A0A3Q0KRE6_SCHMA Loading...

Calcium-activated potassium channel AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KRE6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,049 aa.

						>A0A3Q0KRE6_SCHMA|A0A3Q0KRE6
MRANGARPGLIQLRHVKEFKAAKELENQYQQQTSRKQENQETKTKIKHSNISKYPCTLGIFPARSSSGSSGGLVGTNQPSPFHHLISGGVLGATVLTLAAKDNRSAKELREIQKHQQSTAPQLEKNTISQVKEQLNSEENSSDKPWSQQHNNKNNQALLDEYHHECNCSNVAIDPLAVEQVMYNHDIPIDSIKRNRPNLSSDTSNTSKTSQPVSEIHLHKHNHHYDKIRYQLARSATVTSSSPMTKHTQLETNDNCNPRETDMIRLQETLSVPGLLRQWTDDSDYTDDYSLYKRQNSFETNDRPLSHDSSNMSLHTHSANIYNETLFKQYDTLNENQSGRINQDNNLRLGNTNVKFLSKQPSLDRNDVKNVQFNKELNDENRANSVTNYLNTCPTSHLNSGCHSRIKRLRENFEKTRSSTYTWKPTWNMGGLLESRTDEEQPLATTRISGSDSRVFHTPDALPTIVDKNTKITAENVPQISIEENEDTGKSVKISGIKEQERFSPPTLDLQIADKHDNTDDIHKTPLISPLINIESEVEETADDSERSIMQRRRDAMNNQHQQRTIKNVGYRLGKRKRLFEKRCRISDFSLSFAVFGILVMLIETELIFAGVYEKDSIYSFITKTCISISTCILLGLILAYHVYVIKIFSCDDSIEDWRMAVDCNRIFQMTLEVLVCIIHPFPGSYLIEFPVSSALVGPGTEIYSPVYHSQQTTKSLTLHNITRMTTRQTTNRTVNFRPFSGLSTFSTPITSTSTMSTSSSPTLSTFSSFDNVQSHSIKIVSIDLILSVPMFFRLYLLFRVMLLHSKLFTDAGSRSIGAMNKVNFDTRFIFKTLMTMCPGKLLLGFILCLWIVYSWTLRACESFYDTENGSLLNSMWLIAVTFLSIGYGDIVPHTYCGRVIALATGVMGSGCTALVVAVFARKLELSKAEKHVIHFMMENQLNKKVKNYAANVLRETWLIYKYTKLVKRVDASKVRTHQRKFLRAIHGLRRMKLDQRKVQDSANTLVDLAKTLDHITFSDLKSSLRQTFMKLLLIYEWNRVVYNTEWRH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	32.6	Very low	40.4	Very low	250 Å²	250	135 Å²	135	100%	1.232	76%	0.755	S	S	*	*				0	173.6	0	-74.1	-176.3	172.4	0	0	109.8
2	R	29.1	Very low	41.3	Very low	253 Å²	253	129.3 Å²	129.3	96%	0.955	72%	0.718	S	S	*	*			trans	-56.1	129.7	-169.8	-66.2	175.4	176.6	162.9	-2	114.2
3	A	37.1	Very low	41.9	Very low	86 Å²	86	127.2 Å²	127.2	71%	0.711	70%	0.704	S	S	*	*			trans	-167.6	130.3	141.7	0	0	0	0	0	112.7
4	N	40	Very low	42.8	Very low	159 Å²	159	130.8 Å²	130.8	85%	0.85	70%	0.702	S	S	*	*			trans	48.8	103.8	147.2	-55	-20.7	0	0	0	120.2
5	G	38.9	Very low	44	Very low	78 Å²	78	130 Å²	130	80%	0.804	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-62.4	137	162.7	0	0	0	0	0	112.5	R7	G5-R7 PolarHBondContact O-N 3.44Å
6	A	40.3	Very low	45.3	Very low	88 Å²	88	125.5 Å²	125.5	73%	0.727	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-71.5	123.3	-172.8	0	0	0	0	0	112.6
7	R	40.6	Very low	46.6	Very low	211 Å²	211	127.2 Å²	127.2	80%	0.796	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-69.5	138.9	168.5	-68.5	-177.7	175.6	-171.8	-1.3	109.8	G5 G9 L10	G5-R7 PolarHBondContact O-N 3.44Å; R7-G9 PolarHBondContact O-N 3.46Å; R7-L10 PolarHBondContact O-N 3.02Å
8	P	46.5	Very low	48.1	Very low	116 Å²	116	125.7 Å²	125.7	75%	0.753	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	0.7	-176.6	24.8	-34.5	0	0	0	115.9
9	G	43.2	Very low	49.3	Very low	42 Å²	42	125.2 Å²	125.2	43%	0.433	65%	0.651	S	S	.	*	H	α-helix	trans	-77.3	-14.2	174.4	0	0	0	0	0	115.3	R7 I11 L13	R7-G9 PolarHBondContact O-N 3.46Å; G9-I11 VanDerWaalsContact C-N 3.35Å; G9-I11 PolarHBondContact O-N 2.66Å; G9-L13 PolarHBondContact O-N 3.25Å
10	L	47.1	Very low	50.6	Low	118 Å²	118	125.5 Å²	125.5	62%	0.618	65%	0.647	S	S	*	*	H	α-helix	trans	-68.6	-30.6	-176.6	-105.2	147.7	0	0	0	113.5	R7 L13 R14	R7-L10 PolarHBondContact O-N 3.02Å; L10-L13 WeakPolarHBondContact O-CB 3.39Å; L10-L13 PolarHBondContact O-N 3.26Å; L10-R14 PolarHBondContact O-N 3.42Å
11	I	49.1	Very low	52	Low	84 Å²	84	122 Å²	122	43%	0.431	64%	0.637	S	S	.	*	H	α-helix	trans	-70.4	-45.9	-179.5	-62.6	150.2	0	0	0	110.8	G9 L13 R14 H15 D653	G9-I11 VanDerWaalsContact C-N 3.35Å; G9-I11 PolarHBondContact O-N 2.66Å; I11-L13 PolarHBondContact O-N 3.04Å; I11-R14 PolarHBondContact O-N 2.93Å; I11-R14 VanDerWaalsContact O-N 3.16Å; I11-H15 PolarHBondContact O-N 3.48Å; I11-D653 WeakPolarHBondContact CD1-OD1 3.34Å
12	Q	51.5	Low	54.1	Low	66 Å²	66	112.8 Å²	112.8	31%	0.308	60%	0.601	S	S	.	*	H	α-helix	trans	-55.5	-40.8	171.9	-72.2	-79.5	21.5	0	0	111.6	R14 H15 V16 N824	Q12-R14 VanDerWaalsContact C-N 3.3Å; Q12-R14 PolarHBondContact O-N 2.85Å; Q12-H15 PolarHBondContact O-N 3.45Å; Q12-V16 WeakPolarHBondContact O-CB 3.27Å; Q12-V16 VanDerWaalsContact O-CG2 3.3Å; Q12-V16 WeakPolarHBondContact O-CG2 3.31Å; Q12-V16 PolarHBondContact O-N 2.88Å; Q12-N824 PolarHBondContact NE2-OD1 3.02Å
13	L	48.5	Very low	56.5	Low	102 Å²	102	105.9 Å²	105.9	53%	0.534	58%	0.578	S	S	.	*	H	α-helix	trans	-65.2	-26.8	-179.6	-103.4	161.6	0	0	0	114.1	G9 L10 I11 K17	G9-L13 PolarHBondContact O-N 3.25Å; L10-L13 WeakPolarHBondContact O-CB 3.39Å; L10-L13 PolarHBondContact O-N 3.26Å; I11-L13 PolarHBondContact O-N 3.04Å; L13-K17 WeakPolarHBondContact O-CG 3.49Å; L13-K17 PolarHBondContact O-N 3.23Å
14	R	54.2	Low	58.6	Low	178 Å²	178	105.7 Å²	105.7	67%	0.672	56%	0.562	S	S	*	*	H	α-helix	trans	-73.8	-53.7	174	-171.4	-177.9	-67.3	-130.6	4.6	110.9	L10 I11 Q12 V16 K17 E18	L10-R14 PolarHBondContact O-N 3.42Å; I11-R14 PolarHBondContact O-N 2.93Å; I11-R14 VanDerWaalsContact O-N 3.16Å; Q12-R14 VanDerWaalsContact C-N 3.3Å; Q12-R14 PolarHBondContact O-N 2.85Å; R14-V16 VanDerWaalsContact C-N 3.31Å; R14-V16 PolarHBondContact O-N 3.39Å; R14-K17 WeakPolarHBondContact O-CB 3.41Å; R14-K17 PolarHBondContact O-N 3.44Å; R14-E18 WeakPolarHBondContact CG-OE1 3.22Å; R14-E18 PolarHBondContact O-N 3.18Å
15	H	60.8	Low	60.6	Low	119 Å²	119	103.4 Å²	103.4	55%	0.551	55%	0.549	S	S	*	.	H	α-helix	trans	-62.9	-34.5	179.4	-77.8	-42.2	0	0	0	113.3	I11 Q12 E18 F19	I11-H15 PolarHBondContact O-N 3.48Å; Q12-H15 PolarHBondContact O-N 3.45Å; H15-E18 IonicContact CE1-OE2 2.67Å; H15-E18 IonicContact ND1-OE2 3Å; H15-E18 PolarHBondContact ND1-OE2 3.13Å; H15-E18 PolarHBondContact O-N 2.92Å; H15-F19 VanDerWaalsContact O-CB 3.24Å; H15-F19 WeakPolarHBondContact O-CB 3.37Å; H15-F19 PolarHBondContact O-N 2.99Å
16	V	66.1	Low	62.5	Low	58 Å²	58	105.1 Å²	105.1	35%	0.352	54%	0.536	S	S	.	.	H	α-helix	trans	-67.2	-34.5	173.6	171	0	0	0	0	111.9	Q12 R14 K20	Q12-V16 WeakPolarHBondContact O-CB 3.27Å; Q12-V16 VanDerWaalsContact O-CG2 3.3Å; Q12-V16 WeakPolarHBondContact O-CG2 3.31Å; Q12-V16 PolarHBondContact O-N 2.88Å; R14-V16 VanDerWaalsContact C-N 3.31Å; R14-V16 PolarHBondContact O-N 3.39Å; V16-K20 VanDerWaalsContact O-CB 3.3Å; V16-K20 WeakPolarHBondContact O-CB 3.45Å; V16-K20 PolarHBondContact O-N 3.38Å
17	K	67.3	Low	64.3	Low	154 Å²	154	104.8 Å²	104.8	67%	0.67	52%	0.522	S	S	*	.	H	α-helix	trans	-67.8	-46.2	172.5	-80.5	-177.9	175.9	-171.5	0	111.9	L13 R14 K20 A21	L13-K17 WeakPolarHBondContact O-CG 3.49Å; L13-K17 PolarHBondContact O-N 3.23Å; R14-K17 WeakPolarHBondContact O-CB 3.41Å; R14-K17 PolarHBondContact O-N 3.44Å; K17-K20 PolarHBondContact O-N 3.41Å; K17-A21 WeakPolarHBondContact O-CB 3.29Å; K17-A21 PolarHBondContact O-N 3.38Å
18	E	72.3	Confident	66	Low	100 Å²	100	100 Å²	100	47%	0.467	51%	0.509	S	S	.	.	H	α-helix	trans	-61	-46.7	177.4	-70.4	164.9	-179.9	0	0	111.4	R14 H15 A21 A22	R14-E18 WeakPolarHBondContact CG-OE1 3.22Å; R14-E18 PolarHBondContact O-N 3.18Å; H15-E18 IonicContact CE1-OE2 2.67Å; H15-E18 IonicContact ND1-OE2 3Å; H15-E18 PolarHBondContact ND1-OE2 3.13Å; H15-E18 PolarHBondContact O-N 2.92Å; E18-A21 PolarHBondContact O-N 3.22Å; E18-A22 WeakPolarHBondContact O-CB 3.39Å; E18-A22 PolarHBondContact O-N 2.85Å
19	F	72.5	Confident	67.4	Low	116 Å²	116	102.1 Å²	102.1	51%	0.509	50%	0.503	S	S	.	.	H	α-helix	trans	-68	-36.5	178.4	-165.9	-96.3	0	0	0	112.5	H15 K23 M820	H15-F19 VanDerWaalsContact O-CB 3.24Å; H15-F19 WeakPolarHBondContact O-CB 3.37Å; H15-F19 PolarHBondContact O-N 2.99Å; F19-K23 PolarHBondContact O-N 2.99Å; F19-M820 HydrophobicContact CE1-CG 4.29Å; F19-M820 HydrophobicContact CE1-SD 3.98Å; F19-M820 HydrophobicContact CZ-SD 4.43Å
20	K	75	Confident	68.9	Low	131 Å²	131	105.1 Å²	105.1	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-63.9	-47.8	171.7	-166.1	-173.1	-176.5	-132.1	0	110.8	V16 K17 A22 K23 E24	V16-K20 VanDerWaalsContact O-CB 3.3Å; V16-K20 WeakPolarHBondContact O-CB 3.45Å; V16-K20 PolarHBondContact O-N 3.38Å; K17-K20 PolarHBondContact O-N 3.41Å; K20-A22 VanDerWaalsContact C-N 3.32Å; K20-A22 PolarHBondContact O-N 3.03Å; K20-K23 PolarHBondContact O-N 3.46Å; K20-K23 VanDerWaalsContact O-N 3.14Å; K20-E24 WeakPolarHBondContact CE-OE2 3.5Å; K20-E24 IonicContact NZ-OE2 2.7Å; K20-E24 PolarHBondContact NZ-OE2 3.16Å; K20-E24 WeakPolarHBondContact O-CB 3.41Å; K20-E24 PolarHBondContact O-N 2.83Å
21	A	78.6	Confident	70.1	Confident	53 Å²	53	105.1 Å²	105.1	44%	0.438	50%	0.503	S	S	.	.	H	α-helix	trans	-60.1	-40.2	178.6	0	0	0	0	0	112.4	K17 E18 E24 L25	K17-A21 WeakPolarHBondContact O-CB 3.29Å; K17-A21 PolarHBondContact O-N 3.38Å; E18-A21 PolarHBondContact O-N 3.22Å; A21-E24 PolarHBondContact O-N 3.04Å; A21-L25 WeakPolarHBondContact O-CB 3.45Å; A21-L25 WeakPolarHBondContact O-CG 3.31Å; A21-L25 PolarHBondContact O-N 3.47Å
22	A	78.2	Confident	71.3	Confident	57 Å²	57	106.1 Å²	106.1	47%	0.471	51%	0.506	S	S	.	.	H	α-helix	trans	-61.2	-43.1	173.6	0	0	0	0	0	112.3	E18 K20 L25 E26	E18-A22 WeakPolarHBondContact O-CB 3.39Å; E18-A22 PolarHBondContact O-N 2.85Å; K20-A22 VanDerWaalsContact C-N 3.32Å; K20-A22 PolarHBondContact O-N 3.03Å; A22-L25 PolarHBondContact O-N 3.28Å; A22-E26 PolarHBondContact O-N 2.67Å
23	K	79.7	Confident	72.3	Confident	108 Å²	108	105.5 Å²	105.5	47%	0.47	51%	0.506	S	S	.	.	H	α-helix	trans	-72.6	-32.2	176.8	-170.1	166.9	-175	172	0	113.4	F19 K20 L25 E26 N27	F19-K23 PolarHBondContact O-N 2.99Å; K20-K23 PolarHBondContact O-N 3.46Å; K20-K23 VanDerWaalsContact O-N 3.14Å; K23-L25 VanDerWaalsContact C-N 3.34Å; K23-E26 PolarHBondContact O-N 3.39Å; K23-N27 WeakPolarHBondContact O-CB 3.21Å; K23-N27 VanDerWaalsContact O-CG 3.3Å; K23-N27 PolarHBondContact O-N 2.88Å
24	E	80.7	Confident	73.2	Confident	81 Å²	81	103.8 Å²	103.8	38%	0.379	50%	0.503	S	S	.	.	H	α-helix	trans	-63	-43.1	171.6	-140	86.6	-110.2	0	0	109.8	K20 A21 Q28	K20-E24 WeakPolarHBondContact CE-OE2 3.5Å; K20-E24 IonicContact NZ-OE2 2.7Å; K20-E24 PolarHBondContact NZ-OE2 3.16Å; K20-E24 WeakPolarHBondContact O-CB 3.41Å; K20-E24 PolarHBondContact O-N 2.83Å; A21-E24 PolarHBondContact O-N 3.04Å; E24-Q28 WeakPolarHBondContact O-CB 3.32Å; E24-Q28 WeakPolarHBondContact O-CG 3.47Å; E24-Q28 PolarHBondContact O-N 3.19Å
25	L	81.5	Confident	73.8	Confident	112 Å²	112	102.7 Å²	102.7	59%	0.586	50%	0.499	S	S	*	.	H	α-helix	trans	-65.9	-41.7	173.5	-79.2	166.6	0	0	0	113	A21 A22 K23 Q28 Y29	A21-L25 WeakPolarHBondContact O-CB 3.45Å; A21-L25 WeakPolarHBondContact O-CG 3.31Å; A21-L25 PolarHBondContact O-N 3.47Å; A22-L25 PolarHBondContact O-N 3.28Å; K23-L25 VanDerWaalsContact C-N 3.34Å; L25-Q28 PolarHBondContact O-N 2.99Å; L25-Y29 WeakPolarHBondContact O-CB 3.43Å; L25-Y29 PolarHBondContact O-N 3Å
26	E	79	Confident	74.1	Confident	113 Å²	113	103.3 Å²	103.3	53%	0.528	50%	0.5	S	S	.	.	H	α-helix	trans	-62.9	-43.9	175.9	-170.9	177.4	-165.3	0	0	111.3	A22 K23 Y29 Q30	A22-E26 PolarHBondContact O-N 2.67Å; K23-E26 PolarHBondContact O-N 3.39Å; E26-Y29 PolarHBondContact O-N 3.02Å; E26-Q30 WeakPolarHBondContact O-CG 3.47Å; E26-Q30 PolarHBondContact O-N 3.02Å
27	N	77.5	Confident	74.1	Confident	81 Å²	81	106.8 Å²	106.8	43%	0.433	51%	0.512	S	S	.	.	H	α-helix	trans	-60.8	-44.7	172.9	-77.1	-9.3	0	0	0	112	K23 Y29 Q30 Q31	K23-N27 WeakPolarHBondContact O-CB 3.21Å; K23-N27 VanDerWaalsContact O-CG 3.3Å; K23-N27 PolarHBondContact O-N 2.88Å; N27-Y29 VanDerWaalsContact C-N 3.34Å; N27-Y29 PolarHBondContact O-N 3.18Å; N27-Q30 PolarHBondContact O-N 2.92Å; N27-Q31 WeakPolarHBondContact O-CB 3.49Å; N27-Q31 PolarHBondContact O-N 2.63Å
28	Q	77.5	Confident	73.9	Confident	110 Å²	110	105.7 Å²	105.7	51%	0.514	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-39.9	176.3	-77.3	-177.7	7.6	0	0	112	E24 L25 Q31 Q32	E24-Q28 WeakPolarHBondContact O-CB 3.32Å; E24-Q28 WeakPolarHBondContact O-CG 3.47Å; E24-Q28 PolarHBondContact O-N 3.19Å; L25-Q28 PolarHBondContact O-N 2.99Å; Q28-Q31 PolarHBondContact O-N 2.92Å; Q28-Q32 WeakPolarHBondContact O-CG 3.33Å; Q28-Q32 PolarHBondContact O-N 3.31Å
29	Y	76.2	Confident	73.4	Confident	162 Å²	162	106.1 Å²	106.1	64%	0.635	52%	0.515	S	S	*	.	H	α-helix	trans	-65.3	-46.2	176.7	-171.5	-93.9	0	0	0	111.4	L25 E26 N27 Q31 Q32 T33	L25-Y29 WeakPolarHBondContact O-CB 3.43Å; L25-Y29 PolarHBondContact O-N 3Å; E26-Y29 PolarHBondContact O-N 3.02Å; N27-Y29 VanDerWaalsContact C-N 3.34Å; N27-Y29 PolarHBondContact O-N 3.18Å; Y29-Q31 VanDerWaalsContact C-N 3.35Å; Y29-Q31 PolarHBondContact O-N 2.9Å; Y29-Q32 PolarHBondContact O-N 3.09Å; Y29-T33 HydrophobicContact CD1-CG2 4.44Å; Y29-T33 HydrophobicContact CE1-CG2 4.01Å; Y29-T33 PolarHBondContact O-N 3.43Å; Y29-T33 PolarHBondContact O-OG1 3.17Å
30	Q	74	Confident	72.9	Confident	104 Å²	104	107 Å²	107	49%	0.486	52%	0.521	S	S	.	.	H	α-helix	trans	-57.9	-46.7	174	-73	-174.3	24.6	0	0	111.3	E26 N27 Q32 T33 S34	E26-Q30 WeakPolarHBondContact O-CG 3.47Å; E26-Q30 PolarHBondContact O-N 3.02Å; N27-Q30 PolarHBondContact O-N 2.92Å; Q30-Q32 VanDerWaalsContact C-N 3.34Å; Q30-Q32 PolarHBondContact O-N 3.29Å; Q30-T33 WeakPolarHBondContact CA-OG1 3.38Å; Q30-T33 PolarHBondContact O-N 2.96Å; Q30-T33 VanDerWaalsContact O-N 3.09Å; Q30-T33 PolarHBondContact O-OG1 3.3Å; Q30-S34 PolarHBondContact O-N 3.2Å; Q30-S34 PolarHBondContact O-OG 3.41Å
31	Q	73.1	Confident	71.9	Confident	118 Å²	118	106 Å²	106	55%	0.551	52%	0.518	S	S	*	.	H	α-helix	trans	-66.2	-33	179.1	-163.7	172.7	66.4	0	0	112.6	N27 Q28 Y29 R35	N27-Q31 WeakPolarHBondContact O-CB 3.49Å; N27-Q31 PolarHBondContact O-N 2.63Å; Q28-Q31 PolarHBondContact O-N 2.92Å; Y29-Q31 VanDerWaalsContact C-N 3.35Å; Y29-Q31 PolarHBondContact O-N 2.9Å; Q31-R35 WeakPolarHBondContact O-CG 3.49Å; Q31-R35 PolarHBondContact O-N 2.79Å
32	Q	73.6	Confident	70.8	Confident	106 Å²	106	106.6 Å²	106.6	50%	0.495	52%	0.516	S	S	.	.	H	α-helix	trans	-67.3	-38.8	169.1	-77.6	-165	21.1	0	0	112.6	Q28 Y29 Q30 K36	Q28-Q32 WeakPolarHBondContact O-CG 3.33Å; Q28-Q32 PolarHBondContact O-N 3.31Å; Y29-Q32 PolarHBondContact O-N 3.09Å; Q30-Q32 VanDerWaalsContact C-N 3.34Å; Q30-Q32 PolarHBondContact O-N 3.29Å; Q32-K36 WeakPolarHBondContact O-CB 3.24Å; Q32-K36 VanDerWaalsContact O-CG 3.3Å; Q32-K36 WeakPolarHBondContact O-CG 3.24Å; Q32-K36 PolarHBondContact O-N 3.17Å
33	T	71.8	Confident	69.6	Low	53 Å²	53	111.5 Å²	111.5	33%	0.325	53%	0.527	S	S	.	.	H	α-helix	trans	-66.8	-40.6	175.5	44.2	0	0	0	0	112.2	Y29 Q30 K36 Q37	Y29-T33 HydrophobicContact CD1-CG2 4.44Å; Y29-T33 HydrophobicContact CE1-CG2 4.01Å; Y29-T33 PolarHBondContact O-N 3.43Å; Y29-T33 PolarHBondContact O-OG1 3.17Å; Q30-T33 WeakPolarHBondContact CA-OG1 3.38Å; Q30-T33 PolarHBondContact O-N 2.96Å; Q30-T33 VanDerWaalsContact O-N 3.09Å; Q30-T33 PolarHBondContact O-OG1 3.3Å; T33-K36 PolarHBondContact O-N 2.9Å; T33-Q37 PolarHBondContact O-N 3.02Å
34	S	67.6	Low	68.3	Low	65 Å²	65	110.1 Å²	110.1	46%	0.455	53%	0.527	S	S	.	.	H	α-helix	trans	-61.4	-48.3	174	-56.3	0	0	0	0	111.7	Q30 K36 Q37 E38	Q30-S34 PolarHBondContact O-N 3.2Å; Q30-S34 PolarHBondContact O-OG 3.41Å; S34-K36 PolarHBondContact O-N 3.37Å; S34-Q37 PolarHBondContact O-N 3.4Å; S34-Q37 VanDerWaalsContact O-N 3.11Å; S34-E38 WeakPolarHBondContact O-CB 3.35Å; S34-E38 PolarHBondContact O-N 3.31Å
35	R	67.6	Low	66.6	Low	156 Å²	156	112.3 Å²	112.3	59%	0.589	54%	0.536	S	S	*	.	H	α-helix	trans	-60.1	-32.3	175.3	-74.3	-178	-177	-171.3	3.6	113.1	Q31 N39	Q31-R35 WeakPolarHBondContact O-CG 3.49Å; Q31-R35 PolarHBondContact O-N 2.79Å; R35-N39 VanDerWaalsContact O-CB 3.31Å; R35-N39 WeakPolarHBondContact O-CB 3.48Å; R35-N39 PolarHBondContact O-N 3.42Å; R35-N39 PolarHBondContact O-ND2 3.39Å
36	K	66.4	Low	65	Low	132 Å²	132	113.4 Å²	113.4	57%	0.574	54%	0.541	S	S	*	.	H	α-helix	trans	-70.6	-39.3	174.9	-77.2	169.2	-178.4	168.2	0	112	Q32 T33 S34 Q40	Q32-K36 WeakPolarHBondContact O-CB 3.24Å; Q32-K36 VanDerWaalsContact O-CG 3.3Å; Q32-K36 WeakPolarHBondContact O-CG 3.24Å; Q32-K36 PolarHBondContact O-N 3.17Å; T33-K36 PolarHBondContact O-N 2.9Å; S34-K36 PolarHBondContact O-N 3.37Å; K36-Q40 WeakPolarHBondContact O-CB 3.26Å; K36-Q40 PolarHBondContact O-N 3.49Å
37	Q	66.3	Low	63.2	Low	131 Å²	131	116.8 Å²	116.8	61%	0.612	55%	0.554	S	S	*	*	H	α-helix	trans	-67.3	-43	173	-69.5	-179.7	-72.5	0	0	111.9	T33 S34 Q40 E41	T33-Q37 PolarHBondContact O-N 3.02Å; S34-Q37 PolarHBondContact O-N 3.4Å; S34-Q37 VanDerWaalsContact O-N 3.11Å; Q37-Q40 CarbonylContact O-C 3.49Å; Q37-Q40 WeakPolarHBondContact O-CA 3.13Å; Q37-Q40 WeakPolarHBondContact O-CB 3.32Å; Q37-Q40 PolarHBondContact O-N 3.41Å; Q37-E41 PolarHBondContact O-N 3.2Å
38	E	63.9	Low	61.6	Low	130 Å²	130	121.2 Å²	121.2	61%	0.607	57%	0.571	S	S	*	*	H	α-helix	trans	-65.1	-40.5	-179.9	-167.4	168.5	-142.2	0	0	112.4	S34 Q40 E41 T42	S34-E38 WeakPolarHBondContact O-CB 3.35Å; S34-E38 PolarHBondContact O-N 3.31Å; E38-Q40 PolarHBondContact O-N 3.2Å; E38-E41 PolarHBondContact O-N 3.12Å; E38-T42 WeakPolarHBondContact O-CG2 3.46Å; E38-T42 PolarHBondContact O-N 2.94Å; E38-T42 PolarHBondContact O-OG1 3Å
39	N	61.9	Low	59.7	Low	109 Å²	109	120.2 Å²	120.2	58%	0.583	58%	0.577	S	S	*	*	H	α-helix	trans	-67.7	-14	169.7	-83.3	-26.5	0	0	0	114.1	R35 T42 K43	R35-N39 VanDerWaalsContact O-CB 3.31Å; R35-N39 WeakPolarHBondContact O-CB 3.48Å; R35-N39 PolarHBondContact O-N 3.42Å; R35-N39 PolarHBondContact O-ND2 3.39Å; N39-T42 WeakPolarHBondContact CA-OG1 3.48Å; N39-T42 PolarHBondContact O-OG1 2.98Å; N39-K43 WeakPolarHBondContact O-CG 3.33Å
40	Q	60.2	Low	57.7	Low	136 Å²	136	120 Å²	120	64%	0.636	59%	0.586	S	S	*	*	H	α-helix	trans	-95.8	-37.7	177.1	-158.3	161.4	12.8	0	0	111.2	K36 Q37 E38 K43 T44	K36-Q40 WeakPolarHBondContact O-CB 3.26Å; K36-Q40 PolarHBondContact O-N 3.49Å; Q37-Q40 CarbonylContact O-C 3.49Å; Q37-Q40 WeakPolarHBondContact O-CA 3.13Å; Q37-Q40 WeakPolarHBondContact O-CB 3.32Å; Q37-Q40 PolarHBondContact O-N 3.41Å; E38-Q40 PolarHBondContact O-N 3.2Å; Q40-K43 PolarHBondContact O-N 3.46Å; Q40-T44 PolarHBondContact O-N 2.97Å; Q40-T44 VanDerWaalsContact O-N 3.09Å; Q40-T44 PolarHBondContact O-OG1 2.71Å
41	E	55.4	Low	55.9	Low	110 Å²	110	122.7 Å²	122.7	51%	0.514	60%	0.603	S	S	.	*	H	α-helix	trans	-65.7	-39.8	170	-80.9	-154.1	-173.1	0	0	113.4	Q37 E38 K43 T44 K45	Q37-E41 PolarHBondContact O-N 3.2Å; E38-E41 PolarHBondContact O-N 3.12Å; E41-K43 VanDerWaalsContact C-N 3.34Å; E41-T44 WeakPolarHBondContact CA-OG1 3.48Å; E41-T44 PolarHBondContact O-N 3.41Å; E41-T44 PolarHBondContact O-OG1 3.45Å; E41-T44 VanDerWaalsContact O-OG1 3.04Å; E41-K45 WeakPolarHBondContact O-CB 3.43Å; E41-K45 WeakPolarHBondContact O-CG 3.49Å; E41-K45 PolarHBondContact O-N 2.91Å; E41-K45 IonicContact OE2-NZ 3.49Å; E41-K45 PolarHBondContact OE2-NZ 3.47Å
42	T	55.2	Low	54	Low	64 Å²	64	121.6 Å²	121.6	39%	0.393	61%	0.608	S	S	.	*	H	α-helix	trans	-63.4	-42.9	175	44.2	0	0	0	0	110.8	E38 N39 T44 K45 I46	E38-T42 WeakPolarHBondContact O-CG2 3.46Å; E38-T42 PolarHBondContact O-N 2.94Å; E38-T42 PolarHBondContact O-OG1 3Å; N39-T42 WeakPolarHBondContact CA-OG1 3.48Å; N39-T42 PolarHBondContact O-OG1 2.98Å; T42-T44 VanDerWaalsContact C-N 3.32Å; T42-T44 PolarHBondContact O-N 3.2Å; T42-K45 PolarHBondContact O-N 3.03Å; T42-I46 WeakPolarHBondContact O-CB 3.38Å; T42-I46 WeakPolarHBondContact O-CD1 3.4Å; T42-I46 VanDerWaalsContact O-CG1 3.23Å; T42-I46 WeakPolarHBondContact O-CG1 3.27Å; T42-I46 PolarHBondContact O-N 3.12Å
43	K	53	Low	52	Low	160 Å²	160	125 Å²	125	70%	0.696	62%	0.621	S	S	*	*	H	α-helix	trans	-67.1	-23.8	175.7	-75.8	-175	176.4	-173.5	0	114.6	N39 Q40 E41	N39-K43 WeakPolarHBondContact O-CG 3.33Å; Q40-K43 PolarHBondContact O-N 3.46Å; E41-K43 VanDerWaalsContact C-N 3.34Å
44	T	51.3	Low	50.3	Low	79 Å²	79	132.6 Å²	132.6	49%	0.485	65%	0.646	S	S	.	*	H	α-helix	trans	-85.8	-40	171.1	53.8	0	0	0	0	112.6	Q40 E41 T42 I46 K47 H48	Q40-T44 PolarHBondContact O-N 2.97Å; Q40-T44 VanDerWaalsContact O-N 3.09Å; Q40-T44 PolarHBondContact O-OG1 2.71Å; E41-T44 WeakPolarHBondContact CA-OG1 3.48Å; E41-T44 PolarHBondContact O-N 3.41Å; E41-T44 PolarHBondContact O-OG1 3.45Å; E41-T44 VanDerWaalsContact O-OG1 3.04Å; T42-T44 VanDerWaalsContact C-N 3.32Å; T42-T44 PolarHBondContact O-N 3.2Å; T44-I46 VanDerWaalsContact C-N 3.34Å; T44-I46 PolarHBondContact O-N 2.89Å; T44-K47 PolarHBondContact O-N 3.36Å; T44-H48 PolarHBondContact O-N 3.24Å
45	K	45.3	Very low	48.9	Very low	127 Å²	127	134.5 Å²	134.5	55%	0.552	66%	0.656	S	S	*	*	H	α-helix	trans	-61.9	-38	176.4	-77.1	166	175.4	161.4	0	112.6	E41 T42 K47 H48 S49	E41-K45 WeakPolarHBondContact O-CB 3.43Å; E41-K45 WeakPolarHBondContact O-CG 3.49Å; E41-K45 PolarHBondContact O-N 2.91Å; E41-K45 IonicContact OE2-NZ 3.49Å; E41-K45 PolarHBondContact OE2-NZ 3.47Å; T42-K45 PolarHBondContact O-N 3.03Å; K45-K47 PolarHBondContact O-N 2.88Å; K45-H48 PolarHBondContact O-N 2.95Å; K45-S49 PolarHBondContact O-OG 3.49Å
46	I	48.9	Very low	47.2	Very low	135 Å²	135	132 Å²	132	69%	0.692	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-19.7	174.3	-69.6	166.9	0	0	0	112.5	T42 T44	T42-I46 WeakPolarHBondContact O-CB 3.38Å; T42-I46 WeakPolarHBondContact O-CD1 3.4Å; T42-I46 VanDerWaalsContact O-CG1 3.23Å; T42-I46 WeakPolarHBondContact O-CG1 3.27Å; T42-I46 PolarHBondContact O-N 3.12Å; T44-I46 VanDerWaalsContact C-N 3.34Å; T44-I46 PolarHBondContact O-N 2.89Å
47	K	41.6	Very low	45.5	Very low	185 Å²	185	131.9 Å²	131.9	80%	0.804	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-7.3	176.3	-94.4	-169.2	170.3	-169.7	0	115.5	T44 K45	T44-K47 PolarHBondContact O-N 3.36Å; K45-K47 PolarHBondContact O-N 2.88Å
48	H	42.4	Very low	43.9	Very low	173 Å²	173	132.8 Å²	132.8	80%	0.801	68%	0.68	S	S	*	*	S	Bend	trans	-123.1	11.8	-173	-86.9	-81.8	0	0	0	115.1	T44 K45	T44-H48 PolarHBondContact O-N 3.24Å; K45-H48 PolarHBondContact O-N 2.95Å
49	S	37.5	Very low	42.3	Very low	90 Å²	90	129.9 Å²	129.9	63%	0.629	69%	0.685	S	S	*	*			trans	-119.4	50.5	-172.1	43.7	0	0	0	0	114.1	K45	K45-S49 PolarHBondContact O-OG 3.49Å
50	N	34	Very low	40.8	Very low	156 Å²	156	132.3 Å²	132.3	83%	0.834	70%	0.696	S	S	*	*			trans	-131.3	88.9	172.3	-101.1	-24.7	0	0	0	111.2
51	I	36.8	Very low	39.3	Very low	162 Å²	162	135.1 Å²	135.1	83%	0.831	71%	0.707	S	S	*	*	S	Bend	trans	178.6	137.4	155.1	-98.1	153.2	0	0	0	109.4
52	S	32.6	Very low	38.2	Very low	95 Å²	95	135.8 Å²	135.8	66%	0.664	72%	0.72	S	S	*	*			trans	30.1	118.8	169.6	59	0	0	0	0	120.2
53	K	33.1	Very low	36.9	Very low	178 Å²	178	137.4 Å²	137.4	77%	0.774	74%	0.74	S	S	*	*				56.3	135.7	60.9	-57.6	-171.3	177	-178.1	0	114.2
54	Y	34.8	Very low	35.7	Very low	212 Å²	212	141.8 Å²	141.8	83%	0.831	75%	0.752	S	S	*	*			cis	-163.6	-177.8	-15.8	-106.3	-34.6	0	0	0	109.5
55	P	38.8	Very low	34.6	Very low	104 Å²	104	143.1 Å²	143.1	68%	0.675	77%	0.765	S	S	*	*			trans	-122.3	-174.3	-153.7	44.8	-31.7	0	0	0	116
56	C	31.2	Very low	33.9	Very low	105 Å²	105	142.6 Å²	142.6	71%	0.709	78%	0.778	S	S	*	*				172.5	132.5	123.4	-101.2	0	0	0	0	117.6
57	T	32.4	Very low	33	Very low	128 Å²	128	141.7 Å²	141.7	79%	0.785	78%	0.783	S	S	*	*			trans	56.9	166.2	143.9	58.5	0	0	0	0	120.9
58	L	30.8	Very low	32.4	Very low	151 Å²	151	136.8 Å²	136.8	79%	0.791	79%	0.785	S	S	*	*			cis	-156	141.4	13.5	-160.7	128.1	0	0	0	114
59	G	30.2	Very low	31.8	Very low	68 Å²	68	134.4 Å²	134.4	70%	0.701	79%	0.788	S	S	*	*			trans	68.7	169.3	156.5	0	0	0	0	0	120.1
60	I	31.4	Very low	31.4	Very low	160 Å²	160	135.6 Å²	135.6	82%	0.821	80%	0.796	S	S	*	*			cis	-154.7	150.5	-15.7	-101.8	157.1	0	0	0	108.4
61	F	29	Very low	31.2	Very low	195 Å²	195	132 Å²	132	86%	0.855	80%	0.797	S	S	*	*			trans	-98	153.1	173.4	-106	-83.1	0	0	0	111
62	P	32.6	Very low	30.7	Very low	124 Å²	124	128.1 Å²	128.1	81%	0.805	80%	0.797	S	S	*	*				-151.9	171.1	98	39.5	-22.3	0	0	0	116.2
63	A	28	Very low	30.6	Very low	98 Å²	98	131.8 Å²	131.8	81%	0.81	81%	0.808	S	S	*	*			trans	-117.7	154.7	163.2	0	0	0	0	0	110.1
64	R	27.6	Very low	30.5	Very low	252 Å²	252	129.6 Å²	129.6	95%	0.951	81%	0.809	S	S	*	*			trans	-142.4	146.5	171.9	-164.8	170.8	-175.9	178.8	2.2	112.5
65	S	28.4	Very low	30.1	Very low	107 Å²	107	123 Å²	123	75%	0.748	81%	0.806	S	S	*	*			trans	-114	143.6	-172.2	55.8	0	0	0	0	113.7
66	S	30.8	Very low	29.8	Very low	117 Å²	117	123.9 Å²	123.9	82%	0.818	81%	0.809	S	S	*	*			trans	-171.1	154.5	162	49.5	0	0	0	0	110.5
67	S	29.9	Very low	29.6	Very low	115 Å²	115	126.9 Å²	126.9	80%	0.804	82%	0.818	S	S	*	*			cis	-176.1	144.1	-24.3	51.6	0	0	0	0	109.9
68	G	28.2	Very low	29.6	Very low	83 Å²	83	129.5 Å²	129.5	86%	0.856	82%	0.822	S	S	*	*			trans	79.2	160.8	169.5	0	0	0	0	0	115.4
69	S	29.7	Very low	29.8	Very low	122 Å²	122	128 Å²	128	85%	0.853	82%	0.82	S	S	*	*			cis	-145.4	161.3	14.2	-168.8	0	0	0	0	113.2
70	S	29.1	Very low	30.1	Very low	115 Å²	115	129.7 Å²	129.7	80%	0.804	82%	0.822	S	S	*	*			trans	-78.1	153.9	-179.2	53.3	0	0	0	0	115
71	G	28.8	Very low	30.2	Very low	82 Å²	82	127.9 Å²	127.9	85%	0.845	82%	0.82	S	S	*	*			trans	133.2	130.8	134.6	0	0	0	0	0	118.9
72	G	28.4	Very low	30.6	Very low	80 Å²	80	127.8 Å²	127.8	83%	0.825	82%	0.82	S	S	*	*			trans	112.6	96.7	147.1	0	0	0	0	0	117.7
73	L	28.5	Very low	30.5	Very low	171 Å²	171	129.4 Å²	129.4	90%	0.895	82%	0.817	S	S	*	*			trans	-66.8	140.3	155	-87	69.1	0	0	0	110.2
74	V	31.1	Very low	30.8	Very low	133 Å²	133	133.9 Å²	133.9	81%	0.806	82%	0.82	S	S	*	*			trans	-145.4	126.3	130.9	176.3	0	0	0	0	107.1	T76	V74-T76 HydrophobicContact CG1-CG2 4.34Å
75	G	27.7	Very low	31.1	Very low	74 Å²	74	130 Å²	130	76%	0.763	82%	0.817	S	S	*	*			trans	-94.2	140.7	169.4	0	0	0	0	0	111
76	T	31.9	Very low	31.6	Very low	121 Å²	121	132.5 Å²	132.5	74%	0.742	82%	0.821	S	S	*	*			trans	-132.4	117.3	170	55.1	0	0	0	0	110.4	V74	V74-T76 HydrophobicContact CG1-CG2 4.34Å
77	N	27.8	Very low	31.8	Very low	168 Å²	168	133.2 Å²	133.2	90%	0.898	83%	0.826	S	S	*	*			trans	-66.2	133.7	167	-64.6	-35.3	0	0	0	109.6
78	Q	32.5	Very low	32	Very low	184 Å²	184	130.7 Å²	130.7	86%	0.86	82%	0.818	S	S	*	*			trans	-141.2	138.6	151.9	-93.1	-157	-24.5	0	0	110.6
79	P	34.1	Very low	32.4	Very low	118 Å²	118	129.7 Å²	129.7	77%	0.766	81%	0.808	S	S	*	*			trans	-80.7	153.8	174.2	34.2	-34.6	0	0	0	111.5
80	S	36.2	Very low	33	Very low	105 Å²	105	130.5 Å²	130.5	73%	0.734	81%	0.807	S	S	*	*			trans	-71.5	123.1	173.9	51.8	0	0	0	0	111.8	F82	S80-F82 PolarHBondContact O-N 3.47Å; S80-F82 VanDerWaalsContact O-N 3.14Å
81	P	34.2	Very low	33.8	Very low	121 Å²	121	132.1 Å²	132.1	79%	0.786	81%	0.806	S	S	*	*			trans	-84.4	88.6	-177.4	33.2	-34.5	0	0	0	112.1
82	F	36.7	Very low	34.4	Very low	193 Å²	193	130.3 Å²	130.3	85%	0.846	79%	0.787	S	S	*	*			trans	-135.1	31	172.6	-91.5	-70.5	0	0	0	113.5	S80	S80-F82 PolarHBondContact O-N 3.47Å; S80-F82 VanDerWaalsContact O-N 3.14Å
83	H	31.3	Very low	34.8	Very low	159 Å²	159	129.6 Å²	129.6	74%	0.736	77%	0.773	S	S	*	*			trans	-132	66.4	-176.1	-120.1	-91.1	0	0	0	112
84	H	33.1	Very low	35.7	Very low	191 Å²	191	125.8 Å²	125.8	88%	0.884	76%	0.757	S	S	*	*			trans	-162.7	47.8	168.4	-117.5	-71.2	0	0	0	114.9
85	L	33.9	Very low	36.4	Very low	170 Å²	170	124.3 Å²	124.3	89%	0.89	75%	0.749	S	S	*	*			trans	-150.7	39.7	172.7	-141	120.6	0	0	0	116.6
86	I	40.3	Very low	37.1	Very low	160 Å²	160	125.9 Å²	125.9	82%	0.821	74%	0.739	S	S	*	*			trans	-129.9	92	162.6	-57.1	-178.5	0	0	0	108.4
87	S	33.7	Very low	37.9	Very low	133 Å²	133	124.6 Å²	124.6	93%	0.93	73%	0.731	S	S	*	*			trans	-102.5	77.7	174	177.2	0	0	0	0	109.5
88	G	34.5	Very low	38.7	Very low	61 Å²	61	122.3 Å²	122.3	63%	0.629	72%	0.718	S	S	*	*			trans	159.8	136.4	178.9	0	0	0	0	0	111.8
89	G	37.4	Very low	39.1	Very low	63 Å²	63	117.2 Å²	117.2	65%	0.649	71%	0.708	S	S	*	*			trans	104.9	77.6	177.7	0	0	0	0	0	114.9	L91 G92	G89-L91 PolarHBondContact O-N 3.49Å; G89-G92 PolarHBondContact O-N 2.88Å; G89-G92 VanDerWaalsContact O-N 3.14Å
90	V	41.4	Very low	39.6	Very low	139 Å²	139	115.6 Å²	115.6	84%	0.842	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-17.3	-173.6	174.7	0	0	0	0	114.5
91	L	46.8	Very low	39.7	Very low	149 Å²	149	118.4 Å²	118.4	78%	0.78	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-15.2	177.7	-77.8	82.5	0	0	0	114.8	G89 A93	G89-L91 PolarHBondContact O-N 3.49Å; L91-A93 VanDerWaalsContact C-N 3.34Å; L91-A93 PolarHBondContact O-N 2.94Å
92	G	40.2	Very low	40.1	Very low	43 Å²	43	118.3 Å²	118.3	44%	0.443	70%	0.696	S	S	.	*	H	α-helix	trans	-67.7	-30.8	-174.5	0	0	0	0	0	114.3	G89 T94 V95 L96	G89-G92 PolarHBondContact O-N 2.88Å; G89-G92 VanDerWaalsContact O-N 3.14Å; G92-T94 PolarHBondContact O-N 3.41Å; G92-V95 PolarHBondContact O-N 3.38Å; G92-L96 PolarHBondContact O-N 2.94Å
93	A	38.4	Very low	40.3	Very low	65 Å²	65	115.2 Å²	115.2	54%	0.537	69%	0.688	S	S	.	*	H	α-helix	trans	-62.6	-39.1	-175.2	0	0	0	0	0	113.4	L91 V95 L96 T97	L91-A93 VanDerWaalsContact C-N 3.34Å; L91-A93 PolarHBondContact O-N 2.94Å; A93-V95 VanDerWaalsContact C-N 3.34Å; A93-V95 PolarHBondContact O-N 2.96Å; A93-L96 PolarHBondContact O-N 3.46Å; A93-T97 WeakPolarHBondContact O-CB 3.47Å; A93-T97 PolarHBondContact O-N 3.34Å; A93-T97 PolarHBondContact O-OG1 3.43Å
94	T	45.5	Very low	40.7	Very low	91 Å²	91	117.5 Å²	117.5	56%	0.558	69%	0.691	S	S	*	*	H	α-helix	trans	-64.1	-38.3	-177.1	-48.9	0	0	0	0	112	G92 T97 L98	G92-T94 PolarHBondContact O-N 3.41Å; T94-T97 PolarHBondContact O-N 3.46Å; T94-L98 HydrophobicContact CG2-CD1 4.37Å; T94-L98 WeakPolarHBondContact O-CG 3.26Å; T94-L98 PolarHBondContact O-N 2.67Å
95	V	46.8	Very low	41.1	Very low	103 Å²	103	111.8 Å²	111.8	62%	0.624	67%	0.672	S	S	*	*	H	α-helix	trans	-70.5	-41.7	179.6	-177.5	0	0	0	0	111.1	G92 A93 L98 A99	G92-V95 PolarHBondContact O-N 3.38Å; A93-V95 VanDerWaalsContact C-N 3.34Å; A93-V95 PolarHBondContact O-N 2.96Å; V95-L98 PolarHBondContact O-N 2.92Å; V95-A99 WeakPolarHBondContact O-CB 3.48Å; V95-A99 PolarHBondContact O-N 2.85Å
96	L	43.3	Very low	41.6	Very low	107 Å²	107	105.8 Å²	105.8	56%	0.56	65%	0.647	S	S	*	*	H	α-helix	trans	-66.3	-36	172.7	-94.4	81.6	0	0	0	112.4	G92 A93 L98 A99 A100	G92-L96 PolarHBondContact O-N 2.94Å; A93-L96 PolarHBondContact O-N 3.46Å; L96-L98 VanDerWaalsContact C-N 3.31Å; L96-L98 PolarHBondContact O-N 3.3Å; L96-A99 PolarHBondContact O-N 2.99Å; L96-A100 VanDerWaalsContact O-CB 3.3Å; L96-A100 WeakPolarHBondContact O-CB 3.42Å; L96-A100 PolarHBondContact O-N 3.29Å
97	T	48.1	Very low	41.7	Very low	94 Å²	94	106 Å²	106	58%	0.577	64%	0.642	S	S	*	*	H	α-helix	trans	-70.2	-28.8	178.3	-58	0	0	0	0	112.1	A93 T94 K101	A93-T97 WeakPolarHBondContact O-CB 3.47Å; A93-T97 PolarHBondContact O-N 3.34Å; A93-T97 PolarHBondContact O-OG1 3.43Å; T94-T97 PolarHBondContact O-N 3.46Å; T97-K101 WeakPolarHBondContact O-CB 3.45Å
98	L	43.4	Very low	42.2	Very low	119 Å²	119	105.8 Å²	105.8	62%	0.623	63%	0.626	S	S	*	*	H	α-helix	trans	-74.6	-43.1	169.3	-72.4	168.6	0	0	0	112	T94 V95 L96 A100 K101	T94-L98 HydrophobicContact CG2-CD1 4.37Å; T94-L98 WeakPolarHBondContact O-CG 3.26Å; T94-L98 PolarHBondContact O-N 2.67Å; V95-L98 PolarHBondContact O-N 2.92Å; L96-L98 VanDerWaalsContact C-N 3.31Å; L96-L98 PolarHBondContact O-N 3.3Å; L98-A100 VanDerWaalsContact C-N 3.29Å; L98-A100 PolarHBondContact O-N 3.44Å; L98-K101 PolarHBondContact O-N 3.37Å
99	A	41.9	Very low	42.7	Very low	78 Å²	78	108 Å²	108	65%	0.645	62%	0.623	S	S	*	*	H	α-helix	trans	-61.8	-34.9	175.6	0	0	0	0	0	112.9	V95 L96 K101	V95-A99 WeakPolarHBondContact O-CB 3.48Å; V95-A99 PolarHBondContact O-N 2.85Å; L96-A99 PolarHBondContact O-N 2.99Å; A99-K101 PolarHBondContact O-N 2.91Å
100	A	44.2	Very low	43	Very low	84 Å²	84	113.7 Å²	113.7	69%	0.694	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-7.6	175.2	0	0	0	0	0	114.1	L96 L98	L96-A100 VanDerWaalsContact O-CB 3.3Å; L96-A100 WeakPolarHBondContact O-CB 3.42Å; L96-A100 PolarHBondContact O-N 3.29Å; L98-A100 VanDerWaalsContact C-N 3.29Å; L98-A100 PolarHBondContact O-N 3.44Å
101	K	39	Very low	43.2	Very low	163 Å²	163	111.4 Å²	111.4	71%	0.709	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-7.3	-173	-158.8	163.7	-175.4	174.1	0	114.4	T97 L98 A99 N103	T97-K101 WeakPolarHBondContact O-CB 3.45Å; L98-K101 PolarHBondContact O-N 3.37Å; A99-K101 PolarHBondContact O-N 2.91Å; K101-N103 PolarHBondContact O-N 3.34Å
102	D	41.3	Very low	43.2	Very low	119 Å²	119	108.7 Å²	108.7	64%	0.636	59%	0.59	S	S	*	*			trans	-84.4	48.4	-178.4	-156.4	4.1	0	0	0	114.2	R104	D102-R104 PolarHBondContact O-N 2.89Å
103	N	42.1	Very low	43.4	Very low	128 Å²	128	113.5 Å²	113.5	68%	0.684	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	19.8	177.2	-148.2	-9.2	0	0	0	112.4	K101	K101-N103 PolarHBondContact O-N 3.34Å
104	R	39.6	Very low	43.5	Very low	208 Å²	208	116.3 Å²	116.3	79%	0.785	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-35.6	-179.4	-72.5	-171.5	176.9	-142.9	-0.8	112.6	D102 A106 K107	D102-R104 PolarHBondContact O-N 2.89Å; R104-A106 PolarHBondContact O-N 2.87Å; R104-K107 PolarHBondContact O-N 3.27Å; R104-K107 VanDerWaalsContact O-N 3.07Å
105	S	42.1	Very low	43.3	Very low	71 Å²	71	119.8 Å²	119.8	50%	0.497	61%	0.611	S	S	.	*	H	α-helix	trans	-59.7	-29.1	177.5	-171.4	0	0	0	0	113	K107 E108 L109	S105-K107 PolarHBondContact O-N 2.88Å; S105-E108 PolarHBondContact O-N 2.91Å; S105-L109 PolarHBondContact O-N 3.26Å
106	A	44.6	Very low	42.9	Very low	43 Å²	43	123.1 Å²	123.1	36%	0.355	62%	0.619	S	S	.	*	H	α-helix	trans	-69.4	-11	177.3	0	0	0	0	0	114.9	R104 R110	R104-A106 PolarHBondContact O-N 2.87Å; A106-R110 WeakPolarHBondContact O-CD 3.36Å; A106-R110 WeakPolarHBondContact O-CG 3.48Å
107	K	41.5	Very low	42.4	Very low	166 Å²	166	126.3 Å²	126.3	72%	0.722	63%	0.631	S	S	*	*	H	α-helix	trans	-90.7	-47	166.6	-92.5	-172.1	170.9	-174.2	0	111.8	R104 S105 L109 R110 E111	R104-K107 PolarHBondContact O-N 3.27Å; R104-K107 VanDerWaalsContact O-N 3.07Å; S105-K107 PolarHBondContact O-N 2.88Å; K107-L109 VanDerWaalsContact C-N 3.33Å; K107-L109 PolarHBondContact O-N 2.87Å; K107-R110 CarbonylContact O-C 3.37Å; K107-R110 WeakPolarHBondContact O-CA 3.41Å; K107-R110 WeakPolarHBondContact O-CB 3.37Å; K107-R110 PolarHBondContact O-N 3.29Å; K107-E111 PolarHBondContact O-N 2.98Å
108	E	43.4	Very low	41.6	Very low	127 Å²	127	126.4 Å²	126.4	59%	0.593	64%	0.636	S	S	*	*	H	α-helix	trans	-53.8	-47.9	176	-74.1	-70.3	114.3	0	0	112	S105 R110 E111 I112	S105-E108 PolarHBondContact O-N 2.91Å; E108-R110 PolarHBondContact O-N 3.41Å; E108-E111 PolarHBondContact O-N 3.26Å; E108-E111 VanDerWaalsContact O-N 3.09Å; E108-I112 WeakPolarHBondContact O-CG1 3.38Å; E108-I112 PolarHBondContact O-N 2.85Å
109	L	44.9	Very low	41.2	Very low	108 Å²	108	127.5 Å²	127.5	57%	0.565	65%	0.648	S	S	*	*	H	α-helix	trans	-61.1	-27.1	176	-89.9	158.3	0	0	0	113.6	S105 K107 Q113	S105-L109 PolarHBondContact O-N 3.26Å; K107-L109 VanDerWaalsContact C-N 3.33Å; K107-L109 PolarHBondContact O-N 2.87Å; L109-Q113 VanDerWaalsContact O-CB 3.25Å; L109-Q113 WeakPolarHBondContact O-CB 3.46Å; L109-Q113 PolarHBondContact O-N 2.99Å
110	R	43.8	Very low	40.6	Very low	183 Å²	183	128.5 Å²	128.5	69%	0.691	66%	0.656	S	S	*	*	H	α-helix	trans	-84.2	-21.4	175.8	-72	-179.8	176.2	178.4	0.1	113.5	A106 K107 E108 K114	A106-R110 WeakPolarHBondContact O-CD 3.36Å; A106-R110 WeakPolarHBondContact O-CG 3.48Å; K107-R110 CarbonylContact O-C 3.37Å; K107-R110 WeakPolarHBondContact O-CA 3.41Å; K107-R110 WeakPolarHBondContact O-CB 3.37Å; K107-R110 PolarHBondContact O-N 3.29Å; E108-R110 PolarHBondContact O-N 3.41Å; R110-K114 VanDerWaalsContact O-CG 3.29Å; R110-K114 WeakPolarHBondContact O-CG 3.43Å; R110-K114 PolarHBondContact O-N 3.43Å
111	E	46.7	Very low	40.1	Very low	90 Å²	90	130.2 Å²	130.2	42%	0.421	66%	0.66	S	S	.	*	H	α-helix	trans	-82.9	-41.5	170	-64.8	-53.6	127.4	0	0	111.4	K107 E108 Q113 K114 H115	K107-E111 PolarHBondContact O-N 2.98Å; E108-E111 PolarHBondContact O-N 3.26Å; E108-E111 VanDerWaalsContact O-N 3.09Å; E111-Q113 VanDerWaalsContact C-N 3.28Å; E111-Q113 PolarHBondContact O-N 3.45Å; E111-K114 WeakPolarHBondContact O-CA 3.4Å; E111-K114 WeakPolarHBondContact O-CB 3.26Å; E111-K114 PolarHBondContact O-N 2.97Å; E111-K114 IonicContact OE1-NZ 3.54Å; E111-K114 PolarHBondContact OE1-NZ 2.9Å; E111-K114 IonicContact OE2-NZ 3.13Å; E111-K114 PolarHBondContact OE2-NZ 2.88Å; E111-H115 PolarHBondContact O-N 3.38Å
112	I	47	Very low	39.6	Very low	93 Å²	93	130.8 Å²	130.8	48%	0.477	67%	0.666	S	S	.	*	H	α-helix	trans	-59.1	-41.2	173.7	-66.7	167.8	0	0	0	110.7	E108 K114 H115 Q116	E108-I112 WeakPolarHBondContact O-CG1 3.38Å; E108-I112 PolarHBondContact O-N 2.85Å; I112-K114 VanDerWaalsContact C-N 3.3Å; I112-K114 PolarHBondContact O-N 2.78Å; I112-H115 PolarHBondContact O-N 3.49Å; I112-Q116 PolarHBondContact O-N 2.94Å
113	Q	44.4	Very low	39.2	Very low	143 Å²	143	132.8 Å²	132.8	67%	0.668	68%	0.675	S	S	*	*	H	α-helix	trans	-72.1	-18.5	176.7	-162.7	167.4	9	0	0	113.6	L109 E111	L109-Q113 VanDerWaalsContact O-CB 3.25Å; L109-Q113 WeakPolarHBondContact O-CB 3.46Å; L109-Q113 PolarHBondContact O-N 2.99Å; E111-Q113 VanDerWaalsContact C-N 3.28Å; E111-Q113 PolarHBondContact O-N 3.45Å
114	K	40.2	Very low	38.9	Very low	125 Å²	125	134.3 Å²	134.3	54%	0.543	68%	0.678	S	S	.	*	H	α-helix	trans	-79.9	-35.9	166.6	-73.4	167.4	-178.8	175.9	0	112.5	R110 E111 I112 Q117	R110-K114 VanDerWaalsContact O-CG 3.29Å; R110-K114 WeakPolarHBondContact O-CG 3.43Å; R110-K114 PolarHBondContact O-N 3.43Å; E111-K114 WeakPolarHBondContact O-CA 3.4Å; E111-K114 WeakPolarHBondContact O-CB 3.26Å; E111-K114 PolarHBondContact O-N 2.97Å; E111-K114 IonicContact OE1-NZ 3.54Å; E111-K114 PolarHBondContact OE1-NZ 2.9Å; E111-K114 IonicContact OE2-NZ 3.13Å; E111-K114 PolarHBondContact OE2-NZ 2.88Å; I112-K114 VanDerWaalsContact C-N 3.3Å; I112-K114 PolarHBondContact O-N 2.78Å; K114-Q117 PolarHBondContact O-N 3.46Å
115	H	40.1	Very low	38.6	Very low	164 Å²	164	133.3 Å²	133.3	76%	0.759	68%	0.68	S	S	*	*	H	α-helix	trans	-80.6	-12.1	-176.6	-88.1	14.7	0	0	0	114.9	E111 I112	E111-H115 PolarHBondContact O-N 3.38Å; I112-H115 PolarHBondContact O-N 3.49Å
116	Q	38.8	Very low	38.3	Very low	172 Å²	172	136.1 Å²	136.1	80%	0.804	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-1.9	168.1	-79.9	-171.5	-31.8	0	0	114.6	I112	I112-Q116 PolarHBondContact O-N 2.94Å
117	Q	33.2	Very low	38.2	Very low	174 Å²	174	138.7 Å²	138.7	81%	0.813	70%	0.7	S	S	*	*	S	Bend	trans	-106	42.3	-176.9	-156.6	161	10.4	0	0	113.1	K114	K114-Q117 PolarHBondContact O-N 3.46Å
118	S	31.6	Very low	38.2	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	69%	0.694	S	S	*	*			trans	-150.9	43.4	-176.3	-170.6	0	0	0	0	116.4
119	T	35.2	Very low	38	Very low	142 Å²	142	133.5 Å²	133.5	87%	0.871	69%	0.689	S	S	*	*	S	Bend	trans	-154.4	72	164.4	21	0	0	0	0	113.4
120	A	29.8	Very low	37.7	Very low	100 Å²	100	135.2 Å²	135.2	83%	0.826	69%	0.694	S	S	*	*			trans	-169.7	77.6	159.8	0	0	0	0	0	112
121	P	32.5	Very low	37.5	Very low	119 Å²	119	130.7 Å²	130.7	77%	0.773	69%	0.687	S	S	*	*			trans	-82	-179.8	170.9	35.7	-35	0	0	0	112.2
122	Q	29.7	Very low	37	Very low	176 Å²	176	134.7 Å²	134.7	82%	0.822	70%	0.703	S	S	*	*	S	Bend	trans	83.9	63.3	175.9	-55.2	-71.4	18.8	0	0	117.9
123	L	32.7	Very low	36.6	Very low	160 Å²	160	137.1 Å²	137.1	84%	0.838	71%	0.712	S	S	*	*	S	Bend	trans	-159.2	-31.3	139	-145	67	0	0	0	114.1	K125	L123-K125 PolarHBondContact O-N 3.17Å
124	E	34.1	Very low	36.3	Very low	160 Å²	160	138.8 Å²	138.8	75%	0.748	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	12.9	-163.3	-147.7	178.1	164.5	0	0	116.1
125	K	34.8	Very low	36	Very low	187 Å²	187	138.4 Å²	138.4	81%	0.813	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-20.3	-175.7	-76.1	-166.4	172.9	-172.7	0	116.1	L123	L123-K125 PolarHBondContact O-N 3.17Å
126	N	35.1	Very low	35.7	Very low	130 Å²	130	137.7 Å²	137.7	70%	0.695	73%	0.725	S	S	*	*	S	Bend	trans	-84.6	-35.8	-178.7	-67.9	11.3	0	0	0	112	I128 S129	N126-I128 PolarHBondContact O-N 2.69Å; N126-S129 PolarHBondContact O-N 2.69Å
127	T	42.2	Very low	35.5	Very low	97 Å²	97	134.6 Å²	134.6	60%	0.595	72%	0.722	S	S	*	*	H	α-helix	trans	-66.3	-22	-176.3	-28.6	0	0	0	0	114.1	V131	T127-V131 WeakPolarHBondContact O-CG2 3.31Å
128	I	41.9	Very low	35.5	Very low	113 Å²	113	135.9 Å²	135.9	58%	0.579	73%	0.728	S	S	*	*	H	α-helix	trans	-96	-16	-174.2	-62.9	177.3	0	0	0	112.2	N126	N126-I128 PolarHBondContact O-N 2.69Å
129	S	38.6	Very low	35.4	Very low	71 Å²	71	140.2 Å²	140.2	50%	0.497	74%	0.738	S	S	.	*	H	α-helix	trans	-79.5	-51	175	-147.5	0	0	0	0	111.6	N126 V131 K132 E133	N126-S129 PolarHBondContact O-N 2.69Å; S129-V131 VanDerWaalsContact C-N 3.31Å; S129-V131 PolarHBondContact O-N 2.91Å; S129-K132 PolarHBondContact O-N 3.39Å; S129-E133 PolarHBondContact O-N 2.97Å
130	Q	39.2	Very low	35.2	Very low	145 Å²	145	141.5 Å²	141.5	68%	0.678	74%	0.739	S	S	*	*	H	α-helix	trans	-59.9	-36.7	-176.3	-69.3	-174.5	-47.8	0	0	113.5	K132 E133	Q130-K132 PolarHBondContact O-N 3.29Å; Q130-E133 PolarHBondContact O-N 2.96Å
131	V	40	Very low	35.2	Very low	87 Å²	87	141.7 Å²	141.7	53%	0.527	74%	0.735	S	S	.	*	H	α-helix	trans	-69.6	-16.7	179.5	179.1	0	0	0	0	112.7	T127 S129	T127-V131 WeakPolarHBondContact O-CG2 3.31Å; S129-V131 VanDerWaalsContact C-N 3.31Å; S129-V131 PolarHBondContact O-N 2.91Å
132	K	36	Very low	35.2	Very low	174 Å²	174	140.6 Å²	140.6	76%	0.757	73%	0.73	S	S	*	*	H	α-helix	trans	-102.6	-8.1	-177.4	-145.3	176.2	-176.3	-175.7	0	114.1	S129 Q130	S129-K132 PolarHBondContact O-N 3.39Å; Q130-K132 PolarHBondContact O-N 3.29Å
133	E	38.1	Very low	35.3	Very low	145 Å²	145	138.8 Å²	138.8	68%	0.678	73%	0.726	S	S	*	*	H	α-helix	trans	-104.5	-15.1	-174.5	-155.2	152.6	-149.4	0	0	112.4	S129 Q130	S129-E133 PolarHBondContact O-N 2.97Å; Q130-E133 PolarHBondContact O-N 2.96Å
134	Q	38.4	Very low	35.4	Very low	178 Å²	178	140 Å²	140	83%	0.832	72%	0.724	S	S	*	*	S	Bend	trans	-94	2	173.7	-64.5	-164.5	-60.4	0	0	114.9
135	L	34.7	Very low	35.5	Very low	117 Å²	117	137.1 Å²	137.1	61%	0.613	72%	0.72	S	S	*	*	S	Bend	trans	-117.5	18.1	-169.8	-116.6	168	0	0	0	114
136	N	33	Very low	35.2	Very low	149 Å²	149	139.4 Å²	139.4	80%	0.797	72%	0.723	S	S	*	*	S	Bend	trans	-141.9	26.5	-169.3	-125.9	47.4	0	0	0	113.4
137	S	34.3	Very low	34.9	Very low	107 Å²	107	136.7 Å²	136.7	75%	0.748	72%	0.715	S	S	*	*	S	Bend	trans	-140.4	38	-170.9	-58.8	0	0	0	0	114.2
138	E	33.1	Very low	34.3	Very low	201 Å²	201	140.2 Å²	140.2	94%	0.939	72%	0.724	S	S	*	*			trans	-152.9	46.9	174.6	-134.5	168.5	-171.3	0	0	113.4
139	E	30.5	Very low	33.7	Very low	186 Å²	186	141 Å²	141	87%	0.869	73%	0.726	S	S	*	*			trans	-141.5	84.9	172.1	-167.5	170.7	-136.4	0	0	111.4
140	N	29.6	Very low	33.5	Very low	169 Å²	169	144 Å²	144	90%	0.904	73%	0.732	S	S	*	*			trans	-167.5	148.6	162.7	-110.5	-48.3	0	0	0	113.1
141	S	30.8	Very low	33.2	Very low	105 Å²	105	143.3 Å²	143.3	73%	0.734	73%	0.732	S	S	*	*			trans	76	127.3	173.4	-149.5	0	0	0	0	119.5
142	S	31.8	Very low	33	Very low	96 Å²	96	144.6 Å²	144.6	67%	0.671	74%	0.736	S	S	*	*			trans	65.4	136.8	151.8	-64.9	0	0	0	0	120.5
143	D	33	Very low	33	Very low	138 Å²	138	144.3 Å²	144.3	74%	0.738	74%	0.735	S	S	*	*			cis	-157	172.7	-11.1	-121.6	-57.8	0	0	0	114.7
144	K	35.2	Very low	32.9	Very low	184 Å²	184	143.3 Å²	143.3	80%	0.8	74%	0.735	S	S	*	*			trans	-65.2	-177.9	-177.4	-77.5	172.9	175.2	169.6	0	116.6
145	P	36	Very low	32.7	Very low	100 Å²	100	140.7 Å²	140.7	65%	0.649	73%	0.726	S	S	*	*			cis	-139.5	-144.5	-45.8	40.9	-21.8	0	0	0	113.1
146	W	27.6	Very low	32.6	Very low	235 Å²	235	142.8 Å²	142.8	89%	0.89	73%	0.733	S	S	*	*			trans	82.7	149.5	177.8	-64.3	69.1	0	0	0	117
147	S	28.7	Very low	32.5	Very low	73 Å²	73	139.5 Å²	139.5	51%	0.51	73%	0.726	S	S	.	*				176.6	139.9	-50.9	48.3	0	0	0	0	110.5
148	Q	29.9	Very low	32.2	Very low	171 Å²	171	141.9 Å²	141.9	80%	0.799	73%	0.73	S	S	*	*			trans	64.6	161.6	167.9	-60.9	171.2	-33.1	0	0	115
149	Q	29.6	Very low	31.9	Very low	130 Å²	130	138.8 Å²	138.8	61%	0.607	72%	0.719	S	S	*	*			cis	-152.1	172	-1.7	-145.3	152.6	-86.9	0	0	112.5
150	H	33.6	Very low	31.7	Very low	135 Å²	135	135.9 Å²	135.9	63%	0.625	71%	0.709	S	S	*	*			trans	76.2	119.4	152.3	-77.5	-53.8	0	0	0	123.1
151	N	32.6	Very low	31.6	Very low	129 Å²	129	135.6 Å²	135.6	69%	0.69	70%	0.703	S	S	*	*				56.3	146.7	121.4	-63.2	2.4	0	0	0	120.7
152	N	36.2	Very low	31.6	Very low	115 Å²	115	140.4 Å²	140.4	62%	0.615	71%	0.706	S	S	*	*			cis	-156.7	157.3	17.9	-134.7	-11.7	0	0	0	112.3
153	K	35.5	Very low	31.4	Very low	167 Å²	167	143.6 Å²	143.6	73%	0.726	71%	0.71	S	S	*	*			trans	25.7	136	132.1	-74.9	178.8	-171	-176.7	0	119.2
154	N	37.1	Very low	31.3	Very low	125 Å²	125	143.8 Å²	143.8	67%	0.668	71%	0.706	S	S	*	*			cis	-166.2	173	28	-85.6	-28.4	0	0	0	107.3
155	N	34.5	Very low	31	Very low	122 Å²	122	142.7 Å²	142.7	65%	0.652	70%	0.704	S	S	*	*			cis	-158.8	143.2	-20.3	-96.3	-10.1	0	0	0	106.2
156	Q	32.2	Very low	30.6	Very low	162 Å²	162	143 Å²	143	76%	0.757	71%	0.708	S	S	*	*				54.5	97.7	86.3	-126.1	64.1	15.3	0	0	111.9
157	A	30.2	Very low	30.5	Very low	80 Å²	80	138.9 Å²	138.9	66%	0.661	70%	0.703	S	S	*	*				92.1	-175.2	56.3	0	0	0	0	0	113
158	L	29.2	Very low	30.6	Very low	157 Å²	157	140.8 Å²	140.8	82%	0.822	72%	0.715	S	S	*	*			trans	71.1	158.2	-164.3	-76.7	82.4	0	0	0	115.9
159	L	27.3	Very low	30.6	Very low	135 Å²	135	137 Å²	137	71%	0.707	71%	0.707	S	S	*	*			cis	169.7	157	-47.3	-104.1	172.2	0	0	0	108.3
160	D	25.8	Very low	30.5	Very low	125 Å²	125	137.7 Å²	137.7	67%	0.668	72%	0.715	S	S	*	*			trans	61	153.5	152.8	-58	-34.3	0	0	0	121.9
161	E	27.4	Very low	30.4	Very low	163 Å²	163	137.5 Å²	137.5	76%	0.762	72%	0.723	S	S	*	*			trans	53.4	129.1	167.7	-65.8	176	109.3	0	0	118
162	Y	30.3	Very low	30.1	Very low	206 Å²	206	135.4 Å²	135.4	81%	0.808	72%	0.724	S	S	*	*				-150.1	151.3	60.3	-113.9	-97.6	0	0	0	114.4
163	H	27.9	Very low	29.9	Very low	163 Å²	163	137.6 Å²	137.6	76%	0.755	73%	0.734	S	S	*	*			trans	-69	153.6	158.2	-79.2	-129.9	0	0	0	110.9
164	H	30.7	Very low	29.5	Very low	143 Å²	143	136.9 Å²	136.9	66%	0.662	74%	0.738	S	S	*	*				172.3	139.3	114.4	-102	-99.7	0	0	0	112.3
165	E	28.5	Very low	29.4	Very low	160 Å²	160	136.9 Å²	136.9	75%	0.748	75%	0.745	S	S	*	*			trans	35.7	154	134.2	-65.1	178.1	145.2	0	0	122.6
166	C	28.7	Very low	29.1	Very low	108 Å²	108	139.1 Å²	139.1	73%	0.73	76%	0.756	S	S	*	*			cis	-148.6	172.9	12.1	-147	0	0	0	0	114.5
167	N	25.5	Very low	29	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	76%	0.755	S	S	*	*			trans	-66.4	154.5	177.3	-70.9	-55.4	0	0	0	114.9
168	C	30.3	Very low	29	Very low	113 Å²	113	138.4 Å²	138.4	76%	0.764	76%	0.763	S	S	*	*				178.3	115	117.5	-93.7	0	0	0	0	108.5
169	S	29.1	Very low	29	Very low	91 Å²	91	139.1 Å²	139.1	64%	0.636	76%	0.762	S	S	*	*				67.4	136.2	74.6	80.1	0	0	0	0	112.8
170	N	28	Very low	29	Very low	146 Å²	146	140.3 Å²	140.3	78%	0.781	76%	0.764	S	S	*	*			cis	-159.4	178.3	-4.3	-101.5	-12.8	0	0	0	108.8
171	V	30.6	Very low	29.2	Very low	131 Å²	131	140 Å²	140	79%	0.794	77%	0.767	S	S	*	*			trans	70.2	117.2	168.4	-163	0	0	0	0	114.9
172	A	27.4	Very low	29.3	Very low	84 Å²	84	138.5 Å²	138.5	69%	0.694	76%	0.761	S	S	*	*			cis	96.8	149.4	17.8	0	0	0	0	0	116.7
173	I	31	Very low	29.6	Very low	161 Å²	161	137.3 Å²	137.3	83%	0.826	76%	0.757	S	S	*	*			trans	84.2	118	166.2	-57	174.9	0	0	0	117.4
174	D	28.4	Very low	29.9	Very low	152 Å²	152	134.7 Å²	134.7	81%	0.813	75%	0.748	S	S	*	*			trans	-64.9	155.9	162.3	-68	-66.2	0	0	0	111.5
175	P	35	Very low	30.3	Very low	126 Å²	126	135.4 Å²	135.4	82%	0.818	75%	0.751	S	S	*	*				-149.8	170.8	105.4	38.6	-22.8	0	0	0	116.7
176	L	27.4	Very low	30.7	Very low	169 Å²	169	133.5 Å²	133.5	89%	0.885	75%	0.746	S	S	*	*			trans	-69.5	165.8	161	-78.2	152.9	0	0	0	112.7
177	A	30.6	Very low	31.2	Very low	89 Å²	89	135.4 Å²	135.4	74%	0.736	75%	0.748	S	S	*	*			trans	108	109.8	147.3	0	0	0	0	0	120.2
178	V	29.9	Very low	31.7	Very low	138 Å²	138	133.5 Å²	133.5	84%	0.836	74%	0.743	S	S	*	*				47.4	153.5	129.3	-148.4	0	0	0	0	121.9
179	E	28.5	Very low	32.1	Very low	171 Å²	171	134.9 Å²	134.9	80%	0.799	74%	0.742	S	S	*	*			trans	77.2	158.1	167.1	-62.3	-159.6	115.6	0	0	118.4
180	Q	29	Very low	32.4	Very low	160 Å²	160	137.7 Å²	137.7	75%	0.748	75%	0.75	S	S	*	*				-163.2	157.1	-55	-130.9	-163.9	12.5	0	0	109.7
181	V	29.5	Very low	32.9	Very low	119 Å²	119	134.7 Å²	134.7	72%	0.721	74%	0.74	S	S	*	*			trans	63.1	131.6	154.1	176.2	0	0	0	0	118.7
182	M	30.1	Very low	33.3	Very low	132 Å²	132	135.1 Å²	135.1	65%	0.65	74%	0.737	S	S	*	*				165.9	123.4	108.2	-157.2	168.8	-178.3	0	0	113.5
