A0A096LPS8_POEFO Loading...

WWC family member 3

AlphaFold DB , UniProt , Accession A0A096LPS8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,150 aa.

						>A0A096LPS8_POEFO|A0A096LPS8
MPWVSSGKRRESSELPLPAGWEEARDYDGRVFYIDHNTRQTSWIDPRDRITKPLTFADCVGDELPLGWEEVYDQQVGVYYIDHINKTTQIENPRTQWRQEQERMLKEYLVVAQEALNAKKEMYLIKQQRLELAQREMLRLNELSGDNHSTTSTFSGSSSSAKYDPDQIKAEIACKRERLSRLKQELAQVKQELQYKEMGVETLQEIDRKMSSSQTNYKLDEAQAIFSELRSIKKSISTGEKERQDLIQSLAKLTANFQSSLSIGDAAGEVAISAATAGNPYNPQQYCETGCQTDIMGEYGSQDSSHLVDKVKLNWQYEEAKKKVQSIQHQLAQLDSESWSGRAEADRDRDFLQLLREKEALLQELILVSKQPLAAETQQQLEEERAKLEEEVQRAHTIQSQGANQRLLQQEKRNVLLRQLQEATRITTYLHSQLKSLSASSLTVSSSSSRGSLASSRGSLTSSRGSLSSISFSDIYGVPQYERHEGAAEPLDPHVRYLLPPESASRDCSVLSPEYLAQSKSKRSHDTPQSLASLSSRSSLSSLSPPSSPMDTPYHSAPPDCPLTQMTEEYMEQAGRGLLEELRAQSVSHGVLMGGEDMASLAALHQLDIKSQRESGAQTAFTSTGVTLRGNSGNRSSRRARRVSAGVSEDALATDSGVFEAWGKRPEEYDEVSYAKETSPASEPTQIQLGLLWESTSRSLRLHVLQLKSLNCSNVRESYKVYVKVHLIPLDASRACAFYCCTALEPQSQMTFNEGFRIPVPANALAACALQLSVCSLGPQAQEEVLGTAKLSLADCEGSAEMVYHCLRVQMLTDSQRTLSRRTHDNQEHEARSRATDTISTLLSRSSTHPEERGSELELQRSEKDVRGEATSERGWQAESAHSDYSNITAFPTHSSEGLSTEGVYLPTGGRCDQTPSRHFSVKVEKATMTEAPFPEPVQVRPKERGGRWGHASPFMRGSTIVRSHTFSPGARSHYVCRLYRSDSDSSTLPKKLPFVRNTLERRTLRYKQQSYRSSLAEQPTRTSLDLELDLQACRTRQRQLMEELSALRELKLRLEEPQASDANELPSWALRDERFRCLLREAHRQANQSKQEQRQEEAAERRLRKASKEVLQMRGQNQKEPLPVQTFREKMAFFTRPRFNIPPLPADDV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.6	Very low	32.2	Very low	221 Å²	221	151.1 Å²	151.1	100%	1.089	78%	0.779	S	S	*	*				0	135.3	0	-71.2	175.2	168.4	0	0	107.7
2	P	33.3	Very low	33.5	Very low	130 Å²	130	140 Å²	140	84%	0.844	73%	0.725	S	S	*	*			trans	-72.2	151.7	170.3	32.2	-33.7	0	0	0	110.2
3	W	30.1	Very low	34.9	Very low	230 Å²	230	135.5 Å²	135.5	87%	0.871	71%	0.713	S	S	*	*			trans	-94.1	140.7	-172.8	-65	68.1	0	0	0	110.7	S5	W3-S5 PolarHBondContact O-N 3.19Å
4	V	27.5	Very low	36.5	Very low	140 Å²	140	138.4 Å²	138.4	85%	0.848	72%	0.721	S	S	*	*			trans	-84.8	94.5	172.9	-179.8	0	0	0	0	108.3	S6	V4-S6 PolarHBondContact O-N 2.77Å
5	S	27.1	Very low	38.7	Very low	103 Å²	103	135.1 Å²	135.1	72%	0.72	70%	0.703	S	S	*	*			trans	-63.6	103.6	167	-65.4	0	0	0	0	109.3	W3 G7	W3-S5 PolarHBondContact O-N 3.19Å; S5-G7 PolarHBondContact O-N 2.91Å
6	S	27.2	Very low	41.3	Very low	118 Å²	118	133.3 Å²	133.3	83%	0.825	70%	0.702	S	S	*	*			trans	-77.1	53.3	174.7	59.8	0	0	0	0	111.7	V4	V4-S6 PolarHBondContact O-N 2.77Å
7	G	29.9	Very low	43.9	Very low	61 Å²	61	127.8 Å²	127.8	63%	0.629	67%	0.673	S	S	*	*			trans	-67.2	132.4	166.5	0	0	0	0	0	109.5	S5 R9	S5-G7 PolarHBondContact O-N 2.91Å; G7-R9 PolarHBondContact O-N 2.88Å
8	K	33.8	Very low	46.1	Very low	172 Å²	172	123.4 Å²	123.4	75%	0.748	65%	0.654	S	S	*	*			trans	-61.7	97.8	170.3	-69.4	175	-179.3	173.6	0	108.1	R10 D62	K8-R10 PolarHBondContact O-N 3.45Å; K8-D62 IonicContact NZ-OD2 3.67Å; K8-D62 PolarHBondContact NZ-OD2 2.88Å
9	R	33.2	Very low	48.1	Very low	233 Å²	233	121.7 Å²	121.7	88%	0.879	66%	0.659	S	S	*	*			trans	-65.3	124.6	173.5	-173.6	178.9	-70.8	-166.9	-2.2	107.9	G7	G7-R9 PolarHBondContact O-N 2.88Å
10	R	42.2	Very low	50	Low	80 Å²	80	117.4 Å²	117.4	30%	0.302	64%	0.644	S	S	.	*			trans	-51	137.9	-168.2	-47.6	-177.6	-169.9	-177.5	5.8	112.7	K8 S12 S13 D48 E69	K8-R10 PolarHBondContact O-N 3.45Å; R10-S12 PolarHBondContact O-N 2.79Å; R10-S13 PolarHBondContact O-N 3.11Å; R10-S13 PolarHBondContact O-OG 2.91Å; R10-D48 IonicContact CZ-OD2 2.73Å; R10-D48 IonicContact NH1-OD1 3.39Å; R10-D48 PolarHBondContact NH1-OD1 3.33Å; R10-D48 IonicContact NH1-OD2 3.69Å; R10-D48 PolarHBondContact NH1-OD2 3.19Å; R10-E69 IonicContact CZ-OE1 2.8Å; R10-E69 IonicContact NH2-OE1 3.48Å; R10-E69 PolarHBondContact NH2-OE1 2.94Å
11	E	39.2	Very low	51.8	Low	174 Å²	174	114.5 Å²	114.5	81%	0.813	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-65.1	-14.7	170.4	-71.1	169.6	139.1	0	0	112.1	S13 E14	E11-S13 PolarHBondContact O-N 3.09Å; E11-E14 PolarHBondContact O-N 3.11Å; E11-E14 VanDerWaalsContact O-N 3.12Å
12	S	48.1	Very low	54.6	Low	18 Å²	18	108.5 Å²	108.5	13%	0.126	59%	0.593	C	S	.	*	G	3₁₀ helix	trans	-53.5	-8.4	169.4	-40.7	0	0	0	0	115.5	R10 R47 T51	R10-S12 PolarHBondContact O-N 2.79Å; S12-R47 VanDerWaalsContact O-CD 3.32Å; S12-R47 WeakPolarHBondContact O-CD 3.46Å; S12-R47 PolarHBondContact O-NH1 3.33Å; S12-T51 PolarHBondContact OG-OG1 3.15Å
13	S	52	Low	57.3	Low	82 Å²	82	106.5 Å²	106.5	57%	0.573	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-78.7	-9.9	173.8	59.6	0	0	0	0	115.2	R10 E11	R10-S13 PolarHBondContact O-N 3.11Å; R10-S13 PolarHBondContact O-OG 2.91Å; E11-S13 PolarHBondContact O-N 3.09Å
14	E	56.8	Low	60	Low	176 Å²	176	96.5 Å²	96.5	82%	0.822	54%	0.538	S	S	*	.	S	Bend	trans	-81.6	-19.8	-178	-61.7	-160.6	153.8	0	0	114.2	E11	E11-E14 PolarHBondContact O-N 3.11Å; E11-E14 VanDerWaalsContact O-N 3.12Å
15	L	70.2	Confident	62.8	Low	88 Å²	88	97.6 Å²	97.6	46%	0.461	53%	0.527	S	S	.	.	S	Bend	trans	-91.2	147.7	173.4	-64.5	175.2	0	0	0	110.9	R47 T51	L15-R47 PolarHBondContact O-NE 3.45Å; L15-R47 PolarHBondContact O-NH1 3.28Å; L15-R47 PolarHBondContact O-NH2 2.87Å; L15-R47 VanDerWaalsContact O-NH2 3.14Å; L15-T51 HydrophobicContact CD1-CG2 4.07Å
16	P	80.7	Confident	65.5	Low	106 Å²	106	94.6 Å²	94.6	69%	0.688	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-67.4	164.9	170.7	29.3	-34.7	0	0	0	111.7	R47	P16-R47 VanDerWaalsContact C-NE 3.32Å; P16-R47 PolarHBondContact O-NE 3.29Å
17	L	84.3	Confident	68	Low	40 Å²	40	100.6 Å²	100.6	21%	0.209	51%	0.509	C	S	.	.	P	Polyproline II helix	trans	-69.2	147.2	165.8	-76.7	178.7	0	0	0	109.6	W21 E22 E23 Y33 P46 R47	L17-W21 HydrophobicContact CB-CB 4.17Å; L17-W21 HydrophobicContact CD1-CB 4.39Å; L17-W21 WeakPolarHBondContact CD1-O 3.4Å; L17-E22 VanDerWaalsContact CD1-C 3.48Å; L17-E23 HydrophobicContact CD1-CB 4.35Å; L17-Y33 HydrophobicContact CD2-CD1 4.02Å; L17-Y33 HydrophobicContact CD2-CE1 4.12Å; L17-P46 HydrophobicContact CD2-CG 3.74Å; L17-R47 HydrophobicContact CD2-CG 4.43Å
18	P	84.8	Confident	70.2	Confident	50 Å²	50	104 Å²	104	33%	0.325	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-57.8	153.9	170.1	-26	37.7	0	0	0	112.1	G20 W21 P46	P18-G20 PolarHBondContact O-N 3.45Å; P18-W21 WeakPolarHBondContact O-CB 3.42Å; P18-W21 PolarHBondContact O-N 2.87Å; P18-P46 HydrophobicContact CG-CB 4.07Å; P18-P46 HydrophobicContact CG-CG 4.31Å
19	A	83.9	Confident	72.3	Confident	91 Å²	91	98 Å²	98	75%	0.752	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	129.1	-175.4	0	0	0	0	0	112.1	N37	A19-N37 PolarHBondContact O-ND2 3.2Å
20	G	84.5	Confident	74.5	Confident	34 Å²	34	93.4 Å²	93.4	35%	0.351	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	8	-176.4	0	0	0	0	0	115.4	P18 H36	P18-G20 PolarHBondContact O-N 3.45Å; G20-H36 WeakPolarHBondContact O-CB 3.44Å; G20-H36 PolarHBondContact O-CD2 2.92Å; G20-H36 PolarHBondContact O-N 3.27Å
21	W	88.8	Confident	76.5	Confident	57 Å²	57	92 Å²	92	22%	0.216	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	141.8	169.6	-71.6	72.2	0	0	0	112.2	L17 P18 I34 D35 P46	L17-W21 HydrophobicContact CB-CB 4.17Å; L17-W21 HydrophobicContact CD1-CB 4.39Å; L17-W21 WeakPolarHBondContact CD1-O 3.4Å; P18-W21 WeakPolarHBondContact O-CB 3.42Å; P18-W21 PolarHBondContact O-N 2.87Å; W21-I34 CarbonylContact C-O 3.53Å; W21-I34 VanDerWaalsContact CA-O 3.27Å; W21-I34 WeakPolarHBondContact CA-O 3.12Å; W21-D35 HydrophobicContact CD2-CB 3.83Å; W21-D35 HydrophobicContact CE3-CB 4.02Å; W21-D35 HydrophobicContact CH2-CB 3.84Å; W21-D35 HydrophobicContact CZ2-CB 3.6Å; W21-D35 HydrophobicContact CZ3-CB 4.04Å; W21-P46 HydrophobicContact CB-CG 4.09Å; W21-P46 HydrophobicContact CD2-CB 3.62Å; W21-P46 HydrophobicContact CD2-CG 3.59Å; W21-P46 HydrophobicContact CE3-CB 3.72Å; W21-P46 HydrophobicContact CE3-CG 3.48Å; W21-P46 VanDerWaalsContact CE3-CG 3.48Å; W21-P46 HydrophobicContact CG-CB 4.14Å; W21-P46 HydrophobicContact CG-CG 3.89Å; W21-P46 HydrophobicContact CH2-CB 4.13Å; W21-P46 HydrophobicContact CZ2-CB 4.07Å; W21-P46 HydrophobicContact CZ3-CB 3.96Å; W21-P46 HydrophobicContact CZ3-CG 4.08Å
22	E	89.6	Confident	78.7	Confident	95 Å²	95	85.6 Å²	85.6	44%	0.444	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	146.6	179.1	178.6	173	-163.2	0	0	111.6	L17 Y33 I34 H36	L17-E22 VanDerWaalsContact CD1-C 3.48Å; E22-Y33 CarbonylContact O-C 3.57Å; E22-Y33 VanDerWaalsContact O-CA 3.26Å; E22-Y33 WeakPolarHBondContact O-CA 3.34Å; E22-I34 HydrophobicContact CB-CB 4.39Å; E22-I34 PolarHBondContact N-O 3.04Å; E22-I34 PolarHBondContact O-N 3.38Å; E22-H36 IonicContact OE2-CD2 3.9Å; E22-H36 IonicContact OE2-CE1 3.78Å; E22-H36 PolarHBondContact OE2-CE1 3.14Å; E22-H36 IonicContact OE2-NE2 2.75Å; E22-H36 PolarHBondContact OE2-NE2 3.06Å
23	E	89.9	Confident	80.7	Confident	89 Å²	89	85.8 Å²	85.8	42%	0.416	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	121.2	169.4	-174.2	-165.1	135.5	0	0	109	L17 R25 V31	L17-E23 HydrophobicContact CD1-CB 4.35Å; E23-R25 IonicContact OE1-CZ 3.17Å; E23-R25 IonicContact OE1-NE 2.67Å; E23-R25 PolarHBondContact OE1-NE 3.17Å; E23-R25 IonicContact OE1-NH2 2.82Å; E23-R25 PolarHBondContact OE1-NH2 3.14Å; E23-V31 HydrophobicContact CG-CG1 3.55Å
24	A	86.8	Confident	82.5	Confident	19 Å²	19	83.9 Å²	83.9	16%	0.157	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	171.3	176.2	0	0	0	0	0	110.8	V31 F32 I34	A24-V31 WeakPolarHBondContact O-CA 3.2Å; A24-F32 CarbonylContact C-O 3.51Å; A24-F32 HydrophobicContact CB-CD1 4.32Å; A24-F32 HydrophobicContact CB-CD2 4.15Å; A24-F32 HydrophobicContact CB-CE1 3.92Å; A24-F32 HydrophobicContact CB-CE2 3.72Å; A24-F32 HydrophobicContact CB-CG 4.43Å; A24-F32 HydrophobicContact CB-CZ 3.59Å; A24-F32 PolarHBondContact N-O 2.81Å; A24-F32 PolarHBondContact O-N 2.78Å; A24-I34 HydrophobicContact CB-CD1 3.78Å; A24-I34 HydrophobicContact CB-CG1 4Å
25	R	86.7	Confident	84	Confident	163 Å²	163	76.1 Å²	76.1	62%	0.615	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.6	144.7	176.2	-62.2	-173.9	-171	163.8	6.9	111.8	E23 R30 V31 F32	E23-R25 IonicContact OE1-CZ 3.17Å; E23-R25 IonicContact OE1-NE 2.67Å; E23-R25 PolarHBondContact OE1-NE 3.17Å; E23-R25 IonicContact OE1-NH2 2.82Å; E23-R25 PolarHBondContact OE1-NH2 3.14Å; R25-R30 CarbonylContact C-O 3.58Å; R25-R30 WeakPolarHBondContact CA-O 3.42Å; R25-V31 HydrophobicContact CG-CG2 4.08Å; R25-F32 VanDerWaalsContact C-CE1 3.44Å
26	D	83.7	Confident	84.8	Confident	40 Å²	40	76.8 Å²	76.8	21%	0.214	40%	0.399	C	S	.	.			trans	-81.5	179.6	174.6	72.4	8.1	0	0	0	112	D28 G29 R30 F32 W43	D26-D28 PolarHBondContact O-N 3.17Å; D26-D28 VanDerWaalsContact OD1-C 3.31Å; D26-D28 WeakPolarHBondContact OD1-CA 3.23Å; D26-D28 PolarHBondContact OD1-N 2.71Å; D26-G29 PolarHBondContact O-N 3.16Å; D26-G29 VanDerWaalsContact O-N 3.09Å; D26-G29 PolarHBondContact OD1-N 3.47Å; D26-R30 PolarHBondContact N-O 2.74Å; D26-R30 WeakPolarHBondContact OD1-CB 3.43Å; D26-R30 PolarHBondContact OD1-N 2.87Å; D26-R30 WeakPolarHBondContact OD2-CB 3.39Å; D26-R30 WeakPolarHBondContact OD2-CD 3.33Å; D26-F32 HydrophobicContact CB-CD1 4.38Å; D26-F32 HydrophobicContact CB-CE1 4.33Å; D26-W43 HydrophobicContact CB-CH2 4.23Å; D26-W43 WeakPolarHBondContact OD2-CH2 3.28Å
27	Y	80.2	Confident	85	Confident	244 Å²	244	76.9 Å²	76.9	96%	0.957	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-21.4	178.9	-58.9	-78.8	0	0	0	113.5	G29	Y27-G29 VanDerWaalsContact C-N 3.3Å
28	D	74.6	Confident	85.2	Confident	132 Å²	132	78.6 Å²	78.6	71%	0.706	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	0.4	175.1	-64.3	-27.9	0	0	0	112.1	D26 R30	D26-D28 PolarHBondContact O-N 3.17Å; D26-D28 VanDerWaalsContact OD1-C 3.31Å; D26-D28 WeakPolarHBondContact OD1-CA 3.23Å; D26-D28 PolarHBondContact OD1-N 2.71Å; D28-R30 VanDerWaalsContact C-N 3.34Å; D28-R30 HydrophobicContact CB-CG 4.23Å
29	G	78.3	Confident	85.3	Confident	48 Å²	48	87.1 Å²	87.1	50%	0.495	43%	0.432	S	S	.	.			trans	80.9	6.6	179.7	0	0	0	0	0	115.1	D26 Y27	D26-G29 PolarHBondContact O-N 3.16Å; D26-G29 VanDerWaalsContact O-N 3.09Å; D26-G29 PolarHBondContact OD1-N 3.47Å; Y27-G29 VanDerWaalsContact C-N 3.3Å
30	R	79.1	Confident	85.4	Confident	135 Å²	135	89 Å²	89	51%	0.509	43%	0.425	S	S	.	.			trans	-73.8	142.6	177.8	-51.9	177	179.5	-138.8	-3.4	110	R25 D26 D28 W43	R25-R30 CarbonylContact C-O 3.58Å; R25-R30 WeakPolarHBondContact CA-O 3.42Å; D26-R30 PolarHBondContact N-O 2.74Å; D26-R30 WeakPolarHBondContact OD1-CB 3.43Å; D26-R30 PolarHBondContact OD1-N 2.87Å; D26-R30 WeakPolarHBondContact OD2-CB 3.39Å; D26-R30 WeakPolarHBondContact OD2-CD 3.33Å; D28-R30 VanDerWaalsContact C-N 3.34Å; D28-R30 HydrophobicContact CB-CG 4.23Å; R30-W43 HydrophobicContact CB-CZ3 3.87Å
31	V	83.8	Confident	85.6	Confident	51 Å²	51	92 Å²	92	31%	0.309	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	134.2	178.6	176.2	0	0	0	0	110.5	E23 A24 R25 Y33	E23-V31 HydrophobicContact CG-CG1 3.55Å; A24-V31 WeakPolarHBondContact O-CA 3.2Å; R25-V31 HydrophobicContact CG-CG2 4.08Å; V31-Y33 HydrophobicContact CG1-CE1 4.49Å; V31-Y33 HydrophobicContact CG1-CE2 3.92Å
32	F	86	Confident	85.3	Confident	40 Å²	40	90.8 Å²	90.8	18%	0.175	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	164.5	165.4	71.6	-89.7	0	0	0	110.1	A24 R25 D26 I34 T41 W43	A24-F32 CarbonylContact C-O 3.51Å; A24-F32 HydrophobicContact CB-CD1 4.32Å; A24-F32 HydrophobicContact CB-CD2 4.15Å; A24-F32 HydrophobicContact CB-CE1 3.92Å; A24-F32 HydrophobicContact CB-CE2 3.72Å; A24-F32 HydrophobicContact CB-CG 4.43Å; A24-F32 HydrophobicContact CB-CZ 3.59Å; A24-F32 PolarHBondContact N-O 2.81Å; A24-F32 PolarHBondContact O-N 2.78Å; R25-F32 VanDerWaalsContact C-CE1 3.44Å; D26-F32 HydrophobicContact CB-CD1 4.38Å; D26-F32 HydrophobicContact CB-CE1 4.33Å; F32-I34 HydrophobicContact CD2-CG1 4.13Å; F32-I34 HydrophobicContact CE2-CD1 3.97Å; F32-I34 HydrophobicContact CE2-CG1 3.69Å; F32-T41 HydrophobicContact CD2-CG2 4.17Å; F32-T41 HydrophobicContact CE2-CG2 3.89Å; F32-W43 HydrophobicContact CB-CD2 4.15Å; F32-W43 HydrophobicContact CB-CE3 3.76Å; F32-W43 HydrophobicContact CB-CH2 4.22Å; F32-W43 HydrophobicContact CB-CZ3 3.8Å; F32-W43 HydrophobicContact CD1-CH2 4.35Å; F32-W43 HydrophobicContact CD1-CZ3 4.46Å
33	Y	90	Very high	85	Confident	22 Å²	22	90.6 Å²	90.6	9%	0.086	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.7	-173.2	-57.3	-96.9	0	0	0	110	L17 E22 V31 T41 S42 D45	L17-Y33 HydrophobicContact CD2-CD1 4.02Å; L17-Y33 HydrophobicContact CD2-CE1 4.12Å; E22-Y33 CarbonylContact O-C 3.57Å; E22-Y33 VanDerWaalsContact O-CA 3.26Å; E22-Y33 WeakPolarHBondContact O-CA 3.34Å; V31-Y33 HydrophobicContact CG1-CE1 4.49Å; V31-Y33 HydrophobicContact CG1-CE2 3.92Å; Y33-T41 CarbonylContact O-C 3.56Å; Y33-T41 WeakPolarHBondContact O-CA 3.25Å; Y33-S42 PolarHBondContact N-O 2.66Å; Y33-S42 PolarHBondContact O-N 2.72Å; Y33-D45 HydrophobicContact CD2-CB 4.42Å; Y33-D45 HydrophobicContact CE1-CB 3.91Å; Y33-D45 VanDerWaalsContact CE1-CG 3.42Å; Y33-D45 VanDerWaalsContact CE1-OD2 3.28Å; Y33-D45 WeakPolarHBondContact CE1-OD2 3.35Å; Y33-D45 HydrophobicContact CE2-CB 3.76Å; Y33-D45 VanDerWaalsContact CZ-CB 3.45Å; Y33-D45 VanDerWaalsContact CZ-CG 3.41Å; Y33-D45 WeakPolarHBondContact OH-CB 3.36Å; Y33-D45 VanDerWaalsContact OH-CG 3.28Å; Y33-D45 PolarHBondContact OH-OD2 2.7Å
34	I	88.9	Confident	84.6	Confident	41 Å²	41	87.9 Å²	87.9	21%	0.21	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	121.5	179.4	-49.9	-177.3	0	0	0	108.3	W21 E22 A24 F32 T41	W21-I34 CarbonylContact C-O 3.53Å; W21-I34 VanDerWaalsContact CA-O 3.27Å; W21-I34 WeakPolarHBondContact CA-O 3.12Å; E22-I34 HydrophobicContact CB-CB 4.39Å; E22-I34 PolarHBondContact N-O 3.04Å; E22-I34 PolarHBondContact O-N 3.38Å; A24-I34 HydrophobicContact CB-CD1 3.78Å; A24-I34 HydrophobicContact CB-CG1 4Å; F32-I34 HydrophobicContact CD2-CG1 4.13Å; F32-I34 HydrophobicContact CE2-CD1 3.97Å; F32-I34 HydrophobicContact CE2-CG1 3.69Å; I34-T41 HydrophobicContact CG1-CG2 4.31Å
35	D	89.4	Confident	84.4	Confident	13 Å²	13	87.3 Å²	87.3	7%	0.07	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	102.5	168.4	-178.8	9.6	0	0	0	109.4	W21 N37 T38 R39 Q40	W21-D35 HydrophobicContact CD2-CB 3.83Å; W21-D35 HydrophobicContact CE3-CB 4.02Å; W21-D35 HydrophobicContact CH2-CB 3.84Å; W21-D35 HydrophobicContact CZ2-CB 3.6Å; W21-D35 HydrophobicContact CZ3-CB 4.04Å; D35-N37 PolarHBondContact O-N 3.41Å; D35-N37 WeakPolarHBondContact OD1-CB 3.39Å; D35-N37 PolarHBondContact OD1-N 2.84Å; D35-N37 PolarHBondContact OD1-ND2 3.44Å; D35-T38 WeakPolarHBondContact CB-OG1 3.37Å; D35-T38 PolarHBondContact O-N 2.98Å; D35-T38 WeakPolarHBondContact OD2-CB 3.39Å; D35-T38 WeakPolarHBondContact OD2-CG2 3.33Å; D35-T38 PolarHBondContact OD2-N 3.39Å; D35-T38 PolarHBondContact OD2-OG1 3Å; D35-R39 WeakPolarHBondContact O-CA 3.28Å; D35-R39 PolarHBondContact O-N 3.11Å; D35-Q40 PolarHBondContact N-O 3.26Å; D35-Q40 PolarHBondContact O-N 2.86Å
36	H	87.1	Confident	84.1	Confident	102 Å²	102	80 Å²	80	47%	0.472	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-18.7	176.9	-67.2	-78.5	0	0	0	113.1	G20 E22	G20-H36 WeakPolarHBondContact O-CB 3.44Å; G20-H36 PolarHBondContact O-CD2 2.92Å; G20-H36 PolarHBondContact O-N 3.27Å; E22-H36 IonicContact OE2-CD2 3.9Å; E22-H36 IonicContact OE2-CE1 3.78Å; E22-H36 PolarHBondContact OE2-CE1 3.14Å; E22-H36 IonicContact OE2-NE2 2.75Å; E22-H36 PolarHBondContact OE2-NE2 3.06Å
37	N	85.4	Confident	83.9	Confident	108 Å²	108	79.9 Å²	79.9	58%	0.578	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-44.3	177.4	-50.1	-81.6	0	0	0	111.2	A19 D35	A19-N37 PolarHBondContact O-ND2 3.2Å; D35-N37 PolarHBondContact O-N 3.41Å; D35-N37 WeakPolarHBondContact OD1-CB 3.39Å; D35-N37 PolarHBondContact OD1-N 2.84Å; D35-N37 PolarHBondContact OD1-ND2 3.44Å
38	T	86.9	Confident	83.6	Confident	76 Å²	76	68.4 Å²	68.4	47%	0.466	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-12.4	178	61	0	0	0	0	113.9	D35	D35-T38 WeakPolarHBondContact CB-OG1 3.37Å; D35-T38 PolarHBondContact O-N 2.98Å; D35-T38 WeakPolarHBondContact OD2-CB 3.39Å; D35-T38 WeakPolarHBondContact OD2-CG2 3.33Å; D35-T38 PolarHBondContact OD2-N 3.39Å; D35-T38 PolarHBondContact OD2-OG1 3Å
39	R	88.1	Confident	83.3	Confident	230 Å²	230	70.3 Å²	70.3	87%	0.868	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	42.4	-172.3	-54.1	-179.7	-178.1	179.8	-0.6	112.7	D35	D35-R39 WeakPolarHBondContact O-CA 3.28Å; D35-R39 PolarHBondContact O-N 3.11Å
40	Q	86.2	Confident	82.8	Confident	130 Å²	130	74.5 Å²	74.5	61%	0.607	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	154.1	-179.6	-62	-172.8	-1.2	0	0	111.6	D35	D35-Q40 PolarHBondContact N-O 3.26Å; D35-Q40 PolarHBondContact O-N 2.86Å
41	T	87.9	Confident	82.3	Confident	97 Å²	97	70.5 Å²	70.5	60%	0.595	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	134.6	176	55.6	0	0	0	0	110.7	F32 Y33 I34	F32-T41 HydrophobicContact CD2-CG2 4.17Å; F32-T41 HydrophobicContact CE2-CG2 3.89Å; Y33-T41 CarbonylContact O-C 3.56Å; Y33-T41 WeakPolarHBondContact O-CA 3.25Å; I34-T41 HydrophobicContact CG1-CG2 4.31Å
42	S	82.6	Confident	81.9	Confident	31 Å²	31	69.6 Å²	69.6	22%	0.217	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	138	-176.2	176.7	0	0	0	0	110.8	Y33 I44	Y33-S42 PolarHBondContact N-O 2.66Å; Y33-S42 PolarHBondContact O-N 2.72Å; S42-I44 VanDerWaalsContact C-N 3.27Å; S42-I44 PolarHBondContact OG-N 3Å; S42-I44 PolarHBondContact OG-O 3.35Å
43	W	83.9	Confident	81.4	Confident	91 Å²	91	68.4 Å²	68.4	35%	0.345	33%	0.325	S	S	.	.	S	Bend	trans	-83.4	-7.8	168.2	-62.5	95.5	0	0	0	112.6	D26 R30 F32 H83	D26-W43 HydrophobicContact CB-CH2 4.23Å; D26-W43 WeakPolarHBondContact OD2-CH2 3.28Å; R30-W43 HydrophobicContact CB-CZ3 3.87Å; F32-W43 HydrophobicContact CB-CD2 4.15Å; F32-W43 HydrophobicContact CB-CE3 3.76Å; F32-W43 HydrophobicContact CB-CH2 4.22Å; F32-W43 HydrophobicContact CB-CZ3 3.8Å; F32-W43 HydrophobicContact CD1-CH2 4.35Å; F32-W43 HydrophobicContact CD1-CZ3 4.46Å; W43-H83 HydrophobicContact CB-CB 4.36Å; W43-H83 WeakPolarHBondContact CB-ND1 3.4Å
44	I	81.8	Confident	80.5	Confident	33 Å²	33	73.3 Å²	73.3	17%	0.169	35%	0.352	C	S	.	.	S	Bend	trans	-99.1	127.7	178.8	-50.8	174.6	0	0	0	108.3	S42 D48 L66 H83 I84	S42-I44 VanDerWaalsContact C-N 3.27Å; S42-I44 PolarHBondContact OG-N 3Å; S42-I44 PolarHBondContact OG-O 3.35Å; I44-D48 HydrophobicContact CG2-CB 4.4Å; I44-L66 HydrophobicContact CG2-CD1 3.55Å; I44-L66 HydrophobicContact CG2-CG 4.38Å; I44-H83 HydrophobicContact CD1-CB 4.28Å; I44-H83 HydrophobicContact CG1-CB 3.82Å; I44-I84 HydrophobicContact CD1-CG1 4.04Å
45	D	81.8	Confident	79.8	Confident	6 Å²	6	74.5 Å²	74.5	3%	0.032	36%	0.362	C	S	.	.			trans	-62	129.6	175.4	-167	-43.9	0	0	0	109.6	Y33 R47 D48	Y33-D45 HydrophobicContact CD2-CB 4.42Å; Y33-D45 HydrophobicContact CE1-CB 3.91Å; Y33-D45 VanDerWaalsContact CE1-CG 3.42Å; Y33-D45 VanDerWaalsContact CE1-OD2 3.28Å; Y33-D45 WeakPolarHBondContact CE1-OD2 3.35Å; Y33-D45 HydrophobicContact CE2-CB 3.76Å; Y33-D45 VanDerWaalsContact CZ-CB 3.45Å; Y33-D45 VanDerWaalsContact CZ-CG 3.41Å; Y33-D45 WeakPolarHBondContact OH-CB 3.36Å; Y33-D45 VanDerWaalsContact OH-CG 3.28Å; Y33-D45 PolarHBondContact OH-OD2 2.7Å; D45-R47 PolarHBondContact O-N 2.83Å; D45-R47 VanDerWaalsContact O-N 3.16Å; D45-R47 WeakPolarHBondContact OD1-CA 3.44Å; D45-R47 WeakPolarHBondContact OD1-CB 3.31Å; D45-R47 VanDerWaalsContact OD1-CG 3.23Å; D45-R47 WeakPolarHBondContact OD1-CG 3.31Å; D45-R47 PolarHBondContact OD1-N 3.18Å; D45-D48 HydrophobicContact CB-CB 4.23Å; D45-D48 WeakPolarHBondContact O-CB 3.23Å; D45-D48 PolarHBondContact O-N 3.3Å
46	P	79.4	Confident	79	Confident	11 Å²	11	76.2 Å²	76.2	7%	0.071	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-22.9	175.6	28.8	-39.3	0	0	0	113.3	L17 P18 W21	L17-P46 HydrophobicContact CD2-CG 3.74Å; P18-P46 HydrophobicContact CG-CB 4.07Å; P18-P46 HydrophobicContact CG-CG 4.31Å; W21-P46 HydrophobicContact CB-CG 4.09Å; W21-P46 HydrophobicContact CD2-CB 3.62Å; W21-P46 HydrophobicContact CD2-CG 3.59Å; W21-P46 HydrophobicContact CE3-CB 3.72Å; W21-P46 HydrophobicContact CE3-CG 3.48Å; W21-P46 VanDerWaalsContact CE3-CG 3.48Å; W21-P46 HydrophobicContact CG-CB 4.14Å; W21-P46 HydrophobicContact CG-CG 3.89Å; W21-P46 HydrophobicContact CH2-CB 4.13Å; W21-P46 HydrophobicContact CZ2-CB 4.07Å; W21-P46 HydrophobicContact CZ3-CB 3.96Å; W21-P46 HydrophobicContact CZ3-CG 4.08Å
47	R	79.9	Confident	78.1	Confident	37 Å²	37	74.7 Å²	74.7	14%	0.14	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-24.7	173	-53.8	170.1	-173.7	152.7	9.1	113.4	S12 L15 P16 L17 D45 R49 I50 T51	S12-R47 VanDerWaalsContact O-CD 3.32Å; S12-R47 WeakPolarHBondContact O-CD 3.46Å; S12-R47 PolarHBondContact O-NH1 3.33Å; L15-R47 PolarHBondContact O-NE 3.45Å; L15-R47 PolarHBondContact O-NH1 3.28Å; L15-R47 PolarHBondContact O-NH2 2.87Å; L15-R47 VanDerWaalsContact O-NH2 3.14Å; P16-R47 VanDerWaalsContact C-NE 3.32Å; P16-R47 PolarHBondContact O-NE 3.29Å; L17-R47 HydrophobicContact CD2-CG 4.43Å; D45-R47 PolarHBondContact O-N 2.83Å; D45-R47 VanDerWaalsContact O-N 3.16Å; D45-R47 WeakPolarHBondContact OD1-CA 3.44Å; D45-R47 WeakPolarHBondContact OD1-CB 3.31Å; D45-R47 VanDerWaalsContact OD1-CG 3.23Å; D45-R47 WeakPolarHBondContact OD1-CG 3.31Å; D45-R47 PolarHBondContact OD1-N 3.18Å; R47-R49 PolarHBondContact O-N 3.2Å; R47-R49 VanDerWaalsContact O-N 3.14Å; R47-I50 PolarHBondContact O-N 2.97Å; R47-T51 PolarHBondContact O-N 2.93Å; R47-T51 PolarHBondContact O-OG1 3.42Å
48	D	74.8	Confident	77.4	Confident	3 Å²	3	73.8 Å²	73.8	2%	0.016	37%	0.369	C	S	.	.	H	α-helix	trans	-58.5	-28.2	177.1	-82.6	-7.8	0	0	0	109.9	R10 I44 D45 I50 T51 K52 L66	R10-D48 IonicContact CZ-OD2 2.73Å; R10-D48 IonicContact NH1-OD1 3.39Å; R10-D48 PolarHBondContact NH1-OD1 3.33Å; R10-D48 IonicContact NH1-OD2 3.69Å; R10-D48 PolarHBondContact NH1-OD2 3.19Å; I44-D48 HydrophobicContact CG2-CB 4.4Å; D45-D48 HydrophobicContact CB-CB 4.23Å; D45-D48 WeakPolarHBondContact O-CB 3.23Å; D45-D48 PolarHBondContact O-N 3.3Å; D48-I50 PolarHBondContact O-N 3.49Å; D48-I50 VanDerWaalsContact O-N 3.13Å; D48-T51 PolarHBondContact O-N 2.9Å; D48-K52 HydrophobicContact CB-CB 4.48Å; D48-K52 HydrophobicContact CB-CD 3.9Å; D48-K52 HydrophobicContact CB-CG 4.12Å; D48-K52 WeakPolarHBondContact O-CB 3.44Å; D48-K52 PolarHBondContact O-N 3.29Å; D48-K52 WeakPolarHBondContact OD1-CE 3.32Å; D48-K52 IonicContact OD1-NZ 3.17Å; D48-K52 WeakPolarHBondContact OD2-CE 3.18Å; D48-K52 IonicContact OD2-NZ 3.45Å; D48-K52 PolarHBondContact OD2-NZ 3.47Å; D48-L66 HydrophobicContact CB-CD1 3.58Å
49	R	68.7	Low	76.7	Confident	172 Å²	172	71.6 Å²	71.6	65%	0.649	36%	0.356	S	S	*	.	H	α-helix	trans	-61.6	-16.4	173.9	-64.8	-174.9	173.8	-164.9	-0.3	115.3	R47 L66	R47-R49 PolarHBondContact O-N 3.2Å; R47-R49 VanDerWaalsContact O-N 3.14Å; R49-L66 HydrophobicContact CG-CD1 4.04Å; R49-L66 HydrophobicContact CG-CD2 3.93Å
50	I	67.1	Low	75.4	Confident	136 Å²	136	66 Å²	66	70%	0.697	35%	0.347	S	S	*	.	H	α-helix	trans	-114.1	-29.2	-178	-53.7	175.1	0	0	0	110.3	R47 D48	R47-I50 PolarHBondContact O-N 2.97Å; D48-I50 PolarHBondContact O-N 3.49Å; D48-I50 VanDerWaalsContact O-N 3.13Å
51	T	68.5	Low	74.4	Confident	50 Å²	50	62.8 Å²	62.8	31%	0.307	35%	0.349	S	S	.	.	H	α-helix	trans	-108.1	-12.6	-172	57.4	0	0	0	0	115.1	S12 L15 R47 D48	S12-T51 PolarHBondContact OG-OG1 3.15Å; L15-T51 HydrophobicContact CD1-CG2 4.07Å; R47-T51 PolarHBondContact O-N 2.93Å; R47-T51 PolarHBondContact O-OG1 3.42Å; D48-T51 PolarHBondContact O-N 2.9Å
52	K	76.1	Confident	73.4	Confident	33 Å²	33	63.7 Å²	63.7	14%	0.143	35%	0.35	C	S	.	.	S	Bend	trans	-109.1	153	173.9	-71.8	-172.5	178.2	166.8	0	111.6	D48 W68	D48-K52 HydrophobicContact CB-CB 4.48Å; D48-K52 HydrophobicContact CB-CD 3.9Å; D48-K52 HydrophobicContact CB-CG 4.12Å; D48-K52 WeakPolarHBondContact O-CB 3.44Å; D48-K52 PolarHBondContact O-N 3.29Å; D48-K52 WeakPolarHBondContact OD1-CE 3.32Å; D48-K52 IonicContact OD1-NZ 3.17Å; D48-K52 WeakPolarHBondContact OD2-CE 3.18Å; D48-K52 IonicContact OD2-NZ 3.45Å; D48-K52 PolarHBondContact OD2-NZ 3.47Å; K52-W68 PolarHBondContact NZ-O 3.49Å; K52-W68 VanDerWaalsContact NZ-O 3.17Å
53	P	75.3	Confident	73	Confident	14 Å²	14	67 Å²	67	9%	0.091	36%	0.362	C	S	.	.			trans	-55.6	138.4	167.8	21.5	-32	0	0	0	111.8	D58 C59 P65 L66	P53-D58 HydrophobicContact CB-CB 3.63Å; P53-C59 HydrophobicContact CG-CB 4.38Å; P53-C59 VanDerWaalsContact CG-SG 3.54Å; P53-P65 CarbonylContact O-C 3.59Å; P53-P65 VanDerWaalsContact O-CA 3.3Å; P53-P65 WeakPolarHBondContact O-CA 3.42Å; P53-L66 PolarHBondContact O-N 3.01Å
54	L	71.3	Confident	73	Confident	125 Å²	125	63.3 Å²	63.3	65%	0.654	35%	0.35	S	S	*	.	S	Bend	trans	-79.9	-26.6	179.2	-72.7	90	0	0	0	112.1
55	T	72.7	Confident	73	Confident	66 Å²	66	62 Å²	62	41%	0.405	34%	0.343	S	S	.	.	S	Bend	trans	-129.1	166.6	178.4	80.5	0	0	0	0	112.2	A57 D58 C59	T55-A57 PolarHBondContact O-N 2.9Å; T55-A57 PolarHBondContact OG1-N 3.08Å; T55-D58 VanDerWaalsContact CB-OD2 3.32Å; T55-D58 WeakPolarHBondContact CB-OD2 3.3Å; T55-D58 PolarHBondContact N-OD2 3.3Å; T55-D58 PolarHBondContact O-N 2.9Å; T55-D58 VanDerWaalsContact OG1-CG 3.31Å; T55-D58 PolarHBondContact OG1-N 3.48Å; T55-D58 PolarHBondContact OG1-OD2 3.43Å; T55-C59 PolarHBondContact O-SG 3.02Å
56	F	74.2	Confident	73	Confident	50 Å²	50	63.5 Å²	63.5	22%	0.219	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-63	-24.4	171.9	-72.6	-78.3	0	0	0	113.8	P65 W68 P93 R94 W97	F56-P65 HydrophobicContact CD1-CG 3.52Å; F56-P65 HydrophobicContact CD2-CG 4.21Å; F56-P65 HydrophobicContact CE1-CG 3.54Å; F56-P65 HydrophobicContact CE2-CG 4.23Å; F56-P65 HydrophobicContact CG-CG 3.86Å; F56-P65 HydrophobicContact CZ-CG 3.91Å; F56-W68 AromaticContact CZ-CE2 3.82Å; F56-W68 HydrophobicContact CZ-CZ2 4.16Å; F56-W68 AromaticContact CZ-NE1 3.54Å; F56-P93 HydrophobicContact CE1-CB 3.73Å; F56-P93 HydrophobicContact CE1-CG 4.08Å; F56-P93 HydrophobicContact CZ-CB 3.93Å; F56-R94 HydrophobicContact CD1-CG 3.94Å; F56-R94 HydrophobicContact CE1-CG 4.17Å; F56-W97 HydrophobicContact CB-CB 4.22Å; F56-W97 HydrophobicContact CB-CD2 3.38Å; F56-W97 HydrophobicContact CB-CE3 3.77Å; F56-W97 HydrophobicContact CB-CG 3.56Å; F56-W97 HydrophobicContact CB-CZ2 4.27Å; F56-W97 HydrophobicContact CB-CZ3 4.34Å; F56-W97 HydrophobicContact CD1-CB 4.1Å; F56-W97 HydrophobicContact CD1-CG 4.3Å; F56-W97 AromaticContact CD2-CD1 3.9Å; F56-W97 HydrophobicContact CD2-CG 4.14Å; F56-W97 HydrophobicContact CG-CB 4.04Å; F56-W97 AromaticContact CG-CD1 3.97Å; F56-W97 HydrophobicContact CG-CD2 4.13Å; F56-W97 AromaticContact CG-CG 3.76Å; F56-W97 HydrophobicContact CG-CG 3.76Å
57	A	68.3	Low	73.1	Confident	70 Å²	70	63.1 Å²	63.1	58%	0.579	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-73.8	-28.5	177.8	0	0	0	0	0	112.6	T55 C59 W97	T55-A57 PolarHBondContact O-N 2.9Å; T55-A57 PolarHBondContact OG1-N 3.08Å; A57-C59 VanDerWaalsContact C-N 3.29Å; A57-C59 PolarHBondContact O-N 3.48Å; A57-W97 HydrophobicContact CB-CH2 3.88Å; A57-W97 HydrophobicContact CB-CZ2 4.33Å
58	D	70.6	Confident	73.4	Confident	88 Å²	88	62.5 Å²	62.5	47%	0.471	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-84.4	-1.7	-179.5	-45.1	-62	0	0	0	112.8	P53 T55 V60	P53-D58 HydrophobicContact CB-CB 3.63Å; T55-D58 VanDerWaalsContact CB-OD2 3.32Å; T55-D58 WeakPolarHBondContact CB-OD2 3.3Å; T55-D58 PolarHBondContact N-OD2 3.3Å; T55-D58 PolarHBondContact O-N 2.9Å; T55-D58 VanDerWaalsContact OG1-CG 3.31Å; T55-D58 PolarHBondContact OG1-N 3.48Å; T55-D58 PolarHBondContact OG1-OD2 3.43Å; D58-V60 PolarHBondContact O-N 2.98Å
59	C	72.2	Confident	73.9	Confident	30 Å²	30	65 Å²	65	20%	0.203	36%	0.358	C	S	.	.			trans	-75.1	116.7	-172.3	-71.2	0	0	0	0	113.1	P53 T55 A57	P53-C59 HydrophobicContact CG-CB 4.38Å; P53-C59 VanDerWaalsContact CG-SG 3.54Å; T55-C59 PolarHBondContact O-SG 3.02Å; A57-C59 VanDerWaalsContact C-N 3.29Å; A57-C59 PolarHBondContact O-N 3.48Å
60	V	61	Low	74.8	Confident	113 Å²	113	61.6 Å²	61.6	69%	0.685	35%	0.349	S	S	*	.			trans	-108.5	135.6	177.5	-176.1	0	0	0	0	110.6	D58 D62 E63	D58-V60 PolarHBondContact O-N 2.98Å; V60-D62 PolarHBondContact O-N 3.45Å; V60-E63 PolarHBondContact O-N 2.98Å
61	G	64.8	Low	75.7	Confident	63 Å²	63	57 Å²	57	65%	0.649	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	-126.6	173.9	0	0	0	0	0	114	R94	G61-R94 PolarHBondContact O-NH1 2.94Å
62	D	65.6	Low	76.6	Confident	115 Å²	115	62 Å²	62	62%	0.615	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-8	-176.8	-63.5	-26.9	0	0	0	113.2	K8 V60 R94	K8-D62 IonicContact NZ-OD2 3.67Å; K8-D62 PolarHBondContact NZ-OD2 2.88Å; V60-D62 PolarHBondContact O-N 3.45Å; D62-R94 VanDerWaalsContact O-CZ 3.31Å; D62-R94 PolarHBondContact O-NH1 2.86Å; D62-R94 VanDerWaalsContact O-NH1 3.16Å; D62-R94 PolarHBondContact O-NH2 2.7Å
63	E	76	Confident	77.2	Confident	101 Å²	101	63 Å²	63	47%	0.472	35%	0.349	S	S	.	.			trans	-76	145.6	-169.4	-65.4	177.5	-157.2	0	0	114.3	V60 R94	V60-E63 PolarHBondContact O-N 2.98Å; E63-R94 WeakPolarHBondContact O-CD 3.28Å; E63-R94 VanDerWaalsContact O-CZ 3.29Å; E63-R94 PolarHBondContact O-NE 3.05Å; E63-R94 PolarHBondContact O-NH1 3.01Å
64	L	82.8	Confident	77.6	Confident	14 Å²	14	70.2 Å²	70.2	7%	0.073	38%	0.381	C	S	.	.			trans	-107	154.7	177.8	-74.4	166.4	0	0	0	111	W68 E70 Y80 P93 R94	L64-W68 HydrophobicContact CB-CB 3.94Å; L64-W68 HydrophobicContact CD1-CB 4.4Å; L64-W68 HydrophobicContact CD2-CB 4.42Å; L64-E70 HydrophobicContact CD1-CB 3.87Å; L64-Y80 HydrophobicContact CD1-CD1 3.79Å; L64-Y80 HydrophobicContact CD1-CE1 3.93Å; L64-Y80 HydrophobicContact CD2-CD1 4.14Å; L64-Y80 HydrophobicContact CD2-CE1 4.21Å; L64-P93 HydrophobicContact CD2-CG 3.74Å; L64-R94 HydrophobicContact CD2-CG 4.07Å
65	P	82.9	Confident	78	Confident	4 Å²	4	73.2 Å²	73.2	3%	0.026	39%	0.392	C	S	.	.			trans	-61.7	163.8	176.7	-16.9	27.5	0	0	0	113.8	P53 F56 G67 W68	P53-P65 CarbonylContact O-C 3.59Å; P53-P65 VanDerWaalsContact O-CA 3.3Å; P53-P65 WeakPolarHBondContact O-CA 3.42Å; F56-P65 HydrophobicContact CD1-CG 3.52Å; F56-P65 HydrophobicContact CD2-CG 4.21Å; F56-P65 HydrophobicContact CE1-CG 3.54Å; F56-P65 HydrophobicContact CE2-CG 4.23Å; F56-P65 HydrophobicContact CG-CG 3.86Å; F56-P65 HydrophobicContact CZ-CG 3.91Å; P65-G67 PolarHBondContact O-N 3.33Å; P65-W68 PolarHBondContact O-N 3.16Å
66	L	81.1	Confident	78.4	Confident	39 Å²	39	74 Å²	74	20%	0.204	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	131	166.1	-177.8	66.2	0	0	0	111.4	I44 D48 R49 P53 W68	I44-L66 HydrophobicContact CG2-CD1 3.55Å; I44-L66 HydrophobicContact CG2-CG 4.38Å; D48-L66 HydrophobicContact CB-CD1 3.58Å; R49-L66 HydrophobicContact CG-CD1 4.04Å; R49-L66 HydrophobicContact CG-CD2 3.93Å; P53-L66 PolarHBondContact O-N 3.01Å; L66-W68 VanDerWaalsContact C-N 3.31Å; L66-W68 PolarHBondContact O-N 3.11Å
67	G	81.3	Confident	79	Confident	2 Å²	2	72.6 Å²	72.6	2%	0.021	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	-16.4	-177.9	0	0	0	0	0	115.1	P65 H83	P65-G67 PolarHBondContact O-N 3.33Å; G67-H83 VanDerWaalsContact O-CB 3.28Å; G67-H83 WeakPolarHBondContact O-CB 3.41Å; G67-H83 PolarHBondContact O-CD2 3.28Å; G67-H83 PolarHBondContact O-N 2.87Å
