 4.13Å; M544-F565 HydrophobicContact SD-CG 4.47Å; L547-F565 HydrophobicContact CD2-CE2 4.04Å; P561-F565 HydrophobicContact CB-CD2 4.13Å; P561-F565 HydrophobicContact CB-CE2 4.45Å; P561-F565 WeakPolarHBondContact O-CB 3.16Å; P561-F565 VanDerWaalsContact O-CD2 3.26Å; P561-F565 WeakPolarHBondContact O-CD2 3.22Å; P561-F565 PolarHBondContact O-N 2.94Å; F565-N567 PolarHBondContact O-N 3.4Å; F565-L568 HydrophobicContact CB-CB 4.07Å; F565-L568 HydrophobicContact CB-CD2 4.05Å; F565-L568 HydrophobicContact CD1-CD2 4.34Å; F565-L568 HydrophobicContact CG-CD2 4.31Å; F565-L568 WeakPolarHBondContact O-CB 3.34Å; F565-L568 PolarHBondContact O-N 2.94Å; F565-Y621 WeakPolarHBondContact O-CE2 3.45Å; F565-L659 HydrophobicContact CE1-CD1 4.24Å; F565-L663 HydrophobicContact CD1-CD2 4.21Å
566	G	88.2	Confident	87.6	Confident	17 Å²	17	35.3 Å²	35.3	18%	0.175	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	-137	-179.3	0	0	0	0	0	112.8	M562 L568	M562-G566 VanDerWaalsContact O-CA 3.24Å; M562-G566 WeakPolarHBondContact O-CA 3.41Å; M562-G566 PolarHBondContact O-N 3.3Å; G566-L568 VanDerWaalsContact C-N 3.25Å; G566-L568 PolarHBondContact O-N 3.42Å
567	N	89.8	Confident	87.9	Confident	28 Å²	28	36.1 Å²	36.1	15%	0.15	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	41.3	177	64.2	-50.6	0	0	0	113.4	F565 D569 D570 L571 I617 Y621	F565-N567 PolarHBondContact O-N 3.4Å; N567-D569 VanDerWaalsContact C-N 3.29Å; N567-D569 PolarHBondContact O-N 3.25Å; N567-D570 HydrophobicContact CB-CB 4.32Å; N567-D570 WeakPolarHBondContact O-CB 3.45Å; N567-D570 PolarHBondContact O-N 2.79Å; N567-L571 PolarHBondContact O-N 3.21Å; N567-I617 PolarHBondContact ND2-O 3.29Å; N567-Y621 VanDerWaalsContact OD1-CA 3.31Å; N567-Y621 WeakPolarHBondContact OD1-CA 3.27Å; N567-Y621 WeakPolarHBondContact OD1-CB 3.42Å; N567-Y621 PolarHBondContact OD1-N 2.75Å; N567-Y621 VanDerWaalsContact OD1-N 3.17Å
568	L	89.8	Confident	88.2	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-52.3	-42.7	-179.8	177.7	57.7	0	0	0	113.2	L536 L539 K540 M544 F565 G566 D570 L571 C572	L536-L568 HydrophobicContact CD2-CD1 3.73Å; L539-L568 HydrophobicContact CB-CD2 4.24Å; L539-L568 HydrophobicContact CD2-CD1 4.03Å; L539-L568 HydrophobicContact CD2-CD2 3.94Å; L539-L568 HydrophobicContact CG-CD2 3.83Å; K540-L568 HydrophobicContact CB-CD2 4.3Å; M544-L568 HydrophobicContact CE-CD2 3.94Å; M544-L568 HydrophobicContact CE-CG 4.36Å; M544-L568 HydrophobicContact SD-CD2 4.27Å; F565-L568 HydrophobicContact CB-CB 4.07Å; F565-L568 HydrophobicContact CB-CD2 4.05Å; F565-L568 HydrophobicContact CD1-CD2 4.34Å; F565-L568 HydrophobicContact CG-CD2 4.31Å; F565-L568 WeakPolarHBondContact O-CB 3.34Å; F565-L568 PolarHBondContact O-N 2.94Å; G566-L568 VanDerWaalsContact C-N 3.25Å; G566-L568 PolarHBondContact O-N 3.42Å; L568-D570 VanDerWaalsContact C-N 3.28Å; L568-D570 PolarHBondContact O-N 3.49Å; L568-L571 PolarHBondContact O-N 2.93Å; L568-C572 PolarHBondContact O-N 2.86Å; L568-C572 PolarHBondContact O-SG 3.11Å
569	D	90.2	Very high	88.4	Confident	63 Å²	63	31.3 Å²	31.3	34%	0.337	16%	0.158	S	C	.	.	H	α-helix	trans	-62.2	-32.1	179.2	-78.3	-55.9	0	0	0	112.8	K540 K548 N567 Y573	K540-D569 WeakPolarHBondContact CE-OD1 2.98Å; K540-D569 IonicContact NZ-OD1 2.73Å; K540-D569 PolarHBondContact NZ-OD1 3.47Å; K548-D569 IonicContact NZ-OD2 2.73Å; N567-D569 VanDerWaalsContact C-N 3.29Å; N567-D569 PolarHBondContact O-N 3.25Å; D569-Y573 PolarHBondContact O-N 2.99Å
570	D	90.6	Very high	88.5	Confident	83 Å²	83	37 Å²	37	44%	0.444	18%	0.179	S	C	.	.	H	α-helix	trans	-71.9	-41.6	174.8	-67.3	-24.7	0	0	0	111.3	N567 L568 Y573 V574 I617	N567-D570 HydrophobicContact CB-CB 4.32Å; N567-D570 WeakPolarHBondContact O-CB 3.45Å; N567-D570 PolarHBondContact O-N 2.79Å; L568-D570 VanDerWaalsContact C-N 3.28Å; L568-D570 PolarHBondContact O-N 3.49Å; D570-Y573 WeakPolarHBondContact O-CB 3.21Å; D570-Y573 PolarHBondContact O-N 2.67Å; D570-V574 WeakPolarHBondContact O-CG2 3.3Å; D570-V574 PolarHBondContact O-N 2.91Å; D570-I617 HydrophobicContact CB-CD1 4.47Å; D570-I617 HydrophobicContact CB-CG2 3.77Å
571	L	91.2	Very high	88.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62	-43.8	175.2	-71.7	172	0	0	0	111.3	L536 N567 L568 Y573 V574 S575 I617 Y618 Y621 P666	L536-L571 HydrophobicContact CD1-CB 4.36Å; L536-L571 HydrophobicContact CD2-CB 4.35Å; N567-L571 PolarHBondContact O-N 3.21Å; L568-L571 PolarHBondContact O-N 2.93Å; L571-Y573 VanDerWaalsContact C-N 3.26Å; L571-Y573 PolarHBondContact O-N 3.27Å; L571-V574 PolarHBondContact O-N 2.98Å; L571-S575 PolarHBondContact O-N 2.95Å; L571-I617 HydrophobicContact CD2-CG2 4.01Å; L571-I617 HydrophobicContact CG-CG2 4.37Å; L571-Y618 HydrophobicContact CD2-CD1 3.57Å; L571-Y618 HydrophobicContact CD2-CE1 3.7Å; L571-Y618 HydrophobicContact CD2-CG 4.03Å; L571-Y621 HydrophobicContact CD1-CD1 4.3Å; L571-Y621 HydrophobicContact CD1-CD2 3.46Å; L571-Y621 VanDerWaalsContact CD1-CD2 3.46Å; L571-Y621 HydrophobicContact CD1-CE2 4.07Å; L571-Y621 HydrophobicContact CD1-CG 3.6Å; L571-P666 HydrophobicContact CD1-CB 3.96Å; L571-P666 HydrophobicContact CD1-CG 4.21Å
572	C	90.8	Very high	88.4	Confident	8 Å²	8	36.2 Å²	36.2	5%	0.054	17%	0.174	C	C	.	.	H	α-helix	trans	-56.2	-41.7	174	-66.2	0	0	0	0	111.6	M537 L568 H576	M537-C572 HydrophobicContact CE-CB 3.72Å; M537-C572 WeakPolarHBondContact CE-SG 3.48Å; L568-C572 PolarHBondContact O-N 2.86Å; L568-C572 PolarHBondContact O-SG 3.11Å; C572-H576 WeakPolarHBondContact O-CB 3.42Å; C572-H576 PolarHBondContact O-N 3.21Å
573	Y	90.3	Very high	88.3	Confident	125 Å²	125	30.5 Å²	30.5	49%	0.49	15%	0.145	S	C	.	.	H	α-helix	trans	-66.3	-44.6	177.5	179.9	-89.4	0	0	0	112.6	D569 D570 L571 H576 T577	D569-Y573 PolarHBondContact O-N 2.99Å; D570-Y573 WeakPolarHBondContact O-CB 3.21Å; D570-Y573 PolarHBondContact O-N 2.67Å; L571-Y573 VanDerWaalsContact C-N 3.26Å; L571-Y573 PolarHBondContact O-N 3.27Å; Y573-H576 PolarHBondContact O-N 3.24Å; Y573-T577 HydrophobicContact CD1-CG2 4.31Å; Y573-T577 HydrophobicContact CD2-CG2 4.38Å; Y573-T577 HydrophobicContact CE1-CG2 3.86Å; Y573-T577 HydrophobicContact CE2-CG2 3.96Å; Y573-T577 WeakPolarHBondContact O-CB 3.44Å; Y573-T577 WeakPolarHBondContact O-CG2 3.3Å; Y573-T577 PolarHBondContact O-N 2.86Å; Y573-T577 PolarHBondContact O-OG1 3.3Å
574	V	90.6	Very high	88.1	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-63.1	-48.5	179.5	173.3	0	0	0	0	111.4	D570 L571 T577 F578 I617 Y618	D570-V574 WeakPolarHBondContact O-CG2 3.3Å; D570-V574 PolarHBondContact O-N 2.91Å; L571-V574 PolarHBondContact O-N 2.98Å; V574-T577 PolarHBondContact O-OG1 2.92Å; V574-T577 VanDerWaalsContact O-OG1 3.08Å; V574-F578 WeakPolarHBondContact O-CB 3.27Å; V574-F578 PolarHBondContact O-N 3.02Å; V574-I617 HydrophobicContact CG2-CD1 3.86Å; V574-I617 HydrophobicContact CG2-CG2 4.33Å; V574-Y618 HydrophobicContact CG1-CE2 4.18Å
575	S	90.1	Very high	87.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-68.5	-38.1	178.5	-70.1	0	0	0	0	112.6	E528 F531 L571 C579	E528-S575 WeakPolarHBondContact OE1-CA 3.43Å; E528-S575 WeakPolarHBondContact OE1-CB 3.44Å; E528-S575 PolarHBondContact OE1-OG 3.27Å; F531-S575 WeakPolarHBondContact CE1-OG 3.46Å; L571-S575 PolarHBondContact O-N 2.95Å; S575-C579 WeakPolarHBondContact O-CB 3.19Å; S575-C579 PolarHBondContact O-N 2.84Å; S575-C579 PolarHBondContact O-SG 3.24Å; S575-C579 VanDerWaalsContact O-SG 3.41Å
576	H	88.5	Confident	87	Confident	38 Å²	38	29.5 Å²	29.5	18%	0.176	15%	0.145	C	C	.	.	H	α-helix	trans	-63.9	-47.6	176.5	-173.9	-122.4	0	0	0	112.3	D486 F532 C572 Y573 C579 R580	D486-H576 IonicContact OD2-CD2 2.58Å; D486-H576 IonicContact OD2-CE1 3.63Å; D486-H576 IonicContact OD2-NE2 2.99Å; D486-H576 PolarHBondContact OD2-NE2 3.3Å; F532-H576 HydrophobicContact CD2-CB 4.3Å; F532-H576 AromaticContact CE1-CD2 3.84Å; F532-H576 HydrophobicContact CE2-CB 3.61Å; F532-H576 HydrophobicContact CZ-CB 3.85Å; F532-H576 AromaticContact CZ-CD2 3.51Å; F532-H576 AromaticContact CZ-CG 3.96Å; C572-H576 WeakPolarHBondContact O-CB 3.42Å; C572-H576 PolarHBondContact O-N 3.21Å; Y573-H576 PolarHBondContact O-N 3.24Å; H576-C579 PolarHBondContact O-N 2.94Å; H576-R580 VanDerWaalsContact CE1-CD 3.4Å; H576-R580 WeakPolarHBondContact CE1-CD 3.47Å; H576-R580 WeakPolarHBondContact NE2-CD 3.34Å; H576-R580 WeakPolarHBondContact O-CB 3.39Å; H576-R580 WeakPolarHBondContact O-CG 3.49Å; H576-R580 PolarHBondContact O-N 3.36Å
577	T	88.8	Confident	86.3	Confident	23 Å²	23	30.1 Å²	30.1	14%	0.141	15%	0.147	C	C	.	.	H	α-helix	trans	-63.9	-43.9	178	48.9	0	0	0	0	111.2	Y573 V574 R580 E581	Y573-T577 HydrophobicContact CD1-CG2 4.31Å; Y573-T577 HydrophobicContact CD2-CG2 4.38Å; Y573-T577 HydrophobicContact CE1-CG2 3.86Å; Y573-T577 HydrophobicContact CE2-CG2 3.96Å; Y573-T577 WeakPolarHBondContact O-CB 3.44Å; Y573-T577 WeakPolarHBondContact O-CG2 3.3Å; Y573-T577 PolarHBondContact O-N 2.86Å; Y573-T577 PolarHBondContact O-OG1 3.3Å; V574-T577 PolarHBondContact O-OG1 2.92Å; V574-T577 VanDerWaalsContact O-OG1 3.08Å; T577-R580 PolarHBondContact O-N 2.89Å; T577-E581 VanDerWaalsContact O-CB 3.26Å; T577-E581 WeakPolarHBondContact O-CB 3.49Å; T577-E581 WeakPolarHBondContact O-CG 3.49Å; T577-E581 PolarHBondContact O-N 3.01Å
578	F	88.4	Confident	85.1	Confident	4 Å²	4	34.1 Å²	34.1	2%	0.018	17%	0.165	C	C	.	.	H	α-helix	trans	-64.8	-42.7	176.4	179.4	-130.1	0	0	0	112.9	L524 E528 V574 R580 L582 P604 L605 W608	L524-F578 HydrophobicContact CD1-CE1 4.4Å; L524-F578 HydrophobicContact CD1-CZ 4.47Å; L524-F578 HydrophobicContact CD2-CZ 4.25Å; L524-F578 HydrophobicContact CG-CZ 4.33Å; E528-F578 HydrophobicContact CB-CD1 4.43Å; E528-F578 HydrophobicContact CB-CE1 4.4Å; E528-F578 HydrophobicContact CG-CD1 3.67Å; E528-F578 HydrophobicContact CG-CE1 4.11Å; E528-F578 WeakPolarHBondContact OE2-CD1 3.35Å; V574-F578 WeakPolarHBondContact O-CB 3.27Å; V574-F578 PolarHBondContact O-N 3.02Å; F578-R580 PolarHBondContact O-N 3.39Å; F578-L582 HydrophobicContact CE1-CD2 4.46Å; F578-L582 HydrophobicContact CE2-CB 4.46Å; F578-L582 HydrophobicContact CE2-CD2 4.14Å; F578-L582 HydrophobicContact CZ-CD2 3.9Å; F578-L582 WeakPolarHBondContact O-CB 3.47Å; F578-L582 PolarHBondContact O-N 2.87Å; F578-P604 HydrophobicContact CD2-CB 3.96Å; F578-P604 HydrophobicContact CE2-CB 3.8Å; F578-L605 HydrophobicContact CE2-CD2 4.02Å; F578-L605 HydrophobicContact CZ-CD2 3.92Å; F578-W608 HydrophobicContact CB-CB 4.3Å; F578-W608 HydrophobicContact CB-CG 4.37Å; F578-W608 AromaticContact CD1-CD1 3.8Å; F578-W608 HydrophobicContact CD1-CG 4.36Å; F578-W608 HydrophobicContact CD2-CB 3.83Å; F578-W608 HydrophobicContact CD2-CG 4.27Å; F578-W608 HydrophobicContact CE2-CB 4.38Å; F578-W608 HydrophobicContact CG-CB 4.06Å; F578-W608 AromaticContact CG-CD1 3.7Å; F578-W608 HydrophobicContact CG-CG 4.09Å
579	C	88	Confident	83.6	Confident	1 Å²	1	36 Å²	36	1%	0.007	17%	0.173	C	C	.	.	H	α-helix	trans	-56.8	-49.4	172	-80.6	0	0	0	0	112.4	L489 E528 S575 H576 L582 I583	L489-C579 HydrophobicContact CD1-CB 4.07Å; L489-C579 HydrophobicContact CD2-CB 4.04Å; E528-C579 WeakPolarHBondContact CG-SG 3.36Å; S575-C579 WeakPolarHBondContact O-CB 3.19Å; S575-C579 PolarHBondContact O-N 2.84Å; S575-C579 PolarHBondContact O-SG 3.24Å; S575-C579 VanDerWaalsContact O-SG 3.41Å; H576-C579 PolarHBondContact O-N 2.94Å; C579-L582 PolarHBondContact O-N 3.09Å; C579-I583 WeakPolarHBondContact O-CG2 3.24Å; C579-I583 PolarHBondContact O-N 3.21Å
580	R	85.6	Confident	81.9	Confident	123 Å²	123	34.3 Å²	34.3	46%	0.464	17%	0.167	S	C	.	.	H	α-helix	trans	-69	-41.2	-177.3	-73.1	-166.7	68.3	-149.7	2.2	112.8	L489 H576 T577 F578 S584	L489-R580 HydrophobicContact CD1-CG 4.03Å; L489-R580 HydrophobicContact CD2-CG 4.05Å; L489-R580 HydrophobicContact CG-CG 4.18Å; H576-R580 VanDerWaalsContact CE1-CD 3.4Å; H576-R580 WeakPolarHBondContact CE1-CD 3.47Å; H576-R580 WeakPolarHBondContact NE2-CD 3.34Å; H576-R580 WeakPolarHBondContact O-CB 3.39Å; H576-R580 WeakPolarHBondContact O-CG 3.49Å; H576-R580 PolarHBondContact O-N 3.36Å; T577-R580 PolarHBondContact O-N 2.89Å; F578-R580 PolarHBondContact O-N 3.39Å; R580-S584 WeakPolarHBondContact O-CB 3.43Å; R580-S584 PolarHBondContact O-N 2.97Å
581	E	84.3	Confident	79.9	Confident	51 Å²	51	36.5 Å²	36.5	24%	0.238	18%	0.183	C	C	.	.	H	α-helix	trans	-62.9	-47.3	174	-73.4	-76.6	139	0	0	110.8	T577 S584 N585 P604 R607	T577-E581 VanDerWaalsContact O-CB 3.26Å; T577-E581 WeakPolarHBondContact O-CB 3.49Å; T577-E581 WeakPolarHBondContact O-CG 3.49Å; T577-E581 PolarHBondContact O-N 3.01Å; E581-S584 PolarHBondContact O-N 3.42Å; E581-N585 PolarHBondContact O-N 3.04Å; E581-N585 PolarHBondContact O-ND2 2.88Å; E581-P604 HydrophobicContact CB-CB 4.35Å; E581-P604 HydrophobicContact CB-CG 4.45Å; E581-R607 IonicContact OE1-NH1 3.12Å; E581-R607 PolarHBondContact OE1-NH1 2.95Å; E581-R607 VanDerWaalsContact OE2-CD 3.23Å; E581-R607 WeakPolarHBondContact OE2-CD 3.5Å; E581-R607 IonicContact OE2-CZ 2.66Å; E581-R607 IonicContact OE2-NE 3.57Å; E581-R607 IonicContact OE2-NH1 3.88Å; E581-R607 PolarHBondContact OE2-NH1 3.26Å
582	L	84.6	Confident	78	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.3	-49.5	-178.8	-177.8	49.3	0	0	0	111.8	F525 F578 C579 S584 N585 L586 L601 P604	F525-L582 HydrophobicContact CB-CD2 3.74Å; F525-L582 HydrophobicContact CB-CG 4.24Å; F525-L582 HydrophobicContact CD2-CB 4.35Å; F525-L582 HydrophobicContact CD2-CD2 4.01Å; F525-L582 HydrophobicContact CD2-CG 4.02Å; F525-L582 HydrophobicContact CG-CD2 4.36Å; F578-L582 HydrophobicContact CE1-CD2 4.46Å; F578-L582 HydrophobicContact CE2-CB 4.46Å; F578-L582 HydrophobicContact CE2-CD2 4.14Å; F578-L582 HydrophobicContact CZ-CD2 3.9Å; F578-L582 WeakPolarHBondContact O-CB 3.47Å; F578-L582 PolarHBondContact O-N 2.87Å; C579-L582 PolarHBondContact O-N 3.09Å; L582-S584 VanDerWaalsContact C-N 3.32Å; L582-S584 PolarHBondContact O-N 3.26Å; L582-N585 PolarHBondContact O-N 2.85Å; L582-L586 HydrophobicContact CD1-CD1 3.85Å; L582-L586 HydrophobicContact CD1-CG 4.12Å; L582-L586 HydrophobicContact CG-CD1 4.03Å; L582-L586 WeakPolarHBondContact O-CB 3.18Å; L582-L586 VanDerWaalsContact O-CG 3.26Å; L582-L586 WeakPolarHBondContact O-CG 3.43Å; L582-L586 PolarHBondContact O-N 3.44Å; L582-L601 HydrophobicContact CD1-CD2 3.63Å; L582-P604 HydrophobicContact CB-CB 4.29Å; L582-P604 HydrophobicContact CB-CG 4.4Å; L582-P604 HydrophobicContact CD1-CB 4.49Å; L582-P604 HydrophobicContact CD1-CG 4.28Å
583	I	82.2	Confident	76	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-68.4	-30.6	177.2	-162.4	57.9	0	0	0	112.5	Y488 L489 F492 L500 W522 F525 C579 S587	Y488-I583 HydrophobicContact CE1-CG2 3.62Å; L489-I583 HydrophobicContact CD2-CG2 4.07Å; F492-I583 HydrophobicContact CD1-CD1 4Å; F492-I583 HydrophobicContact CD1-CG1 4.4Å; F492-I583 HydrophobicContact CD2-CD1 4.2Å; F492-I583 HydrophobicContact CD2-CG1 3.74Å; F492-I583 HydrophobicContact CE1-CD1 4.07Å; F492-I583 HydrophobicContact CE1-CG1 4.31Å; F492-I583 HydrophobicContact CE2-CD1 4.26Å; F492-I583 HydrophobicContact CE2-CG1 3.64Å; F492-I583 HydrophobicContact CG-CD1 4.06Å; F492-I583 HydrophobicContact CG-CG1 4.13Å; F492-I583 HydrophobicContact CZ-CD1 4.19Å; F492-I583 HydrophobicContact CZ-CG1 3.93Å; L500-I583 HydrophobicContact CD1-CD1 4.07Å; W522-I583 HydrophobicContact CH2-CD1 4.39Å; W522-I583 HydrophobicContact CZ3-CD1 4.28Å; F525-I583 HydrophobicContact CE1-CD1 4.09Å; F525-I583 HydrophobicContact CE2-CB 3.79Å; F525-I583 HydrophobicContact CE2-CD1 4.45Å; F525-I583 HydrophobicContact CE2-CG1 4.42Å; F525-I583 HydrophobicContact CZ-CB 3.93Å; F525-I583 HydrophobicContact CZ-CD1 3.93Å; F525-I583 HydrophobicContact CZ-CG1 4.06Å; C579-I583 WeakPolarHBondContact O-CG2 3.24Å; C579-I583 PolarHBondContact O-N 3.21Å; I583-S587 WeakPolarHBondContact O-CB 3.41Å; I583-S587 PolarHBondContact O-N 2.93Å; I583-S587 PolarHBondContact O-OG 3.28Å
584	S	81.4	Confident	74.3	Confident	38 Å²	38	45.1 Å²	45.1	27%	0.266	24%	0.238	S	C	.	.	H	α-helix	trans	-67.5	-44	176	-173.6	0	0	0	0	112	R580 E581 L582 S587 Q588	R580-S584 WeakPolarHBondContact O-CB 3.43Å; R580-S584 PolarHBondContact O-N 2.97Å; E581-S584 PolarHBondContact O-N 3.42Å; L582-S584 VanDerWaalsContact C-N 3.32Å; L582-S584 PolarHBondContact O-N 3.26Å; S584-S587 PolarHBondContact O-N 3.45Å; S584-Q588 WeakPolarHBondContact O-CB 3.26Å; S584-Q588 VanDerWaalsContact O-CG 3.26Å; S584-Q588 WeakPolarHBondContact O-CG 3.45Å; S584-Q588 PolarHBondContact O-N 2.91Å; S584-Q588 PolarHBondContact OG-NE2 2.91Å
585	N	78.2	Confident	72.5	Confident	12 Å²	12	45.5 Å²	45.5	6%	0.064	24%	0.24	C	C	.	.	H	α-helix	trans	-67.8	-45.4	177	-73.3	-98.1	0	0	0	109.9	E581 L582 S587 Q588 E589 V600 P604	E581-N585 PolarHBondContact O-N 3.04Å; E581-N585 PolarHBondContact O-ND2 2.88Å; L582-N585 PolarHBondContact O-N 2.85Å; N585-S587 VanDerWaalsContact C-N 3.28Å; N585-S587 PolarHBondContact O-N 3.29Å; N585-Q588 PolarHBondContact O-N 3.42Å; N585-E589 PolarHBondContact O-N 3.19Å; N585-V600 HydrophobicContact CB-CG1 3.68Å; N585-P604 HydrophobicContact CB-CG 4.25Å
586	L	76.5	Confident	70.8	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-60.3	-33.2	174.5	-70.6	170.6	0	0	0	113.7	V521 W522 L582 S590 F595 V600	V521-L586 HydrophobicContact CG1-CD1 4.42Å; V521-L586 HydrophobicContact CG1-CD2 4.05Å; W522-L586 HydrophobicContact CZ3-CD1 4.47Å; L582-L586 HydrophobicContact CD1-CD1 3.85Å; L582-L586 HydrophobicContact CD1-CG 4.12Å; L582-L586 HydrophobicContact CG-CD1 4.03Å; L582-L586 WeakPolarHBondContact O-CB 3.18Å; L582-L586 VanDerWaalsContact O-CG 3.26Å; L582-L586 WeakPolarHBondContact O-CG 3.43Å; L582-L586 PolarHBondContact O-N 3.44Å; L586-S590 PolarHBondContact O-N 3.32Å; L586-F595 HydrophobicContact CD2-CE2 4.4Å; L586-F595 HydrophobicContact CD2-CZ 4.4Å; L586-V600 HydrophobicContact CD2-CG1 4.29Å
587	S	72.5	Confident	69.5	Low	31 Å²	31	44.5 Å²	44.5	22%	0.217	24%	0.237	C	C	.	.	H	α-helix	trans	-76.5	-37.2	177.2	-61.7	0	0	0	0	112.1	I583 S584 N585 S590	I583-S587 WeakPolarHBondContact O-CB 3.41Å; I583-S587 PolarHBondContact O-N 2.93Å; I583-S587 PolarHBondContact O-OG 3.28Å; S584-S587 PolarHBondContact O-N 3.45Å; N585-S587 VanDerWaalsContact C-N 3.28Å; N585-S587 PolarHBondContact O-N 3.29Å; S587-S590 PolarHBondContact O-OG 3.01Å
588	Q	65.5	Low	68.3	Low	111 Å²	111	43.4 Å²	43.4	52%	0.519	23%	0.231	S	C	.	.	H	α-helix	trans	-66.9	-48.5	177.5	-74.2	168.6	15.1	0	0	111	S584 N585 S590 V591	S584-Q588 WeakPolarHBondContact O-CB 3.26Å; S584-Q588 VanDerWaalsContact O-CG 3.26Å; S584-Q588 WeakPolarHBondContact O-CG 3.45Å; S584-Q588 PolarHBondContact O-N 2.91Å; S584-Q588 PolarHBondContact OG-NE2 2.91Å; N585-Q588 PolarHBondContact O-N 3.42Å; Q588-S590 PolarHBondContact O-N 3.01Å; Q588-V591 PolarHBondContact O-N 2.76Å
589	E	57.1	Low	67.3	Low	40 Å²	40	46.3 Å²	46.3	19%	0.187	25%	0.246	C	C	.	.	H	α-helix	trans	-71.1	-10.1	-178.9	-123.9	63.6	-111.7	0	0	114.4	N585 V591 S592 V600	N585-E589 PolarHBondContact O-N 3.19Å; E589-V591 PolarHBondContact O-N 3.23Å; E589-V591 VanDerWaalsContact O-N 3.14Å; E589-S592 PolarHBondContact O-N 2.99Å; E589-S592 VanDerWaalsContact OE1-CB 3.3Å; E589-S592 WeakPolarHBondContact OE1-CB 3.4Å; E589-S592 PolarHBondContact OE1-OG 3.02Å; E589-V600 HydrophobicContact CB-CG1 4.3Å; E589-V600 HydrophobicContact CB-CG2 3.96Å; E589-V600 HydrophobicContact CG-CG2 3.64Å
590	S	54.4	Low	66.3	Low	28 Å²	28	46.3 Å²	46.3	20%	0.196	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-11.2	169.2	73.5	0	0	0	0	114	L586 S587 Q588	L586-S590 PolarHBondContact O-N 3.32Å; S587-S590 PolarHBondContact O-OG 3.01Å; Q588-S590 PolarHBondContact O-N 3.01Å
591	V	48.2	Very low	65.8	Low	129 Å²	129	40.5 Å²	40.5	78%	0.782	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-23.1	171.3	-173.3	0	0	0	0	111.6	Q588 E589	Q588-V591 PolarHBondContact O-N 2.76Å; E589-V591 PolarHBondContact O-N 3.23Å; E589-V591 VanDerWaalsContact O-N 3.14Å
592	S	51.6	Low	65.3	Low	62 Å²	62	39.4 Å²	39.4	43%	0.434	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	0.1	-171.8	-48.1	0	0	0	0	114	E589 E594	E589-S592 PolarHBondContact O-N 2.99Å; E589-S592 VanDerWaalsContact OE1-CB 3.3Å; E589-S592 WeakPolarHBondContact OE1-CB 3.4Å; E589-S592 PolarHBondContact OE1-OG 3.02Å; S592-E594 PolarHBondContact O-N 2.86Å
593	N	50.3	Low	65	Low	131 Å²	131	45.6 Å²	45.6	70%	0.701	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.2	1.4	179.6	-145.4	71.4	0	0	0	115.9
594	E	54.5	Low	64.9	Low	122 Å²	122	45.6 Å²	45.6	57%	0.57	24%	0.244	S	C	*	.			trans	-105.8	65.4	171.2	-75.1	-161.7	-160.7	0	0	111.4	S592 G596 S597	S592-E594 PolarHBondContact O-N 2.86Å; E594-G596 PolarHBondContact O-N 3.43Å; E594-S597 PolarHBondContact O-N 3.17Å; E594-S597 PolarHBondContact OE2-OG 3.34Å
595	F	51.5	Low	64.9	Low	9 Å²	9	44 Å²	44	4%	0.039	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	116	178.1	-176.2	-94.2	0	0	0	110.9	W497 L500 C518 L586	W497-F595 HydrophobicContact CB-CE1 3.87Å; W497-F595 HydrophobicContact CB-CZ 3.99Å; W497-F595 HydrophobicContact CE3-CD1 4.3Å; W497-F595 HydrophobicContact CE3-CE1 4.09Å; L500-F595 HydrophobicContact CB-CD2 4.35Å; L500-F595 HydrophobicContact CB-CE2 3.64Å; L500-F595 HydrophobicContact CB-CZ 4.24Å; L500-F595 HydrophobicContact CD1-CE2 4.07Å; L500-F595 HydrophobicContact CD1-CZ 4.28Å; L500-F595 HydrophobicContact CG-CE2 4.49Å; C518-F595 HydrophobicContact CB-CD1 4.29Å; C518-F595 HydrophobicContact CB-CE1 4.14Å; C518-F595 PolarHBondContact SG-O 3.31Å; C518-F595 VanDerWaalsContact SG-O 3.36Å; L586-F595 HydrophobicContact CD2-CE2 4.4Å; L586-F595 HydrophobicContact CD2-CZ 4.4Å
596	G	54.9	Low	65	Low	2 Å²	2	50 Å²	50	2%	0.021	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.9	-1.9	170.5	0	0	0	0	0	117	R517 E594	R517-G596 PolarHBondContact NH1-O 2.91Å; R517-G596 PolarHBondContact NH2-O 3Å; R517-G596 VanDerWaalsContact NH2-O 3.11Å; E594-G596 PolarHBondContact O-N 3.43Å
597	S	60.5	Low	65.1	Low	15 Å²	15	55.7 Å²	55.7	11%	0.105	28%	0.279	C	S	.	.			trans	-45.7	141.3	-179.9	-74.8	0	0	0	0	113.5	R517 E594 D599 V600	R517-S597 VanDerWaalsContact NH1-CA 3.32Å; E594-S597 PolarHBondContact O-N 3.17Å; E594-S597 PolarHBondContact OE2-OG 3.34Å; S597-D599 VanDerWaalsContact C-N 3.26Å; S597-D599 VanDerWaalsContact CB-OD1 3.28Å; S597-D599 WeakPolarHBondContact CB-OD1 3.24Å; S597-D599 PolarHBondContact O-N 3.06Å; S597-V600 WeakPolarHBondContact O-CB 3.44Å; S597-V600 VanDerWaalsContact O-CG2 3.24Å; S597-V600 WeakPolarHBondContact O-CG2 3.46Å; S597-V600 PolarHBondContact O-N 3.01Å
598	T	64.8	Low	65.8	Low	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-74.7	-22	-158.3	-43.3	0	0	0	0	111.4	R517 V600 L601 L602 T684 E689 L693	R517-T598 VanDerWaalsContact NH1-N 3.12Å; R517-T598 PolarHBondContact NH1-OG1 3.29Å; T598-V600 VanDerWaalsContact C-N 3.29Å; T598-V600 PolarHBondContact O-N 3.01Å; T598-L601 WeakPolarHBondContact O-CA 3.45Å; T598-L601 WeakPolarHBondContact O-CB 3.31Å; T598-L601 PolarHBondContact O-N 3.23Å; T598-L601 VanDerWaalsContact O-N 3.08Å; T598-L602 HydrophobicContact CG2-CD1 4.35Å; T598-L602 HydrophobicContact CG2-CG 4.42Å; T598-L602 VanDerWaalsContact O-CG 3.23Å; T598-L602 WeakPolarHBondContact O-CG 3.3Å; T598-L602 PolarHBondContact O-N 3.19Å; T598-T684 HydrophobicContact CG2-CG2 4.47Å; T598-T684 WeakPolarHBondContact OG1-CG2 3.42Å; T598-T684 PolarHBondContact OG1-OG1 2.82Å; T598-E689 VanDerWaalsContact CA-OE1 3.3Å; T598-E689 WeakPolarHBondContact CA-OE1 3.38Å; T598-E689 WeakPolarHBondContact CB-OE1 3.45Å; T598-E689 HydrophobicContact CG2-CB 4.2Å; T598-E689 PolarHBondContact N-OE1 3.44Å; T598-E689 PolarHBondContact OG1-OE1 3.11Å; T598-E689 VanDerWaalsContact OG1-OE1 3.13Å; T598-E689 PolarHBondContact OG1-OE2 3.12Å; T598-L693 HydrophobicContact CG2-CD1 3.55Å; T598-L693 HydrophobicContact CG2-CD2 4.05Å; T598-L693 HydrophobicContact CG2-CG 3.73Å
599	D	65.9	Low	66.5	Low	65 Å²	65	50 Å²	50	35%	0.348	25%	0.25	S	C	.	.	H	α-helix	trans	-57.7	-37.9	167.6	72.6	-46.5	0	0	0	112.9	S597 L601 L602 R603	S597-D599 VanDerWaalsContact C-N 3.26Å; S597-D599 VanDerWaalsContact CB-OD1 3.28Å; S597-D599 WeakPolarHBondContact CB-OD1 3.24Å; S597-D599 PolarHBondContact O-N 3.06Å; D599-L601 PolarHBondContact O-N 2.67Å; D599-L602 PolarHBondContact O-N 3.44Å; D599-L602 VanDerWaalsContact O-N 3.13Å; D599-R603 PolarHBondContact O-N 3.26Å; D599-R603 IonicContact OD2-NH2 3.62Å
600	V	67.4	Low	67.7	Low	1 Å²	1	53.2 Å²	53.2	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-58.1	-32.8	172.4	-168.5	0	0	0	0	111.5	N585 L586 E589 S597 T598 P604	N585-V600 HydrophobicContact CB-CG1 3.68Å; L586-V600 HydrophobicContact CD2-CG1 4.29Å; E589-V600 HydrophobicContact CB-CG1 4.3Å; E589-V600 HydrophobicContact CB-CG2 3.96Å; E589-V600 HydrophobicContact CG-CG2 3.64Å; S597-V600 WeakPolarHBondContact O-CB 3.44Å; S597-V600 VanDerWaalsContact O-CG2 3.24Å; S597-V600 WeakPolarHBondContact O-CG2 3.46Å; S597-V600 PolarHBondContact O-N 3.01Å; T598-V600 VanDerWaalsContact C-N 3.29Å; T598-V600 PolarHBondContact O-N 3.01Å; V600-P604 WeakPolarHBondContact O-CD 3.25Å; V600-P604 WeakPolarHBondContact O-CG 3.44Å
601	L	75.1	Confident	69	Low	1 Å²	1	55.1 Å²	55.1	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-83	-37.6	173.9	-95.6	175.5	0	0	0	113.1	V521 L524 L582 T598 D599 R603 P604 L605 I680	V521-L601 HydrophobicContact CB-CD1 4.23Å; V521-L601 HydrophobicContact CG1-CD1 3.97Å; V521-L601 HydrophobicContact CG1-CD2 4.18Å; V521-L601 HydrophobicContact CG1-CG 4.04Å; V521-L601 HydrophobicContact CG2-CD1 3.48Å; V521-L601 VanDerWaalsContact CG2-CD1 3.48Å; V521-L601 HydrophobicContact CG2-CG 4.38Å; L524-L601 HydrophobicContact CD2-CD2 4.1Å; L582-L601 HydrophobicContact CD1-CD2 3.63Å; T598-L601 WeakPolarHBondContact O-CA 3.45Å; T598-L601 WeakPolarHBondContact O-CB 3.31Å; T598-L601 PolarHBondContact O-N 3.23Å; T598-L601 VanDerWaalsContact O-N 3.08Å; D599-L601 PolarHBondContact O-N 2.67Å; L601-R603 VanDerWaalsContact C-N 3.3Å; L601-R603 PolarHBondContact O-N 2.75Å; L601-P604 WeakPolarHBondContact O-CD 3.38Å; L601-L605 HydrophobicContact CB-CD1 4.26Å; L601-L605 HydrophobicContact CD2-CD1 4.44Å; L601-L605 WeakPolarHBondContact O-CB 3.45Å; L601-L605 VanDerWaalsContact O-CG 3.26Å; L601-L605 WeakPolarHBondContact O-CG 3.31Å; L601-L605 PolarHBondContact O-N 3.42Å; L601-I680 HydrophobicContact CD1-CD1 3.96Å; L601-I680 HydrophobicContact CD1-CG2 3.78Å
602	L	73.7	Confident	70.5	Confident	28 Å²	28	49 Å²	49	15%	0.147	23%	0.234	C	C	.	.	H	α-helix	trans	-66.7	-30.4	-173.1	-74.5	163.3	0	0	0	112.4	T598 D599 K606 M692 L693	T598-L602 HydrophobicContact CG2-CD1 4.35Å; T598-L602 HydrophobicContact CG2-CG 4.42Å; T598-L602 VanDerWaalsContact O-CG 3.23Å; T598-L602 WeakPolarHBondContact O-CG 3.3Å; T598-L602 PolarHBondContact O-N 3.19Å; D599-L602 PolarHBondContact O-N 3.44Å; D599-L602 VanDerWaalsContact O-N 3.13Å; L602-K606 WeakPolarHBondContact O-CB 3.03Å; L602-K606 PolarHBondContact O-N 2.87Å; L602-M692 HydrophobicContact CD1-CB 3.82Å; L602-M692 HydrophobicContact CD1-CE 3.62Å; L602-M692 HydrophobicContact CD1-CG 4.45Å; L602-M692 HydrophobicContact CD1-SD 3.84Å; L602-M692 HydrophobicContact CD2-CB 3.77Å; L602-M692 HydrophobicContact CG-CB 4.48Å; L602-L693 HydrophobicContact CD2-CD2 4.35Å
603	R	79.4	Confident	72	Confident	129 Å²	129	52 Å²	52	49%	0.487	24%	0.239	S	C	.	.	H	α-helix	trans	-64.2	-57.9	172.4	-63.3	177.8	-159	162.9	9.1	112	D599 L601 L605 K606 R607	D599-R603 PolarHBondContact O-N 3.26Å; D599-R603 IonicContact OD2-NH2 3.62Å; L601-R603 VanDerWaalsContact C-N 3.3Å; L601-R603 PolarHBondContact O-N 2.75Å; R603-L605 PolarHBondContact O-N 3.39Å; R603-K606 PolarHBondContact O-N 3.2Å; R603-R607 PolarHBondContact O-N 3.09Å; R603-R607 VanDerWaalsContact O-N 3.08Å
604	P	79.6	Confident	73.5	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-53.2	-44.8	170.1	-28.5	33	0	0	0	114.7	F578 E581 L582 N585 V600 L601 R607 W608	F578-P604 HydrophobicContact CD2-CB 3.96Å; F578-P604 HydrophobicContact CE2-CB 3.8Å; E581-P604 HydrophobicContact CB-CB 4.35Å; E581-P604 HydrophobicContact CB-CG 4.45Å; L582-P604 HydrophobicContact CB-CB 4.29Å; L582-P604 HydrophobicContact CB-CG 4.4Å; L582-P604 HydrophobicContact CD1-CB 4.49Å; L582-P604 HydrophobicContact CD1-CG 4.28Å; N585-P604 HydrophobicContact CB-CG 4.25Å; V600-P604 WeakPolarHBondContact O-CD 3.25Å; V600-P604 WeakPolarHBondContact O-CG 3.44Å; L601-P604 WeakPolarHBondContact O-CD 3.38Å; P604-R607 PolarHBondContact O-N 3.23Å; P604-W608 WeakPolarHBondContact O-CB 3.26Å; P604-W608 PolarHBondContact O-N 2.91Å
605	L	81.7	Confident	74.9	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-66.7	-38.9	-177.6	-72.6	172.7	0	0	0	112.5	L524 F578 L601 R603 W608 S609 L677 L693	L524-L605 HydrophobicContact CD2-CD2 4.41Å; F578-L605 HydrophobicContact CE2-CD2 4.02Å; F578-L605 HydrophobicContact CZ-CD2 3.92Å; L601-L605 HydrophobicContact CB-CD1 4.26Å; L601-L605 HydrophobicContact CD2-CD1 4.44Å; L601-L605 WeakPolarHBondContact O-CB 3.45Å; L601-L605 VanDerWaalsContact O-CG 3.26Å; L601-L605 WeakPolarHBondContact O-CG 3.31Å; L601-L605 PolarHBondContact O-N 3.42Å; R603-L605 PolarHBondContact O-N 3.39Å; L605-W608 PolarHBondContact O-N 3.49Å; L605-S609 PolarHBondContact O-N 3.39Å; L605-L677 HydrophobicContact CD1-CD2 3.74Å; L605-L677 HydrophobicContact CD2-CD2 3.88Å; L605-L677 HydrophobicContact CG-CD2 4.5Å; L605-L693 HydrophobicContact CD1-CD2 4.07Å
606	K	79.1	Confident	76.7	Confident	138 Å²	138	46.4 Å²	46.4	60%	0.6	21%	0.211	S	C	*	.	H	α-helix	trans	-64.2	-47.2	173.2	-178.2	175.2	174.5	179.5	0	111.1	L602 R603 W608 S609 E610	L602-K606 WeakPolarHBondContact O-CB 3.03Å; L602-K606 PolarHBondContact O-N 2.87Å; R603-K606 PolarHBondContact O-N 3.2Å; K606-W608 VanDerWaalsContact C-N 3.32Å; K606-W608 PolarHBondContact O-N 3.26Å; K606-S609 WeakPolarHBondContact O-CB 2.97Å; K606-S609 PolarHBondContact O-N 2.92Å; K606-S609 VanDerWaalsContact O-N 3.16Å; K606-E610 WeakPolarHBondContact CE-OE1 3.46Å; K606-E610 WeakPolarHBondContact CG-OE1 3.15Å; K606-E610 WeakPolarHBondContact O-CG 3.16Å; K606-E610 PolarHBondContact O-N 3.48Å
607	R	80.4	Confident	78.3	Confident	122 Å²	122	46.9 Å²	46.9	46%	0.46	21%	0.213	S	C	.	.	H	α-helix	trans	-61.6	-36.8	175.3	-77.1	-177.5	168.9	179.8	-3.8	112.7	E581 R603 P604 E610 H611	E581-R607 IonicContact OE1-NH1 3.12Å; E581-R607 PolarHBondContact OE1-NH1 2.95Å; E581-R607 VanDerWaalsContact OE2-CD 3.23Å; E581-R607 WeakPolarHBondContact OE2-CD 3.5Å; E581-R607 IonicContact OE2-CZ 2.66Å; E581-R607 IonicContact OE2-NE 3.57Å; E581-R607 IonicContact OE2-NH1 3.88Å; E581-R607 PolarHBondContact OE2-NH1 3.26Å; R603-R607 PolarHBondContact O-N 3.09Å; R603-R607 VanDerWaalsContact O-N 3.08Å; P604-R607 PolarHBondContact O-N 3.23Å; R607-E610 PolarHBondContact O-N 2.9Å; R607-H611 VanDerWaalsContact O-CB 3.32Å; R607-H611 WeakPolarHBondContact O-CB 3.34Å; R607-H611 VanDerWaalsContact O-CG 3.28Å; R607-H611 PolarHBondContact O-N 3.34Å
608	W	86	Confident	79.8	Confident	8 Å²	8	46.2 Å²	46.2	3%	0.03	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-38.5	173.6	174.1	89.7	0	0	0	112.2	F578 P604 L605 K606 S612 Y618 Y670 I673 V700	F578-W608 HydrophobicContact CB-CB 4.3Å; F578-W608 HydrophobicContact CB-CG 4.37Å; F578-W608 AromaticContact CD1-CD1 3.8Å; F578-W608 HydrophobicContact CD1-CG 4.36Å; F578-W608 HydrophobicContact CD2-CB 3.83Å; F578-W608 HydrophobicContact CD2-CG 4.27Å; F578-W608 HydrophobicContact CE2-CB 4.38Å; F578-W608 HydrophobicContact CG-CB 4.06Å; F578-W608 AromaticContact CG-CD1 3.7Å; F578-W608 HydrophobicContact CG-CG 4.09Å; P604-W608 WeakPolarHBondContact O-CB 3.26Å; P604-W608 PolarHBondContact O-N 2.91Å; L605-W608 PolarHBondContact O-N 3.49Å; K606-W608 VanDerWaalsContact C-N 3.32Å; K606-W608 PolarHBondContact O-N 3.26Å; W608-S612 WeakPolarHBondContact O-CB 3.36Å; W608-S612 PolarHBondContact O-N 3.42Å; W608-S612 PolarHBondContact O-OG 2.86Å; W608-Y618 AromaticContact CZ2-CE2 3.98Å; W608-Y618 HydrophobicContact CZ2-CE2 3.98Å; W608-Y618 PolarHBondContact NE1-OH 2.93Å; W608-Y670 HydrophobicContact CH2-CE2 4.03Å; W608-Y670 HydrophobicContact CZ2-CD2 4.41Å; W608-Y670 HydrophobicContact CZ2-CE2 4.16Å; W608-I673 HydrophobicContact CH2-CG2 4.03Å; W608-I673 HydrophobicContact CZ2-CG1 4.43Å; W608-I673 HydrophobicContact CZ2-CG2 4.49Å; W608-V700 HydrophobicContact CH2-CG2 4.04Å; W608-V700 HydrophobicContact CZ3-CG2 3.79Å
609	S	81.3	Confident	81	Confident	14 Å²	14	46.3 Å²	46.3	10%	0.098	21%	0.209	C	C	.	.	H	α-helix	trans	-59.3	-50.2	170.5	-162	0	0	0	0	110.7	L605 K606 S612 K613 D614 K699	L605-S609 PolarHBondContact O-N 3.39Å; K606-S609 WeakPolarHBondContact O-CB 2.97Å; K606-S609 PolarHBondContact O-N 2.92Å; K606-S609 VanDerWaalsContact O-N 3.16Å; S609-S612 PolarHBondContact O-OG 3.33Å; S609-K613 PolarHBondContact O-N 2.65Å; S609-K613 VanDerWaalsContact O-N 3.13Å; S609-D614 PolarHBondContact O-N 3.37Å; S609-D614 PolarHBondContact OG-OD1 2.87Å; S609-K699 PolarHBondContact OG-NZ 3.39Å
610	E	81.8	Confident	82.2	Confident	109 Å²	109	46.8 Å²	46.8	51%	0.509	21%	0.211	S	C	.	.	H	α-helix	trans	-62.3	-45.1	179.9	-68.8	166	-176.8	0	0	112.5	K606 R607 K613	K606-E610 WeakPolarHBondContact CE-OE1 3.46Å; K606-E610 WeakPolarHBondContact CG-OE1 3.15Å; K606-E610 WeakPolarHBondContact O-CG 3.16Å; K606-E610 PolarHBondContact O-N 3.48Å; R607-E610 PolarHBondContact O-N 2.9Å; E610-K613 PolarHBondContact O-N 2.87Å
611	H	80.7	Confident	83.4	Confident	67 Å²	67	47 Å²	47	31%	0.31	21%	0.212	S	C	.	.	H	α-helix	trans	-72.2	-40	179.3	-70.3	-17.2	0	0	0	113.2	R607 K613 I617	R607-H611 VanDerWaalsContact O-CB 3.32Å; R607-H611 WeakPolarHBondContact O-CB 3.34Å; R607-H611 VanDerWaalsContact O-CG 3.28Å; R607-H611 PolarHBondContact O-N 3.34Å; H611-K613 PolarHBondContact O-N 3.46Å; H611-I617 WeakPolarHBondContact O-CD1 3.32Å
612	S	80.8	Confident	84.1	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.007	21%	0.214	C	C	.	.	H	α-helix	trans	-71.1	-8	174.7	68.6	0	0	0	0	113.6	W608 S609 G615 E616 I617	W608-S612 WeakPolarHBondContact O-CB 3.36Å; W608-S612 PolarHBondContact O-N 3.42Å; W608-S612 PolarHBondContact O-OG 2.86Å; S609-S612 PolarHBondContact O-OG 3.33Å; S612-G615 CarbonylContact O-C 3.53Å; S612-G615 PolarHBondContact O-N 2.88Å; S612-G615 PolarHBondContact OG-N 3.05Å; S612-E616 PolarHBondContact O-N 2.79Å; S612-I617 WeakPolarHBondContact O-CG1 3.27Å; S612-I617 PolarHBondContact O-N 3.1Å; S612-I617 VanDerWaalsContact O-N 3.12Å
613	K	82.7	Confident	84.8	Confident	126 Å²	126	46.9 Å²	46.9	55%	0.548	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	52.9	-171.5	-58.7	170.6	-172.3	163.1	0	110.6	S609 E610 H611 G615 E616 I617	S609-K613 PolarHBondContact O-N 2.65Å; S609-K613 VanDerWaalsContact O-N 3.13Å; E610-K613 PolarHBondContact O-N 2.87Å; H611-K613 PolarHBondContact O-N 3.46Å; K613-G615 PolarHBondContact O-N 3.38Å; K613-E616 HydrophobicContact CB-CB 4.26Å; K613-E616 WeakPolarHBondContact O-CB 3.41Å; K613-E616 WeakPolarHBondContact O-CG 3.24Å; K613-E616 PolarHBondContact O-N 2.65Å; K613-E616 VanDerWaalsContact O-N 3.12Å; K613-I617 HydrophobicContact CD-CD1 4.5Å; K613-I617 HydrophobicContact CD-CG1 4.41Å