183	Y	34.9	Very low	33.8	Very low	181 Å²	181	138 Å²	138	71%	0.71	73%	0.734	S	S	*	*				157.2	124.4	125.5	-98.5	-79.3	0	0	0	113.6
184	N	35.3	Very low	34	Very low	107 Å²	107	139.9 Å²	139.9	57%	0.572	73%	0.73	S	S	*	*			trans	8.7	145.7	156.3	-45.7	-2.5	0	0	0	119.7
185	H	38.2	Very low	34.4	Very low	158 Å²	158	139.8 Å²	139.8	73%	0.731	73%	0.73	S	S	*	*			cis	-163.7	156	48.5	-85.7	-83.1	0	0	0	109.5
186	D	37	Very low	34.4	Very low	120 Å²	120	143.6 Å²	143.6	64%	0.642	73%	0.728	S	S	*	*			cis	-165.3	177	-9.6	-138.2	-39.3	0	0	0	111.9
187	I	39.9	Very low	35	Very low	148 Å²	148	141.4 Å²	141.4	76%	0.759	72%	0.723	S	S	*	*			trans	73	139.7	149.8	-77	162.6	0	0	0	119
188	P	36.6	Very low	35.2	Very low	107 Å²	107	143 Å²	143	70%	0.695	72%	0.72	S	S	*	*				-124.6	-171.6	-128	34.6	-15	0	0	0	115.4
189	I	38.1	Very low	35.6	Very low	142 Å²	142	143.9 Å²	143.9	73%	0.728	72%	0.719	S	S	*	*				-175.7	139.7	88	-87.8	170.9	0	0	0	110.7
190	D	35.9	Very low	35.9	Very low	150 Å²	150	140.2 Å²	140.2	80%	0.802	71%	0.712	S	S	*	*			trans	47	147	155.4	-67	-17.3	0	0	0	123.8
191	S	38.5	Very low	36.2	Very low	84 Å²	84	137.8 Å²	137.8	59%	0.587	71%	0.713	S	S	*	*			cis	-170.7	167	-15.9	61.6	0	0	0	0	112.7
192	I	38.4	Very low	36.5	Very low	140 Å²	140	139.3 Å²	139.3	72%	0.718	72%	0.717	S	S	*	*			trans	70.2	137.7	151.9	-70.7	165.4	0	0	0	118.6
193	K	37.1	Very low	36.8	Very low	145 Å²	145	139.3 Å²	139.3	63%	0.63	73%	0.725	S	S	*	*			cis	-177	145.1	-24.1	-116.4	172.1	-166.5	158.8	0	110.8
194	R	36.3	Very low	36.7	Very low	200 Å²	200	135.3 Å²	135.3	76%	0.755	72%	0.723	S	S	*	*			trans	67.6	157.3	150.9	-62.9	174.8	-178.1	160.5	-4.2	118.3
195	N	36.3	Very low	36.8	Very low	149 Å²	149	138 Å²	138	80%	0.797	74%	0.737	S	S	*	*			cis	-155.3	165.9	-9.2	-114.3	9.1	0	0	0	111.9
196	R	35.8	Very low	36.5	Very low	206 Å²	206	136 Å²	136	78%	0.777	74%	0.737	S	S	*	*			trans	-115.2	167.7	170.4	-138.3	-165.6	-139	-175.2	10.4	110.7
197	P	39.6	Very low	36.3	Very low	123 Å²	123	134.4 Å²	134.4	80%	0.799	74%	0.735	S	S	*	*				-147.3	-163.9	107.8	37.8	-19.6	0	0	0	114.6
198	N	34.5	Very low	35.9	Very low	122 Å²	122	136.3 Å²	136.3	65%	0.652	74%	0.738	S	S	*	*			trans	-126.9	174.5	-168.1	-25.8	-72.2	0	0	0	112.5
199	L	37.8	Very low	35.8	Very low	157 Å²	157	137.4 Å²	137.4	82%	0.822	74%	0.742	S	S	*	*				159.3	153.2	111.6	-165.9	60	0	0	0	113.9
200	S	35.6	Very low	35.6	Very low	95 Å²	95	135 Å²	135	66%	0.664	74%	0.738	S	S	*	*			trans	59.4	132	164.4	48.9	0	0	0	0	119
201	S	35.1	Very low	35.3	Very low	109 Å²	109	136.2 Å²	136.2	76%	0.762	74%	0.739	S	S	*	*			cis	85.6	107.8	22.9	83.1	0	0	0	0	116.6
202	D	35.4	Very low	35.1	Very low	151 Å²	151	137.8 Å²	137.8	81%	0.807	75%	0.748	S	S	*	*			trans	-163.8	156.6	145	-130.5	-24.6	0	0	0	117.4
203	T	36.5	Very low	34.9	Very low	131 Å²	131	138.2 Å²	138.2	80%	0.804	76%	0.756	S	S	*	*			trans	46.9	154.3	161	52.6	0	0	0	0	124.6
204	S	33.6	Very low	34.6	Very low	98 Å²	98	135.9 Å²	135.9	69%	0.685	76%	0.758	S	S	*	*			trans	-111.8	170.2	-178	59.4	0	0	0	0	112.4
205	N	37.2	Very low	34.1	Very low	162 Å²	162	134.9 Å²	134.9	87%	0.866	76%	0.762	S	S	*	*			trans	-151.5	156.6	147.5	-113.4	-44.2	0	0	0	111.9
206	T	32.2	Very low	33.9	Very low	118 Å²	118	134.1 Å²	134.1	72%	0.724	76%	0.756	S	S	*	*			trans	-139.3	170.2	-166.8	60.6	0	0	0	0	114.1
207	S	31.6	Very low	33.7	Very low	85 Å²	85	132.5 Å²	132.5	59%	0.594	76%	0.758	S	S	*	*			trans	99	144.2	149.7	84.8	0	0	0	0	119.1
208	K	32.5	Very low	33.3	Very low	189 Å²	189	133.1 Å²	133.1	82%	0.822	75%	0.753	S	S	*	*			trans	73.6	140.9	168.1	-55.1	153	-168.7	173.3	0	113.5
209	T	33.7	Very low	33.2	Very low	129 Å²	129	134.7 Å²	134.7	79%	0.791	76%	0.757	S	S	*	*			cis	-135.6	146.8	22.6	-55.8	0	0	0	0	113.7
210	S	33.7	Very low	32.7	Very low	92 Å²	92	136 Å²	136	64%	0.643	76%	0.756	S	S	*	*			trans	-46.4	172.4	161.5	36.1	0	0	0	0	115.8
211	Q	30.6	Very low	32.7	Very low	175 Å²	175	139.8 Å²	139.8	82%	0.818	76%	0.762	S	S	*	*			cis	-159.8	169.8	-5.7	-117.4	175.4	-41.5	0	0	108
212	P	34.5	Very low	32.5	Very low	118 Å²	118	141.1 Å²	141.1	77%	0.766	76%	0.761	S	S	*	*			trans	-83.2	155.6	169.9	35.5	-31.1	0	0	0	112
213	V	34.2	Very low	32.2	Very low	148 Å²	148	142.3 Å²	142.3	90%	0.897	76%	0.761	S	S	*	*			trans	-130.4	141.4	166.5	179.2	0	0	0	0	108.8
214	S	29.7	Very low	31.9	Very low	96 Å²	96	141.6 Å²	141.6	67%	0.671	75%	0.749	S	S	*	*			trans	-108.6	170.9	-170.2	49.4	0	0	0	0	113.5
215	E	26.6	Very low	31.7	Very low	179 Å²	179	147.3 Å²	147.3	84%	0.836	76%	0.757	S	S	*	*			trans	84.5	169.4	144.8	-149.1	161.5	-124.2	0	0	119
216	I	32.2	Very low	31.4	Very low	133 Å²	133	147.8 Å²	147.8	68%	0.682	76%	0.759	S	S	*	*			trans	81.6	91.4	168.3	-51.9	178.1	0	0	0	117.9
217	H	31.6	Very low	31.3	Very low	173 Å²	173	149.6 Å²	149.6	80%	0.801	76%	0.757	S	S	*	*			trans	68.8	155.3	145.4	-68.9	-141.5	0	0	0	117.8
218	L	30.6	Very low	31.2	Very low	136 Å²	136	151.8 Å²	151.8	71%	0.712	76%	0.761	S	S	*	*			cis	-144.9	150.1	6.4	-163.7	69.2	0	0	0	111.6
219	H	32	Very low	31.1	Very low	155 Å²	155	155 Å²	155	72%	0.718	77%	0.768	S	S	*	*			trans	29.1	114.5	161	-81.2	-129.4	0	0	0	120.2
220	K	28.6	Very low	31	Very low	185 Å²	185	159 Å²	159	80%	0.804	77%	0.77	S	S	*	*				71	61.3	63.1	-162.7	-172.7	178.8	178.7	0	115.2
221	H	34.3	Very low	30.7	Very low	173 Å²	173	161.6 Å²	161.6	80%	0.801	77%	0.772	S	S	*	*			trans	-159.4	141.3	148.4	-107.7	-94.3	0	0	0	106.6
222	N	31.9	Very low	30.6	Very low	138 Å²	138	161.7 Å²	161.7	74%	0.738	78%	0.777	S	S	*	*			cis	-147.5	154.4	-0.1	-150.5	0.2	0	0	0	110.8
223	H	28.8	Very low	30.4	Very low	175 Å²	175	161.2 Å²	161.2	81%	0.81	78%	0.783	S	S	*	*			trans	-73.2	176.6	168.5	-118	-109.4	0	0	0	110.8
224	H	30.1	Very low	30.1	Very low	117 Å²	117	163.5 Å²	163.5	54%	0.542	78%	0.776	S	S	.	*			trans	82	69.8	153.7	-147.8	107.4	0	0	0	118.4
225	Y	29	Very low	30.1	Very low	217 Å²	217	165 Å²	165	85%	0.851	79%	0.786	S	S	*	*			trans	-137.3	34.8	164.9	-98.6	-68.1	0	0	0	115.5
226	D	31.4	Very low	30.4	Very low	173 Å²	173	160.3 Å²	160.3	93%	0.925	78%	0.778	S	S	*	*	S	Bend	trans	-123.9	23.6	165.2	-125	-23.1	0	0	0	112.8
227	K	29.1	Very low	30.3	Very low	155 Å²	155	159 Å²	159	67%	0.674	78%	0.776	S	S	*	*	S	Bend	trans	-133.9	155.2	163.3	-105.6	173.1	175.3	173.1	0	106.1
228	I	30.1	Very low	30.1	Very low	131 Å²	131	157.5 Å²	157.5	67%	0.672	78%	0.779	S	S	*	*			trans	74.4	71.1	-175.7	-42.2	168.5	0	0	0	114.3
229	R	30.5	Very low	30	Very low	256 Å²	256	156 Å²	156	97%	0.966	78%	0.775	S	S	*	*	S	Bend	trans	-126.7	15.7	142.3	-84.8	-159.1	-178.2	-169.2	5.3	113.9
230	Y	30.5	Very low	30	Very low	214 Å²	214	153.2 Å²	153.2	84%	0.839	77%	0.774	S	S	*	*	S	Bend	trans	-99.4	158.2	157.2	-85.1	-106.6	0	0	0	108.3
231	Q	29.1	Very low	30.1	Very low	146 Å²	146	149.7 Å²	149.7	68%	0.682	77%	0.772	S	S	*	*	S	Bend	trans	78.6	41.8	179.8	-58.2	-83.7	49.9	0	0	118.1
232	L	27.5	Very low	30	Very low	178 Å²	178	147.1 Å²	147.1	93%	0.932	77%	0.774	S	S	*	*	S	Bend	trans	-144.2	51.6	150.4	-151.4	76.1	0	0	0	114.2
233	A	31.5	Very low	30.3	Very low	108 Å²	108	146.1 Å²	146.1	89%	0.893	78%	0.775	S	S	*	*			trans	-145.2	53.5	167.6	0	0	0	0	0	110
234	R	27.6	Very low	30.5	Very low	196 Å²	196	146.3 Å²	146.3	74%	0.74	78%	0.778	S	S	*	*			trans	-136.3	83.4	-175.5	-165.7	176.7	-174.7	179.1	0.3	112.9
235	S	29.1	Very low	30.6	Very low	127 Å²	127	146.1 Å²	146.1	89%	0.888	79%	0.785	S	S	*	*			trans	-171.3	118.5	158.9	-77	0	0	0	0	105.9
236	A	32.9	Very low	30.7	Very low	81 Å²	81	144 Å²	144	67%	0.669	78%	0.781	S	S	*	*			cis	-139	135.9	-1.4	0	0	0	0	0	107.8
237	T	30.4	Very low	30.7	Very low	105 Å²	105	144 Å²	144	64%	0.644	78%	0.775	S	S	*	*				34.3	115.4	90.8	50.7	0	0	0	0	113.2
238	V	27	Very low	30.8	Very low	142 Å²	142	141.7 Å²	141.7	86%	0.861	77%	0.774	S	S	*	*			cis	60.6	87.3	28.9	-169.8	0	0	0	0	113.7
239	T	29.3	Very low	30.9	Very low	103 Å²	103	143.5 Å²	143.5	63%	0.632	78%	0.779	S	S	*	*			trans	179.6	155.3	159.4	23.4	0	0	0	0	106.4
240	S	31.1	Very low	30.9	Very low	98 Å²	98	137.1 Å²	137.1	69%	0.685	76%	0.763	S	S	*	*			cis	-152.6	149.4	-5.3	41.9	0	0	0	0	111.4
241	S	31.5	Very low	31	Very low	110 Å²	110	134.3 Å²	134.3	77%	0.769	76%	0.758	S	S	*	*			trans	-70.8	157.9	164.5	49.4	0	0	0	0	114
242	S	32.4	Very low	31.1	Very low	119 Å²	119	132.8 Å²	132.8	83%	0.832	76%	0.759	S	S	*	*			trans	-167.4	167.6	145.2	-103.6	0	0	0	0	113
243	P	37.7	Very low	31.2	Very low	117 Å²	117	130.9 Å²	130.9	76%	0.76	75%	0.75	S	S	*	*				-137.8	178.5	-126.6	45.4	-29.9	0	0	0	117.1
244	M	32.6	Very low	31.3	Very low	180 Å²	180	132.7 Å²	132.7	89%	0.887	74%	0.744	S	S	*	*			trans	-175.5	154.9	146.7	-93	-129.5	162.9	0	0	109.1
245	T	33.2	Very low	31.5	Very low	113 Å²	113	130.1 Å²	130.1	69%	0.693	75%	0.745	S	S	*	*			cis	-155.3	166	-26.2	-81.4	0	0	0	0	107.9
246	K	29.1	Very low	31.5	Very low	173 Å²	173	130.5 Å²	130.5	75%	0.752	75%	0.746	S	S	*	*			trans	-64.3	147.9	-172.9	-54.8	163.5	-176.7	170.3	0	114.5
247	H	33.3	Very low	31.5	Very low	173 Å²	173	134 Å²	134	80%	0.801	75%	0.754	S	S	*	*				-179.5	115.7	106.5	-93	-70.5	0	0	0	110.1
248	T	30.9	Very low	31.9	Very low	106 Å²	106	133.9 Å²	133.9	65%	0.65	76%	0.755	S	S	*	*				83.2	128.2	67.9	-22.9	0	0	0	0	116.5
249	Q	32.4	Very low	31.9	Very low	169 Å²	169	138.5 Å²	138.5	79%	0.79	76%	0.757	S	S	*	*			trans	73.8	147.9	164.3	-52.8	-156.1	-15	0	0	117.5
250	L	30.5	Very low	32.2	Very low	121 Å²	121	142.2 Å²	142.2	63%	0.634	77%	0.767	S	S	*	*			cis	-151.2	174.1	-10.2	-144.1	67.5	0	0	0	111.5
251	E	30.9	Very low	32.4	Very low	156 Å²	156	143.2 Å²	143.2	73%	0.729	77%	0.769	S	S	*	*			trans	4.8	156.8	149.9	-73.7	164.2	-179.9	0	0	122.2
252	T	32.3	Very low	32.6	Very low	114 Å²	114	146 Å²	146	70%	0.699	78%	0.775	S	S	*	*			cis	-154.4	173.2	16.2	-11.8	0	0	0	0	113.4
253	N	29.9	Very low	32.5	Very low	138 Å²	138	148 Å²	148	74%	0.738	77%	0.773	S	S	*	*			trans	-22.9	152.6	159.1	-59.2	-17.3	0	0	0	117.2
254	D	34	Very low	32.3	Very low	146 Å²	146	148.5 Å²	148.5	78%	0.781	77%	0.768	S	S	*	*				-159.6	-176.4	70	-132.5	-45.8	0	0	0	117.6
255	N	30.1	Very low	32.1	Very low	142 Å²	142	150.3 Å²	150.3	76%	0.759	77%	0.765	S	S	*	*			trans	-96.1	154.3	-164.3	-63.2	-95.2	0	0	0	115.2
256	C	30.8	Very low	32	Very low	134 Å²	134	152 Å²	152	91%	0.905	77%	0.77	S	S	*	*				-162.9	175.5	123.2	-148.2	0	0	0	0	112.8
257	N	32.9	Very low	32	Very low	156 Å²	156	150.8 Å²	150.8	83%	0.834	77%	0.767	S	S	*	*			trans	-116.5	167.8	-166.3	-102.4	-49.3	0	0	0	114.5
258	P	38.1	Very low	31.8	Very low	102 Å²	102	149.8 Å²	149.8	66%	0.662	76%	0.762	S	S	*	*			trans	-105.1	156.7	-171.3	39	-34.6	0	0	0	115.5
259	R	28.2	Very low	31.9	Very low	239 Å²	239	151 Å²	151	90%	0.902	77%	0.769	S	S	*	*			trans	165.9	124.5	135.8	-97.2	166.1	174.2	169.4	-1.6	114
260	E	34	Very low	31.8	Very low	181 Å²	181	150 Å²	150	85%	0.846	77%	0.769	S	S	*	*			trans	-170.4	125.2	139.3	-103.8	160.3	169.5	0	0	105.2
261	T	36.2	Very low	32	Very low	119 Å²	119	149.2 Å²	149.2	73%	0.73	77%	0.773	S	S	*	*				45.2	93.1	69.5	50.3	0	0	0	0	114.8
262	D	36.4	Very low	32	Very low	168 Å²	168	148.5 Å²	148.5	90%	0.898	78%	0.779	S	S	*	*				-159.6	-167.2	106.2	-111.5	-11.8	0	0	0	113.6
263	M	28.8	Very low	32.2	Very low	160 Å²	160	148.9 Å²	148.9	79%	0.788	78%	0.784	S	S	*	*			trans	-140.2	169.1	-146.9	-167.3	177	63.1	0	0	113.7
264	I	34	Very low	32.4	Very low	128 Å²	128	145.6 Å²	145.6	66%	0.656	78%	0.782	S	S	*	*			trans	95.3	116.4	160	-52.5	175.7	0	0	0	118.2
265	R	28.7	Very low	32.2	Very low	219 Å²	219	146.6 Å²	146.6	83%	0.826	79%	0.787	S	S	*	*			trans	64.5	128.3	156.1	-73.6	175.5	172.5	169.3	-2.9	118.8
266	L	30.4	Very low	32.2	Very low	149 Å²	149	146.9 Å²	146.9	78%	0.78	79%	0.788	S	S	*	*				60.2	133.3	78.6	-58.3	-178.8	0	0	0	112.3
267	Q	29	Very low	32.1	Very low	147 Å²	147	151.5 Å²	151.5	69%	0.687	79%	0.786	S	S	*	*			cis	-152	171.9	24.4	-161	159.6	-73.7	0	0	112.5
268	E	28.7	Very low	32	Very low	151 Å²	151	150.1 Å²	150.1	71%	0.706	78%	0.775	S	S	*	*			trans	58.4	118.7	161.7	-85	149.6	-122.5	0	0	121.2
269	T	32.9	Very low	31.5	Very low	131 Å²	131	156.7 Å²	156.7	80%	0.804	79%	0.786	S	S	*	*				-176.1	157.6	106.3	24.2	0	0	0	0	113.7
270	L	32.1	Very low	31.7	Very low	150 Å²	150	149.2 Å²	149.2	79%	0.785	77%	0.768	S	S	*	*			trans	70.5	82.2	154.7	-70.1	160.8	0	0	0	121.3
271	S	33.3	Very low	31.5	Very low	103 Å²	103	148.5 Å²	148.5	72%	0.72	77%	0.77	S	S	*	*				66.7	117.5	122.9	65.1	0	0	0	0	121.7
272	V	32	Very low	31.2	Very low	141 Å²	141	149.5 Å²	149.5	86%	0.855	77%	0.77	S	S	*	*			trans	-117.7	129.2	163.7	174.3	0	0	0	0	110.4
273	P	35.9	Very low	30.9	Very low	122 Å²	122	146 Å²	146	79%	0.792	76%	0.759	S	S	*	*			trans	-131.8	141.3	146	34.5	-21.9	0	0	0	111.6
274	G	33.1	Very low	30.8	Very low	69 Å²	69	144.6 Å²	144.6	71%	0.711	76%	0.755	S	S	*	*			cis	159.2	106.1	-2.5	0	0	0	0	0	110
275	L	30.6	Very low	30.7	Very low	168 Å²	168	148.1 Å²	148.1	88%	0.88	76%	0.761	S	S	*	*			trans	-157.2	61.7	175.9	-124.6	176.4	0	0	0	111.7
276	L	30.2	Very low	30.9	Very low	148 Å²	148	143.5 Å²	143.5	78%	0.775	76%	0.758	S	S	*	*			trans	-99.7	109.5	172.6	-167	76.9	0	0	0	108.9	Q278	L276-Q278 HydrophobicContact CD2-CB 4.38Å; L276-Q278 HydrophobicContact CG-CB 4.36Å
277	R	29.5	Very low	31	Very low	230 Å²	230	143 Å²	143	87%	0.868	76%	0.756	S	S	*	*			trans	-108.1	83.2	160.2	-160.3	173.4	-165.5	-159.1	0.4	109.5	W279	R277-W279 PolarHBondContact O-N 2.86Å
278	Q	29.7	Very low	31.3	Very low	128 Å²	128	142.2 Å²	142.2	60%	0.598	76%	0.756	S	S	*	*			trans	-57.2	123	178.8	-172.9	160.7	-25.1	0	0	110.6	L276 T280	L276-Q278 HydrophobicContact CD2-CB 4.38Å; L276-Q278 HydrophobicContact CG-CB 4.36Å; Q278-T280 HydrophobicContact CG-CG2 3.93Å; Q278-T280 VanDerWaalsContact NE2-CG2 3.34Å
279	W	27.8	Very low	31.4	Very low	239 Å²	239	144.2 Å²	144.2	91%	0.905	76%	0.759	S	S	*	*			trans	-95.2	92.8	158.4	-76.1	71.8	0	0	0	106.1	R277	R277-W279 PolarHBondContact O-N 2.86Å
280	T	33.3	Very low	31.2	Very low	83 Å²	83	143.8 Å²	143.8	51%	0.509	76%	0.761	S	S	.	*			trans	-89.4	125.5	157.8	34.3	0	0	0	0	108.4	Q278 D282	Q278-T280 HydrophobicContact CG-CG2 3.93Å; Q278-T280 VanDerWaalsContact NE2-CG2 3.34Å; T280-D282 VanDerWaalsContact CB-OD2 3.23Å; T280-D282 WeakPolarHBondContact CB-OD2 3.49Å; T280-D282 PolarHBondContact O-N 2.8Å; T280-D282 PolarHBondContact OG1-OD2 2.89Å
281	D	28.9	Very low	31.2	Very low	166 Å²	166	142.6 Å²	142.6	89%	0.888	76%	0.755	S	S	*	*			trans	-73	104.4	154.7	-71.1	-60.2	0	0	0	106.5
282	D	30.4	Very low	31.1	Very low	139 Å²	139	148 Å²	148	74%	0.743	76%	0.761	S	S	*	*			trans	-120.8	154.7	168.3	-79.8	-59.3	0	0	0	109.2	T280	T280-D282 VanDerWaalsContact CB-OD2 3.23Å; T280-D282 WeakPolarHBondContact CB-OD2 3.49Å; T280-D282 PolarHBondContact O-N 2.8Å; T280-D282 PolarHBondContact OG1-OD2 2.89Å
283	S	28.7	Very low	31.1	Very low	96 Å²	96	151.3 Å²	151.3	67%	0.671	76%	0.764	S	S	*	*			trans	-84	173.7	-162.8	63	0	0	0	0	115.1
284	D	28.1	Very low	30.8	Very low	130 Å²	130	155.6 Å²	155.6	70%	0.695	76%	0.764	S	S	*	*			trans	63.6	99.2	157.6	-51.1	-46.5	0	0	0	118.3
285	Y	32.1	Very low	30.8	Very low	202 Å²	202	160.1 Å²	160.1	79%	0.792	77%	0.767	S	S	*	*			trans	-134.3	72.8	151.6	-142.3	-103.9	0	0	0	111.8	D287	Y285-D287 HydrophobicContact CD1-CB 4.15Å; Y285-D287 HydrophobicContact CE1-CB 4.21Å; Y285-D287 PolarHBondContact O-N 2.88Å
286	T	31.6	Very low	30.6	Very low	122 Å²	122	160 Å²	160	75%	0.748	77%	0.767	S	S	*	*			trans	-76.4	88.2	166.1	47.9	0	0	0	0	109.7	D288	T286-D288 PolarHBondContact O-N 3.32Å
287	D	33.8	Very low	30.7	Very low	139 Å²	139	158.1 Å²	158.1	74%	0.743	77%	0.766	S	S	*	*			trans	-80.3	67.5	176.5	-135.7	8	0	0	0	110	Y285	Y285-D287 HydrophobicContact CD1-CB 4.15Å; Y285-D287 HydrophobicContact CE1-CB 4.21Å; Y285-D287 PolarHBondContact O-N 2.88Å
288	D	34	Very low	30.8	Very low	129 Å²	129	155.9 Å²	155.9	69%	0.69	76%	0.763	S	S	*	*			trans	-99.3	136.7	178.5	-112.5	-28.3	0	0	0	112.2	T286	T286-D288 PolarHBondContact O-N 3.32Å
289	Y	32	Very low	30.9	Very low	194 Å²	194	156.6 Å²	156.6	76%	0.761	77%	0.767	S	S	*	*			trans	27.9	99.7	164.8	-74.9	-92.2	0	0	0	119.8	L291	Y289-L291 VanDerWaalsContact C-N 3.28Å; Y289-L291 PolarHBondContact O-N 3.46Å
290	S	29.2	Very low	31.2	Very low	122 Å²	122	150 Å²	150	85%	0.853	75%	0.753	S	S	*	*			trans	-69.4	79.4	157.6	69	0	0	0	0	111.9
291	L	31.6	Very low	31	Very low	125 Å²	125	152.8 Å²	152.8	65%	0.654	76%	0.764	S	S	*	*			trans	-140	157.1	173.1	-115.4	163.1	0	0	0	110.1	Y289	Y289-L291 VanDerWaalsContact C-N 3.28Å; Y289-L291 PolarHBondContact O-N 3.46Å
292	Y	31.3	Very low	31.4	Very low	217 Å²	217	150.8 Å²	150.8	85%	0.851	75%	0.754	S	S	*	*			trans	59.4	62.4	-178.4	-76.4	-86.3	0	0	0	118
293	K	31	Very low	31.5	Very low	209 Å²	209	155.1 Å²	155.1	91%	0.909	76%	0.76	S	S	*	*			trans	-75.9	112.6	144.9	172.2	-173.2	178.6	176.4	0	109.4
294	R	29.6	Very low	31.8	Very low	212 Å²	212	156 Å²	156	80%	0.8	76%	0.763	S	S	*	*			trans	166.1	148.6	142	173.1	176	-83.9	-179	-7.7	112.3
295	Q	33.6	Very low	32.1	Very low	164 Å²	164	158 Å²	158	77%	0.766	77%	0.773	S	S	*	*			trans	68	87.2	165.8	-81.1	159.1	-67.3	0	0	118.6
296	N	27	Very low	32.2	Very low	166 Å²	166	152.5 Å²	152.5	89%	0.888	76%	0.764	S	S	*	*			trans	-81.4	133.9	131.8	-79.1	0.9	0	0	0	107.9
297	S	31.1	Very low	32.5	Very low	109 Å²	109	153.7 Å²	153.7	76%	0.762	76%	0.761	S	S	*	*			trans	-178.9	136.3	155.4	-99.5	0	0	0	0	109.6
298	F	32.7	Very low	32.5	Very low	182 Å²	182	153.3 Å²	153.3	80%	0.798	76%	0.759	S	S	*	*			trans	62.3	159.2	176.2	-93.4	-111.8	0	0	0	117.1
299	E	32	Very low	32.4	Very low	144 Å²	144	152.3 Å²	152.3	67%	0.673	76%	0.762	S	S	*	*				175.3	158.3	-54.6	-106.3	-171.1	103.4	0	0	108.4
300	T	33.4	Very low	32.5	Very low	99 Å²	99	148.5 Å²	148.5	61%	0.607	76%	0.763	S	S	*	*			trans	58.7	107.1	159.6	54.4	0	0	0	0	121.8
301	N	30	Very low	32.5	Very low	142 Å²	142	150.5 Å²	150.5	76%	0.759	77%	0.765	S	S	*	*				86.4	152.8	114.8	-62.3	-3.9	0	0	0	124.5
302	D	36.3	Very low	32.6	Very low	124 Å²	124	153.1 Å²	153.1	66%	0.663	78%	0.776	S	S	*	*			trans	80.3	89.1	153.8	-75.2	-61.1	0	0	0	123.1
303	R	31.9	Very low	32.5	Very low	231 Å²	231	148.2 Å²	148.2	87%	0.872	77%	0.773	S	S	*	*				91.3	153.1	124.2	-75.3	175.8	-175.4	-126.9	-1.2	121.4
304	P	36.2	Very low	32.4	Very low	115 Å²	115	146 Å²	146	75%	0.747	77%	0.77	S	S	*	*			trans	-121.3	172.1	-168.7	43.4	-30.3	0	0	0	115.1
305	L	34.7	Very low	32.5	Very low	172 Å²	172	144 Å²	144	90%	0.901	77%	0.77	S	S	*	*			trans	-150	160.5	143.9	-144.4	72.2	0	0	0	111.8
306	S	34.3	Very low	32.3	Very low	85 Å²	85	141 Å²	141	59%	0.594	76%	0.763	S	S	*	*			trans	-83	153.3	-177.9	44.8	0	0	0	0	112.5
307	H	37.9	Very low	32.5	Very low	148 Å²	148	141.8 Å²	141.8	69%	0.685	76%	0.761	S	S	*	*				-164.9	158.7	75.1	-108.9	-93.7	0	0	0	115.2
308	D	32.2	Very low	32.4	Very low	130 Å²	130	141.7 Å²	141.7	70%	0.695	76%	0.76	S	S	*	*			trans	50.4	103.5	146.1	-58.7	-20.6	0	0	0	121.8
309	S	31.8	Very low	32.3	Very low	109 Å²	109	137.1 Å²	137.1	76%	0.762	76%	0.756	S	S	*	*				138	157.2	93.1	64	0	0	0	0	116.3
310	S	35.4	Very low	32.2	Very low	113 Å²	113	138 Å²	138	79%	0.79	77%	0.765	S	S	*	*			trans	57.5	89.6	173.6	54.3	0	0	0	0	117.7
311	N	29.5	Very low	32	Very low	165 Å²	165	140 Å²	140	88%	0.882	77%	0.771	S	S	*	*			trans	-67	149.2	161.6	-57.6	-54.4	0	0	0	111.4
312	M	32	Very low	32.1	Very low	179 Å²	179	144.1 Å²	144.1	88%	0.882	78%	0.777	S	S	*	*				173.5	99.7	109.4	-178.3	145.9	56.3	0	0	111.6
313	S	29.4	Very low	31.9	Very low	115 Å²	115	144 Å²	144	80%	0.804	78%	0.777	S	S	*	*			trans	-93.2	145.1	168.2	47.2	0	0	0	0	111.1
314	L	30.5	Very low	31.9	Very low	161 Å²	161	140.9 Å²	140.9	84%	0.843	77%	0.772	S	S	*	*			trans	-79.3	137.4	170.6	-69.2	88.9	0	0	0	110
315	H	31.9	Very low	31.9	Very low	170 Å²	170	140.4 Å²	140.4	79%	0.787	77%	0.767	S	S	*	*				-160.9	137.6	121.4	-119.9	-87.8	0	0	0	113.7
316	T	29.4	Very low	31.9	Very low	102 Å²	102	138.5 Å²	138.5	63%	0.626	76%	0.757	S	S	*	*			trans	3.6	122.9	156	50.7	0	0	0	0	120.1
317	H	30.7	Very low	32	Very low	182 Å²	182	143.1 Å²	143.1	84%	0.843	77%	0.767	S	S	*	*				-165.6	166.1	105.2	-112.9	-78.2	0	0	0	114.5
318	S	28.6	Very low	31.9	Very low	108 Å²	108	142.9 Å²	142.9	76%	0.755	76%	0.764	S	S	*	*			trans	-65.5	145.3	-173.5	-35.6	0	0	0	0	115.7
319	A	30.2	Very low	31.8	Very low	85 Å²	85	143 Å²	143	70%	0.702	76%	0.76	S	S	*	*				170	142.6	112.8	0	0	0	0	0	115.3
320	N	29.9	Very low	31.8	Very low	162 Å²	162	148.1 Å²	148.1	87%	0.866	76%	0.764	S	S	*	*			trans	41.5	74.6	142	-60.5	-11.2	0	0	0	120.9
321	I	28.6	Very low	31.7	Very low	141 Å²	141	148.5 Å²	148.5	72%	0.723	76%	0.757	S	S	*	*			trans	-136.3	107.9	141.9	-53.5	178.9	0	0	0	109.1
322	Y	33	Very low	32	Very low	230 Å²	230	145.1 Å²	145.1	90%	0.902	74%	0.743	S	S	*	*			trans	-145.6	129.7	159.8	-106.8	-76.9	0	0	0	110.7
323	N	31.6	Very low	32	Very low	122 Å²	122	143.5 Å²	143.5	65%	0.652	74%	0.737	S	S	*	*			trans	-82.3	152.8	-164	-71	-46.4	0	0	0	114.3	T325	N323-T325 HydrophobicContact CB-CG2 4.48Å; N323-T325 PolarHBondContact O-N 3.4Å
324	E	32.9	Very low	32.2	Very low	165 Å²	165	145.4 Å²	145.4	77%	0.771	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	23.7	-177.2	-152	-161.2	129.8	0	0	114.7	K328	E324-K328 IonicContact OE1-NZ 2.87Å
325	T	36.4	Very low	32.4	Very low	105 Å²	105	145.7 Å²	145.7	64%	0.644	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	-34.6	-164	49.9	0	0	0	0	114.3	N323 F327	N323-T325 HydrophobicContact CB-CG2 4.48Å; N323-T325 PolarHBondContact O-N 3.4Å; T325-F327 VanDerWaalsContact C-N 3.33Å; T325-F327 PolarHBondContact O-N 2.91Å
326	L	34.5	Very low	32.2	Very low	131 Å²	131	145 Å²	145	69%	0.686	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-12.5	-170.6	-116.2	170.3	0	0	0	115.2
327	F	35.9	Very low	32.2	Very low	183 Å²	183	149.7 Å²	149.7	80%	0.803	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-1.5	-175.3	-121.1	-82.6	0	0	0	115.3	T325	T325-F327 VanDerWaalsContact C-N 3.33Å; T325-F327 PolarHBondContact O-N 2.91Å
328	K	34.7	Very low	32.1	Very low	142 Å²	142	147 Å²	147	62%	0.617	75%	0.754	S	S	*	*	S	Bend	trans	-90.7	-10.9	178.1	-77.9	172.1	-179.7	152.6	0	114.3	E324 T332	E324-K328 IonicContact OE1-NZ 2.87Å; K328-T332 PolarHBondContact O-OG1 3.15Å
329	Q	30.8	Very low	32.2	Very low	134 Å²	134	145.2 Å²	145.2	63%	0.626	75%	0.753	S	S	*	*	S	Bend	trans	-93.5	-11.7	-171.4	-160.2	161.6	-12.4	0	0	114.1
330	Y	31.6	Very low	32.4	Very low	215 Å²	215	152.6 Å²	152.6	84%	0.843	76%	0.762	S	S	*	*	S	Bend	trans	-94.2	-22.1	177.1	-113	-89.4	0	0	0	114.3
331	D	34.5	Very low	32.5	Very low	121 Å²	121	152.1 Å²	152.1	65%	0.647	76%	0.758	S	S	*	*	S	Bend	trans	-92.7	1.6	178.7	-91.2	-26.2	0	0	0	113
332	T	34.2	Very low	32.7	Very low	95 Å²	95	151.5 Å²	151.5	58%	0.583	76%	0.757	S	S	*	*	S	Bend	trans	-114.9	-5.9	-172.9	39.6	0	0	0	0	115.5	K328	K328-T332 PolarHBondContact O-OG1 3.15Å
333	L	33.3	Very low	32.8	Very low	145 Å²	145	147.4 Å²	147.4	76%	0.759	75%	0.746	S	S	*	*	S	Bend	trans	-98.6	8.6	-173.7	-101.5	166	0	0	0	115.3
334	N	32.7	Very low	32.9	Very low	155 Å²	155	147 Å²	147	83%	0.829	74%	0.744	S	S	*	*	S	Bend	trans	-136.9	14.2	-169.1	-128.2	-18.6	0	0	0	115.5
335	E	34.3	Very low	33	Very low	166 Å²	166	145.2 Å²	145.2	78%	0.776	74%	0.739	S	S	*	*	S	Bend	trans	-139.9	62	171.9	-73.6	-166.8	143.7	0	0	110.8
336	N	28.4	Very low	32.8	Very low	156 Å²	156	146.9 Å²	146.9	83%	0.834	74%	0.744	S	S	*	*			trans	-155.4	38.3	175.4	-107.4	-25.3	0	0	0	116.1
337	Q	29.2	Very low	32.5	Very low	200 Å²	200	146.9 Å²	146.9	94%	0.935	74%	0.744	S	S	*	*			trans	-138.6	81.3	166.1	-80.1	-168.1	-17.5	0	0	111.6
338	S	29.7	Very low	32.3	Very low	127 Å²	127	149 Å²	149	89%	0.888	75%	0.747	S	S	*	*	S	Bend	trans	-175.2	99.5	158.1	169.7	0	0	0	0	112.8
339	G	30.6	Very low	32.1	Very low	70 Å²	70	149.9 Å²	149.9	72%	0.722	76%	0.758	S	S	*	*			trans	106	109.9	146.5	0	0	0	0	0	119
340	R	33.1	Very low	32.2	Very low	239 Å²	239	147.1 Å²	147.1	90%	0.902	77%	0.765	S	S	*	*			trans	66.8	120.8	165.6	-59.8	-179	178.5	177.9	-1.7	116
341	I	31.8	Very low	32.1	Very low	153 Å²	153	144.2 Å²	144.2	79%	0.785	76%	0.764	S	S	*	*			cis	79.7	127.4	41.8	-57.7	171.3	0	0	0	113
342	N	33.8	Very low	32.1	Very low	128 Å²	128	145.4 Å²	145.4	68%	0.684	78%	0.776	S	S	*	*			trans	79.3	109.6	169.8	-79	26.5	0	0	0	120.9
343	Q	34.9	Very low	31.8	Very low	144 Å²	144	148.1 Å²	148.1	67%	0.673	79%	0.786	S	S	*	*				99	105.1	123.9	-70.4	-176.5	-89	0	0	120.9
344	D	34.6	Very low	31.6	Very low	114 Å²	114	146 Å²	146	61%	0.61	78%	0.779	S	S	*	*				90.2	100.2	117.1	-59.1	-8.7	0	0	0	120.3
345	N	34.5	Very low	31.3	Very low	127 Å²	127	147.3 Å²	147.3	68%	0.679	78%	0.778	S	S	*	*				81.8	116.8	124	-64.5	-31	0	0	0	120.8
346	N	31.2	Very low	31	Very low	139 Å²	139	148 Å²	148	74%	0.743	78%	0.778	S	S	*	*			trans	74.2	147.5	138.4	-62	-25.3	0	0	0	118
347	L	29.7	Very low	31	Very low	132 Å²	132	146.9 Å²	146.9	69%	0.691	77%	0.772	S	S	*	*			cis	-151.9	152	0.3	-153.5	70.4	0	0	0	112.5
348	R	31.5	Very low	31	Very low	227 Å²	227	141.9 Å²	141.9	86%	0.857	76%	0.759	S	S	*	*			trans	57.1	126.4	149.4	-92.8	174.6	178.7	-176.3	-2	122.4
349	L	29.2	Very low	31.1	Very low	161 Å²	161	145.4 Å²	145.4	84%	0.843	76%	0.758	S	S	*	*			trans	-56.6	158.1	150.9	-99.3	63	0	0	0	113
350	G	33.3	Very low	31.1	Very low	75 Å²	75	150 Å²	150	77%	0.773	76%	0.761	S	S	*	*			trans	-151.5	105.1	159.2	0	0	0	0	0	111.2
351	N	29.6	Very low	31.1	Very low	154 Å²	154	144.4 Å²	144.4	82%	0.824	76%	0.755	S	S	*	*			trans	-80.5	126.5	172.3	-85.7	-8.1	0	0	0	110.3
352	T	35.1	Very low	30.8	Very low	147 Å²	147	141.2 Å²	141.2	90%	0.902	75%	0.747	S	S	*	*			trans	-135	157.4	153.8	47.5	0	0	0	0	109.9
353	N	27.3	Very low	30.8	Very low	151 Å²	151	143 Å²	143	81%	0.807	76%	0.756	S	S	*	*			trans	-133	162.6	-163.1	-158.2	-8.6	0	0	0	109.7
354	V	29.2	Very low	30.7	Very low	100 Å²	100	142.7 Å²	142.7	61%	0.606	76%	0.759	S	S	*	*			trans	71.4	118.9	161.1	179.8	0	0	0	0	118.6
355	K	27.3	Very low	30.4	Very low	183 Å²	183	147.1 Å²	147.1	80%	0.796	77%	0.767	S	S	*	*			trans	53.4	127.9	153.1	-60.1	164.8	-170.3	172.7	0	120.2
356	F	27.7	Very low	30.1	Very low	181 Å²	181	147.4 Å²	147.4	79%	0.794	77%	0.768	S	S	*	*				-161.5	172.7	96.1	-128.9	-116.8	0	0	0	113.8
357	L	28.6	Very low	30.2	Very low	133 Å²	133	148 Å²	148	70%	0.696	77%	0.771	S	S	*	*			trans	-40.9	167.5	173.1	-84.1	54.3	0	0	0	116.7
358	S	27.4	Very low	30.4	Very low	95 Å²	95	147.9 Å²	147.9	66%	0.664	78%	0.776	S	S	*	*			cis	-174.6	153.6	-17.1	53.8	0	0	0	0	110.8
359	K	33	Very low	30.2	Very low	201 Å²	201	145.8 Å²	145.8	87%	0.874	77%	0.773	S	S	*	*			trans	172.9	124.1	138.9	-99.2	165.4	-179.3	178.9	0	111.9
360	Q	30.2	Very low	30	Very low	166 Å²	166	145.2 Å²	145.2	78%	0.776	77%	0.771	S	S	*	*			trans	-86.7	166.9	152.3	-73.3	-173.5	-47	0	0	108.8
361	P	33	Very low	29.8	Very low	121 Å²	121	148.3 Å²	148.3	79%	0.786	78%	0.775	S	S	*	*				-114.7	157.1	79.7	36	-35.4	0	0	0	113.2
362	S	27	Very low	29.9	Very low	87 Å²	87	147.5 Å²	147.5	61%	0.608	77%	0.766	S	S	*	*			cis	80.1	76.4	15.7	88.6	0	0	0	0	117.2
363	L	33.5	Very low	29.6	Very low	165 Å²	165	150.5 Å²	150.5	86%	0.864	77%	0.767	S	S	*	*			trans	-141.9	97.4	150.2	-95.4	162.5	0	0	0	105.2
364	D	31.6	Very low	29.5	Very low	138 Å²	138	149.3 Å²	149.3	74%	0.738	76%	0.76	S	S	*	*				75.9	96.3	86.1	-146.9	39.5	0	0	0	110.1
365	R	29	Very low	29.5	Very low	206 Å²	206	153.3 Å²	153.3	78%	0.777	77%	0.77	S	S	*	*			cis	86.8	132.4	43.1	-160.7	-164.2	-169.2	178.4	6.3	111.6
366	N	27.5	Very low	29.7	Very low	133 Å²	133	152.3 Å²	152.3	71%	0.711	77%	0.768	S	S	*	*			trans	57.6	93.8	171.7	-58.3	-21.3	0	0	0	116.5
367	D	34.7	Very low	29.8	Very low	152 Å²	152	151 Å²	151	81%	0.813	77%	0.768	S	S	*	*				-136.9	125.4	125.8	-127.1	-23.8	0	0	0	113.7
368	V	33.1	Very low	29.8	Very low	130 Å²	130	151.1 Å²	151.1	79%	0.788	77%	0.77	S	S	*	*			trans	34.1	136.5	150	168.5	0	0	0	0	122.7
369	K	26.2	Very low	30	Very low	182 Å²	182	150.5 Å²	150.5	79%	0.791	76%	0.759	S	S	*	*	S	Bend	trans	-64.6	170.3	172.8	-56.7	162.5	-178.6	172.6	0	112.1
370	N	25.4	Very low	29.8	Very low	149 Å²	149	149 Å²	149	80%	0.797	76%	0.755	S	S	*	*			trans	79	67.3	166	-50	-11.8	0	0	0	116.9
371	V	29.6	Very low	29.9	Very low	141 Å²	141	147.1 Å²	147.1	86%	0.855	75%	0.75	S	S	*	*			trans	-117.6	66.1	150.3	-169.4	0	0	0	0	110.4	F373	V371-F373 PolarHBondContact O-N 3.2Å
372	Q	30.9	Very low	29.6	Very low	137 Å²	137	149.5 Å²	149.5	64%	0.64	74%	0.743	S	S	*	*			trans	30.4	68.8	131.8	-158.5	75.9	-2	0	0	117.1	N374	Q372-N374 HydrophobicContact CG-CB 3.97Å; Q372-N374 PolarHBondContact O-N 2.92Å
373	F	28.5	Very low	29.8	Very low	210 Å²	210	149.9 Å²	149.9	92%	0.921	75%	0.752	S	S	*	*			trans	-75.2	53.3	162.4	-131.2	-86.3	0	0	0	110.3	V371	V371-F373 PolarHBondContact O-N 3.2Å
374	N	26.4	Very low	29.6	Very low	125 Å²	125	148.4 Å²	148.4	67%	0.668	75%	0.745	S	S	*	*			trans	-141.1	48.3	-169.9	-103.3	-28.4	0	0	0	110	Q372	Q372-N374 HydrophobicContact CG-CB 3.97Å; Q372-N374 PolarHBondContact O-N 2.92Å
375	K	28.2	Very low	29.4	Very low	185 Å²	185	145.2 Å²	145.2	80%	0.804	73%	0.734	S	S	*	*	S	Bend	trans	-169.7	121.3	165.8	-101.7	179.8	176.3	-174.7	0	103.3
376	E	31.2	Very low	29.4	Very low	161 Å²	161	141.9 Å²	141.9	75%	0.752	74%	0.735	S	S	*	*	S	Bend	cis	-131.6	53.6	17.7	-65.6	166.7	124.4	0	0	112.5	N378	E376-N378 PolarHBondContact O-N 3.49Å
377	L	30.8	Very low	29.6	Very low	154 Å²	154	141.3 Å²	141.3	81%	0.806	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	51.9	171.3	-159.4	83.7	0	0	0	112.1
378	N	29.3	Very low	29.3	Very low	136 Å²	136	139.9 Å²	139.9	73%	0.727	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.7	-15.7	-175.8	-118.5	-11.7	0	0	0	113.8	E376	E376-N378 PolarHBondContact O-N 3.49Å
379	D	30	Very low	29.2	Very low	82 Å²	82	144.4 Å²	144.4	44%	0.439	73%	0.734	S	S	.	*	G	3₁₀ helix	trans	-84.9	-7	174.8	-98.1	-47.7	0	0	0	113.7	N381 R382	D379-N381 PolarHBondContact O-N 3.05Å; D379-R382 WeakPolarHBondContact O-CB 3.42Å; D379-R382 PolarHBondContact O-N 3.47Å; D379-R382 WeakPolarHBondContact OD1-CD 3.42Å; D379-R382 IonicContact OD1-CZ 2.65Å; D379-R382 IonicContact OD1-NE 2.66Å; D379-R382 IonicContact OD1-NH1 2.79Å; D379-R382 PolarHBondContact OD1-NH1 3.4Å; D379-R382 IonicContact OD2-NH1 3.83Å; D379-R382 PolarHBondContact OD2-NH1 2.89Å
380	E	30.7	Very low	29.5	Very low	169 Å²	169	143.6 Å²	143.6	79%	0.79	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-72.7	-5.3	176	-155.4	166	179.5	0	0	113.5
381	N	30.4	Very low	29.7	Very low	126 Å²	126	143.4 Å²	143.4	67%	0.674	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-86.9	-6.2	164.9	-87.5	-59.1	0	0	0	113.9	D379	D379-N381 PolarHBondContact O-N 3.05Å
382	R	27.8	Very low	30	Very low	171 Å²	171	143.7 Å²	143.7	65%	0.645	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-83.6	-12.9	-169.6	-163.3	162.6	171.7	-178.4	-3.9	114.9	D379 N384	D379-R382 WeakPolarHBondContact O-CB 3.42Å; D379-R382 PolarHBondContact O-N 3.47Å; D379-R382 WeakPolarHBondContact OD1-CD 3.42Å; D379-R382 IonicContact OD1-CZ 2.65Å; D379-R382 IonicContact OD1-NE 2.66Å; D379-R382 IonicContact OD1-NH1 2.79Å; D379-R382 PolarHBondContact OD1-NH1 3.4Å; D379-R382 IonicContact OD2-NH1 3.83Å; D379-R382 PolarHBondContact OD2-NH1 2.89Å; R382-N384 PolarHBondContact O-N 2.94Å
383	A	29.9	Very low	29.9	Very low	95 Å²	95	142.2 Å²	142.2	79%	0.785	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-66.4	-19.5	171.6	0	0	0	0	0	113.3
384	N	29.8	Very low	30.3	Very low	134 Å²	134	137.8 Å²	137.8	72%	0.717	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-99.1	13.5	-177.3	-72.8	-39.2	0	0	0	114.3	R382	R382-N384 PolarHBondContact O-N 2.94Å
385	S	28	Very low	30.5	Very low	72 Å²	72	137.8 Å²	137.8	50%	0.503	74%	0.739	S	S	.	*			trans	-112.4	1.7	-167.8	-148.2	0	0	0	0	116.3	T387	S385-T387 VanDerWaalsContact C-N 3.29Å; S385-T387 PolarHBondContact O-N 3.22Å
386	V	28.7	Very low	30.8	Very low	135 Å²	135	133.8 Å²	133.8	82%	0.818	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	41.6	179.6	-160.7	0	0	0	0	112.2
387	T	32.1	Very low	31.1	Very low	121 Å²	121	134.7 Å²	134.7	74%	0.742	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.9	-0.5	176.5	45.8	0	0	0	0	113.4	S385	S385-T387 VanDerWaalsContact C-N 3.29Å; S385-T387 PolarHBondContact O-N 3.22Å
388	N	29.1	Very low	31.4	Very low	123 Å²	123	135.1 Å²	135.1	66%	0.658	74%	0.741	S	S	*	*			trans	-113.2	8.1	-173.2	-95.4	-23.2	0	0	0	116	L390	N388-L390 PolarHBondContact O-N 3.4Å
389	Y	29.9	Very low	31.6	Very low	224 Å²	224	136 Å²	136	88%	0.878	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	60.7	174.5	-85	-82.2	0	0	0	112.8
390	L	32.5	Very low	31.7	Very low	165 Å²	165	138.3 Å²	138.3	86%	0.864	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.5	22.3	167.9	-117.6	173.6	0	0	0	114.5	N388	N388-L390 PolarHBondContact O-N 3.4Å
391	N	29.7	Very low	32	Very low	145 Å²	145	132.9 Å²	132.9	78%	0.775	76%	0.758	S	S	*	*			trans	-126.2	68.7	-178.2	-86.4	-29.9	0	0	0	112.3
392	T	36.7	Very low	32.3	Very low	147 Å²	147	131 Å²	131	90%	0.902	75%	0.754	S	S	*	*			trans	-144.2	138.1	160.3	-24.3	0	0	0	0	110.7
393	C	28.9	Very low	32.9	Very low	106 Å²	106	130.9 Å²	130.9	72%	0.716	76%	0.76	S	S	*	*			trans	-72.1	167.9	-177.4	-105	0	0	0	0	112.7
394	P	36.1	Very low	33.6	Very low	118 Å²	118	129.9 Å²	129.9	77%	0.766	75%	0.747	S	S	*	*			cis	-130.4	148.7	33.9	37.5	-20.1	0	0	0	119.1
395	T	30.2	Very low	34.1	Very low	124 Å²	124	132.8 Å²	132.8	76%	0.761	75%	0.748	S	S	*	*			trans	-43.4	130	162.4	47.9	0	0	0	0	115.4
396	S	34.7	Very low	35.2	Very low	102 Å²	102	134 Å²	134	71%	0.713	75%	0.748	S	S	*	*			trans	-156.9	118.6	147.5	38.7	0	0	0	0	112.2
397	H	37.2	Very low	36	Very low	180 Å²	180	134.1 Å²	134.1	83%	0.833	74%	0.737	S	S	*	*			trans	58	141.7	159.7	-64	-80.3	0	0	0	122.9
398	L	36.9	Very low	36.5	Very low	162 Å²	162	136.8 Å²	136.8	85%	0.848	73%	0.734	S	S	*	*			trans	90.3	108	157.8	-65.8	155.1	0	0	0	120.5
399	N	34.8	Very low	37.4	Very low	154 Å²	154	135.8 Å²	135.8	82%	0.824	73%	0.728	S	S	*	*			trans	57.6	90.3	158.4	-70.3	-1.9	0	0	0	120.3
400	S	31.9	Very low	38	Very low	132 Å²	132	133.2 Å²	133.2	92%	0.923	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	130	158.4	42.9	0	0	0	0	112.4
401	G	37.6	Very low	38.5	Very low	55 Å²	55	129.2 Å²	129.2	57%	0.567	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	163.7	-38.4	172.6	0	0	0	0	0	114.6
402	C	36.6	Very low	38.9	Very low	87 Å²	87	126.6 Å²	126.6	59%	0.588	68%	0.68	S	S	*	*	S	Bend	trans	-79.8	-37	-175.2	-162.7	0	0	0	0	113.7	S404 R405 I406	C402-S404 PolarHBondContact O-N 2.61Å; C402-R405 PolarHBondContact O-N 3.03Å; C402-I406 PolarHBondContact O-N 3.2Å
403	H	38.7	Very low	39.1	Very low	167 Å²	167	127.4 Å²	127.4	77%	0.773	67%	0.671	S	S	*	*	H	α-helix	trans	-67.6	-29.8	-169	-114.4	-104.4	0	0	0	115.2	K407	H403-K407 PolarHBondContact O-N 3.34Å
404	S	46.4	Very low	39.7	Very low	74 Å²	74	128.1 Å²	128.1	52%	0.517	66%	0.664	S	S	.	*	H	α-helix	trans	-70.5	-32.7	177.4	58.4	0	0	0	0	112.6	C402 R408	C402-S404 PolarHBondContact O-N 2.61Å; S404-R408 WeakPolarHBondContact O-CG 3.36Å; S404-R408 PolarHBondContact O-N 3.01Å
405	R	38.6	Very low	39.8	Very low	196 Å²	196	129.1 Å²	129.1	74%	0.74	66%	0.656	S	S	*	*	H	α-helix	trans	-74.7	-40.5	-177.7	-148.8	171.5	-169.9	168.5	2.4	111.5	C402 L409	C402-R405 PolarHBondContact O-N 3.03Å; R405-L409 WeakPolarHBondContact O-CB 3.35Å; R405-L409 WeakPolarHBondContact O-CG 3.49Å; R405-L409 PolarHBondContact O-N 3.41Å
406	I	51.3	Low	40.3	Very low	97 Å²	97	128.3 Å²	128.3	50%	0.497	65%	0.651	S	S	.	*	H	α-helix	trans	-68.9	-39	176.8	-63.4	175.2	0	0	0	111.3	C402 L409 R410	C402-I406 PolarHBondContact O-N 3.2Å; I406-L409 PolarHBondContact O-N 3.46Å; I406-R410 PolarHBondContact O-N 3.49Å
407	K	46	Very low	40.4	Very low	137 Å²	137	134.5 Å²	134.5	60%	0.596	66%	0.659	S	S	*	*	H	α-helix	trans	-64.7	-45.8	176.5	-162.7	178.2	178.6	179.9	0	112.1	H403 L409 R410 E411	H403-K407 PolarHBondContact O-N 3.34Å; K407-L409 VanDerWaalsContact C-N 3.33Å; K407-L409 PolarHBondContact O-N 3.02Å; K407-R410 PolarHBondContact O-N 3.09Å; K407-E411 WeakPolarHBondContact CE-OE1 3.38Å; K407-E411 WeakPolarHBondContact CG-OE1 3.49Å; K407-E411 WeakPolarHBondContact O-CG 3.39Å; K407-E411 PolarHBondContact O-N 3.37Å
408	R	43.7	Very low	40.3	Very low	178 Å²	178	130.7 Å²	130.7	67%	0.672	65%	0.652	S	S	*	*	H	α-helix	trans	-61.2	-37.1	172.6	-73.7	-178.1	-178.7	173.2	2.1	113	S404 N412	S404-R408 WeakPolarHBondContact O-CG 3.36Å; S404-R408 PolarHBondContact O-N 3.01Å; R408-N412 VanDerWaalsContact O-CB 3.31Å; R408-N412 WeakPolarHBondContact O-CB 3.37Å; R408-N412 VanDerWaalsContact O-CG 3.23Å; R408-N412 PolarHBondContact O-N 2.77Å
409	L	46.2	Very low	40.1	Very low	101 Å²	101	126.3 Å²	126.3	53%	0.529	64%	0.635	S	S	.	*	H	α-helix	trans	-65.9	-39.5	175.8	-80.9	166.1	0	0	0	112.4	R405 I406 K407 N412 F413	R405-L409 WeakPolarHBondContact O-CB 3.35Å; R405-L409 WeakPolarHBondContact O-CG 3.49Å; R405-L409 PolarHBondContact O-N 3.41Å; I406-L409 PolarHBondContact O-N 3.46Å; K407-L409 VanDerWaalsContact C-N 3.33Å; K407-L409 PolarHBondContact O-N 3.02Å; L409-N412 PolarHBondContact O-N 3.48Å; L409-F413 WeakPolarHBondContact O-CB 3.45Å; L409-F413 PolarHBondContact O-N 3.31Å
410	R	43.2	Very low	40	Very low	171 Å²	171	124.3 Å²	124.3	65%	0.645	63%	0.629	S	S	*	*	H	α-helix	trans	-62.6	-52.7	173.3	-177.3	-178.9	-68.1	-112.7	3.2	111.4	I406 K407 N412 F413 E414	I406-R410 PolarHBondContact O-N 3.49Å; K407-R410 PolarHBondContact O-N 3.09Å; R410-N412 PolarHBondContact O-N 2.97Å; R410-F413 PolarHBondContact O-N 3.22Å; R410-E414 WeakPolarHBondContact CG-OE2 3.37Å; R410-E414 PolarHBondContact O-N 2.95Å
411	E	43.2	Very low	39.9	Very low	80 Å²	80	127.2 Å²	127.2	37%	0.374	62%	0.621	S	S	.	*	H	α-helix	trans	-59.5	-33.5	179.1	-70.3	170.8	-158.5	0	0	112.6	K407 K415	K407-E411 WeakPolarHBondContact CE-OE1 3.38Å; K407-E411 WeakPolarHBondContact CG-OE1 3.49Å; K407-E411 WeakPolarHBondContact O-CG 3.39Å; K407-E411 PolarHBondContact O-N 3.37Å; E411-K415 WeakPolarHBondContact O-CB 3.48Å; E411-K415 WeakPolarHBondContact O-CD 3.41Å; E411-K415 VanDerWaalsContact O-CG 3.23Å; E411-K415 WeakPolarHBondContact O-CG 3.43Å; E411-K415 PolarHBondContact O-N 3.43Å; E411-K415 VanDerWaalsContact O-N 3.15Å
412	N	38.4	Very low	39.5	Very low	91 Å²	91	129.9 Å²	129.9	49%	0.487	63%	0.626	S	S	.	*	H	α-helix	trans	-74.5	-36.5	173.3	-74.5	-9.5	0	0	0	112.8	R408 L409 R410 K415 T416	R408-N412 VanDerWaalsContact O-CB 3.31Å; R408-N412 WeakPolarHBondContact O-CB 3.37Å; R408-N412 VanDerWaalsContact O-CG 3.23Å; R408-N412 PolarHBondContact O-N 2.77Å; L409-N412 PolarHBondContact O-N 3.48Å; R410-N412 PolarHBondContact O-N 2.97Å; N412-K415 PolarHBondContact O-N 3.15Å; N412-T416 WeakPolarHBondContact O-CB 3.42Å; N412-T416 PolarHBondContact O-N 3.14Å; N412-T416 PolarHBondContact O-OG1 2.89Å
413	F	40.7	Very low	39.2	Very low	163 Å²	163	136.4 Å²	136.4	72%	0.715	64%	0.639	S	S	*	*	H	α-helix	trans	-64.8	-42.6	175.4	-115.7	-95.5	0	0	0	112	L409 R410 T416 R417	L409-F413 WeakPolarHBondContact O-CB 3.45Å; L409-F413 PolarHBondContact O-N 3.31Å; R410-F413 PolarHBondContact O-N 3.22Å; F413-T416 PolarHBondContact O-N 3.49Å; F413-R417 PolarHBondContact O-N 2.93Å
414	E	41.3	Very low	38.7	Very low	122 Å²	122	136.7 Å²	136.7	57%	0.57	64%	0.638	S	S	*	*	H	α-helix	trans	-66.4	-41.4	175.3	-84.4	164.5	133.5	0	0	111.9	R410 T416 R417 S418	R410-E414 WeakPolarHBondContact CG-OE2 3.37Å; R410-E414 PolarHBondContact O-N 2.95Å; E414-T416 VanDerWaalsContact C-N 3.3Å; E414-T416 PolarHBondContact O-N 3.45Å; E414-R417 PolarHBondContact O-N 2.7Å; E414-S418 PolarHBondContact O-N 3.24Å
415	K	38.2	Very low	38.2	Very low	138 Å²	138	137.7 Å²	137.7	60%	0.6	64%	0.643	S	S	*	*	H	α-helix	trans	-62.2	-34.6	172.6	-75	168	-175.1	166.5	0	113.1	E411 N412 R417 S418	E411-K415 WeakPolarHBondContact O-CB 3.48Å; E411-K415 WeakPolarHBondContact O-CD 3.41Å; E411-K415 VanDerWaalsContact O-CG 3.23Å; E411-K415 WeakPolarHBondContact O-CG 3.43Å; E411-K415 PolarHBondContact O-N 3.43Å; E411-K415 VanDerWaalsContact O-N 3.15Å; N412-K415 PolarHBondContact O-N 3.15Å; K415-R417 VanDerWaalsContact C-N 3.27Å; K415-R417 PolarHBondContact O-N 2.91Å; K415-S418 PolarHBondContact O-N 3.41Å
416	T	39.7	Very low	37.9	Very low	108 Å²	108	134.8 Å²	134.8	66%	0.663	65%	0.647	S	S	*	*	H	α-helix	trans	-71.7	-20.3	178.9	-54.2	0	0	0	0	112.7	N412 F413 E414	N412-T416 WeakPolarHBondContact O-CB 3.42Å; N412-T416 PolarHBondContact O-N 3.14Å; N412-T416 PolarHBondContact O-OG1 2.89Å; F413-T416 PolarHBondContact O-N 3.49Å; E414-T416 VanDerWaalsContact C-N 3.3Å; E414-T416 PolarHBondContact O-N 3.45Å
417	R	38.5	Very low	37.1	Very low	232 Å²	232	141 Å²	141	88%	0.875	66%	0.664	S	S	*	*	H	α-helix	trans	-92	-9.5	178.3	-139	176.8	-169.8	-175.8	2.8	114.4	F413 E414 K415	F413-R417 PolarHBondContact O-N 2.93Å; E414-R417 PolarHBondContact O-N 2.7Å; K415-R417 VanDerWaalsContact C-N 3.27Å; K415-R417 PolarHBondContact O-N 2.91Å
418	S	34.7	Very low	36.5	Very low	99 Å²	99	142 Å²	142	69%	0.692	68%	0.676	S	S	*	*	S	Bend	trans	-114	5.9	-177.8	-65.6	0	0	0	0	114.7	E414 K415 T420	E414-S418 PolarHBondContact O-N 3.24Å; K415-S418 PolarHBondContact O-N 3.41Å; S418-T420 PolarHBondContact O-N 3.09Å
419	S	32.5	Very low	35.9	Very low	70 Å²	70	142.3 Å²	142.3	49%	0.49	69%	0.687	S	S	.	*			trans	-79	65.4	178.8	68.2	0	0	0	0	112.8	Y421	S419-Y421 PolarHBondContact O-N 3.39Å
420	T	32.4	Very low	35.1	Very low	112 Å²	112	141.2 Å²	141.2	69%	0.687	70%	0.701	S	S	*	*			trans	-58.9	116.6	162.8	-59.2	0	0	0	0	108.2	S418 T422	S418-T420 PolarHBondContact O-N 3.09Å; T420-T422 HydrophobicContact CG2-CG2 4.03Å; T420-T422 PolarHBondContact O-N 3.32Å; T420-T422 PolarHBondContact O-OG1 2.91Å
421	Y	30.2	Very low	34.4	Very low	193 Å²	193	136.7 Å²	136.7	76%	0.757	71%	0.707	S	S	*	*			trans	-71.8	73.6	-178.7	-81.6	-81	0	0	0	112.2	S419 W423	S419-Y421 PolarHBondContact O-N 3.39Å; Y421-W423 AromaticContact CD1-NE1 4Å; Y421-W423 PolarHBondContact O-N 3.04Å
422	T	29.8	Very low	33.8	Very low	112 Å²	112	140.5 Å²	140.5	69%	0.687	73%	0.729	S	S	*	*			trans	-75.6	70.8	174.1	45.7	0	0	0	0	111.4	T420 K424	T420-T422 HydrophobicContact CG2-CG2 4.03Å; T420-T422 PolarHBondContact O-N 3.32Å; T420-T422 PolarHBondContact O-OG1 2.91Å; T422-K424 VanDerWaalsContact C-N 3.31Å; T422-K424 PolarHBondContact O-N 3.43Å
423	W	28.9	Very low	33.4	Very low	223 Å²	223	143.7 Å²	143.7	85%	0.845	75%	0.745	S	S	*	*			trans	-64	91.1	166.1	-76.8	93.3	0	0	0	110	Y421 P425	Y421-W423 AromaticContact CD1-NE1 4Å; Y421-W423 PolarHBondContact O-N 3.04Å; W423-P425 VanDerWaalsContact O-CD 3.27Å; W423-P425 WeakPolarHBondContact O-CD 3.5Å
424	K	27.9	Very low	32.9	Very low	173 Å²	173	144.9 Å²	144.9	75%	0.752	75%	0.753	S	S	*	*			trans	-82.6	112.2	164.5	-79.7	-168.1	172.6	-171.2	0	109.3	T422 T426	T422-K424 VanDerWaalsContact C-N 3.31Å; T422-K424 PolarHBondContact O-N 3.43Å; K424-T426 PolarHBondContact O-N 2.91Å
425	P	37	Very low	32.3	Very low	96 Å²	96	143.8 Å²	143.8	62%	0.623	76%	0.759	S	S	*	*			trans	-78.1	105.2	165.7	31.5	-31.1	0	0	0	109.1	W423 W427	W423-P425 VanDerWaalsContact O-CD 3.27Å; W423-P425 WeakPolarHBondContact O-CD 3.5Å; P425-W427 PolarHBondContact O-N 3.39Å
426	T	32.9	Very low	31.9	Very low	135 Å²	135	147.8 Å²	147.8	83%	0.828	77%	0.77	S	S	*	*			trans	-77.5	98.7	168.1	46.7	0	0	0	0	109.2	K424	K424-T426 PolarHBondContact O-N 2.91Å
427	W	33	Very low	31.4	Very low	227 Å²	227	148.1 Å²	148.1	86%	0.86	77%	0.772	S	S	*	*			trans	-77.6	124.9	171.4	-65.3	93.5	0	0	0	110.1	P425	P425-W427 PolarHBondContact O-N 3.39Å
428	N	34.7	Very low	30.9	Very low	159 Å²	159	145 Å²	145	85%	0.85	77%	0.773	S	S	*	*			trans	-139.7	125	163.1	-112.9	1.5	0	0	0	108.8
429	M	30.1	Very low	30.8	Very low	184 Å²	184	148.8 Å²	148.8	91%	0.906	78%	0.78	S	S	*	*			trans	35.9	119.1	159.7	-66.6	-66.4	-173.2	0	0	121.2
430	G	29	Very low	30.8	Very low	78 Å²	78	154.8 Å²	154.8	80%	0.804	80%	0.8	S	S	*	*				82.1	137.8	115.9	0	0	0	0	0	119.8
431	G	30.2	Very low	30.6	Very low	76 Å²	76	157.4 Å²	157.4	78%	0.784	80%	0.804	S	S	*	*			trans	96	93.6	-176.4	0	0	0	0	0	110.9
432	L	30.2	Very low	30.7	Very low	160 Å²	160	154.1 Å²	154.1	84%	0.838	81%	0.807	S	S	*	*			cis	72.6	111.8	43.1	-158.1	149.4	0	0	0	112.3
433	L	29	Very low	30.7	Very low	157 Å²	157	156.2 Å²	156.2	82%	0.822	81%	0.813	S	S	*	*			trans	30.8	112.8	178	-85.7	66.1	0	0	0	118
434	E	31	Very low	30.9	Very low	189 Å²	189	150.6 Å²	150.6	88%	0.883	81%	0.814	S	S	*	*				-145.2	156.6	127.2	-165.2	48	-88.2	0	0	109.6
435	S	27.5	Very low	31.1	Very low	99 Å²	99	148 Å²	148	69%	0.692	81%	0.813	S	S	*	*			trans	-116.8	172.4	-174.5	-167.6	0	0	0	0	112.5
436	R	31	Very low	31	Very low	222 Å²	222	150.2 Å²	150.2	84%	0.838	83%	0.825	S	S	*	*			trans	82.9	125.9	156.8	-146.9	177.3	-176.2	125.2	2.6	118.3
437	T	29	Very low	30.9	Very low	114 Å²	114	152.7 Å²	152.7	70%	0.699	82%	0.819	S	S	*	*			trans	43.3	122.4	153.8	52.9	0	0	0	0	121.1
438	D	28.8	Very low	31	Very low	166 Å²	166	150.2 Å²	150.2	89%	0.888	82%	0.821	S	S	*	*				-150	132.8	119.9	-93.9	-34.1	0	0	0	109.7
439	E	31.1	Very low	30.9	Very low	179 Å²	179	148.3 Å²	148.3	84%	0.836	82%	0.82	S	S	*	*			trans	-116.1	129.2	165.9	-95.7	-158.5	111.1	0	0	108.8
440	E	33.6	Very low	31.1	Very low	197 Å²	197	143.3 Å²	143.3	92%	0.921	82%	0.815	S	S	*	*			trans	-118.9	116.6	166	-79	-162.9	118.1	0	0	110.7
441	Q	27.5	Very low	31.3	Very low	166 Å²	166	145 Å²	145	78%	0.776	82%	0.815	S	S	*	*			trans	-108	134.7	159.5	-70.3	-170.5	3.9	0	0	110
442	P	33.2	Very low	31.6	Very low	125 Å²	125	148.4 Å²	148.4	81%	0.812	82%	0.815	S	S	*	*			trans	-104.8	125.1	162	32.6	-24.3	0	0	0	111.8
443	L	29.2	Very low	31.7	Very low	156 Å²	156	144.8 Å²	144.8	82%	0.817	80%	0.803	S	S	*	*			trans	-64	153.7	-173.7	-66.3	82.9	0	0	0	115.3
444	A	33.7	Very low	31.9	Very low	105 Å²	105	147.7 Å²	147.7	87%	0.868	80%	0.803	S	S	*	*			trans	-153.7	125.8	136.8	0	0	0	0	0	111.2
445	T	31.8	Very low	32	Very low	119 Å²	119	144.3 Å²	144.3	73%	0.73	80%	0.796	S	S	*	*			trans	-94.4	154.6	-174.8	-50.8	0	0	0	0	112.6
446	T	34.2	Very low	32.3	Very low	142 Å²	142	148.7 Å²	148.7	87%	0.871	80%	0.803	S	S	*	*			trans	-144	138.7	154.9	-43.5	0	0	0	0	110.8
447	R	30.7	Very low	32.5	Very low	186 Å²	186	145 Å²	145	70%	0.702	80%	0.795	S	S	*	*			trans	-75.7	139.3	-172.8	-61.2	169.1	173.9	149.5	-8.4	112.3	D509	R447-D509 IonicContact CZ-OD1 2.78Å; R447-D509 IonicContact CZ-OD2 3.88Å; R447-D509 IonicContact NH1-OD1 3.83Å; R447-D509 PolarHBondContact NH1-OD1 2.8Å; R447-D509 IonicContact NH1-OD2 3.25Å; R447-D509 PolarHBondContact NH1-OD2 2.97Å; R447-D509 VanDerWaalsContact NH1-OD2 3.13Å; R447-D509 IonicContact NH2-OD1 2.83Å; R447-D509 IonicContact NH2-OD2 3.67Å; R447-D509 PolarHBondContact NH2-OD2 3.42Å
448	I	35.9	Very low	32.9	Very low	176 Å²	176	145.2 Å²	145.2	90%	0.903	80%	0.795	S	S	*	*			trans	-132.7	128.7	137.9	-61.1	-176.9	0	0	0	106.3
449	S	31.6	Very low	33.6	Very low	118 Å²	118	142.6 Å²	142.6	83%	0.825	79%	0.788	S	S	*	*			trans	-109.4	145.8	173.2	-170.3	0	0	0	0	109.5
450	G	35.2	Very low	33.9	Very low	79 Å²	79	141.7 Å²	141.7	81%	0.814	79%	0.789	S	S	*	*			trans	-171.8	84.1	-177	0	0	0	0	0	109.8
451	S	33.1	Very low	34.2	Very low	113 Å²	113	136.3 Å²	136.3	79%	0.79	78%	0.778	S	S	*	*			trans	-75.5	136.6	178.5	53.6	0	0	0	0	112
452	D	36.1	Very low	34.6	Very low	148 Å²	148	135.9 Å²	135.9	79%	0.791	78%	0.78	S	S	*	*			trans	-152.3	165.9	134.8	-143.7	-26.3	0	0	0	111.2
453	S	33.5	Very low	34.9	Very low	85 Å²	85	134.8 Å²	134.8	59%	0.594	77%	0.773	S	S	*	*			trans	-132.8	132.6	-158.4	60.6	0	0	0	0	114.5
454	R	32.6	Very low	35.2	Very low	217 Å²	217	133.1 Å²	133.1	82%	0.819	77%	0.769	S	S	*	*			trans	174.1	117.2	149.2	-98.6	155.3	-79	-165.2	-2.9	107.8
455	V	32.7	Very low	35.3	Very low	119 Å²	119	134.9 Å²	134.9	72%	0.721	76%	0.763	S	S	*	*				69.9	93.1	70.2	177.8	0	0	0	0	112.8
456	F	33.4	Very low	35.6	Very low	191 Å²	191	135.1 Å²	135.1	84%	0.838	76%	0.764	S	S	*	*			trans	-153.5	116	135.1	-99.3	-89	0	0	0	104.5
457	H	36.4	Very low	35.6	Very low	145 Å²	145	133.9 Å²	133.9	67%	0.671	75%	0.752	S	S	*	*				61.3	126.9	92.4	-80.4	-73.6	0	0	0	114.8
458	T	37.1	Very low	35.6	Very low	117 Å²	117	132.5 Å²	132.5	72%	0.718	75%	0.751	S	S	*	*			cis	-161	150.1	-18.1	-7.5	0	0	0	0	107.4