68	W	86.4	Confident	79.9	Confident	25 Å²	25	72.3 Å²	72.3	10%	0.095	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	145.7	174.5	-72.6	85.2	0	0	0	112.4	K52 F56 L64 P65 L66 I81 D82 Q89 P93	K52-W68 PolarHBondContact NZ-O 3.49Å; K52-W68 VanDerWaalsContact NZ-O 3.17Å; F56-W68 AromaticContact CZ-CE2 3.82Å; F56-W68 HydrophobicContact CZ-CZ2 4.16Å; F56-W68 AromaticContact CZ-NE1 3.54Å; L64-W68 HydrophobicContact CB-CB 3.94Å; L64-W68 HydrophobicContact CD1-CB 4.4Å; L64-W68 HydrophobicContact CD2-CB 4.42Å; P65-W68 PolarHBondContact O-N 3.16Å; L66-W68 VanDerWaalsContact C-N 3.31Å; L66-W68 PolarHBondContact O-N 3.11Å; W68-I81 WeakPolarHBondContact CA-O 3.49Å; W68-D82 HydrophobicContact CD2-CB 4.18Å; W68-D82 HydrophobicContact CE3-CB 4.08Å; W68-D82 HydrophobicContact CH2-CB 3.75Å; W68-D82 HydrophobicContact CZ2-CB 3.8Å; W68-D82 VanDerWaalsContact CZ2-OD2 3.25Å; W68-D82 WeakPolarHBondContact CZ2-OD2 3.37Å; W68-D82 HydrophobicContact CZ3-CB 3.88Å; W68-Q89 HydrophobicContact CH2-CG 4.4Å; W68-Q89 HydrophobicContact CZ3-CG 4.05Å; W68-P93 HydrophobicContact CD2-CB 4.22Å; W68-P93 HydrophobicContact CD2-CG 3.91Å; W68-P93 HydrophobicContact CE3-CB 3.99Å; W68-P93 HydrophobicContact CE3-CG 3.58Å; W68-P93 HydrophobicContact CH2-CB 3.69Å; W68-P93 HydrophobicContact CH2-CG 4.22Å; W68-P93 HydrophobicContact CZ2-CB 3.97Å; W68-P93 HydrophobicContact CZ3-CB 3.71Å; W68-P93 HydrophobicContact CZ3-CG 3.73Å
69	E	85.1	Confident	80.8	Confident	55 Å²	55	70.1 Å²	70.1	26%	0.257	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	138.3	176.9	-173.7	156.4	-126.3	0	0	111.5	R10 V71 Y80 I81 H83	R10-E69 IonicContact CZ-OE1 2.8Å; R10-E69 IonicContact NH2-OE1 3.48Å; R10-E69 PolarHBondContact NH2-OE1 2.94Å; E69-V71 HydrophobicContact CG-CG2 4Å; E69-Y80 WeakPolarHBondContact O-CA 3.48Å; E69-I81 PolarHBondContact N-O 3.26Å; E69-I81 PolarHBondContact O-N 2.9Å; E69-H83 IonicContact OE2-CD2 3.22Å; E69-H83 IonicContact OE2-CE1 3.26Å; E69-H83 IonicContact OE2-NE2 2.64Å; E69-H83 PolarHBondContact OE2-NE2 3.33Å
70	E	88.1	Confident	81.6	Confident	100 Å²	100	69.6 Å²	69.6	47%	0.467	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	125.9	170	-171.3	172.1	106.5	0	0	108.5	L64 V78 Y80	L64-E70 HydrophobicContact CD1-CB 3.87Å; E70-V78 HydrophobicContact CG-CG1 3.47Å; E70-V78 VanDerWaalsContact CG-CG1 3.47Å; E70-Y80 HydrophobicContact CB-CD1 4.11Å; E70-Y80 HydrophobicContact CB-CE1 3.77Å; E70-Y80 HydrophobicContact CG-CD1 4.23Å; E70-Y80 HydrophobicContact CG-CE1 3.58Å; E70-Y80 WeakPolarHBondContact OE2-CE1 3.46Å; E70-Y80 VanDerWaalsContact OE2-CZ 3.26Å; E70-Y80 PolarHBondContact OE2-OH 3.47Å
71	V	86.1	Confident	82.9	Confident	41 Å²	41	65 Å²	65	25%	0.248	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	139.3	179.8	-176.6	0	0	0	0	109	E69 Y79 I81	E69-V71 HydrophobicContact CG-CG2 4Å; V71-Y79 HydrophobicContact CB-CD1 4.38Å; V71-Y79 HydrophobicContact CB-CE1 3.85Å; V71-Y79 HydrophobicContact CB-CE2 4.27Å; V71-Y79 HydrophobicContact CG1-CE1 3.7Å; V71-Y79 WeakPolarHBondContact CG1-OH 3.42Å; V71-Y79 PolarHBondContact N-O 3.36Å; V71-Y79 VanDerWaalsContact O-CD1 3.31Å; V71-Y79 WeakPolarHBondContact O-CD1 3.3Å; V71-Y79 PolarHBondContact O-N 2.95Å; V71-I81 HydrophobicContact CB-CD1 4.35Å; V71-I81 HydrophobicContact CG2-CD1 3.65Å; V71-I81 HydrophobicContact CG2-CG1 3.94Å
72	Y	87	Confident	84	Confident	153 Å²	153	62.2 Å²	62.2	60%	0.6	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	121.9	173.3	179	-93.8	0	0	0	109.9	G77 V78	Y72-G77 WeakPolarHBondContact CA-O 3.39Å; Y72-V78 HydrophobicContact CD2-CG2 3.9Å
73	D	87.5	Confident	84.8	Confident	56 Å²	56	58 Å²	58	30%	0.299	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	152	164.7	170.3	57	0	0	0	110.7	Q75 V76 G77 Y79	D73-Q75 WeakPolarHBondContact OD2-CA 3.45Å; D73-Q75 WeakPolarHBondContact OD2-CB 3.4Å; D73-Q75 PolarHBondContact OD2-N 2.85Å; D73-V76 HydrophobicContact CB-CB 4.38Å; D73-V76 PolarHBondContact OD2-N 3.39Å; D73-G77 PolarHBondContact N-O 3.38Å; D73-G77 WeakPolarHBondContact O-CA 3.39Å; D73-G77 PolarHBondContact O-N 3.24Å; D73-Y79 HydrophobicContact CB-CD1 4.33Å; D73-Y79 HydrophobicContact CB-CE1 3.77Å
74	Q	83.7	Confident	85	Confident	164 Å²	164	58.1 Å²	58.1	77%	0.766	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-15.9	-176.7	-166.2	169.7	10.5	0	0	113.7
75	Q	80.9	Confident	85	Confident	188 Å²	188	62.9 Å²	62.9	88%	0.879	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-41.4	176.5	-55.9	-174.6	-0.3	0	0	112.1	D73	D73-Q75 WeakPolarHBondContact OD2-CA 3.45Å; D73-Q75 WeakPolarHBondContact OD2-CB 3.4Å; D73-Q75 PolarHBondContact OD2-N 2.85Å
76	V	81.5	Confident	85	Confident	84 Å²	84	69.2 Å²	69.2	51%	0.509	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-27	-178.1	-177.6	0	0	0	0	112.7	D73 I90	D73-V76 HydrophobicContact CB-CB 4.38Å; D73-V76 PolarHBondContact OD2-N 3.39Å; V76-I90 HydrophobicContact CG1-CD1 4.39Å; V76-I90 HydrophobicContact CG1-CG1 4.22Å
77	G	86.6	Confident	85.2	Confident	20 Å²	20	70.7 Å²	70.7	21%	0.206	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.5	-147.6	-172.2	0	0	0	0	0	112.4	Y72 D73	Y72-G77 WeakPolarHBondContact CA-O 3.39Å; D73-G77 PolarHBondContact N-O 3.38Å; D73-G77 WeakPolarHBondContact O-CA 3.39Å; D73-G77 PolarHBondContact O-N 3.24Å
78	V	86.9	Confident	85.6	Confident	63 Å²	63	75.2 Å²	75.2	38%	0.382	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	130.1	173.7	-179.7	0	0	0	0	109.4	E70 Y72 Y80	E70-V78 HydrophobicContact CG-CG1 3.47Å; E70-V78 VanDerWaalsContact CG-CG1 3.47Å; Y72-V78 HydrophobicContact CD2-CG2 3.9Å; V78-Y80 HydrophobicContact CG1-CE2 4.19Å
79	Y	89.2	Confident	85.7	Confident	43 Å²	43	76.3 Å²	76.3	17%	0.169	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	167.2	172.4	72.4	-80	0	0	0	110.3	V71 D73 I81 T88	V71-Y79 HydrophobicContact CB-CD1 4.38Å; V71-Y79 HydrophobicContact CB-CE1 3.85Å; V71-Y79 HydrophobicContact CB-CE2 4.27Å; V71-Y79 HydrophobicContact CG1-CE1 3.7Å; V71-Y79 WeakPolarHBondContact CG1-OH 3.42Å; V71-Y79 PolarHBondContact N-O 3.36Å; V71-Y79 VanDerWaalsContact O-CD1 3.31Å; V71-Y79 WeakPolarHBondContact O-CD1 3.3Å; V71-Y79 PolarHBondContact O-N 2.95Å; D73-Y79 HydrophobicContact CB-CD1 4.33Å; D73-Y79 HydrophobicContact CB-CE1 3.77Å; Y79-I81 HydrophobicContact CD2-CG1 4.16Å; Y79-I81 HydrophobicContact CE2-CD1 3.81Å; Y79-I81 HydrophobicContact CE2-CG1 3.68Å; Y79-T88 HydrophobicContact CE2-CG2 4.43Å
80	Y	89.7	Confident	85.9	Confident	18 Å²	18	79.6 Å²	79.6	7%	0.071	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	137.6	-171.7	-61.7	-83.9	0	0	0	110.7	L64 E69 E70 V78 T88 Q89 E91 N92 P93	L64-Y80 HydrophobicContact CD1-CD1 3.79Å; L64-Y80 HydrophobicContact CD1-CE1 3.93Å; L64-Y80 HydrophobicContact CD2-CD1 4.14Å; L64-Y80 HydrophobicContact CD2-CE1 4.21Å; E69-Y80 WeakPolarHBondContact O-CA 3.48Å; E70-Y80 HydrophobicContact CB-CD1 4.11Å; E70-Y80 HydrophobicContact CB-CE1 3.77Å; E70-Y80 HydrophobicContact CG-CD1 4.23Å; E70-Y80 HydrophobicContact CG-CE1 3.58Å; E70-Y80 WeakPolarHBondContact OE2-CE1 3.46Å; E70-Y80 VanDerWaalsContact OE2-CZ 3.26Å; E70-Y80 PolarHBondContact OE2-OH 3.47Å; V78-Y80 HydrophobicContact CG1-CE2 4.19Å; Y80-T88 CarbonylContact O-C 3.5Å; Y80-T88 VanDerWaalsContact O-CA 3.31Å; Y80-T88 WeakPolarHBondContact O-CA 3.43Å; Y80-Q89 PolarHBondContact N-O 3.1Å; Y80-Q89 PolarHBondContact O-N 3.11Å; Y80-E91 WeakPolarHBondContact CD2-O 3.26Å; Y80-N92 HydrophobicContact CD2-CB 4.39Å; Y80-N92 HydrophobicContact CE2-CB 3.69Å; Y80-P93 HydrophobicContact CD1-CG 4.46Å; Y80-P93 HydrophobicContact CG-CG 4.47Å
81	I	87.9	Confident	85.8	Confident	17 Å²	17	78.6 Å²	78.6	9%	0.087	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129	177.5	-52.2	-169.2	0	0	0	109	W68 E69 V71 Y79 T88	W68-I81 WeakPolarHBondContact CA-O 3.49Å; E69-I81 PolarHBondContact N-O 3.26Å; E69-I81 PolarHBondContact O-N 2.9Å; V71-I81 HydrophobicContact CB-CD1 4.35Å; V71-I81 HydrophobicContact CG2-CD1 3.65Å; V71-I81 HydrophobicContact CG2-CG1 3.94Å; Y79-I81 HydrophobicContact CD2-CG1 4.16Å; Y79-I81 HydrophobicContact CE2-CD1 3.81Å; Y79-I81 HydrophobicContact CE2-CG1 3.68Å; I81-T88 HydrophobicContact CB-CG2 4.47Å; I81-T88 HydrophobicContact CD1-CG2 4.46Å; I81-T88 HydrophobicContact CG1-CG2 4.02Å; I81-T88 HydrophobicContact CG2-CG2 4.25Å
82	D	88.7	Confident	85.7	Confident	5 Å²	5	78 Å²	78	3%	0.027	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	103.8	168.7	-173.5	-27.7	0	0	0	109	W68 I84 N85 K86 T87	W68-D82 HydrophobicContact CD2-CB 4.18Å; W68-D82 HydrophobicContact CE3-CB 4.08Å; W68-D82 HydrophobicContact CH2-CB 3.75Å; W68-D82 HydrophobicContact CZ2-CB 3.8Å; W68-D82 VanDerWaalsContact CZ2-OD2 3.25Å; W68-D82 WeakPolarHBondContact CZ2-OD2 3.37Å; W68-D82 HydrophobicContact CZ3-CB 3.88Å; D82-I84 PolarHBondContact O-N 2.9Å; D82-I84 VanDerWaalsContact OD1-CA 3.31Å; D82-I84 WeakPolarHBondContact OD1-CA 3.41Å; D82-I84 VanDerWaalsContact OD1-CB 3.28Å; D82-I84 WeakPolarHBondContact OD1-CB 3.3Å; D82-I84 PolarHBondContact OD1-N 3.18Å; D82-N85 HydrophobicContact CB-CB 4.45Å; D82-N85 PolarHBondContact OD1-N 3.46Å; D82-N85 WeakPolarHBondContact OD2-CB 3.44Å; D82-N85 PolarHBondContact OD2-ND2 3.01Å; D82-K86 WeakPolarHBondContact O-CA 3.37Å; D82-K86 PolarHBondContact O-N 3.44Å; D82-T87 WeakPolarHBondContact CB-OG1 3.31Å; D82-T87 PolarHBondContact N-O 3Å; D82-T87 PolarHBondContact O-N 3.5Å
83	H	80.7	Confident	85.6	Confident	26 Å²	26	71 Å²	71	12%	0.12	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-4.8	178.1	-67.3	-70.4	0	0	0	113.6	W43 I44 G67 E69 K86	W43-H83 HydrophobicContact CB-CB 4.36Å; W43-H83 WeakPolarHBondContact CB-ND1 3.4Å; I44-H83 HydrophobicContact CD1-CB 4.28Å; I44-H83 HydrophobicContact CG1-CB 3.82Å; G67-H83 VanDerWaalsContact O-CB 3.28Å; G67-H83 WeakPolarHBondContact O-CB 3.41Å; G67-H83 PolarHBondContact O-CD2 3.28Å; G67-H83 PolarHBondContact O-N 2.87Å; E69-H83 IonicContact OE2-CD2 3.22Å; E69-H83 IonicContact OE2-CE1 3.26Å; E69-H83 IonicContact OE2-NE2 2.64Å; E69-H83 PolarHBondContact OE2-NE2 3.33Å; H83-K86 WeakPolarHBondContact O-CE 3.33Å; H83-K86 PolarHBondContact O-NZ 2.95Å
84	I	81.9	Confident	85.3	Confident	103 Å²	103	70.3 Å²	70.3	53%	0.528	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-58.2	173.2	-57.8	170.4	0	0	0	108.9	I44 D82	I44-I84 HydrophobicContact CD1-CG1 4.04Å; D82-I84 PolarHBondContact O-N 2.9Å; D82-I84 VanDerWaalsContact OD1-CA 3.31Å; D82-I84 WeakPolarHBondContact OD1-CA 3.41Å; D82-I84 VanDerWaalsContact OD1-CB 3.28Å; D82-I84 WeakPolarHBondContact OD1-CB 3.3Å; D82-I84 PolarHBondContact OD1-N 3.18Å
85	N	80.9	Confident	85.2	Confident	114 Å²	114	65.3 Å²	65.3	61%	0.61	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-9.6	-177.5	-65.6	-56.4	0	0	0	114.2	D82 T87	D82-N85 HydrophobicContact CB-CB 4.45Å; D82-N85 PolarHBondContact OD1-N 3.46Å; D82-N85 WeakPolarHBondContact OD2-CB 3.44Å; D82-N85 PolarHBondContact OD2-ND2 3.01Å; N85-T87 VanDerWaalsContact C-N 3.29Å; N85-T87 HydrophobicContact CB-CG2 4.49Å; N85-T87 PolarHBondContact O-N 3.09Å
86	K	84	Confident	85.2	Confident	137 Å²	137	59.7 Å²	59.7	60%	0.596	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	33.1	-178.4	-49.1	-53.6	-174.4	-175	0	113.6	D82 H83	D82-K86 WeakPolarHBondContact O-CA 3.37Å; D82-K86 PolarHBondContact O-N 3.44Å; H83-K86 WeakPolarHBondContact O-CE 3.33Å; H83-K86 PolarHBondContact O-NZ 2.95Å
87	T	85.6	Confident	85.2	Confident	70 Å²	70	60 Å²	60	43%	0.429	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	160.8	178.2	47.4	0	0	0	0	111.3	D82 N85	D82-T87 WeakPolarHBondContact CB-OG1 3.31Å; D82-T87 PolarHBondContact N-O 3Å; D82-T87 PolarHBondContact O-N 3.5Å; N85-T87 VanDerWaalsContact C-N 3.29Å; N85-T87 HydrophobicContact CB-CG2 4.49Å; N85-T87 PolarHBondContact O-N 3.09Å
88	T	89.6	Confident	84.9	Confident	98 Å²	98	64.9 Å²	64.9	60%	0.601	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.3	137.3	175.7	56.2	0	0	0	0	109.4	Y79 Y80 I81	Y79-T88 HydrophobicContact CE2-CG2 4.43Å; Y80-T88 CarbonylContact O-C 3.5Å; Y80-T88 VanDerWaalsContact O-CA 3.31Å; Y80-T88 WeakPolarHBondContact O-CA 3.43Å; I81-T88 HydrophobicContact CB-CG2 4.47Å; I81-T88 HydrophobicContact CD1-CG2 4.46Å; I81-T88 HydrophobicContact CG1-CG2 4.02Å; I81-T88 HydrophobicContact CG2-CG2 4.25Å
89	Q	88.3	Confident	84.7	Confident	48 Å²	48	66.8 Å²	66.8	22%	0.224	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	149.6	-176.4	59.3	179.1	67.7	0	0	111.6	W68 Y80 E91	W68-Q89 HydrophobicContact CH2-CG 4.4Å; W68-Q89 HydrophobicContact CZ3-CG 4.05Å; Y80-Q89 PolarHBondContact N-O 3.1Å; Y80-Q89 PolarHBondContact O-N 3.11Å; Q89-E91 PolarHBondContact NE2-O 3.34Å
90	I	89	Confident	84.2	Confident	124 Å²	124	68.3 Å²	68.3	64%	0.636	33%	0.332	S	S	*	.	S	Bend	trans	-81.8	-36.4	-178.7	-59.9	170.7	0	0	0	111	V76	V76-I90 HydrophobicContact CG1-CD1 4.39Å; V76-I90 HydrophobicContact CG1-CG1 4.22Å
91	E	85.6	Confident	83.7	Confident	78 Å²	78	70.7 Å²	70.7	36%	0.364	34%	0.344	S	S	.	.	S	Bend	trans	-78	144.7	-179.2	-162	-174.8	169	0	0	112.1	Y80 Q89 Q96 Q99	Y80-E91 WeakPolarHBondContact CD2-O 3.26Å; Q89-E91 PolarHBondContact NE2-O 3.34Å; E91-Q96 HydrophobicContact CB-CG 4.21Å; E91-Q96 HydrophobicContact CG-CG 3.89Å; E91-Q96 VanDerWaalsContact OE2-CG 3.25Å; E91-Q96 WeakPolarHBondContact OE2-CG 3.31Å; E91-Q96 PolarHBondContact OE2-NE2 3.08Å; E91-Q99 PolarHBondContact OE1-NE2 3.27Å; E91-Q99 VanDerWaalsContact OE1-NE2 3.07Å
92	N	85.3	Confident	83.4	Confident	30 Å²	30	72.3 Å²	72.3	16%	0.16	35%	0.351	C	S	.	.			trans	-65	120.9	178.5	-176.7	-23.1	0	0	0	110.5	Y80 R94 T95 Q96	Y80-N92 HydrophobicContact CD2-CB 4.39Å; Y80-N92 HydrophobicContact CE2-CB 3.69Å; N92-R94 PolarHBondContact ND2-NH2 3.34Å; N92-R94 PolarHBondContact O-N 2.73Å; N92-R94 WeakPolarHBondContact OD1-CB 3.43Å; N92-R94 PolarHBondContact OD1-N 3.25Å; N92-R94 PolarHBondContact OD1-NE 3.19Å; N92-T95 HydrophobicContact CB-CG2 4.3Å; N92-T95 PolarHBondContact O-N 3.41Å; N92-T95 PolarHBondContact O-OG1 3.3Å; N92-Q96 PolarHBondContact O-N 3.12Å; N92-Q96 VanDerWaalsContact O-N 3.13Å
93	P	83.9	Confident	83.1	Confident	4 Å²	4	77.1 Å²	77.1	3%	0.026	37%	0.369	C	S	.	.	H	α-helix	trans	-64.4	-20.6	-174.8	30.3	-40	0	0	0	112.3	F56 L64 W68 Y80 W97	F56-P93 HydrophobicContact CE1-CB 3.73Å; F56-P93 HydrophobicContact CE1-CG 4.08Å; F56-P93 HydrophobicContact CZ-CB 3.93Å; L64-P93 HydrophobicContact CD2-CG 3.74Å; W68-P93 HydrophobicContact CD2-CB 4.22Å; W68-P93 HydrophobicContact CD2-CG 3.91Å; W68-P93 HydrophobicContact CE3-CB 3.99Å; W68-P93 HydrophobicContact CE3-CG 3.58Å; W68-P93 HydrophobicContact CH2-CB 3.69Å; W68-P93 HydrophobicContact CH2-CG 4.22Å; W68-P93 HydrophobicContact CZ2-CB 3.97Å; W68-P93 HydrophobicContact CZ3-CB 3.71Å; W68-P93 HydrophobicContact CZ3-CG 3.73Å; Y80-P93 HydrophobicContact CD1-CG 4.46Å; Y80-P93 HydrophobicContact CG-CG 4.47Å; P93-W97 WeakPolarHBondContact O-CB 3.5Å; P93-W97 PolarHBondContact O-N 2.89Å
94	R	81.6	Confident	83.1	Confident	42 Å²	42	78.8 Å²	78.8	16%	0.158	38%	0.377	C	S	.	.	H	α-helix	trans	-76.5	-32.2	175.3	-60.4	172.6	-69.9	159.6	-3.6	112.6	F56 G61 D62 E63 L64 N92 R98	F56-R94 HydrophobicContact CD1-CG 3.94Å; F56-R94 HydrophobicContact CE1-CG 4.17Å; G61-R94 PolarHBondContact O-NH1 2.94Å; D62-R94 VanDerWaalsContact O-CZ 3.31Å; D62-R94 PolarHBondContact O-NH1 2.86Å; D62-R94 VanDerWaalsContact O-NH1 3.16Å; D62-R94 PolarHBondContact O-NH2 2.7Å; E63-R94 WeakPolarHBondContact O-CD 3.28Å; E63-R94 VanDerWaalsContact O-CZ 3.29Å; E63-R94 PolarHBondContact O-NE 3.05Å; E63-R94 PolarHBondContact O-NH1 3.01Å; L64-R94 HydrophobicContact CD2-CG 4.07Å; N92-R94 PolarHBondContact ND2-NH2 3.34Å; N92-R94 PolarHBondContact O-N 2.73Å; N92-R94 WeakPolarHBondContact OD1-CB 3.43Å; N92-R94 PolarHBondContact OD1-N 3.25Å; N92-R94 PolarHBondContact OD1-NE 3.19Å; R94-R98 WeakPolarHBondContact O-CB 3.46Å; R94-R98 PolarHBondContact O-N 3.34Å; R94-R98 VanDerWaalsContact O-N 3.1Å
95	T	80.6	Confident	83.2	Confident	59 Å²	59	75 Å²	75	36%	0.362	36%	0.358	S	S	.	.	H	α-helix	trans	-74.4	-42.4	173.3	56.4	0	0	0	0	110.2	N92 R98 Q99	N92-T95 HydrophobicContact CB-CG2 4.3Å; N92-T95 PolarHBondContact O-N 3.41Å; N92-T95 PolarHBondContact O-OG1 3.3Å; T95-R98 PolarHBondContact O-N 3.45Å; T95-Q99 WeakPolarHBondContact O-CB 3.41Å; T95-Q99 WeakPolarHBondContact O-CG 3.43Å; T95-Q99 PolarHBondContact O-N 2.78Å
96	Q	82.2	Confident	83.4	Confident	70 Å²	70	73 Å²	73	33%	0.327	34%	0.344	S	S	.	.	H	α-helix	trans	-58.2	-50	172.1	-69.6	-171.4	-29.8	0	0	112.1	E91 N92 R98 Q99 E100	E91-Q96 HydrophobicContact CB-CG 4.21Å; E91-Q96 HydrophobicContact CG-CG 3.89Å; E91-Q96 VanDerWaalsContact OE2-CG 3.25Å; E91-Q96 WeakPolarHBondContact OE2-CG 3.31Å; E91-Q96 PolarHBondContact OE2-NE2 3.08Å; N92-Q96 PolarHBondContact O-N 3.12Å; N92-Q96 VanDerWaalsContact O-N 3.13Å; Q96-R98 VanDerWaalsContact C-N 3.34Å; Q96-R98 PolarHBondContact O-N 2.78Å; Q96-Q99 PolarHBondContact O-N 3.06Å; Q96-E100 WeakPolarHBondContact O-CB 3.35Å; Q96-E100 PolarHBondContact O-N 3.34Å
97	W	82.2	Confident	83.3	Confident	91 Å²	91	69.1 Å²	69.1	35%	0.345	33%	0.327	S	S	.	.	H	α-helix	trans	-59.9	-42.6	178.4	-177.6	85	0	0	0	112	F56 A57 P93 E100 Q101	F56-W97 HydrophobicContact CB-CB 4.22Å; F56-W97 HydrophobicContact CB-CD2 3.38Å; F56-W97 HydrophobicContact CB-CE3 3.77Å; F56-W97 HydrophobicContact CB-CG 3.56Å; F56-W97 HydrophobicContact CB-CZ2 4.27Å; F56-W97 HydrophobicContact CB-CZ3 4.34Å; F56-W97 HydrophobicContact CD1-CB 4.1Å; F56-W97 HydrophobicContact CD1-CG 4.3Å; F56-W97 AromaticContact CD2-CD1 3.9Å; F56-W97 HydrophobicContact CD2-CG 4.14Å; F56-W97 HydrophobicContact CG-CB 4.04Å; F56-W97 AromaticContact CG-CD1 3.97Å; F56-W97 HydrophobicContact CG-CD2 4.13Å; F56-W97 AromaticContact CG-CG 3.76Å; F56-W97 HydrophobicContact CG-CG 3.76Å; A57-W97 HydrophobicContact CB-CH2 3.88Å; A57-W97 HydrophobicContact CB-CZ2 4.33Å; P93-W97 WeakPolarHBondContact O-CB 3.5Å; P93-W97 PolarHBondContact O-N 2.89Å; W97-E100 PolarHBondContact O-N 2.89Å; W97-Q101 HydrophobicContact CD2-CG 4.09Å; W97-Q101 HydrophobicContact CE3-CG 4.33Å; W97-Q101 HydrophobicContact CH2-CG 4.02Å; W97-Q101 HydrophobicContact CZ2-CG 3.75Å; W97-Q101 HydrophobicContact CZ3-CG 4.31Å; W97-Q101 WeakPolarHBondContact O-CG 3.49Å; W97-Q101 PolarHBondContact O-N 3.32Å
98	R	79.8	Confident	83.2	Confident	123 Å²	123	70.6 Å²	70.6	46%	0.464	33%	0.326	S	S	.	.	H	α-helix	trans	-63.7	-47.7	175.3	-176	-176.4	-66.3	172.8	-1	112.1	R94 T95 Q96 E100 Q101 E102	R94-R98 WeakPolarHBondContact O-CB 3.46Å; R94-R98 PolarHBondContact O-N 3.34Å; R94-R98 VanDerWaalsContact O-N 3.1Å; T95-R98 PolarHBondContact O-N 3.45Å; Q96-R98 VanDerWaalsContact C-N 3.34Å; Q96-R98 PolarHBondContact O-N 2.78Å; R98-E100 VanDerWaalsContact C-N 3.25Å; R98-E100 PolarHBondContact O-N 2.78Å; R98-Q101 PolarHBondContact O-N 3.21Å; R98-E102 WeakPolarHBondContact O-CB 3.48Å; R98-E102 PolarHBondContact O-N 3.13Å
99	Q	81.3	Confident	83.1	Confident	102 Å²	102	67.2 Å²	67.2	48%	0.477	30%	0.304	S	S	.	.	H	α-helix	trans	-58.2	-40	177.1	-73	168.5	36.2	0	0	111.1	E91 T95 Q96 E102 R103	E91-Q99 PolarHBondContact OE1-NE2 3.27Å; E91-Q99 VanDerWaalsContact OE1-NE2 3.07Å; T95-Q99 WeakPolarHBondContact O-CB 3.41Å; T95-Q99 WeakPolarHBondContact O-CG 3.43Å; T95-Q99 PolarHBondContact O-N 2.78Å; Q96-Q99 PolarHBondContact O-N 3.06Å; Q99-E102 PolarHBondContact O-N 2.66Å; Q99-R103 VanDerWaalsContact O-CB 3.3Å; Q99-R103 WeakPolarHBondContact O-CB 3.48Å; Q99-R103 PolarHBondContact O-N 3.36Å
100	E	80.3	Confident	83	Confident	76 Å²	76	68.9 Å²	68.9	36%	0.355	32%	0.317	S	S	.	.	H	α-helix	trans	-67.8	-41.7	177.9	179.8	63.9	178.4	0	0	111.9	Q96 W97 R98 E102 R103 M104	Q96-E100 WeakPolarHBondContact O-CB 3.35Å; Q96-E100 PolarHBondContact O-N 3.34Å; W97-E100 PolarHBondContact O-N 2.89Å; R98-E100 VanDerWaalsContact C-N 3.25Å; R98-E100 PolarHBondContact O-N 2.78Å; E100-E102 VanDerWaalsContact C-N 3.33Å; E100-E102 PolarHBondContact O-N 3.24Å; E100-R103 VanDerWaalsContact CD-NH2 3.29Å; E100-R103 PolarHBondContact O-N 3.46Å; E100-R103 IonicContact OE1-CZ 2.71Å; E100-R103 IonicContact OE1-NE 3.82Å; E100-R103 IonicContact OE1-NH2 2.63Å; E100-R103 PolarHBondContact OE1-NH2 3.03Å; E100-R103 IonicContact OE2-CZ 3.27Å; E100-R103 IonicContact OE2-NE 2.75Å; E100-R103 PolarHBondContact OE2-NE 3.46Å; E100-R103 IonicContact OE2-NH2 3.66Å; E100-R103 PolarHBondContact OE2-NH2 3.07Å; E100-R103 VanDerWaalsContact OE2-NH2 3.17Å; E100-M104 HydrophobicContact CG-SD 4.38Å; E100-M104 WeakPolarHBondContact O-CB 3.47Å; E100-M104 VanDerWaalsContact O-CG 3.24Å; E100-M104 WeakPolarHBondContact O-CG 3.5Å; E100-M104 PolarHBondContact O-N 3.2Å
101	Q	77.9	Confident	82.9	Confident	68 Å²	68	64.4 Å²	64.4	32%	0.318	30%	0.296	S	S	.	.	H	α-helix	trans	-65.6	-35.9	172.7	-63.9	-48.8	-90.4	0	0	112.5	W97 R98 L105 M210	W97-Q101 HydrophobicContact CD2-CG 4.09Å; W97-Q101 HydrophobicContact CE3-CG 4.33Å; W97-Q101 HydrophobicContact CH2-CG 4.02Å; W97-Q101 HydrophobicContact CZ2-CG 3.75Å; W97-Q101 HydrophobicContact CZ3-CG 4.31Å; W97-Q101 WeakPolarHBondContact O-CG 3.49Å; W97-Q101 PolarHBondContact O-N 3.32Å; R98-Q101 PolarHBondContact O-N 3.21Å; Q101-L105 VanDerWaalsContact O-CB 3.27Å; Q101-L105 WeakPolarHBondContact O-CB 3.49Å; Q101-L105 PolarHBondContact O-N 3.49Å; Q101-M210 HydrophobicContact CB-CE 4.13Å
102	E	81.9	Confident	82.9	Confident	51 Å²	51	61.8 Å²	61.8	24%	0.238	29%	0.288	C	S	.	.	H	α-helix	trans	-67	-42.8	174.7	-169.4	-172.1	140.7	0	0	111.7	R98 Q99 E100 L105 K106	R98-E102 WeakPolarHBondContact O-CB 3.48Å; R98-E102 PolarHBondContact O-N 3.13Å; Q99-E102 PolarHBondContact O-N 2.66Å; E100-E102 VanDerWaalsContact C-N 3.33Å; E100-E102 PolarHBondContact O-N 3.24Å; E102-L105 PolarHBondContact O-N 3.49Å; E102-K106 HydrophobicContact CG-CD 4.25Å; E102-K106 WeakPolarHBondContact O-CB 3.33Å; E102-K106 WeakPolarHBondContact O-CG 3.4Å; E102-K106 PolarHBondContact O-N 2.97Å; E102-K106 IonicContact OE1-NZ 2.74Å; E102-K106 PolarHBondContact OE1-NZ 2.85Å
103	R	83	Confident	83.1	Confident	106 Å²	106	63.2 Å²	63.2	40%	0.4	29%	0.293	S	S	.	.	H	α-helix	trans	-59.5	-55	174	-173.3	-171	68.8	86.7	-2.2	110.7	Q99 E100 L105 K106 E107	Q99-R103 VanDerWaalsContact O-CB 3.3Å; Q99-R103 WeakPolarHBondContact O-CB 3.48Å; Q99-R103 PolarHBondContact O-N 3.36Å; E100-R103 VanDerWaalsContact CD-NH2 3.29Å; E100-R103 PolarHBondContact O-N 3.46Å; E100-R103 IonicContact OE1-CZ 2.71Å; E100-R103 IonicContact OE1-NE 3.82Å; E100-R103 IonicContact OE1-NH2 2.63Å; E100-R103 PolarHBondContact OE1-NH2 3.03Å; E100-R103 IonicContact OE2-CZ 3.27Å; E100-R103 IonicContact OE2-NE 2.75Å; E100-R103 PolarHBondContact OE2-NE 3.46Å; E100-R103 IonicContact OE2-NH2 3.66Å; E100-R103 PolarHBondContact OE2-NH2 3.07Å; E100-R103 VanDerWaalsContact OE2-NH2 3.17Å; R103-L105 VanDerWaalsContact C-N 3.3Å; R103-L105 PolarHBondContact O-N 3.21Å; R103-K106 PolarHBondContact O-N 2.94Å; R103-K106 VanDerWaalsContact O-N 3.13Å; R103-E107 WeakPolarHBondContact CG-OE1 3.35Å; R103-E107 IonicContact CZ-OE1 2.67Å; R103-E107 IonicContact CZ-OE2 2.96Å; R103-E107 IonicContact NE-OE2 3.33Å; R103-E107 IonicContact NH1-OE1 3.18Å; R103-E107 PolarHBondContact NH1-OE1 3.23Å; R103-E107 IonicContact NH1-OE2 2.65Å; R103-E107 PolarHBondContact NH1-OE2 2.76Å; R103-E107 WeakPolarHBondContact O-CG 3.34Å; R103-E107 PolarHBondContact O-N 2.83Å
104	M	79.5	Confident	83.3	Confident	61 Å²	61	67 Å²	67	30%	0.3	31%	0.311	S	S	.	.	H	α-helix	trans	-56.3	-43.2	177.8	-72.4	178.3	70.8	0	0	111.9	E100 E107 Y108	E100-M104 HydrophobicContact CG-SD 4.38Å; E100-M104 WeakPolarHBondContact O-CB 3.47Å; E100-M104 VanDerWaalsContact O-CG 3.24Å; E100-M104 WeakPolarHBondContact O-CG 3.5Å; E100-M104 PolarHBondContact O-N 3.2Å; M104-E107 PolarHBondContact O-N 3.09Å; M104-Y108 HydrophobicContact CE-CE2 4.32Å; M104-Y108 WeakPolarHBondContact O-CD2 3.29Å; M104-Y108 PolarHBondContact O-N 3.5Å
105	L	83.9	Confident	83.6	Confident	23 Å²	23	65.9 Å²	65.9	12%	0.12	31%	0.311	C	S	.	.	H	α-helix	trans	-62.5	-44	177.6	176.6	61.4	0	0	0	112	Q101 E102 R103 E107 Y108 L109 L203 I206 D207 M210	Q101-L105 VanDerWaalsContact O-CB 3.27Å; Q101-L105 WeakPolarHBondContact O-CB 3.49Å; Q101-L105 PolarHBondContact O-N 3.49Å; E102-L105 PolarHBondContact O-N 3.49Å; R103-L105 VanDerWaalsContact C-N 3.3Å; R103-L105 PolarHBondContact O-N 3.21Å; L105-E107 VanDerWaalsContact C-N 3.33Å; L105-E107 PolarHBondContact O-N 3.16Å; L105-Y108 PolarHBondContact O-N 3.19Å; L105-L109 VanDerWaalsContact O-CB 3.3Å; L105-L109 WeakPolarHBondContact O-CB 3.48Å; L105-L109 PolarHBondContact O-N 3.18Å; L105-L203 HydrophobicContact CD1-CD2 4.1Å; L105-I206 HydrophobicContact CD2-CB 4.48Å; L105-I206 HydrophobicContact CD2-CG2 3.8Å; L105-D207 HydrophobicContact CD2-CB 4.02Å; L105-D207 HydrophobicContact CG-CB 4.4Å; L105-M210 HydrophobicContact CD2-CB 4.28Å; L105-M210 HydrophobicContact CD2-CG 3.85Å
106	K	85	Confident	84	Confident	73 Å²	73	63.3 Å²	63.3	32%	0.317	30%	0.295	S	S	.	.	H	α-helix	trans	-65	-37.8	178.1	-73.5	171	-177.8	179.2	0	111.7	E102 R103 L109 V110 D207 S211	E102-K106 HydrophobicContact CG-CD 4.25Å; E102-K106 WeakPolarHBondContact O-CB 3.33Å; E102-K106 WeakPolarHBondContact O-CG 3.4Å; E102-K106 PolarHBondContact O-N 2.97Å; E102-K106 IonicContact OE1-NZ 2.74Å; E102-K106 PolarHBondContact OE1-NZ 2.85Å; R103-K106 PolarHBondContact O-N 2.94Å; R103-K106 VanDerWaalsContact O-N 3.13Å; K106-L109 PolarHBondContact O-N 3.35Å; K106-V110 WeakPolarHBondContact O-CG2 3.47Å; K106-V110 PolarHBondContact O-N 3.2Å; K106-D207 WeakPolarHBondContact CE-OD1 3.46Å; K106-D207 WeakPolarHBondContact CG-OD1 3.32Å; K106-D207 IonicContact NZ-OD1 3.45Å; K106-S211 WeakPolarHBondContact CE-OG 3.32Å; K106-S211 PolarHBondContact NZ-OG 2.68Å
107	E	83.3	Confident	84.5	Confident	54 Å²	54	63.5 Å²	63.5	25%	0.252	30%	0.298	S	S	.	.	H	α-helix	trans	-69.4	-42.6	176.1	-68	159.7	154.2	0	0	111.8	R103 M104 L105 L109 V110 V111 W339	R103-E107 WeakPolarHBondContact CG-OE1 3.35Å; R103-E107 IonicContact CZ-OE1 2.67Å; R103-E107 IonicContact CZ-OE2 2.96Å; R103-E107 IonicContact NE-OE2 3.33Å; R103-E107 IonicContact NH1-OE1 3.18Å; R103-E107 PolarHBondContact NH1-OE1 3.23Å; R103-E107 IonicContact NH1-OE2 2.65Å; R103-E107 PolarHBondContact NH1-OE2 2.76Å; R103-E107 WeakPolarHBondContact O-CG 3.34Å; R103-E107 PolarHBondContact O-N 2.83Å; M104-E107 PolarHBondContact O-N 3.09Å; L105-E107 VanDerWaalsContact C-N 3.33Å; L105-E107 PolarHBondContact O-N 3.16Å; E107-L109 VanDerWaalsContact C-N 3.31Å; E107-L109 PolarHBondContact O-N 2.73Å; E107-V110 PolarHBondContact O-N 3.06Å; E107-V111 WeakPolarHBondContact O-CG2 3.11Å; E107-V111 PolarHBondContact O-N 3.13Å; E107-W339 HydrophobicContact CB-CH2 3.52Å; E107-W339 HydrophobicContact CB-CZ2 3.85Å; E107-W339 VanDerWaalsContact CD-CZ2 3.46Å; E107-W339 HydrophobicContact CG-CH2 4.03Å; E107-W339 HydrophobicContact CG-CZ2 3.94Å; E107-W339 VanDerWaalsContact OE2-CH2 3.22Å; E107-W339 WeakPolarHBondContact OE2-CH2 3.46Å; E107-W339 WeakPolarHBondContact OE2-CZ2 3.48Å
108	Y	83.5	Confident	84.9	Confident	102 Å²	102	59.9 Å²	59.9	40%	0.4	29%	0.287	S	S	.	.	H	α-helix	trans	-62.5	-35.8	170.4	-82	-61.3	0	0	0	112.7	M104 L105 V111 A112	M104-Y108 HydrophobicContact CE-CE2 4.32Å; M104-Y108 WeakPolarHBondContact O-CD2 3.29Å; M104-Y108 PolarHBondContact O-N 3.5Å; L105-Y108 PolarHBondContact O-N 3.19Å; Y108-V111 PolarHBondContact O-N 2.96Å; Y108-A112 VanDerWaalsContact O-CB 3.29Å; Y108-A112 WeakPolarHBondContact O-CB 3.2Å; Y108-A112 PolarHBondContact O-N 3.36Å
109	L	86.8	Confident	85.5	Confident	26 Å²	26	54.4 Å²	54.4	14%	0.136	27%	0.267	C	S	.	.	H	α-helix	trans	-66.7	-40.8	176.7	176.6	60.6	0	0	0	111.7	L105 K106 E107 A112 Q113 V200 L203 Q204 D207	L105-L109 VanDerWaalsContact O-CB 3.3Å; L105-L109 WeakPolarHBondContact O-CB 3.48Å; L105-L109 PolarHBondContact O-N 3.18Å; K106-L109 PolarHBondContact O-N 3.35Å; E107-L109 VanDerWaalsContact C-N 3.31Å; E107-L109 PolarHBondContact O-N 2.73Å; L109-A112 PolarHBondContact O-N 2.96Å; L109-Q113 WeakPolarHBondContact O-CB 3.42Å; L109-Q113 PolarHBondContact O-N 3.41Å; L109-V200 HydrophobicContact CD1-CG1 4.12Å; L109-L203 HydrophobicContact CD1-CB 3.96Å; L109-Q204 HydrophobicContact CD1-CG 3.69Å; L109-Q204 HydrophobicContact CD2-CG 4.1Å; L109-D207 HydrophobicContact CD2-CB 4.3Å
110	V	87.4	Confident	86.1	Confident	84 Å²	84	53.2 Å²	53.2	51%	0.509	26%	0.26	S	S	.	.	H	α-helix	trans	-60.4	-50.1	171.7	170.8	0	0	0	0	110.5	K106 E107 A112 Q113 E114	K106-V110 WeakPolarHBondContact O-CG2 3.47Å; K106-V110 PolarHBondContact O-N 3.2Å; E107-V110 PolarHBondContact O-N 3.06Å; V110-A112 VanDerWaalsContact C-N 3.31Å; V110-A112 PolarHBondContact O-N 3.03Å; V110-Q113 PolarHBondContact O-N 3.27Å; V110-Q113 VanDerWaalsContact O-N 3.13Å; V110-E114 HydrophobicContact CG1-CG 4.43Å; V110-E114 WeakPolarHBondContact O-CG 3.42Å; V110-E114 PolarHBondContact O-N 3.31Å
111	V	85.1	Confident	86.8	Confident	29 Å²	29	53.2 Å²	53.2	18%	0.176	26%	0.26	C	S	.	.	H	α-helix	trans	-58.1	-41	177.2	167.3	0	0	0	0	112.2	E107 Y108 A115 R347	E107-V111 WeakPolarHBondContact O-CG2 3.11Å; E107-V111 PolarHBondContact O-N 3.13Å; Y108-V111 PolarHBondContact O-N 2.96Å; V111-A115 WeakPolarHBondContact O-CB 3.39Å; V111-A115 PolarHBondContact O-N 3.4Å; V111-R347 HydrophobicContact CG1-CG 4Å
112	A	85.5	Confident	87.6	Confident	24 Å²	24	50 Å²	50	20%	0.198	25%	0.245	C	C	.	.	H	α-helix	trans	-69	-37.4	177.3	0	0	0	0	0	112	Y108 L109 V110 A115 L116 V200 L203	Y108-A112 VanDerWaalsContact O-CB 3.29Å; Y108-A112 WeakPolarHBondContact O-CB 3.2Å; Y108-A112 PolarHBondContact O-N 3.36Å; L109-A112 PolarHBondContact O-N 2.96Å; V110-A112 VanDerWaalsContact C-N 3.31Å; V110-A112 PolarHBondContact O-N 3.03Å; A112-A115 PolarHBondContact O-N 3.29Å; A112-L116 WeakPolarHBondContact O-CB 3.29Å; A112-L116 PolarHBondContact O-N 2.92Å; A112-V200 HydrophobicContact CB-CG2 3.83Å; A112-L203 HydrophobicContact CB-CD1 3.94Å
113	Q	90	Very high	88.2	Confident	60 Å²	60	50 Å²	50	28%	0.28	24%	0.243	S	C	.	.	H	α-helix	trans	-68.9	-40	175.3	-171.3	64.8	68.7	0	0	112.1	L109 V110 L116 N117	L109-Q113 WeakPolarHBondContact O-CB 3.42Å; L109-Q113 PolarHBondContact O-N 3.41Å; V110-Q113 PolarHBondContact O-N 3.27Å; V110-Q113 VanDerWaalsContact O-N 3.13Å; Q113-L116 PolarHBondContact O-N 2.84Å; Q113-N117 PolarHBondContact NE2-OD1 3.44Å; Q113-N117 WeakPolarHBondContact O-CB 3.36Å; Q113-N117 PolarHBondContact O-N 2.93Å; Q113-N117 PolarHBondContact O-OD1 3.49Å
114	E	87.9	Confident	88.8	Confident	83 Å²	83	49.4 Å²	49.4	39%	0.388	25%	0.248	S	C	.	.	H	α-helix	trans	-57.8	-52.3	170.6	-72.4	171.8	172.9	0	0	110.8	V110 L116 N117 A118 R347	V110-E114 HydrophobicContact CG1-CG 4.43Å; V110-E114 WeakPolarHBondContact O-CG 3.42Å; V110-E114 PolarHBondContact O-N 3.31Å; E114-L116 PolarHBondContact O-N 2.89Å; E114-N117 PolarHBondContact O-N 3.01Å; E114-A118 WeakPolarHBondContact O-CB 3.48Å; E114-A118 PolarHBondContact O-N 3.2Å; E114-R347 IonicContact OE1-NH1 3.45Å; E114-R347 WeakPolarHBondContact OE2-CD 3.4Å; E114-R347 IonicContact OE2-CZ 2.87Å; E114-R347 IonicContact OE2-NE 2.94Å; E114-R347 IonicContact OE2-NH1 2.69Å; E114-R347 PolarHBondContact OE2-NH1 2.86Å
115	A	87.6	Confident	89.6	Confident	19 Å²	19	47 Å²	47	16%	0.157	24%	0.236	C	C	.	.	H	α-helix	trans	-70	-18.4	-179.1	0	0	0	0	0	113.7	V111 A112 K119 K196	V111-A115 WeakPolarHBondContact O-CB 3.39Å; V111-A115 PolarHBondContact O-N 3.4Å; A112-A115 PolarHBondContact O-N 3.29Å; A115-K119 WeakPolarHBondContact O-CG 3.49Å; A115-K196 PolarHBondContact O-NZ 2.91Å
116	L	90.3	Very high	90.1	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-79.2	-48.3	169.1	171.8	57	0	0	0	110.8	A112 Q113 E114 A118 K119 K120 L193 K196 E197 V200	A112-L116 WeakPolarHBondContact O-CB 3.29Å; A112-L116 PolarHBondContact O-N 2.92Å; Q113-L116 PolarHBondContact O-N 2.84Å; E114-L116 PolarHBondContact O-N 2.89Å; L116-A118 VanDerWaalsContact C-N 3.33Å; L116-A118 PolarHBondContact O-N 2.65Å; L116-K119 PolarHBondContact O-N 3.49Å; L116-K120 PolarHBondContact O-N 3.39Å; L116-L193 HydrophobicContact CD1-CD1 3.42Å; L116-L193 VanDerWaalsContact CD1-CD1 3.42Å; L116-K196 HydrophobicContact CD1-CB 3.92Å; L116-E197 HydrophobicContact CD1-CG 3.56Å; L116-E197 HydrophobicContact CD2-CG 4.09Å; L116-E197 HydrophobicContact CG-CG 4.45Å; L116-V200 HydrophobicContact CB-CG2 4.26Å; L116-V200 HydrophobicContact CD2-CB 3.98Å; L116-V200 HydrophobicContact CD2-CG1 4.2Å; L116-V200 HydrophobicContact CD2-CG2 3.83Å
117	N	91.8	Very high	90.6	Very high	73 Å²	73	45.9 Å²	45.9	39%	0.39	23%	0.231	S	C	.	.	H	α-helix	trans	-59.5	-44.1	177.7	-68.4	-5.1	0	0	0	111.2	Q113 E114 K119 K120 E121	Q113-N117 PolarHBondContact NE2-OD1 3.44Å; Q113-N117 WeakPolarHBondContact O-CB 3.36Å; Q113-N117 PolarHBondContact O-N 2.93Å; Q113-N117 PolarHBondContact O-OD1 3.49Å; E114-N117 PolarHBondContact O-N 3.01Å; N117-K119 VanDerWaalsContact C-N 3.26Å; N117-K119 PolarHBondContact O-N 2.69Å; N117-K120 WeakPolarHBondContact O-CA 3.49Å; N117-K120 WeakPolarHBondContact O-CB 3.28Å; N117-K120 PolarHBondContact O-N 3.14Å; N117-E121 PolarHBondContact O-N 2.69Å