614	D	81.5	Confident	85.3	Confident	73 Å²	73	41 Å²	41	39%	0.39	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	40.9	-179.5	-61.6	-17.3	0	0	0	112.8	S609 K699 S703	S609-D614 PolarHBondContact O-N 3.37Å; S609-D614 PolarHBondContact OG-OD1 2.87Å; D614-K699 WeakPolarHBondContact OD1-CE 3.14Å; D614-K699 IonicContact OD1-NZ 2.75Å; D614-K699 PolarHBondContact OD1-NZ 3.27Å; D614-K699 WeakPolarHBondContact OD2-CE 3.35Å; D614-K699 IonicContact OD2-NZ 2.92Å; D614-K699 PolarHBondContact OD2-NZ 3.35Å; D614-S703 PolarHBondContact O-OG 2.96Å
615	G	85	Confident	85.8	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.01	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.6	-16.2	179.2	0	0	0	0	0	116.1	S612 K613 I617 Y618 H619 Y670	S612-G615 CarbonylContact O-C 3.53Å; S612-G615 PolarHBondContact O-N 2.88Å; S612-G615 PolarHBondContact OG-N 3.05Å; K613-G615 PolarHBondContact O-N 3.38Å; G615-I617 PolarHBondContact O-N 3.47Å; G615-Y618 WeakPolarHBondContact O-CA 3.37Å; G615-Y618 WeakPolarHBondContact O-CB 3.33Å; G615-Y618 PolarHBondContact O-N 3.36Å; G615-H619 PolarHBondContact O-CD2 3.08Å; G615-H619 VanDerWaalsContact O-CD2 3.23Å; G615-H619 PolarHBondContact O-N 2.91Å; G615-Y670 WeakPolarHBondContact CA-OH 3.25Å
616	E	88.1	Confident	86.1	Confident	70 Å²	70	43.4 Å²	43.4	33%	0.327	20%	0.202	S	C	.	.	H	α-helix	trans	-59.1	-27.5	-173.5	-71.5	-66.6	107.8	0	0	114.1	S612 K613 H619 N620 K710	S612-E616 PolarHBondContact O-N 2.79Å; K613-E616 HydrophobicContact CB-CB 4.26Å; K613-E616 WeakPolarHBondContact O-CB 3.41Å; K613-E616 WeakPolarHBondContact O-CG 3.24Å; K613-E616 PolarHBondContact O-N 2.65Å; K613-E616 VanDerWaalsContact O-N 3.12Å; E616-H619 PolarHBondContact O-N 2.87Å; E616-H619 IonicContact OE1-CE1 2.72Å; E616-H619 IonicContact OE1-CG 3.64Å; E616-H619 IonicContact OE1-ND1 3.38Å; E616-H619 PolarHBondContact OE1-ND1 2.92Å; E616-N620 PolarHBondContact O-N 2.89Å; E616-N620 PolarHBondContact O-ND2 2.87Å; E616-K710 IonicContact OE1-NZ 3.45Å; E616-K710 PolarHBondContact OE1-NZ 3.02Å; E616-K710 IonicContact OE2-NZ 3.81Å; E616-K710 PolarHBondContact OE2-NZ 2.57Å
617	I	89.7	Confident	86.5	Confident	12 Å²	12	39.4 Å²	39.4	6%	0.062	19%	0.191	C	C	.	.	H	α-helix	trans	-67.1	-40.4	173.9	-65.2	-175.5	0	0	0	111.6	N567 D570 L571 V574 H611 S612 K613 G615	N567-I617 PolarHBondContact ND2-O 3.29Å; D570-I617 HydrophobicContact CB-CD1 4.47Å; D570-I617 HydrophobicContact CB-CG2 3.77Å; L571-I617 HydrophobicContact CD2-CG2 4.01Å; L571-I617 HydrophobicContact CG-CG2 4.37Å; V574-I617 HydrophobicContact CG2-CD1 3.86Å; V574-I617 HydrophobicContact CG2-CG2 4.33Å; H611-I617 WeakPolarHBondContact O-CD1 3.32Å; S612-I617 WeakPolarHBondContact O-CG1 3.27Å; S612-I617 PolarHBondContact O-N 3.1Å; S612-I617 VanDerWaalsContact O-N 3.12Å; K613-I617 HydrophobicContact CD-CD1 4.5Å; K613-I617 HydrophobicContact CD-CG1 4.41Å; G615-I617 PolarHBondContact O-N 3.47Å
618	Y	90.5	Very high	87	Confident	1 Å²	1	33.8 Å²	33.8	0%	0.004	17%	0.171	C	C	.	.	H	α-helix	trans	-69.8	-35.1	171.9	-67.3	-88.1	0	0	0	111.1	F531 L571 V574 W608 G615 Y621 C622 Y670	F531-Y618 HydrophobicContact CE1-CE1 4.47Å; L571-Y618 HydrophobicContact CD2-CD1 3.57Å; L571-Y618 HydrophobicContact CD2-CE1 3.7Å; L571-Y618 HydrophobicContact CD2-CG 4.03Å; V574-Y618 HydrophobicContact CG1-CE2 4.18Å; W608-Y618 AromaticContact CZ2-CE2 3.98Å; W608-Y618 HydrophobicContact CZ2-CE2 3.98Å; W608-Y618 PolarHBondContact NE1-OH 2.93Å; G615-Y618 WeakPolarHBondContact O-CA 3.37Å; G615-Y618 WeakPolarHBondContact O-CB 3.33Å; G615-Y618 PolarHBondContact O-N 3.36Å; Y618-Y621 PolarHBondContact O-N 3.48Å; Y618-C622 WeakPolarHBondContact O-CB 3.31Å; Y618-C622 PolarHBondContact O-N 2.88Å; Y618-C622 PolarHBondContact O-SG 2.55Å; Y618-Y670 AromaticContact CD1-CD2 3.79Å; Y618-Y670 HydrophobicContact CD1-CD2 3.79Å; Y618-Y670 AromaticContact CD1-CG 3.94Å; Y618-Y670 HydrophobicContact CD1-CG 3.94Å; Y618-Y670 AromaticContact CD2-CD2 3.6Å; Y618-Y670 HydrophobicContact CD2-CD2 3.6Å; Y618-Y670 AromaticContact CD2-CE2 3.65Å; Y618-Y670 HydrophobicContact CD2-CE2 3.65Å; Y618-Y670 HydrophobicContact CD2-CG 4.39Å; Y618-Y670 HydrophobicContact CE1-CD2 4.17Å; Y618-Y670 HydrophobicContact CE2-CD2 4Å; Y618-Y670 HydrophobicContact CE2-CE2 4.2Å; Y618-Y670 HydrophobicContact CG-CD1 4.44Å; Y618-Y670 AromaticContact CG-CD2 3.49Å; Y618-Y670 HydrophobicContact CG-CD2 3.49Å; Y618-Y670 VanDerWaalsContact CG-CD2 3.49Å; Y618-Y670 AromaticContact CG-CE2 3.9Å; Y618-Y670 HydrophobicContact CG-CE2 3.9Å; Y618-Y670 AromaticContact CG-CG 3.82Å; Y618-Y670 HydrophobicContact CG-CG 3.82Å
619	H	91.4	Very high	87.3	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-62.7	-45.2	178.8	-61.6	174.6	0	0	0	112.1	G615 E616 Y621 C622 L623 Y670 S703 L707	G615-H619 PolarHBondContact O-CD2 3.08Å; G615-H619 VanDerWaalsContact O-CD2 3.23Å; G615-H619 PolarHBondContact O-N 2.91Å; E616-H619 PolarHBondContact O-N 2.87Å; E616-H619 IonicContact OE1-CE1 2.72Å; E616-H619 IonicContact OE1-CG 3.64Å; E616-H619 IonicContact OE1-ND1 3.38Å; E616-H619 PolarHBondContact OE1-ND1 2.92Å; H619-Y621 VanDerWaalsContact C-N 3.33Å; H619-Y621 PolarHBondContact O-N 2.98Å; H619-C622 PolarHBondContact O-N 2.89Å; H619-L623 WeakPolarHBondContact O-CB 3.23Å; H619-L623 VanDerWaalsContact O-CG 3.25Å; H619-L623 WeakPolarHBondContact O-CG 3.1Å; H619-L623 PolarHBondContact O-N 3.16Å; H619-Y670 AromaticContact NE2-CE1 3.87Å; H619-S703 PolarHBondContact CE1-O 3.45Å; H619-S703 VanDerWaalsContact CE1-O 3.31Å; H619-S703 PolarHBondContact CE1-OG 2.87Å; H619-S703 PolarHBondContact NE2-O 2.93Å; H619-S703 PolarHBondContact NE2-OG 3.33Å; H619-L707 HydrophobicContact CB-CD1 3.93Å
620	N	90.8	Very high	87.6	Confident	76 Å²	76	38.3 Å²	38.3	41%	0.406	19%	0.194	S	C	.	.	H	α-helix	trans	-58.2	-43.7	176.9	-71.6	-32.6	0	0	0	112.3	E616 N624	E616-N620 PolarHBondContact O-N 2.89Å; E616-N620 PolarHBondContact O-ND2 2.87Å; N620-N624 PolarHBondContact O-N 3.43Å; N620-N624 VanDerWaalsContact O-N 3.11Å
621	Y	91.6	Very high	88	Confident	5 Å²	5	35.1 Å²	35.1	2%	0.02	18%	0.178	C	C	.	.	H	α-helix	trans	-63.5	-49	176.5	-174	-89.9	0	0	0	111.7	F565 N567 L571 Y618 H619 L623 N624 Y625 L663 P666	F565-Y621 WeakPolarHBondContact O-CE2 3.45Å; N567-Y621 VanDerWaalsContact OD1-CA 3.31Å; N567-Y621 WeakPolarHBondContact OD1-CA 3.27Å; N567-Y621 WeakPolarHBondContact OD1-CB 3.42Å; N567-Y621 PolarHBondContact OD1-N 2.75Å; N567-Y621 VanDerWaalsContact OD1-N 3.17Å; L571-Y621 HydrophobicContact CD1-CD1 4.3Å; L571-Y621 HydrophobicContact CD1-CD2 3.46Å; L571-Y621 VanDerWaalsContact CD1-CD2 3.46Å; L571-Y621 HydrophobicContact CD1-CE2 4.07Å; L571-Y621 HydrophobicContact CD1-CG 3.6Å; Y618-Y621 PolarHBondContact O-N 3.48Å; H619-Y621 VanDerWaalsContact C-N 3.33Å; H619-Y621 PolarHBondContact O-N 2.98Å; Y621-L623 VanDerWaalsContact C-N 3.27Å; Y621-L623 PolarHBondContact O-N 2.97Å; Y621-N624 PolarHBondContact O-N 2.96Å; Y621-N624 VanDerWaalsContact O-N 3.12Å; Y621-Y625 PolarHBondContact O-N 3.13Å; Y621-L663 WeakPolarHBondContact CE1-O 3.35Å; Y621-L663 PolarHBondContact OH-O 2.94Å; Y621-P666 HydrophobicContact CD1-CB 3.93Å; Y621-P666 HydrophobicContact CD1-CG 4.25Å; Y621-P666 HydrophobicContact CE1-CB 3.83Å; Y621-P666 HydrophobicContact CE1-CG 3.68Å; Y621-P666 HydrophobicContact CE2-CG 4.44Å
622	C	90.5	Very high	88.5	Confident	8 Å²	8	32 Å²	32	5%	0.054	16%	0.163	C	C	.	.	H	α-helix	trans	-67.8	-25.6	-176.8	-62.7	0	0	0	0	113	Y618 H619 M667 L707 M711	Y618-C622 WeakPolarHBondContact O-CB 3.31Å; Y618-C622 PolarHBondContact O-N 2.88Å; Y618-C622 PolarHBondContact O-SG 2.55Å; H619-C622 PolarHBondContact O-N 2.89Å; C622-M667 HydrophobicContact CB-SD 4.44Å; C622-L707 HydrophobicContact CB-CD1 4.1Å; C622-L707 HydrophobicContact CB-CD2 3.89Å; C622-M711 HydrophobicContact CB-CE 3.55Å; C622-M711 WeakPolarHBondContact O-CE 3.36Å
623	L	89.5	Confident	88.9	Confident	18 Å²	18	34.4 Å²	34.4	9%	0.094	18%	0.176	C	C	.	.	H	α-helix	trans	-79.3	-29.7	171.9	-68	168.2	0	0	0	112.7	L262 H619 Y621 L707 K710 M711 L714	L262-L623 HydrophobicContact CD1-CD1 4.48Å; H619-L623 WeakPolarHBondContact O-CB 3.23Å; H619-L623 VanDerWaalsContact O-CG 3.25Å; H619-L623 WeakPolarHBondContact O-CG 3.1Å; H619-L623 PolarHBondContact O-N 3.16Å; Y621-L623 VanDerWaalsContact C-N 3.27Å; Y621-L623 PolarHBondContact O-N 2.97Å; L623-L707 HydrophobicContact CG-CD1 4.27Å; L623-K710 HydrophobicContact CD1-CB 4.37Å; L623-K710 HydrophobicContact CD1-CD 4.49Å; L623-K710 HydrophobicContact CD2-CB 4.2Å; L623-M711 HydrophobicContact CD2-CG 3.94Å; L623-L714 HydrophobicContact CB-CD2 4.45Å; L623-L714 HydrophobicContact CD2-CD2 3.97Å
624	N	89.3	Confident	89.2	Confident	6 Å²	6	30.7 Å²	30.7	3%	0.032	17%	0.166	C	C	.	.	H	α-helix	trans	-73.7	-29.5	170.7	-178.2	55.1	0	0	0	112.9	Y259 H563 N620 Y621 D626 S627 A628	Y259-N624 HydrophobicContact CE1-CB 4.06Å; Y259-N624 PolarHBondContact OH-OD1 3.03Å; H563-N624 PolarHBondContact O-ND2 2.94Å; N620-N624 PolarHBondContact O-N 3.43Å; N620-N624 VanDerWaalsContact O-N 3.11Å; Y621-N624 PolarHBondContact O-N 2.96Å; Y621-N624 VanDerWaalsContact O-N 3.12Å; N624-D626 PolarHBondContact O-N 3.29Å; N624-D626 VanDerWaalsContact O-N 3.17Å; N624-S627 CarbonylContact O-C 3.58Å; N624-S627 WeakPolarHBondContact O-CA 3.29Å; N624-S627 WeakPolarHBondContact O-CB 3.19Å; N624-S627 PolarHBondContact O-N 3.22Å; N624-A628 PolarHBondContact O-N 3.18Å
625	Y	90.6	Very high	89.5	Confident	18 Å²	18	27.4 Å²	27.4	7%	0.071	15%	0.149	C	C	.	.	H	α-helix	trans	-50.2	-44.4	-167.8	173.5	-97.7	0	0	0	115.7	Y621 A628 L629 L663 V664 M667	Y621-Y625 PolarHBondContact O-N 3.13Å; Y625-A628 PolarHBondContact O-N 3.4Å; Y625-L629 HydrophobicContact CD1-CD1 4.43Å; Y625-L629 HydrophobicContact CE1-CD1 3.66Å; Y625-L629 HydrophobicContact CE1-CG 4.27Å; Y625-L629 HydrophobicContact CE2-CD1 4.32Å; Y625-L629 HydrophobicContact CE2-CD2 4.4Å; Y625-L629 HydrophobicContact CE2-CG 4.23Å; Y625-L629 PolarHBondContact O-N 2.9Å; Y625-L663 HydrophobicContact CE2-CB 4.38Å; Y625-V664 HydrophobicContact CE1-CG2 4.46Å; Y625-V664 HydrophobicContact CE2-CB 3.78Å; Y625-V664 HydrophobicContact CE2-CG2 4Å; Y625-V664 WeakPolarHBondContact OH-CB 3.33Å; Y625-V664 VanDerWaalsContact OH-CG2 3.3Å; Y625-V664 WeakPolarHBondContact OH-CG2 3.4Å; Y625-M667 HydrophobicContact CD1-SD 4.1Å; Y625-M667 HydrophobicContact CE1-SD 4.48Å; Y625-M667 HydrophobicContact CG-SD 4.36Å
626	D	87	Confident	89.7	Confident	38 Å²	38	29.6 Å²	29.6	20%	0.203	16%	0.157	C	C	.	.	H	α-helix	trans	-68.5	-41.3	179.1	-146.6	112.5	0	0	0	110.9	H22 W26 N624 A628 L629 N630	H22-D626 IonicContact CE1-OD1 3.49Å; H22-D626 IonicContact CE1-OD2 3.51Å; W26-D626 WeakPolarHBondContact CZ2-OD1 3.46Å; N624-D626 PolarHBondContact O-N 3.29Å; N624-D626 VanDerWaalsContact O-N 3.17Å; D626-A628 VanDerWaalsContact C-N 3.34Å; D626-A628 PolarHBondContact O-N 3.37Å; D626-L629 PolarHBondContact O-N 3.24Å; D626-N630 PolarHBondContact O-N 2.99Å; D626-N630 PolarHBondContact O-ND2 3.49Å; D626-N630 PolarHBondContact OD2-ND2 2.92Å
627	S	88.2	Confident	89.6	Confident	54 Å²	54	34.1 Å²	34.1	38%	0.378	18%	0.175	S	C	.	.	H	α-helix	trans	-61.4	-39.5	171.6	-75.3	0	0	0	0	112.5	N624 N630 Y631	N624-S627 CarbonylContact O-C 3.58Å; N624-S627 WeakPolarHBondContact O-CA 3.29Å; N624-S627 WeakPolarHBondContact O-CB 3.19Å; N624-S627 PolarHBondContact O-N 3.22Å; S627-N630 PolarHBondContact O-N 3.46Å; S627-Y631 WeakPolarHBondContact O-CB 3.47Å; S627-Y631 PolarHBondContact O-N 3.36Å
628	A	90.6	Very high	89.5	Confident	3 Å²	3	37.1 Å²	37.1	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-65.2	-38.8	177	0	0	0	0	0	112.6	H563 N624 Y625 D626 Y631 L632	H563-A628 WeakPolarHBondContact O-CB 3.26Å; N624-A628 PolarHBondContact O-N 3.18Å; Y625-A628 PolarHBondContact O-N 3.4Å; D626-A628 VanDerWaalsContact C-N 3.34Å; D626-A628 PolarHBondContact O-N 3.37Å; A628-Y631 PolarHBondContact O-N 3.28Å; A628-L632 WeakPolarHBondContact O-CB 3.35Å; A628-L632 PolarHBondContact O-N 3.38Å
629	L	91	Very high	89.3	Confident	19 Å²	19	43.9 Å²	43.9	10%	0.099	22%	0.223	C	C	.	.	H	α-helix	trans	-65.9	-48	172.9	-74.3	-174.6	0	0	0	112.1	Y625 D626 Y631 L632 D633 T660	Y625-L629 HydrophobicContact CD1-CD1 4.43Å; Y625-L629 HydrophobicContact CE1-CD1 3.66Å; Y625-L629 HydrophobicContact CE1-CG 4.27Å; Y625-L629 HydrophobicContact CE2-CD1 4.32Å; Y625-L629 HydrophobicContact CE2-CD2 4.4Å; Y625-L629 HydrophobicContact CE2-CG 4.23Å; Y625-L629 PolarHBondContact O-N 2.9Å; D626-L629 PolarHBondContact O-N 3.24Å; L629-Y631 PolarHBondContact O-N 3.13Å; L629-L632 PolarHBondContact O-N 3.34Å; L629-L632 VanDerWaalsContact O-N 3.09Å; L629-D633 PolarHBondContact O-N 3.46Å; L629-T660 HydrophobicContact CD2-CG2 4.13Å
630	N	89.1	Confident	89	Confident	98 Å²	98	47.2 Å²	47.2	52%	0.524	24%	0.238	S	C	.	.	H	α-helix	trans	-60.3	-33.9	177.1	-73.3	-65.5	0	0	0	111.5	D626 S627 S634	D626-N630 PolarHBondContact O-N 2.99Å; D626-N630 PolarHBondContact O-ND2 3.49Å; D626-N630 PolarHBondContact OD2-ND2 2.92Å; S627-N630 PolarHBondContact O-N 3.46Å; N630-S634 PolarHBondContact O-N 3.1Å
631	Y	89.6	Confident	88.9	Confident	42 Å²	42	43.6 Å²	43.6	17%	0.165	22%	0.219	C	C	.	.	H	α-helix	trans	-69.7	-45.4	171.7	-173.6	-130.4	0	0	0	112.2	F558 V559 E560 H563 L564 S627 A628 L629 D633 S634 L635	F558-Y631 PolarHBondContact O-OH 3.4Å; V559-Y631 WeakPolarHBondContact CA-OH 3.2Å; E560-Y631 HydrophobicContact CB-CE1 4.49Å; E560-Y631 PolarHBondContact N-OH 3.16Å; H563-Y631 HydrophobicContact CB-CD1 3.75Å; H563-Y631 HydrophobicContact CB-CE1 3.79Å; H563-Y631 HydrophobicContact CB-CG 4.47Å; L564-Y631 HydrophobicContact CB-CD1 4.32Å; L564-Y631 HydrophobicContact CB-CE1 4.47Å; S627-Y631 WeakPolarHBondContact O-CB 3.47Å; S627-Y631 PolarHBondContact O-N 3.36Å; A628-Y631 PolarHBondContact O-N 3.28Å; L629-Y631 PolarHBondContact O-N 3.13Å; Y631-D633 PolarHBondContact O-N 3.16Å; Y631-S634 CarbonylContact O-C 3.09Å; Y631-S634 WeakPolarHBondContact O-CA 3.42Å; Y631-S634 VanDerWaalsContact O-CB 3.28Å; Y631-S634 WeakPolarHBondContact O-CB 3.36Å; Y631-S634 PolarHBondContact O-N 2.71Å; Y631-S634 PolarHBondContact O-OG 2.78Å; Y631-L635 HydrophobicContact CD1-CD1 4.05Å; Y631-L635 HydrophobicContact CD2-CG 4.49Å; Y631-L635 HydrophobicContact CE1-CD1 3.8Å; Y631-L635 HydrophobicContact CE1-CG 4.38Å; Y631-L635 HydrophobicContact CE2-CD2 4.09Å; Y631-L635 HydrophobicContact CE2-CG 4.27Å; Y631-L635 WeakPolarHBondContact O-CG 3.47Å; Y631-L635 PolarHBondContact O-N 2.95Å
632	L	90.8	Very high	88.7	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-58.3	-43.8	176.2	178.4	57.5	0	0	0	112.5	L564 A628 L629 S634 L635 R636 F641 L659 T660 L663	L564-L632 HydrophobicContact CD1-CB 3.92Å; L564-L632 HydrophobicContact CD1-CD1 4.2Å; L564-L632 HydrophobicContact CD1-CG 4.46Å; A628-L632 WeakPolarHBondContact O-CB 3.35Å; A628-L632 PolarHBondContact O-N 3.38Å; L629-L632 PolarHBondContact O-N 3.34Å; L629-L632 VanDerWaalsContact O-N 3.09Å; L632-S634 PolarHBondContact O-N 3.14Å; L632-L635 PolarHBondContact O-N 2.9Å; L632-R636 HydrophobicContact CD1-CG 4.26Å; L632-R636 PolarHBondContact O-N 2.7Å; L632-F641 HydrophobicContact CD1-CE1 3.47Å; L632-F641 VanDerWaalsContact CD1-CE1 3.47Å; L632-F641 HydrophobicContact CD1-CZ 3.68Å; L632-L659 HydrophobicContact CD1-CD2 3.83Å; L632-L659 HydrophobicContact CD2-CD2 4.22Å; L632-L659 HydrophobicContact CD2-CG 4.21Å; L632-T660 HydrophobicContact CD2-CG2 3.69Å; L632-L663 HydrophobicContact CD2-CD1 3.83Å
633	D	89.8	Confident	88.5	Confident	52 Å²	52	46.8 Å²	46.8	28%	0.278	24%	0.235	S	C	.	.	H	α-helix	trans	-72.4	-8.4	174.5	-79.9	-6.1	0	0	0	113.2	L629 Y631 R636 K637	L629-D633 PolarHBondContact O-N 3.46Å; Y631-D633 PolarHBondContact O-N 3.16Å; D633-R636 IonicContact OD1-NH1 2.77Å; D633-K637 WeakPolarHBondContact O-CE 3.36Å; D633-K637 PolarHBondContact O-NZ 3.26Å
634	S	88.7	Confident	88.5	Confident	49 Å²	49	46.1 Å²	46.1	34%	0.343	23%	0.231	S	C	.	.	H	α-helix	trans	-84.7	-37.6	163.3	88	0	0	0	0	112.1	N630 Y631 L632 K637	N630-S634 PolarHBondContact O-N 3.1Å; Y631-S634 CarbonylContact O-C 3.09Å; Y631-S634 WeakPolarHBondContact O-CA 3.42Å; Y631-S634 VanDerWaalsContact O-CB 3.28Å; Y631-S634 WeakPolarHBondContact O-CB 3.36Å; Y631-S634 PolarHBondContact O-N 2.71Å; Y631-S634 PolarHBondContact O-OG 2.78Å; L632-S634 PolarHBondContact O-N 3.14Å; S634-K637 WeakPolarHBondContact O-CB 3.47Å; S634-K637 PolarHBondContact O-N 3.35Å
635	L	88.3	Confident	88.5	Confident	4 Å²	4	46.4 Å²	46.4	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-71.3	-39	179.2	-65.2	175.7	0	0	0	112.4	F558 V559 L564 Y631 L632 K637 L638 F641	F558-L635 HydrophobicContact CD2-CD2 3.96Å; F558-L635 HydrophobicContact CE2-CD2 4.07Å; V559-L635 HydrophobicContact CG1-CD1 3.8Å; V559-L635 HydrophobicContact CG2-CD1 4.47Å; V559-L635 HydrophobicContact CG2-CD2 4.14Å; L564-L635 HydrophobicContact CD2-CD1 4.39Å; Y631-L635 HydrophobicContact CD1-CD1 4.05Å; Y631-L635 HydrophobicContact CD2-CG 4.49Å; Y631-L635 HydrophobicContact CE1-CD1 3.8Å; Y631-L635 HydrophobicContact CE1-CG 4.38Å; Y631-L635 HydrophobicContact CE2-CD2 4.09Å; Y631-L635 HydrophobicContact CE2-CG 4.27Å; Y631-L635 WeakPolarHBondContact O-CG 3.47Å; Y631-L635 PolarHBondContact O-N 2.95Å; L632-L635 PolarHBondContact O-N 2.9Å; L635-K637 PolarHBondContact O-N 3.12Å; L635-L638 VanDerWaalsContact O-CB 3.31Å; L635-L638 WeakPolarHBondContact O-CB 3.37Å; L635-L638 PolarHBondContact O-N 2.85Å; L635-F641 HydrophobicContact CB-CB 4.46Å; L635-F641 HydrophobicContact CB-CD1 3.79Å; L635-F641 HydrophobicContact CB-CD2 4.05Å; L635-F641 HydrophobicContact CB-CE1 4.03Å; L635-F641 HydrophobicContact CB-CE2 4.26Å; L635-F641 HydrophobicContact CB-CG 3.81Å; L635-F641 HydrophobicContact CB-CZ 4.25Å; L635-F641 HydrophobicContact CD1-CD2 4.23Å; L635-F641 HydrophobicContact CD1-CE2 3.86Å; L635-F641 HydrophobicContact CD1-CZ 4.1Å; L635-F641 WeakPolarHBondContact O-CB 3.4Å
636	R	89	Confident	88.3	Confident	46 Å²	46	51.9 Å²	51.9	17%	0.174	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-7.4	175.6	-76.3	172.1	167.6	173.8	-7.6	115	L632 D633 L638 F641 N642 E645	L632-R636 HydrophobicContact CD1-CG 4.26Å; L632-R636 PolarHBondContact O-N 2.7Å; D633-R636 IonicContact OD1-NH1 2.77Å; R636-L638 VanDerWaalsContact C-N 3.28Å; R636-F641 HydrophobicContact CG-CD1 4.32Å; R636-F641 HydrophobicContact CG-CE1 4.31Å; R636-N642 WeakPolarHBondContact CA-OD1 2.9Å; R636-N642 PolarHBondContact O-ND2 2.74Å; R636-N642 PolarHBondContact O-OD1 3.13Å; R636-E645 WeakPolarHBondContact CG-OE2 3.48Å; R636-E645 IonicContact CZ-OE1 3.45Å; R636-E645 VanDerWaalsContact CZ-OE1 3.3Å; R636-E645 IonicContact CZ-OE2 3.28Å; R636-E645 IonicContact NE-OE1 3.97Å; R636-E645 PolarHBondContact NE-OE1 3.29Å; R636-E645 VanDerWaalsContact NE-OE1 3.12Å; R636-E645 IonicContact NE-OE2 2.77Å; R636-E645 PolarHBondContact NE-OE2 3.48Å; R636-E645 IonicContact NH2-OE1 3.68Å; R636-E645 PolarHBondContact NH2-OE1 2.68Å; R636-E645 IonicContact NH2-OE2 2.73Å
637	K	86.6	Confident	88.3	Confident	166 Å²	166	52.9 Å²	52.9	72%	0.722	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-6.1	169.7	-63.5	164.4	-177.7	135.7	0	112.6	D633 S634 L635	D633-K637 WeakPolarHBondContact O-CE 3.36Å; D633-K637 PolarHBondContact O-NZ 3.26Å; S634-K637 WeakPolarHBondContact O-CB 3.47Å; S634-K637 PolarHBondContact O-N 3.35Å; L635-K637 PolarHBondContact O-N 3.12Å
638	L	87.8	Confident	88.2	Confident	75 Å²	75	50.3 Å²	50.3	39%	0.393	24%	0.239	S	C	.	.	S	Bend	trans	-108.9	119.2	-178.5	-55.5	173.4	0	0	0	109.4	F558 L635 R636 H640 F641 N642	F558-L638 HydrophobicContact CD2-CD1 3.52Å; F558-L638 HydrophobicContact CE2-CB 4.36Å; F558-L638 HydrophobicContact CE2-CD1 3.37Å; F558-L638 HydrophobicContact CE2-CG 4.5Å; F558-L638 HydrophobicContact CG-CD1 4.23Å; F558-L638 HydrophobicContact CZ-CB 4.35Å; F558-L638 HydrophobicContact CZ-CD1 3.97Å; L635-L638 VanDerWaalsContact O-CB 3.31Å; L635-L638 WeakPolarHBondContact O-CB 3.37Å; L635-L638 PolarHBondContact O-N 2.85Å; R636-L638 VanDerWaalsContact C-N 3.28Å; L638-H640 VanDerWaalsContact C-N 3.33Å; L638-H640 PolarHBondContact O-N 3.2Å; L638-F641 HydrophobicContact CB-CB 4.46Å; L638-F641 WeakPolarHBondContact O-CB 3.45Å; L638-F641 PolarHBondContact O-N 3.12Å; L638-N642 PolarHBondContact O-N 2.79Å
639	E	85.6	Confident	88.1	Confident	143 Å²	143	52.7 Å²	52.7	67%	0.668	25%	0.25	S	C	*	.	H	α-helix	trans	-54.5	-45.4	-173.5	-172.8	165.4	-147.7	0	0	113	F641 N642 E643	E639-F641 PolarHBondContact O-N 3.2Å; E639-N642 CarbonylContact O-C 3.48Å; E639-N642 WeakPolarHBondContact O-CA 3.25Å; E639-N642 WeakPolarHBondContact O-CB 3.37Å; E639-N642 PolarHBondContact O-N 3.44Å; E639-E643 PolarHBondContact O-N 3.02Å
640	H	84.5	Confident	87.8	Confident	71 Å²	71	59 Å²	59	33%	0.329	28%	0.279	S	S	.	.	H	α-helix	trans	-59.7	-29.7	176.8	-59.8	-36.5	0	0	0	114.6	L472 L556 L638 E643 F644	L472-H640 HydrophobicContact CD1-CB 3.93Å; L556-H640 HydrophobicContact CD2-CB 4.16Å; L638-H640 VanDerWaalsContact C-N 3.33Å; L638-H640 PolarHBondContact O-N 3.2Å; H640-E643 WeakPolarHBondContact CA-OE2 3.41Å; H640-E643 IonicContact CE1-OE2 2.88Å; H640-E643 IonicContact CG-OE2 3.67Å; H640-E643 IonicContact ND1-OE2 3.43Å; H640-E643 PolarHBondContact ND1-OE2 3.24Å; H640-F644 PolarHBondContact O-N 2.9Å
641	F	88.3	Confident	87.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-75.7	-35.4	173.6	-173.6	-90.9	0	0	0	111.1	F558 V559 L564 L632 L635 R636 L638 E639 F644 E645 L659	F558-F641 HydrophobicContact CE2-CB 4.32Å; F558-F641 HydrophobicContact CZ-CB 4.38Å; V559-F641 HydrophobicContact CG1-CE2 4.38Å; V559-F641 HydrophobicContact CG2-CD2 3.82Å; V559-F641 HydrophobicContact CG2-CE2 4.22Å; L564-F641 HydrophobicContact CD2-CE2 4.42Å; L564-F641 HydrophobicContact CD2-CZ 4.27Å; L632-F641 HydrophobicContact CD1-CE1 3.47Å; L632-F641 VanDerWaalsContact CD1-CE1 3.47Å; L632-F641 HydrophobicContact CD1-CZ 3.68Å; L635-F641 HydrophobicContact CB-CB 4.46Å; L635-F641 HydrophobicContact CB-CD1 3.79Å; L635-F641 HydrophobicContact CB-CD2 4.05Å; L635-F641 HydrophobicContact CB-CE1 4.03Å; L635-F641 HydrophobicContact CB-CE2 4.26Å; L635-F641 HydrophobicContact CB-CG 3.81Å; L635-F641 HydrophobicContact CB-CZ 4.25Å; L635-F641 HydrophobicContact CD1-CD2 4.23Å; L635-F641 HydrophobicContact CD1-CE2 3.86Å; L635-F641 HydrophobicContact CD1-CZ 4.1Å; L635-F641 WeakPolarHBondContact O-CB 3.4Å; R636-F641 HydrophobicContact CG-CD1 4.32Å; R636-F641 HydrophobicContact CG-CE1 4.31Å; L638-F641 HydrophobicContact CB-CB 4.46Å; L638-F641 WeakPolarHBondContact O-CB 3.45Å; L638-F641 PolarHBondContact O-N 3.12Å; E639-F641 PolarHBondContact O-N 3.2Å; F641-F644 HydrophobicContact CD2-CD1 4.35Å; F641-F644 HydrophobicContact CE2-CD1 4.17Å; F641-F644 HydrophobicContact CE2-CE1 4.48Å; F641-F644 PolarHBondContact O-N 2.91Å; F641-E645 HydrophobicContact CD1-CB 4.49Å; F641-E645 HydrophobicContact CE1-CB 4.19Å; F641-E645 WeakPolarHBondContact O-CB 3.27Å; F641-E645 PolarHBondContact O-N 3.33Å; F641-L659 HydrophobicContact CZ-CD2 4.25Å
642	N	88.7	Confident	87.1	Confident	48 Å²	48	59.6 Å²	59.6	26%	0.257	29%	0.29	S	S	.	.	H	α-helix	trans	-69.7	-32.8	173.9	-63.7	-34.3	0	0	0	112.5	R636 L638 E639 K646	R636-N642 WeakPolarHBondContact CA-OD1 2.9Å; R636-N642 PolarHBondContact O-ND2 2.74Å; R636-N642 PolarHBondContact O-OD1 3.13Å; L638-N642 PolarHBondContact O-N 2.79Å; E639-N642 CarbonylContact O-C 3.48Å; E639-N642 WeakPolarHBondContact O-CA 3.25Å; E639-N642 WeakPolarHBondContact O-CB 3.37Å; E639-N642 PolarHBondContact O-N 3.44Å; N642-K646 WeakPolarHBondContact O-CB 3.46Å; N642-K646 WeakPolarHBondContact O-CD 3.45Å; N642-K646 WeakPolarHBondContact O-CG 3.2Å; N642-K646 PolarHBondContact O-N 2.98Å; N642-K646 VanDerWaalsContact O-N 3.16Å
643	E	86.3	Confident	86.6	Confident	32 Å²	32	62.3 Å²	62.3	15%	0.15	30%	0.3	C	S	.	.	H	α-helix	trans	-60.2	-48.7	169.5	-69.1	177.6	115.8	0	0	110.3	S469 L472 N473 E639 H640 W647	S469-E643 PolarHBondContact OG-OE1 3.26Å; L472-E643 HydrophobicContact CD2-CB 3.86Å; N473-E643 PolarHBondContact ND2-OE1 3.16Å; E639-E643 PolarHBondContact O-N 3.02Å; H640-E643 WeakPolarHBondContact CA-OE2 3.41Å; H640-E643 IonicContact CE1-OE2 2.88Å; H640-E643 IonicContact CG-OE2 3.67Å; H640-E643 IonicContact ND1-OE2 3.43Å; H640-E643 PolarHBondContact ND1-OE2 3.24Å; E643-W647 PolarHBondContact O-N 2.71Å; E643-W647 VanDerWaalsContact O-N 3.14Å
644	F	88.4	Confident	86.1	Confident	3 Å²	3	59.9 Å²	59.9	1%	0.013	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-48.3	177.2	170.8	-104	0	0	0	113.7	L476 P546 L547 L550 L556 H640 F641 K646 W647 C648	L476-F644 HydrophobicContact CD2-CD2 4.02Å; P546-F644 HydrophobicContact CB-CE2 4.14Å; L547-F644 HydrophobicContact CB-CE1 4.29Å; L547-F644 HydrophobicContact CB-CE2 4.46Å; L547-F644 HydrophobicContact CB-CZ 3.76Å; L547-F644 HydrophobicContact CD1-CE1 4.28Å; L547-F644 HydrophobicContact CD1-CZ 4.36Å; L550-F644 HydrophobicContact CD1-CD2 3.47Å; L550-F644 VanDerWaalsContact CD1-CD2 3.47Å; L550-F644 HydrophobicContact CD1-CE2 3.59Å; L556-F644 HydrophobicContact CD1-CB 3.73Å; L556-F644 HydrophobicContact CD1-CD1 3.92Å; L556-F644 HydrophobicContact CD1-CD2 3.71Å; L556-F644 HydrophobicContact CD1-CE1 4.49Å; L556-F644 HydrophobicContact CD1-CE2 4.3Å; L556-F644 HydrophobicContact CD1-CG 3.49Å; L556-F644 VanDerWaalsContact CD1-CG 3.49Å; H640-F644 PolarHBondContact O-N 2.9Å; F641-F644 HydrophobicContact CD2-CD1 4.35Å; F641-F644 HydrophobicContact CE2-CD1 4.17Å; F641-F644 HydrophobicContact CE2-CE1 4.48Å; F641-F644 PolarHBondContact O-N 2.91Å; F644-K646 VanDerWaalsContact C-N 3.32Å; F644-K646 PolarHBondContact O-N 2.73Å; F644-W647 WeakPolarHBondContact O-CB 3.46Å; F644-W647 PolarHBondContact O-N 3.25Å; F644-C648 WeakPolarHBondContact CE2-SG 3.49Å; F644-C648 WeakPolarHBondContact CZ-SG 3.46Å; F644-C648 PolarHBondContact O-N 3.2Å; F644-C648 PolarHBondContact O-SG 3.32Å; F644-C648 VanDerWaalsContact O-SG 3.35Å
645	E	89.6	Confident	85.7	Confident	12 Å²	12	63.7 Å²	63.7	6%	0.056	29%	0.294	C	S	.	.	H	α-helix	trans	-59.2	-43.7	179.9	-175.4	171.5	-152.1	0	0	110.7	R636 F641 W647 C648 E649 L659	R636-E645 WeakPolarHBondContact CG-OE2 3.48Å; R636-E645 IonicContact CZ-OE1 3.45Å; R636-E645 VanDerWaalsContact CZ-OE1 3.3Å; R636-E645 IonicContact CZ-OE2 3.28Å; R636-E645 IonicContact NE-OE1 3.97Å; R636-E645 PolarHBondContact NE-OE1 3.29Å; R636-E645 VanDerWaalsContact NE-OE1 3.12Å; R636-E645 IonicContact NE-OE2 2.77Å; R636-E645 PolarHBondContact NE-OE2 3.48Å; R636-E645 IonicContact NH2-OE1 3.68Å; R636-E645 PolarHBondContact NH2-OE1 2.68Å; R636-E645 IonicContact NH2-OE2 2.73Å; F641-E645 HydrophobicContact CD1-CB 4.49Å; F641-E645 HydrophobicContact CE1-CB 4.19Å; F641-E645 WeakPolarHBondContact O-CB 3.27Å; F641-E645 PolarHBondContact O-N 3.33Å; E645-W647 VanDerWaalsContact C-N 3.35Å; E645-W647 PolarHBondContact O-N 3.21Å; E645-C648 PolarHBondContact O-N 3.04Å; E645-E649 WeakPolarHBondContact O-CB 3.49Å; E645-E649 WeakPolarHBondContact O-CG 3.47Å; E645-E649 PolarHBondContact O-N 2.91Å; E645-L659 HydrophobicContact CG-CD2 4.49Å; E645-L659 WeakPolarHBondContact OE1-CB 3.09Å
646	K	87.4	Confident	85.3	Confident	134 Å²	134	75 Å²	75	58%	0.583	34%	0.336	S	S	*	.	H	α-helix	trans	-63.4	-35.8	174.1	-73.9	172.4	-176.9	174.2	0	113.4	N642 F644 Q650	N642-K646 WeakPolarHBondContact O-CB 3.46Å; N642-K646 WeakPolarHBondContact O-CD 3.45Å; N642-K646 WeakPolarHBondContact O-CG 3.2Å; N642-K646 PolarHBondContact O-N 2.98Å; N642-K646 VanDerWaalsContact O-N 3.16Å; F644-K646 VanDerWaalsContact C-N 3.32Å; F644-K646 PolarHBondContact O-N 2.73Å; K646-Q650 WeakPolarHBondContact O-CG 3.42Å; K646-Q650 PolarHBondContact O-N 3.19Å; K646-Q650 PolarHBondContact O-NE2 2.68Å
647	W	86.7	Confident	85.1	Confident	59 Å²	59	75.7 Å²	75.7	22%	0.223	34%	0.343	C	S	.	.	H	α-helix	trans	-68	-42.1	176.5	-177.8	92.3	0	0	0	110.9	L476 L479 P546 E643 F644 E645 Q650	L476-W647 HydrophobicContact CB-CD2 4.39Å; L476-W647 HydrophobicContact CB-CG 4.17Å; L476-W647 HydrophobicContact CD1-CB 4Å; L476-W647 HydrophobicContact CD1-CG 4.12Å; L476-W647 HydrophobicContact CD2-CB 4.36Å; L476-W647 HydrophobicContact CD2-CD2 3.97Å; L476-W647 HydrophobicContact CD2-CE3 4.18Å; L476-W647 HydrophobicContact CD2-CG 4.06Å; L476-W647 HydrophobicContact CG-CG 4.35Å; L476-W647 VanDerWaalsContact O-CZ2 3.26Å; L476-W647 WeakPolarHBondContact O-CZ2 3.46Å; L476-W647 PolarHBondContact O-NE1 2.9Å; L479-W647 HydrophobicContact CB-CH2 4.14Å; L479-W647 HydrophobicContact CB-CZ2 4.15Å; L479-W647 HydrophobicContact CD2-CH2 4.12Å; L479-W647 HydrophobicContact CD2-CZ3 4.31Å; P546-W647 HydrophobicContact CB-CZ3 4.23Å; E643-W647 PolarHBondContact O-N 2.71Å; E643-W647 VanDerWaalsContact O-N 3.14Å; F644-W647 WeakPolarHBondContact O-CB 3.46Å; F644-W647 PolarHBondContact O-N 3.25Å; E645-W647 VanDerWaalsContact C-N 3.35Å; E645-W647 PolarHBondContact O-N 3.21Å; W647-Q650 PolarHBondContact O-N 3.03Å
648	C	86.2	Confident	85.3	Confident	0 Å²	0	72 Å²	72	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-66.2	-41.4	174.4	-62.7	0	0	0	0	112.9	C542 F543 F644 E645 Q650 D651 C654	C542-C648 PolarHBondContact O-SG 2.9Å; F543-C648 HydrophobicContact CD1-CB 3.47Å; F543-C648 VanDerWaalsContact CD1-CB 3.47Å; F543-C648 HydrophobicContact CD2-CB 4.5Å; F543-C648 HydrophobicContact CE1-CB 3.24Å; F543-C648 HydrophobicContact CE2-CB 4.3Å; F543-C648 HydrophobicContact CG-CB 4.12Å; F543-C648 HydrophobicContact CZ-CB 3.7Å; F644-C648 WeakPolarHBondContact CE2-SG 3.49Å; F644-C648 WeakPolarHBondContact CZ-SG 3.46Å; F644-C648 PolarHBondContact O-N 3.2Å; F644-C648 PolarHBondContact O-SG 3.32Å; F644-C648 VanDerWaalsContact O-SG 3.35Å; E645-C648 PolarHBondContact O-N 3.04Å; C648-Q650 PolarHBondContact O-N 3.17Å; C648-D651 WeakPolarHBondContact O-CB 3.36Å; C648-D651 PolarHBondContact O-N 3.39Å; C648-D651 VanDerWaalsContact O-N 3.15Å; C648-C654 PolarHBondContact O-SG 3.35Å
649	E	87.3	Confident	85.3	Confident	53 Å²	53	68.5 Å²	68.5	25%	0.248	31%	0.31	C	S	.	.	H	α-helix	trans	-67.4	-16.4	176.9	-74.2	-172.1	161.1	0	0	113.5	E645 Q658 L659	E645-E649 WeakPolarHBondContact O-CB 3.49Å; E645-E649 WeakPolarHBondContact O-CG 3.47Å; E645-E649 PolarHBondContact O-N 2.91Å; E649-Q658 WeakPolarHBondContact OE1-CA 3.37Å; E649-Q658 VanDerWaalsContact OE1-CB 3.22Å; E649-Q658 WeakPolarHBondContact OE1-CB 3.31Å; E649-Q658 WeakPolarHBondContact OE1-CG 3.42Å; E649-Q658 PolarHBondContact OE1-NE2 3.21Å; E649-Q658 PolarHBondContact OE2-NE2 3.35Å; E649-L659 PolarHBondContact OE1-N 3.27Å
650	Q	84.6	Confident	85.6	Confident	150 Å²	150	62.5 Å²	62.5	70%	0.701	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-13.9	172.6	-80	167.4	81.7	0	0	113.8	K646 W647 C648 T652	K646-Q650 WeakPolarHBondContact O-CG 3.42Å; K646-Q650 PolarHBondContact O-N 3.19Å; K646-Q650 PolarHBondContact O-NE2 2.68Å; W647-Q650 PolarHBondContact O-N 3.03Å; C648-Q650 PolarHBondContact O-N 3.17Å; Q650-T652 PolarHBondContact O-N 2.97Å
651	D	83.1	Confident	85.9	Confident	26 Å²	26	61.8 Å²	61.8	14%	0.139	28%	0.282	C	S	.	.	S	Bend	trans	-64.6	127.7	176.2	-167.4	-44.1	0	0	0	110.1	C648 R653 C654	C648-D651 WeakPolarHBondContact O-CB 3.36Å; C648-D651 PolarHBondContact O-N 3.39Å; C648-D651 VanDerWaalsContact O-N 3.15Å; D651-R653 PolarHBondContact O-N 3.06Å; D651-R653 VanDerWaalsContact O-N 3.08Å; D651-R653 WeakPolarHBondContact OD1-CB 3.39Å; D651-R653 WeakPolarHBondContact OD1-CG 3.44Å; D651-R653 IonicContact OD1-CZ 2.95Å; D651-R653 PolarHBondContact OD1-N 2.85Å; D651-R653 IonicContact OD1-NE 3.84Å; D651-R653 PolarHBondContact OD1-NE 3.38Å; D651-R653 IonicContact OD2-CZ 2.69Å; D651-R653 VanDerWaalsContact OD2-CZ 3.25Å; D651-R653 IonicContact OD2-NE 3.83Å; D651-R653 PolarHBondContact OD2-NE 3.04Å; D651-R653 IonicContact OD2-NH2 2.81Å; D651-R653 PolarHBondContact OD2-NH2 3.43Å; D651-C654 WeakPolarHBondContact O-CB 3.46Å; D651-C654 PolarHBondContact O-N 3.47Å
652	T	82.3	Confident	86	Confident	128 Å²	128	61.9 Å²	61.9	79%	0.785	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-57.3	-28.2	-179.1	56.9	0	0	0	0	112.5	Q650 C654 R655	Q650-T652 PolarHBondContact O-N 2.97Å; T652-C654 VanDerWaalsContact C-N 3.26Å; T652-C654 PolarHBondContact O-N 3.13Å; T652-R655 PolarHBondContact O-N 2.92Å; T652-R655 VanDerWaalsContact O-N 3.13Å
653	R	80.1	Confident	86.2	Confident	57 Å²	57	59.6 Å²	59.6	22%	0.215	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-66.5	-26.4	177.8	-59.4	176.6	-65.7	165	6.8	112.6	S482 V538 C542 D651 R655	S482-R653 PolarHBondContact O-NH1 3.36Å; V538-R653 HydrophobicContact CG2-CB 4.34Å; V538-R653 WeakPolarHBondContact CG2-O 3.34Å; C542-R653 VanDerWaalsContact SG-CZ 3.55Å; C542-R653 PolarHBondContact SG-NH2 3.01Å; C542-R653 VanDerWaalsContact SG-NH2 3.36Å; D651-R653 PolarHBondContact O-N 3.06Å; D651-R653 VanDerWaalsContact O-N 3.08Å; D651-R653 WeakPolarHBondContact OD1-CB 3.39Å; D651-R653 WeakPolarHBondContact OD1-CG 3.44Å; D651-R653 IonicContact OD1-CZ 2.95Å; D651-R653 PolarHBondContact OD1-N 2.85Å; D651-R653 IonicContact OD1-NE 3.84Å; D651-R653 PolarHBondContact OD1-NE 3.38Å; D651-R653 IonicContact OD2-CZ 2.69Å; D651-R653 VanDerWaalsContact OD2-CZ 3.25Å; D651-R653 IonicContact OD2-NE 3.83Å; D651-R653 PolarHBondContact OD2-NE 3.04Å; D651-R653 IonicContact OD2-NH2 2.81Å; D651-R653 PolarHBondContact OD2-NH2 3.43Å; R653-R655 PolarHBondContact O-N 3.12Å
654	C	79.7	Confident	86.4	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.007	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-70.3	-11.5	174.4	-64.6	0	0	0	0	113.2	V538 C648 D651 T652 R656 L657	V538-C654 HydrophobicContact CG1-CB 4.34Å; C648-C654 PolarHBondContact O-SG 3.35Å; D651-C654 WeakPolarHBondContact O-CB 3.46Å; D651-C654 PolarHBondContact O-N 3.47Å; T652-C654 VanDerWaalsContact C-N 3.26Å; T652-C654 PolarHBondContact O-N 3.13Å; C654-R656 PolarHBondContact O-N 3.23Å; C654-L657 VanDerWaalsContact O-CB 3.31Å; C654-L657 WeakPolarHBondContact O-CB 3.45Å; C654-L657 PolarHBondContact O-N 2.96Å
655	R	78.5	Confident	86.6	Confident	130 Å²	130	58.8 Å²	58.8	49%	0.491	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	30.2	177.6	-63.7	-174.3	178	159.5	6.5	114.9	D534 T652 R653 L657	D534-R655 IonicContact OD1-CZ 3.3Å; D534-R655 IonicContact OD1-NH1 3.51Å; D534-R655 IonicContact OD1-NH2 3.1Å; D534-R655 PolarHBondContact OD1-NH2 3Å; D534-R655 IonicContact OD2-CZ 3.12Å; D534-R655 IonicContact OD2-NH1 2.7Å; D534-R655 PolarHBondContact OD2-NH1 3.31Å; D534-R655 IonicContact OD2-NH2 2.8Å; D534-R655 PolarHBondContact OD2-NH2 2.84Å; T652-R655 PolarHBondContact O-N 2.92Å; T652-R655 VanDerWaalsContact O-N 3.13Å; R653-R655 PolarHBondContact O-N 3.12Å; R655-L657 PolarHBondContact O-N 2.84Å
656	R	81	Confident	86.7	Confident	241 Å²	241	58.3 Å²	58.3	91%	0.909	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	13.8	-175.9	-38.6	170.6	85.8	169.8	7.8	114.4	C654	C654-R656 PolarHBondContact O-N 3.23Å
657	L	85.5	Confident	86.8	Confident	60 Å²	60	52.3 Å²	52.3	31%	0.314	24%	0.24	S	C	.	.			trans	-75.4	140.7	166.7	-61.9	174.7	0	0	0	109.8	C654 R655 L662	C654-L657 VanDerWaalsContact O-CB 3.31Å; C654-L657 WeakPolarHBondContact O-CB 3.45Å; C654-L657 PolarHBondContact O-N 2.96Å; R655-L657 PolarHBondContact O-N 2.84Å; L657-L662 HydrophobicContact CB-CD2 4.28Å; L657-L662 HydrophobicContact CB-CG 4.26Å; L657-L662 HydrophobicContact CD1-CD2 3.88Å