459	P	42.4	Very low	35.4	Very low	111 Å²	111	131 Å²	131	72%	0.721	74%	0.744	S	S	*	*			trans	-101.5	165.4	-178.9	39.2	-33.4	0	0	0	113.6
460	D	38	Very low	35.4	Very low	161 Å²	161	131.7 Å²	131.7	86%	0.861	74%	0.744	S	S	*	*			trans	-144.7	122.4	151.5	-90.4	-49.5	0	0	0	106.3
461	A	40.7	Very low	35	Very low	84 Å²	84	137.1 Å²	137.1	69%	0.694	75%	0.745	S	S	*	*				84.4	141.3	73.2	0	0	0	0	0	112
462	L	35.9	Very low	35	Very low	156 Å²	156	138.9 Å²	138.9	82%	0.817	74%	0.744	S	S	*	*			cis	-144.5	154.7	14.2	-157.9	138.8	0	0	0	110.9
463	P	38.6	Very low	34.8	Very low	103 Å²	103	138.2 Å²	138.2	67%	0.669	75%	0.746	S	S	*	*			trans	-116.4	-139.9	-164.6	42.7	-30.3	0	0	0	114
464	T	35.9	Very low	34.8	Very low	120 Å²	120	138.3 Å²	138.3	74%	0.736	75%	0.752	S	S	*	*			trans	79	152.2	174.3	71.8	0	0	0	0	116.5
465	I	36.1	Very low	34.8	Very low	143 Å²	143	136 Å²	136	73%	0.733	75%	0.75	S	S	*	*			cis	-149.1	126.6	-0.4	-128	154.5	0	0	0	108.4
466	V	37.2	Very low	34.8	Very low	123 Å²	123	136 Å²	136	75%	0.745	75%	0.746	S	S	*	*				77.5	121.4	99.2	173.4	0	0	0	0	118
467	D	33.5	Very low	35	Very low	116 Å²	116	133.1 Å²	133.1	62%	0.62	74%	0.744	S	S	*	*			trans	58.3	116.4	152.3	-81.6	-3	0	0	0	126.6
468	K	32.4	Very low	34.9	Very low	157 Å²	157	131.7 Å²	131.7	68%	0.683	75%	0.748	S	S	*	*				63	138.9	120.8	-62.3	-179.1	-174.8	80.9	0	123.3
469	N	31.1	Very low	34.5	Very low	144 Å²	144	134.8 Å²	134.8	77%	0.77	75%	0.754	S	S	*	*			trans	97.9	140	149.7	-63.5	-20.4	0	0	0	120.9
470	T	32.2	Very low	34	Very low	134 Å²	134	136.9 Å²	136.9	82%	0.822	76%	0.758	S	S	*	*			trans	63.3	96	158.3	21.8	0	0	0	0	120.9
471	K	26.8	Very low	33.6	Very low	192 Å²	192	133.6 Å²	133.6	84%	0.835	75%	0.747	S	S	*	*				44.1	157.7	107.2	-147.5	176.8	-175.6	-177.4	0	120.3
472	I	31.9	Very low	33.1	Very low	151 Å²	151	136.8 Å²	136.8	77%	0.774	75%	0.751	S	S	*	*			trans	71.3	143.6	175.5	-18.2	177.6	0	0	0	111.4
473	T	32.2	Very low	32.9	Very low	134 Å²	134	137.3 Å²	137.3	82%	0.822	75%	0.749	S	S	*	*			cis	-145.4	160.6	15.5	-40.2	0	0	0	0	113.7
474	A	32.9	Very low	32.3	Very low	87 Å²	87	141 Å²	141	72%	0.719	76%	0.757	S	S	*	*			trans	-57.3	170.6	-175.3	0	0	0	0	0	120.6
475	E	33.5	Very low	32.2	Very low	167 Å²	167	143.3 Å²	143.3	78%	0.78	77%	0.765	S	S	*	*				-145.7	139.3	119.7	-98.7	-156.5	108.3	0	0	112.4
476	N	33.5	Very low	32.1	Very low	120 Å²	120	145 Å²	145	64%	0.642	77%	0.77	S	S	*	*			trans	46.2	110.7	152.7	-45.9	-32.6	0	0	0	120.2
477	V	36.8	Very low	31.9	Very low	131 Å²	131	146 Å²	146	79%	0.794	77%	0.771	S	S	*	*			cis	77.6	141.3	38	-175.5	0	0	0	0	113.3
478	P	34.4	Very low	31.9	Very low	115 Å²	115	146.2 Å²	146.2	75%	0.747	78%	0.777	S	S	*	*			cis	-113.6	175.1	-2.5	38.1	-23.8	0	0	0	113.4
479	Q	27.5	Very low	31.8	Very low	181 Å²	181	142.4 Å²	142.4	85%	0.846	78%	0.783	S	S	*	*			cis	90.8	109.5	10	-133.6	-165.3	21.9	0	0	120.2
480	I	32.4	Very low	31.9	Very low	156 Å²	156	145.5 Å²	145.5	80%	0.8	79%	0.789	S	S	*	*			trans	-147.8	125.5	159.7	-67.4	-179.1	0	0	0	104.2
481	S	29.4	Very low	31.8	Very low	91 Å²	91	144.1 Å²	144.1	64%	0.636	79%	0.785	S	S	*	*			cis	93.8	126.3	20.9	81.8	0	0	0	0	115
482	I	31.6	Very low	31.9	Very low	152 Å²	152	141 Å²	141	78%	0.779	78%	0.782	S	S	*	*			cis	-103.1	-129	2	-29.6	-175.5	0	0	0	109.6
483	E	31.2	Very low	31.8	Very low	166 Å²	166	142.9 Å²	142.9	78%	0.776	78%	0.784	S	S	*	*			cis	-156.9	164.9	-3.2	-151.7	152.8	-79.5	0	0	109.4
484	E	26.2	Very low	31.5	Very low	180 Å²	180	144.3 Å²	144.3	84%	0.841	79%	0.785	S	S	*	*			trans	-120.8	154.9	179.8	-68.3	176.5	110.6	0	0	112.6
485	N	32.7	Very low	31.4	Very low	169 Å²	169	145.7 Å²	145.7	90%	0.904	79%	0.79	S	S	*	*			trans	-164.6	162.5	136.7	-115.9	-74.6	0	0	0	113.4
486	E	34	Very low	31.3	Very low	178 Å²	178	140.8 Å²	140.8	83%	0.832	78%	0.784	S	S	*	*			trans	-99.4	168.3	-165.1	-56.6	-175.5	100.3	0	0	115.7
487	D	33.3	Very low	31.2	Very low	144 Å²	144	143.3 Å²	143.3	77%	0.77	80%	0.795	S	S	*	*			trans	88.7	158.5	133.2	-142.1	8.1	0	0	0	123.3
488	T	34.7	Very low	30.7	Very low	121 Å²	121	145.7 Å²	145.7	74%	0.742	80%	0.795	S	S	*	*			trans	75.3	73.3	166.8	67.6	0	0	0	0	118.7
489	G	29.1	Very low	30.5	Very low	78 Å²	78	149.3 Å²	149.3	80%	0.804	80%	0.802	S	S	*	*			trans	-64.5	169.3	176	0	0	0	0	0	117.9
490	K	33	Very low	30.5	Very low	209 Å²	209	148.2 Å²	148.2	91%	0.909	80%	0.797	S	S	*	*			trans	-124	94	164	-85.7	179.1	179.1	166.5	0	112.5
491	S	30.8	Very low	30.4	Very low	105 Å²	105	147 Å²	147	73%	0.734	79%	0.788	S	S	*	*				60.8	110.3	118.8	-157.7	0	0	0	0	120.6
492	V	29.6	Very low	30.3	Very low	127 Å²	127	151.1 Å²	151.1	77%	0.77	79%	0.79	S	S	*	*			trans	74.5	131.1	133	171.3	0	0	0	0	117.2
493	K	28.6	Very low	30.2	Very low	190 Å²	190	152.8 Å²	152.8	83%	0.826	79%	0.791	S	S	*	*			cis	-141.2	140.6	29.1	-157.7	159.5	-174.1	173.1	0	113.9
494	I	27.1	Very low	30	Very low	163 Å²	163	149.9 Å²	149.9	84%	0.836	79%	0.789	S	S	*	*			trans	-121	148.6	177.8	-63.6	167.9	0	0	0	109.1
495	S	30	Very low	30.5	Very low	117 Å²	117	147 Å²	147	82%	0.818	79%	0.786	S	S	*	*			trans	164.8	154.1	141.7	41.6	0	0	0	0	113.1
496	G	31.3	Very low	30.6	Very low	63 Å²	63	144.4 Å²	144.4	65%	0.649	78%	0.779	S	S	*	*			trans	114.4	60.8	175.7	0	0	0	0	0	114.5
497	I	31.7	Very low	30.2	Very low	173 Å²	173	142.1 Å²	142.1	89%	0.887	78%	0.777	S	S	*	*				98.3	149.3	81.1	-74.1	166.8	0	0	0	111.6
498	K	25.2	Very low	30	Very low	182 Å²	182	142 Å²	142	79%	0.791	78%	0.775	S	S	*	*			trans	-93.9	148.8	-169.9	-56.2	171.4	177.7	177.7	0	112.5
499	E	31.2	Very low	29.8	Very low	190 Å²	190	140.7 Å²	140.7	89%	0.888	76%	0.764	S	S	*	*			trans	179.4	132.8	130.9	-96.7	163.9	143.5	0	0	106.5
500	Q	26.8	Very low	29.9	Very low	158 Å²	158	144 Å²	144	74%	0.738	76%	0.763	S	S	*	*			cis	80.5	130.9	30.8	-171.3	160.7	-7	0	0	113.8
501	E	30.3	Very low	29.8	Very low	132 Å²	132	142.4 Å²	142.4	62%	0.617	76%	0.759	S	S	*	*			trans	67.4	160.2	-177.9	-57.4	-81.8	120.7	0	0	115.9
502	R	26.9	Very low	29.8	Very low	177 Å²	177	145 Å²	145	67%	0.668	76%	0.763	S	S	*	*			cis	-162.2	170.4	-44.2	-160.3	-174	-74.6	-147.5	4	107.9
503	F	30.8	Very low	30	Very low	186 Å²	186	143.3 Å²	143.3	82%	0.816	76%	0.762	S	S	*	*			trans	78.2	155.6	161.1	-85.2	-73	0	0	0	121.2
504	S	27.2	Very low	30.2	Very low	105 Å²	105	141.7 Å²	141.7	73%	0.734	76%	0.762	S	S	*	*			trans	-120.5	155.3	-168	-39.1	0	0	0	0	111.5
505	P	36.3	Very low	30.4	Very low	119 Å²	119	142.3 Å²	142.3	77%	0.773	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-80.9	156.3	155.4	34.3	-31.2	0	0	0	110.9
506	P	34.1	Very low	30.7	Very low	115 Å²	115	143.9 Å²	143.9	75%	0.747	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-84.9	150.2	-156.4	31.8	-37.1	0	0	0	115.8
507	T	27	Very low	30.9	Very low	131 Å²	131	146.4 Å²	146.4	80%	0.804	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-76.7	129.4	154.3	-54.3	0	0	0	0	109.1
508	L	29.1	Very low	31.1	Very low	140 Å²	140	144 Å²	144	73%	0.733	74%	0.741	S	S	*	*			trans	-146.2	87.4	168.6	-124.2	165.6	0	0	0	108.5	L510	L508-L510 HydrophobicContact CD2-CD1 4.46Å; L508-L510 PolarHBondContact O-N 3.45Å; L508-L510 VanDerWaalsContact O-N 3.16Å
509	D	30.1	Very low	31.7	Very low	95 Å²	95	140.8 Å²	140.8	51%	0.508	74%	0.736	S	S	.	*			trans	-67.2	104.8	169.4	-103.1	-44.1	0	0	0	107.4	R447 Q511	R447-D509 IonicContact CZ-OD1 2.78Å; R447-D509 IonicContact CZ-OD2 3.88Å; R447-D509 IonicContact NH1-OD1 3.83Å; R447-D509 PolarHBondContact NH1-OD1 2.8Å; R447-D509 IonicContact NH1-OD2 3.25Å; R447-D509 PolarHBondContact NH1-OD2 2.97Å; R447-D509 VanDerWaalsContact NH1-OD2 3.13Å; R447-D509 IonicContact NH2-OD1 2.83Å; R447-D509 IonicContact NH2-OD2 3.67Å; R447-D509 PolarHBondContact NH2-OD2 3.42Å; D509-Q511 PolarHBondContact O-N 3.48Å; D509-Q511 VanDerWaalsContact O-N 3.13Å
510	L	31.3	Very low	31.8	Very low	148 Å²	148	138.5 Å²	138.5	78%	0.775	73%	0.73	S	S	*	*			trans	-85.5	78.5	177.7	-152	86.7	0	0	0	110.3	L508	L508-L510 HydrophobicContact CD2-CD1 4.46Å; L508-L510 PolarHBondContact O-N 3.45Å; L508-L510 VanDerWaalsContact O-N 3.16Å
511	Q	31	Very low	32.3	Very low	175 Å²	175	137.7 Å²	137.7	82%	0.818	73%	0.731	S	S	*	*			trans	-84.3	112.4	167	-77.3	-164.5	-47.7	0	0	110.3	D509 A513	D509-Q511 PolarHBondContact O-N 3.48Å; D509-Q511 VanDerWaalsContact O-N 3.13Å; Q511-A513 PolarHBondContact O-N 2.92Å
512	I	30.5	Very low	32.5	Very low	160 Å²	160	137.6 Å²	137.6	82%	0.821	73%	0.733	S	S	*	*			trans	-74.3	117.5	165.6	-61.4	170.8	0	0	0	107.3
513	A	33.3	Very low	33	Very low	91 Å²	91	137.9 Å²	137.9	75%	0.752	74%	0.742	S	S	*	*			trans	-137.7	143.7	168.2	0	0	0	0	0	108.2	Q511	Q511-A513 PolarHBondContact O-N 2.92Å
514	D	33.7	Very low	33.1	Very low	156 Å²	156	137.7 Å²	137.7	83%	0.834	74%	0.741	S	S	*	*			trans	-74.9	153.9	-167	-79.9	-67.5	0	0	0	115.2
515	K	31.8	Very low	33.3	Very low	176 Å²	176	139.6 Å²	139.6	77%	0.765	75%	0.748	S	S	*	*			trans	93.6	138.2	134.7	-108.6	176.2	172	-172.3	0	122
516	H	35.5	Very low	33.2	Very low	149 Å²	149	138.9 Å²	138.9	69%	0.69	74%	0.743	S	S	*	*			trans	90.5	130.6	153.2	-84.3	-75.5	0	0	0	121.6
517	D	35.8	Very low	33.2	Very low	116 Å²	116	140.6 Å²	140.6	62%	0.62	75%	0.745	S	S	*	*			trans	68.5	98.9	149.3	-74.7	39.8	0	0	0	122.7
518	N	34.5	Very low	33.7	Very low	124 Å²	124	141.5 Å²	141.5	66%	0.663	74%	0.744	S	S	*	*				75.7	139.7	109.5	-64.2	-27	0	0	0	122.6
519	T	38.7	Very low	33.8	Very low	114 Å²	114	139.3 Å²	139.3	70%	0.699	74%	0.74	S	S	*	*			trans	63.1	98.1	150.5	49	0	0	0	0	120.5
520	D	33.9	Very low	33.9	Very low	142 Å²	142	140.6 Å²	140.6	76%	0.759	75%	0.754	S	S	*	*				62.5	155.6	108.4	-51.2	-31.5	0	0	0	123.5
521	D	36.6	Very low	33.8	Very low	140 Å²	140	140.7 Å²	140.7	75%	0.749	75%	0.754	S	S	*	*			trans	62.2	113.1	168	-63.3	-24.5	0	0	0	119.7
522	I	33.8	Very low	34	Very low	130 Å²	130	140 Å²	140	67%	0.667	75%	0.754	S	S	*	*				84.1	122.2	60.7	-71.2	176	0	0	0	113.7
523	H	38.4	Very low	33.8	Very low	183 Å²	183	139 Å²	139	85%	0.847	75%	0.751	S	S	*	*			trans	150.9	110.1	151.9	-89.4	-71.8	0	0	0	108.7
524	K	32.1	Very low	33.9	Very low	183 Å²	183	141.9 Å²	141.9	80%	0.796	75%	0.752	S	S	*	*			cis	94.5	101.1	18.5	-158	-177.4	-172.4	178.2	0	115.2
525	T	32.3	Very low	33.7	Very low	144 Å²	144	142.3 Å²	142.3	88%	0.883	75%	0.749	S	S	*	*			trans	-135.7	126.1	165.5	7.4	0	0	0	0	109.4
526	P	34.8	Very low	33.5	Very low	105 Å²	105	138 Å²	138	68%	0.682	74%	0.741	S	S	*	*			trans	-105	179.1	-175.9	39.8	-34.3	0	0	0	113.3
527	L	32.8	Very low	33.2	Very low	151 Å²	151	139.6 Å²	139.6	79%	0.791	75%	0.749	S	S	*	*				171.4	130.3	123.2	-87.7	167	0	0	0	114
528	I	37.2	Very low	33.2	Very low	149 Å²	149	139.9 Å²	139.9	76%	0.764	75%	0.754	S	S	*	*			trans	75.8	120.7	140.1	-69.3	174.1	0	0	0	122.8
529	S	31	Very low	33.3	Very low	94 Å²	94	141.1 Å²	141.1	66%	0.657	76%	0.756	S	S	*	*			trans	-55.7	174.6	158.8	42.6	0	0	0	0	115.4
530	P	33.1	Very low	33.3	Very low	123 Å²	123	145.6 Å²	145.6	80%	0.799	77%	0.769	S	S	*	*			cis	-118.1	154.2	25.9	40.3	-26.4	0	0	0	115.2
531	L	29.5	Very low	33.5	Very low	149 Å²	149	144.2 Å²	144.2	78%	0.78	77%	0.766	S	S	*	*			cis	76.6	92.7	40.4	-162.9	161.7	0	0	0	113.3
532	I	34.9	Very low	33.9	Very low	160 Å²	160	141 Å²	141	82%	0.821	76%	0.758	S	S	*	*			trans	-148.5	135.2	154	-97.5	163.6	0	0	0	105.9
533	N	26.3	Very low	34.7	Very low	139 Å²	139	139 Å²	139	74%	0.743	75%	0.749	S	S	*	*			trans	-83.2	150.5	168.3	-78.1	2.9	0	0	0	110
534	I	36.1	Very low	35.4	Very low	153 Å²	153	136.2 Å²	136.2	79%	0.785	74%	0.741	S	S	*	*			trans	170.4	103.1	142.9	-90.5	151.7	0	0	0	104.4
535	E	28	Very low	36.5	Very low	165 Å²	165	130.5 Å²	130.5	77%	0.771	72%	0.724	S	S	*	*				92.9	144.3	79	-146.7	84.5	-169.8	0	0	110.9
536	S	28.7	Very low	37.9	Very low	85 Å²	85	129.5 Å²	129.5	59%	0.594	71%	0.709	S	S	*	*			trans	48.1	112.5	159.7	58.8	0	0	0	0	120.9
537	E	29.2	Very low	39.3	Very low	183 Å²	183	131.6 Å²	131.6	86%	0.855	70%	0.703	S	S	*	*			trans	62.9	141.3	133.2	-59.3	162.2	122.1	0	0	118.4
538	V	35.7	Very low	41.1	Very low	121 Å²	121	126.7 Å²	126.7	73%	0.733	68%	0.682	S	S	*	*				-168.4	137.1	69.9	152.7	0	0	0	0	111.4
539	E	37.3	Very low	43	Very low	151 Å²	151	123.7 Å²	123.7	71%	0.706	67%	0.666	S	S	*	*			trans	42	87	151.9	-60.5	178	132.5	0	0	121.8	T541	E539-T541 HydrophobicContact CB-CG2 4.34Å; E539-T541 PolarHBondContact O-N 3.28Å; E539-T541 PolarHBondContact O-OG1 3.16Å
540	E	37.3	Very low	45.1	Very low	208 Å²	208	123.8 Å²	123.8	97%	0.972	66%	0.657	S	S	*	*				34.4	36	104.5	-148	175.1	-165.5	0	0	120.3
541	T	38.7	Very low	47.3	Very low	113 Å²	113	122.5 Å²	122.5	69%	0.693	64%	0.641	S	S	*	*			trans	-119.3	-0.2	-174.5	49.4	0	0	0	0	115.5	E539	E539-T541 HydrophobicContact CB-CG2 4.34Å; E539-T541 PolarHBondContact O-N 3.28Å; E539-T541 PolarHBondContact O-OG1 3.16Å
542	A	45	Very low	49.4	Very low	71 Å²	71	124 Å²	124	59%	0.587	64%	0.636	S	S	*	*	S	Bend	trans	-83.8	-43	-170.1	0	0	0	0	0	115.8	D544 S545 E546	A542-D544 PolarHBondContact O-N 3.21Å; A542-S545 VanDerWaalsContact O-CB 3.29Å; A542-S545 WeakPolarHBondContact O-CB 3.46Å; A542-S545 PolarHBondContact O-N 2.86Å; A542-S545 PolarHBondContact O-OG 3.18Å; A542-E546 PolarHBondContact O-N 3.35Å
543	D	50.1	Low	51.5	Low	89 Å²	89	124.5 Å²	124.5	48%	0.476	63%	0.628	S	S	.	*	H	α-helix	trans	-62.6	-43.4	-167.4	-176	5.1	0	0	0	112.9	S545 E546 R547	D543-S545 PolarHBondContact O-N 2.77Å; D543-E546 PolarHBondContact O-N 3Å; D543-R547 WeakPolarHBondContact O-CG 3.16Å; D543-R547 PolarHBondContact O-N 3.13Å; D543-R547 IonicContact OD1-CZ 2.71Å; D543-R547 IonicContact OD1-NE 3.17Å; D543-R547 PolarHBondContact OD1-NE 2.89Å; D543-R547 IonicContact OD1-NH2 3.71Å; D543-R547 IonicContact OD2-CZ 3.22Å; D543-R547 VanDerWaalsContact OD2-CZ 3.23Å; D543-R547 IonicContact OD2-NE 3.5Å; D543-R547 PolarHBondContact OD2-NE 3.19Å; D543-R547 IonicContact OD2-NH2 3.68Å; D543-R547 PolarHBondContact OD2-NH2 3.29Å
544	D	52.9	Low	53.9	Low	124 Å²	124	125.3 Å²	125.3	66%	0.663	62%	0.62	S	S	*	*	H	α-helix	trans	-61.1	-28.2	176.2	-104.4	-2	0	0	0	113.1	A542 S548	A542-D544 PolarHBondContact O-N 3.21Å; D544-S548 WeakPolarHBondContact O-CB 3.46Å; D544-S548 PolarHBondContact O-N 2.67Å
545	S	55.3	Low	56	Low	63 Å²	63	121.6 Å²	121.6	44%	0.441	60%	0.602	S	S	.	*	H	α-helix	trans	-66.9	-43.3	174.1	85.6	0	0	0	0	111.2	A542 D543 S548 I549	A542-S545 VanDerWaalsContact O-CB 3.29Å; A542-S545 WeakPolarHBondContact O-CB 3.46Å; A542-S545 PolarHBondContact O-N 2.86Å; A542-S545 PolarHBondContact O-OG 3.18Å; D543-S545 PolarHBondContact O-N 2.77Å; S545-S548 WeakPolarHBondContact O-CB 3.41Å; S545-S548 PolarHBondContact O-N 3.4Å; S545-S548 PolarHBondContact O-OG 2.82Å; S545-I549 WeakPolarHBondContact O-CG1 3.5Å; S545-I549 PolarHBondContact O-N 3.41Å; S545-I549 VanDerWaalsContact O-N 3.13Å
546	E	62.4	Low	58.5	Low	123 Å²	123	116.1 Å²	116.1	58%	0.575	59%	0.585	S	S	*	*	H	α-helix	trans	-72.9	-39.5	-178.3	-149.8	-173.8	161.8	0	0	111.4	A542 D543 S548 I549 M550	A542-E546 PolarHBondContact O-N 3.35Å; D543-E546 PolarHBondContact O-N 3Å; E546-S548 VanDerWaalsContact C-N 3.26Å; E546-S548 PolarHBondContact O-N 2.81Å; E546-I549 PolarHBondContact O-N 3.21Å; E546-I549 VanDerWaalsContact O-N 3.07Å; E546-M550 PolarHBondContact O-N 2.98Å
547	R	64.6	Low	60.7	Low	149 Å²	149	118.8 Å²	118.8	56%	0.562	59%	0.59	S	S	*	*	H	α-helix	trans	-55.6	-41.5	169	-67	173.2	-173.3	-155.8	2	111.6	D543 I549 M550 Q551	D543-R547 WeakPolarHBondContact O-CG 3.16Å; D543-R547 PolarHBondContact O-N 3.13Å; D543-R547 IonicContact OD1-CZ 2.71Å; D543-R547 IonicContact OD1-NE 3.17Å; D543-R547 PolarHBondContact OD1-NE 2.89Å; D543-R547 IonicContact OD1-NH2 3.71Å; D543-R547 IonicContact OD2-CZ 3.22Å; D543-R547 VanDerWaalsContact OD2-CZ 3.23Å; D543-R547 IonicContact OD2-NE 3.5Å; D543-R547 PolarHBondContact OD2-NE 3.19Å; D543-R547 IonicContact OD2-NH2 3.68Å; D543-R547 PolarHBondContact OD2-NH2 3.29Å; R547-I549 VanDerWaalsContact C-N 3.34Å; R547-I549 PolarHBondContact O-N 3.39Å; R547-M550 PolarHBondContact O-N 3.42Å; R547-Q551 WeakPolarHBondContact O-CB 3.29Å; R547-Q551 PolarHBondContact O-N 3.23Å
548	S	70.8	Confident	63	Low	49 Å²	49	114 Å²	114	34%	0.343	57%	0.571	S	S	.	*	H	α-helix	trans	-65.4	-35	176.3	90	0	0	0	0	113	D544 S545 E546 R552	D544-S548 WeakPolarHBondContact O-CB 3.46Å; D544-S548 PolarHBondContact O-N 2.67Å; S545-S548 WeakPolarHBondContact O-CB 3.41Å; S545-S548 PolarHBondContact O-N 3.4Å; S545-S548 PolarHBondContact O-OG 2.82Å; E546-S548 VanDerWaalsContact C-N 3.26Å; E546-S548 PolarHBondContact O-N 2.81Å; S548-R552 WeakPolarHBondContact O-CG 3.49Å; S548-R552 PolarHBondContact O-N 3.2Å; S548-R552 VanDerWaalsContact O-N 3.08Å
549	I	77.2	Confident	64.8	Low	85 Å²	85	112.4 Å²	112.4	44%	0.436	56%	0.557	S	S	.	*	H	α-helix	trans	-73.1	-42.9	178	-67.5	164.2	0	0	0	110.6	S545 E546 R547 Q551 R552 R553	S545-I549 WeakPolarHBondContact O-CG1 3.5Å; S545-I549 PolarHBondContact O-N 3.41Å; S545-I549 VanDerWaalsContact O-N 3.13Å; E546-I549 PolarHBondContact O-N 3.21Å; E546-I549 VanDerWaalsContact O-N 3.07Å; R547-I549 VanDerWaalsContact C-N 3.34Å; R547-I549 PolarHBondContact O-N 3.39Å; I549-Q551 VanDerWaalsContact C-N 3.33Å; I549-Q551 PolarHBondContact O-N 3.07Å; I549-R552 PolarHBondContact O-N 3.47Å; I549-R553 PolarHBondContact O-N 3.2Å
550	M	73.9	Confident	66.4	Low	96 Å²	96	110.2 Å²	110.2	47%	0.473	55%	0.547	S	S	.	.	H	α-helix	trans	-57.6	-44.3	172.1	-79.4	-69.3	-167.8	0	0	111.8	E546 R547 R553 R554	E546-M550 PolarHBondContact O-N 2.98Å; R547-M550 PolarHBondContact O-N 3.42Å; M550-R553 PolarHBondContact O-N 2.74Å; M550-R554 PolarHBondContact O-N 2.87Å
551	Q	79	Confident	67.9	Low	96 Å²	96	106.3 Å²	106.3	45%	0.449	53%	0.529	S	S	.	.	H	α-helix	trans	-61.1	-48.5	176.2	-167.1	73.2	-11	0	0	111.3	R547 I549 R553 R554 D555	R547-Q551 WeakPolarHBondContact O-CB 3.29Å; R547-Q551 PolarHBondContact O-N 3.23Å; I549-Q551 VanDerWaalsContact C-N 3.33Å; I549-Q551 PolarHBondContact O-N 3.07Å; Q551-R553 VanDerWaalsContact C-N 3.33Å; Q551-R553 PolarHBondContact O-N 3.06Å; Q551-R554 WeakPolarHBondContact O-CB 3.44Å; Q551-R554 PolarHBondContact O-N 2.97Å; Q551-R554 VanDerWaalsContact O-N 3.12Å; Q551-D555 PolarHBondContact O-N 3.3Å
552	R	74.6	Confident	69.1	Low	181 Å²	181	105.2 Å²	105.2	68%	0.683	52%	0.516	S	S	*	.	H	α-helix	trans	-60	-37.4	176.4	-71.5	178.3	-164.3	178.9	9.4	113.2	S548 I549 A556	S548-R552 WeakPolarHBondContact O-CG 3.49Å; S548-R552 PolarHBondContact O-N 3.2Å; S548-R552 VanDerWaalsContact O-N 3.08Å; I549-R552 PolarHBondContact O-N 3.47Å; R552-A556 WeakPolarHBondContact O-CB 3.25Å; R552-A556 PolarHBondContact O-N 3.2Å
553	R	77.6	Confident	70.2	Confident	171 Å²	171	107.1 Å²	107.1	65%	0.645	51%	0.513	S	S	*	.	H	α-helix	trans	-64.5	-43	174.2	-80	-177.8	170.5	172.9	-1.7	111.6	I549 M550 Q551 A556 M557	I549-R553 PolarHBondContact O-N 3.2Å; M550-R553 PolarHBondContact O-N 2.74Å; Q551-R553 VanDerWaalsContact C-N 3.33Å; Q551-R553 PolarHBondContact O-N 3.06Å; R553-A556 PolarHBondContact O-N 3.48Å; R553-M557 PolarHBondContact O-N 2.71Å
554	R	78.3	Confident	70.7	Confident	156 Å²	156	110.5 Å²	110.5	59%	0.589	52%	0.519	S	S	*	.	H	α-helix	trans	-62.5	-43.8	176.3	-165.2	-179.5	-66.6	131.3	-4	111.5	M550 Q551 M557 N558	M550-R554 PolarHBondContact O-N 2.87Å; Q551-R554 WeakPolarHBondContact O-CB 3.44Å; Q551-R554 PolarHBondContact O-N 2.97Å; Q551-R554 VanDerWaalsContact O-N 3.12Å; R554-M557 PolarHBondContact O-N 3.03Å; R554-N558 WeakPolarHBondContact O-CB 3.39Å; R554-N558 PolarHBondContact O-N 3.11Å
555	D	80.1	Confident	71.4	Confident	74 Å²	74	107.7 Å²	107.7	40%	0.396	51%	0.506	S	S	.	.	H	α-helix	trans	-64.6	-40.4	174.7	-67.7	-29.4	0	0	0	111.9	Q551 N558 N559	Q551-D555 PolarHBondContact O-N 3.3Å; D555-N558 PolarHBondContact O-N 3.12Å; D555-N559 WeakPolarHBondContact O-CB 3.38Å; D555-N559 PolarHBondContact O-N 3.46Å; D555-N559 PolarHBondContact O-ND2 3.28Å
556	A	79.2	Confident	71.9	Confident	51 Å²	51	110.1 Å²	110.1	42%	0.421	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-42.4	176.3	0	0	0	0	0	112.3	R552 R553 N559 Q560	R552-A556 WeakPolarHBondContact O-CB 3.25Å; R552-A556 PolarHBondContact O-N 3.2Å; R553-A556 PolarHBondContact O-N 3.48Å; A556-N559 PolarHBondContact O-N 2.88Å; A556-Q560 PolarHBondContact O-N 3Å
557	M	75.7	Confident	72.1	Confident	140 Å²	140	111.2 Å²	111.2	69%	0.69	52%	0.516	S	S	*	.	H	α-helix	trans	-63.3	-43.9	173.5	-76.8	177.7	63.1	0	0	112.2	R553 R554 Q560 H561	R553-M557 PolarHBondContact O-N 2.71Å; R554-M557 PolarHBondContact O-N 3.03Å; M557-Q560 PolarHBondContact O-N 3.18Å; M557-H561 PolarHBondContact O-N 3.04Å
558	N	77.3	Confident	72.6	Confident	84 Å²	84	109.2 Å²	109.2	45%	0.449	52%	0.516	S	S	.	.	H	α-helix	trans	-60.9	-46.2	176.4	-171	11.8	0	0	0	111.1	R554 D555 Q560 H561 Q562	R554-N558 WeakPolarHBondContact O-CB 3.39Å; R554-N558 PolarHBondContact O-N 3.11Å; D555-N558 PolarHBondContact O-N 3.12Å; N558-Q560 PolarHBondContact O-N 2.91Å; N558-H561 PolarHBondContact O-N 3.24Å; N558-H561 VanDerWaalsContact O-N 3.16Å; N558-Q562 WeakPolarHBondContact O-CG 3.44Å; N558-Q562 PolarHBondContact O-N 3.34Å; N558-Q562 PolarHBondContact OD1-NE2 3.2Å
559	N	73	Confident	73	Confident	86 Å²	86	110.6 Å²	110.6	46%	0.46	52%	0.522	S	S	.	.	H	α-helix	trans	-59.9	-41.6	174.9	-78.9	-59.5	0	0	0	112.6	D555 A556 Q563	D555-N559 WeakPolarHBondContact O-CB 3.38Å; D555-N559 PolarHBondContact O-N 3.46Å; D555-N559 PolarHBondContact O-ND2 3.28Å; A556-N559 PolarHBondContact O-N 2.88Å; N559-Q563 WeakPolarHBondContact O-CB 3.33Å; N559-Q563 VanDerWaalsContact O-CG 3.3Å; N559-Q563 WeakPolarHBondContact O-CG 3.48Å; N559-Q563 PolarHBondContact O-N 3.1Å
560	Q	71.5	Confident	73.3	Confident	106 Å²	106	108.5 Å²	108.5	50%	0.495	52%	0.522	S	S	.	.	H	α-helix	trans	-64.6	-41	173.8	-75.2	-165.3	16.7	0	0	112.3	A556 M557 N558 Q563 R564	A556-Q560 PolarHBondContact O-N 3Å; M557-Q560 PolarHBondContact O-N 3.18Å; N558-Q560 PolarHBondContact O-N 2.91Å; Q560-Q563 PolarHBondContact O-N 2.75Å; Q560-R564 WeakPolarHBondContact O-CG 3.5Å; Q560-R564 PolarHBondContact O-N 3.46Å
561	H	67.8	Low	73.7	Confident	125 Å²	125	111.2 Å²	111.2	58%	0.579	53%	0.528	S	S	*	.	H	α-helix	trans	-65.4	-43.2	178.3	-165.1	85.5	0	0	0	111.3	M557 N558 R564 T565	M557-H561 PolarHBondContact O-N 3.04Å; N558-H561 PolarHBondContact O-N 3.24Å; N558-H561 VanDerWaalsContact O-N 3.16Å; H561-R564 PolarHBondContact O-N 2.81Å; H561-T565 WeakPolarHBondContact O-CG2 3.5Å; H561-T565 PolarHBondContact O-N 3.3Å; H561-T565 PolarHBondContact O-OG1 2.9Å
562	Q	65.9	Low	74	Confident	90 Å²	90	110.5 Å²	110.5	42%	0.421	52%	0.521	S	S	.	.	H	α-helix	trans	-60.7	-42.8	172	-70.5	-178.5	10.5	0	0	112.2	N558 R564 T565 I566	N558-Q562 WeakPolarHBondContact O-CG 3.44Å; N558-Q562 PolarHBondContact O-N 3.34Å; N558-Q562 PolarHBondContact OD1-NE2 3.2Å; Q562-R564 VanDerWaalsContact C-N 3.35Å; Q562-R564 PolarHBondContact O-N 3.5Å; Q562-T565 WeakPolarHBondContact CA-OG1 3.49Å; Q562-T565 PolarHBondContact O-N 2.9Å; Q562-T565 PolarHBondContact O-OG1 3.05Å; Q562-T565 VanDerWaalsContact O-OG1 3.05Å; Q562-I566 VanDerWaalsContact O-CB 3.3Å; Q562-I566 WeakPolarHBondContact O-CB 3.5Å; Q562-I566 WeakPolarHBondContact O-CD1 3.49Å; Q562-I566 WeakPolarHBondContact O-CG1 3.31Å; Q562-I566 PolarHBondContact O-N 3.27Å
563	Q	66.4	Low	74.4	Confident	112 Å²	112	106.7 Å²	106.7	52%	0.523	51%	0.514	S	S	.	.	H	α-helix	trans	-64.5	-37	175.7	-75	179	15.2	0	0	112.8	N559 Q560 K567	N559-Q563 WeakPolarHBondContact O-CB 3.33Å; N559-Q563 VanDerWaalsContact O-CG 3.3Å; N559-Q563 WeakPolarHBondContact O-CG 3.48Å; N559-Q563 PolarHBondContact O-N 3.1Å; Q560-Q563 PolarHBondContact O-N 2.75Å; Q563-K567 WeakPolarHBondContact O-CB 3.48Å; Q563-K567 WeakPolarHBondContact O-CG 3.33Å; Q563-K567 PolarHBondContact O-N 3.18Å
564	R	61.2	Low	74.8	Confident	160 Å²	160	100.1 Å²	100.1	60%	0.604	50%	0.5	S	S	*	.	H	α-helix	trans	-67.1	-46.4	174.7	-70.4	177.7	-166.6	-159.8	6.1	111.4	Q560 H561 Q562 K567 N568	Q560-R564 WeakPolarHBondContact O-CG 3.5Å; Q560-R564 PolarHBondContact O-N 3.46Å; H561-R564 PolarHBondContact O-N 2.81Å; Q562-R564 VanDerWaalsContact C-N 3.35Å; Q562-R564 PolarHBondContact O-N 3.5Å; R564-K567 PolarHBondContact O-N 2.96Å; R564-N568 VanDerWaalsContact O-CG 3.26Å; R564-N568 PolarHBondContact O-N 3.1Å; R564-N568 PolarHBondContact O-OD1 3.41Å
565	T	66.8	Low	75.3	Confident	64 Å²	64	97.4 Å²	97.4	39%	0.393	49%	0.492	S	S	.	.	H	α-helix	trans	-65.5	-41.5	178.2	54.5	0	0	0	0	112.1	H561 Q562 N568 V569	H561-T565 WeakPolarHBondContact O-CG2 3.5Å; H561-T565 PolarHBondContact O-N 3.3Å; H561-T565 PolarHBondContact O-OG1 2.9Å; Q562-T565 WeakPolarHBondContact CA-OG1 3.49Å; Q562-T565 PolarHBondContact O-N 2.9Å; Q562-T565 PolarHBondContact O-OG1 3.05Å; Q562-T565 VanDerWaalsContact O-OG1 3.05Å; T565-N568 PolarHBondContact O-N 2.97Å; T565-V569 WeakPolarHBondContact O-CB 3.47Å; T565-V569 WeakPolarHBondContact O-CG2 3.3Å; T565-V569 PolarHBondContact O-N 3.05Å
566	I	65.7	Low	75.7	Confident	114 Å²	114	98 Å²	98	59%	0.585	49%	0.489	S	S	*	.	H	α-helix	trans	-61.4	-44.5	174.8	-69.5	164.9	0	0	0	111.5	Q562 N568 V569 G570	Q562-I566 VanDerWaalsContact O-CB 3.3Å; Q562-I566 WeakPolarHBondContact O-CB 3.5Å; Q562-I566 WeakPolarHBondContact O-CD1 3.49Å; Q562-I566 WeakPolarHBondContact O-CG1 3.31Å; Q562-I566 PolarHBondContact O-N 3.27Å; I566-N568 PolarHBondContact O-N 3.43Å; I566-V569 PolarHBondContact O-N 3.35Å; I566-G570 PolarHBondContact O-N 3.37Å
567	K	67.1	Low	76.2	Confident	146 Å²	146	103.2 Å²	103.2	64%	0.635	50%	0.502	S	S	*	.	H	α-helix	trans	-59.7	-45.4	175.1	-77.2	172.6	-179.8	-177.2	0	111.6	Q563 R564 G570 Y571	Q563-K567 WeakPolarHBondContact O-CB 3.48Å; Q563-K567 WeakPolarHBondContact O-CG 3.33Å; Q563-K567 PolarHBondContact O-N 3.18Å; R564-K567 PolarHBondContact O-N 2.96Å; K567-G570 PolarHBondContact O-N 3.35Å; K567-Y571 PolarHBondContact O-N 2.86Å
568	N	76.6	Confident	76.9	Confident	107 Å²	107	105.5 Å²	105.5	57%	0.572	50%	0.503	S	S	*	.	H	α-helix	trans	-66	-40.8	179.6	-68.9	5.7	0	0	0	112.2	R564 T565 I566 Y571 R572	R564-N568 VanDerWaalsContact O-CG 3.26Å; R564-N568 PolarHBondContact O-N 3.1Å; R564-N568 PolarHBondContact O-OD1 3.41Å; T565-N568 PolarHBondContact O-N 2.97Å; I566-N568 PolarHBondContact O-N 3.43Å; N568-Y571 PolarHBondContact O-N 2.96Å; N568-R572 WeakPolarHBondContact O-CG 3.28Å; N568-R572 PolarHBondContact O-N 3.37Å
569	V	79.1	Confident	77.6	Confident	78 Å²	78	102.7 Å²	102.7	47%	0.473	49%	0.488	S	S	.	.	H	α-helix	trans	-64.6	-42.7	174	170.5	0	0	0	0	111.1	T565 I566 Y571 R572 L573	T565-V569 WeakPolarHBondContact O-CB 3.47Å; T565-V569 WeakPolarHBondContact O-CG2 3.3Å; T565-V569 PolarHBondContact O-N 3.05Å; I566-V569 PolarHBondContact O-N 3.35Å; V569-Y571 PolarHBondContact O-N 2.84Å; V569-R572 PolarHBondContact O-N 3.5Å; V569-L573 HydrophobicContact CG1-CD1 3.86Å; V569-L573 HydrophobicContact CG1-CG 4.31Å; V569-L573 WeakPolarHBondContact O-CB 3.34Å; V569-L573 WeakPolarHBondContact O-CG 3.27Å; V569-L573 PolarHBondContact O-N 3.1Å
570	G	81.7	Confident	78.4	Confident	42 Å²	42	100.2 Å²	100.2	43%	0.433	47%	0.473	S	S	.	.	H	α-helix	trans	-59.1	-45.7	175	0	0	0	0	0	112.8	I566 K567 L573 G574	I566-G570 PolarHBondContact O-N 3.37Å; K567-G570 PolarHBondContact O-N 3.35Å; G570-L573 PolarHBondContact O-N 2.81Å; G570-G574 PolarHBondContact O-N 3.38Å
571	Y	83.9	Confident	79.3	Confident	153 Å²	153	99.6 Å²	99.6	60%	0.6	47%	0.47	S	S	*	.	H	α-helix	trans	-60.6	-46.8	173.8	175.8	-90.9	0	0	0	111.9	K567 N568 V569 L573 G574 K575	K567-Y571 PolarHBondContact O-N 2.86Å; N568-Y571 PolarHBondContact O-N 2.96Å; V569-Y571 PolarHBondContact O-N 2.84Å; Y571-L573 PolarHBondContact O-N 2.98Å; Y571-G574 PolarHBondContact O-N 3.46Å; Y571-K575 HydrophobicContact CE1-CD 3.85Å; Y571-K575 WeakPolarHBondContact O-CB 3.48Å; Y571-K575 PolarHBondContact O-N 2.9Å
572	R	84	Confident	80.5	Confident	80 Å²	80	98.4 Å²	98.4	30%	0.302	46%	0.463	S	S	.	.	H	α-helix	trans	-61.1	-42.4	177.5	-74.3	179	64.9	-161	-5.9	112.4	N568 V569 K575 R576 C651 D652 S654	N568-R572 WeakPolarHBondContact O-CG 3.28Å; N568-R572 PolarHBondContact O-N 3.37Å; V569-R572 PolarHBondContact O-N 3.5Å; R572-K575 PolarHBondContact O-N 2.87Å; R572-R576 WeakPolarHBondContact O-CB 3.31Å; R572-R576 PolarHBondContact O-N 2.94Å; R572-C651 PolarHBondContact NE-O 3.31Å; R572-C651 PolarHBondContact NH2-O 2.98Å; R572-D652 VanDerWaalsContact NH2-C 3.29Å; R572-D652 PolarHBondContact NH2-O 3.06Å; R572-S654 PolarHBondContact NH1-OG 3.32Å
573	L	83.3	Confident	81.8	Confident	101 Å²	101	95.1 Å²	95.1	53%	0.529	45%	0.447	S	S	.	.	H	α-helix	trans	-64.7	-40.9	175.4	-71.1	170.9	0	0	0	112.2	V569 G570 Y571 R576 K577	V569-L573 HydrophobicContact CG1-CD1 3.86Å; V569-L573 HydrophobicContact CG1-CG 4.31Å; V569-L573 WeakPolarHBondContact O-CB 3.34Å; V569-L573 WeakPolarHBondContact O-CG 3.27Å; V569-L573 PolarHBondContact O-N 3.1Å; G570-L573 PolarHBondContact O-N 2.81Å; Y571-L573 PolarHBondContact O-N 2.98Å; L573-R576 PolarHBondContact O-N 2.88Å; L573-K577 PolarHBondContact O-N 3.14Å
574	G	86.3	Confident	83.1	Confident	34 Å²	34	90.5 Å²	90.5	35%	0.351	43%	0.427	S	S	.	.	H	α-helix	trans	-62.9	-44.7	173.3	0	0	0	0	0	112.8	G570 Y571 K577 R578	G570-G574 PolarHBondContact O-N 3.38Å; Y571-G574 PolarHBondContact O-N 3.46Å; G574-K577 PolarHBondContact O-N 2.89Å; G574-R578 WeakPolarHBondContact O-CG 3.3Å; G574-R578 PolarHBondContact O-N 3.43Å
575	K	88.4	Confident	84.6	Confident	98 Å²	98	89 Å²	89	43%	0.426	42%	0.421	S	S	.	.	H	α-helix	trans	-60.1	-45.8	174.2	-171.8	170.7	179.2	174.3	0	111	Y571 R572 K577 R578 L579	Y571-K575 HydrophobicContact CE1-CD 3.85Å; Y571-K575 WeakPolarHBondContact O-CB 3.48Å; Y571-K575 PolarHBondContact O-N 2.9Å; R572-K575 PolarHBondContact O-N 2.87Å; K575-K577 PolarHBondContact O-N 2.8Å; K575-R578 PolarHBondContact O-N 3Å; K575-L579 HydrophobicContact CG-CD1 4.2Å; K575-L579 WeakPolarHBondContact O-CB 3.25Å; K575-L579 WeakPolarHBondContact O-CG 3.4Å; K575-L579 PolarHBondContact O-N 3.42Å
576	R	89	Confident	86	Confident	88 Å²	88	87.1 Å²	87.1	33%	0.332	41%	0.408	S	S	.	.	H	α-helix	trans	-57.9	-46.3	174.5	-166.9	-169.3	-163.8	-178.4	12.4	112.3	R572 L573 L579 F580 D652	R572-R576 WeakPolarHBondContact O-CB 3.31Å; R572-R576 PolarHBondContact O-N 2.94Å; L573-R576 PolarHBondContact O-N 2.88Å; R576-L579 PolarHBondContact O-N 2.77Å; R576-F580 WeakPolarHBondContact O-CB 3.15Å; R576-F580 PolarHBondContact O-N 3.26Å; R576-D652 WeakPolarHBondContact CD-OD1 3.4Å; R576-D652 WeakPolarHBondContact CG-OD1 3.47Å; R576-D652 VanDerWaalsContact CZ-CG 3.49Å; R576-D652 IonicContact CZ-OD1 2.73Å; R576-D652 IonicContact CZ-OD2 3.41Å; R576-D652 IonicContact NE-OD1 3.9Å; R576-D652 PolarHBondContact NE-OD1 2.74Å; R576-D652 IonicContact NE-OD2 3.5Å; R576-D652 PolarHBondContact NE-OD2 3.12Å; R576-D652 VanDerWaalsContact NH2-CG 3.3Å; R576-D652 IonicContact NH2-OD1 2.74Å; R576-D652 IonicContact NH2-OD2 3.56Å; R576-D652 PolarHBondContact NH2-OD2 3.11Å
577	K	88.7	Confident	87.4	Confident	159 Å²	159	81.7 Å²	81.7	69%	0.691	38%	0.381	S	S	*	.	H	α-helix	trans	-62.1	-46.5	177.8	-171	177.8	179.7	-178.7	0	111.6	L573 G574 K575 L579 F580 E581	L573-K577 PolarHBondContact O-N 3.14Å; G574-K577 PolarHBondContact O-N 2.89Å; K575-K577 PolarHBondContact O-N 2.8Å; K577-L579 PolarHBondContact O-N 3.25Å; K577-F580 PolarHBondContact O-N 3.03Å; K577-E581 WeakPolarHBondContact O-CB 3.26Å; K577-E581 PolarHBondContact O-N 3.38Å
578	R	91.2	Very high	88.7	Confident	189 Å²	189	76.8 Å²	76.8	71%	0.713	36%	0.361	S	S	*	.	H	α-helix	trans	-61.9	-39.9	176.7	-70.7	174.7	176.4	178.9	-1.3	112.6	G574 K575 K582	G574-R578 WeakPolarHBondContact O-CG 3.3Å; G574-R578 PolarHBondContact O-N 3.43Å; K575-R578 PolarHBondContact O-N 3Å; R578-K582 WeakPolarHBondContact O-CG 3.4Å; R578-K582 PolarHBondContact O-N 3.4Å; R578-K582 VanDerWaalsContact O-N 3.17Å
579	L	91.3	Very high	89.6	Confident	25 Å²	25	77.2 Å²	77.2	13%	0.131	36%	0.358	C	S	.	.	H	α-helix	trans	-68.7	-40.5	175.8	-72	171.4	0	0	0	112.3	K575 R576 K577 K582 R583 Y644 I648 C651	K575-L579 HydrophobicContact CG-CD1 4.2Å; K575-L579 WeakPolarHBondContact O-CB 3.25Å; K575-L579 WeakPolarHBondContact O-CG 3.4Å; K575-L579 PolarHBondContact O-N 3.42Å; R576-L579 PolarHBondContact O-N 2.77Å; K577-L579 PolarHBondContact O-N 3.25Å; L579-K582 PolarHBondContact O-N 3.47Å; L579-R583 PolarHBondContact O-N 2.93Å; L579-Y644 HydrophobicContact CD2-CD1 3.95Å; L579-Y644 HydrophobicContact CD2-CE1 3.93Å; L579-I648 HydrophobicContact CB-CD1 4.29Å; L579-I648 HydrophobicContact CB-CG1 3.74Å; L579-I648 HydrophobicContact CD1-CG1 4.44Å; L579-C651 HydrophobicContact CD1-CB 4.3Å
580	F	89.7	Confident	90.4	Very high	34 Å²	34	73.6 Å²	73.6	15%	0.149	34%	0.336	C	S	.	.	H	α-helix	trans	-60.5	-46.7	175.7	-175.4	-77.3	0	0	0	111.4	R576 K577 R583 C584 L804 F809 T810	R576-F580 WeakPolarHBondContact O-CB 3.15Å; R576-F580 PolarHBondContact O-N 3.26Å; K577-F580 PolarHBondContact O-N 3.03Å; F580-R583 VanDerWaalsContact CD2-NH2 3.3Å; F580-R583 WeakPolarHBondContact O-CB 3.22Å; F580-R583 PolarHBondContact O-N 2.73Å; F580-R583 VanDerWaalsContact O-N 3.12Å; F580-C584 WeakPolarHBondContact CE1-SG 3.38Å; F580-C584 PolarHBondContact O-N 3Å; F580-C584 PolarHBondContact O-SG 3.49Å; F580-C584 VanDerWaalsContact O-SG 3.4Å; F580-L804 HydrophobicContact CE1-CD1 4.33Å; F580-L804 HydrophobicContact CE2-CD1 4.16Å; F580-L804 HydrophobicContact CZ-CD1 3.72Å; F580-F809 HydrophobicContact CE2-CD1 4.07Å; F580-F809 AromaticContact CE2-CE1 3.82Å; F580-F809 HydrophobicContact CE2-CE1 3.82Å; F580-F809 HydrophobicContact CZ-CD1 4.07Å; F580-F809 HydrophobicContact CZ-CE1 4.25Å; F580-T810 HydrophobicContact CE1-CG2 3.55Å; F580-T810 HydrophobicContact CZ-CG2 3.56Å
581	E	91	Very high	91.1	Very high	93 Å²	93	72.9 Å²	72.9	44%	0.435	32%	0.322	S	S	.	.	H	α-helix	trans	-62.9	-41.6	179.2	-168.9	-154.6	112.6	0	0	112.5	K577 R583 C584 R585	K577-E581 WeakPolarHBondContact O-CB 3.26Å; K577-E581 PolarHBondContact O-N 3.38Å; E581-R583 VanDerWaalsContact C-N 3.32Å; E581-R583 PolarHBondContact O-N 2.96Å; E581-C584 PolarHBondContact O-N 3.28Å; E581-R585 PolarHBondContact O-N 2.65Å; E581-R585 IonicContact OE1-CZ 3.89Å; E581-R585 IonicContact OE1-NE 2.69Å; E581-R585 IonicContact OE1-NH2 2.67Å; E581-R585 PolarHBondContact OE1-NH2 2.79Å
582	K	93.5	Very high	91.6	Very high	99 Å²	99	69 Å²	69	43%	0.43	32%	0.318	S	S	.	.	H	α-helix	trans	-60.9	-39.6	171.6	-75.2	-174.4	175	-168	0	112	R578 L579 R585 I586 Y644	R578-K582 WeakPolarHBondContact O-CG 3.4Å; R578-K582 PolarHBondContact O-N 3.4Å; R578-K582 VanDerWaalsContact O-N 3.17Å; L579-K582 PolarHBondContact O-N 3.47Å; K582-R585 PolarHBondContact O-N 3.22Å; K582-I586 WeakPolarHBondContact O-CG1 3.07Å; K582-I586 PolarHBondContact O-N 3.31Å; K582-Y644 HydrophobicContact CB-CD1 4.26Å; K582-Y644 HydrophobicContact CB-CE1 3.83Å; K582-Y644 HydrophobicContact CD-CE1 3.9Å
583	R	93.4	Very high	92.2	Very high	22 Å²	22	68.3 Å²	68.3	8%	0.083	32%	0.317	C	S	.	.	H	α-helix	trans	-65.5	-36.9	176.3	-171.3	-175.7	64.6	-179.5	2.8	112.5	L579 F580 E581 S587 Y641 I648	L579-R583 PolarHBondContact O-N 2.93Å; F580-R583 VanDerWaalsContact CD2-NH2 3.3Å; F580-R583 WeakPolarHBondContact O-CB 3.22Å; F580-R583 PolarHBondContact O-N 2.73Å; F580-R583 VanDerWaalsContact O-N 3.12Å; E581-R583 VanDerWaalsContact C-N 3.32Å; E581-R583 PolarHBondContact O-N 2.96Å; R583-S587 WeakPolarHBondContact O-CB 3.21Å; R583-S587 PolarHBondContact O-N 3.47Å; R583-Y641 HydrophobicContact CG-CD2 3.72Å; R583-Y641 HydrophobicContact CG-CE2 3.67Å; R583-I648 HydrophobicContact CB-CD1 4.49Å
584	C	92.3	Very high	92.7	Very high	14 Å²	14	63.6 Å²	63.6	10%	0.095	29%	0.293	C	S	.	.	H	α-helix	trans	-59.6	-56.2	172.4	-63.1	0	0	0	0	110.5	F580 E581 I586 S587 D588 L804	F580-C584 WeakPolarHBondContact CE1-SG 3.38Å; F580-C584 PolarHBondContact O-N 3Å; F580-C584 PolarHBondContact O-SG 3.49Å; F580-C584 VanDerWaalsContact O-SG 3.4Å; E581-C584 PolarHBondContact O-N 3.28Å; C584-I586 VanDerWaalsContact C-N 3.27Å; C584-I586 PolarHBondContact O-N 2.89Å; C584-S587 CarbonylContact O-C 3.54Å; C584-S587 WeakPolarHBondContact O-CA 3.2Å; C584-S587 VanDerWaalsContact O-CB 3.26Å; C584-S587 WeakPolarHBondContact O-CB 3.34Å; C584-S587 PolarHBondContact O-N 3.38Å; C584-D588 PolarHBondContact O-N 2.87Å; C584-L804 HydrophobicContact CB-CD2 4.44Å
585	R	94.5	Very high	93.1	Very high	130 Å²	130	65.3 Å²	65.3	49%	0.491	30%	0.296	S	S	.	.	H	α-helix	trans	-54.9	-39.9	-179.9	-70.5	-170.1	-92.6	159.4	-15.8	113.3	E581 K582 D588 F589	E581-R585 PolarHBondContact O-N 2.65Å; E581-R585 IonicContact OE1-CZ 3.89Å; E581-R585 IonicContact OE1-NE 2.69Å; E581-R585 IonicContact OE1-NH2 2.67Å; E581-R585 PolarHBondContact OE1-NH2 2.79Å; K582-R585 PolarHBondContact O-N 3.22Å; R585-D588 PolarHBondContact O-N 3.21Å; R585-F589 HydrophobicContact CB-CE2 4.46Å; R585-F589 WeakPolarHBondContact O-CD2 3.29Å; R585-F589 PolarHBondContact O-N 3.37Å
586	I	95.2	Very high	93.4	Very high	24 Å²	24	65.5 Å²	65.5	12%	0.123	30%	0.297	C	S	.	.	H	α-helix	trans	-69.2	-37	176.1	-69.6	165.9	0	0	0	112	K582 C584 D588 S590 L637 A640 Y644	K582-I586 WeakPolarHBondContact O-CG1 3.07Å; K582-I586 PolarHBondContact O-N 3.31Å; C584-I586 VanDerWaalsContact C-N 3.27Å; C584-I586 PolarHBondContact O-N 2.89Å; I586-D588 VanDerWaalsContact C-N 3.3Å; I586-D588 PolarHBondContact O-N 3.42Å; I586-S590 WeakPolarHBondContact O-CB 3.48Å; I586-S590 PolarHBondContact O-N 3.42Å; I586-L637 HydrophobicContact CG2-CD2 4.2Å; I586-L637 WeakPolarHBondContact CG2-O 3.35Å; I586-A640 HydrophobicContact CG2-CB 4.31Å; I586-Y644 HydrophobicContact CD1-CD2 3.36Å; I586-Y644 HydrophobicContact CD1-CE2 3.18Å; I586-Y644 HydrophobicContact CD1-CG 4.33Å
587	S	94.3	Very high	93.7	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-39.5	171.7	-162	0	0	0	0	111.4	R583 C584 S590 L591 V801	R583-S587 WeakPolarHBondContact O-CB 3.21Å; R583-S587 PolarHBondContact O-N 3.47Å; C584-S587 CarbonylContact O-C 3.54Å; C584-S587 WeakPolarHBondContact O-CA 3.2Å; C584-S587 VanDerWaalsContact O-CB 3.26Å; C584-S587 WeakPolarHBondContact O-CB 3.34Å; C584-S587 PolarHBondContact O-N 3.38Å; S587-S590 WeakPolarHBondContact CA-OG 3.47Å; S587-S590 PolarHBondContact O-N 3.31Å; S587-S590 PolarHBondContact O-OG 2.88Å; S587-L591 PolarHBondContact O-N 2.66Å; S587-V801 WeakPolarHBondContact O-CG2 3.37Å; S587-V801 WeakPolarHBondContact OG-CG2 3.3Å
588	D	95.3	Very high	93.9	Very high	43 Å²	43	54.4 Å²	54.4	23%	0.23	25%	0.252	C	S	.	.	H	α-helix	trans	-66.4	-48.2	179.3	-55.8	-29.9	0	0	0	110.9	C584 R585 I586 S590 L591 S592 H805	C584-D588 PolarHBondContact O-N 2.87Å; R585-D588 PolarHBondContact O-N 3.21Å; I586-D588 VanDerWaalsContact C-N 3.3Å; I586-D588 PolarHBondContact O-N 3.42Å; D588-S590 VanDerWaalsContact C-N 3.3Å; D588-S590 PolarHBondContact O-N 2.77Å; D588-L591 WeakPolarHBondContact O-CB 3.43Å; D588-L591 PolarHBondContact O-N 3.22Å; D588-L591 VanDerWaalsContact O-N 3.13Å; D588-S592 PolarHBondContact O-N 2.9Å; D588-S592 PolarHBondContact O-OG 3.47Å; D588-H805 IonicContact OD1-CD2 3.29Å; D588-H805 PolarHBondContact OD1-CD2 3.31Å; D588-H805 IonicContact OD1-CE1 2.98Å; D588-H805 IonicContact OD1-NE2 3.74Å; D588-H805 PolarHBondContact OD1-NE2 2.78Å; D588-H805 IonicContact OD2-CE1 3.06Å; D588-H805 PolarHBondContact OD2-CE1 3.39Å; D588-H805 IonicContact OD2-NE2 2.89Å; D588-H805 PolarHBondContact OD2-NE2 3.39Å
589	F	95.7	Very high	94.1	Very high	116 Å²	116	49.7 Å²	49.7	51%	0.509	24%	0.24	S	C	.	.	H	α-helix	trans	-58.9	-39.9	172	-68.5	-56.3	0	0	0	112.4	R585 L591 S592 F593 L637	R585-F589 HydrophobicContact CB-CE2 4.46Å; R585-F589 WeakPolarHBondContact O-CD2 3.29Å; R585-F589 PolarHBondContact O-N 3.37Å; F589-L591 VanDerWaalsContact C-N 3.29Å; F589-L591 PolarHBondContact O-N 2.79Å; F589-S592 PolarHBondContact O-N 3.39Å; F589-F593 VanDerWaalsContact O-CD2 3.32Å; F589-F593 WeakPolarHBondContact O-CD2 3.39Å; F589-F593 PolarHBondContact O-N 3.38Å; F589-L637 HydrophobicContact CB-CD1 3.96Å; F589-L637 HydrophobicContact CB-CD2 4.28Å
590	S	95.7	Very high	94.2	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.007	24%	0.24	C	C	.	.	H	α-helix	trans	-63.4	-35	176.8	77.9	0	0	0	0	112.3	I586 S587 D588 A594 L634	I586-S590 WeakPolarHBondContact O-CB 3.48Å; I586-S590 PolarHBondContact O-N 3.42Å; S587-S590 WeakPolarHBondContact CA-OG 3.47Å; S587-S590 PolarHBondContact O-N 3.31Å; S587-S590 PolarHBondContact O-OG 2.88Å; D588-S590 VanDerWaalsContact C-N 3.3Å; D588-S590 PolarHBondContact O-N 2.77Å; S590-A594 VanDerWaalsContact O-CB 3.24Å; S590-A594 WeakPolarHBondContact O-CB 3.44Å; S590-A594 PolarHBondContact O-N 3.09Å; S590-L634 WeakPolarHBondContact O-CD1 3.35Å
591	L	95.3	Very high	94.3	Very high	27 Å²	27	47.9 Å²	47.9	14%	0.141	23%	0.233	C	C	.	.	H	α-helix	trans	-68.6	-44.1	172.3	177.1	62.9	0	0	0	111.3	S587 D588 F589 F593 A594 V595 L797 L798 V801	S587-L591 PolarHBondContact O-N 2.66Å; D588-L591 WeakPolarHBondContact O-CB 3.43Å; D588-L591 PolarHBondContact O-N 3.22Å; D588-L591 VanDerWaalsContact O-N 3.13Å; F589-L591 VanDerWaalsContact C-N 3.29Å; F589-L591 PolarHBondContact O-N 2.79Å; L591-F593 PolarHBondContact O-N 3.46Å; L591-A594 PolarHBondContact O-N 3.23Å; L591-V595 HydrophobicContact CD1-CG2 3.74Å; L591-V595 HydrophobicContact CG-CG2 4.25Å; L591-V595 WeakPolarHBondContact O-CB 3.43Å; L591-V595 WeakPolarHBondContact O-CG2 3.35Å; L591-V595 PolarHBondContact O-N 3.41Å; L591-L797 HydrophobicContact CD1-CB 4.36Å; L591-L798 HydrophobicContact CD1-CB 3.92Å; L591-L798 HydrophobicContact CD1-CD1 4.26Å; L591-L798 HydrophobicContact CD2-CD1 3.79Å; L591-V801 HydrophobicContact CB-CG2 3.85Å; L591-V801 HydrophobicContact CD2-CB 3.93Å; L591-V801 HydrophobicContact CD2-CG1 3.93Å; L591-V801 HydrophobicContact CD2-CG2 3.93Å
592	S	95.4	Very high	94.4	Very high	73 Å²	73	45.6 Å²	45.6	51%	0.51	22%	0.223	S	C	.	.	H	α-helix	trans	-57.9	-47.7	177.8	-59.9	0	0	0	0	112.3	D588 F589 F596	D588-S592 PolarHBondContact O-N 2.9Å; D588-S592 PolarHBondContact O-OG 3.47Å; F589-S592 PolarHBondContact O-N 3.39Å; S592-F596 VanDerWaalsContact O-CB 3.24Å; S592-F596 WeakPolarHBondContact O-CB 3.34Å; S592-F596 PolarHBondContact O-N 3.45Å
593	F	95.7	Very high	94.3	Very high	64 Å²	64	44.7 Å²	44.7	28%	0.281	22%	0.223	S	C	.	.	H	α-helix	trans	-69.4	-33.3	177.2	-77.9	-73.7	0	0	0	113	F589 L591 G597 I633 L634 L637	F589-F593 VanDerWaalsContact O-CD2 3.32Å; F589-F593 WeakPolarHBondContact O-CD2 3.39Å; F589-F593 PolarHBondContact O-N 3.38Å; L591-F593 PolarHBondContact O-N 3.46Å; F593-G597 PolarHBondContact O-N 3.32Å; F593-I633 HydrophobicContact CD1-CB 4.41Å; F593-I633 HydrophobicContact CD1-CG2 4.08Å; F593-I633 HydrophobicContact CD2-CG2 3.82Å; F593-I633 HydrophobicContact CE1-CB 4.45Å; F593-I633 HydrophobicContact CE1-CD1 4.01Å; F593-I633 HydrophobicContact CE1-CG2 3.95Å; F593-I633 HydrophobicContact CE2-CG2 3.68Å; F593-I633 HydrophobicContact CG-CG2 4.03Å; F593-I633 HydrophobicContact CZ-CD1 4.4Å; F593-I633 HydrophobicContact CZ-CG2 3.75Å; F593-L634 HydrophobicContact CB-CB 4.37Å; F593-L637 HydrophobicContact CD2-CD1 3.49Å; F593-L637 VanDerWaalsContact CD2-CD1 3.49Å; F593-L637 HydrophobicContact CE2-CD1 4.03Å; F593-L637 HydrophobicContact CG-CD1 4.4Å
594	A	95.1	Very high	94.1	Very high	2 Å²	2	44 Å²	44	2%	0.017	22%	0.221	C	C	.	.	H	α-helix	trans	-67.1	-44.9	174.2	0	0	0	0	0	112.6	S590 L591 G597 I598 L634 R794 L797	S590-A594 VanDerWaalsContact O-CB 3.24Å; S590-A594 WeakPolarHBondContact O-CB 3.44Å; S590-A594 PolarHBondContact O-N 3.09Å; L591-A594 PolarHBondContact O-N 3.23Å; A594-G597 PolarHBondContact O-N 2.89Å; A594-I598 WeakPolarHBondContact O-CG1 3.48Å; A594-I598 PolarHBondContact O-N 2.99Å; A594-L634 HydrophobicContact CB-CD1 4.17Å; A594-L634 HydrophobicContact CB-CD2 3.95Å; A594-R794 HydrophobicContact CB-CB 4.34Å; A594-L797 HydrophobicContact CB-CD1 3.69Å
595	V	94.4	Very high	93.9	Very high	70 Å²	70	44.1 Å²	44.1	42%	0.424	22%	0.22	S	C	.	.	H	α-helix	trans	-68.1	-40	177	172.2	0	0	0	0	111.1	L591 I598 L599	L591-V595 HydrophobicContact CD1-CG2 3.74Å; L591-V595 HydrophobicContact CG-CG2 4.25Å; L591-V595 WeakPolarHBondContact O-CB 3.43Å; L591-V595 WeakPolarHBondContact O-CG2 3.35Å; L591-V595 PolarHBondContact O-N 3.41Å; V595-I598 PolarHBondContact O-N 3.11Å; V595-L599 WeakPolarHBondContact O-CB 3.06Å; V595-L599 PolarHBondContact O-N 3.05Å
596	F	95.3	Very high	93.6	Very high	103 Å²	103	40.1 Å²	40.1	45%	0.452	21%	0.207	S	C	.	.	H	α-helix	trans	-59.7	-47.8	172.7	177.8	-96.6	0	0	0	111.5	S592 I598 L599 V600	S592-F596 VanDerWaalsContact O-CB 3.24Å; S592-F596 WeakPolarHBondContact O-CB 3.34Å; S592-F596 PolarHBondContact O-N 3.45Å; F596-I598 PolarHBondContact O-N 3.28Å; F596-L599 PolarHBondContact O-N 3.01Å; F596-V600 HydrophobicContact CD1-CG2 4.25Å; F596-V600 HydrophobicContact CD2-CG2 4.33Å; F596-V600 HydrophobicContact CE1-CG2 3.85Å; F596-V600 HydrophobicContact CE2-CG2 3.93Å; F596-V600 HydrophobicContact CG-CG2 4.49Å; F596-V600 HydrophobicContact CZ-CG2 3.68Å; F596-V600 WeakPolarHBondContact O-CG2 3.43Å; F596-V600 PolarHBondContact O-N 3.03Å
597	G	94.7	Very high	93.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.8	-46.6	176.2	0	0	0	0	0	112.5	F593 A594 M601 M791	F593-G597 PolarHBondContact O-N 3.32Å; A594-G597 PolarHBondContact O-N 2.89Å; G597-M601 WeakPolarHBondContact O-CB 3.4Å; G597-M601 PolarHBondContact O-N 2.88Å; G597-M601 VanDerWaalsContact O-N 3.08Å; G597-M791 WeakPolarHBondContact O-CE 3.33Å
598	I	93.7	Very high	92.8	Very high	13 Å²	13	43.5 Å²	43.5	7%	0.067	23%	0.225	C	C	.	.	H	α-helix	trans	-58.5	-48.6	174	-68.4	166.2	0	0	0	110.5	A594 V595 F596 V600 M601 L602 M791 F792 R794 L795	A594-I598 WeakPolarHBondContact O-CG1 3.48Å; A594-I598 PolarHBondContact O-N 2.99Å; V595-I598 PolarHBondContact O-N 3.11Å; F596-I598 PolarHBondContact O-N 3.28Å; I598-V600 PolarHBondContact O-N 3.21Å; I598-M601 HydrophobicContact CG2-CE 4.47Å; I598-M601 PolarHBondContact O-N 3.26Å; I598-L602 HydrophobicContact CG2-CD1 3.96Å; I598-L602 HydrophobicContact CG2-CG 4.21Å; I598-L602 VanDerWaalsContact O-CG 3.31Å; I598-L602 WeakPolarHBondContact O-CG 3.39Å; I598-L602 PolarHBondContact O-N 2.84Å; I598-M791 HydrophobicContact CG1-CE 4.47Å; I598-M791 HydrophobicContact CG1-SD 3.76Å; I598-F792 HydrophobicContact CG2-CD1 4.23Å; I598-F792 HydrophobicContact CG2-CE1 3.97Å; I598-R794 HydrophobicContact CD1-CB 4.38Å; I598-L795 HydrophobicContact CD1-CD2 3.8Å; I598-L795 HydrophobicContact CD1-CG 3.98Å
599	L	94.1	Very high	92.1	Very high	90 Å²	90	44 Å²	44	47%	0.471	23%	0.225	S	C	.	.	H	α-helix	trans	-62.5	-43.2	-177.6	-177.6	62.8	0	0	0	112.6	V595 F596 M601 L602 I603	V595-L599 WeakPolarHBondContact O-CB 3.06Å; V595-L599 PolarHBondContact O-N 3.05Å; F596-L599 PolarHBondContact O-N 3.01Å; L599-M601 VanDerWaalsContact C-N 3.35Å; L599-L602 PolarHBondContact O-N 3.31Å; L599-I603 HydrophobicContact CD1-CD1 4.05Å; L599-I603 HydrophobicContact CD1-CG1 4.42Å; L599-I603 HydrophobicContact CG-CD1 3.9Å; L599-I603 WeakPolarHBondContact O-CB 3.39Å; L599-I603 VanDerWaalsContact O-CG1 3.25Å; L599-I603 WeakPolarHBondContact O-CG1 3.4Å; L599-I603 PolarHBondContact O-N 3.32Å
600	V	93.8	Very high	91.6	Very high	20 Å²	20	41.9 Å²	41.9	12%	0.121	23%	0.229	C	C	.	.	H	α-helix	trans	-66.1	-38.5	177	179.2	0	0	0	0	111	F596 I598 I603 E604 T623 I627	F596-V600 HydrophobicContact CD1-CG2 4.25Å; F596-V600 HydrophobicContact CD2-CG2 4.33Å; F596-V600 HydrophobicContact CE1-CG2 3.85Å; F596-V600 HydrophobicContact CE2-CG2 3.93Å; F596-V600 HydrophobicContact CG-CG2 4.49Å; F596-V600 HydrophobicContact CZ-CG2 3.68Å; F596-V600 WeakPolarHBondContact O-CG2 3.43Å; F596-V600 PolarHBondContact O-N 3.03Å; I598-V600 PolarHBondContact O-N 3.21Å; V600-I603 PolarHBondContact O-N 2.97Å; V600-E604 WeakPolarHBondContact O-CB 3.29Å; V600-E604 PolarHBondContact O-N 2.86Å; V600-T623 HydrophobicContact CG1-CG2 4.5Å; V600-I627 HydrophobicContact CB-CG1 3.97Å; V600-I627 HydrophobicContact CG1-CD1 4.14Å; V600-I627 HydrophobicContact CG1-CG1 3.66Å