118	A	91.1	Very high	91.2	Very high	15 Å²	15	47.5 Å²	47.5	12%	0.124	24%	0.239	C	C	.	.	H	α-helix	trans	-58.7	-34.6	174.3	0	0	0	0	0	113.1	E114 L116 M122 L354	E114-A118 WeakPolarHBondContact O-CB 3.48Å; E114-A118 PolarHBondContact O-N 3.2Å; L116-A118 VanDerWaalsContact C-N 3.33Å; L116-A118 PolarHBondContact O-N 2.65Å; A118-M122 VanDerWaalsContact O-CB 3.32Å; A118-M122 WeakPolarHBondContact O-CB 3.37Å; A118-M122 PolarHBondContact O-N 3.34Å; A118-L354 HydrophobicContact CB-CD2 3.99Å
119	K	91.9	Very high	91.7	Very high	9 Å²	9	44.2 Å²	44.2	4%	0.039	23%	0.225	C	C	.	.	H	α-helix	trans	-75.5	-30.4	173.6	-74.9	-76.8	-179.3	173.4	0	112.7	A115 L116 N117 M122 Y123 E192 L193 K196 D350	A115-K119 WeakPolarHBondContact O-CG 3.49Å; L116-K119 PolarHBondContact O-N 3.49Å; N117-K119 VanDerWaalsContact C-N 3.26Å; N117-K119 PolarHBondContact O-N 2.69Å; K119-M122 HydrophobicContact CD-CE 4.11Å; K119-M122 HydrophobicContact CD-SD 3.96Å; K119-M122 PolarHBondContact O-N 2.92Å; K119-Y123 WeakPolarHBondContact O-CB 3.39Å; K119-Y123 PolarHBondContact O-N 2.93Å; K119-E192 IonicContact NZ-OE2 2.68Å; K119-E192 PolarHBondContact NZ-OE2 2.76Å; K119-L193 HydrophobicContact CB-CD1 4.43Å; K119-K196 HydrophobicContact CG-CD 4.05Å; K119-D350 WeakPolarHBondContact CE-OD2 3.43Å
120	K	94.6	Very high	92.1	Very high	76 Å²	76	43.7 Å²	43.7	33%	0.33	22%	0.223	S	C	.	.	H	α-helix	trans	-65.3	-44.8	170.5	-68.6	-175.7	178.4	-164.1	0	111.4	L116 N117 Y123 L124 L193 E197	L116-K120 PolarHBondContact O-N 3.39Å; N117-K120 WeakPolarHBondContact O-CA 3.49Å; N117-K120 WeakPolarHBondContact O-CB 3.28Å; N117-K120 PolarHBondContact O-N 3.14Å; K120-Y123 WeakPolarHBondContact O-CB 3.05Å; K120-Y123 PolarHBondContact O-N 2.87Å; K120-L124 WeakPolarHBondContact O-CG 3.43Å; K120-L124 PolarHBondContact O-N 3.19Å; K120-L193 HydrophobicContact CD-CD1 4.4Å; K120-L193 HydrophobicContact CG-CD1 3.49Å; K120-L193 VanDerWaalsContact CG-CD1 3.49Å; K120-L193 HydrophobicContact CG-CD2 4.23Å; K120-E197 WeakPolarHBondContact CE-OE1 3.4Å; K120-E197 IonicContact NZ-OE1 2.69Å; K120-E197 PolarHBondContact NZ-OE1 2.94Å
121	E	94.2	Very high	92.4	Very high	77 Å²	77	42.5 Å²	42.5	36%	0.36	21%	0.212	S	C	.	.	H	α-helix	trans	-61.8	-45.9	172.7	-69	176.8	-136	0	0	111.5	N117 Y123 L124 I125 L354 K358	N117-E121 PolarHBondContact O-N 2.69Å; E121-Y123 VanDerWaalsContact C-N 3.28Å; E121-Y123 PolarHBondContact O-N 3.48Å; E121-L124 PolarHBondContact O-N 3.09Å; E121-L124 VanDerWaalsContact O-N 3.09Å; E121-I125 HydrophobicContact CB-CD1 4.49Å; E121-I125 WeakPolarHBondContact O-CD1 3.39Å; E121-I125 VanDerWaalsContact O-CG1 3.32Å; E121-I125 WeakPolarHBondContact O-CG1 3.46Å; E121-I125 PolarHBondContact O-N 2.9Å; E121-L354 HydrophobicContact CB-CD1 3.73Å; E121-L354 HydrophobicContact CB-CD2 4.24Å; E121-K358 WeakPolarHBondContact OE2-CE 3.44Å; E121-K358 IonicContact OE2-NZ 3.12Å; E121-K358 PolarHBondContact OE2-NZ 3.32Å
122	M	94.3	Very high	92.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-57.9	-39.1	177	-169.8	-175.8	-61.1	0	0	112.4	A118 K119 K126 V189 Q353 L354 E357	A118-M122 VanDerWaalsContact O-CB 3.32Å; A118-M122 WeakPolarHBondContact O-CB 3.37Å; A118-M122 PolarHBondContact O-N 3.34Å; K119-M122 HydrophobicContact CD-CE 4.11Å; K119-M122 HydrophobicContact CD-SD 3.96Å; K119-M122 PolarHBondContact O-N 2.92Å; M122-K126 WeakPolarHBondContact O-CB 3.34Å; M122-K126 WeakPolarHBondContact O-CG 3.42Å; M122-K126 PolarHBondContact O-N 3.03Å; M122-V189 HydrophobicContact SD-CG2 4.44Å; M122-Q353 HydrophobicContact CE-CB 3.78Å; M122-Q353 HydrophobicContact CE-CG 3.62Å; M122-Q353 HydrophobicContact SD-CG 4.08Å; M122-L354 HydrophobicContact CB-CD1 4.1Å; M122-L354 HydrophobicContact CE-CB 4.34Å; M122-E357 HydrophobicContact CG-CG 4.28Å
123	Y	95.4	Very high	92.9	Very high	50 Å²	50	40.7 Å²	40.7	20%	0.196	20%	0.198	C	C	.	.	H	α-helix	trans	-62.6	-48.9	172.5	174	-91	0	0	0	111.8	K119 K120 E121 I125 K126 Q127 L186 K190	K119-Y123 WeakPolarHBondContact O-CB 3.39Å; K119-Y123 PolarHBondContact O-N 2.93Å; K120-Y123 WeakPolarHBondContact O-CB 3.05Å; K120-Y123 PolarHBondContact O-N 2.87Å; E121-Y123 VanDerWaalsContact C-N 3.28Å; E121-Y123 PolarHBondContact O-N 3.48Å; Y123-I125 PolarHBondContact O-N 3.25Å; Y123-K126 PolarHBondContact O-N 3.09Å; Y123-Q127 WeakPolarHBondContact O-CB 3.44Å; Y123-Q127 PolarHBondContact O-N 3.06Å; Y123-L186 HydrophobicContact CD2-CG 4.25Å; Y123-L186 HydrophobicContact CE2-CD1 4.38Å; Y123-L186 HydrophobicContact CE2-CD2 3.72Å; Y123-L186 HydrophobicContact CE2-CG 3.8Å; Y123-K190 HydrophobicContact CD2-CB 4.21Å; Y123-K190 HydrophobicContact CE2-CB 3.96Å; Y123-K190 HydrophobicContact CE2-CD 4.39Å; Y123-K190 HydrophobicContact CE2-CG 4.31Å
124	L	96.1	Very high	92.9	Very high	95 Å²	95	41.4 Å²	41.4	50%	0.497	20%	0.201	S	C	.	.	H	α-helix	trans	-61.9	-41.3	179.5	-69.5	170.2	0	0	0	112.2	K120 E121 Q127 Q128	K120-L124 WeakPolarHBondContact O-CG 3.43Å; K120-L124 PolarHBondContact O-N 3.19Å; E121-L124 PolarHBondContact O-N 3.09Å; E121-L124 VanDerWaalsContact O-N 3.09Å; L124-Q127 WeakPolarHBondContact O-CB 3.31Å; L124-Q127 PolarHBondContact O-N 2.88Å; L124-Q128 WeakPolarHBondContact O-CG 3.43Å; L124-Q128 PolarHBondContact O-N 3.45Å
125	I	95.1	Very high	92.9	Very high	11 Å²	11	43.9 Å²	43.9	6%	0.056	21%	0.207	C	C	.	.	H	α-helix	trans	-65	-46.5	176.8	-67.6	154	0	0	0	110.7	E121 Y123 Q127 Q128 R129 L354 E357 K358 L361	E121-I125 HydrophobicContact CB-CD1 4.49Å; E121-I125 WeakPolarHBondContact O-CD1 3.39Å; E121-I125 VanDerWaalsContact O-CG1 3.32Å; E121-I125 WeakPolarHBondContact O-CG1 3.46Å; E121-I125 PolarHBondContact O-N 2.9Å; Y123-I125 PolarHBondContact O-N 3.25Å; I125-Q127 VanDerWaalsContact C-N 3.25Å; I125-Q127 PolarHBondContact O-N 3.31Å; I125-Q128 PolarHBondContact O-N 3.48Å; I125-R129 HydrophobicContact CG2-CG 4.43Å; I125-R129 WeakPolarHBondContact O-CG 3.29Å; I125-R129 PolarHBondContact O-N 3.35Å; I125-L354 HydrophobicContact CD1-CD1 3.43Å; I125-L354 VanDerWaalsContact CD1-CD1 3.43Å; I125-E357 HydrophobicContact CG2-CB 3.86Å; I125-E357 WeakPolarHBondContact CG2-O 3.47Å; I125-K358 HydrophobicContact CD1-CD 4.18Å; I125-K358 HydrophobicContact CD1-CG 3.43Å; I125-K358 VanDerWaalsContact CD1-CG 3.43Å; I125-K358 HydrophobicContact CG1-CG 4.35Å; I125-L361 HydrophobicContact CG1-CD2 4.49Å; I125-L361 HydrophobicContact CG2-CB 4.01Å; I125-L361 HydrophobicContact CG2-CD2 4.04Å
126	K	95.1	Very high	92.8	Very high	6 Å²	6	43.9 Å²	43.9	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-62.5	-33.2	174.7	-76.2	-169.6	-179.6	-61.5	0	112.2	M122 Y123 L130 E185 V189 E357	M122-K126 WeakPolarHBondContact O-CB 3.34Å; M122-K126 WeakPolarHBondContact O-CG 3.42Å; M122-K126 PolarHBondContact O-N 3.03Å; Y123-K126 PolarHBondContact O-N 3.09Å; K126-L130 VanDerWaalsContact O-CB 3.24Å; K126-L130 WeakPolarHBondContact O-CB 3.37Å; K126-L130 PolarHBondContact O-N 2.96Å; K126-E185 HydrophobicContact CD-CB 4.1Å; K126-E185 IonicContact NZ-OE2 2.82Å; K126-E185 PolarHBondContact NZ-OE2 2.94Å; K126-V189 HydrophobicContact CD-CG2 4.11Å; K126-E357 WeakPolarHBondContact CG-OE2 3.49Å; K126-E357 IonicContact NZ-OE1 3.85Å; K126-E357 PolarHBondContact NZ-OE1 3.31Å; K126-E357 IonicContact NZ-OE2 2.69Å; K126-E357 PolarHBondContact NZ-OE2 3.02Å
127	Q	96.5	Very high	92.6	Very high	65 Å²	65	44.8 Å²	44.8	30%	0.304	21%	0.208	S	C	.	.	H	α-helix	trans	-64.6	-48.6	172.1	-172	-176.9	-40.6	0	0	111.3	Y123 L124 I125 R129 L130 E131 L186	Y123-Q127 WeakPolarHBondContact O-CB 3.44Å; Y123-Q127 PolarHBondContact O-N 3.06Å; L124-Q127 WeakPolarHBondContact O-CB 3.31Å; L124-Q127 PolarHBondContact O-N 2.88Å; I125-Q127 VanDerWaalsContact C-N 3.25Å; I125-Q127 PolarHBondContact O-N 3.31Å; Q127-R129 PolarHBondContact O-N 2.88Å; Q127-L130 WeakPolarHBondContact O-CB 3.34Å; Q127-L130 PolarHBondContact O-N 3.18Å; Q127-E131 PolarHBondContact NE2-OE1 3.1Å; Q127-E131 WeakPolarHBondContact O-CG 3.45Å; Q127-E131 PolarHBondContact O-N 2.88Å; Q127-L186 HydrophobicContact CB-CD1 3.84Å; Q127-L186 HydrophobicContact CG-CD1 4.32Å
128	Q	94.6	Very high	92.3	Very high	89 Å²	89	46.4 Å²	46.4	42%	0.416	22%	0.216	S	C	.	.	H	α-helix	trans	-60.6	-44.8	177.3	-72.2	172.9	-14.3	0	0	112.2	L124 I125 L130 E131 L132 L361	L124-Q128 WeakPolarHBondContact O-CG 3.43Å; L124-Q128 PolarHBondContact O-N 3.45Å; I125-Q128 PolarHBondContact O-N 3.48Å; Q128-L130 VanDerWaalsContact C-N 3.33Å; Q128-L130 PolarHBondContact O-N 2.92Å; Q128-E131 PolarHBondContact O-N 3.19Å; Q128-L132 WeakPolarHBondContact O-CG 3.39Å; Q128-L132 PolarHBondContact O-N 3.19Å; Q128-L361 HydrophobicContact CB-CD1 4.23Å; Q128-L361 HydrophobicContact CB-CD2 4.33Å; Q128-L361 VanDerWaalsContact OE1-CD2 3.23Å
129	R	94.6	Very high	91.7	Very high	33 Å²	33	49.6 Å²	49.6	13%	0.125	23%	0.225	C	C	.	.	H	α-helix	trans	-59.8	-41	173.8	-68.9	-179.2	68.1	-163.4	2.5	112.1	I125 Q127 L132 A133 L182 E357 A360 L361 E364	I125-R129 HydrophobicContact CG2-CG 4.43Å; I125-R129 WeakPolarHBondContact O-CG 3.29Å; I125-R129 PolarHBondContact O-N 3.35Å; Q127-R129 PolarHBondContact O-N 2.88Å; R129-L132 PolarHBondContact O-N 2.86Å; R129-A133 WeakPolarHBondContact O-CB 3.45Å; R129-A133 PolarHBondContact O-N 3.44Å; R129-L182 HydrophobicContact CB-CD1 4.4Å; R129-L182 HydrophobicContact CB-CD2 4.33Å; R129-E357 IonicContact CZ-OE2 2.85Å; R129-E357 IonicContact NH1-OE1 2.65Å; R129-E357 IonicContact NH1-OE2 2.7Å; R129-E357 PolarHBondContact NH1-OE2 3.05Å; R129-A360 VanDerWaalsContact CZ-CB 3.48Å; R129-L361 HydrophobicContact CG-CB 3.82Å; R129-L361 HydrophobicContact CG-CD1 3.78Å; R129-L361 HydrophobicContact CG-CG 4.35Å; R129-E364 IonicContact CZ-OE1 3.71Å; R129-E364 VanDerWaalsContact CZ-OE1 3.27Å; R129-E364 IonicContact NE-OE1 2.98Å; R129-E364 PolarHBondContact NE-OE1 2.87Å; R129-E364 IonicContact NE-OE2 2.7Å; R129-E364 IonicContact NH2-OE1 3.88Å; R129-E364 PolarHBondContact NH2-OE1 3.46Å
130	L	95.1	Very high	91.2	Very high	15 Å²	15	50.5 Å²	50.5	8%	0.079	23%	0.23	C	C	.	.	H	α-helix	trans	-66.7	-39.3	175.4	175.5	59.6	0	0	0	112.2	K126 Q127 Q128 A133 Q134 L179 L182 K183 L186	K126-L130 VanDerWaalsContact O-CB 3.24Å; K126-L130 WeakPolarHBondContact O-CB 3.37Å; K126-L130 PolarHBondContact O-N 2.96Å; Q127-L130 WeakPolarHBondContact O-CB 3.34Å; Q127-L130 PolarHBondContact O-N 3.18Å; Q128-L130 VanDerWaalsContact C-N 3.33Å; Q128-L130 PolarHBondContact O-N 2.92Å; L130-A133 PolarHBondContact O-N 2.87Å; L130-Q134 HydrophobicContact CD1-CG 4.39Å; L130-Q134 WeakPolarHBondContact O-CB 3.4Å; L130-Q134 VanDerWaalsContact O-CG 3.28Å; L130-Q134 WeakPolarHBondContact O-CG 3.38Å; L130-Q134 PolarHBondContact O-N 3.1Å; L130-L179 HydrophobicContact CD1-CG 4.19Å; L130-L182 HydrophobicContact CB-CB 4.23Å; L130-L182 HydrophobicContact CD1-CB 4Å; L130-K183 HydrophobicContact CD1-CG 3.79Å; L130-K183 HydrophobicContact CD2-CG 3.85Å; L130-L186 HydrophobicContact CD2-CD1 4.03Å
131	E	92.9	Very high	90.5	Very high	59 Å²	59	50.9 Å²	50.9	28%	0.276	24%	0.236	S	C	.	.	H	α-helix	trans	-66.1	-41.9	174.5	-73	178.8	-151.6	0	0	112.1	Q127 Q128 Q134 R135	Q127-E131 PolarHBondContact NE2-OE1 3.1Å; Q127-E131 WeakPolarHBondContact O-CG 3.45Å; Q127-E131 PolarHBondContact O-N 2.88Å; Q128-E131 PolarHBondContact O-N 3.19Å; E131-Q134 PolarHBondContact O-N 3.22Å; E131-R135 VanDerWaalsContact O-CG 3.3Å; E131-R135 WeakPolarHBondContact O-CG 3.47Å; E131-R135 PolarHBondContact O-N 2.94Å; E131-R135 IonicContact OE2-CZ 2.77Å; E131-R135 IonicContact OE2-NH1 2.81Å; E131-R135 IonicContact OE2-NH2 3.38Å; E131-R135 PolarHBondContact OE2-NH2 3.48Å
132	L	90.1	Very high	89.8	Confident	11 Å²	11	52.9 Å²	52.9	6%	0.058	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-46.6	173.2	-70.2	171.3	0	0	0	111.2	Q128 R129 Q134 R135 E136 L361 L365	Q128-L132 WeakPolarHBondContact O-CG 3.39Å; Q128-L132 PolarHBondContact O-N 3.19Å; R129-L132 PolarHBondContact O-N 2.86Å; L132-Q134 VanDerWaalsContact C-N 3.27Å; L132-Q134 PolarHBondContact O-N 3.29Å; L132-R135 PolarHBondContact O-N 3.12Å; L132-E136 WeakPolarHBondContact O-CG 3.39Å; L132-E136 PolarHBondContact O-N 3.14Å; L132-L361 HydrophobicContact CD1-CD1 3.56Å; L132-L365 HydrophobicContact CD1-CD2 3.86Å; L132-L365 HydrophobicContact CD1-CG 4.23Å; L132-L365 HydrophobicContact CD2-CD2 4.4Å
133	A	90.8	Very high	88.6	Confident	3 Å²	3	58.8 Å²	58.8	3%	0.025	28%	0.276	C	S	.	.	H	α-helix	trans	-61.7	-32.7	175.5	0	0	0	0	0	113	R129 L130 M137 L182	R129-A133 WeakPolarHBondContact O-CB 3.45Å; R129-A133 PolarHBondContact O-N 3.44Å; L130-A133 PolarHBondContact O-N 2.87Å; A133-M137 WeakPolarHBondContact O-CB 3.5Å; A133-M137 PolarHBondContact O-N 2.72Å; A133-M137 VanDerWaalsContact O-N 3.1Å; A133-L182 HydrophobicContact CB-CD1 3.95Å
134	Q	91.7	Very high	87.2	Confident	76 Å²	76	58.4 Å²	58.4	36%	0.355	28%	0.281	S	S	.	.	H	α-helix	trans	-69.9	-44.8	172.2	-76.3	175.1	41.3	0	0	112.2	L130 E131 L132 M137 L138 L179	L130-Q134 HydrophobicContact CD1-CG 4.39Å; L130-Q134 WeakPolarHBondContact O-CB 3.4Å; L130-Q134 VanDerWaalsContact O-CG 3.28Å; L130-Q134 WeakPolarHBondContact O-CG 3.38Å; L130-Q134 PolarHBondContact O-N 3.1Å; E131-Q134 PolarHBondContact O-N 3.22Å; L132-Q134 VanDerWaalsContact C-N 3.27Å; L132-Q134 PolarHBondContact O-N 3.29Å; Q134-M137 WeakPolarHBondContact O-CB 3.44Å; Q134-M137 PolarHBondContact O-N 3.1Å; Q134-L138 WeakPolarHBondContact O-CG 3.48Å; Q134-L138 PolarHBondContact O-N 2.83Å; Q134-L179 HydrophobicContact CG-CD1 3.84Å; Q134-L179 HydrophobicContact CG-CG 4.29Å
135	R	87.4	Confident	85.4	Confident	134 Å²	134	54.8 Å²	54.8	51%	0.506	27%	0.267	S	S	.	.	H	α-helix	trans	-61.3	-42.9	176.1	-69.7	168.1	-172.1	126.1	12.2	111.6	E131 L132 L138 R139	E131-R135 VanDerWaalsContact O-CG 3.3Å; E131-R135 WeakPolarHBondContact O-CG 3.47Å; E131-R135 PolarHBondContact O-N 2.94Å; E131-R135 IonicContact OE2-CZ 2.77Å; E131-R135 IonicContact OE2-NH1 2.81Å; E131-R135 IonicContact OE2-NH2 3.38Å; E131-R135 PolarHBondContact OE2-NH2 3.48Å; L132-R135 PolarHBondContact O-N 3.12Å; R135-L138 PolarHBondContact O-N 3.18Å; R135-R139 PolarHBondContact O-N 2.94Å; R135-R139 VanDerWaalsContact O-N 3.09Å
136	E	85.3	Confident	83.4	Confident	19 Å²	19	60.4 Å²	60.4	9%	0.089	30%	0.297	C	S	.	.	H	α-helix	trans	-57.5	-47.4	171.2	-75.4	178.9	-138.9	0	0	111.8	L132 R139 L140 K175 R178 V368	L132-E136 WeakPolarHBondContact O-CG 3.39Å; L132-E136 PolarHBondContact O-N 3.14Å; E136-R139 PolarHBondContact O-N 2.87Å; E136-L140 WeakPolarHBondContact O-CB 3.43Å; E136-L140 PolarHBondContact O-N 3.38Å; E136-K175 WeakPolarHBondContact OE2-CD 3.36Å; E136-K175 WeakPolarHBondContact OE2-CE 3.39Å; E136-K175 IonicContact OE2-NZ 3.75Å; E136-K175 PolarHBondContact OE2-NZ 2.81Å; E136-R178 VanDerWaalsContact CD-NH1 3.25Å; E136-R178 IonicContact OE1-CZ 2.72Å; E136-R178 IonicContact OE1-NH1 3.2Å; E136-R178 PolarHBondContact OE1-NH1 2.95Å; E136-R178 IonicContact OE1-NH2 3.51Å; E136-R178 PolarHBondContact OE1-NH2 3.3Å; E136-R178 VanDerWaalsContact OE1-NH2 3.14Å; E136-R178 IonicContact OE2-NH1 2.73Å; E136-R178 PolarHBondContact OE2-NH1 3.06Å; E136-V368 HydrophobicContact CG-CG2 4.43Å
137	M	86.9	Confident	81.4	Confident	24 Å²	24	66.8 Å²	66.8	12%	0.118	33%	0.331	C	S	.	.	H	α-helix	trans	-62.4	-42.2	179.4	-103.5	-104.7	64	0	0	112.8	A133 Q134 N141 I172 K175 R176 L179	A133-M137 WeakPolarHBondContact O-CB 3.5Å; A133-M137 PolarHBondContact O-N 2.72Å; A133-M137 VanDerWaalsContact O-N 3.1Å; Q134-M137 WeakPolarHBondContact O-CB 3.44Å; Q134-M137 PolarHBondContact O-N 3.1Å; M137-N141 VanDerWaalsContact O-CB 3.3Å; M137-N141 WeakPolarHBondContact O-CB 3.34Å; M137-N141 PolarHBondContact O-N 2.97Å; M137-I172 HydrophobicContact CE-CG2 4.45Å; M137-K175 HydrophobicContact CG-CB 4.14Å; M137-R176 HydrophobicContact CE-CG 4.3Å; M137-R176 HydrophobicContact SD-CB 4.47Å; M137-R176 HydrophobicContact SD-CG 3.37Å; M137-R176 WeakPolarHBondContact SD-CG 3.26Å; M137-L179 HydrophobicContact CB-CD1 4.05Å; M137-L179 HydrophobicContact CG-CD1 3.76Å; M137-L179 HydrophobicContact SD-CD1 4.45Å
138	L	85.1	Confident	79.1	Confident	108 Å²	108	70.9 Å²	70.9	57%	0.565	35%	0.35	S	S	*	.	H	α-helix	trans	-63.1	-50.5	177.2	-70.4	169.4	0	0	0	110.8	Q134 R135 L140 N141 E142	Q134-L138 WeakPolarHBondContact O-CG 3.48Å; Q134-L138 PolarHBondContact O-N 2.83Å; R135-L138 PolarHBondContact O-N 3.18Å; L138-L140 VanDerWaalsContact C-N 3.34Å; L138-L140 PolarHBondContact O-N 2.68Å; L138-N141 CarbonylContact O-C 3.6Å; L138-N141 WeakPolarHBondContact O-CB 3.42Å; L138-N141 PolarHBondContact O-N 2.93Å; L138-N141 VanDerWaalsContact O-N 3.11Å; L138-E142 WeakPolarHBondContact O-CG 3.39Å; L138-E142 PolarHBondContact O-N 2.95Å
139	R	79.1	Confident	77	Confident	82 Å²	82	70.9 Å²	70.9	31%	0.309	36%	0.36	S	S	.	.	H	α-helix	trans	-54.1	-46	175.5	-102.6	-174.1	165.2	-158.2	-9.9	113.6	R135 E136 N141 E142 L143 P372	R135-R139 PolarHBondContact O-N 2.94Å; R135-R139 VanDerWaalsContact O-N 3.09Å; E136-R139 PolarHBondContact O-N 2.87Å; R139-N141 VanDerWaalsContact C-N 3.3Å; R139-N141 PolarHBondContact O-N 3.42Å; R139-E142 WeakPolarHBondContact O-CB 3.4Å; R139-E142 PolarHBondContact O-N 3.28Å; R139-L143 WeakPolarHBondContact O-CG 3.48Å; R139-L143 PolarHBondContact O-N 3.32Å; R139-P372 PolarHBondContact NH1-O 3.49Å; R139-P372 VanDerWaalsContact NH1-O 3.14Å; R139-P372 PolarHBondContact NH2-O 2.92Å
140	L	79.7	Confident	74.6	Confident	27 Å²	27	75 Å²	75	14%	0.141	39%	0.389	C	S	.	.	H	α-helix	trans	-72.1	-30.1	-177.5	-154.9	160.3	0	0	0	110.8	E136 L138 S144 I168 E171 I172	E136-L140 WeakPolarHBondContact O-CB 3.43Å; E136-L140 PolarHBondContact O-N 3.38Å; L138-L140 VanDerWaalsContact C-N 3.34Å; L138-L140 PolarHBondContact O-N 2.68Å; L140-S144 PolarHBondContact O-N 2.95Å; L140-S144 VanDerWaalsContact O-N 3.1Å; L140-I168 HydrophobicContact CD2-CG2 4.44Å; L140-E171 HydrophobicContact CD1-CG 3.87Å; L140-I172 HydrophobicContact CD2-CD1 4.03Å; L140-I172 HydrophobicContact CD2-CG1 3.42Å; L140-I172 VanDerWaalsContact CD2-CG1 3.42Å
141	N	81.3	Confident	72.3	Confident	84 Å²	84	81.8 Å²	81.8	45%	0.449	43%	0.431	S	S	.	.	H	α-helix	trans	-68.9	-41.9	170.6	-163.3	91.1	0	0	0	112.1	M137 L138 R139 S144 G145	M137-N141 VanDerWaalsContact O-CB 3.3Å; M137-N141 WeakPolarHBondContact O-CB 3.34Å; M137-N141 PolarHBondContact O-N 2.97Å; L138-N141 CarbonylContact O-C 3.6Å; L138-N141 WeakPolarHBondContact O-CB 3.42Å; L138-N141 PolarHBondContact O-N 2.93Å; L138-N141 VanDerWaalsContact O-N 3.11Å; R139-N141 VanDerWaalsContact C-N 3.3Å; R139-N141 PolarHBondContact O-N 3.42Å; N141-S144 PolarHBondContact O-N 3.36Å; N141-S144 PolarHBondContact O-OG 2.89Å; N141-G145 PolarHBondContact O-N 3.29Å
142	E	78.8	Confident	69.9	Low	120 Å²	120	83.3 Å²	83.3	56%	0.561	45%	0.448	S	S	*	.	H	α-helix	trans	-58.5	-48.5	172.6	-70.1	160.8	179.8	0	0	111.5	L138 R139 S144 G145 D146	L138-E142 WeakPolarHBondContact O-CG 3.39Å; L138-E142 PolarHBondContact O-N 2.95Å; R139-E142 WeakPolarHBondContact O-CB 3.4Å; R139-E142 PolarHBondContact O-N 3.28Å; E142-S144 PolarHBondContact O-N 2.97Å; E142-G145 VanDerWaalsContact O-CA 3.28Å; E142-G145 WeakPolarHBondContact O-CA 3.48Å; E142-G145 PolarHBondContact O-N 3.49Å; E142-D146 PolarHBondContact O-N 2.97Å
143	L	68.6	Low	67.8	Low	123 Å²	123	89.6 Å²	89.6	64%	0.644	49%	0.487	S	S	*	.	H	α-helix	trans	-63.7	-25.1	176.2	-69.3	169.2	0	0	0	113.3	R139 N147	R139-L143 WeakPolarHBondContact O-CG 3.48Å; R139-L143 PolarHBondContact O-N 3.32Å; L143-N147 PolarHBondContact O-ND2 2.96Å
144	S	66.3	Low	65.4	Low	43 Å²	43	99 Å²	99	30%	0.301	53%	0.528	S	S	.	.	H	α-helix	trans	-80	-19.8	169	78.7	0	0	0	0	113.4	L140 N141 E142 H148	L140-S144 PolarHBondContact O-N 2.95Å; L140-S144 VanDerWaalsContact O-N 3.1Å; N141-S144 PolarHBondContact O-N 3.36Å; N141-S144 PolarHBondContact O-OG 2.89Å; E142-S144 PolarHBondContact O-N 2.97Å; S144-H148 PolarHBondContact O-CE1 2.91Å; S144-H148 PolarHBondContact O-ND1 3.47Å
145	G	58	Low	62.9	Low	19 Å²	19	100.1 Å²	100.1	20%	0.196	54%	0.544	C	S	.	.	H	α-helix	trans	-69.8	-51.7	179.9	0	0	0	0	0	113.7	N141 E142 N147 H148	N141-G145 PolarHBondContact O-N 3.29Å; E142-G145 VanDerWaalsContact O-CA 3.28Å; E142-G145 WeakPolarHBondContact O-CA 3.48Å; E142-G145 PolarHBondContact O-N 3.49Å; G145-N147 PolarHBondContact O-N 3.45Å; G145-H148 VanDerWaalsContact CA-CE1 3.44Å; G145-H148 WeakPolarHBondContact CA-CE1 3.32Å; G145-H148 PolarHBondContact O-CD2 3.48Å; G145-H148 PolarHBondContact O-CE1 2.84Å; G145-H148 VanDerWaalsContact O-CG 3.24Å; G145-H148 PolarHBondContact O-N 3.43Å; G145-H148 PolarHBondContact O-ND1 3.23Å; G145-H148 VanDerWaalsContact O-ND1 3.08Å; G145-H148 PolarHBondContact O-NE2 3.38Å
146	D	52.9	Low	60.6	Low	129 Å²	129	97.2 Å²	97.2	69%	0.69	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-66.6	-14.3	-171.4	-68.5	-30.5	0	0	0	114.2	E142 H148	E142-D146 PolarHBondContact O-N 2.97Å; D146-H148 VanDerWaalsContact C-N 3.28Å; D146-H148 PolarHBondContact O-N 2.74Å
147	N	53	Low	58.7	Low	139 Å²	139	102.5 Å²	102.5	74%	0.743	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-74.9	-4.5	179.9	-72.8	-73.6	0	0	0	115.1	L143 G145	L143-N147 PolarHBondContact O-ND2 2.96Å; G145-N147 PolarHBondContact O-N 3.45Å
148	H	49.6	Very low	56.4	Low	152 Å²	152	107 Å²	107	70%	0.704	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-102.6	5.3	175.7	28	-84.2	0	0	0	115.4	S144 G145 D146	S144-H148 PolarHBondContact O-CE1 2.91Å; S144-H148 PolarHBondContact O-ND1 3.47Å; G145-H148 VanDerWaalsContact CA-CE1 3.44Å; G145-H148 WeakPolarHBondContact CA-CE1 3.32Å; G145-H148 PolarHBondContact O-CD2 3.48Å; G145-H148 PolarHBondContact O-CE1 2.84Å; G145-H148 VanDerWaalsContact O-CG 3.24Å; G145-H148 PolarHBondContact O-N 3.43Å; G145-H148 PolarHBondContact O-ND1 3.23Å; G145-H148 VanDerWaalsContact O-ND1 3.08Å; G145-H148 PolarHBondContact O-NE2 3.38Å; D146-H148 VanDerWaalsContact C-N 3.28Å; D146-H148 PolarHBondContact O-N 2.74Å
149	S	49.3	Very low	54.6	Low	89 Å²	89	108 Å²	108	62%	0.622	65%	0.645	S	S	*	*			trans	-105.7	34.2	-163.8	-63.8	0	0	0	0	117
150	T	43.9	Very low	53.2	Low	120 Å²	120	108.2 Å²	108.2	74%	0.736	66%	0.659	S	S	*	*			trans	-140.5	94.6	165.3	53.4	0	0	0	0	114.2	S152	T150-S152 PolarHBondContact O-N 3.12Å
151	T	47.9	Very low	51.7	Low	157 Å²	157	111.6 Å²	111.6	96%	0.963	69%	0.69	S	S	*	*			trans	-78.3	82	158.6	31.1	0	0	0	0	110.5
152	S	42.1	Very low	50.7	Low	90 Å²	90	116.1 Å²	116.1	63%	0.629	71%	0.706	S	S	*	*			trans	-129	100.8	177.5	59.2	0	0	0	0	112.4	T150 F154	T150-S152 PolarHBondContact O-N 3.12Å; S152-F154 PolarHBondContact O-N 3.2Å; S152-F154 VanDerWaalsContact O-N 3.16Å
153	T	46.3	Very low	49.8	Very low	144 Å²	144	118.3 Å²	118.3	88%	0.883	71%	0.71	S	S	*	*			trans	-82.6	80.7	-178.5	49.6	0	0	0	0	113.2
154	F	39.1	Very low	50.3	Low	199 Å²	199	116.6 Å²	116.6	87%	0.873	70%	0.702	S	S	*	*			trans	-165	168.8	148	-141.9	-118.5	0	0	0	113.8	S152	S152-F154 PolarHBondContact O-N 3.2Å; S152-F154 VanDerWaalsContact O-N 3.16Å
155	S	39.5	Very low	50.8	Low	100 Å²	100	118.5 Å²	118.5	70%	0.699	71%	0.714	S	S	*	*			trans	65.2	96.3	164.8	-67	0	0	0	0	120.2
156	G	39.5	Very low	51.8	Low	73 Å²	73	122.3 Å²	122.3	75%	0.753	73%	0.729	S	S	*	*			trans	16	125.6	130.8	0	0	0	0	0	122.1
157	S	45.4	Very low	53.1	Low	131 Å²	131	121.8 Å²	121.8	92%	0.916	72%	0.723	S	S	*	*			trans	51.6	89.5	142.6	-57.3	0	0	0	0	119
158	S	39.9	Very low	54.4	Low	119 Å²	119	118.1 Å²	118.1	83%	0.832	70%	0.702	S	S	*	*			trans	-139.8	133.6	142.7	63.1	0	0	0	0	111.2
159	S	46.7	Very low	56	Low	128 Å²	128	116.7 Å²	116.7	90%	0.895	69%	0.694	S	S	*	*			trans	-96.5	94.3	-175.3	54.1	0	0	0	0	110.9
160	S	48.3	Very low	57.6	Low	87 Å²	87	115.3 Å²	115.3	61%	0.608	69%	0.688	S	S	*	*			trans	-152.9	40.1	178.7	-169.9	0	0	0	0	115.7	K162	S160-K162 PolarHBondContact O-N 3.1Å
161	A	49.4	Very low	59.5	Low	97 Å²	97	113.9 Å²	113.9	80%	0.802	67%	0.673	S	S	*	*			trans	-79.4	94.3	156	0	0	0	0	0	108.3	Y163	A161-Y163 PolarHBondContact O-N 3.38Å
162	K	60.6	Low	61.3	Low	179 Å²	179	107.6 Å²	107.6	78%	0.778	63%	0.633	S	S	*	*			trans	-75.9	-5.5	-176.6	-78.2	-171.5	176.8	-179.5	0	114.7	S160	S160-K162 PolarHBondContact O-N 3.1Å
163	Y	59.8	Low	63.5	Low	166 Å²	166	106 Å²	106	65%	0.651	63%	0.626	S	S	*	*	S	Bend	trans	-133.2	139.6	-177.1	-65.1	-80.2	0	0	0	109.4	A161	A161-Y163 PolarHBondContact O-N 3.38Å
164	D	78.3	Confident	65.5	Low	87 Å²	87	102.6 Å²	102.6	47%	0.465	61%	0.607	S	S	.	*			trans	-74.2	126.3	175.3	177.7	-9.1	0	0	0	109.8	D166 Q167 I168	D164-D166 PolarHBondContact O-N 3.5Å; D164-D166 PolarHBondContact OD1-N 3.48Å; D164-Q167 HydrophobicContact CB-CB 3.8Å; D164-Q167 WeakPolarHBondContact O-CB 3.24Å; D164-Q167 PolarHBondContact O-N 3.17Å; D164-Q167 VanDerWaalsContact O-N 3.09Å; D164-I168 PolarHBondContact O-N 3.4Å
165	P	76.7	Confident	67.7	Low	84 Å²	84	95.3 Å²	95.3	55%	0.545	58%	0.575	S	S	.	*	H	α-helix	trans	-54.1	-31.1	174.9	-27	35.8	0	0	0	114.4	K169	P165-K169 WeakPolarHBondContact O-CE 3.46Å; P165-K169 VanDerWaalsContact O-CG 3.26Å; P165-K169 WeakPolarHBondContact O-CG 3.39Å; P165-K169 PolarHBondContact O-N 2.81Å; P165-K169 VanDerWaalsContact O-N 3.14Å
166	D	79.1	Confident	70.2	Confident	98 Å²	98	97 Å²	97	52%	0.524	57%	0.566	S	S	.	*	H	α-helix	trans	-80.5	-30.8	178	-70.6	-30.8	0	0	0	112.1	D164 K169 A170	D164-D166 PolarHBondContact O-N 3.5Å; D164-D166 PolarHBondContact OD1-N 3.48Å; D166-K169 PolarHBondContact O-N 2.71Å; D166-K169 WeakPolarHBondContact OD1-CD 3.46Å; D166-K169 WeakPolarHBondContact OD1-CE 3.48Å; D166-K169 IonicContact OD1-NZ 3.35Å; D166-K169 PolarHBondContact OD1-NZ 2.93Å; D166-A170 WeakPolarHBondContact O-CB 3.31Å; D166-A170 PolarHBondContact O-N 2.96Å
167	Q	80.9	Confident	72.7	Confident	119 Å²	119	98.3 Å²	98.3	56%	0.556	55%	0.552	S	S	*	*	H	α-helix	trans	-62.8	-42.3	168.1	-173.3	-178.7	24	0	0	111.5	D164 A170 E171	D164-Q167 HydrophobicContact CB-CB 3.8Å; D164-Q167 WeakPolarHBondContact O-CB 3.24Å; D164-Q167 PolarHBondContact O-N 3.17Å; D164-Q167 VanDerWaalsContact O-N 3.09Å; Q167-A170 PolarHBondContact O-N 3.47Å; Q167-E171 PolarHBondContact O-N 3.31Å
168	I	79	Confident	75	Confident	61 Å²	61	94.3 Å²	94.3	31%	0.313	52%	0.517	S	S	.	.	H	α-helix	trans	-63.9	-42.1	175.5	-64	170.7	0	0	0	110.8	L140 D164 A170 E171 I172	L140-I168 HydrophobicContact CD2-CG2 4.44Å; D164-I168 PolarHBondContact O-N 3.4Å; I168-A170 VanDerWaalsContact C-N 3.34Å; I168-A170 PolarHBondContact O-N 2.83Å; I168-E171 PolarHBondContact O-N 2.95Å; I168-I172 HydrophobicContact CG2-CD1 3.9Å; I168-I172 HydrophobicContact CG2-CG1 4.48Å; I168-I172 VanDerWaalsContact O-CG1 3.29Å; I168-I172 WeakPolarHBondContact O-CG1 3.36Å; I168-I172 PolarHBondContact O-N 2.72Å
169	K	83.3	Confident	77.6	Confident	122 Å²	122	89.8 Å²	89.8	53%	0.53	48%	0.484	S	S	.	.	H	α-helix	trans	-62	-40.8	174.6	-69.9	165.7	-150.6	164.5	0	112	P165 D166 I172 A173	P165-K169 WeakPolarHBondContact O-CE 3.46Å; P165-K169 VanDerWaalsContact O-CG 3.26Å; P165-K169 WeakPolarHBondContact O-CG 3.39Å; P165-K169 PolarHBondContact O-N 2.81Å; P165-K169 VanDerWaalsContact O-N 3.14Å; D166-K169 PolarHBondContact O-N 2.71Å; D166-K169 WeakPolarHBondContact OD1-CD 3.46Å; D166-K169 WeakPolarHBondContact OD1-CE 3.48Å; D166-K169 IonicContact OD1-NZ 3.35Å; D166-K169 PolarHBondContact OD1-NZ 2.93Å; K169-I172 PolarHBondContact O-N 3.21Å; K169-A173 WeakPolarHBondContact O-CB 3.46Å; K169-A173 PolarHBondContact O-N 2.95Å
170	A	84.3	Confident	79.9	Confident	60 Å²	60	87.2 Å²	87.2	50%	0.496	47%	0.466	S	S	.	.	H	α-helix	trans	-64.4	-41.6	176.6	0	0	0	0	0	111.9	D166 Q167 I168 A173 C174	D166-A170 WeakPolarHBondContact O-CB 3.31Å; D166-A170 PolarHBondContact O-N 2.96Å; Q167-A170 PolarHBondContact O-N 3.47Å; I168-A170 VanDerWaalsContact C-N 3.34Å; I168-A170 PolarHBondContact O-N 2.83Å; A170-A173 PolarHBondContact O-N 2.87Å; A170-C174 WeakPolarHBondContact O-CB 3.37Å; A170-C174 PolarHBondContact O-N 3.31Å
171	E	84.3	Confident	82.1	Confident	91 Å²	91	88.5 Å²	88.5	43%	0.425	46%	0.457	S	S	.	.	H	α-helix	trans	-64.5	-46.3	173.6	-172.5	171.9	-174.1	0	0	111.4	L140 Q167 I168 A173 C174 K175	L140-E171 HydrophobicContact CD1-CG 3.87Å; Q167-E171 PolarHBondContact O-N 3.31Å; I168-E171 PolarHBondContact O-N 2.95Å; E171-A173 VanDerWaalsContact C-N 3.27Å; E171-A173 PolarHBondContact O-N 2.95Å; E171-C174 PolarHBondContact O-N 2.96Å; E171-K175 HydrophobicContact CG-CG 4.05Å; E171-K175 WeakPolarHBondContact O-CB 3.48Å; E171-K175 WeakPolarHBondContact O-CG 3.21Å; E171-K175 PolarHBondContact O-N 2.91Å; E171-K175 WeakPolarHBondContact OE1-CE 3.41Å; E171-K175 IonicContact OE1-NZ 2.78Å
172	I	84.9	Confident	84.3	Confident	24 Å²	24	84 Å²	84	12%	0.123	42%	0.42	C	S	.	.	H	α-helix	trans	-53.9	-45.4	174	-71.2	165.4	0	0	0	110.9	M137 L140 I168 K169 R176	M137-I172 HydrophobicContact CE-CG2 4.45Å; L140-I172 HydrophobicContact CD2-CD1 4.03Å; L140-I172 HydrophobicContact CD2-CG1 3.42Å; L140-I172 VanDerWaalsContact CD2-CG1 3.42Å; I168-I172 HydrophobicContact CG2-CD1 3.9Å; I168-I172 HydrophobicContact CG2-CG1 4.48Å; I168-I172 VanDerWaalsContact O-CG1 3.29Å; I168-I172 WeakPolarHBondContact O-CG1 3.36Å; I168-I172 PolarHBondContact O-N 2.72Å; K169-I172 PolarHBondContact O-N 3.21Å; I172-R176 HydrophobicContact CG2-CG 4.47Å; I172-R176 VanDerWaalsContact CG2-CZ 3.45Å; I172-R176 WeakPolarHBondContact O-CB 2.97Å; I172-R176 WeakPolarHBondContact O-CG 3.5Å; I172-R176 PolarHBondContact O-N 2.63Å
173	A	87.7	Confident	85.9	Confident	57 Å²	57	80.7 Å²	80.7	47%	0.471	41%	0.405	S	S	.	.	H	α-helix	trans	-62.9	-48.4	178.7	0	0	0	0	0	111.9	K169 A170 E171 K175 R176 E177	K169-A173 WeakPolarHBondContact O-CB 3.46Å; K169-A173 PolarHBondContact O-N 2.95Å; A170-A173 PolarHBondContact O-N 2.87Å; E171-A173 VanDerWaalsContact C-N 3.27Å; E171-A173 PolarHBondContact O-N 2.95Å; A173-K175 PolarHBondContact O-N 3.34Å; A173-R176 WeakPolarHBondContact O-CB 3.18Å; A173-R176 PolarHBondContact O-N 2.85Å; A173-E177 WeakPolarHBondContact O-CB 3.49Å; A173-E177 PolarHBondContact O-N 3.27Å
174	C	87.9	Confident	87.7	Confident	72 Å²	72	79.4 Å²	79.4	49%	0.486	41%	0.405	S	S	.	.	H	α-helix	trans	-62.3	-42.3	178.8	-173.8	0	0	0	0	112.5	A170 E171 E177 R178	A170-C174 WeakPolarHBondContact O-CB 3.37Å; A170-C174 PolarHBondContact O-N 3.31Å; E171-C174 PolarHBondContact O-N 2.96Å; C174-E177 PolarHBondContact O-N 3.35Å; C174-R178 PolarHBondContact O-N 3.29Å
175	K	87.2	Confident	88.5	Confident	47 Å²	47	78.1 Å²	78.1	20%	0.204	40%	0.397	C	S	.	.	H	α-helix	trans	-64.3	-41.4	175.4	-62.1	-75.5	-172.2	176.5	0	111.3	E136 M137 E171 A173 R178 L179	E136-K175 WeakPolarHBondContact OE2-CD 3.36Å; E136-K175 WeakPolarHBondContact OE2-CE 3.39Å; E136-K175 IonicContact OE2-NZ 3.75Å; E136-K175 PolarHBondContact OE2-NZ 2.81Å; M137-K175 HydrophobicContact CG-CB 4.14Å; E171-K175 HydrophobicContact CG-CG 4.05Å; E171-K175 WeakPolarHBondContact O-CB 3.48Å; E171-K175 WeakPolarHBondContact O-CG 3.21Å; E171-K175 PolarHBondContact O-N 2.91Å; E171-K175 WeakPolarHBondContact OE1-CE 3.41Å; E171-K175 IonicContact OE1-NZ 2.78Å; A173-K175 PolarHBondContact O-N 3.34Å; K175-R178 PolarHBondContact O-N 3.14Å; K175-L179 VanDerWaalsContact O-CB 3.31Å; K175-L179 WeakPolarHBondContact O-CB 3.44Å; K175-L179 PolarHBondContact O-N 3.46Å
176	R	90.1	Very high	89.4	Confident	136 Å²	136	75.3 Å²	75.3	51%	0.513	38%	0.377	S	S	.	.	H	α-helix	trans	-62.2	-40.7	173.7	-75.5	173.9	-179.6	176.3	3.2	112.2	M137 I172 A173 L179 S180	M137-R176 HydrophobicContact CE-CG 4.3Å; M137-R176 HydrophobicContact SD-CB 4.47Å; M137-R176 HydrophobicContact SD-CG 3.37Å; M137-R176 WeakPolarHBondContact SD-CG 3.26Å; I172-R176 HydrophobicContact CG2-CG 4.47Å; I172-R176 VanDerWaalsContact CG2-CZ 3.45Å; I172-R176 WeakPolarHBondContact O-CB 2.97Å; I172-R176 WeakPolarHBondContact O-CG 3.5Å; I172-R176 PolarHBondContact O-N 2.63Å; A173-R176 WeakPolarHBondContact O-CB 3.18Å; A173-R176 PolarHBondContact O-N 2.85Å; R176-L179 PolarHBondContact O-N 2.98Å; R176-S180 WeakPolarHBondContact O-CB 3.39Å; R176-S180 PolarHBondContact O-N 3.36Å
177	E	93.1	Very high	90.2	Very high	99 Å²	99	73.4 Å²	73.4	46%	0.463	37%	0.374	S	S	.	.	H	α-helix	trans	-65.3	-46.5	177	-165.3	-160.5	157.4	0	0	111.9	A173 C174 L179 S180 R181	A173-E177 WeakPolarHBondContact O-CB 3.49Å; A173-E177 PolarHBondContact O-N 3.27Å; C174-E177 PolarHBondContact O-N 3.35Å; E177-L179 VanDerWaalsContact C-N 3.33Å; E177-L179 PolarHBondContact O-N 2.92Å; E177-S180 WeakPolarHBondContact O-CB 3.42Å; E177-S180 PolarHBondContact O-N 2.87Å; E177-R181 PolarHBondContact O-N 3.01Å; E177-R181 IonicContact OE1-CZ 3.69Å; E177-R181 IonicContact OE1-NH1 3.74Å; E177-R181 PolarHBondContact OE1-NH1 3.33Å; E177-R181 IonicContact OE1-NH2 2.72Å; E177-R181 PolarHBondContact OE1-NH2 3.44Å; E177-R181 IonicContact OE2-NH2 3.59Å