658	Q	88.9	Confident	87.1	Confident	89 Å²	89	54.5 Å²	54.5	42%	0.416	25%	0.253	S	S	.	.			trans	-82.5	159.5	175	-58.3	-147.2	-99.6	0	0	111.6	E649 T660 D661 L662	E649-Q658 WeakPolarHBondContact OE1-CA 3.37Å; E649-Q658 VanDerWaalsContact OE1-CB 3.22Å; E649-Q658 WeakPolarHBondContact OE1-CB 3.31Å; E649-Q658 WeakPolarHBondContact OE1-CG 3.42Å; E649-Q658 PolarHBondContact OE1-NE2 3.21Å; E649-Q658 PolarHBondContact OE2-NE2 3.35Å; Q658-T660 PolarHBondContact O-N 3.45Å; Q658-D661 PolarHBondContact O-N 3.47Å; Q658-L662 PolarHBondContact O-N 2.94Å
659	L	89.6	Confident	87.3	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-53.7	-38.2	174.7	177.5	55.4	0	0	0	112.1	L539 F543 F565 L632 F641 E645 E649 D661 L662 L663	L539-L659 HydrophobicContact CD1-CD1 3.57Å; F543-L659 HydrophobicContact CD1-CB 4.48Å; F543-L659 HydrophobicContact CD1-CD1 3.81Å; F543-L659 HydrophobicContact CD1-CD2 4.11Å; F543-L659 HydrophobicContact CD1-CG 4.35Å; F543-L659 HydrophobicContact CD2-CD1 4.45Å; F543-L659 HydrophobicContact CE1-CB 3.85Å; F543-L659 HydrophobicContact CE1-CD1 3.97Å; F543-L659 HydrophobicContact CE1-CD2 4.21Å; F543-L659 HydrophobicContact CE1-CG 4.22Å; F543-L659 HydrophobicContact CG-CD1 4.06Å; F543-L659 HydrophobicContact CZ-CB 4.22Å; F543-L659 HydrophobicContact CZ-CD1 4.38Å; F565-L659 HydrophobicContact CE1-CD1 4.24Å; L632-L659 HydrophobicContact CD1-CD2 3.83Å; L632-L659 HydrophobicContact CD2-CD2 4.22Å; L632-L659 HydrophobicContact CD2-CG 4.21Å; F641-L659 HydrophobicContact CZ-CD2 4.25Å; E645-L659 HydrophobicContact CG-CD2 4.49Å; E645-L659 WeakPolarHBondContact OE1-CB 3.09Å; E649-L659 PolarHBondContact OE1-N 3.27Å; L659-D661 PolarHBondContact O-N 2.86Å; L659-L662 PolarHBondContact O-N 2.9Å; L659-L663 HydrophobicContact CD1-CD1 4.09Å; L659-L663 HydrophobicContact CD1-CG 4.07Å; L659-L663 HydrophobicContact CG-CD1 4Å; L659-L663 HydrophobicContact CG-CG 4.46Å; L659-L663 WeakPolarHBondContact O-CB 3.48Å; L659-L663 VanDerWaalsContact O-CG 3.27Å; L659-L663 WeakPolarHBondContact O-CG 3.48Å; L659-L663 PolarHBondContact O-N 3.38Å
660	T	90.7	Very high	87.5	Confident	17 Å²	17	52.9 Å²	52.9	10%	0.104	25%	0.245	C	C	.	.	H	α-helix	trans	-65	-20.2	175.5	33.8	0	0	0	0	115.3	L629 L632 Q658	L629-T660 HydrophobicContact CD2-CG2 4.13Å; L632-T660 HydrophobicContact CD2-CG2 3.69Å; Q658-T660 PolarHBondContact O-N 3.45Å
661	D	90.6	Very high	87.8	Confident	57 Å²	57	48.2 Å²	48.2	31%	0.305	22%	0.224	S	C	.	.	H	α-helix	trans	-99	-29.1	179.6	-58.3	-49.1	0	0	0	111.4	K25 Q658 L659 V664 A665	K25-D661 IonicContact NZ-OD1 3.54Å; K25-D661 PolarHBondContact NZ-OD1 3.5Å; Q658-D661 PolarHBondContact O-N 3.47Å; L659-D661 PolarHBondContact O-N 2.86Å; D661-V664 WeakPolarHBondContact O-CG1 3.41Å; D661-A665 PolarHBondContact O-N 3.42Å
662	L	91.1	Very high	88.2	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-64.8	-41.7	165.1	-65.5	170.5	0	0	0	111.8	H535 V538 L539 F543 L657 Q658 L659 V664 A665	H535-L662 HydrophobicContact CB-CD2 4.46Å; V538-L662 HydrophobicContact CG1-CD1 3.78Å; V538-L662 HydrophobicContact CG1-CD2 4.17Å; L539-L662 HydrophobicContact CD1-CB 4.11Å; F543-L662 HydrophobicContact CD2-CD1 4.27Å; F543-L662 HydrophobicContact CE2-CD1 3.46Å; F543-L662 VanDerWaalsContact CE2-CD1 3.46Å; F543-L662 HydrophobicContact CZ-CD1 4.05Å; L657-L662 HydrophobicContact CB-CD2 4.28Å; L657-L662 HydrophobicContact CB-CG 4.26Å; L657-L662 HydrophobicContact CD1-CD2 3.88Å; Q658-L662 PolarHBondContact O-N 2.94Å; L659-L662 PolarHBondContact O-N 2.9Å; L662-V664 VanDerWaalsContact C-N 3.3Å; L662-V664 PolarHBondContact O-N 2.92Å; L662-A665 WeakPolarHBondContact O-CB 3.17Å; L662-A665 PolarHBondContact O-N 3.25Å
663	L	91.8	Very high	88.6	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-28	179.6	-76.6	169.2	0	0	0	113.9	L539 L564 F565 Y621 Y625 L632 L659	L539-L663 HydrophobicContact CD1-CD2 4.22Å; L539-L663 HydrophobicContact CD1-CG 4.41Å; L539-L663 HydrophobicContact CD2-CD2 4.14Å; L564-L663 HydrophobicContact CD1-CD1 4.16Å; L564-L663 WeakPolarHBondContact O-CD2 3.5Å; F565-L663 HydrophobicContact CD1-CD2 4.21Å; Y621-L663 WeakPolarHBondContact CE1-O 3.35Å; Y621-L663 PolarHBondContact OH-O 2.94Å; Y625-L663 HydrophobicContact CE2-CB 4.38Å; L632-L663 HydrophobicContact CD2-CD1 3.83Å; L659-L663 HydrophobicContact CD1-CD1 4.09Å; L659-L663 HydrophobicContact CD1-CG 4.07Å; L659-L663 HydrophobicContact CG-CD1 4Å; L659-L663 HydrophobicContact CG-CG 4.46Å; L659-L663 WeakPolarHBondContact O-CB 3.48Å; L659-L663 VanDerWaalsContact O-CG 3.27Å; L659-L663 WeakPolarHBondContact O-CG 3.48Å; L659-L663 PolarHBondContact O-N 3.38Å
664	V	91.8	Very high	89.2	Confident	13 Å²	13	42.2 Å²	42.2	8%	0.079	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-14.1	178.4	75.6	0	0	0	0	113	Y625 D661 L662 M667 Q668	Y625-V664 HydrophobicContact CE1-CG2 4.46Å; Y625-V664 HydrophobicContact CE2-CB 3.78Å; Y625-V664 HydrophobicContact CE2-CG2 4Å; Y625-V664 WeakPolarHBondContact OH-CB 3.33Å; Y625-V664 VanDerWaalsContact OH-CG2 3.3Å; Y625-V664 WeakPolarHBondContact OH-CG2 3.4Å; D661-V664 WeakPolarHBondContact O-CG1 3.41Å; L662-V664 VanDerWaalsContact C-N 3.3Å; L662-V664 PolarHBondContact O-N 2.92Å; V664-M667 PolarHBondContact O-N 3.13Å; V664-Q668 HydrophobicContact CG2-CG 4.24Å; V664-Q668 PolarHBondContact O-N 3.12Å; V664-Q668 VanDerWaalsContact O-N 3.1Å
665	A	91.9	Very high	89.8	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.033	21%	0.205	C	C	.	.	H	α-helix	trans	-58.5	-42.1	-174.5	0	0	0	0	0	114.6	H535 D661 L662 M667 Q668 H669	H535-A665 HydrophobicContact CB-CB 3.82Å; D661-A665 PolarHBondContact O-N 3.42Å; L662-A665 WeakPolarHBondContact O-CB 3.17Å; L662-A665 PolarHBondContact O-N 3.25Å; A665-M667 VanDerWaalsContact C-N 3.29Å; A665-M667 PolarHBondContact O-N 3.26Å; A665-Q668 PolarHBondContact O-N 3.23Å; A665-H669 VanDerWaalsContact O-CB 3.28Å; A665-H669 WeakPolarHBondContact O-CB 3.35Å; A665-H669 PolarHBondContact O-N 3.39Å
666	P	91	Very high	90.4	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.013	18%	0.182	C	C	.	.	H	α-helix	trans	-62	-36.9	178.9	-23.7	35	0	0	0	113.4	F531 L536 L571 Y621 Y670	F531-P666 VanDerWaalsContact CE2-CA 3.47Å; F531-P666 HydrophobicContact CE2-CB 4Å; F531-P666 HydrophobicContact CE2-CG 3.91Å; F531-P666 HydrophobicContact CZ-CB 3.81Å; F531-P666 HydrophobicContact CZ-CG 4.07Å; L536-P666 HydrophobicContact CD2-CG 3.98Å; L571-P666 HydrophobicContact CD1-CB 3.96Å; L571-P666 HydrophobicContact CD1-CG 4.21Å; Y621-P666 HydrophobicContact CD1-CB 3.93Å; Y621-P666 HydrophobicContact CD1-CG 4.25Å; Y621-P666 HydrophobicContact CE1-CB 3.83Å; Y621-P666 HydrophobicContact CE1-CG 3.68Å; Y621-P666 HydrophobicContact CE2-CG 4.44Å; P666-Y670 WeakPolarHBondContact O-CB 3.21Å; P666-Y670 PolarHBondContact O-N 3.02Å
667	M	90.7	Very high	90.9	Very high	8 Å²	8	27.9 Å²	27.9	4%	0.039	14%	0.139	C	C	.	.	H	α-helix	trans	-71	-41.2	178.8	-177.6	171.3	171.5	0	0	111.4	W26 L29 C622 Y625 V664 A665 M671 M711	W26-M667 HydrophobicContact CH2-CE 4.29Å; W26-M667 HydrophobicContact CZ3-CE 4.44Å; L29-M667 HydrophobicContact CD1-CE 3.78Å; L29-M667 HydrophobicContact CD2-CE 3.55Å; L29-M667 HydrophobicContact CG-CE 4.12Å; C622-M667 HydrophobicContact CB-SD 4.44Å; Y625-M667 HydrophobicContact CD1-SD 4.1Å; Y625-M667 HydrophobicContact CE1-SD 4.48Å; Y625-M667 HydrophobicContact CG-SD 4.36Å; V664-M667 PolarHBondContact O-N 3.13Å; A665-M667 VanDerWaalsContact C-N 3.29Å; A665-M667 PolarHBondContact O-N 3.26Å; M667-M671 HydrophobicContact CE-CE 4.32Å; M667-M671 HydrophobicContact CG-CE 3.76Å; M667-M671 WeakPolarHBondContact O-CE 3.42Å; M667-M671 PolarHBondContact O-N 3.26Å; M667-M711 HydrophobicContact CE-CE 3.75Å; M667-M711 HydrophobicContact CE-SD 4.4Å; M667-M711 HydrophobicContact SD-CE 4.4Å
668	Q	91.9	Very high	91.1	Very high	105 Å²	105	26.3 Å²	26.3	49%	0.491	13%	0.133	S	C	.	.	H	α-helix	trans	-65.7	-43.9	173.7	-70.2	176.9	-4.8	0	0	112.5	V664 A665 M671 K672	V664-Q668 HydrophobicContact CG2-CG 4.24Å; V664-Q668 PolarHBondContact O-N 3.12Å; V664-Q668 VanDerWaalsContact O-N 3.1Å; A665-Q668 PolarHBondContact O-N 3.23Å; Q668-M671 PolarHBondContact O-N 2.99Å; Q668-K672 PolarHBondContact O-N 3.31Å
669	H	91.9	Very high	91.1	Very high	16 Å²	16	23.2 Å²	23.2	7%	0.074	12%	0.121	C	C	.	.	H	α-helix	trans	-61.5	-46.8	178.7	165.3	87.5	0	0	0	111.3	E528 F531 A665 M671 K672 I673	E528-H669 IonicContact OE1-CE1 3.61Å; E528-H669 IonicContact OE1-NE2 2.71Å; E528-H669 IonicContact OE2-CE1 3.76Å; E528-H669 PolarHBondContact OE2-CE1 2.89Å; E528-H669 IonicContact OE2-NE2 3.76Å; E528-H669 PolarHBondContact OE2-NE2 3.42Å; F531-H669 HydrophobicContact CD1-CB 4.21Å; F531-H669 AromaticContact CD1-CD2 3.46Å; F531-H669 VanDerWaalsContact CD1-CD2 3.46Å; F531-H669 WeakPolarHBondContact CD1-CD2 3.48Å; F531-H669 AromaticContact CD1-CE1 3.57Å; F531-H669 AromaticContact CD1-CG 3.44Å; F531-H669 VanDerWaalsContact CD1-CG 3.44Å; F531-H669 AromaticContact CD1-ND1 3.51Å; F531-H669 AromaticContact CD1-NE2 3.56Å; F531-H669 HydrophobicContact CD2-CB 3.91Å; F531-H669 HydrophobicContact CE1-CB 4.35Å; F531-H669 AromaticContact CE1-CD2 3.42Å; F531-H669 VanDerWaalsContact CE1-CD2 3.42Å; F531-H669 WeakPolarHBondContact CE1-CD2 3.47Å; F531-H669 AromaticContact CE1-CG 3.76Å; F531-H669 AromaticContact CE1-NE2 3.8Å; F531-H669 HydrophobicContact CE2-CB 4.09Å; F531-H669 HydrophobicContact CG-CB 3.98Å; F531-H669 AromaticContact CG-CG 3.58Å; F531-H669 AromaticContact CG-ND1 3.58Å; F531-H669 HydrophobicContact CZ-CB 4.3Å; A665-H669 VanDerWaalsContact O-CB 3.28Å; A665-H669 WeakPolarHBondContact O-CB 3.35Å; A665-H669 PolarHBondContact O-N 3.39Å; H669-M671 VanDerWaalsContact C-N 3.28Å; H669-M671 PolarHBondContact O-N 2.71Å; H669-K672 WeakPolarHBondContact O-CA 3.49Å; H669-K672 WeakPolarHBondContact O-CB 3.32Å; H669-K672 PolarHBondContact O-N 2.85Å; H669-I673 PolarHBondContact O-N 3.24Å
670	Y	91.2	Very high	91.1	Very high	3 Å²	3	23.1 Å²	23.1	1%	0.012	12%	0.121	C	C	.	.	H	α-helix	trans	-60.1	-36.8	178.5	-168.4	-119.3	0	0	0	112.5	W608 G615 Y618 H619 P666 K672 I673 S703 L704	W608-Y670 HydrophobicContact CH2-CE2 4.03Å; W608-Y670 HydrophobicContact CZ2-CD2 4.41Å; W608-Y670 HydrophobicContact CZ2-CE2 4.16Å; G615-Y670 WeakPolarHBondContact CA-OH 3.25Å; Y618-Y670 AromaticContact CD1-CD2 3.79Å; Y618-Y670 HydrophobicContact CD1-CD2 3.79Å; Y618-Y670 AromaticContact CD1-CG 3.94Å; Y618-Y670 HydrophobicContact CD1-CG 3.94Å; Y618-Y670 AromaticContact CD2-CD2 3.6Å; Y618-Y670 HydrophobicContact CD2-CD2 3.6Å; Y618-Y670 AromaticContact CD2-CE2 3.65Å; Y618-Y670 HydrophobicContact CD2-CE2 3.65Å; Y618-Y670 HydrophobicContact CD2-CG 4.39Å; Y618-Y670 HydrophobicContact CE1-CD2 4.17Å; Y618-Y670 HydrophobicContact CE2-CD2 4Å; Y618-Y670 HydrophobicContact CE2-CE2 4.2Å; Y618-Y670 HydrophobicContact CG-CD1 4.44Å; Y618-Y670 AromaticContact CG-CD2 3.49Å; Y618-Y670 HydrophobicContact CG-CD2 3.49Å; Y618-Y670 VanDerWaalsContact CG-CD2 3.49Å; Y618-Y670 AromaticContact CG-CE2 3.9Å; Y618-Y670 HydrophobicContact CG-CE2 3.9Å; Y618-Y670 AromaticContact CG-CG 3.82Å; Y618-Y670 HydrophobicContact CG-CG 3.82Å; H619-Y670 AromaticContact NE2-CE1 3.87Å; P666-Y670 WeakPolarHBondContact O-CB 3.21Å; P666-Y670 PolarHBondContact O-N 3.02Å; Y670-K672 VanDerWaalsContact C-N 3.28Å; Y670-K672 PolarHBondContact O-N 3.43Å; Y670-I673 PolarHBondContact O-N 3.12Å; Y670-S703 WeakPolarHBondContact OH-CB 3.49Å; Y670-S703 PolarHBondContact OH-OG 2.77Å; Y670-L704 HydrophobicContact CD1-CD2 3.45Å; Y670-L704 VanDerWaalsContact CD1-CD2 3.45Å; Y670-L704 HydrophobicContact CD1-CG 4.21Å; Y670-L704 HydrophobicContact CE1-CD2 3.53Å; Y670-L704 HydrophobicContact CE1-CG 3.85Å; Y670-L704 HydrophobicContact CG-CD2 4.45Å
671	M	90.2	Very high	90.9	Very high	53 Å²	53	26.3 Å²	26.3	26%	0.261	13%	0.131	S	C	.	.	H	α-helix	trans	-68.5	-18.7	171.6	-79	-178.9	-84.1	0	0	114.4	L29 M667 Q668 H669 L704	L29-M671 HydrophobicContact CD2-CE 3.84Å; L29-M671 HydrophobicContact CD2-SD 3.73Å; L29-M671 HydrophobicContact CG-CE 3.88Å; L29-M671 HydrophobicContact CG-SD 3.9Å; M667-M671 HydrophobicContact CE-CE 4.32Å; M667-M671 HydrophobicContact CG-CE 3.76Å; M667-M671 WeakPolarHBondContact O-CE 3.42Å; M667-M671 PolarHBondContact O-N 3.26Å; Q668-M671 PolarHBondContact O-N 2.99Å; H669-M671 VanDerWaalsContact C-N 3.28Å; H669-M671 PolarHBondContact O-N 2.71Å; M671-L704 HydrophobicContact CG-CD2 4.11Å
672	K	92	Very high	90.8	Very high	69 Å²	69	28.3 Å²	28.3	30%	0.3	13%	0.134	S	C	.	.	H	α-helix	trans	-81.9	-30.2	176.1	-162.5	-166.9	172.2	-161.8	0	112.6	E523 Q668 H669 Y670 L675 L676	E523-K672 WeakPolarHBondContact OE1-CE 3.5Å; E523-K672 IonicContact OE1-NZ 3.98Å; E523-K672 PolarHBondContact OE1-NZ 2.81Å; Q668-K672 PolarHBondContact O-N 3.31Å; H669-K672 WeakPolarHBondContact O-CA 3.49Å; H669-K672 WeakPolarHBondContact O-CB 3.32Å; H669-K672 PolarHBondContact O-N 2.85Å; Y670-K672 VanDerWaalsContact C-N 3.28Å; Y670-K672 PolarHBondContact O-N 3.43Å; K672-L675 WeakPolarHBondContact O-CB 3.33Å; K672-L675 PolarHBondContact O-N 3.23Å; K672-L676 HydrophobicContact CD-CD1 3.91Å; K672-L676 HydrophobicContact CD-CG 4.34Å; K672-L676 HydrophobicContact CG-CD1 4.07Å; K672-L676 HydrophobicContact CG-CG 4.3Å; K672-L676 PolarHBondContact O-N 2.92Å
673	I	91	Very high	90.5	Very high	4 Å²	4	30.6 Å²	30.6	2%	0.021	14%	0.143	C	C	.	.	H	α-helix	trans	-49.9	-46.2	-174.7	-63.6	-59.6	0	0	0	113.7	L524 W608 H669 Y670 L675 L676 L677 V700	L524-I673 HydrophobicContact CD1-CD1 4.1Å; W608-I673 HydrophobicContact CH2-CG2 4.03Å; W608-I673 HydrophobicContact CZ2-CG1 4.43Å; W608-I673 HydrophobicContact CZ2-CG2 4.49Å; H669-I673 PolarHBondContact O-N 3.24Å; Y670-I673 PolarHBondContact O-N 3.12Å; I673-L675 VanDerWaalsContact C-N 3.27Å; I673-L675 PolarHBondContact O-N 3.24Å; I673-L676 HydrophobicContact CD1-CD1 4.4Å; I673-L676 PolarHBondContact O-N 3.28Å; I673-L677 HydrophobicContact CG2-CD1 3.79Å; I673-L677 HydrophobicContact CG2-CG 4.17Å; I673-L677 WeakPolarHBondContact O-CG 3.37Å; I673-L677 PolarHBondContact O-N 2.65Å; I673-V700 HydrophobicContact CG2-CG1 4.31Å
674	P	91.6	Very high	90.1	Very high	11 Å²	11	30.6 Å²	30.6	7%	0.071	14%	0.143	C	C	.	.	H	α-helix	trans	-60.5	-30.7	176.5	-23.5	33.1	0	0	0	114.6	S678 V700 E701 L704	P674-S678 WeakPolarHBondContact O-CB 3.36Å; P674-S678 PolarHBondContact O-N 2.99Å; P674-V700 HydrophobicContact CG-CG1 3.89Å; P674-E701 HydrophobicContact CB-CG 4.2Å; P674-L704 HydrophobicContact CG-CD1 3.45Å; P674-L704 VanDerWaalsContact CG-CD1 3.45Å
675	L	92.5	Very high	89.5	Confident	68 Å²	68	32.9 Å²	32.9	36%	0.356	16%	0.163	S	C	.	.	H	α-helix	trans	-73.3	-35.9	179.9	-60.5	176.4	0	0	0	112	A36 K672 I673 S679	A36-L675 HydrophobicContact CB-CD2 3.68Å; K672-L675 WeakPolarHBondContact O-CB 3.33Å; K672-L675 PolarHBondContact O-N 3.23Å; I673-L675 VanDerWaalsContact C-N 3.27Å; I673-L675 PolarHBondContact O-N 3.24Å; L675-S679 WeakPolarHBondContact O-CB 3.33Å; L675-S679 PolarHBondContact O-N 3.44Å; L675-S679 VanDerWaalsContact O-N 3.12Å; L675-S679 PolarHBondContact O-OG 2.8Å
676	L	91.4	Very high	89	Confident	3 Å²	3	35.6 Å²	35.6	2%	0.016	18%	0.181	C	C	.	.	H	α-helix	trans	-68.8	-53.1	174.5	-69.7	161.6	0	0	0	110.1	E523 L524 S527 K672 I673 S678 S679 I680	E523-L676 HydrophobicContact CB-CD2 4.16Å; E523-L676 VanDerWaalsContact CD-CD2 3.49Å; E523-L676 HydrophobicContact CG-CD2 4.05Å; E523-L676 WeakPolarHBondContact OE1-CD2 3.4Å; L524-L676 HydrophobicContact CB-CB 4.49Å; L524-L676 HydrophobicContact CD1-CB 4.13Å; L524-L676 HydrophobicContact CD1-CD1 3.86Å; S527-L676 WeakPolarHBondContact OG-CD1 3.46Å; K672-L676 HydrophobicContact CD-CD1 3.91Å; K672-L676 HydrophobicContact CD-CG 4.34Å; K672-L676 HydrophobicContact CG-CD1 4.07Å; K672-L676 HydrophobicContact CG-CG 4.3Å; K672-L676 PolarHBondContact O-N 2.92Å; I673-L676 HydrophobicContact CD1-CD1 4.4Å; I673-L676 PolarHBondContact O-N 3.28Å; L676-S678 VanDerWaalsContact C-N 3.32Å; L676-S678 PolarHBondContact O-N 3.33Å; L676-S679 WeakPolarHBondContact O-CA 3.4Å; L676-S679 PolarHBondContact O-N 3.06Å; L676-I680 PolarHBondContact O-N 3.15Å
677	L	90.6	Very high	88.6	Confident	1 Å²	1	39 Å²	39	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-57.5	-42.4	175.8	-65.9	177.4	0	0	0	112.2	L524 L605 I673 S679 I680 R681 V700	L524-L677 HydrophobicContact CD2-CD2 4.4Å; L605-L677 HydrophobicContact CD1-CD2 3.74Å; L605-L677 HydrophobicContact CD2-CD2 3.88Å; L605-L677 HydrophobicContact CG-CD2 4.5Å; I673-L677 HydrophobicContact CG2-CD1 3.79Å; I673-L677 HydrophobicContact CG2-CG 4.17Å; I673-L677 WeakPolarHBondContact O-CG 3.37Å; I673-L677 PolarHBondContact O-N 2.65Å; L677-S679 PolarHBondContact O-N 3.25Å; L677-I680 PolarHBondContact O-N 3.28Å; L677-R681 VanDerWaalsContact O-CB 3.25Å; L677-R681 WeakPolarHBondContact O-CB 3.23Å; L677-R681 PolarHBondContact O-N 3.3Å; L677-V700 HydrophobicContact CD1-CG2 4.37Å
678	S	91.1	Very high	88.2	Confident	26 Å²	26	41.1 Å²	41.1	18%	0.182	22%	0.224	C	C	.	.	H	α-helix	trans	-64.7	-27.5	175.6	-173.8	0	0	0	0	113.1	P674 L676 R682	P674-S678 WeakPolarHBondContact O-CB 3.36Å; P674-S678 PolarHBondContact O-N 2.99Å; L676-S678 VanDerWaalsContact C-N 3.32Å; L676-S678 PolarHBondContact O-N 3.33Å; S678-R682 WeakPolarHBondContact O-CB 3.42Å; S678-R682 PolarHBondContact O-N 2.82Å
679	S	89.5	Confident	87.7	Confident	24 Å²	24	37.5 Å²	37.5	17%	0.168	21%	0.207	C	C	.	.	H	α-helix	trans	-80.7	-43.2	176.1	-65.4	0	0	0	0	112.1	L675 L676 L677 R682 Y683	L675-S679 WeakPolarHBondContact O-CB 3.33Å; L675-S679 PolarHBondContact O-N 3.44Å; L675-S679 VanDerWaalsContact O-N 3.12Å; L675-S679 PolarHBondContact O-OG 2.8Å; L676-S679 WeakPolarHBondContact O-CA 3.4Å; L676-S679 PolarHBondContact O-N 3.06Å; L677-S679 PolarHBondContact O-N 3.25Å; S679-R682 WeakPolarHBondContact O-CB 3.47Å; S679-R682 PolarHBondContact O-N 3.06Å; S679-R682 PolarHBondContact OG-NH1 3.21Å; S679-R682 VanDerWaalsContact OG-NH1 3.11Å; S679-R682 PolarHBondContact OG-NH2 3.46Å; S679-Y683 WeakPolarHBondContact O-CD2 3.16Å; S679-Y683 PolarHBondContact O-N 3.15Å
680	I	88.1	Confident	87.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-56.8	-52.8	171.7	-62.8	163.7	0	0	0	109.7	A520 V521 L524 L601 L676 L677 R682 Y683 T684 L693	A520-I680 HydrophobicContact CB-CG1 3.73Å; V521-I680 HydrophobicContact CG2-CG2 4.34Å; L524-I680 HydrophobicContact CB-CD1 4.08Å; L524-I680 HydrophobicContact CD2-CD1 3.62Å; L601-I680 HydrophobicContact CD1-CD1 3.96Å; L601-I680 HydrophobicContact CD1-CG2 3.78Å; L676-I680 PolarHBondContact O-N 3.15Å; L677-I680 PolarHBondContact O-N 3.28Å; I680-R682 PolarHBondContact O-N 3.28Å; I680-R682 VanDerWaalsContact O-N 3.13Å; I680-Y683 PolarHBondContact O-N 3.31Å; I680-T684 PolarHBondContact O-N 2.75Å; I680-T684 PolarHBondContact O-OG1 3.36Å; I680-L693 HydrophobicContact CG2-CD1 3.88Å
681	R	87.7	Confident	87.2	Confident	84 Å²	84	44.7 Å²	44.7	32%	0.317	24%	0.241	S	C	.	.	H	α-helix	trans	-55.5	-33.4	179	-167.4	-170.9	82.1	111.4	9.6	113.7	L677 Y683 Q690 L693 T694	L677-R681 VanDerWaalsContact O-CB 3.25Å; L677-R681 WeakPolarHBondContact O-CB 3.23Å; L677-R681 PolarHBondContact O-N 3.3Å; R681-Y683 VanDerWaalsContact C-N 3.26Å; R681-Y683 PolarHBondContact O-N 2.98Å; R681-Q690 HydrophobicContact CG-CB 4.39Å; R681-Q690 HydrophobicContact CG-CG 4.42Å; R681-Q690 PolarHBondContact O-NE2 2.87Å; R681-L693 HydrophobicContact CB-CB 4.1Å; R681-L693 HydrophobicContact CB-CD1 3.93Å; R681-L693 HydrophobicContact CG-CB 3.9Å; R681-L693 HydrophobicContact CG-CD1 4.31Å; R681-T694 WeakPolarHBondContact CD-OG1 3.47Å; R681-T694 PolarHBondContact NH1-OG1 3.28Å
682	R	88	Confident	87	Confident	98 Å²	98	46.7 Å²	46.7	37%	0.37	25%	0.251	S	S	.	.	H	α-helix	trans	-67.9	-25.7	177.4	179.9	177.3	69.8	-118.7	1.3	112.5	S678 S679 I680	S678-R682 WeakPolarHBondContact O-CB 3.42Å; S678-R682 PolarHBondContact O-N 2.82Å; S679-R682 WeakPolarHBondContact O-CB 3.47Å; S679-R682 PolarHBondContact O-N 3.06Å; S679-R682 PolarHBondContact OG-NH1 3.21Å; S679-R682 VanDerWaalsContact OG-NH1 3.11Å; S679-R682 PolarHBondContact OG-NH2 3.46Å; I680-R682 PolarHBondContact O-N 3.28Å; I680-R682 VanDerWaalsContact O-N 3.13Å
683	Y	84.5	Confident	86.7	Confident	50 Å²	50	43.4 Å²	43.4	20%	0.196	24%	0.236	C	C	.	.	H	α-helix	trans	-102.2	-32.1	-178.8	-60.8	-59.8	0	0	0	112.8	R513 R516 A520 S679 I680 R681 A685	R513-Y683 WeakPolarHBondContact CD-O 3.22Å; R513-Y683 WeakPolarHBondContact CG-O 3.19Å; R513-Y683 PolarHBondContact NE-O 3.42Å; R516-Y683 HydrophobicContact CB-CD1 3.66Å; R516-Y683 HydrophobicContact CB-CD2 4.04Å; R516-Y683 HydrophobicContact CB-CE1 3.68Å; R516-Y683 HydrophobicContact CB-CE2 4.08Å; R516-Y683 HydrophobicContact CB-CG 3.86Å; R516-Y683 HydrophobicContact CG-CE1 4.34Å; R516-Y683 WeakPolarHBondContact O-CD2 3.26Å; A520-Y683 HydrophobicContact CB-CD2 4.26Å; S679-Y683 WeakPolarHBondContact O-CD2 3.16Å; S679-Y683 PolarHBondContact O-N 3.15Å; I680-Y683 PolarHBondContact O-N 3.31Å; R681-Y683 VanDerWaalsContact C-N 3.26Å; R681-Y683 PolarHBondContact O-N 2.98Å; Y683-A685 PolarHBondContact O-N 2.59Å
684	T	83.5	Confident	86.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.249	C	C	.	.			trans	-39.5	130.6	168	-64.2	0	0	0	0	112.9	R513 T598 I680 E689 Q690 L693	R513-T684 PolarHBondContact NH2-O 3.36Å; T598-T684 HydrophobicContact CG2-CG2 4.47Å; T598-T684 WeakPolarHBondContact OG1-CG2 3.42Å; T598-T684 PolarHBondContact OG1-OG1 2.82Å; I680-T684 PolarHBondContact O-N 2.75Å; I680-T684 PolarHBondContact O-OG1 3.36Å; T684-E689 HydrophobicContact CG2-CB 3.43Å; T684-E689 VanDerWaalsContact CG2-CB 3.43Å; T684-E689 HydrophobicContact CG2-CG 4.49Å; T684-E689 WeakPolarHBondContact CG2-OE2 3.18Å; T684-Q690 HydrophobicContact CG2-CG 3.76Å; T684-Q690 PolarHBondContact O-NE2 2.87Å; T684-L693 HydrophobicContact CG2-CD1 4.44Å; T684-L693 WeakPolarHBondContact OG1-CD1 3.29Å
685	A	80	Confident	86.5	Confident	61 Å²	61	47.9 Å²	47.9	50%	0.504	27%	0.27	S	S	.	.			trans	-92.4	-41.1	-173.4	0	0	0	0	0	114.1	Y683	Y683-A685 PolarHBondContact O-N 2.59Å
686	C	80.6	Confident	86.2	Confident	61 Å²	61	45.7 Å²	45.7	41%	0.412	26%	0.26	S	S	.	.			trans	-76.2	139	-177.5	177.5	0	0	0	0	112.2	E689 Q690	C686-E689 HydrophobicContact CB-CB 4.02Å; C686-E689 HydrophobicContact CB-CG 3.72Å; C686-E689 PolarHBondContact O-N 3.29Å; C686-Q690 WeakPolarHBondContact O-CG 3.46Å; C686-Q690 PolarHBondContact O-N 3.17Å
687	S	83	Confident	86.2	Confident	75 Å²	75	46.1 Å²	46.1	52%	0.524	26%	0.263	S	S	.	.	H	α-helix	trans	-64.9	-49.1	179.5	-160.4	0	0	0	0	111.8	E689 Q690 E691	S687-E689 VanDerWaalsContact C-N 3.25Å; S687-E689 PolarHBondContact O-N 3.43Å; S687-Q690 CarbonylContact O-C 3.53Å; S687-Q690 WeakPolarHBondContact O-CA 3.33Å; S687-Q690 WeakPolarHBondContact O-CB 3.24Å; S687-Q690 PolarHBondContact O-N 3.05Å; S687-E691 VanDerWaalsContact C-OE1 3.25Å; S687-E691 WeakPolarHBondContact CB-OE1 3.41Å; S687-E691 WeakPolarHBondContact O-CG 3.29Å; S687-E691 PolarHBondContact O-N 2.89Å; S687-E691 PolarHBondContact OG-OE1 2.84Å
688	A	82.7	Confident	86.2	Confident	51 Å²	51	49 Å²	49	42%	0.421	28%	0.28	S	S	.	.	H	α-helix	trans	-58.3	-37.7	179.1	0	0	0	0	0	112.3	E691 M692	A688-E691 PolarHBondContact O-N 3.04Å; A688-M692 WeakPolarHBondContact O-CE 3.49Å; A688-M692 WeakPolarHBondContact O-CG 3.32Å; A688-M692 PolarHBondContact O-N 2.91Å
689	E	81.3	Confident	86.2	Confident	30 Å²	30	52.1 Å²	52.1	14%	0.14	29%	0.29	C	S	.	.	H	α-helix	trans	-67.1	-43.1	172.6	-64.6	-172	132.6	0	0	112.5	T598 T684 C686 S687 E691 M692 L693	T598-E689 VanDerWaalsContact CA-OE1 3.3Å; T598-E689 WeakPolarHBondContact CA-OE1 3.38Å; T598-E689 WeakPolarHBondContact CB-OE1 3.45Å; T598-E689 HydrophobicContact CG2-CB 4.2Å; T598-E689 PolarHBondContact N-OE1 3.44Å; T598-E689 PolarHBondContact OG1-OE1 3.11Å; T598-E689 VanDerWaalsContact OG1-OE1 3.13Å; T598-E689 PolarHBondContact OG1-OE2 3.12Å; T684-E689 HydrophobicContact CG2-CB 3.43Å; T684-E689 VanDerWaalsContact CG2-CB 3.43Å; T684-E689 HydrophobicContact CG2-CG 4.49Å; T684-E689 WeakPolarHBondContact CG2-OE2 3.18Å; C686-E689 HydrophobicContact CB-CB 4.02Å; C686-E689 HydrophobicContact CB-CG 3.72Å; C686-E689 PolarHBondContact O-N 3.29Å; S687-E689 VanDerWaalsContact C-N 3.25Å; S687-E689 PolarHBondContact O-N 3.43Å; E689-E691 VanDerWaalsContact C-N 3.29Å; E689-E691 PolarHBondContact O-N 2.99Å; E689-M692 PolarHBondContact O-N 3.39Å; E689-L693 WeakPolarHBondContact O-CB 3.4Å; E689-L693 WeakPolarHBondContact O-CG 3.3Å; E689-L693 PolarHBondContact O-N 3.33Å
690	Q	86.5	Confident	86.2	Confident	55 Å²	55	51.2 Å²	51.2	26%	0.257	28%	0.284	S	S	.	.	H	α-helix	trans	-62.4	-36.4	174	-74.8	-164.8	4.1	0	0	112.2	R681 T684 C686 S687 T694	R681-Q690 HydrophobicContact CG-CB 4.39Å; R681-Q690 HydrophobicContact CG-CG 4.42Å; R681-Q690 PolarHBondContact O-NE2 2.87Å; T684-Q690 HydrophobicContact CG2-CG 3.76Å; T684-Q690 PolarHBondContact O-NE2 2.87Å; C686-Q690 WeakPolarHBondContact O-CG 3.46Å; C686-Q690 PolarHBondContact O-N 3.17Å; S687-Q690 CarbonylContact O-C 3.53Å; S687-Q690 WeakPolarHBondContact O-CA 3.33Å; S687-Q690 WeakPolarHBondContact O-CB 3.24Å; S687-Q690 PolarHBondContact O-N 3.05Å; Q690-T694 WeakPolarHBondContact O-CB 3.11Å; Q690-T694 PolarHBondContact O-N 3.44Å; Q690-T694 PolarHBondContact O-OG1 2.91Å
691	E	86.2	Confident	86.4	Confident	114 Å²	114	54.6 Å²	54.6	53%	0.533	30%	0.3	S	S	.	.	H	α-helix	trans	-68.2	-47.6	177.7	-72.6	158.6	-128.7	0	0	110.8	S687 A688 E689 L693 T694 A695	S687-E691 VanDerWaalsContact C-OE1 3.25Å; S687-E691 WeakPolarHBondContact CB-OE1 3.41Å; S687-E691 WeakPolarHBondContact O-CG 3.29Å; S687-E691 PolarHBondContact O-N 2.89Å; S687-E691 PolarHBondContact OG-OE1 2.84Å; A688-E691 PolarHBondContact O-N 3.04Å; E689-E691 VanDerWaalsContact C-N 3.29Å; E689-E691 PolarHBondContact O-N 2.99Å; E691-L693 PolarHBondContact O-N 2.96Å; E691-T694 CarbonylContact O-C 3.52Å; E691-T694 WeakPolarHBondContact O-CA 3.38Å; E691-T694 WeakPolarHBondContact O-CB 3.37Å; E691-T694 PolarHBondContact O-N 3.49Å; E691-A695 PolarHBondContact O-N 3.02Å
692	M	84.7	Confident	86.6	Confident	95 Å²	95	55.2 Å²	55.2	47%	0.468	31%	0.309	S	S	.	.	H	α-helix	trans	-61.4	-40.7	174	-71.6	-173.5	-78	0	0	112.4	L602 A688 E689 T694 A695 C696	L602-M692 HydrophobicContact CD1-CB 3.82Å; L602-M692 HydrophobicContact CD1-CE 3.62Å; L602-M692 HydrophobicContact CD1-CG 4.45Å; L602-M692 HydrophobicContact CD1-SD 3.84Å; L602-M692 HydrophobicContact CD2-CB 3.77Å; L602-M692 HydrophobicContact CG-CB 4.48Å; A688-M692 WeakPolarHBondContact O-CE 3.49Å; A688-M692 WeakPolarHBondContact O-CG 3.32Å; A688-M692 PolarHBondContact O-N 2.91Å; E689-M692 PolarHBondContact O-N 3.39Å; M692-T694 VanDerWaalsContact C-N 3.33Å; M692-T694 PolarHBondContact O-N 2.91Å; M692-A695 PolarHBondContact O-N 3.23Å; M692-C696 PolarHBondContact O-N 2.75Å
693	L	87.2	Confident	86.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.8	-32.5	170.5	-74.9	-179.4	0	0	0	112.8	T598 L602 L605 I680 R681 T684 E689 E691 L697	T598-L693 HydrophobicContact CG2-CD1 3.55Å; T598-L693 HydrophobicContact CG2-CD2 4.05Å; T598-L693 HydrophobicContact CG2-CG 3.73Å; L602-L693 HydrophobicContact CD2-CD2 4.35Å; L605-L693 HydrophobicContact CD1-CD2 4.07Å; I680-L693 HydrophobicContact CG2-CD1 3.88Å; R681-L693 HydrophobicContact CB-CB 4.1Å; R681-L693 HydrophobicContact CB-CD1 3.93Å; R681-L693 HydrophobicContact CG-CB 3.9Å; R681-L693 HydrophobicContact CG-CD1 4.31Å; T684-L693 HydrophobicContact CG2-CD1 4.44Å; T684-L693 WeakPolarHBondContact OG1-CD1 3.29Å; E689-L693 WeakPolarHBondContact O-CB 3.4Å; E689-L693 WeakPolarHBondContact O-CG 3.3Å; E689-L693 PolarHBondContact O-N 3.33Å; E691-L693 PolarHBondContact O-N 2.96Å; L693-L697 WeakPolarHBondContact O-CB 3.44Å; L693-L697 PolarHBondContact O-N 3.27Å
694	T	89.3	Confident	87.1	Confident	46 Å²	46	50.3 Å²	50.3	28%	0.282	30%	0.295	S	S	.	.	H	α-helix	trans	-68.2	-41.8	175.2	-57.4	0	0	0	0	110.8	R681 Q690 E691 M692 L697 T698	R681-T694 WeakPolarHBondContact CD-OG1 3.47Å; R681-T694 PolarHBondContact NH1-OG1 3.28Å; Q690-T694 WeakPolarHBondContact O-CB 3.11Å; Q690-T694 PolarHBondContact O-N 3.44Å; Q690-T694 PolarHBondContact O-OG1 2.91Å; E691-T694 CarbonylContact O-C 3.52Å; E691-T694 WeakPolarHBondContact O-CA 3.38Å; E691-T694 WeakPolarHBondContact O-CB 3.37Å; E691-T694 PolarHBondContact O-N 3.49Å; M692-T694 VanDerWaalsContact C-N 3.33Å; M692-T694 PolarHBondContact O-N 2.91Å; T694-L697 PolarHBondContact O-N 3.18Å; T694-T698 VanDerWaalsContact O-CB 3.28Å; T694-T698 WeakPolarHBondContact O-CB 3.41Å; T694-T698 PolarHBondContact O-N 3.14Å; T694-T698 PolarHBondContact O-OG1 3.1Å
695	A	87.9	Confident	87.5	Confident	63 Å²	63	56.4 Å²	56.4	52%	0.521	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-47.4	175.1	0	0	0	0	0	111.2	E691 M692 T698 K699	E691-A695 PolarHBondContact O-N 3.02Å; M692-A695 PolarHBondContact O-N 3.23Å; A695-T698 PolarHBondContact O-N 3.33Å; A695-K699 WeakPolarHBondContact O-CB 3.43Å; A695-K699 PolarHBondContact O-N 3.24Å
696	C	87.3	Confident	88.1	Confident	22 Å²	22	55.9 Å²	55.9	15%	0.149	31%	0.314	C	S	.	.	H	α-helix	trans	-59.9	-47.7	175.3	-173.1	0	0	0	0	112.2	M692 T698 K699 V700	M692-C696 PolarHBondContact O-N 2.75Å; C696-T698 PolarHBondContact O-N 3.43Å; C696-K699 WeakPolarHBondContact O-CB 3.32Å; C696-K699 PolarHBondContact O-N 3.03Å; C696-V700 PolarHBondContact O-N 2.96Å; C696-V700 VanDerWaalsContact O-N 3.08Å
697	L	90.9	Very high	88.5	Confident	13 Å²	13	53.4 Å²	53.4	7%	0.068	30%	0.297	C	S	.	.	H	α-helix	trans	-60.6	-45	176.9	179.9	155.8	0	0	0	111.9	L693 T694 K699 V700 E701	L693-L697 WeakPolarHBondContact O-CB 3.44Å; L693-L697 PolarHBondContact O-N 3.27Å; T694-L697 PolarHBondContact O-N 3.18Å; L697-K699 VanDerWaalsContact C-N 3.28Å; L697-K699 PolarHBondContact O-N 2.93Å; L697-V700 PolarHBondContact O-N 3Å; L697-E701 HydrophobicContact CD2-CG 3.98Å; L697-E701 PolarHBondContact O-N 3.12Å
698	T	91	Very high	88.9	Confident	60 Å²	60	54 Å²	54	37%	0.368	29%	0.291	S	S	.	.	H	α-helix	trans	-61.2	-39.4	177.3	-57.7	0	0	0	0	111.1	T694 A695 C696 E701 N702	T694-T698 VanDerWaalsContact O-CB 3.28Å; T694-T698 WeakPolarHBondContact O-CB 3.41Å; T694-T698 PolarHBondContact O-N 3.14Å; T694-T698 PolarHBondContact O-OG1 3.1Å; A695-T698 PolarHBondContact O-N 3.33Å; C696-T698 PolarHBondContact O-N 3.43Å; T698-E701 PolarHBondContact O-N 3.42Å; T698-N702 VanDerWaalsContact O-CB 3.27Å; T698-N702 WeakPolarHBondContact O-CB 3.32Å; T698-N702 VanDerWaalsContact O-CG 3.31Å; T698-N702 PolarHBondContact O-N 2.77Å; T698-N702 PolarHBondContact O-ND2 2.76Å
699	K	89.8	Confident	89.2	Confident	92 Å²	92	54 Å²	54	40%	0.4	28%	0.284	S	S	.	.	H	α-helix	trans	-61.9	-44	176	-161.3	177.6	-171.9	-170.1	0	111.9	S609 D614 A695 C696 L697 S703	S609-K699 PolarHBondContact OG-NZ 3.39Å; D614-K699 WeakPolarHBondContact OD1-CE 3.14Å; D614-K699 IonicContact OD1-NZ 2.75Å; D614-K699 PolarHBondContact OD1-NZ 3.27Å; D614-K699 WeakPolarHBondContact OD2-CE 3.35Å; D614-K699 IonicContact OD2-NZ 2.92Å; D614-K699 PolarHBondContact OD2-NZ 3.35Å; A695-K699 WeakPolarHBondContact O-CB 3.43Å; A695-K699 PolarHBondContact O-N 3.24Å; C696-K699 WeakPolarHBondContact O-CB 3.32Å; C696-K699 PolarHBondContact O-N 3.03Å; L697-K699 VanDerWaalsContact C-N 3.28Å; L697-K699 PolarHBondContact O-N 2.93Å; K699-S703 VanDerWaalsContact O-CB 3.32Å; K699-S703 WeakPolarHBondContact O-CB 3.47Å; K699-S703 PolarHBondContact O-N 3.42Å
700	V	90.4	Very high	89.6	Confident	6 Å²	6	54.3 Å²	54.3	4%	0.036	29%	0.285	C	S	.	.	H	α-helix	trans	-72.5	-40	177.1	-174.5	0	0	0	0	112.2	W608 I673 P674 L677 C696 L697 N702 S703 L704	W608-V700 HydrophobicContact CH2-CG2 4.04Å; W608-V700 HydrophobicContact CZ3-CG2 3.79Å; I673-V700 HydrophobicContact CG2-CG1 4.31Å; P674-V700 HydrophobicContact CG-CG1 3.89Å; L677-V700 HydrophobicContact CD1-CG2 4.37Å; C696-V700 PolarHBondContact O-N 2.96Å; C696-V700 VanDerWaalsContact O-N 3.08Å; L697-V700 PolarHBondContact O-N 3Å; V700-N702 VanDerWaalsContact C-N 3.34Å; V700-N702 PolarHBondContact O-N 3.26Å; V700-S703 PolarHBondContact O-N 3.03Å; V700-L704 HydrophobicContact CG1-CD1 4.17Å; V700-L704 WeakPolarHBondContact O-CB 3.06Å; V700-L704 WeakPolarHBondContact O-CG 3.4Å; V700-L704 PolarHBondContact O-N 2.74Å
701	E	91.9	Very high	89.7	Confident	71 Å²	71	52.6 Å²	52.6	33%	0.332	28%	0.277	S	S	.	.	H	α-helix	trans	-62.2	-39.8	174.1	-73.4	-168.3	163.2	0	0	111.2	K40 P674 L697 T698 K705	K40-E701 IonicContact NZ-OE1 3.44Å; K40-E701 PolarHBondContact NZ-OE1 3.47Å; K40-E701 IonicContact NZ-OE2 2.69Å; P674-E701 HydrophobicContact CB-CG 4.2Å; L697-E701 HydrophobicContact CD2-CG 3.98Å; L697-E701 PolarHBondContact O-N 3.12Å; T698-E701 PolarHBondContact O-N 3.42Å; E701-K705 PolarHBondContact O-N 3.08Å
702	N	91.8	Very high	89.8	Confident	96 Å²	96	54.2 Å²	54.2	51%	0.513	28%	0.278	S	S	.	.	H	α-helix	trans	-68.4	-38.8	173.5	-77.8	-19.6	0	0	0	112.9	T698 V700 K705 S706	T698-N702 VanDerWaalsContact O-CB 3.27Å; T698-N702 WeakPolarHBondContact O-CB 3.32Å; T698-N702 VanDerWaalsContact O-CG 3.31Å; T698-N702 PolarHBondContact O-N 2.77Å; T698-N702 PolarHBondContact O-ND2 2.76Å; V700-N702 VanDerWaalsContact C-N 3.34Å; V700-N702 PolarHBondContact O-N 3.26Å; N702-K705 WeakPolarHBondContact O-CB 3.43Å; N702-K705 PolarHBondContact O-N 2.95Å; N702-S706 PolarHBondContact O-N 2.81Å
703	S	91.7	Very high	90	Very high	14 Å²	14	51.5 Å²	51.5	10%	0.098	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-46.8	175.5	-170.1	0	0	0	0	111.5	D614 H619 Y670 K699 V700 K705 S706 L707	D614-S703 PolarHBondContact O-OG 2.96Å; H619-S703 PolarHBondContact CE1-O 3.45Å; H619-S703 VanDerWaalsContact CE1-O 3.31Å; H619-S703 PolarHBondContact CE1-OG 2.87Å; H619-S703 PolarHBondContact NE2-O 2.93Å; H619-S703 PolarHBondContact NE2-OG 3.33Å; Y670-S703 WeakPolarHBondContact OH-CB 3.49Å; Y670-S703 PolarHBondContact OH-OG 2.77Å; K699-S703 VanDerWaalsContact O-CB 3.32Å; K699-S703 WeakPolarHBondContact O-CB 3.47Å; K699-S703 PolarHBondContact O-N 3.42Å; V700-S703 PolarHBondContact O-N 3.03Å; S703-K705 VanDerWaalsContact C-N 3.33Å; S703-K705 PolarHBondContact O-N 3.35Å; S703-S706 WeakPolarHBondContact O-CA 3.4Å; S703-S706 WeakPolarHBondContact O-CB 3.32Å; S703-S706 PolarHBondContact O-N 2.86Å; S703-S706 VanDerWaalsContact O-N 3.12Å; S703-L707 PolarHBondContact O-N 3.18Å
704	L	91.6	Very high	90	Very high	32 Å²	32	53.2 Å²	53.2	17%	0.168	27%	0.272	C	S	.	.	H	α-helix	trans	-59.6	-39.4	173.6	-78.8	164	0	0	0	112.7	Y670 M671 P674 V700 L707 E708	Y670-L704 HydrophobicContact CD1-CD2 3.45Å; Y670-L704 VanDerWaalsContact CD1-CD2 3.45Å; Y670-L704 HydrophobicContact CD1-CG 4.21Å; Y670-L704 HydrophobicContact CE1-CD2 3.53Å; Y670-L704 HydrophobicContact CE1-CG 3.85Å; Y670-L704 HydrophobicContact CG-CD2 4.45Å; M671-L704 HydrophobicContact CG-CD2 4.11Å; P674-L704 HydrophobicContact CG-CD1 3.45Å; P674-L704 VanDerWaalsContact CG-CD1 3.45Å; V700-L704 HydrophobicContact CG1-CD1 4.17Å; V700-L704 WeakPolarHBondContact O-CB 3.06Å; V700-L704 WeakPolarHBondContact O-CG 3.4Å; V700-L704 PolarHBondContact O-N 2.74Å; L704-L707 WeakPolarHBondContact O-CB 3.05Å; L704-L707 PolarHBondContact O-N 2.73Å; L704-E708 PolarHBondContact O-N 3.39Å