601	M	92	Very high	90.8	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-64.8	-42	174.2	173.1	-81.6	-72.1	0	0	112.8	G597 I598 L599 T605 I627 P681 M791 F792 W856	G597-M601 WeakPolarHBondContact O-CB 3.4Å; G597-M601 PolarHBondContact O-N 2.88Å; G597-M601 VanDerWaalsContact O-N 3.08Å; I598-M601 HydrophobicContact CG2-CE 4.47Å; I598-M601 PolarHBondContact O-N 3.26Å; L599-M601 VanDerWaalsContact C-N 3.35Å; M601-T605 WeakPolarHBondContact O-CB 3.49Å; M601-T605 PolarHBondContact O-N 3.04Å; M601-T605 PolarHBondContact O-OG1 2.93Å; M601-I627 HydrophobicContact CB-CD1 3.9Å; M601-P681 HydrophobicContact CG-CG 4.4Å; M601-M791 HydrophobicContact CB-CE 3.27Å; M601-M791 HydrophobicContact CE-CB 4.47Å; M601-M791 HydrophobicContact CE-CE 3.79Å; M601-M791 HydrophobicContact CG-CE 3.62Å; M601-F792 HydrophobicContact CE-CE1 4.37Å; M601-F792 HydrophobicContact CE-CE2 4.26Å; M601-F792 HydrophobicContact CE-CZ 4.02Å; M601-W856 HydrophobicContact CE-CH2 4.27Å; M601-W856 HydrophobicContact CE-CZ3 4.47Å; M601-W856 HydrophobicContact SD-CH2 3.41Å; M601-W856 WeakPolarHBondContact SD-CH2 3.32Å; M601-W856 HydrophobicContact SD-CZ2 3.87Å; M601-W856 HydrophobicContact SD-CZ3 4.16Å
602	L	92.5	Very high	90.3	Very high	44 Å²	44	48.1 Å²	48.1	23%	0.23	28%	0.281	C	S	.	.	H	α-helix	trans	-59.1	-50	174	-71.6	173.9	0	0	0	110	I598 L599 T605 E606 F792 W856	I598-L602 HydrophobicContact CG2-CD1 3.96Å; I598-L602 HydrophobicContact CG2-CG 4.21Å; I598-L602 VanDerWaalsContact O-CG 3.31Å; I598-L602 WeakPolarHBondContact O-CG 3.39Å; I598-L602 PolarHBondContact O-N 2.84Å; L599-L602 PolarHBondContact O-N 3.31Å; L602-T605 PolarHBondContact O-N 2.92Å; L602-E606 WeakPolarHBondContact O-CB 3.22Å; L602-E606 VanDerWaalsContact O-CG 3.27Å; L602-E606 WeakPolarHBondContact O-CG 3.49Å; L602-E606 PolarHBondContact O-N 2.8Å; L602-F792 HydrophobicContact CD2-CE1 4.22Å; L602-F792 HydrophobicContact CD2-CZ 3.87Å; L602-W856 HydrophobicContact CD2-CD2 3.57Å; L602-W856 HydrophobicContact CD2-CE3 4.27Å; L602-W856 HydrophobicContact CD2-CG 3.73Å; L602-W856 HydrophobicContact CD2-CH2 4.46Å; L602-W856 HydrophobicContact CD2-CZ2 3.82Å
603	I	91.8	Very high	89.9	Confident	81 Å²	81	46.1 Å²	46.1	42%	0.415	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-46.8	179.9	-70.6	166.9	0	0	0	111.3	L599 V600 L607	L599-I603 HydrophobicContact CD1-CD1 4.05Å; L599-I603 HydrophobicContact CD1-CG1 4.42Å; L599-I603 HydrophobicContact CG-CD1 3.9Å; L599-I603 WeakPolarHBondContact O-CB 3.39Å; L599-I603 VanDerWaalsContact O-CG1 3.25Å; L599-I603 WeakPolarHBondContact O-CG1 3.4Å; L599-I603 PolarHBondContact O-N 3.32Å; V600-I603 PolarHBondContact O-N 2.97Å; I603-L607 HydrophobicContact CG2-CD1 3.62Å; I603-L607 HydrophobicContact CG2-CG 4.39Å; I603-L607 WeakPolarHBondContact O-CB 3.28Å; I603-L607 WeakPolarHBondContact O-CD1 3.34Å; I603-L607 WeakPolarHBondContact O-CG 3.19Å; I603-L607 PolarHBondContact O-N 3.42Å
604	E	89.8	Confident	89.1	Confident	8 Å²	8	50.7 Å²	50.7	4%	0.037	28%	0.284	C	S	.	.	H	α-helix	trans	-60.1	-50.2	177.4	171.4	166.1	-174.1	0	0	111.6	V600 E606 L607 I608 Y613 S620 T623 K624	V600-E604 WeakPolarHBondContact O-CB 3.29Å; V600-E604 PolarHBondContact O-N 2.86Å; E604-E606 PolarHBondContact O-N 2.91Å; E604-L607 PolarHBondContact O-N 3.45Å; E604-I608 HydrophobicContact CG-CD1 3.67Å; E604-I608 HydrophobicContact CG-CG1 4.45Å; E604-I608 VanDerWaalsContact O-CG1 3.31Å; E604-I608 WeakPolarHBondContact O-CG1 3.25Å; E604-I608 PolarHBondContact O-N 3.42Å; E604-Y613 WeakPolarHBondContact CA-OH 3.3Å; E604-S620 PolarHBondContact OE1-OG 3.2Å; E604-T623 PolarHBondContact OE1-OG1 3.17Å; E604-T623 VanDerWaalsContact OE2-CB 3.23Å; E604-T623 WeakPolarHBondContact OE2-CB 3.35Å; E604-T623 PolarHBondContact OE2-OG1 3.49Å; E604-K624 VanDerWaalsContact OE1-CE 3.26Å; E604-K624 WeakPolarHBondContact OE1-CE 3.37Å; E604-K624 VanDerWaalsContact OE1-CG 3.32Å; E604-K624 WeakPolarHBondContact OE1-CG 3.42Å; E604-K624 WeakPolarHBondContact OE2-CG 3.44Å; E604-K624 PolarHBondContact OE2-N 3.22Å
605	T	86.9	Confident	88.2	Confident	15 Å²	15	54.5 Å²	54.5	9%	0.092	30%	0.3	C	S	.	.	H	α-helix	trans	-63.2	-42.4	-177.2	-53.5	0	0	0	0	111.7	M601 L602 I608 F609 L785 W856	M601-T605 WeakPolarHBondContact O-CB 3.49Å; M601-T605 PolarHBondContact O-N 3.04Å; M601-T605 PolarHBondContact O-OG1 2.93Å; L602-T605 PolarHBondContact O-N 2.92Å; T605-I608 PolarHBondContact O-N 2.73Å; T605-F609 HydrophobicContact CG2-CD2 3.98Å; T605-F609 HydrophobicContact CG2-CE1 4.28Å; T605-F609 HydrophobicContact CG2-CE2 3.48Å; T605-F609 VanDerWaalsContact CG2-CE2 3.48Å; T605-F609 HydrophobicContact CG2-CZ 3.65Å; T605-F609 WeakPolarHBondContact O-CD2 3.34Å; T605-F609 VanDerWaalsContact O-CG 3.27Å; T605-F609 WeakPolarHBondContact O-CG 3.35Å; T605-F609 PolarHBondContact O-N 3.42Å; T605-L785 HydrophobicContact CG2-CD1 3.43Å; T605-L785 VanDerWaalsContact CG2-CD1 3.43Å; T605-W856 HydrophobicContact CG2-CH2 3.99Å; T605-W856 HydrophobicContact CG2-CZ2 3.53Å
606	E	89	Confident	87.4	Confident	46 Å²	46	56.9 Å²	56.9	22%	0.215	31%	0.311	C	S	.	.	H	α-helix	trans	-68.7	-34.2	177.7	-69.7	-62.3	148	0	0	112.6	L602 E604 F609 A610 W856 R859	L602-E606 WeakPolarHBondContact O-CB 3.22Å; L602-E606 VanDerWaalsContact O-CG 3.27Å; L602-E606 WeakPolarHBondContact O-CG 3.49Å; L602-E606 PolarHBondContact O-N 2.8Å; E604-E606 PolarHBondContact O-N 2.91Å; E606-F609 PolarHBondContact O-N 2.87Å; E606-A610 VanDerWaalsContact O-CB 3.25Å; E606-A610 WeakPolarHBondContact O-CB 3.41Å; E606-A610 PolarHBondContact O-N 3.18Å; E606-W856 PolarHBondContact OE1-NE1 2.98Å; E606-R859 IonicContact OE1-CZ 3.02Å; E606-R859 IonicContact OE1-NE 3.7Å; E606-R859 PolarHBondContact OE1-NE 3.01Å; E606-R859 IonicContact OE1-NH2 2.77Å; E606-R859 IonicContact OE2-CZ 3.64Å; E606-R859 VanDerWaalsContact OE2-CZ 3.28Å; E606-R859 IonicContact OE2-NE 2.74Å; E606-R859 PolarHBondContact OE2-NE 2.93Å; E606-R859 IonicContact OE2-NH2 3.44Å; E606-R859 PolarHBondContact OE2-NH2 3.46Å
607	L	88	Confident	86.9	Confident	59 Å²	59	53.1 Å²	53.1	31%	0.309	30%	0.297	S	S	.	.	H	α-helix	trans	-71.3	-33.8	174.9	-71.7	169.8	0	0	0	112.5	I603 E604 G611 V612 Y613	I603-L607 HydrophobicContact CG2-CD1 3.62Å; I603-L607 HydrophobicContact CG2-CG 4.39Å; I603-L607 WeakPolarHBondContact O-CB 3.28Å; I603-L607 WeakPolarHBondContact O-CD1 3.34Å; I603-L607 WeakPolarHBondContact O-CG 3.19Å; I603-L607 PolarHBondContact O-N 3.42Å; E604-L607 PolarHBondContact O-N 3.45Å; L607-G611 PolarHBondContact O-N 3.14Å; L607-V612 HydrophobicContact CD2-CB 4.19Å; L607-V612 HydrophobicContact CD2-CG1 4.36Å; L607-V612 HydrophobicContact CD2-CG2 4Å; L607-V612 PolarHBondContact O-N 3.04Å; L607-V612 VanDerWaalsContact O-N 3.09Å; L607-Y613 HydrophobicContact CB-CD1 4.43Å; L607-Y613 HydrophobicContact CB-CE1 3.63Å; L607-Y613 HydrophobicContact CD1-CE1 3.87Å; L607-Y613 HydrophobicContact CG-CE1 4.33Å
608	I	84.2	Confident	86.6	Confident	36 Å²	36	59.4 Å²	59.4	19%	0.185	33%	0.33	C	S	.	.	H	α-helix	trans	-66.1	-44.8	169.6	-68.3	167	0	0	0	110.3	E604 T605 A610 G611 Y613 K615	E604-I608 HydrophobicContact CG-CD1 3.67Å; E604-I608 HydrophobicContact CG-CG1 4.45Å; E604-I608 VanDerWaalsContact O-CG1 3.31Å; E604-I608 WeakPolarHBondContact O-CG1 3.25Å; E604-I608 PolarHBondContact O-N 3.42Å; T605-I608 PolarHBondContact O-N 2.73Å; I608-A610 VanDerWaalsContact C-N 3.31Å; I608-A610 PolarHBondContact O-N 3.39Å; I608-G611 PolarHBondContact O-N 2.94Å; I608-G611 VanDerWaalsContact O-N 3.14Å; I608-Y613 HydrophobicContact CD1-CE2 4.33Å; I608-Y613 HydrophobicContact CG1-CD2 4.17Å; I608-Y613 HydrophobicContact CG1-CE2 3.66Å; I608-K615 HydrophobicContact CD1-CG 4.38Å; I608-K615 HydrophobicContact CG2-CG 4.13Å
609	F	81.6	Confident	86.3	Confident	55 Å²	55	66.5 Å²	66.5	24%	0.241	36%	0.357	C	S	.	.	H	α-helix	trans	-66.8	-29.5	176.1	-68.6	-23.8	0	0	0	113.6	T605 E606 G611 L785 R859 S863	T605-F609 HydrophobicContact CG2-CD2 3.98Å; T605-F609 HydrophobicContact CG2-CE1 4.28Å; T605-F609 HydrophobicContact CG2-CE2 3.48Å; T605-F609 VanDerWaalsContact CG2-CE2 3.48Å; T605-F609 HydrophobicContact CG2-CZ 3.65Å; T605-F609 WeakPolarHBondContact O-CD2 3.34Å; T605-F609 VanDerWaalsContact O-CG 3.27Å; T605-F609 WeakPolarHBondContact O-CG 3.35Å; T605-F609 PolarHBondContact O-N 3.42Å; E606-F609 PolarHBondContact O-N 2.87Å; F609-G611 PolarHBondContact O-N 3.24Å; F609-L785 HydrophobicContact CE1-CD2 4.41Å; F609-L785 HydrophobicContact CZ-CD1 3.95Å; F609-L785 HydrophobicContact CZ-CD2 3.92Å; F609-R859 HydrophobicContact CE2-CG 4.36Å; F609-S863 WeakPolarHBondContact CE1-OG 3.44Å
610	A	84	Confident	86.1	Confident	70 Å²	70	62.2 Å²	62.2	58%	0.579	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-2.7	173.9	0	0	0	0	0	113.5	E606 I608 V612	E606-A610 VanDerWaalsContact O-CB 3.25Å; E606-A610 WeakPolarHBondContact O-CB 3.41Å; E606-A610 PolarHBondContact O-N 3.18Å; I608-A610 VanDerWaalsContact C-N 3.31Å; I608-A610 PolarHBondContact O-N 3.39Å; A610-V612 HydrophobicContact CB-CG2 3.94Å; A610-V612 PolarHBondContact O-N 3.39Å
611	G	80	Confident	85.8	Confident	63 Å²	63	67 Å²	67	65%	0.649	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	19.1	179.7	0	0	0	0	0	114.5	L607 I608 F609 Y613	L607-G611 PolarHBondContact O-N 3.14Å; I608-G611 PolarHBondContact O-N 2.94Å; I608-G611 VanDerWaalsContact O-N 3.14Å; F609-G611 PolarHBondContact O-N 3.24Å; G611-Y613 VanDerWaalsContact C-N 3.31Å; G611-Y613 PolarHBondContact O-N 3.24Å
612	V	85.2	Confident	85.8	Confident	97 Å²	97	71 Å²	71	59%	0.588	38%	0.375	S	S	*	.	S	Bend	trans	-70.9	-30.6	-177.1	179.1	0	0	0	0	111.5	L607 A610	L607-V612 HydrophobicContact CD2-CB 4.19Å; L607-V612 HydrophobicContact CD2-CG1 4.36Å; L607-V612 HydrophobicContact CD2-CG2 4Å; L607-V612 PolarHBondContact O-N 3.04Å; L607-V612 VanDerWaalsContact O-N 3.09Å; A610-V612 HydrophobicContact CB-CG2 3.94Å; A610-V612 PolarHBondContact O-N 3.39Å
613	Y	85.5	Confident	85.7	Confident	31 Å²	31	70.3 Å²	70.3	12%	0.122	37%	0.372	C	S	.	.	S	Bend	trans	-151.2	152.9	169.4	53.7	-105.9	0	0	0	111.5	E604 L607 I608 G611 S617	E604-Y613 WeakPolarHBondContact CA-OH 3.3Å; L607-Y613 HydrophobicContact CB-CD1 4.43Å; L607-Y613 HydrophobicContact CB-CE1 3.63Å; L607-Y613 HydrophobicContact CD1-CE1 3.87Å; L607-Y613 HydrophobicContact CG-CE1 4.33Å; I608-Y613 HydrophobicContact CD1-CE2 4.33Å; I608-Y613 HydrophobicContact CG1-CD2 4.17Å; I608-Y613 HydrophobicContact CG1-CE2 3.66Å; G611-Y613 VanDerWaalsContact C-N 3.31Å; G611-Y613 PolarHBondContact O-N 3.24Å; Y613-S617 WeakPolarHBondContact CD2-OG 3.23Å
614	E	80.4	Confident	85.7	Confident	159 Å²	159	66.9 Å²	66.9	74%	0.743	35%	0.354	S	S	*	.			trans	-79.1	160.6	175.7	-62.7	-179.3	155.7	0	0	111.7	D616 S617	E614-D616 PolarHBondContact O-N 2.94Å; E614-S617 WeakPolarHBondContact O-CB 3.4Å; E614-S617 PolarHBondContact O-N 2.9Å; E614-S617 PolarHBondContact O-OG 3.29Å
615	K	75.1	Confident	85.8	Confident	82 Å²	82	68.4 Å²	68.4	36%	0.357	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-25	-176	-69.5	173.7	-179.6	168	0	113.9	I608 S617 S782	I608-K615 HydrophobicContact CD1-CG 4.38Å; I608-K615 HydrophobicContact CG2-CG 4.13Å; K615-S617 VanDerWaalsContact C-N 3.3Å; K615-S782 PolarHBondContact NZ-OG 3.23Å
616	D	77.3	Confident	86.1	Confident	120 Å²	120	70.2 Å²	70.2	64%	0.642	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	3.9	177.8	-57.5	-51.3	0	0	0	112.8	E614	E614-D616 PolarHBondContact O-N 2.94Å
617	S	84.8	Confident	86.3	Confident	25 Å²	25	68 Å²	68	18%	0.175	37%	0.366	C	S	.	.	S	Bend	trans	-70.5	149.9	177.3	69.2	0	0	0	0	112.8	Y613 E614 K615 Y619 S620 F621	Y613-S617 WeakPolarHBondContact CD2-OG 3.23Å; E614-S617 WeakPolarHBondContact O-CB 3.4Å; E614-S617 PolarHBondContact O-N 2.9Å; E614-S617 PolarHBondContact O-OG 3.29Å; K615-S617 VanDerWaalsContact C-N 3.3Å; S617-Y619 PolarHBondContact O-N 3.1Å; S617-Y619 VanDerWaalsContact O-N 3.13Å; S617-S620 PolarHBondContact O-N 3.43Å; S617-S620 PolarHBondContact OG-N 3.43Å; S617-F621 PolarHBondContact O-N 3.15Å; S617-F621 VanDerWaalsContact O-N 3.15Å
618	I	88.1	Confident	86.6	Confident	132 Å²	132	66.8 Å²	66.8	68%	0.677	36%	0.363	S	S	*	.	H	α-helix	trans	-55.2	-30.9	172.2	-59.2	171.7	0	0	0	110.9	F621 I622	I618-F621 PolarHBondContact O-N 3.03Å; I618-I622 HydrophobicContact CG2-CD1 3.8Å; I618-I622 HydrophobicContact CG2-CG1 4.33Å; I618-I622 WeakPolarHBondContact O-CB 3.41Å; I618-I622 VanDerWaalsContact O-CG1 3.27Å; I618-I622 WeakPolarHBondContact O-CG1 3.42Å; I618-I622 PolarHBondContact O-N 3.14Å
619	Y	89	Confident	87.1	Confident	161 Å²	161	69.7 Å²	69.7	63%	0.631	38%	0.378	S	S	*	.	H	α-helix	trans	-66.6	-46.8	178.4	-59.1	-66.6	0	0	0	112.8	S617 F621 I622 T623	S617-Y619 PolarHBondContact O-N 3.1Å; S617-Y619 VanDerWaalsContact O-N 3.13Å; Y619-F621 VanDerWaalsContact C-N 3.34Å; Y619-F621 PolarHBondContact O-N 3.22Å; Y619-I622 PolarHBondContact O-N 3.06Å; Y619-T623 PolarHBondContact O-N 3.41Å; Y619-T623 PolarHBondContact O-OG1 2.96Å; Y619-T623 VanDerWaalsContact O-OG1 3.14Å
620	S	88.2	Confident	87.8	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.007	37%	0.367	C	S	.	.	H	α-helix	trans	-62.9	-40.3	173	177.4	0	0	0	0	111.4	E604 S617 I622 T623 K624	E604-S620 PolarHBondContact OE1-OG 3.2Å; S617-S620 PolarHBondContact O-N 3.43Å; S617-S620 PolarHBondContact OG-N 3.43Å; S620-I622 VanDerWaalsContact C-N 3.35Å; S620-I622 PolarHBondContact O-N 3.33Å; S620-T623 WeakPolarHBondContact CA-OG1 3.33Å; S620-T623 PolarHBondContact O-N 3.03Å; S620-T623 PolarHBondContact O-OG1 2.66Å; S620-T623 VanDerWaalsContact O-OG1 3.1Å; S620-K624 WeakPolarHBondContact O-CB 3.07Å; S620-K624 WeakPolarHBondContact O-CG 3.06Å; S620-K624 PolarHBondContact O-N 3.42Å; S620-K624 WeakPolarHBondContact OG-CE 3.39Å
621	F	88	Confident	88.3	Confident	119 Å²	119	64.1 Å²	64.1	52%	0.522	34%	0.341	S	S	.	.	H	α-helix	trans	-60.9	-42.3	176.1	-174	-94.7	0	0	0	112.5	S617 I618 Y619 T625 P683	S617-F621 PolarHBondContact O-N 3.15Å; S617-F621 VanDerWaalsContact O-N 3.15Å; I618-F621 PolarHBondContact O-N 3.03Å; Y619-F621 VanDerWaalsContact C-N 3.34Å; Y619-F621 PolarHBondContact O-N 3.22Å; F621-T625 VanDerWaalsContact O-CB 3.26Å; F621-T625 WeakPolarHBondContact O-CB 3.38Å; F621-T625 PolarHBondContact O-N 2.73Å; F621-T625 PolarHBondContact O-OG1 3.34Å; F621-P683 HydrophobicContact CD2-CB 4.2Å; F621-P683 HydrophobicContact CE2-CB 3.92Å; F621-P683 HydrophobicContact CZ-CB 4.48Å
622	I	91.9	Very high	89	Confident	88 Å²	88	65.3 Å²	65.3	45%	0.451	34%	0.338	S	S	.	.	H	α-helix	trans	-65.1	-46.3	175.8	-71.6	168.4	0	0	0	111	I618 Y619 S620 T625 C626	I618-I622 HydrophobicContact CG2-CD1 3.8Å; I618-I622 HydrophobicContact CG2-CG1 4.33Å; I618-I622 WeakPolarHBondContact O-CB 3.41Å; I618-I622 VanDerWaalsContact O-CG1 3.27Å; I618-I622 WeakPolarHBondContact O-CG1 3.42Å; I618-I622 PolarHBondContact O-N 3.14Å; Y619-I622 PolarHBondContact O-N 3.06Å; S620-I622 VanDerWaalsContact C-N 3.35Å; S620-I622 PolarHBondContact O-N 3.33Å; I622-T625 PolarHBondContact O-N 3.04Å; I622-C626 PolarHBondContact O-N 3.05Å; I622-C626 PolarHBondContact O-SG 2.87Å; I622-C626 VanDerWaalsContact O-SG 3.38Å
623	T	91.1	Very high	89.6	Confident	29 Å²	29	64.1 Å²	64.1	18%	0.178	33%	0.328	C	S	.	.	H	α-helix	trans	-66.7	-43	-178.8	50.5	0	0	0	0	112.4	V600 E604 Y619 S620 T625 C626 I627	V600-T623 HydrophobicContact CG1-CG2 4.5Å; E604-T623 PolarHBondContact OE1-OG1 3.17Å; E604-T623 VanDerWaalsContact OE2-CB 3.23Å; E604-T623 WeakPolarHBondContact OE2-CB 3.35Å; E604-T623 PolarHBondContact OE2-OG1 3.49Å; Y619-T623 PolarHBondContact O-N 3.41Å; Y619-T623 PolarHBondContact O-OG1 2.96Å; Y619-T623 VanDerWaalsContact O-OG1 3.14Å; S620-T623 WeakPolarHBondContact CA-OG1 3.33Å; S620-T623 PolarHBondContact O-N 3.03Å; S620-T623 PolarHBondContact O-OG1 2.66Å; S620-T623 VanDerWaalsContact O-OG1 3.1Å; T623-T625 VanDerWaalsContact C-N 3.3Å; T623-T625 PolarHBondContact O-N 2.87Å; T623-C626 WeakPolarHBondContact O-CB 3.35Å; T623-C626 PolarHBondContact O-N 3.25Å; T623-I627 VanDerWaalsContact O-CG1 3.32Å; T623-I627 WeakPolarHBondContact O-CG1 3.31Å; T623-I627 PolarHBondContact O-N 2.97Å
624	K	90.9	Very high	90.1	Very high	8 Å²	8	62.6 Å²	62.6	4%	0.035	32%	0.322	C	S	.	.	H	α-helix	trans	-59	-39.7	171.3	-70.8	172.6	175.2	176.9	0	112.5	E604 S620 I627 S628 P683 D784	E604-K624 VanDerWaalsContact OE1-CE 3.26Å; E604-K624 WeakPolarHBondContact OE1-CE 3.37Å; E604-K624 VanDerWaalsContact OE1-CG 3.32Å; E604-K624 WeakPolarHBondContact OE1-CG 3.42Å; E604-K624 WeakPolarHBondContact OE2-CG 3.44Å; E604-K624 PolarHBondContact OE2-N 3.22Å; S620-K624 WeakPolarHBondContact O-CB 3.07Å; S620-K624 WeakPolarHBondContact O-CG 3.06Å; S620-K624 PolarHBondContact O-N 3.42Å; S620-K624 WeakPolarHBondContact OG-CE 3.39Å; K624-I627 PolarHBondContact O-N 3.46Å; K624-S628 WeakPolarHBondContact O-CB 3.36Å; K624-S628 PolarHBondContact O-N 2.94Å; K624-P683 HydrophobicContact CB-CB 3.86Å; K624-D784 WeakPolarHBondContact CE-OD2 3.38Å; K624-D784 IonicContact NZ-OD1 3.9Å; K624-D784 IonicContact NZ-OD2 2.7Å; K624-D784 PolarHBondContact NZ-OD2 2.94Å
625	T	92.1	Very high	90.8	Very high	41 Å²	41	56.3 Å²	56.3	25%	0.252	29%	0.293	S	S	.	.	H	α-helix	trans	-65.6	-44.3	176.1	-60.8	0	0	0	0	111.2	F621 I622 T623 I627 S628 I629	F621-T625 VanDerWaalsContact O-CB 3.26Å; F621-T625 WeakPolarHBondContact O-CB 3.38Å; F621-T625 PolarHBondContact O-N 2.73Å; F621-T625 PolarHBondContact O-OG1 3.34Å; I622-T625 PolarHBondContact O-N 3.04Å; T623-T625 VanDerWaalsContact C-N 3.3Å; T623-T625 PolarHBondContact O-N 2.87Å; T625-I627 PolarHBondContact O-N 3.07Å; T625-S628 PolarHBondContact O-N 2.9Å; T625-I629 HydrophobicContact CG2-CD1 3.86Å; T625-I629 HydrophobicContact CG2-CG1 4.46Å; T625-I629 WeakPolarHBondContact O-CG1 3.3Å; T625-I629 PolarHBondContact O-N 3.39Å
626	C	93.6	Very high	91.8	Very high	52 Å²	52	54.4 Å²	54.4	35%	0.351	30%	0.297	S	S	.	.	H	α-helix	trans	-61.4	-41.2	173.8	-74	0	0	0	0	112.6	I622 T623 S630	I622-C626 PolarHBondContact O-N 3.05Å; I622-C626 PolarHBondContact O-SG 2.87Å; I622-C626 VanDerWaalsContact O-SG 3.38Å; T623-C626 WeakPolarHBondContact O-CB 3.35Å; T623-C626 PolarHBondContact O-N 3.25Å; C626-S630 WeakPolarHBondContact O-CB 3.45Å; C626-S630 PolarHBondContact O-N 3.34Å
627	I	93.8	Very high	92.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57.7	-55.9	171.5	-67.2	162.3	0	0	0	108.6	V600 M601 T623 K624 T625 I629 S630 T631 H680 P681	V600-I627 HydrophobicContact CB-CG1 3.97Å; V600-I627 HydrophobicContact CG1-CD1 4.14Å; V600-I627 HydrophobicContact CG1-CG1 3.66Å; M601-I627 HydrophobicContact CB-CD1 3.9Å; T623-I627 VanDerWaalsContact O-CG1 3.32Å; T623-I627 WeakPolarHBondContact O-CG1 3.31Å; T623-I627 PolarHBondContact O-N 2.97Å; K624-I627 PolarHBondContact O-N 3.46Å; T625-I627 PolarHBondContact O-N 3.07Å; I627-I629 PolarHBondContact O-N 2.91Å; I627-S630 WeakPolarHBondContact O-CA 3.36Å; I627-S630 WeakPolarHBondContact O-CB 3.39Å; I627-S630 PolarHBondContact O-N 3.09Å; I627-S630 PolarHBondContact O-OG 2.92Å; I627-T631 HydrophobicContact CG2-CG2 4.2Å; I627-T631 WeakPolarHBondContact O-CG2 3.42Å; I627-T631 PolarHBondContact O-N 3.37Å; I627-H680 HydrophobicContact CG2-CB 4.04Å; I627-P681 HydrophobicContact CD1-CG 4.29Å
628	S	93.9	Very high	93.2	Very high	34 Å²	34	48.9 Å²	48.9	24%	0.238	27%	0.265	C	S	.	.	H	α-helix	trans	-57.3	-46.3	-176.2	-162.3	0	0	0	0	113.2	K624 T625 S630 T631 C632 H680	K624-S628 WeakPolarHBondContact O-CB 3.36Å; K624-S628 PolarHBondContact O-N 2.94Å; T625-S628 PolarHBondContact O-N 2.9Å; S628-S630 VanDerWaalsContact C-N 3.35Å; S628-S630 PolarHBondContact O-N 3.43Å; S628-T631 WeakPolarHBondContact O-CA 3.4Å; S628-T631 WeakPolarHBondContact O-CB 3.47Å; S628-T631 PolarHBondContact O-N 2.85Å; S628-T631 PolarHBondContact O-OG1 3.33Å; S628-C632 PolarHBondContact O-N 3.39Å; S628-H680 WeakPolarHBondContact CA-NE2 3.37Å; S628-H680 WeakPolarHBondContact CB-NE2 3.45Å; S628-H680 PolarHBondContact OG-NE2 3.44Å
629	I	94.7	Very high	93.6	Very high	97 Å²	97	46.4 Å²	46.4	50%	0.497	25%	0.253	S	S	.	.	H	α-helix	trans	-58.2	-45.6	174.2	-68.3	167.6	0	0	0	110.9	T625 I627 T631 C632 I633	T625-I629 HydrophobicContact CG2-CD1 3.86Å; T625-I629 HydrophobicContact CG2-CG1 4.46Å; T625-I629 WeakPolarHBondContact O-CG1 3.3Å; T625-I629 PolarHBondContact O-N 3.39Å; I627-I629 PolarHBondContact O-N 2.91Å; I629-T631 VanDerWaalsContact C-N 3.25Å; I629-T631 PolarHBondContact O-N 3.22Å; I629-C632 PolarHBondContact O-N 2.96Å; I629-I633 HydrophobicContact CG2-CD1 4.03Å; I629-I633 WeakPolarHBondContact O-CG1 3.45Å; I629-I633 PolarHBondContact O-N 3.31Å; I629-I633 VanDerWaalsContact O-N 3.1Å
630	S	95.6	Very high	93.9	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-62.1	-32.6	176.2	80.2	0	0	0	0	112.6	C626 I627 S628 L634	C626-S630 WeakPolarHBondContact O-CB 3.45Å; C626-S630 PolarHBondContact O-N 3.34Å; I627-S630 WeakPolarHBondContact O-CA 3.36Å; I627-S630 WeakPolarHBondContact O-CB 3.39Å; I627-S630 PolarHBondContact O-N 3.09Å; I627-S630 PolarHBondContact O-OG 2.92Å; S628-S630 VanDerWaalsContact C-N 3.35Å; S628-S630 PolarHBondContact O-N 3.43Å; S630-L634 VanDerWaalsContact O-CB 3.25Å; S630-L634 WeakPolarHBondContact O-CB 3.44Å; S630-L634 PolarHBondContact O-N 2.85Å
631	T	95.6	Very high	94.2	Very high	4 Å²	4	41.7 Å²	41.7	3%	0.025	24%	0.241	C	C	.	.	H	α-helix	trans	-70.5	-39.2	175.3	82.1	0	0	0	0	112.3	I627 S628 I629 L634 L635 H680	I627-T631 HydrophobicContact CG2-CG2 4.2Å; I627-T631 WeakPolarHBondContact O-CG2 3.42Å; I627-T631 PolarHBondContact O-N 3.37Å; S628-T631 WeakPolarHBondContact O-CA 3.4Å; S628-T631 WeakPolarHBondContact O-CB 3.47Å; S628-T631 PolarHBondContact O-N 2.85Å; S628-T631 PolarHBondContact O-OG1 3.33Å; I629-T631 VanDerWaalsContact C-N 3.25Å; I629-T631 PolarHBondContact O-N 3.22Å; T631-L634 WeakPolarHBondContact O-CB 3.42Å; T631-L634 PolarHBondContact O-N 2.95Å; T631-L635 VanDerWaalsContact O-CG 3.32Å; T631-L635 WeakPolarHBondContact O-CG 3.5Å; T631-L635 PolarHBondContact O-N 3.05Å; T631-H680 HydrophobicContact CG2-CB 3.81Å; T631-H680 PolarHBondContact OG1-CE1 2.77Å
632	C	95.3	Very high	94.5	Very high	88 Å²	88	36.7 Å²	36.7	60%	0.595	22%	0.219	S	C	*	.	H	α-helix	trans	-62.8	-45.4	177.5	-173.8	0	0	0	0	110.8	S628 I629 L635 G636	S628-C632 PolarHBondContact O-N 3.39Å; I629-C632 PolarHBondContact O-N 2.96Å; C632-L635 PolarHBondContact O-N 2.9Å; C632-G636 PolarHBondContact O-N 3.44Å
633	I	96.4	Very high	94.5	Very high	72 Å²	72	35.6 Å²	35.6	37%	0.369	22%	0.217	S	C	.	.	H	α-helix	trans	-62	-44.2	173.9	-62.6	167.1	0	0	0	110.8	F593 I629 L635 G636 L637	F593-I633 HydrophobicContact CD1-CB 4.41Å; F593-I633 HydrophobicContact CD1-CG2 4.08Å; F593-I633 HydrophobicContact CD2-CG2 3.82Å; F593-I633 HydrophobicContact CE1-CB 4.45Å; F593-I633 HydrophobicContact CE1-CD1 4.01Å; F593-I633 HydrophobicContact CE1-CG2 3.95Å; F593-I633 HydrophobicContact CE2-CG2 3.68Å; F593-I633 HydrophobicContact CG-CG2 4.03Å; F593-I633 HydrophobicContact CZ-CD1 4.4Å; F593-I633 HydrophobicContact CZ-CG2 3.75Å; I629-I633 HydrophobicContact CG2-CD1 4.03Å; I629-I633 WeakPolarHBondContact O-CG1 3.45Å; I629-I633 PolarHBondContact O-N 3.31Å; I629-I633 VanDerWaalsContact O-N 3.1Å; I633-L635 PolarHBondContact O-N 3.31Å; I633-G636 PolarHBondContact O-N 2.9Å; I633-L637 HydrophobicContact CG2-CD1 4.01Å; I633-L637 HydrophobicContact CG2-CG 4.48Å; I633-L637 WeakPolarHBondContact O-CG 3.36Å; I633-L637 PolarHBondContact O-N 3.06Å
634	L	96.2	Very high	94.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58.9	-45	176.6	176.3	60.6	0	0	0	112.6	S590 F593 A594 S630 T631 L637 I638 C677 L797	S590-L634 WeakPolarHBondContact O-CD1 3.35Å; F593-L634 HydrophobicContact CB-CB 4.37Å; A594-L634 HydrophobicContact CB-CD1 4.17Å; A594-L634 HydrophobicContact CB-CD2 3.95Å; S630-L634 VanDerWaalsContact O-CB 3.25Å; S630-L634 WeakPolarHBondContact O-CB 3.44Å; S630-L634 PolarHBondContact O-N 2.85Å; T631-L634 WeakPolarHBondContact O-CB 3.42Å; T631-L634 PolarHBondContact O-N 2.95Å; L634-L637 PolarHBondContact O-N 2.88Å; L634-I638 HydrophobicContact CD1-CD1 4.04Å; L634-I638 HydrophobicContact CD1-CG1 4.35Å; L634-I638 HydrophobicContact CG-CD1 3.94Å; L634-I638 WeakPolarHBondContact O-CG1 3.3Å; L634-I638 PolarHBondContact O-N 3.44Å; L634-C677 HydrophobicContact CD2-CB 4.34Å; L634-L797 HydrophobicContact CD1-CD1 3.91Å
635	L	96.1	Very high	94.7	Very high	27 Å²	27	37.3 Å²	37.3	14%	0.141	22%	0.222	C	C	.	.	H	α-helix	trans	-63.3	-42.5	176.9	-71.2	174.4	0	0	0	111.4	T631 C632 I633 L637 I638 L639 V674 C677 I678	T631-L635 VanDerWaalsContact O-CG 3.32Å; T631-L635 WeakPolarHBondContact O-CG 3.5Å; T631-L635 PolarHBondContact O-N 3.05Å; C632-L635 PolarHBondContact O-N 2.9Å; I633-L635 PolarHBondContact O-N 3.31Å; L635-L637 VanDerWaalsContact C-N 3.32Å; L635-L637 PolarHBondContact O-N 3.34Å; L635-I638 PolarHBondContact O-N 3.16Å; L635-L639 WeakPolarHBondContact O-CG 3.48Å; L635-L639 PolarHBondContact O-N 3.46Å; L635-V674 HydrophobicContact CD2-CB 4.34Å; L635-V674 HydrophobicContact CD2-CG1 4.11Å; L635-V674 HydrophobicContact CD2-CG2 4.36Å; L635-C677 HydrophobicContact CD2-CB 3.73Å; L635-I678 HydrophobicContact CD1-CB 4.16Å; L635-I678 HydrophobicContact CD1-CG1 4.03Å
636	G	95.8	Very high	94.7	Very high	41 Å²	41	36.6 Å²	36.6	42%	0.423	22%	0.217	S	C	.	.	H	α-helix	trans	-58.1	-41.3	171.9	0	0	0	0	0	113	C632 I633 A640	C632-G636 PolarHBondContact O-N 3.44Å; I633-G636 PolarHBondContact O-N 2.9Å; G636-A640 VanDerWaalsContact O-CB 3.3Å; G636-A640 WeakPolarHBondContact O-CB 3.49Å; G636-A640 PolarHBondContact O-N 3.36Å
637	L	96.4	Very high	94.6	Very high	30 Å²	30	39.4 Å²	39.4	16%	0.157	22%	0.223	C	C	.	.	H	α-helix	trans	-69.2	-34.7	176.4	-70.4	168.2	0	0	0	113	I586 F589 F593 I633 L634 L635 A640 Y641	I586-L637 HydrophobicContact CG2-CD2 4.2Å; I586-L637 WeakPolarHBondContact CG2-O 3.35Å; F589-L637 HydrophobicContact CB-CD1 3.96Å; F589-L637 HydrophobicContact CB-CD2 4.28Å; F593-L637 HydrophobicContact CD2-CD1 3.49Å; F593-L637 VanDerWaalsContact CD2-CD1 3.49Å; F593-L637 HydrophobicContact CE2-CD1 4.03Å; F593-L637 HydrophobicContact CG-CD1 4.4Å; I633-L637 HydrophobicContact CG2-CD1 4.01Å; I633-L637 HydrophobicContact CG2-CG 4.48Å; I633-L637 WeakPolarHBondContact O-CG 3.36Å; I633-L637 PolarHBondContact O-N 3.06Å; L634-L637 PolarHBondContact O-N 2.88Å; L635-L637 VanDerWaalsContact C-N 3.32Å; L635-L637 PolarHBondContact O-N 3.34Å; L637-A640 PolarHBondContact O-N 3.35Å; L637-Y641 WeakPolarHBondContact O-CB 3.36Å; L637-Y641 PolarHBondContact O-N 3.44Å
638	I	95.8	Very high	94.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.3	-45.5	174.7	-70.8	164.2	0	0	0	110.6	L634 L635 A640 Y641 H642 E673 V674 C677	L634-I638 HydrophobicContact CD1-CD1 4.04Å; L634-I638 HydrophobicContact CD1-CG1 4.35Å; L634-I638 HydrophobicContact CG-CD1 3.94Å; L634-I638 WeakPolarHBondContact O-CG1 3.3Å; L634-I638 PolarHBondContact O-N 3.44Å; L635-I638 PolarHBondContact O-N 3.16Å; I638-A640 VanDerWaalsContact C-N 3.34Å; I638-A640 PolarHBondContact O-N 2.95Å; I638-Y641 WeakPolarHBondContact O-CB 3.45Å; I638-Y641 PolarHBondContact O-N 3.31Å; I638-H642 PolarHBondContact O-CD2 3.14Å; I638-H642 VanDerWaalsContact O-CD2 3.23Å; I638-H642 PolarHBondContact O-N 3.34Å; I638-E673 HydrophobicContact CG2-CB 4.23Å; I638-V674 HydrophobicContact CG2-CG2 4.4Å; I638-C677 HydrophobicContact CD1-CB 3.6Å; I638-C677 WeakPolarHBondContact CD1-SG 3.38Å
639	L	95	Very high	94.2	Very high	79 Å²	79	41.6 Å²	41.6	41%	0.414	23%	0.228	S	C	.	.	H	α-helix	trans	-61.4	-43.6	173.9	-68.3	173.4	0	0	0	111	L635 Y641 H642 V643 M670 V674	L635-L639 WeakPolarHBondContact O-CG 3.48Å; L635-L639 PolarHBondContact O-N 3.46Å; L639-Y641 PolarHBondContact O-N 3.37Å; L639-H642 PolarHBondContact O-N 3.47Å; L639-V643 WeakPolarHBondContact O-CG2 3.25Å; L639-V643 PolarHBondContact O-N 3.49Å; L639-M670 HydrophobicContact CD2-CG 4.2Å; L639-M670 HydrophobicContact CD2-SD 3.92Å; L639-V674 HydrophobicContact CD2-CG2 4.08Å; L639-V674 HydrophobicContact CG-CG2 4.5Å
640	A	95.3	Very high	93.9	Very high	33 Å²	33	38.3 Å²	38.3	27%	0.273	21%	0.214	S	C	.	.	H	α-helix	trans	-59.6	-44.3	173.7	0	0	0	0	0	112	I586 G636 L637 I638 H642 V643 Y644	I586-A640 HydrophobicContact CG2-CB 4.31Å; G636-A640 VanDerWaalsContact O-CB 3.3Å; G636-A640 WeakPolarHBondContact O-CB 3.49Å; G636-A640 PolarHBondContact O-N 3.36Å; L637-A640 PolarHBondContact O-N 3.35Å; I638-A640 VanDerWaalsContact C-N 3.34Å; I638-A640 PolarHBondContact O-N 2.95Å; A640-H642 PolarHBondContact O-N 2.96Å; A640-V643 PolarHBondContact O-N 2.83Å; A640-Y644 VanDerWaalsContact O-CD2 3.26Å; A640-Y644 WeakPolarHBondContact O-CD2 3.48Å; A640-Y644 PolarHBondContact O-N 2.84Å
641	Y	94.9	Very high	93.4	Very high	31 Å²	31	38.8 Å²	38.8	12%	0.122	22%	0.217	C	C	.	.	H	α-helix	trans	-55.5	-48.3	175.4	175.8	-87.2	0	0	0	111.5	R583 L637 I638 L639 Y644 V645 L804	R583-Y641 HydrophobicContact CG-CD2 3.72Å; R583-Y641 HydrophobicContact CG-CE2 3.67Å; L637-Y641 WeakPolarHBondContact O-CB 3.36Å; L637-Y641 PolarHBondContact O-N 3.44Å; I638-Y641 WeakPolarHBondContact O-CB 3.45Å; I638-Y641 PolarHBondContact O-N 3.31Å; L639-Y641 PolarHBondContact O-N 3.37Å; Y641-Y644 PolarHBondContact O-N 2.81Å; Y641-V645 HydrophobicContact CD1-CG2 4.08Å; Y641-V645 HydrophobicContact CE1-CG2 3.74Å; Y641-V645 WeakPolarHBondContact O-CG2 3.44Å; Y641-V645 PolarHBondContact O-N 2.96Å; Y641-L804 HydrophobicContact CE2-CD2 4.29Å
642	H	93.5	Very high	92.9	Very high	14 Å²	14	40.7 Å²	40.7	7%	0.065	23%	0.227	C	C	.	.	H	α-helix	trans	-65.3	-37.7	177.3	-76.1	-67.8	0	0	0	112.7	I638 L639 A640 Y644 V645 I646 M670 E673	I638-H642 PolarHBondContact O-CD2 3.14Å; I638-H642 VanDerWaalsContact O-CD2 3.23Å; I638-H642 PolarHBondContact O-N 3.34Å; L639-H642 PolarHBondContact O-N 3.47Å; A640-H642 PolarHBondContact O-N 2.96Å; H642-Y644 VanDerWaalsContact C-N 3.34Å; H642-Y644 PolarHBondContact O-N 3.47Å; H642-V645 WeakPolarHBondContact O-CB 3.45Å; H642-V645 PolarHBondContact O-N 3.47Å; H642-V645 VanDerWaalsContact O-N 3.16Å; H642-I646 WeakPolarHBondContact O-CD1 3.47Å; H642-I646 WeakPolarHBondContact O-CG1 3.5Å; H642-I646 PolarHBondContact O-N 2.73Å; H642-M670 HydrophobicContact CB-CG 4.2Å; H642-M670 HydrophobicContact CB-SD 3.82Å; H642-E673 IonicContact CD2-OE2 2.79Å; H642-E673 IonicContact CE1-OE1 3.62Å; H642-E673 IonicContact CE1-OE2 3.22Å; H642-E673 PolarHBondContact CE1-OE2 3.41Å; H642-E673 VanDerWaalsContact NE2-CD 3.33Å; H642-E673 IonicContact NE2-OE1 3.23Å; H642-E673 IonicContact NE2-OE2 3.66Å; H642-E673 PolarHBondContact NE2-OE2 3.34Å
643	V	93.5	Very high	92.5	Very high	65 Å²	65	39.6 Å²	39.6	39%	0.394	22%	0.215	S	C	.	.	H	α-helix	trans	-61.5	-40	171.3	169.8	0	0	0	0	111.8	L639 A640 I646 K647	L639-V643 WeakPolarHBondContact O-CG2 3.25Å; L639-V643 PolarHBondContact O-N 3.49Å; A640-V643 PolarHBondContact O-N 2.83Å; V643-I646 PolarHBondContact O-N 3.38Å; V643-K647 HydrophobicContact CG1-CD 4Å; V643-K647 WeakPolarHBondContact O-CB 3.29Å; V643-K647 VanDerWaalsContact O-CG 3.29Å; V643-K647 WeakPolarHBondContact O-CG 3.42Å; V643-K647 PolarHBondContact O-N 3.24Å
644	Y	93.6	Very high	91.9	Very high	52 Å²	52	39.3 Å²	39.3	20%	0.204	22%	0.22	C	C	.	.	H	α-helix	trans	-69.8	-31.7	173.5	-84.4	-78.9	0	0	0	112.8	L579 K582 I586 A640 Y641 H642 I648	L579-Y644 HydrophobicContact CD2-CD1 3.95Å; L579-Y644 HydrophobicContact CD2-CE1 3.93Å; K582-Y644 HydrophobicContact CB-CD1 4.26Å; K582-Y644 HydrophobicContact CB-CE1 3.83Å; K582-Y644 HydrophobicContact CD-CE1 3.9Å; I586-Y644 HydrophobicContact CD1-CD2 3.36Å; I586-Y644 HydrophobicContact CD1-CE2 3.18Å; I586-Y644 HydrophobicContact CD1-CG 4.33Å; A640-Y644 VanDerWaalsContact O-CD2 3.26Å; A640-Y644 WeakPolarHBondContact O-CD2 3.48Å; A640-Y644 PolarHBondContact O-N 2.84Å; Y641-Y644 PolarHBondContact O-N 2.81Å; H642-Y644 VanDerWaalsContact C-N 3.34Å; H642-Y644 PolarHBondContact O-N 3.47Å; Y644-I648 WeakPolarHBondContact O-CD1 3.46Å; Y644-I648 VanDerWaalsContact O-CG1 3.26Å; Y644-I648 WeakPolarHBondContact O-CG1 3.45Å; Y644-I648 PolarHBondContact O-N 3.11Å; Y644-I648 VanDerWaalsContact O-N 3.11Å
645	V	91.8	Very high	91.5	Very high	20 Å²	20	41.4 Å²	41.4	12%	0.121	23%	0.231	C	C	.	.	H	α-helix	trans	-61.8	-53.9	169.5	171.3	0	0	0	0	110	Y641 H642 K647 I648 F649	Y641-V645 HydrophobicContact CD1-CG2 4.08Å; Y641-V645 HydrophobicContact CE1-CG2 3.74Å; Y641-V645 WeakPolarHBondContact O-CG2 3.44Å; Y641-V645 PolarHBondContact O-N 2.96Å; H642-V645 WeakPolarHBondContact O-CB 3.45Å; H642-V645 PolarHBondContact O-N 3.47Å; H642-V645 VanDerWaalsContact O-N 3.16Å; V645-K647 VanDerWaalsContact C-N 3.32Å; V645-K647 PolarHBondContact O-N 2.8Å; V645-I648 WeakPolarHBondContact O-CB 3.47Å; V645-I648 PolarHBondContact O-N 3.19Å; V645-F649 HydrophobicContact CG1-CD2 3.86Å; V645-F649 HydrophobicContact CG1-CE2 3.77Å; V645-F649 VanDerWaalsContact O-CD2 3.32Å; V645-F649 WeakPolarHBondContact O-CD2 3.39Å; V645-F649 PolarHBondContact O-N 2.97Å; V645-F649 VanDerWaalsContact O-N 3.1Å
646	I	91.7	Very high	90.9	Very high	27 Å²	27	49.2 Å²	49.2	14%	0.138	27%	0.267	C	S	.	.	H	α-helix	trans	-57.7	-43.6	179.5	-64.6	156.9	0	0	0	111.2	H642 V643 I648 F649 S650 A661 V662	H642-I646 WeakPolarHBondContact O-CD1 3.47Å; H642-I646 WeakPolarHBondContact O-CG1 3.5Å; H642-I646 PolarHBondContact O-N 2.73Å; V643-I646 PolarHBondContact O-N 3.38Å; I646-I648 VanDerWaalsContact C-N 3.29Å; I646-I648 PolarHBondContact O-N 3.45Å; I646-F649 PolarHBondContact O-N 3.3Å; I646-S650 PolarHBondContact O-N 3.03Å; I646-A661 HydrophobicContact CG2-CB 4.09Å; I646-V662 HydrophobicContact CD1-CG2 3.86Å; I646-V662 HydrophobicContact CG1-CG2 4.2Å; I646-V662 HydrophobicContact CG2-CG2 4.02Å
647	K	92.2	Very high	90.5	Very high	110 Å²	110	51.9 Å²	51.9	48%	0.478	27%	0.271	S	S	.	.	H	α-helix	trans	-63.5	-28.6	176.1	-75	174.6	179.1	178.5	0	113.9	V643 V645 C651	V643-K647 HydrophobicContact CG1-CD 4Å; V643-K647 WeakPolarHBondContact O-CB 3.29Å; V643-K647 VanDerWaalsContact O-CG 3.29Å; V643-K647 WeakPolarHBondContact O-CG 3.42Å; V643-K647 PolarHBondContact O-N 3.24Å; V645-K647 VanDerWaalsContact C-N 3.32Å; V645-K647 PolarHBondContact O-N 2.8Å; K647-C651 VanDerWaalsContact O-CB 3.29Å; K647-C651 WeakPolarHBondContact O-CB 3.37Å; K647-C651 PolarHBondContact O-N 3.25Å
648	I	89.9	Confident	90	Very high	10 Å²	10	58.4 Å²	58.4	5%	0.051	29%	0.294	C	S	.	.	H	α-helix	trans	-73.3	-44	172.5	-70.8	164.3	0	0	0	110.4	L579 R583 Y644 V645 I646 C651 D652	L579-I648 HydrophobicContact CB-CD1 4.29Å; L579-I648 HydrophobicContact CB-CG1 3.74Å; L579-I648 HydrophobicContact CD1-CG1 4.44Å; R583-I648 HydrophobicContact CB-CD1 4.49Å; Y644-I648 WeakPolarHBondContact O-CD1 3.46Å; Y644-I648 VanDerWaalsContact O-CG1 3.26Å; Y644-I648 WeakPolarHBondContact O-CG1 3.45Å; Y644-I648 PolarHBondContact O-N 3.11Å; Y644-I648 VanDerWaalsContact O-N 3.11Å; V645-I648 WeakPolarHBondContact O-CB 3.47Å; V645-I648 PolarHBondContact O-N 3.19Å; I646-I648 VanDerWaalsContact C-N 3.29Å; I646-I648 PolarHBondContact O-N 3.45Å; I648-C651 PolarHBondContact O-N 2.94Å; I648-D652 WeakPolarHBondContact O-CB 3.46Å; I648-D652 PolarHBondContact O-N 3.26Å
649	F	88.8	Confident	89.7	Confident	70 Å²	70	67.2 Å²	67.2	31%	0.307	33%	0.327	S	S	.	.	H	α-helix	trans	-63.2	-45.9	177.1	-80.3	-82.3	0	0	0	112.3	V645 I646 C651 D652 D653	V645-F649 HydrophobicContact CG1-CD2 3.86Å; V645-F649 HydrophobicContact CG1-CE2 3.77Å; V645-F649 VanDerWaalsContact O-CD2 3.32Å; V645-F649 WeakPolarHBondContact O-CD2 3.39Å; V645-F649 PolarHBondContact O-N 2.97Å; V645-F649 VanDerWaalsContact O-N 3.1Å; I646-F649 PolarHBondContact O-N 3.3Å; F649-C651 VanDerWaalsContact C-N 3.3Å; F649-C651 PolarHBondContact O-N 3.1Å; F649-D652 PolarHBondContact O-N 3.37Å; F649-D652 VanDerWaalsContact O-N 3.08Å; F649-D653 PolarHBondContact O-N 3.44Å
650	S	88.1	Confident	89.2	Confident	28 Å²	28	70 Å²	70	20%	0.196	34%	0.339	C	S	.	.	H	α-helix	trans	-53.7	-44.2	170.6	152.2	0	0	0	0	112.3	I646 D652 S654 I655	I646-S650 PolarHBondContact O-N 3.03Å; S650-D652 VanDerWaalsContact C-N 3.33Å; S650-D652 PolarHBondContact O-N 2.9Å; S650-S654 CarbonylContact O-C 3.56Å; S650-S654 WeakPolarHBondContact O-CA 3.4Å; S650-S654 PolarHBondContact O-N 3.41Å; S650-I655 WeakPolarHBondContact CB-O 3.33Å; S650-I655 PolarHBondContact O-N 3.08Å; S650-I655 PolarHBondContact OG-O 3.23Å
651	C	86.3	Confident	88.7	Confident	13 Å²	13	68.8 Å²	68.8	9%	0.088	33%	0.33	C	S	.	.	H	α-helix	trans	-69.2	-27.7	178	-169.8	0	0	0	0	113.8	R572 L579 K647 I648 F649	R572-C651 PolarHBondContact NE-O 3.31Å; R572-C651 PolarHBondContact NH2-O 2.98Å; L579-C651 HydrophobicContact CD1-CB 4.3Å; K647-C651 VanDerWaalsContact O-CB 3.29Å; K647-C651 WeakPolarHBondContact O-CB 3.37Å; K647-C651 PolarHBondContact O-N 3.25Å; I648-C651 PolarHBondContact O-N 2.94Å; F649-C651 VanDerWaalsContact C-N 3.3Å; F649-C651 PolarHBondContact O-N 3.1Å
652	D	85.2	Confident	88.3	Confident	44 Å²	44	69.1 Å²	69.1	24%	0.235	34%	0.335	C	S	.	.	H	α-helix	trans	-83.2	-42.8	-178.7	-73.7	-16.7	0	0	0	112	R572 R576 I648 F649 S650	R572-D652 VanDerWaalsContact NH2-C 3.29Å; R572-D652 PolarHBondContact NH2-O 3.06Å; R576-D652 WeakPolarHBondContact CD-OD1 3.4Å; R576-D652 WeakPolarHBondContact CG-OD1 3.47Å; R576-D652 VanDerWaalsContact CZ-CG 3.49Å; R576-D652 IonicContact CZ-OD1 2.73Å; R576-D652 IonicContact CZ-OD2 3.41Å; R576-D652 IonicContact NE-OD1 3.9Å; R576-D652 PolarHBondContact NE-OD1 2.74Å; R576-D652 IonicContact NE-OD2 3.5Å; R576-D652 PolarHBondContact NE-OD2 3.12Å; R576-D652 VanDerWaalsContact NH2-CG 3.3Å; R576-D652 IonicContact NH2-OD1 2.74Å; R576-D652 IonicContact NH2-OD2 3.56Å; R576-D652 PolarHBondContact NH2-OD2 3.11Å; I648-D652 WeakPolarHBondContact O-CB 3.46Å; I648-D652 PolarHBondContact O-N 3.26Å; F649-D652 PolarHBondContact O-N 3.37Å; F649-D652 VanDerWaalsContact O-N 3.08Å; S650-D652 VanDerWaalsContact C-N 3.33Å; S650-D652 PolarHBondContact O-N 2.9Å
653	D	86.2	Confident	88.1	Confident	65 Å²	65	72.3 Å²	72.3	35%	0.348	35%	0.352	S	S	.	.	H	α-helix	trans	-87.3	-5.8	177.8	-66.6	-47	0	0	0	113.4	I11 F649 I655	I11-D653 WeakPolarHBondContact CD1-OD1 3.34Å; F649-D653 PolarHBondContact O-N 3.44Å; D653-I655 VanDerWaalsContact C-N 3.28Å; D653-I655 HydrophobicContact CB-CD1 3.72Å; D653-I655 HydrophobicContact CB-CG1 3.83Å; D653-I655 PolarHBondContact O-N 3.18Å
654	S	84.4	Confident	88	Confident	67 Å²	67	74.1 Å²	74.1	47%	0.469	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	30.1	-177.2	-136	0	0	0	0	113.6	R572 S650	R572-S654 PolarHBondContact NH1-OG 3.32Å; S650-S654 CarbonylContact O-C 3.56Å; S650-S654 WeakPolarHBondContact O-CA 3.4Å; S650-S654 PolarHBondContact O-N 3.41Å
655	I	86.7	Confident	87.9	Confident	43 Å²	43	78.1 Å²	78.1	22%	0.221	39%	0.392	C	S	.	.			trans	-87.9	118.7	179.4	-62.8	173.2	0	0	0	108.8	S650 D653 D657 M660	S650-I655 WeakPolarHBondContact CB-O 3.33Å; S650-I655 PolarHBondContact O-N 3.08Å; S650-I655 PolarHBondContact OG-O 3.23Å; D653-I655 VanDerWaalsContact C-N 3.28Å; D653-I655 HydrophobicContact CB-CD1 3.72Å; D653-I655 HydrophobicContact CB-CG1 3.83Å; D653-I655 PolarHBondContact O-N 3.18Å; I655-D657 WeakPolarHBondContact CG2-O 3.45Å; I655-M660 HydrophobicContact CG2-CB 3.79Å
656	E	83.5	Confident	87.8	Confident	192 Å²	192	80.1 Å²	80.1	90%	0.897	40%	0.397	S	S	*	.	S	Bend	trans	-80.1	-40.6	178.1	-64.4	175.9	177	0	0	111.2	W658	E656-W658 PolarHBondContact O-N 2.86Å
657	D	87.5	Confident	87.8	Confident	96 Å²	96	82.5 Å²	82.5	51%	0.513	41%	0.409	S	S	.	.			trans	-69.9	97.3	172.9	-99.9	-44	0	0	0	112.1	I655 R659 M660	I655-D657 WeakPolarHBondContact CG2-O 3.45Å; D657-R659 PolarHBondContact O-N 3.48Å; D657-M660 HydrophobicContact CB-CG 4.12Å; D657-M660 HydrophobicContact CB-SD 4.17Å; D657-M660 PolarHBondContact O-N 2.94Å
658	W	86.1	Confident	87.8	Confident	168 Å²	168	84.2 Å²	84.2	64%	0.636	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-52.4	-29.9	176.2	71.7	-91.2	0	0	0	113	E656 M660 A661 V662	E656-W658 PolarHBondContact O-N 2.86Å; W658-M660 PolarHBondContact O-N 2.9Å; W658-A661 PolarHBondContact O-N 2.87Å; W658-V662 HydrophobicContact CE3-CG2 3.84Å; W658-V662 HydrophobicContact CZ3-CG2 4.03Å
659	R	88.8	Confident	87.9	Confident	184 Å²	184	88.3 Å²	88.3	69%	0.694	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-58.1	-33.7	176.7	-64.8	175.7	67.5	-163	2.6	112.7	D657 A661	D657-R659 PolarHBondContact O-N 3.48Å; R659-A661 VanDerWaalsContact C-N 3.29Å
660	M	86	Confident	88.1	Confident	137 Å²	137	87.3 Å²	87.3	68%	0.675	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-77.3	-13.7	176.9	-67.3	179.3	66.4	0	0	113.2	I655 D657 W658	I655-M660 HydrophobicContact CG2-CB 3.79Å; D657-M660 HydrophobicContact CB-CG 4.12Å; D657-M660 HydrophobicContact CB-SD 4.17Å; D657-M660 PolarHBondContact O-N 2.94Å; W658-M660 PolarHBondContact O-N 2.9Å
661	A	83.3	Confident	88.4	Confident	9 Å²	9	89.6 Å²	89.6	7%	0.074	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-96.3	5.2	178.2	0	0	0	0	0	113.8	I646 W658 R659	I646-A661 HydrophobicContact CG2-CB 4.09Å; W658-A661 PolarHBondContact O-N 2.87Å; R659-A661 VanDerWaalsContact C-N 3.29Å
662	V	87.6	Confident	88.7	Confident	37 Å²	37	93.2 Å²	93.2	22%	0.224	46%	0.464	C	S	.	.			trans	-107.8	92.6	-178.6	-177.8	0	0	0	0	111	I646 W658 I667	I646-V662 HydrophobicContact CD1-CG2 3.86Å; I646-V662 HydrophobicContact CG1-CG2 4.2Å; I646-V662 HydrophobicContact CG2-CG2 4.02Å; W658-V662 HydrophobicContact CE3-CG2 3.84Å; W658-V662 HydrophobicContact CZ3-CG2 4.03Å; V662-I667 HydrophobicContact CG1-CD1 3.74Å; V662-I667 HydrophobicContact CG1-CG1 3.53Å
663	D	89.7	Confident	89.2	Confident	81 Å²	81	91.5 Å²	91.5	43%	0.433	45%	0.454	S	S	.	.			trans	-71.3	143.7	172.3	-60.1	-63	0	0	0	112	N665 R666 I667	D663-N665 PolarHBondContact O-N 3.13Å; D663-N665 VanDerWaalsContact O-N 3.15Å; D663-R666 HydrophobicContact CB-CG 4.08Å; D663-R666 WeakPolarHBondContact O-CA 3.3Å; D663-R666 WeakPolarHBondContact O-CB 3.42Å; D663-R666 PolarHBondContact O-N 3.47Å; D663-R666 IonicContact OD2-CZ 2.77Å; D663-R666 VanDerWaalsContact OD2-CZ 3.29Å; D663-R666 IonicContact OD2-NE 3.67Å; D663-R666 PolarHBondContact OD2-NE 3.43Å; D663-R666 IonicContact OD2-NH2 3.49Å; D663-R666 PolarHBondContact OD2-NH2 3.16Å; D663-I667 PolarHBondContact O-N 2.95Å; D663-I667 VanDerWaalsContact O-N 3.12Å
664	C	91.6	Very high	89.6	Confident	104 Å²	104	90.3 Å²	90.3	70%	0.703	45%	0.449	S	S	*	.	H	α-helix	trans	-54.7	-35.2	173.5	-57.5	0	0	0	0	113	R666 I667 F668	C664-R666 VanDerWaalsContact C-N 3.28Å; C664-R666 PolarHBondContact O-N 2.71Å; C664-I667 PolarHBondContact O-N 3.34Å; C664-F668 WeakPolarHBondContact O-CB 3.24Å; C664-F668 PolarHBondContact O-N 3.47Å
665	N	91.3	Very high	90	Very high	135 Å²	135	92 Å²	92	72%	0.722	45%	0.453	S	S	*	.	H	α-helix	trans	-64.1	-32	175.9	-67.7	-16.9	0	0	0	112.6	D663 Q669	D663-N665 PolarHBondContact O-N 3.13Å; D663-N665 VanDerWaalsContact O-N 3.15Å; N665-Q669 WeakPolarHBondContact O-CB 3.4Å; N665-Q669 PolarHBondContact O-N 3.02Å
666	R	89.4	Confident	90.3	Very high	63 Å²	63	91.4 Å²	91.4	24%	0.238	45%	0.451	C	S	.	.	H	α-helix	trans	-75.6	-39.5	175.1	-63	172.5	-159.7	-106.7	8.3	111.3	D663 C664 Q669 M670	D663-R666 HydrophobicContact CB-CG 4.08Å; D663-R666 WeakPolarHBondContact O-CA 3.3Å; D663-R666 WeakPolarHBondContact O-CB 3.42Å; D663-R666 PolarHBondContact O-N 3.47Å; D663-R666 IonicContact OD2-CZ 2.77Å; D663-R666 VanDerWaalsContact OD2-CZ 3.29Å; D663-R666 IonicContact OD2-NE 3.67Å; D663-R666 PolarHBondContact OD2-NE 3.43Å; D663-R666 IonicContact OD2-NH2 3.49Å; D663-R666 PolarHBondContact OD2-NH2 3.16Å; C664-R666 VanDerWaalsContact C-N 3.28Å; C664-R666 PolarHBondContact O-N 2.71Å; R666-Q669 PolarHBondContact O-N 3.42Å; R666-M670 VanDerWaalsContact O-CB 3.29Å; R666-M670 WeakPolarHBondContact O-CB 3.36Å; R666-M670 PolarHBondContact O-N 3.33Å
667	I	91.4	Very high	90.7	Very high	77 Å²	77	82.2 Å²	82.2	40%	0.395	41%	0.408	S	S	.	.	H	α-helix	trans	-58.1	-51.7	172.5	-59.8	173.9	0	0	0	108.9	V662 D663 C664 Q669 M670 T671	V662-I667 HydrophobicContact CG1-CD1 3.74Å; V662-I667 HydrophobicContact CG1-CG1 3.53Å; D663-I667 PolarHBondContact O-N 2.95Å; D663-I667 VanDerWaalsContact O-N 3.12Å; C664-I667 PolarHBondContact O-N 3.34Å; I667-Q669 PolarHBondContact O-N 2.98Å; I667-M670 PolarHBondContact O-N 3.12Å; I667-M670 VanDerWaalsContact O-N 3.14Å; I667-T671 WeakPolarHBondContact O-CB 3.44Å; I667-T671 PolarHBondContact O-N 3.37Å; I667-T671 PolarHBondContact O-OG1 2.8Å; I667-T671 VanDerWaalsContact O-OG1 3.1Å
668	F	92.7	Very high	91	Very high	145 Å²	145	82 Å²	82	64%	0.636	41%	0.406	S	S	*	.	H	α-helix	trans	-57.5	-45.1	178.3	-179	-98.9	0	0	0	112.6	C664 T671 L672	C664-F668 WeakPolarHBondContact O-CB 3.24Å; C664-F668 PolarHBondContact O-N 3.47Å; F668-T671 PolarHBondContact O-N 3.3Å; F668-L672 HydrophobicContact CE1-CD1 4.25Å; F668-L672 HydrophobicContact CZ-CD1 4.45Å; F668-L672 WeakPolarHBondContact O-CB 3.41Å; F668-L672 PolarHBondContact O-N 3.08Å
669	Q	92.3	Very high	91.2	Very high	97 Å²	97	76.4 Å²	76.4	45%	0.453	39%	0.388	S	S	.	.	H	α-helix	trans	-61.8	-45	175	-172.4	-171	-33.1	0	0	112	N665 R666 I667 L672 E673	N665-Q669 WeakPolarHBondContact O-CB 3.4Å; N665-Q669 PolarHBondContact O-N 3.02Å; R666-Q669 PolarHBondContact O-N 3.42Å; I667-Q669 PolarHBondContact O-N 2.98Å; Q669-L672 PolarHBondContact O-N 2.88Å; Q669-E673 WeakPolarHBondContact CG-OE1 3.32Å; Q669-E673 PolarHBondContact NE2-OE1 2.9Å; Q669-E673 WeakPolarHBondContact O-CG 3.4Å; Q669-E673 PolarHBondContact O-N 2.69Å
670	M	92.8	Very high	91.3	Very high	48 Å²	48	68.7 Å²	68.7	24%	0.236	36%	0.36	C	S	.	.	H	α-helix	trans	-62.3	-43.8	177.7	179.9	-180	73.6	0	0	111.6	L639 H642 R666 I667 E673 V674	L639-M670 HydrophobicContact CD2-CG 4.2Å; L639-M670 HydrophobicContact CD2-SD 3.92Å; H642-M670 HydrophobicContact CB-CG 4.2Å; H642-M670 HydrophobicContact CB-SD 3.82Å; R666-M670 VanDerWaalsContact O-CB 3.29Å; R666-M670 WeakPolarHBondContact O-CB 3.36Å; R666-M670 PolarHBondContact O-N 3.33Å; I667-M670 PolarHBondContact O-N 3.12Å; I667-M670 VanDerWaalsContact O-N 3.14Å; M670-E673 PolarHBondContact O-N 2.89Å; M670-V674 WeakPolarHBondContact O-CB 3.46Å; M670-V674 WeakPolarHBondContact O-CG2 3.37Å; M670-V674 PolarHBondContact O-N 3.24Å
671	T	93.8	Very high	91.3	Very high	76 Å²	76	62.5 Å²	62.5	47%	0.466	33%	0.329	S	S	.	.	H	α-helix	trans	-62.6	-41	175.3	-60.4	0	0	0	0	111.6	I667 F668 V674 L675	I667-T671 WeakPolarHBondContact O-CB 3.44Å; I667-T671 PolarHBondContact O-N 3.37Å; I667-T671 PolarHBondContact O-OG1 2.8Å; I667-T671 VanDerWaalsContact O-OG1 3.1Å; F668-T671 PolarHBondContact O-N 3.3Å; T671-V674 PolarHBondContact O-N 2.98Å; T671-L675 VanDerWaalsContact O-CB 3.3Å; T671-L675 WeakPolarHBondContact O-CB 3.37Å; T671-L675 PolarHBondContact O-N 3.45Å
672	L	93.3	Very high	91.3	Very high	90 Å²	90	66.4 Å²	66.4	47%	0.471	35%	0.345	S	S	.	.	H	α-helix	trans	-65.3	-43.5	175.9	-171.7	154.9	0	0	0	111.6	F668 Q669 V674 L675 V676	F668-L672 HydrophobicContact CE1-CD1 4.25Å; F668-L672 HydrophobicContact CZ-CD1 4.45Å; F668-L672 WeakPolarHBondContact O-CB 3.41Å; F668-L672 PolarHBondContact O-N 3.08Å; Q669-L672 PolarHBondContact O-N 2.88Å; L672-V674 PolarHBondContact O-N 3.32Å; L672-L675 PolarHBondContact O-N 3.33Å; L672-V676 HydrophobicContact CD2-CG2 4.06Å; L672-V676 WeakPolarHBondContact O-CG2 3.49Å; L672-V676 PolarHBondContact O-N 2.98Å
673	E	94.3	Very high	91	Very high	8 Å²	8	66.7 Å²	66.7	4%	0.037	35%	0.347	C	S	.	.	H	α-helix	trans	-63.1	-40	176.1	-73.6	180	-154.6	0	0	112.4	I638 H642 Q669 M670 C677 Y796 R800	I638-E673 HydrophobicContact CG2-CB 4.23Å; H642-E673 IonicContact CD2-OE2 2.79Å; H642-E673 IonicContact CE1-OE1 3.62Å; H642-E673 IonicContact CE1-OE2 3.22Å; H642-E673 PolarHBondContact CE1-OE2 3.41Å; H642-E673 VanDerWaalsContact NE2-CD 3.33Å; H642-E673 IonicContact NE2-OE1 3.23Å; H642-E673 IonicContact NE2-OE2 3.66Å; H642-E673 PolarHBondContact NE2-OE2 3.34Å; Q669-E673 WeakPolarHBondContact CG-OE1 3.32Å; Q669-E673 PolarHBondContact NE2-OE1 2.9Å; Q669-E673 WeakPolarHBondContact O-CG 3.4Å; Q669-E673 PolarHBondContact O-N 2.69Å; M670-E673 PolarHBondContact O-N 2.89Å; E673-C677 WeakPolarHBondContact O-CB 3.42Å; E673-C677 PolarHBondContact O-N 3.02Å; E673-Y796 WeakPolarHBondContact CB-OH 3.48Å; E673-Y796 HydrophobicContact CG-CE2 3.96Å; E673-Y796 WeakPolarHBondContact CG-OH 3.46Å; E673-R800 IonicContact OE1-CZ 3.83Å; E673-R800 IonicContact OE1-NH2 3.28Å; E673-R800 PolarHBondContact OE1-NH2 3.35Å; E673-R800 IonicContact OE2-CZ 2.69Å; E673-R800 VanDerWaalsContact OE2-CZ 3.25Å; E673-R800 IonicContact OE2-NH1 3.49Å; E673-R800 PolarHBondContact OE2-NH1 2.98Å; E673-R800 IonicContact OE2-NH2 3Å; E673-R800 PolarHBondContact OE2-NH2 3.17Å