178	R	92.7	Very high	90.8	Very high	48 Å²	48	72.9 Å²	72.9	18%	0.181	37%	0.372	C	S	.	.	H	α-helix	trans	-56.5	-45	171.3	169.4	171.3	160.7	-125.9	-0.9	111.5	E136 C174 K175 S180 R181 L182 E364	E136-R178 VanDerWaalsContact CD-NH1 3.25Å; E136-R178 IonicContact OE1-CZ 2.72Å; E136-R178 IonicContact OE1-NH1 3.2Å; E136-R178 PolarHBondContact OE1-NH1 2.95Å; E136-R178 IonicContact OE1-NH2 3.51Å; E136-R178 PolarHBondContact OE1-NH2 3.3Å; E136-R178 VanDerWaalsContact OE1-NH2 3.14Å; E136-R178 IonicContact OE2-NH1 2.73Å; E136-R178 PolarHBondContact OE2-NH1 3.06Å; C174-R178 PolarHBondContact O-N 3.29Å; K175-R178 PolarHBondContact O-N 3.14Å; R178-S180 VanDerWaalsContact C-N 3.34Å; R178-S180 PolarHBondContact O-N 3.42Å; R178-R181 PolarHBondContact O-N 2.92Å; R178-L182 HydrophobicContact CG-CD1 3.86Å; R178-L182 HydrophobicContact CG-CG 4.45Å; R178-L182 WeakPolarHBondContact O-CB 3.41Å; R178-L182 WeakPolarHBondContact O-CG 3.49Å; R178-L182 PolarHBondContact O-N 3.22Å; R178-E364 IonicContact CZ-OE1 2.66Å; R178-E364 IonicContact CZ-OE2 3.42Å; R178-E364 IonicContact NE-OE1 2.77Å; R178-E364 IonicContact NH2-OE1 3.53Å; R178-E364 IonicContact NH2-OE2 3.96Å; R178-E364 PolarHBondContact NH2-OE2 3.37Å
179	L	94.5	Very high	91.5	Very high	24 Å²	24	70.2 Å²	70.2	13%	0.126	36%	0.359	C	S	.	.	H	α-helix	trans	-65.1	-36.6	178.7	-169.4	159.4	0	0	0	111.9	L130 Q134 M137 K175 R176 E177 K183	L130-L179 HydrophobicContact CD1-CG 4.19Å; Q134-L179 HydrophobicContact CG-CD1 3.84Å; Q134-L179 HydrophobicContact CG-CG 4.29Å; M137-L179 HydrophobicContact CB-CD1 4.05Å; M137-L179 HydrophobicContact CG-CD1 3.76Å; M137-L179 HydrophobicContact SD-CD1 4.45Å; K175-L179 VanDerWaalsContact O-CB 3.31Å; K175-L179 WeakPolarHBondContact O-CB 3.44Å; K175-L179 PolarHBondContact O-N 3.46Å; R176-L179 PolarHBondContact O-N 2.98Å; E177-L179 VanDerWaalsContact C-N 3.33Å; E177-L179 PolarHBondContact O-N 2.92Å; L179-K183 HydrophobicContact CD2-CD 3.91Å; L179-K183 VanDerWaalsContact CD2-CE 3.49Å; L179-K183 WeakPolarHBondContact O-CG 3.29Å; L179-K183 PolarHBondContact O-N 3.35Å; L179-K183 VanDerWaalsContact O-N 3.16Å
180	S	94.9	Very high	92.1	Very high	74 Å²	74	69.4 Å²	69.4	52%	0.517	36%	0.355	S	S	.	.	H	α-helix	trans	-66.3	-48.7	173.8	-161.6	0	0	0	0	112	R176 E177 R178 L182 K183 Q184	R176-S180 WeakPolarHBondContact O-CB 3.39Å; R176-S180 PolarHBondContact O-N 3.36Å; E177-S180 WeakPolarHBondContact O-CB 3.42Å; E177-S180 PolarHBondContact O-N 2.87Å; R178-S180 VanDerWaalsContact C-N 3.34Å; R178-S180 PolarHBondContact O-N 3.42Å; S180-L182 PolarHBondContact O-N 3.37Å; S180-K183 PolarHBondContact O-N 3.4Å; S180-Q184 PolarHBondContact O-N 3.48Å
181	R	95.3	Very high	92.6	Very high	113 Å²	113	71.4 Å²	71.4	43%	0.426	35%	0.354	S	S	.	.	H	α-helix	trans	-55.5	-52.2	174.5	-82.4	-170.2	-77.9	-108.7	-11.7	112	E177 R178 K183 Q184 E185	E177-R181 PolarHBondContact O-N 3.01Å; E177-R181 IonicContact OE1-CZ 3.69Å; E177-R181 IonicContact OE1-NH1 3.74Å; E177-R181 PolarHBondContact OE1-NH1 3.33Å; E177-R181 IonicContact OE1-NH2 2.72Å; E177-R181 PolarHBondContact OE1-NH2 3.44Å; E177-R181 IonicContact OE2-NH2 3.59Å; R178-R181 PolarHBondContact O-N 2.92Å; R181-K183 VanDerWaalsContact C-N 3.26Å; R181-K183 PolarHBondContact O-N 2.96Å; R181-Q184 PolarHBondContact O-N 3.27Å; R181-E185 WeakPolarHBondContact O-CG 3.21Å; R181-E185 PolarHBondContact O-N 3.04Å
182	L	94.9	Very high	92.9	Very high	4 Å²	4	69.9 Å²	69.9	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-60.1	-33.7	179.9	-72.8	171.1	0	0	0	112.7	R129 L130 A133 R178 S180 L186	R129-L182 HydrophobicContact CB-CD1 4.4Å; R129-L182 HydrophobicContact CB-CD2 4.33Å; L130-L182 HydrophobicContact CB-CB 4.23Å; L130-L182 HydrophobicContact CD1-CB 4Å; A133-L182 HydrophobicContact CB-CD1 3.95Å; R178-L182 HydrophobicContact CG-CD1 3.86Å; R178-L182 HydrophobicContact CG-CG 4.45Å; R178-L182 WeakPolarHBondContact O-CB 3.41Å; R178-L182 WeakPolarHBondContact O-CG 3.49Å; R178-L182 PolarHBondContact O-N 3.22Å; S180-L182 PolarHBondContact O-N 3.37Å; L182-L186 WeakPolarHBondContact O-CB 3.28Å; L182-L186 PolarHBondContact O-N 2.97Å
183	K	95.9	Very high	93.3	Very high	108 Å²	108	69.6 Å²	69.6	47%	0.47	35%	0.346	S	S	.	.	H	α-helix	trans	-66.9	-43.6	172.1	-78.2	178	175.9	177.2	0	112.6	L130 L179 S180 R181 A187	L130-K183 HydrophobicContact CD1-CG 3.79Å; L130-K183 HydrophobicContact CD2-CG 3.85Å; L179-K183 HydrophobicContact CD2-CD 3.91Å; L179-K183 VanDerWaalsContact CD2-CE 3.49Å; L179-K183 WeakPolarHBondContact O-CG 3.29Å; L179-K183 PolarHBondContact O-N 3.35Å; L179-K183 VanDerWaalsContact O-N 3.16Å; S180-K183 PolarHBondContact O-N 3.4Å; R181-K183 VanDerWaalsContact C-N 3.26Å; R181-K183 PolarHBondContact O-N 2.96Å; K183-A187 WeakPolarHBondContact O-CB 3.11Å; K183-A187 PolarHBondContact O-N 3.25Å
184	Q	96.9	Very high	93.6	Very high	139 Å²	139	72.1 Å²	72.1	65%	0.65	35%	0.347	S	S	*	.	H	α-helix	trans	-66.3	-45.9	178.3	-176.8	176.5	-8.2	0	0	111.5	S180 R181 L186 A187 Q188	S180-Q184 PolarHBondContact O-N 3.48Å; R181-Q184 PolarHBondContact O-N 3.27Å; Q184-L186 PolarHBondContact O-N 2.89Å; Q184-A187 PolarHBondContact O-N 2.98Å; Q184-Q188 PolarHBondContact O-N 3.47Å
185	E	94.4	Very high	93.6	Very high	61 Å²	61	76.3 Å²	76.3	29%	0.285	35%	0.354	S	S	.	.	H	α-helix	trans	-61.6	-42	176.3	-69.5	169.7	-144.9	0	0	112	K126 R181 Q188 V189	K126-E185 HydrophobicContact CD-CB 4.1Å; K126-E185 IonicContact NZ-OE2 2.82Å; K126-E185 PolarHBondContact NZ-OE2 2.94Å; R181-E185 WeakPolarHBondContact O-CG 3.21Å; R181-E185 PolarHBondContact O-N 3.04Å; E185-Q188 PolarHBondContact O-N 2.91Å; E185-V189 WeakPolarHBondContact O-CB 3.31Å; E185-V189 WeakPolarHBondContact O-CG2 3.43Å; E185-V189 PolarHBondContact O-N 2.91Å
186	L	95.9	Very high	93.7	Very high	25 Å²	25	76.8 Å²	76.8	13%	0.131	36%	0.356	C	S	.	.	H	α-helix	trans	-66	-37.7	176.7	-175.6	150.1	0	0	0	111.9	Y123 Q127 L130 L182 Q184 K190	Y123-L186 HydrophobicContact CD2-CG 4.25Å; Y123-L186 HydrophobicContact CE2-CD1 4.38Å; Y123-L186 HydrophobicContact CE2-CD2 3.72Å; Y123-L186 HydrophobicContact CE2-CG 3.8Å; Q127-L186 HydrophobicContact CB-CD1 3.84Å; Q127-L186 HydrophobicContact CG-CD1 4.32Å; L130-L186 HydrophobicContact CD2-CD1 4.03Å; L182-L186 WeakPolarHBondContact O-CB 3.28Å; L182-L186 PolarHBondContact O-N 2.97Å; Q184-L186 PolarHBondContact O-N 2.89Å; L186-K190 VanDerWaalsContact O-CB 3.28Å; L186-K190 WeakPolarHBondContact O-CB 3.32Å; L186-K190 PolarHBondContact O-N 2.65Å
187	A	95.1	Very high	93.8	Very high	57 Å²	57	73 Å²	73	47%	0.471	34%	0.344	S	S	.	.	H	α-helix	trans	-64.5	-43.1	173.8	0	0	0	0	0	111.9	K183 Q184 K190 Q191	K183-A187 WeakPolarHBondContact O-CB 3.11Å; K183-A187 PolarHBondContact O-N 3.25Å; Q184-A187 PolarHBondContact O-N 2.98Å; A187-K190 PolarHBondContact O-N 3.01Å; A187-Q191 PolarHBondContact O-N 3.13Å; A187-Q191 VanDerWaalsContact O-N 3.14Å
188	Q	95.1	Very high	93.7	Very high	109 Å²	109	73.4 Å²	73.4	51%	0.509	35%	0.348	S	S	.	.	H	α-helix	trans	-61.7	-52.2	174.3	179.2	-176.1	-26.8	0	0	111.6	Q184 E185 K190 Q191 E192	Q184-Q188 PolarHBondContact O-N 3.47Å; E185-Q188 PolarHBondContact O-N 2.91Å; Q188-K190 PolarHBondContact O-N 3.16Å; Q188-Q191 PolarHBondContact O-N 3.41Å; Q188-E192 HydrophobicContact CG-CG 4.47Å; Q188-E192 PolarHBondContact NE2-OE1 3.13Å; Q188-E192 PolarHBondContact O-N 3.24Å
189	V	93.9	Very high	93.4	Very high	5 Å²	5	72.7 Å²	72.7	3%	0.03	36%	0.355	C	S	.	.	H	α-helix	trans	-62.4	-32.9	-179.1	172.2	0	0	0	0	111.3	M122 K126 E185 L193	M122-V189 HydrophobicContact SD-CG2 4.44Å; K126-V189 HydrophobicContact CD-CG2 4.11Å; E185-V189 WeakPolarHBondContact O-CB 3.31Å; E185-V189 WeakPolarHBondContact O-CG2 3.43Å; E185-V189 PolarHBondContact O-N 2.91Å; V189-L193 WeakPolarHBondContact O-CB 3.2Å; V189-L193 PolarHBondContact O-N 3.13Å
190	K	94.9	Very high	93.2	Very high	105 Å²	105	71.9 Å²	71.9	46%	0.457	35%	0.351	S	S	.	.	H	α-helix	trans	-64.1	-39.9	171.8	-174.5	174.7	178.3	176.4	0	112.7	Y123 L186 A187 Q188 Q194	Y123-K190 HydrophobicContact CD2-CB 4.21Å; Y123-K190 HydrophobicContact CE2-CB 3.96Å; Y123-K190 HydrophobicContact CE2-CD 4.39Å; Y123-K190 HydrophobicContact CE2-CG 4.31Å; L186-K190 VanDerWaalsContact O-CB 3.28Å; L186-K190 WeakPolarHBondContact O-CB 3.32Å; L186-K190 PolarHBondContact O-N 2.65Å; A187-K190 PolarHBondContact O-N 3.01Å; Q188-K190 PolarHBondContact O-N 3.16Å; K190-Q194 WeakPolarHBondContact O-CG 3.25Å; K190-Q194 PolarHBondContact O-N 2.94Å; K190-Q194 VanDerWaalsContact O-N 3.16Å
191	Q	95.1	Very high	92.9	Very high	101 Å²	101	73.4 Å²	73.4	47%	0.472	35%	0.35	S	S	.	.	H	α-helix	trans	-71.1	-42.8	176.4	-172.4	-179.9	1.4	0	0	111.8	A187 Q188 L193 Q194 Y195	A187-Q191 PolarHBondContact O-N 3.13Å; A187-Q191 VanDerWaalsContact O-N 3.14Å; Q188-Q191 PolarHBondContact O-N 3.41Å; Q191-L193 VanDerWaalsContact C-N 3.27Å; Q191-L193 PolarHBondContact O-N 3.22Å; Q191-Q194 PolarHBondContact O-N 2.76Å; Q191-Y195 HydrophobicContact CG-CD2 4.15Å; Q191-Y195 HydrophobicContact CG-CE2 3.56Å; Q191-Y195 PolarHBondContact NE2-OH 2.96Å; Q191-Y195 VanDerWaalsContact NE2-OH 3.14Å; Q191-Y195 VanDerWaalsContact O-CD2 3.28Å; Q191-Y195 WeakPolarHBondContact O-CD2 3.36Å; Q191-Y195 PolarHBondContact O-N 2.75Å
192	E	91.5	Very high	92.6	Very high	59 Å²	59	71.8 Å²	71.8	28%	0.276	35%	0.353	S	S	.	.	H	α-helix	trans	-56.9	-42.1	172	-72.8	179	-156.8	0	0	111.7	K119 Q188 Y195 K196	K119-E192 IonicContact NZ-OE2 2.68Å; K119-E192 PolarHBondContact NZ-OE2 2.76Å; Q188-E192 HydrophobicContact CG-CG 4.47Å; Q188-E192 PolarHBondContact NE2-OE1 3.13Å; Q188-E192 PolarHBondContact O-N 3.24Å; E192-Y195 PolarHBondContact O-N 3.02Å; E192-K196 PolarHBondContact O-N 2.92Å
193	L	93.1	Very high	92.1	Very high	19 Å²	19	74.1 Å²	74.1	10%	0.099	37%	0.365	C	S	.	.	H	α-helix	trans	-59.9	-50.5	177.9	177.4	62.4	0	0	0	111.2	L116 K119 K120 V189 Q191 Y195 K196 E197	L116-L193 HydrophobicContact CD1-CD1 3.42Å; L116-L193 VanDerWaalsContact CD1-CD1 3.42Å; K119-L193 HydrophobicContact CB-CD1 4.43Å; K120-L193 HydrophobicContact CD-CD1 4.4Å; K120-L193 HydrophobicContact CG-CD1 3.49Å; K120-L193 VanDerWaalsContact CG-CD1 3.49Å; K120-L193 HydrophobicContact CG-CD2 4.23Å; V189-L193 WeakPolarHBondContact O-CB 3.2Å; V189-L193 PolarHBondContact O-N 3.13Å; Q191-L193 VanDerWaalsContact C-N 3.27Å; Q191-L193 PolarHBondContact O-N 3.22Å; L193-Y195 VanDerWaalsContact C-N 3.31Å; L193-Y195 PolarHBondContact O-N 2.88Å; L193-K196 PolarHBondContact O-N 3.21Å; L193-K196 VanDerWaalsContact O-N 3.08Å; L193-E197 HydrophobicContact CD1-CG 4.21Å; L193-E197 HydrophobicContact CG-CG 4.43Å; L193-E197 WeakPolarHBondContact O-CG 3.49Å; L193-E197 PolarHBondContact O-N 3.29Å
194	Q	92.4	Very high	91.7	Very high	109 Å²	109	73.2 Å²	73.2	51%	0.509	36%	0.363	S	S	.	.	H	α-helix	trans	-58.3	-40.8	179.1	-72.6	-179.6	-47.6	0	0	112.5	K190 Q191 E197 M198	K190-Q194 WeakPolarHBondContact O-CG 3.25Å; K190-Q194 PolarHBondContact O-N 2.94Å; K190-Q194 VanDerWaalsContact O-N 3.16Å; Q191-Q194 PolarHBondContact O-N 2.76Å; Q194-E197 PolarHBondContact O-N 2.84Å; Q194-M198 WeakPolarHBondContact O-CG 3.19Å; Q194-M198 PolarHBondContact O-N 2.75Å; Q194-M198 VanDerWaalsContact O-N 3.08Å
195	Y	88.8	Confident	91.1	Very high	160 Å²	160	69.8 Å²	69.8	63%	0.627	35%	0.346	S	S	*	.	H	α-helix	trans	-68.3	-36.6	175.4	-65.6	-49.7	0	0	0	112.9	Q191 E192 L193 G199	Q191-Y195 HydrophobicContact CG-CD2 4.15Å; Q191-Y195 HydrophobicContact CG-CE2 3.56Å; Q191-Y195 PolarHBondContact NE2-OH 2.96Å; Q191-Y195 VanDerWaalsContact NE2-OH 3.14Å; Q191-Y195 VanDerWaalsContact O-CD2 3.28Å; Q191-Y195 WeakPolarHBondContact O-CD2 3.36Å; Q191-Y195 PolarHBondContact O-N 2.75Å; E192-Y195 PolarHBondContact O-N 3.02Å; L193-Y195 VanDerWaalsContact C-N 3.31Å; L193-Y195 PolarHBondContact O-N 2.88Å; Y195-G199 PolarHBondContact O-N 3.5Å
196	K	89.3	Confident	90.5	Very high	58 Å²	58	70.3 Å²	70.3	25%	0.252	35%	0.351	S	S	.	.	H	α-helix	trans	-66.8	-38	172.6	-73.8	-155.9	-173.4	-171	0	112.2	A115 L116 K119 E192 L193 G199 V200 D350	A115-K196 PolarHBondContact O-NZ 2.91Å; L116-K196 HydrophobicContact CD1-CB 3.92Å; K119-K196 HydrophobicContact CG-CD 4.05Å; E192-K196 PolarHBondContact O-N 2.92Å; L193-K196 PolarHBondContact O-N 3.21Å; L193-K196 VanDerWaalsContact O-N 3.08Å; K196-G199 PolarHBondContact O-N 3.35Å; K196-V200 WeakPolarHBondContact O-CG2 3.41Å; K196-V200 PolarHBondContact O-N 2.78Å; K196-D350 IonicContact NZ-OD2 2.79Å; K196-D350 PolarHBondContact NZ-OD2 3.32Å
197	E	92.4	Very high	90	Very high	56 Å²	56	70.6 Å²	70.6	26%	0.262	35%	0.352	S	S	.	.	H	α-helix	trans	-61.6	-54	176.3	-71.6	-177.4	127.9	0	0	111.1	L116 K120 L193 Q194 G199 V200 E201	L116-E197 HydrophobicContact CD1-CG 3.56Å; L116-E197 HydrophobicContact CD2-CG 4.09Å; L116-E197 HydrophobicContact CG-CG 4.45Å; K120-E197 WeakPolarHBondContact CE-OE1 3.4Å; K120-E197 IonicContact NZ-OE1 2.69Å; K120-E197 PolarHBondContact NZ-OE1 2.94Å; L193-E197 HydrophobicContact CD1-CG 4.21Å; L193-E197 HydrophobicContact CG-CG 4.43Å; L193-E197 WeakPolarHBondContact O-CG 3.49Å; L193-E197 PolarHBondContact O-N 3.29Å; Q194-E197 PolarHBondContact O-N 2.84Å; E197-G199 PolarHBondContact O-N 3.17Å; E197-V200 PolarHBondContact O-N 3.35Å; E197-V200 VanDerWaalsContact O-N 3.11Å; E197-E201 WeakPolarHBondContact O-CG 3.46Å; E197-E201 PolarHBondContact O-N 2.92Å
198	M	89.8	Confident	89.4	Confident	108 Å²	108	73.6 Å²	73.6	53%	0.532	35%	0.351	S	S	.	.	H	α-helix	trans	-57.7	-35.1	175.6	-65.1	-57.3	-39.6	0	0	112.7	Q194 T202	Q194-M198 WeakPolarHBondContact O-CG 3.19Å; Q194-M198 PolarHBondContact O-N 2.75Å; Q194-M198 VanDerWaalsContact O-N 3.08Å; M198-T202 WeakPolarHBondContact O-CB 3.42Å; M198-T202 PolarHBondContact O-N 3.3Å; M198-T202 PolarHBondContact O-OG1 3.39Å
199	G	87.2	Confident	88.6	Confident	33 Å²	33	73.9 Å²	73.9	34%	0.34	35%	0.351	S	S	.	.	H	α-helix	trans	-66.3	-44.8	175.6	0	0	0	0	0	113	Y195 K196 E197 T202 L203	Y195-G199 PolarHBondContact O-N 3.5Å; K196-G199 PolarHBondContact O-N 3.35Å; E197-G199 PolarHBondContact O-N 3.17Å; G199-T202 WeakPolarHBondContact O-CB 3.37Å; G199-T202 PolarHBondContact O-N 2.95Å; G199-L203 WeakPolarHBondContact O-CG 3.47Å; G199-L203 PolarHBondContact O-N 2.99Å
200	V	90	Very high	87.4	Confident	6 Å²	6	76.9 Å²	76.9	4%	0.036	37%	0.365	C	S	.	.	H	α-helix	trans	-67	-42.8	176.2	169.8	0	0	0	0	111.2	L109 A112 L116 K196 E197 T202 L203 Q204	L109-V200 HydrophobicContact CD1-CG1 4.12Å; A112-V200 HydrophobicContact CB-CG2 3.83Å; L116-V200 HydrophobicContact CB-CG2 4.26Å; L116-V200 HydrophobicContact CD2-CB 3.98Å; L116-V200 HydrophobicContact CD2-CG1 4.2Å; L116-V200 HydrophobicContact CD2-CG2 3.83Å; K196-V200 WeakPolarHBondContact O-CG2 3.41Å; K196-V200 PolarHBondContact O-N 2.78Å; E197-V200 PolarHBondContact O-N 3.35Å; E197-V200 VanDerWaalsContact O-N 3.11Å; V200-T202 VanDerWaalsContact C-N 3.27Å; V200-T202 PolarHBondContact O-N 3.45Å; V200-L203 PolarHBondContact O-N 3.43Å; V200-L203 VanDerWaalsContact O-N 3.12Å; V200-Q204 HydrophobicContact CG1-CG 4.37Å; V200-Q204 WeakPolarHBondContact O-CG 3.26Å; V200-Q204 PolarHBondContact O-N 2.77Å
201	E	89.9	Confident	86.3	Confident	107 Å²	107	74 Å²	74	50%	0.5	36%	0.359	S	S	.	.	H	α-helix	trans	-57.3	-41.4	173.2	-72.1	176.3	-174.9	0	0	111.8	E197 Q204 E205	E197-E201 WeakPolarHBondContact O-CG 3.46Å; E197-E201 PolarHBondContact O-N 2.92Å; E201-Q204 PolarHBondContact O-N 3.4Å; E201-E205 WeakPolarHBondContact O-CB 3.45Å; E201-E205 PolarHBondContact O-N 3.4Å
202	T	88.5	Confident	84.8	Confident	79 Å²	79	71.8 Å²	71.8	49%	0.485	35%	0.354	S	S	.	.	H	α-helix	trans	-63.7	-40.9	175.8	-57.4	0	0	0	0	111.6	M198 G199 V200 E205 I206	M198-T202 WeakPolarHBondContact O-CB 3.42Å; M198-T202 PolarHBondContact O-N 3.3Å; M198-T202 PolarHBondContact O-OG1 3.39Å; G199-T202 WeakPolarHBondContact O-CB 3.37Å; G199-T202 PolarHBondContact O-N 2.95Å; V200-T202 VanDerWaalsContact C-N 3.27Å; V200-T202 PolarHBondContact O-N 3.45Å; T202-E205 PolarHBondContact O-N 3.44Å; T202-I206 HydrophobicContact CG2-CD1 4.21Å; T202-I206 VanDerWaalsContact O-CG1 3.28Å; T202-I206 WeakPolarHBondContact O-CG1 3.29Å; T202-I206 PolarHBondContact O-N 3.05Å
203	L	84.8	Confident	82.9	Confident	52 Å²	52	74.4 Å²	74.4	27%	0.272	38%	0.379	S	S	.	.	H	α-helix	trans	-67.3	-39.6	175.5	-70.2	171.5	0	0	0	112.3	L105 L109 A112 G199 V200 E205 I206 D207	L105-L203 HydrophobicContact CD1-CD2 4.1Å; L109-L203 HydrophobicContact CD1-CB 3.96Å; A112-L203 HydrophobicContact CB-CD1 3.94Å; G199-L203 WeakPolarHBondContact O-CG 3.47Å; G199-L203 PolarHBondContact O-N 2.99Å; V200-L203 PolarHBondContact O-N 3.43Å; V200-L203 VanDerWaalsContact O-N 3.12Å; L203-E205 VanDerWaalsContact C-N 3.35Å; L203-I206 PolarHBondContact O-N 2.96Å; L203-D207 PolarHBondContact O-N 2.72Å
204	Q	87.4	Confident	80.7	Confident	90 Å²	90	79.5 Å²	79.5	42%	0.421	40%	0.402	S	S	.	.	H	α-helix	trans	-63	-39.9	174.3	-69.6	176.4	4.7	0	0	111.8	L109 V200 E201 I206 D207 R208	L109-Q204 HydrophobicContact CD1-CG 3.69Å; L109-Q204 HydrophobicContact CD2-CG 4.1Å; V200-Q204 HydrophobicContact CG1-CG 4.37Å; V200-Q204 WeakPolarHBondContact O-CG 3.26Å; V200-Q204 PolarHBondContact O-N 2.77Å; E201-Q204 PolarHBondContact O-N 3.4Å; Q204-I206 VanDerWaalsContact C-N 3.33Å; Q204-D207 PolarHBondContact O-N 3.01Å; Q204-R208 WeakPolarHBondContact O-CB 3.47Å; Q204-R208 PolarHBondContact O-N 3.27Å
205	E	84.7	Confident	78.7	Confident	66 Å²	66	79.2 Å²	79.2	31%	0.308	41%	0.408	S	S	.	.	H	α-helix	trans	-67.9	-31.3	175.7	172.2	58.4	-168	0	0	112.5	E201 T202 L203 R208 K209	E201-E205 WeakPolarHBondContact O-CB 3.45Å; E201-E205 PolarHBondContact O-N 3.4Å; T202-E205 PolarHBondContact O-N 3.44Å; L203-E205 VanDerWaalsContact C-N 3.35Å; E205-R208 IonicContact OE1-CZ 2.72Å; E205-R208 IonicContact OE1-NH2 3.87Å; E205-R208 PolarHBondContact OE1-NH2 3.24Å; E205-R208 IonicContact OE2-CZ 3.69Å; E205-R208 IonicContact OE2-NE 3.81Å; E205-R208 PolarHBondContact OE2-NE 3.49Å; E205-R208 IonicContact OE2-NH2 2.81Å; E205-R208 PolarHBondContact OE2-NH2 2.86Å; E205-K209 WeakPolarHBondContact O-CD 3.45Å; E205-K209 WeakPolarHBondContact O-CG 3.26Å; E205-K209 PolarHBondContact O-N 3.43Å; E205-K209 WeakPolarHBondContact OE1-CE 3.4Å; E205-K209 IonicContact OE1-NZ 2.96Å; E205-K209 PolarHBondContact OE1-NZ 3.02Å
206	I	81.6	Confident	77	Confident	73 Å²	73	76.9 Å²	76.9	37%	0.374	41%	0.406	S	S	.	.	H	α-helix	trans	-72.3	-43.6	171.2	-64.1	162.8	0	0	0	110.4	L105 T202 L203 Q204 R208 K209 M210	L105-I206 HydrophobicContact CD2-CB 4.48Å; L105-I206 HydrophobicContact CD2-CG2 3.8Å; T202-I206 HydrophobicContact CG2-CD1 4.21Å; T202-I206 VanDerWaalsContact O-CG1 3.28Å; T202-I206 WeakPolarHBondContact O-CG1 3.29Å; T202-I206 PolarHBondContact O-N 3.05Å; L203-I206 PolarHBondContact O-N 2.96Å; Q204-I206 VanDerWaalsContact C-N 3.33Å; I206-R208 VanDerWaalsContact C-N 3.34Å; I206-R208 PolarHBondContact O-N 2.87Å; I206-K209 WeakPolarHBondContact O-CB 3.22Å; I206-K209 PolarHBondContact O-N 2.73Å; I206-K209 VanDerWaalsContact O-N 3.1Å; I206-M210 HydrophobicContact CG2-CG 4.26Å; I206-M210 WeakPolarHBondContact O-CG 3.1Å; I206-M210 PolarHBondContact O-N 3.15Å
207	D	83.9	Confident	75.4	Confident	30 Å²	30	78 Å²	78	16%	0.16	41%	0.41	C	S	.	.	H	α-helix	trans	-62.2	-40.7	176.6	-178.9	55.8	0	0	0	112	L105 K106 L109 L203 Q204 K209 M210 S211	L105-D207 HydrophobicContact CD2-CB 4.02Å; L105-D207 HydrophobicContact CG-CB 4.4Å; K106-D207 WeakPolarHBondContact CE-OD1 3.46Å; K106-D207 WeakPolarHBondContact CG-OD1 3.32Å; K106-D207 IonicContact NZ-OD1 3.45Å; L109-D207 HydrophobicContact CD2-CB 4.3Å; L203-D207 PolarHBondContact O-N 2.72Å; Q204-D207 PolarHBondContact O-N 3.01Å; D207-K209 VanDerWaalsContact C-N 3.26Å; D207-K209 PolarHBondContact O-N 2.79Å; D207-M210 PolarHBondContact O-N 3.29Å; D207-S211 WeakPolarHBondContact O-CB 3.46Å; D207-S211 PolarHBondContact O-N 2.88Å; D207-S211 PolarHBondContact O-OG 3.04Å; D207-S211 VanDerWaalsContact O-OG 3.1Å; D207-S211 PolarHBondContact OD1-OG 2.64Å
208	R	83.8	Confident	74.1	Confident	120 Å²	120	80.3 Å²	80.3	45%	0.453	42%	0.419	S	S	.	.	H	α-helix	trans	-58.9	-36.8	173.1	-169.9	-172.6	68.3	77.3	-3.1	112.2	Q204 E205 I206 S212	Q204-R208 WeakPolarHBondContact O-CB 3.47Å; Q204-R208 PolarHBondContact O-N 3.27Å; E205-R208 IonicContact OE1-CZ 2.72Å; E205-R208 IonicContact OE1-NH2 3.87Å; E205-R208 PolarHBondContact OE1-NH2 3.24Å; E205-R208 IonicContact OE2-CZ 3.69Å; E205-R208 IonicContact OE2-NE 3.81Å; E205-R208 PolarHBondContact OE2-NE 3.49Å; E205-R208 IonicContact OE2-NH2 2.81Å; E205-R208 PolarHBondContact OE2-NH2 2.86Å; I206-R208 VanDerWaalsContact C-N 3.34Å; I206-R208 PolarHBondContact O-N 2.87Å; R208-S212 WeakPolarHBondContact O-CB 3.33Å; R208-S212 PolarHBondContact O-N 3.49Å
209	K	78.7	Confident	72.9	Confident	115 Å²	115	81.1 Å²	81.1	50%	0.5	43%	0.425	S	S	.	.	H	α-helix	trans	-73	-45.5	175.6	-77.9	164.1	168.5	143.4	0	111.8	E205 I206 D207 S212	E205-K209 WeakPolarHBondContact O-CD 3.45Å; E205-K209 WeakPolarHBondContact O-CG 3.26Å; E205-K209 PolarHBondContact O-N 3.43Å; E205-K209 WeakPolarHBondContact OE1-CE 3.4Å; E205-K209 IonicContact OE1-NZ 2.96Å; E205-K209 PolarHBondContact OE1-NZ 3.02Å; I206-K209 WeakPolarHBondContact O-CB 3.22Å; I206-K209 PolarHBondContact O-N 2.73Å; I206-K209 VanDerWaalsContact O-N 3.1Å; D207-K209 VanDerWaalsContact C-N 3.26Å; D207-K209 PolarHBondContact O-N 2.79Å; K209-S212 PolarHBondContact O-N 3.39Å; K209-S212 PolarHBondContact O-OG 2.75Å
210	M	67.9	Low	72	Confident	68 Å²	68	85 Å²	85	34%	0.335	44%	0.438	S	S	.	.	H	α-helix	trans	-63.4	-46.4	178.2	-70.4	-69.1	-74	0	0	112.1	Q101 L105 I206 D207 S212	Q101-M210 HydrophobicContact CB-CE 4.13Å; L105-M210 HydrophobicContact CD2-CB 4.28Å; L105-M210 HydrophobicContact CD2-CG 3.85Å; I206-M210 HydrophobicContact CG2-CG 4.26Å; I206-M210 WeakPolarHBondContact O-CG 3.1Å; I206-M210 PolarHBondContact O-N 3.15Å; D207-M210 PolarHBondContact O-N 3.29Å; M210-S212 PolarHBondContact O-N 2.96Å
211	S	71.6	Confident	71.1	Confident	45 Å²	45	88 Å²	88	32%	0.315	45%	0.451	S	S	.	.	S	Bend	trans	-68.5	-18	176.4	-63.6	0	0	0	0	112.9	K106 D207 S213	K106-S211 WeakPolarHBondContact CE-OG 3.32Å; K106-S211 PolarHBondContact NZ-OG 2.68Å; D207-S211 WeakPolarHBondContact O-CB 3.46Å; D207-S211 PolarHBondContact O-N 2.88Å; D207-S211 PolarHBondContact O-OG 3.04Å; D207-S211 VanDerWaalsContact O-OG 3.1Å; D207-S211 PolarHBondContact OD1-OG 2.64Å; S211-S213 PolarHBondContact O-N 3.33Å
212	S	63.3	Low	70.3	Confident	55 Å²	55	83.8 Å²	83.8	39%	0.385	44%	0.435	S	S	.	.	S	Bend	trans	-75.2	104.7	172.5	76.3	0	0	0	0	110.1	R208 K209 M210 Q214	R208-S212 WeakPolarHBondContact O-CB 3.33Å; R208-S212 PolarHBondContact O-N 3.49Å; K209-S212 PolarHBondContact O-N 3.39Å; K209-S212 PolarHBondContact O-OG 2.75Å; M210-S212 PolarHBondContact O-N 2.96Å; S212-Q214 PolarHBondContact O-N 2.98Å
213	S	52.8	Low	69.8	Low	113 Å²	113	85.3 Å²	85.3	79%	0.79	44%	0.436	S	S	*	.			trans	-70.4	19.4	-168.5	-32.4	0	0	0	0	115.4	S211	S211-S213 PolarHBondContact O-N 3.33Å
214	Q	46	Very low	69.5	Low	126 Å²	126	85.3 Å²	85.3	59%	0.589	44%	0.444	S	S	*	.			trans	-125.3	107.4	-176.6	-69.9	179.9	-26.9	0	0	109.9	S212 N216	S212-Q214 PolarHBondContact O-N 2.98Å; Q214-N216 PolarHBondContact O-N 3.04Å
215	T	50.3	Low	69.1	Low	103 Å²	103	81.7 Å²	81.7	63%	0.632	43%	0.427	S	S	*	.	S	Bend	trans	-71.4	24.4	167.6	53.1	0	0	0	0	112.8
216	N	52.6	Low	68.7	Low	111 Å²	111	83.2 Å²	83.2	59%	0.594	43%	0.433	S	S	*	.	S	Bend	trans	-127.3	119.9	-178.7	-62.4	-48.5	0	0	0	106.6	Q214 K218	Q214-N216 PolarHBondContact O-N 3.04Å; N216-K218 PolarHBondContact O-N 3.35Å
217	Y	55.3	Low	68.9	Low	82 Å²	82	83.2 Å²	83.2	32%	0.322	44%	0.44	S	S	.	.			trans	-51.1	139.6	169.9	-70.6	-86	0	0	0	110	E221 I225 S1024 E1028	Y217-E221 HydrophobicContact CD1-CB 4.02Å; Y217-I225 HydrophobicContact CD1-CD1 3.9Å; Y217-I225 HydrophobicContact CE1-CD1 3.42Å; Y217-I225 VanDerWaalsContact CE1-CD1 3.42Å; Y217-I225 HydrophobicContact CE2-CD1 4.43Å; Y217-S1024 WeakPolarHBondContact CE2-O 3.5Å; Y217-E1028 WeakPolarHBondContact OH-CB 3.21Å; Y217-E1028 PolarHBondContact OH-OE2 3.42Å
218	K	65.1	Low	69.1	Low	105 Å²	105	85.1 Å²	85.1	46%	0.457	45%	0.447	S	S	.	.			trans	-61.7	152	166.8	-63.7	173	-173	163.8	0	108.7	N216 D220 E221 A222	N216-K218 PolarHBondContact O-N 3.35Å; K218-D220 PolarHBondContact O-N 3.39Å; K218-D220 VanDerWaalsContact O-N 3.09Å; K218-E221 HydrophobicContact CB-CG 4.09Å; K218-E221 WeakPolarHBondContact CB-OE2 3.29Å; K218-E221 PolarHBondContact N-OE2 2.9Å; K218-E221 WeakPolarHBondContact O-CB 3.35Å; K218-E221 PolarHBondContact O-N 3.44Å; K218-A222 PolarHBondContact O-N 2.85Å
219	L	65.6	Low	69.2	Low	125 Å²	125	80.2 Å²	80.2	65%	0.654	43%	0.43	S	S	*	.	H	α-helix	trans	-54.7	-35.6	-176.7	-179.4	60.3	0	0	0	111.9	Q223	L219-Q223 WeakPolarHBondContact O-CB 3.43Å; L219-Q223 VanDerWaalsContact O-CG 3.25Å; L219-Q223 WeakPolarHBondContact O-CG 3.37Å; L219-Q223 PolarHBondContact O-N 3.13Å
220	D	68.7	Low	69.7	Low	114 Å²	114	83 Å²	83	61%	0.61	44%	0.438	S	S	*	.	H	α-helix	trans	-73	-36.8	179.5	-43.4	-61.3	0	0	0	112.5	K218 Q223 A224	K218-D220 PolarHBondContact O-N 3.39Å; K218-D220 VanDerWaalsContact O-N 3.09Å; D220-Q223 PolarHBondContact O-N 2.89Å; D220-A224 WeakPolarHBondContact O-CB 3.37Å; D220-A224 PolarHBondContact O-N 3.49Å
221	E	69.8	Low	70.8	Confident	69 Å²	69	83 Å²	83	32%	0.322	44%	0.444	S	S	.	.	H	α-helix	trans	-68	-43.8	175.9	-63.2	164.1	170.3	0	0	110.4	Y217 K218 Q223 A224 I225	Y217-E221 HydrophobicContact CD1-CB 4.02Å; K218-E221 HydrophobicContact CB-CG 4.09Å; K218-E221 WeakPolarHBondContact CB-OE2 3.29Å; K218-E221 PolarHBondContact N-OE2 2.9Å; K218-E221 WeakPolarHBondContact O-CB 3.35Å; K218-E221 PolarHBondContact O-N 3.44Å; E221-Q223 PolarHBondContact O-N 3.34Å; E221-A224 WeakPolarHBondContact O-CB 3.49Å; E221-A224 PolarHBondContact O-N 2.85Å; E221-I225 WeakPolarHBondContact O-CG1 3.46Å; E221-I225 PolarHBondContact O-N 3Å
222	A	73.9	Confident	71.7	Confident	19 Å²	19	81.2 Å²	81.2	16%	0.157	43%	0.431	C	S	.	.	H	α-helix	trans	-63.3	-40.2	173	0	0	0	0	0	112	K218 I225 F226	K218-A222 PolarHBondContact O-N 2.85Å; A222-I225 PolarHBondContact O-N 2.72Å; A222-F226 VanDerWaalsContact O-CD2 3.27Å; A222-F226 WeakPolarHBondContact O-CD2 3.2Å; A222-F226 PolarHBondContact O-N 3.49Å
223	Q	77.4	Confident	72.9	Confident	110 Å²	110	86 Å²	86	51%	0.514	45%	0.445	S	S	.	.	H	α-helix	trans	-64.2	-38.8	173.6	-78.7	-179.3	45.2	0	0	112.3	L219 D220 E221 F226 S227	L219-Q223 WeakPolarHBondContact O-CB 3.43Å; L219-Q223 VanDerWaalsContact O-CG 3.25Å; L219-Q223 WeakPolarHBondContact O-CG 3.37Å; L219-Q223 PolarHBondContact O-N 3.13Å; D220-Q223 PolarHBondContact O-N 2.89Å; E221-Q223 PolarHBondContact O-N 3.34Å; Q223-F226 PolarHBondContact O-N 2.84Å; Q223-S227 WeakPolarHBondContact O-CB 3.45Å; Q223-S227 PolarHBondContact O-N 2.86Å
224	A	78.6	Confident	74.7	Confident	52 Å²	52	87.1 Å²	87.1	43%	0.43	44%	0.436	S	S	.	.	H	α-helix	trans	-60.5	-49.4	174.4	0	0	0	0	0	110.9	D220 E221 F226 S227 E228	D220-A224 WeakPolarHBondContact O-CB 3.37Å; D220-A224 PolarHBondContact O-N 3.49Å; E221-A224 WeakPolarHBondContact O-CB 3.49Å; E221-A224 PolarHBondContact O-N 2.85Å; A224-F226 PolarHBondContact O-N 3.03Å; A224-S227 WeakPolarHBondContact O-CA 3.49Å; A224-S227 WeakPolarHBondContact O-CB 3.28Å; A224-S227 PolarHBondContact O-N 2.93Å; A224-S227 PolarHBondContact O-OG 3.1Å; A224-E228 PolarHBondContact O-N 3.4Å
225	I	78.9	Confident	76.8	Confident	15 Å²	15	83.3 Å²	83.3	8%	0.077	42%	0.423	C	S	.	.	H	α-helix	trans	-57.7	-45.4	175.3	-68.5	167.5	0	0	0	111.5	Y217 E221 A222 S227 E228 L229 L1027 L1031	Y217-I225 HydrophobicContact CD1-CD1 3.9Å; Y217-I225 HydrophobicContact CE1-CD1 3.42Å; Y217-I225 VanDerWaalsContact CE1-CD1 3.42Å; Y217-I225 HydrophobicContact CE2-CD1 4.43Å; E221-I225 WeakPolarHBondContact O-CG1 3.46Å; E221-I225 PolarHBondContact O-N 3Å; A222-I225 PolarHBondContact O-N 2.72Å; I225-S227 VanDerWaalsContact C-N 3.27Å; I225-S227 PolarHBondContact O-N 3.22Å; I225-E228 PolarHBondContact O-N 2.65Å; I225-L229 HydrophobicContact CG2-CD1 3.98Å; I225-L229 HydrophobicContact CG2-CG 4.44Å; I225-L229 WeakPolarHBondContact O-CB 2.83Å; I225-L229 WeakPolarHBondContact O-CG 3.43Å; I225-L229 PolarHBondContact O-N 2.69Å; I225-L1027 HydrophobicContact CG2-CB 4.2Å; I225-L1031 HydrophobicContact CG1-CD2 4.2Å; I225-L1031 HydrophobicContact CG2-CB 4.44Å; I225-L1031 HydrophobicContact CG2-CD2 4.16Å
226	F	77.9	Confident	78.6	Confident	98 Å²	98	78.9 Å²	78.9	43%	0.43	40%	0.395	S	S	.	.	H	α-helix	trans	-63.5	-30.4	174.8	-88.3	-64	0	0	0	113.6	A222 Q223 A224 R230 L1027	A222-F226 VanDerWaalsContact O-CD2 3.27Å; A222-F226 WeakPolarHBondContact O-CD2 3.2Å; A222-F226 PolarHBondContact O-N 3.49Å; Q223-F226 PolarHBondContact O-N 2.84Å; A224-F226 PolarHBondContact O-N 3.03Å; F226-R230 VanDerWaalsContact O-CB 3.31Å; F226-R230 WeakPolarHBondContact O-CB 3.41Å; F226-R230 PolarHBondContact O-N 3.24Å; F226-L1027 HydrophobicContact CD1-CD2 4.36Å; F226-L1027 HydrophobicContact CD2-CD2 4.46Å; F226-L1027 HydrophobicContact CE1-CD2 3.75Å; F226-L1027 HydrophobicContact CE2-CD1 4.11Å; F226-L1027 HydrophobicContact CE2-CD2 3.86Å; F226-L1027 HydrophobicContact CZ-CD1 4.37Å; F226-L1027 HydrophobicContact CZ-CD2 3.48Å; F226-L1027 VanDerWaalsContact CZ-CD2 3.48Å
227	S	83.9	Confident	80.3	Confident	73 Å²	73	76.9 Å²	76.9	51%	0.51	39%	0.39	S	S	.	.	H	α-helix	trans	-74	-40.4	175.4	84.4	0	0	0	0	111.6	Q223 A224 I225 R230 S231	Q223-S227 WeakPolarHBondContact O-CB 3.45Å; Q223-S227 PolarHBondContact O-N 2.86Å; A224-S227 WeakPolarHBondContact O-CA 3.49Å; A224-S227 WeakPolarHBondContact O-CB 3.28Å; A224-S227 PolarHBondContact O-N 2.93Å; A224-S227 PolarHBondContact O-OG 3.1Å; I225-S227 VanDerWaalsContact C-N 3.27Å; I225-S227 PolarHBondContact O-N 3.22Å; S227-R230 PolarHBondContact O-N 2.9Å; S227-S231 PolarHBondContact O-N 2.99Å
228	E	88.1	Confident	82	Confident	69 Å²	69	77.2 Å²	77.2	32%	0.322	40%	0.401	S	S	.	.	H	α-helix	trans	-69	-46.8	177.4	-160.6	-169.6	145.4	0	0	110.8	A224 I225 R230 S231 I232 L1031 R1035	A224-E228 PolarHBondContact O-N 3.4Å; I225-E228 PolarHBondContact O-N 2.65Å; E228-R230 PolarHBondContact O-N 3.34Å; E228-S231 CarbonylContact O-C 3.59Å; E228-S231 WeakPolarHBondContact O-CA 3.47Å; E228-S231 WeakPolarHBondContact O-CB 3.21Å; E228-S231 PolarHBondContact O-N 2.94Å; E228-I232 HydrophobicContact CG-CD1 3.81Å; E228-I232 HydrophobicContact CG-CG1 4.25Å; E228-I232 WeakPolarHBondContact O-CG1 3.42Å; E228-I232 PolarHBondContact O-N 2.88Å; E228-L1031 HydrophobicContact CB-CD1 4.08Å; E228-L1031 HydrophobicContact CG-CD1 4.12Å; E228-R1035 IonicContact OE1-CZ 3.89Å; E228-R1035 VanDerWaalsContact OE1-CZ 3.23Å; E228-R1035 IonicContact OE1-NE 2.84Å; E228-R1035 PolarHBondContact OE1-NE 3.33Å; E228-R1035 IonicContact OE1-NH2 3.75Å; E228-R1035 PolarHBondContact OE1-NH2 2.81Å; E228-R1035 IonicContact OE2-CZ 2.71Å; E228-R1035 IonicContact OE2-NH2 3.82Å; E228-R1035 PolarHBondContact OE2-NH2 2.81Å
229	L	87.8	Confident	83	Confident	18 Å²	18	72.5 Å²	72.5	9%	0.094	38%	0.382	C	S	.	.	H	α-helix	trans	-52.4	-41.9	171.3	-82.7	171	0	0	0	112.1	I225 S231 K233 L1027 D1030 L1031 C1034	I225-L229 HydrophobicContact CG2-CD1 3.98Å; I225-L229 HydrophobicContact CG2-CG 4.44Å; I225-L229 WeakPolarHBondContact O-CB 2.83Å; I225-L229 WeakPolarHBondContact O-CG 3.43Å; I225-L229 PolarHBondContact O-N 2.69Å; L229-S231 VanDerWaalsContact C-N 3.35Å; L229-K233 WeakPolarHBondContact O-CB 3.39Å; L229-K233 PolarHBondContact O-N 3.08Å; L229-L1027 HydrophobicContact CD1-CD2 4.35Å; L229-D1030 HydrophobicContact CD1-CB 4.37Å; L229-D1030 HydrophobicContact CD2-CB 4.14Å; L229-L1031 HydrophobicContact CD2-CB 4.23Å; L229-L1031 HydrophobicContact CD2-CD1 4.14Å; L229-L1031 HydrophobicContact CG-CB 4.39Å; L229-L1031 HydrophobicContact CG-CD1 3.98Å; L229-C1034 HydrophobicContact CD2-CB 4.05Å
230	R	87.7	Confident	84	Confident	173 Å²	173	69.3 Å²	69.3	65%	0.653	36%	0.364	S	S	*	.	H	α-helix	trans	-69.5	-32.2	176.6	-170.5	-175.3	-58.9	-178.8	2.8	112.4	F226 S227 E228 K234	F226-R230 VanDerWaalsContact O-CB 3.31Å; F226-R230 WeakPolarHBondContact O-CB 3.41Å; F226-R230 PolarHBondContact O-N 3.24Å; S227-R230 PolarHBondContact O-N 2.9Å; E228-R230 PolarHBondContact O-N 3.34Å; R230-K234 WeakPolarHBondContact O-CG 3.33Å; R230-K234 PolarHBondContact O-N 2.87Å
231	S	91.6	Very high	84.9	Confident	68 Å²	68	70 Å²	70	48%	0.476	36%	0.361	S	S	.	.	H	α-helix	trans	-71.6	-55.4	175	-161.4	0	0	0	0	111	S227 E228 L229 K233 K234 S235	S227-S231 PolarHBondContact O-N 2.99Å; E228-S231 CarbonylContact O-C 3.59Å; E228-S231 WeakPolarHBondContact O-CA 3.47Å; E228-S231 WeakPolarHBondContact O-CB 3.21Å; E228-S231 PolarHBondContact O-N 2.94Å; L229-S231 VanDerWaalsContact C-N 3.35Å; S231-K233 VanDerWaalsContact C-N 3.32Å; S231-K233 PolarHBondContact O-N 3.45Å; S231-K234 WeakPolarHBondContact O-CA 3.44Å; S231-K234 WeakPolarHBondContact O-CB 3.36Å; S231-K234 PolarHBondContact O-N 3.34Å; S231-S235 PolarHBondContact O-N 2.85Å; S231-S235 PolarHBondContact O-OG 3.39Å