705	K	91.2	Very high	89.9	Confident	128 Å²	128	55 Å²	55	56%	0.557	28%	0.276	S	S	*	.	H	α-helix	trans	-63	-43.1	173.2	-176.2	-173.6	173.9	-167.9	0	111.9	E701 N702 S703 L707 E708 D709	E701-K705 PolarHBondContact O-N 3.08Å; N702-K705 WeakPolarHBondContact O-CB 3.43Å; N702-K705 PolarHBondContact O-N 2.95Å; S703-K705 VanDerWaalsContact C-N 3.33Å; S703-K705 PolarHBondContact O-N 3.35Å; K705-L707 VanDerWaalsContact C-N 3.29Å; K705-L707 PolarHBondContact O-N 3.38Å; K705-E708 PolarHBondContact O-N 3.06Å; K705-D709 PolarHBondContact O-N 3.31Å
706	S	91.9	Very high	90	Very high	50 Å²	50	53 Å²	53	35%	0.35	26%	0.256	S	S	.	.	H	α-helix	trans	-60	-38.8	173.3	-171.8	0	0	0	0	111.6	N702 S703 D709 K710	N702-S706 PolarHBondContact O-N 2.81Å; S703-S706 WeakPolarHBondContact O-CA 3.4Å; S703-S706 WeakPolarHBondContact O-CB 3.32Å; S703-S706 PolarHBondContact O-N 2.86Å; S703-S706 VanDerWaalsContact O-N 3.12Å; S706-D709 PolarHBondContact O-N 2.89Å; S706-K710 WeakPolarHBondContact O-CB 3.27Å; S706-K710 VanDerWaalsContact O-CG 3.25Å; S706-K710 WeakPolarHBondContact O-CG 3.22Å; S706-K710 PolarHBondContact O-N 2.98Å
707	L	90.8	Very high	90.1	Very high	9 Å²	9	54.4 Å²	54.4	5%	0.047	26%	0.26	C	S	.	.	H	α-helix	trans	-63.8	-44.7	172.7	-176.5	57.8	0	0	0	112.7	H619 C622 L623 S703 L704 K705 D709 K710 M711	H619-L707 HydrophobicContact CB-CD1 3.93Å; C622-L707 HydrophobicContact CB-CD1 4.1Å; C622-L707 HydrophobicContact CB-CD2 3.89Å; L623-L707 HydrophobicContact CG-CD1 4.27Å; S703-L707 PolarHBondContact O-N 3.18Å; L704-L707 WeakPolarHBondContact O-CB 3.05Å; L704-L707 PolarHBondContact O-N 2.73Å; K705-L707 VanDerWaalsContact C-N 3.29Å; K705-L707 PolarHBondContact O-N 3.38Å; L707-D709 VanDerWaalsContact C-N 3.33Å; L707-D709 PolarHBondContact O-N 2.94Å; L707-K710 PolarHBondContact O-N 2.92Å; L707-M711 HydrophobicContact CD1-CE 3.95Å; L707-M711 HydrophobicContact CD1-CG 4.34Å; L707-M711 HydrophobicContact CD2-CE 4.12Å; L707-M711 HydrophobicContact CG-CE 3.92Å; L707-M711 HydrophobicContact CG-SD 4.44Å; L707-M711 WeakPolarHBondContact O-CB 3.39Å; L707-M711 WeakPolarHBondContact O-CG 3.34Å; L707-M711 PolarHBondContact O-N 2.92Å
708	E	89.7	Confident	89.9	Confident	86 Å²	86	57.3 Å²	57.3	40%	0.402	27%	0.273	S	S	.	.	H	α-helix	trans	-60.2	-42	175.7	-74	-165.9	177.8	0	0	112.1	L704 K705 M711 R712	L704-E708 PolarHBondContact O-N 3.39Å; K705-E708 PolarHBondContact O-N 3.06Å; E708-M711 PolarHBondContact O-N 3.15Å; E708-R712 WeakPolarHBondContact O-CB 3.31Å; E708-R712 PolarHBondContact O-N 3.34Å
709	D	89.4	Confident	89.7	Confident	52 Å²	52	56 Å²	56	28%	0.278	26%	0.261	S	S	.	.	H	α-helix	trans	-70.9	-38.3	178	-72.4	-30	0	0	0	111.7	K705 S706 L707 R712 W713	K705-D709 PolarHBondContact O-N 3.31Å; S706-D709 PolarHBondContact O-N 2.89Å; L707-D709 VanDerWaalsContact C-N 3.33Å; L707-D709 PolarHBondContact O-N 2.94Å; D709-R712 PolarHBondContact O-N 2.95Å; D709-R712 IonicContact OD1-CZ 2.67Å; D709-R712 IonicContact OD1-NH1 3.54Å; D709-R712 PolarHBondContact OD1-NH1 2.91Å; D709-R712 IonicContact OD1-NH2 3.11Å; D709-R712 PolarHBondContact OD1-NH2 3.44Å; D709-W713 WeakPolarHBondContact O-CB 3.45Å; D709-W713 PolarHBondContact O-N 3.03Å
710	K	89.7	Confident	89.7	Confident	37 Å²	37	51.7 Å²	51.7	16%	0.161	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-43.9	170.6	-76.3	175.6	178.7	-171	0	112	E616 L623 S706 L707 W713 L714	E616-K710 IonicContact OE1-NZ 3.45Å; E616-K710 PolarHBondContact OE1-NZ 3.02Å; E616-K710 IonicContact OE2-NZ 3.81Å; E616-K710 PolarHBondContact OE2-NZ 2.57Å; L623-K710 HydrophobicContact CD1-CB 4.37Å; L623-K710 HydrophobicContact CD1-CD 4.49Å; L623-K710 HydrophobicContact CD2-CB 4.2Å; S706-K710 WeakPolarHBondContact O-CB 3.27Å; S706-K710 VanDerWaalsContact O-CG 3.25Å; S706-K710 WeakPolarHBondContact O-CG 3.22Å; S706-K710 PolarHBondContact O-N 2.98Å; L707-K710 PolarHBondContact O-N 2.92Å; K710-W713 PolarHBondContact O-N 2.73Å; K710-L714 WeakPolarHBondContact O-CB 3.22Å; K710-L714 PolarHBondContact O-N 2.76Å
711	M	88.5	Confident	89.5	Confident	19 Å²	19	56.2 Å²	56.2	9%	0.094	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-40.5	174.7	-76.6	-178.1	177.2	0	0	112.5	W26 C622 L623 M667 L707 E708 L714 K715	W26-M711 HydrophobicContact CH2-SD 4.2Å; W26-M711 HydrophobicContact CZ3-SD 4.24Å; C622-M711 HydrophobicContact CB-CE 3.55Å; C622-M711 WeakPolarHBondContact O-CE 3.36Å; L623-M711 HydrophobicContact CD2-CG 3.94Å; M667-M711 HydrophobicContact CE-CE 3.75Å; M667-M711 HydrophobicContact CE-SD 4.4Å; M667-M711 HydrophobicContact SD-CE 4.4Å; L707-M711 HydrophobicContact CD1-CE 3.95Å; L707-M711 HydrophobicContact CD1-CG 4.34Å; L707-M711 HydrophobicContact CD2-CE 4.12Å; L707-M711 HydrophobicContact CG-CE 3.92Å; L707-M711 HydrophobicContact CG-SD 4.44Å; L707-M711 WeakPolarHBondContact O-CB 3.39Å; L707-M711 WeakPolarHBondContact O-CG 3.34Å; L707-M711 PolarHBondContact O-N 2.92Å; E708-M711 PolarHBondContact O-N 3.15Å; M711-L714 PolarHBondContact O-N 2.99Å; M711-K715 WeakPolarHBondContact O-CG 3.35Å; M711-K715 PolarHBondContact O-N 2.95Å
712	R	88.3	Confident	89.2	Confident	147 Å²	147	57.1 Å²	57.1	56%	0.555	27%	0.268	S	S	*	.	H	α-helix	trans	-66.1	-40.8	177.2	-163.6	-174.7	-51.1	125.9	18.5	111	E708 D709 N716	E708-R712 WeakPolarHBondContact O-CB 3.31Å; E708-R712 PolarHBondContact O-N 3.34Å; D709-R712 PolarHBondContact O-N 2.95Å; D709-R712 IonicContact OD1-CZ 2.67Å; D709-R712 IonicContact OD1-NH1 3.54Å; D709-R712 PolarHBondContact OD1-NH1 2.91Å; D709-R712 IonicContact OD1-NH2 3.11Å; D709-R712 PolarHBondContact OD1-NH2 3.44Å; R712-N716 VanDerWaalsContact O-CB 3.31Å; R712-N716 WeakPolarHBondContact O-CB 3.28Å; R712-N716 PolarHBondContact O-N 3.37Å; R712-N716 VanDerWaalsContact O-N 3.09Å
713	W	89.4	Confident	89	Confident	39 Å²	39	52.5 Å²	52.5	15%	0.148	24%	0.243	C	C	.	.	H	α-helix	trans	-62.1	-46.4	173	177.8	87.4	0	0	0	111.7	L262 D709 K710 N716 F717 P761	L262-W713 HydrophobicContact CD1-CE3 4.3Å; L262-W713 HydrophobicContact CD1-CZ3 3.91Å; L262-W713 HydrophobicContact CD2-CH2 3.93Å; L262-W713 HydrophobicContact CD2-CZ3 3.68Å; L262-W713 HydrophobicContact CG-CZ3 4.38Å; D709-W713 WeakPolarHBondContact O-CB 3.45Å; D709-W713 PolarHBondContact O-N 3.03Å; K710-W713 PolarHBondContact O-N 2.73Å; W713-N716 WeakPolarHBondContact O-CB 3.27Å; W713-N716 PolarHBondContact O-N 2.68Å; W713-F717 HydrophobicContact CD2-CB 4.49Å; W713-F717 HydrophobicContact CH2-CB 3.95Å; W713-F717 AromaticContact CH2-CD1 3.52Å; W713-F717 HydrophobicContact CH2-CD1 3.52Å; W713-F717 HydrophobicContact CH2-CD2 4.31Å; W713-F717 HydrophobicContact CH2-CE1 4.04Å; W713-F717 AromaticContact CH2-CG 3.67Å; W713-F717 HydrophobicContact CH2-CG 3.67Å; W713-F717 HydrophobicContact CZ2-CB 3.95Å; W713-F717 HydrophobicContact CZ2-CD1 4.12Å; W713-F717 HydrophobicContact CZ2-CD2 4.07Å; W713-F717 AromaticContact CZ2-CG 3.79Å; W713-F717 HydrophobicContact CZ2-CG 3.79Å; W713-F717 HydrophobicContact CZ3-CB 4.23Å; W713-F717 HydrophobicContact CZ3-CD1 4.1Å; W713-F717 HydrophobicContact CZ3-CG 4.34Å; W713-F717 WeakPolarHBondContact O-CB 3.28Å; W713-F717 PolarHBondContact O-N 3.37Å; W713-P761 HydrophobicContact CZ2-CB 3.82Å; W713-P761 PolarHBondContact NE1-O 3.47Å
714	L	88.2	Confident	88.8	Confident	36 Å²	36	54.8 Å²	54.8	19%	0.188	25%	0.252	C	S	.	.	H	α-helix	trans	-59.7	-50.8	-179.3	-178.9	61.2	0	0	0	111.2	L623 K710 M711 N716 F717 E718	L623-L714 HydrophobicContact CB-CD2 4.45Å; L623-L714 HydrophobicContact CD2-CD2 3.97Å; K710-L714 WeakPolarHBondContact O-CB 3.22Å; K710-L714 PolarHBondContact O-N 2.76Å; M711-L714 PolarHBondContact O-N 2.99Å; L714-N716 VanDerWaalsContact C-N 3.31Å; L714-N716 PolarHBondContact O-N 2.92Å; L714-F717 CarbonylContact O-C 3.58Å; L714-F717 WeakPolarHBondContact O-CA 3.36Å; L714-F717 WeakPolarHBondContact O-CB 3.41Å; L714-F717 PolarHBondContact O-N 3.08Å; L714-E718 HydrophobicContact CD1-CG 4.31Å; L714-E718 HydrophobicContact CG-CG 4.47Å; L714-E718 WeakPolarHBondContact O-CG 3.45Å; L714-E718 PolarHBondContact O-N 2.91Å
715	K	86.9	Confident	88.4	Confident	82 Å²	82	57.8 Å²	57.8	36%	0.357	28%	0.276	S	S	.	.	H	α-helix	trans	-62.5	-36.2	178.2	-70.4	178.2	177.9	-178	0	113.3	M711 E718 R719	M711-K715 WeakPolarHBondContact O-CG 3.35Å; M711-K715 PolarHBondContact O-N 2.95Å; K715-E718 WeakPolarHBondContact CA-OE2 3.42Å; K715-R719 WeakPolarHBondContact O-CB 3.43Å; K715-R719 PolarHBondContact O-N 3.24Å
716	N	90	Very high	88.2	Confident	22 Å²	22	53.5 Å²	53.5	12%	0.118	26%	0.258	C	S	.	.	H	α-helix	trans	-64.1	-43.7	171.1	167.4	82.4	0	0	0	111.4	R712 W713 L714 R719 L720 R763 Q764 L765	R712-N716 VanDerWaalsContact O-CB 3.31Å; R712-N716 WeakPolarHBondContact O-CB 3.28Å; R712-N716 PolarHBondContact O-N 3.37Å; R712-N716 VanDerWaalsContact O-N 3.09Å; W713-N716 WeakPolarHBondContact O-CB 3.27Å; W713-N716 PolarHBondContact O-N 2.68Å; L714-N716 VanDerWaalsContact C-N 3.31Å; L714-N716 PolarHBondContact O-N 2.92Å; N716-R719 PolarHBondContact O-N 3.24Å; N716-L720 WeakPolarHBondContact O-CB 3.32Å; N716-L720 VanDerWaalsContact O-CG 3.24Å; N716-L720 WeakPolarHBondContact O-CG 3.11Å; N716-L720 PolarHBondContact O-N 3.39Å; N716-R763 PolarHBondContact ND2-O 3.28Å; N716-Q764 WeakPolarHBondContact OD1-CA 3.49Å; N716-L765 PolarHBondContact OD1-N 2.86Å
717	F	88.2	Confident	88	Confident	51 Å²	51	51.9 Å²	51.9	22%	0.224	25%	0.246	C	C	.	.	H	α-helix	trans	-68.5	-40.3	-179.6	-177.4	-119.4	0	0	0	112.8	W713 L714 L720 Q721 P761	W713-F717 HydrophobicContact CD2-CB 4.49Å; W713-F717 HydrophobicContact CH2-CB 3.95Å; W713-F717 AromaticContact CH2-CD1 3.52Å; W713-F717 HydrophobicContact CH2-CD1 3.52Å; W713-F717 HydrophobicContact CH2-CD2 4.31Å; W713-F717 HydrophobicContact CH2-CE1 4.04Å; W713-F717 AromaticContact CH2-CG 3.67Å; W713-F717 HydrophobicContact CH2-CG 3.67Å; W713-F717 HydrophobicContact CZ2-CB 3.95Å; W713-F717 HydrophobicContact CZ2-CD1 4.12Å; W713-F717 HydrophobicContact CZ2-CD2 4.07Å; W713-F717 AromaticContact CZ2-CG 3.79Å; W713-F717 HydrophobicContact CZ2-CG 3.79Å; W713-F717 HydrophobicContact CZ3-CB 4.23Å; W713-F717 HydrophobicContact CZ3-CD1 4.1Å; W713-F717 HydrophobicContact CZ3-CG 4.34Å; W713-F717 WeakPolarHBondContact O-CB 3.28Å; W713-F717 PolarHBondContact O-N 3.37Å; L714-F717 CarbonylContact O-C 3.58Å; L714-F717 WeakPolarHBondContact O-CA 3.36Å; L714-F717 WeakPolarHBondContact O-CB 3.41Å; L714-F717 PolarHBondContact O-N 3.08Å; F717-L720 PolarHBondContact O-N 3Å; F717-Q721 WeakPolarHBondContact O-CG 3.46Å; F717-Q721 PolarHBondContact O-N 3.17Å; F717-P761 HydrophobicContact CD2-CB 4.29Å; F717-P761 HydrophobicContact CE2-CB 4.11Å
718	E	86.6	Confident	87.7	Confident	74 Å²	74	55.4 Å²	55.4	35%	0.346	26%	0.263	S	S	.	.	H	α-helix	trans	-58.5	-50	170.5	-70	167.3	149.8	0	0	110.5	L714 K715 L720 Q721 E722	L714-E718 HydrophobicContact CD1-CG 4.31Å; L714-E718 HydrophobicContact CG-CG 4.47Å; L714-E718 WeakPolarHBondContact O-CG 3.45Å; L714-E718 PolarHBondContact O-N 2.91Å; K715-E718 WeakPolarHBondContact CA-OE2 3.42Å; E718-L720 VanDerWaalsContact C-N 3.32Å; E718-L720 PolarHBondContact O-N 2.95Å; E718-Q721 WeakPolarHBondContact O-CB 3.42Å; E718-Q721 PolarHBondContact O-N 2.92Å; E718-Q721 VanDerWaalsContact O-N 3.07Å; E718-E722 PolarHBondContact O-N 2.77Å
719	R	88.2	Confident	87.4	Confident	32 Å²	32	53.4 Å²	53.4	12%	0.121	25%	0.252	C	S	.	.	H	α-helix	trans	-62.2	-36.1	176.7	-175.5	54.9	177.3	174.1	-0.6	112.9	K715 N716 Q721 E722 I723 L765 E768 T816	K715-R719 WeakPolarHBondContact O-CB 3.43Å; K715-R719 PolarHBondContact O-N 3.24Å; N716-R719 PolarHBondContact O-N 3.24Å; R719-Q721 VanDerWaalsContact C-N 3.34Å; R719-E722 WeakPolarHBondContact CD-OE2 3.45Å; R719-E722 IonicContact CZ-OE2 3.05Å; R719-E722 IonicContact NE-OE2 3.81Å; R719-E722 IonicContact NH1-OE2 3.83Å; R719-E722 PolarHBondContact NH1-OE2 3.33Å; R719-E722 PolarHBondContact O-N 2.86Å; R719-I723 HydrophobicContact CG-CD1 3.91Å; R719-I723 HydrophobicContact CG-CG1 4.47Å; R719-I723 WeakPolarHBondContact O-CB 3.4Å; R719-I723 WeakPolarHBondContact O-CD1 3.35Å; R719-I723 VanDerWaalsContact O-CG1 3.22Å; R719-I723 WeakPolarHBondContact O-CG1 3.46Å; R719-I723 PolarHBondContact O-N 3.43Å; R719-L765 HydrophobicContact CG-CD2 3.74Å; R719-E768 IonicContact CZ-OE1 3.63Å; R719-E768 IonicContact CZ-OE2 2.69Å; R719-E768 IonicContact NE-OE1 3.44Å; R719-E768 IonicContact NE-OE2 3.99Å; R719-E768 PolarHBondContact NE-OE2 2.9Å; R719-E768 IonicContact NH2-OE1 3.43Å; R719-E768 PolarHBondContact NH2-OE1 3.46Å; R719-E768 IonicContact NH2-OE2 2.97Å; R719-E768 PolarHBondContact NH2-OE2 2.83Å; R719-T816 PolarHBondContact NH1-OG1 2.85Å; R719-T816 PolarHBondContact NH2-OG1 3.08Å
720	L	88.7	Confident	87.1	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-63.6	-38.1	173.4	-73.8	168.7	0	0	0	112	N716 F717 E718 Q724 I758 R763 F787	N716-L720 WeakPolarHBondContact O-CB 3.32Å; N716-L720 VanDerWaalsContact O-CG 3.24Å; N716-L720 WeakPolarHBondContact O-CG 3.11Å; N716-L720 PolarHBondContact O-N 3.39Å; F717-L720 PolarHBondContact O-N 3Å; E718-L720 VanDerWaalsContact C-N 3.32Å; E718-L720 PolarHBondContact O-N 2.95Å; L720-Q724 WeakPolarHBondContact O-CB 3.1Å; L720-Q724 PolarHBondContact O-N 2.73Å; L720-I758 HydrophobicContact CB-CG2 4.23Å; L720-I758 HydrophobicContact CD2-CG2 3.6Å; L720-R763 HydrophobicContact CD1-CB 4.45Å; L720-R763 WeakPolarHBondContact CD1-O 3.45Å; L720-F787 HydrophobicContact CD2-CD1 4.09Å; L720-F787 HydrophobicContact CD2-CE1 3.56Å
721	Q	86.2	Confident	86.8	Confident	101 Å²	101	50.5 Å²	50.5	47%	0.472	24%	0.241	S	C	.	.	H	α-helix	trans	-68.7	-42.7	174.1	-69.7	-174.8	46.1	0	0	112.2	F717 E718 R719 I723 Q724 S725	F717-Q721 WeakPolarHBondContact O-CG 3.46Å; F717-Q721 PolarHBondContact O-N 3.17Å; E718-Q721 WeakPolarHBondContact O-CB 3.42Å; E718-Q721 PolarHBondContact O-N 2.92Å; E718-Q721 VanDerWaalsContact O-N 3.07Å; R719-Q721 VanDerWaalsContact C-N 3.34Å; Q721-I723 PolarHBondContact O-N 3.47Å; Q721-Q724 PolarHBondContact O-N 3.49Å; Q721-S725 WeakPolarHBondContact O-CB 3.44Å; Q721-S725 PolarHBondContact O-N 2.88Å
722	E	86.6	Confident	86.3	Confident	90 Å²	90	51.2 Å²	51.2	42%	0.421	25%	0.246	S	C	.	.	H	α-helix	trans	-54.6	-54.3	173.1	-70.5	-176.9	161.7	0	0	110.8	E718 R719 Q724 S725 Q726	E718-E722 PolarHBondContact O-N 2.77Å; R719-E722 WeakPolarHBondContact CD-OE2 3.45Å; R719-E722 IonicContact CZ-OE2 3.05Å; R719-E722 IonicContact NE-OE2 3.81Å; R719-E722 IonicContact NH1-OE2 3.83Å; R719-E722 PolarHBondContact NH1-OE2 3.33Å; R719-E722 PolarHBondContact O-N 2.86Å; E722-Q724 VanDerWaalsContact C-N 3.34Å; E722-Q724 PolarHBondContact O-N 3.28Å; E722-S725 PolarHBondContact O-N 2.57Å; E722-S725 VanDerWaalsContact O-N 3.11Å; E722-S725 PolarHBondContact O-OG 3.07Å; E722-Q726 WeakPolarHBondContact O-CG 3.35Å; E722-Q726 PolarHBondContact O-N 3.34Å
723	I	87.4	Confident	85.7	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.6	-46.2	179.9	-66.8	165	0	0	0	110.1	R719 Q721 S725 Q726 L727 I758 L765 F785	R719-I723 HydrophobicContact CG-CD1 3.91Å; R719-I723 HydrophobicContact CG-CG1 4.47Å; R719-I723 WeakPolarHBondContact O-CB 3.4Å; R719-I723 WeakPolarHBondContact O-CD1 3.35Å; R719-I723 VanDerWaalsContact O-CG1 3.22Å; R719-I723 WeakPolarHBondContact O-CG1 3.46Å; R719-I723 PolarHBondContact O-N 3.43Å; Q721-I723 PolarHBondContact O-N 3.47Å; I723-S725 VanDerWaalsContact C-N 3.31Å; I723-S725 PolarHBondContact O-N 3.25Å; I723-Q726 PolarHBondContact O-N 2.86Å; I723-L727 WeakPolarHBondContact O-CB 3.39Å; I723-L727 PolarHBondContact O-N 3.34Å; I723-I758 HydrophobicContact CG2-CD1 3.83Å; I723-L765 HydrophobicContact CD1-CD1 4.41Å; I723-L765 HydrophobicContact CD1-CD2 3.83Å; I723-F785 HydrophobicContact CB-CE1 4.44Å; I723-F785 HydrophobicContact CD1-CD1 3.6Å; I723-F785 HydrophobicContact CD1-CE1 3.49Å; I723-F785 VanDerWaalsContact CD1-CE1 3.49Å; I723-F785 HydrophobicContact CD1-CZ 4.45Å; I723-F785 HydrophobicContact CG1-CD1 4.18Å; I723-F785 HydrophobicContact CG1-CE1 3.57Å; I723-F785 HydrophobicContact CG1-CZ 4.14Å; I723-F785 HydrophobicContact CG2-CD1 4.36Å; I723-F785 HydrophobicContact CG2-CE1 3.99Å; I723-F785 HydrophobicContact CG2-CE2 4.3Å; I723-F785 HydrophobicContact CG2-CZ 3.95Å
724	Q	86.6	Confident	85.3	Confident	61 Å²	61	50.8 Å²	50.8	29%	0.285	26%	0.258	S	S	.	.	H	α-helix	trans	-61.1	-38.7	177.7	-168.5	-171	4.5	0	0	112.3	L720 Q721 E722 Q726 E755 I758 A759	L720-Q724 WeakPolarHBondContact O-CB 3.1Å; L720-Q724 PolarHBondContact O-N 2.73Å; Q721-Q724 PolarHBondContact O-N 3.49Å; E722-Q724 VanDerWaalsContact C-N 3.34Å; E722-Q724 PolarHBondContact O-N 3.28Å; Q724-Q726 VanDerWaalsContact C-N 3.31Å; Q724-Q726 PolarHBondContact O-N 3.29Å; Q724-E755 PolarHBondContact NE2-O 3.41Å; Q724-I758 HydrophobicContact CB-CB 4.46Å; Q724-I758 HydrophobicContact CB-CG2 4.42Å; Q724-A759 VanDerWaalsContact OE1-CB 3.29Å
725	S	84.7	Confident	84.9	Confident	96 Å²	96	51.5 Å²	51.5	67%	0.671	26%	0.262	S	S	*	.	H	α-helix	trans	-69.7	-27.5	178.3	77.2	0	0	0	0	113.6	Q721 E722 I723	Q721-S725 WeakPolarHBondContact O-CB 3.44Å; Q721-S725 PolarHBondContact O-N 2.88Å; E722-S725 PolarHBondContact O-N 2.57Å; E722-S725 VanDerWaalsContact O-N 3.11Å; E722-S725 PolarHBondContact O-OG 3.07Å; I723-S725 VanDerWaalsContact C-N 3.31Å; I723-S725 PolarHBondContact O-N 3.25Å
726	Q	86.4	Confident	84.5	Confident	38 Å²	38	52.9 Å²	52.9	18%	0.178	27%	0.27	C	S	.	.	H	α-helix	trans	-94.1	-9.7	-179.2	-66.7	168.8	15.8	0	0	113	E722 I723 Q724 F821	E722-Q726 WeakPolarHBondContact O-CG 3.35Å; E722-Q726 PolarHBondContact O-N 3.34Å; I723-Q726 PolarHBondContact O-N 2.86Å; Q724-Q726 VanDerWaalsContact C-N 3.31Å; Q724-Q726 PolarHBondContact O-N 3.29Å; Q726-F821 HydrophobicContact CB-CD2 3.93Å; Q726-F821 HydrophobicContact CB-CE2 4.4Å; Q726-F821 PolarHBondContact O-N 3.23Å
727	L	87.3	Confident	83.9	Confident	16 Å²	16	57 Å²	57	8%	0.084	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	122.7	-173.6	-170.2	68.5	0	0	0	113.2	I723 W729 I758 L792 T794 F821 V823	I723-L727 WeakPolarHBondContact O-CB 3.39Å; I723-L727 PolarHBondContact O-N 3.34Å; L727-W729 HydrophobicContact CD2-CH2 4.45Å; L727-W729 HydrophobicContact CD2-CZ2 3.63Å; L727-I758 HydrophobicContact CD2-CD1 3.44Å; L727-I758 VanDerWaalsContact CD2-CD1 3.44Å; L727-L792 HydrophobicContact CD2-CD2 3.89Å; L727-T794 HydrophobicContact CD1-CG2 3.72Å; L727-F821 WeakPolarHBondContact CA-O 3.35Å; L727-F821 HydrophobicContact CD1-CB 3.73Å; L727-V823 HydrophobicContact CD1-CG2 3.62Å; L727-V823 HydrophobicContact CD2-CG2 3.93Å; L727-V823 HydrophobicContact CG-CG2 3.9Å
728	I	84.2	Confident	83.4	Confident	82 Å²	82	66.3 Å²	66.3	42%	0.421	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125.9	170.4	-59.4	-179.4	0	0	0	109.6	V820 F821 V822 V823	I728-V820 HydrophobicContact CD1-CG1 3.5Å; I728-V820 VanDerWaalsContact CD1-CG1 3.5Å; I728-V820 HydrophobicContact CG1-CG1 3.91Å; I728-F821 PolarHBondContact N-O 3.35Å; I728-V822 HydrophobicContact CB-CG2 4.32Å; I728-V822 WeakPolarHBondContact O-CA 3.42Å; I728-V823 PolarHBondContact O-N 2.92Å; I728-V823 VanDerWaalsContact O-N 3.08Å
729	W	85.2	Confident	83.2	Confident	44 Å²	44	66.1 Å²	66.1	17%	0.167	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-90.2	116.5	168.6	-63.9	92	0	0	0	109.5	L727 Q752 L757 L792 V823 V827	L727-W729 HydrophobicContact CD2-CH2 4.45Å; L727-W729 HydrophobicContact CD2-CZ2 3.63Å; W729-Q752 HydrophobicContact CB-CB 4.23Å; W729-Q752 HydrophobicContact CB-CG 4.05Å; W729-L757 HydrophobicContact CH2-CD2 3.75Å; W729-L757 HydrophobicContact CZ2-CB 4.31Å; W729-L757 HydrophobicContact CZ2-CD2 4.14Å; W729-L792 HydrophobicContact CH2-CD1 4.07Å; W729-L792 HydrophobicContact CZ3-CD1 4.48Å; W729-V823 HydrophobicContact CD2-CG2 3.9Å; W729-V823 HydrophobicContact CE3-CB 4.11Å; W729-V823 HydrophobicContact CE3-CG1 4.15Å; W729-V823 HydrophobicContact CE3-CG2 3.63Å; W729-V823 HydrophobicContact CH2-CG2 4.09Å; W729-V823 HydrophobicContact CZ2-CG2 4.34Å; W729-V823 HydrophobicContact CZ3-CB 4.29Å; W729-V823 HydrophobicContact CZ3-CG1 3.93Å; W729-V823 HydrophobicContact CZ3-CG2 3.74Å; W729-V827 HydrophobicContact CH2-CG2 3.82Å; W729-V827 HydrophobicContact CZ3-CG2 3.82Å
730	P	82.5	Confident	83	Confident	11 Å²	11	72.9 Å²	72.9	7%	0.071	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-65.9	158.2	175.3	-19.2	31.9	0	0	0	112.8	E734 L735 Q752 V822 V823	P730-E734 HydrophobicContact CB-CB 3.65Å; P730-E734 HydrophobicContact CB-CG 4.45Å; P730-L735 HydrophobicContact CG-CD1 4.38Å; P730-Q752 VanDerWaalsContact O-CG 3.25Å; P730-Q752 WeakPolarHBondContact O-CG 3.49Å; P730-Q752 PolarHBondContact O-NE2 3.32Å; P730-V822 HydrophobicContact CG-CG1 3.71Å; P730-V823 VanDerWaalsContact CG-O 3.29Å; P730-V823 WeakPolarHBondContact CG-O 3.04Å
731	S	82.1	Confident	82.6	Confident	18 Å²	18	73.3 Å²	73.3	13%	0.126	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-61.3	158.7	167	63.9	0	0	0	0	111.3	S733 E734 L735	S731-S733 PolarHBondContact O-N 2.94Å; S731-E734 WeakPolarHBondContact CB-OE1 3.36Å; S731-E734 PolarHBondContact N-OE1 2.74Å; S731-E734 PolarHBondContact O-N 3.44Å; S731-E734 WeakPolarHBondContact OG-CG 3.18Å; S731-E734 PolarHBondContact OG-N 2.8Å; S731-E734 PolarHBondContact OG-OE1 2.89Å; S731-L735 PolarHBondContact O-N 3.01Å; S731-L735 VanDerWaalsContact O-N 3.17Å
732	V	78.9	Confident	82.5	Confident	33 Å²	33	70.5 Å²	70.5	20%	0.2	36%	0.358	C	S	.	.	H	α-helix	trans	-56	-38.7	177.4	-178.3	0	0	0	0	110.9	E734 L735 E736 I741 L749	V732-E734 VanDerWaalsContact C-N 3.3Å; V732-E734 PolarHBondContact O-N 3.37Å; V732-L735 PolarHBondContact O-N 3.36Å; V732-E736 PolarHBondContact O-N 3.12Å; V732-I741 HydrophobicContact CB-CD1 4.18Å; V732-I741 HydrophobicContact CG1-CD1 4.07Å; V732-L749 HydrophobicContact CB-CB 4.44Å; V732-L749 HydrophobicContact CG2-CB 4.08Å; V732-L749 HydrophobicContact CG2-CD2 4.27Å
733	S	76.7	Confident	82.3	Confident	58 Å²	58	72.5 Å²	72.5	41%	0.406	37%	0.368	S	S	.	.	H	α-helix	trans	-60.7	-31.7	177.1	-45.5	0	0	0	0	114.4	S731 P737 I741	S731-S733 PolarHBondContact O-N 2.94Å; S733-P737 WeakPolarHBondContact O-CA 3.37Å; S733-I741 WeakPolarHBondContact OG-CD1 3.26Å
734	E	80.1	Confident	82.1	Confident	120 Å²	120	80.1 Å²	80.1	56%	0.561	40%	0.401	S	S	*	.	H	α-helix	trans	-81.9	-34.7	176.8	-74.7	164.7	-86.1	0	0	112.2	P730 S731 V732	P730-E734 HydrophobicContact CB-CB 3.65Å; P730-E734 HydrophobicContact CB-CG 4.45Å; S731-E734 WeakPolarHBondContact CB-OE1 3.36Å; S731-E734 PolarHBondContact N-OE1 2.74Å; S731-E734 PolarHBondContact O-N 3.44Å; S731-E734 WeakPolarHBondContact OG-CG 3.18Å; S731-E734 PolarHBondContact OG-N 2.8Å; S731-E734 PolarHBondContact OG-OE1 2.89Å; V732-E734 VanDerWaalsContact C-N 3.3Å; V732-E734 PolarHBondContact O-N 3.37Å
735	L	79.4	Confident	81.9	Confident	50 Å²	50	80.4 Å²	80.4	26%	0.262	40%	0.404	S	S	.	.	H	α-helix	trans	-75.8	-40.8	-177.4	-155.8	76.3	0	0	0	111.5	P730 S731 V732 Y824	P730-L735 HydrophobicContact CG-CD1 4.38Å; S731-L735 PolarHBondContact O-N 3.01Å; S731-L735 VanDerWaalsContact O-N 3.17Å; V732-L735 PolarHBondContact O-N 3.36Å; L735-Y824 WeakPolarHBondContact CD1-O 3.45Å
736	E	79	Confident	81.7	Confident	111 Å²	111	80.6 Å²	80.6	52%	0.519	39%	0.39	S	S	.	.			trans	-129.3	74.7	179.5	-60.3	-159.7	137.1	0	0	111.9	V732 R738 V739	V732-E736 PolarHBondContact O-N 3.12Å; E736-R738 PolarHBondContact O-N 2.85Å; E736-V739 HydrophobicContact CB-CB 4.49Å; E736-V739 HydrophobicContact CB-CG2 3.7Å; E736-V739 PolarHBondContact O-N 2.97Å
737	P	77.3	Confident	81.3	Confident	109 Å²	109	86 Å²	86	71%	0.708	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	5.3	-174.7	28.6	-37.5	0	0	0	115.2	S733	S733-P737 WeakPolarHBondContact O-CA 3.37Å
738	R	78.5	Confident	80.8	Confident	247 Å²	247	89.3 Å²	89.3	93%	0.932	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-10.7	173.1	-56.7	-175.8	-168.6	167	3.9	113.1	E736	E736-R738 PolarHBondContact O-N 2.85Å
739	V	82.1	Confident	80.5	Confident	69 Å²	69	88.2 Å²	88.2	42%	0.418	43%	0.434	S	S	.	.	S	Bend	trans	-80.5	124.1	-176.7	176.1	0	0	0	0	110.1	E736 I741	E736-V739 HydrophobicContact CB-CB 4.49Å; E736-V739 HydrophobicContact CB-CG2 3.7Å; E736-V739 PolarHBondContact O-N 2.97Å; V739-I741 HydrophobicContact CG1-CG1 4.04Å; V739-I741 PolarHBondContact O-N 3.44Å
740	F	83.1	Confident	79.9	Confident	174 Å²	174	90.7 Å²	90.7	76%	0.763	45%	0.45	S	S	*	.			trans	-72.9	108.2	170	179.1	-96.3	0	0	0	109.9	P742	F740-P742 HydrophobicContact CD1-CG 4.45Å; F740-P742 HydrophobicContact CE1-CG 4.13Å
741	I	80.8	Confident	79.3	Confident	11 Å²	11	95.5 Å²	95.5	6%	0.056	47%	0.467	C	S	.	.			trans	-100.2	116.5	175.9	-61.2	170.9	0	0	0	108.9	V732 S733 V739 L745 R746 L749	V732-I741 HydrophobicContact CB-CD1 4.18Å; V732-I741 HydrophobicContact CG1-CD1 4.07Å; S733-I741 WeakPolarHBondContact OG-CD1 3.26Å; V739-I741 HydrophobicContact CG1-CG1 4.04Å; V739-I741 PolarHBondContact O-N 3.44Å; I741-L745 HydrophobicContact CG2-CB 4.18Å; I741-R746 HydrophobicContact CG2-CG 3.85Å; I741-R746 VanDerWaalsContact O-CZ 3.24Å; I741-R746 PolarHBondContact O-NH2 2.98Å; I741-L749 HydrophobicContact CG2-CD1 4.04Å
742	P	83.7	Confident	78.8	Confident	43 Å²	43	96.6 Å²	96.6	28%	0.279	47%	0.47	S	S	.	.			trans	-59.3	144.7	171.6	-24.5	34.4	0	0	0	112.5	F740 F744 L745 R746	F740-P742 HydrophobicContact CD1-CG 4.45Å; F740-P742 HydrophobicContact CE1-CG 4.13Å; P742-F744 VanDerWaalsContact C-N 3.31Å; P742-F744 HydrophobicContact CB-CD1 3.73Å; P742-F744 HydrophobicContact CB-CE1 3.37Å; P742-F744 HydrophobicContact CB-CZ 4.04Å; P742-F744 HydrophobicContact CG-CE1 4.16Å; P742-F744 HydrophobicContact CG-CZ 4.46Å; P742-F744 PolarHBondContact O-N 3.5Å; P742-L745 PolarHBondContact O-N 3.46Å; P742-R746 PolarHBondContact O-N 3.02Å
743	E	81.8	Confident	78.4	Confident	131 Å²	131	101 Å²	101	61%	0.612	50%	0.499	S	S	*	.	H	α-helix	trans	-53.5	-44.5	-174.2	-171.7	59.1	-118.8	0	0	113	L745 R746	E743-L745 PolarHBondContact O-N 3.39Å; E743-L745 VanDerWaalsContact O-N 3.09Å; E743-R746 WeakPolarHBondContact O-CB 3.22Å; E743-R746 PolarHBondContact O-N 2.71Å; E743-R746 WeakPolarHBondContact OE1-CD 3.15Å; E743-R746 IonicContact OE2-CZ 3.66Å; E743-R746 IonicContact OE2-NE 3.96Å; E743-R746 IonicContact OE2-NH1 2.66Å; E743-R746 PolarHBondContact OE2-NH1 3.16Å
744	F	84.3	Confident	78.2	Confident	160 Å²	160	99.9 Å²	99.9	70%	0.702	49%	0.491	S	S	*	.	H	α-helix	trans	-62.7	-19	-179.4	69.5	-91.8	0	0	0	114.3	P742	P742-F744 VanDerWaalsContact C-N 3.31Å; P742-F744 HydrophobicContact CB-CD1 3.73Å; P742-F744 HydrophobicContact CB-CE1 3.37Å; P742-F744 HydrophobicContact CB-CZ 4.04Å; P742-F744 HydrophobicContact CG-CE1 4.16Å; P742-F744 HydrophobicContact CG-CZ 4.46Å; P742-F744 PolarHBondContact O-N 3.5Å
745	L	82.8	Confident	77.5	Confident	67 Å²	67	98.2 Å²	98.2	35%	0.351	48%	0.483	S	S	.	.	H	α-helix	trans	-93	-17.3	173.6	-64	-176.5	0	0	0	113.3	I741 P742 E743 Q747 S748 L749	I741-L745 HydrophobicContact CG2-CB 4.18Å; P742-L745 PolarHBondContact O-N 3.46Å; E743-L745 PolarHBondContact O-N 3.39Å; E743-L745 VanDerWaalsContact O-N 3.09Å; L745-Q747 VanDerWaalsContact C-N 3.34Å; L745-Q747 PolarHBondContact O-N 3.41Å; L745-S748 PolarHBondContact O-N 3.43Å; L745-L749 HydrophobicContact CB-CD1 4.04Å; L745-L749 HydrophobicContact CB-CG 4.47Å; L745-L749 WeakPolarHBondContact O-CG 3.23Å; L745-L749 PolarHBondContact O-N 3.28Å
746	R	80.3	Confident	77.1	Confident	101 Å²	101	105.8 Å²	105.8	38%	0.381	51%	0.508	S	S	.	.	H	α-helix	trans	-55.8	-49.1	-177.2	-72	-173.5	167.6	107.5	11.8	111.2	I741 P742 E743 S748 L749 I750	I741-R746 HydrophobicContact CG2-CG 3.85Å; I741-R746 VanDerWaalsContact O-CZ 3.24Å; I741-R746 PolarHBondContact O-NH2 2.98Å; P742-R746 PolarHBondContact O-N 3.02Å; E743-R746 WeakPolarHBondContact O-CB 3.22Å; E743-R746 PolarHBondContact O-N 2.71Å; E743-R746 WeakPolarHBondContact OE1-CD 3.15Å; E743-R746 IonicContact OE2-CZ 3.66Å; E743-R746 IonicContact OE2-NE 3.96Å; E743-R746 IonicContact OE2-NH1 2.66Å; E743-R746 PolarHBondContact OE2-NH1 3.16Å; R746-S748 PolarHBondContact O-N 3.05Å; R746-L749 PolarHBondContact O-N 3.34Å; R746-L749 VanDerWaalsContact O-N 3.1Å; R746-I750 WeakPolarHBondContact O-CG1 3.35Å; R746-I750 PolarHBondContact O-N 2.81Å; R746-I750 VanDerWaalsContact O-N 3.17Å
747	Q	77.1	Confident	77	Confident	152 Å²	152	103.1 Å²	103.1	71%	0.71	50%	0.497	S	S	*	.	H	α-helix	trans	-60.3	-30.3	-179.8	-174.2	54.7	78.9	0	0	113.5	L745	L745-Q747 VanDerWaalsContact C-N 3.34Å; L745-Q747 PolarHBondContact O-N 3.41Å
748	S	76.7	Confident	77	Confident	85 Å²	85	98 Å²	98	59%	0.594	46%	0.464	S	S	*	.	H	α-helix	trans	-82	-27.4	177.7	-55.1	0	0	0	0	113.3	L745 R746	L745-S748 PolarHBondContact O-N 3.43Å; R746-S748 PolarHBondContact O-N 3.05Å
749	L	77.8	Confident	76.6	Confident	58 Å²	58	88.1 Å²	88.1	30%	0.304	44%	0.435	S	S	.	.	H	α-helix	trans	-101.3	4.6	-174.6	-61.2	178.7	0	0	0	114.4	V732 I741 L745 R746 R751	V732-L749 HydrophobicContact CB-CB 4.44Å; V732-L749 HydrophobicContact CG2-CB 4.08Å; V732-L749 HydrophobicContact CG2-CD2 4.27Å; I741-L749 HydrophobicContact CG2-CD1 4.04Å; L745-L749 HydrophobicContact CB-CD1 4.04Å; L745-L749 HydrophobicContact CB-CG 4.47Å; L745-L749 WeakPolarHBondContact O-CG 3.23Å; L745-L749 PolarHBondContact O-N 3.28Å; R746-L749 PolarHBondContact O-N 3.34Å; R746-L749 VanDerWaalsContact O-N 3.1Å; L749-R751 PolarHBondContact O-N 3.48Å
750	I	73.9	Confident	76.4	Confident	96 Å²	96	88.4 Å²	88.4	49%	0.492	43%	0.434	S	S	.	.	S	Bend	trans	-61.6	-31.2	170.3	-75.2	161.4	0	0	0	111.7	R746	R746-I750 WeakPolarHBondContact O-CG1 3.35Å; R746-I750 PolarHBondContact O-N 2.81Å; R746-I750 VanDerWaalsContact O-N 3.17Å
751	R	69.1	Low	75.9	Confident	113 Å²	113	82.8 Å²	82.8	43%	0.426	42%	0.415	S	S	.	.	S	Bend	trans	-120.5	130.4	-177.9	-72.3	-178.4	141.2	-92.9	-38.3	110.8	L749 E755	L749-R751 PolarHBondContact O-N 3.48Å; R751-E755 IonicContact CZ-OE1 3.08Å; R751-E755 IonicContact CZ-OE2 3.95Å; R751-E755 IonicContact NH1-OE1 2.73Å; R751-E755 PolarHBondContact NH1-OE1 2.95Å; R751-E755 IonicContact NH1-OE2 2.65Å; R751-E755 PolarHBondContact NH1-OE2 2.85Å; R751-E755 IonicContact NH2-OE1 2.91Å; R751-E755 PolarHBondContact NH2-OE1 3.47Å
752	Q	71.9	Confident	75.9	Confident	41 Å²	41	88.9 Å²	88.9	19%	0.192	44%	0.441	C	S	.	.			trans	-75.7	137.8	170.7	-56.6	-67.5	-8.6	0	0	110	W729 P730 C754	W729-Q752 HydrophobicContact CB-CB 4.23Å; W729-Q752 HydrophobicContact CB-CG 4.05Å; P730-Q752 VanDerWaalsContact O-CG 3.25Å; P730-Q752 WeakPolarHBondContact O-CG 3.49Å; P730-Q752 PolarHBondContact O-NE2 3.32Å; Q752-C754 WeakPolarHBondContact CB-SG 3.49Å; Q752-C754 PolarHBondContact O-N 3.41Å
753	P	70.5	Confident	76.1	Confident	126 Å²	126	87.4 Å²	87.4	82%	0.818	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-68.8	-10.7	174.3	28.8	-34.8	0	0	0	113.1	E755	P753-E755 VanDerWaalsContact C-N 3.3Å; P753-E755 PolarHBondContact O-N 3.08Å
754	C	71.1	Confident	76.4	Confident	33 Å²	33	86.4 Å²	86.4	22%	0.223	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-82.7	13.4	-177.5	62.4	0	0	0	0	115.3	Q752 R756 L757	Q752-C754 WeakPolarHBondContact CB-SG 3.49Å; Q752-C754 PolarHBondContact O-N 3.41Å; C754-R756 PolarHBondContact O-N 3.23Å; C754-L757 HydrophobicContact CB-CB 4.02Å; C754-L757 HydrophobicContact CB-CD2 4.48Å; C754-L757 WeakPolarHBondContact O-CB 3.21Å; C754-L757 PolarHBondContact O-N 3.08Å
755	E	66.9	Low	76.7	Confident	86 Å²	86	80.4 Å²	80.4	40%	0.402	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-52.5	-27.1	173.7	-73.6	-172.3	148.4	0	0	113.4	Q724 R751 P753	Q724-E755 PolarHBondContact NE2-O 3.41Å; R751-E755 IonicContact CZ-OE1 3.08Å; R751-E755 IonicContact CZ-OE2 3.95Å; R751-E755 IonicContact NH1-OE1 2.73Å; R751-E755 PolarHBondContact NH1-OE1 2.95Å; R751-E755 IonicContact NH1-OE2 2.65Å; R751-E755 PolarHBondContact NH1-OE2 2.85Å; R751-E755 IonicContact NH2-OE1 2.91Å; R751-E755 PolarHBondContact NH2-OE1 3.47Å; P753-E755 VanDerWaalsContact C-N 3.3Å; P753-E755 PolarHBondContact O-N 3.08Å
756	R	71.3	Confident	77.1	Confident	208 Å²	208	80.5 Å²	80.5	79%	0.785	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-98.8	5.5	176.4	-60.8	-172.8	-173.2	174.9	3.6	114.7	C754 I758 A759	C754-R756 PolarHBondContact O-N 3.23Å; R756-I758 VanDerWaalsContact C-N 3.34Å; R756-I758 PolarHBondContact O-N 3.22Å; R756-A759 WeakPolarHBondContact O-CB 3.39Å; R756-A759 PolarHBondContact O-N 3.47Å; R756-A759 VanDerWaalsContact O-N 3.15Å
757	L	75.1	Confident	77.6	Confident	56 Å²	56	78 Å²	78	29%	0.293	39%	0.393	S	S	.	.	S	Bend	trans	-54.6	-50.3	-172.6	-178.7	66.7	0	0	0	111.4	W729 C754 A759 R763 F790 V827	W729-L757 HydrophobicContact CH2-CD2 3.75Å; W729-L757 HydrophobicContact CZ2-CB 4.31Å; W729-L757 HydrophobicContact CZ2-CD2 4.14Å; C754-L757 HydrophobicContact CB-CB 4.02Å; C754-L757 HydrophobicContact CB-CD2 4.48Å; C754-L757 WeakPolarHBondContact O-CB 3.21Å; C754-L757 PolarHBondContact O-N 3.08Å; L757-A759 VanDerWaalsContact C-N 3.33Å; L757-A759 PolarHBondContact O-N 2.87Å; L757-R763 PolarHBondContact O-NH1 3.41Å; L757-F790 HydrophobicContact CD1-CE1 4.13Å; L757-F790 HydrophobicContact CD2-CE1 3.74Å; L757-F790 HydrophobicContact CD2-CZ 3.64Å; L757-F790 HydrophobicContact CG-CE1 3.88Å; L757-F790 HydrophobicContact CG-CZ 3.91Å; L757-V827 HydrophobicContact CD2-CG2 4.17Å
758	I	78.2	Confident	78.3	Confident	2 Å²	2	73.4 Å²	73.4	1%	0.01	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-25.1	-176.5	-61.9	-175.5	0	0	0	112.9	L720 I723 Q724 L727 R756 N760 F787 L792	L720-I758 HydrophobicContact CB-CG2 4.23Å; L720-I758 HydrophobicContact CD2-CG2 3.6Å; I723-I758 HydrophobicContact CG2-CD1 3.83Å; Q724-I758 HydrophobicContact CB-CB 4.46Å; Q724-I758 HydrophobicContact CB-CG2 4.42Å; L727-I758 HydrophobicContact CD2-CD1 3.44Å; L727-I758 VanDerWaalsContact CD2-CD1 3.44Å; R756-I758 VanDerWaalsContact C-N 3.34Å; R756-I758 PolarHBondContact O-N 3.22Å; I758-N760 PolarHBondContact O-N 2.95Å; I758-F787 HydrophobicContact CD1-CZ 4.32Å; I758-L792 HydrophobicContact CD1-CD2 3.94Å
759	A	69.3	Low	79.1	Confident	39 Å²	39	70 Å²	70	32%	0.322	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	6.5	-172.1	0	0	0	0	0	116.1	Q724 R756 L757 P761	Q724-A759 VanDerWaalsContact OE1-CB 3.29Å; R756-A759 WeakPolarHBondContact O-CB 3.39Å; R756-A759 PolarHBondContact O-N 3.47Å; R756-A759 VanDerWaalsContact O-N 3.15Å; L757-A759 VanDerWaalsContact C-N 3.33Å; L757-A759 PolarHBondContact O-N 2.87Å; A759-P761 WeakPolarHBondContact O-CD 3.43Å
760	N	77.7	Confident	79.7	Confident	75 Å²	75	72 Å²	72	40%	0.401	36%	0.356	S	S	.	.			trans	-79.9	116.1	-174.7	-175.6	-8.6	0	0	0	110.5	I758 K762 R763	I758-N760 PolarHBondContact O-N 2.95Å; N760-K762 PolarHBondContact O-N 2.84Å; N760-K762 PolarHBondContact OD1-N 3.36Å; N760-R763 PolarHBondContact O-N 3.28Å
761	P	73.6	Confident	80.6	Confident	55 Å²	55	67.8 Å²	67.8	36%	0.357	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-11.6	-179.7	27	-35.9	0	0	0	114.2	W713 F717 A759	W713-P761 HydrophobicContact CZ2-CB 3.82Å; W713-P761 PolarHBondContact NE1-O 3.47Å; F717-P761 HydrophobicContact CD2-CB 4.29Å; F717-P761 HydrophobicContact CE2-CB 4.11Å; A759-P761 WeakPolarHBondContact O-CD 3.43Å
762	K	80.2	Confident	81.7	Confident	139 Å²	139	64.6 Å²	64.6	60%	0.604	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-2.9	174.5	-63	-166	172.1	-169.2	0	114.4	D266 N760	D266-K762 WeakPolarHBondContact OD2-CE 3.28Å; D266-K762 IonicContact OD2-NZ 2.93Å; D266-K762 PolarHBondContact OD2-NZ 3.08Å; N760-K762 PolarHBondContact O-N 2.84Å; N760-K762 PolarHBondContact OD1-N 3.36Å