674	V	94.5	Very high	89.9	Confident	39 Å²	39	64 Å²	64	24%	0.236	34%	0.339	C	S	.	.	H	α-helix	trans	-64.3	-43.2	172.3	164.6	0	0	0	0	111.1	L635 I638 L639 M670 T671 L672 C677 I678	L635-V674 HydrophobicContact CD2-CB 4.34Å; L635-V674 HydrophobicContact CD2-CG1 4.11Å; L635-V674 HydrophobicContact CD2-CG2 4.36Å; I638-V674 HydrophobicContact CG2-CG2 4.4Å; L639-V674 HydrophobicContact CD2-CG2 4.08Å; L639-V674 HydrophobicContact CG-CG2 4.5Å; M670-V674 WeakPolarHBondContact O-CB 3.46Å; M670-V674 WeakPolarHBondContact O-CG2 3.37Å; M670-V674 PolarHBondContact O-N 3.24Å; T671-V674 PolarHBondContact O-N 2.98Å; L672-V674 PolarHBondContact O-N 3.32Å; V674-C677 CarbonylContact O-C 3.57Å; V674-C677 PolarHBondContact O-N 2.78Å; V674-I678 WeakPolarHBondContact O-CB 3.39Å; V674-I678 PolarHBondContact O-N 3.15Å
675	L	93	Very high	88.5	Confident	104 Å²	104	63.7 Å²	63.7	55%	0.545	34%	0.338	S	S	.	.	H	α-helix	trans	-65.8	-37.8	178.6	-172.7	153.9	0	0	0	112.4	T671 L672 C677 I678	T671-L675 VanDerWaalsContact O-CB 3.3Å; T671-L675 WeakPolarHBondContact O-CB 3.37Å; T671-L675 PolarHBondContact O-N 3.45Å; L672-L675 PolarHBondContact O-N 3.33Å; L675-C677 VanDerWaalsContact C-N 3.34Å; L675-I678 WeakPolarHBondContact O-CG2 3.4Å
676	V	93.4	Very high	86.8	Confident	29 Å²	29	59.5 Å²	59.5	18%	0.176	31%	0.312	C	S	.	.	H	α-helix	trans	-68.1	-35	173.1	170.6	0	0	0	0	111.5	L672 F793 Y796	L672-V676 HydrophobicContact CD2-CG2 4.06Å; L672-V676 WeakPolarHBondContact O-CG2 3.49Å; L672-V676 PolarHBondContact O-N 2.98Å; V676-F793 HydrophobicContact CG1-CB 3.67Å; V676-Y796 HydrophobicContact CG1-CE1 4.3Å
677	C	92.8	Very high	85	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-90	-13.3	-177.6	-72.2	0	0	0	0	115.2	L634 L635 I638 E673 V674 L675 R794	L634-C677 HydrophobicContact CD2-CB 4.34Å; L635-C677 HydrophobicContact CD2-CB 3.73Å; I638-C677 HydrophobicContact CD1-CB 3.6Å; I638-C677 WeakPolarHBondContact CD1-SG 3.38Å; E673-C677 WeakPolarHBondContact O-CB 3.42Å; E673-C677 PolarHBondContact O-N 3.02Å; V674-C677 CarbonylContact O-C 3.57Å; V674-C677 PolarHBondContact O-N 2.78Å; L675-C677 VanDerWaalsContact C-N 3.34Å; C677-R794 PolarHBondContact O-NH2 2.97Å
678	I	92.9	Very high	83.1	Confident	92 Å²	92	61.9 Å²	61.9	47%	0.472	33%	0.329	S	S	.	.	H	α-helix	trans	-79.1	-23.9	174.4	-159.3	169.3	0	0	0	112.4	L635 V674 L675 H680	L635-I678 HydrophobicContact CD1-CB 4.16Å; L635-I678 HydrophobicContact CD1-CG1 4.03Å; V674-I678 WeakPolarHBondContact O-CB 3.39Å; V674-I678 PolarHBondContact O-N 3.15Å; L675-I678 WeakPolarHBondContact O-CG2 3.4Å; I678-H680 PolarHBondContact O-N 3.2Å; I678-H680 PolarHBondContact O-ND1 3.03Å
679	I	90.7	Very high	81	Confident	49 Å²	49	61 Å²	61	25%	0.251	33%	0.327	S	S	.	.			trans	-69.3	118.9	179.1	-58.9	164.8	0	0	0	109.9	L787 P790 R794	I679-L787 HydrophobicContact CG2-CD2 3.99Å; I679-P790 HydrophobicContact CB-CB 4.49Å; I679-P790 HydrophobicContact CD1-CB 4.3Å; I679-P790 HydrophobicContact CG2-CB 3.82Å; I679-P790 HydrophobicContact CG2-CG 4.22Å; I679-R794 PolarHBondContact O-NH2 3.45Å
680	H	90.9	Very high	78.8	Confident	23 Å²	23	60.8 Å²	60.8	11%	0.106	33%	0.325	C	S	.	.	S	Bend	trans	-158.5	157.5	173	61.6	-70.8	0	0	0	110.2	I627 S628 T631 I678 F682 L787	I627-H680 HydrophobicContact CG2-CB 4.04Å; S628-H680 WeakPolarHBondContact CA-NE2 3.37Å; S628-H680 WeakPolarHBondContact CB-NE2 3.45Å; S628-H680 PolarHBondContact OG-NE2 3.44Å; T631-H680 HydrophobicContact CG2-CB 3.81Å; T631-H680 PolarHBondContact OG1-CE1 2.77Å; I678-H680 PolarHBondContact O-N 3.2Å; I678-H680 PolarHBondContact O-ND1 3.03Å; H680-F682 PolarHBondContact O-N 2.76Å; H680-L787 WeakPolarHBondContact O-CD1 3.31Å
681	P	85.9	Confident	76.4	Confident	6 Å²	6	62.8 Å²	62.8	4%	0.039	34%	0.342	C	S	.	.			trans	-61.1	119.9	163.3	27.1	-34.4	0	0	0	109.2	M601 I627 D784	M601-P681 HydrophobicContact CG-CG 4.4Å; I627-P681 HydrophobicContact CD1-CG 4.29Å; P681-D784 HydrophobicContact CB-CB 3.99Å
682	F	83.4	Confident	74.4	Confident	92 Å²	92	60.8 Å²	60.8	40%	0.404	33%	0.329	S	S	.	.			trans	-93.5	150.9	-179.3	65.6	-95.7	0	0	0	111	H680 G684 Y686 L787	H680-F682 PolarHBondContact O-N 2.76Å; F682-G684 PolarHBondContact O-N 3Å; F682-G684 VanDerWaalsContact O-N 3.1Å; F682-Y686 HydrophobicContact CD1-CE1 4.2Å; F682-Y686 HydrophobicContact CD1-CE2 4.39Å; F682-Y686 AromaticContact CD1-CZ 3.89Å; F682-Y686 HydrophobicContact CD2-CD1 4.26Å; F682-Y686 AromaticContact CD2-CE1 3.99Å; F682-Y686 HydrophobicContact CD2-CE1 3.99Å; F682-Y686 HydrophobicContact CE1-CD1 4.35Å; F682-Y686 HydrophobicContact CE1-CD2 4.08Å; F682-Y686 AromaticContact CE1-CE1 3.81Å; F682-Y686 HydrophobicContact CE1-CE1 3.81Å; F682-Y686 AromaticContact CE1-CE2 3.42Å; F682-Y686 HydrophobicContact CE1-CE2 3.42Å; F682-Y686 VanDerWaalsContact CE1-CE2 3.42Å; F682-Y686 AromaticContact CE1-CZ 3.33Å; F682-Y686 AromaticContact CE2-CD1 3.52Å; F682-Y686 HydrophobicContact CE2-CD1 3.52Å; F682-Y686 HydrophobicContact CE2-CD2 4.28Å; F682-Y686 AromaticContact CE2-CE1 3.58Å; F682-Y686 HydrophobicContact CE2-CE1 3.58Å; F682-Y686 HydrophobicContact CE2-CE2 4.26Å; F682-Y686 AromaticContact CE2-CG 3.96Å; F682-Y686 HydrophobicContact CE2-CG 3.96Å; F682-Y686 AromaticContact CE2-CZ 3.99Å; F682-Y686 HydrophobicContact CG-CE1 4.29Å; F682-Y686 AromaticContact CZ-CD1 3.58Å; F682-Y686 HydrophobicContact CZ-CD1 3.58Å; F682-Y686 AromaticContact CZ-CD2 3.51Å; F682-Y686 HydrophobicContact CZ-CD2 3.51Å; F682-Y686 AromaticContact CZ-CE1 3.49Å; F682-Y686 HydrophobicContact CZ-CE1 3.49Å; F682-Y686 VanDerWaalsContact CZ-CE1 3.49Å; F682-Y686 AromaticContact CZ-CE2 3.34Å; F682-Y686 HydrophobicContact CZ-CE2 3.34Å; F682-Y686 AromaticContact CZ-CG 3.66Å; F682-Y686 HydrophobicContact CZ-CG 3.66Å; F682-Y686 AromaticContact CZ-CZ 3.4Å; F682-Y686 VanDerWaalsContact CZ-CZ 3.4Å; F682-L787 HydrophobicContact CD1-CD1 4.2Å; F682-L787 HydrophobicContact CE1-CD1 4.4Å
683	P	80.1	Confident	71.9	Confident	42 Å²	42	59.7 Å²	59.7	27%	0.273	33%	0.329	S	S	.	.	S	Bend	trans	-66.1	110.9	178.9	25.3	-33.4	0	0	0	111.5	F621 K624	F621-P683 HydrophobicContact CD2-CB 4.2Å; F621-P683 HydrophobicContact CE2-CB 3.92Å; F621-P683 HydrophobicContact CZ-CB 4.48Å; K624-P683 HydrophobicContact CB-CB 3.86Å
684	G	68.5	Low	69.6	Low	26 Å²	26	63 Å²	63	27%	0.268	35%	0.353	S	S	.	.	S	Bend	trans	178.1	158.4	174.4	0	0	0	0	0	112.4	F682 Y686	F682-G684 PolarHBondContact O-N 3Å; F682-G684 VanDerWaalsContact O-N 3.1Å; G684-Y686 VanDerWaalsContact C-N 3.31Å; G684-Y686 PolarHBondContact O-N 3.17Å
685	S	60.8	Low	67.3	Low	96 Å²	96	65.1 Å²	65.1	67%	0.671	37%	0.374	S	S	*	.			trans	-94.9	38.3	177.6	48.6	0	0	0	0	112.4	L687	S685-L687 VanDerWaalsContact C-N 3.33Å; S685-L687 PolarHBondContact O-N 2.92Å
686	Y	55.9	Low	65	Low	47 Å²	47	65.1 Å²	65.1	18%	0.184	37%	0.374	C	S	.	.			trans	-81.5	75.6	-172.4	66.5	-66.3	0	0	0	111.5	F682 G684 I688 I783 D784 L787	F682-Y686 HydrophobicContact CD1-CE1 4.2Å; F682-Y686 HydrophobicContact CD1-CE2 4.39Å; F682-Y686 AromaticContact CD1-CZ 3.89Å; F682-Y686 HydrophobicContact CD2-CD1 4.26Å; F682-Y686 AromaticContact CD2-CE1 3.99Å; F682-Y686 HydrophobicContact CD2-CE1 3.99Å; F682-Y686 HydrophobicContact CE1-CD1 4.35Å; F682-Y686 HydrophobicContact CE1-CD2 4.08Å; F682-Y686 AromaticContact CE1-CE1 3.81Å; F682-Y686 HydrophobicContact CE1-CE1 3.81Å; F682-Y686 AromaticContact CE1-CE2 3.42Å; F682-Y686 HydrophobicContact CE1-CE2 3.42Å; F682-Y686 VanDerWaalsContact CE1-CE2 3.42Å; F682-Y686 AromaticContact CE1-CZ 3.33Å; F682-Y686 AromaticContact CE2-CD1 3.52Å; F682-Y686 HydrophobicContact CE2-CD1 3.52Å; F682-Y686 HydrophobicContact CE2-CD2 4.28Å; F682-Y686 AromaticContact CE2-CE1 3.58Å; F682-Y686 HydrophobicContact CE2-CE1 3.58Å; F682-Y686 HydrophobicContact CE2-CE2 4.26Å; F682-Y686 AromaticContact CE2-CG 3.96Å; F682-Y686 HydrophobicContact CE2-CG 3.96Å; F682-Y686 AromaticContact CE2-CZ 3.99Å; F682-Y686 HydrophobicContact CG-CE1 4.29Å; F682-Y686 AromaticContact CZ-CD1 3.58Å; F682-Y686 HydrophobicContact CZ-CD1 3.58Å; F682-Y686 AromaticContact CZ-CD2 3.51Å; F682-Y686 HydrophobicContact CZ-CD2 3.51Å; F682-Y686 AromaticContact CZ-CE1 3.49Å; F682-Y686 HydrophobicContact CZ-CE1 3.49Å; F682-Y686 VanDerWaalsContact CZ-CE1 3.49Å; F682-Y686 AromaticContact CZ-CE2 3.34Å; F682-Y686 HydrophobicContact CZ-CE2 3.34Å; F682-Y686 AromaticContact CZ-CG 3.66Å; F682-Y686 HydrophobicContact CZ-CG 3.66Å; F682-Y686 AromaticContact CZ-CZ 3.4Å; F682-Y686 VanDerWaalsContact CZ-CZ 3.4Å; G684-Y686 VanDerWaalsContact C-N 3.31Å; G684-Y686 PolarHBondContact O-N 3.17Å; Y686-I688 VanDerWaalsContact C-N 3.28Å; Y686-I688 PolarHBondContact O-N 2.92Å; Y686-I783 HydrophobicContact CD2-CB 4.42Å; Y686-I783 HydrophobicContact CD2-CD1 4.06Å; Y686-I783 HydrophobicContact CE2-CB 3.56Å; Y686-I783 HydrophobicContact CE2-CD1 3.83Å; Y686-I783 HydrophobicContact CE2-CG1 4.24Å; Y686-I783 HydrophobicContact CE2-CG2 3.66Å; Y686-D784 WeakPolarHBondContact CE1-OD1 3.42Å; Y686-D784 PolarHBondContact OH-OD1 3.46Å; Y686-L787 WeakPolarHBondContact OH-CD1 3.4Å
687	L	52.5	Low	63	Low	105 Å²	105	65.1 Å²	65.1	55%	0.55	37%	0.374	S	S	.	.			trans	-66.9	86.6	165.9	-64.7	179.3	0	0	0	109.7	S685 E689	S685-L687 VanDerWaalsContact C-N 3.33Å; S685-L687 PolarHBondContact O-N 2.92Å; L687-E689 PolarHBondContact O-N 3.4Å
688	I	50.3	Low	60.7	Low	86 Å²	86	65.2 Å²	65.2	44%	0.441	38%	0.375	S	S	.	.			trans	-81.7	112.4	166.5	-65.6	-166.8	0	0	0	108.1	Y686 F690 I783	Y686-I688 VanDerWaalsContact C-N 3.28Å; Y686-I688 PolarHBondContact O-N 2.92Å; I688-F690 HydrophobicContact CB-CE2 4.2Å; I688-F690 HydrophobicContact CG2-CD2 4.04Å; I688-F690 HydrophobicContact CG2-CE2 3.63Å; I688-F690 HydrophobicContact CG2-CZ 4.16Å; I688-F690 PolarHBondContact O-N 2.87Å; I688-I783 HydrophobicContact CB-CD1 3.66Å; I688-I783 HydrophobicContact CB-CG1 4.34Å; I688-I783 HydrophobicContact CD1-CD1 3.62Å; I688-I783 HydrophobicContact CG1-CD1 3.85Å; I688-I783 HydrophobicContact CG2-CD1 4.21Å
689	E	49	Very low	58.4	Low	126 Å²	126	67 Å²	67	59%	0.589	39%	0.393	S	S	*	.			trans	-67.1	97.1	171.4	-61.7	-171.5	160.8	0	0	109.7	L687 P691 I780	L687-E689 PolarHBondContact O-N 3.4Å; E689-P691 VanDerWaalsContact O-CD 3.27Å; E689-P691 WeakPolarHBondContact O-CD 3.32Å; E689-I780 HydrophobicContact CG-CD1 4.23Å; E689-I780 HydrophobicContact CG-CG1 4.17Å; E689-I780 HydrophobicContact CG-CG2 4.35Å
690	F	46.7	Very low	56.3	Low	93 Å²	93	67 Å²	67	41%	0.408	41%	0.405	S	S	.	.			trans	-73.8	119.5	159.8	-76.1	-88.9	0	0	0	108.2	I688 V692 I783	I688-F690 HydrophobicContact CB-CE2 4.2Å; I688-F690 HydrophobicContact CG2-CD2 4.04Å; I688-F690 HydrophobicContact CG2-CE2 3.63Å; I688-F690 HydrophobicContact CG2-CZ 4.16Å; I688-F690 PolarHBondContact O-N 2.87Å; F690-V692 PolarHBondContact O-N 3.26Å; F690-I783 HydrophobicContact CD2-CG1 4.45Å; F690-I783 HydrophobicContact CE2-CD1 3.8Å; F690-I783 HydrophobicContact CE2-CG1 3.56Å; F690-I783 HydrophobicContact CZ-CD1 4.32Å; F690-I783 HydrophobicContact CZ-CG1 4.34Å
691	P	42.1	Very low	54.3	Low	90 Å²	90	67.7 Å²	67.7	58%	0.584	41%	0.411	S	S	*	.			trans	-67.9	91.9	165.8	28.8	-32.9	0	0	0	107.7	E689 S693	E689-P691 VanDerWaalsContact O-CD 3.27Å; E689-P691 WeakPolarHBondContact O-CD 3.32Å; P691-S693 PolarHBondContact O-N 3.2Å
692	V	50.8	Low	52.1	Low	34 Å²	34	75 Å²	75	21%	0.206	44%	0.444	C	S	.	.			trans	-66.2	78	166.5	-174.9	0	0	0	0	107.1	F690 L696 V781	F690-V692 PolarHBondContact O-N 3.26Å; V692-L696 HydrophobicContact CG1-CB 4.31Å; V692-V781 HydrophobicContact CG2-CG2 3.76Å
693	S	40.8	Very low	50.2	Low	66 Å²	66	77.8 Å²	77.8	46%	0.462	46%	0.462	S	S	.	.			trans	-52.8	145	171.6	-64.6	0	0	0	0	108.2	P691 A695 L696	P691-S693 PolarHBondContact O-N 3.2Å; S693-A695 PolarHBondContact O-N 2.88Å; S693-L696 WeakPolarHBondContact O-CA 3.14Å; S693-L696 PolarHBondContact O-N 2.98Å
694	S	47.3	Very low	48.1	Very low	79 Å²	79	86 Å²	86	55%	0.552	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-58.6	-16.9	179.5	-45.5	0	0	0	0	113.4	L696 V697	S694-L696 VanDerWaalsContact C-N 3.3Å; S694-L696 PolarHBondContact O-N 3.07Å; S694-V697 WeakPolarHBondContact O-CB 3.37Å; S694-V697 PolarHBondContact O-N 3.35Å; S694-V697 VanDerWaalsContact O-N 3.07Å
695	A	44.8	Very low	46.3	Very low	82 Å²	82	89.1 Å²	89.1	68%	0.678	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-68.3	-20.5	169.2	0	0	0	0	0	114.8	S693 V697 Y896	S693-A695 PolarHBondContact O-N 2.88Å; A695-V697 VanDerWaalsContact C-N 3.33Å; A695-V697 CarbonylContact C-O 3.58Å; A695-Y896 WeakPolarHBondContact O-CE2 3.49Å; A695-Y896 PolarHBondContact O-OH 3.37Å
696	L	45.6	Very low	45.1	Very low	105 Å²	105	89 Å²	89	55%	0.55	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-93.6	10.8	168.5	-156.5	71	0	0	0	112.1	V692 S693 S694 Y896	V692-L696 HydrophobicContact CG1-CB 4.31Å; S693-L696 WeakPolarHBondContact O-CA 3.14Å; S693-L696 PolarHBondContact O-N 2.98Å; S694-L696 VanDerWaalsContact C-N 3.3Å; S694-L696 PolarHBondContact O-N 3.07Å; L696-Y896 VanDerWaalsContact C-CE2 3.45Å; L696-Y896 HydrophobicContact CD1-CD2 3.99Å; L696-Y896 HydrophobicContact CG-CD2 4.24Å; L696-Y896 VanDerWaalsContact O-CD2 3.28Å; L696-Y896 WeakPolarHBondContact O-CD2 3.38Å
697	V	51.3	Low	43.9	Very low	29 Å²	29	92.7 Å²	92.7	18%	0.176	53%	0.531	C	S	.	.	B	Isolated β-bridge	trans	-102.2	145.9	152.1	-176.5	0	0	0	0	107	S694 A695 T701 Y865 Y896	S694-V697 WeakPolarHBondContact O-CB 3.37Å; S694-V697 PolarHBondContact O-N 3.35Å; S694-V697 VanDerWaalsContact O-N 3.07Å; A695-V697 VanDerWaalsContact C-N 3.33Å; A695-V697 CarbonylContact C-O 3.58Å; V697-T701 HydrophobicContact CG1-CG2 3.75Å; V697-Y865 HydrophobicContact CG1-CE2 4.45Å; V697-Y896 VanDerWaalsContact C-CE2 3.49Å; V697-Y896 WeakPolarHBondContact O-CE2 3.34Å
698	G	44.1	Very low	42.8	Very low	1 Å²	1	97.1 Å²	97.1	1%	0.01	54%	0.542	C	S	.	.			trans	-63.7	139.3	-179.5	0	0	0	0	0	112	G700	G698-G700 VanDerWaalsContact C-N 3.26Å; G698-G700 PolarHBondContact O-N 3.28Å
699	P	44.6	Very low	41.9	Very low	130 Å²	130	99.3 Å²	99.3	84%	0.844	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	73.7	-173.8	31	-37.7	0	0	0	112.3	Y896	P699-Y896 WeakPolarHBondContact CD-OH 3.45Å
700	G	47.8	Very low	40.8	Very low	50 Å²	50	99 Å²	99	52%	0.515	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-174.6	1.7	-177.8	0	0	0	0	0	116	G698 E702	G698-G700 VanDerWaalsContact C-N 3.26Å; G698-G700 PolarHBondContact O-N 3.28Å; G700-E702 VanDerWaalsContact C-N 3.33Å
701	T	47.1	Very low	40	Very low	36 Å²	36	100.5 Å²	100.5	22%	0.221	57%	0.57	C	S	.	*	G	3₁₀ helix	trans	-74.5	-18.3	178.8	44.1	0	0	0	0	114.3	V697 I703 Y704	V697-T701 HydrophobicContact CG1-CG2 3.75Å; T701-I703 PolarHBondContact O-N 3.28Å; T701-I703 VanDerWaalsContact O-N 3.12Å; T701-Y704 PolarHBondContact O-N 2.94Å
702	E	40.3	Very low	39.3	Very low	160 Å²	160	104.2 Å²	104.2	75%	0.748	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-59.7	-21.3	178.2	-63.6	-69.3	126.4	0	0	114	G700	G700-E702 VanDerWaalsContact C-N 3.33Å
703	I	43	Very low	38.2	Very low	150 Å²	150	109 Å²	109	77%	0.769	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-95.3	-9.3	-171.3	-60.4	177.6	0	0	0	112.6	T701	T701-I703 PolarHBondContact O-N 3.28Å; T701-I703 VanDerWaalsContact O-N 3.12Å
704	Y	36.9	Very low	37.7	Very low	214 Å²	214	111.8 Å²	111.8	84%	0.839	62%	0.623	S	S	*	*			trans	-133.7	48.6	-179.5	-119.4	-93.6	0	0	0	112.9	T701 P706	T701-Y704 PolarHBondContact O-N 2.94Å; Y704-P706 VanDerWaalsContact O-CD 3.27Å; Y704-P706 WeakPolarHBondContact O-CD 3.42Å
705	S	30.6	Very low	37	Very low	92 Å²	92	117.8 Å²	117.8	64%	0.643	64%	0.639	S	S	*	*			trans	-80.1	112	166.2	-69	0	0	0	0	110.3	V707	S705-V707 PolarHBondContact O-N 3.42Å
706	P	35.9	Very low	36.2	Very low	94 Å²	94	118.9 Å²	118.9	61%	0.61	64%	0.642	S	S	*	*			trans	-64.2	128.3	164.1	28.3	-32.9	0	0	0	108.5	Y704 Y708	Y704-P706 VanDerWaalsContact O-CD 3.27Å; Y704-P706 WeakPolarHBondContact O-CD 3.42Å; P706-Y708 HydrophobicContact CG-CD2 4.36Å; P706-Y708 HydrophobicContact CG-CE2 4.05Å; P706-Y708 PolarHBondContact O-N 3.02Å
707	V	30.1	Very low	35.6	Very low	124 Å²	124	121.9 Å²	121.9	75%	0.752	66%	0.658	S	S	*	*			trans	-70.1	94.2	177.1	178.4	0	0	0	0	108.6	S705 H709	S705-V707 PolarHBondContact O-N 3.42Å; V707-H709 PolarHBondContact O-N 3.36Å
708	Y	29.9	Very low	34.7	Very low	199 Å²	199	126.9 Å²	126.9	78%	0.78	69%	0.688	S	S	*	*			trans	-67.4	84.4	164.2	-84.5	-80.1	0	0	0	108.9	P706 S710	P706-Y708 HydrophobicContact CG-CD2 4.36Å; P706-Y708 HydrophobicContact CG-CE2 4.05Å; P706-Y708 PolarHBondContact O-N 3.02Å; Y708-S710 PolarHBondContact O-N 3.06Å
709	H	31.3	Very low	34.2	Very low	132 Å²	132	134.4 Å²	134.4	61%	0.611	73%	0.728	S	S	*	*			trans	-62	117.1	179.1	-135.3	-40.2	0	0	0	108.9	V707 Q711	V707-H709 PolarHBondContact O-N 3.36Å; H709-Q711 HydrophobicContact CB-CG 4.12Å; H709-Q711 PolarHBondContact CD2-NE2 3.47Å; H709-Q711 PolarHBondContact CE1-NE2 2.89Å; H709-Q711 PolarHBondContact ND1-NE2 3.33Å; H709-Q711 PolarHBondContact NE2-NE2 3.49Å; H709-Q711 PolarHBondContact O-N 3.12Å
710	S	26	Very low	34	Very low	120 Å²	120	135.5 Å²	135.5	84%	0.839	72%	0.721	S	S	*	*			trans	-71.4	74.9	172.6	59.8	0	0	0	0	110.3	Y708	Y708-S710 PolarHBondContact O-N 3.06Å
711	Q	29.2	Very low	33.3	Very low	123 Å²	123	138.6 Å²	138.6	58%	0.575	73%	0.726	S	S	*	*			trans	-112.4	114.6	178.5	-67.5	-168.9	8	0	0	111.5	H709	H709-Q711 HydrophobicContact CB-CG 4.12Å; H709-Q711 PolarHBondContact CD2-NE2 3.47Å; H709-Q711 PolarHBondContact CE1-NE2 2.89Å; H709-Q711 PolarHBondContact ND1-NE2 3.33Å; H709-Q711 PolarHBondContact NE2-NE2 3.49Å; H709-Q711 PolarHBondContact O-N 3.12Å
712	Q	27.4	Very low	32.9	Very low	169 Å²	169	143.8 Å²	143.8	79%	0.79	75%	0.751	S	S	*	*			trans	52.3	89	143.1	-57.9	178.6	-1.2	0	0	118.7
713	T	28.3	Very low	32.8	Very low	135 Å²	135	140.3 Å²	140.3	83%	0.828	74%	0.741	S	S	*	*			trans	-131.5	49.7	141.8	44.1	0	0	0	0	112	K715	T713-K715 PolarHBondContact O-N 3.34Å
714	T	29.3	Very low	32.2	Very low	124 Å²	124	143.4 Å²	143.4	76%	0.761	74%	0.743	S	S	*	*			trans	-63.3	96.9	163.6	45	0	0	0	0	109.5	S716	T714-S716 VanDerWaalsContact C-N 3.25Å; T714-S716 PolarHBondContact O-N 3.35Å
715	K	32.6	Very low	31.9	Very low	204 Å²	204	140.2 Å²	140.2	89%	0.887	74%	0.737	S	S	*	*			trans	-69.1	80.6	173.6	-75.4	-176.7	176.3	177.1	0	110.7	T713 L717	T713-K715 PolarHBondContact O-N 3.34Å; K715-L717 PolarHBondContact O-N 2.92Å; K715-L717 VanDerWaalsContact O-N 3.15Å
716	S	28.3	Very low	32.2	Very low	105 Å²	105	141.2 Å²	141.2	73%	0.734	74%	0.74	S	S	*	*			trans	-71	99.3	167.3	55.1	0	0	0	0	109.7	T714	T714-S716 VanDerWaalsContact C-N 3.25Å; T714-S716 PolarHBondContact O-N 3.35Å
717	L	34.2	Very low	32.3	Very low	169 Å²	169	142.2 Å²	142.2	89%	0.885	74%	0.744	S	S	*	*			trans	-101.4	101.8	166.4	-156.4	78.7	0	0	0	109.3	K715 L719	K715-L717 PolarHBondContact O-N 2.92Å; K715-L717 VanDerWaalsContact O-N 3.15Å; L717-L719 PolarHBondContact O-N 3.44Å
718	T	31.7	Very low	32.3	Very low	133 Å²	133	146.4 Å²	146.4	82%	0.816	75%	0.746	S	S	*	*			trans	-74.9	118.4	177.7	47.5	0	0	0	0	110.9
719	L	34.3	Very low	32.4	Very low	159 Å²	159	144.2 Å²	144.2	83%	0.832	74%	0.743	S	S	*	*			trans	-140.3	89.7	162.4	-136.6	172.7	0	0	0	112.9	L717	L717-L719 PolarHBondContact O-N 3.44Å
720	H	39.2	Very low	32.6	Very low	153 Å²	153	143.3 Å²	143.3	71%	0.708	75%	0.747	S	S	*	*			trans	0.3	106.2	152.9	-153.3	-114.3	0	0	0	120.1
721	N	33.5	Very low	32.9	Very low	116 Å²	116	143.2 Å²	143.2	62%	0.62	74%	0.742	S	S	*	*				72.7	163.4	117.6	-148.9	-6.9	0	0	0	120.1
722	I	39.2	Very low	33	Very low	145 Å²	145	144.8 Å²	144.8	74%	0.744	75%	0.754	S	S	*	*			trans	74.8	135.9	171.8	-51.9	174.8	0	0	0	115.9
723	T	37.3	Very low	33.1	Very low	87 Å²	87	147.8 Å²	147.8	53%	0.534	76%	0.758	S	S	.	*			cis	175.7	130.4	-36.3	-99.5	0	0	0	0	108.3
724	R	31.4	Very low	33.1	Very low	214 Å²	214	147.2 Å²	147.2	81%	0.808	76%	0.755	S	S	*	*			trans	64.2	162.7	165.9	-69.9	171.2	-171.1	131.8	0	116.8
725	M	29.7	Very low	33.3	Very low	148 Å²	148	147.1 Å²	147.1	73%	0.729	75%	0.754	S	S	*	*			cis	-161.4	163.4	-25	-114.2	171.9	171.6	0	0	111.4
726	T	37.9	Very low	33.3	Very low	113 Å²	113	145.2 Å²	145.2	69%	0.693	75%	0.753	S	S	*	*			trans	56.2	109.8	146.3	55.5	0	0	0	0	122.8
727	T	36.6	Very low	33.3	Very low	114 Å²	114	149.8 Å²	149.8	70%	0.699	76%	0.76	S	S	*	*				90.8	113.8	109.4	-56.7	0	0	0	0	121.7
728	R	30.5	Very low	33.1	Very low	212 Å²	212	152.9 Å²	152.9	80%	0.8	76%	0.76	S	S	*	*			trans	82.3	132.9	145.6	-86.9	175.7	174.5	176.8	-1	122.7
729	Q	32	Very low	33.6	Very low	154 Å²	154	151.7 Å²	151.7	72%	0.72	76%	0.755	S	S	*	*			trans	92	131.4	134.8	-81.8	171.1	-73.7	0	0	121.9
730	T	35.5	Very low	33.4	Very low	112 Å²	112	153.3 Å²	153.3	69%	0.687	76%	0.755	S	S	*	*			trans	66.9	111.6	147.5	46.3	0	0	0	0	121.3
731	T	33.5	Very low	33.1	Very low	119 Å²	119	151.2 Å²	151.2	73%	0.73	76%	0.758	S	S	*	*			trans	73.3	129.2	136.3	57.4	0	0	0	0	120.8
732	N	31.2	Very low	33.2	Very low	155 Å²	155	149 Å²	149	83%	0.829	76%	0.762	S	S	*	*			trans	76.3	141	155.6	-60.8	-23.9	0	0	0	119.2
733	R	29.7	Very low	32.7	Very low	232 Å²	232	150.1 Å²	150.1	88%	0.875	77%	0.769	S	S	*	*			trans	74.7	122.4	166.5	-114.6	176.8	-179	133.4	0.6	118.8
734	T	28.5	Very low	32.5	Very low	124 Å²	124	150.6 Å²	150.6	76%	0.761	78%	0.776	S	S	*	*			trans	74.7	133.7	145.4	32.8	0	0	0	0	121.4
735	V	32.6	Very low	32.5	Very low	122 Å²	122	146.6 Å²	146.6	74%	0.739	78%	0.776	S	S	*	*			trans	60.6	96.1	167.5	-157.1	0	0	0	0	117.4	F737	V735-F737 PolarHBondContact O-N 3.34Å
736	N	32.9	Very low	32.9	Very low	163 Å²	163	148.5 Å²	148.5	87%	0.872	78%	0.78	S	S	*	*			trans	-73.1	106.9	159	-65.8	-17.2	0	0	0	108
737	F	28.5	Very low	32.8	Very low	201 Å²	201	148.1 Å²	148.1	88%	0.882	78%	0.782	S	S	*	*				77.1	133	79.3	-107.2	-93.6	0	0	0	115.9	V735	V735-F737 PolarHBondContact O-N 3.34Å
738	R	30.4	Very low	32.8	Very low	234 Å²	234	148.1 Å²	148.1	88%	0.883	78%	0.782	S	S	*	*			trans	-115.5	-159.9	-172.6	-136.1	-161.1	-175.3	-170	5.3	109.1
739	P	41.8	Very low	33.2	Very low	109 Å²	109	144 Å²	144	71%	0.708	78%	0.783	S	S	*	*			trans	-94.9	175.9	-145	43.3	-36.8	0	0	0	114
740	F	28.7	Very low	33.3	Very low	192 Å²	192	143.9 Å²	143.9	84%	0.842	79%	0.785	S	S	*	*			trans	-155.5	157.5	148.9	-149.2	-114	0	0	0	116.4
741	S	33.1	Very low	33.1	Very low	109 Å²	109	144.4 Å²	144.4	76%	0.762	79%	0.789	S	S	*	*			trans	69	147.1	164.9	68.5	0	0	0	0	119.2
742	G	35.7	Very low	33	Very low	69 Å²	69	143.4 Å²	143.4	71%	0.711	79%	0.787	S	S	*	*			cis	-137.2	140	-11.6	0	0	0	0	0	109
743	L	29.2	Very low	33.1	Very low	169 Å²	169	142.1 Å²	142.1	89%	0.885	79%	0.785	S	S	*	*				81.4	123.1	60.4	-167.8	68.1	0	0	0	113.1
744	S	32	Very low	33.5	Very low	98 Å²	98	135.7 Å²	135.7	69%	0.685	78%	0.775	S	S	*	*			trans	-76.8	168.7	177.4	52.1	0	0	0	0	114.2
745	T	33.1	Very low	33.9	Very low	130 Å²	130	135.6 Å²	135.6	80%	0.798	78%	0.775	S	S	*	*			trans	177.6	121.1	135.4	-75.4	0	0	0	0	107.6
746	F	37.3	Very low	34.2	Very low	187 Å²	187	137.7 Å²	137.7	82%	0.82	78%	0.778	S	S	*	*				83.7	121.8	57.9	-140.5	-80.3	0	0	0	114.4
747	S	35.1	Very low	34.5	Very low	106 Å²	106	134.7 Å²	134.7	74%	0.741	77%	0.77	S	S	*	*			trans	-166.8	111.5	170.9	-77	0	0	0	0	108.1
748	T	36.6	Very low	35	Very low	114 Å²	114	130.5 Å²	130.5	70%	0.699	76%	0.761	S	S	*	*				74	138.8	77.6	63.6	0	0	0	0	113.1
749	P	39.8	Very low	35.6	Very low	124 Å²	124	124.9 Å²	124.9	81%	0.805	76%	0.758	S	S	*	*				-138.3	125.3	78.2	35.8	-19.8	0	0	0	115.8
750	I	33.9	Very low	35.6	Very low	152 Å²	152	124.7 Å²	124.7	78%	0.779	76%	0.759	S	S	*	*	S	Bend	trans	-134.6	118.7	138.7	-67.4	-172.9	0	0	0	106.6
751	T	30.5	Very low	36.2	Very low	123 Å²	123	120.9 Å²	120.9	76%	0.755	76%	0.756	S	S	*	*	S	Bend	trans	76.7	133.3	168.7	-48.1	0	0	0	0	119.9
752	S	32.5	Very low	36.6	Very low	99 Å²	99	121.3 Å²	121.3	69%	0.692	76%	0.757	S	S	*	*			trans	73	91.7	158	48.5	0	0	0	0	123.9
753	T	33.3	Very low	36.6	Very low	127 Å²	127	125.5 Å²	125.5	78%	0.779	77%	0.769	S	S	*	*				65.9	121.5	120.2	-8.4	0	0	0	0	124.6
754	S	37.5	Very low	36.7	Very low	97 Å²	97	125.4 Å²	125.4	68%	0.678	77%	0.768	S	S	*	*			trans	60.5	142.7	138.3	55.4	0	0	0	0	122.6
755	T	37.2	Very low	37.1	Very low	123 Å²	123	125.8 Å²	125.8	76%	0.755	77%	0.77	S	S	*	*			cis	-169.6	141.2	-8.7	20.8	0	0	0	0	111.8
756	M	38.5	Very low	37.1	Very low	165 Å²	165	125.5 Å²	125.5	81%	0.813	77%	0.769	S	S	*	*			trans	62.6	-178.1	159.9	-51.2	-94	66.3	0	0	115.8
757	S	40.1	Very low	36.9	Very low	100 Å²	100	127 Å²	127	70%	0.699	78%	0.775	S	S	*	*			cis	-168.9	165.3	-5	12.5	0	0	0	0	108.8
758	T	39.4	Very low	36.9	Very low	114 Å²	114	127.1 Å²	127.1	70%	0.699	78%	0.777	S	S	*	*			cis	-173.9	152.2	-29.1	29.4	0	0	0	0	109.3
759	S	41.1	Very low	36.9	Very low	116 Å²	116	126 Å²	126	81%	0.811	77%	0.774	S	S	*	*			trans	66.3	153.7	162	68.3	0	0	0	0	119.2
760	S	42.3	Very low	36.6	Very low	105 Å²	105	130 Å²	130	73%	0.734	78%	0.779	S	S	*	*			cis	-150.7	142	-2.9	43.2	0	0	0	0	109.8
761	S	42	Very low	36.7	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	77%	0.774	S	S	*	*				92.1	165.2	61.2	-43.2	0	0	0	0	113.3
762	P	41.2	Very low	37	Very low	118 Å²	118	130.7 Å²	130.7	77%	0.766	78%	0.779	S	S	*	*				-138.7	171.4	-96.3	39.1	-19.7	0	0	0	117.3
763	T	36.8	Very low	37.3	Very low	157 Å²	157	131.5 Å²	131.5	96%	0.963	78%	0.78	S	S	*	*			trans	-155.9	153.9	151.7	16.3	0	0	0	0	114.7
764	L	31.4	Very low	37.4	Very low	167 Å²	167	132.7 Å²	132.7	87%	0.874	78%	0.777	S	S	*	*			trans	-97.7	133.6	-164.2	176.1	83.3	0	0	0	114.5
765	S	39.4	Very low	37.3	Very low	105 Å²	105	133.8 Å²	133.8	73%	0.734	78%	0.784	S	S	*	*			trans	-169.9	119.1	147.9	60.8	0	0	0	0	116.3
766	T	33.9	Very low	37.5	Very low	125 Å²	125	133.9 Å²	133.9	77%	0.767	78%	0.776	S	S	*	*			trans	52.7	118	131.9	-44.6	0	0	0	0	123.2
767	F	31.9	Very low	37.9	Very low	217 Å²	217	130.6 Å²	130.6	95%	0.952	77%	0.769	S	S	*	*			trans	3	106.4	152.6	-82.5	-98.3	0	0	0	120.6
768	S	34.5	Very low	38.2	Very low	110 Å²	110	130.9 Å²	130.9	77%	0.769	76%	0.762	S	S	*	*			trans	-161.3	150.2	151.7	60.5	0	0	0	0	107.9
769	S	38.3	Very low	38.8	Very low	91 Å²	91	129.9 Å²	129.9	64%	0.636	75%	0.748	S	S	*	*			cis	-141.7	168.6	13.4	-64.3	0	0	0	0	111.7	D771	S769-D771 WeakPolarHBondContact CB-OD2 3.18Å
770	F	32.9	Very low	39.4	Very low	207 Å²	207	128.5 Å²	128.5	91%	0.908	73%	0.73	S	S	*	*			trans	-103.1	55.6	179.6	-163.1	-94.2	0	0	0	111.3	N772	F770-N772 PolarHBondContact O-N 3.01Å; F770-N772 VanDerWaalsContact O-N 3.12Å
771	D	36.6	Very low	40.3	Very low	127 Å²	127	124.4 Å²	124.4	68%	0.679	70%	0.701	S	S	*	*			trans	-88.6	79.7	-169.1	-69	-49.6	0	0	0	113.4	S769	S769-D771 WeakPolarHBondContact CB-OD2 3.18Å
772	N	35.3	Very low	41.4	Very low	162 Å²	162	119.5 Å²	119.5	87%	0.866	67%	0.666	S	S	*	*			trans	-125.2	66.4	163.4	-112.3	-27.8	0	0	0	108.8	F770	F770-N772 PolarHBondContact O-N 3.01Å; F770-N772 VanDerWaalsContact O-N 3.12Å
773	V	39	Very low	42.8	Very low	117 Å²	117	115.1 Å²	115.1	71%	0.709	64%	0.636	S	S	*	*			trans	-87.6	130.7	-177	-179.9	0	0	0	0	110.5
774	Q	36.3	Very low	44.6	Very low	152 Å²	152	109 Å²	109	71%	0.71	60%	0.597	S	S	*	*			trans	-70.2	130.7	-173.7	-162.4	141.5	0.7	0	0	112.2	H776	Q774-H776 PolarHBondContact O-CD2 3.36Å; Q774-H776 VanDerWaalsContact O-CD2 3.29Å; Q774-H776 PolarHBondContact O-N 3.46Å
775	S	35	Very low	46.8	Very low	120 Å²	120	101.8 Å²	101.8	84%	0.839	56%	0.56	S	S	*	*			trans	-67.2	90.2	176.9	-61.7	0	0	0	0	111.6	S777	S775-S777 PolarHBondContact O-N 2.79Å
776	H	41.3	Very low	48.7	Very low	124 Å²	124	101.2 Å²	101.2	57%	0.574	55%	0.548	S	S	*	.			trans	-64.6	114	176.3	-70.8	-74.5	0	0	0	111.3	Q774 I778	Q774-H776 PolarHBondContact O-CD2 3.36Å; Q774-H776 VanDerWaalsContact O-CD2 3.29Å; Q774-H776 PolarHBondContact O-N 3.46Å; H776-I778 PolarHBondContact O-N 3.41Å
777	S	46.3	Very low	51	Low	97 Å²	97	97.2 Å²	97.2	68%	0.678	52%	0.521	S	S	*	.			trans	-80.7	94.9	177.8	-166.3	0	0	0	0	110.8	S775 K779	S775-S777 PolarHBondContact O-N 2.79Å; S777-K779 PolarHBondContact O-N 2.94Å
778	I	46.7	Very low	53.5	Low	106 Å²	106	86.9 Å²	86.9	54%	0.544	48%	0.476	S	S	.	.			trans	-75.7	107.9	-179.9	-58.9	172.6	0	0	0	109.4	H776	H776-I778 PolarHBondContact O-N 3.41Å
779	K	53.1	Low	56	Low	93 Å²	93	83.3 Å²	83.3	40%	0.404	45%	0.449	S	S	.	.			trans	-89.5	120.2	167.5	-77.8	-167.5	169.6	-168.4	0	110.3	S777 F864 Y865	S777-K779 PolarHBondContact O-N 2.94Å; K779-F864 PolarHBondContact NZ-O 2.65Å; K779-Y865 PolarHBondContact NZ-O 3.31Å
780	I	53.4	Low	58.4	Low	86 Å²	86	80.2 Å²	80.2	44%	0.441	43%	0.428	S	S	.	.			trans	-74.8	126.1	176.8	-55.6	176.7	0	0	0	109.8	E689	E689-I780 HydrophobicContact CG-CD1 4.23Å; E689-I780 HydrophobicContact CG-CG1 4.17Å; E689-I780 HydrophobicContact CG-CG2 4.35Å
781	V	60.7	Low	61.2	Low	19 Å²	19	70.4 Å²	70.4	12%	0.115	38%	0.384	C	S	.	.			trans	-119.6	122	-176.3	175	0	0	0	0	110.4	V692 I786 F864	V692-V781 HydrophobicContact CG2-CG2 3.76Å; V781-I786 HydrophobicContact CG1-CD1 4.33Å; V781-F864 HydrophobicContact CG1-CD2 4.13Å; V781-F864 HydrophobicContact CG1-CE1 4.23Å; V781-F864 HydrophobicContact CG1-CE2 3.64Å; V781-F864 HydrophobicContact CG1-CZ 3.69Å
782	S	65.6	Low	63.8	Low	9 Å²	9	65.2 Å²	65.2	6%	0.063	36%	0.356	C	S	.	.			trans	-74.7	126.5	179.8	-50.8	0	0	0	0	111.9	K615 D784 L785	K615-S782 PolarHBondContact NZ-OG 3.23Å; S782-D784 PolarHBondContact O-N 2.87Å; S782-L785 PolarHBondContact O-N 2.9Å
783	I	70.5	Confident	66.4	Low	26 Å²	26	63.8 Å²	63.8	13%	0.133	34%	0.342	C	S	.	.	H	α-helix	trans	-57.7	-31.3	179.5	-71.3	174.4	0	0	0	112.9	Y686 I688 F690 L785 I786 L787	Y686-I783 HydrophobicContact CD2-CB 4.42Å; Y686-I783 HydrophobicContact CD2-CD1 4.06Å; Y686-I783 HydrophobicContact CE2-CB 3.56Å; Y686-I783 HydrophobicContact CE2-CD1 3.83Å; Y686-I783 HydrophobicContact CE2-CG1 4.24Å; Y686-I783 HydrophobicContact CE2-CG2 3.66Å; I688-I783 HydrophobicContact CB-CD1 3.66Å; I688-I783 HydrophobicContact CB-CG1 4.34Å; I688-I783 HydrophobicContact CD1-CD1 3.62Å; I688-I783 HydrophobicContact CG1-CD1 3.85Å; I688-I783 HydrophobicContact CG2-CD1 4.21Å; F690-I783 HydrophobicContact CD2-CG1 4.45Å; F690-I783 HydrophobicContact CE2-CD1 3.8Å; F690-I783 HydrophobicContact CE2-CG1 3.56Å; F690-I783 HydrophobicContact CZ-CD1 4.32Å; F690-I783 HydrophobicContact CZ-CG1 4.34Å; I783-L785 PolarHBondContact O-N 2.88Å; I783-I786 CarbonylContact O-C 3.57Å; I783-I786 WeakPolarHBondContact O-CA 3.46Å; I783-I786 WeakPolarHBondContact O-CB 3.47Å; I783-I786 PolarHBondContact O-N 2.95Å; I783-L787 HydrophobicContact CG2-CD1 3.56Å; I783-L787 HydrophobicContact CG2-CD2 4.35Å; I783-L787 HydrophobicContact CG2-CG 3.61Å; I783-L787 PolarHBondContact O-N 3.45Å
784	D	74.8	Confident	69	Low	28 Å²	28	58.2 Å²	58.2	15%	0.15	31%	0.308	C	S	.	.	H	α-helix	trans	-48.6	-35.3	-179.4	-65.4	-37.6	0	0	0	113.4	K624 P681 Y686 S782 L787 S788	K624-D784 WeakPolarHBondContact CE-OD2 3.38Å; K624-D784 IonicContact NZ-OD1 3.9Å; K624-D784 IonicContact NZ-OD2 2.7Å; K624-D784 PolarHBondContact NZ-OD2 2.94Å; P681-D784 HydrophobicContact CB-CB 3.99Å; Y686-D784 WeakPolarHBondContact CE1-OD1 3.42Å; Y686-D784 PolarHBondContact OH-OD1 3.46Å; S782-D784 PolarHBondContact O-N 2.87Å; D784-L787 PolarHBondContact O-N 2.98Å; D784-S788 WeakPolarHBondContact O-CB 3.48Å; D784-S788 PolarHBondContact O-N 3.46Å
785	L	76.5	Confident	71.6	Confident	16 Å²	16	53.1 Å²	53.1	8%	0.084	29%	0.286	C	S	.	.	H	α-helix	trans	-83.2	-23.2	179.2	-151.6	74.9	0	0	0	113.7	T605 F609 S782 I783 L787 S788 A860 F864	T605-L785 HydrophobicContact CG2-CD1 3.43Å; T605-L785 VanDerWaalsContact CG2-CD1 3.43Å; F609-L785 HydrophobicContact CE1-CD2 4.41Å; F609-L785 HydrophobicContact CZ-CD1 3.95Å; F609-L785 HydrophobicContact CZ-CD2 3.92Å; S782-L785 PolarHBondContact O-N 2.9Å; I783-L785 PolarHBondContact O-N 2.88Å; L785-L787 VanDerWaalsContact C-N 3.33Å; L785-S788 WeakPolarHBondContact CA-OG 2.84Å; L785-S788 PolarHBondContact O-OG 2.98Å; L785-A860 HydrophobicContact CD1-CB 4.09Å; L785-A860 HydrophobicContact CD2-CB 3.97Å; L785-A860 WeakPolarHBondContact CD2-O 3.38Å; L785-A860 HydrophobicContact CG-CB 4.01Å; L785-F864 HydrophobicContact CB-CE2 4.03Å; L785-F864 HydrophobicContact CB-CZ 3.69Å; L785-F864 HydrophobicContact CD2-CD2 4.15Å; L785-F864 HydrophobicContact CD2-CE1 4.27Å; L785-F864 HydrophobicContact CD2-CE2 3.37Å; L785-F864 HydrophobicContact CD2-CZ 3.44Å; L785-F864 VanDerWaalsContact CD2-CZ 3.44Å; L785-F864 HydrophobicContact CG-CE2 4.29Å; L785-F864 HydrophobicContact CG-CZ 4.22Å
786	I	79.7	Confident	74.3	Confident	93 Å²	93	50.5 Å²	50.5	48%	0.477	26%	0.258	S	S	.	.	H	α-helix	trans	-74.1	-30.5	168.2	-57.4	176.2	0	0	0	109.6	V781 I783 P790	V781-I786 HydrophobicContact CG1-CD1 4.33Å; I783-I786 CarbonylContact O-C 3.57Å; I783-I786 WeakPolarHBondContact O-CA 3.46Å; I783-I786 WeakPolarHBondContact O-CB 3.47Å; I783-I786 PolarHBondContact O-N 2.95Å; I786-P790 WeakPolarHBondContact O-CD 3.39Å
787	L	82.8	Confident	76.8	Confident	41 Å²	41	44.6 Å²	44.6	22%	0.215	23%	0.231	C	C	.	.	H	α-helix	trans	-83.2	-21.9	174.9	-62	177.7	0	0	0	113.9	I679 H680 F682 Y686 I783 D784 L785	I679-L787 HydrophobicContact CG2-CD2 3.99Å; H680-L787 WeakPolarHBondContact O-CD1 3.31Å; F682-L787 HydrophobicContact CD1-CD1 4.2Å; F682-L787 HydrophobicContact CE1-CD1 4.4Å; Y686-L787 WeakPolarHBondContact OH-CD1 3.4Å; I783-L787 HydrophobicContact CG2-CD1 3.56Å; I783-L787 HydrophobicContact CG2-CD2 4.35Å; I783-L787 HydrophobicContact CG2-CG 3.61Å; I783-L787 PolarHBondContact O-N 3.45Å; D784-L787 PolarHBondContact O-N 2.98Å; L785-L787 VanDerWaalsContact C-N 3.33Å
788	S	84.6	Confident	78.8	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.007	22%	0.22	C	C	.	.	H	α-helix	trans	-69.7	-39.2	176.4	72.1	0	0	0	0	112.2	D784 L785 M791	D784-S788 WeakPolarHBondContact O-CB 3.48Å; D784-S788 PolarHBondContact O-N 3.46Å; L785-S788 WeakPolarHBondContact CA-OG 2.84Å; L785-S788 PolarHBondContact O-OG 2.98Å; S788-M791 WeakPolarHBondContact O-CB 3.5Å; S788-M791 PolarHBondContact O-N 3.3Å
789	V	86.8	Confident	80.6	Confident	34 Å²	34	43.1 Å²	43.1	21%	0.206	21%	0.212	C	C	.	.	H	α-helix	trans	-60.6	-51	-178.3	167.7	0	0	0	0	113.3	M791 F792 T857	V789-M791 PolarHBondContact O-N 2.93Å; V789-M791 VanDerWaalsContact O-N 3.13Å; V789-F792 WeakPolarHBondContact O-CD2 3.32Å; V789-F792 PolarHBondContact O-N 3.37Å; V789-T857 HydrophobicContact CB-CG2 4.22Å; V789-T857 HydrophobicContact CG1-CG2 3.61Å; V789-T857 HydrophobicContact CG2-CG2 3.72Å
790	P	89.2	Confident	82.4	Confident	27 Å²	27	40.1 Å²	40.1	18%	0.175	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-19.3	173	-24.7	34.1	0	0	0	114.2	I679 I786 F792 F793	I679-P790 HydrophobicContact CB-CB 4.49Å; I679-P790 HydrophobicContact CD1-CB 4.3Å; I679-P790 HydrophobicContact CG2-CB 3.82Å; I679-P790 HydrophobicContact CG2-CG 4.22Å; I786-P790 WeakPolarHBondContact O-CD 3.39Å; P790-F792 PolarHBondContact O-N 3.21Å; P790-F793 HydrophobicContact CB-CD2 3.89Å; P790-F793 HydrophobicContact CB-CE2 3.86Å; P790-F793 WeakPolarHBondContact O-CB 3.23Å; P790-F793 VanDerWaalsContact O-CD2 3.24Å; P790-F793 WeakPolarHBondContact O-CD2 3.3Å; P790-F793 VanDerWaalsContact O-CG 3.29Å; P790-F793 WeakPolarHBondContact O-CG 3.34Å; P790-F793 PolarHBondContact O-N 3.3Å
791	M	91.1	Very high	84	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-69	-22.9	-176	-144.2	-99.7	-78.6	0	0	112.3	G597 I598 M601 S788 V789 F793 R794	G597-M791 WeakPolarHBondContact O-CE 3.33Å; I598-M791 HydrophobicContact CG1-CE 4.47Å; I598-M791 HydrophobicContact CG1-SD 3.76Å; M601-M791 HydrophobicContact CB-CE 3.27Å; M601-M791 HydrophobicContact CE-CB 4.47Å; M601-M791 HydrophobicContact CE-CE 3.79Å; M601-M791 HydrophobicContact CG-CE 3.62Å; S788-M791 WeakPolarHBondContact O-CB 3.5Å; S788-M791 PolarHBondContact O-N 3.3Å; V789-M791 PolarHBondContact O-N 2.93Å; V789-M791 VanDerWaalsContact O-N 3.13Å; M791-F793 PolarHBondContact O-N 3.13Å; M791-R794 VanDerWaalsContact O-CB 3.31Å; M791-R794 WeakPolarHBondContact O-CB 3.36Å; M791-R794 WeakPolarHBondContact O-CD 3.46Å; M791-R794 WeakPolarHBondContact O-CG 3.37Å; M791-R794 PolarHBondContact O-N 3.13Å; M791-R794 VanDerWaalsContact SD-CZ 3.56Å
792	F	91.2	Very high	85.1	Confident	18 Å²	18	39.7 Å²	39.7	8%	0.079	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-65.6	-20.7	167.4	-66.9	-69.5	0	0	0	114.2	I598 M601 L602 V789 P790 R794 L795 V853 W856	I598-F792 HydrophobicContact CG2-CD1 4.23Å; I598-F792 HydrophobicContact CG2-CE1 3.97Å; M601-F792 HydrophobicContact CE-CE1 4.37Å; M601-F792 HydrophobicContact CE-CE2 4.26Å; M601-F792 HydrophobicContact CE-CZ 4.02Å; L602-F792 HydrophobicContact CD2-CE1 4.22Å; L602-F792 HydrophobicContact CD2-CZ 3.87Å; V789-F792 WeakPolarHBondContact O-CD2 3.32Å; V789-F792 PolarHBondContact O-N 3.37Å; P790-F792 PolarHBondContact O-N 3.21Å; F792-R794 PolarHBondContact O-N 2.87Å; F792-L795 HydrophobicContact CB-CD1 4.32Å; F792-L795 HydrophobicContact CD1-CD1 4.17Å; F792-L795 VanDerWaalsContact O-CB 3.26Å; F792-L795 WeakPolarHBondContact O-CB 3.33Å; F792-L795 VanDerWaalsContact O-CG 3.27Å; F792-L795 WeakPolarHBondContact O-CG 3.5Å; F792-L795 PolarHBondContact O-N 3.45Å; F792-V853 HydrophobicContact CB-CG1 4.08Å; F792-V853 HydrophobicContact CD1-CG1 4.16Å; F792-V853 HydrophobicContact CD1-CG2 4.06Å; F792-V853 HydrophobicContact CD2-CG1 4.21Å; F792-V853 HydrophobicContact CE1-CG2 4.45Å; F792-V853 HydrophobicContact CG-CG1 3.9Å; F792-W856 HydrophobicContact CE2-CD2 4.3Å; F792-W856 AromaticContact CE2-CE3 3.31Å; F792-W856 HydrophobicContact CE2-CE3 3.31Å; F792-W856 AromaticContact CE2-CZ3 3.51Å; F792-W856 HydrophobicContact CE2-CZ3 3.51Å; F792-W856 AromaticContact CZ-CD2 3.92Å; F792-W856 HydrophobicContact CZ-CD2 3.92Å; F792-W856 AromaticContact CZ-CE3 3.37Å; F792-W856 HydrophobicContact CZ-CE3 3.37Å; F792-W856 HydrophobicContact CZ-CG 4.44Å; F792-W856 AromaticContact CZ-CZ3 3.82Å; F792-W856 HydrophobicContact CZ-CZ3 3.82Å
793	F	90.6	Very high	85.9	Confident	132 Å²	132	40 Å²	40	58%	0.579	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-57.7	-25.7	176.3	-63.6	-32.4	0	0	0	111.6	V676 P790 M791 L795 Y796	V676-F793 HydrophobicContact CG1-CB 3.67Å; P790-F793 HydrophobicContact CB-CD2 3.89Å; P790-F793 HydrophobicContact CB-CE2 3.86Å; P790-F793 WeakPolarHBondContact O-CB 3.23Å; P790-F793 VanDerWaalsContact O-CD2 3.24Å; P790-F793 WeakPolarHBondContact O-CD2 3.3Å; P790-F793 VanDerWaalsContact O-CG 3.29Å; P790-F793 WeakPolarHBondContact O-CG 3.34Å; P790-F793 PolarHBondContact O-N 3.3Å; M791-F793 PolarHBondContact O-N 3.13Å; F793-L795 PolarHBondContact O-N 2.74Å; F793-L795 VanDerWaalsContact O-N 3.08Å; F793-Y796 WeakPolarHBondContact O-CD1 3.29Å; F793-Y796 PolarHBondContact O-N 3.29Å; F793-Y796 VanDerWaalsContact O-N 3.14Å
794	R	93.8	Very high	86.7	Confident	1 Å²	1	39.2 Å²	39.2	0%	0.004	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-55.8	-19.6	172.2	-60.7	178.4	-176.4	-168	2.4	114.4	A594 I598 C677 I679 M791 F792 Y796 L797	A594-R794 HydrophobicContact CB-CB 4.34Å; I598-R794 HydrophobicContact CD1-CB 4.38Å; C677-R794 PolarHBondContact O-NH2 2.97Å; I679-R794 PolarHBondContact O-NH2 3.45Å; M791-R794 VanDerWaalsContact O-CB 3.31Å; M791-R794 WeakPolarHBondContact O-CB 3.36Å; M791-R794 WeakPolarHBondContact O-CD 3.46Å; M791-R794 WeakPolarHBondContact O-CG 3.37Å; M791-R794 PolarHBondContact O-N 3.13Å; M791-R794 VanDerWaalsContact SD-CZ 3.56Å; F792-R794 PolarHBondContact O-N 2.87Å; R794-Y796 PolarHBondContact O-N 3.16Å; R794-L797 WeakPolarHBondContact O-CB 3.22Å; R794-L797 WeakPolarHBondContact O-CG 3.46Å; R794-L797 PolarHBondContact O-N 2.86Å
795	L	90.5	Very high	87.1	Confident	45 Å²	45	42.6 Å²	42.6	24%	0.236	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-60.2	-14.2	173.7	-67.2	172.4	0	0	0	113.4	I598 F792 F793 L797 L798 V853	I598-L795 HydrophobicContact CD1-CD2 3.8Å; I598-L795 HydrophobicContact CD1-CG 3.98Å; F792-L795 HydrophobicContact CB-CD1 4.32Å; F792-L795 HydrophobicContact CD1-CD1 4.17Å; F792-L795 VanDerWaalsContact O-CB 3.26Å; F792-L795 WeakPolarHBondContact O-CB 3.33Å; F792-L795 VanDerWaalsContact O-CG 3.27Å; F792-L795 WeakPolarHBondContact O-CG 3.5Å; F792-L795 PolarHBondContact O-N 3.45Å; F793-L795 PolarHBondContact O-N 2.74Å; F793-L795 VanDerWaalsContact O-N 3.08Å; L795-L797 PolarHBondContact O-N 2.9Å; L795-L797 VanDerWaalsContact O-N 3.13Å; L795-L798 VanDerWaalsContact O-CB 3.31Å; L795-L798 WeakPolarHBondContact O-CB 3.31Å; L795-L798 PolarHBondContact O-N 2.95Å; L795-V853 HydrophobicContact CD1-CG2 3.5Å
796	Y	92.1	Very high	87.4	Confident	65 Å²	65	42.6 Å²	42.6	26%	0.255	21%	0.208	S	C	.	.	H	α-helix	trans	-55.8	-25.2	167.2	87.2	-71.2	0	0	0	113.4	E673 V676 F793 R794 L798 F799 R800	E673-Y796 WeakPolarHBondContact CB-OH 3.48Å; E673-Y796 HydrophobicContact CG-CE2 3.96Å; E673-Y796 WeakPolarHBondContact CG-OH 3.46Å; V676-Y796 HydrophobicContact CG1-CE1 4.3Å; F793-Y796 WeakPolarHBondContact O-CD1 3.29Å; F793-Y796 PolarHBondContact O-N 3.29Å; F793-Y796 VanDerWaalsContact O-N 3.14Å; R794-Y796 PolarHBondContact O-N 3.16Å; Y796-L798 VanDerWaalsContact C-N 3.32Å; Y796-L798 PolarHBondContact O-N 2.91Å; Y796-F799 WeakPolarHBondContact O-CB 3.33Å; Y796-F799 PolarHBondContact O-N 3.43Å; Y796-R800 PolarHBondContact O-N 3.27Å
797	L	92.2	Very high	86.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68	-29.5	175.5	-64.5	172.2	0	0	0	112.5	L591 A594 L634 R794 L795 R800 V801	L591-L797 HydrophobicContact CD1-CB 4.36Å; A594-L797 HydrophobicContact CB-CD1 3.69Å; L634-L797 HydrophobicContact CD1-CD1 3.91Å; R794-L797 WeakPolarHBondContact O-CB 3.22Å; R794-L797 WeakPolarHBondContact O-CG 3.46Å; R794-L797 PolarHBondContact O-N 2.86Å; L795-L797 PolarHBondContact O-N 2.9Å; L795-L797 VanDerWaalsContact O-N 3.13Å; L797-R800 WeakPolarHBondContact O-CB 3.43Å; L797-R800 PolarHBondContact O-N 3.05Å; L797-V801 WeakPolarHBondContact O-CG2 3.44Å; L797-V801 PolarHBondContact O-N 2.93Å
798	L	89.4	Confident	86.3	Confident	86 Å²	86	47.3 Å²	47.3	45%	0.45	23%	0.226	S	C	.	.	H	α-helix	trans	-64.6	-43.9	173.2	-179.4	63.4	0	0	0	110.2	L591 L795 Y796 V801 M802	L591-L798 HydrophobicContact CD1-CB 3.92Å; L591-L798 HydrophobicContact CD1-CD1 4.26Å; L591-L798 HydrophobicContact CD2-CD1 3.79Å; L795-L798 VanDerWaalsContact O-CB 3.31Å; L795-L798 WeakPolarHBondContact O-CB 3.31Å; L795-L798 PolarHBondContact O-N 2.95Å; Y796-L798 VanDerWaalsContact C-N 3.32Å; Y796-L798 PolarHBondContact O-N 2.91Å; L798-V801 PolarHBondContact O-N 3.45Å; L798-M802 WeakPolarHBondContact O-CB 3.44Å; L798-M802 PolarHBondContact O-N 2.88Å
799	F	85.1	Confident	85.5	Confident	86 Å²	86	49.6 Å²	49.6	38%	0.377	24%	0.236	S	C	.	.	H	α-helix	trans	-64.7	-38.8	175.5	-172.5	-108.3	0	0	0	112.1	Y796 M802 L803 F831	Y796-F799 WeakPolarHBondContact O-CB 3.33Å; Y796-F799 PolarHBondContact O-N 3.43Å; F799-M802 HydrophobicContact CD2-CE 3.52Å; F799-M802 HydrophobicContact CE2-CE 3.68Å; F799-L803 HydrophobicContact CD1-CD1 3.89Å; F799-L803 HydrophobicContact CD1-CG 4.47Å; F799-L803 HydrophobicContact CE1-CD1 3.43Å; F799-L803 VanDerWaalsContact CE1-CD1 3.43Å; F799-L803 HydrophobicContact CE1-CG 4.2Å; F799-L803 HydrophobicContact CZ-CD1 3.79Å; F799-L803 HydrophobicContact CZ-CD2 4.43Å; F799-L803 HydrophobicContact CZ-CG 4.21Å; F799-L803 WeakPolarHBondContact O-CB 3.49Å; F799-L803 WeakPolarHBondContact O-CG 3.16Å; F799-L803 PolarHBondContact O-N 2.89Å; F799-F831 AromaticContact CE2-CD2 3.52Å; F799-F831 HydrophobicContact CE2-CD2 3.52Å; F799-F831 AromaticContact CE2-CE2 3.66Å; F799-F831 HydrophobicContact CE2-CE2 3.66Å; F799-F831 HydrophobicContact CE2-CG 4.46Å; F799-F831 HydrophobicContact CZ-CB 4.33Å; F799-F831 AromaticContact CZ-CD2 3.52Å; F799-F831 HydrophobicContact CZ-CD2 3.52Å; F799-F831 AromaticContact CZ-CE2 3.95Å; F799-F831 HydrophobicContact CZ-CE2 3.95Å; F799-F831 HydrophobicContact CZ-CG 4.02Å
800	R	88.9	Confident	84.9	Confident	29 Å²	29	51.2 Å²	51.2	11%	0.109	25%	0.245	C	C	.	.	H	α-helix	trans	-58.5	-51.2	172	169.9	177.3	-65.9	-171.7	-6.3	112.2	E673 Y796 L797 L803 L804	E673-R800 IonicContact OE1-CZ 3.83Å; E673-R800 IonicContact OE1-NH2 3.28Å; E673-R800 PolarHBondContact OE1-NH2 3.35Å; E673-R800 IonicContact OE2-CZ 2.69Å; E673-R800 VanDerWaalsContact OE2-CZ 3.25Å; E673-R800 IonicContact OE2-NH1 3.49Å; E673-R800 PolarHBondContact OE2-NH1 2.98Å; E673-R800 IonicContact OE2-NH2 3Å; E673-R800 PolarHBondContact OE2-NH2 3.17Å; Y796-R800 PolarHBondContact O-N 3.27Å; L797-R800 WeakPolarHBondContact O-CB 3.43Å; L797-R800 PolarHBondContact O-N 3.05Å; R800-L803 PolarHBondContact O-N 3.17Å; R800-L804 VanDerWaalsContact O-CB 3.27Å; R800-L804 WeakPolarHBondContact O-CB 3.3Å; R800-L804 PolarHBondContact O-N 3.41Å
801	V	88.5	Confident	84.4	Confident	18 Å²	18	53.7 Å²	53.7	11%	0.109	26%	0.257	C	S	.	.	H	α-helix	trans	-62.8	-45.9	179.8	166.5	0	0	0	0	110.8	S587 L591 L797 L798 L803 L804 H805	S587-V801 WeakPolarHBondContact O-CG2 3.37Å; S587-V801 WeakPolarHBondContact OG-CG2 3.3Å; L591-V801 HydrophobicContact CB-CG2 3.85Å; L591-V801 HydrophobicContact CD2-CB 3.93Å; L591-V801 HydrophobicContact CD2-CG1 3.93Å; L591-V801 HydrophobicContact CD2-CG2 3.93Å; L797-V801 WeakPolarHBondContact O-CG2 3.44Å; L797-V801 PolarHBondContact O-N 2.93Å; L798-V801 PolarHBondContact O-N 3.45Å; V801-L803 VanDerWaalsContact C-N 3.34Å; V801-L803 PolarHBondContact O-N 3.29Å; V801-L804 PolarHBondContact O-N 3.04Å; V801-L804 VanDerWaalsContact O-N 3.13Å; V801-H805 PolarHBondContact O-N 2.97Å
802	M	83.7	Confident	83.7	Confident	79 Å²	79	57.3 Å²	57.3	39%	0.389	29%	0.287	S	S	.	.	H	α-helix	trans	-58.1	-42.4	176.4	-175.2	-171.2	69	0	0	112.6	L798 F799 S806 L834	L798-M802 WeakPolarHBondContact O-CB 3.44Å; L798-M802 PolarHBondContact O-N 2.88Å; F799-M802 HydrophobicContact CD2-CE 3.52Å; F799-M802 HydrophobicContact CE2-CE 3.68Å; M802-S806 PolarHBondContact O-N 3.26Å; M802-L834 HydrophobicContact CE-CD2 3.69Å; M802-L834 HydrophobicContact SD-CD2 4.04Å
803	L	83.2	Confident	83.2	Confident	15 Å²	15	57.8 Å²	57.8	8%	0.079	30%	0.297	C	S	.	.	H	α-helix	trans	-70.1	-36	175.4	-73.4	-179.5	0	0	0	112.8	F799 R800 V801 S806 T827 I830	F799-L803 HydrophobicContact CD1-CD1 3.89Å; F799-L803 HydrophobicContact CD1-CG 4.47Å; F799-L803 HydrophobicContact CE1-CD1 3.43Å; F799-L803 VanDerWaalsContact CE1-CD1 3.43Å; F799-L803 HydrophobicContact CE1-CG 4.2Å; F799-L803 HydrophobicContact CZ-CD1 3.79Å; F799-L803 HydrophobicContact CZ-CD2 4.43Å; F799-L803 HydrophobicContact CZ-CG 4.21Å; F799-L803 WeakPolarHBondContact O-CB 3.49Å; F799-L803 WeakPolarHBondContact O-CG 3.16Å; F799-L803 PolarHBondContact O-N 2.89Å; R800-L803 PolarHBondContact O-N 3.17Å; V801-L803 VanDerWaalsContact C-N 3.34Å; V801-L803 PolarHBondContact O-N 3.29Å; L803-S806 WeakPolarHBondContact O-CB 3.45Å; L803-S806 PolarHBondContact O-N 3.5Å; L803-T827 HydrophobicContact CD1-CG2 4.19Å; L803-I830 HydrophobicContact CD2-CB 4.16Å; L803-I830 HydrophobicContact CD2-CG2 3.64Å
804	L	85.5	Confident	82.8	Confident	9 Å²	9	52.9 Å²	52.9	5%	0.047	28%	0.279	C	S	.	.	H	α-helix	trans	-76.3	-35.7	-174.8	-177.4	58.8	0	0	0	113.2	F580 C584 Y641 R800 V801 S806 F809	F580-L804 HydrophobicContact CE1-CD1 4.33Å; F580-L804 HydrophobicContact CE2-CD1 4.16Å; F580-L804 HydrophobicContact CZ-CD1 3.72Å; C584-L804 HydrophobicContact CB-CD2 4.44Å; Y641-L804 HydrophobicContact CE2-CD2 4.29Å; R800-L804 VanDerWaalsContact O-CB 3.27Å; R800-L804 WeakPolarHBondContact O-CB 3.3Å; R800-L804 PolarHBondContact O-N 3.41Å; V801-L804 PolarHBondContact O-N 3.04Å; V801-L804 VanDerWaalsContact O-N 3.13Å; L804-S806 VanDerWaalsContact C-N 3.33Å; L804-F809 HydrophobicContact CD1-CD1 4.43Å; L804-F809 HydrophobicContact CD1-CE1 4.4Å