232	I	89.6	Confident	85.8	Confident	8 Å²	8	69.7 Å²	69.7	4%	0.041	36%	0.36	C	S	.	.	H	α-helix	trans	-55.8	-45.3	177.7	-63.5	162.3	0	0	0	110.8	E228 K234 S235 I236 L1031 C1034 R1035 Q1038	E228-I232 HydrophobicContact CG-CD1 3.81Å; E228-I232 HydrophobicContact CG-CG1 4.25Å; E228-I232 WeakPolarHBondContact O-CG1 3.42Å; E228-I232 PolarHBondContact O-N 2.88Å; I232-K234 VanDerWaalsContact C-N 3.28Å; I232-K234 PolarHBondContact O-N 2.97Å; I232-S235 WeakPolarHBondContact O-CB 3.4Å; I232-S235 PolarHBondContact O-N 3.05Å; I232-S235 VanDerWaalsContact O-N 3.13Å; I232-I236 HydrophobicContact CG2-CD1 3.66Å; I232-I236 HydrophobicContact CG2-CG1 4.18Å; I232-I236 WeakPolarHBondContact O-CB 3.4Å; I232-I236 WeakPolarHBondContact O-CG1 3.29Å; I232-I236 PolarHBondContact O-N 3.28Å; I232-L1031 HydrophobicContact CD1-CD1 3.63Å; I232-C1034 HydrophobicContact CB-CB 4.41Å; I232-C1034 HydrophobicContact CD1-CB 4.5Å; I232-C1034 HydrophobicContact CG2-CB 3.7Å; I232-R1035 HydrophobicContact CD1-CG 3.65Å; I232-Q1038 HydrophobicContact CG2-CB 4.02Å
233	K	88.9	Confident	86.5	Confident	155 Å²	155	71.1 Å²	71.1	67%	0.674	36%	0.361	S	S	*	.	H	α-helix	trans	-62.5	-33.3	177.8	-173.9	168.1	-176.5	169.3	0	112.9	L229 S231 S237	L229-K233 WeakPolarHBondContact O-CB 3.39Å; L229-K233 PolarHBondContact O-N 3.08Å; S231-K233 VanDerWaalsContact C-N 3.32Å; S231-K233 PolarHBondContact O-N 3.45Å; K233-S237 PolarHBondContact O-N 3.22Å; K233-S237 PolarHBondContact O-OG 2.95Å
234	K	90.3	Very high	86.7	Confident	137 Å²	137	70.1 Å²	70.1	60%	0.596	36%	0.356	S	S	*	.	H	α-helix	trans	-66.2	-52.3	169.9	-74.2	171.6	175.2	-174.3	0	110.4	R230 S231 I232 I236 S237 T238	R230-K234 WeakPolarHBondContact O-CG 3.33Å; R230-K234 PolarHBondContact O-N 2.87Å; S231-K234 WeakPolarHBondContact O-CA 3.44Å; S231-K234 WeakPolarHBondContact O-CB 3.36Å; S231-K234 PolarHBondContact O-N 3.34Å; I232-K234 VanDerWaalsContact C-N 3.28Å; I232-K234 PolarHBondContact O-N 2.97Å; K234-I236 VanDerWaalsContact C-N 3.25Å; K234-I236 PolarHBondContact O-N 3.17Å; K234-S237 PolarHBondContact O-N 2.86Å; K234-S237 PolarHBondContact O-OG 3.27Å; K234-T238 PolarHBondContact O-N 3.05Å; K234-T238 PolarHBondContact O-OG1 3.49Å; K234-T238 VanDerWaalsContact O-OG1 3.12Å
235	S	90.4	Very high	87.1	Confident	45 Å²	45	71.4 Å²	71.4	32%	0.315	36%	0.356	S	S	.	.	H	α-helix	trans	-55.1	-39.6	178.9	-60.4	0	0	0	0	112.7	S231 I232 T238 G239	S231-S235 PolarHBondContact O-N 2.85Å; S231-S235 PolarHBondContact O-OG 3.39Å; I232-S235 WeakPolarHBondContact O-CB 3.4Å; I232-S235 PolarHBondContact O-N 3.05Å; I232-S235 VanDerWaalsContact O-N 3.13Å; S235-T238 WeakPolarHBondContact CA-OG1 3.43Å; S235-T238 PolarHBondContact O-OG1 3.23Å; S235-G239 PolarHBondContact O-N 2.8Å
236	I	88.2	Confident	87.4	Confident	10 Å²	10	71.5 Å²	71.5	5%	0.051	36%	0.357	C	S	.	.	H	α-helix	trans	-62.8	-53	171.9	-71	169.8	0	0	0	110.4	I232 K234 T238 G239 E240 R1037 Q1038 L1041	I232-I236 HydrophobicContact CG2-CD1 3.66Å; I232-I236 HydrophobicContact CG2-CG1 4.18Å; I232-I236 WeakPolarHBondContact O-CB 3.4Å; I232-I236 WeakPolarHBondContact O-CG1 3.29Å; I232-I236 PolarHBondContact O-N 3.28Å; K234-I236 VanDerWaalsContact C-N 3.25Å; K234-I236 PolarHBondContact O-N 3.17Å; I236-T238 VanDerWaalsContact C-N 3.3Å; I236-T238 PolarHBondContact O-N 3.24Å; I236-G239 PolarHBondContact O-N 3.27Å; I236-E240 VanDerWaalsContact CG2-CD 3.45Å; I236-E240 HydrophobicContact CG2-CG 4.2Å; I236-E240 WeakPolarHBondContact CG2-OE1 3.34Å; I236-E240 WeakPolarHBondContact O-CB 3.28Å; I236-E240 WeakPolarHBondContact O-CG 3.29Å; I236-E240 PolarHBondContact O-N 3.32Å; I236-R1037 HydrophobicContact CD1-CB 4.15Å; I236-R1037 HydrophobicContact CD1-CG 4.03Å; I236-R1037 HydrophobicContact CG2-CG 4.48Å; I236-Q1038 HydrophobicContact CD1-CB 4.24Å; I236-Q1038 HydrophobicContact CG1-CB 3.95Å; I236-Q1038 HydrophobicContact CG1-CG 4.44Å; I236-L1041 HydrophobicContact CB-CD2 4.26Å; I236-L1041 HydrophobicContact CG1-CD2 4.35Å; I236-L1041 HydrophobicContact CG2-CD2 4.22Å; I236-L1041 WeakPolarHBondContact O-CD2 3.14Å
237	S	88.1	Confident	87.6	Confident	69 Å²	69	67.1 Å²	67.1	48%	0.483	34%	0.338	S	S	.	.	H	α-helix	trans	-62.1	-33.3	-179.5	67.5	0	0	0	0	114	K233 K234 K241	K233-S237 PolarHBondContact O-N 3.22Å; K233-S237 PolarHBondContact O-OG 2.95Å; K234-S237 PolarHBondContact O-N 2.86Å; K234-S237 PolarHBondContact O-OG 3.27Å; S237-K241 PolarHBondContact O-N 2.9Å
238	T	90.7	Very high	87.4	Confident	90 Å²	90	67 Å²	67	55%	0.552	33%	0.329	S	S	*	.	H	α-helix	trans	-74.3	-40.3	174.5	49	0	0	0	0	111.8	K234 S235 I236 K241 E242	K234-T238 PolarHBondContact O-N 3.05Å; K234-T238 PolarHBondContact O-OG1 3.49Å; K234-T238 VanDerWaalsContact O-OG1 3.12Å; S235-T238 WeakPolarHBondContact CA-OG1 3.43Å; S235-T238 PolarHBondContact O-OG1 3.23Å; I236-T238 VanDerWaalsContact C-N 3.3Å; I236-T238 PolarHBondContact O-N 3.24Å; T238-K241 PolarHBondContact O-N 3.44Å; T238-E242 PolarHBondContact O-N 3.33Å
239	G	87.6	Confident	87.2	Confident	6 Å²	6	65 Å²	65	6%	0.062	32%	0.323	C	S	.	.	H	α-helix	trans	-68.6	-38.7	177	0	0	0	0	0	112.4	S235 I236 K241 E242 R243	S235-G239 PolarHBondContact O-N 2.8Å; I236-G239 PolarHBondContact O-N 3.27Å; G239-K241 VanDerWaalsContact C-N 3.32Å; G239-K241 PolarHBondContact O-N 3.34Å; G239-E242 PolarHBondContact O-N 2.94Å; G239-R243 VanDerWaalsContact O-CB 3.29Å; G239-R243 WeakPolarHBondContact O-CB 3.29Å; G239-R243 PolarHBondContact O-N 3.43Å
240	E	85.5	Confident	86.8	Confident	57 Å²	57	64.2 Å²	64.2	27%	0.266	32%	0.318	S	S	.	.	H	α-helix	trans	-65.4	-36.3	175.8	-75.9	172.2	176.6	0	0	111.4	I236 R243 Q244 R1037 L1041	I236-E240 VanDerWaalsContact CG2-CD 3.45Å; I236-E240 HydrophobicContact CG2-CG 4.2Å; I236-E240 WeakPolarHBondContact CG2-OE1 3.34Å; I236-E240 WeakPolarHBondContact O-CB 3.28Å; I236-E240 WeakPolarHBondContact O-CG 3.29Å; I236-E240 PolarHBondContact O-N 3.32Å; E240-R243 WeakPolarHBondContact O-CB 3.49Å; E240-R243 PolarHBondContact O-N 3.35Å; E240-Q244 WeakPolarHBondContact O-CG 3.33Å; E240-Q244 PolarHBondContact O-N 2.87Å; E240-R1037 IonicContact OE1-CZ 2.72Å; E240-R1037 IonicContact OE1-NE 2.84Å; E240-R1037 PolarHBondContact OE1-NE 2.77Å; E240-R1037 IonicContact OE1-NH2 3.98Å; E240-R1037 PolarHBondContact OE1-NH2 3.01Å; E240-R1037 IonicContact OE2-NH2 3.84Å; E240-R1037 PolarHBondContact OE2-NH2 3.16Å; E240-L1041 HydrophobicContact CG-CD1 3.78Å; E240-L1041 HydrophobicContact CG-CD2 3.89Å; E240-L1041 HydrophobicContact CG-CG 4.5Å
241	K	88.2	Confident	86.2	Confident	129 Å²	129	56.9 Å²	56.9	56%	0.561	30%	0.295	S	S	*	.	H	α-helix	trans	-63.9	-50	169.6	-171.5	-166.2	169.2	-166.1	0	111.5	S237 T238 G239 R243 Q244 D245	S237-K241 PolarHBondContact O-N 2.9Å; T238-K241 PolarHBondContact O-N 3.44Å; G239-K241 VanDerWaalsContact C-N 3.32Å; G239-K241 PolarHBondContact O-N 3.34Å; K241-R243 PolarHBondContact O-N 3.32Å; K241-Q244 WeakPolarHBondContact O-CB 3.47Å; K241-Q244 PolarHBondContact O-N 3.36Å; K241-Q244 VanDerWaalsContact O-N 3.12Å; K241-D245 WeakPolarHBondContact CE-OD2 3.46Å; K241-D245 PolarHBondContact O-N 3.12Å
242	E	89.6	Confident	85.6	Confident	63 Å²	63	60.1 Å²	60.1	29%	0.294	30%	0.3	S	S	.	.	H	α-helix	trans	-58.4	-38.2	177.2	-168.5	-166.5	155.9	0	0	111.3	T238 G239 Q244 D245 L246 L1045 R1049	T238-E242 PolarHBondContact O-N 3.33Å; G239-E242 PolarHBondContact O-N 2.94Å; E242-Q244 PolarHBondContact O-N 3.08Å; E242-D245 PolarHBondContact O-N 3.21Å; E242-L246 HydrophobicContact CG-CD1 4.12Å; E242-L246 HydrophobicContact CG-CG 4.38Å; E242-L246 WeakPolarHBondContact O-CB 3.46Å; E242-L246 WeakPolarHBondContact O-CG 3.35Å; E242-L246 PolarHBondContact O-N 3.4Å; E242-L1045 HydrophobicContact CB-CD2 3.88Å; E242-L1045 HydrophobicContact CG-CD2 3.94Å; E242-R1049 IonicContact OE1-CZ 2.65Å; E242-R1049 IonicContact OE1-NE 2.85Å; E242-R1049 PolarHBondContact OE1-NE 2.84Å; E242-R1049 IonicContact OE1-NH2 3.2Å; E242-R1049 PolarHBondContact OE1-NH2 3.27Å; E242-R1049 IonicContact OE2-CZ 3.86Å; E242-R1049 IonicContact OE2-NH2 3.81Å; E242-R1049 PolarHBondContact OE2-NH2 2.84Å
243	R	87.3	Confident	84.7	Confident	49 Å²	49	61.5 Å²	61.5	19%	0.185	31%	0.308	C	S	.	.	H	α-helix	trans	-61.7	-44.4	176.6	-154	-172.9	86.2	80.2	10.7	111	G239 E240 K241 I247 L1041 E1044 L1045 L1048 Q1086	G239-R243 VanDerWaalsContact O-CB 3.29Å; G239-R243 WeakPolarHBondContact O-CB 3.29Å; G239-R243 PolarHBondContact O-N 3.43Å; E240-R243 WeakPolarHBondContact O-CB 3.49Å; E240-R243 PolarHBondContact O-N 3.35Å; K241-R243 PolarHBondContact O-N 3.32Å; R243-I247 HydrophobicContact CG-CD1 4.24Å; R243-I247 VanDerWaalsContact O-CB 3.25Å; R243-I247 WeakPolarHBondContact O-CB 3.49Å; R243-I247 WeakPolarHBondContact O-CD1 3.42Å; R243-I247 WeakPolarHBondContact O-CG1 3.39Å; R243-I247 PolarHBondContact O-N 3.16Å; R243-L1041 HydrophobicContact CB-CD1 4.33Å; R243-L1041 HydrophobicContact CG-CD1 4.42Å; R243-E1044 VanDerWaalsContact CD-OE2 3.29Å; R243-E1044 WeakPolarHBondContact CD-OE2 3.34Å; R243-E1044 IonicContact CZ-OE2 3.26Å; R243-E1044 IonicContact NE-OE2 3.45Å; R243-E1044 IonicContact NH1-OE2 3.07Å; R243-E1044 PolarHBondContact NH1-OE2 3.31Å; R243-L1045 HydrophobicContact CB-CD2 3.9Å; R243-L1045 HydrophobicContact CG-CD2 4.31Å; R243-L1048 HydrophobicContact CG-CD1 3.47Å; R243-L1048 VanDerWaalsContact CG-CD1 3.47Å; R243-Q1086 VanDerWaalsContact CZ-OE1 3.22Å
244	Q	82.1	Confident	83.7	Confident	88 Å²	88	54.3 Å²	54.3	41%	0.411	28%	0.277	S	S	.	.	H	α-helix	trans	-64.5	-41.9	173.4	-71	174.6	10.6	0	0	112.3	E240 K241 E242 Q248	E240-Q244 WeakPolarHBondContact O-CG 3.33Å; E240-Q244 PolarHBondContact O-N 2.87Å; K241-Q244 WeakPolarHBondContact O-CB 3.47Å; K241-Q244 PolarHBondContact O-N 3.36Å; K241-Q244 VanDerWaalsContact O-N 3.12Å; E242-Q244 PolarHBondContact O-N 3.08Å; Q244-Q248 WeakPolarHBondContact O-CB 3.37Å; Q244-Q248 VanDerWaalsContact O-CG 3.27Å; Q244-Q248 WeakPolarHBondContact O-CG 3.22Å; Q244-Q248 PolarHBondContact O-N 3.14Å
245	D	86.1	Confident	82.5	Confident	80 Å²	80	50 Å²	50	43%	0.428	27%	0.267	S	S	.	.	H	α-helix	trans	-66.8	-41.6	179.2	-73.6	-30.6	0	0	0	111.4	K241 E242 Q248 S249	K241-D245 WeakPolarHBondContact CE-OD2 3.46Å; K241-D245 PolarHBondContact O-N 3.12Å; E242-D245 PolarHBondContact O-N 3.21Å; D245-Q248 PolarHBondContact O-N 2.73Å; D245-S249 WeakPolarHBondContact O-CB 3.4Å; D245-S249 PolarHBondContact O-N 3.42Å
246	L	85.6	Confident	81.1	Confident	17 Å²	17	53.2 Å²	53.2	9%	0.089	28%	0.281	C	S	.	.	H	α-helix	trans	-64.4	-48.8	172.8	-73.1	170.3	0	0	0	111.7	E242 Q248 S249 L250 L1045 L1048 R1049 K1052	E242-L246 HydrophobicContact CG-CD1 4.12Å; E242-L246 HydrophobicContact CG-CG 4.38Å; E242-L246 WeakPolarHBondContact O-CB 3.46Å; E242-L246 WeakPolarHBondContact O-CG 3.35Å; E242-L246 PolarHBondContact O-N 3.4Å; L246-Q248 VanDerWaalsContact C-N 3.26Å; L246-Q248 PolarHBondContact O-N 2.95Å; L246-S249 WeakPolarHBondContact O-CB 3.36Å; L246-S249 PolarHBondContact O-N 2.85Å; L246-S249 VanDerWaalsContact O-N 3.08Å; L246-L250 WeakPolarHBondContact O-CB 3.38Å; L246-L250 VanDerWaalsContact O-CG 3.28Å; L246-L250 WeakPolarHBondContact O-CG 3.47Å; L246-L250 PolarHBondContact O-N 2.8Å; L246-L1045 HydrophobicContact CD1-CD2 3.78Å; L246-L1048 HydrophobicContact CB-CB 4.16Å; L246-L1048 HydrophobicContact CD1-CB 3.94Å; L246-R1049 HydrophobicContact CD1-CG 3.82Å; L246-R1049 HydrophobicContact CD2-CG 4.46Å; L246-K1052 HydrophobicContact CD2-CD 3.64Å
247	I	82.2	Confident	79.9	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.031	29%	0.29	C	S	.	.	H	α-helix	trans	-58.6	-39	176.2	-76.2	169.1	0	0	0	111.1	R243 A251 L1048 A1083 Q1086 A1087	R243-I247 HydrophobicContact CG-CD1 4.24Å; R243-I247 VanDerWaalsContact O-CB 3.25Å; R243-I247 WeakPolarHBondContact O-CB 3.49Å; R243-I247 WeakPolarHBondContact O-CD1 3.42Å; R243-I247 WeakPolarHBondContact O-CG1 3.39Å; R243-I247 PolarHBondContact O-N 3.16Å; I247-A251 VanDerWaalsContact O-CB 3.26Å; I247-A251 WeakPolarHBondContact O-CB 3.46Å; I247-A251 PolarHBondContact O-N 2.81Å; I247-L1048 HydrophobicContact CD1-CD1 4.15Å; I247-L1048 HydrophobicContact CG1-CD1 3.95Å; I247-L1048 HydrophobicContact CG1-CD2 3.89Å; I247-A1083 HydrophobicContact CG1-CB 4.37Å; I247-A1083 WeakPolarHBondContact CG2-O 3.46Å; I247-Q1086 HydrophobicContact CD1-CB 4.45Å; I247-A1087 HydrophobicContact CG2-CB 3.58Å
248	Q	80.2	Confident	78.4	Confident	71 Å²	71	57 Å²	57	33%	0.332	29%	0.29	S	S	.	.	H	α-helix	trans	-70.5	-36.5	173.8	-75.5	-178.8	69.9	0	0	113.3	Q244 D245 L246 K252	Q244-Q248 WeakPolarHBondContact O-CB 3.37Å; Q244-Q248 VanDerWaalsContact O-CG 3.27Å; Q244-Q248 WeakPolarHBondContact O-CG 3.22Å; Q244-Q248 PolarHBondContact O-N 3.14Å; D245-Q248 PolarHBondContact O-N 2.73Å; L246-Q248 VanDerWaalsContact C-N 3.26Å; L246-Q248 PolarHBondContact O-N 2.95Å; Q248-K252 WeakPolarHBondContact O-CD 3.5Å; Q248-K252 VanDerWaalsContact O-CG 3.24Å; Q248-K252 WeakPolarHBondContact O-CG 3.47Å; Q248-K252 PolarHBondContact O-N 3.27Å
249	S	84	Confident	75.9	Confident	26 Å²	26	58.4 Å²	58.4	18%	0.182	30%	0.303	C	S	.	.	H	α-helix	trans	-61.2	-47.5	173.3	-162	0	0	0	0	110.4	D245 L246 K252 L253 K1052	D245-S249 WeakPolarHBondContact O-CB 3.4Å; D245-S249 PolarHBondContact O-N 3.42Å; L246-S249 WeakPolarHBondContact O-CB 3.36Å; L246-S249 PolarHBondContact O-N 2.85Å; L246-S249 VanDerWaalsContact O-N 3.08Å; S249-K252 PolarHBondContact O-N 3.09Å; S249-L253 WeakPolarHBondContact O-CG 3.25Å; S249-L253 PolarHBondContact O-N 2.82Å; S249-K1052 PolarHBondContact OG-NZ 2.68Å; S249-K1052 VanDerWaalsContact OG-NZ 3.09Å
250	L	79.8	Confident	73.5	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-65.6	-41.7	177.8	-70.5	169.2	0	0	0	112.2	L246 K252 L253 T254 L1048 L1051 K1052 L1055	L246-L250 WeakPolarHBondContact O-CB 3.38Å; L246-L250 VanDerWaalsContact O-CG 3.28Å; L246-L250 WeakPolarHBondContact O-CG 3.47Å; L246-L250 PolarHBondContact O-N 2.8Å; L250-K252 VanDerWaalsContact C-N 3.3Å; L250-K252 PolarHBondContact O-N 3.09Å; L250-L253 PolarHBondContact O-N 3.28Å; L250-T254 WeakPolarHBondContact O-CB 3.48Å; L250-T254 WeakPolarHBondContact O-CG2 3.22Å; L250-T254 PolarHBondContact O-N 2.88Å; L250-T254 PolarHBondContact O-OG1 2.72Å; L250-L1048 HydrophobicContact CD1-CB 4.45Å; L250-L1048 HydrophobicContact CD1-CD2 3.61Å; L250-L1051 HydrophobicContact CD1-CD2 3.7Å; L250-L1051 HydrophobicContact CD2-CD2 3.85Å; L250-L1051 HydrophobicContact CG-CD2 4.34Å; L250-K1052 HydrophobicContact CD2-CB 3.87Å; L250-K1052 HydrophobicContact CD2-CG 4.48Å; L250-K1052 HydrophobicContact CG-CB 4.38Å; L250-L1055 HydrophobicContact CD2-CD1 3.78Å
251	A	75.1	Confident	71.2	Confident	20 Å²	20	67.3 Å²	67.3	17%	0.165	36%	0.358	C	S	.	.	H	α-helix	trans	-63.1	-35.1	175.3	0	0	0	0	0	112.2	I247 T254 A255 A1087	I247-A251 VanDerWaalsContact O-CB 3.26Å; I247-A251 WeakPolarHBondContact O-CB 3.46Å; I247-A251 PolarHBondContact O-N 2.81Å; A251-T254 WeakPolarHBondContact CA-OG1 3.4Å; A251-T254 PolarHBondContact O-OG1 2.87Å; A251-A255 VanDerWaalsContact O-CB 3.25Å; A251-A255 WeakPolarHBondContact O-CB 3.34Å; A251-A255 PolarHBondContact O-N 2.84Å; A251-A1087 HydrophobicContact CB-CB 3.97Å
252	K	78.1	Confident	68.7	Low	135 Å²	135	67.2 Å²	67.2	59%	0.587	37%	0.373	S	S	*	.	H	α-helix	trans	-69.5	-50.3	173.2	-69.9	163.6	-172.4	171.5	0	111.6	Q248 S249 L250 T254 A255 N256	Q248-K252 WeakPolarHBondContact O-CD 3.5Å; Q248-K252 VanDerWaalsContact O-CG 3.24Å; Q248-K252 WeakPolarHBondContact O-CG 3.47Å; Q248-K252 PolarHBondContact O-N 3.27Å; S249-K252 PolarHBondContact O-N 3.09Å; L250-K252 VanDerWaalsContact C-N 3.3Å; L250-K252 PolarHBondContact O-N 3.09Å; K252-T254 VanDerWaalsContact C-N 3.27Å; K252-T254 PolarHBondContact O-N 3.49Å; K252-A255 PolarHBondContact O-N 3.18Å; K252-N256 PolarHBondContact O-N 2.79Å; K252-N256 PolarHBondContact O-OD1 3.5Å
253	L	71.5	Confident	65.9	Low	37 Å²	37	72.6 Å²	72.6	19%	0.194	40%	0.402	C	S	.	.	H	α-helix	trans	-55.5	-43.4	176.7	-72.4	166.6	0	0	0	111.4	S249 L250 N256 F257 L1055 E1056	S249-L253 WeakPolarHBondContact O-CG 3.25Å; S249-L253 PolarHBondContact O-N 2.82Å; L250-L253 PolarHBondContact O-N 3.28Å; L253-N256 WeakPolarHBondContact O-CB 3.28Å; L253-F257 WeakPolarHBondContact O-CD2 3.22Å; L253-F257 WeakPolarHBondContact O-CE2 3.4Å; L253-L1055 HydrophobicContact CD1-CB 4.48Å; L253-E1056 HydrophobicContact CD1-CG 3.9Å; L253-E1056 HydrophobicContact CD2-CG 4.44Å
254	T	68.3	Low	63.4	Low	4 Å²	4	73.4 Å²	73.4	3%	0.025	43%	0.426	C	S	.	.	H	α-helix	trans	-77.6	-29.8	-179.6	52	0	0	0	0	115.5	L250 A251 K252 N256 F257 Q258 L1055 L1066 L1080	L250-T254 WeakPolarHBondContact O-CB 3.48Å; L250-T254 WeakPolarHBondContact O-CG2 3.22Å; L250-T254 PolarHBondContact O-N 2.88Å; L250-T254 PolarHBondContact O-OG1 2.72Å; A251-T254 WeakPolarHBondContact CA-OG1 3.4Å; A251-T254 PolarHBondContact O-OG1 2.87Å; K252-T254 VanDerWaalsContact C-N 3.27Å; K252-T254 PolarHBondContact O-N 3.49Å; T254-N256 PolarHBondContact O-N 2.95Å; T254-F257 PolarHBondContact O-N 2.81Å; T254-Q258 WeakPolarHBondContact O-CG 3.49Å; T254-Q258 PolarHBondContact O-N 2.9Å; T254-L1055 HydrophobicContact CG2-CD1 4.46Å; T254-L1066 HydrophobicContact CG2-CD1 4.48Å; T254-L1080 HydrophobicContact CG2-CD1 4.07Å; T254-L1080 HydrophobicContact CG2-CD2 3.5Å; T254-L1080 VanDerWaalsContact CG2-CD2 3.5Å; T254-L1080 HydrophobicContact CG2-CG 4.46Å
255	A	64.3	Low	60.8	Low	48 Å²	48	77.2 Å²	77.2	40%	0.397	45%	0.449	S	S	.	.	H	α-helix	trans	-61.1	-34.1	174.5	0	0	0	0	0	112.2	A251 K252 F257 Q258 S259	A251-A255 VanDerWaalsContact O-CB 3.25Å; A251-A255 WeakPolarHBondContact O-CB 3.34Å; A251-A255 PolarHBondContact O-N 2.84Å; K252-A255 PolarHBondContact O-N 3.18Å; A255-F257 PolarHBondContact O-N 2.83Å; A255-Q258 PolarHBondContact O-N 2.99Å; A255-S259 PolarHBondContact O-OG 2.76Å
256	N	61.8	Low	58.1	Low	111 Å²	111	77.3 Å²	77.3	59%	0.594	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.4	174.4	-60.3	-14.2	0	0	0	112.7	K252 L253 T254	K252-N256 PolarHBondContact O-N 2.79Å; K252-N256 PolarHBondContact O-OD1 3.5Å; L253-N256 WeakPolarHBondContact O-CB 3.28Å; T254-N256 PolarHBondContact O-N 2.95Å
257	F	62.5	Low	55.4	Low	56 Å²	56	81.8 Å²	81.8	25%	0.246	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-5.4	-177.4	-61.3	-67.7	0	0	0	114.7	L253 T254 A255 E1065 L1066	L253-F257 WeakPolarHBondContact O-CD2 3.22Å; L253-F257 WeakPolarHBondContact O-CE2 3.4Å; T254-F257 PolarHBondContact O-N 2.81Å; A255-F257 PolarHBondContact O-N 2.83Å; F257-E1065 WeakPolarHBondContact CD1-O 3.44Å; F257-E1065 WeakPolarHBondContact CE1-O 3.46Å; F257-L1066 HydrophobicContact CB-CB 4.5Å; F257-L1066 HydrophobicContact CB-CD1 3.97Å; F257-L1066 HydrophobicContact CD2-CD1 3.71Å; F257-L1066 HydrophobicContact CE2-CD1 4.41Å; F257-L1066 HydrophobicContact CG-CD1 3.96Å
258	Q	55.3	Low	52.9	Low	103 Å²	103	85.3 Å²	85.3	48%	0.481	54%	0.538	S	S	.	.			trans	-117.9	6.9	-164.9	-74.2	-173.6	2.8	0	0	116.3	T254 A255 S260	T254-Q258 WeakPolarHBondContact O-CG 3.49Å; T254-Q258 PolarHBondContact O-N 2.9Å; A255-Q258 PolarHBondContact O-N 2.99Å; Q258-S260 PolarHBondContact O-N 2.83Å
259	S	39.6	Very low	50.5	Low	119 Å²	119	88.2 Å²	88.2	83%	0.832	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	31	-170.1	-63.9	0	0	0	0	115.7	A255	A255-S259 PolarHBondContact O-OG 2.76Å
260	S	37.1	Very low	48	Very low	95 Å²	95	93.7 Å²	93.7	66%	0.664	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.5	-16.4	-164.2	57.5	0	0	0	0	118.5	Q258	Q258-S260 PolarHBondContact O-N 2.83Å
261	L	37.5	Very low	45.7	Very low	156 Å²	156	97.9 Å²	97.9	82%	0.817	62%	0.619	S	S	*	*			trans	-145.6	120.2	-170.6	-67.3	171.4	0	0	0	114.2
262	S	34.8	Very low	43.4	Very low	126 Å²	126	104.9 Å²	104.9	88%	0.881	65%	0.651	S	S	*	*			trans	-168	122.7	168.9	-81.4	0	0	0	0	116.2
263	I	30.6	Very low	41	Very low	177 Å²	177	103.7 Å²	103.7	91%	0.908	66%	0.66	S	S	*	*			trans	-156.8	154.3	167.4	-62.1	-170.5	0	0	0	105.7
264	G	35.3	Very low	38.8	Very low	65 Å²	65	106.8 Å²	106.8	67%	0.67	69%	0.691	S	S	*	*			cis	123.5	142.9	10.2	0	0	0	0	0	110.4
265	D	27.1	Very low	36.9	Very low	168 Å²	168	110.9 Å²	110.9	90%	0.898	73%	0.725	S	S	*	*			cis	-149.7	-143.1	-2.4	-159.7	-100.1	0	0	0	111.7
266	A	28.6	Very low	35.1	Very low	83 Å²	83	114.9 Å²	114.9	69%	0.686	75%	0.745	S	S	*	*			trans	-137.6	-172.4	-159.3	0	0	0	0	0	118.5
267	A	29.4	Very low	33.5	Very low	111 Å²	111	114.6 Å²	114.6	92%	0.917	76%	0.758	S	S	*	*			trans	73.5	160	170.8	0	0	0	0	0	119
268	G	31.1	Very low	31.7	Very low	79 Å²	79	115.7 Å²	115.7	81%	0.814	79%	0.785	S	S	*	*			cis	-168.5	-174.6	2.2	0	0	0	0	0	114.7
269	E	28.9	Very low	30.4	Very low	133 Å²	133	118.3 Å²	118.3	62%	0.621	80%	0.802	S	S	*	*			trans	-100.9	175.3	-172.7	-57.7	-177.5	114.2	0	0	115.8	R978	E269-R978 IonicContact OE1-NH1 3.6Å; E269-R978 IonicContact OE2-NH1 2.62Å
270	V	31.3	Very low	30.3	Very low	140 Å²	140	117.1 Å²	117.1	85%	0.848	79%	0.792	S	S	*	*				164.6	127.4	128.7	156	0	0	0	0	117.7
271	A	31.2	Very low	29.8	Very low	90 Å²	90	123.5 Å²	123.5	74%	0.744	80%	0.803	S	S	*	*			trans	49.5	174	149.2	0	0	0	0	0	123
272	I	28.4	Very low	29.3	Very low	166 Å²	166	123.5 Å²	123.5	85%	0.851	80%	0.804	S	S	*	*			cis	-141.8	179	20	-64.6	175.2	0	0	0	112.9
273	S	26	Very low	29.6	Very low	111 Å²	111	122 Å²	122	78%	0.776	79%	0.791	S	S	*	*			trans	-100.9	-179.3	-155.1	-31.4	0	0	0	0	121.8
274	A	26.6	Very low	29.2	Very low	102 Å²	102	121.1 Å²	121.1	84%	0.843	78%	0.783	S	S	*	*			trans	80.2	163.5	152.4	0	0	0	0	0	120.2
275	A	26.8	Very low	28.8	Very low	89 Å²	89	124.8 Å²	124.8	74%	0.736	78%	0.783	S	S	*	*			cis	-173.3	-171.5	-30.5	0	0	0	0	0	108.4
276	T	26.8	Very low	28.7	Very low	132 Å²	132	126.3 Å²	126.3	81%	0.81	78%	0.777	S	S	*	*			cis	-165.1	152.2	7.3	-32	0	0	0	0	112.1
277	A	28.4	Very low	28.5	Very low	106 Å²	106	127.9 Å²	127.9	88%	0.876	78%	0.782	S	S	*	*			trans	60.7	159.8	159.8	0	0	0	0	0	120.6
278	G	24.8	Very low	28.2	Very low	78 Å²	78	130.8 Å²	130.8	80%	0.804	78%	0.777	S	S	*	*			cis	-168.6	-178	0.9	0	0	0	0	0	113.8
279	N	28.8	Very low	28.3	Very low	158 Å²	158	134.1 Å²	134.1	85%	0.845	78%	0.781	S	S	*	*			trans	-151	166	-173.9	-156.9	2.4	0	0	0	110
280	P	36.4	Very low	28.2	Very low	95 Å²	95	131.1 Å²	131.1	62%	0.617	79%	0.786	S	S	*	*				-168.2	174.5	95.8	45.3	-24.1	0	0	0	121.7
281	Y	26.5	Very low	28.1	Very low	229 Å²	229	130.5 Å²	130.5	90%	0.898	79%	0.786	S	S	*	*			trans	82.4	163.4	152.8	-67.5	-55.4	0	0	0	123.5
282	N	26.9	Very low	28.1	Very low	155 Å²	155	134 Å²	134	83%	0.829	79%	0.787	S	S	*	*			trans	-159.2	-163.3	-154	-149	13	0	0	0	109.3
283	P	41.7	Very low	28.5	Very low	95 Å²	95	132.9 Å²	132.9	62%	0.617	79%	0.788	S	S	*	*			cis	-145.1	-159.4	-1.6	43.1	-19.3	0	0	0	117.7
284	Q	23.1	Very low	28.9	Very low	158 Å²	158	134 Å²	134	74%	0.738	79%	0.785	S	S	*	*			trans	100.6	125	145.7	-89.7	-178.9	-36	0	0	126
285	Q	24.9	Very low	29	Very low	143 Å²	143	137.5 Å²	137.5	67%	0.668	79%	0.788	S	S	*	*			trans	99.3	126.7	130.7	-82.9	-178.5	-3.1	0	0	127.3
286	Y	25.2	Very low	29.2	Very low	199 Å²	199	142 Å²	142	78%	0.78	80%	0.796	S	S	*	*			trans	61.5	160.2	151	-72.2	-66.4	0	0	0	122.1
287	C	24.7	Very low	29.4	Very low	117 Å²	117	139.1 Å²	139.1	79%	0.791	79%	0.793	S	S	*	*			cis	-152.3	-169.7	12.5	-140.5	0	0	0	0	115.2
288	E	24.3	Very low	29.7	Very low	172 Å²	172	141.2 Å²	141.2	80%	0.804	79%	0.785	S	S	*	*			trans	-123.2	-176.8	-169.2	-59.7	-177.8	109.8	0	0	117.5
289	T	31.6	Very low	30.3	Very low	149 Å²	149	146.9 Å²	146.9	91%	0.914	78%	0.783	S	S	*	*			trans	76.4	162.4	170.1	68.3	0	0	0	0	119.2
290	G	27.1	Very low	30.4	Very low	69 Å²	69	142.4 Å²	142.4	71%	0.711	77%	0.774	S	S	*	*			cis	156.8	169.5	-6.8	0	0	0	0	0	112.1
291	C	29.6	Very low	31	Very low	127 Å²	127	143.8 Å²	143.8	86%	0.858	79%	0.786	S	S	*	*			cis	-169	150.4	-19.1	-86.5	0	0	0	0	112.7
292	Q	32.5	Very low	31.8	Very low	165 Å²	165	141.5 Å²	141.5	77%	0.771	78%	0.784	S	S	*	*			trans	55.6	142.9	153.7	-169.7	175	4.1	0	0	124.6
293	T	34.8	Very low	32.9	Very low	141 Å²	141	139.7 Å²	139.7	87%	0.865	77%	0.774	S	S	*	*			trans	-170.2	155.1	141.5	4.6	0	0	0	0	114.8
294	D	35.9	Very low	33.3	Very low	134 Å²	134	139.7 Å²	139.7	72%	0.717	78%	0.776	S	S	*	*			trans	-132.1	150.2	179.3	-66.6	-77.1	0	0	0	112
295	I	28.1	Very low	34.9	Very low	177 Å²	177	135.8 Å²	135.8	91%	0.908	77%	0.766	S	S	*	*			trans	-147.9	149.8	164.1	-51.9	-178.5	0	0	0	110.9
296	M	32.2	Very low	36.6	Very low	182 Å²	182	135.4 Å²	135.4	90%	0.897	76%	0.764	S	S	*	*			trans	-137	157	178.4	-162.2	-139.9	-53	0	0	111.4
297	G	29.7	Very low	38.7	Very low	72 Å²	72	130.9 Å²	130.9	74%	0.742	75%	0.753	S	S	*	*			trans	173.8	151.5	169.7	0	0	0	0	0	116.5
298	E	35.4	Very low	41	Very low	150 Å²	150	129.9 Å²	129.9	70%	0.701	74%	0.743	S	S	*	*			trans	-113.3	176.7	178.5	-51.8	169.2	113.9	0	0	109.7
299	Y	37.5	Very low	43.5	Very low	198 Å²	198	125.3 Å²	125.3	78%	0.776	72%	0.724	S	S	*	*			cis	-150.8	161.4	12.5	-119.8	-61.7	0	0	0	110.3
300	G	31	Very low	45.8	Very low	64 Å²	64	121.9 Å²	121.9	66%	0.66	70%	0.697	S	S	*	*			trans	-178	122.9	164.5	0	0	0	0	0	115.2
301	S	48.1	Very low	48.6	Very low	124 Å²	124	122.9 Å²	122.9	87%	0.867	69%	0.689	S	S	*	*			trans	-99.9	104.8	-179.6	-58.6	0	0	0	0	112.8
302	Q	44.5	Very low	51.3	Low	181 Å²	181	122.4 Å²	122.4	85%	0.846	67%	0.672	S	S	*	*			trans	-149.8	0.5	165.5	-136.9	167.9	0.1	0	0	116.3	S304	Q302-S304 PolarHBondContact O-N 3.14Å
303	D	48.5	Very low	53.9	Low	116 Å²	116	115.2 Å²	115.2	62%	0.62	64%	0.639	S	S	*	*			trans	-84.5	-3.1	-165.8	-77.3	-42.2	0	0	0	117.6	S305 H306 L307	D303-S305 VanDerWaalsContact C-N 3.32Å; D303-S305 PolarHBondContact O-N 2.9Å; D303-S305 VanDerWaalsContact O-N 3.16Å; D303-H306 PolarHBondContact O-N 3.01Å; D303-L307 WeakPolarHBondContact O-CB 3.3Å; D303-L307 PolarHBondContact O-N 2.84Å
304	S	51.2	Low	56.5	Low	95 Å²	95	112.3 Å²	112.3	66%	0.664	62%	0.618	S	S	*	*	H	α-helix	trans	-57.6	-38.4	-166.7	57.2	0	0	0	0	114.4	Q302 V308	Q302-S304 PolarHBondContact O-N 3.14Å; S304-V308 VanDerWaalsContact O-CG2 3.31Å; S304-V308 WeakPolarHBondContact O-CG2 3.27Å; S304-V308 PolarHBondContact O-N 3.44Å; S304-V308 VanDerWaalsContact O-N 3.1Å
305	S	55.4	Low	59.2	Low	76 Å²	76	113.7 Å²	113.7	53%	0.531	61%	0.613	S	S	.	*	H	α-helix	trans	-69.1	-48.3	177.7	-161.2	0	0	0	0	112.2	D303 L307 V308 D309	D303-S305 VanDerWaalsContact C-N 3.32Å; D303-S305 PolarHBondContact O-N 2.9Å; D303-S305 VanDerWaalsContact O-N 3.16Å; S305-L307 VanDerWaalsContact C-N 3.29Å; S305-L307 PolarHBondContact O-N 3.46Å; S305-V308 PolarHBondContact O-N 2.9Å; S305-D309 PolarHBondContact O-N 3.33Å
306	H	60.6	Low	62.2	Low	135 Å²	135	108.7 Å²	108.7	63%	0.625	59%	0.586	S	S	*	*	H	α-helix	trans	-66.8	-32	180	-71.8	-56.6	0	0	0	112.3	D303 K310	D303-H306 PolarHBondContact O-N 3.01Å; H306-K310 WeakPolarHBondContact O-CB 3.4Å; H306-K310 PolarHBondContact O-N 2.91Å
307	L	70.1	Confident	65.1	Low	105 Å²	105	102.2 Å²	102.2	55%	0.55	55%	0.552	S	S	.	*	H	α-helix	trans	-66	-43.6	171.8	-175.8	60.8	0	0	0	111.6	D303 S305 K310 V311	D303-L307 WeakPolarHBondContact O-CB 3.3Å; D303-L307 PolarHBondContact O-N 2.84Å; S305-L307 VanDerWaalsContact C-N 3.29Å; S305-L307 PolarHBondContact O-N 3.46Å; L307-K310 PolarHBondContact O-N 3.42Å; L307-V311 HydrophobicContact CD1-CG2 4.28Å; L307-V311 WeakPolarHBondContact O-CB 3.38Å; L307-V311 VanDerWaalsContact O-CG2 3.25Å; L307-V311 WeakPolarHBondContact O-CG2 3.3Å; L307-V311 PolarHBondContact O-N 3.17Å
308	V	73.4	Confident	68.1	Low	96 Å²	96	101.9 Å²	101.9	58%	0.582	53%	0.531	S	S	*	.	H	α-helix	trans	-62	-45.9	176.1	166.1	0	0	0	0	111.5	S304 S305 V311 K312	S304-V308 VanDerWaalsContact O-CG2 3.31Å; S304-V308 WeakPolarHBondContact O-CG2 3.27Å; S304-V308 PolarHBondContact O-N 3.44Å; S304-V308 VanDerWaalsContact O-N 3.1Å; S305-V308 PolarHBondContact O-N 2.9Å; V308-V311 PolarHBondContact O-N 2.94Å; V308-K312 VanDerWaalsContact O-CB 3.26Å; V308-K312 WeakPolarHBondContact O-CB 3.14Å; V308-K312 PolarHBondContact O-N 2.83Å
309	D	75.8	Confident	70.7	Confident	75 Å²	75	98.1 Å²	98.1	40%	0.401	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-39.8	177.2	-74.7	-42.9	0	0	0	112.1	S305 K312 L313	S305-D309 PolarHBondContact O-N 3.33Å; D309-K312 PolarHBondContact O-N 3.04Å; D309-L313 VanDerWaalsContact O-CB 3.3Å; D309-L313 WeakPolarHBondContact O-CB 3.45Å; D309-L313 PolarHBondContact O-N 3.32Å
310	K	81.6	Confident	73.3	Confident	78 Å²	78	89 Å²	89	34%	0.339	48%	0.479	S	S	.	.	H	α-helix	trans	-64.3	-41.4	174.9	-173.5	171.4	-175.1	168.7	0	112.1	H306 L307 N314 S438	H306-K310 WeakPolarHBondContact O-CB 3.4Å; H306-K310 PolarHBondContact O-N 2.91Å; L307-K310 PolarHBondContact O-N 3.42Å; K310-N314 WeakPolarHBondContact O-CB 3.38Å; K310-N314 PolarHBondContact O-N 2.91Å; K310-S438 PolarHBondContact NZ-OG 3.41Å
311	V	84.7	Confident	76.2	Confident	90 Å²	90	89.3 Å²	89.3	55%	0.545	46%	0.462	S	S	.	.	H	α-helix	trans	-65.9	-43.4	175.5	166.9	0	0	0	0	111.1	L307 V308 N314 W315	L307-V311 HydrophobicContact CD1-CG2 4.28Å; L307-V311 WeakPolarHBondContact O-CB 3.38Å; L307-V311 VanDerWaalsContact O-CG2 3.25Å; L307-V311 WeakPolarHBondContact O-CG2 3.3Å; L307-V311 PolarHBondContact O-N 3.17Å; V308-V311 PolarHBondContact O-N 2.94Å; V311-N314 PolarHBondContact O-N 3.05Å; V311-W315 WeakPolarHBondContact O-CB 3.43Å; V311-W315 PolarHBondContact O-N 3.14Å
312	K	86.7	Confident	78.4	Confident	117 Å²	117	90 Å²	90	51%	0.509	45%	0.45	S	S	.	.	H	α-helix	trans	-61.4	-46.5	176.3	-179.3	-178.3	176.8	-174.2	0	111.9	V308 D309 W315 Q316	V308-K312 VanDerWaalsContact O-CB 3.26Å; V308-K312 WeakPolarHBondContact O-CB 3.14Å; V308-K312 PolarHBondContact O-N 2.83Å; D309-K312 PolarHBondContact O-N 3.04Å; K312-W315 PolarHBondContact O-N 3.31Å; K312-Q316 WeakPolarHBondContact O-CG 3.37Å; K312-Q316 PolarHBondContact O-N 2.7Å
313	L	85.9	Confident	80.8	Confident	14 Å²	14	86.3 Å²	86.3	7%	0.073	43%	0.431	C	S	.	.	H	α-helix	trans	-66	-37.4	176.9	-167.6	75.2	0	0	0	111.8	D309 Q316 Y317 L430 Q433 L434 L437	D309-L313 VanDerWaalsContact O-CB 3.3Å; D309-L313 WeakPolarHBondContact O-CB 3.45Å; D309-L313 PolarHBondContact O-N 3.32Å; L313-Q316 PolarHBondContact O-N 3.47Å; L313-Y317 WeakPolarHBondContact O-CB 3.28Å; L313-Y317 PolarHBondContact O-N 3.05Å; L313-L430 HydrophobicContact CD1-CD2 3.59Å; L313-L430 HydrophobicContact CG-CD2 4.5Å; L313-Q433 HydrophobicContact CD1-CB 4.45Å; L313-Q433 HydrophobicContact CD2-CB 3.7Å; L313-L434 HydrophobicContact CB-CD2 4.14Å; L313-L434 HydrophobicContact CD2-CB 4.48Å; L313-L434 HydrophobicContact CD2-CD2 3.84Å; L313-L434 HydrophobicContact CD2-CG 3.75Å; L313-L434 HydrophobicContact CG-CD2 4.07Å; L313-L434 HydrophobicContact CG-CG 4Å; L313-L437 HydrophobicContact CD2-CD1 3.68Å
314	N	89.8	Confident	83	Confident	80 Å²	80	81.7 Å²	81.7	43%	0.428	41%	0.407	S	S	.	.	H	α-helix	trans	-68.3	-38.7	175.8	-170.3	79.8	0	0	0	112.2	K310 V311 Y317 E318 L434	K310-N314 WeakPolarHBondContact O-CB 3.38Å; K310-N314 PolarHBondContact O-N 2.91Å; V311-N314 PolarHBondContact O-N 3.05Å; N314-Y317 PolarHBondContact O-N 3.2Å; N314-E318 PolarHBondContact O-N 2.82Å; N314-L434 HydrophobicContact CB-CD2 3.98Å
315	W	92.4	Very high	85	Confident	162 Å²	162	82.4 Å²	82.4	61%	0.614	40%	0.399	S	S	*	.	H	α-helix	trans	-62.8	-45.9	172.2	175.9	87.1	0	0	0	111.5	V311 K312 Y317 E318 E319	V311-W315 WeakPolarHBondContact O-CB 3.43Å; V311-W315 PolarHBondContact O-N 3.14Å; K312-W315 PolarHBondContact O-N 3.31Å; W315-Y317 VanDerWaalsContact C-N 3.33Å; W315-Y317 PolarHBondContact O-N 3.35Å; W315-E318 PolarHBondContact O-N 3.05Å; W315-E319 WeakPolarHBondContact O-CB 3.39Å; W315-E319 PolarHBondContact O-N 2.92Å
316	Q	91.1	Very high	86.9	Confident	73 Å²	73	81.7 Å²	81.7	34%	0.341	39%	0.394	S	S	.	.	H	α-helix	trans	-60.8	-39.3	174.5	-73.3	179.5	-29.7	0	0	112.5	K312 L313 E319 A320 L430	K312-Q316 WeakPolarHBondContact O-CG 3.37Å; K312-Q316 PolarHBondContact O-N 2.7Å; L313-Q316 PolarHBondContact O-N 3.47Å; Q316-E319 PolarHBondContact O-N 3.17Å; Q316-A320 WeakPolarHBondContact O-CB 3.42Å; Q316-A320 PolarHBondContact O-N 3.33Å; Q316-L430 HydrophobicContact CB-CD1 4.07Å; Q316-L430 HydrophobicContact CB-CD2 4.39Å
317	Y	93.6	Very high	88.6	Confident	46 Å²	46	76 Å²	76	18%	0.18	37%	0.369	C	S	.	.	H	α-helix	trans	-64.5	-46.8	176.4	168.7	-104.7	0	0	0	112.2	L313 N314 W315 E319 A320 K321 T427 L430 H431 L434	L313-Y317 WeakPolarHBondContact O-CB 3.28Å; L313-Y317 PolarHBondContact O-N 3.05Å; N314-Y317 PolarHBondContact O-N 3.2Å; W315-Y317 VanDerWaalsContact C-N 3.33Å; W315-Y317 PolarHBondContact O-N 3.35Å; Y317-E319 VanDerWaalsContact C-N 3.32Å; Y317-E319 PolarHBondContact O-N 3Å; Y317-A320 PolarHBondContact O-N 2.79Å; Y317-K321 HydrophobicContact CE1-CD 4.26Å; Y317-K321 VanDerWaalsContact O-CB 3.25Å; Y317-K321 WeakPolarHBondContact O-CB 3.5Å; Y317-K321 PolarHBondContact O-N 2.84Å; Y317-T427 HydrophobicContact CD2-CG2 4.01Å; Y317-T427 HydrophobicContact CE2-CG2 3.61Å; Y317-L430 HydrophobicContact CD2-CB 4.24Å; Y317-H431 HydrophobicContact CD2-CB 4.15Å; Y317-H431 HydrophobicContact CE2-CB 3.73Å; Y317-H431 AromaticContact CE2-ND1 3.97Å; Y317-H431 AromaticContact CZ-ND1 3.88Å; Y317-L434 HydrophobicContact CD1-CD1 3.89Å; Y317-L434 HydrophobicContact CD2-CD1 4.31Å; Y317-L434 HydrophobicContact CG-CD1 3.64Å
318	E	92.7	Very high	89.7	Confident	65 Å²	65	75.8 Å²	75.8	30%	0.304	37%	0.365	S	S	.	.	H	α-helix	trans	-68.2	-30	175.9	-72.5	-63.8	144.1	0	0	112.3	N314 W315 K321 K322	N314-E318 PolarHBondContact O-N 2.82Å; W315-E318 PolarHBondContact O-N 3.05Å; E318-K321 IonicContact OE1-NZ 3.21Å; E318-K321 PolarHBondContact OE1-NZ 3.27Å; E318-K321 IonicContact OE2-NZ 3.54Å; E318-K321 PolarHBondContact OE2-NZ 2.76Å; E318-K322 WeakPolarHBondContact O-CB 3.5Å; E318-K322 VanDerWaalsContact O-CG 3.27Å; E318-K322 WeakPolarHBondContact O-CG 3.41Å; E318-K322 PolarHBondContact O-N 2.99Å