763	R	87.5	Confident	82.6	Confident	13 Å²	13	62.8 Å²	62.8	5%	0.049	32%	0.32	C	S	.	.			trans	-84.6	148.3	174.2	-179.8	167.2	-70.6	123.3	10.9	111.2	N716 L720 L757 N760 F787 D788 D789 F790	N716-R763 PolarHBondContact ND2-O 3.28Å; L720-R763 HydrophobicContact CD1-CB 4.45Å; L720-R763 WeakPolarHBondContact CD1-O 3.45Å; L757-R763 PolarHBondContact O-NH1 3.41Å; N760-R763 PolarHBondContact O-N 3.28Å; R763-F787 VanDerWaalsContact CD-CD1 3.48Å; R763-F787 HydrophobicContact CG-CB 4Å; R763-F787 HydrophobicContact CG-CD1 3.85Å; R763-F787 HydrophobicContact CG-CG 4.23Å; R763-D788 WeakPolarHBondContact CA-OD1 3.29Å; R763-D788 WeakPolarHBondContact CG-OD1 3.21Å; R763-D789 IonicContact CZ-OD1 3.63Å; R763-D789 IonicContact CZ-OD2 2.77Å; R763-D789 IonicContact NE-OD1 2.71Å; R763-D789 PolarHBondContact NE-OD1 2.99Å; R763-D789 IonicContact NE-OD2 3.4Å; R763-D789 IonicContact NH2-OD1 2.75Å; R763-D789 PolarHBondContact NH2-OD1 2.77Å; R763-D789 IonicContact NH2-OD2 2.7Å; R763-D789 PolarHBondContact NH2-OD2 3.12Å; R763-F790 VanDerWaalsContact NH2-CE1 3.31Å
764	Q	89.1	Confident	83.5	Confident	109 Å²	109	58.6 Å²	58.6	51%	0.509	29%	0.29	S	S	.	.			trans	-120.9	135.9	171.4	-65.2	-179.2	-10	0	0	111	N716 L766 F787 D788	N716-Q764 WeakPolarHBondContact OD1-CA 3.49Å; Q764-L766 HydrophobicContact CB-CD2 4.24Å; Q764-F787 CarbonylContact O-C 3.55Å; Q764-F787 WeakPolarHBondContact O-CA 3.42Å; Q764-D788 HydrophobicContact CB-CB 4.46Å; Q764-D788 PolarHBondContact N-OD1 3.48Å; Q764-D788 PolarHBondContact O-N 2.87Å; Q764-D788 VanDerWaalsContact O-N 3.09Å
765	L	90.8	Very high	83.9	Confident	35 Å²	35	59.3 Å²	59.3	18%	0.183	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	115.5	166.4	-179.8	71.7	0	0	0	108.4	N716 R719 I723 E768 F785 F787	N716-L765 PolarHBondContact OD1-N 2.86Å; R719-L765 HydrophobicContact CG-CD2 3.74Å; I723-L765 HydrophobicContact CD1-CD1 4.41Å; I723-L765 HydrophobicContact CD1-CD2 3.83Å; L765-E768 HydrophobicContact CD1-CB 4.45Å; L765-E768 HydrophobicContact CD2-CG 4.27Å; L765-E768 WeakPolarHBondContact CD2-OE2 3.48Å; L765-F785 HydrophobicContact CD1-CB 4.05Å; L765-F785 HydrophobicContact CD1-CD1 4.15Å; L765-F787 HydrophobicContact CB-CD1 4.16Å; L765-F787 HydrophobicContact CB-CE1 4.15Å; L765-F787 HydrophobicContact CD1-CD1 3.87Å; L765-F787 HydrophobicContact CD1-CE1 3.53Å; L765-F787 HydrophobicContact CD1-CZ 3.99Å; L765-F787 HydrophobicContact CG-CE1 4.43Å
766	L	90.4	Very high	84.4	Confident	69 Å²	69	59.3 Å²	59.3	36%	0.361	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-34.6	-175.6	-58.9	-177.5	0	0	0	112.6	Q764 L786 D788	Q764-L766 HydrophobicContact CB-CD2 4.24Å; L766-L786 HydrophobicContact CB-CG 4.34Å; L766-L786 PolarHBondContact N-O 2.88Å; L766-D788 HydrophobicContact CD1-CB 4.31Å
767	H	91.6	Very high	84.5	Confident	48 Å²	48	55.7 Å²	55.7	22%	0.222	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	152.3	175.3	-163	34.3	0	0	0	110.7	L786 W880 K883	H767-L786 HydrophobicContact CB-CB 4.21Å; H767-L786 HydrophobicContact CB-CD2 4.31Å; H767-L786 PolarHBondContact N-O 2.91Å; H767-L786 PolarHBondContact O-N 3.01Å; H767-W880 AromaticContact CD2-CD2 3.59Å; H767-W880 AromaticContact CD2-CE2 3.61Å; H767-W880 AromaticContact CD2-CE3 3.77Å; H767-W880 AromaticContact CD2-CH2 3.97Å; H767-W880 AromaticContact CD2-CZ2 3.82Å; H767-W880 AromaticContact CD2-CZ3 3.95Å; H767-W880 AromaticContact NE2-CD2 3.98Å; H767-W880 AromaticContact NE2-CE2 3.74Å; H767-W880 AromaticContact NE2-NE1 3.81Å; H767-K883 HydrophobicContact CB-CB 4.24Å; H767-K883 HydrophobicContact CB-CG 4.22Å
768	E	92.7	Very high	84.9	Confident	56 Å²	56	60 Å²	60	26%	0.262	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	154.7	171.1	58.2	165.3	-132.1	0	0	110	R719 L765 F783 A784 F785	R719-E768 IonicContact CZ-OE1 3.63Å; R719-E768 IonicContact CZ-OE2 2.69Å; R719-E768 IonicContact NE-OE1 3.44Å; R719-E768 IonicContact NE-OE2 3.99Å; R719-E768 PolarHBondContact NE-OE2 2.9Å; R719-E768 IonicContact NH2-OE1 3.43Å; R719-E768 PolarHBondContact NH2-OE1 3.46Å; R719-E768 IonicContact NH2-OE2 2.97Å; R719-E768 PolarHBondContact NH2-OE2 2.83Å; L765-E768 HydrophobicContact CD1-CB 4.45Å; L765-E768 HydrophobicContact CD2-CG 4.27Å; L765-E768 WeakPolarHBondContact CD2-OE2 3.48Å; E768-F783 HydrophobicContact CB-CE1 3.83Å; E768-F783 HydrophobicContact CB-CZ 4.12Å; E768-F783 HydrophobicContact CG-CE1 4.38Å; E768-F783 HydrophobicContact CG-CZ 4.31Å; E768-A784 VanDerWaalsContact CA-O 3.27Å; E768-A784 WeakPolarHBondContact CA-O 3.11Å; E768-F785 HydrophobicContact CB-CD1 3.88Å; E768-F785 HydrophobicContact CB-CE1 4.4Å
769	G	91.8	Very high	85.3	Confident	13 Å²	13	64.6 Å²	64.6	13%	0.134	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.5	175.2	177.8	0	0	0	0	0	115.7	F783 A784	G769-F783 WeakPolarHBondContact O-CA 3.36Å; G769-A784 PolarHBondContact N-O 2.73Å; G769-A784 VanDerWaalsContact N-O 3.11Å; G769-A784 PolarHBondContact O-N 2.94Å
770	F	91.6	Very high	86.3	Confident	100 Å²	100	63.6 Å²	63.6	44%	0.439	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	135.4	178.3	-67.6	-97.8	0	0	0	111.4	F783 I796 I815	F770-F783 HydrophobicContact CD1-CD2 4.11Å; F770-F783 AromaticContact CD2-CD2 3.83Å; F770-F783 HydrophobicContact CD2-CD2 3.83Å; F770-F783 AromaticContact CD2-CE2 3.68Å; F770-F783 HydrophobicContact CD2-CE2 3.68Å; F770-F783 HydrophobicContact CE1-CD2 4.11Å; F770-F783 AromaticContact CE2-CD2 3.8Å; F770-F783 HydrophobicContact CE2-CD2 3.8Å; F770-F783 AromaticContact CE2-CE2 3.52Å; F770-F783 HydrophobicContact CE2-CE2 3.52Å; F770-F783 AromaticContact CG-CD2 3.96Å; F770-F783 HydrophobicContact CG-CD2 3.96Å; F770-F783 HydrophobicContact CG-CE2 4.28Å; F770-F783 AromaticContact CZ-CD2 3.94Å; F770-F783 HydrophobicContact CZ-CD2 3.94Å; F770-F783 HydrophobicContact CZ-CE2 4.03Å; F770-I796 HydrophobicContact CD1-CD1 3.98Å; F770-I796 HydrophobicContact CE1-CD1 3.34Å; F770-I796 HydrophobicContact CZ-CD1 4.12Å; F770-I815 HydrophobicContact CE2-CB 4.12Å; F770-I815 HydrophobicContact CE2-CG2 3.59Å; F770-I815 HydrophobicContact CZ-CB 4.5Å; F770-I815 HydrophobicContact CZ-CG2 3.69Å
771	L	92.4	Very high	86.9	Confident	8 Å²	8	65.7 Å²	65.7	4%	0.042	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	161.8	171.4	-69.1	172.6	0	0	0	108.9	I782 A784 L869 Q870 A871 W880	L771-I782 HydrophobicContact CB-CD1 3.91Å; L771-I782 HydrophobicContact CB-CG1 3.86Å; L771-I782 PolarHBondContact N-O 3.05Å; L771-I782 WeakPolarHBondContact O-CG1 3.25Å; L771-I782 PolarHBondContact O-N 2.84Å; L771-A784 HydrophobicContact CD1-CB 4.05Å; L771-L869 HydrophobicContact CD1-CB 4.4Å; L771-L869 HydrophobicContact CD1-CD1 4.23Å; L771-L869 HydrophobicContact CD1-CD2 4.42Å; L771-Q870 WeakPolarHBondContact CA-O 3.22Å; L771-Q870 WeakPolarHBondContact CD2-O 3.46Å; L771-A871 HydrophobicContact CD2-CB 3.97Å; L771-W880 HydrophobicContact CD1-CD2 4.17Å; L771-W880 HydrophobicContact CD1-CZ2 4.17Å; L771-W880 HydrophobicContact CD2-CG 4.48Å; L771-W880 HydrophobicContact CG-CZ2 4.46Å
772	T	91.6	Very high	87.8	Confident	45 Å²	45	63.1 Å²	63.1	28%	0.276	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129.2	165.2	-56.9	0	0	0	0	109.3	T779 I780 L869 Q870	T772-T779 HydrophobicContact CG2-CG2 4.16Å; T772-I780 WeakPolarHBondContact CA-O 3.3Å; T772-L869 CarbonylContact O-C 3.47Å; T772-L869 WeakPolarHBondContact O-CA 3.41Å; T772-Q870 PolarHBondContact N-O 3.38Å; T772-Q870 PolarHBondContact O-N 3.13Å
773	L	91.8	Very high	88.4	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.021	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	126.6	175.6	173.7	61.2	0	0	0	110	I780 I782 V793 Y824 Y867 L869	L773-I780 PolarHBondContact N-O 2.95Å; L773-I780 PolarHBondContact O-N 2.81Å; L773-I782 HydrophobicContact CB-CD1 3.87Å; L773-I782 HydrophobicContact CB-CG1 4.15Å; L773-I782 HydrophobicContact CB-CG2 4.11Å; L773-V793 HydrophobicContact CD2-CG1 4.36Å; L773-Y824 HydrophobicContact CD2-CD1 3.79Å; L773-Y824 HydrophobicContact CD2-CE1 3.69Å; L773-Y867 HydrophobicContact CD1-CD1 3.85Å; L773-Y867 HydrophobicContact CD1-CG 4.27Å; L773-Y867 HydrophobicContact CD2-CD1 4.08Å; L773-Y867 HydrophobicContact CD2-CE1 4.38Å; L773-L869 HydrophobicContact CB-CD2 4.39Å; L773-L869 HydrophobicContact CD1-CD2 3.98Å
774	N	88.2	Confident	88.6	Confident	38 Å²	38	56.1 Å²	56.1	20%	0.203	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	99	-179.3	-66	25.1	0	0	0	109.7	G776 L848 T868 Q870	N774-G776 VanDerWaalsContact C-N 3.35Å; N774-G776 PolarHBondContact O-N 2.67Å; N774-L848 VanDerWaalsContact ND2-CD2 3.33Å; N774-L848 WeakPolarHBondContact ND2-CD2 3.37Å; N774-T868 HydrophobicContact CB-CG2 4.34Å; N774-T868 PolarHBondContact N-O 2.99Å; N774-Q870 PolarHBondContact ND2-NE2 3.32Å
775	D	81.1	Confident	88.8	Confident	48 Å²	48	51 Å²	51	26%	0.257	29%	0.286	S	S	.	.			trans	-97.1	57.9	-173.4	-149.4	-34.3	0	0	0	110.7	T777 K778 I780 Y824 R825	D775-T777 PolarHBondContact O-N 2.69Å; D775-K778 PolarHBondContact N-O 3.01Å; D775-I780 HydrophobicContact CB-CD1 3.63Å; D775-Y824 WeakPolarHBondContact OD2-CE1 3.26Å; D775-Y824 PolarHBondContact OD2-OH 3Å; D775-R825 VanDerWaalsContact CG-NH2 3.25Å; D775-R825 IonicContact OD1-NH2 3.97Å; D775-R825 PolarHBondContact OD1-NH2 3.28Å; D775-R825 IonicContact OD2-CZ 3.25Å; D775-R825 IonicContact OD2-NE 2.68Å; D775-R825 PolarHBondContact OD2-NE 2.73Å; D775-R825 IonicContact OD2-NH2 3.03Å; D775-R825 PolarHBondContact OD2-NH2 2.73Å
776	G	75.8	Confident	89	Confident	85 Å²	85	49.3 Å²	49.3	88%	0.876	28%	0.278	S	S	*	.	S	Bend	trans	68.7	-55.7	178.3	0	0	0	0	0	116	N774	N774-G776 VanDerWaalsContact C-N 3.35Å; N774-G776 PolarHBondContact O-N 2.67Å
777	T	73.8	Confident	89.1	Confident	132 Å²	132	46 Å²	46	81%	0.81	26%	0.261	S	S	*	.	S	Bend	trans	-118	-7.8	-177.4	55.3	0	0	0	0	113.5	D775	D775-T777 PolarHBondContact O-N 2.69Å
778	K	83.8	Confident	89.1	Confident	146 Å²	146	44.7 Å²	44.7	64%	0.635	26%	0.255	S	S	*	.			trans	-140.6	130.1	-175.3	-61.8	-177.2	-176.4	-179.5	0	110.8	D775	D775-K778 PolarHBondContact N-O 3.01Å
779	T	86.4	Confident	89	Confident	100 Å²	100	44 Å²	44	61%	0.613	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	141.1	161.9	46.2	0	0	0	0	109.3	T772	T772-T779 HydrophobicContact CG2-CG2 4.16Å
780	I	89.9	Confident	89	Confident	17 Å²	17	44.1 Å²	44.1	9%	0.087	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	119.2	-173.6	-58.2	164	0	0	0	108.7	T772 L773 D775 I782 R795 Y824	T772-I780 WeakPolarHBondContact CA-O 3.3Å; L773-I780 PolarHBondContact N-O 2.95Å; L773-I780 PolarHBondContact O-N 2.81Å; D775-I780 HydrophobicContact CB-CD1 3.63Å; I780-I782 HydrophobicContact CB-CG2 4.47Å; I780-I782 HydrophobicContact CG2-CG2 3.81Å; I780-I782 PolarHBondContact O-N 3.24Å; I780-R795 VanDerWaalsContact CD1-NH2 3.34Å; I780-R795 HydrophobicContact CG2-CG 3.77Å; I780-Y824 HydrophobicContact CD1-CE1 3.66Å; I780-Y824 WeakPolarHBondContact CD1-OH 3.5Å
781	E	90.5	Very high	89.1	Confident	120 Å²	120	39.6 Å²	39.6	56%	0.561	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-60	116.7	165.6	-66.6	-179.2	173.1	0	0	109.2	K798	E781-K798 IonicContact OE1-NZ 3.5Å; E781-K798 IonicContact OE2-NZ 3.96Å; E781-K798 PolarHBondContact OE2-NZ 2.9Å
782	I	92.2	Very high	89.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	154.2	175.5	57.8	158.5	0	0	0	111.2	L771 L773 I780 V793 T794 R795 L869	L771-I782 HydrophobicContact CB-CD1 3.91Å; L771-I782 HydrophobicContact CB-CG1 3.86Å; L771-I782 PolarHBondContact N-O 3.05Å; L771-I782 WeakPolarHBondContact O-CG1 3.25Å; L771-I782 PolarHBondContact O-N 2.84Å; L773-I782 HydrophobicContact CB-CD1 3.87Å; L773-I782 HydrophobicContact CB-CG1 4.15Å; L773-I782 HydrophobicContact CB-CG2 4.11Å; I780-I782 HydrophobicContact CB-CG2 4.47Å; I780-I782 HydrophobicContact CG2-CG2 3.81Å; I780-I782 PolarHBondContact O-N 3.24Å; I782-V793 HydrophobicContact CB-CG1 4.23Å; I782-V793 HydrophobicContact CD1-CG1 3.73Å; I782-V793 HydrophobicContact CG2-CG1 4.03Å; I782-T794 CarbonylContact C-O 3.49Å; I782-T794 WeakPolarHBondContact CA-O 3.48Å; I782-T794 WeakPolarHBondContact CB-O 3.46Å; I782-R795 HydrophobicContact CG2-CG 4.41Å; I782-L869 HydrophobicContact CD1-CD2 3.74Å
783	F	92.8	Very high	89.1	Confident	4 Å²	4	37.2 Å²	37.2	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	123.3	164.4	-159.8	-92.9	0	0	0	108	E768 G769 F770 F785 T794 I796 T816 F821	E768-F783 HydrophobicContact CB-CE1 3.83Å; E768-F783 HydrophobicContact CB-CZ 4.12Å; E768-F783 HydrophobicContact CG-CE1 4.38Å; E768-F783 HydrophobicContact CG-CZ 4.31Å; G769-F783 WeakPolarHBondContact O-CA 3.36Å; F770-F783 HydrophobicContact CD1-CD2 4.11Å; F770-F783 AromaticContact CD2-CD2 3.83Å; F770-F783 HydrophobicContact CD2-CD2 3.83Å; F770-F783 AromaticContact CD2-CE2 3.68Å; F770-F783 HydrophobicContact CD2-CE2 3.68Å; F770-F783 HydrophobicContact CE1-CD2 4.11Å; F770-F783 AromaticContact CE2-CD2 3.8Å; F770-F783 HydrophobicContact CE2-CD2 3.8Å; F770-F783 AromaticContact CE2-CE2 3.52Å; F770-F783 HydrophobicContact CE2-CE2 3.52Å; F770-F783 AromaticContact CG-CD2 3.96Å; F770-F783 HydrophobicContact CG-CD2 3.96Å; F770-F783 HydrophobicContact CG-CE2 4.28Å; F770-F783 AromaticContact CZ-CD2 3.94Å; F770-F783 HydrophobicContact CZ-CD2 3.94Å; F770-F783 HydrophobicContact CZ-CE2 4.03Å; F783-F785 HydrophobicContact CD1-CD1 4.27Å; F783-F785 HydrophobicContact CD1-CD2 4.23Å; F783-F785 AromaticContact CD1-CE1 3.75Å; F783-F785 HydrophobicContact CD1-CE1 3.75Å; F783-F785 AromaticContact CD1-CE2 3.7Å; F783-F785 HydrophobicContact CD1-CE2 3.7Å; F783-F785 HydrophobicContact CD1-CG 4.5Å; F783-F785 AromaticContact CD1-CZ 3.44Å; F783-F785 HydrophobicContact CD1-CZ 3.44Å; F783-F785 VanDerWaalsContact CD1-CZ 3.44Å; F783-F785 AromaticContact CE1-CD1 3.99Å; F783-F785 HydrophobicContact CE1-CD1 3.99Å; F783-F785 AromaticContact CE1-CE1 3.44Å; F783-F785 HydrophobicContact CE1-CE1 3.44Å; F783-F785 VanDerWaalsContact CE1-CE1 3.44Å; F783-F785 HydrophobicContact CE1-CE2 4.28Å; F783-F785 AromaticContact CE1-CZ 3.61Å; F783-F785 HydrophobicContact CE1-CZ 3.61Å; F783-T794 PolarHBondContact N-O 3Å; F783-T794 PolarHBondContact O-N 2.96Å; F783-T794 PolarHBondContact O-OG1 3.49Å; F783-I796 HydrophobicContact CB-CD1 4.15Å; F783-I796 HydrophobicContact CB-CG1 4.09Å; F783-I796 HydrophobicContact CD2-CD1 4.5Å; F783-T816 HydrophobicContact CE1-CG2 4.19Å; F783-T816 HydrophobicContact CE2-CG2 4.03Å; F783-T816 HydrophobicContact CZ-CG2 3.65Å; F783-F821 HydrophobicContact CB-CD1 3.91Å; F783-F821 HydrophobicContact CB-CE1 3.56Å; F783-F821 HydrophobicContact CD1-CD1 4.32Å; F783-F821 AromaticContact CD1-CE1 3.68Å; F783-F821 HydrophobicContact CD1-CE1 3.68Å; F783-F821 HydrophobicContact CD1-CZ 4.06Å; F783-F821 HydrophobicContact CD2-CE1 4.21Å; F783-F821 HydrophobicContact CE1-CE1 4.39Å; F783-F821 HydrophobicContact CE1-CZ 4.34Å; F783-F821 HydrophobicContact CG-CD1 4.3Å; F783-F821 AromaticContact CG-CE1 3.56Å; F783-F821 HydrophobicContact CG-CE1 3.56Å; F783-F821 HydrophobicContact CG-CZ 4.24Å
784	A	92.8	Very high	89.1	Confident	2 Å²	2	37 Å²	37	2%	0.017	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	138.7	-177.8	0	0	0	0	0	110.2	E768 G769 L771 L791 L792 W880	E768-A784 VanDerWaalsContact CA-O 3.27Å; E768-A784 WeakPolarHBondContact CA-O 3.11Å; G769-A784 PolarHBondContact N-O 2.73Å; G769-A784 VanDerWaalsContact N-O 3.11Å; G769-A784 PolarHBondContact O-N 2.94Å; L771-A784 HydrophobicContact CD1-CB 4.05Å; A784-L791 HydrophobicContact CB-CD1 4.39Å; A784-L792 WeakPolarHBondContact CA-O 3.13Å; A784-W880 HydrophobicContact CB-CH2 3.62Å; A784-W880 HydrophobicContact CB-CZ2 4.11Å; A784-W880 HydrophobicContact CB-CZ3 4.27Å
785	F	93.5	Very high	89.2	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	120.1	172.1	-56.5	-89.8	0	0	0	108.7	I723 L765 E768 F783 F787 L792 T794 F821	I723-F785 HydrophobicContact CB-CE1 4.44Å; I723-F785 HydrophobicContact CD1-CD1 3.6Å; I723-F785 HydrophobicContact CD1-CE1 3.49Å; I723-F785 VanDerWaalsContact CD1-CE1 3.49Å; I723-F785 HydrophobicContact CD1-CZ 4.45Å; I723-F785 HydrophobicContact CG1-CD1 4.18Å; I723-F785 HydrophobicContact CG1-CE1 3.57Å; I723-F785 HydrophobicContact CG1-CZ 4.14Å; I723-F785 HydrophobicContact CG2-CD1 4.36Å; I723-F785 HydrophobicContact CG2-CE1 3.99Å; I723-F785 HydrophobicContact CG2-CE2 4.3Å; I723-F785 HydrophobicContact CG2-CZ 3.95Å; L765-F785 HydrophobicContact CD1-CB 4.05Å; L765-F785 HydrophobicContact CD1-CD1 4.15Å; E768-F785 HydrophobicContact CB-CD1 3.88Å; E768-F785 HydrophobicContact CB-CE1 4.4Å; F783-F785 HydrophobicContact CD1-CD1 4.27Å; F783-F785 HydrophobicContact CD1-CD2 4.23Å; F783-F785 AromaticContact CD1-CE1 3.75Å; F783-F785 HydrophobicContact CD1-CE1 3.75Å; F783-F785 AromaticContact CD1-CE2 3.7Å; F783-F785 HydrophobicContact CD1-CE2 3.7Å; F783-F785 HydrophobicContact CD1-CG 4.5Å; F783-F785 AromaticContact CD1-CZ 3.44Å; F783-F785 HydrophobicContact CD1-CZ 3.44Å; F783-F785 VanDerWaalsContact CD1-CZ 3.44Å; F783-F785 AromaticContact CE1-CD1 3.99Å; F783-F785 HydrophobicContact CE1-CD1 3.99Å; F783-F785 AromaticContact CE1-CE1 3.44Å; F783-F785 HydrophobicContact CE1-CE1 3.44Å; F783-F785 VanDerWaalsContact CE1-CE1 3.44Å; F783-F785 HydrophobicContact CE1-CE2 4.28Å; F783-F785 AromaticContact CE1-CZ 3.61Å; F783-F785 HydrophobicContact CE1-CZ 3.61Å; F785-F787 HydrophobicContact CB-CD2 4.3Å; F785-F787 HydrophobicContact CB-CE2 3.46Å; F785-F787 VanDerWaalsContact CB-CE2 3.46Å; F785-F787 HydrophobicContact CB-CZ 3.64Å; F785-F787 HydrophobicContact CG-CE2 4.48Å; F785-F787 HydrophobicContact CG-CZ 4.32Å; F785-L792 HydrophobicContact CB-CB 4.35Å; F785-L792 HydrophobicContact CD2-CD2 4.13Å; F785-L792 PolarHBondContact N-O 3.07Å; F785-L792 PolarHBondContact O-N 2.71Å; F785-T794 HydrophobicContact CD2-CG2 4.06Å; F785-T794 HydrophobicContact CE2-CG2 3.91Å; F785-F821 HydrophobicContact CE2-CD1 4.28Å; F785-F821 HydrophobicContact CE2-CD2 4.46Å; F785-F821 HydrophobicContact CE2-CG 4.18Å; F785-F821 HydrophobicContact CZ-CD1 4.29Å; F785-F821 AromaticContact CZ-CD2 3.99Å; F785-F821 HydrophobicContact CZ-CD2 3.99Å; F785-F821 HydrophobicContact CZ-CE1 4.31Å; F785-F821 HydrophobicContact CZ-CE2 4.01Å; F785-F821 HydrophobicContact CZ-CG 4.13Å; F785-F821 HydrophobicContact CZ-CZ 4.18Å
786	L	94.4	Very high	89.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	119.8	175.7	177.4	60.8	0	0	0	109.4	L766 H767 L791 L830 W880 K883 L884	L766-L786 HydrophobicContact CB-CG 4.34Å; L766-L786 PolarHBondContact N-O 2.88Å; H767-L786 HydrophobicContact CB-CB 4.21Å; H767-L786 HydrophobicContact CB-CD2 4.31Å; H767-L786 PolarHBondContact N-O 2.91Å; H767-L786 PolarHBondContact O-N 3.01Å; L786-L791 HydrophobicContact CB-CD1 4.19Å; L786-L791 HydrophobicContact CD1-CB 4.39Å; L786-L791 HydrophobicContact CD1-CD1 4.29Å; L786-L830 HydrophobicContact CD1-CD2 3.7Å; L786-W880 HydrophobicContact CB-CZ3 4.09Å; L786-K883 HydrophobicContact CD2-CB 3.9Å; L786-L884 HydrophobicContact CD1-CD2 3.82Å; L786-L884 HydrophobicContact CD2-CD2 3.97Å; L786-L884 HydrophobicContact CD2-CG 4.25Å; L786-L884 HydrophobicContact CG-CD2 4.48Å
787	F	92.8	Very high	89.4	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	176.2	177.1	-56.8	-82.9	0	0	0	111.2	L720 I758 R763 Q764 L765 F785 D789 F790 L792	L720-F787 HydrophobicContact CD2-CD1 4.09Å; L720-F787 HydrophobicContact CD2-CE1 3.56Å; I758-F787 HydrophobicContact CD1-CZ 4.32Å; R763-F787 VanDerWaalsContact CD-CD1 3.48Å; R763-F787 HydrophobicContact CG-CB 4Å; R763-F787 HydrophobicContact CG-CD1 3.85Å; R763-F787 HydrophobicContact CG-CG 4.23Å; Q764-F787 CarbonylContact O-C 3.55Å; Q764-F787 WeakPolarHBondContact O-CA 3.42Å; L765-F787 HydrophobicContact CB-CD1 4.16Å; L765-F787 HydrophobicContact CB-CE1 4.15Å; L765-F787 HydrophobicContact CD1-CD1 3.87Å; L765-F787 HydrophobicContact CD1-CE1 3.53Å; L765-F787 HydrophobicContact CD1-CZ 3.99Å; L765-F787 HydrophobicContact CG-CE1 4.43Å; F785-F787 HydrophobicContact CB-CD2 4.3Å; F785-F787 HydrophobicContact CB-CE2 3.46Å; F785-F787 VanDerWaalsContact CB-CE2 3.46Å; F785-F787 HydrophobicContact CB-CZ 3.64Å; F785-F787 HydrophobicContact CG-CE2 4.48Å; F785-F787 HydrophobicContact CG-CZ 4.32Å; F787-D789 PolarHBondContact O-N 3.35Å; F787-F790 HydrophobicContact CB-CD2 4.46Å; F787-F790 AromaticContact CD2-CD2 3.54Å; F787-F790 HydrophobicContact CD2-CD2 3.54Å; F787-F790 AromaticContact CD2-CE2 3.24Å; F787-F790 HydrophobicContact CD2-CE2 3.24Å; F787-F790 HydrophobicContact CD2-CZ 4.13Å; F787-F790 HydrophobicContact CE2-CD2 4.21Å; F787-F790 AromaticContact CE2-CE2 3.56Å; F787-F790 HydrophobicContact CE2-CE2 3.56Å; F787-F790 HydrophobicContact CE2-CZ 4.42Å; F787-F790 HydrophobicContact CG-CD2 4.39Å; F787-F790 HydrophobicContact CG-CE2 4.13Å; F787-F790 PolarHBondContact N-O 2.95Å; F787-L792 HydrophobicContact CE2-CB 4.01Å; F787-L792 HydrophobicContact CE2-CD2 4.26Å
788	D	91.5	Very high	89	Confident	21 Å²	21	41.7 Å²	41.7	11%	0.112	20%	0.195	C	C	.	.	S	Bend	trans	-72.9	-7.1	179.7	73.5	-79	0	0	0	115.3	R763 Q764 L766 F891 K894	R763-D788 WeakPolarHBondContact CA-OD1 3.29Å; R763-D788 WeakPolarHBondContact CG-OD1 3.21Å; Q764-D788 HydrophobicContact CB-CB 4.46Å; Q764-D788 PolarHBondContact N-OD1 3.48Å; Q764-D788 PolarHBondContact O-N 2.87Å; Q764-D788 VanDerWaalsContact O-N 3.09Å; L766-D788 HydrophobicContact CD1-CB 4.31Å; D788-F891 WeakPolarHBondContact O-CD2 3.28Å; D788-K894 IonicContact OD2-NZ 3.25Å; D788-K894 PolarHBondContact OD2-NZ 3.24Å
789	D	89.7	Confident	87.7	Confident	42 Å²	42	38.5 Å²	38.5	23%	0.225	19%	0.189	C	C	.	.	S	Bend	trans	-129.9	-19.4	178.4	62.1	-16.6	0	0	0	115.1	R763 F787 L830 F891	R763-D789 IonicContact CZ-OD1 3.63Å; R763-D789 IonicContact CZ-OD2 2.77Å; R763-D789 IonicContact NE-OD1 2.71Å; R763-D789 PolarHBondContact NE-OD1 2.99Å; R763-D789 IonicContact NE-OD2 3.4Å; R763-D789 IonicContact NH2-OD1 2.75Å; R763-D789 PolarHBondContact NH2-OD1 2.77Å; R763-D789 IonicContact NH2-OD2 2.7Å; R763-D789 PolarHBondContact NH2-OD2 3.12Å; F787-D789 PolarHBondContact O-N 3.35Å; D789-L830 PolarHBondContact O-N 3.25Å; D789-F891 HydrophobicContact CB-CD2 4.21Å; D789-F891 HydrophobicContact CB-CE2 3.7Å
790	F	91.9	Very high	85.6	Confident	15 Å²	15	39.6 Å²	39.6	7%	0.066	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	164.1	176.7	61.2	-116.3	0	0	0	115.5	L757 R763 F787 L792 V827 I828	L757-F790 HydrophobicContact CD1-CE1 4.13Å; L757-F790 HydrophobicContact CD2-CE1 3.74Å; L757-F790 HydrophobicContact CD2-CZ 3.64Å; L757-F790 HydrophobicContact CG-CE1 3.88Å; L757-F790 HydrophobicContact CG-CZ 3.91Å; R763-F790 VanDerWaalsContact NH2-CE1 3.31Å; F787-F790 HydrophobicContact CB-CD2 4.46Å; F787-F790 AromaticContact CD2-CD2 3.54Å; F787-F790 HydrophobicContact CD2-CD2 3.54Å; F787-F790 AromaticContact CD2-CE2 3.24Å; F787-F790 HydrophobicContact CD2-CE2 3.24Å; F787-F790 HydrophobicContact CD2-CZ 4.13Å; F787-F790 HydrophobicContact CE2-CD2 4.21Å; F787-F790 AromaticContact CE2-CE2 3.56Å; F787-F790 HydrophobicContact CE2-CE2 3.56Å; F787-F790 HydrophobicContact CE2-CZ 4.42Å; F787-F790 HydrophobicContact CG-CD2 4.39Å; F787-F790 HydrophobicContact CG-CE2 4.13Å; F787-F790 PolarHBondContact N-O 2.95Å; F790-L792 HydrophobicContact CD2-CB 4.3Å; F790-L792 HydrophobicContact CE2-CB 4.11Å; F790-V827 HydrophobicContact CB-CG1 3.81Å; F790-V827 HydrophobicContact CD1-CG1 3.93Å; F790-V827 HydrophobicContact CD2-CG1 3.12Å; F790-V827 HydrophobicContact CE1-CG1 4.21Å; F790-V827 HydrophobicContact CE2-CG1 3.5Å; F790-V827 VanDerWaalsContact CE2-CG1 3.5Å; F790-V827 HydrophobicContact CG-CG1 3.37Å; F790-V827 HydrophobicContact CZ-CG1 4.03Å; F790-I828 CarbonylContact C-O 3.54Å; F790-I828 WeakPolarHBondContact CA-O 3.49Å; F790-I828 WeakPolarHBondContact CB-O 3.34Å
791	L	93.4	Very high	83.4	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128.4	165.9	179.7	65.9	0	0	0	110.2	A784 L786 I828 L854 W880 L884	A784-L791 HydrophobicContact CB-CD1 4.39Å; L786-L791 HydrophobicContact CB-CD1 4.19Å; L786-L791 HydrophobicContact CD1-CB 4.39Å; L786-L791 HydrophobicContact CD1-CD1 4.29Å; L791-I828 HydrophobicContact CB-CB 4.5Å; L791-I828 PolarHBondContact N-O 3Å; L791-I828 PolarHBondContact O-N 2.71Å; L791-L854 HydrophobicContact CD2-CD1 3.64Å; L791-W880 HydrophobicContact CD1-CZ3 4.29Å; L791-L884 HydrophobicContact CD1-CD2 4.43Å; L791-L884 HydrophobicContact CD2-CD2 4.22Å
792	L	92.4	Very high	81.1	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	125.1	177	-179.2	68.9	0	0	0	110.5	L727 W729 I758 A784 F785 F787 F790 T794 V823 V827	L727-L792 HydrophobicContact CD2-CD2 3.89Å; W729-L792 HydrophobicContact CH2-CD1 4.07Å; W729-L792 HydrophobicContact CZ3-CD1 4.48Å; I758-L792 HydrophobicContact CD1-CD2 3.94Å; A784-L792 WeakPolarHBondContact CA-O 3.13Å; F785-L792 HydrophobicContact CB-CB 4.35Å; F785-L792 HydrophobicContact CD2-CD2 4.13Å; F785-L792 PolarHBondContact N-O 3.07Å; F785-L792 PolarHBondContact O-N 2.71Å; F787-L792 HydrophobicContact CE2-CB 4.01Å; F787-L792 HydrophobicContact CE2-CD2 4.26Å; F790-L792 HydrophobicContact CD2-CB 4.3Å; F790-L792 HydrophobicContact CE2-CB 4.11Å; L792-T794 HydrophobicContact CD2-CG2 4.11Å; L792-T794 HydrophobicContact CG-CG2 3.97Å; L792-V823 HydrophobicContact CD1-CG1 4.01Å; L792-V823 HydrophobicContact CD1-CG2 4.07Å; L792-V827 HydrophobicContact CB-CG1 4.43Å; L792-V827 HydrophobicContact CD1-CB 4.5Å; L792-V827 HydrophobicContact CD1-CG1 4.12Å; L792-V827 HydrophobicContact CD1-CG2 3.9Å
793	V	92.7	Very high	78.2	Confident	4 Å²	4	62.2 Å²	62.2	2%	0.024	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	120.9	178.8	178.4	0	0	0	0	110	L773 I782 Y824 Y867	L773-V793 HydrophobicContact CD2-CG1 4.36Å; I782-V793 HydrophobicContact CB-CG1 4.23Å; I782-V793 HydrophobicContact CD1-CG1 3.73Å; I782-V793 HydrophobicContact CG2-CG1 4.03Å; V793-Y824 HydrophobicContact CG1-CD1 4.48Å; V793-Y824 PolarHBondContact O-N 3.43Å; V793-Y867 HydrophobicContact CG2-CE1 4.43Å
794	T	91.7	Very high	75.5	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	150.6	-178.7	74.7	0	0	0	0	112	L727 I782 F783 F785 L792 F821 V822	L727-T794 HydrophobicContact CD1-CG2 3.72Å; I782-T794 CarbonylContact C-O 3.49Å; I782-T794 WeakPolarHBondContact CA-O 3.48Å; I782-T794 WeakPolarHBondContact CB-O 3.46Å; F783-T794 PolarHBondContact N-O 3Å; F783-T794 PolarHBondContact O-N 2.96Å; F783-T794 PolarHBondContact O-OG1 3.49Å; F785-T794 HydrophobicContact CD2-CG2 4.06Å; F785-T794 HydrophobicContact CE2-CG2 3.91Å; L792-T794 HydrophobicContact CD2-CG2 4.11Å; L792-T794 HydrophobicContact CG-CG2 3.97Å; T794-F821 HydrophobicContact CG2-CB 4.31Å; T794-F821 WeakPolarHBondContact OG1-CD1 3.36Å; T794-V822 CarbonylContact C-O 3.6Å; T794-V822 VanDerWaalsContact CA-O 3.25Å; T794-V822 WeakPolarHBondContact CA-O 3.26Å; T794-V822 WeakPolarHBondContact CB-O 3.43Å
795	R	89.5	Confident	72.7	Confident	100 Å²	100	76.5 Å²	76.5	38%	0.377	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	144.1	165.2	-77.3	176.1	177.5	-167.8	0.8	109.5	I780 I782 V822 Y824	I780-R795 VanDerWaalsContact CD1-NH2 3.34Å; I780-R795 HydrophobicContact CG2-CG 3.77Å; I782-R795 HydrophobicContact CG2-CG 4.41Å; R795-V822 PolarHBondContact N-O 2.89Å; R795-V822 PolarHBondContact O-N 2.94Å; R795-Y824 HydrophobicContact CG-CD2 4.18Å; R795-Y824 HydrophobicContact CG-CG 4.05Å; R795-Y824 PolarHBondContact NH2-OH 3.48Å; R795-Y824 VanDerWaalsContact NH2-OH 3.07Å
796	I	84.5	Confident	70.1	Confident	40 Å²	40	81.7 Å²	81.7	21%	0.205	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	117.2	176.8	-57.2	171	0	0	0	109.7	F770 F783 K798 F821	F770-I796 HydrophobicContact CD1-CD1 3.98Å; F770-I796 HydrophobicContact CE1-CD1 3.34Å; F770-I796 HydrophobicContact CZ-CD1 4.12Å; F783-I796 HydrophobicContact CB-CD1 4.15Å; F783-I796 HydrophobicContact CB-CG1 4.09Å; F783-I796 HydrophobicContact CD2-CD1 4.5Å; I796-K798 HydrophobicContact CG2-CG 4.39Å; I796-K798 PolarHBondContact O-N 3Å; I796-F821 HydrophobicContact CD1-CE1 4.39Å; I796-F821 HydrophobicContact CG1-CD1 4.08Å; I796-F821 HydrophobicContact CG1-CE1 3.89Å
797	K	77.6	Confident	67.3	Low	115 Å²	115	90.3 Å²	90.3	50%	0.5	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	101.6	162.1	-78.4	-174.4	-177.1	163.9	0	108.5	V820 V822	K797-V820 HydrophobicContact CB-CB 4.39Å; K797-V820 PolarHBondContact N-O 2.77Å; K797-V822 HydrophobicContact CB-CG2 4.32Å; K797-V822 HydrophobicContact CD-CG2 3.56Å; K797-V822 HydrophobicContact CG-CG2 3.71Å
798	K	65.5	Low	64.3	Low	145 Å²	145	97.2 Å²	97.2	63%	0.63	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-59.3	126.8	168.2	-67.5	166.8	-173.4	160.3	0	107.5	E781 I796	E781-K798 IonicContact OE1-NZ 3.5Å; E781-K798 IonicContact OE2-NZ 3.96Å; E781-K798 PolarHBondContact OE2-NZ 2.9Å; I796-K798 HydrophobicContact CG2-CG 4.39Å; I796-K798 PolarHBondContact O-N 3Å
799	P	56.9	Low	61.5	Low	80 Å²	80	102 Å²	102	52%	0.519	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-62.3	147.1	-176.8	24.3	-33.7	0	0	0	111	K801	P799-K801 PolarHBondContact O-N 3.24Å; P799-K801 VanDerWaalsContact O-N 3.15Å
800	P	41.3	Very low	58.8	Low	123 Å²	123	107.2 Å²	107.2	80%	0.799	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-63.6	119.4	-177.3	25.6	-33.6	0	0	0	110.3	K802	P800-K802 PolarHBondContact O-N 3.29Å
801	K	42.9	Very low	56.1	Low	207 Å²	207	110.8 Å²	110.8	90%	0.9	57%	0.566	S	S	*	*			trans	-62	92.7	-179.7	-67.6	-174.2	178.2	-175.1	0	111	P799 K803	P799-K801 PolarHBondContact O-N 3.24Å; P799-K801 VanDerWaalsContact O-N 3.15Å; K801-K803 PolarHBondContact O-N 3.33Å
802	K	42.1	Very low	53	Low	195 Å²	195	114.5 Å²	114.5	85%	0.848	61%	0.605	S	S	*	*			trans	-61.4	126.6	159.5	-79.6	-171.3	174.4	-177.4	0	107.8	P800 S804	P800-K802 PolarHBondContact O-N 3.29Å; K802-S804 PolarHBondContact O-N 2.92Å
803	K	33.2	Very low	50.3	Low	209 Å²	209	122.7 Å²	122.7	91%	0.909	64%	0.636	S	S	*	*			trans	-66.4	113.3	175.4	-66.4	-176	179.1	-178.1	0	109.3	K801	K801-K803 PolarHBondContact O-N 3.33Å
804	S	34.2	Very low	48	Very low	112 Å²	112	126 Å²	126	78%	0.783	66%	0.659	S	S	*	*			trans	-142.8	143.5	162.1	-169.8	0	0	0	0	107.9	K802	K802-S804 PolarHBondContact O-N 2.92Å
805	F	34.6	Very low	46	Very low	195 Å²	195	132.7 Å²	132.7	86%	0.855	69%	0.694	S	S	*	*			trans	-88.1	-173.3	-179.7	-84	-107.8	0	0	0	111.5
806	S	39.9	Very low	44.5	Very low	109 Å²	109	128.3 Å²	128.3	76%	0.762	68%	0.678	S	S	*	*			trans	66.1	77.1	178.1	73.2	0	0	0	0	117.3
807	E	34.2	Very low	42.9	Very low	180 Å²	180	131.8 Å²	131.8	84%	0.841	69%	0.693	S	S	*	*				28.1	117.5	120.7	-61.4	172.5	160.1	0	0	119.6
808	N	31.1	Very low	42	Very low	145 Å²	145	128.9 Å²	128.9	78%	0.775	70%	0.696	S	S	*	*				-167.3	106.1	115.9	-122.3	-28.4	0	0	0	111.4	L810	N808-L810 VanDerWaalsContact C-N 3.33Å; N808-L810 PolarHBondContact O-N 3.42Å
809	P	32	Very low	42	Very low	121 Å²	121	122.7 Å²	122.7	79%	0.786	67%	0.673	S	S	*	*			trans	-91	36.6	-171.8	37.4	-36.8	0	0	0	114.3
810	L	33.2	Very low	43.2	Very low	153 Å²	153	121.1 Å²	121.1	80%	0.801	66%	0.662	S	S	*	*			trans	-123.5	65.7	-175.3	-70.6	174.8	0	0	0	112.7	N808	N808-L810 VanDerWaalsContact C-N 3.33Å; N808-L810 PolarHBondContact O-N 3.42Å
811	T	34.1	Very low	45.4	Very low	90 Å²	90	115.4 Å²	115.4	55%	0.552	63%	0.625	S	S	*	*	S	Bend	trans	-153.1	127	162.3	-14.7	0	0	0	0	109.5	R813	T811-R813 VanDerWaalsContact C-N 3.3Å; T811-R813 PolarHBondContact O-N 3.06Å
812	G	28.5	Very low	47.5	Very low	81 Å²	81	106.3 Å²	106.3	84%	0.835	59%	0.586	S	S	*	*			trans	-73.2	77.4	-177.3	0	0	0	0	0	112.7
813	R	36.3	Very low	49.6	Very low	173 Å²	173	97.2 Å²	97.2	65%	0.653	55%	0.547	S	S	*	.			trans	-62.7	150.7	177	-69.1	-165.9	179.6	-153.5	-2.4	112.2	T811 E817	T811-R813 VanDerWaalsContact C-N 3.3Å; T811-R813 PolarHBondContact O-N 3.06Å; R813-E817 VanDerWaalsContact CB-OE2 3.24Å; R813-E817 WeakPolarHBondContact CB-OE2 3.43Å; R813-E817 WeakPolarHBondContact CD-OE2 3.04Å; R813-E817 WeakPolarHBondContact CG-OE2 3.01Å
814	S	44.2	Very low	52.1	Low	73 Å²	73	89.3 Å²	89.3	51%	0.51	51%	0.512	S	S	.	.			trans	-62.6	135.4	164.4	179.2	0	0	0	0	108.9	T816 E817	S814-T816 PolarHBondContact O-N 2.98Å; S814-E817 VanDerWaalsContact O-CB 3.26Å; S814-E817 WeakPolarHBondContact O-CB 3.47Å; S814-E817 PolarHBondContact O-N 3.32Å
815	I	50.6	Low	54.4	Low	141 Å²	141	88.2 Å²	88.2	72%	0.723	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-8	-170.2	-36.1	-179.1	0	0	0	112.4	F770	F770-I815 HydrophobicContact CE2-CB 4.12Å; F770-I815 HydrophobicContact CE2-CG2 3.59Å; F770-I815 HydrophobicContact CZ-CB 4.5Å; F770-I815 HydrophobicContact CZ-CG2 3.69Å
816	T	57	Low	56.8	Low	7 Å²	7	86.3 Å²	86.3	4%	0.043	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-3	176.4	61.8	0	0	0	0	114.3	R719 F783 S814 G818 G819 F821	R719-T816 PolarHBondContact NH1-OG1 2.85Å; R719-T816 PolarHBondContact NH2-OG1 3.08Å; F783-T816 HydrophobicContact CE1-CG2 4.19Å; F783-T816 HydrophobicContact CE2-CG2 4.03Å; F783-T816 HydrophobicContact CZ-CG2 3.65Å; S814-T816 PolarHBondContact O-N 2.98Å; T816-G818 PolarHBondContact O-N 3.45Å; T816-G819 PolarHBondContact O-N 3.25Å; T816-F821 HydrophobicContact CG2-CE2 4.37Å; T816-F821 HydrophobicContact CG2-CZ 3.73Å
817	E	52.5	Low	59.1	Low	114 Å²	114	82.9 Å²	82.9	53%	0.533	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	93.3	-171.5	-165.7	-177.9	-177	0	0	113	R813 S814	R813-E817 VanDerWaalsContact CB-OE2 3.24Å; R813-E817 WeakPolarHBondContact CB-OE2 3.43Å; R813-E817 WeakPolarHBondContact CD-OE2 3.04Å; R813-E817 WeakPolarHBondContact CG-OE2 3.01Å; S814-E817 VanDerWaalsContact O-CB 3.26Å; S814-E817 WeakPolarHBondContact O-CB 3.47Å; S814-E817 PolarHBondContact O-N 3.32Å
818	G	57	Low	61.8	Low	54 Å²	54	74.7 Å²	74.7	56%	0.557	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.8	8	-176.9	0	0	0	0	0	115	T816	T816-G818 PolarHBondContact O-N 3.45Å
819	G	67	Low	64.6	Low	15 Å²	15	69.5 Å²	69.5	16%	0.155	40%	0.398	C	S	.	.			trans	-74.9	144.8	169.1	0	0	0	0	0	112.1	T816	T816-G819 PolarHBondContact O-N 3.25Å
820	V	82.3	Confident	67.4	Low	47 Å²	47	63.8 Å²	63.8	29%	0.285	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117.6	168.7	178.2	0	0	0	0	108.4	I728 K797	I728-V820 HydrophobicContact CD1-CG1 3.5Å; I728-V820 VanDerWaalsContact CD1-CG1 3.5Å; I728-V820 HydrophobicContact CG1-CG1 3.91Å; K797-V820 HydrophobicContact CB-CB 4.39Å; K797-V820 PolarHBondContact N-O 2.77Å