805	H	84.4	Confident	82.3	Confident	99 Å²	99	56.2 Å²	56.2	46%	0.458	29%	0.292	S	S	.	.	H	α-helix	trans	-81.2	-10.2	171.8	-79.4	-84.6	0	0	0	113.9	D588 V801 K807	D588-H805 IonicContact OD1-CD2 3.29Å; D588-H805 PolarHBondContact OD1-CD2 3.31Å; D588-H805 IonicContact OD1-CE1 2.98Å; D588-H805 IonicContact OD1-NE2 3.74Å; D588-H805 PolarHBondContact OD1-NE2 2.78Å; D588-H805 IonicContact OD2-CE1 3.06Å; D588-H805 PolarHBondContact OD2-CE1 3.39Å; D588-H805 IonicContact OD2-NE2 2.89Å; D588-H805 PolarHBondContact OD2-NE2 3.39Å; V801-H805 PolarHBondContact O-N 2.97Å; H805-K807 PolarHBondContact O-N 2.73Å; H805-K807 VanDerWaalsContact O-N 3.14Å
806	S	81.4	Confident	81.9	Confident	16 Å²	16	56.7 Å²	56.7	11%	0.112	30%	0.299	C	S	.	.			trans	-59.2	119.5	178.6	-166.8	0	0	0	0	111	M802 L803 L804 L808 F809	M802-S806 PolarHBondContact O-N 3.26Å; L803-S806 WeakPolarHBondContact O-CB 3.45Å; L803-S806 PolarHBondContact O-N 3.5Å; L804-S806 VanDerWaalsContact C-N 3.33Å; S806-L808 PolarHBondContact O-N 3.3Å; S806-F809 PolarHBondContact O-N 2.93Å
807	K	70.8	Confident	81.6	Confident	179 Å²	179	58.4 Å²	58.4	78%	0.778	31%	0.311	S	S	*	.	H	α-helix	trans	-50.1	-30	178.5	-69.5	-174.5	178.3	-178.6	0	112.6	H805 F809 T810 D811	H805-K807 PolarHBondContact O-N 2.73Å; H805-K807 VanDerWaalsContact O-N 3.14Å; K807-F809 VanDerWaalsContact C-N 3.26Å; K807-F809 PolarHBondContact O-N 2.99Å; K807-T810 WeakPolarHBondContact CA-OG1 3.38Å; K807-T810 PolarHBondContact O-N 3.33Å; K807-T810 PolarHBondContact O-OG1 3.4Å; K807-D811 WeakPolarHBondContact O-CB 3.34Å; K807-D811 PolarHBondContact O-N 2.91Å
808	L	69.2	Low	81.2	Confident	55 Å²	55	58.7 Å²	58.7	29%	0.288	31%	0.314	S	S	.	.	H	α-helix	trans	-58.6	-34	177.5	-73.1	82.9	0	0	0	113.3	S806 S814 T833	S806-L808 PolarHBondContact O-N 3.3Å; L808-S814 PolarHBondContact O-OG 3.29Å; L808-T833 HydrophobicContact CD2-CG2 3.37Å
809	F	68	Low	80.9	Confident	49 Å²	49	56 Å²	56	22%	0.215	30%	0.304	C	S	.	.	H	α-helix	trans	-89.4	-23.8	-179.6	-170.5	-121.8	0	0	0	113.2	F580 L804 S806 K807 R815 F825 I830	F580-F809 HydrophobicContact CE2-CD1 4.07Å; F580-F809 AromaticContact CE2-CE1 3.82Å; F580-F809 HydrophobicContact CE2-CE1 3.82Å; F580-F809 HydrophobicContact CZ-CD1 4.07Å; F580-F809 HydrophobicContact CZ-CE1 4.25Å; L804-F809 HydrophobicContact CD1-CD1 4.43Å; L804-F809 HydrophobicContact CD1-CE1 4.4Å; S806-F809 PolarHBondContact O-N 2.93Å; K807-F809 VanDerWaalsContact C-N 3.26Å; K807-F809 PolarHBondContact O-N 2.99Å; F809-R815 PolarHBondContact O-NE 3.12Å; F809-R815 PolarHBondContact O-NH2 3.39Å; F809-F825 HydrophobicContact CD2-CB 4.22Å; F809-F825 HydrophobicContact CE2-CB 4.19Å; F809-I830 HydrophobicContact CB-CD1 4.05Å; F809-I830 HydrophobicContact CD2-CD1 3.56Å; F809-I830 HydrophobicContact CE2-CD1 4.25Å; F809-I830 HydrophobicContact CG-CD1 4Å
810	T	74.2	Confident	81	Confident	67 Å²	67	57.1 Å²	57.1	41%	0.411	31%	0.312	S	S	.	.	H	α-helix	trans	-92.9	-26.5	-176.9	48.1	0	0	0	0	114.2	F580 K807	F580-T810 HydrophobicContact CE1-CG2 3.55Å; F580-T810 HydrophobicContact CZ-CG2 3.56Å; K807-T810 WeakPolarHBondContact CA-OG1 3.38Å; K807-T810 PolarHBondContact O-N 3.33Å; K807-T810 PolarHBondContact O-OG1 3.4Å
811	D	78.7	Confident	81	Confident	80 Å²	80	61 Å²	61	43%	0.428	34%	0.335	S	S	.	.			trans	-61.7	138.6	-177.9	178.4	33.1	0	0	0	113.3	K807 G813 S814 R815	K807-D811 WeakPolarHBondContact O-CB 3.34Å; K807-D811 PolarHBondContact O-N 2.91Å; D811-G813 VanDerWaalsContact CG-N 3.27Å; D811-G813 PolarHBondContact OD1-N 3.08Å; D811-G813 WeakPolarHBondContact OD2-CA 3.5Å; D811-G813 PolarHBondContact OD2-N 2.71Å; D811-S814 PolarHBondContact O-OG 2.67Å; D811-S814 PolarHBondContact OD2-N 2.92Å; D811-R815 WeakPolarHBondContact O-CB 3.18Å; D811-R815 WeakPolarHBondContact O-CD 3.08Å; D811-R815 WeakPolarHBondContact O-CG 3.35Å; D811-R815 PolarHBondContact O-N 3Å
812	A	76	Confident	81	Confident	75 Å²	75	68.3 Å²	68.3	62%	0.62	37%	0.365	S	S	*	.	H	α-helix	trans	-79.2	-31.5	173.4	0	0	0	0	0	111.9	S816	A812-S816 WeakPolarHBondContact O-CB 3.47Å; A812-S816 PolarHBondContact O-N 2.89Å; A812-S816 PolarHBondContact O-OG 3Å
813	G	81	Confident	81	Confident	28 Å²	28	67 Å²	67	29%	0.289	36%	0.362	S	S	.	.	H	α-helix	trans	-58.9	-60.6	174.4	0	0	0	0	0	110.8	D811 R815 S816 I817	D811-G813 VanDerWaalsContact CG-N 3.27Å; D811-G813 PolarHBondContact OD1-N 3.08Å; D811-G813 WeakPolarHBondContact OD2-CA 3.5Å; D811-G813 PolarHBondContact OD2-N 2.71Å; G813-R815 VanDerWaalsContact C-N 3.34Å; G813-R815 PolarHBondContact O-N 3.31Å; G813-S816 PolarHBondContact O-N 2.89Å; G813-S816 VanDerWaalsContact O-N 3.17Å; G813-S816 PolarHBondContact O-OG 3.04Å; G813-I817 WeakPolarHBondContact O-CG1 3.32Å; G813-I817 PolarHBondContact O-N 3.31Å
814	S	83.3	Confident	80.9	Confident	30 Å²	30	70.4 Å²	70.4	21%	0.21	38%	0.38	C	S	.	.	H	α-helix	trans	-50.2	-52.3	176.3	78.8	0	0	0	0	111.3	L808 D811 S816 I817 G818 F825	L808-S814 PolarHBondContact O-OG 3.29Å; D811-S814 PolarHBondContact O-OG 2.67Å; D811-S814 PolarHBondContact OD2-N 2.92Å; S814-S816 PolarHBondContact O-N 2.72Å; S814-I817 PolarHBondContact O-N 3.44Å; S814-G818 PolarHBondContact O-N 2.93Å; S814-F825 WeakPolarHBondContact O-CZ 3.37Å
815	R	81.9	Confident	80.5	Confident	70 Å²	70	72.3 Å²	72.3	26%	0.264	39%	0.388	S	S	.	.	H	α-helix	trans	-58.1	-42.5	-179.5	-75.4	175.9	178	-149.9	2.5	113.2	F809 D811 G813 A819 F825	F809-R815 PolarHBondContact O-NE 3.12Å; F809-R815 PolarHBondContact O-NH2 3.39Å; D811-R815 WeakPolarHBondContact O-CB 3.18Å; D811-R815 WeakPolarHBondContact O-CD 3.08Å; D811-R815 WeakPolarHBondContact O-CG 3.35Å; D811-R815 PolarHBondContact O-N 3Å; G813-R815 VanDerWaalsContact C-N 3.34Å; G813-R815 PolarHBondContact O-N 3.31Å; R815-A819 WeakPolarHBondContact O-CB 3.49Å; R815-A819 PolarHBondContact O-N 3.28Å; R815-F825 HydrophobicContact CG-CD2 4.47Å; R815-F825 HydrophobicContact CG-CE2 4.46Å
816	S	82.8	Confident	80.2	Confident	56 Å²	56	72 Å²	72	39%	0.392	39%	0.39	S	S	.	.	H	α-helix	trans	-66.1	-44.1	177.3	70.8	0	0	0	0	112	A812 G813 S814 G818 A819 M820	A812-S816 WeakPolarHBondContact O-CB 3.47Å; A812-S816 PolarHBondContact O-N 2.89Å; A812-S816 PolarHBondContact O-OG 3Å; G813-S816 PolarHBondContact O-N 2.89Å; G813-S816 VanDerWaalsContact O-N 3.17Å; G813-S816 PolarHBondContact O-OG 3.04Å; S814-S816 PolarHBondContact O-N 2.72Å; S816-G818 PolarHBondContact O-N 2.84Å; S816-A819 PolarHBondContact O-N 3.26Å; S816-M820 WeakPolarHBondContact O-CG 3.42Å; S816-M820 PolarHBondContact O-N 3.38Å
817	I	85.2	Confident	80.2	Confident	100 Å²	100	75.6 Å²	75.6	51%	0.513	41%	0.411	S	S	.	.	H	α-helix	trans	-65.1	-40.6	178.3	-65.7	166.2	0	0	0	110.8	G813 S814 M820 N821	G813-I817 WeakPolarHBondContact O-CG1 3.32Å; G813-I817 PolarHBondContact O-N 3.31Å; S814-I817 PolarHBondContact O-N 3.44Å; I817-M820 PolarHBondContact O-N 3.43Å; I817-N821 WeakPolarHBondContact O-CB 3.38Å; I817-N821 PolarHBondContact O-N 2.84Å; I817-N821 PolarHBondContact O-ND2 2.9Å
818	G	84.7	Confident	80.7	Confident	6 Å²	6	77.5 Å²	77.5	6%	0.062	41%	0.413	C	S	.	.	H	α-helix	trans	-66.8	-42.2	175.8	0	0	0	0	0	112.6	S814 S816 M820 N821 K822 V823	S814-G818 PolarHBondContact O-N 2.93Å; S816-G818 PolarHBondContact O-N 2.84Å; G818-M820 PolarHBondContact O-N 2.93Å; G818-N821 CarbonylContact O-C 3.59Å; G818-N821 PolarHBondContact O-N 2.76Å; G818-K822 CarbonylContact O-C 3.59Å; G818-K822 WeakPolarHBondContact O-CA 3.48Å; G818-K822 PolarHBondContact O-N 3.29Å; G818-V823 PolarHBondContact O-N 2.91Å
819	A	83.6	Confident	81.4	Confident	29 Å²	29	78.8 Å²	78.8	24%	0.24	42%	0.417	C	S	.	.	H	α-helix	trans	-61.1	-43.1	174.3	0	0	0	0	0	112.2	R815 S816 N821 K822	R815-A819 WeakPolarHBondContact O-CB 3.49Å; R815-A819 PolarHBondContact O-N 3.28Å; S816-A819 PolarHBondContact O-N 3.26Å; A819-N821 VanDerWaalsContact C-N 3.31Å; A819-N821 PolarHBondContact O-N 3.38Å; A819-K822 PolarHBondContact O-N 3.03Å; A819-K822 VanDerWaalsContact O-N 3.14Å
820	M	86	Confident	82.1	Confident	111 Å²	111	76.7 Å²	76.7	55%	0.547	41%	0.408	S	S	.	.	H	α-helix	trans	-59.6	-39.6	173.7	-73.2	176.2	62.1	0	0	112.5	F19 S816 I817 G818 K822	F19-M820 HydrophobicContact CE1-CG 4.29Å; F19-M820 HydrophobicContact CE1-SD 3.98Å; F19-M820 HydrophobicContact CZ-SD 4.43Å; S816-M820 WeakPolarHBondContact O-CG 3.42Å; S816-M820 PolarHBondContact O-N 3.38Å; I817-M820 PolarHBondContact O-N 3.43Å; G818-M820 PolarHBondContact O-N 2.93Å; M820-K822 VanDerWaalsContact C-N 3.34Å
821	N	88.9	Confident	82.5	Confident	109 Å²	109	76.9 Å²	76.9	58%	0.583	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	3.9	177.5	-69.8	-67.4	0	0	0	114.1	I817 G818 A819 V823	I817-N821 WeakPolarHBondContact O-CB 3.38Å; I817-N821 PolarHBondContact O-N 2.84Å; I817-N821 PolarHBondContact O-ND2 2.9Å; G818-N821 CarbonylContact O-C 3.59Å; G818-N821 PolarHBondContact O-N 2.76Å; A819-N821 VanDerWaalsContact C-N 3.31Å; A819-N821 PolarHBondContact O-N 3.38Å; N821-V823 HydrophobicContact CB-CG2 4.07Å; N821-V823 PolarHBondContact O-N 3.28Å
822	K	87.7	Confident	82.9	Confident	172 Å²	172	80.2 Å²	80.2	75%	0.748	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	27.7	-174.5	-54	175.9	-175.8	171.6	0	114.6	G818 A819 M820	G818-K822 CarbonylContact O-C 3.59Å; G818-K822 WeakPolarHBondContact O-CA 3.48Å; G818-K822 PolarHBondContact O-N 3.29Å; A819-K822 PolarHBondContact O-N 3.03Å; A819-K822 VanDerWaalsContact O-N 3.14Å; M820-K822 VanDerWaalsContact C-N 3.34Å
823	V	84.1	Confident	83.3	Confident	53 Å²	53	77.7 Å²	77.7	32%	0.321	39%	0.391	S	S	.	.			trans	-87	122.9	174.3	-179.6	0	0	0	0	109.3	G818 N821 F829	G818-V823 PolarHBondContact O-N 2.91Å; N821-V823 HydrophobicContact CB-CG2 4.07Å; N821-V823 PolarHBondContact O-N 3.28Å; V823-F829 HydrophobicContact CG1-CD2 4.18Å; V823-F829 HydrophobicContact CG1-CE1 4.46Å; V823-F829 HydrophobicContact CG1-CE2 3.97Å; V823-F829 HydrophobicContact CG1-CZ 4.12Å
824	N	81.2	Confident	83.5	Confident	85 Å²	85	77.9 Å²	77.9	46%	0.455	39%	0.385	S	S	.	.			trans	-80.2	140.9	173.6	-66.8	-31.5	0	0	0	110.9	Q12 D826	Q12-N824 PolarHBondContact NE2-OD1 3.02Å; N824-D826 PolarHBondContact O-N 2.97Å
825	F	76.9	Confident	83.5	Confident	50 Å²	50	78.8 Å²	78.8	22%	0.219	39%	0.387	C	S	.	.			trans	-83.6	59.1	179.6	-72.1	-86.9	0	0	0	111.8	F809 S814 R815 F829	F809-F825 HydrophobicContact CD2-CB 4.22Å; F809-F825 HydrophobicContact CE2-CB 4.19Å; S814-F825 WeakPolarHBondContact O-CZ 3.37Å; R815-F825 HydrophobicContact CG-CD2 4.47Å; R815-F825 HydrophobicContact CG-CE2 4.46Å; F825-F829 HydrophobicContact CD1-CE1 4.43Å; F825-F829 HydrophobicContact CE1-CE1 4.27Å
826	D	78.6	Confident	83.7	Confident	92 Å²	92	79.1 Å²	79.1	49%	0.492	40%	0.396	S	S	.	.			trans	-73.8	150.3	-179.3	-59.9	-30.8	0	0	0	111.2	N824 R828 F829 I830	N824-D826 PolarHBondContact O-N 2.97Å; D826-R828 PolarHBondContact O-N 3.31Å; D826-F829 HydrophobicContact CB-CB 4.49Å; D826-F829 WeakPolarHBondContact O-CA 3.21Å; D826-F829 WeakPolarHBondContact O-CB 3.36Å; D826-F829 PolarHBondContact O-N 3.19Å; D826-I830 WeakPolarHBondContact O-CG1 3.43Å; D826-I830 PolarHBondContact O-N 2.78Å
827	T	80.7	Confident	83.9	Confident	92 Å²	92	82.9 Å²	82.9	56%	0.564	41%	0.409	S	S	*	.	H	α-helix	trans	-55.4	-35.3	174.9	52.3	0	0	0	0	112.5	L803 I830 F831	L803-T827 HydrophobicContact CD1-CG2 4.19Å; T827-I830 PolarHBondContact O-N 2.82Å; T827-F831 VanDerWaalsContact O-CB 3.31Å; T827-F831 WeakPolarHBondContact O-CB 3.4Å; T827-F831 PolarHBondContact O-N 3.17Å
828	R	83.1	Confident	83.9	Confident	218 Å²	218	81.1 Å²	81.1	82%	0.823	41%	0.405	S	S	*	.	H	α-helix	trans	-62.9	-39.7	173.4	-64.8	179.8	179.2	173.6	-0.8	112.7	D826 K832	D826-R828 PolarHBondContact O-N 3.31Å; R828-K832 WeakPolarHBondContact O-CB 3.13Å; R828-K832 PolarHBondContact O-N 3.46Å; R828-K832 VanDerWaalsContact O-N 3.07Å
829	F	83.2	Confident	84.1	Confident	83 Å²	83	81.8 Å²	81.8	36%	0.364	41%	0.409	S	S	.	.	H	α-helix	trans	-67.9	-48.9	176.2	175.7	-100.6	0	0	0	110.4	V823 F825 D826 F831 K832 T833	V823-F829 HydrophobicContact CG1-CD2 4.18Å; V823-F829 HydrophobicContact CG1-CE1 4.46Å; V823-F829 HydrophobicContact CG1-CE2 3.97Å; V823-F829 HydrophobicContact CG1-CZ 4.12Å; F825-F829 HydrophobicContact CD1-CE1 4.43Å; F825-F829 HydrophobicContact CE1-CE1 4.27Å; D826-F829 HydrophobicContact CB-CB 4.49Å; D826-F829 WeakPolarHBondContact O-CA 3.21Å; D826-F829 WeakPolarHBondContact O-CB 3.36Å; D826-F829 PolarHBondContact O-N 3.19Å; F829-F831 PolarHBondContact O-N 3.42Å; F829-K832 WeakPolarHBondContact O-CB 3.39Å; F829-K832 PolarHBondContact O-N 3.32Å; F829-T833 PolarHBondContact O-N 3.3Å; F829-T833 PolarHBondContact O-OG1 3.05Å
830	I	83	Confident	84.3	Confident	5 Å²	5	82.6 Å²	82.6	3%	0.026	42%	0.42	C	S	.	.	H	α-helix	trans	-59.9	-44.9	179.6	-57.6	159.5	0	0	0	110.9	L803 F809 D826 T827 T833 L834	L803-I830 HydrophobicContact CD2-CB 4.16Å; L803-I830 HydrophobicContact CD2-CG2 3.64Å; F809-I830 HydrophobicContact CB-CD1 4.05Å; F809-I830 HydrophobicContact CD2-CD1 3.56Å; F809-I830 HydrophobicContact CE2-CD1 4.25Å; F809-I830 HydrophobicContact CG-CD1 4Å; D826-I830 WeakPolarHBondContact O-CG1 3.43Å; D826-I830 PolarHBondContact O-N 2.78Å; T827-I830 PolarHBondContact O-N 2.82Å; I830-T833 PolarHBondContact O-N 2.93Å; I830-L834 WeakPolarHBondContact O-CB 3.29Å; I830-L834 PolarHBondContact O-N 3.32Å
831	F	82.7	Confident	84.4	Confident	70 Å²	70	85.7 Å²	85.7	31%	0.307	43%	0.43	S	S	.	.	H	α-helix	trans	-61.9	-45.2	176.5	-178.8	-117.4	0	0	0	112.3	F799 T827 F829 T833 L834 M835 L842	F799-F831 AromaticContact CE2-CD2 3.52Å; F799-F831 HydrophobicContact CE2-CD2 3.52Å; F799-F831 AromaticContact CE2-CE2 3.66Å; F799-F831 HydrophobicContact CE2-CE2 3.66Å; F799-F831 HydrophobicContact CE2-CG 4.46Å; F799-F831 HydrophobicContact CZ-CB 4.33Å; F799-F831 AromaticContact CZ-CD2 3.52Å; F799-F831 HydrophobicContact CZ-CD2 3.52Å; F799-F831 AromaticContact CZ-CE2 3.95Å; F799-F831 HydrophobicContact CZ-CE2 3.95Å; F799-F831 HydrophobicContact CZ-CG 4.02Å; T827-F831 VanDerWaalsContact O-CB 3.31Å; T827-F831 WeakPolarHBondContact O-CB 3.4Å; T827-F831 PolarHBondContact O-N 3.17Å; F829-F831 PolarHBondContact O-N 3.42Å; F831-T833 VanDerWaalsContact C-N 3.32Å; F831-T833 PolarHBondContact O-N 2.94Å; F831-L834 PolarHBondContact O-N 3.44Å; F831-M835 HydrophobicContact CD1-SD 4.27Å; F831-M835 HydrophobicContact CE1-CE 3.87Å; F831-M835 HydrophobicContact CE1-SD 3.68Å; F831-M835 HydrophobicContact CE2-CE 4.1Å; F831-M835 HydrophobicContact CE2-CG 4.38Å; F831-M835 HydrophobicContact CE2-SD 4.35Å; F831-M835 HydrophobicContact CZ-CE 3.4Å; F831-M835 HydrophobicContact CZ-CG 4.35Å; F831-M835 HydrophobicContact CZ-SD 3.74Å; F831-M835 WeakPolarHBondContact O-CB 3.46Å; F831-M835 PolarHBondContact O-N 2.93Å; F831-L842 HydrophobicContact CE2-CD1 4.28Å
832	K	85.8	Confident	84.4	Confident	150 Å²	150	81.9 Å²	81.9	65%	0.652	41%	0.41	S	S	*	.	H	α-helix	trans	-58.6	-43.1	174	-175.8	177.1	-179.3	178.3	0	111.5	R828 F829 M835 T836	R828-K832 WeakPolarHBondContact O-CB 3.13Å; R828-K832 PolarHBondContact O-N 3.46Å; R828-K832 VanDerWaalsContact O-N 3.07Å; F829-K832 WeakPolarHBondContact O-CB 3.39Å; F829-K832 PolarHBondContact O-N 3.32Å; K832-M835 PolarHBondContact O-N 2.83Å; K832-T836 PolarHBondContact O-N 2.93Å; K832-T836 VanDerWaalsContact O-N 3.12Å; K832-T836 PolarHBondContact O-OG1 3.39Å
833	T	85.3	Confident	84.5	Confident	23 Å²	23	74.3 Å²	74.3	14%	0.141	38%	0.377	C	S	.	.	H	α-helix	trans	-67.8	-40.9	178.1	-46.5	0	0	0	0	111.8	L808 F829 I830 F831 M835 T836 M837	L808-T833 HydrophobicContact CD2-CG2 3.37Å; F829-T833 PolarHBondContact O-N 3.3Å; F829-T833 PolarHBondContact O-OG1 3.05Å; I830-T833 PolarHBondContact O-N 2.93Å; F831-T833 VanDerWaalsContact C-N 3.32Å; F831-T833 PolarHBondContact O-N 2.94Å; T833-M835 PolarHBondContact O-N 3.31Å; T833-T836 WeakPolarHBondContact CA-OG1 3.37Å; T833-T836 PolarHBondContact O-N 3.47Å; T833-T836 PolarHBondContact O-OG1 3.02Å; T833-M837 HydrophobicContact CG2-CE 4.11Å; T833-M837 HydrophobicContact CG2-CG 4.14Å; T833-M837 VanDerWaalsContact O-CG 3.32Å; T833-M837 WeakPolarHBondContact O-CG 3.47Å; T833-M837 PolarHBondContact O-N 2.88Å
834	L	84.2	Confident	84.8	Confident	32 Å²	32	76.9 Å²	76.9	17%	0.168	39%	0.389	C	S	.	.	H	α-helix	trans	-62.7	-41.6	177.1	-170.2	62.1	0	0	0	111.7	M802 I830 F831 T836 M837 C838 L842	M802-L834 HydrophobicContact CE-CD2 3.69Å; M802-L834 HydrophobicContact SD-CD2 4.04Å; I830-L834 WeakPolarHBondContact O-CB 3.29Å; I830-L834 PolarHBondContact O-N 3.32Å; F831-L834 PolarHBondContact O-N 3.44Å; L834-T836 VanDerWaalsContact C-N 3.26Å; L834-T836 PolarHBondContact O-N 3.36Å; L834-M837 PolarHBondContact O-N 3.47Å; L834-C838 PolarHBondContact O-N 3.44Å; L834-L842 HydrophobicContact CB-CD1 4.28Å; L834-L842 HydrophobicContact CD2-CD1 3.66Å; L834-L842 HydrophobicContact CG-CD1 3.68Å
835	M	84.6	Confident	85.2	Confident	49 Å²	49	74.7 Å²	74.7	24%	0.241	39%	0.386	C	S	.	.	H	α-helix	trans	-63.9	-23.1	170.8	-80.6	-171.9	150	0	0	114.1	F831 K832 T833 P839 L842 L915	F831-M835 HydrophobicContact CD1-SD 4.27Å; F831-M835 HydrophobicContact CE1-CE 3.87Å; F831-M835 HydrophobicContact CE1-SD 3.68Å; F831-M835 HydrophobicContact CE2-CE 4.1Å; F831-M835 HydrophobicContact CE2-CG 4.38Å; F831-M835 HydrophobicContact CE2-SD 4.35Å; F831-M835 HydrophobicContact CZ-CE 3.4Å; F831-M835 HydrophobicContact CZ-CG 4.35Å; F831-M835 HydrophobicContact CZ-SD 3.74Å; F831-M835 WeakPolarHBondContact O-CB 3.46Å; F831-M835 PolarHBondContact O-N 2.93Å; K832-M835 PolarHBondContact O-N 2.83Å; T833-M835 PolarHBondContact O-N 3.31Å; M835-P839 WeakPolarHBondContact O-CB 3.42Å; M835-L842 HydrophobicContact CE-CD2 3.94Å; M835-L842 HydrophobicContact CG-CD1 4.2Å; M835-L842 HydrophobicContact CG-CD2 4.06Å; M835-L915 HydrophobicContact CE-CD1 4.13Å
836	T	86	Confident	85.7	Confident	76 Å²	76	76.6 Å²	76.6	47%	0.466	40%	0.395	S	S	.	.	H	α-helix	trans	-86.4	-34.8	171.7	50.2	0	0	0	0	113.7	K832 T833 L834	K832-T836 PolarHBondContact O-N 2.93Å; K832-T836 VanDerWaalsContact O-N 3.12Å; K832-T836 PolarHBondContact O-OG1 3.39Å; T833-T836 WeakPolarHBondContact CA-OG1 3.37Å; T833-T836 PolarHBondContact O-N 3.47Å; T833-T836 PolarHBondContact O-OG1 3.02Å; L834-T836 VanDerWaalsContact C-N 3.26Å; L834-T836 PolarHBondContact O-N 3.36Å
837	M	86.7	Confident	86.4	Confident	135 Å²	135	73.9 Å²	73.9	67%	0.665	38%	0.38	S	S	*	.	H	α-helix	trans	-79.7	-42	-174.7	-68.3	-65	175.6	0	0	113	T833 L834	T833-M837 HydrophobicContact CG2-CE 4.11Å; T833-M837 HydrophobicContact CG2-CG 4.14Å; T833-M837 VanDerWaalsContact O-CG 3.32Å; T833-M837 WeakPolarHBondContact O-CG 3.47Å; T833-M837 PolarHBondContact O-N 2.88Å; L834-M837 PolarHBondContact O-N 3.47Å
838	C	85.6	Confident	86.9	Confident	63 Å²	63	73.3 Å²	73.3	43%	0.426	37%	0.373	S	S	.	.	S	Bend	trans	-138	55.3	-177.2	-81.8	0	0	0	0	112.3	L834 G840 K841 L842	L834-C838 PolarHBondContact O-N 3.44Å; C838-G840 PolarHBondContact O-N 3.36Å; C838-K841 PolarHBondContact O-N 2.89Å; C838-L842 PolarHBondContact O-N 3.39Å; C838-L842 VanDerWaalsContact O-N 3.17Å
839	P	88.6	Confident	87.2	Confident	21 Å²	21	65.2 Å²	65.2	14%	0.136	35%	0.349	C	S	.	.	H	α-helix	trans	-53	-49.5	-174.3	16.8	-29.8	0	0	0	113.1	M835 K841 L842 L843 V919	M835-P839 WeakPolarHBondContact O-CB 3.42Å; P839-K841 PolarHBondContact O-N 3.09Å; P839-L842 PolarHBondContact O-N 3.3Å; P839-L843 WeakPolarHBondContact O-CB 3.19Å; P839-L843 PolarHBondContact O-N 2.82Å; P839-V919 HydrophobicContact CB-CB 4.39Å; P839-V919 HydrophobicContact CB-CG1 3.8Å; P839-V919 HydrophobicContact CB-CG2 3.59Å; P839-V919 HydrophobicContact CG-CG1 4.02Å; P839-V919 HydrophobicContact CG-CG2 4.46Å
840	G	87.5	Confident	87.6	Confident	46 Å²	46	62.6 Å²	62.6	47%	0.474	34%	0.339	S	S	.	.	H	α-helix	trans	-61.4	-45	-176.7	0	0	0	0	0	113.6	C838 L844	C838-G840 PolarHBondContact O-N 3.36Å; G840-L844 WeakPolarHBondContact O-CB 3.3Å; G840-L844 PolarHBondContact O-N 3.44Å
841	K	87.8	Confident	88	Confident	175 Å²	175	66.3 Å²	66.3	76%	0.761	35%	0.352	S	S	*	.	H	α-helix	trans	-67.1	-43.4	-179.5	-67.2	-174.3	177.9	-177.7	0	111.9	C838 P839 G845	C838-K841 PolarHBondContact O-N 2.89Å; P839-K841 PolarHBondContact O-N 3.09Å; K841-G845 PolarHBondContact O-N 3.07Å; K841-G845 VanDerWaalsContact O-N 3.16Å
842	L	88.1	Confident	88.4	Confident	29 Å²	29	68.8 Å²	68.8	15%	0.152	37%	0.368	C	S	.	.	H	α-helix	trans	-64.8	-47.4	176.3	178.8	151.8	0	0	0	111.4	F831 L834 M835 C838 P839 G845 F846	F831-L842 HydrophobicContact CE2-CD1 4.28Å; L834-L842 HydrophobicContact CB-CD1 4.28Å; L834-L842 HydrophobicContact CD2-CD1 3.66Å; L834-L842 HydrophobicContact CG-CD1 3.68Å; M835-L842 HydrophobicContact CE-CD2 3.94Å; M835-L842 HydrophobicContact CG-CD1 4.2Å; M835-L842 HydrophobicContact CG-CD2 4.06Å; C838-L842 PolarHBondContact O-N 3.39Å; C838-L842 VanDerWaalsContact O-N 3.17Å; P839-L842 PolarHBondContact O-N 3.3Å; L842-G845 PolarHBondContact O-N 2.85Å; L842-F846 VanDerWaalsContact O-CB 3.3Å; L842-F846 WeakPolarHBondContact O-CB 3.39Å; L842-F846 PolarHBondContact O-N 2.72Å
843	L	89.8	Confident	88.7	Confident	14 Å²	14	62.8 Å²	62.8	7%	0.073	34%	0.343	C	S	.	.	H	α-helix	trans	-69.1	-40.2	-174.6	-171.1	54.9	0	0	0	111.5	P839 F846 I847 L915 V916	P839-L843 WeakPolarHBondContact O-CB 3.19Å; P839-L843 PolarHBondContact O-N 2.82Å; L843-F846 PolarHBondContact O-N 3.34Å; L843-I847 HydrophobicContact CD1-CD1 4.11Å; L843-I847 HydrophobicContact CD1-CG1 4.4Å; L843-I847 HydrophobicContact CG-CD1 3.98Å; L843-I847 WeakPolarHBondContact O-CB 3.43Å; L843-I847 WeakPolarHBondContact O-CG1 3.11Å; L843-I847 PolarHBondContact O-N 2.76Å; L843-L915 HydrophobicContact CD1-CB 4.38Å; L843-L915 HydrophobicContact CD2-CB 4.35Å; L843-V916 HydrophobicContact CD2-CB 4.36Å; L843-V916 HydrophobicContact CD2-CG2 3.55Å; L843-V916 HydrophobicContact CG-CG2 4.19Å
844	L	90.6	Very high	89.1	Confident	107 Å²	107	63.6 Å²	63.6	56%	0.56	34%	0.344	S	S	*	.	H	α-helix	trans	-61.4	-49.4	173.1	179.7	61.7	0	0	0	111.7	G840 F846 I847 L848	G840-L844 WeakPolarHBondContact O-CB 3.3Å; G840-L844 PolarHBondContact O-N 3.44Å; L844-F846 VanDerWaalsContact C-N 3.31Å; L844-F846 PolarHBondContact O-N 3.48Å; L844-I847 PolarHBondContact O-N 2.9Å; L844-L848 HydrophobicContact CD1-CD1 3.93Å; L844-L848 HydrophobicContact CD1-CG 4.15Å; L844-L848 HydrophobicContact CG-CD1 3.98Å; L844-L848 WeakPolarHBondContact O-CB 3.18Å; L844-L848 WeakPolarHBondContact O-CG 3.31Å; L844-L848 PolarHBondContact O-N 2.93Å
845	G	89.5	Confident	89.5	Confident	39 Å²	39	62.4 Å²	62.4	40%	0.402	34%	0.339	S	S	.	.	H	α-helix	trans	-61.7	-38	178	0	0	0	0	0	113.1	K841 L842 C849	K841-G845 PolarHBondContact O-N 3.07Å; K841-G845 VanDerWaalsContact O-N 3.16Å; L842-G845 PolarHBondContact O-N 2.85Å; G845-C849 VanDerWaalsContact O-CB 3.26Å; G845-C849 WeakPolarHBondContact O-CB 3.28Å; G845-C849 PolarHBondContact O-N 2.69Å
846	F	89	Confident	89.9	Confident	90 Å²	90	60.9 Å²	60.9	40%	0.395	33%	0.33	S	S	.	.	H	α-helix	trans	-66.4	-45.5	175.6	-176	-112.4	0	0	0	112.3	L842 L843 L844 C849 L850 M908	L842-F846 VanDerWaalsContact O-CB 3.3Å; L842-F846 WeakPolarHBondContact O-CB 3.39Å; L842-F846 PolarHBondContact O-N 2.72Å; L843-F846 PolarHBondContact O-N 3.34Å; L844-F846 VanDerWaalsContact C-N 3.31Å; L844-F846 PolarHBondContact O-N 3.48Å; F846-C849 PolarHBondContact O-N 2.93Å; F846-L850 HydrophobicContact CD1-CD1 4Å; F846-L850 HydrophobicContact CE1-CD1 3.51Å; F846-L850 HydrophobicContact CE1-CG 4.43Å; F846-L850 HydrophobicContact CE2-CD1 4.21Å; F846-L850 HydrophobicContact CE2-CG 4.37Å; F846-L850 HydrophobicContact CZ-CD1 3.64Å; F846-L850 HydrophobicContact CZ-CG 4.28Å; F846-L850 WeakPolarHBondContact O-CG 3.25Å; F846-L850 PolarHBondContact O-N 3.12Å; F846-M908 HydrophobicContact CE1-CE 3.97Å; F846-M908 HydrophobicContact CZ-CE 3.77Å
847	I	91.8	Very high	90.1	Very high	34 Å²	34	57.7 Å²	57.7	17%	0.174	31%	0.31	C	S	.	.	H	α-helix	trans	-63.5	-46.6	178.3	-69.5	168.6	0	0	0	111	L843 L844 C849 L850 W851 F883 C912 V916	L843-I847 HydrophobicContact CD1-CD1 4.11Å; L843-I847 HydrophobicContact CD1-CG1 4.4Å; L843-I847 HydrophobicContact CG-CD1 3.98Å; L843-I847 WeakPolarHBondContact O-CB 3.43Å; L843-I847 WeakPolarHBondContact O-CG1 3.11Å; L843-I847 PolarHBondContact O-N 2.76Å; L844-I847 PolarHBondContact O-N 2.9Å; I847-C849 PolarHBondContact O-N 3.4Å; I847-L850 PolarHBondContact O-N 3.38Å; I847-W851 WeakPolarHBondContact O-CB 3.38Å; I847-W851 PolarHBondContact O-N 3.32Å; I847-F883 HydrophobicContact CG1-CZ 4.06Å; I847-F883 HydrophobicContact CG2-CE1 4.04Å; I847-F883 HydrophobicContact CG2-CZ 3.99Å; I847-C912 HydrophobicContact CD1-CB 4.4Å; I847-C912 HydrophobicContact CG1-CB 4.34Å; I847-V916 HydrophobicContact CD1-CG2 4.37Å
848	L	91.8	Very high	90.2	Very high	81 Å²	81	51.3 Å²	51.3	42%	0.424	28%	0.279	S	S	.	.	H	α-helix	trans	-62.5	-41.9	178.2	-69.1	171.8	0	0	0	112	L844 W851 I852	L844-L848 HydrophobicContact CD1-CD1 3.93Å; L844-L848 HydrophobicContact CD1-CG 4.15Å; L844-L848 HydrophobicContact CG-CD1 3.98Å; L844-L848 WeakPolarHBondContact O-CB 3.18Å; L844-L848 WeakPolarHBondContact O-CG 3.31Å; L844-L848 PolarHBondContact O-N 2.93Å; L848-W851 PolarHBondContact O-N 3.25Å; L848-I852 WeakPolarHBondContact O-CG1 3.28Å; L848-I852 PolarHBondContact O-N 3Å; L848-I852 VanDerWaalsContact O-N 3.09Å
849	C	89.8	Confident	90.4	Very high	48 Å²	48	49.8 Å²	49.8	32%	0.324	27%	0.265	S	S	.	.	H	α-helix	trans	-62.5	-47.3	176.1	-177.1	0	0	0	0	111.9	G845 F846 I847 W851 I852 V853	G845-C849 VanDerWaalsContact O-CB 3.26Å; G845-C849 WeakPolarHBondContact O-CB 3.28Å; G845-C849 PolarHBondContact O-N 2.69Å; F846-C849 PolarHBondContact O-N 2.93Å; I847-C849 PolarHBondContact O-N 3.4Å; C849-W851 PolarHBondContact O-N 2.89Å; C849-I852 PolarHBondContact O-N 2.75Å; C849-V853 VanDerWaalsContact O-CG2 3.29Å; C849-V853 WeakPolarHBondContact O-CG2 3.46Å; C849-V853 PolarHBondContact O-N 3.12Å
850	L	90.6	Very high	90.2	Very high	28 Å²	28	48.8 Å²	48.8	15%	0.147	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-40.8	176.4	-73.5	-179.1	0	0	0	112.7	F846 I847 V853 Y854 M908	F846-L850 HydrophobicContact CD1-CD1 4Å; F846-L850 HydrophobicContact CE1-CD1 3.51Å; F846-L850 HydrophobicContact CE1-CG 4.43Å; F846-L850 HydrophobicContact CE2-CD1 4.21Å; F846-L850 HydrophobicContact CE2-CG 4.37Å; F846-L850 HydrophobicContact CZ-CD1 3.64Å; F846-L850 HydrophobicContact CZ-CG 4.28Å; F846-L850 WeakPolarHBondContact O-CG 3.25Å; F846-L850 PolarHBondContact O-N 3.12Å; I847-L850 PolarHBondContact O-N 3.38Å; L850-V853 PolarHBondContact O-N 2.94Å; L850-Y854 HydrophobicContact CB-CD2 4.22Å; L850-Y854 HydrophobicContact CB-CE2 4.28Å; L850-Y854 HydrophobicContact CD2-CE2 4.05Å; L850-Y854 WeakPolarHBondContact O-CB 3.48Å; L850-Y854 VanDerWaalsContact O-CD2 3.28Å; L850-Y854 WeakPolarHBondContact O-CD2 3.15Å; L850-Y854 PolarHBondContact O-N 3.41Å; L850-M908 HydrophobicContact CD1-CE 3.74Å
851	W	91.4	Very high	90.1	Very high	82 Å²	82	47.5 Å²	47.5	31%	0.311	24%	0.241	S	C	.	.	H	α-helix	trans	-63.4	-45.9	-180	-170.9	4.3	0	0	0	111	I847 L848 C849 S855 M876 A880	I847-W851 WeakPolarHBondContact O-CB 3.38Å; I847-W851 PolarHBondContact O-N 3.32Å; L848-W851 PolarHBondContact O-N 3.25Å; C849-W851 PolarHBondContact O-N 2.89Å; W851-S855 VanDerWaalsContact CD1-OG 3.26Å; W851-S855 VanDerWaalsContact O-CB 3.26Å; W851-S855 WeakPolarHBondContact O-CB 3.31Å; W851-S855 PolarHBondContact O-N 3.33Å; W851-S855 PolarHBondContact O-OG 3.44Å; W851-M876 HydrophobicContact CH2-CE 4.01Å; W851-M876 HydrophobicContact CZ2-CE 3.54Å; W851-M876 HydrophobicContact CZ2-CG 4.2Å; W851-M876 PolarHBondContact NE1-O 3.29Å; W851-M876 VanDerWaalsContact NE1-O 3.13Å; W851-A880 HydrophobicContact CH2-CB 4.44Å; W851-A880 HydrophobicContact CZ2-CB 3.55Å
852	I	92	Very high	89.9	Confident	123 Å²	123	40.2 Å²	40.2	63%	0.631	21%	0.21	S	C	*	.	H	α-helix	trans	-60.8	-49.9	176.1	-66.7	165.7	0	0	0	110.7	L848 C849 S855 W856	L848-I852 WeakPolarHBondContact O-CG1 3.28Å; L848-I852 PolarHBondContact O-N 3Å; L848-I852 VanDerWaalsContact O-N 3.09Å; C849-I852 PolarHBondContact O-N 2.75Å; I852-S855 PolarHBondContact O-N 3.37Å; I852-W856 PolarHBondContact O-N 3.04Å; I852-W856 VanDerWaalsContact O-N 3.12Å
853	V	92.7	Very high	89.4	Confident	23 Å²	23	40 Å²	40	14%	0.139	21%	0.211	C	C	.	.	H	α-helix	trans	-61	-50.9	-178.9	171.5	0	0	0	0	111.2	F792 L795 C849 L850 S855 W856 T857	F792-V853 HydrophobicContact CB-CG1 4.08Å; F792-V853 HydrophobicContact CD1-CG1 4.16Å; F792-V853 HydrophobicContact CD1-CG2 4.06Å; F792-V853 HydrophobicContact CD2-CG1 4.21Å; F792-V853 HydrophobicContact CE1-CG2 4.45Å; F792-V853 HydrophobicContact CG-CG1 3.9Å; L795-V853 HydrophobicContact CD1-CG2 3.5Å; C849-V853 VanDerWaalsContact O-CG2 3.29Å; C849-V853 WeakPolarHBondContact O-CG2 3.46Å; C849-V853 PolarHBondContact O-N 3.12Å; L850-V853 PolarHBondContact O-N 2.94Å; V853-S855 PolarHBondContact O-N 3.3Å; V853-W856 PolarHBondContact O-N 2.99Å; V853-T857 WeakPolarHBondContact O-CB 3.47Å; V853-T857 PolarHBondContact O-N 3.27Å; V853-T857 PolarHBondContact O-OG1 3.48Å
854	Y	93.4	Very high	88.5	Confident	41 Å²	41	42.2 Å²	42.2	16%	0.161	22%	0.22	C	C	.	.	H	α-helix	trans	-67	-36.4	-179.3	-73.4	-49.2	0	0	0	112.8	L850 W856 T857 L858 I901 A904 M908	L850-Y854 HydrophobicContact CB-CD2 4.22Å; L850-Y854 HydrophobicContact CB-CE2 4.28Å; L850-Y854 HydrophobicContact CD2-CE2 4.05Å; L850-Y854 WeakPolarHBondContact O-CB 3.48Å; L850-Y854 VanDerWaalsContact O-CD2 3.28Å; L850-Y854 WeakPolarHBondContact O-CD2 3.15Å; L850-Y854 PolarHBondContact O-N 3.41Å; Y854-W856 PolarHBondContact O-N 3.2Å; Y854-T857 PolarHBondContact O-N 3.41Å; Y854-L858 VanDerWaalsContact O-CB 3.29Å; Y854-L858 WeakPolarHBondContact O-CB 3.48Å; Y854-L858 PolarHBondContact O-N 2.94Å; Y854-I901 HydrophobicContact CD1-CG2 4.04Å; Y854-A904 HydrophobicContact CE1-CB 4.3Å; Y854-M908 HydrophobicContact CE2-CB 4.37Å; Y854-M908 HydrophobicContact CE2-CG 4.37Å
855	S	92.6	Very high	87.4	Confident	7 Å²	7	41 Å²	41	5%	0.049	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-45.7	176.8	-56.8	0	0	0	0	111.5	W851 I852 V853 R859 S875 M876	W851-S855 VanDerWaalsContact CD1-OG 3.26Å; W851-S855 VanDerWaalsContact O-CB 3.26Å; W851-S855 WeakPolarHBondContact O-CB 3.31Å; W851-S855 PolarHBondContact O-N 3.33Å; W851-S855 PolarHBondContact O-OG 3.44Å; I852-S855 PolarHBondContact O-N 3.37Å; V853-S855 PolarHBondContact O-N 3.3Å; S855-R859 PolarHBondContact O-N 2.88Å; S855-S875 WeakPolarHBondContact O-CB 3.41Å; S855-M876 WeakPolarHBondContact OG-CA 3.2Å
856	W	91.5	Very high	86.3	Confident	16 Å²	16	41.4 Å²	41.4	6%	0.061	20%	0.202	C	C	.	.	H	α-helix	trans	-71.7	-40.9	178	-169.7	89.8	0	0	0	112.3	M601 L602 T605 E606 F792 I852 V853 Y854 L858 R859 A860	M601-W856 HydrophobicContact CE-CH2 4.27Å; M601-W856 HydrophobicContact CE-CZ3 4.47Å; M601-W856 HydrophobicContact SD-CH2 3.41Å; M601-W856 WeakPolarHBondContact SD-CH2 3.32Å; M601-W856 HydrophobicContact SD-CZ2 3.87Å; M601-W856 HydrophobicContact SD-CZ3 4.16Å; L602-W856 HydrophobicContact CD2-CD2 3.57Å; L602-W856 HydrophobicContact CD2-CE3 4.27Å; L602-W856 HydrophobicContact CD2-CG 3.73Å; L602-W856 HydrophobicContact CD2-CH2 4.46Å; L602-W856 HydrophobicContact CD2-CZ2 3.82Å; T605-W856 HydrophobicContact CG2-CH2 3.99Å; T605-W856 HydrophobicContact CG2-CZ2 3.53Å; E606-W856 PolarHBondContact OE1-NE1 2.98Å; F792-W856 HydrophobicContact CE2-CD2 4.3Å; F792-W856 AromaticContact CE2-CE3 3.31Å; F792-W856 HydrophobicContact CE2-CE3 3.31Å; F792-W856 AromaticContact CE2-CZ3 3.51Å; F792-W856 HydrophobicContact CE2-CZ3 3.51Å; F792-W856 AromaticContact CZ-CD2 3.92Å; F792-W856 HydrophobicContact CZ-CD2 3.92Å; F792-W856 AromaticContact CZ-CE3 3.37Å; F792-W856 HydrophobicContact CZ-CE3 3.37Å; F792-W856 HydrophobicContact CZ-CG 4.44Å; F792-W856 AromaticContact CZ-CZ3 3.82Å; F792-W856 HydrophobicContact CZ-CZ3 3.82Å; I852-W856 PolarHBondContact O-N 3.04Å; I852-W856 VanDerWaalsContact O-N 3.12Å; V853-W856 PolarHBondContact O-N 2.99Å; Y854-W856 PolarHBondContact O-N 3.2Å; W856-L858 VanDerWaalsContact C-N 3.27Å; W856-L858 PolarHBondContact O-N 3.31Å; W856-R859 WeakPolarHBondContact O-CB 3.21Å; W856-R859 PolarHBondContact O-N 2.68Å; W856-A860 HydrophobicContact CE3-CB 4.12Å; W856-A860 HydrophobicContact CH2-CB 4.23Å; W856-A860 HydrophobicContact CZ3-CB 3.85Å; W856-A860 WeakPolarHBondContact O-CB 3.22Å; W856-A860 PolarHBondContact O-N 3.49Å
857	T	90.4	Very high	85.2	Confident	9 Å²	9	43.3 Å²	43.3	6%	0.055	22%	0.221	C	C	.	.	H	α-helix	trans	-61.7	-38.3	178.1	-49.9	0	0	0	0	111	V789 V853 Y854 C861 I901	V789-T857 HydrophobicContact CB-CG2 4.22Å; V789-T857 HydrophobicContact CG1-CG2 3.61Å; V789-T857 HydrophobicContact CG2-CG2 3.72Å; V853-T857 WeakPolarHBondContact O-CB 3.47Å; V853-T857 PolarHBondContact O-N 3.27Å; V853-T857 PolarHBondContact O-OG1 3.48Å; Y854-T857 PolarHBondContact O-N 3.41Å; T857-C861 PolarHBondContact O-N 2.96Å; T857-C861 VanDerWaalsContact O-N 3.12Å; T857-I901 HydrophobicContact CG2-CD1 3.54Å; T857-I901 HydrophobicContact CG2-CG1 3.99Å; T857-I901 WeakPolarHBondContact O-CD1 3.34Å
858	L	90	Very high	83.6	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-66.7	-48	174.4	-177.4	65.5	0	0	0	111.7	Y854 W856 A860 C861 E862 L878 I879 P893 I901	Y854-L858 VanDerWaalsContact O-CB 3.29Å; Y854-L858 WeakPolarHBondContact O-CB 3.48Å; Y854-L858 PolarHBondContact O-N 2.94Å; W856-L858 VanDerWaalsContact C-N 3.27Å; W856-L858 PolarHBondContact O-N 3.31Å; L858-A860 VanDerWaalsContact C-N 3.28Å; L858-A860 PolarHBondContact O-N 3.24Å; L858-C861 PolarHBondContact O-N 3.01Å; L858-E862 HydrophobicContact CD1-CG 4.01Å; L858-E862 PolarHBondContact O-N 2.98Å; L858-L878 HydrophobicContact CD2-CB 4.15Å; L858-L878 HydrophobicContact CD2-CD2 3.78Å; L858-L878 HydrophobicContact CD2-CG 3.86Å; L858-I879 HydrophobicContact CB-CD1 4.14Å; L858-I879 HydrophobicContact CB-CG1 4.17Å; L858-I879 HydrophobicContact CD2-CD1 3.71Å; L858-I879 HydrophobicContact CD2-CG1 3.72Å; L858-I879 HydrophobicContact CG-CD1 4.47Å; L858-P893 HydrophobicContact CD1-CB 4.29Å; L858-I901 HydrophobicContact CB-CG2 4.16Å
859	R	88.6	Confident	82	Confident	31 Å²	31	49.8 Å²	49.8	12%	0.117	25%	0.251	C	S	.	.	H	α-helix	trans	-52.1	-48.6	174.1	171.1	169.7	166.4	72.1	-6.7	111	E606 F609 S855 W856 S863 G870 S875	E606-R859 IonicContact OE1-CZ 3.02Å; E606-R859 IonicContact OE1-NE 3.7Å; E606-R859 PolarHBondContact OE1-NE 3.01Å; E606-R859 IonicContact OE1-NH2 2.77Å; E606-R859 IonicContact OE2-CZ 3.64Å; E606-R859 VanDerWaalsContact OE2-CZ 3.28Å; E606-R859 IonicContact OE2-NE 2.74Å; E606-R859 PolarHBondContact OE2-NE 2.93Å; E606-R859 IonicContact OE2-NH2 3.44Å; E606-R859 PolarHBondContact OE2-NH2 3.46Å; F609-R859 HydrophobicContact CE2-CG 4.36Å; S855-R859 PolarHBondContact O-N 2.88Å; W856-R859 WeakPolarHBondContact O-CB 3.21Å; W856-R859 PolarHBondContact O-N 2.68Å; R859-S863 WeakPolarHBondContact O-CB 3.35Å; R859-S863 PolarHBondContact O-N 2.94Å; R859-G870 PolarHBondContact NH1-O 3.49Å; R859-S875 WeakPolarHBondContact CA-OG 3.28Å; R859-S875 WeakPolarHBondContact CB-OG 3.37Å
860	A	85.6	Confident	80.8	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56.1	-53.7	177.4	0	0	0	0	0	111.4	L785 W856 L858 E862	L785-A860 HydrophobicContact CD1-CB 4.09Å; L785-A860 HydrophobicContact CD2-CB 3.97Å; L785-A860 WeakPolarHBondContact CD2-O 3.38Å; L785-A860 HydrophobicContact CG-CB 4.01Å; W856-A860 HydrophobicContact CE3-CB 4.12Å; W856-A860 HydrophobicContact CH2-CB 4.23Å; W856-A860 HydrophobicContact CZ3-CB 3.85Å; W856-A860 WeakPolarHBondContact O-CB 3.22Å; W856-A860 PolarHBondContact O-N 3.49Å; L858-A860 VanDerWaalsContact C-N 3.28Å; L858-A860 PolarHBondContact O-N 3.24Å; A860-E862 PolarHBondContact O-N 3.24Å
861	C	84.9	Confident	80.2	Confident	18 Å²	18	48.6 Å²	48.6	12%	0.122	25%	0.247	C	C	.	.	H	α-helix	trans	-70.3	-30.4	-175.6	-86.9	0	0	0	0	115.2	T857 L858 T895 C897 I901	T857-C861 PolarHBondContact O-N 2.96Å; T857-C861 VanDerWaalsContact O-N 3.12Å; L858-C861 PolarHBondContact O-N 3.01Å; C861-T895 WeakPolarHBondContact O-CG2 3.33Å; C861-C897 HydrophobicContact CB-CB 3.52Å; C861-C897 WeakPolarHBondContact CB-SG 3.27Å; C861-C897 WeakPolarHBondContact SG-CB 3.43Å; C861-C897 CovalentContact SG-SG 2.03Å; C861-C897 PolarHBondContact SG-SG 3.13Å; C861-I901 HydrophobicContact CB-CD1 4.01Å
862	E	83.9	Confident	79.9	Confident	23 Å²	23	48.3 Å²	48.3	11%	0.107	25%	0.251	C	S	.	.	H	α-helix	trans	-85.9	-21.7	177.2	-63.4	-60.7	126.5	0	0	113.8	L858 A860 F864 Y865 P893 H894 T895 G898	L858-E862 HydrophobicContact CD1-CG 4.01Å; L858-E862 PolarHBondContact O-N 2.98Å; A860-E862 PolarHBondContact O-N 3.24Å; E862-F864 PolarHBondContact O-N 3.06Å; E862-Y865 PolarHBondContact O-N 3.19Å; E862-P893 HydrophobicContact CG-CB 4.4Å; E862-H894 PolarHBondContact OE2-N 2.86Å; E862-T895 VanDerWaalsContact OE1-CB 3.28Å; E862-T895 WeakPolarHBondContact OE1-CB 3.26Å; E862-T895 WeakPolarHBondContact OE1-CG2 3.39Å; E862-T895 PolarHBondContact OE1-N 2.92Å; E862-T895 PolarHBondContact OE1-OG1 2.73Å; E862-T895 PolarHBondContact OE2-N 2.89Å; E862-G898 WeakPolarHBondContact OE1-CA 3.44Å
863	S	78.2	Confident	79.7	Confident	23 Å²	23	48.4 Å²	48.4	16%	0.161	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-8.1	-177.1	-173	0	0	0	0	115.4	F609 R859	F609-S863 WeakPolarHBondContact CE1-OG 3.44Å; R859-S863 WeakPolarHBondContact O-CB 3.35Å; R859-S863 PolarHBondContact O-N 2.94Å
864	F	69.4	Low	79.5	Confident	61 Å²	61	49.6 Å²	49.6	27%	0.268	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-21.5	170.1	-66.2	-59.8	0	0	0	113.8	K779 V781 L785 E862	K779-F864 PolarHBondContact NZ-O 2.65Å; V781-F864 HydrophobicContact CG1-CD2 4.13Å; V781-F864 HydrophobicContact CG1-CE1 4.23Å; V781-F864 HydrophobicContact CG1-CE2 3.64Å; V781-F864 HydrophobicContact CG1-CZ 3.69Å; L785-F864 HydrophobicContact CB-CE2 4.03Å; L785-F864 HydrophobicContact CB-CZ 3.69Å; L785-F864 HydrophobicContact CD2-CD2 4.15Å; L785-F864 HydrophobicContact CD2-CE1 4.27Å; L785-F864 HydrophobicContact CD2-CE2 3.37Å; L785-F864 HydrophobicContact CD2-CZ 3.44Å; L785-F864 VanDerWaalsContact CD2-CZ 3.44Å; L785-F864 HydrophobicContact CG-CE2 4.29Å; L785-F864 HydrophobicContact CG-CZ 4.22Å; E862-F864 PolarHBondContact O-N 3.06Å
865	Y	68.2	Low	79.3	Confident	83 Å²	83	48 Å²	48	33%	0.325	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-48.2	-174.8	-170.1	-97.9	0	0	0	111.3	V697 K779 E862 H894	V697-Y865 HydrophobicContact CG1-CE2 4.45Å; K779-Y865 PolarHBondContact NZ-O 3.31Å; E862-Y865 PolarHBondContact O-N 3.19Å; Y865-H894 HydrophobicContact CD1-CB 3.75Å; Y865-H894 AromaticContact CD1-CG 3.93Å; Y865-H894 HydrophobicContact CD2-CB 4.41Å; Y865-H894 HydrophobicContact CE1-CB 3.87Å; Y865-H894 AromaticContact CE1-CG 3.74Å; Y865-H894 AromaticContact CE1-ND1 3.92Å; Y865-H894 HydrophobicContact CG-CB 4.05Å
866	D	66.8	Low	79.3	Confident	47 Å²	47	51.1 Å²	51.1	25%	0.251	27%	0.267	S	S	.	.			trans	-142.6	123.5	-170.6	-176.7	-25.8	0	0	0	110.5	E868 N869	D866-E868 PolarHBondContact OD1-N 3.26Å; D866-N869 PolarHBondContact OD1-N 2.96Å; D866-N869 WeakPolarHBondContact OD2-CB 3.48Å; D866-N869 PolarHBondContact OD2-ND2 2.87Å
867	T	64.6	Low	79.3	Confident	130 Å²	130	55.8 Å²	55.8	80%	0.798	29%	0.285	S	S	*	.	S	Bend	trans	-87.1	-19.1	179.7	43.5	0	0	0	0	114.2
868	E	60.1	Low	79.4	Confident	155 Å²	155	56 Å²	56	72%	0.724	29%	0.286	S	S	*	.	S	Bend	trans	-90.3	-45.1	-176.8	-60.8	-169.2	163.3	0	0	110.8	D866	D866-E868 PolarHBondContact OD1-N 3.26Å
869	N	57.9	Low	79.6	Confident	96 Å²	96	56 Å²	56	51%	0.513	29%	0.286	S	S	.	.	S	Bend	trans	-80.6	-16	178.1	-71.3	-61.3	0	0	0	113.9	D866 S871 N874	D866-N869 PolarHBondContact OD1-N 2.96Å; D866-N869 WeakPolarHBondContact OD2-CB 3.48Å; D866-N869 PolarHBondContact OD2-ND2 2.87Å; N869-S871 PolarHBondContact O-N 3.45Å; N869-N874 PolarHBondContact O-ND2 3.41Å
870	G	64.1	Low	79.9	Confident	9 Å²	9	55.3 Å²	55.3	9%	0.093	29%	0.287	C	S	.	.			trans	-67.7	16.3	-173.5	0	0	0	0	0	117.2	R859	R859-G870 PolarHBondContact NH1-O 3.49Å
871	S	78.2	Confident	80.3	Confident	41 Å²	41	55.6 Å²	55.6	29%	0.287	29%	0.288	S	S	.	.			trans	-62	150.1	-176	99.6	0	0	0	0	112.9	N869 L873 N874 S875	N869-S871 PolarHBondContact O-N 3.45Å; S871-L873 VanDerWaalsContact C-N 3.29Å; S871-L873 PolarHBondContact O-N 2.95Å; S871-L873 PolarHBondContact OG-N 3.42Å; S871-N874 PolarHBondContact O-N 3.2Å; S871-N874 WeakPolarHBondContact OG-CB 3.31Å; S871-N874 PolarHBondContact OG-N 3.28Å; S871-N874 PolarHBondContact OG-ND2 3.37Å; S871-N874 PolarHBondContact OG-OD1 3.3Å; S871-N874 VanDerWaalsContact OG-OD1 3.11Å; S871-S875 PolarHBondContact O-N 3.5Å; S871-S875 PolarHBondContact O-OG 3.2Å
872	L	84.9	Confident	80.7	Confident	76 Å²	76	56 Å²	56	40%	0.398	29%	0.29	S	S	.	.	H	α-helix	trans	-64.7	-34.3	178.8	-170.9	147.9	0	0	0	112	S875 M876	L872-S875 PolarHBondContact O-N 3Å; L872-M876 VanDerWaalsContact O-CB 3.32Å; L872-M876 WeakPolarHBondContact O-CB 3.38Å; L872-M876 PolarHBondContact O-N 2.91Å
873	L	87.4	Confident	81.3	Confident	126 Å²	126	56 Å²	56	66%	0.66	29%	0.29	S	S	*	.	H	α-helix	trans	-69.5	-41.3	176.4	-65.3	176.3	0	0	0	111.7	S871 S875 M876 W877	S871-L873 VanDerWaalsContact C-N 3.29Å; S871-L873 PolarHBondContact O-N 2.95Å; S871-L873 PolarHBondContact OG-N 3.42Å; L873-S875 VanDerWaalsContact C-N 3.31Å; L873-S875 PolarHBondContact O-N 3.19Å; L873-M876 PolarHBondContact O-N 3.42Å; L873-W877 WeakPolarHBondContact O-CB 3.5Å; L873-W877 PolarHBondContact O-N 2.97Å
874	N	89.1	Confident	82	Confident	47 Å²	47	59.5 Å²	59.5	25%	0.251	31%	0.307	S	S	.	.	H	α-helix	trans	-60.6	-43.8	174.3	-67.3	3.4	0	0	0	110.8	N869 S871 W877 L878 I891	N869-N874 PolarHBondContact O-ND2 3.41Å; S871-N874 PolarHBondContact O-N 3.2Å; S871-N874 WeakPolarHBondContact OG-CB 3.31Å; S871-N874 PolarHBondContact OG-N 3.28Å; S871-N874 PolarHBondContact OG-ND2 3.37Å; S871-N874 PolarHBondContact OG-OD1 3.3Å; S871-N874 VanDerWaalsContact OG-OD1 3.11Å; N874-W877 PolarHBondContact O-N 2.85Å; N874-L878 WeakPolarHBondContact O-CB 3.34Å; N874-L878 PolarHBondContact O-N 3.18Å; N874-I891 HydrophobicContact CB-CD1 3.81Å
875	S	89.6	Confident	83.2	Confident	7 Å²	7	61.2 Å²	61.2	5%	0.049	33%	0.326	C	S	.	.	H	α-helix	trans	-65	-41.4	177.3	-54.7	0	0	0	0	111.9	S855 R859 S871 L872 L873 I879	S855-S875 WeakPolarHBondContact O-CB 3.41Å; R859-S875 WeakPolarHBondContact CA-OG 3.28Å; R859-S875 WeakPolarHBondContact CB-OG 3.37Å; S871-S875 PolarHBondContact O-N 3.5Å; S871-S875 PolarHBondContact O-OG 3.2Å; L872-S875 PolarHBondContact O-N 3Å; L873-S875 VanDerWaalsContact C-N 3.31Å; L873-S875 PolarHBondContact O-N 3.19Å; S875-I879 WeakPolarHBondContact O-CB 3.32Å; S875-I879 WeakPolarHBondContact O-CG1 3.29Å; S875-I879 PolarHBondContact O-N 3.1Å
876	M	91	Very high	84.5	Confident	74 Å²	74	61.3 Å²	61.3	37%	0.365	33%	0.331	S	S	.	.	H	α-helix	trans	-66.4	-39	176.6	-177.5	-179.8	172.6	0	0	112.8	W851 S855 L872 L873 A880	W851-M876 HydrophobicContact CH2-CE 4.01Å; W851-M876 HydrophobicContact CZ2-CE 3.54Å; W851-M876 HydrophobicContact CZ2-CG 4.2Å; W851-M876 PolarHBondContact NE1-O 3.29Å; W851-M876 VanDerWaalsContact NE1-O 3.13Å; S855-M876 WeakPolarHBondContact OG-CA 3.2Å; L872-M876 VanDerWaalsContact O-CB 3.32Å; L872-M876 WeakPolarHBondContact O-CB 3.38Å; L872-M876 PolarHBondContact O-N 2.91Å; L873-M876 PolarHBondContact O-N 3.42Å; M876-A880 WeakPolarHBondContact O-CB 3.36Å; M876-A880 PolarHBondContact O-N 3.11Å
877	W	93	Very high	85.7	Confident	114 Å²	114	61.8 Å²	61.8	43%	0.432	35%	0.347	S	S	.	.	H	α-helix	trans	-64.2	-52	174.5	168.5	-110.5	0	0	0	111.6	L873 N874 I879 A880 V881 Y888 D890	L873-W877 WeakPolarHBondContact O-CB 3.5Å; L873-W877 PolarHBondContact O-N 2.97Å; N874-W877 PolarHBondContact O-N 2.85Å; W877-I879 VanDerWaalsContact C-N 3.31Å; W877-I879 PolarHBondContact O-N 3.34Å; W877-A880 WeakPolarHBondContact O-CB 3.46Å; W877-A880 PolarHBondContact O-N 3.38Å; W877-V881 HydrophobicContact CD2-CG2 3.8Å; W877-V881 HydrophobicContact CE3-CG2 4.03Å; W877-V881 HydrophobicContact CG-CG2 4.46Å; W877-V881 HydrophobicContact CH2-CG2 3.93Å; W877-V881 HydrophobicContact CZ2-CG2 3.67Å; W877-V881 HydrophobicContact CZ3-CG2 4.09Å; W877-V881 WeakPolarHBondContact O-CG2 3.49Å; W877-V881 PolarHBondContact O-N 3.35Å; W877-Y888 HydrophobicContact CH2-CD2 4.3Å; W877-Y888 AromaticContact CH2-CE2 3.82Å; W877-Y888 HydrophobicContact CH2-CE2 3.82Å; W877-Y888 AromaticContact CZ2-CD2 3.75Å; W877-Y888 HydrophobicContact CZ2-CD2 3.75Å; W877-Y888 AromaticContact CZ2-CE2 3.75Å; W877-Y888 HydrophobicContact CZ2-CE2 3.75Å; W877-D890 PolarHBondContact NE1-OD2 3.24Å
878	L	92.3	Very high	87	Confident	14 Å²	14	62.5 Å²	62.5	7%	0.073	34%	0.336	C	S	.	.	H	α-helix	trans	-59	-41	178.6	176.5	50.4	0	0	0	111.7	L858 N874 T882 I891	L858-L878 HydrophobicContact CD2-CB 4.15Å; L858-L878 HydrophobicContact CD2-CD2 3.78Å; L858-L878 HydrophobicContact CD2-CG 3.86Å; N874-L878 WeakPolarHBondContact O-CB 3.34Å; N874-L878 PolarHBondContact O-N 3.18Å; L878-T882 WeakPolarHBondContact O-CB 3.49Å; L878-T882 PolarHBondContact O-N 3.45Å; L878-T882 PolarHBondContact O-OG1 2.87Å; L878-I891 VanDerWaalsContact CD1-O 3.28Å; L878-I891 WeakPolarHBondContact CD1-O 3.36Å; L878-I891 HydrophobicContact CD2-CB 4.28Å; L878-I891 HydrophobicContact CD2-CG2 3.87Å
879	I	94.3	Very high	88.4	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-65.5	-38.9	173.1	-70.1	-57.4	0	0	0	112.3	L858 S875 W877 T882 F883 I901 T905	L858-I879 HydrophobicContact CB-CD1 4.14Å; L858-I879 HydrophobicContact CB-CG1 4.17Å; L858-I879 HydrophobicContact CD2-CD1 3.71Å; L858-I879 HydrophobicContact CD2-CG1 3.72Å; L858-I879 HydrophobicContact CG-CD1 4.47Å; S875-I879 WeakPolarHBondContact O-CB 3.32Å; S875-I879 WeakPolarHBondContact O-CG1 3.29Å; S875-I879 PolarHBondContact O-N 3.1Å; W877-I879 VanDerWaalsContact C-N 3.31Å; W877-I879 PolarHBondContact O-N 3.34Å; I879-T882 PolarHBondContact O-N 3.03Å; I879-F883 WeakPolarHBondContact O-CB 3.47Å; I879-F883 PolarHBondContact O-N 3.1Å; I879-I901 HydrophobicContact CD1-CG2 4.22Å; I879-T905 HydrophobicContact CD1-CG2 4.03Å; I879-T905 WeakPolarHBondContact CD1-OG1 3.2Å; I879-T905 HydrophobicContact CG2-CG2 3.95Å
880	A	93.6	Very high	89.9	Confident	17 Å²	17	57.4 Å²	57.4	14%	0.14	33%	0.326	C	S	.	.	H	α-helix	trans	-64.3	-48.4	176.5	0	0	0	0	0	112.2	W851 M876 W877 T882 F883 L884	W851-A880 HydrophobicContact CH2-CB 4.44Å; W851-A880 HydrophobicContact CZ2-CB 3.55Å; M876-A880 WeakPolarHBondContact O-CB 3.36Å; M876-A880 PolarHBondContact O-N 3.11Å; W877-A880 WeakPolarHBondContact O-CB 3.46Å; W877-A880 PolarHBondContact O-N 3.38Å; A880-T882 VanDerWaalsContact C-N 3.28Å; A880-T882 PolarHBondContact O-N 2.88Å; A880-F883 PolarHBondContact O-N 2.82Å; A880-L884 WeakPolarHBondContact O-CB 3.49Å; A880-L884 WeakPolarHBondContact O-CG 3.45Å; A880-L884 PolarHBondContact O-N 3.36Å
881	V	94.3	Very high	91	Very high	5 Å²	5	59.1 Å²	59.1	3%	0.03	33%	0.333	C	S	.	.	H	α-helix	trans	-61.7	-36.3	177.4	170	0	0	0	0	111.5	W877 S885 I886 G887 Y888	W877-V881 HydrophobicContact CD2-CG2 3.8Å; W877-V881 HydrophobicContact CE3-CG2 4.03Å; W877-V881 HydrophobicContact CG-CG2 4.46Å; W877-V881 HydrophobicContact CH2-CG2 3.93Å; W877-V881 HydrophobicContact CZ2-CG2 3.67Å; W877-V881 HydrophobicContact CZ3-CG2 4.09Å; W877-V881 WeakPolarHBondContact O-CG2 3.49Å; W877-V881 PolarHBondContact O-N 3.35Å; V881-S885 PolarHBondContact O-N 3.14Å; V881-I886 HydrophobicContact CG1-CB 4.22Å; V881-I886 PolarHBondContact O-N 2.77Å; V881-G887 VanDerWaalsContact CG1-N 3.34Å; V881-G887 PolarHBondContact O-N 2.94Å; V881-Y888 HydrophobicContact CG1-CD2 3.77Å; V881-Y888 HydrophobicContact CG1-CE2 4.4Å; V881-Y888 HydrophobicContact CG1-CG 4.42Å; V881-Y888 HydrophobicContact CG2-CD2 3.83Å; V881-Y888 HydrophobicContact CG2-CE2 3.99Å