319	E	90.9	Very high	90.6	Very high	70 Å²	70	77.4 Å²	77.4	33%	0.327	37%	0.366	S	S	.	.	H	α-helix	trans	-67.5	-44.6	171	-159.4	-151.7	159.5	0	0	111.9	W315 Q316 Y317 K322 K323	W315-E319 WeakPolarHBondContact O-CB 3.39Å; W315-E319 PolarHBondContact O-N 2.92Å; Q316-E319 PolarHBondContact O-N 3.17Å; Y317-E319 VanDerWaalsContact C-N 3.32Å; Y317-E319 PolarHBondContact O-N 3Å; E319-K322 PolarHBondContact O-N 2.74Å; E319-K323 VanDerWaalsContact CD-NZ 3.32Å; E319-K323 WeakPolarHBondContact O-CG 3.45Å; E319-K323 PolarHBondContact O-N 3.07Å; E319-K323 WeakPolarHBondContact OE1-CE 3.28Å; E319-K323 IonicContact OE1-NZ 2.82Å; E319-K323 PolarHBondContact OE1-NZ 3.09Å; E319-K323 IonicContact OE2-NZ 2.73Å
320	A	91.6	Very high	91.4	Very high	6 Å²	6	77.8 Å²	77.8	5%	0.05	37%	0.365	C	S	.	.	H	α-helix	trans	-63.8	-40.7	176	0	0	0	0	0	111.9	Q316 Y317 K323 V324 I426 T427 L430	Q316-A320 WeakPolarHBondContact O-CB 3.42Å; Q316-A320 PolarHBondContact O-N 3.33Å; Y317-A320 PolarHBondContact O-N 2.79Å; A320-K323 WeakPolarHBondContact O-CB 3.49Å; A320-K323 PolarHBondContact O-N 2.87Å; A320-K323 VanDerWaalsContact O-N 3.16Å; A320-V324 PolarHBondContact O-N 3.17Å; A320-I426 HydrophobicContact CB-CG2 4.07Å; A320-T427 WeakPolarHBondContact CB-OG1 3.09Å; A320-T427 PolarHBondContact O-OG1 2.72Å; A320-L430 HydrophobicContact CB-CD1 4.02Å
321	K	92.4	Very high	91.9	Very high	71 Å²	71	74.7 Å²	74.7	31%	0.309	35%	0.352	S	S	.	.	H	α-helix	trans	-63.2	-40.3	173.6	178.3	176	158.7	-137.2	0	112.5	Y317 E318 V324 Q325 T427	Y317-K321 HydrophobicContact CE1-CD 4.26Å; Y317-K321 VanDerWaalsContact O-CB 3.25Å; Y317-K321 WeakPolarHBondContact O-CB 3.5Å; Y317-K321 PolarHBondContact O-N 2.84Å; E318-K321 IonicContact OE1-NZ 3.21Å; E318-K321 PolarHBondContact OE1-NZ 3.27Å; E318-K321 IonicContact OE2-NZ 3.54Å; E318-K321 PolarHBondContact OE2-NZ 2.76Å; K321-V324 WeakPolarHBondContact O-CB 3.45Å; K321-V324 PolarHBondContact O-N 3.38Å; K321-Q325 WeakPolarHBondContact O-CG 3.4Å; K321-Q325 PolarHBondContact O-N 2.87Å; K321-T427 HydrophobicContact CB-CG2 4.37Å
322	K	93.4	Very high	91.9	Very high	139 Å²	139	73.2 Å²	73.2	60%	0.604	35%	0.35	S	S	*	.	H	α-helix	trans	-63.6	-38	170.2	-76.6	172.5	-178.7	-177.6	0	112.4	E318 E319 Q325 S326	E318-K322 WeakPolarHBondContact O-CB 3.5Å; E318-K322 VanDerWaalsContact O-CG 3.27Å; E318-K322 WeakPolarHBondContact O-CG 3.41Å; E318-K322 PolarHBondContact O-N 2.99Å; E319-K322 PolarHBondContact O-N 2.74Å; K322-Q325 PolarHBondContact O-N 2.82Å; K322-S326 WeakPolarHBondContact O-CB 3.47Å; K322-S326 PolarHBondContact O-N 3.34Å
323	K	94.2	Very high	91.9	Very high	104 Å²	104	71.9 Å²	71.9	45%	0.452	35%	0.345	S	S	.	.	H	α-helix	trans	-63.9	-43.2	173.7	-72.3	167.8	-178.7	168.4	0	111.6	E319 A320 S326 I327	E319-K323 VanDerWaalsContact CD-NZ 3.32Å; E319-K323 WeakPolarHBondContact O-CG 3.45Å; E319-K323 PolarHBondContact O-N 3.07Å; E319-K323 WeakPolarHBondContact OE1-CE 3.28Å; E319-K323 IonicContact OE1-NZ 2.82Å; E319-K323 PolarHBondContact OE1-NZ 3.09Å; E319-K323 IonicContact OE2-NZ 2.73Å; A320-K323 WeakPolarHBondContact O-CB 3.49Å; A320-K323 PolarHBondContact O-N 2.87Å; A320-K323 VanDerWaalsContact O-N 3.16Å; K323-S326 PolarHBondContact O-N 3.39Å; K323-I327 WeakPolarHBondContact O-CD1 3.42Å; K323-I327 VanDerWaalsContact O-CG1 3.27Å; K323-I327 WeakPolarHBondContact O-CG1 3.33Å; K323-I327 PolarHBondContact O-N 2.85Å
324	V	94.6	Very high	91.9	Very high	19 Å²	19	71.5 Å²	71.5	12%	0.115	34%	0.343	C	S	.	.	H	α-helix	trans	-56.4	-49.9	171.7	168	0	0	0	0	111.2	A320 K321 S326 I327 Q328 L420 A423	A320-V324 PolarHBondContact O-N 3.17Å; K321-V324 WeakPolarHBondContact O-CB 3.45Å; K321-V324 PolarHBondContact O-N 3.38Å; V324-S326 PolarHBondContact O-N 3.41Å; V324-I327 PolarHBondContact O-N 3.42Å; V324-Q328 WeakPolarHBondContact O-CB 3.44Å; V324-Q328 VanDerWaalsContact O-CG 3.28Å; V324-Q328 WeakPolarHBondContact O-CG 3.45Å; V324-Q328 PolarHBondContact O-N 2.88Å; V324-L420 HydrophobicContact CB-CD1 4.48Å; V324-L420 HydrophobicContact CG1-CD1 3.89Å; V324-A423 HydrophobicContact CG2-CB 3.67Å
325	Q	94.1	Very high	91.3	Very high	109 Å²	109	71.3 Å²	71.3	51%	0.509	34%	0.342	S	S	.	.	H	α-helix	trans	-62.6	-39.8	178.4	-72.1	175.4	-35.7	0	0	112.9	K321 K322 Q328 H329	K321-Q325 WeakPolarHBondContact O-CG 3.4Å; K321-Q325 PolarHBondContact O-N 2.87Å; K322-Q325 PolarHBondContact O-N 2.82Å; Q325-Q328 PolarHBondContact O-N 2.97Å; Q325-H329 WeakPolarHBondContact O-CB 3.25Å; Q325-H329 PolarHBondContact O-N 3.27Å
326	S	96.4	Very high	90.3	Very high	61 Å²	61	67.9 Å²	67.9	43%	0.427	34%	0.343	S	S	.	.	H	α-helix	trans	-63.3	-45.3	176.6	-175.5	0	0	0	0	112	K322 K323 V324 Q328 H329 Q330	K322-S326 WeakPolarHBondContact O-CB 3.47Å; K322-S326 PolarHBondContact O-N 3.34Å; K323-S326 PolarHBondContact O-N 3.39Å; V324-S326 PolarHBondContact O-N 3.41Å; S326-Q328 PolarHBondContact O-N 2.92Å; S326-H329 PolarHBondContact O-N 2.8Å; S326-Q330 WeakPolarHBondContact O-CG 3.24Å; S326-Q330 PolarHBondContact O-N 3.01Å
327	I	95.2	Very high	89.3	Confident	17 Å²	17	68.4 Å²	68.4	9%	0.087	35%	0.345	C	S	.	.	H	α-helix	trans	-67.2	-37.6	177.1	-62.6	159.3	0	0	0	110.9	K323 V324 H329 Q330 L331 L416 Q419 L420 A423	K323-I327 WeakPolarHBondContact O-CD1 3.42Å; K323-I327 VanDerWaalsContact O-CG1 3.27Å; K323-I327 WeakPolarHBondContact O-CG1 3.33Å; K323-I327 PolarHBondContact O-N 2.85Å; V324-I327 PolarHBondContact O-N 3.42Å; I327-H329 VanDerWaalsContact C-N 3.35Å; I327-Q330 PolarHBondContact O-N 3.5Å; I327-L331 HydrophobicContact CG2-CD1 4.19Å; I327-L331 WeakPolarHBondContact O-CB 3.48Å; I327-L331 WeakPolarHBondContact O-CG 3.35Å; I327-L331 PolarHBondContact O-N 3.34Å; I327-L416 HydrophobicContact CG2-CB 4.18Å; I327-L416 HydrophobicContact CG2-CD2 4.27Å; I327-L416 VanDerWaalsContact CG2-O 3.31Å; I327-L416 WeakPolarHBondContact CG2-O 3.49Å; I327-Q419 HydrophobicContact CD1-CB 3.93Å; I327-L420 HydrophobicContact CB-CD1 4.47Å; I327-L420 HydrophobicContact CG2-CB 3.78Å; I327-L420 HydrophobicContact CG2-CD1 4.36Å; I327-A423 HydrophobicContact CD1-CB 3.98Å
328	Q	93.5	Very high	87.9	Confident	100 Å²	100	68.4 Å²	68.4	47%	0.467	35%	0.352	S	S	.	.	H	α-helix	trans	-61.9	-40.9	172.6	-75.3	171.1	-21.8	0	0	112.1	V324 Q325 S326 L331 A332 L420	V324-Q328 WeakPolarHBondContact O-CB 3.44Å; V324-Q328 VanDerWaalsContact O-CG 3.28Å; V324-Q328 WeakPolarHBondContact O-CG 3.45Å; V324-Q328 PolarHBondContact O-N 2.88Å; Q325-Q328 PolarHBondContact O-N 2.97Å; S326-Q328 PolarHBondContact O-N 2.92Å; Q328-L331 PolarHBondContact O-N 3.32Å; Q328-A332 WeakPolarHBondContact O-CB 3.27Å; Q328-A332 PolarHBondContact O-N 2.8Å; Q328-L420 HydrophobicContact CG-CD1 3.85Å; Q328-L420 HydrophobicContact CG-CD2 4.32Å
329	H	91.5	Very high	86	Confident	130 Å²	130	69.6 Å²	69.6	60%	0.602	35%	0.354	S	S	*	.	H	α-helix	trans	-66.3	-41.5	174.8	-178.4	62.5	0	0	0	112.1	Q325 S326 I327 L331 A332 Q333	Q325-H329 WeakPolarHBondContact O-CB 3.25Å; Q325-H329 PolarHBondContact O-N 3.27Å; S326-H329 PolarHBondContact O-N 2.8Å; I327-H329 VanDerWaalsContact C-N 3.35Å; H329-L331 VanDerWaalsContact C-N 3.32Å; H329-L331 PolarHBondContact O-N 3.25Å; H329-A332 PolarHBondContact O-N 3.13Å; H329-Q333 WeakPolarHBondContact O-CB 3.45Å; H329-Q333 PolarHBondContact O-N 3.4Å
330	Q	93.3	Very high	84.2	Confident	82 Å²	82	69.4 Å²	69.4	38%	0.383	36%	0.36	S	S	.	.	H	α-helix	trans	-64.5	-33.9	174.9	-71.3	174.9	-14.3	0	0	113	S326 I327 L334 L416	S326-Q330 WeakPolarHBondContact O-CG 3.24Å; S326-Q330 PolarHBondContact O-N 3.01Å; I327-Q330 PolarHBondContact O-N 3.5Å; Q330-L334 PolarHBondContact O-N 2.78Å; Q330-L416 HydrophobicContact CB-CD1 3.84Å; Q330-L416 HydrophobicContact CB-CD2 4.3Å; Q330-L416 VanDerWaalsContact OE1-CD2 3.32Å
331	L	91.3	Very high	82.5	Confident	14 Å²	14	71.6 Å²	71.6	7%	0.073	38%	0.383	C	S	.	.	H	α-helix	trans	-69.3	-42.8	171.3	-77.2	164.9	0	0	0	111.8	I327 Q328 H329 Q333 L334 D335 R413 L416 L417 L420	I327-L331 HydrophobicContact CG2-CD1 4.19Å; I327-L331 WeakPolarHBondContact O-CB 3.48Å; I327-L331 WeakPolarHBondContact O-CG 3.35Å; I327-L331 PolarHBondContact O-N 3.34Å; Q328-L331 PolarHBondContact O-N 3.32Å; H329-L331 VanDerWaalsContact C-N 3.32Å; H329-L331 PolarHBondContact O-N 3.25Å; L331-Q333 VanDerWaalsContact C-N 3.33Å; L331-Q333 PolarHBondContact O-N 3.01Å; L331-L334 PolarHBondContact O-N 2.86Å; L331-D335 WeakPolarHBondContact O-CB 3.26Å; L331-D335 VanDerWaalsContact O-CG 3.28Å; L331-D335 PolarHBondContact O-N 2.91Å; L331-R413 HydrophobicContact CD2-CG 3.98Å; L331-L416 HydrophobicContact CD1-CB 4.35Å; L331-L416 HydrophobicContact CD2-CB 3.67Å; L331-L416 HydrophobicContact CD2-CD1 4.16Å; L331-L416 HydrophobicContact CG-CB 3.84Å; L331-L416 HydrophobicContact CG-CD1 4.19Å; L331-L417 HydrophobicContact CD1-CD2 3.96Å; L331-L417 HydrophobicContact CD2-CD2 4.3Å; L331-L417 HydrophobicContact CD2-CG 4.16Å; L331-L420 HydrophobicContact CD1-CD2 3.82Å
332	A	86.1	Confident	80.5	Confident	59 Å²	59	78.1 Å²	78.1	49%	0.488	41%	0.406	S	S	.	.	H	α-helix	trans	-64.4	-37.5	175.5	0	0	0	0	0	112.3	Q328 H329 D335 S336	Q328-A332 WeakPolarHBondContact O-CB 3.27Å; Q328-A332 PolarHBondContact O-N 2.8Å; H329-A332 PolarHBondContact O-N 3.13Å; A332-D335 PolarHBondContact O-N 3.11Å; A332-S336 PolarHBondContact O-N 2.72Å
333	Q	86.6	Confident	78.7	Confident	89 Å²	89	72.5 Å²	72.5	42%	0.416	39%	0.385	S	S	.	.	H	α-helix	trans	-62.9	-49.1	172.7	-175.1	-174	-21.7	0	0	110.7	H329 L331 D335 S336 E337	H329-Q333 WeakPolarHBondContact O-CB 3.45Å; H329-Q333 PolarHBondContact O-N 3.4Å; L331-Q333 VanDerWaalsContact C-N 3.33Å; L331-Q333 PolarHBondContact O-N 3.01Å; Q333-D335 VanDerWaalsContact C-N 3.26Å; Q333-D335 PolarHBondContact O-N 3.4Å; Q333-S336 CarbonylContact O-C 3.43Å; Q333-S336 PolarHBondContact O-N 2.88Å; Q333-S336 PolarHBondContact O-OG 3.28Å; Q333-E337 WeakPolarHBondContact CG-OE1 3.29Å; Q333-E337 PolarHBondContact NE2-OE1 3.25Å; Q333-E337 WeakPolarHBondContact O-CG 3.1Å; Q333-E337 PolarHBondContact O-N 3.01Å
334	L	84.8	Confident	77.3	Confident	6 Å²	6	69.7 Å²	69.7	3%	0.031	37%	0.374	C	S	.	.	H	α-helix	trans	-56.1	-41.4	174.1	-86.9	-175.3	0	0	0	112.8	Q330 L331 S336 E337 S338 K412 R413 L416	Q330-L334 PolarHBondContact O-N 2.78Å; L331-L334 PolarHBondContact O-N 2.86Å; L334-S336 PolarHBondContact O-N 3.1Å; L334-E337 CarbonylContact O-C 3.53Å; L334-E337 PolarHBondContact O-N 2.87Å; L334-E337 VanDerWaalsContact O-N 3.14Å; L334-S338 WeakPolarHBondContact O-CB 3.46Å; L334-S338 PolarHBondContact O-N 3.07Å; L334-S338 PolarHBondContact O-OG 3.04Å; L334-K412 HydrophobicContact CD1-CB 4.27Å; L334-K412 HydrophobicContact CD1-CD 4.18Å; L334-K412 HydrophobicContact CD1-CG 3.97Å; L334-K412 HydrophobicContact CD2-CD 3.87Å; L334-K412 VanDerWaalsContact CD2-NZ 3.31Å; L334-K412 HydrophobicContact CG-CD 4.45Å; L334-R413 HydrophobicContact CD1-CB 4.14Å; L334-L416 HydrophobicContact CD1-CD1 3.7Å; L334-L416 HydrophobicContact CG-CD1 4.48Å
335	D	77.9	Confident	75.9	Confident	76 Å²	76	71.6 Å²	71.6	41%	0.406	39%	0.391	S	S	.	.	H	α-helix	trans	-74	-13.7	-179.1	-69	1.4	0	0	0	112.5	L331 A332 Q333 R413	L331-D335 WeakPolarHBondContact O-CB 3.26Å; L331-D335 VanDerWaalsContact O-CG 3.28Å; L331-D335 PolarHBondContact O-N 2.91Å; A332-D335 PolarHBondContact O-N 3.11Å; Q333-D335 VanDerWaalsContact C-N 3.26Å; Q333-D335 PolarHBondContact O-N 3.4Å; D335-R413 IonicContact OD1-CZ 3.88Å; D335-R413 IonicContact OD1-NH1 3.68Å; D335-R413 PolarHBondContact OD1-NH1 2.92Å; D335-R413 IonicContact OD2-CZ 2.72Å; D335-R413 IonicContact OD2-NH1 3.87Å; D335-R413 PolarHBondContact OD2-NH1 2.99Å; D335-R413 IonicContact OD2-NH2 3.35Å
336	S	71.6	Confident	74.5	Confident	90 Å²	90	69.8 Å²	69.8	63%	0.629	39%	0.385	S	S	*	.	H	α-helix	trans	-89.8	-27.3	166.1	72.5	0	0	0	0	113.6	A332 Q333 L334	A332-S336 PolarHBondContact O-N 2.72Å; Q333-S336 CarbonylContact O-C 3.43Å; Q333-S336 PolarHBondContact O-N 2.88Å; Q333-S336 PolarHBondContact O-OG 3.28Å; L334-S336 PolarHBondContact O-N 3.1Å
337	E	70	Confident	73.3	Confident	83 Å²	83	70.2 Å²	70.2	39%	0.388	38%	0.377	S	S	.	.	H	α-helix	trans	-75.9	-32.2	172.2	-71.2	170.8	-169.5	0	0	111.7	Q333 L334 K412	Q333-E337 WeakPolarHBondContact CG-OE1 3.29Å; Q333-E337 PolarHBondContact NE2-OE1 3.25Å; Q333-E337 WeakPolarHBondContact O-CG 3.1Å; Q333-E337 PolarHBondContact O-N 3.01Å; L334-E337 CarbonylContact O-C 3.53Å; L334-E337 PolarHBondContact O-N 2.87Å; L334-E337 VanDerWaalsContact O-N 3.14Å; E337-K412 IonicContact OE2-NZ 3.58Å
338	S	63.7	Low	72.4	Confident	47 Å²	47	71.7 Å²	71.7	33%	0.329	39%	0.385	S	S	.	.	S	Bend	trans	-88.5	106.3	175.2	69.3	0	0	0	0	110.9	L334	L334-S338 WeakPolarHBondContact O-CB 3.46Å; L334-S338 PolarHBondContact O-N 3.07Å; L334-S338 PolarHBondContact O-OG 3.04Å
339	W	52.7	Low	71.9	Confident	90 Å²	90	73 Å²	73	34%	0.341	39%	0.386	S	S	.	.			trans	-56.9	150.8	173.6	-88.6	89.6	0	0	0	112.4	E107 G341 E344	E107-W339 HydrophobicContact CB-CH2 3.52Å; E107-W339 HydrophobicContact CB-CZ2 3.85Å; E107-W339 VanDerWaalsContact CD-CZ2 3.46Å; E107-W339 HydrophobicContact CG-CH2 4.03Å; E107-W339 HydrophobicContact CG-CZ2 3.94Å; E107-W339 VanDerWaalsContact OE2-CH2 3.22Å; E107-W339 WeakPolarHBondContact OE2-CH2 3.46Å; E107-W339 WeakPolarHBondContact OE2-CZ2 3.48Å; W339-G341 PolarHBondContact O-N 2.73Å; W339-E344 HydrophobicContact CB-CG 4.03Å
340	S	54.1	Low	71.5	Confident	66 Å²	66	67.4 Å²	67.4	46%	0.462	36%	0.361	S	S	.	.			trans	-61.2	110.8	-177	81.6	0	0	0	0	110.4	R342 A343	S340-R342 PolarHBondContact O-N 3.34Å; S340-A343 PolarHBondContact O-N 3.03Å
341	G	55.8	Low	71.2	Confident	51 Å²	51	67 Å²	67	53%	0.526	36%	0.358	S	S	.	.	H	α-helix	trans	-62	-3.5	-165.4	0	0	0	0	0	116.2	W339 A345	W339-G341 PolarHBondContact O-N 2.73Å; G341-A345 WeakPolarHBondContact O-CB 3.43Å; G341-A345 PolarHBondContact O-N 2.67Å
342	R	50.6	Low	71	Confident	209 Å²	209	68.8 Å²	68.8	79%	0.789	37%	0.367	S	S	*	.	H	α-helix	trans	-73.6	-47.7	170	-165.5	180	-64.7	-109.9	2.5	111.2	S340 E344 A345 D346	S340-R342 PolarHBondContact O-N 3.34Å; R342-E344 VanDerWaalsContact C-N 3.3Å; R342-E344 PolarHBondContact O-N 3.2Å; R342-A345 PolarHBondContact O-N 3.44Å; R342-D346 PolarHBondContact O-N 2.99Å
343	A	55.5	Low	71.2	Confident	21 Å²	21	69.3 Å²	69.3	17%	0.174	36%	0.36	C	S	.	.	H	α-helix	trans	-68.1	-31.9	176.2	0	0	0	0	0	111.9	S340 R347	S340-A343 PolarHBondContact O-N 3.03Å; A343-R347 PolarHBondContact O-N 3.07Å
344	E	63.5	Low	71.5	Confident	45 Å²	45	65.5 Å²	65.5	21%	0.21	34%	0.342	C	S	.	.	H	α-helix	trans	-68.6	-43.6	170.5	-59.2	-153.6	138.3	0	0	112.4	W339 R342 D346 R347 D348	W339-E344 HydrophobicContact CB-CG 4.03Å; R342-E344 VanDerWaalsContact C-N 3.3Å; R342-E344 PolarHBondContact O-N 3.2Å; E344-D346 VanDerWaalsContact C-N 3.26Å; E344-D346 PolarHBondContact O-N 3Å; E344-R347 PolarHBondContact O-N 2.9Å; E344-R347 VanDerWaalsContact O-N 3.09Å; E344-R347 IonicContact OE1-NH2 2.74Å; E344-D348 WeakPolarHBondContact O-CB 3.27Å; E344-D348 PolarHBondContact O-N 3.38Å
345	A	64.6	Low	71.9	Confident	58 Å²	58	65.4 Å²	65.4	48%	0.479	34%	0.342	S	S	.	.	H	α-helix	trans	-61.7	-33.5	176.4	0	0	0	0	0	112.8	G341 R342 R349	G341-A345 WeakPolarHBondContact O-CB 3.43Å; G341-A345 PolarHBondContact O-N 2.67Å; R342-A345 PolarHBondContact O-N 3.44Å; A345-R349 VanDerWaalsContact O-CB 3.28Å; A345-R349 WeakPolarHBondContact O-CB 3.41Å; A345-R349 PolarHBondContact O-N 2.82Å
346	D	64.9	Low	72.7	Confident	72 Å²	72	69.4 Å²	69.4	39%	0.385	35%	0.351	S	S	.	.	H	α-helix	trans	-66.4	-41.9	171.6	-79.9	-55	0	0	0	112.3	R342 E344 R349 D350	R342-D346 PolarHBondContact O-N 2.99Å; E344-D346 VanDerWaalsContact C-N 3.26Å; E344-D346 PolarHBondContact O-N 3Å; D346-R349 IonicContact OD1-CZ 3.9Å; D346-R349 IonicContact OD1-NH1 3.89Å; D346-R349 PolarHBondContact OD1-NH1 3.09Å; D346-R349 IonicContact OD1-NH2 3.05Å; D346-R349 PolarHBondContact OD1-NH2 2.75Å; D346-D350 PolarHBondContact O-N 2.84Å; D346-D350 VanDerWaalsContact O-N 3.15Å
347	R	71.9	Confident	73.8	Confident	69 Å²	69	66.2 Å²	66.2	26%	0.26	33%	0.326	S	S	.	.	H	α-helix	trans	-64.4	-51.6	172.7	-75.5	-164.8	-70.7	-177.7	1.1	112.2	V111 E114 A343 E344 R349 D350 F351	V111-R347 HydrophobicContact CG1-CG 4Å; E114-R347 IonicContact OE1-NH1 3.45Å; E114-R347 WeakPolarHBondContact OE2-CD 3.4Å; E114-R347 IonicContact OE2-CZ 2.87Å; E114-R347 IonicContact OE2-NE 2.94Å; E114-R347 IonicContact OE2-NH1 2.69Å; E114-R347 PolarHBondContact OE2-NH1 2.86Å; A343-R347 PolarHBondContact O-N 3.07Å; E344-R347 PolarHBondContact O-N 2.9Å; E344-R347 VanDerWaalsContact O-N 3.09Å; E344-R347 IonicContact OE1-NH2 2.74Å; R347-R349 VanDerWaalsContact C-N 3.26Å; R347-R349 PolarHBondContact O-N 3.25Å; R347-D350 PolarHBondContact O-N 3.5Å; R347-F351 VanDerWaalsContact O-CB 3.26Å; R347-F351 WeakPolarHBondContact O-CB 3.33Å; R347-F351 PolarHBondContact O-N 3.01Å
348	D	77	Confident	74.9	Confident	48 Å²	48	63.2 Å²	63.2	26%	0.257	31%	0.312	S	S	.	.	H	α-helix	trans	-57	-38.3	178.7	-92.2	45.3	0	0	0	111.5	E344 L352 R406	E344-D348 WeakPolarHBondContact O-CB 3.27Å; E344-D348 PolarHBondContact O-N 3.38Å; D348-L352 WeakPolarHBondContact O-CB 3.38Å; D348-L352 VanDerWaalsContact O-CG 3.26Å; D348-L352 WeakPolarHBondContact O-CG 3.48Å; D348-L352 PolarHBondContact O-N 2.86Å; D348-R406 VanDerWaalsContact CG-NH1 3.33Å; D348-R406 IonicContact OD1-CZ 2.76Å; D348-R406 IonicContact OD1-NH1 3.96Å; D348-R406 PolarHBondContact OD1-NH1 3.47Å; D348-R406 IonicContact OD1-NH2 3.6Å; D348-R406 IonicContact OD2-CZ 3.74Å; D348-R406 IonicContact OD2-NH1 3.55Å; D348-R406 PolarHBondContact OD2-NH1 2.95Å; D348-R406 IonicContact OD2-NH2 3.14Å; D348-R406 PolarHBondContact OD2-NH2 3.16Å
349	R	83.1	Confident	76.4	Confident	129 Å²	129	63.7 Å²	63.7	49%	0.487	31%	0.309	S	S	.	.	H	α-helix	trans	-67.6	-51.7	176.1	-178.2	-163.1	60.7	-119	-15.6	112.1	A345 D346 R347 F351 L352 Q353	A345-R349 VanDerWaalsContact O-CB 3.28Å; A345-R349 WeakPolarHBondContact O-CB 3.41Å; A345-R349 PolarHBondContact O-N 2.82Å; D346-R349 IonicContact OD1-CZ 3.9Å; D346-R349 IonicContact OD1-NH1 3.89Å; D346-R349 PolarHBondContact OD1-NH1 3.09Å; D346-R349 IonicContact OD1-NH2 3.05Å; D346-R349 PolarHBondContact OD1-NH2 2.75Å; R347-R349 VanDerWaalsContact C-N 3.26Å; R347-R349 PolarHBondContact O-N 3.25Å; R349-F351 VanDerWaalsContact C-N 3.27Å; R349-F351 PolarHBondContact O-N 2.97Å; R349-L352 PolarHBondContact O-N 2.88Å; R349-Q353 PolarHBondContact O-N 2.85Å
350	D	82.8	Confident	78.4	Confident	11 Å²	11	60.3 Å²	60.3	6%	0.059	30%	0.3	C	S	.	.	H	α-helix	trans	-65.4	-34.6	-178	-80.6	37.9	0	0	0	110.5	K119 K196 D346 R347 Q353 L354	K119-D350 WeakPolarHBondContact CE-OD2 3.43Å; K196-D350 IonicContact NZ-OD2 2.79Å; K196-D350 PolarHBondContact NZ-OD2 3.32Å; D346-D350 PolarHBondContact O-N 2.84Å; D346-D350 VanDerWaalsContact O-N 3.15Å; R347-D350 PolarHBondContact O-N 3.5Å; D350-Q353 PolarHBondContact O-N 2.91Å; D350-L354 WeakPolarHBondContact O-CB 3.42Å; D350-L354 PolarHBondContact O-N 2.89Å
351	F	86.4	Confident	80.3	Confident	74 Å²	74	57.4 Å²	57.4	33%	0.325	28%	0.28	S	S	.	.	H	α-helix	trans	-65.5	-45.4	170.2	-179.6	-93.3	0	0	0	112.9	R347 R349 Q353 L354 L355 A395 Q399	R347-F351 VanDerWaalsContact O-CB 3.26Å; R347-F351 WeakPolarHBondContact O-CB 3.33Å; R347-F351 PolarHBondContact O-N 3.01Å; R349-F351 VanDerWaalsContact C-N 3.27Å; R349-F351 PolarHBondContact O-N 2.97Å; F351-Q353 VanDerWaalsContact C-N 3.31Å; F351-Q353 PolarHBondContact O-N 3.37Å; F351-L354 WeakPolarHBondContact O-CB 3.31Å; F351-L354 PolarHBondContact O-N 2.83Å; F351-L355 HydrophobicContact CE1-CD2 4.42Å; F351-L355 WeakPolarHBondContact O-CB 3.36Å; F351-L355 PolarHBondContact O-N 2.76Å; F351-A395 HydrophobicContact CE1-CB 4.49Å; F351-A395 HydrophobicContact CZ-CB 3.82Å; F351-Q399 HydrophobicContact CE1-CB 4.34Å
352	L	87.9	Confident	82.2	Confident	52 Å²	52	55.9 Å²	55.9	27%	0.272	26%	0.259	S	S	.	.	H	α-helix	trans	-63	-35.9	174.7	-85.8	168.3	0	0	0	112.6	D348 R349 R356 Q399	D348-L352 WeakPolarHBondContact O-CB 3.38Å; D348-L352 VanDerWaalsContact O-CG 3.26Å; D348-L352 WeakPolarHBondContact O-CG 3.48Å; D348-L352 PolarHBondContact O-N 2.86Å; R349-L352 PolarHBondContact O-N 2.88Å; L352-R356 VanDerWaalsContact O-CG 3.29Å; L352-R356 WeakPolarHBondContact O-CG 3.5Å; L352-R356 PolarHBondContact O-N 2.82Å; L352-R356 VanDerWaalsContact O-N 3.1Å; L352-Q399 VanDerWaalsContact CD2-NE2 3.31Å
353	Q	90.6	Very high	84.2	Confident	70 Å²	70	52 Å²	52	33%	0.327	25%	0.25	S	C	.	.	H	α-helix	trans	-65.6	-45.6	173.9	-171.6	179	13.1	0	0	110.4	M122 R349 D350 F351 L355 R356 E357	M122-Q353 HydrophobicContact CE-CB 3.78Å; M122-Q353 HydrophobicContact CE-CG 3.62Å; M122-Q353 HydrophobicContact SD-CG 4.08Å; R349-Q353 PolarHBondContact O-N 2.85Å; D350-Q353 PolarHBondContact O-N 2.91Å; F351-Q353 VanDerWaalsContact C-N 3.31Å; F351-Q353 PolarHBondContact O-N 3.37Å; Q353-L355 PolarHBondContact O-N 2.65Å; Q353-R356 PolarHBondContact O-N 3.22Å; Q353-E357 WeakPolarHBondContact O-CG 3.41Å; Q353-E357 PolarHBondContact O-N 2.61Å; Q353-E357 VanDerWaalsContact O-N 3.12Å
354	L	92.6	Very high	85.9	Confident	8 Å²	8	51.8 Å²	51.8	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-59.3	-44.3	175.2	177	62.5	0	0	0	112.2	A118 E121 M122 I125 D350 F351 R356 E357 K358	A118-L354 HydrophobicContact CB-CD2 3.99Å; E121-L354 HydrophobicContact CB-CD1 3.73Å; E121-L354 HydrophobicContact CB-CD2 4.24Å; M122-L354 HydrophobicContact CB-CD1 4.1Å; M122-L354 HydrophobicContact CE-CB 4.34Å; I125-L354 HydrophobicContact CD1-CD1 3.43Å; I125-L354 VanDerWaalsContact CD1-CD1 3.43Å; D350-L354 WeakPolarHBondContact O-CB 3.42Å; D350-L354 PolarHBondContact O-N 2.89Å; F351-L354 WeakPolarHBondContact O-CB 3.31Å; F351-L354 PolarHBondContact O-N 2.83Å; L354-R356 PolarHBondContact O-N 3.37Å; L354-E357 PolarHBondContact O-N 3.09Å; L354-K358 WeakPolarHBondContact O-CG 3.46Å; L354-K358 PolarHBondContact O-N 3.16Å
355	L	93.2	Very high	87.2	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.026	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-45.1	178.4	-176.3	54	0	0	0	111.8	F351 Q353 E357 K358 E359 V392 A395	F351-L355 HydrophobicContact CE1-CD2 4.42Å; F351-L355 WeakPolarHBondContact O-CB 3.36Å; F351-L355 PolarHBondContact O-N 2.76Å; Q353-L355 PolarHBondContact O-N 2.65Å; L355-E357 VanDerWaalsContact C-N 3.3Å; L355-E357 PolarHBondContact O-N 3.15Å; L355-K358 WeakPolarHBondContact O-CB 3.3Å; L355-K358 PolarHBondContact O-N 2.79Å; L355-K358 VanDerWaalsContact O-N 3.17Å; L355-E359 WeakPolarHBondContact O-CG 3.47Å; L355-E359 PolarHBondContact O-N 3.28Å; L355-V392 HydrophobicContact CD1-CB 4.39Å; L355-V392 HydrophobicContact CD1-CG1 4.09Å; L355-V392 HydrophobicContact CD1-CG2 4.26Å; L355-A395 HydrophobicContact CD1-CB 3.72Å; L355-A395 HydrophobicContact CD2-CB 4.41Å
356	R	93.6	Very high	88.4	Confident	159 Å²	159	49.7 Å²	49.7	60%	0.6	23%	0.227	S	C	*	.	H	α-helix	trans	-62.2	-34.8	175.1	-70	169.3	-170.8	170.8	4.8	113.1	L352 Q353 L354 A360	L352-R356 VanDerWaalsContact O-CG 3.29Å; L352-R356 WeakPolarHBondContact O-CG 3.5Å; L352-R356 PolarHBondContact O-N 2.82Å; L352-R356 VanDerWaalsContact O-N 3.1Å; Q353-R356 PolarHBondContact O-N 3.22Å; L354-R356 PolarHBondContact O-N 3.37Å; R356-A360 VanDerWaalsContact O-CB 3.29Å; R356-A360 WeakPolarHBondContact O-CB 3.22Å; R356-A360 PolarHBondContact O-N 2.96Å
357	E	94.9	Very high	89.5	Confident	24 Å²	24	51.5 Å²	51.5	11%	0.112	24%	0.236	C	C	.	.	H	α-helix	trans	-70.6	-38.6	174.6	-66.2	-68.5	151.5	0	0	111.6	M122 I125 K126 R129 Q353 L354 L355 A360 L361	M122-E357 HydrophobicContact CG-CG 4.28Å; I125-E357 HydrophobicContact CG2-CB 3.86Å; I125-E357 WeakPolarHBondContact CG2-O 3.47Å; K126-E357 WeakPolarHBondContact CG-OE2 3.49Å; K126-E357 IonicContact NZ-OE1 3.85Å; K126-E357 PolarHBondContact NZ-OE1 3.31Å; K126-E357 IonicContact NZ-OE2 2.69Å; K126-E357 PolarHBondContact NZ-OE2 3.02Å; R129-E357 IonicContact CZ-OE2 2.85Å; R129-E357 IonicContact NH1-OE1 2.65Å; R129-E357 IonicContact NH1-OE2 2.7Å; R129-E357 PolarHBondContact NH1-OE2 3.05Å; Q353-E357 WeakPolarHBondContact O-CG 3.41Å; Q353-E357 PolarHBondContact O-N 2.61Å; Q353-E357 VanDerWaalsContact O-N 3.12Å; L354-E357 PolarHBondContact O-N 3.09Å; L355-E357 VanDerWaalsContact C-N 3.3Å; L355-E357 PolarHBondContact O-N 3.15Å; E357-A360 PolarHBondContact O-N 2.79Å; E357-L361 WeakPolarHBondContact O-CB 3.36Å; E357-L361 PolarHBondContact O-N 3.43Å
358	K	94.6	Very high	90.1	Very high	19 Å²	19	49 Å²	49	8%	0.083	23%	0.228	C	C	.	.	H	α-helix	trans	-63	-44.8	172	-70.1	-176.4	-178	177.2	0	111.4	E121 I125 L354 L355 A360 L361 L362 L388 E391 V392	E121-K358 WeakPolarHBondContact OE2-CE 3.44Å; E121-K358 IonicContact OE2-NZ 3.12Å; E121-K358 PolarHBondContact OE2-NZ 3.32Å; I125-K358 HydrophobicContact CD1-CD 4.18Å; I125-K358 HydrophobicContact CD1-CG 3.43Å; I125-K358 VanDerWaalsContact CD1-CG 3.43Å; I125-K358 HydrophobicContact CG1-CG 4.35Å; L354-K358 WeakPolarHBondContact O-CG 3.46Å; L354-K358 PolarHBondContact O-N 3.16Å; L355-K358 WeakPolarHBondContact O-CB 3.3Å; L355-K358 PolarHBondContact O-N 2.79Å; L355-K358 VanDerWaalsContact O-N 3.17Å; K358-A360 PolarHBondContact O-N 3.44Å; K358-L361 PolarHBondContact O-N 2.99Å; K358-L362 WeakPolarHBondContact O-CB 3.21Å; K358-L362 PolarHBondContact O-N 2.87Å; K358-L388 HydrophobicContact CB-CD1 3.98Å; K358-L388 HydrophobicContact CD-CD1 4.38Å; K358-L388 HydrophobicContact CG-CD1 4.11Å; K358-E391 IonicContact NZ-OE1 2.75Å; K358-E391 PolarHBondContact NZ-OE1 3.35Å; K358-V392 HydrophobicContact CB-CG2 3.75Å
359	E	94.9	Very high	90.4	Very high	57 Å²	57	47.5 Å²	47.5	27%	0.266	22%	0.222	S	C	.	.	H	α-helix	trans	-60.5	-42.7	173.8	-72.5	172.2	160.9	0	0	112.4	L355 L362 Q363 V392 H396	L355-E359 WeakPolarHBondContact O-CG 3.47Å; L355-E359 PolarHBondContact O-N 3.28Å; E359-L362 WeakPolarHBondContact O-CB 3.37Å; E359-L362 PolarHBondContact O-N 3.31Å; E359-Q363 WeakPolarHBondContact O-CG 3.35Å; E359-Q363 PolarHBondContact O-N 3.01Å; E359-V392 HydrophobicContact CG-CG1 3.85Å; E359-V392 HydrophobicContact CG-CG2 4.42Å; E359-H396 IonicContact OE1-CD2 2.7Å; E359-H396 IonicContact OE1-CE1 3.9Å; E359-H396 PolarHBondContact OE1-CE1 2.68Å; E359-H396 IonicContact OE1-NE2 3.24Å; E359-H396 PolarHBondContact OE1-NE2 3.27Å
360	A	93.7	Very high	90.3	Very high	20 Å²	20	48.7 Å²	48.7	17%	0.165	23%	0.23	C	C	.	.	H	α-helix	trans	-69	-38.9	178.5	0	0	0	0	0	112.3	R129 R356 E357 K358 Q363 E364	R129-A360 VanDerWaalsContact CZ-CB 3.48Å; R356-A360 VanDerWaalsContact O-CB 3.29Å; R356-A360 WeakPolarHBondContact O-CB 3.22Å; R356-A360 PolarHBondContact O-N 2.96Å; E357-A360 PolarHBondContact O-N 2.79Å; K358-A360 PolarHBondContact O-N 3.44Å; A360-Q363 PolarHBondContact O-N 3.22Å; A360-E364 VanDerWaalsContact O-CG 3.29Å; A360-E364 WeakPolarHBondContact O-CG 3.36Å; A360-E364 PolarHBondContact O-N 3.35Å
361	L	94.4	Very high	90.1	Very high	5 Å²	5	51.1 Å²	51.1	3%	0.026	24%	0.242	C	C	.	.	H	α-helix	trans	-62.3	-42.3	170.3	174.4	61.9	0	0	0	111.4	I125 Q128 R129 L132 E357 K358 Q363 E364 L365 L388	I125-L361 HydrophobicContact CG1-CD2 4.49Å; I125-L361 HydrophobicContact CG2-CB 4.01Å; I125-L361 HydrophobicContact CG2-CD2 4.04Å; Q128-L361 HydrophobicContact CB-CD1 4.23Å; Q128-L361 HydrophobicContact CB-CD2 4.33Å; Q128-L361 VanDerWaalsContact OE1-CD2 3.23Å; R129-L361 HydrophobicContact CG-CB 3.82Å; R129-L361 HydrophobicContact CG-CD1 3.78Å; R129-L361 HydrophobicContact CG-CG 4.35Å; L132-L361 HydrophobicContact CD1-CD1 3.56Å; E357-L361 WeakPolarHBondContact O-CB 3.36Å; E357-L361 PolarHBondContact O-N 3.43Å; K358-L361 PolarHBondContact O-N 2.99Å; L361-Q363 PolarHBondContact O-N 3.45Å; L361-E364 PolarHBondContact O-N 3.16Å; L361-L365 HydrophobicContact CD1-CD1 4.31Å; L361-L365 HydrophobicContact CD1-CG 4.22Å; L361-L365 HydrophobicContact CG-CD1 4.15Å; L361-L365 HydrophobicContact CG-CG 4.49Å; L361-L365 WeakPolarHBondContact O-CG 3.49Å; L361-L365 PolarHBondContact O-N 3.5Å; L361-L388 HydrophobicContact CB-CD2 4.1Å; L361-L388 HydrophobicContact CD2-CD2 3.79Å; L361-L388 HydrophobicContact CG-CD2 3.72Å
362	L	94.9	Very high	89.3	Confident	18 Å²	18	53.1 Å²	53.1	9%	0.094	26%	0.262	C	S	.	.	H	α-helix	trans	-61.5	-43.3	177.1	-179.4	62.6	0	0	0	111.8	K358 E359 L365 I366 R385 L388 E389	K358-L362 WeakPolarHBondContact O-CB 3.21Å; K358-L362 PolarHBondContact O-N 2.87Å; E359-L362 WeakPolarHBondContact O-CB 3.37Å; E359-L362 PolarHBondContact O-N 3.31Å; L362-L365 PolarHBondContact O-N 3.38Å; L362-I366 HydrophobicContact CD1-CD1 4.16Å; L362-I366 HydrophobicContact CG-CD1 3.97Å; L362-I366 WeakPolarHBondContact O-CB 3.34Å; L362-I366 WeakPolarHBondContact O-CD1 3.38Å; L362-I366 VanDerWaalsContact O-CG1 3.23Å; L362-I366 WeakPolarHBondContact O-CG1 3.21Å; L362-I366 PolarHBondContact O-N 3.37Å; L362-R385 HydrophobicContact CD1-CG 3.58Å; L362-L388 HydrophobicContact CB-CD2 3.86Å; L362-L388 HydrophobicContact CB-CG 4.26Å; L362-L388 HydrophobicContact CD1-CB 4.43Å; L362-L388 HydrophobicContact CD1-CD2 4.44Å; L362-L388 HydrophobicContact CD1-CG 4.49Å; L362-E389 HydrophobicContact CD1-CB 3.97Å; L362-E389 HydrophobicContact CD2-CB 4.1Å; L362-E389 HydrophobicContact CD2-CG 4.13Å
363	Q	93.6	Very high	88.8	Confident	128 Å²	128	53 Å²	53	60%	0.598	26%	0.261	S	S	*	.	H	α-helix	trans	-61.8	-41.3	173.4	-71.6	174.1	22.8	0	0	112.2	E359 A360 L361 I366 L367	E359-Q363 WeakPolarHBondContact O-CG 3.35Å; E359-Q363 PolarHBondContact O-N 3.01Å; A360-Q363 PolarHBondContact O-N 3.22Å; L361-Q363 PolarHBondContact O-N 3.45Å; Q363-I366 PolarHBondContact O-N 2.93Å; Q363-L367 WeakPolarHBondContact O-CG 3.4Å; Q363-L367 PolarHBondContact O-N 2.92Å; Q363-L367 VanDerWaalsContact O-N 3.11Å
364	E	91.3	Very high	88.3	Confident	17 Å²	17	52.6 Å²	52.6	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-65.5	-42.7	176.7	-71.9	173.6	-159.6	0	0	111.6	R129 R178 A360 L361 I366 L367 V368	R129-E364 IonicContact CZ-OE1 3.71Å; R129-E364 VanDerWaalsContact CZ-OE1 3.27Å; R129-E364 IonicContact NE-OE1 2.98Å; R129-E364 PolarHBondContact NE-OE1 2.87Å; R129-E364 IonicContact NE-OE2 2.7Å; R129-E364 IonicContact NH2-OE1 3.88Å; R129-E364 PolarHBondContact NH2-OE1 3.46Å; R178-E364 IonicContact CZ-OE1 2.66Å; R178-E364 IonicContact CZ-OE2 3.42Å; R178-E364 IonicContact NE-OE1 2.77Å; R178-E364 IonicContact NH2-OE1 3.53Å; R178-E364 IonicContact NH2-OE2 3.96Å; R178-E364 PolarHBondContact NH2-OE2 3.37Å; A360-E364 VanDerWaalsContact O-CG 3.29Å; A360-E364 WeakPolarHBondContact O-CG 3.36Å; A360-E364 PolarHBondContact O-N 3.35Å; L361-E364 PolarHBondContact O-N 3.16Å; E364-I366 PolarHBondContact O-N 3.24Å; E364-L367 PolarHBondContact O-N 2.92Å; E364-L367 VanDerWaalsContact O-N 3.16Å; E364-V368 WeakPolarHBondContact O-CG2 3.24Å; E364-V368 PolarHBondContact O-N 3.2Å
365	L	90.9	Very high	87.7	Confident	13 Å²	13	56 Å²	56	7%	0.068	30%	0.3	C	S	.	.	H	α-helix	trans	-61	-43	172.9	-71.8	170.8	0	0	0	112.1	L132 L361 L362 L367 V368 S369 L381 R385 L388	L132-L365 HydrophobicContact CD1-CD2 3.86Å; L132-L365 HydrophobicContact CD1-CG 4.23Å; L132-L365 HydrophobicContact CD2-CD2 4.4Å; L361-L365 HydrophobicContact CD1-CD1 4.31Å; L361-L365 HydrophobicContact CD1-CG 4.22Å; L361-L365 HydrophobicContact CG-CD1 4.15Å; L361-L365 HydrophobicContact CG-CG 4.49Å; L361-L365 WeakPolarHBondContact O-CG 3.49Å; L361-L365 PolarHBondContact O-N 3.5Å; L362-L365 PolarHBondContact O-N 3.38Å; L365-L367 PolarHBondContact O-N 3.35Å; L365-V368 PolarHBondContact O-N 2.94Å; L365-S369 WeakPolarHBondContact O-CB 3.46Å; L365-S369 PolarHBondContact O-N 2.87Å; L365-S369 PolarHBondContact O-OG 2.83Å; L365-L381 HydrophobicContact CD2-CD2 3.63Å; L365-R385 HydrophobicContact CB-CB 4.43Å; L365-L388 HydrophobicContact CD1-CD2 3.98Å
366	I	90	Very high	87.2	Confident	45 Å²	45	63 Å²	63	23%	0.231	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-23.7	175.9	-72.7	166.2	0	0	0	112.7	L362 Q363 E364 K370 R385	L362-I366 HydrophobicContact CD1-CD1 4.16Å; L362-I366 HydrophobicContact CG-CD1 3.97Å; L362-I366 WeakPolarHBondContact O-CB 3.34Å; L362-I366 WeakPolarHBondContact O-CD1 3.38Å; L362-I366 VanDerWaalsContact O-CG1 3.23Å; L362-I366 WeakPolarHBondContact O-CG1 3.21Å; L362-I366 PolarHBondContact O-N 3.37Å; Q363-I366 PolarHBondContact O-N 2.93Å; E364-I366 PolarHBondContact O-N 3.24Å; I366-K370 WeakPolarHBondContact O-CD 3.44Å; I366-K370 WeakPolarHBondContact O-CE 3.42Å; I366-K370 WeakPolarHBondContact O-CG 3.27Å; I366-R385 HydrophobicContact CG1-CG 4.09Å
367	L	87.1	Confident	86.7	Confident	111 Å²	111	58.1 Å²	58.1	58%	0.581	32%	0.32	S	S	*	.	H	α-helix	trans	-85.5	-38.8	173.8	-70.4	170.6	0	0	0	112	Q363 E364 L365	Q363-L367 WeakPolarHBondContact O-CG 3.4Å; Q363-L367 PolarHBondContact O-N 2.92Å; Q363-L367 VanDerWaalsContact O-N 3.11Å; E364-L367 PolarHBondContact O-N 2.92Å; E364-L367 VanDerWaalsContact O-N 3.16Å; L365-L367 PolarHBondContact O-N 3.35Å