821	F	86.8	Confident	70	Confident	3 Å²	3	59.2 Å²	59.2	1%	0.013	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	135.6	179.4	-61.4	-72.7	0	0	0	109.9	Q726 L727 I728 F783 F785 T794 I796 T816	Q726-F821 HydrophobicContact CB-CD2 3.93Å; Q726-F821 HydrophobicContact CB-CE2 4.4Å; Q726-F821 PolarHBondContact O-N 3.23Å; L727-F821 WeakPolarHBondContact CA-O 3.35Å; L727-F821 HydrophobicContact CD1-CB 3.73Å; I728-F821 PolarHBondContact N-O 3.35Å; F783-F821 HydrophobicContact CB-CD1 3.91Å; F783-F821 HydrophobicContact CB-CE1 3.56Å; F783-F821 HydrophobicContact CD1-CD1 4.32Å; F783-F821 AromaticContact CD1-CE1 3.68Å; F783-F821 HydrophobicContact CD1-CE1 3.68Å; F783-F821 HydrophobicContact CD1-CZ 4.06Å; F783-F821 HydrophobicContact CD2-CE1 4.21Å; F783-F821 HydrophobicContact CE1-CE1 4.39Å; F783-F821 HydrophobicContact CE1-CZ 4.34Å; F783-F821 HydrophobicContact CG-CD1 4.3Å; F783-F821 AromaticContact CG-CE1 3.56Å; F783-F821 HydrophobicContact CG-CE1 3.56Å; F783-F821 HydrophobicContact CG-CZ 4.24Å; F785-F821 HydrophobicContact CE2-CD1 4.28Å; F785-F821 HydrophobicContact CE2-CD2 4.46Å; F785-F821 HydrophobicContact CE2-CG 4.18Å; F785-F821 HydrophobicContact CZ-CD1 4.29Å; F785-F821 AromaticContact CZ-CD2 3.99Å; F785-F821 HydrophobicContact CZ-CD2 3.99Å; F785-F821 HydrophobicContact CZ-CE1 4.31Å; F785-F821 HydrophobicContact CZ-CE2 4.01Å; F785-F821 HydrophobicContact CZ-CG 4.13Å; F785-F821 HydrophobicContact CZ-CZ 4.18Å; T794-F821 HydrophobicContact CG2-CB 4.31Å; T794-F821 WeakPolarHBondContact OG1-CD1 3.36Å; I796-F821 HydrophobicContact CD1-CE1 4.39Å; I796-F821 HydrophobicContact CG1-CD1 4.08Å; I796-F821 HydrophobicContact CG1-CE1 3.89Å; T816-F821 HydrophobicContact CG2-CE2 4.37Å; T816-F821 HydrophobicContact CG2-CZ 3.73Å
822	V	86.7	Confident	72.6	Confident	15 Å²	15	59 Å²	59	9%	0.091	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	120.9	176.4	-175.5	0	0	0	0	108.3	I728 P730 T794 R795 K797 Y824	I728-V822 HydrophobicContact CB-CG2 4.32Å; I728-V822 WeakPolarHBondContact O-CA 3.42Å; P730-V822 HydrophobicContact CG-CG1 3.71Å; T794-V822 CarbonylContact C-O 3.6Å; T794-V822 VanDerWaalsContact CA-O 3.25Å; T794-V822 WeakPolarHBondContact CA-O 3.26Å; T794-V822 WeakPolarHBondContact CB-O 3.43Å; R795-V822 PolarHBondContact N-O 2.89Å; R795-V822 PolarHBondContact O-N 2.94Å; K797-V822 HydrophobicContact CB-CG2 4.32Å; K797-V822 HydrophobicContact CD-CG2 3.56Å; K797-V822 HydrophobicContact CG-CG2 3.71Å; V822-Y824 PolarHBondContact O-N 2.89Å
823	V	87	Confident	75.7	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.024	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	125	179.2	179.7	0	0	0	0	109.5	L727 I728 W729 P730 L792 R825	L727-V823 HydrophobicContact CD1-CG2 3.62Å; L727-V823 HydrophobicContact CD2-CG2 3.93Å; L727-V823 HydrophobicContact CG-CG2 3.9Å; I728-V823 PolarHBondContact O-N 2.92Å; I728-V823 VanDerWaalsContact O-N 3.08Å; W729-V823 HydrophobicContact CD2-CG2 3.9Å; W729-V823 HydrophobicContact CE3-CB 4.11Å; W729-V823 HydrophobicContact CE3-CG1 4.15Å; W729-V823 HydrophobicContact CE3-CG2 3.63Å; W729-V823 HydrophobicContact CH2-CG2 4.09Å; W729-V823 HydrophobicContact CZ2-CG2 4.34Å; W729-V823 HydrophobicContact CZ3-CB 4.29Å; W729-V823 HydrophobicContact CZ3-CG1 3.93Å; W729-V823 HydrophobicContact CZ3-CG2 3.74Å; P730-V823 VanDerWaalsContact CG-O 3.29Å; P730-V823 WeakPolarHBondContact CG-O 3.04Å; L792-V823 HydrophobicContact CD1-CG1 4.01Å; L792-V823 HydrophobicContact CD1-CG2 4.07Å; V823-R825 VanDerWaalsContact CG1-O 3.25Å; V823-R825 WeakPolarHBondContact CG1-O 3.18Å
824	Y	84.8	Confident	78.2	Confident	43 Å²	43	49.6 Å²	49.6	17%	0.169	27%	0.271	C	S	.	.			trans	-90.3	-40.1	-172.4	-179	-136.1	0	0	0	113.2	L735 L773 D775 I780 V793 R795 V822	L735-Y824 WeakPolarHBondContact CD1-O 3.45Å; L773-Y824 HydrophobicContact CD2-CD1 3.79Å; L773-Y824 HydrophobicContact CD2-CE1 3.69Å; D775-Y824 WeakPolarHBondContact OD2-CE1 3.26Å; D775-Y824 PolarHBondContact OD2-OH 3Å; I780-Y824 HydrophobicContact CD1-CE1 3.66Å; I780-Y824 WeakPolarHBondContact CD1-OH 3.5Å; V793-Y824 HydrophobicContact CG1-CD1 4.48Å; V793-Y824 PolarHBondContact O-N 3.43Å; R795-Y824 HydrophobicContact CG-CD2 4.18Å; R795-Y824 HydrophobicContact CG-CG 4.05Å; R795-Y824 PolarHBondContact NH2-OH 3.48Å; R795-Y824 VanDerWaalsContact NH2-OH 3.07Å; V822-Y824 PolarHBondContact O-N 2.89Å
825	R	82.6	Confident	80.6	Confident	89 Å²	89	47.1 Å²	47.1	34%	0.336	25%	0.252	S	S	.	.	S	Bend	trans	-142.2	172.2	-177.6	-68.9	-178.3	171.9	-85.6	9.1	109	D775 V823 Y867	D775-R825 VanDerWaalsContact CG-NH2 3.25Å; D775-R825 IonicContact OD1-NH2 3.97Å; D775-R825 PolarHBondContact OD1-NH2 3.28Å; D775-R825 IonicContact OD2-CZ 3.25Å; D775-R825 IonicContact OD2-NE 2.68Å; D775-R825 PolarHBondContact OD2-NE 2.73Å; D775-R825 IonicContact OD2-NH2 3.03Å; D775-R825 PolarHBondContact OD2-NH2 2.73Å; V823-R825 VanDerWaalsContact CG1-O 3.25Å; V823-R825 WeakPolarHBondContact CG1-O 3.18Å; R825-Y867 HydrophobicContact CB-CE1 4.46Å; R825-Y867 VanDerWaalsContact CB-OH 3.32Å; R825-Y867 WeakPolarHBondContact CB-OH 3.36Å; R825-Y867 VanDerWaalsContact CD-OH 3.26Å; R825-Y867 WeakPolarHBondContact CD-OH 3.23Å
826	Q	85.3	Confident	82.5	Confident	155 Å²	155	45.8 Å²	45.8	72%	0.724	24%	0.243	S	C	*	.			trans	-55.2	143.7	176.2	-168.6	179.7	22.4	0	0	111.3
827	V	88.1	Confident	84.1	Confident	37 Å²	37	48.2 Å²	48.2	22%	0.224	26%	0.255	C	S	.	.			trans	-63.7	132.1	177.2	-158.5	0	0	0	0	110.3	W729 L757 F790 L792	W729-V827 HydrophobicContact CH2-CG2 3.82Å; W729-V827 HydrophobicContact CZ3-CG2 3.82Å; L757-V827 HydrophobicContact CD2-CG2 4.17Å; F790-V827 HydrophobicContact CB-CG1 3.81Å; F790-V827 HydrophobicContact CD1-CG1 3.93Å; F790-V827 HydrophobicContact CD2-CG1 3.12Å; F790-V827 HydrophobicContact CE1-CG1 4.21Å; F790-V827 HydrophobicContact CE2-CG1 3.5Å; F790-V827 VanDerWaalsContact CE2-CG1 3.5Å; F790-V827 HydrophobicContact CG-CG1 3.37Å; F790-V827 HydrophobicContact CZ-CG1 4.03Å; L792-V827 HydrophobicContact CB-CG1 4.43Å; L792-V827 HydrophobicContact CD1-CB 4.5Å; L792-V827 HydrophobicContact CD1-CG1 4.12Å; L792-V827 HydrophobicContact CD1-CG2 3.9Å
828	I	90.9	Very high	85.7	Confident	8 Å²	8	44.1 Å²	44.1	4%	0.041	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	113.2	-170.6	-44.1	175.2	0	0	0	110	F790 L791 F833 L856 Y867	F790-I828 CarbonylContact C-O 3.54Å; F790-I828 WeakPolarHBondContact CA-O 3.49Å; F790-I828 WeakPolarHBondContact CB-O 3.34Å; L791-I828 HydrophobicContact CB-CB 4.5Å; L791-I828 PolarHBondContact N-O 3Å; L791-I828 PolarHBondContact O-N 2.71Å; I828-F833 HydrophobicContact CG2-CD1 3.6Å; I828-F833 HydrophobicContact CG2-CE1 4.17Å; I828-L856 HydrophobicContact CD1-CD1 4.43Å; I828-L856 HydrophobicContact CD1-CD2 4.24Å; I828-L856 HydrophobicContact CG1-CD2 4.33Å; I828-L856 HydrophobicContact CG2-CD2 3.99Å; I828-L856 HydrophobicContact CG2-CG 4.07Å; I828-Y867 HydrophobicContact CD1-CD1 4.43Å; I828-Y867 HydrophobicContact CD1-CD2 4.46Å; I828-Y867 HydrophobicContact CD1-CE1 3.99Å; I828-Y867 HydrophobicContact CD1-CE2 4.04Å
829	A	90.6	Very high	86.8	Confident	37 Å²	37	43.1 Å²	43.1	31%	0.306	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	144.2	176.7	0	0	0	0	0	112.1	D831 R832	A829-D831 WeakPolarHBondContact CB-OD1 3.17Å; A829-D831 PolarHBondContact O-N 3.27Å; A829-R832 HydrophobicContact CB-CG 4.22Å; A829-R832 PolarHBondContact O-N 3.36Å
830	L	90.1	Very high	87.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-17.7	-174	-60.8	177.2	0	0	0	114.3	L786 D789 R832 F833 Q888 F891	L786-L830 HydrophobicContact CD1-CD2 3.7Å; D789-L830 PolarHBondContact O-N 3.25Å; L830-R832 VanDerWaalsContact C-N 3.32Å; L830-F833 HydrophobicContact CD2-CE1 3.99Å; L830-F833 HydrophobicContact CD2-CZ 3.9Å; L830-Q888 WeakPolarHBondContact O-CG 3.37Å; L830-Q888 PolarHBondContact O-NE2 2.78Å; L830-F891 HydrophobicContact CB-CB 4.11Å; L830-F891 HydrophobicContact CB-CD1 3.79Å; L830-F891 HydrophobicContact CB-CE1 4.4Å; L830-F891 HydrophobicContact CB-CG 4.02Å; L830-F891 HydrophobicContact CD1-CB 3.95Å; L830-F891 HydrophobicContact CD1-CG 4.25Å
831	D	88.4	Confident	87	Confident	57 Å²	57	52 Å²	52	31%	0.305	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	0.8	172.7	69.9	-49.8	0	0	0	113.8	A829 F891 L895	A829-D831 WeakPolarHBondContact CB-OD1 3.17Å; A829-D831 PolarHBondContact O-N 3.27Å; D831-F891 HydrophobicContact CB-CD1 4.25Å; D831-F891 HydrophobicContact CB-CE1 3.97Å; D831-L895 HydrophobicContact CB-CD1 4.34Å
832	R	88.8	Confident	86.8	Confident	87 Å²	87	56.8 Å²	56.8	33%	0.328	29%	0.294	S	S	.	.	S	Bend	trans	-119.4	21.3	-170	-58.8	-60.5	160.6	84.7	13	115.9	A829 L830 L856 I857	A829-R832 HydrophobicContact CB-CG 4.22Å; A829-R832 PolarHBondContact O-N 3.36Å; L830-R832 VanDerWaalsContact C-N 3.32Å; R832-L856 CarbonylContact O-C 3.5Å; R832-L856 VanDerWaalsContact O-CA 3.25Å; R832-L856 WeakPolarHBondContact O-CA 3.4Å; R832-I857 WeakPolarHBondContact CA-O 3.35Å; R832-I857 WeakPolarHBondContact CB-O 3.42Å; R832-I857 WeakPolarHBondContact CD-O 3.34Å; R832-I857 PolarHBondContact O-N 2.66Å
833	F	92.2	Very high	86.4	Confident	6 Å²	6	56.3 Å²	56.3	3%	0.026	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	155.6	167	60.2	-88.2	0	0	0	113.3	I828 L830 I835 L854 V855 L856 L884 Q888	I828-F833 HydrophobicContact CG2-CD1 3.6Å; I828-F833 HydrophobicContact CG2-CE1 4.17Å; L830-F833 HydrophobicContact CD2-CE1 3.99Å; L830-F833 HydrophobicContact CD2-CZ 3.9Å; F833-I835 HydrophobicContact CD2-CG1 3.86Å; F833-I835 HydrophobicContact CE2-CD1 4.09Å; F833-I835 HydrophobicContact CE2-CG1 3.69Å; F833-L854 HydrophobicContact CB-CB 4.47Å; F833-L854 HydrophobicContact CD2-CB 4.33Å; F833-L854 HydrophobicContact CD2-CD1 4.28Å; F833-L854 HydrophobicContact CD2-CD2 3.95Å; F833-L854 HydrophobicContact CD2-CG 4.42Å; F833-L854 HydrophobicContact CE2-CD1 4.32Å; F833-L854 HydrophobicContact CE2-CD2 4.14Å; F833-V855 CarbonylContact C-O 3.58Å; F833-V855 WeakPolarHBondContact CA-O 3.16Å; F833-V855 WeakPolarHBondContact CB-O 3.36Å; F833-L856 HydrophobicContact CB-CD1 4.5Å; F833-L856 HydrophobicContact CB-CG 4.46Å; F833-L884 HydrophobicContact CE2-CD2 4.21Å; F833-L884 HydrophobicContact CZ-CD2 3.99Å; F833-Q888 PolarHBondContact O-NE2 2.89Å
834	T	90.4	Very high	86	Confident	50 Å²	50	61 Å²	61	31%	0.307	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	146.1	165.6	52.9	0	0	0	0	110.1	H836 L854 V855 I857	T834-H836 WeakPolarHBondContact CB-NE2 3.24Å; T834-H836 PolarHBondContact OG1-NE2 2.89Å; T834-L854 WeakPolarHBondContact O-CA 3.17Å; T834-V855 PolarHBondContact N-O 3.13Å; T834-V855 PolarHBondContact O-N 3.33Å; T834-I857 HydrophobicContact CG2-CD1 3.76Å
835	I	93.4	Very high	85.6	Confident	21 Å²	21	63 Å²	63	11%	0.108	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	110.9	-173.7	-54.4	157.3	0	0	0	108.9	F833 I852 L854 I881 L884 R885	F833-I835 HydrophobicContact CD2-CG1 3.86Å; F833-I835 HydrophobicContact CE2-CD1 4.09Å; F833-I835 HydrophobicContact CE2-CG1 3.69Å; I835-I852 HydrophobicContact CG2-CG2 3.96Å; I835-L854 HydrophobicContact CB-CD2 4.27Å; I835-L854 HydrophobicContact CG1-CD2 3.93Å; I835-L854 HydrophobicContact CG2-CD2 4.14Å; I835-I881 HydrophobicContact CG2-CG1 4.49Å; I835-L884 HydrophobicContact CD1-CB 3.61Å; I835-L884 HydrophobicContact CG1-CB 4.4Å; I835-R885 HydrophobicContact CD1-CB 4.48Å; I835-R885 HydrophobicContact CD1-CG 3.72Å
836	H	90.8	Very high	85.3	Confident	113 Å²	113	64.1 Å²	64.1	52%	0.523	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.4	176.1	-58.8	-95	0	0	0	109	T834 V853	T834-H836 WeakPolarHBondContact CB-NE2 3.24Å; T834-H836 PolarHBondContact OG1-NE2 2.89Å; H836-V853 HydrophobicContact CB-CB 4.22Å; H836-V853 PolarHBondContact N-O 3.2Å; H836-V853 PolarHBondContact O-N 3.25Å
837	D	90.3	Very high	85	Confident	58 Å²	58	60 Å²	60	31%	0.31	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	116.8	177.3	-175.7	6.8	0	0	0	108.1	K877 Q878 I881	D837-K877 WeakPolarHBondContact OD1-CE 3.42Å; D837-K877 IonicContact OD1-NZ 2.77Å; D837-K877 PolarHBondContact OD1-NZ 3.34Å; D837-Q878 PolarHBondContact OD2-NE2 3.41Å; D837-I881 HydrophobicContact CB-CD1 3.91Å; D837-I881 VanDerWaalsContact CG-CD1 3.42Å; D837-I881 WeakPolarHBondContact OD1-CD1 3.43Å
838	L	85.7	Confident	84.8	Confident	28 Å²	28	59.5 Å²	59.5	15%	0.147	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-81.8	121.5	178.7	-71.7	171.4	0	0	0	109.9	E842 A843 L848 A851 V853 K877	L838-E842 HydrophobicContact CD2-CB 4.27Å; L838-A843 HydrophobicContact CB-CB 4.42Å; L838-L848 HydrophobicContact CD1-CD1 3.93Å; L838-A851 HydrophobicContact CD1-CB 3.77Å; L838-A851 PolarHBondContact N-O 3.32Å; L838-V853 HydrophobicContact CD1-CG2 3.66Å; L838-V853 HydrophobicContact CG-CG2 4.08Å; L838-K877 PolarHBondContact O-NZ 3.42Å
839	G	80.5	Confident	84.3	Confident	32 Å²	32	68.6 Å²	68.6	33%	0.33	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-64.8	154.3	174.6	0	0	0	0	0	111.5	V841 E842 A843	G839-V841 PolarHBondContact O-N 3.02Å; G839-V841 VanDerWaalsContact O-N 3.08Å; G839-E842 PolarHBondContact N-OE2 3.44Å; G839-E842 PolarHBondContact O-N 2.93Å; G839-A843 WeakPolarHBondContact O-CB 3.17Å; G839-A843 PolarHBondContact O-N 3.4Å
840	I	78	Confident	84	Confident	128 Å²	128	68.8 Å²	68.8	66%	0.656	38%	0.383	S	S	*	.	H	α-helix	trans	-53.2	-37.4	-176.6	-62	171.8	0	0	0	111.7	T844	I840-T844 VanDerWaalsContact O-CB 3.26Å; I840-T844 WeakPolarHBondContact O-CB 3.12Å; I840-T844 PolarHBondContact O-N 2.97Å; I840-T844 PolarHBondContact O-OG1 2.7Å
841	V	76.4	Confident	84	Confident	121 Å²	121	68.8 Å²	68.8	73%	0.733	38%	0.383	S	S	*	.	H	α-helix	trans	-65.7	-50.1	177.8	-176.1	0	0	0	0	111.7	G839 T844 A845	G839-V841 PolarHBondContact O-N 3.02Å; G839-V841 VanDerWaalsContact O-N 3.08Å; V841-T844 PolarHBondContact O-N 2.85Å; V841-A845 WeakPolarHBondContact O-CB 3.16Å; V841-A845 PolarHBondContact O-N 3.43Å
842	E	81.1	Confident	84.2	Confident	103 Å²	103	66.1 Å²	66.1	48%	0.481	37%	0.368	S	S	.	.	H	α-helix	trans	-66.8	-38.8	-179.3	-54.9	172	129.8	0	0	111.8	L838 G839 N846	L838-E842 HydrophobicContact CD2-CB 4.27Å; G839-E842 PolarHBondContact N-OE2 3.44Å; G839-E842 PolarHBondContact O-N 2.93Å; E842-N846 PolarHBondContact O-N 2.81Å; E842-N846 PolarHBondContact O-ND2 3.21Å
843	A	79.3	Confident	84.4	Confident	6 Å²	6	63 Å²	63	5%	0.05	36%	0.359	C	S	.	.	H	α-helix	trans	-62.1	-51.5	174.8	0	0	0	0	0	110.1	L838 G839 A845 N846 G847 L848	L838-A843 HydrophobicContact CB-CB 4.42Å; G839-A843 WeakPolarHBondContact O-CB 3.17Å; G839-A843 PolarHBondContact O-N 3.4Å; A843-A845 PolarHBondContact O-N 3.5Å; A843-N846 CarbonylContact O-C 3.57Å; A843-N846 PolarHBondContact O-N 3.47Å; A843-G847 PolarHBondContact O-N 3.34Å; A843-G847 VanDerWaalsContact O-N 3.14Å; A843-L848 CarbonylContact C-O 3.56Å; A843-L848 VanDerWaalsContact CB-O 3.3Å; A843-L848 WeakPolarHBondContact CB-O 3.4Å; A843-L848 PolarHBondContact O-N 3.25Å
844	T	77.7	Confident	84.5	Confident	103 Å²	103	62.8 Å²	62.8	63%	0.632	36%	0.358	S	S	*	.	H	α-helix	trans	-60.1	-44.8	178.3	-56.6	0	0	0	0	112.1	I840 V841 N846 G847	I840-T844 VanDerWaalsContact O-CB 3.26Å; I840-T844 WeakPolarHBondContact O-CB 3.12Å; I840-T844 PolarHBondContact O-N 2.97Å; I840-T844 PolarHBondContact O-OG1 2.7Å; V841-T844 PolarHBondContact O-N 2.85Å; T844-N846 PolarHBondContact O-N 3Å; T844-G847 PolarHBondContact O-N 3.23Å
845	A	76.4	Confident	84.6	Confident	83 Å²	83	61.4 Å²	61.4	69%	0.686	35%	0.35	S	S	*	.	H	α-helix	trans	-59.8	-32	178.6	0	0	0	0	0	113.2	V841 A843	V841-A845 WeakPolarHBondContact O-CB 3.16Å; V841-A845 PolarHBondContact O-N 3.43Å; A843-A845 PolarHBondContact O-N 3.5Å
846	N	76.8	Confident	84.6	Confident	114 Å²	114	61.6 Å²	61.6	61%	0.61	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	6.1	178	-68.8	-66.7	0	0	0	113.8	E842 A843 T844 L848	E842-N846 PolarHBondContact O-N 2.81Å; E842-N846 PolarHBondContact O-ND2 3.21Å; A843-N846 CarbonylContact O-C 3.57Å; A843-N846 PolarHBondContact O-N 3.47Å; T844-N846 PolarHBondContact O-N 3Å; N846-L848 HydrophobicContact CB-CD1 4.03Å; N846-L848 HydrophobicContact CB-CG 3.96Å; N846-L848 PolarHBondContact O-N 3.15Å
847	G	79.1	Confident	84.6	Confident	67 Å²	67	58.5 Å²	58.5	69%	0.691	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	15.8	-175.5	0	0	0	0	0	114.5	A843 T844	A843-G847 PolarHBondContact O-N 3.34Å; A843-G847 VanDerWaalsContact O-N 3.14Å; T844-G847 PolarHBondContact O-N 3.23Å
848	L	83.1	Confident	84.6	Confident	27 Å²	27	57.4 Å²	57.4	14%	0.141	33%	0.333	C	S	.	.			trans	-93.6	140.9	178.7	-54	176.2	0	0	0	109.4	N774 L838 A843 N846 A851 T868 Q870	N774-L848 VanDerWaalsContact ND2-CD2 3.33Å; N774-L848 WeakPolarHBondContact ND2-CD2 3.37Å; L838-L848 HydrophobicContact CD1-CD1 3.93Å; A843-L848 CarbonylContact C-O 3.56Å; A843-L848 VanDerWaalsContact CB-O 3.3Å; A843-L848 WeakPolarHBondContact CB-O 3.4Å; A843-L848 PolarHBondContact O-N 3.25Å; N846-L848 HydrophobicContact CB-CD1 4.03Å; N846-L848 HydrophobicContact CB-CG 3.96Å; N846-L848 PolarHBondContact O-N 3.15Å; L848-A851 HydrophobicContact CB-CB 3.9Å; L848-A851 HydrophobicContact CD1-CB 4.41Å; L848-T868 HydrophobicContact CD1-CG2 3.8Å; L848-T868 HydrophobicContact CD2-CG2 4.33Å; L848-Q870 VanDerWaalsContact CD2-NE2 3.3Å
849	R	81.2	Confident	84.6	Confident	199 Å²	199	62.1 Å²	62.1	75%	0.751	35%	0.349	S	S	*	.	S	Bend	trans	-117.1	139.6	172.8	-67	-172.5	-68	179.8	-0.4	110.2	A851	R849-A851 VanDerWaalsContact C-N 3.29Å; R849-A851 PolarHBondContact O-N 3.12Å
850	N	85.6	Confident	85	Confident	41 Å²	41	67.9 Å²	67.9	22%	0.219	37%	0.365	C	S	.	.	S	Bend	trans	46	49.6	176.4	-34.5	-42.1	0	0	0	112.7	A871 A872 N873 K877	N850-A871 HydrophobicContact CB-CB 4.34Å; N850-A871 WeakPolarHBondContact CB-O 3.46Å; N850-A871 PolarHBondContact ND2-O 2.81Å; N850-A871 PolarHBondContact O-N 3.24Å; N850-A872 PolarHBondContact ND2-O 3.42Å; N850-N873 VanDerWaalsContact ND2-CA 3.31Å; N850-N873 WeakPolarHBondContact ND2-CA 3.47Å; N850-N873 PolarHBondContact ND2-N 3.24Å; N850-K877 HydrophobicContact CB-CB 4.21Å
851	A	89.6	Confident	85.4	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	144.2	-163.9	0	0	0	0	0	114	L838 L848 R849 L869 Q870 K877	L838-A851 HydrophobicContact CD1-CB 3.77Å; L838-A851 PolarHBondContact N-O 3.32Å; L848-A851 HydrophobicContact CB-CB 3.9Å; L848-A851 HydrophobicContact CD1-CB 4.41Å; R849-A851 VanDerWaalsContact C-N 3.29Å; R849-A851 PolarHBondContact O-N 3.12Å; A851-L869 CarbonylContact C-O 3.59Å; A851-L869 WeakPolarHBondContact CA-O 3.49Å; A851-Q870 HydrophobicContact CB-CG 4.31Å; A851-K877 WeakPolarHBondContact O-CE 3.44Å
852	I	92.9	Very high	86	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.7	177.5	-47.9	170	0	0	0	107.2	I835 L854 L869 K877 W880 I881	I835-I852 HydrophobicContact CG2-CG2 3.96Å; I852-L854 HydrophobicContact CG2-CD2 4.06Å; I852-L869 HydrophobicContact CB-CB 4.48Å; I852-L869 PolarHBondContact N-O 3.12Å; I852-L869 PolarHBondContact O-N 3.33Å; I852-K877 HydrophobicContact CD1-CG 3.96Å; I852-K877 HydrophobicContact CG1-CG 3.54Å; I852-W880 HydrophobicContact CD1-CB 3.65Å; I852-I881 HydrophobicContact CD1-CD1 4.46Å; I852-I881 HydrophobicContact CD1-CG1 3.88Å; I852-I881 HydrophobicContact CG1-CD1 4.17Å; I852-I881 HydrophobicContact CG1-CG1 4.01Å; I852-I881 HydrophobicContact CG2-CG1 4.2Å
853	V	92.6	Very high	86.4	Confident	22 Å²	22	68.8 Å²	68.8	13%	0.133	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119.8	176.8	178.1	0	0	0	0	109.9	H836 L838 V855 V866 Y867 T868	H836-V853 HydrophobicContact CB-CB 4.22Å; H836-V853 PolarHBondContact N-O 3.2Å; H836-V853 PolarHBondContact O-N 3.25Å; L838-V853 HydrophobicContact CD1-CG2 3.66Å; L838-V853 HydrophobicContact CG-CG2 4.08Å; V853-V855 HydrophobicContact CG1-CG2 4.17Å; V853-V866 HydrophobicContact CG1-CG1 3.41Å; V853-V866 VanDerWaalsContact CG1-CG1 3.41Å; V853-Y867 WeakPolarHBondContact CA-O 3.44Å; V853-T868 HydrophobicContact CG2-CG2 4.33Å
854	L	93.8	Very high	86.9	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.005	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	115.8	172.9	-50.4	-175.4	0	0	0	109.4	L791 F833 T834 I835 I852 V866 Y867 L869 L884	L791-L854 HydrophobicContact CD2-CD1 3.64Å; F833-L854 HydrophobicContact CB-CB 4.47Å; F833-L854 HydrophobicContact CD2-CB 4.33Å; F833-L854 HydrophobicContact CD2-CD1 4.28Å; F833-L854 HydrophobicContact CD2-CD2 3.95Å; F833-L854 HydrophobicContact CD2-CG 4.42Å; F833-L854 HydrophobicContact CE2-CD1 4.32Å; F833-L854 HydrophobicContact CE2-CD2 4.14Å; T834-L854 WeakPolarHBondContact O-CA 3.17Å; I835-L854 HydrophobicContact CB-CD2 4.27Å; I835-L854 HydrophobicContact CG1-CD2 3.93Å; I835-L854 HydrophobicContact CG2-CD2 4.14Å; I852-L854 HydrophobicContact CG2-CD2 4.06Å; L854-V866 CarbonylContact O-C 3.56Å; L854-V866 WeakPolarHBondContact O-CA 3.38Å; L854-Y867 PolarHBondContact N-O 3.05Å; L854-Y867 PolarHBondContact O-N 2.85Å; L854-L869 HydrophobicContact CD1-CD1 3.67Å; L854-L869 HydrophobicContact CG-CD1 3.94Å; L854-L884 HydrophobicContact CD2-CD1 4.32Å
855	V	93.2	Very high	87.4	Confident	22 Å²	22	69 Å²	69	13%	0.133	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	116	176.3	179.5	0	0	0	0	108.4	F833 T834 V853 I857 I863 V866	F833-V855 CarbonylContact C-O 3.58Å; F833-V855 WeakPolarHBondContact CA-O 3.16Å; F833-V855 WeakPolarHBondContact CB-O 3.36Å; T834-V855 PolarHBondContact N-O 3.13Å; T834-V855 PolarHBondContact O-N 3.33Å; V853-V855 HydrophobicContact CG1-CG2 4.17Å; V855-I857 HydrophobicContact CG1-CG1 4.45Å; V855-I863 HydrophobicContact CG1-CD1 4.03Å; V855-I863 HydrophobicContact CG1-CG1 4.07Å; V855-I863 HydrophobicContact CG1-CG2 3.71Å; V855-V866 HydrophobicContact CG1-CG2 4.49Å; V855-V866 HydrophobicContact CG2-CG1 4.4Å; V855-V866 HydrophobicContact CG2-CG2 4.33Å
856	L	92.6	Very high	88.1	Confident	24 Å²	24	69 Å²	69	13%	0.126	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	127.8	-176	-78.8	69.5	0	0	0	110.7	I828 R832 F833 I863 T864 G865 Y867	I828-L856 HydrophobicContact CD1-CD1 4.43Å; I828-L856 HydrophobicContact CD1-CD2 4.24Å; I828-L856 HydrophobicContact CG1-CD2 4.33Å; I828-L856 HydrophobicContact CG2-CD2 3.99Å; I828-L856 HydrophobicContact CG2-CG 4.07Å; R832-L856 CarbonylContact O-C 3.5Å; R832-L856 VanDerWaalsContact O-CA 3.25Å; R832-L856 WeakPolarHBondContact O-CA 3.4Å; F833-L856 HydrophobicContact CB-CD1 4.5Å; F833-L856 HydrophobicContact CB-CG 4.46Å; L856-I863 CarbonylContact O-C 3.59Å; L856-I863 VanDerWaalsContact O-CA 3.29Å; L856-I863 WeakPolarHBondContact O-CA 3.48Å; L856-T864 PolarHBondContact O-N 3.27Å; L856-G865 PolarHBondContact N-O 3.43Å; L856-Y867 HydrophobicContact CD1-CD2 3.4Å; L856-Y867 HydrophobicContact CD1-CE2 3.6Å; L856-Y867 HydrophobicContact CD1-CG 4.44Å; L856-Y867 HydrophobicContact CD2-CD2 4.45Å; L856-Y867 HydrophobicContact CD2-CE2 3.77Å; L856-Y867 HydrophobicContact CG-CE2 4.37Å
857	I	92	Very high	88.8	Confident	48 Å²	48	64.8 Å²	64.8	25%	0.246	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	131.8	-174.2	-51.1	-176.2	0	0	0	109.1	R832 T834 V855 I863	R832-I857 WeakPolarHBondContact CA-O 3.35Å; R832-I857 WeakPolarHBondContact CB-O 3.42Å; R832-I857 WeakPolarHBondContact CD-O 3.34Å; R832-I857 PolarHBondContact O-N 2.66Å; T834-I857 HydrophobicContact CG2-CD1 3.76Å; V855-I857 HydrophobicContact CG1-CG1 4.45Å; I857-I863 HydrophobicContact CG1-CG1 4.43Å
858	T	89.7	Confident	89.4	Confident	36 Å²	36	63 Å²	63	22%	0.221	31%	0.309	C	S	.	.			trans	-81.5	170.4	177.6	64.5	0	0	0	0	112.8	F860 Q861 Q862 T864	T858-F860 PolarHBondContact O-N 3.24Å; T858-F860 PolarHBondContact OG1-N 2.81Å; T858-Q861 PolarHBondContact O-N 2.9Å; T858-Q862 PolarHBondContact N-O 3.39Å; T858-Q862 PolarHBondContact OG1-N 3.43Å; T858-Q862 PolarHBondContact OG1-O 3.45Å; T858-T864 HydrophobicContact CG2-CG2 3.42Å; T858-T864 VanDerWaalsContact CG2-CG2 3.42Å
859	R	85.9	Confident	89.9	Confident	127 Å²	127	62 Å²	62	48%	0.479	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-12.4	167.4	62.3	175.6	-77.3	148	-0.3	114.6
860	F	89.2	Confident	90.4	Very high	152 Å²	152	54.1 Å²	54.1	67%	0.667	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	19	177.8	-54	-65	0	0	0	112.1	T858 Q862	T858-F860 PolarHBondContact O-N 3.24Å; T858-F860 PolarHBondContact OG1-N 2.81Å; F860-Q862 PolarHBondContact O-N 2.66Å
861	Q	85.7	Confident	90.7	Very high	139 Å²	139	52.6 Å²	52.6	65%	0.65	27%	0.269	S	S	*	.	S	Bend	trans	60.6	-3.1	-177.6	-59.8	-179.3	-9.1	0	0	115.8	T858 I863	T858-Q861 PolarHBondContact O-N 2.9Å; Q861-I863 PolarHBondContact O-N 2.68Å
862	Q	89.2	Confident	90.7	Very high	128 Å²	128	56.8 Å²	56.8	60%	0.598	30%	0.304	S	S	*	.			trans	-62.7	126.8	171.9	-174.5	-176	16.4	0	0	110.7	T858 F860	T858-Q862 PolarHBondContact N-O 3.39Å; T858-Q862 PolarHBondContact OG1-N 3.43Å; T858-Q862 PolarHBondContact OG1-O 3.45Å; F860-Q862 PolarHBondContact O-N 2.66Å
863	I	90.3	Very high	90.5	Very high	105 Å²	105	59.7 Å²	59.7	54%	0.538	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	128.9	169	-61.7	171.3	0	0	0	108.7	V855 L856 I857 Q861	V855-I863 HydrophobicContact CG1-CD1 4.03Å; V855-I863 HydrophobicContact CG1-CG1 4.07Å; V855-I863 HydrophobicContact CG1-CG2 3.71Å; L856-I863 CarbonylContact O-C 3.59Å; L856-I863 VanDerWaalsContact O-CA 3.29Å; L856-I863 WeakPolarHBondContact O-CA 3.48Å; I857-I863 HydrophobicContact CG1-CG1 4.43Å; Q861-I863 PolarHBondContact O-N 2.68Å
864	T	89.2	Confident	90.4	Very high	88 Å²	88	61.6 Å²	61.6	54%	0.54	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	-13.3	-176.8	44.6	0	0	0	0	114.7	L856 T858	L856-T864 PolarHBondContact O-N 3.27Å; T858-T864 HydrophobicContact CG2-CG2 3.42Å; T858-T864 VanDerWaalsContact CG2-CG2 3.42Å
865	G	87.7	Confident	90.2	Very high	25 Å²	25	67.5 Å²	67.5	26%	0.258	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178	166.4	177.1	0	0	0	0	0	112.8	L856	L856-G865 PolarHBondContact N-O 3.43Å
866	V	91.8	Very high	90.2	Very high	84 Å²	84	68.3 Å²	68.3	51%	0.509	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	131.8	177.9	-176.7	0	0	0	0	108.2	V853 L854 V855	V853-V866 HydrophobicContact CG1-CG1 3.41Å; V853-V866 VanDerWaalsContact CG1-CG1 3.41Å; L854-V866 CarbonylContact O-C 3.56Å; L854-V866 WeakPolarHBondContact O-CA 3.38Å; V855-V866 HydrophobicContact CG1-CG2 4.49Å; V855-V866 HydrophobicContact CG2-CG1 4.4Å; V855-V866 HydrophobicContact CG2-CG2 4.33Å
867	Y	91.2	Very high	90.1	Very high	24 Å²	24	67.4 Å²	67.4	9%	0.094	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	111.3	177	-73.3	-122.6	0	0	0	108.7	L773 V793 R825 I828 V853 L854 L856	L773-Y867 HydrophobicContact CD1-CD1 3.85Å; L773-Y867 HydrophobicContact CD1-CG 4.27Å; L773-Y867 HydrophobicContact CD2-CD1 4.08Å; L773-Y867 HydrophobicContact CD2-CE1 4.38Å; V793-Y867 HydrophobicContact CG2-CE1 4.43Å; R825-Y867 HydrophobicContact CB-CE1 4.46Å; R825-Y867 VanDerWaalsContact CB-OH 3.32Å; R825-Y867 WeakPolarHBondContact CB-OH 3.36Å; R825-Y867 VanDerWaalsContact CD-OH 3.26Å; R825-Y867 WeakPolarHBondContact CD-OH 3.23Å; I828-Y867 HydrophobicContact CD1-CD1 4.43Å; I828-Y867 HydrophobicContact CD1-CD2 4.46Å; I828-Y867 HydrophobicContact CD1-CE1 3.99Å; I828-Y867 HydrophobicContact CD1-CE2 4.04Å; V853-Y867 WeakPolarHBondContact CA-O 3.44Å; L854-Y867 PolarHBondContact N-O 3.05Å; L854-Y867 PolarHBondContact O-N 2.85Å; L856-Y867 HydrophobicContact CD1-CD2 3.4Å; L856-Y867 HydrophobicContact CD1-CE2 3.6Å; L856-Y867 HydrophobicContact CD1-CG 4.44Å; L856-Y867 HydrophobicContact CD2-CD2 4.45Å; L856-Y867 HydrophobicContact CD2-CE2 3.77Å; L856-Y867 HydrophobicContact CG-CE2 4.37Å
868	T	92.5	Very high	90.2	Very high	29 Å²	29	68.7 Å²	68.7	18%	0.178	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	107.2	172.4	-57.6	0	0	0	0	108.9	N774 L848 V853	N774-T868 HydrophobicContact CB-CG2 4.34Å; N774-T868 PolarHBondContact N-O 2.99Å; L848-T868 HydrophobicContact CD1-CG2 3.8Å; L848-T868 HydrophobicContact CD2-CG2 4.33Å; V853-T868 HydrophobicContact CG2-CG2 4.33Å
869	L	93	Very high	90.3	Very high	6 Å²	6	70.7 Å²	70.7	3%	0.031	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	139.6	-178.1	-57.3	170.5	0	0	0	109.4	L771 T772 L773 I782 A851 I852 L854	L771-L869 HydrophobicContact CD1-CB 4.4Å; L771-L869 HydrophobicContact CD1-CD1 4.23Å; L771-L869 HydrophobicContact CD1-CD2 4.42Å; T772-L869 CarbonylContact O-C 3.47Å; T772-L869 WeakPolarHBondContact O-CA 3.41Å; L773-L869 HydrophobicContact CB-CD2 4.39Å; L773-L869 HydrophobicContact CD1-CD2 3.98Å; I782-L869 HydrophobicContact CD1-CD2 3.74Å; A851-L869 CarbonylContact C-O 3.59Å; A851-L869 WeakPolarHBondContact CA-O 3.49Å; I852-L869 HydrophobicContact CB-CB 4.48Å; I852-L869 PolarHBondContact N-O 3.12Å; I852-L869 PolarHBondContact O-N 3.33Å; L854-L869 HydrophobicContact CD1-CD1 3.67Å; L854-L869 HydrophobicContact CG-CD1 3.94Å
870	Q	91.7	Very high	90.7	Very high	34 Å²	34	65 Å²	65	16%	0.159	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.9	174.5	-57.3	-175.9	-30.2	0	0	110.2	L771 T772 N774 L848 A851	L771-Q870 WeakPolarHBondContact CA-O 3.22Å; L771-Q870 WeakPolarHBondContact CD2-O 3.46Å; T772-Q870 PolarHBondContact N-O 3.38Å; T772-Q870 PolarHBondContact O-N 3.13Å; N774-Q870 PolarHBondContact ND2-NE2 3.32Å; L848-Q870 VanDerWaalsContact CD2-NE2 3.3Å; A851-Q870 HydrophobicContact CB-CG 4.31Å
871	A	92.1	Very high	90.9	Very high	9 Å²	9	57.9 Å²	57.9	7%	0.074	31%	0.312	C	S	.	.			trans	-95.7	158.9	174.4	0	0	0	0	0	112.3	L771 N850 N873 D876 K877	L771-A871 HydrophobicContact CD2-CB 3.97Å; N850-A871 HydrophobicContact CB-CB 4.34Å; N850-A871 WeakPolarHBondContact CB-O 3.46Å; N850-A871 PolarHBondContact ND2-O 2.81Å; N850-A871 PolarHBondContact O-N 3.24Å; A871-N873 VanDerWaalsContact C-N 3.28Å; A871-N873 PolarHBondContact O-N 3.33Å; A871-D876 HydrophobicContact CB-CB 4.16Å; A871-K877 HydrophobicContact CB-CB 3.89Å
872	A	89.4	Confident	91.3	Very high	89 Å²	89	55.2 Å²	55.2	74%	0.736	30%	0.3	S	S	*	.	S	Bend	trans	-61.9	-34.9	-179.6	0	0	0	0	0	113.1	N850	N850-A872 PolarHBondContact ND2-O 3.42Å
873	N	89.2	Confident	91.5	Very high	61 Å²	61	51.5 Å²	51.5	33%	0.326	28%	0.282	S	S	.	.	S	Bend	trans	-147.4	167.8	177.3	60.4	71.3	0	0	0	110.4	N850 A871 L875 D876 K877	N850-N873 VanDerWaalsContact ND2-CA 3.31Å; N850-N873 WeakPolarHBondContact ND2-CA 3.47Å; N850-N873 PolarHBondContact ND2-N 3.24Å; A871-N873 VanDerWaalsContact C-N 3.28Å; A871-N873 PolarHBondContact O-N 3.33Å; N873-L875 VanDerWaalsContact C-N 3.32Å; N873-L875 PolarHBondContact O-N 3.3Å; N873-L875 WeakPolarHBondContact OD1-CA 3.26Å; N873-L875 WeakPolarHBondContact OD1-CB 3.48Å; N873-L875 PolarHBondContact OD1-N 3.43Å; N873-D876 PolarHBondContact ND2-OD2 3.24Å; N873-D876 PolarHBondContact O-N 2.99Å; N873-D876 PolarHBondContact OD1-N 3.05Å; N873-D876 PolarHBondContact OD1-OD2 2.97Å; N873-K877 PolarHBondContact O-N 3.05Å; N873-K877 VanDerWaalsContact O-N 3.13Å
874	E	88.5	Confident	91.7	Very high	62 Å²	62	46.6 Å²	46.6	29%	0.29	26%	0.256	S	S	.	.	H	α-helix	trans	-66	-30.4	-179.6	-172.6	64.4	-155.9	0	0	112.7	K877 Q878	E874-K877 WeakPolarHBondContact O-CB 3.26Å; E874-K877 PolarHBondContact O-N 3.12Å; E874-K877 WeakPolarHBondContact OE1-CD 3.25Å; E874-K877 IonicContact OE1-NZ 3.12Å; E874-K877 PolarHBondContact OE1-NZ 2.93Å; E874-K877 WeakPolarHBondContact OE2-CD 3.47Å; E874-K877 IonicContact OE2-NZ 2.84Å; E874-K877 PolarHBondContact OE2-NZ 2.94Å; E874-Q878 HydrophobicContact CG-CG 4.37Å; E874-Q878 WeakPolarHBondContact O-CB 3.12Å; E874-Q878 VanDerWaalsContact O-CG 3.32Å; E874-Q878 WeakPolarHBondContact O-CG 3.35Å; E874-Q878 PolarHBondContact O-N 2.93Å; E874-Q878 PolarHBondContact OE1-NE2 2.99Å
875	L	91.2	Very high	91.9	Very high	126 Å²	126	48.2 Å²	48.2	66%	0.66	25%	0.252	S	S	*	.	H	α-helix	trans	-65.3	-41.5	177.4	-59.8	175	0	0	0	111.2	N873 Q878 R879	N873-L875 VanDerWaalsContact C-N 3.32Å; N873-L875 PolarHBondContact O-N 3.3Å; N873-L875 WeakPolarHBondContact OD1-CA 3.26Å; N873-L875 WeakPolarHBondContact OD1-CB 3.48Å; N873-L875 PolarHBondContact OD1-N 3.43Å; L875-Q878 PolarHBondContact O-N 3.19Å; L875-R879 WeakPolarHBondContact O-CB 3.49Å; L875-R879 WeakPolarHBondContact O-CD 3.38Å; L875-R879 WeakPolarHBondContact O-CG 3.3Å; L875-R879 PolarHBondContact O-N 3.08Å
876	D	91.5	Very high	92.2	Very high	39 Å²	39	51 Å²	51	21%	0.209	26%	0.261	C	S	.	.	H	α-helix	trans	-68.3	-39	174.8	-71.1	-33	0	0	0	112	A871 N873 Q878 R879 W880	A871-D876 HydrophobicContact CB-CB 4.16Å; N873-D876 PolarHBondContact ND2-OD2 3.24Å; N873-D876 PolarHBondContact O-N 2.99Å; N873-D876 PolarHBondContact OD1-N 3.05Å; N873-D876 PolarHBondContact OD1-OD2 2.97Å; D876-Q878 PolarHBondContact O-N 3.44Å; D876-R879 PolarHBondContact O-N 3.34Å; D876-R879 WeakPolarHBondContact OD1-CD 3.4Å; D876-R879 IonicContact OD1-CZ 3.79Å; D876-R879 IonicContact OD1-NE 3.8Å; D876-R879 IonicContact OD1-NH1 2.81Å; D876-R879 PolarHBondContact OD1-NH1 3.05Å; D876-W880 WeakPolarHBondContact O-CB 3.41Å; D876-W880 PolarHBondContact O-N 3.45Å
877	K	92.4	Very high	92.2	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.017	24%	0.238	C	C	.	.	H	α-helix	trans	-57.4	-48.6	171.5	-176.5	-144.5	-170.5	-161.8	0	111.1	D837 L838 N850 A851 I852 A871 N873 E874 W880 I881	D837-K877 WeakPolarHBondContact OD1-CE 3.42Å; D837-K877 IonicContact OD1-NZ 2.77Å; D837-K877 PolarHBondContact OD1-NZ 3.34Å; L838-K877 PolarHBondContact O-NZ 3.42Å; N850-K877 HydrophobicContact CB-CB 4.21Å; A851-K877 WeakPolarHBondContact O-CE 3.44Å; I852-K877 HydrophobicContact CD1-CG 3.96Å; I852-K877 HydrophobicContact CG1-CG 3.54Å; A871-K877 HydrophobicContact CB-CB 3.89Å; N873-K877 PolarHBondContact O-N 3.05Å; N873-K877 VanDerWaalsContact O-N 3.13Å; E874-K877 WeakPolarHBondContact O-CB 3.26Å; E874-K877 PolarHBondContact O-N 3.12Å; E874-K877 WeakPolarHBondContact OE1-CD 3.25Å; E874-K877 IonicContact OE1-NZ 3.12Å; E874-K877 PolarHBondContact OE1-NZ 2.93Å; E874-K877 WeakPolarHBondContact OE2-CD 3.47Å; E874-K877 IonicContact OE2-NZ 2.84Å; E874-K877 PolarHBondContact OE2-NZ 2.94Å; K877-W880 PolarHBondContact O-N 3.28Å; K877-I881 HydrophobicContact CD-CD1 4.27Å; K877-I881 HydrophobicContact CG-CD1 4.01Å; K877-I881 VanDerWaalsContact O-CG1 3.31Å; K877-I881 WeakPolarHBondContact O-CG1 3.38Å; K877-I881 PolarHBondContact O-N 3.29Å
878	Q	92.8	Very high	92.2	Very high	76 Å²	76	47.5 Å²	47.5	36%	0.355	24%	0.241	S	C	.	.	H	α-helix	trans	-67.4	-38.7	179.2	-66.7	-60.6	-27.3	0	0	112.2	D837 E874 L875 D876 W880 I881 E882	D837-Q878 PolarHBondContact OD2-NE2 3.41Å; E874-Q878 HydrophobicContact CG-CG 4.37Å; E874-Q878 WeakPolarHBondContact O-CB 3.12Å; E874-Q878 VanDerWaalsContact O-CG 3.32Å; E874-Q878 WeakPolarHBondContact O-CG 3.35Å; E874-Q878 PolarHBondContact O-N 2.93Å; E874-Q878 PolarHBondContact OE1-NE2 2.99Å; L875-Q878 PolarHBondContact O-N 3.19Å; D876-Q878 PolarHBondContact O-N 3.44Å; Q878-W880 PolarHBondContact O-N 3.45Å; Q878-I881 PolarHBondContact O-N 3.44Å; Q878-E882 WeakPolarHBondContact O-CB 3.35Å; Q878-E882 PolarHBondContact O-N 3.01Å
879	R	92.8	Very high	92.2	Very high	78 Å²	78	51.5 Å²	51.5	29%	0.294	26%	0.257	S	S	.	.	H	α-helix	trans	-56.8	-47.1	169.3	-74.7	160.4	167.7	-179	-5.4	111.5	L875 D876 E882 K883 N1016	L875-R879 WeakPolarHBondContact O-CB 3.49Å; L875-R879 WeakPolarHBondContact O-CD 3.38Å; L875-R879 WeakPolarHBondContact O-CG 3.3Å; L875-R879 PolarHBondContact O-N 3.08Å; D876-R879 PolarHBondContact O-N 3.34Å; D876-R879 WeakPolarHBondContact OD1-CD 3.4Å; D876-R879 IonicContact OD1-CZ 3.79Å; D876-R879 IonicContact OD1-NE 3.8Å; D876-R879 IonicContact OD1-NH1 2.81Å; D876-R879 PolarHBondContact OD1-NH1 3.05Å; R879-E882 PolarHBondContact O-N 3.28Å; R879-K883 WeakPolarHBondContact O-CG 3.02Å; R879-K883 PolarHBondContact O-N 3.08Å; R879-N1016 PolarHBondContact NH2-OD1 3.04Å