882	T	95	Very high	91.5	Very high	27 Å²	27	60.9 Å²	60.9	17%	0.166	34%	0.342	C	S	.	.	H	α-helix	trans	-74.8	-42.7	176.4	-58	0	0	0	0	112.3	L878 I879 A880 L884 S885 A902 T905	L878-T882 WeakPolarHBondContact O-CB 3.49Å; L878-T882 PolarHBondContact O-N 3.45Å; L878-T882 PolarHBondContact O-OG1 2.87Å; I879-T882 PolarHBondContact O-N 3.03Å; A880-T882 VanDerWaalsContact C-N 3.28Å; A880-T882 PolarHBondContact O-N 2.88Å; T882-L884 VanDerWaalsContact C-N 3.32Å; T882-L884 PolarHBondContact O-N 3.45Å; T882-S885 WeakPolarHBondContact O-CA 3.34Å; T882-S885 PolarHBondContact O-N 3.16Å; T882-A902 HydrophobicContact CG2-CB 4.29Å; T882-A902 VanDerWaalsContact CG2-O 3.22Å; T882-A902 WeakPolarHBondContact CG2-O 3.31Å; T882-T905 HydrophobicContact CG2-CG2 4Å
883	F	94.7	Very high	91.7	Very high	22 Å²	22	57.9 Å²	57.9	10%	0.096	33%	0.327	C	S	.	.	H	α-helix	trans	-65.5	-35.2	179	-175.2	-88	0	0	0	112.2	I847 I879 A880 S885 T905 G909 C912	I847-F883 HydrophobicContact CG1-CZ 4.06Å; I847-F883 HydrophobicContact CG2-CE1 4.04Å; I847-F883 HydrophobicContact CG2-CZ 3.99Å; I879-F883 WeakPolarHBondContact O-CB 3.47Å; I879-F883 PolarHBondContact O-N 3.1Å; A880-F883 PolarHBondContact O-N 2.82Å; F883-S885 PolarHBondContact O-N 2.92Å; F883-T905 HydrophobicContact CB-CG2 3.87Å; F883-T905 HydrophobicContact CD2-CG2 4.34Å; F883-G909 VanDerWaalsContact O-CA 3.31Å; F883-G909 WeakPolarHBondContact O-CA 3.5Å; F883-C912 HydrophobicContact CE1-CB 4.35Å; F883-C912 HydrophobicContact CE2-CB 4.33Å; F883-C912 HydrophobicContact CZ-CB 3.6Å
884	L	93.5	Very high	91.4	Very high	98 Å²	98	55.2 Å²	55.2	51%	0.513	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-1.3	171.9	-65.6	172.2	0	0	0	113.3	A880 T882 I886	A880-L884 WeakPolarHBondContact O-CB 3.49Å; A880-L884 WeakPolarHBondContact O-CG 3.45Å; A880-L884 PolarHBondContact O-N 3.36Å; T882-L884 VanDerWaalsContact C-N 3.32Å; T882-L884 PolarHBondContact O-N 3.45Å; L884-I886 HydrophobicContact CB-CD1 3.75Å; L884-I886 HydrophobicContact CB-CG1 3.87Å; L884-I886 HydrophobicContact CD1-CD1 4.02Å; L884-I886 PolarHBondContact O-N 3.49Å
885	S	94.5	Very high	91.2	Very high	96 Å²	96	54.2 Å²	54.2	67%	0.671	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	32.9	-177.3	59.9	0	0	0	0	114.8	V881 T882 F883	V881-S885 PolarHBondContact O-N 3.14Å; T882-S885 WeakPolarHBondContact O-CA 3.34Å; T882-S885 PolarHBondContact O-N 3.16Å; F883-S885 PolarHBondContact O-N 2.92Å
886	I	95	Very high	90.9	Very high	86 Å²	86	58.1 Å²	58.1	44%	0.441	32%	0.321	S	S	.	.			trans	-84.6	-52	-179.6	-61.5	170.2	0	0	0	110.7	V881 L884 Y888	V881-I886 HydrophobicContact CG1-CB 4.22Å; V881-I886 PolarHBondContact O-N 2.77Å; L884-I886 HydrophobicContact CB-CD1 3.75Å; L884-I886 HydrophobicContact CB-CG1 3.87Å; L884-I886 HydrophobicContact CD1-CD1 4.02Å; L884-I886 PolarHBondContact O-N 3.49Å; I886-Y888 HydrophobicContact CG2-CD1 4Å; I886-Y888 HydrophobicContact CG2-CD2 4.17Å; I886-Y888 HydrophobicContact CG2-CE1 3.63Å; I886-Y888 HydrophobicContact CG2-CE2 3.82Å; I886-Y888 HydrophobicContact CG2-CG 4.25Å
887	G	92.2	Very high	90.6	Very high	56 Å²	56	57 Å²	57	58%	0.577	32%	0.32	S	S	*	.			trans	60.2	62.3	173.1	0	0	0	0	0	115.8	V881 G889	V881-G887 VanDerWaalsContact CG1-N 3.34Å; V881-G887 PolarHBondContact O-N 2.94Å; G887-G889 VanDerWaalsContact C-N 3.28Å; G887-G889 PolarHBondContact O-N 3.23Å
888	Y	93.1	Very high	90.4	Very high	146 Å²	146	51.6 Å²	51.6	57%	0.573	30%	0.299	S	S	*	.			trans	-61.2	-29.7	-180	-66.3	-61.5	0	0	0	114.7	W877 V881 I886 D890	W877-Y888 HydrophobicContact CH2-CD2 4.3Å; W877-Y888 AromaticContact CH2-CE2 3.82Å; W877-Y888 HydrophobicContact CH2-CE2 3.82Å; W877-Y888 AromaticContact CZ2-CD2 3.75Å; W877-Y888 HydrophobicContact CZ2-CD2 3.75Å; W877-Y888 AromaticContact CZ2-CE2 3.75Å; W877-Y888 HydrophobicContact CZ2-CE2 3.75Å; V881-Y888 HydrophobicContact CG1-CD2 3.77Å; V881-Y888 HydrophobicContact CG1-CE2 4.4Å; V881-Y888 HydrophobicContact CG1-CG 4.42Å; V881-Y888 HydrophobicContact CG2-CD2 3.83Å; V881-Y888 HydrophobicContact CG2-CE2 3.99Å; I886-Y888 HydrophobicContact CG2-CD1 4Å; I886-Y888 HydrophobicContact CG2-CD2 4.17Å; I886-Y888 HydrophobicContact CG2-CE1 3.63Å; I886-Y888 HydrophobicContact CG2-CE2 3.82Å; I886-Y888 HydrophobicContact CG2-CG 4.25Å; Y888-D890 VanDerWaalsContact C-N 3.32Å
889	G	89	Confident	90.3	Very high	54 Å²	54	54.9 Å²	54.9	56%	0.557	31%	0.311	S	S	*	.	S	Bend	trans	80.3	11.7	-179.4	0	0	0	0	0	114.8	G887	G887-G889 VanDerWaalsContact C-N 3.28Å; G887-G889 PolarHBondContact O-N 3.23Å
890	D	89.8	Confident	90.2	Very high	89 Å²	89	59.4 Å²	59.4	48%	0.476	34%	0.338	S	S	.	.	S	Bend	trans	-71.1	-37.4	174	59.3	-36.5	0	0	0	112.9	W877 Y888	W877-D890 PolarHBondContact NE1-OD2 3.24Å; Y888-D890 VanDerWaalsContact C-N 3.32Å
891	I	86.9	Confident	90.1	Very high	46 Å²	46	59.2 Å²	59.2	24%	0.236	33%	0.334	C	S	.	.	S	Bend	trans	-130.2	135.6	172.1	-48.5	-174.7	0	0	0	108.1	N874 L878	N874-I891 HydrophobicContact CB-CD1 3.81Å; L878-I891 VanDerWaalsContact CD1-O 3.28Å; L878-I891 WeakPolarHBondContact CD1-O 3.36Å; L878-I891 HydrophobicContact CD2-CB 4.28Å; L878-I891 HydrophobicContact CD2-CG2 3.87Å
892	V	88.8	Confident	90.1	Very high	77 Å²	77	59.7 Å²	59.7	47%	0.467	34%	0.339	S	S	.	.			trans	-138.9	137.7	-173.1	-179.3	0	0	0	0	109.9	H894	V892-H894 PolarHBondContact O-CD2 3.43Å; V892-H894 PolarHBondContact O-N 3.49Å
893	P	88.2	Confident	90	Very high	13 Å²	13	64.3 Å²	64.3	8%	0.084	36%	0.362	C	S	.	.			trans	-71.9	124.8	176.5	27.6	-32.2	0	0	0	111.9	L858 E862 G898 R899 A902	L858-P893 HydrophobicContact CD1-CB 4.29Å; E862-P893 HydrophobicContact CG-CB 4.4Å; P893-G898 VanDerWaalsContact CB-C 3.47Å; P893-R899 HydrophobicContact CB-CG 4.17Å; P893-R899 HydrophobicContact CG-CG 3.86Å; P893-R899 WeakPolarHBondContact O-CG 3.39Å; P893-R899 PolarHBondContact O-NE 3.33Å; P893-A902 HydrophobicContact CG-CB 4.16Å
894	H	82.3	Confident	90	Very high	71 Å²	71	65 Å²	65	33%	0.329	37%	0.372	S	S	.	.			trans	-84.3	-32.8	178.5	-69.2	-91.8	0	0	0	111.7	E862 Y865 V892	E862-H894 PolarHBondContact OE2-N 2.86Å; Y865-H894 HydrophobicContact CD1-CB 3.75Å; Y865-H894 AromaticContact CD1-CG 3.93Å; Y865-H894 HydrophobicContact CD2-CB 4.41Å; Y865-H894 HydrophobicContact CE1-CB 3.87Å; Y865-H894 AromaticContact CE1-CG 3.74Å; Y865-H894 AromaticContact CE1-ND1 3.92Å; Y865-H894 HydrophobicContact CG-CB 4.05Å; V892-H894 PolarHBondContact O-CD2 3.43Å; V892-H894 PolarHBondContact O-N 3.49Å
895	T	84.1	Confident	90.1	Very high	26 Å²	26	60.3 Å²	60.3	16%	0.16	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-82	151.8	179.8	79.1	0	0	0	0	112.5	C861 E862 C897 G898 R899	C861-T895 WeakPolarHBondContact O-CG2 3.33Å; E862-T895 VanDerWaalsContact OE1-CB 3.28Å; E862-T895 WeakPolarHBondContact OE1-CB 3.26Å; E862-T895 WeakPolarHBondContact OE1-CG2 3.39Å; E862-T895 PolarHBondContact OE1-N 2.92Å; E862-T895 PolarHBondContact OE1-OG1 2.73Å; E862-T895 PolarHBondContact OE2-N 2.89Å; T895-C897 PolarHBondContact O-N 3.3Å; T895-C897 PolarHBondContact OG1-N 2.97Å; T895-G898 PolarHBondContact O-N 2.83Å; T895-G898 PolarHBondContact OG1-N 2.95Å; T895-R899 VanDerWaalsContact O-CG 3.25Å; T895-R899 WeakPolarHBondContact O-CG 3.4Å; T895-R899 PolarHBondContact O-N 2.78Å
896	Y	83.9	Confident	90.1	Very high	89 Å²	89	56.8 Å²	56.8	35%	0.349	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-30.3	171.7	-76	-84.7	0	0	0	112.7	A695 L696 V697 P699 R899 V900	A695-Y896 WeakPolarHBondContact O-CE2 3.49Å; A695-Y896 PolarHBondContact O-OH 3.37Å; L696-Y896 VanDerWaalsContact C-CE2 3.45Å; L696-Y896 HydrophobicContact CD1-CD2 3.99Å; L696-Y896 HydrophobicContact CG-CD2 4.24Å; L696-Y896 VanDerWaalsContact O-CD2 3.28Å; L696-Y896 WeakPolarHBondContact O-CD2 3.38Å; V697-Y896 VanDerWaalsContact C-CE2 3.49Å; V697-Y896 WeakPolarHBondContact O-CE2 3.34Å; P699-Y896 WeakPolarHBondContact CD-OH 3.45Å; Y896-R899 PolarHBondContact O-N 3.38Å; Y896-V900 VanDerWaalsContact O-CG2 3.31Å; Y896-V900 WeakPolarHBondContact O-CG2 3.45Å; Y896-V900 PolarHBondContact O-N 2.94Å
897	C	84.9	Confident	90.1	Very high	50 Å²	50	57.4 Å²	57.4	34%	0.338	33%	0.334	S	S	.	.	H	α-helix	trans	-64.9	-51.4	174.8	177.1	0	0	0	0	111.2	C861 T895 R899 V900 I901	C861-C897 HydrophobicContact CB-CB 3.52Å; C861-C897 WeakPolarHBondContact CB-SG 3.27Å; C861-C897 WeakPolarHBondContact SG-CB 3.43Å; C861-C897 CovalentContact SG-SG 2.03Å; C861-C897 PolarHBondContact SG-SG 3.13Å; T895-C897 PolarHBondContact O-N 3.3Å; T895-C897 PolarHBondContact OG1-N 2.97Å; C897-R899 VanDerWaalsContact C-N 3.26Å; C897-R899 PolarHBondContact O-N 3.38Å; C897-V900 PolarHBondContact O-N 2.93Å; C897-V900 VanDerWaalsContact O-N 3.09Å; C897-I901 WeakPolarHBondContact O-CD1 3.2Å; C897-I901 VanDerWaalsContact O-CG1 3.31Å; C897-I901 WeakPolarHBondContact O-CG1 3.43Å; C897-I901 PolarHBondContact O-N 3.18Å; C897-I901 WeakPolarHBondContact SG-CD1 3.49Å
898	G	87.9	Confident	90.2	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-58.9	-36.9	176.3	0	0	0	0	0	112.7	E862 P893 T895 I901 A902	E862-G898 WeakPolarHBondContact OE1-CA 3.44Å; P893-G898 VanDerWaalsContact CB-C 3.47Å; T895-G898 PolarHBondContact O-N 2.83Å; T895-G898 PolarHBondContact OG1-N 2.95Å; G898-I901 PolarHBondContact O-N 3.13Å; G898-A902 WeakPolarHBondContact O-CB 3.3Å; G898-A902 PolarHBondContact O-N 3.46Å
899	R	90.8	Very high	90.3	Very high	83 Å²	83	50.7 Å²	50.7	31%	0.313	29%	0.293	S	S	.	.	H	α-helix	trans	-64.1	-43.4	172.8	-70.3	168.4	-176.9	-149	-0.3	112.7	P893 T895 Y896 C897 I901 A902 L903	P893-R899 HydrophobicContact CB-CG 4.17Å; P893-R899 HydrophobicContact CG-CG 3.86Å; P893-R899 WeakPolarHBondContact O-CG 3.39Å; P893-R899 PolarHBondContact O-NE 3.33Å; T895-R899 VanDerWaalsContact O-CG 3.25Å; T895-R899 WeakPolarHBondContact O-CG 3.4Å; T895-R899 PolarHBondContact O-N 2.78Å; Y896-R899 PolarHBondContact O-N 3.38Å; C897-R899 VanDerWaalsContact C-N 3.26Å; C897-R899 PolarHBondContact O-N 3.38Å; R899-I901 VanDerWaalsContact C-N 3.34Å; R899-A902 PolarHBondContact O-N 2.99Å; R899-L903 WeakPolarHBondContact O-CB 3.24Å; R899-L903 VanDerWaalsContact O-CG 3.29Å; R899-L903 WeakPolarHBondContact O-CG 3.29Å; R899-L903 PolarHBondContact O-N 2.99Å
900	V	91.7	Very high	90.6	Very high	96 Å²	96	51.3 Å²	51.3	58%	0.582	29%	0.289	S	S	*	.	H	α-helix	trans	-63.7	-40.1	174.5	167.7	0	0	0	0	111.2	Y896 C897 L903 A904	Y896-V900 VanDerWaalsContact O-CG2 3.31Å; Y896-V900 WeakPolarHBondContact O-CG2 3.45Å; Y896-V900 PolarHBondContact O-N 2.94Å; C897-V900 PolarHBondContact O-N 2.93Å; C897-V900 VanDerWaalsContact O-N 3.09Å; V900-L903 PolarHBondContact O-N 3.14Å; V900-A904 WeakPolarHBondContact O-CB 3.34Å; V900-A904 PolarHBondContact O-N 3Å
901	I	92.3	Very high	90.7	Very high	13 Å²	13	48.7 Å²	48.7	7%	0.067	28%	0.283	C	S	.	.	H	α-helix	trans	-64.7	-44.4	175.8	-66.1	158	0	0	0	111	Y854 T857 L858 C861 I879 C897 G898 R899 A904 T905	Y854-I901 HydrophobicContact CD1-CG2 4.04Å; T857-I901 HydrophobicContact CG2-CD1 3.54Å; T857-I901 HydrophobicContact CG2-CG1 3.99Å; T857-I901 WeakPolarHBondContact O-CD1 3.34Å; L858-I901 HydrophobicContact CB-CG2 4.16Å; C861-I901 HydrophobicContact CB-CD1 4.01Å; I879-I901 HydrophobicContact CD1-CG2 4.22Å; C897-I901 WeakPolarHBondContact O-CD1 3.2Å; C897-I901 VanDerWaalsContact O-CG1 3.31Å; C897-I901 WeakPolarHBondContact O-CG1 3.43Å; C897-I901 PolarHBondContact O-N 3.18Å; C897-I901 WeakPolarHBondContact SG-CD1 3.49Å; G898-I901 PolarHBondContact O-N 3.13Å; R899-I901 VanDerWaalsContact C-N 3.34Å; I901-A904 PolarHBondContact O-N 3.33Å; I901-T905 VanDerWaalsContact O-CB 3.31Å; I901-T905 WeakPolarHBondContact O-CB 3.4Å; I901-T905 PolarHBondContact O-N 3.08Å; I901-T905 PolarHBondContact O-OG1 2.98Å
902	A	92.8	Very high	91	Very high	15 Å²	15	46.7 Å²	46.7	12%	0.124	27%	0.273	C	S	.	.	H	α-helix	trans	-62.9	-42.7	176.4	0	0	0	0	0	112	T882 P893 G898 R899 T905 G906	T882-A902 HydrophobicContact CG2-CB 4.29Å; T882-A902 VanDerWaalsContact CG2-O 3.22Å; T882-A902 WeakPolarHBondContact CG2-O 3.31Å; P893-A902 HydrophobicContact CG-CB 4.16Å; G898-A902 WeakPolarHBondContact O-CB 3.3Å; G898-A902 PolarHBondContact O-N 3.46Å; R899-A902 PolarHBondContact O-N 2.99Å; A902-T905 WeakPolarHBondContact O-CB 3.35Å; A902-T905 PolarHBondContact O-N 3.35Å; A902-G906 PolarHBondContact O-N 3.48Å
903	L	94.7	Very high	91.2	Very high	125 Å²	125	45.8 Å²	45.8	65%	0.654	27%	0.268	S	S	*	.	H	α-helix	trans	-61.8	-46.3	173.9	-72.1	169.6	0	0	0	111.9	R899 V900 T905 G906 V907	R899-L903 WeakPolarHBondContact O-CB 3.24Å; R899-L903 VanDerWaalsContact O-CG 3.29Å; R899-L903 WeakPolarHBondContact O-CG 3.29Å; R899-L903 PolarHBondContact O-N 2.99Å; V900-L903 PolarHBondContact O-N 3.14Å; L903-T905 VanDerWaalsContact C-N 3.32Å; L903-T905 PolarHBondContact O-N 3.29Å; L903-G906 PolarHBondContact O-N 3.06Å; L903-V907 WeakPolarHBondContact O-CG2 3.29Å; L903-V907 PolarHBondContact O-N 3.14Å
904	A	93.9	Very high	91.5	Very high	36 Å²	36	48.1 Å²	48.1	30%	0.298	29%	0.288	S	S	.	.	H	α-helix	trans	-61.3	-40.4	175.5	0	0	0	0	0	112.1	Y854 V900 I901 M908	Y854-A904 HydrophobicContact CE1-CB 4.3Å; V900-A904 WeakPolarHBondContact O-CB 3.34Å; V900-A904 PolarHBondContact O-N 3Å; I901-A904 PolarHBondContact O-N 3.33Å; A904-M908 WeakPolarHBondContact O-CB 3.26Å; A904-M908 VanDerWaalsContact O-CG 3.3Å; A904-M908 WeakPolarHBondContact O-CG 3.34Å; A904-M908 PolarHBondContact O-N 2.97Å
905	T	94.9	Very high	91.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62	-47.2	175.7	-60	0	0	0	0	111.6	I879 T882 F883 I901 A902 L903 M908 G909	I879-T905 HydrophobicContact CD1-CG2 4.03Å; I879-T905 WeakPolarHBondContact CD1-OG1 3.2Å; I879-T905 HydrophobicContact CG2-CG2 3.95Å; T882-T905 HydrophobicContact CG2-CG2 4Å; F883-T905 HydrophobicContact CB-CG2 3.87Å; F883-T905 HydrophobicContact CD2-CG2 4.34Å; I901-T905 VanDerWaalsContact O-CB 3.31Å; I901-T905 WeakPolarHBondContact O-CB 3.4Å; I901-T905 PolarHBondContact O-N 3.08Å; I901-T905 PolarHBondContact O-OG1 2.98Å; A902-T905 WeakPolarHBondContact O-CB 3.35Å; A902-T905 PolarHBondContact O-N 3.35Å; L903-T905 VanDerWaalsContact C-N 3.32Å; L903-T905 PolarHBondContact O-N 3.29Å; T905-M908 PolarHBondContact O-N 3.35Å; T905-G909 PolarHBondContact O-N 3.49Å
906	G	95.3	Very high	92.2	Very high	22 Å²	22	49 Å²	49	23%	0.227	30%	0.295	C	S	.	.	H	α-helix	trans	-65.4	-42.2	178.9	0	0	0	0	0	112.9	A902 L903 G909 S910	A902-G906 PolarHBondContact O-N 3.48Å; L903-G906 PolarHBondContact O-N 3.06Å; G906-G909 PolarHBondContact O-N 3.49Å; G906-S910 PolarHBondContact O-N 3.47Å
907	V	95.7	Very high	92.6	Very high	99 Å²	99	49.5 Å²	49.5	60%	0.6	31%	0.307	S	S	*	.	H	α-helix	trans	-61.3	-48.5	174.3	171.7	0	0	0	0	110.7	L903 G909 S910 G911	L903-V907 WeakPolarHBondContact O-CG2 3.29Å; L903-V907 PolarHBondContact O-N 3.14Å; V907-G909 VanDerWaalsContact C-N 3.35Å; V907-G909 PolarHBondContact O-N 3.06Å; V907-S910 PolarHBondContact O-N 2.94Å; V907-S910 PolarHBondContact O-OG 3.4Å; V907-G911 PolarHBondContact O-N 3.16Å; V907-G911 VanDerWaalsContact O-N 3.08Å
908	M	93.4	Very high	93	Very high	61 Å²	61	49.4 Å²	49.4	30%	0.3	31%	0.31	S	S	.	.	H	α-helix	trans	-65.4	-36.4	177.7	-72.1	-58.9	-63.4	0	0	112.8	F846 L850 Y854 A904 T905 G911 C912	F846-M908 HydrophobicContact CE1-CE 3.97Å; F846-M908 HydrophobicContact CZ-CE 3.77Å; L850-M908 HydrophobicContact CD1-CE 3.74Å; Y854-M908 HydrophobicContact CE2-CB 4.37Å; Y854-M908 HydrophobicContact CE2-CG 4.37Å; A904-M908 WeakPolarHBondContact O-CB 3.26Å; A904-M908 VanDerWaalsContact O-CG 3.3Å; A904-M908 WeakPolarHBondContact O-CG 3.34Å; A904-M908 PolarHBondContact O-N 2.97Å; T905-M908 PolarHBondContact O-N 3.35Å; M908-G911 PolarHBondContact O-N 2.96Å; M908-C912 WeakPolarHBondContact O-CB 3.4Å; M908-C912 PolarHBondContact O-N 2.86Å; M908-C912 PolarHBondContact O-SG 2.94Å; M908-C912 VanDerWaalsContact O-SG 3.34Å
909	G	94.7	Very high	93	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58.5	-48.4	172.6	0	0	0	0	0	112.1	F883 T905 G906 V907 G911 C912 T913	F883-G909 VanDerWaalsContact O-CA 3.31Å; F883-G909 WeakPolarHBondContact O-CA 3.5Å; T905-G909 PolarHBondContact O-N 3.49Å; G906-G909 PolarHBondContact O-N 3.49Å; V907-G909 VanDerWaalsContact C-N 3.35Å; V907-G909 PolarHBondContact O-N 3.06Å; G909-G911 VanDerWaalsContact C-N 3.34Å; G909-G911 PolarHBondContact O-N 2.03Å; G909-C912 PolarHBondContact O-N 2.62Å; G909-T913 WeakPolarHBondContact O-CG2 3.48Å; G909-T913 PolarHBondContact O-N 3.43Å; G909-T913 PolarHBondContact O-OG1 3.09Å; G909-T913 VanDerWaalsContact O-OG1 3.11Å
910	S	94.7	Very high	93	Very high	66 Å²	66	52.9 Å²	52.9	46%	0.462	33%	0.33	S	S	.	.	H	α-helix	trans	-62.1	-37	176	77	0	0	0	0	113.3	G906 V907 T913 A914	G906-S910 PolarHBondContact O-N 3.47Å; V907-S910 PolarHBondContact O-N 2.94Å; V907-S910 PolarHBondContact O-OG 3.4Å; S910-T913 PolarHBondContact O-OG1 3.43Å; S910-T913 VanDerWaalsContact O-OG1 3.12Å; S910-A914 WeakPolarHBondContact O-CB 3.03Å; S910-A914 PolarHBondContact O-N 3.05Å
911	G	93.2	Very high	93	Very high	35 Å²	35	50.9 Å²	50.9	36%	0.361	32%	0.323	S	S	.	.	H	α-helix	trans	-68.5	-41.8	174	0	0	0	0	0	112.7	V907 M908 G909 L915	V907-G911 PolarHBondContact O-N 3.16Å; V907-G911 VanDerWaalsContact O-N 3.08Å; M908-G911 PolarHBondContact O-N 2.96Å; G909-G911 VanDerWaalsContact C-N 3.34Å; G909-G911 PolarHBondContact O-N 2.03Å; G911-L915 WeakPolarHBondContact O-CG 3.46Å; G911-L915 PolarHBondContact O-N 2.62Å; G911-L915 VanDerWaalsContact O-N 3.11Å
912	C	91.8	Very high	92.8	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.02	34%	0.343	C	S	.	.	H	α-helix	trans	-66.2	-44.7	176.9	-76.8	0	0	0	0	112.1	I847 F883 M908 G909 A914 L915 V916	I847-C912 HydrophobicContact CD1-CB 4.4Å; I847-C912 HydrophobicContact CG1-CB 4.34Å; F883-C912 HydrophobicContact CE1-CB 4.35Å; F883-C912 HydrophobicContact CE2-CB 4.33Å; F883-C912 HydrophobicContact CZ-CB 3.6Å; M908-C912 WeakPolarHBondContact O-CB 3.4Å; M908-C912 PolarHBondContact O-N 2.86Å; M908-C912 PolarHBondContact O-SG 2.94Å; M908-C912 VanDerWaalsContact O-SG 3.34Å; G909-C912 PolarHBondContact O-N 2.62Å; C912-A914 PolarHBondContact O-N 2.89Å; C912-L915 PolarHBondContact O-N 2.72Å; C912-V916 WeakPolarHBondContact O-CG2 3.26Å; C912-V916 PolarHBondContact O-N 2.57Å
913	T	93.5	Very high	92.5	Very high	59 Å²	59	63.5 Å²	63.5	36%	0.362	37%	0.371	S	S	.	.	H	α-helix	trans	-64.2	-39.3	177.9	52.3	0	0	0	0	111.9	G909 S910 L915 V916 V917	G909-T913 WeakPolarHBondContact O-CG2 3.48Å; G909-T913 PolarHBondContact O-N 3.43Å; G909-T913 PolarHBondContact O-OG1 3.09Å; G909-T913 VanDerWaalsContact O-OG1 3.11Å; S910-T913 PolarHBondContact O-OG1 3.43Å; S910-T913 VanDerWaalsContact O-OG1 3.12Å; T913-L915 PolarHBondContact O-N 3.47Å; T913-V916 WeakPolarHBondContact O-CB 3.31Å; T913-V916 PolarHBondContact O-N 2.95Å; T913-V917 WeakPolarHBondContact O-CG2 3.05Å; T913-V917 PolarHBondContact O-N 3.43Å
914	A	94.1	Very high	92.3	Very high	61 Å²	61	63.9 Å²	63.9	50%	0.504	37%	0.373	S	S	.	.	H	α-helix	trans	-60	-42.1	172.1	0	0	0	0	0	112.6	S910 C912 A918	S910-A914 WeakPolarHBondContact O-CB 3.03Å; S910-A914 PolarHBondContact O-N 3.05Å; C912-A914 PolarHBondContact O-N 2.89Å; A914-A918 WeakPolarHBondContact O-CB 3.39Å; A914-A918 PolarHBondContact O-N 3.36Å
915	L	90.6	Very high	92.1	Very high	71 Å²	71	68 Å²	68	37%	0.372	39%	0.387	S	S	.	.	H	α-helix	trans	-66	-40	174.1	-72.3	173	0	0	0	112.5	M835 L843 G911 C912 T913 A918 V919	M835-L915 HydrophobicContact CE-CD1 4.13Å; L843-L915 HydrophobicContact CD1-CB 4.38Å; L843-L915 HydrophobicContact CD2-CB 4.35Å; G911-L915 WeakPolarHBondContact O-CG 3.46Å; G911-L915 PolarHBondContact O-N 2.62Å; G911-L915 VanDerWaalsContact O-N 3.11Å; C912-L915 PolarHBondContact O-N 2.72Å; T913-L915 PolarHBondContact O-N 3.47Å; L915-A918 PolarHBondContact O-N 3.47Å; L915-V919 WeakPolarHBondContact O-CG2 3.34Å; L915-V919 PolarHBondContact O-N 3.29Å
916	V	91	Very high	91.8	Very high	45 Å²	45	71.8 Å²	71.8	27%	0.273	41%	0.406	S	S	.	.	H	α-helix	trans	-59	-50.2	175.1	167.5	0	0	0	0	110.4	L843 I847 C912 T913 A918 V919 F920	L843-V916 HydrophobicContact CD2-CB 4.36Å; L843-V916 HydrophobicContact CD2-CG2 3.55Å; L843-V916 HydrophobicContact CG-CG2 4.19Å; I847-V916 HydrophobicContact CD1-CG2 4.37Å; C912-V916 WeakPolarHBondContact O-CG2 3.26Å; C912-V916 PolarHBondContact O-N 2.57Å; T913-V916 WeakPolarHBondContact O-CB 3.31Å; T913-V916 PolarHBondContact O-N 2.95Å; V916-A918 PolarHBondContact O-N 3.13Å; V916-V919 PolarHBondContact O-N 3.33Å; V916-V919 VanDerWaalsContact O-N 3.1Å; V916-F920 HydrophobicContact CG1-CD2 3.56Å; V916-F920 HydrophobicContact CG1-CE2 3.56Å; V916-F920 WeakPolarHBondContact O-CD2 3.39Å; V916-F920 PolarHBondContact O-N 2.77Å
917	V	93.5	Very high	91.4	Very high	99 Å²	99	73.8 Å²	73.8	60%	0.6	42%	0.417	S	S	*	.	H	α-helix	trans	-61.2	-43.3	177.9	173.6	0	0	0	0	111.4	T913 V919 F920 A921	T913-V917 WeakPolarHBondContact O-CG2 3.05Å; T913-V917 PolarHBondContact O-N 3.43Å; V917-V919 PolarHBondContact O-N 3.04Å; V917-F920 PolarHBondContact O-N 3.41Å; V917-A921 WeakPolarHBondContact O-CB 3.38Å; V917-A921 PolarHBondContact O-N 2.88Å
918	A	91.7	Very high	90.8	Very high	48 Å²	48	75.6 Å²	75.6	40%	0.397	42%	0.417	S	S	.	.	H	α-helix	trans	-67.9	-19.3	176.8	0	0	0	0	0	113.9	A914 L915 V916 R922	A914-A918 WeakPolarHBondContact O-CB 3.39Å; A914-A918 PolarHBondContact O-N 3.36Å; L915-A918 PolarHBondContact O-N 3.47Å; V916-A918 PolarHBondContact O-N 3.13Å; A918-R922 PolarHBondContact O-NE 3.01Å; A918-R922 PolarHBondContact O-NH2 2.87Å
919	V	89.6	Confident	90.5	Very high	26 Å²	26	75.7 Å²	75.7	16%	0.158	43%	0.428	C	S	.	.	H	α-helix	trans	-82.6	-45.5	169.7	168.3	0	0	0	0	110.7	P839 L915 V916 V917 R922 K923	P839-V919 HydrophobicContact CB-CB 4.39Å; P839-V919 HydrophobicContact CB-CG1 3.8Å; P839-V919 HydrophobicContact CB-CG2 3.59Å; P839-V919 HydrophobicContact CG-CG1 4.02Å; P839-V919 HydrophobicContact CG-CG2 4.46Å; L915-V919 WeakPolarHBondContact O-CG2 3.34Å; L915-V919 PolarHBondContact O-N 3.29Å; V916-V919 PolarHBondContact O-N 3.33Å; V916-V919 VanDerWaalsContact O-N 3.1Å; V917-V919 PolarHBondContact O-N 3.04Å; V919-R922 PolarHBondContact O-N 3.42Å; V919-K923 PolarHBondContact O-N 3.2Å
920	F	90.2	Very high	90.2	Very high	131 Å²	131	80.6 Å²	80.6	58%	0.575	45%	0.45	S	S	*	.	H	α-helix	trans	-61.5	-44.8	178	-86.7	-66.7	0	0	0	112.5	V916 V917 R922 K923 L924	V916-F920 HydrophobicContact CG1-CD2 3.56Å; V916-F920 HydrophobicContact CG1-CE2 3.56Å; V916-F920 WeakPolarHBondContact O-CD2 3.39Å; V916-F920 PolarHBondContact O-N 2.77Å; V917-F920 PolarHBondContact O-N 3.41Å; F920-R922 VanDerWaalsContact C-N 3.35Å; F920-R922 PolarHBondContact O-N 2.87Å; F920-K923 CarbonylContact O-C 3.54Å; F920-K923 WeakPolarHBondContact O-CA 3.29Å; F920-K923 PolarHBondContact O-N 2.74Å; F920-L924 WeakPolarHBondContact O-CG 3.34Å; F920-L924 PolarHBondContact O-N 3.34Å
921	A	92.2	Very high	89.9	Confident	53 Å²	53	81.7 Å²	81.7	44%	0.438	45%	0.447	S	S	.	.	H	α-helix	trans	-52.9	-50.4	177.8	0	0	0	0	0	112.1	V917 K923 L924 E925	V917-A921 WeakPolarHBondContact O-CB 3.38Å; V917-A921 PolarHBondContact O-N 2.88Å; A921-K923 PolarHBondContact O-N 3.05Å; A921-L924 PolarHBondContact O-N 2.95Å; A921-L924 VanDerWaalsContact O-N 3.15Å; A921-E925 PolarHBondContact O-N 3.02Å
922	R	87.8	Confident	89.6	Confident	127 Å²	127	85.2 Å²	85.2	48%	0.479	45%	0.454	S	S	.	.	H	α-helix	trans	-68.5	-11.8	177.4	-70.9	179.8	-68.5	155.5	1.6	114.7	A918 V919 F920	A918-R922 PolarHBondContact O-NE 3.01Å; A918-R922 PolarHBondContact O-NH2 2.87Å; V919-R922 PolarHBondContact O-N 3.42Å; F920-R922 VanDerWaalsContact C-N 3.35Å; F920-R922 PolarHBondContact O-N 2.87Å
923	K	86.8	Confident	89.5	Confident	166 Å²	166	89.6 Å²	89.6	72%	0.722	48%	0.48	S	S	*	.	H	α-helix	trans	-101.4	-15.3	174	-76.5	-65.9	-172.1	-179.9	0	113.4	V919 F920 A921	V919-K923 PolarHBondContact O-N 3.2Å; F920-K923 CarbonylContact O-C 3.54Å; F920-K923 WeakPolarHBondContact O-CA 3.29Å; F920-K923 PolarHBondContact O-N 2.74Å; A921-K923 PolarHBondContact O-N 3.05Å
924	L	89.6	Confident	89.3	Confident	133 Å²	133	90.3 Å²	90.3	70%	0.696	48%	0.481	S	S	*	.	H	α-helix	trans	-92.4	-12.6	169.9	-65.7	170.6	0	0	0	112.3	F920 A921 L926	F920-L924 WeakPolarHBondContact O-CG 3.34Å; F920-L924 PolarHBondContact O-N 3.34Å; A921-L924 PolarHBondContact O-N 2.95Å; A921-L924 VanDerWaalsContact O-N 3.15Å; L924-L926 PolarHBondContact O-N 3.36Å
925	E	89.7	Confident	89	Confident	123 Å²	123	88.7 Å²	88.7	58%	0.575	46%	0.463	S	S	*	.	S	Bend	trans	-64.6	112.3	166.1	-79.8	-172.6	-115.2	0	0	111.2	A921	A921-E925 PolarHBondContact O-N 3.02Å
926	L	87.8	Confident	89	Confident	79 Å²	79	91.3 Å²	91.3	41%	0.414	47%	0.471	S	S	.	.			trans	-59.3	148.1	178.3	-41.9	-46.5	0	0	0	111.7	L924 E930 K931 I934	L924-L926 PolarHBondContact O-N 3.36Å; L926-E930 HydrophobicContact CB-CB 4.23Å; L926-K931 HydrophobicContact CB-CG 3.99Å; L926-K931 WeakPolarHBondContact O-CD 3.4Å; L926-K931 WeakPolarHBondContact O-CE 3.41Å; L926-K931 PolarHBondContact O-NZ 3.04Å; L926-I934 HydrophobicContact CD2-CD1 3.48Å; L926-I934 VanDerWaalsContact CD2-CD1 3.48Å
927	S	87.2	Confident	89	Confident	64 Å²	64	94.2 Å²	94.2	45%	0.448	48%	0.484	S	S	.	.			trans	-59.5	156	175.2	179.5	0	0	0	0	112.3	A929 E930 K931	S927-A929 PolarHBondContact O-N 3.15Å; S927-E930 VanDerWaalsContact CB-OE2 3.25Å; S927-E930 WeakPolarHBondContact CB-OE2 3.35Å; S927-E930 PolarHBondContact N-OE2 3.48Å; S927-E930 PolarHBondContact O-N 2.84Å; S927-K931 WeakPolarHBondContact O-CB 3.49Å; S927-K931 WeakPolarHBondContact O-CG 3.47Å; S927-K931 PolarHBondContact O-N 3.26Å
928	K	83.4	Confident	88.8	Confident	137 Å²	137	93.7 Å²	93.7	60%	0.596	48%	0.476	S	S	*	.	H	α-helix	trans	-59.4	-35.1	176.6	-171.6	177.5	179.3	-177	0	111.7	H932 L1006	K928-H932 PolarHBondContact O-N 3.46Å; K928-L1006 HydrophobicContact CG-CD1 4.38Å
929	A	87.3	Confident	88.8	Confident	64 Å²	64	94.7 Å²	94.7	53%	0.529	47%	0.472	S	S	.	.	H	α-helix	trans	-68.8	-48.1	175.6	0	0	0	0	0	111.7	S927 K931 H932 V933	S927-A929 PolarHBondContact O-N 3.15Å; A929-K931 VanDerWaalsContact C-N 3.35Å; A929-K931 PolarHBondContact O-N 3.45Å; A929-H932 WeakPolarHBondContact O-CB 3.43Å; A929-H932 PolarHBondContact O-N 2.92Å; A929-H932 VanDerWaalsContact O-N 3.1Å; A929-V933 WeakPolarHBondContact O-CG2 3.48Å; A929-V933 PolarHBondContact O-N 3.34Å
930	E	89.6	Confident	88.9	Confident	103 Å²	103	96.5 Å²	96.5	48%	0.481	48%	0.481	S	S	.	.	H	α-helix	trans	-60.5	-42.8	177.6	-64.1	171.7	140.1	0	0	111.8	L926 S927 H932 V933 I934	L926-E930 HydrophobicContact CB-CB 4.23Å; S927-E930 VanDerWaalsContact CB-OE2 3.25Å; S927-E930 WeakPolarHBondContact CB-OE2 3.35Å; S927-E930 PolarHBondContact N-OE2 3.48Å; S927-E930 PolarHBondContact O-N 2.84Å; E930-H932 VanDerWaalsContact C-N 3.29Å; E930-H932 PolarHBondContact O-N 3.33Å; E930-V933 PolarHBondContact O-N 3.18Å; E930-I934 WeakPolarHBondContact O-CB 3.28Å; E930-I934 WeakPolarHBondContact O-CG1 3.4Å; E930-I934 PolarHBondContact O-N 2.78Å
931	K	88.1	Confident	89.1	Confident	88 Å²	88	95.1 Å²	95.1	38%	0.383	48%	0.476	S	S	.	.	H	α-helix	trans	-56.9	-41.7	173.6	-75.7	166.8	171.2	150.2	0	111.6	L926 S927 A929 H935	L926-K931 HydrophobicContact CB-CG 3.99Å; L926-K931 WeakPolarHBondContact O-CD 3.4Å; L926-K931 WeakPolarHBondContact O-CE 3.41Å; L926-K931 PolarHBondContact O-NZ 3.04Å; S927-K931 WeakPolarHBondContact O-CB 3.49Å; S927-K931 WeakPolarHBondContact O-CG 3.47Å; S927-K931 PolarHBondContact O-N 3.26Å; A929-K931 VanDerWaalsContact C-N 3.35Å; A929-K931 PolarHBondContact O-N 3.45Å; K931-H935 WeakPolarHBondContact O-CB 2.95Å; K931-H935 PolarHBondContact O-N 3.32Å
932	H	85.6	Confident	89.1	Confident	109 Å²	109	93.3 Å²	93.3	51%	0.505	46%	0.459	S	S	.	.	H	α-helix	trans	-68.8	-41	176.6	-169.7	-82.2	0	0	0	112.5	K928 A929 E930 H935 F936	K928-H932 PolarHBondContact O-N 3.46Å; A929-H932 WeakPolarHBondContact O-CB 3.43Å; A929-H932 PolarHBondContact O-N 2.92Å; A929-H932 VanDerWaalsContact O-N 3.1Å; E930-H932 VanDerWaalsContact C-N 3.29Å; E930-H932 PolarHBondContact O-N 3.33Å; H932-H935 PolarHBondContact O-N 2.9Å; H932-F936 WeakPolarHBondContact O-CB 3.38Å; H932-F936 PolarHBondContact O-N 2.95Å
933	V	90	Very high	89.3	Confident	95 Å²	95	89.5 Å²	89.5	58%	0.576	45%	0.448	S	S	*	.	H	α-helix	trans	-65.3	-44.8	176.8	172.9	0	0	0	0	111.6	A929 E930 F936 M937	A929-V933 WeakPolarHBondContact O-CG2 3.48Å; A929-V933 PolarHBondContact O-N 3.34Å; E930-V933 PolarHBondContact O-N 3.18Å; V933-F936 PolarHBondContact O-N 2.94Å; V933-M937 WeakPolarHBondContact O-CB 3.35Å; V933-M937 PolarHBondContact O-N 3.5Å
934	I	89.4	Confident	89.7	Confident	75 Å²	75	87.9 Å²	87.9	39%	0.385	44%	0.441	S	S	.	.	H	α-helix	trans	-66.8	-39.5	177.2	-69.7	174.2	0	0	0	111.1	L926 E930 M937 M938	L926-I934 HydrophobicContact CD2-CD1 3.48Å; L926-I934 VanDerWaalsContact CD2-CD1 3.48Å; E930-I934 WeakPolarHBondContact O-CB 3.28Å; E930-I934 WeakPolarHBondContact O-CG1 3.4Å; E930-I934 PolarHBondContact O-N 2.78Å; I934-M937 PolarHBondContact O-N 2.9Å; I934-M938 VanDerWaalsContact O-CB 3.29Å; I934-M938 WeakPolarHBondContact O-CB 3.33Å; I934-M938 PolarHBondContact O-N 3.43Å
935	H	87.9	Confident	90	Very high	27 Å²	27	86 Å²	86	13%	0.125	43%	0.427	C	S	.	.	H	α-helix	trans	-58.6	-53.1	173.6	177.7	-75.4	0	0	0	111.3	K931 H932 M937 M938 E939 V999 A1003	K931-H935 WeakPolarHBondContact O-CB 2.95Å; K931-H935 PolarHBondContact O-N 3.32Å; H932-H935 PolarHBondContact O-N 2.9Å; H935-M937 VanDerWaalsContact C-N 3.31Å; H935-M937 PolarHBondContact O-N 3.47Å; H935-M938 WeakPolarHBondContact O-CB 3.27Å; H935-M938 PolarHBondContact O-N 3.38Å; H935-M938 VanDerWaalsContact O-N 3.1Å; H935-E939 IonicContact CE1-OE2 3.88Å; H935-E939 PolarHBondContact O-N 3.01Å; H935-V999 PolarHBondContact CD2-O 2.83Å; H935-V999 VanDerWaalsContact NE2-CG1 3.32Å; H935-V999 WeakPolarHBondContact NE2-CG1 3.47Å; H935-V999 PolarHBondContact NE2-O 2.88Å; H935-A1003 WeakPolarHBondContact CE1-CB 3.47Å; H935-A1003 WeakPolarHBondContact NE2-CB 3.41Å
936	F	90.1	Very high	90.2	Very high	125 Å²	125	81 Å²	81	55%	0.548	41%	0.405	S	S	.	.	H	α-helix	trans	-60	-39.3	178	177.1	-107.1	0	0	0	112.4	H932 V933 N940	H932-F936 WeakPolarHBondContact O-CB 3.38Å; H932-F936 PolarHBondContact O-N 2.95Å; V933-F936 PolarHBondContact O-N 2.94Å; F936-N940 VanDerWaalsContact CE1-ND2 3.34Å; F936-N940 WeakPolarHBondContact CE1-ND2 3.42Å; F936-N940 VanDerWaalsContact CE2-ND2 3.28Å; F936-N940 WeakPolarHBondContact CE2-ND2 3.29Å; F936-N940 WeakPolarHBondContact CZ-ND2 3.39Å; F936-N940 WeakPolarHBondContact O-CB 3.23Å; F936-N940 PolarHBondContact O-N 3.21Å; F936-N940 PolarHBondContact O-ND2 3.45Å
937	M	90.8	Very high	90.5	Very high	107 Å²	107	84.7 Å²	84.7	53%	0.527	42%	0.418	S	S	.	.	H	α-helix	trans	-62.3	-46.3	173.7	179.7	179.6	65.1	0	0	111.6	V933 I934 H935 N940 Q941	V933-M937 WeakPolarHBondContact O-CB 3.35Å; V933-M937 PolarHBondContact O-N 3.5Å; I934-M937 PolarHBondContact O-N 2.9Å; H935-M937 VanDerWaalsContact C-N 3.31Å; H935-M937 PolarHBondContact O-N 3.47Å; M937-N940 PolarHBondContact O-N 3.28Å; M937-Q941 WeakPolarHBondContact O-CG 3.42Å; M937-Q941 PolarHBondContact O-N 3.04Å
938	M	90.3	Very high	90.9	Very high	88 Å²	88	86.3 Å²	86.3	43%	0.433	42%	0.421	S	S	.	.	H	α-helix	trans	-64.2	-43.2	179.2	177.5	166.2	50.2	0	0	111.6	I934 H935 N940 Q941 L942 V999	I934-M938 VanDerWaalsContact O-CB 3.29Å; I934-M938 WeakPolarHBondContact O-CB 3.33Å; I934-M938 PolarHBondContact O-N 3.43Å; H935-M938 WeakPolarHBondContact O-CB 3.27Å; H935-M938 PolarHBondContact O-N 3.38Å; H935-M938 VanDerWaalsContact O-N 3.1Å; M938-N940 PolarHBondContact O-N 3.46Å; M938-Q941 PolarHBondContact O-N 3.18Å; M938-L942 VanDerWaalsContact O-CB 3.25Å; M938-L942 WeakPolarHBondContact O-CB 3.35Å; M938-L942 PolarHBondContact O-N 2.88Å; M938-V999 HydrophobicContact CE-CG1 4.15Å; M938-V999 HydrophobicContact CE-CG2 3.84Å; M938-V999 HydrophobicContact CG-CG1 4.36Å; M938-V999 HydrophobicContact CG-CG2 3.93Å; M938-V999 HydrophobicContact SD-CG2 3.77Å
939	E	90.6	Very high	91.5	Very high	69 Å²	69	83.9 Å²	83.9	32%	0.322	41%	0.409	S	S	.	.	H	α-helix	trans	-60.4	-44.6	173.4	-178.8	176.3	173.8	0	0	111.5	H935 Q941 L942 N943 V999	H935-E939 IonicContact CE1-OE2 3.88Å; H935-E939 PolarHBondContact O-N 3.01Å; E939-Q941 PolarHBondContact O-N 3.01Å; E939-L942 PolarHBondContact O-N 3.46Å; E939-N943 WeakPolarHBondContact CG-ND2 3.34Å; E939-N943 WeakPolarHBondContact O-CB 3.37Å; E939-N943 PolarHBondContact O-N 3.4Å; E939-N943 PolarHBondContact O-ND2 2.97Å; E939-V999 HydrophobicContact CB-CG1 4.29Å
940	N	92.8	Very high	91.9	Very high	64 Å²	64	82.6 Å²	82.6	34%	0.342	40%	0.398	S	S	.	.	H	α-helix	trans	-62.7	-42.9	177.2	-86.2	-70.8	0	0	0	112.7	F936 M937 M938 L942 K944	F936-N940 VanDerWaalsContact CE1-ND2 3.34Å; F936-N940 WeakPolarHBondContact CE1-ND2 3.42Å; F936-N940 VanDerWaalsContact CE2-ND2 3.28Å; F936-N940 WeakPolarHBondContact CE2-ND2 3.29Å; F936-N940 WeakPolarHBondContact CZ-ND2 3.39Å; F936-N940 WeakPolarHBondContact O-CB 3.23Å; F936-N940 PolarHBondContact O-N 3.21Å; F936-N940 PolarHBondContact O-ND2 3.45Å; M937-N940 PolarHBondContact O-N 3.28Å; M938-N940 PolarHBondContact O-N 3.46Å; N940-L942 VanDerWaalsContact C-N 3.33Å; N940-K944 WeakPolarHBondContact O-CG 3.48Å; N940-K944 PolarHBondContact O-N 3.12Å
941	Q	93.9	Very high	92.3	Very high	101 Å²	101	80.2 Å²	80.2	47%	0.472	40%	0.396	S	S	.	.	H	α-helix	trans	-64.7	-39	175.4	-68.9	-67.9	10.6	0	0	111.7	M937 M938 E939 K944 K945	M937-Q941 WeakPolarHBondContact O-CG 3.42Å; M937-Q941 PolarHBondContact O-N 3.04Å; M938-Q941 PolarHBondContact O-N 3.18Å; E939-Q941 PolarHBondContact O-N 3.01Å; Q941-K944 WeakPolarHBondContact O-CB 3.5Å; Q941-K944 PolarHBondContact O-N 2.95Å; Q941-K945 PolarHBondContact O-N 3Å
942	L	91.8	Very high	92.6	Very high	16 Å²	16	78.3 Å²	78.3	8%	0.084	39%	0.39	C	S	.	.	H	α-helix	trans	-72.8	-38.4	-179.7	-166.1	41.5	0	0	0	111.8	M938 E939 N940 K944 K945 V946 M992 D995 Q996 V999	M938-L942 VanDerWaalsContact O-CB 3.25Å; M938-L942 WeakPolarHBondContact O-CB 3.35Å; M938-L942 PolarHBondContact O-N 2.88Å; E939-L942 PolarHBondContact O-N 3.46Å; N940-L942 VanDerWaalsContact C-N 3.33Å; L942-K944 VanDerWaalsContact C-N 3.31Å; L942-K944 PolarHBondContact O-N 3.23Å; L942-K945 HydrophobicContact CD1-CB 4.41Å; L942-K945 PolarHBondContact O-N 2.81Å; L942-V946 WeakPolarHBondContact O-CB 3.26Å; L942-V946 WeakPolarHBondContact O-CG2 3.39Å; L942-V946 PolarHBondContact O-N 3.05Å; L942-M992 HydrophobicContact CD1-CB 3.96Å; L942-M992 HydrophobicContact CD1-CG 4.32Å; L942-M992 HydrophobicContact CD1-SD 3.59Å; L942-M992 VanDerWaalsContact CD1-SD 3.59Å; L942-D995 HydrophobicContact CD2-CB 3.98Å; L942-Q996 HydrophobicContact CD2-CB 4.11Å; L942-Q996 HydrophobicContact CG-CB 4.17Å; L942-V999 HydrophobicContact CD2-CG2 4.12Å
943	N	93.5	Very high	93.1	Very high	46 Å²	46	74.1 Å²	74.1	25%	0.246	37%	0.372	C	S	.	.	H	α-helix	trans	-59.4	-38.5	168.9	-86.6	-48.7	0	0	0	112.2	E939 K947 Q996	E939-N943 WeakPolarHBondContact CG-ND2 3.34Å; E939-N943 WeakPolarHBondContact O-CB 3.37Å; E939-N943 PolarHBondContact O-N 3.4Å; E939-N943 PolarHBondContact O-ND2 2.97Å; N943-K947 WeakPolarHBondContact O-CB 3.4Å; N943-K947 VanDerWaalsContact O-CG 3.3Å; N943-K947 WeakPolarHBondContact O-CG 3.38Å; N943-K947 PolarHBondContact O-N 2.98Å; N943-Q996 PolarHBondContact OD1-NE2 3.46Å
944	K	95.5	Very high	93.3	Very high	132 Å²	132	75.5 Å²	75.5	57%	0.574	38%	0.376	S	S	*	.	H	α-helix	trans	-63.6	-47	171.3	-70.8	170.2	-176.5	178.6	0	111.7	N940 Q941 L942 K947 N948	N940-K944 WeakPolarHBondContact O-CG 3.48Å; N940-K944 PolarHBondContact O-N 3.12Å; Q941-K944 WeakPolarHBondContact O-CB 3.5Å; Q941-K944 PolarHBondContact O-N 2.95Å; L942-K944 VanDerWaalsContact C-N 3.31Å; L942-K944 PolarHBondContact O-N 3.23Å; K944-K947 PolarHBondContact O-N 3.04Å; K944-N948 PolarHBondContact O-N 2.84Å; K944-N948 VanDerWaalsContact O-N 3.1Å
945	K	94.3	Very high	93.6	Very high	95 Å²	95	79.4 Å²	79.4	41%	0.413	39%	0.386	S	S	.	.	H	α-helix	trans	-59.5	-47.4	175.6	-71.7	-171.6	178.7	-170.9	0	111.5	Q941 L942 K947 N948 Y949 M992	Q941-K945 PolarHBondContact O-N 3Å; L942-K945 HydrophobicContact CD1-CB 4.41Å; L942-K945 PolarHBondContact O-N 2.81Å; K945-K947 PolarHBondContact O-N 3.13Å; K945-N948 WeakPolarHBondContact O-CB 3.4Å; K945-N948 PolarHBondContact O-N 3.19Å; K945-N948 VanDerWaalsContact O-N 3.16Å; K945-Y949 VanDerWaalsContact O-CD2 3.27Å; K945-Y949 WeakPolarHBondContact O-CD2 3.47Å; K945-Y949 PolarHBondContact O-N 3.38Å; K945-M992 HydrophobicContact CB-CG 4.33Å; K945-M992 HydrophobicContact CB-SD 3.9Å; K945-M992 HydrophobicContact CD-SD 3.69Å; K945-M992 HydrophobicContact CG-SD 4.41Å
946	V	94.2	Very high	93.8	Very high	16 Å²	16	78.7 Å²	78.7	10%	0.097	38%	0.382	C	S	.	.	H	α-helix	trans	-59.1	-43.9	178	169.2	0	0	0	0	111.9	L942 N948 Y949 A950 L989 M992	L942-V946 WeakPolarHBondContact O-CB 3.26Å; L942-V946 WeakPolarHBondContact O-CG2 3.39Å; L942-V946 PolarHBondContact O-N 3.05Å; V946-N948 PolarHBondContact O-N 2.7Å; V946-Y949 PolarHBondContact O-N 2.74Å; V946-A950 WeakPolarHBondContact O-CB 3.26Å; V946-A950 PolarHBondContact O-N 3.41Å; V946-L989 HydrophobicContact CG1-CD1 4.04Å; V946-M992 HydrophobicContact CG2-CB 3.69Å
947	K	95.1	Very high	94	Very high	157 Å²	157	75.6 Å²	75.6	68%	0.683	37%	0.374	S	S	*	.	H	α-helix	trans	-60.3	-42.8	174.6	-74.4	173.1	-179.4	-178.3	0	112.1	N943 K944 K945 A950 A951	N943-K947 WeakPolarHBondContact O-CB 3.4Å; N943-K947 VanDerWaalsContact O-CG 3.3Å; N943-K947 WeakPolarHBondContact O-CG 3.38Å; N943-K947 PolarHBondContact O-N 2.98Å; K944-K947 PolarHBondContact O-N 3.04Å; K945-K947 PolarHBondContact O-N 3.13Å; K947-A950 PolarHBondContact O-N 3.29Å; K947-A951 WeakPolarHBondContact O-CB 3.41Å; K947-A951 PolarHBondContact O-N 3.05Å
948	N	95.6	Very high	94.1	Very high	98 Å²	98	77.4 Å²	77.4	52%	0.524	38%	0.375	S	S	.	.	H	α-helix	trans	-64.6	-45.9	176.3	-171.7	5.7	0	0	0	112.2	K944 K945 V946 A950 A951 N952	K944-N948 PolarHBondContact O-N 2.84Å; K944-N948 VanDerWaalsContact O-N 3.1Å; K945-N948 WeakPolarHBondContact O-CB 3.4Å; K945-N948 PolarHBondContact O-N 3.19Å; K945-N948 VanDerWaalsContact O-N 3.16Å; V946-N948 PolarHBondContact O-N 2.7Å; N948-A950 PolarHBondContact O-N 2.9Å; N948-A951 PolarHBondContact O-N 2.99Å; N948-N952 PolarHBondContact O-N 3.38Å; N948-N952 PolarHBondContact O-ND2 3.33Å; N948-N952 PolarHBondContact OD1-ND2 2.92Å
949	Y	95.6	Very high	94.2	Very high	87 Å²	87	74.4 Å²	74.4	34%	0.341	36%	0.361	S	S	.	.	H	α-helix	trans	-64.1	-38.1	175.7	-79.7	-74.5	0	0	0	112.6	K945 V946 N952 V953 M992	K945-Y949 VanDerWaalsContact O-CD2 3.27Å; K945-Y949 WeakPolarHBondContact O-CD2 3.47Å; K945-Y949 PolarHBondContact O-N 3.38Å; V946-Y949 PolarHBondContact O-N 2.74Å; Y949-N952 PolarHBondContact O-N 3.43Å; Y949-V953 WeakPolarHBondContact O-CG2 3.41Å; Y949-V953 PolarHBondContact O-N 2.91Å; Y949-M992 HydrophobicContact CD2-CG 3.57Å; Y949-M992 HydrophobicContact CE2-CG 3.57Å; Y949-M992 HydrophobicContact CE2-SD 4.2Å
950	A	96.4	Very high	94.2	Very high	37 Å²	37	72.7 Å²	72.7	31%	0.306	35%	0.353	S	S	.	.	H	α-helix	trans	-62.5	-43.1	173.8	0	0	0	0	0	112.1	V946 K947 N948 N952 V953 L954 L989	V946-A950 WeakPolarHBondContact O-CB 3.26Å; V946-A950 PolarHBondContact O-N 3.41Å; K947-A950 PolarHBondContact O-N 3.29Å; N948-A950 PolarHBondContact O-N 2.9Å; A950-N952 VanDerWaalsContact C-N 3.33Å; A950-N952 PolarHBondContact O-N 2.89Å; A950-V953 PolarHBondContact O-N 3.48Å; A950-L954 WeakPolarHBondContact O-CG 3.38Å; A950-L954 PolarHBondContact O-N 3.42Å; A950-L989 HydrophobicContact CB-CD1 4.39Å
951	A	96.4	Very high	94.1	Very high	53 Å²	53	76 Å²	76	44%	0.438	36%	0.362	S	S	.	.	H	α-helix	trans	-61.6	-38.7	174	0	0	0	0	0	112.4	K947 N948 L954 R955	K947-A951 WeakPolarHBondContact O-CB 3.41Å; K947-A951 PolarHBondContact O-N 3.05Å; N948-A951 PolarHBondContact O-N 2.99Å; A951-L954 PolarHBondContact O-N 2.82Å; A951-R955 VanDerWaalsContact O-CB 3.31Å; A951-R955 WeakPolarHBondContact O-CB 3.49Å; A951-R955 PolarHBondContact O-N 2.96Å
952	N	95.7	Very high	93.9	Very high	47 Å²	47	74.9 Å²	74.9	25%	0.251	36%	0.355	S	S	.	.	H	α-helix	trans	-69	-36.9	174.9	-74.2	-63.8	0	0	0	112.9	N948 Y949 A950 R955 E956 A985	N948-N952 PolarHBondContact O-N 3.38Å; N948-N952 PolarHBondContact O-ND2 3.33Å; N948-N952 PolarHBondContact OD1-ND2 2.92Å; Y949-N952 PolarHBondContact O-N 3.43Å; A950-N952 VanDerWaalsContact C-N 3.33Å; A950-N952 PolarHBondContact O-N 2.89Å; N952-R955 PolarHBondContact O-N 3.42Å; N952-E956 WeakPolarHBondContact O-CG 3.42Å; N952-E956 PolarHBondContact O-N 3.19Å; N952-A985 HydrophobicContact CB-CB 4.23Å
953	V	95.2	Very high	93.8	Very high	22 Å²	22	76.7 Å²	76.7	13%	0.133	36%	0.362	C	S	.	.	H	α-helix	trans	-60.9	-47.4	171.4	171.5	0	0	0	0	110.3	Y949 A950 T957 F982 A985 I986 L989	Y949-V953 WeakPolarHBondContact O-CG2 3.41Å; Y949-V953 PolarHBondContact O-N 2.91Å; A950-V953 PolarHBondContact O-N 3.48Å; V953-T957 WeakPolarHBondContact O-CB 3.45Å; V953-T957 PolarHBondContact O-N 3.12Å; V953-T957 PolarHBondContact O-OG1 2.88Å; V953-F982 HydrophobicContact CG1-CD2 4.38Å; V953-F982 HydrophobicContact CG1-CE2 4.1Å; V953-A985 HydrophobicContact CG2-CB 3.64Å; V953-I986 HydrophobicContact CG1-CG1 4.34Å; V953-I986 HydrophobicContact CG2-CG1 4.02Å; V953-L989 HydrophobicContact CG2-CB 4.48Å; V953-L989 HydrophobicContact CG2-CD2 4.06Å
954	L	94.4	Very high	93.5	Very high	124 Å²	124	77.3 Å²	77.3	65%	0.649	37%	0.367	S	S	*	.	H	α-helix	trans	-60.6	-46	176.4	-71.2	172.3	0	0	0	112.2	A950 A951 T957 W958	A950-L954 WeakPolarHBondContact O-CG 3.38Å; A950-L954 PolarHBondContact O-N 3.42Å; A951-L954 PolarHBondContact O-N 2.82Å; L954-T957 PolarHBondContact O-N 3.46Å; L954-W958 WeakPolarHBondContact O-CB 3.34Å; L954-W958 PolarHBondContact O-N 2.98Å
955	R	95.1	Very high	92.9	Very high	156 Å²	156	78.4 Å²	78.4	59%	0.589	37%	0.372	S	S	*	.	H	α-helix	trans	-56.2	-52.5	177.7	-179.9	-174	-175.9	-179.7	4.5	112	A951 N952 W958 L959	A951-R955 VanDerWaalsContact O-CB 3.31Å; A951-R955 WeakPolarHBondContact O-CB 3.49Å; A951-R955 PolarHBondContact O-N 2.96Å; N952-R955 PolarHBondContact O-N 3.42Å; R955-W958 PolarHBondContact O-N 3.23Å; R955-L959 HydrophobicContact CG-CD1 4.01Å; R955-L959 WeakPolarHBondContact O-CD1 3.34Å; R955-L959 VanDerWaalsContact O-CG 3.26Å; R955-L959 WeakPolarHBondContact O-CG 3.37Å; R955-L959 PolarHBondContact O-N 3.07Å
956	E	92.6	Very high	92.4	Very high	12 Å²	12	78.9 Å²	78.9	6%	0.056	38%	0.379	C	S	.	.	H	α-helix	trans	-71.6	-32	-178.5	-61.9	-65.2	153.4	0	0	111.5	N952 L959 I960 H978 K981 F982	N952-E956 WeakPolarHBondContact O-CG 3.42Å; N952-E956 PolarHBondContact O-N 3.19Å; E956-L959 PolarHBondContact O-N 3.12Å; E956-I960 VanDerWaalsContact O-CG1 3.24Å; E956-I960 WeakPolarHBondContact O-CG1 3.41Å; E956-I960 PolarHBondContact O-N 2.99Å; E956-H978 IonicContact OE2-CE1 2.67Å; E956-H978 IonicContact OE2-CG 2.71Å; E956-H978 IonicContact OE2-ND1 3.78Å; E956-H978 PolarHBondContact OE2-ND1 3.17Å; E956-K981 VanDerWaalsContact CD-CB 3.44Å; E956-K981 HydrophobicContact CG-CB 3.78Å; E956-K981 WeakPolarHBondContact OE1-CD 3.49Å; E956-K981 WeakPolarHBondContact OE2-CB 3.48Å; E956-K981 WeakPolarHBondContact OE2-CD 3.45Å; E956-F982 HydrophobicContact CB-CB 3.88Å
957	T	93.5	Very high	91.8	Very high	61 Å²	61	81 Å²	81	37%	0.374	39%	0.391	S	S	.	.	H	α-helix	trans	-61.2	-46.9	171.4	-54.3	0	0	0	0	111.5	V953 L954 L959 I960 Y961 F982	V953-T957 WeakPolarHBondContact O-CB 3.45Å; V953-T957 PolarHBondContact O-N 3.12Å; V953-T957 PolarHBondContact O-OG1 2.88Å; L954-T957 PolarHBondContact O-N 3.46Å; T957-L959 VanDerWaalsContact C-N 3.35Å; T957-L959 PolarHBondContact O-N 3.29Å; T957-I960 PolarHBondContact O-N 3.36Å; T957-Y961 PolarHBondContact O-N 3.17Å; T957-F982 WeakPolarHBondContact OG1-CE2 3.45Å
958	W	93.8	Very high	90.9	Very high	144 Å²	144	84 Å²	84	55%	0.545	40%	0.404	S	S	.	.	H	α-helix	trans	-64.6	-38.3	177.5	179.8	84	0	0	0	112.1	L954 R955 Y961 K962	L954-W958 WeakPolarHBondContact O-CB 3.34Å; L954-W958 PolarHBondContact O-N 2.98Å; R955-W958 PolarHBondContact O-N 3.23Å; W958-Y961 PolarHBondContact O-N 2.88Å; W958-K962 HydrophobicContact CH2-CD 3.85Å; W958-K962 HydrophobicContact CZ2-CD 4.24Å; W958-K962 HydrophobicContact CZ3-CD 4.1Å; W958-K962 WeakPolarHBondContact O-CB 3.46Å; W958-K962 PolarHBondContact O-N 3.28Å
959	L	91.7	Very high	90.1	Very high	26 Å²	26	89.5 Å²	89.5	14%	0.136	42%	0.417	C	S	.	.	H	α-helix	trans	-66.1	-41.8	174.9	-69.1	164.5	0	0	0	111.6	R955 E956 T957 K962 Y963 H978	R955-L959 HydrophobicContact CG-CD1 4.01Å; R955-L959 WeakPolarHBondContact O-CD1 3.34Å; R955-L959 VanDerWaalsContact O-CG 3.26Å; R955-L959 WeakPolarHBondContact O-CG 3.37Å; R955-L959 PolarHBondContact O-N 3.07Å; E956-L959 PolarHBondContact O-N 3.12Å; T957-L959 VanDerWaalsContact C-N 3.35Å; T957-L959 PolarHBondContact O-N 3.29Å; L959-K962 PolarHBondContact O-N 2.9Å; L959-Y963 HydrophobicContact CD2-CE2 4.24Å; L959-Y963 WeakPolarHBondContact O-CD2 3.46Å; L959-Y963 PolarHBondContact O-N 3.46Å; L959-H978 HydrophobicContact CB-CB 4.46Å
960	I	90.8	Very high	89.3	Confident	32 Å²	32	89.4 Å²	89.4	16%	0.164	43%	0.426	C	S	.	.	H	α-helix	trans	-58.5	-50.2	171.9	-69	163.2	0	0	0	110.2	E956 T957 K962 Y963 T964 H978 Q979 F982	E956-I960 VanDerWaalsContact O-CG1 3.24Å; E956-I960 WeakPolarHBondContact O-CG1 3.41Å; E956-I960 PolarHBondContact O-N 2.99Å; T957-I960 PolarHBondContact O-N 3.36Å; I960-K962 PolarHBondContact O-N 3.45Å; I960-Y963 PolarHBondContact O-N 3.02Å; I960-T964 VanDerWaalsContact O-CB 3.22Å; I960-T964 WeakPolarHBondContact O-CB 3.21Å; I960-T964 PolarHBondContact O-N 3.34Å; I960-T964 PolarHBondContact O-OG1 3.41Å; I960-H978 HydrophobicContact CG1-CB 3.74Å; I960-Q979 HydrophobicContact CD1-CG 4.12Å; I960-Q979 HydrophobicContact CG1-CG 4.36Å; I960-F982 HydrophobicContact CD1-CB 3.69Å; I960-F982 HydrophobicContact CD1-CD1 4.1Å; I960-F982 HydrophobicContact CD1-CD2 4.36Å; I960-F982 HydrophobicContact CD1-CG 3.83Å
961	Y	91	Very high	88.6	Confident	135 Å²	135	90.7 Å²	90.7	53%	0.529	43%	0.428	S	S	.	.	H	α-helix	trans	-57.8	-47.8	178	178.3	-107.6	0	0	0	111.8	T957 W958 Y963 T964 K965 L966	T957-Y961 PolarHBondContact O-N 3.17Å; W958-Y961 PolarHBondContact O-N 2.88Å; Y961-Y963 PolarHBondContact O-N 3.27Å; Y961-T964 PolarHBondContact O-N 2.97Å; Y961-K965 HydrophobicContact CD2-CB 4.2Å; Y961-K965 HydrophobicContact CD2-CG 4.15Å; Y961-K965 HydrophobicContact CE2-CB 3.86Å; Y961-K965 HydrophobicContact CE2-CG 3.91Å; Y961-K965 PolarHBondContact O-N 2.91Å; Y961-L966 HydrophobicContact CD1-CD1 4.11Å; Y961-L966 HydrophobicContact CE1-CD1 3.43Å; Y961-L966 VanDerWaalsContact CE1-CD1 3.43Å
962	K	90.3	Very high	88.1	Confident	76 Å²	76	90.5 Å²	90.5	33%	0.33	43%	0.426	S	S	.	.	I	π-helix	trans	-55.7	-52.7	178.6	-176.3	174.6	-179.6	174.7	0	111.9	W958 L959 I960 T964 L966 V967	W958-K962 HydrophobicContact CH2-CD 3.85Å; W958-K962 HydrophobicContact CZ2-CD 4.24Å; W958-K962 HydrophobicContact CZ3-CD 4.1Å; W958-K962 WeakPolarHBondContact O-CB 3.46Å; W958-K962 PolarHBondContact O-N 3.28Å; L959-K962 PolarHBondContact O-N 2.9Å; I960-K962 PolarHBondContact O-N 3.45Å; K962-T964 VanDerWaalsContact C-N 3.28Å; K962-T964 PolarHBondContact O-N 3.05Å; K962-L966 HydrophobicContact CG-CB 4.44Å; K962-L966 WeakPolarHBondContact O-CB 3.31Å; K962-L966 PolarHBondContact O-N 3.21Å; K962-V967 PolarHBondContact O-N 3.02Å
963	Y	88.6	Confident	87.7	Confident	54 Å²	54	92.1 Å²	92.1	21%	0.212	44%	0.441	C	S	.	.	I	π-helix	trans	-75.3	-11.7	-178.8	-67.3	-62.6	0	0	0	114.6	L959 I960 Y961 V967 K974 H978	L959-Y963 HydrophobicContact CD2-CE2 4.24Å; L959-Y963 WeakPolarHBondContact O-CD2 3.46Å; L959-Y963 PolarHBondContact O-N 3.46Å; I960-Y963 PolarHBondContact O-N 3.02Å; Y961-Y963 PolarHBondContact O-N 3.27Å; Y963-V967 HydrophobicContact CD1-CG2 4.22Å; Y963-K974 HydrophobicContact CD1-CD 4.39Å; Y963-K974 HydrophobicContact CE1-CD 4.06Å; Y963-K974 HydrophobicContact CG-CB 4.5Å; Y963-H978 AromaticContact CD2-CD2 3.65Å; Y963-H978 AromaticContact CD2-NE2 3.93Å; Y963-H978 AromaticContact CE2-CD2 3.71Å; Y963-H978 AromaticContact CE2-NE2 3.46Å; Y963-H978 WeakPolarHBondContact CE2-NE2 3.46Å