368	V	84.6	Confident	86.2	Confident	15 Å²	15	60 Å²	60	9%	0.091	33%	0.329	C	S	.	.	H	α-helix	trans	-70	-41.5	177.8	174.7	0	0	0	0	111.5	E136 E364 L365 K370 Q371 L373 L381	E136-V368 HydrophobicContact CG-CG2 4.43Å; E364-V368 WeakPolarHBondContact O-CG2 3.24Å; E364-V368 PolarHBondContact O-N 3.2Å; L365-V368 PolarHBondContact O-N 2.94Å; V368-K370 PolarHBondContact O-N 3.22Å; V368-K370 VanDerWaalsContact O-N 3.11Å; V368-Q371 WeakPolarHBondContact O-CB 3.49Å; V368-Q371 PolarHBondContact O-N 3.43Å; V368-L373 HydrophobicContact CG1-CD1 4.08Å; V368-L381 HydrophobicContact CG1-CD1 3.99Å
369	S	83.3	Confident	85.9	Confident	18 Å²	18	64.5 Å²	64.5	13%	0.126	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-11.6	-179.6	78.8	0	0	0	0	114.2	L365	L365-S369 WeakPolarHBondContact O-CB 3.46Å; L365-S369 PolarHBondContact O-N 2.87Å; L365-S369 PolarHBondContact O-OG 2.83Å
370	K	81	Confident	85.6	Confident	153 Å²	153	67.5 Å²	67.5	67%	0.665	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-7	173.2	-69.4	171	-172.8	166.7	0	113.2	I366 V368	I366-K370 WeakPolarHBondContact O-CD 3.44Å; I366-K370 WeakPolarHBondContact O-CE 3.42Å; I366-K370 WeakPolarHBondContact O-CG 3.27Å; V368-K370 PolarHBondContact O-N 3.22Å; V368-K370 VanDerWaalsContact O-N 3.11Å
371	Q	78.3	Confident	85.2	Confident	63 Å²	63	68.2 Å²	68.2	29%	0.294	37%	0.365	S	S	.	.	S	Bend	trans	-87.1	145.3	175.1	-57.3	-176.8	11.6	0	0	110.3	V368 L373	V368-Q371 WeakPolarHBondContact O-CB 3.49Å; V368-Q371 PolarHBondContact O-N 3.43Å; Q371-L373 PolarHBondContact O-N 2.91Å
372	P	70.6	Confident	84.8	Confident	115 Å²	115	72.1 Å²	72.1	75%	0.747	38%	0.383	S	S	*	.			trans	-60.1	123	171.8	25.9	-33.6	0	0	0	109.9	R139	R139-P372 PolarHBondContact NH1-O 3.49Å; R139-P372 VanDerWaalsContact NH1-O 3.14Å; R139-P372 PolarHBondContact NH2-O 2.92Å
373	L	76.3	Confident	84.6	Confident	49 Å²	49	76.3 Å²	76.3	26%	0.257	40%	0.402	S	S	.	.			trans	-134.3	174.3	-178.4	-83.2	158.8	0	0	0	109.3	V368 Q371 Q378 L381	V368-L373 HydrophobicContact CG1-CD1 4.08Å; Q371-L373 PolarHBondContact O-N 2.91Å; L373-Q378 HydrophobicContact CB-CB 4.26Å; L373-L381 HydrophobicContact CD1-CD1 3.79Å
374	A	80.3	Confident	84.4	Confident	62 Å²	62	74.5 Å²	74.5	51%	0.512	39%	0.394	S	S	.	.			trans	-70.3	142.3	170.4	0	0	0	0	0	109.1	E376 T377 Q378	A374-E376 VanDerWaalsContact C-N 3.26Å; A374-E376 PolarHBondContact O-N 2.9Å; A374-T377 PolarHBondContact O-N 3.4Å; A374-T377 PolarHBondContact O-OG1 2.7Å; A374-T377 VanDerWaalsContact O-OG1 3.14Å; A374-Q378 PolarHBondContact O-N 3Å
375	A	79.6	Confident	84.4	Confident	81 Å²	81	77.4 Å²	77.4	67%	0.669	40%	0.404	S	S	*	.	H	α-helix	trans	-55.5	-40.8	-173.4	0	0	0	0	0	112.9	Q378 Q379	A375-Q378 PolarHBondContact O-N 2.62Å; A375-Q379 WeakPolarHBondContact O-CB 3.42Å; A375-Q379 PolarHBondContact O-N 3.35Å
376	E	83.4	Confident	84.5	Confident	152 Å²	152	79.6 Å²	79.6	71%	0.71	42%	0.424	S	S	*	.	H	α-helix	trans	-63.2	-43.6	177.3	-61.6	175.1	175.7	0	0	112.7	A374 Q380	A374-E376 VanDerWaalsContact C-N 3.26Å; A374-E376 PolarHBondContact O-N 2.9Å; E376-Q380 WeakPolarHBondContact O-CG 3.34Å; E376-Q380 PolarHBondContact O-N 2.79Å; E376-Q380 VanDerWaalsContact O-N 3.11Å
377	T	83.2	Confident	84.7	Confident	56 Å²	56	82.5 Å²	82.5	34%	0.344	44%	0.435	S	S	.	.	H	α-helix	trans	-77.7	-28	179.8	58.9	0	0	0	0	112.3	A374 L381	A374-T377 PolarHBondContact O-N 3.4Å; A374-T377 PolarHBondContact O-OG1 2.7Å; A374-T377 VanDerWaalsContact O-OG1 3.14Å; T377-L381 WeakPolarHBondContact O-CD1 3.31Å; T377-L381 VanDerWaalsContact O-CG 3.23Å; T377-L381 WeakPolarHBondContact O-CG 3.46Å; T377-L381 PolarHBondContact O-N 2.94Å; T377-L381 VanDerWaalsContact O-N 3.15Å
378	Q	85.1	Confident	85	Confident	63 Å²	63	77.9 Å²	77.9	29%	0.294	41%	0.411	S	S	.	.	H	α-helix	trans	-67.1	-45.4	170	-168.9	-177.7	-39.8	0	0	111	L373 A374 A375 Q380 L381 E382	L373-Q378 HydrophobicContact CB-CB 4.26Å; A374-Q378 PolarHBondContact O-N 3Å; A375-Q378 PolarHBondContact O-N 2.62Å; Q378-Q380 PolarHBondContact O-N 2.84Å; Q378-L381 PolarHBondContact O-N 2.86Å; Q378-E382 WeakPolarHBondContact CG-OE1 3.45Å; Q378-E382 PolarHBondContact NE2-OE1 3.23Å; Q378-E382 WeakPolarHBondContact O-CG 3.43Å; Q378-E382 PolarHBondContact O-N 2.67Å
379	Q	87.6	Confident	85.5	Confident	113 Å²	113	81 Å²	81	53%	0.528	42%	0.424	S	S	.	.	H	α-helix	trans	-58.7	-46.8	175.9	-176.9	-177.7	-26.4	0	0	111.6	A375 L381 E382 E383	A375-Q379 WeakPolarHBondContact O-CB 3.42Å; A375-Q379 PolarHBondContact O-N 3.35Å; Q379-L381 VanDerWaalsContact C-N 3.29Å; Q379-L381 PolarHBondContact O-N 2.79Å; Q379-E382 PolarHBondContact O-N 2.87Å; Q379-E382 VanDerWaalsContact O-N 3.11Å; Q379-E383 HydrophobicContact CG-CG 4.46Å; Q379-E383 WeakPolarHBondContact CG-OE1 3.21Å; Q379-E383 PolarHBondContact NE2-OE1 3.13Å; Q379-E383 WeakPolarHBondContact O-CG 3.44Å; Q379-E383 PolarHBondContact O-N 3.04Å
380	Q	88.1	Confident	86.1	Confident	121 Å²	121	85.2 Å²	85.2	57%	0.565	44%	0.442	S	S	*	.	H	α-helix	trans	-59.6	-37.7	176.8	-72.5	170.3	1.4	0	0	112.9	E376 Q378 E384	E376-Q380 WeakPolarHBondContact O-CG 3.34Å; E376-Q380 PolarHBondContact O-N 2.79Å; E376-Q380 VanDerWaalsContact O-N 3.11Å; Q378-Q380 PolarHBondContact O-N 2.84Å; Q380-E384 PolarHBondContact O-N 2.84Å; Q380-E384 VanDerWaalsContact O-N 3.09Å
381	L	85.7	Confident	86.7	Confident	35 Å²	35	81.1 Å²	81.1	18%	0.183	43%	0.425	C	S	.	.	H	α-helix	trans	-71.7	-33.4	175.5	-72	166.4	0	0	0	112.4	L365 V368 L373 T377 Q378 Q379 R385	L365-L381 HydrophobicContact CD2-CD2 3.63Å; V368-L381 HydrophobicContact CG1-CD1 3.99Å; L373-L381 HydrophobicContact CD1-CD1 3.79Å; T377-L381 WeakPolarHBondContact O-CD1 3.31Å; T377-L381 VanDerWaalsContact O-CG 3.23Å; T377-L381 WeakPolarHBondContact O-CG 3.46Å; T377-L381 PolarHBondContact O-N 2.94Å; T377-L381 VanDerWaalsContact O-N 3.15Å; Q378-L381 PolarHBondContact O-N 2.86Å; Q379-L381 VanDerWaalsContact C-N 3.29Å; Q379-L381 PolarHBondContact O-N 2.79Å; L381-R385 WeakPolarHBondContact O-CB 3.4Å; L381-R385 PolarHBondContact O-N 3Å
382	E	86.9	Confident	87.5	Confident	87 Å²	87	78.8 Å²	78.8	41%	0.407	42%	0.415	S	S	.	.	H	α-helix	trans	-71.1	-37.9	174.8	-73.4	175.8	-165.1	0	0	112	Q378 Q379 A386	Q378-E382 WeakPolarHBondContact CG-OE1 3.45Å; Q378-E382 PolarHBondContact NE2-OE1 3.23Å; Q378-E382 WeakPolarHBondContact O-CG 3.43Å; Q378-E382 PolarHBondContact O-N 2.67Å; Q379-E382 PolarHBondContact O-N 2.87Å; Q379-E382 VanDerWaalsContact O-N 3.11Å; E382-A386 WeakPolarHBondContact O-CB 3.25Å; E382-A386 PolarHBondContact O-N 2.98Å
383	E	90.8	Very high	88.6	Confident	105 Å²	105	78.6 Å²	78.6	49%	0.491	40%	0.404	S	S	.	.	H	α-helix	trans	-64.8	-52.1	174.1	-73.8	173.4	-169.8	0	0	112.1	Q379 R385 A386 K387	Q379-E383 HydrophobicContact CG-CG 4.46Å; Q379-E383 WeakPolarHBondContact CG-OE1 3.21Å; Q379-E383 PolarHBondContact NE2-OE1 3.13Å; Q379-E383 WeakPolarHBondContact O-CG 3.44Å; Q379-E383 PolarHBondContact O-N 3.04Å; E383-R385 VanDerWaalsContact C-N 3.32Å; E383-R385 PolarHBondContact O-N 2.65Å; E383-A386 PolarHBondContact O-N 3.39Å; E383-K387 WeakPolarHBondContact O-CB 3.26Å; E383-K387 PolarHBondContact O-N 2.68Å
384	E	88.9	Confident	89.5	Confident	90 Å²	90	81.5 Å²	81.5	42%	0.421	41%	0.412	S	S	.	.	H	α-helix	trans	-66.3	-33	177	-74.3	-65.3	131.8	0	0	112.3	Q380 K387 L388	Q380-E384 PolarHBondContact O-N 2.84Å; Q380-E384 VanDerWaalsContact O-N 3.09Å; E384-K387 IonicContact OE1-NZ 2.78Å; E384-K387 PolarHBondContact OE1-NZ 2.77Å; E384-K387 IonicContact OE2-NZ 2.71Å; E384-K387 PolarHBondContact OE2-NZ 2.89Å; E384-L388 VanDerWaalsContact O-CB 3.3Å; E384-L388 WeakPolarHBondContact O-CB 3.41Å; E384-L388 PolarHBondContact O-N 2.77Å
385	R	91.3	Very high	89.9	Confident	79 Å²	79	79.3 Å²	79.3	30%	0.298	39%	0.393	S	S	.	.	H	α-helix	trans	-61.2	-52.2	170.4	-178.8	-150.2	146.3	-163.9	-8.9	110.8	L362 L365 I366 L381 E383 K387 L388 E389	L362-R385 HydrophobicContact CD1-CG 3.58Å; L365-R385 HydrophobicContact CB-CB 4.43Å; I366-R385 HydrophobicContact CG1-CG 4.09Å; L381-R385 WeakPolarHBondContact O-CB 3.4Å; L381-R385 PolarHBondContact O-N 3Å; E383-R385 VanDerWaalsContact C-N 3.32Å; E383-R385 PolarHBondContact O-N 2.65Å; R385-K387 VanDerWaalsContact C-N 3.31Å; R385-K387 PolarHBondContact O-N 3.42Å; R385-L388 PolarHBondContact O-N 3.07Å; R385-E389 IonicContact CZ-OE2 3.67Å; R385-E389 IonicContact NE-OE2 3.17Å; R385-E389 PolarHBondContact NE-OE2 3.38Å; R385-E389 IonicContact NH2-OE1 2.89Å; R385-E389 PolarHBondContact NH2-OE1 3.36Å; R385-E389 VanDerWaalsContact NH2-OE1 3.17Å; R385-E389 IonicContact NH2-OE2 2.87Å; R385-E389 PolarHBondContact NH2-OE2 3.1Å; R385-E389 VanDerWaalsContact O-CB 3.31Å; R385-E389 WeakPolarHBondContact O-CB 3.47Å; R385-E389 PolarHBondContact O-N 2.89Å
386	A	93.1	Very high	90.5	Very high	59 Å²	59	78.8 Å²	78.8	49%	0.488	38%	0.377	S	S	.	.	H	α-helix	trans	-60.9	-41	-176.4	0	0	0	0	0	112.1	E382 E383 E389 E390	E382-A386 WeakPolarHBondContact O-CB 3.25Å; E382-A386 PolarHBondContact O-N 2.98Å; E383-A386 PolarHBondContact O-N 3.39Å; A386-E389 PolarHBondContact O-N 3.14Å; A386-E390 PolarHBondContact O-N 2.96Å
387	K	94.2	Very high	90.8	Very high	105 Å²	105	74.4 Å²	74.4	46%	0.457	36%	0.361	S	S	.	.	H	α-helix	trans	-60.4	-47	173.2	174	-174.8	166	-152	0	112.5	E383 E384 R385 E390 E391	E383-K387 WeakPolarHBondContact O-CB 3.26Å; E383-K387 PolarHBondContact O-N 2.68Å; E384-K387 IonicContact OE1-NZ 2.78Å; E384-K387 PolarHBondContact OE1-NZ 2.77Å; E384-K387 IonicContact OE2-NZ 2.71Å; E384-K387 PolarHBondContact OE2-NZ 2.89Å; R385-K387 VanDerWaalsContact C-N 3.31Å; R385-K387 PolarHBondContact O-N 3.42Å; K387-E390 PolarHBondContact O-N 3.41Å; K387-E391 WeakPolarHBondContact O-CB 3.39Å; K387-E391 PolarHBondContact O-N 2.88Å
388	L	93.9	Very high	91	Very high	15 Å²	15	76.7 Å²	76.7	8%	0.079	37%	0.37	C	S	.	.	H	α-helix	trans	-68.4	-35	177.6	-174.5	63.4	0	0	0	112.4	K358 L361 L362 L365 E384 R385 E391 V392	K358-L388 HydrophobicContact CB-CD1 3.98Å; K358-L388 HydrophobicContact CD-CD1 4.38Å; K358-L388 HydrophobicContact CG-CD1 4.11Å; L361-L388 HydrophobicContact CB-CD2 4.1Å; L361-L388 HydrophobicContact CD2-CD2 3.79Å; L361-L388 HydrophobicContact CG-CD2 3.72Å; L362-L388 HydrophobicContact CB-CD2 3.86Å; L362-L388 HydrophobicContact CB-CG 4.26Å; L362-L388 HydrophobicContact CD1-CB 4.43Å; L362-L388 HydrophobicContact CD1-CD2 4.44Å; L362-L388 HydrophobicContact CD1-CG 4.49Å; L365-L388 HydrophobicContact CD1-CD2 3.98Å; E384-L388 VanDerWaalsContact O-CB 3.3Å; E384-L388 WeakPolarHBondContact O-CB 3.41Å; E384-L388 PolarHBondContact O-N 2.77Å; R385-L388 PolarHBondContact O-N 3.07Å; L388-E391 PolarHBondContact O-N 2.71Å; L388-V392 WeakPolarHBondContact O-CB 3.4Å; L388-V392 WeakPolarHBondContact O-CG2 3.4Å; L388-V392 PolarHBondContact O-N 3.02Å
389	E	94.8	Very high	91.1	Very high	79 Å²	79	76 Å²	76	37%	0.369	37%	0.366	S	S	.	.	H	α-helix	trans	-65.5	-42.7	175.4	-164.2	162.1	143.8	0	0	111.3	L362 R385 A386 Q393	L362-E389 HydrophobicContact CD1-CB 3.97Å; L362-E389 HydrophobicContact CD2-CB 4.1Å; L362-E389 HydrophobicContact CD2-CG 4.13Å; R385-E389 IonicContact CZ-OE2 3.67Å; R385-E389 IonicContact NE-OE2 3.17Å; R385-E389 PolarHBondContact NE-OE2 3.38Å; R385-E389 IonicContact NH2-OE1 2.89Å; R385-E389 PolarHBondContact NH2-OE1 3.36Å; R385-E389 VanDerWaalsContact NH2-OE1 3.17Å; R385-E389 IonicContact NH2-OE2 2.87Å; R385-E389 PolarHBondContact NH2-OE2 3.1Å; R385-E389 VanDerWaalsContact O-CB 3.31Å; R385-E389 WeakPolarHBondContact O-CB 3.47Å; R385-E389 PolarHBondContact O-N 2.89Å; A386-E389 PolarHBondContact O-N 3.14Å; E389-Q393 VanDerWaalsContact O-CB 3.31Å; E389-Q393 WeakPolarHBondContact O-CB 3.37Å; E389-Q393 PolarHBondContact O-N 2.86Å
390	E	95.7	Very high	91.1	Very high	108 Å²	108	73.6 Å²	73.6	51%	0.505	36%	0.362	S	S	.	.	H	α-helix	trans	-64.2	-40.2	171.7	-163.2	-157.8	-170.9	0	0	112.1	A386 K387 Q393 R394	A386-E390 PolarHBondContact O-N 2.96Å; K387-E390 PolarHBondContact O-N 3.41Å; E390-Q393 PolarHBondContact O-N 3.32Å; E390-R394 VanDerWaalsContact CD-NH2 3.3Å; E390-R394 WeakPolarHBondContact O-CG 3.38Å; E390-R394 PolarHBondContact O-N 3.33Å; E390-R394 IonicContact OE1-CZ 2.67Å; E390-R394 IonicContact OE1-NH1 2.77Å; E390-R394 PolarHBondContact OE1-NH1 2.9Å; E390-R394 IonicContact OE2-CZ 3.23Å; E390-R394 IonicContact OE2-NH1 3.16Å; E390-R394 PolarHBondContact OE2-NH1 2.79Å; E390-R394 IonicContact OE2-NH2 3.77Å; E390-R394 PolarHBondContact OE2-NH2 3.28Å
391	E	93.5	Very high	91	Very high	67 Å²	67	74 Å²	74	31%	0.313	36%	0.364	S	S	.	.	H	α-helix	trans	-67.1	-45.8	178.9	-163	-173.5	156.9	0	0	113	K358 K387 L388 Q393 R394 A395	K358-E391 IonicContact NZ-OE1 2.75Å; K358-E391 PolarHBondContact NZ-OE1 3.35Å; K387-E391 WeakPolarHBondContact O-CB 3.39Å; K387-E391 PolarHBondContact O-N 2.88Å; L388-E391 PolarHBondContact O-N 2.71Å; E391-Q393 VanDerWaalsContact C-N 3.32Å; E391-Q393 PolarHBondContact O-N 2.94Å; E391-R394 PolarHBondContact O-N 2.87Å; E391-A395 WeakPolarHBondContact O-CB 3.37Å; E391-A395 PolarHBondContact O-N 3.45Å
392	V	94.4	Very high	90.9	Very high	13 Å²	13	73.4 Å²	73.4	8%	0.079	37%	0.367	C	S	.	.	H	α-helix	trans	-59.5	-44	172.6	166.4	0	0	0	0	110.4	L355 K358 E359 L388 R394 A395 H396	L355-V392 HydrophobicContact CD1-CB 4.39Å; L355-V392 HydrophobicContact CD1-CG1 4.09Å; L355-V392 HydrophobicContact CD1-CG2 4.26Å; K358-V392 HydrophobicContact CB-CG2 3.75Å; E359-V392 HydrophobicContact CG-CG1 3.85Å; E359-V392 HydrophobicContact CG-CG2 4.42Å; L388-V392 WeakPolarHBondContact O-CB 3.4Å; L388-V392 WeakPolarHBondContact O-CG2 3.4Å; L388-V392 PolarHBondContact O-N 3.02Å; V392-R394 PolarHBondContact O-N 3.42Å; V392-A395 PolarHBondContact O-N 2.91Å; V392-H396 PolarHBondContact O-CD2 3.21Å; V392-H396 VanDerWaalsContact O-CD2 3.27Å; V392-H396 PolarHBondContact O-N 2.87Å
393	Q	94.3	Very high	90.7	Very high	111 Å²	111	71.4 Å²	71.4	52%	0.519	37%	0.365	S	S	.	.	H	α-helix	trans	-64.2	-40.3	177.9	-173.9	59.4	69.5	0	0	112.4	E389 E390 E391 T397	E389-Q393 VanDerWaalsContact O-CB 3.31Å; E389-Q393 WeakPolarHBondContact O-CB 3.37Å; E389-Q393 PolarHBondContact O-N 2.86Å; E390-Q393 PolarHBondContact O-N 3.32Å; E391-Q393 VanDerWaalsContact C-N 3.32Å; E391-Q393 PolarHBondContact O-N 2.94Å; Q393-T397 WeakPolarHBondContact O-CG2 3.46Å; Q393-T397 PolarHBondContact O-N 3.22Å; Q393-T397 VanDerWaalsContact O-N 3.13Å
394	R	93.9	Very high	90.5	Very high	111 Å²	111	70.9 Å²	70.9	42%	0.419	37%	0.365	S	S	.	.	H	α-helix	trans	-60.7	-48.4	172.2	-80.4	-175.2	-71.3	-118.1	-11	111.3	E390 E391 V392 H396 T397 I398	E390-R394 VanDerWaalsContact CD-NH2 3.3Å; E390-R394 WeakPolarHBondContact O-CG 3.38Å; E390-R394 PolarHBondContact O-N 3.33Å; E390-R394 IonicContact OE1-CZ 2.67Å; E390-R394 IonicContact OE1-NH1 2.77Å; E390-R394 PolarHBondContact OE1-NH1 2.9Å; E390-R394 IonicContact OE2-CZ 3.23Å; E390-R394 IonicContact OE2-NH1 3.16Å; E390-R394 PolarHBondContact OE2-NH1 2.79Å; E390-R394 IonicContact OE2-NH2 3.77Å; E390-R394 PolarHBondContact OE2-NH2 3.28Å; E391-R394 PolarHBondContact O-N 2.87Å; V392-R394 PolarHBondContact O-N 3.42Å; R394-H396 VanDerWaalsContact C-N 3.32Å; R394-H396 PolarHBondContact O-N 3.09Å; R394-T397 PolarHBondContact O-N 3.08Å; R394-T397 PolarHBondContact O-OG1 2.85Å; R394-I398 WeakPolarHBondContact O-CG1 3.39Å; R394-I398 PolarHBondContact O-N 2.83Å
395	A	90.1	Very high	90.4	Very high	15 Å²	15	72.4 Å²	72.4	12%	0.124	37%	0.373	C	S	.	.	H	α-helix	trans	-56.7	-43.7	179.3	0	0	0	0	0	112.4	F351 L355 E391 V392 I398 Q399	F351-A395 HydrophobicContact CE1-CB 4.49Å; F351-A395 HydrophobicContact CZ-CB 3.82Å; L355-A395 HydrophobicContact CD1-CB 3.72Å; L355-A395 HydrophobicContact CD2-CB 4.41Å; E391-A395 WeakPolarHBondContact O-CB 3.37Å; E391-A395 PolarHBondContact O-N 3.45Å; V392-A395 PolarHBondContact O-N 2.91Å; A395-I398 PolarHBondContact O-N 3.17Å; A395-Q399 WeakPolarHBondContact O-CB 3.44Å; A395-Q399 PolarHBondContact O-N 3.34Å
396	H	90.8	Very high	90	Very high	70 Å²	70	72.4 Å²	72.4	32%	0.324	37%	0.373	S	S	.	.	H	α-helix	trans	-61.1	-42.4	173	-83.9	-67.8	0	0	0	113.1	E359 V392 R394 Q399 S400	E359-H396 IonicContact OE1-CD2 2.7Å; E359-H396 IonicContact OE1-CE1 3.9Å; E359-H396 PolarHBondContact OE1-CE1 2.68Å; E359-H396 IonicContact OE1-NE2 3.24Å; E359-H396 PolarHBondContact OE1-NE2 3.27Å; V392-H396 PolarHBondContact O-CD2 3.21Å; V392-H396 VanDerWaalsContact O-CD2 3.27Å; V392-H396 PolarHBondContact O-N 2.87Å; R394-H396 VanDerWaalsContact C-N 3.32Å; R394-H396 PolarHBondContact O-N 3.09Å; H396-Q399 PolarHBondContact O-N 3.1Å; H396-S400 WeakPolarHBondContact O-CB 3.27Å; H396-S400 PolarHBondContact O-N 3.41Å
397	T	91.6	Very high	89.7	Confident	60 Å²	60	73.8 Å²	73.8	37%	0.368	37%	0.372	S	S	.	.	H	α-helix	trans	-65.7	-40.2	177.3	56.9	0	0	0	0	112.9	Q393 R394 S400 Q401	Q393-T397 WeakPolarHBondContact O-CG2 3.46Å; Q393-T397 PolarHBondContact O-N 3.22Å; Q393-T397 VanDerWaalsContact O-N 3.13Å; R394-T397 PolarHBondContact O-N 3.08Å; R394-T397 PolarHBondContact O-OG1 2.85Å; T397-S400 PolarHBondContact O-N 2.91Å; T397-Q401 WeakPolarHBondContact O-CB 3.39Å; T397-Q401 VanDerWaalsContact O-CG 3.28Å; T397-Q401 WeakPolarHBondContact O-CG 3.49Å; T397-Q401 PolarHBondContact O-N 2.85Å
398	I	87.3	Confident	89.5	Confident	104 Å²	104	74.3 Å²	74.3	53%	0.533	38%	0.379	S	S	.	.	H	α-helix	trans	-65.8	-44.7	177.5	-66.5	164.8	0	0	0	110.3	R394 A395 S400 Q401 G402	R394-I398 WeakPolarHBondContact O-CG1 3.39Å; R394-I398 PolarHBondContact O-N 2.83Å; A395-I398 PolarHBondContact O-N 3.17Å; I398-S400 PolarHBondContact O-N 2.89Å; I398-Q401 PolarHBondContact O-N 3.34Å; I398-G402 PolarHBondContact O-N 3.09Å
399	Q	86.6	Confident	89.2	Confident	48 Å²	48	76.1 Å²	76.1	22%	0.224	39%	0.387	C	S	.	.	H	α-helix	trans	-61.1	-43.6	175.8	174.9	164.2	82.3	0	0	112.3	F351 L352 A395 H396 G402 A403	F351-Q399 HydrophobicContact CE1-CB 4.34Å; L352-Q399 VanDerWaalsContact CD2-NE2 3.31Å; A395-Q399 WeakPolarHBondContact O-CB 3.44Å; A395-Q399 PolarHBondContact O-N 3.34Å; H396-Q399 PolarHBondContact O-N 3.1Å; Q399-G402 PolarHBondContact O-N 3.32Å; Q399-A403 WeakPolarHBondContact O-CB 3.45Å; Q399-A403 PolarHBondContact O-N 3.31Å
400	S	86.3	Confident	88.8	Confident	63 Å²	63	77.9 Å²	77.9	44%	0.441	40%	0.395	S	S	.	.	H	α-helix	trans	-62.1	-44.4	176.3	-177.5	0	0	0	0	111.7	H396 T397 I398 A403 N404	H396-S400 WeakPolarHBondContact O-CB 3.27Å; H396-S400 PolarHBondContact O-N 3.41Å; T397-S400 PolarHBondContact O-N 2.91Å; I398-S400 PolarHBondContact O-N 2.89Å; S400-A403 PolarHBondContact O-N 3.43Å; S400-N404 WeakPolarHBondContact O-CB 3.24Å; S400-N404 VanDerWaalsContact O-CG 3.27Å; S400-N404 PolarHBondContact O-N 3.42Å; S400-N404 PolarHBondContact O-ND2 3.41Å
401	Q	87.2	Confident	88.6	Confident	129 Å²	129	77.8 Å²	77.8	60%	0.603	40%	0.395	S	S	*	.	H	α-helix	trans	-60.8	-46.9	175.6	-73.4	170.7	2.7	0	0	112.1	T397 I398 A403 N404 Q405	T397-Q401 WeakPolarHBondContact O-CB 3.39Å; T397-Q401 VanDerWaalsContact O-CG 3.28Å; T397-Q401 WeakPolarHBondContact O-CG 3.49Å; T397-Q401 PolarHBondContact O-N 2.85Å; I398-Q401 PolarHBondContact O-N 3.34Å; Q401-A403 PolarHBondContact O-N 2.87Å; Q401-N404 PolarHBondContact O-N 2.84Å; Q401-Q405 WeakPolarHBondContact O-CB 3.23Å; Q401-Q405 PolarHBondContact O-N 2.87Å
402	G	83.9	Confident	88.6	Confident	24 Å²	24	79.5 Å²	79.5	25%	0.247	40%	0.401	C	S	.	.	H	α-helix	trans	-63.4	-39.2	176.5	0	0	0	0	0	113.3	I398 Q399 Q405 R406	I398-G402 PolarHBondContact O-N 3.09Å; Q399-G402 PolarHBondContact O-N 3.32Å; G402-Q405 PolarHBondContact O-N 3.37Å; G402-R406 WeakPolarHBondContact O-CG 3.39Å; G402-R406 PolarHBondContact O-N 2.77Å; G402-R406 PolarHBondContact O-NE 3.08Å
403	A	82.2	Confident	88.5	Confident	44 Å²	44	83.3 Å²	83.3	36%	0.364	41%	0.414	S	S	.	.	H	α-helix	trans	-62.3	-44.9	173.6	0	0	0	0	0	112.1	Q399 S400 Q401 R406 L407	Q399-A403 WeakPolarHBondContact O-CB 3.45Å; Q399-A403 PolarHBondContact O-N 3.31Å; S400-A403 PolarHBondContact O-N 3.43Å; Q401-A403 PolarHBondContact O-N 2.87Å; A403-R406 PolarHBondContact O-N 2.9Å; A403-L407 PolarHBondContact O-N 2.95Å
404	N	86.4	Confident	88.4	Confident	94 Å²	94	81.2 Å²	81.2	50%	0.503	41%	0.406	S	S	.	.	H	α-helix	trans	-65.4	-38	176.5	-70.3	-39.4	0	0	0	112.4	S400 Q401 L407 L408	S400-N404 WeakPolarHBondContact O-CB 3.24Å; S400-N404 VanDerWaalsContact O-CG 3.27Å; S400-N404 PolarHBondContact O-N 3.42Å; S400-N404 PolarHBondContact O-ND2 3.41Å; Q401-N404 PolarHBondContact O-N 2.84Å; N404-L407 PolarHBondContact O-N 3.3Å; N404-L408 WeakPolarHBondContact O-CB 3.28Å; N404-L408 PolarHBondContact O-N 2.9Å
405	Q	85.8	Confident	88.5	Confident	123 Å²	123	78.8 Å²	78.8	58%	0.575	40%	0.404	S	S	*	.	H	α-helix	trans	-64.8	-43.1	175.8	-173.7	174.9	5.8	0	0	111.8	Q401 G402 L408 Q409	Q401-Q405 WeakPolarHBondContact O-CB 3.23Å; Q401-Q405 PolarHBondContact O-N 2.87Å; G402-Q405 PolarHBondContact O-N 3.37Å; Q405-L408 PolarHBondContact O-N 3.5Å; Q405-Q409 WeakPolarHBondContact O-CG 3.28Å; Q405-Q409 PolarHBondContact O-N 2.91Å
406	R	84.2	Confident	88.8	Confident	78 Å²	78	78.6 Å²	78.6	29%	0.294	40%	0.4	S	S	.	.	H	α-helix	trans	-64.2	-39.7	175.2	-71.3	-178.5	-65	-150.7	8.6	111.9	D348 G402 A403 Q409 Q410	D348-R406 VanDerWaalsContact CG-NH1 3.33Å; D348-R406 IonicContact OD1-CZ 2.76Å; D348-R406 IonicContact OD1-NH1 3.96Å; D348-R406 PolarHBondContact OD1-NH1 3.47Å; D348-R406 IonicContact OD1-NH2 3.6Å; D348-R406 IonicContact OD2-CZ 3.74Å; D348-R406 IonicContact OD2-NH1 3.55Å; D348-R406 PolarHBondContact OD2-NH1 2.95Å; D348-R406 IonicContact OD2-NH2 3.14Å; D348-R406 PolarHBondContact OD2-NH2 3.16Å; G402-R406 WeakPolarHBondContact O-CG 3.39Å; G402-R406 PolarHBondContact O-N 2.77Å; G402-R406 PolarHBondContact O-NE 3.08Å; A403-R406 PolarHBondContact O-N 2.9Å; R406-Q409 PolarHBondContact O-N 3.33Å; R406-Q410 WeakPolarHBondContact O-CB 3.46Å; R406-Q410 PolarHBondContact O-N 2.98Å
407	L	85.8	Confident	89	Confident	89 Å²	89	78.6 Å²	78.6	47%	0.466	40%	0.402	S	S	.	.	H	α-helix	trans	-60.7	-47.4	172.9	-177.4	64.2	0	0	0	111.3	A403 N404 Q409 Q410 E411	A403-L407 PolarHBondContact O-N 2.95Å; N404-L407 PolarHBondContact O-N 3.3Å; L407-Q409 PolarHBondContact O-N 3.35Å; L407-Q410 CarbonylContact O-C 3.48Å; L407-Q410 WeakPolarHBondContact O-CB 3.31Å; L407-Q410 PolarHBondContact O-N 2.69Å; L407-Q410 VanDerWaalsContact O-N 3.17Å; L407-E411 WeakPolarHBondContact O-CG 3.46Å; L407-E411 PolarHBondContact O-N 2.89Å
408	L	90.5	Very high	89.2	Confident	116 Å²	116	83.2 Å²	83.2	61%	0.607	41%	0.413	S	S	*	.	H	α-helix	trans	-63.2	-39.3	178.3	-176.9	64.6	0	0	0	112.7	N404 Q405 E411 K412	N404-L408 WeakPolarHBondContact O-CB 3.28Å; N404-L408 PolarHBondContact O-N 2.9Å; Q405-L408 PolarHBondContact O-N 3.5Å; L408-E411 PolarHBondContact O-N 3.41Å; L408-K412 WeakPolarHBondContact O-CB 3.31Å; L408-K412 PolarHBondContact O-N 3.11Å
409	Q	86.9	Confident	89.6	Confident	52 Å²	52	82.8 Å²	82.8	24%	0.243	41%	0.409	C	S	.	.	H	α-helix	trans	-63.1	-43.3	172.3	-75.8	173.6	-34.2	0	0	111.5	Q405 R406 L407 K412 R413	Q405-Q409 WeakPolarHBondContact O-CG 3.28Å; Q405-Q409 PolarHBondContact O-N 2.91Å; R406-Q409 PolarHBondContact O-N 3.33Å; L407-Q409 PolarHBondContact O-N 3.35Å; Q409-K412 PolarHBondContact O-N 3.4Å; Q409-R413 WeakPolarHBondContact O-CB 3.42Å; Q409-R413 PolarHBondContact O-N 3.21Å
410	Q	87.8	Confident	90.1	Very high	117 Å²	117	81.9 Å²	81.9	55%	0.547	41%	0.405	S	S	.	.	H	α-helix	trans	-64.6	-39	176.3	-170.9	177	4.6	0	0	111.9	R406 L407 R413 N414	R406-Q410 WeakPolarHBondContact O-CB 3.46Å; R406-Q410 PolarHBondContact O-N 2.98Å; L407-Q410 CarbonylContact O-C 3.48Å; L407-Q410 WeakPolarHBondContact O-CB 3.31Å; L407-Q410 PolarHBondContact O-N 2.69Å; L407-Q410 VanDerWaalsContact O-N 3.17Å; Q410-R413 PolarHBondContact O-N 2.99Å; Q410-N414 WeakPolarHBondContact O-CB 3.13Å; Q410-N414 PolarHBondContact O-N 2.88Å; Q410-N414 PolarHBondContact O-ND2 2.86Å
411	E	91.3	Very high	90.6	Very high	106 Å²	106	85.8 Å²	85.8	50%	0.495	42%	0.417	S	S	.	.	H	α-helix	trans	-64.2	-45.4	172.5	-74.3	-173.1	171.2	0	0	112.2	L407 L408 R413 N414 V415	L407-E411 WeakPolarHBondContact O-CG 3.46Å; L407-E411 PolarHBondContact O-N 2.89Å; L408-E411 PolarHBondContact O-N 3.41Å; E411-R413 VanDerWaalsContact C-N 3.34Å; E411-R413 PolarHBondContact O-N 2.84Å; E411-N414 WeakPolarHBondContact O-CB 3.47Å; E411-N414 PolarHBondContact O-N 2.96Å; E411-N414 VanDerWaalsContact O-N 3.14Å; E411-V415 WeakPolarHBondContact O-CG2 3.37Å; E411-V415 PolarHBondContact O-N 2.81Å
412	K	92.6	Very high	91	Very high	103 Å²	103	83.4 Å²	83.4	45%	0.448	41%	0.406	S	S	.	.	H	α-helix	trans	-59	-43.8	175	-170.1	-177.7	151.9	-162.3	0	110.9	L334 E337 L408 Q409 V415 L416	L334-K412 HydrophobicContact CD1-CB 4.27Å; L334-K412 HydrophobicContact CD1-CD 4.18Å; L334-K412 HydrophobicContact CD1-CG 3.97Å; L334-K412 HydrophobicContact CD2-CD 3.87Å; L334-K412 VanDerWaalsContact CD2-NZ 3.31Å; L334-K412 HydrophobicContact CG-CD 4.45Å; E337-K412 IonicContact OE2-NZ 3.58Å; L408-K412 WeakPolarHBondContact O-CB 3.31Å; L408-K412 PolarHBondContact O-N 3.11Å; Q409-K412 PolarHBondContact O-N 3.4Å; K412-V415 PolarHBondContact O-N 3.25Å; K412-L416 WeakPolarHBondContact O-CG 3.39Å; K412-L416 PolarHBondContact O-N 2.81Å
413	R	92.3	Very high	91.5	Very high	92 Å²	92	82.9 Å²	82.9	35%	0.347	40%	0.399	S	S	.	.	H	α-helix	trans	-60.5	-45.5	172.2	-179.5	174.8	173.6	81.5	-9	111.9	L331 L334 D335 Q409 Q410 E411 V415 L416 L417	L331-R413 HydrophobicContact CD2-CG 3.98Å; L334-R413 HydrophobicContact CD1-CB 4.14Å; D335-R413 IonicContact OD1-CZ 3.88Å; D335-R413 IonicContact OD1-NH1 3.68Å; D335-R413 PolarHBondContact OD1-NH1 2.92Å; D335-R413 IonicContact OD2-CZ 2.72Å; D335-R413 IonicContact OD2-NH1 3.87Å; D335-R413 PolarHBondContact OD2-NH1 2.99Å; D335-R413 IonicContact OD2-NH2 3.35Å; Q409-R413 WeakPolarHBondContact O-CB 3.42Å; Q409-R413 PolarHBondContact O-N 3.21Å; Q410-R413 PolarHBondContact O-N 2.99Å; E411-R413 VanDerWaalsContact C-N 3.34Å; E411-R413 PolarHBondContact O-N 2.84Å; R413-V415 VanDerWaalsContact C-N 3.35Å; R413-V415 PolarHBondContact O-N 3Å; R413-L416 PolarHBondContact O-N 2.8Å; R413-L417 HydrophobicContact CG-CD1 4.03Å; R413-L417 HydrophobicContact CG-CG 4.46Å; R413-L417 WeakPolarHBondContact O-CB 3.25Å; R413-L417 VanDerWaalsContact O-CG 3.3Å; R413-L417 WeakPolarHBondContact O-CG 3.13Å; R413-L417 PolarHBondContact O-N 3.33Å
414	N	92.9	Very high	92.1	Very high	67 Å²	67	83.6 Å²	83.6	36%	0.358	40%	0.399	S	S	.	.	H	α-helix	trans	-63.7	-36.5	177.4	-72.9	-26.8	0	0	0	112.8	Q410 E411 R418	Q410-N414 WeakPolarHBondContact O-CB 3.13Å; Q410-N414 PolarHBondContact O-N 2.88Å; Q410-N414 PolarHBondContact O-ND2 2.86Å; E411-N414 WeakPolarHBondContact O-CB 3.47Å; E411-N414 PolarHBondContact O-N 2.96Å; E411-N414 VanDerWaalsContact O-N 3.14Å; N414-R418 WeakPolarHBondContact O-CG 3.34Å; N414-R418 PolarHBondContact O-N 2.9Å; N414-R418 VanDerWaalsContact O-N 3.16Å
415	V	96.4	Very high	92.6	Very high	60 Å²	60	85.8 Å²	85.8	36%	0.364	40%	0.4	S	S	.	.	H	α-helix	trans	-64.3	-50.1	172.9	170	0	0	0	0	110.5	E411 K412 R413 L417 R418 Q419	E411-V415 WeakPolarHBondContact O-CG2 3.37Å; E411-V415 PolarHBondContact O-N 2.81Å; K412-V415 PolarHBondContact O-N 3.25Å; R413-V415 VanDerWaalsContact C-N 3.35Å; R413-V415 PolarHBondContact O-N 3Å; V415-L417 VanDerWaalsContact C-N 3.34Å; V415-L417 PolarHBondContact O-N 3.2Å; V415-R418 PolarHBondContact O-N 3.16Å; V415-Q419 WeakPolarHBondContact O-CG 3.33Å; V415-Q419 PolarHBondContact O-N 2.69Å
416	L	95.6	Very high	93.1	Very high	11 Å²	11	83.1 Å²	83.1	6%	0.058	39%	0.389	C	S	.	.	H	α-helix	trans	-62.7	-37.6	178.6	-69.7	176.9	0	0	0	112.3	I327 Q330 L331 L334 K412 R413 Q419 L420	I327-L416 HydrophobicContact CG2-CB 4.18Å; I327-L416 HydrophobicContact CG2-CD2 4.27Å; I327-L416 VanDerWaalsContact CG2-O 3.31Å; I327-L416 WeakPolarHBondContact CG2-O 3.49Å; Q330-L416 HydrophobicContact CB-CD1 3.84Å; Q330-L416 HydrophobicContact CB-CD2 4.3Å; Q330-L416 VanDerWaalsContact OE1-CD2 3.32Å; L331-L416 HydrophobicContact CD1-CB 4.35Å; L331-L416 HydrophobicContact CD2-CB 3.67Å; L331-L416 HydrophobicContact CD2-CD1 4.16Å; L331-L416 HydrophobicContact CG-CB 3.84Å; L331-L416 HydrophobicContact CG-CD1 4.19Å; L334-L416 HydrophobicContact CD1-CD1 3.7Å; L334-L416 HydrophobicContact CG-CD1 4.48Å; K412-L416 WeakPolarHBondContact O-CG 3.39Å; K412-L416 PolarHBondContact O-N 2.81Å; R413-L416 PolarHBondContact O-N 2.8Å; L416-Q419 PolarHBondContact O-N 3.31Å; L416-L420 WeakPolarHBondContact O-CB 3.46Å; L416-L420 PolarHBondContact O-N 3.43Å
417	L	95.6	Very high	93.6	Very high	70 Å²	70	80.3 Å²	80.3	37%	0.366	38%	0.38	S	S	.	.	H	α-helix	trans	-63.9	-39.6	174.9	-73.3	170.9	0	0	0	112.4	L331 R413 V415 L420 Q421	L331-L417 HydrophobicContact CD1-CD2 3.96Å; L331-L417 HydrophobicContact CD2-CD2 4.3Å; L331-L417 HydrophobicContact CD2-CG 4.16Å; R413-L417 HydrophobicContact CG-CD1 4.03Å; R413-L417 HydrophobicContact CG-CG 4.46Å; R413-L417 WeakPolarHBondContact O-CB 3.25Å; R413-L417 VanDerWaalsContact O-CG 3.3Å; R413-L417 WeakPolarHBondContact O-CG 3.13Å; R413-L417 PolarHBondContact O-N 3.33Å; V415-L417 VanDerWaalsContact C-N 3.34Å; V415-L417 PolarHBondContact O-N 3.2Å; L417-L420 PolarHBondContact O-N 3.38Å; L417-Q421 PolarHBondContact O-N 3.5Å
418	R	95.9	Very high	94	Very high	157 Å²	157	80 Å²	80	59%	0.592	38%	0.383	S	S	*	.	H	α-helix	trans	-66.1	-41.4	172.6	-71.4	-171.6	-61.7	-107	3.6	112.1	N414 V415 L420 Q421 E422	N414-R418 WeakPolarHBondContact O-CG 3.34Å; N414-R418 PolarHBondContact O-N 2.9Å; N414-R418 VanDerWaalsContact O-N 3.16Å; V415-R418 PolarHBondContact O-N 3.16Å; R418-L420 VanDerWaalsContact C-N 3.34Å; R418-Q421 PolarHBondContact O-N 3.01Å; R418-E422 PolarHBondContact O-N 3.31Å; R418-E422 VanDerWaalsContact O-N 3.08Å
419	Q	96.1	Very high	94.3	Very high	95 Å²	95	80.5 Å²	80.5	44%	0.444	38%	0.377	S	S	.	.	H	α-helix	trans	-64	-39	174.9	-70.3	177.5	-4.8	0	0	111.8	I327 V415 L416 E422 A423	I327-Q419 HydrophobicContact CD1-CB 3.93Å; V415-Q419 WeakPolarHBondContact O-CG 3.33Å; V415-Q419 PolarHBondContact O-N 2.69Å; L416-Q419 PolarHBondContact O-N 3.31Å; Q419-E422 PolarHBondContact O-N 2.84Å; Q419-A423 VanDerWaalsContact O-CB 3.23Å; Q419-A423 WeakPolarHBondContact O-CB 3.36Å; Q419-A423 PolarHBondContact O-N 2.94Å
420	L	96.8	Very high	94.6	Very high	29 Å²	29	78.7 Å²	78.7	15%	0.152	37%	0.369	C	S	.	.	H	α-helix	trans	-63.9	-43.4	175.6	-177.3	60.5	0	0	0	111.5	V324 I327 Q328 L331 L416 L417 R418 T424	V324-L420 HydrophobicContact CB-CD1 4.48Å; V324-L420 HydrophobicContact CG1-CD1 3.89Å; I327-L420 HydrophobicContact CB-CD1 4.47Å; I327-L420 HydrophobicContact CG2-CB 3.78Å; I327-L420 HydrophobicContact CG2-CD1 4.36Å; Q328-L420 HydrophobicContact CG-CD1 3.85Å; Q328-L420 HydrophobicContact CG-CD2 4.32Å; L331-L420 HydrophobicContact CD1-CD2 3.82Å; L416-L420 WeakPolarHBondContact O-CB 3.46Å; L416-L420 PolarHBondContact O-N 3.43Å; L417-L420 PolarHBondContact O-N 3.38Å; R418-L420 VanDerWaalsContact C-N 3.34Å; L420-T424 VanDerWaalsContact O-CB 3.24Å; L420-T424 WeakPolarHBondContact O-CB 3.46Å; L420-T424 PolarHBondContact O-N 3.37Å; L420-T424 PolarHBondContact O-OG1 3.38Å
421	Q	96.4	Very high	94.8	Very high	146 Å²	146	77.4 Å²	77.4	68%	0.682	36%	0.363	S	S	*	.	H	α-helix	trans	-59.1	-47.6	175.7	-177.7	180	-5	0	0	111.2	L417 R418 T424 R425	L417-Q421 PolarHBondContact O-N 3.5Å; R418-Q421 PolarHBondContact O-N 3.01Å; Q421-T424 PolarHBondContact O-N 3.29Å; Q421-R425 PolarHBondContact O-N 2.93Å
422	E	95.7	Very high	94.8	Very high	79 Å²	79	76 Å²	76	37%	0.369	37%	0.365	S	S	.	.	H	α-helix	trans	-70.2	-43	179.9	-179.1	55	-159.4	0	0	112.5	R418 Q419 T424 R425 I426	R418-E422 PolarHBondContact O-N 3.31Å; R418-E422 VanDerWaalsContact O-N 3.08Å; Q419-E422 PolarHBondContact O-N 2.84Å; E422-T424 PolarHBondContact O-N 3.18Å; E422-R425 WeakPolarHBondContact O-CB 3.15Å; E422-R425 PolarHBondContact O-N 3.38Å; E422-R425 VanDerWaalsContact O-N 3.09Å; E422-R425 IonicContact OE1-CZ 2.81Å; E422-R425 IonicContact OE1-NE 3.83Å; E422-R425 PolarHBondContact OE1-NE 2.86Å; E422-R425 IonicContact OE1-NH2 2.78Å; E422-R425 PolarHBondContact OE1-NH2 3.31Å; E422-R425 IonicContact OE2-CZ 2.73Å; E422-R425 IonicContact OE2-NE 2.68Å; E422-R425 PolarHBondContact OE2-NE 3.36Å; E422-R425 IonicContact OE2-NH2 2.75Å; E422-I426 HydrophobicContact CG-CD1 4.08Å; E422-I426 WeakPolarHBondContact O-CG1 3.44Å; E422-I426 PolarHBondContact O-N 3.03Å
423	A	94.7	Very high	94.7	Very high	12 Å²	12	74.4 Å²	74.4	10%	0.099	36%	0.359	C	S	.	.	H	α-helix	trans	-60.5	-35.8	174	0	0	0	0	0	111.7	V324 I327 Q419 T427	V324-A423 HydrophobicContact CG2-CB 3.67Å; I327-A423 HydrophobicContact CD1-CB 3.98Å; Q419-A423 VanDerWaalsContact O-CB 3.23Å; Q419-A423 WeakPolarHBondContact O-CB 3.36Å; Q419-A423 PolarHBondContact O-N 2.94Å; A423-T427 VanDerWaalsContact O-CB 3.29Å; A423-T427 WeakPolarHBondContact O-CB 3.32Å; A423-T427 PolarHBondContact O-N 2.94Å; A423-T427 PolarHBondContact O-OG1 2.86Å