880	W	93.9	Very high	92.1	Very high	8 Å²	8	53.5 Å²	53.5	3%	0.03	28%	0.275	C	S	.	.	H	α-helix	trans	-61.9	-45.4	176.9	-87.6	106.5	0	0	0	111.8	H767 L771 A784 L786 L791 I852 D876 K877 Q878 K883 L884	H767-W880 AromaticContact CD2-CD2 3.59Å; H767-W880 AromaticContact CD2-CE2 3.61Å; H767-W880 AromaticContact CD2-CE3 3.77Å; H767-W880 AromaticContact CD2-CH2 3.97Å; H767-W880 AromaticContact CD2-CZ2 3.82Å; H767-W880 AromaticContact CD2-CZ3 3.95Å; H767-W880 AromaticContact NE2-CD2 3.98Å; H767-W880 AromaticContact NE2-CE2 3.74Å; H767-W880 AromaticContact NE2-NE1 3.81Å; L771-W880 HydrophobicContact CD1-CD2 4.17Å; L771-W880 HydrophobicContact CD1-CZ2 4.17Å; L771-W880 HydrophobicContact CD2-CG 4.48Å; L771-W880 HydrophobicContact CG-CZ2 4.46Å; A784-W880 HydrophobicContact CB-CH2 3.62Å; A784-W880 HydrophobicContact CB-CZ2 4.11Å; A784-W880 HydrophobicContact CB-CZ3 4.27Å; L786-W880 HydrophobicContact CB-CZ3 4.09Å; L791-W880 HydrophobicContact CD1-CZ3 4.29Å; I852-W880 HydrophobicContact CD1-CB 3.65Å; D876-W880 WeakPolarHBondContact O-CB 3.41Å; D876-W880 PolarHBondContact O-N 3.45Å; K877-W880 PolarHBondContact O-N 3.28Å; Q878-W880 PolarHBondContact O-N 3.45Å; W880-K883 PolarHBondContact O-N 2.86Å; W880-L884 HydrophobicContact CE3-CD1 4.35Å; W880-L884 HydrophobicContact CE3-CG 4.38Å; W880-L884 VanDerWaalsContact O-CB 3.22Å; W880-L884 WeakPolarHBondContact O-CB 3.36Å; W880-L884 WeakPolarHBondContact O-CD1 3.41Å; W880-L884 WeakPolarHBondContact O-CG 3.21Å; W880-L884 PolarHBondContact O-N 3.38Å
881	I	93.2	Very high	91.9	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-61	-45.9	176.5	-67.7	162.3	0	0	0	111	I835 D837 I852 K877 Q878 R885	I835-I881 HydrophobicContact CG2-CG1 4.49Å; D837-I881 HydrophobicContact CB-CD1 3.91Å; D837-I881 VanDerWaalsContact CG-CD1 3.42Å; D837-I881 WeakPolarHBondContact OD1-CD1 3.43Å; I852-I881 HydrophobicContact CD1-CD1 4.46Å; I852-I881 HydrophobicContact CD1-CG1 3.88Å; I852-I881 HydrophobicContact CG1-CD1 4.17Å; I852-I881 HydrophobicContact CG1-CG1 4.01Å; I852-I881 HydrophobicContact CG2-CG1 4.2Å; K877-I881 HydrophobicContact CD-CD1 4.27Å; K877-I881 HydrophobicContact CG-CD1 4.01Å; K877-I881 VanDerWaalsContact O-CG1 3.31Å; K877-I881 WeakPolarHBondContact O-CG1 3.38Å; K877-I881 PolarHBondContact O-N 3.29Å; Q878-I881 PolarHBondContact O-N 3.44Å; I881-R885 HydrophobicContact CG2-CG 4.42Å; I881-R885 VanDerWaalsContact CG2-CZ 3.42Å; I881-R885 WeakPolarHBondContact O-CB 3.35Å; I881-R885 WeakPolarHBondContact O-CG 3.41Å; I881-R885 PolarHBondContact O-N 2.8Å
882	E	93.7	Very high	91.7	Very high	82 Å²	82	56.4 Å²	56.4	38%	0.383	29%	0.287	S	S	.	.	H	α-helix	trans	-59.5	-52.1	177.5	-169.9	-135.7	114.3	0	0	111.2	Q878 R879 R885 N886	Q878-E882 WeakPolarHBondContact O-CB 3.35Å; Q878-E882 PolarHBondContact O-N 3.01Å; R879-E882 PolarHBondContact O-N 3.28Å; E882-R885 PolarHBondContact O-N 2.97Å; E882-N886 VanDerWaalsContact O-CB 3.27Å; E882-N886 WeakPolarHBondContact O-CB 3.34Å; E882-N886 PolarHBondContact O-N 3.48Å; E882-N886 PolarHBondContact O-ND2 3.23Å; E882-N886 PolarHBondContact OE1-ND2 2.62Å
883	K	93.4	Very high	91.7	Very high	51 Å²	51	55.7 Å²	55.7	22%	0.222	27%	0.268	C	S	.	.	H	α-helix	trans	-66.2	-39.4	-179.8	-63.1	-49.7	178.7	-149.2	0	112.5	H767 L786 R879 W880 S887	H767-K883 HydrophobicContact CB-CB 4.24Å; H767-K883 HydrophobicContact CB-CG 4.22Å; L786-K883 HydrophobicContact CD2-CB 3.9Å; R879-K883 WeakPolarHBondContact O-CG 3.02Å; R879-K883 PolarHBondContact O-N 3.08Å; W880-K883 PolarHBondContact O-N 2.86Å; K883-S887 VanDerWaalsContact O-CB 3.24Å; K883-S887 WeakPolarHBondContact O-CB 3.48Å; K883-S887 PolarHBondContact O-N 2.6Å; K883-S887 PolarHBondContact O-OG 3.22Å; K883-S887 VanDerWaalsContact O-OG 3.1Å
884	L	93.9	Very high	91.5	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-62.8	-50.3	175.6	-73.5	166.4	0	0	0	111.1	L786 L791 F833 I835 L854 W880 N886 S887 Q888	L786-L884 HydrophobicContact CD1-CD2 3.82Å; L786-L884 HydrophobicContact CD2-CD2 3.97Å; L786-L884 HydrophobicContact CD2-CG 4.25Å; L786-L884 HydrophobicContact CG-CD2 4.48Å; L791-L884 HydrophobicContact CD1-CD2 4.43Å; L791-L884 HydrophobicContact CD2-CD2 4.22Å; F833-L884 HydrophobicContact CE2-CD2 4.21Å; F833-L884 HydrophobicContact CZ-CD2 3.99Å; I835-L884 HydrophobicContact CD1-CB 3.61Å; I835-L884 HydrophobicContact CG1-CB 4.4Å; L854-L884 HydrophobicContact CD2-CD1 4.32Å; W880-L884 HydrophobicContact CE3-CD1 4.35Å; W880-L884 HydrophobicContact CE3-CG 4.38Å; W880-L884 VanDerWaalsContact O-CB 3.22Å; W880-L884 WeakPolarHBondContact O-CB 3.36Å; W880-L884 WeakPolarHBondContact O-CD1 3.41Å; W880-L884 WeakPolarHBondContact O-CG 3.21Å; W880-L884 PolarHBondContact O-N 3.38Å; L884-N886 PolarHBondContact O-N 3.11Å; L884-S887 PolarHBondContact O-N 2.92Å; L884-S887 PolarHBondContact O-OG 3.46Å; L884-Q888 WeakPolarHBondContact O-CB 3.2Å; L884-Q888 PolarHBondContact O-N 2.8Å
885	R	93.9	Very high	91.3	Very high	122 Å²	122	56.4 Å²	56.4	46%	0.46	27%	0.27	S	S	.	.	H	α-helix	trans	-59.8	-47.6	177.3	-73.3	177.3	178.9	162.2	4.3	112	I835 I881 E882 S887 Q888 Q889	I835-R885 HydrophobicContact CD1-CB 4.48Å; I835-R885 HydrophobicContact CD1-CG 3.72Å; I881-R885 HydrophobicContact CG2-CG 4.42Å; I881-R885 VanDerWaalsContact CG2-CZ 3.42Å; I881-R885 WeakPolarHBondContact O-CB 3.35Å; I881-R885 WeakPolarHBondContact O-CG 3.41Å; I881-R885 PolarHBondContact O-N 2.8Å; E882-R885 PolarHBondContact O-N 2.97Å; R885-S887 PolarHBondContact O-N 2.86Å; R885-Q888 PolarHBondContact O-N 2.86Å; R885-Q889 PolarHBondContact O-N 3.13Å
886	N	93.4	Very high	91	Very high	83 Å²	83	55.7 Å²	55.7	44%	0.444	26%	0.261	S	S	.	.	H	α-helix	trans	-63.5	-42	179.8	-69.6	-12.2	0	0	0	112.1	E882 L884 A890	E882-N886 VanDerWaalsContact O-CB 3.27Å; E882-N886 WeakPolarHBondContact O-CB 3.34Å; E882-N886 PolarHBondContact O-N 3.48Å; E882-N886 PolarHBondContact O-ND2 3.23Å; E882-N886 PolarHBondContact OE1-ND2 2.62Å; L884-N886 PolarHBondContact O-N 3.11Å; N886-A890 WeakPolarHBondContact O-CB 3.24Å; N886-A890 PolarHBondContact O-N 2.74Å
887	S	92.4	Very high	90.6	Very high	4 Å²	4	61.6 Å²	61.6	3%	0.028	28%	0.281	C	S	.	.	H	α-helix	trans	-64.4	-42	175.5	70.7	0	0	0	0	112.2	K883 L884 R885 A890 F891	K883-S887 VanDerWaalsContact O-CB 3.24Å; K883-S887 WeakPolarHBondContact O-CB 3.48Å; K883-S887 PolarHBondContact O-N 2.6Å; K883-S887 PolarHBondContact O-OG 3.22Å; K883-S887 VanDerWaalsContact O-OG 3.1Å; L884-S887 PolarHBondContact O-N 2.92Å; L884-S887 PolarHBondContact O-OG 3.46Å; R885-S887 PolarHBondContact O-N 2.86Å; S887-A890 PolarHBondContact O-N 3.32Å; S887-F891 VanDerWaalsContact O-CB 3.27Å; S887-F891 WeakPolarHBondContact O-CB 3.01Å; S887-F891 PolarHBondContact O-N 3.34Å
888	Q	92.4	Very high	90.1	Very high	32 Å²	32	68.6 Å²	68.6	15%	0.15	31%	0.311	C	S	.	.	H	α-helix	trans	-64.2	-44	177.8	174.8	166.6	74.5	0	0	111.7	L830 F833 L884 R885 F891 Q892	L830-Q888 WeakPolarHBondContact O-CG 3.37Å; L830-Q888 PolarHBondContact O-NE2 2.78Å; F833-Q888 PolarHBondContact O-NE2 2.89Å; L884-Q888 WeakPolarHBondContact O-CB 3.2Å; L884-Q888 PolarHBondContact O-N 2.8Å; R885-Q888 PolarHBondContact O-N 2.86Å; Q888-F891 PolarHBondContact O-N 3.14Å; Q888-Q892 VanDerWaalsContact O-CG 3.3Å; Q888-Q892 WeakPolarHBondContact O-CG 3.46Å; Q888-Q892 PolarHBondContact O-N 2.97Å
889	Q	91.6	Very high	89.4	Confident	112 Å²	112	70.6 Å²	70.6	52%	0.523	32%	0.324	S	S	.	.	H	α-helix	trans	-62.8	-50.2	174.7	179.4	177.4	-19.8	0	0	111.4	R885 F891 Q892 E893	R885-Q889 PolarHBondContact O-N 3.13Å; Q889-F891 VanDerWaalsContact C-N 3.27Å; Q889-F891 PolarHBondContact O-N 2.67Å; Q889-Q892 PolarHBondContact O-N 3.02Å; Q889-Q892 VanDerWaalsContact O-N 3.11Å; Q889-E893 VanDerWaalsContact CG-OE1 3.31Å; Q889-E893 WeakPolarHBondContact CG-OE1 3.3Å; Q889-E893 PolarHBondContact NE2-OE1 3.01Å; Q889-E893 WeakPolarHBondContact O-CG 3.41Å; Q889-E893 PolarHBondContact O-N 3.23Å
890	A	90.5	Very high	87.9	Confident	49 Å²	49	75.1 Å²	75.1	41%	0.405	34%	0.342	S	S	.	.	H	α-helix	trans	-59.8	-37.6	179.2	0	0	0	0	0	112.1	N886 S887 E893 K894	N886-A890 WeakPolarHBondContact O-CB 3.24Å; N886-A890 PolarHBondContact O-N 2.74Å; S887-A890 PolarHBondContact O-N 3.32Å; A890-E893 PolarHBondContact O-N 3.18Å; A890-K894 WeakPolarHBondContact O-CB 3.39Å; A890-K894 PolarHBondContact O-N 3.11Å
891	F	88.5	Confident	86	Confident	29 Å²	29	77.9 Å²	77.9	13%	0.127	37%	0.373	C	S	.	.	H	α-helix	trans	-67.3	-42.6	174.2	-172.5	-110.3	0	0	0	112.2	D788 D789 L830 D831 S887 Q888 Q889 E893 K894 L895	D788-F891 WeakPolarHBondContact O-CD2 3.28Å; D789-F891 HydrophobicContact CB-CD2 4.21Å; D789-F891 HydrophobicContact CB-CE2 3.7Å; L830-F891 HydrophobicContact CB-CB 4.11Å; L830-F891 HydrophobicContact CB-CD1 3.79Å; L830-F891 HydrophobicContact CB-CE1 4.4Å; L830-F891 HydrophobicContact CB-CG 4.02Å; L830-F891 HydrophobicContact CD1-CB 3.95Å; L830-F891 HydrophobicContact CD1-CG 4.25Å; D831-F891 HydrophobicContact CB-CD1 4.25Å; D831-F891 HydrophobicContact CB-CE1 3.97Å; S887-F891 VanDerWaalsContact O-CB 3.27Å; S887-F891 WeakPolarHBondContact O-CB 3.01Å; S887-F891 PolarHBondContact O-N 3.34Å; Q888-F891 PolarHBondContact O-N 3.14Å; Q889-F891 VanDerWaalsContact C-N 3.27Å; Q889-F891 PolarHBondContact O-N 2.67Å; F891-E893 VanDerWaalsContact C-N 3.35Å; F891-E893 PolarHBondContact O-N 3.18Å; F891-K894 CarbonylContact O-C 3.5Å; F891-K894 WeakPolarHBondContact O-CB 3.46Å; F891-K894 PolarHBondContact O-N 3.46Å; F891-L895 HydrophobicContact CD1-CD1 3.89Å; F891-L895 HydrophobicContact CD1-CG 4.38Å; F891-L895 HydrophobicContact CE1-CD1 3.6Å; F891-L895 HydrophobicContact CE1-CG 4.17Å; F891-L895 HydrophobicContact CZ-CD1 4.19Å; F891-L895 HydrophobicContact CZ-CD2 4.42Å; F891-L895 HydrophobicContact CZ-CG 4.36Å; F891-L895 WeakPolarHBondContact O-CG 3.31Å; F891-L895 PolarHBondContact O-N 3.45Å
892	Q	88.2	Confident	83.8	Confident	74 Å²	74	82.3 Å²	82.3	35%	0.346	40%	0.396	S	S	.	.	H	α-helix	trans	-61.8	-40	173.3	-73.4	177.6	18.6	0	0	112.2	Q888 Q889 L895 K896	Q888-Q892 VanDerWaalsContact O-CG 3.3Å; Q888-Q892 WeakPolarHBondContact O-CG 3.46Å; Q888-Q892 PolarHBondContact O-N 2.97Å; Q889-Q892 PolarHBondContact O-N 3.02Å; Q889-Q892 VanDerWaalsContact O-N 3.11Å; Q892-L895 PolarHBondContact O-N 3.3Å; Q892-K896 WeakPolarHBondContact O-CB 3.36Å; Q892-K896 VanDerWaalsContact O-CG 3.27Å; Q892-K896 WeakPolarHBondContact O-CG 3.47Å; Q892-K896 PolarHBondContact O-N 2.58Å
893	E	87.8	Confident	81.3	Confident	75 Å²	75	82 Å²	82	35%	0.35	40%	0.396	S	S	.	.	H	α-helix	trans	-68.2	-33.5	174.6	-71	170.6	-168.2	0	0	112.7	Q889 A890 F891 R897	Q889-E893 VanDerWaalsContact CG-OE1 3.31Å; Q889-E893 WeakPolarHBondContact CG-OE1 3.3Å; Q889-E893 PolarHBondContact NE2-OE1 3.01Å; Q889-E893 WeakPolarHBondContact O-CG 3.41Å; Q889-E893 PolarHBondContact O-N 3.23Å; A890-E893 PolarHBondContact O-N 3.18Å; F891-E893 VanDerWaalsContact C-N 3.35Å; F891-E893 PolarHBondContact O-N 3.18Å; E893-R897 WeakPolarHBondContact O-CB 3.33Å; E893-R897 WeakPolarHBondContact O-CG 3.24Å; E893-R897 PolarHBondContact O-N 2.67Å; E893-R897 PolarHBondContact O-NE 3.48Å; E893-R897 VanDerWaalsContact O-NE 3.09Å
894	K	85.5	Confident	79	Confident	80 Å²	80	85.5 Å²	85.5	35%	0.348	42%	0.415	S	S	.	.	H	α-helix	trans	-70.5	-32.9	173.7	-172.7	173.2	-175.9	168.3	0	111.8	D788 A890 F891 K898	D788-K894 IonicContact OD2-NZ 3.25Å; D788-K894 PolarHBondContact OD2-NZ 3.24Å; A890-K894 WeakPolarHBondContact O-CB 3.39Å; A890-K894 PolarHBondContact O-N 3.11Å; F891-K894 CarbonylContact O-C 3.5Å; F891-K894 WeakPolarHBondContact O-CB 3.46Å; F891-K894 PolarHBondContact O-N 3.46Å; K894-K898 WeakPolarHBondContact O-CG 3.37Å; K894-K898 PolarHBondContact O-N 3.5Å
895	L	84.4	Confident	76.4	Confident	58 Å²	58	91.3 Å²	91.3	30%	0.304	45%	0.447	S	S	.	.	H	α-helix	trans	-73.2	-46.5	170.4	-72.2	176.5	0	0	0	111.9	D831 F891 Q892 R897 K898 L899	D831-L895 HydrophobicContact CB-CD1 4.34Å; F891-L895 HydrophobicContact CD1-CD1 3.89Å; F891-L895 HydrophobicContact CD1-CG 4.38Å; F891-L895 HydrophobicContact CE1-CD1 3.6Å; F891-L895 HydrophobicContact CE1-CG 4.17Å; F891-L895 HydrophobicContact CZ-CD1 4.19Å; F891-L895 HydrophobicContact CZ-CD2 4.42Å; F891-L895 HydrophobicContact CZ-CG 4.36Å; F891-L895 WeakPolarHBondContact O-CG 3.31Å; F891-L895 PolarHBondContact O-N 3.45Å; Q892-L895 PolarHBondContact O-N 3.3Å; L895-R897 PolarHBondContact O-N 3.5Å; L895-K898 WeakPolarHBondContact O-CB 3.37Å; L895-K898 PolarHBondContact O-N 2.9Å; L895-K898 VanDerWaalsContact O-N 3.11Å; L895-L899 WeakPolarHBondContact O-CG 3.43Å; L895-L899 PolarHBondContact O-N 3.38Å
896	K	85.5	Confident	73.6	Confident	110 Å²	110	91.7 Å²	91.7	48%	0.478	45%	0.454	S	S	.	.	H	α-helix	trans	-55.1	-50	175.8	-75.7	168.1	-177.9	173.9	0	111.3	Q892 K898 L899 Y900	Q892-K896 WeakPolarHBondContact O-CB 3.36Å; Q892-K896 VanDerWaalsContact O-CG 3.27Å; Q892-K896 WeakPolarHBondContact O-CG 3.47Å; Q892-K896 PolarHBondContact O-N 2.58Å; K896-K898 VanDerWaalsContact C-N 3.27Å; K896-K898 PolarHBondContact O-N 2.81Å; K896-L899 PolarHBondContact O-N 3.13Å; K896-Y900 HydrophobicContact CB-CD2 4.2Å; K896-Y900 HydrophobicContact CB-CE2 4.22Å; K896-Y900 HydrophobicContact CG-CE2 4.37Å; K896-Y900 WeakPolarHBondContact O-CD2 3.16Å; K896-Y900 PolarHBondContact O-N 3.45Å
897	R	82.7	Confident	70.7	Confident	163 Å²	163	93.7 Å²	93.7	62%	0.615	46%	0.46	S	S	*	.	H	α-helix	trans	-57	-37.1	176.4	-80.2	177	-80.9	179.9	-12.9	113.3	E893 L895	E893-R897 WeakPolarHBondContact O-CB 3.33Å; E893-R897 WeakPolarHBondContact O-CG 3.24Å; E893-R897 PolarHBondContact O-N 2.67Å; E893-R897 PolarHBondContact O-NE 3.48Å; E893-R897 VanDerWaalsContact O-NE 3.09Å; L895-R897 PolarHBondContact O-N 3.5Å
898	K	82.4	Confident	67.9	Low	152 Å²	152	97 Å²	97	66%	0.661	48%	0.48	S	S	*	.	H	α-helix	trans	-71	-43.1	175	-74	175.4	176.5	-174.5	0	113	K894 L895 K896	K894-K898 WeakPolarHBondContact O-CG 3.37Å; K894-K898 PolarHBondContact O-N 3.5Å; L895-K898 WeakPolarHBondContact O-CB 3.37Å; L895-K898 PolarHBondContact O-N 2.9Å; L895-K898 VanDerWaalsContact O-N 3.11Å; K896-K898 VanDerWaalsContact C-N 3.27Å; K896-K898 PolarHBondContact O-N 2.81Å
899	L	77.6	Confident	65.3	Low	117 Å²	117	101 Å²	101	61%	0.613	50%	0.502	S	S	*	.	H	α-helix	trans	-70.1	-39.8	-177.9	-75.8	166.1	0	0	0	112.8	L895 K896 G901	L895-L899 WeakPolarHBondContact O-CG 3.43Å; L895-L899 PolarHBondContact O-N 3.38Å; K896-L899 PolarHBondContact O-N 3.13Å; L899-G901 VanDerWaalsContact C-N 3.3Å; L899-G901 PolarHBondContact O-N 2.81Å
900	Y	62	Low	63.2	Low	173 Å²	173	104.3 Å²	104.3	68%	0.678	52%	0.515	S	S	*	.	H	α-helix	trans	-74.2	-20.8	-179.9	-75.4	-63.4	0	0	0	113.1	K896 I902	K896-Y900 HydrophobicContact CB-CD2 4.2Å; K896-Y900 HydrophobicContact CB-CE2 4.22Å; K896-Y900 HydrophobicContact CG-CE2 4.37Å; K896-Y900 WeakPolarHBondContact O-CD2 3.16Å; K896-Y900 PolarHBondContact O-N 3.45Å; Y900-I902 WeakPolarHBondContact O-CG1 3.49Å; Y900-I902 PolarHBondContact O-N 3.11Å
901	G	54.1	Low	60.9	Low	66 Å²	66	108.4 Å²	108.4	68%	0.68	53%	0.526	S	S	*	.			trans	63.9	-2.7	178.8	0	0	0	0	0	115.3	L899 D903	L899-G901 VanDerWaalsContact C-N 3.3Å; L899-G901 PolarHBondContact O-N 2.81Å; G901-D903 PolarHBondContact O-N 3.5Å
902	I	46.2	Very low	58.9	Low	96 Å²	96	109.1 Å²	109.1	49%	0.492	53%	0.534	S	S	.	.			trans	-88.7	97.3	-178.3	-63.2	156.3	0	0	0	108.4	Y900 M904	Y900-I902 WeakPolarHBondContact O-CG1 3.49Å; Y900-I902 PolarHBondContact O-N 3.11Å; I902-M904 HydrophobicContact CG2-CB 4.45Å; I902-M904 HydrophobicContact CG2-CG 3.83Å; I902-M904 HydrophobicContact CG2-SD 3.46Å; I902-M904 WeakPolarHBondContact CG2-SD 3.46Å; I902-M904 PolarHBondContact O-N 2.72Å
903	D	42	Very low	56.8	Low	74 Å²	74	111.7 Å²	111.7	40%	0.396	54%	0.544	S	S	.	.			trans	-69	100.1	147.8	-169.5	-1.4	0	0	0	106.9	G901 D905 Q906	G901-D903 PolarHBondContact O-N 3.5Å; D903-D905 PolarHBondContact O-N 2.86Å; D903-D905 VanDerWaalsContact O-N 3.16Å; D903-Q906 HydrophobicContact CB-CB 4.16Å; D903-Q906 HydrophobicContact CB-CG 4.46Å; D903-Q906 PolarHBondContact O-N 2.78Å; D903-Q906 WeakPolarHBondContact OD2-CG 3.33Å; D903-Q906 PolarHBondContact OD2-NE2 2.89Å
904	M	43.7	Very low	54.6	Low	125 Å²	125	113.6 Å²	113.6	62%	0.616	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-58.8	-27	-176.1	-79.1	-66.2	-61	0	0	111.7	I902 Q906 H907	I902-M904 HydrophobicContact CG2-CB 4.45Å; I902-M904 HydrophobicContact CG2-CG 3.83Å; I902-M904 HydrophobicContact CG2-SD 3.46Å; I902-M904 WeakPolarHBondContact CG2-SD 3.46Å; I902-M904 PolarHBondContact O-N 2.72Å; M904-Q906 VanDerWaalsContact C-N 3.26Å; M904-Q906 PolarHBondContact O-N 3.18Å; M904-H907 PolarHBondContact O-CD2 2.66Å; M904-H907 VanDerWaalsContact O-CD2 3.29Å
905	D	38.9	Very low	52.8	Low	124 Å²	124	114.7 Å²	114.7	66%	0.663	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-84.1	-0.3	-179.7	-55.7	-33.7	0	0	0	112.2	D903	D903-D905 PolarHBondContact O-N 2.86Å; D903-D905 VanDerWaalsContact O-N 3.16Å
906	Q	36.5	Very low	50.6	Low	130 Å²	130	118 Å²	118	61%	0.607	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-117.8	46.6	173.2	-68.3	-166	63.4	0	0	113.7	D903 M904 T908	D903-Q906 HydrophobicContact CB-CB 4.16Å; D903-Q906 HydrophobicContact CB-CG 4.46Å; D903-Q906 PolarHBondContact O-N 2.78Å; D903-Q906 WeakPolarHBondContact OD2-CG 3.33Å; D903-Q906 PolarHBondContact OD2-NE2 2.89Å; M904-Q906 VanDerWaalsContact C-N 3.26Å; M904-Q906 PolarHBondContact O-N 3.18Å; Q906-T908 PolarHBondContact O-N 2.91Å
907	H	32.2	Very low	48.6	Very low	124 Å²	124	116 Å²	116	57%	0.574	59%	0.587	S	S	*	*			trans	-68.3	52.3	164.7	-88.2	-64.2	0	0	0	113.7	M904	M904-H907 PolarHBondContact O-CD2 2.66Å; M904-H907 VanDerWaalsContact O-CD2 3.29Å
908	T	34.1	Very low	46.6	Very low	74 Å²	74	116.1 Å²	116.1	45%	0.454	59%	0.592	S	S	.	*			trans	-117.9	28	174.6	74.4	0	0	0	0	113.5	Q906 K910	Q906-T908 PolarHBondContact O-N 2.91Å; T908-K910 PolarHBondContact O-N 2.74Å; T908-K910 VanDerWaalsContact O-N 3.11Å
909	N	36.9	Very low	44.6	Very low	116 Å²	116	115.6 Å²	115.6	62%	0.62	60%	0.597	S	S	*	*			trans	-49	121.6	164.9	-173.8	-16.1	0	0	0	109	H911 S912	N909-H911 PolarHBondContact O-N 3.13Å; N909-S912 PolarHBondContact O-N 3.44Å; N909-S912 PolarHBondContact O-OG 3.4Å
910	K	47.2	Very low	42.4	Very low	182 Å²	182	119.2 Å²	119.2	79%	0.791	61%	0.607	S	S	*	*	H	α-helix	trans	-59.3	-22.3	-166.8	-64.8	179.9	-179.1	177.8	0	113	T908	T908-K910 PolarHBondContact O-N 2.74Å; T908-K910 VanDerWaalsContact O-N 3.11Å
911	H	42.6	Very low	40.8	Very low	135 Å²	135	118.5 Å²	118.5	63%	0.625	61%	0.614	S	S	*	*	H	α-helix	trans	-74.7	-34.4	175.5	-123	-67.6	0	0	0	114.6	N909 L914 I915	N909-H911 PolarHBondContact O-N 3.13Å; H911-L914 PolarHBondContact O-N 3.23Å; H911-I915 WeakPolarHBondContact O-CG1 3.48Å; H911-I915 PolarHBondContact O-N 2.79Å
912	S	46.8	Very low	39.6	Very low	43 Å²	43	120.8 Å²	120.8	30%	0.301	62%	0.62	S	S	.	*	H	α-helix	trans	-74.5	-36.2	-179.8	62.2	0	0	0	0	111.9	N909 L914 I915 N916	N909-S912 PolarHBondContact O-N 3.44Å; N909-S912 PolarHBondContact O-OG 3.4Å; S912-L914 PolarHBondContact O-N 2.88Å; S912-I915 PolarHBondContact O-N 3.45Å; S912-I915 VanDerWaalsContact O-N 3.13Å; S912-N916 PolarHBondContact O-N 2.98Å
913	K	43.8	Very low	38.7	Very low	129 Å²	129	121.9 Å²	121.9	56%	0.561	64%	0.636	S	S	*	*	H	α-helix	trans	-59.3	-32.1	172.2	-76.3	-171.2	168.1	-178.1	0	112.7	A917	K913-A917 WeakPolarHBondContact O-CB 3.13Å; K913-A917 PolarHBondContact O-N 3.08Å
914	L	42.7	Very low	38.1	Very low	115 Å²	115	127.6 Å²	127.6	60%	0.602	66%	0.66	S	S	*	*	H	α-helix	trans	-77.4	-21.6	176.7	-102.3	160.7	0	0	0	114.5	H911 S912	H911-L914 PolarHBondContact O-N 3.23Å; S912-L914 PolarHBondContact O-N 2.88Å
915	I	46	Very low	37.5	Very low	103 Å²	103	127.8 Å²	127.8	53%	0.528	67%	0.669	S	S	.	*	H	α-helix	trans	-88.3	-47.2	178.9	-66.9	168.5	0	0	0	109.9	H911 S912 A917 K918	H911-I915 WeakPolarHBondContact O-CG1 3.48Å; H911-I915 PolarHBondContact O-N 2.79Å; S912-I915 PolarHBondContact O-N 3.45Å; S912-I915 VanDerWaalsContact O-N 3.13Å; I915-A917 VanDerWaalsContact C-N 3.29Å; I915-A917 PolarHBondContact O-N 3.11Å; I915-K918 PolarHBondContact O-N 3.43Å
916	N	39.6	Very low	36.9	Very low	126 Å²	126	126.4 Å²	126.4	67%	0.674	67%	0.669	S	S	*	*	H	α-helix	trans	-70.2	-24.3	177.4	-74.4	11	0	0	0	113.1	S912 K918	S912-N916 PolarHBondContact O-N 2.98Å; N916-K918 VanDerWaalsContact C-N 3.26Å; N916-K918 PolarHBondContact O-N 3Å
917	A	42.8	Very low	36.5	Very low	70 Å²	70	127.9 Å²	127.9	58%	0.579	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-15.2	173.1	0	0	0	0	0	114.2	K913 I915	K913-A917 WeakPolarHBondContact O-CB 3.13Å; K913-A917 PolarHBondContact O-N 3.08Å; I915-A917 VanDerWaalsContact C-N 3.29Å; I915-A917 PolarHBondContact O-N 3.11Å
918	K	40.6	Very low	36.3	Very low	164 Å²	164	125.6 Å²	125.6	71%	0.713	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-14.4	178	-78	-169.4	169.8	-169.2	0	114.6	I915 N916	I915-K918 PolarHBondContact O-N 3.43Å; N916-K918 VanDerWaalsContact C-N 3.26Å; N916-K918 PolarHBondContact O-N 3Å
919	N	39.4	Very low	36	Very low	142 Å²	142	129.3 Å²	129.3	76%	0.759	70%	0.699	S	S	*	*	S	Bend	trans	-106.4	22.8	-178.6	-70.2	1.1	0	0	0	113.4
920	K	33.4	Very low	35.5	Very low	193 Å²	193	129.8 Å²	129.8	84%	0.839	70%	0.701	S	S	*	*	S	Bend	trans	-135.5	36.1	177.3	-151.2	-174.4	-178	-174.5	0	113.1
921	L	27.6	Very low	34.4	Very low	158 Å²	158	130.4 Å²	130.4	83%	0.827	70%	0.7	S	S	*	*			trans	-135.1	71.3	-177.6	-171.2	71.3	0	0	0	111.1
922	S	28.1	Very low	33.9	Very low	114 Å²	114	132 Å²	132	80%	0.797	71%	0.713	S	S	*	*			trans	-160.6	48.4	-178.8	65.6	0	0	0	0	115.1
923	S	28.7	Very low	32.8	Very low	119 Å²	119	134.9 Å²	134.9	83%	0.832	73%	0.733	S	S	*	*			trans	-171.1	56.8	168.1	50.1	0	0	0	0	115.3
924	Q	28.7	Very low	31.9	Very low	193 Å²	193	135 Å²	135	90%	0.902	74%	0.744	S	S	*	*			trans	-155.2	86.3	165	-132.7	179.3	45.3	0	0	115.2
925	T	31	Very low	31.1	Very low	130 Å²	130	134.4 Å²	134.4	80%	0.798	75%	0.75	S	S	*	*			trans	-157.5	109.2	160.1	45.1	0	0	0	0	105.5
926	S	26.7	Very low	30.3	Very low	95 Å²	95	137.4 Å²	137.4	66%	0.664	77%	0.766	S	S	*	*			cis	103.6	148.1	47.9	63.3	0	0	0	0	111.3
927	I	26.8	Very low	29.6	Very low	161 Å²	161	136 Å²	136	83%	0.826	77%	0.766	S	S	*	*			trans	91	128	166.4	-54	156	0	0	0	116.2
928	A	29.3	Very low	28.9	Very low	75 Å²	75	140.8 Å²	140.8	62%	0.62	78%	0.781	S	S	*	*			trans	62.4	154.7	158.6	0	0	0	0	0	119.9
929	D	27.9	Very low	28.4	Very low	153 Å²	153	136.5 Å²	136.5	82%	0.818	78%	0.783	S	S	*	*			cis	-151.8	147.5	-31.6	-97.5	-29.4	0	0	0	108.3
930	D	25.7	Very low	28.2	Very low	125 Å²	125	137.4 Å²	137.4	67%	0.668	79%	0.786	S	S	*	*			trans	15	146.6	134	-139.1	-1.1	0	0	0	121.7
931	Y	25	Very low	27.9	Very low	195 Å²	195	136.2 Å²	136.2	77%	0.765	78%	0.781	S	S	*	*			trans	56.9	112	176.3	-60.4	-88.9	0	0	0	119
932	L	31	Very low	28	Very low	170 Å²	170	134.8 Å²	134.8	89%	0.89	78%	0.775	S	S	*	*				-178.7	124.3	101.1	-96.8	172.2	0	0	0	112.5
933	S	23.5	Very low	28.3	Very low	103 Å²	103	134.3 Å²	134.3	72%	0.72	77%	0.771	S	S	*	*			trans	-86.1	156.1	163	-56.5	0	0	0	0	111.1
934	T	25	Very low	28.1	Very low	131 Å²	131	136.6 Å²	136.6	80%	0.804	77%	0.772	S	S	*	*			trans	78.4	103.5	163.2	-33	0	0	0	0	116.9
935	S	26.2	Very low	28.1	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	77%	0.768	S	S	*	*				167.3	169.2	112.7	55.2	0	0	0	0	113.7
936	L	28.4	Very low	28.1	Very low	165 Å²	165	136.4 Å²	136.4	86%	0.864	77%	0.767	S	S	*	*			trans	72	90.9	161.2	-69.3	160.5	0	0	0	119.1
937	S	26.2	Very low	28.1	Very low	97 Å²	97	137.4 Å²	137.4	68%	0.678	76%	0.764	S	S	*	*			trans	-64.5	-177.6	162.9	50	0	0	0	0	115.9
938	L	27.7	Very low	28	Very low	170 Å²	170	138 Å²	138	89%	0.89	77%	0.769	S	S	*	*			trans	82.9	118.4	171.9	-54	137.7	0	0	0	113.9
939	G	29.4	Very low	28	Very low	74 Å²	74	142.7 Å²	142.7	76%	0.763	78%	0.776	S	S	*	*			cis	-172.7	-152	-4.6	0	0	0	0	0	107.6
940	I	35.2	Very low	28.1	Very low	162 Å²	162	141 Å²	141	83%	0.831	78%	0.776	S	S	*	*			cis	-151.1	117.1	0.4	-77.4	168.9	0	0	0	102.6
941	K	28.5	Very low	28.1	Very low	168 Å²	168	140.9 Å²	140.9	73%	0.73	78%	0.78	S	S	*	*				67.5	136.4	75.2	-177.6	179.7	-178.1	-177.1	0	113.2
942	D	29.1	Very low	28.2	Very low	128 Å²	128	138.4 Å²	138.4	68%	0.684	78%	0.78	S	S	*	*			cis	-92.5	-163.8	-11.9	-74.1	-74.7	0	0	0	109.6
943	S	34.2	Very low	28	Very low	103 Å²	103	137.9 Å²	137.9	72%	0.72	78%	0.777	S	S	*	*			cis	-151.5	148.5	2	-30.1	0	0	0	0	110.8
944	I	25	Very low	28.1	Very low	168 Å²	168	138.1 Å²	138.1	86%	0.862	78%	0.777	S	S	*	*			trans	-143.4	113.5	158.1	-65.4	-178.2	0	0	0	107.6
945	D	27.4	Very low	28	Very low	153 Å²	153	141.8 Å²	141.8	82%	0.818	78%	0.782	S	S	*	*			trans	-155.4	141.7	172.7	-81	-54.6	0	0	0	106.4
946	E	30.8	Very low	28.1	Very low	165 Å²	165	140.5 Å²	140.5	77%	0.771	79%	0.786	S	S	*	*			cis	-132	153.9	5.2	-65.2	-175.1	81.9	0	0	112.6
947	L	27.5	Very low	28	Very low	116 Å²	116	139.8 Å²	139.8	61%	0.607	78%	0.783	S	S	*	*			trans	21.8	122	133	-52.5	166.2	0	0	0	117.2	K949	L947-K949 HydrophobicContact CB-CB 4.33Å
948	N	25.1	Very low	28.1	Very low	173 Å²	173	141.6 Å²	141.6	93%	0.925	78%	0.783	S	S	*	*			cis	49.4	57.6	39.3	-113.4	1.4	0	0	0	113.3
949	K	28.3	Very low	28	Very low	174 Å²	174	138.6 Å²	138.6	76%	0.757	77%	0.772	S	S	*	*			trans	-152.6	162.7	169.4	-135.9	170.9	-173.2	172.9	0	112.2	L947	L947-K949 HydrophobicContact CB-CB 4.33Å
950	S	30.6	Very low	27.8	Very low	118 Å²	118	141.3 Å²	141.3	83%	0.825	77%	0.769	S	S	*	*			trans	73.2	93.2	174.1	-53	0	0	0	0	116.2
951	T	26.6	Very low	27.6	Very low	122 Å²	122	143.2 Å²	143.2	75%	0.748	78%	0.775	S	S	*	*			trans	-72.8	179.1	157.5	46	0	0	0	0	111.8
952	D	26.1	Very low	27.6	Very low	143 Å²	143	144.2 Å²	144.2	77%	0.765	78%	0.779	S	S	*	*			trans	85.4	160	157.1	-58.3	-64	0	0	0	120.5
953	L	28.3	Very low	27.5	Very low	159 Å²	159	144.6 Å²	144.6	83%	0.832	78%	0.781	S	S	*	*			trans	77.1	75	169.6	-62.8	168.1	0	0	0	119.4
954	C	24.3	Very low	27.4	Very low	108 Å²	108	144.4 Å²	144.4	73%	0.73	78%	0.78	S	S	*	*				52.1	114.7	117.2	-68	0	0	0	0	122
955	K	23.8	Very low	27.6	Very low	208 Å²	208	143 Å²	143	90%	0.904	77%	0.77	S	S	*	*			trans	52.5	90.5	133.1	-62.2	-179.3	179.1	177.3	0	117.9
956	G	27.8	Very low	27.9	Very low	77 Å²	77	140.8 Å²	140.8	79%	0.794	76%	0.757	S	S	*	*			trans	-141.1	105.8	166.5	0	0	0	0	0	113.7
957	N	26.5	Very low	28	Very low	150 Å²	150	137 Å²	137	80%	0.802	75%	0.749	S	S	*	*			trans	-26.9	152.9	153.7	-72.4	-4.1	0	0	0	115.9
958	I	27.3	Very low	28.2	Very low	134 Å²	134	138 Å²	138	69%	0.687	75%	0.754	S	S	*	*			cis	-168	166.4	-9.3	-124.1	163.8	0	0	0	107.4
959	T	25.5	Very low	28.6	Very low	108 Å²	108	137 Å²	137	66%	0.663	74%	0.741	S	S	*	*			trans	23.8	120.1	167.2	57.9	0	0	0	0	118.9
960	D	27.1	Very low	28.9	Very low	130 Å²	130	136.2 Å²	136.2	70%	0.695	74%	0.738	S	S	*	*				180	123.7	73.1	-102.9	-44.2	0	0	0	112.3
961	Q	30.2	Very low	28.9	Very low	203 Å²	203	137 Å²	137	95%	0.949	73%	0.732	S	S	*	*			trans	-167.5	72.5	154.9	-113.7	166.8	50.4	0	0	110.9
962	K	28.7	Very low	29.3	Very low	188 Å²	188	138.8 Å²	138.8	82%	0.817	74%	0.736	S	S	*	*			trans	-137.6	27.3	177.4	-113.4	177.6	-176.5	174.6	0	114.5
963	N	27.3	Very low	29.7	Very low	137 Å²	137	141.2 Å²	141.2	73%	0.733	74%	0.739	S	S	*	*			trans	-126.5	66.8	-177	-81.9	-40.3	0	0	0	112.7
964	S	30.6	Very low	29.7	Very low	99 Å²	99	137.6 Å²	137.6	69%	0.692	73%	0.727	S	S	*	*	S	Bend	trans	-137.7	-41.8	170	55.3	0	0	0	0	112.8	L966	S964-L966 PolarHBondContact O-N 2.86Å
965	E	30.8	Very low	30.1	Very low	139 Å²	139	142 Å²	142	65%	0.65	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-12.4	179.1	-94	-145.5	87.5	0	0	116	K969	E965-K969 IonicContact OE1-NZ 3.74Å; E965-K969 PolarHBondContact OE1-NZ 3.36Å
966	L	31.9	Very low	30.4	Very low	106 Å²	106	138.4 Å²	138.4	56%	0.555	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-24.2	-178.5	-108.2	76.8	0	0	0	114.1	S964 K970	S964-L966 PolarHBondContact O-N 2.86Å; L966-K970 PolarHBondContact O-N 3.38Å
967	S	33.6	Very low	30.4	Very low	86 Å²	86	142.7 Å²	142.7	60%	0.601	73%	0.733	S	S	*	*	H	α-helix	trans	-74.6	-38	-167.4	-56.4	0	0	0	0	113.4
968	L	31.3	Very low	30.5	Very low	136 Å²	136	144.4 Å²	144.4	71%	0.712	74%	0.737	S	S	*	*	H	α-helix	trans	-77.2	-24.2	178.6	-70.7	170.7	0	0	0	113.4
969	K	34.2	Very low	30.6	Very low	151 Å²	151	145 Å²	145	66%	0.657	75%	0.747	S	S	*	*	H	α-helix	trans	-85.1	-9.4	178	-71.6	163.8	-176.1	158.6	0	113.3	E965	E965-K969 IonicContact OE1-NZ 3.74Å; E965-K969 PolarHBondContact OE1-NZ 3.36Å
970	K	34.6	Very low	30.6	Very low	159 Å²	159	148.1 Å²	148.1	69%	0.691	75%	0.754	S	S	*	*	H	α-helix	trans	-84.3	-31.9	167.7	-85.4	-174.9	172.9	-179.3	0	113.7	L966 I972 K973	L966-K970 PolarHBondContact O-N 3.38Å; K970-I972 PolarHBondContact O-N 2.93Å; K970-K973 PolarHBondContact O-N 3.28Å
971	L	30.8	Very low	30.7	Very low	133 Å²	133	150.5 Å²	150.5	70%	0.696	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-17.2	-169.4	-161.4	63.6	0	0	0	115.1
972	I	35.6	Very low	30.6	Very low	160 Å²	160	149 Å²	149	82%	0.821	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-1.6	-177.5	-59.8	176.6	0	0	0	111.9	K970	K970-I972 PolarHBondContact O-N 2.93Å
973	K	33	Very low	30.7	Very low	194 Å²	194	149 Å²	149	84%	0.843	76%	0.757	S	S	*	*	S	Bend	trans	-111.1	7.7	-174.9	-139.6	177.4	-176.6	-176.4	0	114.6	K970	K970-K973 PolarHBondContact O-N 3.28Å
974	S	29.5	Very low	30.8	Very low	83 Å²	83	149.5 Å²	149.5	58%	0.58	75%	0.754	S	S	*	*			trans	-123.7	58	-172.3	52.8	0	0	0	0	111.8
975	K	33.1	Very low	30.7	Very low	202 Å²	202	153 Å²	153	88%	0.878	76%	0.76	S	S	*	*	S	Bend	trans	-147	40	174.1	-137.8	170.1	-172.1	176.2	0	114.4
976	T	28.6	Very low	30.6	Very low	131 Å²	131	149.8 Å²	149.8	80%	0.804	76%	0.764	S	S	*	*	S	Bend	trans	-154.4	141.4	166.6	-43.8	0	0	0	0	107.4
977	L	28.1	Very low	30.5	Very low	167 Å²	167	150.5 Å²	150.5	87%	0.874	78%	0.778	S	S	*	*			trans	65.7	83.5	-176.3	-61.7	162.3	0	0	0	116
978	Q	28.5	Very low	30.3	Very low	186 Å²	186	149.7 Å²	149.7	87%	0.869	78%	0.782	S	S	*	*			trans	-166.1	90.5	142.4	-115.7	176.2	-0.1	0	0	111.1
979	T	29.1	Very low	30.2	Very low	148 Å²	148	150.6 Å²	150.6	91%	0.908	79%	0.788	S	S	*	*	S	Bend	trans	-152	48.5	164.5	-42.9	0	0	0	0	109.7
980	E	26.7	Very low	30.1	Very low	173 Å²	173	149.6 Å²	149.6	81%	0.808	79%	0.79	S	S	*	*	S	Bend	trans	-152.6	144.4	171.1	-108.8	179.8	124.4	0	0	109.3
981	Q	27.8	Very low	29.9	Very low	180 Å²	180	149 Å²	149	84%	0.841	80%	0.795	S	S	*	*			trans	63.4	94.1	170.5	-56.3	-175.7	20.5	0	0	119.1
982	Q	28.8	Very low	30.1	Very low	171 Å²	171	147.6 Å²	147.6	80%	0.799	79%	0.793	S	S	*	*				-168.1	110.3	128	-102.7	165.8	43.5	0	0	107.3
983	H	31.1	Very low	29.7	Very low	189 Å²	189	147.5 Å²	147.5	88%	0.875	79%	0.789	S	S	*	*				-132.7	157.5	75.3	-95.9	62.2	0	0	0	116.3
984	Q	29.3	Very low	29.5	Very low	147 Å²	147	145 Å²	145	69%	0.687	78%	0.781	S	S	*	*			trans	-94.2	174.8	164.9	-55.4	166	-14	0	0	107.2
985	Q	27.7	Very low	29.5	Very low	173 Å²	173	147.6 Å²	147.6	81%	0.808	79%	0.788	S	S	*	*			cis	-164.6	155.4	13.5	-148.9	154.9	46	0	0	110.9
986	G	29.8	Very low	29.3	Very low	71 Å²	71	144 Å²	144	73%	0.732	78%	0.778	S	S	*	*			trans	90.1	155.8	162.2	0	0	0	0	0	117.2
987	S	29	Very low	29.4	Very low	121 Å²	121	144 Å²	144	85%	0.846	77%	0.773	S	S	*	*			cis	-171.1	120.9	-14.1	48.7	0	0	0	0	111.6
988	G	29.8	Very low	29.5	Very low	68 Å²	68	140 Å²	140	70%	0.701	76%	0.76	S	S	*	*			trans	69.6	163.9	176.3	0	0	0	0	0	114.8
989	D	29.8	Very low	29.5	Very low	156 Å²	156	137.8 Å²	137.8	83%	0.834	75%	0.754	S	S	*	*			cis	-158	171.5	-18.9	-120.7	-31.9	0	0	0	110.1
990	D	32.6	Very low	29.7	Very low	129 Å²	129	138 Å²	138	69%	0.69	74%	0.744	S	S	*	*			trans	50.9	100.9	162	-82.7	-47.5	0	0	0	122.2
991	N	29.7	Very low	29.9	Very low	148 Å²	148	135.8 Å²	135.8	79%	0.791	74%	0.737	S	S	*	*				65.9	158.6	122.2	-82	-48.4	0	0	0	122.9
992	P	34.3	Very low	29.9	Very low	103 Å²	103	133.8 Å²	133.8	67%	0.669	73%	0.732	S	S	*	*			trans	-112.5	159.2	-166.1	41.3	-32.7	0	0	0	115.2
993	Q	27.5	Very low	29.8	Very low	157 Å²	157	131.6 Å²	131.6	73%	0.734	73%	0.725	S	S	*	*			trans	-170.2	164	140.5	-108.7	164.3	-109.4	0	0	110.6
994	E	28.2	Very low	29.6	Very low	143 Å²	143	128.3 Å²	128.3	67%	0.668	72%	0.719	S	S	*	*			trans	28.1	143.3	140.7	-65	142.7	-160.4	0	0	120.2
995	D	30.3	Very low	29.6	Very low	137 Å²	137	128 Å²	128	73%	0.733	73%	0.727	S	S	*	*			cis	-160.5	136.4	1	-106.8	-12.2	0	0	0	107.3
996	D	29.2	Very low	29.4	Very low	125 Å²	125	127.9 Å²	127.9	67%	0.668	73%	0.732	S	S	*	*				81.6	140.3	88.4	-162.1	28.7	0	0	0	114.9
997	N	29.8	Very low	29.4	Very low	132 Å²	132	129.5 Å²	129.5	71%	0.706	73%	0.733	S	S	*	*			trans	65.8	142.4	175.8	-61.1	-65.3	0	0	0	118.4
998	S	30.5	Very low	29.2	Very low	84 Å²	84	129.5 Å²	129.5	59%	0.587	73%	0.732	S	S	*	*			cis	-167.8	168.9	-7.9	48.5	0	0	0	0	111.7
999	N	29.9	Very low	29.2	Very low	138 Å²	138	135 Å²	135	74%	0.738	74%	0.74	S	S	*	*			trans	73.6	140.3	157	-57.9	-24	0	0	0	118.2
1000	E	32.9	Very low	29.1	Very low	153 Å²	153	133.5 Å²	133.5	72%	0.715	74%	0.736	S	S	*	*			cis	-154.7	145.9	-3.2	-119.8	-174.2	142	0	0	113.4
1001	L	31	Very low	28.7	Very low	126 Å²	126	133.3 Å²	133.3	66%	0.66	74%	0.74	S	S	*	*			trans	59.5	121.2	145.1	-68.7	166.6	0	0	0	123.8
1002	L	27.1	Very low	28.5	Very low	139 Å²	139	132 Å²	132	73%	0.728	74%	0.737	S	S	*	*			trans	70.2	130.8	139.4	-56.7	169.2	0	0	0	118
1003	N	27	Very low	28.1	Very low	124 Å²	124	133.2 Å²	133.2	66%	0.663	74%	0.742	S	S	*	*			cis	-158.8	144.4	30.9	-114.8	-31.2	0	0	0	114.2
1004	T	25.8	Very low	28	Very low	120 Å²	120	132 Å²	132	74%	0.736	74%	0.737	S	S	*	*			trans	23.1	111.6	147.6	61	0	0	0	0	121
1005	T	29.5	Very low	27.9	Very low	141 Å²	141	129.7 Å²	129.7	87%	0.865	73%	0.732	S	S	*	*			trans	-161.6	98.7	135.8	8.9	0	0	0	0	112.6
1006	D	23.9	Very low	27.7	Very low	170 Å²	170	128.6 Å²	128.6	91%	0.909	73%	0.726	S	S	*	*			trans	-99	117.3	164.3	-105.3	-46.6	0	0	0	109.6
1007	S	29.1	Very low	27.6	Very low	106 Å²	106	128.3 Å²	128.3	74%	0.741	72%	0.717	S	S	*	*			trans	-161.6	99.1	171.8	-81.4	0	0	0	0	110.9	Q1009	S1007-Q1009 PolarHBondContact O-N 2.88Å
1008	S	25.8	Very low	27.4	Very low	120 Å²	120	126.3 Å²	126.3	84%	0.839	72%	0.718	S	S	*	*			trans	-62.4	114.4	-177.4	54.6	0	0	0	0	112.9
1009	Q	29.3	Very low	27.3	Very low	185 Å²	185	127 Å²	127	86%	0.864	72%	0.72	S	S	*	*			trans	-87.1	123.5	169.3	-63	-169.2	22.5	0	0	110.6	S1007	S1007-Q1009 PolarHBondContact O-N 2.88Å
1010	V	27.4	Very low	27.2	Very low	123 Å²	123	126 Å²	126	75%	0.745	72%	0.718	S	S	*	*			trans	-99.4	108.5	172.4	176.9	0	0	0	0	108.8	T1012	V1010-T1012 PolarHBondContact O-N 3.24Å
1011	T	23.7	Very low	26.9	Very low	126 Å²	126	125 Å²	125	77%	0.773	72%	0.717	S	S	*	*			trans	-71.6	97.3	-173.2	-44.3	0	0	0	0	112.4	V1013	T1011-V1013 PolarHBondContact O-N 3.14Å
1012	T	27.3	Very low	26.7	Very low	121 Å²	121	125.7 Å²	125.7	74%	0.742	72%	0.722	S	S	*	*			trans	-79.8	105.3	174.7	49.3	0	0	0	0	111.8	V1010 E1014	V1010-T1012 PolarHBondContact O-N 3.24Å; T1012-E1014 PolarHBondContact O-N 3.34Å
1013	V	24.3	Very low	26.8	Very low	128 Å²	128	124.5 Å²	124.5	78%	0.776	72%	0.721	S	S	*	*			trans	-80.5	109.7	171.5	-179.5	0	0	0	0	109.9	T1011	T1011-V1013 PolarHBondContact O-N 3.14Å
1014	E	26.1	Very low	26.6	Very low	131 Å²	131	124.7 Å²	124.7	61%	0.612	73%	0.726	S	S	*	*			trans	-105.8	136.6	171.1	-65.2	-142.9	123.2	0	0	112	K23 T1012	K23-E1014 IonicContact NZ-OE1 2.58Å; T1012-E1014 PolarHBondContact O-N 3.34Å
1015	V	26.9	Very low	26.7	Very low	94 Å²	94	125 Å²	125	57%	0.57	72%	0.722	S	S	*	*			trans	-92.9	117.7	-170.7	179.9	0	0	0	0	110.4	Y1017	V1015-Y1017 HydrophobicContact CG1-CE1 3.99Å