964	T	87.7	Confident	87.2	Confident	59 Å²	59	95.7 Å²	95.7	36%	0.362	46%	0.455	S	S	.	.	I	π-helix	trans	-100.8	-26.4	179.2	-50.5	0	0	0	0	113.3	I960 Y961 K962	I960-T964 VanDerWaalsContact O-CB 3.22Å; I960-T964 WeakPolarHBondContact O-CB 3.21Å; I960-T964 PolarHBondContact O-N 3.34Å; I960-T964 PolarHBondContact O-OG1 3.41Å; Y961-T964 PolarHBondContact O-N 2.97Å; K962-T964 VanDerWaalsContact C-N 3.28Å; K962-T964 PolarHBondContact O-N 3.05Å
965	K	83.7	Confident	86.9	Confident	156 Å²	156	90.5 Å²	90.5	68%	0.678	43%	0.428	S	S	*	.	I	π-helix	trans	-130.7	-24	-172.6	-68.4	-65.6	-173.3	177.3	0	116.2	Y961	Y961-K965 HydrophobicContact CD2-CB 4.2Å; Y961-K965 HydrophobicContact CD2-CG 4.15Å; Y961-K965 HydrophobicContact CE2-CB 3.86Å; Y961-K965 HydrophobicContact CE2-CG 3.91Å; Y961-K965 PolarHBondContact O-N 2.91Å
966	L	82.7	Confident	86.7	Confident	105 Å²	105	90 Å²	90	55%	0.55	43%	0.426	S	S	.	.	I	π-helix	trans	-101.1	-11.4	-175.4	-91.2	60.7	0	0	0	114.3	Y961 K962	Y961-L966 HydrophobicContact CD1-CD1 4.11Å; Y961-L966 HydrophobicContact CE1-CD1 3.43Å; Y961-L966 VanDerWaalsContact CE1-CD1 3.43Å; K962-L966 HydrophobicContact CG-CB 4.44Å; K962-L966 WeakPolarHBondContact O-CB 3.31Å; K962-L966 PolarHBondContact O-N 3.21Å
967	V	81.9	Confident	86.6	Confident	59 Å²	59	91.9 Å²	91.9	36%	0.358	44%	0.439	S	S	.	.	S	Bend	trans	-104.8	130.3	-179.9	-173.2	0	0	0	0	109.9	K962 Y963 R969	K962-V967 PolarHBondContact O-N 3.02Å; Y963-V967 HydrophobicContact CD1-CG2 4.22Å; V967-R969 VanDerWaalsContact CG1-O 3.27Å; V967-R969 WeakPolarHBondContact CG1-O 3.43Å; V967-R969 PolarHBondContact O-N 2.76Å
968	K	76.3	Confident	86.5	Confident	221 Å²	221	90 Å²	90	96%	0.961	43%	0.426	S	S	*	.	S	Bend	trans	-60.3	-12.9	-177.7	-68.6	-172.4	177.2	-176.3	0	115.1
969	R	78.3	Confident	86.4	Confident	213 Å²	213	87.2 Å²	87.2	80%	0.804	42%	0.419	S	S	*	.	S	Bend	trans	-136.9	133	172.5	-66.2	-175.5	178.9	178.7	-0.4	108.2	V967 D971	V967-R969 VanDerWaalsContact CG1-O 3.27Å; V967-R969 WeakPolarHBondContact CG1-O 3.43Å; V967-R969 PolarHBondContact O-N 2.76Å; R969-D971 PolarHBondContact O-N 2.8Å
970	V	79.1	Confident	86.5	Confident	86 Å²	86	93 Å²	93	52%	0.521	44%	0.439	S	S	.	.			trans	-90	107.4	-173.4	178.2	0	0	0	0	110.6	A972 V975	V970-A972 PolarHBondContact O-N 3.46Å; V970-V975 HydrophobicContact CG1-CG2 4.16Å
971	D	82	Confident	86.7	Confident	63 Å²	63	95.9 Å²	95.9	34%	0.337	45%	0.45	S	S	.	.			trans	-73.7	82.8	176.9	-75.3	-35.4	0	0	0	111.5	R969 S973 K974 V975	R969-D971 PolarHBondContact O-N 2.8Å; D971-S973 PolarHBondContact O-N 2.91Å; D971-K974 HydrophobicContact CB-CB 3.9Å; D971-K974 HydrophobicContact CB-CD 3.74Å; D971-K974 HydrophobicContact CB-CG 3.87Å; D971-K974 WeakPolarHBondContact O-CA 3.36Å; D971-K974 PolarHBondContact O-N 2.82Å; D971-K974 WeakPolarHBondContact OD2-CD 3.26Å; D971-K974 VanDerWaalsContact OD2-CE 3.29Å; D971-K974 WeakPolarHBondContact OD2-CE 3.14Å; D971-K974 IonicContact OD2-NZ 3.42Å; D971-K974 PolarHBondContact OD2-NZ 2.87Å; D971-V975 PolarHBondContact O-N 3.35Å
972	A	86	Confident	86.8	Confident	49 Å²	49	92.1 Å²	92.1	41%	0.405	44%	0.437	S	S	.	.	H	α-helix	trans	-52.5	-29.3	-175.9	0	0	0	0	0	114.5	V970 R976	V970-A972 PolarHBondContact O-N 3.46Å; A972-R976 WeakPolarHBondContact O-CB 2.96Å; A972-R976 WeakPolarHBondContact O-CG 3.44Å; A972-R976 PolarHBondContact O-N 2.9Å; A972-R976 PolarHBondContact O-NE 3.49Å; A972-R976 VanDerWaalsContact O-NE 3.16Å
973	S	86.7	Confident	87	Confident	82 Å²	82	92.9 Å²	92.9	57%	0.573	44%	0.444	S	S	*	.	H	α-helix	trans	-76.5	-31.9	176.3	-56.9	0	0	0	0	113.4	D971 T977	D971-S973 PolarHBondContact O-N 2.91Å; S973-T977 WeakPolarHBondContact O-CB 3.27Å; S973-T977 PolarHBondContact O-N 3.11Å; S973-T977 PolarHBondContact O-OG1 2.89Å
974	K	85.5	Confident	87.3	Confident	97 Å²	97	98.8 Å²	98.8	42%	0.422	47%	0.466	S	S	.	.	H	α-helix	trans	-73.3	-44.9	172.4	-63.9	179.5	-167.8	157.1	0	109.8	Y963 D971 R976 T977 H978	Y963-K974 HydrophobicContact CD1-CD 4.39Å; Y963-K974 HydrophobicContact CE1-CD 4.06Å; Y963-K974 HydrophobicContact CG-CB 4.5Å; D971-K974 HydrophobicContact CB-CB 3.9Å; D971-K974 HydrophobicContact CB-CD 3.74Å; D971-K974 HydrophobicContact CB-CG 3.87Å; D971-K974 WeakPolarHBondContact O-CA 3.36Å; D971-K974 PolarHBondContact O-N 2.82Å; D971-K974 WeakPolarHBondContact OD2-CD 3.26Å; D971-K974 VanDerWaalsContact OD2-CE 3.29Å; D971-K974 WeakPolarHBondContact OD2-CE 3.14Å; D971-K974 IonicContact OD2-NZ 3.42Å; D971-K974 PolarHBondContact OD2-NZ 2.87Å; K974-R976 PolarHBondContact O-N 3.48Å; K974-T977 WeakPolarHBondContact O-CA 3.39Å; K974-T977 WeakPolarHBondContact O-CB 3.47Å; K974-T977 PolarHBondContact O-N 3.06Å; K974-H978 PolarHBondContact O-CD2 2.69Å; K974-H978 PolarHBondContact O-N 3.43Å
975	V	87.3	Confident	87.6	Confident	15 Å²	15	96.4 Å²	96.4	9%	0.091	45%	0.452	C	S	.	.	H	α-helix	trans	-56.1	-51.6	174.8	177.4	0	0	0	0	111.1	V970 D971 T977 H978 Q979	V970-V975 HydrophobicContact CG1-CG2 4.16Å; D971-V975 PolarHBondContact O-N 3.35Å; V975-T977 PolarHBondContact O-N 3.44Å; V975-T977 VanDerWaalsContact O-N 3.13Å; V975-H978 PolarHBondContact O-N 3.17Å; V975-Q979 HydrophobicContact CG1-CG 4.28Å; V975-Q979 WeakPolarHBondContact O-CB 3.4Å; V975-Q979 VanDerWaalsContact O-CG 3.31Å; V975-Q979 WeakPolarHBondContact O-CG 3.06Å; V975-Q979 PolarHBondContact O-N 2.85Å
976	R	91.1	Very high	88.1	Confident	145 Å²	145	90.8 Å²	90.8	55%	0.547	43%	0.429	S	S	.	.	H	α-helix	trans	-59.8	-22.3	174.7	-81	-179.3	-79.8	167.2	-10.9	114.5	A972 K974 R980	A972-R976 WeakPolarHBondContact O-CB 2.96Å; A972-R976 WeakPolarHBondContact O-CG 3.44Å; A972-R976 PolarHBondContact O-N 2.9Å; A972-R976 PolarHBondContact O-NE 3.49Å; A972-R976 VanDerWaalsContact O-NE 3.16Å; K974-R976 PolarHBondContact O-N 3.48Å; R976-R980 WeakPolarHBondContact O-CG 3.48Å; R976-R980 PolarHBondContact O-N 3.29Å; R976-R980 PolarHBondContact O-NE 3.42Å
977	T	91.2	Very high	88.6	Confident	52 Å²	52	91.6 Å²	91.6	32%	0.319	43%	0.429	S	S	.	.	H	α-helix	trans	-85.1	-41.5	177.6	-62.4	0	0	0	0	111.6	S973 K974 V975 R980 K981	S973-T977 WeakPolarHBondContact O-CB 3.27Å; S973-T977 PolarHBondContact O-N 3.11Å; S973-T977 PolarHBondContact O-OG1 2.89Å; K974-T977 WeakPolarHBondContact O-CA 3.39Å; K974-T977 WeakPolarHBondContact O-CB 3.47Å; K974-T977 PolarHBondContact O-N 3.06Å; V975-T977 PolarHBondContact O-N 3.44Å; V975-T977 VanDerWaalsContact O-N 3.13Å; T977-R980 PolarHBondContact O-N 3.24Å; T977-R980 PolarHBondContact OG1-NH2 2.93Å; T977-K981 WeakPolarHBondContact O-CG 3.27Å; T977-K981 PolarHBondContact O-N 3.21Å; T977-K981 VanDerWaalsContact O-N 3.12Å
978	H	90.8	Very high	89.2	Confident	22 Å²	22	89.3 Å²	89.3	10%	0.102	42%	0.418	C	S	.	.	H	α-helix	trans	-68.6	-37.2	172.4	-68.8	-65.4	0	0	0	112.4	E956 L959 I960 Y963 K974 V975 R980 K981 F982	E956-H978 IonicContact OE2-CE1 2.67Å; E956-H978 IonicContact OE2-CG 2.71Å; E956-H978 IonicContact OE2-ND1 3.78Å; E956-H978 PolarHBondContact OE2-ND1 3.17Å; L959-H978 HydrophobicContact CB-CB 4.46Å; I960-H978 HydrophobicContact CG1-CB 3.74Å; Y963-H978 AromaticContact CD2-CD2 3.65Å; Y963-H978 AromaticContact CD2-NE2 3.93Å; Y963-H978 AromaticContact CE2-CD2 3.71Å; Y963-H978 AromaticContact CE2-NE2 3.46Å; Y963-H978 WeakPolarHBondContact CE2-NE2 3.46Å; K974-H978 PolarHBondContact O-CD2 2.69Å; K974-H978 PolarHBondContact O-N 3.43Å; V975-H978 PolarHBondContact O-N 3.17Å; H978-R980 PolarHBondContact O-N 2.91Å; H978-K981 PolarHBondContact O-N 3.27Å; H978-F982 VanDerWaalsContact O-CB 3.24Å; H978-F982 WeakPolarHBondContact O-CB 3.32Å; H978-F982 PolarHBondContact O-N 3.03Å
979	Q	92	Very high	90.1	Very high	84 Å²	84	80.2 Å²	80.2	39%	0.393	38%	0.38	S	S	.	.	H	α-helix	trans	-57	-44.8	170.8	-75.5	170.9	-31.7	0	0	112.3	I960 V975 F982 L983	I960-Q979 HydrophobicContact CD1-CG 4.12Å; I960-Q979 HydrophobicContact CG1-CG 4.36Å; V975-Q979 HydrophobicContact CG1-CG 4.28Å; V975-Q979 WeakPolarHBondContact O-CB 3.4Å; V975-Q979 VanDerWaalsContact O-CG 3.31Å; V975-Q979 WeakPolarHBondContact O-CG 3.06Å; V975-Q979 PolarHBondContact O-N 2.85Å; Q979-F982 PolarHBondContact O-N 2.93Å; Q979-L983 WeakPolarHBondContact O-CG 3.46Å; Q979-L983 PolarHBondContact O-N 2.91Å
980	R	94.6	Very high	90.8	Very high	148 Å²	148	77.9 Å²	77.9	56%	0.558	37%	0.371	S	S	*	.	H	α-helix	trans	-64.7	-38.6	176	-75.1	-179.7	-66.3	171.3	4.7	112.5	R976 T977 H978 R984	R976-R980 WeakPolarHBondContact O-CG 3.48Å; R976-R980 PolarHBondContact O-N 3.29Å; R976-R980 PolarHBondContact O-NE 3.42Å; T977-R980 PolarHBondContact O-N 3.24Å; T977-R980 PolarHBondContact OG1-NH2 2.93Å; H978-R980 PolarHBondContact O-N 2.91Å; R980-R984 WeakPolarHBondContact O-CG 3.18Å; R980-R984 PolarHBondContact O-N 2.98Å; R980-R984 VanDerWaalsContact O-N 3.17Å
981	K	93.8	Very high	91.5	Very high	92 Å²	92	81 Å²	81	40%	0.4	37%	0.374	S	S	.	.	H	α-helix	trans	-68.6	-41.7	174.9	-70.2	179.9	179.1	-176.7	0	112.5	E956 T977 H978 R984 A985	E956-K981 VanDerWaalsContact CD-CB 3.44Å; E956-K981 HydrophobicContact CG-CB 3.78Å; E956-K981 WeakPolarHBondContact OE1-CD 3.49Å; E956-K981 WeakPolarHBondContact OE2-CB 3.48Å; E956-K981 WeakPolarHBondContact OE2-CD 3.45Å; T977-K981 WeakPolarHBondContact O-CG 3.27Å; T977-K981 PolarHBondContact O-N 3.21Å; T977-K981 VanDerWaalsContact O-N 3.12Å; H978-K981 PolarHBondContact O-N 3.27Å; K981-R984 PolarHBondContact O-N 3.31Å; K981-A985 WeakPolarHBondContact O-CB 3.27Å; K981-A985 PolarHBondContact O-N 2.89Å
982	F	94.2	Very high	92	Very high	56 Å²	56	79 Å²	79	25%	0.246	36%	0.363	C	S	.	.	H	α-helix	trans	-58.6	-46.3	174.3	169.4	-107	0	0	0	112	V953 E956 T957 I960 H978 Q979 A985 I986	V953-F982 HydrophobicContact CG1-CD2 4.38Å; V953-F982 HydrophobicContact CG1-CE2 4.1Å; E956-F982 HydrophobicContact CB-CB 3.88Å; T957-F982 WeakPolarHBondContact OG1-CE2 3.45Å; I960-F982 HydrophobicContact CD1-CB 3.69Å; I960-F982 HydrophobicContact CD1-CD1 4.1Å; I960-F982 HydrophobicContact CD1-CD2 4.36Å; I960-F982 HydrophobicContact CD1-CG 3.83Å; H978-F982 VanDerWaalsContact O-CB 3.24Å; H978-F982 WeakPolarHBondContact O-CB 3.32Å; H978-F982 PolarHBondContact O-N 3.03Å; Q979-F982 PolarHBondContact O-N 2.93Å; F982-A985 PolarHBondContact O-N 3.49Å; F982-I986 HydrophobicContact CD1-CD1 4.08Å; F982-I986 HydrophobicContact CD2-CD1 4.19Å; F982-I986 HydrophobicContact CE1-CD1 3.59Å; F982-I986 HydrophobicContact CE2-CD1 3.7Å; F982-I986 HydrophobicContact CE2-CG1 4.39Å; F982-I986 HydrophobicContact CG-CD1 4.37Å; F982-I986 HydrophobicContact CZ-CD1 3.4Å; F982-I986 WeakPolarHBondContact O-CG1 3.3Å; F982-I986 PolarHBondContact O-N 3Å
983	L	93.7	Very high	92.2	Very high	92 Å²	92	82.1 Å²	82.1	48%	0.482	37%	0.367	S	S	.	.	H	α-helix	trans	-61.6	-44.6	174.9	-71.7	171.3	0	0	0	112	Q979 A985 I986 H987	Q979-L983 WeakPolarHBondContact O-CG 3.46Å; Q979-L983 PolarHBondContact O-N 2.91Å; L983-A985 VanDerWaalsContact C-N 3.34Å; L983-A985 PolarHBondContact O-N 3.18Å; L983-I986 PolarHBondContact O-N 3.49Å; L983-H987 WeakPolarHBondContact O-CB 3.41Å; L983-H987 PolarHBondContact O-CD2 3.47Å; L983-H987 PolarHBondContact O-N 3.23Å
984	R	93.9	Very high	92.5	Very high	179 Å²	179	83 Å²	83	68%	0.675	36%	0.364	S	S	*	.	H	α-helix	trans	-59	-42.8	172.4	-68.2	174.2	-165.2	174.3	0.8	112.2	R980 K981 H987 G988	R980-R984 WeakPolarHBondContact O-CG 3.18Å; R980-R984 PolarHBondContact O-N 2.98Å; R980-R984 VanDerWaalsContact O-N 3.17Å; K981-R984 PolarHBondContact O-N 3.31Å; R984-H987 PolarHBondContact O-N 2.86Å; R984-G988 PolarHBondContact O-N 3.37Å
985	A	94	Very high	92.8	Very high	8 Å²	8	80.1 Å²	80.1	7%	0.066	35%	0.354	C	S	.	.	H	α-helix	trans	-65.3	-38.8	178.8	0	0	0	0	0	111.9	N952 V953 K981 F982 L983 L989	N952-A985 HydrophobicContact CB-CB 4.23Å; V953-A985 HydrophobicContact CG2-CB 3.64Å; K981-A985 WeakPolarHBondContact O-CB 3.27Å; K981-A985 PolarHBondContact O-N 2.89Å; F982-A985 PolarHBondContact O-N 3.49Å; L983-A985 VanDerWaalsContact C-N 3.34Å; L983-A985 PolarHBondContact O-N 3.18Å; A985-L989 VanDerWaalsContact O-CB 3.26Å; A985-L989 WeakPolarHBondContact O-CB 3.35Å; A985-L989 PolarHBondContact O-N 3.4Å
986	I	94.5	Very high	92.9	Very high	39 Å²	39	81.4 Å²	81.4	20%	0.2	36%	0.359	C	S	.	.	H	α-helix	trans	-65.1	-43.6	171.9	-73.2	175	0	0	0	111.2	V953 F982 L983 L989 R990	V953-I986 HydrophobicContact CG1-CG1 4.34Å; V953-I986 HydrophobicContact CG2-CG1 4.02Å; F982-I986 HydrophobicContact CD1-CD1 4.08Å; F982-I986 HydrophobicContact CD2-CD1 4.19Å; F982-I986 HydrophobicContact CE1-CD1 3.59Å; F982-I986 HydrophobicContact CE2-CD1 3.7Å; F982-I986 HydrophobicContact CE2-CG1 4.39Å; F982-I986 HydrophobicContact CG-CD1 4.37Å; F982-I986 HydrophobicContact CZ-CD1 3.4Å; F982-I986 WeakPolarHBondContact O-CG1 3.3Å; F982-I986 PolarHBondContact O-N 3Å; L983-I986 PolarHBondContact O-N 3.49Å; I986-L989 PolarHBondContact O-N 3.13Å; I986-R990 HydrophobicContact CG2-CG 4.38Å; I986-R990 WeakPolarHBondContact O-CB 3.42Å; I986-R990 VanDerWaalsContact O-CG 3.31Å; I986-R990 WeakPolarHBondContact O-CG 3.43Å; I986-R990 PolarHBondContact O-N 3.37Å
987	H	94.7	Very high	92.8	Very high	121 Å²	121	82 Å²	82	56%	0.56	36%	0.361	S	S	*	.	H	α-helix	trans	-64.8	-43.4	179.3	-75.4	-147.5	0	0	0	111	L983 R984 R990 R991	L983-H987 WeakPolarHBondContact O-CB 3.41Å; L983-H987 PolarHBondContact O-CD2 3.47Å; L983-H987 PolarHBondContact O-N 3.23Å; R984-H987 PolarHBondContact O-N 2.86Å; H987-R990 PolarHBondContact O-N 3.3Å; H987-R991 WeakPolarHBondContact O-CB 3.4Å; H987-R991 PolarHBondContact O-N 2.95Å
988	G	93.8	Very high	92.7	Very high	12 Å²	12	85.3 Å²	85.3	12%	0.124	37%	0.371	C	S	.	.	H	α-helix	trans	-61.3	-45.3	171.9	0	0	0	0	0	113	R984 R990 R991 M992	R984-G988 PolarHBondContact O-N 3.37Å; G988-R990 VanDerWaalsContact C-N 3.35Å; G988-R990 PolarHBondContact O-N 2.97Å; G988-R991 PolarHBondContact O-N 3.36Å; G988-M992 WeakPolarHBondContact O-CG 3.03Å; G988-M992 PolarHBondContact O-N 2.78Å
989	L	94.3	Very high	92.4	Very high	30 Å²	30	85 Å²	85	16%	0.157	37%	0.37	C	S	.	.	H	α-helix	trans	-62.2	-39.8	176.2	-175.6	59.1	0	0	0	112.3	V946 A950 V953 A985 I986 K993	V946-L989 HydrophobicContact CG1-CD1 4.04Å; A950-L989 HydrophobicContact CB-CD1 4.39Å; V953-L989 HydrophobicContact CG2-CB 4.48Å; V953-L989 HydrophobicContact CG2-CD2 4.06Å; A985-L989 VanDerWaalsContact O-CB 3.26Å; A985-L989 WeakPolarHBondContact O-CB 3.35Å; A985-L989 PolarHBondContact O-N 3.4Å; I986-L989 PolarHBondContact O-N 3.13Å; L989-K993 WeakPolarHBondContact O-CB 3.32Å; L989-K993 WeakPolarHBondContact O-CG 3.44Å; L989-K993 PolarHBondContact O-N 3.01Å
990	R	94.6	Very high	92	Very high	164 Å²	164	85.6 Å²	85.6	62%	0.619	37%	0.373	S	S	*	.	H	α-helix	trans	-64.5	-46.9	174.3	-75.7	176.2	178.6	-174.8	-0.5	111.2	I986 H987 G988 K993 L994	I986-R990 HydrophobicContact CG2-CG 4.38Å; I986-R990 WeakPolarHBondContact O-CB 3.42Å; I986-R990 VanDerWaalsContact O-CG 3.31Å; I986-R990 WeakPolarHBondContact O-CG 3.43Å; I986-R990 PolarHBondContact O-N 3.37Å; H987-R990 PolarHBondContact O-N 3.3Å; G988-R990 VanDerWaalsContact C-N 3.35Å; G988-R990 PolarHBondContact O-N 2.97Å; R990-K993 PolarHBondContact O-N 3.19Å; R990-L994 WeakPolarHBondContact O-CG 3.25Å; R990-L994 PolarHBondContact O-N 3.23Å
991	R	93.5	Very high	91.4	Very high	152 Å²	152	82.8 Å²	82.8	57%	0.574	37%	0.369	S	S	*	.	H	α-helix	trans	-57.7	-52.9	176.7	-172.6	172.6	178.1	173.9	-2.3	111	H987 G988 K993 L994 D995	H987-R991 WeakPolarHBondContact O-CB 3.4Å; H987-R991 PolarHBondContact O-N 2.95Å; G988-R991 PolarHBondContact O-N 3.36Å; R991-K993 VanDerWaalsContact C-N 3.33Å; R991-K993 PolarHBondContact O-N 3.25Å; R991-L994 WeakPolarHBondContact O-CB 3.15Å; R991-L994 PolarHBondContact O-N 2.93Å; R991-L994 VanDerWaalsContact O-N 3.09Å; R991-D995 PolarHBondContact O-N 2.76Å
992	M	90.8	Very high	90.7	Very high	21 Å²	21	82.1 Å²	82.1	10%	0.103	38%	0.376	C	S	.	.	H	α-helix	trans	-62.8	-34.3	178.5	-62.8	-65.5	91.9	0	0	113.4	L942 K945 V946 Y949 G988 D995 Q996	L942-M992 HydrophobicContact CD1-CB 3.96Å; L942-M992 HydrophobicContact CD1-CG 4.32Å; L942-M992 HydrophobicContact CD1-SD 3.59Å; L942-M992 VanDerWaalsContact CD1-SD 3.59Å; K945-M992 HydrophobicContact CB-CG 4.33Å; K945-M992 HydrophobicContact CB-SD 3.9Å; K945-M992 HydrophobicContact CD-SD 3.69Å; K945-M992 HydrophobicContact CG-SD 4.41Å; V946-M992 HydrophobicContact CG2-CB 3.69Å; Y949-M992 HydrophobicContact CD2-CG 3.57Å; Y949-M992 HydrophobicContact CE2-CG 3.57Å; Y949-M992 HydrophobicContact CE2-SD 4.2Å; G988-M992 WeakPolarHBondContact O-CG 3.03Å; G988-M992 PolarHBondContact O-N 2.78Å; M992-D995 WeakPolarHBondContact CE-OD2 3.32Å; M992-Q996 VanDerWaalsContact O-CB 3.31Å; M992-Q996 WeakPolarHBondContact O-CB 3.48Å; M992-Q996 PolarHBondContact O-N 2.85Å
993	K	91.8	Very high	89.7	Confident	114 Å²	114	80.4 Å²	80.4	50%	0.496	37%	0.373	S	S	.	.	H	α-helix	trans	-71.9	-30.9	173	-80.2	-171.3	169.8	-169.8	0	113.7	L989 R990 R991 R997	L989-K993 WeakPolarHBondContact O-CB 3.32Å; L989-K993 WeakPolarHBondContact O-CG 3.44Å; L989-K993 PolarHBondContact O-N 3.01Å; R990-K993 PolarHBondContact O-N 3.19Å; R991-K993 VanDerWaalsContact C-N 3.33Å; R991-K993 PolarHBondContact O-N 3.25Å; K993-R997 WeakPolarHBondContact O-CG 3.24Å; K993-R997 PolarHBondContact O-N 3.25Å
994	L	92.4	Very high	88.5	Confident	99 Å²	99	78.7 Å²	78.7	52%	0.518	36%	0.364	S	S	.	.	H	α-helix	trans	-69.9	-44	172	-73.2	168.9	0	0	0	110.8	R990 R991 Q996 R997 K998	R990-L994 WeakPolarHBondContact O-CG 3.25Å; R990-L994 PolarHBondContact O-N 3.23Å; R991-L994 WeakPolarHBondContact O-CB 3.15Å; R991-L994 PolarHBondContact O-N 2.93Å; R991-L994 VanDerWaalsContact O-N 3.09Å; L994-Q996 VanDerWaalsContact C-N 3.29Å; L994-Q996 PolarHBondContact O-N 3.24Å; L994-R997 WeakPolarHBondContact O-CB 3.11Å; L994-R997 PolarHBondContact O-N 3.44Å; L994-K998 WeakPolarHBondContact O-CG 3.38Å; L994-K998 PolarHBondContact O-N 3.43Å; L994-K998 VanDerWaalsContact O-N 3.14Å
995	D	91.8	Very high	87.5	Confident	37 Å²	37	74.8 Å²	74.8	20%	0.198	36%	0.36	C	S	.	.	H	α-helix	trans	-64.9	-35.5	175.8	-62.3	-36.2	0	0	0	111.2	L942 R991 M992 R997 K998 V999	L942-D995 HydrophobicContact CD2-CB 3.98Å; R991-D995 PolarHBondContact O-N 2.76Å; M992-D995 WeakPolarHBondContact CE-OD2 3.32Å; D995-R997 VanDerWaalsContact C-N 3.31Å; D995-R997 PolarHBondContact O-N 3.38Å; D995-K998 PolarHBondContact O-N 2.65Å; D995-K998 WeakPolarHBondContact OD1-CE 3.47Å; D995-K998 IonicContact OD1-NZ 2.69Å; D995-K998 PolarHBondContact OD1-NZ 3.18Å; D995-V999 WeakPolarHBondContact O-CG2 3.46Å; D995-V999 PolarHBondContact O-N 2.99Å
996	Q	89.6	Confident	86.1	Confident	42 Å²	42	77.3 Å²	77.3	20%	0.196	37%	0.372	C	S	.	.	H	α-helix	trans	-61.4	-39	174.3	-176	168.6	16.6	0	0	112	L942 N943 M992 L994 V999 Q1000	L942-Q996 HydrophobicContact CD2-CB 4.11Å; L942-Q996 HydrophobicContact CG-CB 4.17Å; N943-Q996 PolarHBondContact OD1-NE2 3.46Å; M992-Q996 VanDerWaalsContact O-CB 3.31Å; M992-Q996 WeakPolarHBondContact O-CB 3.48Å; M992-Q996 PolarHBondContact O-N 2.85Å; L994-Q996 VanDerWaalsContact C-N 3.29Å; L994-Q996 PolarHBondContact O-N 3.24Å; Q996-V999 PolarHBondContact O-N 3.05Å; Q996-Q1000 WeakPolarHBondContact O-CB 3.49Å; Q996-Q1000 PolarHBondContact O-N 3.26Å
997	R	88.7	Confident	84.6	Confident	159 Å²	159	77.6 Å²	77.6	60%	0.6	38%	0.376	S	S	*	.	H	α-helix	trans	-63.9	-51.5	174	-71.4	171.9	177.1	-167.1	-5.4	111.4	K993 L994 D995 V999 Q1000 D1001	K993-R997 WeakPolarHBondContact O-CG 3.24Å; K993-R997 PolarHBondContact O-N 3.25Å; L994-R997 WeakPolarHBondContact O-CB 3.11Å; L994-R997 PolarHBondContact O-N 3.44Å; D995-R997 VanDerWaalsContact C-N 3.31Å; D995-R997 PolarHBondContact O-N 3.38Å; R997-V999 PolarHBondContact O-N 3.01Å; R997-V999 VanDerWaalsContact O-N 3.15Å; R997-Q1000 CarbonylContact O-C 3.56Å; R997-Q1000 WeakPolarHBondContact O-CA 3.47Å; R997-Q1000 PolarHBondContact O-N 2.85Å; R997-D1001 WeakPolarHBondContact O-CB 3.37Å; R997-D1001 PolarHBondContact O-N 3.48Å; R997-D1001 VanDerWaalsContact O-OD2 3.05Å
998	K	89.4	Confident	83	Confident	121 Å²	121	75.2 Å²	75.2	53%	0.526	37%	0.367	S	S	.	.	H	α-helix	trans	-51.3	-43.2	176.6	-61.4	171.6	-167	164.9	0	112.4	L994 D995 S1002	L994-K998 WeakPolarHBondContact O-CG 3.38Å; L994-K998 PolarHBondContact O-N 3.43Å; L994-K998 VanDerWaalsContact O-N 3.14Å; D995-K998 PolarHBondContact O-N 2.65Å; D995-K998 WeakPolarHBondContact OD1-CE 3.47Å; D995-K998 IonicContact OD1-NZ 2.69Å; D995-K998 PolarHBondContact OD1-NZ 3.18Å; K998-S1002 WeakPolarHBondContact O-CB 3.33Å; K998-S1002 PolarHBondContact O-N 2.67Å; K998-S1002 VanDerWaalsContact O-N 3.12Å; K998-S1002 PolarHBondContact O-OG 2.87Å
999	V	85.1	Confident	81.4	Confident	14 Å²	14	80.3 Å²	80.3	9%	0.085	39%	0.391	C	S	.	.	H	α-helix	trans	-65.1	-50.6	176.1	171.2	0	0	0	0	110.4	H935 M938 E939 L942 D995 Q996 R997 D1001 S1002 A1003	H935-V999 PolarHBondContact CD2-O 2.83Å; H935-V999 VanDerWaalsContact NE2-CG1 3.32Å; H935-V999 WeakPolarHBondContact NE2-CG1 3.47Å; H935-V999 PolarHBondContact NE2-O 2.88Å; M938-V999 HydrophobicContact CE-CG1 4.15Å; M938-V999 HydrophobicContact CE-CG2 3.84Å; M938-V999 HydrophobicContact CG-CG1 4.36Å; M938-V999 HydrophobicContact CG-CG2 3.93Å; M938-V999 HydrophobicContact SD-CG2 3.77Å; E939-V999 HydrophobicContact CB-CG1 4.29Å; L942-V999 HydrophobicContact CD2-CG2 4.12Å; D995-V999 WeakPolarHBondContact O-CG2 3.46Å; D995-V999 PolarHBondContact O-N 2.99Å; Q996-V999 PolarHBondContact O-N 3.05Å; R997-V999 PolarHBondContact O-N 3.01Å; R997-V999 VanDerWaalsContact O-N 3.15Å; V999-D1001 PolarHBondContact O-N 3.46Å; V999-S1002 WeakPolarHBondContact O-CB 3.33Å; V999-S1002 PolarHBondContact O-N 2.89Å; V999-A1003 PolarHBondContact O-N 2.77Å
1000	Q	82.9	Confident	79.9	Confident	97 Å²	97	81 Å²	81	45%	0.453	40%	0.4	S	S	.	.	H	α-helix	trans	-60.1	-45.9	179.3	-170.6	177.3	-1	0	0	112.4	Q996 R997 S1002 A1003 N1004	Q996-Q1000 WeakPolarHBondContact O-CB 3.49Å; Q996-Q1000 PolarHBondContact O-N 3.26Å; R997-Q1000 CarbonylContact O-C 3.56Å; R997-Q1000 WeakPolarHBondContact O-CA 3.47Å; R997-Q1000 PolarHBondContact O-N 2.85Å; Q1000-S1002 VanDerWaalsContact C-N 3.27Å; Q1000-S1002 PolarHBondContact O-N 3.06Å; Q1000-A1003 PolarHBondContact O-N 3.49Å; Q1000-A1003 VanDerWaalsContact O-N 3.1Å; Q1000-N1004 PolarHBondContact O-N 2.79Å; Q1000-N1004 PolarHBondContact O-ND2 2.86Å; Q1000-N1004 PolarHBondContact O-OD1 3.2Å
1001	D	82.1	Confident	78.4	Confident	90 Å²	90	78.3 Å²	78.3	48%	0.481	39%	0.394	S	S	.	.	H	α-helix	trans	-58.3	-39.8	176.1	-60.8	-32.9	0	0	0	111.2	R997 V999 A1003 N1004 T1005	R997-D1001 WeakPolarHBondContact O-CB 3.37Å; R997-D1001 PolarHBondContact O-N 3.48Å; R997-D1001 VanDerWaalsContact O-OD2 3.05Å; V999-D1001 PolarHBondContact O-N 3.46Å; D1001-A1003 PolarHBondContact O-N 3.34Å; D1001-N1004 PolarHBondContact O-N 2.86Å; D1001-T1005 PolarHBondContact O-N 2.98Å; D1001-T1005 VanDerWaalsContact O-N 3.11Å
1002	S	78	Confident	76.8	Confident	77 Å²	77	74.3 Å²	74.3	54%	0.538	39%	0.386	S	S	.	.	H	α-helix	trans	-64.1	-36	176.1	-58.2	0	0	0	0	113	K998 V999 Q1000 T1005	K998-S1002 WeakPolarHBondContact O-CB 3.33Å; K998-S1002 PolarHBondContact O-N 2.67Å; K998-S1002 VanDerWaalsContact O-N 3.12Å; K998-S1002 PolarHBondContact O-OG 2.87Å; V999-S1002 WeakPolarHBondContact O-CB 3.33Å; V999-S1002 PolarHBondContact O-N 2.89Å; Q1000-S1002 VanDerWaalsContact C-N 3.27Å; Q1000-S1002 PolarHBondContact O-N 3.06Å; S1002-T1005 PolarHBondContact O-OG1 3.1Å
1003	A	73.4	Confident	75.2	Confident	21 Å²	21	79.4 Å²	79.4	17%	0.174	41%	0.413	C	S	.	.	H	α-helix	trans	-74.3	-41.4	171.2	0	0	0	0	0	112.4	H935 V999 Q1000 D1001 T1005 L1006 V1007	H935-A1003 WeakPolarHBondContact CE1-CB 3.47Å; H935-A1003 WeakPolarHBondContact NE2-CB 3.41Å; V999-A1003 PolarHBondContact O-N 2.77Å; Q1000-A1003 PolarHBondContact O-N 3.49Å; Q1000-A1003 VanDerWaalsContact O-N 3.1Å; D1001-A1003 PolarHBondContact O-N 3.34Å; A1003-T1005 VanDerWaalsContact C-N 3.28Å; A1003-T1005 PolarHBondContact O-N 3.32Å; A1003-L1006 PolarHBondContact O-N 3.18Å; A1003-V1007 WeakPolarHBondContact O-CB 3.31Å; A1003-V1007 WeakPolarHBondContact O-CG2 3.48Å; A1003-V1007 PolarHBondContact O-N 2.95Å
1004	N	69.3	Low	73.6	Confident	56 Å²	56	79.9 Å²	79.9	30%	0.299	42%	0.421	S	S	.	.	H	α-helix	trans	-55.1	-44.6	-179.2	-69.3	-19.4	0	0	0	110.7	Q1000 D1001 L1006 V1007 D1008	Q1000-N1004 PolarHBondContact O-N 2.79Å; Q1000-N1004 PolarHBondContact O-ND2 2.86Å; Q1000-N1004 PolarHBondContact O-OD1 3.2Å; D1001-N1004 PolarHBondContact O-N 2.86Å; N1004-L1006 VanDerWaalsContact C-N 3.28Å; N1004-L1006 PolarHBondContact O-N 3.39Å; N1004-V1007 PolarHBondContact O-N 3.46Å; N1004-D1008 WeakPolarHBondContact O-CB 3.47Å; N1004-D1008 PolarHBondContact O-N 3.31Å
1005	T	73.6	Confident	72	Confident	97 Å²	97	81.1 Å²	81.1	60%	0.595	42%	0.424	S	S	*	.	H	α-helix	trans	-57.5	-35.6	176.2	60.6	0	0	0	0	114.5	D1001 S1002 A1003 L1009	D1001-T1005 PolarHBondContact O-N 2.98Å; D1001-T1005 VanDerWaalsContact O-N 3.11Å; S1002-T1005 PolarHBondContact O-OG1 3.1Å; A1003-T1005 VanDerWaalsContact C-N 3.28Å; A1003-T1005 PolarHBondContact O-N 3.32Å; T1005-L1009 PolarHBondContact O-N 3.37Å
1006	L	63.4	Low	70.3	Confident	61 Å²	61	84.1 Å²	84.1	32%	0.319	44%	0.439	S	S	.	.	H	α-helix	trans	-80.9	-34.1	179.1	-172.9	123.4	0	0	0	112.6	K928 A1003 N1004	K928-L1006 HydrophobicContact CG-CD1 4.38Å; A1003-L1006 PolarHBondContact O-N 3.18Å; N1004-L1006 VanDerWaalsContact C-N 3.28Å; N1004-L1006 PolarHBondContact O-N 3.39Å
1007	V	64.2	Low	68.8	Low	45 Å²	45	86.6 Å²	86.6	27%	0.273	46%	0.457	S	S	.	.	H	α-helix	trans	-79.7	-37.8	-179.9	170.5	0	0	0	0	111.3	A1003 N1004 A1010 K1011	A1003-V1007 WeakPolarHBondContact O-CB 3.31Å; A1003-V1007 WeakPolarHBondContact O-CG2 3.48Å; A1003-V1007 PolarHBondContact O-N 2.95Å; N1004-V1007 PolarHBondContact O-N 3.46Å; V1007-A1010 WeakPolarHBondContact O-CA 3.49Å; V1007-A1010 WeakPolarHBondContact O-CB 3.43Å; V1007-A1010 PolarHBondContact O-N 2.9Å; V1007-K1011 HydrophobicContact CG1-CD 3.94Å; V1007-K1011 HydrophobicContact CG1-CG 4.26Å; V1007-K1011 WeakPolarHBondContact O-CG 3.37Å; V1007-K1011 PolarHBondContact O-N 3.05Å
1008	D	60.3	Low	67.6	Low	70 Å²	70	85.3 Å²	85.3	37%	0.374	46%	0.456	S	S	.	.	H	α-helix	trans	-74.6	-27.4	179.9	-63.6	-24.3	0	0	0	111.4	N1004 A1010 K1011 T1012	N1004-D1008 WeakPolarHBondContact O-CB 3.47Å; N1004-D1008 PolarHBondContact O-N 3.31Å; D1008-A1010 PolarHBondContact O-N 2.86Å; D1008-K1011 PolarHBondContact O-N 2.75Å; D1008-K1011 IonicContact OD1-NZ 3.91Å; D1008-T1012 VanDerWaalsContact O-CB 3.29Å; D1008-T1012 WeakPolarHBondContact O-CB 3.44Å; D1008-T1012 VanDerWaalsContact O-CG2 3.22Å; D1008-T1012 WeakPolarHBondContact O-CG2 3.49Å; D1008-T1012 PolarHBondContact O-N 3.42Å; D1008-T1012 PolarHBondContact O-OG1 2.88Å
1009	L	61.3	Low	66.5	Low	119 Å²	119	81.5 Å²	81.5	62%	0.623	44%	0.444	S	S	*	.	H	α-helix	trans	-61.2	-31	164.3	-90.3	169.7	0	0	0	113	T1005 T1012 L1013	T1005-L1009 PolarHBondContact O-N 3.37Å; L1009-T1012 PolarHBondContact O-OG1 2.95Å; L1009-L1013 WeakPolarHBondContact O-CD1 3.46Å; L1009-L1013 WeakPolarHBondContact O-CG 3.43Å
1010	A	61.7	Low	65.7	Low	44 Å²	44	85.3 Å²	85.3	36%	0.364	46%	0.464	S	S	.	.	H	α-helix	trans	-79.6	-46.8	173	0	0	0	0	0	111.5	V1007 D1008 T1012 L1013 D1014	V1007-A1010 WeakPolarHBondContact O-CA 3.49Å; V1007-A1010 WeakPolarHBondContact O-CB 3.43Å; V1007-A1010 PolarHBondContact O-N 2.9Å; D1008-A1010 PolarHBondContact O-N 2.86Å; A1010-T1012 PolarHBondContact O-N 3.23Å; A1010-L1013 PolarHBondContact O-N 2.66Å; A1010-D1014 PolarHBondContact O-N 3.05Å
1011	K	63.3	Low	65.1	Low	109 Å²	109	86 Å²	86	47%	0.474	47%	0.47	S	S	.	.	H	α-helix	trans	-66.2	-31.5	-179.6	-68.4	173.3	-176.6	158.7	0	113.7	V1007 D1008 L1013 H1015	V1007-K1011 HydrophobicContact CG1-CD 3.94Å; V1007-K1011 HydrophobicContact CG1-CG 4.26Å; V1007-K1011 WeakPolarHBondContact O-CG 3.37Å; V1007-K1011 PolarHBondContact O-N 3.05Å; D1008-K1011 PolarHBondContact O-N 2.75Å; D1008-K1011 IonicContact OD1-NZ 3.91Å; K1011-L1013 VanDerWaalsContact C-N 3.34Å; K1011-H1015 WeakPolarHBondContact O-CA 3.48Å; K1011-H1015 WeakPolarHBondContact O-CB 3.46Å; K1011-H1015 PolarHBondContact O-N 3.04Å
1012	T	60.5	Low	64.9	Low	67 Å²	67	87.3 Å²	87.3	41%	0.411	47%	0.472	S	S	.	.	I	π-helix	trans	-68	-35.2	174.7	47.4	0	0	0	0	111.7	D1008 L1009 A1010 I1016	D1008-T1012 VanDerWaalsContact O-CB 3.29Å; D1008-T1012 WeakPolarHBondContact O-CB 3.44Å; D1008-T1012 VanDerWaalsContact O-CG2 3.22Å; D1008-T1012 WeakPolarHBondContact O-CG2 3.49Å; D1008-T1012 PolarHBondContact O-N 3.42Å; D1008-T1012 PolarHBondContact O-OG1 2.88Å; L1009-T1012 PolarHBondContact O-OG1 2.95Å; A1010-T1012 PolarHBondContact O-N 3.23Å; T1012-I1016 HydrophobicContact CG2-CD1 3.89Å
1013	L	56.8	Low	64.8	Low	129 Å²	129	86.3 Å²	86.3	68%	0.675	47%	0.465	S	S	*	.	I	π-helix	trans	-75.5	-42.4	176.2	-70.6	172.3	0	0	0	113.2	L1009 A1010 K1011 T1017	L1009-L1013 WeakPolarHBondContact O-CD1 3.46Å; L1009-L1013 WeakPolarHBondContact O-CG 3.43Å; A1010-L1013 PolarHBondContact O-N 2.66Å; K1011-L1013 VanDerWaalsContact C-N 3.34Å; L1013-T1017 PolarHBondContact O-OG1 2.94Å
1014	D	58	Low	65.1	Low	123 Å²	123	88.4 Å²	88.4	66%	0.658	48%	0.478	S	S	*	.	I	π-helix	trans	-80.2	-52.7	178.1	-84.3	-27.2	0	0	0	112.2	A1010 F1018	A1010-D1014 PolarHBondContact O-N 3.05Å; D1014-F1018 WeakPolarHBondContact O-CB 3.24Å; D1014-F1018 PolarHBondContact O-N 2.89Å; D1014-F1018 VanDerWaalsContact O-N 3.13Å
1015	H	58.5	Low	65.6	Low	125 Å²	125	91 Å²	91	58%	0.579	49%	0.491	S	S	*	.	I	π-helix	trans	-79.1	-47.3	-162.9	-143.1	-66.1	0	0	0	112.7	K1011 S1019	K1011-H1015 WeakPolarHBondContact O-CA 3.48Å; K1011-H1015 WeakPolarHBondContact O-CB 3.46Å; K1011-H1015 PolarHBondContact O-N 3.04Å; H1015-S1019 PolarHBondContact ND1-OG 2.91Å; H1015-S1019 VanDerWaalsContact O-CB 3.26Å; H1015-S1019 WeakPolarHBondContact O-CB 3.32Å; H1015-S1019 PolarHBondContact O-N 3.1Å; H1015-S1019 PolarHBondContact O-OG 3.08Å
1016	I	57.4	Low	66	Low	100 Å²	100	95 Å²	95	51%	0.513	50%	0.496	S	S	.	.	I	π-helix	trans	-67	-48.1	-175.1	-58	178	0	0	0	110.2	T1012	T1012-I1016 HydrophobicContact CG2-CD1 3.89Å
1017	T	56.5	Low	66.9	Low	94 Å²	94	98.3 Å²	98.3	58%	0.577	51%	0.509	S	S	*	.	H	α-helix	trans	-78.9	-28.7	-178.1	23.9	0	0	0	0	115	L1013 L1021	L1013-T1017 PolarHBondContact O-OG1 2.94Å; T1017-L1021 VanDerWaalsContact O-CB 3.31Å; T1017-L1021 WeakPolarHBondContact O-CB 3.44Å
1018	F	64.6	Low	67.7	Low	133 Å²	133	99.5 Å²	99.5	58%	0.583	52%	0.517	S	S	*	.	H	α-helix	trans	-95.1	-38.5	-178.2	-161.4	-113	0	0	0	113.9	D1014 K1022	D1014-F1018 WeakPolarHBondContact O-CB 3.24Å; D1014-F1018 PolarHBondContact O-N 2.89Å; D1014-F1018 VanDerWaalsContact O-N 3.13Å; F1018-K1022 HydrophobicContact CE1-CD 4.41Å; F1018-K1022 WeakPolarHBondContact O-CB 3.41Å; F1018-K1022 PolarHBondContact O-N 3.44Å
1019	S	66.6	Low	68.8	Low	40 Å²	40	102.9 Å²	102.9	28%	0.28	53%	0.529	S	S	.	.	H	α-helix	trans	-75.6	-40.3	-176.4	74.9	0	0	0	0	112.7	H1015 K1022 S1023	H1015-S1019 PolarHBondContact ND1-OG 2.91Å; H1015-S1019 VanDerWaalsContact O-CB 3.26Å; H1015-S1019 WeakPolarHBondContact O-CB 3.32Å; H1015-S1019 PolarHBondContact O-N 3.1Å; H1015-S1019 PolarHBondContact O-OG 3.08Å; S1019-K1022 PolarHBondContact O-N 2.7Å; S1019-S1023 WeakPolarHBondContact O-CB 3.36Å; S1019-S1023 PolarHBondContact O-N 3.21Å; S1019-S1023 PolarHBondContact O-OG 2.68Å
1020	D	66.9	Low	69.9	Low	94 Å²	94	103.2 Å²	103.2	50%	0.503	53%	0.529	S	S	.	.	H	α-helix	trans	-74.5	-35.5	-179.8	-65.9	-28.5	0	0	0	112.4	K1022 S1023 S1024	D1020-K1022 VanDerWaalsContact C-N 3.33Å; D1020-K1022 PolarHBondContact O-N 3.18Å; D1020-S1023 WeakPolarHBondContact CA-OG 3.34Å; D1020-S1023 PolarHBondContact O-N 2.94Å; D1020-S1023 PolarHBondContact O-OG 2.91Å; D1020-S1023 VanDerWaalsContact O-OG 3.05Å; D1020-S1024 WeakPolarHBondContact O-CB 3.39Å; D1020-S1024 PolarHBondContact O-N 3.37Å
1021	L	71	Confident	71.1	Confident	112 Å²	112	107.8 Å²	107.8	59%	0.586	54%	0.54	S	S	*	.	H	α-helix	trans	-63.6	-41.3	171.4	-162.1	82.8	0	0	0	110.9	T1017 L1025	T1017-L1021 VanDerWaalsContact O-CB 3.31Å; T1017-L1021 WeakPolarHBondContact O-CB 3.44Å; L1021-L1025 HydrophobicContact CD2-CD1 4.41Å; L1021-L1025 HydrophobicContact CG-CD1 4.19Å; L1021-L1025 VanDerWaalsContact O-CB 3.25Å; L1021-L1025 WeakPolarHBondContact O-CB 3.26Å; L1021-L1025 VanDerWaalsContact O-CG 3.3Å; L1021-L1025 WeakPolarHBondContact O-CG 3.33Å; L1021-L1025 PolarHBondContact O-N 3.41Å
1022	K	76.7	Confident	72.1	Confident	117 Å²	117	107.6 Å²	107.6	51%	0.509	54%	0.544	S	S	.	.	H	α-helix	trans	-70.7	-34.4	179.2	-173.7	174.9	-178.5	177.8	0	112.8	F1018 S1019 D1020 R1026	F1018-K1022 HydrophobicContact CE1-CD 4.41Å; F1018-K1022 WeakPolarHBondContact O-CB 3.41Å; F1018-K1022 PolarHBondContact O-N 3.44Å; S1019-K1022 PolarHBondContact O-N 2.7Å; D1020-K1022 VanDerWaalsContact C-N 3.33Å; D1020-K1022 PolarHBondContact O-N 3.18Å; K1022-R1026 WeakPolarHBondContact O-CB 3.32Å; K1022-R1026 WeakPolarHBondContact O-CG 3.23Å; K1022-R1026 PolarHBondContact O-N 2.96Å; K1022-R1026 VanDerWaalsContact O-N 3.15Å
1023	S	77.1	Confident	73.4	Confident	57 Å²	57	108.2 Å²	108.2	40%	0.399	54%	0.544	S	S	.	.	H	α-helix	trans	-73.6	-43.4	175.1	71.1	0	0	0	0	111.5	S1019 D1020 R1026 Q1027	S1019-S1023 WeakPolarHBondContact O-CB 3.36Å; S1019-S1023 PolarHBondContact O-N 3.21Å; S1019-S1023 PolarHBondContact O-OG 2.68Å; D1020-S1023 WeakPolarHBondContact CA-OG 3.34Å; D1020-S1023 PolarHBondContact O-N 2.94Å; D1020-S1023 PolarHBondContact O-OG 2.91Å; D1020-S1023 VanDerWaalsContact O-OG 3.05Å; S1023-R1026 WeakPolarHBondContact O-CB 3.44Å; S1023-R1026 PolarHBondContact O-N 2.86Å; S1023-Q1027 PolarHBondContact O-N 2.95Å
1024	S	79.5	Confident	74.7	Confident	65 Å²	65	108 Å²	108	46%	0.455	54%	0.543	S	S	.	.	H	α-helix	trans	-64	-42.7	175.8	-175.1	0	0	0	0	112.4	D1020 R1026 Q1027 T1028	D1020-S1024 WeakPolarHBondContact O-CB 3.39Å; D1020-S1024 PolarHBondContact O-N 3.37Å; S1024-R1026 VanDerWaalsContact C-N 3.35Å; S1024-R1026 PolarHBondContact O-N 2.97Å; S1024-Q1027 PolarHBondContact O-N 2.73Å; S1024-T1028 WeakPolarHBondContact O-CB 3.43Å; S1024-T1028 PolarHBondContact O-N 2.86Å; S1024-T1028 PolarHBondContact O-OG1 2.94Å
1025	L	79.3	Confident	75.9	Confident	109 Å²	109	106.9 Å²	106.9	57%	0.571	54%	0.536	S	S	*	.	H	α-helix	trans	-60.2	-41.9	171.2	-81.9	165.8	0	0	0	111.9	L1021 T1028 F1029	L1021-L1025 HydrophobicContact CD2-CD1 4.41Å; L1021-L1025 HydrophobicContact CG-CD1 4.19Å; L1021-L1025 VanDerWaalsContact O-CB 3.25Å; L1021-L1025 WeakPolarHBondContact O-CB 3.26Å; L1021-L1025 VanDerWaalsContact O-CG 3.3Å; L1021-L1025 WeakPolarHBondContact O-CG 3.33Å; L1021-L1025 PolarHBondContact O-N 3.41Å; L1025-T1028 PolarHBondContact O-N 3.42Å; L1025-F1029 VanDerWaalsContact O-CB 3.28Å; L1025-F1029 WeakPolarHBondContact O-CB 3.32Å; L1025-F1029 PolarHBondContact O-N 3.4Å
1026	R	81.9	Confident	77.1	Confident	182 Å²	182	108.3 Å²	108.3	69%	0.687	54%	0.537	S	S	*	.	H	α-helix	trans	-64	-42.7	175.6	-84.5	-176.8	164	-151.9	-5.7	112.9	K1022 S1023 S1024 M1030	K1022-R1026 WeakPolarHBondContact O-CB 3.32Å; K1022-R1026 WeakPolarHBondContact O-CG 3.23Å; K1022-R1026 PolarHBondContact O-N 2.96Å; K1022-R1026 VanDerWaalsContact O-N 3.15Å; S1023-R1026 WeakPolarHBondContact O-CB 3.44Å; S1023-R1026 PolarHBondContact O-N 2.86Å; S1024-R1026 VanDerWaalsContact C-N 3.35Å; S1024-R1026 PolarHBondContact O-N 2.97Å; R1026-M1030 WeakPolarHBondContact O-CB 3.25Å; R1026-M1030 WeakPolarHBondContact O-CG 3.46Å; R1026-M1030 PolarHBondContact O-N 2.98Å
1027	Q	82.1	Confident	78.3	Confident	130 Å²	130	106.6 Å²	106.6	61%	0.607	53%	0.527	S	S	*	.	H	α-helix	trans	-64.8	-42	175.1	-72.8	-170.9	2.4	0	0	112	S1023 S1024 M1030 K1031	S1023-Q1027 PolarHBondContact O-N 2.95Å; S1024-Q1027 PolarHBondContact O-N 2.73Å; Q1027-M1030 PolarHBondContact O-N 3.26Å; Q1027-K1031 WeakPolarHBondContact O-CG 3.31Å; Q1027-K1031 PolarHBondContact O-N 2.91Å
1028	T	81.8	Confident	79.4	Confident	71 Å²	71	110.4 Å²	110.4	44%	0.436	53%	0.531	S	S	.	.	H	α-helix	trans	-65.1	-43.5	178.6	-54.8	0	0	0	0	111.2	S1024 L1025 K1031 L1032	S1024-T1028 WeakPolarHBondContact O-CB 3.43Å; S1024-T1028 PolarHBondContact O-N 2.86Å; S1024-T1028 PolarHBondContact O-OG1 2.94Å; L1025-T1028 PolarHBondContact O-N 3.42Å; T1028-K1031 PolarHBondContact O-N 3.39Å; T1028-L1032 HydrophobicContact CG2-CD1 4.3Å; T1028-L1032 WeakPolarHBondContact O-CG 3.49Å; T1028-L1032 PolarHBondContact O-N 2.85Å
1029	F	84.2	Confident	80.2	Confident	140 Å²	140	108 Å²	108	61%	0.614	52%	0.524	S	S	*	.	H	α-helix	trans	-64	-44	175.9	-165.7	-99.4	0	0	0	111.8	L1025 K1031 L1032 L1033	L1025-F1029 VanDerWaalsContact O-CB 3.28Å; L1025-F1029 WeakPolarHBondContact O-CB 3.32Å; L1025-F1029 PolarHBondContact O-N 3.4Å; F1029-K1031 PolarHBondContact O-N 3.14Å; F1029-L1032 PolarHBondContact O-N 3.49Å; F1029-L1033 HydrophobicContact CD1-CD1 4.3Å; F1029-L1033 HydrophobicContact CE1-CD1 3.84Å; F1029-L1033 WeakPolarHBondContact O-CB 3.49Å; F1029-L1033 PolarHBondContact O-N 3.23Å
1030	M	84.5	Confident	80.8	Confident	126 Å²	126	112 Å²	112	62%	0.621	53%	0.534	S	S	*	.	H	α-helix	trans	-61.6	-39.9	174.4	-78.3	-67.2	-167.9	0	0	112.9	R1026 Q1027 L1033 L1034	R1026-M1030 WeakPolarHBondContact O-CB 3.25Å; R1026-M1030 WeakPolarHBondContact O-CG 3.46Å; R1026-M1030 PolarHBondContact O-N 2.98Å; Q1027-M1030 PolarHBondContact O-N 3.26Å; M1030-L1033 PolarHBondContact O-N 3.49Å; M1030-L1034 WeakPolarHBondContact O-CG 3.2Å; M1030-L1034 PolarHBondContact O-N 2.71Å
1031	K	85.5	Confident	81.4	Confident	140 Å²	140	111.3 Å²	111.3	61%	0.609	53%	0.532	S	S	*	.	H	α-helix	trans	-63.3	-45.1	174.1	-76.9	-179.9	177.3	-177.8	0	111.9	Q1027 T1028 F1029 L1033 L1034 I1035	Q1027-K1031 WeakPolarHBondContact O-CG 3.31Å; Q1027-K1031 PolarHBondContact O-N 2.91Å; T1028-K1031 PolarHBondContact O-N 3.39Å; F1029-K1031 PolarHBondContact O-N 3.14Å; K1031-L1033 VanDerWaalsContact C-N 3.32Å; K1031-L1033 PolarHBondContact O-N 3.45Å; K1031-L1034 PolarHBondContact O-N 3.41Å; K1031-I1035 WeakPolarHBondContact O-CD1 3.27Å; K1031-I1035 VanDerWaalsContact O-CG1 3.26Å; K1031-I1035 WeakPolarHBondContact O-CG1 3.35Å; K1031-I1035 PolarHBondContact O-N 3.01Å
1032	L	85.9	Confident	81.6	Confident	106 Å²	106	107.7 Å²	107.7	56%	0.555	52%	0.515	S	S	*	.	H	α-helix	trans	-62	-39.4	175.9	-75	166.4	0	0	0	112.2	T1028 F1029 I1035 Y1036	T1028-L1032 HydrophobicContact CG2-CD1 4.3Å; T1028-L1032 WeakPolarHBondContact O-CG 3.49Å; T1028-L1032 PolarHBondContact O-N 2.85Å; F1029-L1032 PolarHBondContact O-N 3.49Å; L1032-I1035 PolarHBondContact O-N 3.4Å; L1032-Y1036 WeakPolarHBondContact O-CB 3.37Å; L1032-Y1036 PolarHBondContact O-N 2.87Å
1033	L	86.1	Confident	81.3	Confident	79 Å²	79	110 Å²	110	41%	0.414	52%	0.521	S	S	.	.	H	α-helix	trans	-68.3	-40.1	178.5	-140.1	161.7	0	0	0	111.5	F1029 M1030 K1031 Y1036 E1037	F1029-L1033 HydrophobicContact CD1-CD1 4.3Å; F1029-L1033 HydrophobicContact CE1-CD1 3.84Å; F1029-L1033 WeakPolarHBondContact O-CB 3.49Å; F1029-L1033 PolarHBondContact O-N 3.23Å; M1030-L1033 PolarHBondContact O-N 3.49Å; K1031-L1033 VanDerWaalsContact C-N 3.32Å; K1031-L1033 PolarHBondContact O-N 3.45Å; L1033-Y1036 PolarHBondContact O-N 3.38Å; L1033-E1037 HydrophobicContact CD2-CG 4.12Å; L1033-E1037 WeakPolarHBondContact O-CG 3.25Å; L1033-E1037 PolarHBondContact O-N 3.38Å
1034	L	84.6	Confident	81	Confident	126 Å²	126	112.3 Å²	112.3	66%	0.66	53%	0.529	S	S	*	.	H	α-helix	trans	-64.8	-42.4	172.2	-77.1	170.5	0	0	0	112.6	M1030 K1031 Y1036 E1037 W1038	M1030-L1034 WeakPolarHBondContact O-CG 3.2Å; M1030-L1034 PolarHBondContact O-N 2.71Å; K1031-L1034 PolarHBondContact O-N 3.41Å; L1034-Y1036 VanDerWaalsContact C-N 3.32Å; L1034-Y1036 PolarHBondContact O-N 3.25Å; L1034-E1037 PolarHBondContact O-N 3.15Å; L1034-W1038 VanDerWaalsContact O-CB 3.27Å; L1034-W1038 WeakPolarHBondContact O-CB 3.32Å; L1034-W1038 PolarHBondContact O-N 3.49Å
1035	I	84.2	Confident	80.1	Confident	98 Å²	98	113 Å²	113	50%	0.503	53%	0.531	S	S	.	.	H	α-helix	trans	-62.9	-40.6	175.4	-69	162.9	0	0	0	110.6	K1031 L1032 W1038 N1039	K1031-I1035 WeakPolarHBondContact O-CD1 3.27Å; K1031-I1035 VanDerWaalsContact O-CG1 3.26Å; K1031-I1035 WeakPolarHBondContact O-CG1 3.35Å; K1031-I1035 PolarHBondContact O-N 3.01Å; L1032-I1035 PolarHBondContact O-N 3.4Å; I1035-W1038 PolarHBondContact O-N 2.86Å; I1035-N1039 WeakPolarHBondContact O-CB 3.4Å; I1035-N1039 PolarHBondContact O-N 3.2Å
1036	Y	83.2	Confident	78.9	Confident	155 Å²	155	114.4 Å²	114.4	61%	0.608	54%	0.535	S	S	*	.	H	α-helix	trans	-64.4	-48.4	177	-174.2	-93.5	0	0	0	112	L1032 L1033 L1034 W1038 N1039 R1040	L1032-Y1036 WeakPolarHBondContact O-CB 3.37Å; L1032-Y1036 PolarHBondContact O-N 2.87Å; L1033-Y1036 PolarHBondContact O-N 3.38Å; L1034-Y1036 VanDerWaalsContact C-N 3.32Å; L1034-Y1036 PolarHBondContact O-N 3.25Å; Y1036-W1038 PolarHBondContact O-N 3.42Å; Y1036-N1039 PolarHBondContact O-N 2.61Å; Y1036-R1040 WeakPolarHBondContact O-CB 3.26Å; Y1036-R1040 PolarHBondContact O-N 2.92Å
1037	E	82.8	Confident	77.3	Confident	65 Å²	65	115.9 Å²	115.9	30%	0.304	54%	0.54	S	S	.	.	H	α-helix	trans	-65.4	-37.3	176.9	-70.5	-62.6	101.2	0	0	112.3	L1033 L1034 R1040 V1041	L1033-E1037 HydrophobicContact CD2-CG 4.12Å; L1033-E1037 WeakPolarHBondContact O-CG 3.25Å; L1033-E1037 PolarHBondContact O-N 3.38Å; L1034-E1037 PolarHBondContact O-N 3.15Å; E1037-R1040 WeakPolarHBondContact O-CB 3.48Å; E1037-R1040 PolarHBondContact O-N 3.1Å; E1037-R1040 IonicContact OE1-CZ 3.15Å; E1037-R1040 IonicContact OE1-NH1 2.69Å; E1037-R1040 PolarHBondContact OE1-NH1 3.14Å; E1037-R1040 IonicContact OE2-CZ 2.67Å; E1037-R1040 IonicContact OE2-NH1 3.17Å; E1037-R1040 PolarHBondContact OE2-NH1 3.32Å; E1037-R1040 IonicContact OE2-NH2 3.51Å; E1037-R1040 PolarHBondContact OE2-NH2 2.96Å; E1037-V1041 WeakPolarHBondContact O-CG2 3.27Å; E1037-V1041 PolarHBondContact O-N 3.41Å
1038	W	79.1	Confident	75.5	Confident	174 Å²	174	120.1 Å²	120.1	66%	0.659	55%	0.551	S	S	*	*	H	α-helix	trans	-65.1	-47.5	176.9	-161.5	82.5	0	0	0	111.3	L1034 I1035 Y1036 R1040 V1041 V1042	L1034-W1038 VanDerWaalsContact O-CB 3.27Å; L1034-W1038 WeakPolarHBondContact O-CB 3.32Å; L1034-W1038 PolarHBondContact O-N 3.49Å; I1035-W1038 PolarHBondContact O-N 2.86Å; Y1036-W1038 PolarHBondContact O-N 3.42Å; W1038-R1040 VanDerWaalsContact C-N 3.28Å; W1038-R1040 PolarHBondContact O-N 3.46Å; W1038-V1041 PolarHBondContact O-N 3.25Å; W1038-V1041 VanDerWaalsContact O-N 3.12Å; W1038-V1042 HydrophobicContact CD2-CG2 4.07Å; W1038-V1042 HydrophobicContact CE3-CG2 3.84Å; W1038-V1042 HydrophobicContact CH2-CG2 3.95Å; W1038-V1042 HydrophobicContact CZ2-CG2 4.16Å; W1038-V1042 HydrophobicContact CZ3-CG2 3.79Å; W1038-V1042 WeakPolarHBondContact O-CG2 3.41Å; W1038-V1042 PolarHBondContact O-N 3.04Å
1039	N	81.8	Confident	73.2	Confident	81 Å²	81	128.3 Å²	128.3	43%	0.433	58%	0.583	S	S	.	*	H	α-helix	trans	-60	-37.9	172.1	-74	-5.2	0	0	0	111.9	I1035 Y1036 V1041 V1042 Y1043	I1035-N1039 WeakPolarHBondContact O-CB 3.4Å; I1035-N1039 PolarHBondContact O-N 3.2Å; Y1036-N1039 PolarHBondContact O-N 2.61Å; N1039-V1041 VanDerWaalsContact C-N 3.32Å; N1039-V1041 PolarHBondContact O-N 2.7Å; N1039-V1042 PolarHBondContact O-N 3.09Å; N1039-Y1043 WeakPolarHBondContact O-CB 3.16Å; N1039-Y1043 PolarHBondContact O-N 3.3Å
1040	R	79	Confident	72.6	Confident	126 Å²	126	127.8 Å²	127.8	48%	0.475	58%	0.582	S	S	.	*	H	α-helix	trans	-65.7	-33.7	176.2	-156.6	-168.4	81.9	-147.8	-6.6	112.1	Y1036 E1037 W1038 N1044	Y1036-R1040 WeakPolarHBondContact O-CB 3.26Å; Y1036-R1040 PolarHBondContact O-N 2.92Å; E1037-R1040 WeakPolarHBondContact O-CB 3.48Å; E1037-R1040 PolarHBondContact O-N 3.1Å; E1037-R1040 IonicContact OE1-CZ 3.15Å; E1037-R1040 IonicContact OE1-NH1 2.69Å; E1037-R1040 PolarHBondContact OE1-NH1 3.14Å; E1037-R1040 IonicContact OE2-CZ 2.67Å; E1037-R1040 IonicContact OE2-NH1 3.17Å; E1037-R1040 PolarHBondContact OE2-NH1 3.32Å; E1037-R1040 IonicContact OE2-NH2 3.51Å; E1037-R1040 PolarHBondContact OE2-NH2 2.96Å; W1038-R1040 VanDerWaalsContact C-N 3.28Å; W1038-R1040 PolarHBondContact O-N 3.46Å; R1040-N1044 PolarHBondContact O-N 3.33Å; R1040-N1044 PolarHBondContact O-ND2 3.13Å
1041	V	78.9	Confident	72	Confident	79 Å²	79	127.8 Å²	127.8	48%	0.479	58%	0.58	S	S	.	*	H	α-helix	trans	-71.6	-50.8	173.5	170.5	0	0	0	0	110.4	E1037 W1038 N1039 Y1043 N1044 T1045	E1037-V1041 WeakPolarHBondContact O-CG2 3.27Å; E1037-V1041 PolarHBondContact O-N 3.41Å; W1038-V1041 PolarHBondContact O-N 3.25Å; W1038-V1041 VanDerWaalsContact O-N 3.12Å; N1039-V1041 VanDerWaalsContact C-N 3.32Å; N1039-V1041 PolarHBondContact O-N 2.7Å; V1041-Y1043 PolarHBondContact O-N 2.93Å; V1041-N1044 CarbonylContact O-C 3.59Å; V1041-N1044 WeakPolarHBondContact O-CA 3.33Å; V1041-N1044 PolarHBondContact O-N 3.18Å; V1041-T1045 HydrophobicContact CG1-CG2 4.46Å; V1041-T1045 PolarHBondContact O-N 3.49Å; V1041-T1045 PolarHBondContact O-OG1 2.84Å
1042	V	75.7	Confident	71.3	Confident	35 Å²	35	127.2 Å²	127.2	21%	0.212	58%	0.578	C	S	.	*	H	α-helix	trans	-57.4	-48.6	-179.1	174.2	0	0	0	0	111.6	W1038 N1039 N1044 T1045 E1046	W1038-V1042 HydrophobicContact CD2-CG2 4.07Å; W1038-V1042 HydrophobicContact CE3-CG2 3.84Å; W1038-V1042 HydrophobicContact CH2-CG2 3.95Å; W1038-V1042 HydrophobicContact CZ2-CG2 4.16Å; W1038-V1042 HydrophobicContact CZ3-CG2 3.79Å; W1038-V1042 WeakPolarHBondContact O-CG2 3.41Å; W1038-V1042 PolarHBondContact O-N 3.04Å; N1039-V1042 PolarHBondContact O-N 3.09Å; V1042-N1044 PolarHBondContact O-N 3.3Å; V1042-T1045 WeakPolarHBondContact CA-OG1 3.27Å; V1042-T1045 PolarHBondContact O-N 3.29Å; V1042-T1045 PolarHBondContact O-OG1 2.93Å; V1042-E1046 HydrophobicContact CG1-CG 4.25Å; V1042-E1046 WeakPolarHBondContact CG1-OE2 3.49Å; V1042-E1046 PolarHBondContact O-N 3.49Å
1043	Y	69.9	Low	70.4	Confident	166 Å²	166	128.4 Å²	128.4	65%	0.651	58%	0.58	S	S	*	*	H	α-helix	trans	-62.1	-23.9	176	-98	-91.7	0	0	0	114.2	N1039 V1041	N1039-Y1043 WeakPolarHBondContact O-CB 3.16Å; N1039-Y1043 PolarHBondContact O-N 3.3Å; V1041-Y1043 PolarHBondContact O-N 2.93Å
1044	N	71.5	Confident	69.4	Low	106 Å²	106	131.5 Å²	131.5	57%	0.567	59%	0.59	S	S	*	*	H	α-helix	trans	-89.4	-13.2	174.9	-84.3	-86.7	0	0	0	113.5	R1040 V1041 V1042	R1040-N1044 PolarHBondContact O-N 3.33Å; R1040-N1044 PolarHBondContact O-ND2 3.13Å; V1041-N1044 CarbonylContact O-C 3.59Å; V1041-N1044 WeakPolarHBondContact O-CA 3.33Å; V1041-N1044 PolarHBondContact O-N 3.18Å; V1042-N1044 PolarHBondContact O-N 3.3Å
1045	T	60.2	Low	68.4	Low	78 Å²	78	131.9 Å²	131.9	48%	0.479	59%	0.585	S	S	.	*	H	α-helix	trans	-98.1	-38.4	176.4	48	0	0	0	0	112.8	V1041 V1042 W1047 R1048	V1041-T1045 HydrophobicContact CG1-CG2 4.46Å; V1041-T1045 PolarHBondContact O-N 3.49Å; V1041-T1045 PolarHBondContact O-OG1 2.84Å; V1042-T1045 WeakPolarHBondContact CA-OG1 3.27Å; V1042-T1045 PolarHBondContact O-N 3.29Å; V1042-T1045 PolarHBondContact O-OG1 2.93Å; T1045-W1047 VanDerWaalsContact C-N 3.27Å; T1045-W1047 PolarHBondContact O-N 3.15Å; T1045-R1048 PolarHBondContact O-N 3.29Å
1046	E	54.9	Low	67.3	Low	140 Å²	140	134.3 Å²	134.3	65%	0.654	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-71.2	-20	176.9	-70.8	-173.5	129.4	0	0	113.2	V1042 R1048	V1042-E1046 HydrophobicContact CG1-CG 4.25Å; V1042-E1046 WeakPolarHBondContact CG1-OE2 3.49Å; V1042-E1046 PolarHBondContact O-N 3.49Å; E1046-R1048 VanDerWaalsContact C-N 3.32Å
1047	W	47.4	Very low	66.1	Low	212 Å²	212	132.7 Å²	132.7	80%	0.803	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-91.8	19.4	170.8	-82.7	91.9	0	0	0	113.8	T1045	T1045-W1047 VanDerWaalsContact C-N 3.27Å; T1045-W1047 PolarHBondContact O-N 3.15Å
1048	R	44.4	Very low	64.7	Low	220 Å²	220	138.3 Å²	138.3	83%	0.83	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-126.7	8.2	175.8	-90.9	-171	176.3	-135.4	-0.9	114.5	T1045 E1046	T1045-R1048 PolarHBondContact O-N 3.29Å; E1046-R1048 VanDerWaalsContact C-N 3.32Å
1049	H	33.5	Very low	63.4	Low	243 Å²	243	135.1 Å²	135.1	100%	1.125	61%	0.61	S	S	*	*			trans	-117.8	0	164.5	-88.4	-63.1	0	0	0	109.7

Retrieved 1,049 of 1,049 residues in 746.2 ms (Link to these results)

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