1016	N	25.9	Very low	26.5	Very low	114 Å²	114	124 Å²	124	61%	0.61	72%	0.715	S	S	*	*			trans	-64.5	137.7	174.1	-76.7	-39.3	0	0	0	111.9	R879	R879-N1016 PolarHBondContact NH2-OD1 3.04Å
1017	Y	26.6	Very low	26.7	Very low	119 Å²	119	122.6 Å²	122.6	47%	0.467	71%	0.707	S	S	.	*			trans	-118.2	97.3	166.8	-63.6	-54.3	0	0	0	110	R30 V1015	R30-Y1017 VanDerWaalsContact NH1-CE2 3.26Å; R30-Y1017 PolarHBondContact NH1-OH 2.83Å; V1015-Y1017 HydrophobicContact CG1-CE1 3.99Å
1018	A	26.3	Very low	26.7	Very low	90 Å²	90	124.1 Å²	124.1	74%	0.744	71%	0.706	S	S	*	*			trans	-70.1	130.6	169.2	0	0	0	0	0	109.9	V1020	A1018-V1020 PolarHBondContact O-N 3.39Å
1019	T	27.1	Very low	26.8	Very low	100 Å²	100	123.8 Å²	123.8	61%	0.613	70%	0.701	S	S	*	*			trans	-90	98.9	175.8	-53.9	0	0	0	0	109	N1021	T1019-N1021 PolarHBondContact O-N 3.42Å
1020	V	28.3	Very low	26.8	Very low	115 Å²	115	122.5 Å²	122.5	70%	0.697	70%	0.7	S	S	*	*			trans	-82.2	106.1	175.1	-177.4	0	0	0	0	109	A1018 N1022	A1018-V1020 PolarHBondContact O-N 3.39Å; V1020-N1022 PolarHBondContact O-N 2.8Å; V1020-N1022 VanDerWaalsContact O-N 3.15Å
1021	N	27.1	Very low	26.8	Very low	133 Å²	133	122.8 Å²	122.8	71%	0.711	70%	0.702	S	S	*	*			trans	-74	98.7	173.4	-71	-13.2	0	0	0	109.6	T1019 T1023	T1019-N1021 PolarHBondContact O-N 3.42Å; N1021-T1023 VanDerWaalsContact C-N 3.29Å; N1021-T1023 PolarHBondContact O-N 3.33Å
1022	N	26.7	Very low	27.1	Very low	141 Å²	141	124.8 Å²	124.8	75%	0.754	71%	0.708	S	S	*	*			trans	-74.8	79.3	172.2	-84.6	7.6	0	0	0	111.2	V1020 V1024	V1020-N1022 PolarHBondContact O-N 2.8Å; V1020-N1022 VanDerWaalsContact O-N 3.15Å; N1022-V1024 PolarHBondContact O-N 2.75Å
1023	T	27.7	Very low	27.1	Very low	114 Å²	114	126.8 Å²	126.8	70%	0.699	71%	0.711	S	S	*	*			trans	-69.9	109	158.5	44.6	0	0	0	0	109	N1021 I1025	N1021-T1023 VanDerWaalsContact C-N 3.29Å; N1021-T1023 PolarHBondContact O-N 3.33Å; T1023-I1025 PolarHBondContact O-N 2.89Å; T1023-I1025 VanDerWaalsContact O-N 3.12Å
1024	V	24.7	Very low	27.3	Very low	127 Å²	127	127.2 Å²	127.2	77%	0.77	71%	0.709	S	S	*	*			trans	-72.9	101.2	172.5	179.7	0	0	0	0	108.5	N1022 V1026	N1022-V1024 PolarHBondContact O-N 2.75Å; V1024-V1026 HydrophobicContact CG1-CG2 4.09Å; V1024-V1026 PolarHBondContact O-N 3.38Å
1025	I	27.2	Very low	27.3	Very low	128 Å²	128	126.2 Å²	126.2	66%	0.656	71%	0.712	S	S	*	*			trans	-86.2	106.8	170.9	-59.7	179.4	0	0	0	107.7	T1023 N1027	T1023-I1025 PolarHBondContact O-N 2.89Å; T1023-I1025 VanDerWaalsContact O-N 3.12Å; I1025-N1027 VanDerWaalsContact CG2-OD1 3.29Å; I1025-N1027 WeakPolarHBondContact CG2-OD1 3.37Å; I1025-N1027 PolarHBondContact O-N 2.63Å
1026	V	25.1	Very low	27.4	Very low	120 Å²	120	129.9 Å²	129.9	73%	0.727	72%	0.72	S	S	*	*			trans	-80.6	93.6	173.1	-177.9	0	0	0	0	108.6	V1024	V1024-V1026 HydrophobicContact CG1-CG2 4.09Å; V1024-V1026 PolarHBondContact O-N 3.38Å
1027	N	27.5	Very low	27.4	Very low	139 Å²	139	131 Å²	131	74%	0.743	73%	0.726	S	S	*	*			trans	-95	117.2	171.2	-82.8	0.1	0	0	0	110.3	I1025	I1025-N1027 VanDerWaalsContact CG2-OD1 3.29Å; I1025-N1027 WeakPolarHBondContact CG2-OD1 3.37Å; I1025-N1027 PolarHBondContact O-N 2.63Å
1028	I	29.1	Very low	27.5	Very low	138 Å²	138	131.5 Å²	131.5	71%	0.708	74%	0.736	S	S	*	*			trans	-75.4	131.6	173.7	-60	167.6	0	0	0	108.6	D1030	I1028-D1030 PolarHBondContact O-N 2.99Å
1029	P	29.5	Very low	27.7	Very low	114 Å²	114	135.1 Å²	135.1	74%	0.74	74%	0.738	S	S	*	*			trans	-90.5	90.8	178.8	34.2	-32.1	0	0	0	111.5	T1031	P1029-T1031 PolarHBondContact O-N 2.56Å
1030	D	29.1	Very low	28	Very low	157 Å²	157	135.4 Å²	135.4	84%	0.84	74%	0.741	S	S	*	*			trans	-67.4	115.2	169.1	-81.6	-33.2	0	0	0	110.5	I1028	I1028-D1030 PolarHBondContact O-N 2.99Å
1031	T	26.9	Very low	27.9	Very low	130 Å²	130	136.4 Å²	136.4	80%	0.798	74%	0.743	S	S	*	*			trans	-77.9	131.4	178.9	52.1	0	0	0	0	111.6	P1029	P1029-T1031 PolarHBondContact O-N 2.56Å
1032	N	30.2	Very low	28	Very low	168 Å²	168	135.7 Å²	135.7	90%	0.898	74%	0.739	S	S	*	*			trans	-151.6	134.2	145.8	-118.9	-40.9	0	0	0	112.7
1033	M	27	Very low	28	Very low	163 Å²	163	134.5 Å²	134.5	80%	0.803	74%	0.737	S	S	*	*			trans	-99.4	140.4	177.2	-70.6	-90.3	-120.8	0	0	109.3
1034	N	27.4	Very low	28.2	Very low	137 Å²	137	136.2 Å²	136.2	73%	0.733	74%	0.741	S	S	*	*				170.3	136.6	110.7	-96.8	-34	0	0	0	114.2
1035	T	27.9	Very low	28.4	Very low	109 Å²	109	135.2 Å²	135.2	67%	0.669	74%	0.74	S	S	*	*			trans	58.1	146.2	140.4	63.4	0	0	0	0	120.6
1036	K	27.5	Very low	28.5	Very low	171 Å²	171	132.3 Å²	132.3	74%	0.743	74%	0.742	S	S	*	*			cis	-170.7	167	-10.3	-116.2	174	-178.3	179.9	0	107.6
1037	N	26.7	Very low	28.8	Very low	137 Å²	137	134.5 Å²	134.5	73%	0.733	75%	0.749	S	S	*	*			trans	69.7	151.6	155.3	-68	13.5	0	0	0	116.4
1038	L	29.1	Very low	28.9	Very low	130 Å²	130	133.2 Å²	133.2	68%	0.681	75%	0.746	S	S	*	*			cis	-149.6	142.6	2.4	-106.6	142.1	0	0	0	109.6
1039	E	29.5	Very low	29	Very low	167 Å²	167	133 Å²	133	78%	0.78	75%	0.747	S	S	*	*			trans	41.9	166.5	136.3	-74.6	-174.9	155.7	0	0	124.4
1040	P	34.9	Very low	29	Very low	105 Å²	105	138 Å²	138	68%	0.682	75%	0.752	S	S	*	*			cis	-141	164.4	-43.6	39.8	-23	0	0	0	116
1041	D	25.3	Very low	29	Very low	136 Å²	136	135.9 Å²	135.9	73%	0.727	75%	0.75	S	S	*	*				-1.2	156.6	128.9	-74.8	20.4	0	0	0	120
1042	N	28.4	Very low	29.2	Very low	118 Å²	118	134.2 Å²	134.2	63%	0.631	74%	0.743	S	S	*	*			cis	-166.7	162.4	5.7	-126.5	-37.7	0	0	0	114.6
1043	T	28.1	Very low	29.2	Very low	116 Å²	116	133.6 Å²	133.6	71%	0.712	74%	0.74	S	S	*	*			trans	59.8	168.8	153.4	59.4	0	0	0	0	119.4
1044	L	31.8	Very low	29.3	Very low	150 Å²	150	134.5 Å²	134.5	79%	0.785	74%	0.742	S	S	*	*			cis	-148.9	169.6	13.2	-146.2	132	0	0	0	112.3
1045	S	29	Very low	29.5	Very low	107 Å²	107	133.8 Å²	133.8	75%	0.748	75%	0.748	S	S	*	*			trans	-73.6	166.6	174.8	51.7	0	0	0	0	114.1
1046	G	29.7	Very low	29.5	Very low	67 Å²	67	136.3 Å²	136.3	69%	0.691	76%	0.756	S	S	*	*			cis	163.9	-157.6	1.9	0	0	0	0	0	111.8
1047	N	30.9	Very low	29.8	Very low	165 Å²	165	132.9 Å²	132.9	88%	0.882	75%	0.751	S	S	*	*			trans	84.8	145.8	172.3	-63.1	1.8	0	0	0	120.6
1048	T	29.8	Very low	29.8	Very low	112 Å²	112	133 Å²	133	69%	0.687	75%	0.751	S	S	*	*			trans	-47.2	170.7	176.8	56.8	0	0	0	0	116.3
1049	D	30.2	Very low	29.7	Very low	134 Å²	134	130.4 Å²	130.4	72%	0.717	74%	0.739	S	S	*	*			cis	-157	-177.2	43.3	-107.9	-59.4	0	0	0	116.6
1050	Y	29.8	Very low	29.7	Very low	219 Å²	219	128.9 Å²	128.9	86%	0.859	74%	0.736	S	S	*	*			trans	-61.8	149.8	-172.9	-74.1	-107.8	0	0	0	117.7
1051	S	29.9	Very low	29.3	Very low	113 Å²	113	128.8 Å²	128.8	79%	0.79	73%	0.725	S	S	*	*				-169.7	154.1	117.2	-169.3	0	0	0	0	113.3
1052	S	29.7	Very low	29.4	Very low	94 Å²	94	128.2 Å²	128.2	66%	0.657	72%	0.72	S	S	*	*			trans	-51.4	164.4	168.6	-27.8	0	0	0	0	114
1053	D	31.5	Very low	29.7	Very low	155 Å²	155	131.1 Å²	131.1	83%	0.829	72%	0.722	S	S	*	*			cis	-157.5	-173.8	45.8	-99.1	-40.4	0	0	0	115
1054	E	27.5	Very low	29.9	Very low	182 Å²	182	129.8 Å²	129.8	85%	0.85	72%	0.715	S	S	*	*			trans	-62.1	146.9	-174.8	-50.2	-179.1	114.1	0	0	116.9
1055	S	31.5	Very low	29.7	Very low	122 Å²	122	129.7 Å²	129.7	85%	0.853	72%	0.716	S	S	*	*				174.3	168.4	127.7	44.8	0	0	0	0	114.7
1056	I	28.6	Very low	29.6	Very low	163 Å²	163	129.9 Å²	129.9	84%	0.836	71%	0.708	S	S	*	*			trans	-135.4	157.1	-167.4	-64.3	169.6	0	0	0	107.2
1057	P	34	Very low	29.6	Very low	98 Å²	98	133.9 Å²	133.9	64%	0.636	71%	0.714	S	S	*	*			cis	-130.1	-167.1	-18	38	-19.5	0	0	0	114
1058	N	26.4	Very low	29.4	Very low	139 Å²	139	133 Å²	133	74%	0.743	71%	0.709	S	S	*	*			trans	53.3	130.2	148.7	-67.8	-25.3	0	0	0	120
1059	N	27.7	Very low	29.2	Very low	77 Å²	77	132.5 Å²	132.5	41%	0.412	71%	0.71	S	S	.	*				-169.3	169.2	81.8	-100.4	-90.2	0	0	0	113.9	N1114 S1115	N1059-N1114 WeakPolarHBondContact CB-OD1 3.42Å; N1059-N1114 PolarHBondContact ND2-OD1 2.97Å; N1059-S1115 PolarHBondContact ND2-OG 2.81Å; N1059-S1115 PolarHBondContact OD1-OG 2.8Å; N1059-S1115 VanDerWaalsContact OD1-OG 3.08Å
1060	N	28.7	Very low	29.1	Very low	135 Å²	135	134.1 Å²	134.1	72%	0.722	72%	0.718	S	S	*	*			trans	-91.9	150.4	179	-72.8	-60.8	0	0	0	115
1061	K	26.9	Very low	29	Very low	103 Å²	103	131 Å²	131	45%	0.448	71%	0.71	S	S	.	*			trans	-170.9	118.5	131.3	-107.9	163.8	176.8	167.1	0	107.5	T1112 M1113	K1061-T1112 HydrophobicContact CB-CG2 4Å; K1061-M1113 WeakPolarHBondContact CD-O 3.44Å; K1061-M1113 WeakPolarHBondContact CE-O 3.49Å; K1061-M1113 PolarHBondContact NZ-O 3.05Å
1062	I	27.2	Very low	28.9	Very low	124 Å²	124	133.3 Å²	133.3	64%	0.636	71%	0.714	S	S	*	*				74.4	108.4	76.8	-67.6	167.6	0	0	0	112.1
1063	R	33.7	Very low	28.7	Very low	178 Å²	178	137.5 Å²	137.5	67%	0.672	72%	0.72	S	S	*	*				35.6	160.1	123.1	-81.5	-179.8	174.8	-108.3	0.4	119.7	D1066	R1063-D1066 IonicContact CZ-OD1 3.42Å; R1063-D1066 IonicContact NH1-OD1 2.79Å; R1063-D1066 PolarHBondContact NH1-OD1 2.72Å; R1063-D1066 IonicContact NH1-OD2 2.65Å; R1063-D1066 IonicContact NH2-OD1 2.88Å
1064	P	34.3	Very low	28.4	Very low	88 Å²	88	134.6 Å²	134.6	57%	0.571	71%	0.708	S	S	*	*			cis	-119	-169.7	18.3	44.6	-29.5	0	0	0	111.7
1065	N	27.3	Very low	28.5	Very low	148 Å²	148	132.3 Å²	132.3	79%	0.791	71%	0.709	S	S	*	*			cis	-135.7	160.6	28.8	-90.1	-34.9	0	0	0	114
1066	D	26.5	Very low	28.2	Very low	111 Å²	111	132.1 Å²	132.1	59%	0.594	70%	0.698	S	S	*	*			trans	-85.1	159.7	175	-52.1	-79.3	0	0	0	111.9	R1063	R1063-D1066 IonicContact CZ-OD1 3.42Å; R1063-D1066 IonicContact NH1-OD1 2.79Å; R1063-D1066 PolarHBondContact NH1-OD1 2.72Å; R1063-D1066 IonicContact NH1-OD2 2.65Å; R1063-D1066 IonicContact NH2-OD1 2.88Å
1067	N	28.7	Very low	28	Very low	151 Å²	151	133 Å²	133	81%	0.807	69%	0.693	S	S	*	*			trans	-149.6	114.2	154.8	-115.3	-32.3	0	0	0	111.9
1068	L	27.8	Very low	27.7	Very low	148 Å²	148	134.7 Å²	134.7	78%	0.775	70%	0.695	S	S	*	*			trans	57	70.7	148.4	-60.9	167.4	0	0	0	118.7
1069	S	25.3	Very low	27.7	Very low	101 Å²	101	133.7 Å²	133.7	71%	0.706	69%	0.688	S	S	*	*				12.7	129.2	120.6	61.2	0	0	0	0	119.6
1070	L	28.3	Very low	27.8	Very low	168 Å²	168	140 Å²	140	88%	0.88	71%	0.706	S	S	*	*			trans	-151.5	92.8	141.2	-117.8	168.8	0	0	0	112.9
1071	H	27.4	Very low	27.6	Very low	153 Å²	153	140.1 Å²	140.1	71%	0.708	71%	0.707	S	S	*	*			trans	42.8	122.8	152.3	-100.9	-81.6	0	0	0	122.3	K1073	H1071-K1073 PolarHBondContact O-N 3.44Å
1072	N	27.2	Very low	27.8	Very low	161 Å²	161	146.4 Å²	146.4	86%	0.861	73%	0.728	S	S	*	*			trans	-45.4	123.8	134.6	-73.6	-24.4	0	0	0	110.3
1073	K	26.6	Very low	27.9	Very low	183 Å²	183	148.7 Å²	148.7	80%	0.796	74%	0.736	S	S	*	*			trans	-131.9	109.9	153.5	-84.3	-170.8	175.1	176.9	0	110.9	H1071	H1071-K1073 PolarHBondContact O-N 3.44Å
1074	T	24.7	Very low	27.6	Very low	94 Å²	94	145 Å²	145	58%	0.577	74%	0.737	S	S	*	*			trans	-46.1	141.8	151.7	33.2	0	0	0	0	111.1	D1076	T1074-D1076 VanDerWaalsContact CB-OD2 3.23Å; T1074-D1076 WeakPolarHBondContact CB-OD2 3.42Å; T1074-D1076 PolarHBondContact O-N 3.26Å; T1074-D1076 PolarHBondContact OG1-OD2 2.69Å
1075	P	29.6	Very low	27.4	Very low	133 Å²	133	147.7 Å²	147.7	86%	0.864	75%	0.746	S	S	*	*			trans	-76.1	69.4	156.8	33.7	-32.3	0	0	0	108.3
1076	D	25.1	Very low	27.6	Very low	118 Å²	118	147.5 Å²	147.5	63%	0.631	75%	0.745	S	S	*	*			trans	-62.5	146.9	176.4	-92.7	-56.9	0	0	0	111.5	T1074 I1078	T1074-D1076 VanDerWaalsContact CB-OD2 3.23Å; T1074-D1076 WeakPolarHBondContact CB-OD2 3.42Å; T1074-D1076 PolarHBondContact O-N 3.26Å; T1074-D1076 PolarHBondContact OG1-OD2 2.69Å; D1076-I1078 PolarHBondContact O-N 3.42Å
1077	Y	25.8	Very low	27.8	Very low	183 Å²	183	147.3 Å²	147.3	72%	0.718	75%	0.75	S	S	*	*			trans	-62.7	107.1	-174.6	-85.8	-108.9	0	0	0	111.9	I1079	Y1077-I1079 HydrophobicContact CD1-CD1 3.97Å; Y1077-I1079 HydrophobicContact CD1-CG1 4.09Å
1078	I	26.1	Very low	27.8	Very low	133 Å²	133	147.5 Å²	147.5	68%	0.682	75%	0.751	S	S	*	*			trans	-103.3	78.1	160.6	-57	-175.2	0	0	0	109	D1076 R1080	D1076-I1078 PolarHBondContact O-N 3.42Å; I1078-R1080 HydrophobicContact CG2-CB 4.3Å; I1078-R1080 HydrophobicContact CG2-CG 3.7Å; I1078-R1080 PolarHBondContact O-N 3.29Å
1079	I	27.6	Very low	28	Very low	118 Å²	118	150.2 Å²	150.2	61%	0.605	76%	0.757	S	S	*	*			trans	-73.4	85.2	160.3	-59	176.3	0	0	0	107.1	Y1077 N1081	Y1077-I1079 HydrophobicContact CD1-CD1 3.97Å; Y1077-I1079 HydrophobicContact CD1-CG1 4.09Å; I1079-N1081 PolarHBondContact O-N 3.24Å; I1079-N1081 VanDerWaalsContact O-N 3.13Å
1080	R	28.4	Very low	28.1	Very low	208 Å²	208	149.5 Å²	149.5	79%	0.785	76%	0.756	S	S	*	*			trans	-77.2	94.1	167.7	-96.4	175.7	-175.5	171.8	2.9	109.3	I1078 R1082	I1078-R1080 HydrophobicContact CG2-CB 4.3Å; I1078-R1080 HydrophobicContact CG2-CG 3.7Å; I1078-R1080 PolarHBondContact O-N 3.29Å; R1080-R1082 PolarHBondContact O-N 3.21Å; R1080-R1082 VanDerWaalsContact O-N 3.08Å
1081	N	26.4	Very low	28	Very low	138 Å²	138	147.8 Å²	147.8	74%	0.738	75%	0.753	S	S	*	*			trans	-56.3	111.9	158.5	-80.2	-17.3	0	0	0	109.2	I1079	I1079-N1081 PolarHBondContact O-N 3.24Å; I1079-N1081 VanDerWaalsContact O-N 3.13Å
1082	R	29.3	Very low	28.1	Very low	235 Å²	235	148.4 Å²	148.4	89%	0.887	76%	0.761	S	S	*	*			trans	-134.8	83.6	158.8	-83.3	-162.2	171.9	-165.9	-2.1	109.9	R1080 S1084	R1080-R1082 PolarHBondContact O-N 3.21Å; R1080-R1082 VanDerWaalsContact O-N 3.08Å; R1082-S1084 PolarHBondContact O-N 2.92Å
1083	H	29.2	Very low	28	Very low	173 Å²	173	147.8 Å²	147.8	80%	0.801	76%	0.758	S	S	*	*			trans	-72.6	112.2	146.9	-67.8	-79.9	0	0	0	107.5
1084	S	29	Very low	28.1	Very low	101 Å²	101	146.6 Å²	146.6	71%	0.706	76%	0.758	S	S	*	*			trans	-176.4	137.4	141.9	-170.8	0	0	0	0	110.5	R1082	R1082-S1084 PolarHBondContact O-N 2.92Å
1085	L	29.8	Very low	28.1	Very low	143 Å²	143	146.5 Å²	146.5	75%	0.749	76%	0.762	S	S	*	*			trans	-8.8	141.2	140.6	-52.6	169.5	0	0	0	115.2
1086	D	31.4	Very low	27.9	Very low	144 Å²	144	147.3 Å²	147.3	77%	0.77	76%	0.759	S	S	*	*			cis	-143.6	164.1	21.1	-91	-51.6	0	0	0	114.3
1087	P	30.4	Very low	28.2	Very low	107 Å²	107	148.7 Å²	148.7	70%	0.695	77%	0.772	S	S	*	*			trans	-98.5	118.5	167.5	35	-26.2	0	0	0	112.4
1088	N	29.4	Very low	28.3	Very low	155 Å²	155	149.4 Å²	149.4	83%	0.829	78%	0.778	S	S	*	*			trans	-172.2	169	150	-107.6	-41.6	0	0	0	114
1089	F	32	Very low	28.6	Very low	206 Å²	206	154.2 Å²	154.2	90%	0.904	79%	0.79	S	S	*	*			trans	71.9	137.4	-179.4	-68.2	-81.3	0	0	0	116.8
1090	A	27.5	Very low	28.7	Very low	85 Å²	85	152.9 Å²	152.9	70%	0.702	79%	0.791	S	S	*	*			trans	-135.4	173.9	-166.7	0	0	0	0	0	110.6
1091	T	25.8	Very low	28.9	Very low	133 Å²	133	150 Å²	150	82%	0.816	79%	0.791	S	S	*	*			trans	57.4	115.6	168.8	36.5	0	0	0	0	117.3
1092	L	29.6	Very low	29.2	Very low	165 Å²	165	149.2 Å²	149.2	86%	0.864	80%	0.797	S	S	*	*				-161.8	140.9	105.1	-100.1	164.4	0	0	0	110.3
1093	N	24.8	Very low	29.3	Very low	149 Å²	149	145.9 Å²	145.9	80%	0.797	79%	0.794	S	S	*	*			trans	-79.1	160.7	162.5	-80.2	-30.3	0	0	0	109.2
1094	I	28.3	Very low	29.4	Very low	157 Å²	157	141.1 Å²	141.1	81%	0.805	79%	0.793	S	S	*	*				174.5	138.9	122.8	-88.7	155.6	0	0	0	112.3
1095	S	25.5	Very low	29.4	Very low	93 Å²	93	143.4 Å²	143.4	65%	0.65	80%	0.795	S	S	*	*			trans	-13.6	146.1	174.4	64.8	0	0	0	0	124.4
1096	N	25	Very low	29.4	Very low	149 Å²	149	142.8 Å²	142.8	80%	0.797	80%	0.798	S	S	*	*				35.1	132	129.8	-60.2	-13.9	0	0	0	121.9
1097	T	31.8	Very low	29.2	Very low	148 Å²	148	140.3 Å²	140.3	91%	0.908	79%	0.792	S	S	*	*				-163.1	158.3	115.5	9.4	0	0	0	0	111.8
1098	K	26.7	Very low	29.2	Very low	197 Å²	197	141.5 Å²	141.5	86%	0.857	80%	0.797	S	S	*	*			trans	-106.7	156.2	170.8	-70.5	-179.5	177.6	178.1	0	109.9
1099	Y	32.9	Very low	29.2	Very low	234 Å²	234	139.4 Å²	139.4	92%	0.918	79%	0.794	S	S	*	*			trans	-144.5	159.5	153.1	-108.5	-83.1	0	0	0	109.9
1100	S	28.9	Very low	29.1	Very low	90 Å²	90	133.7 Å²	133.7	63%	0.629	78%	0.78	S	S	*	*			trans	-145	-170	-168.8	58.1	0	0	0	0	112.7
1101	D	32.2	Very low	29.3	Very low	148 Å²	148	135.8 Å²	135.8	79%	0.791	78%	0.784	S	S	*	*			trans	81.2	151.4	165.1	-44.3	-12.4	0	0	0	115.3
1102	S	33.5	Very low	29.6	Very low	122 Å²	122	132.4 Å²	132.4	85%	0.853	76%	0.763	S	S	*	*			cis	-149.4	-164.7	4.6	51.8	0	0	0	0	112.9
1103	I	30.8	Very low	29.8	Very low	164 Å²	164	130 Å²	130	84%	0.841	75%	0.749	S	S	*	*			trans	-111.7	157	-161.4	-74.1	162.2	0	0	0	113.6	I1105	I1103-I1105 HydrophobicContact CG2-CG1 4.37Å
1104	G	32.2	Very low	30.1	Very low	74 Å²	74	127.8 Å²	127.8	76%	0.763	74%	0.737	S	S	*	*			trans	-156.3	147.1	167.8	0	0	0	0	0	113.7
1105	I	29	Very low	30.4	Very low	149 Å²	149	124 Å²	124	76%	0.764	73%	0.725	S	S	*	*			trans	-126.4	165.4	-156.2	-31.3	175.8	0	0	0	113.4	I1103	I1103-I1105 HydrophobicContact CG2-CG1 4.37Å
1106	T	30.2	Very low	31.1	Very low	130 Å²	130	124.7 Å²	124.7	80%	0.798	73%	0.727	S	S	*	*			trans	82.9	163	160.4	75.4	0	0	0	0	120.9
1107	S	27.1	Very low	31.4	Very low	92 Å²	92	124.7 Å²	124.7	64%	0.643	73%	0.727	S	S	*	*				-174.6	161.4	-61.5	54.6	0	0	0	0	114
1108	T	29.1	Very low	31.6	Very low	131 Å²	131	125 Å²	125	80%	0.804	73%	0.729	S	S	*	*			trans	77.7	156	169.4	74.7	0	0	0	0	118.1
1109	S	30	Very low	31.6	Very low	111 Å²	111	123.5 Å²	123.5	78%	0.776	73%	0.725	S	S	*	*			cis	-166.4	171.9	-23	-91.3	0	0	0	0	111.6
1110	S	30.8	Very low	31.7	Very low	87 Å²	87	119.3 Å²	119.3	61%	0.608	72%	0.717	S	S	*	*			trans	-129.2	167.2	-166.9	58.9	0	0	0	0	117
1111	V	32	Very low	31.7	Very low	128 Å²	128	122.3 Å²	122.3	78%	0.776	72%	0.721	S	S	*	*			trans	-161.6	168.4	160.7	118.8	0	0	0	0	116.4
1112	T	31.5	Very low	31.4	Very low	63 Å²	63	121.4 Å²	121.4	39%	0.387	71%	0.714	S	S	.	*			trans	-99.4	-166.3	-157.6	49.2	0	0	0	0	117	K1061	K1061-T1112 HydrophobicContact CB-CG2 4Å
1113	M	33.7	Very low	31.2	Very low	113 Å²	113	121.8 Å²	121.8	56%	0.557	71%	0.712	S	S	*	*			cis	-145	175.3	11.3	-62.5	-78.9	-163.3	0	0	114.1	K1061	K1061-M1113 WeakPolarHBondContact CD-O 3.44Å; K1061-M1113 WeakPolarHBondContact CE-O 3.49Å; K1061-M1113 PolarHBondContact NZ-O 3.05Å
1114	N	31.9	Very low	31.3	Very low	103 Å²	103	119.6 Å²	119.6	55%	0.551	71%	0.708	S	S	*	*			trans	65.7	160.9	148	-70.9	11.4	0	0	0	122.2	N1059	N1059-N1114 WeakPolarHBondContact CB-OD1 3.42Å; N1059-N1114 PolarHBondContact ND2-OD1 2.97Å
1115	S	33.1	Very low	31.4	Very low	78 Å²	78	123.2 Å²	123.2	55%	0.545	72%	0.715	S	S	.	*			cis	-171.2	176.7	-20.5	-86.9	0	0	0	0	112.6	N1059	N1059-S1115 PolarHBondContact ND2-OG 2.81Å; N1059-S1115 PolarHBondContact OD1-OG 2.8Å; N1059-S1115 VanDerWaalsContact OD1-OG 3.08Å
1116	P	41.3	Very low	31.4	Very low	107 Å²	107	122.1 Å²	122.1	70%	0.695	72%	0.715	S	S	*	*			trans	-136.4	-168.1	-156.7	46.3	-30.5	0	0	0	120.6
1117	N	31.1	Very low	31.4	Very low	149 Å²	149	123.2 Å²	123.2	80%	0.797	71%	0.712	S	S	*	*			trans	95	127.3	154.4	-70.3	-6.4	0	0	0	123.7
1118	T	35.8	Very low	31.5	Very low	156 Å²	156	127.1 Å²	127.1	96%	0.957	72%	0.717	S	S	*	*			trans	-170.6	-177.5	130.2	15.2	0	0	0	0	111.7
1119	H	27.6	Very low	31.6	Very low	165 Å²	165	129.5 Å²	129.5	76%	0.764	72%	0.719	S	S	*	*			trans	-135.4	-177.7	-146.9	-161	-103.2	0	0	0	115.6
1120	I	34.1	Very low	31.5	Very low	146 Å²	146	131.6 Å²	131.6	75%	0.749	72%	0.72	S	S	*	*			trans	111	87.1	163	-54.8	163.2	0	0	0	118.2
1121	Q	27.8	Very low	31.5	Very low	153 Å²	153	134.5 Å²	134.5	72%	0.715	73%	0.733	S	S	*	*				40	141.5	116	-94.1	-176.5	-26.5	0	0	125.8
1122	I	27	Very low	31.4	Very low	128 Å²	128	131.9 Å²	131.9	66%	0.656	73%	0.726	S	S	*	*				114.2	107.7	128.2	-85.1	166.4	0	0	0	122.4
1123	T	28.3	Very low	31.4	Very low	130 Å²	130	135 Å²	135	80%	0.798	75%	0.747	S	S	*	*			trans	75	146.7	148.8	54.6	0	0	0	0	124.1
1124	P	34.5	Very low	31.2	Very low	119 Å²	119	136.4 Å²	136.4	77%	0.773	76%	0.755	S	S	*	*			trans	-111.1	159.2	-179.9	41.7	-33	0	0	0	115
1125	V	33.1	Very low	31.2	Very low	149 Å²	149	141.2 Å²	141.2	90%	0.903	77%	0.771	S	S	*	*			trans	-140.8	148.5	165.8	-178.2	0	0	0	0	110.5
1126	T	29.2	Very low	31	Very low	126 Å²	126	142.6 Å²	142.6	77%	0.773	78%	0.781	S	S	*	*			trans	-88.9	148.5	178.2	53.2	0	0	0	0	113.1
1127	E	29.9	Very low	30.5	Very low	154 Å²	154	142.3 Å²	142.3	72%	0.72	78%	0.78	S	S	*	*				174.9	158	114	-170.4	151.8	-147.9	0	0	114.1
1128	K	29.1	Very low	30.7	Very low	173 Å²	173	141.4 Å²	141.4	75%	0.752	78%	0.782	S	S	*	*			trans	-37.5	130.6	-176.8	-53.3	142.3	-172.6	158.7	0	118.8
1129	Q	32.4	Very low	30.5	Very low	182 Å²	182	139.3 Å²	139.3	85%	0.85	77%	0.773	S	S	*	*			trans	-151.9	122.8	136.7	-101	169.5	6.3	0	0	106.5
1130	I	26.9	Very low	30.9	Very low	154 Å²	154	139.7 Å²	139.7	79%	0.79	78%	0.78	S	S	*	*				47.9	101.8	81.9	-51.6	177	0	0	0	113.1
1131	V	31.5	Very low	30.6	Very low	148 Å²	148	139.8 Å²	139.8	90%	0.897	78%	0.782	S	S	*	*			trans	-175.7	162.6	138	140.5	0	0	0	0	110.9
1132	A	30.4	Very low	30.9	Very low	74 Å²	74	141 Å²	141	61%	0.612	79%	0.792	S	S	*	*			trans	-63.2	163.8	-165.5	0	0	0	0	0	118.2
1133	P	29.8	Very low	31	Very low	129 Å²	129	142.7 Å²	142.7	84%	0.838	80%	0.795	S	S	*	*			trans	-81.8	131	175.2	33	-34.5	0	0	0	112.8
1134	I	29.6	Very low	31.4	Very low	142 Å²	142	144.1 Å²	144.1	73%	0.728	80%	0.798	S	S	*	*			trans	-144.6	115.9	173.2	-53	177.3	0	0	0	109.5
1135	F	31.8	Very low	31.1	Very low	203 Å²	203	148 Å²	148	89%	0.89	80%	0.797	S	S	*	*				-176.1	136.2	121.9	-112.5	-79.9	0	0	0	110.6
1136	S	29.4	Very low	31.2	Very low	108 Å²	108	148 Å²	148	76%	0.755	80%	0.797	S	S	*	*			trans	-109.8	159.8	-179.6	-132.8	0	0	0	0	110.5
1137	P	31.1	Very low	31.3	Very low	101 Å²	101	146.9 Å²	146.9	66%	0.656	79%	0.79	S	S	*	*			trans	-81.6	154.9	-168.3	33.2	-35.5	0	0	0	113.6	S1139	P1137-S1139 PolarHBondContact O-N 3.01Å
1138	P	36.1	Very low	31.4	Very low	130 Å²	130	147.7 Å²	147.7	84%	0.844	79%	0.794	S	S	*	*			trans	-73.7	113.2	175.2	30.3	-33.4	0	0	0	111
1139	S	31	Very low	31.5	Very low	111 Å²	111	146.9 Å²	146.9	78%	0.776	79%	0.792	S	S	*	*			trans	-91.9	124.8	164.6	-63.1	0	0	0	0	109.3	P1137	P1137-S1139 PolarHBondContact O-N 3.01Å
1140	L	35.3	Very low	31.5	Very low	173 Å²	173	145.4 Å²	145.4	91%	0.906	79%	0.79	S	S	*	*			trans	-128.6	122.3	164.5	-77.3	178.4	0	0	0	110
1141	L	29.3	Very low	31.8	Very low	149 Å²	149	144.5 Å²	144.5	78%	0.78	78%	0.783	S	S	*	*			trans	-88.3	147.8	169.7	-65.9	166.6	0	0	0	109.1
1142	L	33.3	Very low	31.8	Very low	177 Å²	177	146.6 Å²	146.6	93%	0.927	78%	0.78	S	S	*	*			trans	-138.6	134.9	143.7	-146.7	77.1	0	0	0	109
1143	F	29.9	Very low	32	Very low	165 Å²	165	147.5 Å²	147.5	72%	0.724	78%	0.78	S	S	*	*			trans	-83	159.2	173.3	-83.4	-107.1	0	0	0	110.1
1144	D	35.1	Very low	32	Very low	160 Å²	160	149.7 Å²	149.7	86%	0.856	78%	0.776	S	S	*	*				-142.5	164.3	120.5	-142.9	-23.4	0	0	0	111.4
1145	R	28.9	Very low	32.2	Very low	201 Å²	201	152 Å²	152	76%	0.758	78%	0.784	S	S	*	*			trans	-105.2	141.7	-168.2	-67.1	169.5	166.5	166.7	-6.3	113
1146	V	35.2	Very low	32.1	Very low	149 Å²	149	149.3 Å²	149.3	90%	0.903	78%	0.776	S	S	*	*			trans	-134.5	144.9	135.7	-175.9	0	0	0	0	107.5
1147	T	30.8	Very low	32.2	Very low	101 Å²	101	149.7 Å²	149.7	62%	0.62	77%	0.774	S	S	*	*			trans	-122.8	151.3	-166.8	46.8	0	0	0	0	112.7
1148	Q	31.9	Very low	32.4	Very low	172 Å²	172	155.2 Å²	155.2	80%	0.804	78%	0.782	S	S	*	*				158.6	135.8	119.3	-82.8	-178.4	7.3	0	0	113.2
1149	H	32.5	Very low	32	Very low	156 Å²	156	157.8 Å²	157.8	72%	0.722	78%	0.782	S	S	*	*			trans	25.2	131.7	145.6	-66.4	-93.7	0	0	0	120.4
1150	N	31.8	Very low	32.2	Very low	151 Å²	151	158.4 Å²	158.4	81%	0.807	78%	0.781	S	S	*	*				-154.9	178.2	65.7	-113.5	-16.2	0	0	0	115.5
1151	E	32.6	Very low	31.9	Very low	135 Å²	135	157.6 Å²	157.6	63%	0.631	77%	0.773	S	S	*	*			trans	-106.5	160.6	-160.3	-55.2	161.8	125.5	0	0	114.6
1152	F	31.5	Very low	32	Very low	191 Å²	191	158.3 Å²	158.3	84%	0.838	77%	0.77	S	S	*	*				177.3	154.2	104	-106	-90.2	0	0	0	112.8
1153	P	35.2	Very low	31.9	Very low	94 Å²	94	154.5 Å²	154.5	61%	0.61	76%	0.758	S	S	*	*			trans	-138.5	-176.6	-160.9	44.4	-26.5	0	0	0	118.4
1154	F	30.7	Very low	32.4	Very low	174 Å²	174	152.3 Å²	152.3	76%	0.763	76%	0.761	S	S	*	*			trans	63.6	131.5	155.5	-82.5	-72.2	0	0	0	122.6	M1156	F1154-M1156 HydrophobicContact CD1-CE 4.3Å; F1154-M1156 HydrophobicContact CE1-CE 3.91Å
1155	E	32.1	Very low	32.5	Very low	190 Å²	190	150.1 Å²	150.1	89%	0.888	76%	0.755	S	S	*	*				-172.7	-170.3	104.9	-105	-163.9	151	0	0	113.3
1156	M	30.4	Very low	32.8	Very low	148 Å²	148	148.9 Å²	148.9	73%	0.729	76%	0.762	S	S	*	*			trans	-133.6	-164.8	-165	-55.9	-170.1	-171.4	0	0	112.4	F1154	F1154-M1156 HydrophobicContact CD1-CE 4.3Å; F1154-M1156 HydrophobicContact CE1-CE 3.91Å
1157	T	32.3	Very low	32.7	Very low	116 Å²	116	146.7 Å²	146.7	71%	0.712	75%	0.754	S	S	*	*			cis	-166.5	175.7	18.6	-20.6	0	0	0	0	112.7
1158	R	34.1	Very low	33.1	Very low	217 Å²	217	147.2 Å²	147.2	82%	0.819	76%	0.759	S	S	*	*			trans	76.9	98.3	150.9	-72.8	169.1	-172.1	-101.9	0.9	122.1
1159	Q	29.2	Very low	33.3	Very low	183 Å²	183	147.1 Å²	147.1	86%	0.855	76%	0.762	S	S	*	*				23.8	140.6	119.7	-65	178.1	-29.3	0	0	123.5
1160	V	33.2	Very low	33.2	Very low	125 Å²	125	146.7 Å²	146.7	76%	0.758	76%	0.764	S	S	*	*				155.5	108.9	128.9	158.6	0	0	0	0	106.9
1161	Q	30.8	Very low	33.4	Very low	155 Å²	155	148 Å²	148	72%	0.724	77%	0.765	S	S	*	*				94.1	135.4	53.7	-167.3	-177.5	10.8	0	0	113.4
1162	F	31.5	Very low	33.6	Very low	164 Å²	164	145.2 Å²	145.2	72%	0.719	77%	0.766	S	S	*	*			trans	120.1	98.3	163.2	-73.9	-77	0	0	0	120.7
1163	S	30.1	Very low	33.9	Very low	97 Å²	97	141.5 Å²	141.5	68%	0.678	76%	0.761	S	S	*	*			trans	54.7	123.4	133.9	54.4	0	0	0	0	124.4
1164	P	40.2	Very low	33.9	Very low	120 Å²	120	143.2 Å²	143.2	78%	0.779	77%	0.774	S	S	*	*			trans	-85.1	-168.9	151.8	41.6	-36.3	0	0	0	110.3
1165	P	38.2	Very low	33.9	Very low	114 Å²	114	139.6 Å²	139.6	74%	0.74	78%	0.775	S	S	*	*			cis	-136.4	-174.8	6.4	44.7	-27.5	0	0	0	115.9
1166	L	34.7	Very low	34.1	Very low	174 Å²	174	135.9 Å²	135.9	91%	0.911	77%	0.77	S	S	*	*			trans	179.6	167.6	139	-99.6	166	0	0	0	111.9
1167	S	32.1	Very low	34.2	Very low	104 Å²	104	136.6 Å²	136.6	73%	0.727	78%	0.776	S	S	*	*			trans	-159.5	-175.5	178	62.2	0	0	0	0	110
1168	P	39.7	Very low	34.3	Very low	111 Å²	111	136.4 Å²	136.4	72%	0.721	78%	0.777	S	S	*	*				-114.7	173	-55.3	38.7	-28.1	0	0	0	111.6
1169	I	36.2	Very low	34.4	Very low	170 Å²	170	134.8 Å²	134.8	87%	0.872	78%	0.784	S	S	*	*			trans	-160.9	162.8	162	-112.3	151	0	0	0	114.7
1170	L	30.7	Very low	34.3	Very low	147 Å²	147	132.7 Å²	132.7	77%	0.77	78%	0.778	S	S	*	*			trans	-59.7	148.4	-172.5	-55.2	127.9	0	0	0	116.3
1171	H	35.9	Very low	34.1	Very low	178 Å²	178	133.7 Å²	133.7	82%	0.824	78%	0.778	S	S	*	*				-179.6	164.9	97.2	-126.7	-89	0	0	0	114
1172	A	37.4	Very low	34.2	Very low	78 Å²	78	133.4 Å²	133.4	65%	0.645	79%	0.787	S	S	*	*			trans	-137.9	161	157.3	0	0	0	0	0	108.3
1173	P	37.3	Very low	34	Very low	113 Å²	113	129.7 Å²	129.7	73%	0.734	79%	0.787	S	S	*	*				-160.6	-172.2	102	42.5	-22.8	0	0	0	116.9
1174	C	34.5	Very low	33.9	Very low	130 Å²	130	133.8 Å²	133.8	88%	0.878	80%	0.795	S	S	*	*			trans	82.5	155.4	154.8	-67.7	0	0	0	0	120.1
1175	A	31.1	Very low	33.3	Very low	97 Å²	97	133 Å²	133	80%	0.802	79%	0.792	S	S	*	*			trans	-154	149.8	-164.8	0	0	0	0	0	113.2
1176	S	36.5	Very low	32.8	Very low	112 Å²	112	133.5 Å²	133.5	78%	0.783	79%	0.793	S	S	*	*			trans	168.4	156.6	167.9	47.6	0	0	0	0	107.6
1177	L	31.8	Very low	32.5	Very low	163 Å²	163	134.7 Å²	134.7	85%	0.853	79%	0.787	S	S	*	*			cis	-158.6	161.1	-18.8	-101.1	167.3	0	0	0	105.4
1178	P	34.9	Very low	32.6	Very low	113 Å²	113	136 Å²	136	73%	0.734	79%	0.786	S	S	*	*			trans	-84.4	157.8	-177.7	35.2	-34.7	0	0	0	113
1179	L	35.9	Very low	32.3	Very low	183 Å²	183	138.2 Å²	138.2	96%	0.958	79%	0.791	S	S	*	*			trans	-150.7	155.2	167.4	-107.7	141	0	0	0	110.4
1180	D	27.8	Very low	32.6	Very low	138 Å²	138	134.6 Å²	134.6	74%	0.738	78%	0.778	S	S	*	*			trans	-125.3	163	-163.3	-148.3	-18.5	0	0	0	111.5
1181	I	27.9	Very low	32.8	Very low	147 Å²	147	135.4 Å²	135.4	75%	0.754	78%	0.783	S	S	*	*			trans	53.7	102.3	165.2	-50.2	162.7	0	0	0	117.7
1182	T	33.2	Very low	32.6	Very low	148 Å²	148	136.3 Å²	136.3	91%	0.908	78%	0.779	S	S	*	*			trans	-141.1	150.6	138.1	35.1	0	0	0	0	110.5
1183	A	28.5	Very low	32.5	Very low	87 Å²	87	140.5 Å²	140.5	72%	0.719	79%	0.788	S	S	*	*			trans	-102.2	-172.6	-174.3	0	0	0	0	0	112.8
1184	Q	28.2	Very low	32.2	Very low	183 Å²	183	141 Å²	141	86%	0.855	78%	0.784	S	S	*	*			trans	69.3	101.6	173.4	-66.2	162.9	-28.3	0	0	113.5
1185	S	25.9	Very low	32.1	Very low	102 Å²	102	139.9 Å²	139.9	71%	0.713	78%	0.777	S	S	*	*				62.4	120.9	77	75.3	0	0	0	0	114
1186	V	28	Very low	32.2	Very low	125 Å²	125	144 Å²	144	76%	0.758	78%	0.78	S	S	*	*			trans	176	117.4	133.6	145.9	0	0	0	0	112.3
1187	Y	29.9	Very low	31.8	Very low	200 Å²	200	146.1 Å²	146.1	78%	0.784	78%	0.779	S	S	*	*			trans	71.8	164.7	138.7	-76.6	-118.9	0	0	0	125
1188	D	33.5	Very low	31.8	Very low	132 Å²	132	145.7 Å²	145.7	71%	0.706	78%	0.778	S	S	*	*			trans	71.6	116.1	160.9	-55.1	-31	0	0	0	120.8
1189	L	34.2	Very low	31.5	Very low	157 Å²	157	146.8 Å²	146.8	82%	0.822	78%	0.776	S	S	*	*			cis	85.1	166.3	19.5	-137.7	82.7	0	0	0	113.3
1190	P	40.8	Very low	31.4	Very low	93 Å²	93	142.8 Å²	142.8	60%	0.604	76%	0.764	S	S	*	*				-129.6	175.1	-83.9	42.8	-30.7	0	0	0	116.5
1191	D	35.8	Very low	31.6	Very low	164 Å²	164	142.7 Å²	142.7	88%	0.877	76%	0.763	S	S	*	*			trans	-125.4	129	149.4	-76.7	-54.7	0	0	0	108.7
1192	R	32	Very low	32.1	Very low	197 Å²	197	143.6 Å²	143.6	74%	0.743	77%	0.769	S	S	*	*			cis	92.5	86.3	12.4	-158.3	-166.5	-174.3	-161.2	2.2	117.4
1193	M	35.2	Very low	31.9	Very low	166 Å²	166	141.5 Å²	141.5	82%	0.818	76%	0.761	S	S	*	*				-147.6	122.9	127	-68.8	-143.3	92.3	0	0	106.7
1194	L	30.7	Very low	32.1	Very low	124 Å²	124	142.4 Å²	142.4	65%	0.649	76%	0.762	S	S	*	*				51.5	116.8	78.6	-61.1	173.3	0	0	0	110.5
1195	S	32.8	Very low	32.5	Very low	106 Å²	106	142.8 Å²	142.8	74%	0.741	76%	0.76	S	S	*	*			cis	-171.2	-179.2	32.5	58.9	0	0	0	0	109.4
1196	Q	33.8	Very low	32.8	Very low	185 Å²	185	146.3 Å²	146.3	86%	0.864	77%	0.77	S	S	*	*			cis	-134.8	178.7	3.9	-78.6	-170	-16	0	0	111
1197	M	26.9	Very low	32.9	Very low	155 Å²	155	148 Å²	148	76%	0.764	78%	0.776	S	S	*	*			trans	-90.6	150.9	174.4	-64.1	164.1	166.1	0	0	113	I1199	M1197-I1199 HydrophobicContact CB-CD1 4.2Å; M1197-I1199 HydrophobicContact SD-CD1 4.41Å
1198	N	31.9	Very low	33.2	Very low	155 Å²	155	146.1 Å²	146.1	83%	0.829	78%	0.779	S	S	*	*			trans	-174.7	120.4	131.2	-87.9	-20.1	0	0	0	105.9
1199	I	29.4	Very low	33.3	Very low	136 Å²	136	148 Å²	148	70%	0.697	79%	0.788	S	S	*	*			cis	74.4	133.1	41.1	-53.7	177.6	0	0	0	112	M1197	M1197-I1199 HydrophobicContact CB-CD1 4.2Å; M1197-I1199 HydrophobicContact SD-CD1 4.41Å
1200	S	33.5	Very low	33.1	Very low	99 Å²	99	148.4 Å²	148.4	69%	0.692	79%	0.789	S	S	*	*			trans	75.2	140.9	-178	-155.3	0	0	0	0	115.7
1201	D	31.9	Very low	32.8	Very low	135 Å²	135	151.3 Å²	151.3	72%	0.722	80%	0.8	S	S	*	*			cis	-165	147.4	-36	-94	-52.2	0	0	0	104.6
1202	D	37.6	Very low	32.8	Very low	167 Å²	167	153.1 Å²	153.1	89%	0.893	80%	0.8	S	S	*	*				-171.2	125	125.4	-117.7	-28.5	0	0	0	111.1
1203	S	29.1	Very low	32.8	Very low	104 Å²	104	154.7 Å²	154.7	73%	0.727	81%	0.806	S	S	*	*			trans	-117	137.5	178.7	72.9	0	0	0	0	110.1
1204	S	32.5	Very low	32.8	Very low	105 Å²	105	151.9 Å²	151.9	73%	0.734	80%	0.802	S	S	*	*			trans	175.7	172.7	130.2	50.4	0	0	0	0	111.3
1205	K	36.5	Very low	32.9	Very low	191 Å²	191	152.6 Å²	152.6	83%	0.83	81%	0.805	S	S	*	*	S	Bend	trans	67.9	63.3	173.1	-53	176.4	-176.3	173.1	0	116.7
1206	L	33.3	Very low	33	Very low	176 Å²	176	157.4 Å²	157.4	92%	0.921	81%	0.813	S	S	*	*				-170	61.2	129.5	-103.9	163.3	0	0	0	111.9
1207	N	29.3	Very low	33	Very low	162 Å²	162	151.4 Å²	151.4	87%	0.866	80%	0.8	S	S	*	*			trans	-122.4	92.4	173.2	-120.4	-16.2	0	0	0	109.3
1208	N	36.2	Very low	33.4	Very low	159 Å²	159	155.2 Å²	155.2	85%	0.85	81%	0.808	S	S	*	*			trans	-167.1	160.4	165.9	-103.5	-36.2	0	0	0	110.1
1209	L	35.8	Very low	33.4	Very low	171 Å²	171	152.9 Å²	152.9	90%	0.895	80%	0.804	S	S	*	*			trans	72.9	41.2	172	-58	171.5	0	0	0	119.1
1210	I	30.6	Very low	33.7	Very low	166 Å²	166	150.5 Å²	150.5	85%	0.851	81%	0.805	S	S	*	*			trans	-132.2	101.4	146.6	-56.7	-179.2	0	0	0	109.8
1211	N	33.6	Very low	33.8	Very low	154 Å²	154	151.4 Å²	151.4	82%	0.824	81%	0.811	S	S	*	*			trans	-168.4	151	160.4	-117.4	-49	0	0	0	114.4
1212	K	37	Very low	34	Very low	202 Å²	202	150.5 Å²	150.5	88%	0.878	81%	0.812	S	S	*	*			trans	77.2	136.3	-174.7	-53.3	171.6	178.8	175.8	0	115.6
1213	R	31.6	Very low	34	Very low	231 Å²	231	148.5 Å²	148.5	87%	0.872	81%	0.808	S	S	*	*			cis	151.3	144	-29.7	-101.8	-165.1	169.1	-172.3	-1	109.1
1214	S	35.1	Very low	34.4	Very low	106 Å²	106	150.2 Å²	150.2	74%	0.741	81%	0.814	S	S	*	*			trans	111.4	111.8	156.5	-155.8	0	0	0	0	114
1215	I	32.8	Very low	34.4	Very low	140 Å²	140	151.6 Å²	151.6	72%	0.718	81%	0.813	S	S	*	*			cis	90.6	103.8	37.2	-58.9	166.8	0	0	0	114.1
1216	K	34.7	Very low	34.4	Very low	207 Å²	207	153.7 Å²	153.7	90%	0.9	82%	0.816	S	S	*	*			trans	166	146.9	144.4	-95.8	170.5	179.1	-179.7	0	108.8
1217	G	34.1	Very low	34.6	Very low	58 Å²	58	153.3 Å²	153.3	60%	0.598	81%	0.807	S	S	*	*			cis	161.7	146.6	-12.1	0	0	0	0	0	112.7
1218	Y	34.8	Very low	34.9	Very low	235 Å²	235	151 Å²	151	92%	0.922	79%	0.794	S	S	*	*			trans	68.9	154.2	175.1	-55.8	-84.8	0	0	0	116.3
1219	S	32.2	Very low	35	Very low	107 Å²	107	149.4 Å²	149.4	75%	0.748	79%	0.786	S	S	*	*			cis	-179.6	163.9	-19.6	51.9	0	0	0	0	110.5
1220	A	36	Very low	34.9	Very low	86 Å²	86	149.7 Å²	149.7	71%	0.711	78%	0.783	S	S	*	*			cis	-180	145.2	-29.6	0	0	0	0	0	111.1
1221	S	34.4	Very low	35.1	Very low	118 Å²	118	146.9 Å²	146.9	83%	0.825	78%	0.778	S	S	*	*			trans	66.2	165.9	156.9	-62.6	0	0	0	0	120.2
1222	P	37.8	Very low	35.1	Very low	115 Å²	115	151.2 Å²	151.2	75%	0.747	80%	0.801	S	S	*	*			cis	-135.6	177.3	-34.9	37.9	-20.7	0	0	0	114.5
1223	P	36.3	Very low	35	Very low	125 Å²	125	148.7 Å²	148.7	81%	0.812	80%	0.797	S	S	*	*			trans	-101.8	162.1	175.6	38.3	-34	0	0	0	115.3
1224	V	37.5	Very low	35.2	Very low	140 Å²	140	144.3 Å²	144.3	85%	0.848	79%	0.793	S	S	*	*			trans	-130.1	99.4	178.3	-176.4	0	0	0	0	114.9
1225	N	32.1	Very low	35.2	Very low	134 Å²	134	146.4 Å²	146.4	72%	0.717	80%	0.796	S	S	*	*			trans	-11.8	128.8	144.6	-170.7	4.2	0	0	0	119.9
1226	R	36.5	Very low	35.4	Very low	235 Å²	235	146.8 Å²	146.8	89%	0.887	80%	0.8	S	S	*	*			trans	167.7	152.4	138.1	-91.7	158.6	-166	-168	5.5	108.9
1227	K	37.9	Very low	35.4	Very low	168 Å²	168	143.1 Å²	143.1	73%	0.73	79%	0.794	S	S	*	*			cis	169.8	146	-27.7	-128.8	-165.5	167.6	-147.4	0	105.3
1228	N	36.3	Very low	35.5	Very low	114 Å²	114	148.7 Å²	148.7	61%	0.61	81%	0.807	S	S	*	*			trans	81.1	152.7	145.5	-91.4	77.5	0	0	0	122.8
1229	D	37.3	Very low	35.5	Very low	126 Å²	126	142.6 Å²	142.6	67%	0.674	80%	0.799	S	S	*	*			trans	81.4	74	153.7	-49.1	-18.6	0	0	0	121
1230	E	34.3	Very low	35.8	Very low	177 Å²	177	145.3 Å²	145.3	83%	0.827	80%	0.803	S	S	*	*				50.4	135	117.4	-61.3	-173.3	154.1	0	0	123.9
1231	S	34.8	Very low	35.8	Very low	106 Å²	106	150.3 Å²	150.3	74%	0.741	81%	0.811	S	S	*	*			trans	70.4	96.7	145.9	64.4	0	0	0	0	121.3
1232	N	34.2	Very low	35.9	Very low	245 Å²	245	153.2 Å²	153.2	100%	1.31	81%	0.809	S	S	*	*				-160.1	0	112.6	-99.9	-71.8	0	0	0	110.3

Retrieved 1,232 of 1,232 residues in 197.5 ms (Link to these results)

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