424	T	95.3	Very high	94.4	Very high	59 Å²	59	70.9 Å²	70.9	36%	0.362	35%	0.347	S	S	.	.	H	α-helix	trans	-70.2	-38.4	173.7	-56.3	0	0	0	0	111.7	L420 Q421 E422 T427 T428	L420-T424 VanDerWaalsContact O-CB 3.24Å; L420-T424 WeakPolarHBondContact O-CB 3.46Å; L420-T424 PolarHBondContact O-N 3.37Å; L420-T424 PolarHBondContact O-OG1 3.38Å; Q421-T424 PolarHBondContact O-N 3.29Å; E422-T424 PolarHBondContact O-N 3.18Å; T424-T427 PolarHBondContact O-N 3.13Å; T424-T428 HydrophobicContact CG2-CG2 4.45Å; T424-T428 WeakPolarHBondContact O-CB 3.4Å; T424-T428 WeakPolarHBondContact O-CG2 3.34Å; T424-T428 PolarHBondContact O-N 3.48Å; T424-T428 PolarHBondContact O-OG1 2.77Å
425	R	96.9	Very high	94.1	Very high	140 Å²	140	74.6 Å²	74.6	53%	0.528	36%	0.36	S	S	.	.	H	α-helix	trans	-62.2	-43.8	173.8	-166.6	-170.1	71.6	84.4	2.7	111.5	Q421 E422 T428 Y429	Q421-R425 PolarHBondContact O-N 2.93Å; E422-R425 WeakPolarHBondContact O-CB 3.15Å; E422-R425 PolarHBondContact O-N 3.38Å; E422-R425 VanDerWaalsContact O-N 3.09Å; E422-R425 IonicContact OE1-CZ 2.81Å; E422-R425 IonicContact OE1-NE 3.83Å; E422-R425 PolarHBondContact OE1-NE 2.86Å; E422-R425 IonicContact OE1-NH2 2.78Å; E422-R425 PolarHBondContact OE1-NH2 3.31Å; E422-R425 IonicContact OE2-CZ 2.73Å; E422-R425 IonicContact OE2-NE 2.68Å; E422-R425 PolarHBondContact OE2-NE 3.36Å; E422-R425 IonicContact OE2-NH2 2.75Å; R425-T428 PolarHBondContact O-OG1 3.24Å; R425-T428 VanDerWaalsContact O-OG1 3.09Å; R425-Y429 WeakPolarHBondContact O-CB 3.36Å; R425-Y429 PolarHBondContact O-N 2.98Å
426	I	95.1	Very high	93.4	Very high	68 Å²	68	74.7 Å²	74.7	35%	0.349	36%	0.363	S	S	.	.	H	α-helix	trans	-65.3	-47.2	175.7	-66.5	165.7	0	0	0	110.4	A320 E422 T428 Y429 L430	A320-I426 HydrophobicContact CB-CG2 4.07Å; E422-I426 HydrophobicContact CG-CD1 4.08Å; E422-I426 WeakPolarHBondContact O-CG1 3.44Å; E422-I426 PolarHBondContact O-N 3.03Å; I426-T428 PolarHBondContact O-N 3.33Å; I426-Y429 PolarHBondContact O-N 3.31Å; I426-L430 HydrophobicContact CG2-CD1 3.77Å; I426-L430 HydrophobicContact CG2-CG 4.36Å; I426-L430 WeakPolarHBondContact O-CG 3.24Å; I426-L430 PolarHBondContact O-N 3.34Å
427	T	95.3	Very high	92.5	Very high	18 Å²	18	77.6 Å²	77.6	11%	0.11	38%	0.378	C	S	.	.	H	α-helix	trans	-60	-43	179.2	-58.3	0	0	0	0	112	Y317 A320 K321 A423 T424 H431	Y317-T427 HydrophobicContact CD2-CG2 4.01Å; Y317-T427 HydrophobicContact CE2-CG2 3.61Å; A320-T427 WeakPolarHBondContact CB-OG1 3.09Å; A320-T427 PolarHBondContact O-OG1 2.72Å; K321-T427 HydrophobicContact CB-CG2 4.37Å; A423-T427 VanDerWaalsContact O-CB 3.29Å; A423-T427 WeakPolarHBondContact O-CB 3.32Å; A423-T427 PolarHBondContact O-N 2.94Å; A423-T427 PolarHBondContact O-OG1 2.86Å; T424-T427 PolarHBondContact O-N 3.13Å; T427-H431 WeakPolarHBondContact O-CB 3.33Å; T427-H431 PolarHBondContact O-N 3.1Å
428	T	94.1	Very high	91.3	Very high	84 Å²	84	76.6 Å²	76.6	52%	0.515	38%	0.377	S	S	.	.	H	α-helix	trans	-71.9	-34.8	177.9	49.5	0	0	0	0	112.8	T424 R425 I426 S432	T424-T428 HydrophobicContact CG2-CG2 4.45Å; T424-T428 WeakPolarHBondContact O-CB 3.4Å; T424-T428 WeakPolarHBondContact O-CG2 3.34Å; T424-T428 PolarHBondContact O-N 3.48Å; T424-T428 PolarHBondContact O-OG1 2.77Å; R425-T428 PolarHBondContact O-OG1 3.24Å; R425-T428 VanDerWaalsContact O-OG1 3.09Å; I426-T428 PolarHBondContact O-N 3.33Å; T428-S432 WeakPolarHBondContact O-CB 3.49Å; T428-S432 PolarHBondContact O-N 3.38Å
429	Y	95.9	Very high	89.3	Confident	125 Å²	125	72 Å²	72	49%	0.49	37%	0.372	S	S	.	.	H	α-helix	trans	-62.2	-49.8	171.1	174.2	-96.4	0	0	0	112.1	R425 I426 H431 S432 Q433	R425-Y429 WeakPolarHBondContact O-CB 3.36Å; R425-Y429 PolarHBondContact O-N 2.98Å; I426-Y429 PolarHBondContact O-N 3.31Å; Y429-H431 VanDerWaalsContact C-N 3.34Å; Y429-H431 PolarHBondContact O-N 2.92Å; Y429-S432 WeakPolarHBondContact O-CB 3.31Å; Y429-S432 PolarHBondContact O-N 3.35Å; Y429-S432 VanDerWaalsContact O-N 3.14Å; Y429-Q433 HydrophobicContact CE1-CG 4.4Å; Y429-Q433 PolarHBondContact O-N 3.37Å; Y429-Q433 PolarHBondContact OH-NE2 3.42Å; Y429-Q433 VanDerWaalsContact OH-NE2 3.09Å
430	L	93.8	Very high	87.2	Confident	14 Å²	14	71.1 Å²	71.1	7%	0.073	38%	0.377	C	S	.	.	H	α-helix	trans	-63.8	-38.6	178.1	-66.9	170	0	0	0	111.7	L313 Q316 Y317 A320 I426 S432 Q433 L434	L313-L430 HydrophobicContact CD1-CD2 3.59Å; L313-L430 HydrophobicContact CG-CD2 4.5Å; Q316-L430 HydrophobicContact CB-CD1 4.07Å; Q316-L430 HydrophobicContact CB-CD2 4.39Å; Y317-L430 HydrophobicContact CD2-CB 4.24Å; A320-L430 HydrophobicContact CB-CD1 4.02Å; I426-L430 HydrophobicContact CG2-CD1 3.77Å; I426-L430 HydrophobicContact CG2-CG 4.36Å; I426-L430 WeakPolarHBondContact O-CG 3.24Å; I426-L430 PolarHBondContact O-N 3.34Å; L430-S432 VanDerWaalsContact C-N 3.35Å; L430-S432 PolarHBondContact O-N 2.86Å; L430-Q433 PolarHBondContact O-N 2.96Å; L430-L434 WeakPolarHBondContact O-CG 3.25Å; L430-L434 PolarHBondContact O-N 2.79Å
431	H	92	Very high	84.8	Confident	90 Å²	90	73.9 Å²	73.9	42%	0.417	40%	0.399	S	S	.	.	H	α-helix	trans	-60.9	-42.2	172	-172.7	80.7	0	0	0	112.3	Y317 T427 Y429 Q433 L434 K435	Y317-H431 HydrophobicContact CD2-CB 4.15Å; Y317-H431 HydrophobicContact CE2-CB 3.73Å; Y317-H431 AromaticContact CE2-ND1 3.97Å; Y317-H431 AromaticContact CZ-ND1 3.88Å; T427-H431 WeakPolarHBondContact O-CB 3.33Å; T427-H431 PolarHBondContact O-N 3.1Å; Y429-H431 VanDerWaalsContact C-N 3.34Å; Y429-H431 PolarHBondContact O-N 2.92Å; H431-Q433 VanDerWaalsContact C-N 3.35Å; H431-Q433 PolarHBondContact O-N 3.4Å; H431-L434 PolarHBondContact O-N 3.27Å; H431-K435 VanDerWaalsContact O-CB 3.31Å; H431-K435 WeakPolarHBondContact O-CB 3.47Å; H431-K435 PolarHBondContact O-N 2.87Å
432	S	90.9	Very high	82.2	Confident	76 Å²	76	74.2 Å²	74.2	53%	0.531	40%	0.404	S	S	.	.	H	α-helix	trans	-61.4	-42.3	176.3	-167.1	0	0	0	0	111.7	T428 Y429 L430 K435 S436	T428-S432 WeakPolarHBondContact O-CB 3.49Å; T428-S432 PolarHBondContact O-N 3.38Å; Y429-S432 WeakPolarHBondContact O-CB 3.31Å; Y429-S432 PolarHBondContact O-N 3.35Å; Y429-S432 VanDerWaalsContact O-N 3.14Å; L430-S432 VanDerWaalsContact C-N 3.35Å; L430-S432 PolarHBondContact O-N 2.86Å; S432-K435 PolarHBondContact O-N 2.88Å; S432-S436 PolarHBondContact O-N 2.85Å
433	Q	90.8	Very high	79.3	Confident	71 Å²	71	75.8 Å²	75.8	33%	0.332	42%	0.42	S	S	.	.	H	α-helix	trans	-69.6	-39.6	175.7	-70.3	-158.2	-28	0	0	113.4	L313 Y429 L430 H431 K435 S436 L437	L313-Q433 HydrophobicContact CD1-CB 4.45Å; L313-Q433 HydrophobicContact CD2-CB 3.7Å; Y429-Q433 HydrophobicContact CE1-CG 4.4Å; Y429-Q433 PolarHBondContact O-N 3.37Å; Y429-Q433 PolarHBondContact OH-NE2 3.42Å; Y429-Q433 VanDerWaalsContact OH-NE2 3.09Å; L430-Q433 PolarHBondContact O-N 2.96Å; H431-Q433 VanDerWaalsContact C-N 3.35Å; H431-Q433 PolarHBondContact O-N 3.4Å; Q433-K435 PolarHBondContact O-N 2.75Å; Q433-S436 WeakPolarHBondContact CA-OG 3.26Å; Q433-S436 PolarHBondContact O-N 2.99Å; Q433-S436 PolarHBondContact O-OG 2.93Å; Q433-L437 WeakPolarHBondContact O-CB 3.3Å; Q433-L437 WeakPolarHBondContact O-CG 3.49Å; Q433-L437 PolarHBondContact O-N 2.92Å
434	L	87.3	Confident	76.6	Confident	18 Å²	18	81.6 Å²	81.6	9%	0.094	45%	0.453	C	S	.	.	H	α-helix	trans	-60.4	-37.5	172.6	-77.6	165.2	0	0	0	111.8	L313 N314 Y317 L430 H431 S438	L313-L434 HydrophobicContact CB-CD2 4.14Å; L313-L434 HydrophobicContact CD2-CB 4.48Å; L313-L434 HydrophobicContact CD2-CD2 3.84Å; L313-L434 HydrophobicContact CD2-CG 3.75Å; L313-L434 HydrophobicContact CG-CD2 4.07Å; L313-L434 HydrophobicContact CG-CG 4Å; N314-L434 HydrophobicContact CB-CD2 3.98Å; Y317-L434 HydrophobicContact CD1-CD1 3.89Å; Y317-L434 HydrophobicContact CD2-CD1 4.31Å; Y317-L434 HydrophobicContact CG-CD1 3.64Å; L430-L434 WeakPolarHBondContact O-CG 3.25Å; L430-L434 PolarHBondContact O-N 2.79Å; H431-L434 PolarHBondContact O-N 3.27Å; L434-S438 VanDerWaalsContact O-CB 3.28Å; L434-S438 WeakPolarHBondContact O-CB 3.22Å; L434-S438 PolarHBondContact O-N 2.95Å; L434-S438 VanDerWaalsContact O-N 3.09Å; L434-S438 PolarHBondContact O-OG 2.89Å
435	K	85.9	Confident	73.5	Confident	145 Å²	145	84.4 Å²	84.4	63%	0.63	48%	0.475	S	S	*	.	H	α-helix	trans	-71.4	-39.8	177	-170	172.1	-177.1	175	0	112.4	H431 S432 Q433 S438 A439	H431-K435 VanDerWaalsContact O-CB 3.31Å; H431-K435 WeakPolarHBondContact O-CB 3.47Å; H431-K435 PolarHBondContact O-N 2.87Å; S432-K435 PolarHBondContact O-N 2.88Å; Q433-K435 PolarHBondContact O-N 2.75Å; K435-S438 PolarHBondContact O-N 2.93Å; K435-A439 WeakPolarHBondContact O-CB 3.41Å; K435-A439 PolarHBondContact O-N 3.4Å
436	S	81.7	Confident	70.3	Confident	61 Å²	61	84 Å²	84	43%	0.427	49%	0.494	S	S	.	.	H	α-helix	trans	-67.9	-47.6	176.2	66.4	0	0	0	0	111.8	S432 Q433 S438 A439 S440	S432-S436 PolarHBondContact O-N 2.85Å; Q433-S436 WeakPolarHBondContact CA-OG 3.26Å; Q433-S436 PolarHBondContact O-N 2.99Å; Q433-S436 PolarHBondContact O-OG 2.93Å; S436-S438 VanDerWaalsContact C-N 3.25Å; S436-S438 PolarHBondContact O-N 3.28Å; S436-A439 WeakPolarHBondContact O-CB 3.37Å; S436-A439 PolarHBondContact O-N 3.38Å; S436-S440 PolarHBondContact O-N 3.32Å; S436-S440 PolarHBondContact O-OG 2.9Å
437	L	75.4	Confident	67.2	Low	72 Å²	72	85.8 Å²	85.8	38%	0.377	51%	0.513	S	S	.	.	H	α-helix	trans	-58.5	-37.1	175.2	-69.1	178.3	0	0	0	112.3	L313 Q433 S441	L313-L437 HydrophobicContact CD2-CD1 3.68Å; Q433-L437 WeakPolarHBondContact O-CB 3.3Å; Q433-L437 WeakPolarHBondContact O-CG 3.49Å; Q433-L437 PolarHBondContact O-N 2.92Å; L437-S441 PolarHBondContact O-OG 3.09Å
438	S	70.7	Confident	64.3	Low	50 Å²	50	90.3 Å²	90.3	35%	0.35	55%	0.545	S	S	.	.	H	α-helix	trans	-75.4	-22.2	177	-57.4	0	0	0	0	113.6	K310 L434 K435 S436	K310-S438 PolarHBondContact NZ-OG 3.41Å; L434-S438 VanDerWaalsContact O-CB 3.28Å; L434-S438 WeakPolarHBondContact O-CB 3.22Å; L434-S438 PolarHBondContact O-N 2.95Å; L434-S438 VanDerWaalsContact O-N 3.09Å; L434-S438 PolarHBondContact O-OG 2.89Å; K435-S438 PolarHBondContact O-N 2.93Å; S436-S438 VanDerWaalsContact C-N 3.25Å; S436-S438 PolarHBondContact O-N 3.28Å
439	A	55.1	Low	61.3	Low	59 Å²	59	92 Å²	92	49%	0.488	56%	0.561	S	S	.	*	H	α-helix	trans	-79	-37.2	171.1	0	0	0	0	0	112	K435 S436 S441 L442	K435-A439 WeakPolarHBondContact O-CB 3.41Å; K435-A439 PolarHBondContact O-N 3.4Å; S436-A439 WeakPolarHBondContact O-CB 3.37Å; S436-A439 PolarHBondContact O-N 3.38Å; A439-S441 PolarHBondContact O-N 2.99Å; A439-L442 PolarHBondContact O-N 2.91Å; A439-L442 VanDerWaalsContact O-N 3.13Å
440	S	51	Low	58.4	Low	77 Å²	77	98.1 Å²	98.1	54%	0.538	58%	0.583	S	S	.	*	H	α-helix	trans	-62	-24.2	178.8	-62.6	0	0	0	0	114.1	S436 L442 T443	S436-S440 PolarHBondContact O-N 3.32Å; S436-S440 PolarHBondContact O-OG 2.9Å; S440-L442 PolarHBondContact O-N 2.78Å; S440-T443 PolarHBondContact O-OG1 3.39Å
441	S	47.7	Very low	55.6	Low	87 Å²	87	100.9 Å²	100.9	61%	0.608	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-8.5	174.8	-56.1	0	0	0	0	114.7	L437 A439	L437-S441 PolarHBondContact O-OG 3.09Å; A439-S441 PolarHBondContact O-N 2.99Å
442	L	40.8	Very low	52.6	Low	153 Å²	153	102.6 Å²	102.6	80%	0.801	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	5.4	-176.9	-66.8	175.2	0	0	0	114.3	A439 S440	A439-L442 PolarHBondContact O-N 2.91Å; A439-L442 VanDerWaalsContact O-N 3.13Å; S440-L442 PolarHBondContact O-N 2.78Å
443	T	35.2	Very low	50	Low	113 Å²	113	107.3 Å²	107.3	69%	0.693	66%	0.655	S	S	*	*			trans	-122.1	79.7	-178.2	52.9	0	0	0	0	112.6	S440	S440-T443 PolarHBondContact O-OG1 3.39Å
444	V	38.6	Very low	47.1	Very low	133 Å²	133	108.4 Å²	108.4	81%	0.806	68%	0.676	S	S	*	*			trans	-123.8	87.5	171.2	-173	0	0	0	0	110
445	S	28.8	Very low	44.4	Very low	118 Å²	118	113.2 Å²	113.2	83%	0.825	71%	0.711	S	S	*	*			trans	-169.2	91.6	164.9	-86.7	0	0	0	0	112.9
446	S	29.5	Very low	41.8	Very low	132 Å²	132	110.2 Å²	110.2	92%	0.923	71%	0.709	S	S	*	*			trans	-176.3	137.5	137.4	-81.9	0	0	0	0	109.5
447	S	31.2	Very low	39.8	Very low	105 Å²	105	118.8 Å²	118.8	73%	0.734	73%	0.732	S	S	*	*			trans	-111.7	174	-178.5	64.7	0	0	0	0	111.5
448	S	34.5	Very low	37.8	Very low	113 Å²	113	119 Å²	119	79%	0.79	75%	0.751	S	S	*	*			trans	77.2	144.3	175.8	-38	0	0	0	0	113.9
449	S	31.1	Very low	35.9	Very low	121 Å²	121	122 Å²	122	85%	0.846	77%	0.772	S	S	*	*			cis	-140.6	170.9	9.6	-115.9	0	0	0	0	113.1
450	R	34.9	Very low	34.9	Very low	252 Å²	252	127.5 Å²	127.5	95%	0.951	79%	0.792	S	S	*	*			trans	-83.2	125.3	-171.5	-59.8	162.9	73.4	117.9	-3.1	112.6
451	G	35.3	Very low	34	Very low	73 Å²	73	130.8 Å²	130.8	75%	0.753	81%	0.809	S	S	*	*			trans	71.4	116.8	145.3	0	0	0	0	0	119.2
452	S	29.2	Very low	33.2	Very low	125 Å²	125	131.1 Å²	131.1	87%	0.874	81%	0.812	S	S	*	*			trans	-156.5	146.3	143.6	-81.7	0	0	0	0	109.8
453	L	34.9	Very low	32.8	Very low	176 Å²	176	129.8 Å²	129.8	92%	0.921	82%	0.815	S	S	*	*			trans	-103.5	166.4	174	-70.8	170.5	0	0	0	110
454	A	30.7	Very low	32.8	Very low	93 Å²	93	136 Å²	136	77%	0.769	83%	0.826	S	S	*	*			trans	71.4	110.5	164.2	0	0	0	0	0	119.2
455	S	30.9	Very low	32.5	Very low	119 Å²	119	133 Å²	133	83%	0.832	82%	0.822	S	S	*	*				70.7	154.3	121.8	-154.9	0	0	0	0	122.1
456	S	31.7	Very low	32.5	Very low	82 Å²	82	133 Å²	133	57%	0.573	82%	0.822	S	S	*	*			trans	76.1	106	152.1	-179.7	0	0	0	0	120.7
457	R	38.8	Very low	32.5	Very low	242 Å²	242	135.4 Å²	135.4	91%	0.913	82%	0.824	S	S	*	*			trans	63.8	114.7	136.8	-62.9	173.5	167.8	144	-7.5	120
458	G	33.5	Very low	32.4	Very low	75 Å²	75	135.9 Å²	135.9	77%	0.773	83%	0.827	S	S	*	*				125.7	149.4	119.3	0	0	0	0	0	119
459	S	30.3	Very low	32.2	Very low	115 Å²	115	135.6 Å²	135.6	80%	0.804	83%	0.825	S	S	*	*			trans	68	95.7	153.8	-57.5	0	0	0	0	120.7
460	L	33.7	Very low	32.2	Very low	173 Å²	173	137.8 Å²	137.8	91%	0.906	83%	0.825	S	S	*	*				32.7	117.9	120.4	-55.5	173.5	0	0	0	119.1
461	T	33.6	Very low	32.1	Very low	146 Å²	146	131.6 Å²	131.6	90%	0.896	82%	0.821	S	S	*	*				-168.1	160.8	117.3	-168.5	0	0	0	0	113.4
462	S	30.4	Very low	31.7	Very low	94 Å²	94	137.6 Å²	137.6	66%	0.657	83%	0.827	S	S	*	*			trans	-48.5	141.9	-178.3	178.8	0	0	0	0	117.4
463	S	32.5	Very low	31.8	Very low	125 Å²	125	136.1 Å²	136.1	87%	0.874	82%	0.816	S	S	*	*			trans	-154.2	144.1	141.1	-80.1	0	0	0	0	110
464	R	35.2	Very low	31.6	Very low	244 Å²	244	134.3 Å²	134.3	92%	0.921	81%	0.807	S	S	*	*			trans	-102.8	134.7	-172.7	-62.6	167.8	88.8	142.5	0.9	111.5
465	G	31	Very low	31.6	Very low	71 Å²	71	136.9 Å²	136.9	73%	0.732	81%	0.807	S	S	*	*			trans	94.9	93.2	148	0	0	0	0	0	117.7
466	S	30.2	Very low	31.6	Very low	118 Å²	118	142.3 Å²	142.3	83%	0.825	81%	0.81	S	S	*	*			trans	-162.8	116.3	144.2	-82.2	0	0	0	0	108.5
467	L	29.6	Very low	31.4	Very low	182 Å²	182	142.1 Å²	142.1	95%	0.953	82%	0.822	S	S	*	*			trans	-129.2	100.2	177.3	-74.8	179.8	0	0	0	109.8
468	S	29	Very low	31.3	Very low	114 Å²	114	136.7 Å²	136.7	80%	0.797	82%	0.815	S	S	*	*			trans	-157.5	62.2	174	56.3	0	0	0	0	113.5
469	S	29.7	Very low	31.6	Very low	108 Å²	108	138.4 Å²	138.4	76%	0.755	81%	0.813	S	S	*	*			trans	-169.6	114.6	146.4	31.3	0	0	0	0	114.7
470	I	32.1	Very low	31.5	Very low	166 Å²	166	140.6 Å²	140.6	85%	0.851	81%	0.81	S	S	*	*			trans	39	112.7	130.3	-43.3	156.3	0	0	0	118.9
471	S	31.3	Very low	31.2	Very low	122 Å²	122	141.7 Å²	141.7	85%	0.853	80%	0.804	S	S	*	*				-171.5	152.9	120.3	55.5	0	0	0	0	111.9
472	F	28.6	Very low	30.9	Very low	200 Å²	200	141.6 Å²	141.6	88%	0.877	79%	0.793	S	S	*	*			trans	-126.8	129	175	-180	-81.2	0	0	0	108.6
473	S	31	Very low	30.8	Very low	93 Å²	93	147.2 Å²	147.2	65%	0.65	80%	0.8	S	S	*	*			trans	174.5	166.6	146.4	-91.1	0	0	0	0	110.5
474	D	29.3	Very low	30.6	Very low	139 Å²	139	148.8 Å²	148.8	74%	0.743	79%	0.793	S	S	*	*			trans	64.1	95.1	171	-54.2	-15.8	0	0	0	116.3
475	I	31	Very low	30.1	Very low	147 Å²	147	145.9 Å²	145.9	75%	0.754	79%	0.79	S	S	*	*				86.8	107.5	64.5	-67.4	167.2	0	0	0	113.2
476	Y	31	Very low	30	Very low	232 Å²	232	145.8 Å²	145.8	91%	0.91	79%	0.789	S	S	*	*			trans	21.2	118.3	155.1	-67.2	-89.8	0	0	0	120.9
477	G	27.3	Very low	29.8	Very low	79 Å²	79	145.2 Å²	145.2	81%	0.814	79%	0.792	S	S	*	*			trans	-160.6	93.9	164.1	0	0	0	0	0	113.2
478	V	36.3	Very low	29.7	Very low	128 Å²	128	141.5 Å²	141.5	78%	0.776	79%	0.787	S	S	*	*			trans	-109.7	128.7	174.1	167	0	0	0	0	107.7
479	P	40.4	Very low	29.6	Very low	110 Å²	110	144.9 Å²	144.9	71%	0.714	79%	0.79	S	S	*	*				-151.3	132.9	107.5	35.8	-16.5	0	0	0	118
480	Q	27.8	Very low	30.3	Very low	161 Å²	161	144.5 Å²	144.5	75%	0.752	79%	0.785	S	S	*	*				44.9	122.9	123.6	-59.9	-167.8	-10.8	0	0	124.3
481	Y	28.1	Very low	30.1	Very low	196 Å²	196	144.1 Å²	144.1	77%	0.769	78%	0.784	S	S	*	*				69.7	134.7	125.9	-84.3	-99.3	0	0	0	124.8
482	E	27.2	Very low	29.9	Very low	145 Å²	145	144 Å²	144	68%	0.678	77%	0.774	S	S	*	*			trans	54	137.7	150.1	-77.8	170.9	-156	0	0	120
483	R	27.4	Very low	30.9	Very low	212 Å²	212	139.2 Å²	139.2	80%	0.8	76%	0.763	S	S	*	*				-154.9	144.4	50.6	-158.4	165	-78.4	172.4	-0.7	108.7
484	H	29.5	Very low	31.1	Very low	157 Å²	157	142.5 Å²	142.5	73%	0.727	77%	0.767	S	S	*	*				45.6	129.1	81.2	-98.7	-81	0	0	0	112
485	E	24.8	Very low	31.2	Very low	183 Å²	183	141 Å²	141	86%	0.855	76%	0.763	S	S	*	*			cis	-143.3	175.2	16.7	-66.9	174.4	119.2	0	0	109.7
486	G	27.6	Very low	31.3	Very low	69 Å²	69	143.2 Å²	143.2	71%	0.711	76%	0.762	S	S	*	*			cis	169.5	177	-6.5	0	0	0	0	0	113.6
487	A	26.9	Very low	31.3	Very low	107 Å²	107	140.7 Å²	140.7	88%	0.884	75%	0.752	S	S	*	*			trans	46.5	111.2	153.2	0	0	0	0	0	122.3
488	A	26.6	Very low	31.2	Very low	103 Å²	103	143.7 Å²	143.7	85%	0.851	75%	0.749	S	S	*	*				-172.8	120.2	124	0	0	0	0	0	112.9
489	E	27.8	Very low	30.8	Very low	185 Å²	185	145.5 Å²	145.5	86%	0.864	75%	0.753	S	S	*	*			trans	-79.4	176.4	151.8	-111.3	-167.7	159.2	0	0	109.1
490	P	43.3	Very low	31.6	Very low	101 Å²	101	145.4 Å²	145.4	66%	0.656	75%	0.753	S	S	*	*			cis	-147.9	177.9	26	42.3	-21.3	0	0	0	119.4
491	L	28	Very low	32.5	Very low	158 Å²	158	143 Å²	143	83%	0.827	75%	0.751	S	S	*	*			trans	83.8	125.1	140.4	-84.4	160.4	0	0	0	124.9
492	D	27.9	Very low	32.5	Very low	120 Å²	120	142.2 Å²	142.2	64%	0.642	75%	0.754	S	S	*	*			trans	-62	177.1	154.8	-153.2	39.9	0	0	0	111	H494	D492-H494 IonicContact OD2-ND1 3.58Å
493	P	48.8	Very low	32.6	Very low	98 Å²	98	140.2 Å²	140.2	64%	0.636	76%	0.756	S	S	*	*			cis	-160.8	159.7	44.7	43.5	-18.1	0	0	0	125.3
494	H	35.9	Very low	32.8	Very low	162 Å²	162	134.4 Å²	134.4	75%	0.75	75%	0.753	S	S	*	*			trans	75.4	165.2	144.3	-66	4.7	0	0	0	119.1	D492	D492-H494 IonicContact OD2-ND1 3.58Å
495	V	32.1	Very low	32.6	Very low	109 Å²	109	131.5 Å²	131.5	66%	0.661	75%	0.751	S	S	*	*			cis	-159.6	120.3	45	172.5	0	0	0	0	115.7
496	R	32	Very low	32.9	Very low	193 Å²	193	133.3 Å²	133.3	73%	0.728	75%	0.75	S	S	*	*			trans	61.8	172.4	147	-52.4	174.6	-165.3	165.4	7.1	120.6
497	Y	31	Very low	32.8	Very low	178 Å²	178	135.8 Å²	135.8	70%	0.698	75%	0.747	S	S	*	*			cis	-159.7	156.6	18.8	-118.5	-46.1	0	0	0	115.8
498	L	26.6	Very low	32.6	Very low	142 Å²	142	135.8 Å²	135.8	74%	0.743	74%	0.739	S	S	*	*			trans	71.2	96	149.6	-61	178.7	0	0	0	126.2
499	L	28	Very low	32.4	Very low	167 Å²	167	135.7 Å²	135.7	87%	0.874	73%	0.733	S	S	*	*				38.1	161.8	112.4	-68.6	173.4	0	0	0	126.6
500	P	56	Low	32.3	Very low	108 Å²	108	133 Å²	133	70%	0.701	73%	0.728	S	S	*	*			trans	-117.7	-162.1	-158.8	45.4	-33.6	0	0	0	116.2
501	P	46.9	Very low	31.4	Very low	110 Å²	110	135.4 Å²	135.4	71%	0.714	74%	0.735	S	S	*	*				-154.1	163.4	109.6	40.7	-23.2	0	0	0	119.6
502	E	28	Very low	31.2	Very low	180 Å²	180	132.9 Å²	132.9	84%	0.841	73%	0.731	S	S	*	*			trans	57.8	160	146.6	-73.9	-174.6	-142.4	0	0	122.9
503	S	30.4	Very low	31.5	Very low	102 Å²	102	133.2 Å²	133.2	71%	0.713	74%	0.739	S	S	*	*			cis	-169.9	177.7	-25.8	63.5	0	0	0	0	107.1
504	A	31.5	Very low	30.4	Very low	90 Å²	90	135.3 Å²	135.3	74%	0.744	74%	0.74	S	S	*	*			cis	-159.4	-163.8	-2.1	0	0	0	0	0	106.8
505	S	25.6	Very low	29.9	Very low	96 Å²	96	136.9 Å²	136.9	67%	0.671	74%	0.741	S	S	*	*			cis	-173.9	149.9	-13.4	50.5	0	0	0	0	111.5
506	R	31.3	Very low	29.7	Very low	221 Å²	221	139 Å²	139	83%	0.834	75%	0.748	S	S	*	*			trans	70.4	149.5	147.4	-74.1	179.5	161.5	147.8	4.7	121.3
507	D	23.5	Very low	29.3	Very low	121 Å²	121	134 Å²	134	65%	0.647	75%	0.748	S	S	*	*			cis	-154	171.1	0.4	-123.6	-35.8	0	0	0	116.3
508	C	23.5	Very low	29	Very low	107 Å²	107	133.5 Å²	133.5	72%	0.723	75%	0.752	S	S	*	*			trans	-25.9	169.8	167.3	-62.5	0	0	0	0	121.2
509	S	23.3	Very low	29	Very low	102 Å²	102	130 Å²	130	71%	0.713	74%	0.739	S	S	*	*			cis	-174.5	157.6	-17.8	-82.4	0	0	0	0	107.9
510	V	25	Very low	28.9	Very low	127 Å²	127	129.8 Å²	129.8	77%	0.77	73%	0.732	S	S	*	*				171.5	131.5	87.2	162	0	0	0	0	111.2
511	L	25.2	Very low	27.6	Very low	152 Å²	152	129.8 Å²	129.8	80%	0.796	73%	0.734	S	S	*	*			trans	30.3	118.3	150.5	-55.6	174.6	0	0	0	125.1
512	S	23	Very low	26.7	Very low	106 Å²	106	132.9 Å²	132.9	74%	0.741	74%	0.736	S	S	*	*				47.8	154.2	113	-76.3	0	0	0	0	123.6
513	P	34.3	Very low	26.6	Very low	127 Å²	127	133.7 Å²	133.7	83%	0.825	73%	0.732	S	S	*	*			cis	-130.9	-173.9	30.9	41.6	-23.9	0	0	0	118.3
514	E	25.7	Very low	26.4	Very low	141 Å²	141	134.1 Å²	134.1	66%	0.659	73%	0.734	S	S	*	*			trans	-83.3	168	-161.1	-59.9	172.1	104	0	0	114.1
515	Y	24.8	Very low	26.2	Very low	195 Å²	195	135.6 Å²	135.6	77%	0.765	73%	0.726	S	S	*	*				-165.4	172.6	57	-75	-72.8	0	0	0	111.1
516	L	27.5	Very low	26.1	Very low	154 Å²	154	136.6 Å²	136.6	81%	0.806	72%	0.724	S	S	*	*			cis	-156.7	-176.3	4.2	-132.4	177.1	0	0	0	110.3
517	A	25.4	Very low	26	Very low	88 Å²	88	131.8 Å²	131.8	73%	0.727	72%	0.719	S	S	*	*			trans	55.3	80.3	148.1	0	0	0	0	0	120.1
518	Q	24.3	Very low	26.9	Very low	167 Å²	167	131.9 Å²	131.9	78%	0.78	73%	0.726	S	S	*	*			trans	-74.8	169.7	148.5	-80.1	-166.2	49.3	0	0	112
519	S	25.8	Very low	27.1	Very low	69 Å²	69	135.3 Å²	135.3	48%	0.483	73%	0.732	S	S	.	*			cis	174.8	165.3	-29.8	67.3	0	0	0	0	111.4
520	K	25.9	Very low	27.4	Very low	163 Å²	163	135.2 Å²	135.2	71%	0.709	73%	0.731	S	S	*	*			trans	69.1	167.3	155.8	-59.7	153.7	-155.9	135.2	0	114.5
521	S	29.5	Very low	27.6	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	74%	0.737	S	S	*	*			cis	-153.4	173.3	17.7	72	0	0	0	0	110.1
522	K	27.4	Very low	27.7	Very low	175 Å²	175	134.7 Å²	134.7	76%	0.761	74%	0.737	S	S	*	*			cis	-167.8	142.9	-22.7	-101.7	172.3	179.7	-177.9	0	103.3
523	R	26.7	Very low	28	Very low	197 Å²	197	135.1 Å²	135.1	74%	0.743	74%	0.74	S	S	*	*			cis	81.2	101.9	41.2	-167.4	-152.8	-136.8	-145	12.9	114.9	H525	R523-H525 PolarHBondContact NH1-CE1 2.94Å; R523-H525 PolarHBondContact NH1-NE2 2.83Å; R523-H525 VanDerWaalsContact NH1-NE2 3.16Å
524	S	26.5	Very low	27.7	Very low	110 Å²	110	137.9 Å²	137.9	77%	0.769	75%	0.747	S	S	*	*			trans	-156.9	123.1	151.5	43.9	0	0	0	0	109.2
525	H	25.2	Very low	27.6	Very low	121 Å²	121	135.8 Å²	135.8	56%	0.56	75%	0.748	S	S	*	*				81.6	132.5	57	-70.7	-61.7	0	0	0	111.5	R523	R523-H525 PolarHBondContact NH1-CE1 2.94Å; R523-H525 PolarHBondContact NH1-NE2 2.83Å; R523-H525 VanDerWaalsContact NH1-NE2 3.16Å
526	D	24.8	Very low	27.9	Very low	118 Å²	118	131.6 Å²	131.6	63%	0.631	75%	0.747	S	S	*	*			cis	-172.1	171.3	-10.4	-132.1	-25.6	0	0	0	114.1
527	T	28.4	Very low	28	Very low	119 Å²	119	135.5 Å²	135.5	73%	0.73	75%	0.751	S	S	*	*			trans	63.8	170.9	148.2	54.1	0	0	0	0	122.4
528	P	42	Very low	28	Very low	124 Å²	124	136.8 Å²	136.8	81%	0.805	75%	0.754	S	S	*	*			cis	-135.6	-154.2	-43.5	39.7	-21.5	0	0	0	114.5
529	Q	28.5	Very low	28.2	Very low	179 Å²	179	134.1 Å²	134.1	84%	0.836	75%	0.754	S	S	*	*			trans	-103.8	155.5	-166.1	-64.2	172.6	-82.7	0	0	117.4
530	S	30.6	Very low	28.4	Very low	100 Å²	100	138.8 Å²	138.8	70%	0.699	77%	0.773	S	S	*	*			trans	47.8	136.1	137.2	-56.4	0	0	0	0	123.9
531	L	28.4	Very low	28.6	Very low	173 Å²	173	136.2 Å²	136.2	91%	0.906	78%	0.775	S	S	*	*				174.6	167.9	105.8	-94.2	175.3	0	0	0	115.4
532	A	26.4	Very low	28.5	Very low	95 Å²	95	136.5 Å²	136.5	79%	0.785	78%	0.778	S	S	*	*			trans	83.6	155.1	162	0	0	0	0	0	120.3
533	S	29.5	Very low	28.8	Very low	114 Å²	114	136.2 Å²	136.2	80%	0.797	78%	0.783	S	S	*	*			trans	-153.1	158.8	-158	-37.4	0	0	0	0	113.9
534	L	27.9	Very low	29.1	Very low	186 Å²	186	132 Å²	132	97%	0.974	78%	0.784	S	S	*	*			trans	-143.3	161.2	150.8	-79.2	-174.8	0	0	0	111.5
535	S	25.2	Very low	29.6	Very low	97 Å²	97	132.8 Å²	132.8	68%	0.678	79%	0.787	S	S	*	*			trans	-109.2	173	-170.7	-167.4	0	0	0	0	110.5
536	S	30.9	Very low	30.1	Very low	106 Å²	106	132.9 Å²	132.9	74%	0.741	80%	0.798	S	S	*	*			cis	-156.2	136.9	27.9	-73.2	0	0	0	0	110.3
537	R	29.3	Very low	30.3	Very low	237 Å²	237	133 Å²	133	89%	0.894	81%	0.808	S	S	*	*				76.5	103.9	71.2	-96.9	-171.3	162.3	-151.7	-4.6	116.9
538	S	25.9	Very low	30.3	Very low	115 Å²	115	132.9 Å²	132.9	80%	0.804	81%	0.812	S	S	*	*				-174.2	120.3	128.9	39.5	0	0	0	0	114.5
539	S	28.6	Very low	30	Very low	111 Å²	111	131.7 Å²	131.7	78%	0.776	80%	0.804	S	S	*	*			trans	39.8	131.3	134.7	-43.3	0	0	0	0	121.7
540	L	29.4	Very low	30.1	Very low	166 Å²	166	131.5 Å²	131.5	87%	0.869	81%	0.805	S	S	*	*			cis	67.9	110.5	24	-58	177.4	0	0	0	117.7
541	S	29.9	Very low	29.9	Very low	109 Å²	109	132.5 Å²	132.5	76%	0.762	80%	0.803	S	S	*	*				159.9	123.7	114.2	-67.7	0	0	0	0	115.5
542	S	28.1	Very low	29.8	Very low	115 Å²	115	129.8 Å²	129.8	80%	0.804	79%	0.794	S	S	*	*			trans	161.7	111.1	147.7	56.9	0	0	0	0	108.4
543	L	32	Very low	30.2	Very low	168 Å²	168	130 Å²	130	88%	0.88	79%	0.788	S	S	*	*			cis	70.3	122	12.8	-61.4	-177.1	0	0	0	117
544	S	34.4	Very low	30	Very low	109 Å²	109	134.2 Å²	134.2	76%	0.762	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-67.1	160.6	178.8	-45.3	0	0	0	0	113.2
545	P	35.7	Very low	30	Very low	127 Å²	127	133.3 Å²	133.3	83%	0.825	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-65.1	142	-176.9	25.7	-35.5	0	0	0	113.2
546	P	36	Very low	30	Very low	123 Å²	123	134.2 Å²	134.2	80%	0.799	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-86.3	148.1	-179.7	34.2	-35	0	0	0	113.1
547	S	28.3	Very low	29.6	Very low	119 Å²	119	133.5 Å²	133.5	83%	0.832	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-72.7	143.2	156.3	-53.3	0	0	0	0	110.1
548	S	29.5	Very low	30	Very low	118 Å²	118	127.8 Å²	127.8	83%	0.825	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-69.6	136.7	-174.7	-167.6	0	0	0	0	112.9
549	P	34.9	Very low	30.8	Very low	99 Å²	99	127.1 Å²	127.1	64%	0.643	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-87.9	163.4	174.7	36.2	-35.5	0	0	0	112.8
550	M	31.3	Very low	30.5	Very low	174 Å²	174	128.9 Å²	128.9	86%	0.857	77%	0.772	S	S	*	*			trans	-151	144.7	164.6	-92.1	-56.3	-60	0	0	112
551	D	26.9	Very low	30.4	Very low	121 Å²	121	127 Å²	127	65%	0.647	77%	0.771	S	S	*	*			trans	-143.5	157.3	-172.1	-78.3	-94.6	0	0	0	109
552	T	26.1	Very low	30.5	Very low	117 Å²	117	127.6 Å²	127.6	72%	0.718	77%	0.772	S	S	*	*			cis	-169.9	-174.3	-15.9	27.2	0	0	0	0	105.5
553	P	35.2	Very low	30.7	Very low	100 Å²	100	130.1 Å²	130.1	65%	0.649	78%	0.776	S	S	*	*			cis	-124.7	-156.6	-31.2	26.9	-5.4	0	0	0	111.6
554	Y	25.2	Very low	30.7	Very low	202 Å²	202	128.8 Å²	128.8	79%	0.792	78%	0.775	S	S	*	*			trans	109.2	142.1	163.7	-70.9	-80.6	0	0	0	119.2
555	H	26.5	Very low	30.5	Very low	166 Å²	166	131.4 Å²	131.4	77%	0.769	78%	0.775	S	S	*	*			trans	-70.8	171.6	-169.7	-41.7	-81.6	0	0	0	113.9
556	S	25.1	Very low	30.2	Very low	116 Å²	116	133.4 Å²	133.4	81%	0.811	78%	0.775	S	S	*	*			cis	-160.7	161.6	6	2.3	0	0	0	0	111.6
557	A	24	Very low	30.2	Very low	91 Å²	91	133.3 Å²	133.3	75%	0.752	77%	0.773	S	S	*	*			trans	-94.7	174.6	161.3	0	0	0	0	0	110.1
558	P	36.3	Very low	30.3	Very low	117 Å²	117	136.3 Å²	136.3	76%	0.76	77%	0.773	S	S	*	*			cis	-139.9	-153.2	15.9	47.4	-28.3	0	0	0	112.7
559	P	43	Very low	30.4	Very low	101 Å²	101	138.3 Å²	138.3	66%	0.656	77%	0.77	S	S	*	*			cis	-117.9	170.2	-29.2	34.2	-18.2	0	0	0	113.1
560	D	23.8	Very low	30.3	Very low	149 Å²	149	143.1 Å²	143.1	80%	0.797	78%	0.777	S	S	*	*				164.6	150.4	121.6	-88.8	-16.8	0	0	0	113.9
561	C	25.3	Very low	30.5	Very low	127 Å²	127	142.8 Å²	142.8	86%	0.858	78%	0.775	S	S	*	*			trans	67.7	147.7	175.3	-73	0	0	0	0	118.9
562	P	33.7	Very low	30.9	Very low	120 Å²	120	145.3 Å²	145.3	78%	0.779	78%	0.783	S	S	*	*			trans	-130.4	111.4	-146.3	34	-13.1	0	0	0	114.3
563	L	31.6	Very low	31.2	Very low	169 Å²	169	147 Å²	147	89%	0.885	78%	0.782	S	S	*	*	S	Bend	trans	-149.7	25.2	175.7	-118.8	166.5	0	0	0	115.5
564	T	31.4	Very low	31	Very low	139 Å²	139	147.3 Å²	147.3	85%	0.853	79%	0.794	S	S	*	*	S	Bend	trans	-147.5	53.6	178.2	-10.9	0	0	0	0	112.9
565	Q	31.6	Very low	31.6	Very low	165 Å²	165	140.4 Å²	140.4	77%	0.771	78%	0.784	S	S	*	*			trans	-148.8	41.7	-179.7	-153.4	171.6	8.8	0	0	113.7
566	M	28.9	Very low	31.8	Very low	168 Å²	168	144 Å²	144	83%	0.828	79%	0.791	S	S	*	*	S	Bend	trans	-139.8	27.7	-177.3	-75.7	-62.6	-63.1	0	0	113.7
567	T	35.2	Very low	31.9	Very low	122 Å²	122	142 Å²	142	75%	0.748	79%	0.788	S	S	*	*	S	Bend	trans	-133.4	-10.8	-172.6	-12.3	0	0	0	0	116.1
568	E	31.4	Very low	32.1	Very low	181 Å²	181	146 Å²	146	85%	0.846	80%	0.796	S	S	*	*	S	Bend	trans	-121.2	-27.8	-173	-146.2	161.2	-165.4	0	0	113.6
569	E	30.3	Very low	31.7	Very low	161 Å²	161	148.5 Å²	148.5	75%	0.752	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-4.2	176.9	-65.7	-172.8	147.5	0	0	114.4
570	Y	32.9	Very low	30.9	Very low	199 Å²	199	152.1 Å²	152.1	78%	0.78	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	9.7	-176.4	-148.4	-100.7	0	0	0	115.2
571	M	35.8	Very low	30.9	Very low	167 Å²	167	154 Å²	154	82%	0.823	82%	0.815	S	S	*	*	S	Bend	trans	-106.1	-5.1	175.8	-92.1	-168.2	-73.3	0	0	115.9
572	E	36	Very low	30.9	Very low	174 Å²	174	156.2 Å²	156.2	81%	0.813	82%	0.817	S	S	*	*	S	Bend	trans	-105.1	-7.6	175.3	-67.1	-150.5	123	0	0	115.1
573	Q	32.2	Very low	30.5	Very low	152 Å²	152	162.1 Å²	162.1	71%	0.71	82%	0.824	S	S	*	*	S	Bend	trans	-97.1	-4.5	-174.9	-108.5	64.2	22.1	0	0	116.4	G575	Q573-G575 PolarHBondContact O-N 3.25Å
574	A	32	Very low	30.3	Very low	108 Å²	108	157.8 Å²	157.8	89%	0.893	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	28	177.3	0	0	0	0	0	114.1
575	G	36.4	Very low	30	Very low	56 Å²	56	160.1 Å²	160.1	58%	0.577	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.1	-6.8	-159.6	0	0	0	0	0	118	Q573	Q573-G575 PolarHBondContact O-N 3.25Å
576	R	30.9	Very low	29.7	Very low	242 Å²	242	157.7 Å²	157.7	91%	0.913	81%	0.814	S	S	*	*	S	Bend	trans	-152.9	141.7	174.1	-62.1	-164.5	-158.6	-48.1	-0.2	112.1
577	G	28.2	Very low	29.5	Very low	74 Å²	74	155.6 Å²	155.6	76%	0.763	81%	0.811	S	S	*	*			trans	111.3	53.6	148.9	0	0	0	0	0	119.2
578	L	27.1	Very low	29.1	Very low	176 Å²	176	154.2 Å²	154.2	92%	0.921	81%	0.806	S	S	*	*			trans	-150.1	102.9	136.2	-145.5	81.5	0	0	0	111.4
579	L	28	Very low	28.8	Very low	168 Å²	168	154.8 Å²	154.8	88%	0.88	81%	0.808	S	S	*	*			trans	-149.2	65.7	168.4	-162.2	170.5	0	0	0	107.1
580	E	26.2	Very low	28.6	Very low	177 Å²	177	150.3 Å²	150.3	83%	0.827	81%	0.805	S	S	*	*			trans	-155.9	45.6	-179.2	-158.9	86.2	-103.5	0	0	111.6
581	E	23.8	Very low	28.2	Very low	190 Å²	190	147.4 Å²	147.4	89%	0.888	81%	0.808	S	S	*	*	S	Bend	trans	-167.5	98.2	147.4	-115.4	179.5	169.5	0	0	112.7
582	L	26.1	Very low	27.8	Very low	172 Å²	172	146.2 Å²	146.2	90%	0.901	81%	0.805	S	S	*	*			trans	179.6	76.2	130.5	-99.3	171.5	0	0	0	109.8
583	R	24	Very low	27.3	Very low	245 Å²	245	146.1 Å²	146.1	93%	0.925	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-84.5	125.2	154.7	-179.5	168.8	-74.1	152.3	0.3	107.2
584	A	28	Very low	26.9	Very low	77 Å²	77	142.5 Å²	142.5	64%	0.636	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-54.6	149.4	-165.8	0	0	0	0	0	115.2
585	Q	25.2	Very low	26.6	Very low	188 Å²	188	140.4 Å²	140.4	88%	0.879	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-69.2	124.2	150.1	-69.5	-174.6	6.3	0	0	109.1
586	S	25.1	Very low	26.1	Very low	114 Å²	114	146.9 Å²	146.9	80%	0.797	81%	0.814	S	S	*	*			trans	-133.4	119.6	160.6	59.3	0	0	0	0	107.5
587	V	25.5	Very low	26	Very low	124 Å²	124	142 Å²	142	75%	0.752	81%	0.806	S	S	*	*			trans	-123.1	120.2	-167.1	179.1	0	0	0	0	111.1
588	S	26.1	Very low	26.1	Very low	94 Å²	94	146.5 Å²	146.5	66%	0.657	81%	0.809	S	S	*	*			trans	168.2	157	133.6	45.5	0	0	0	0	112.1
589	H	25.2	Very low	26.1	Very low	192 Å²	192	141.7 Å²	141.7	89%	0.889	79%	0.794	S	S	*	*			trans	65.6	134.2	-177.4	-53.9	-88.5	0	0	0	116.1
590	G	25.3	Very low	26.1	Very low	67 Å²	67	138.8 Å²	138.8	69%	0.691	79%	0.789	S	S	*	*			cis	158.1	144.2	-12.4	0	0	0	0	0	114
591	V	25.9	Very low	26.1	Very low	138 Å²	138	137.8 Å²	137.8	84%	0.836	79%	0.788	S	S	*	*			trans	75.2	96.4	164.8	-167.5	0	0	0	0	118.6
592	L	26.9	Very low	26.1	Very low	143 Å²	143	132.9 Å²	132.9	75%	0.749	78%	0.78	S	S	*	*				30.4	138.3	122.3	-78.4	161.7	0	0	0	123.2
593	M	26.1	Very low	26.3	Very low	172 Å²	172	128.6 Å²	128.6	85%	0.847	77%	0.77	S	S	*	*			trans	79	115.8	145.7	-68.6	-68.1	160.7	0	0	121.4
594	G	23.3	Very low	26.4	Very low	75 Å²	75	124.1 Å²	124.1	77%	0.773	76%	0.763	S	S	*	*				115.2	113.5	96.2	0	0	0	0	0	119.2
595	G	24.7	Very low	26.4	Very low	65 Å²	65	127.1 Å²	127.1	67%	0.67	76%	0.764	S	S	*	*			trans	99.6	123.5	134.7	0	0	0	0	0	119.8
596	E	27.5	Very low	26.4	Very low	192 Å²	192	125.2 Å²	125.2	90%	0.897	76%	0.755	S	S	*	*				66.7	136.4	125.2	-71	164.9	-144.8	0	0	120.8
597	D	28.6	Very low	26.5	Very low	140 Å²	140	126.5 Å²	126.5	75%	0.749	75%	0.752	S	S	*	*			cis	-165	-179.3	-14	-156.4	0.8	0	0	0	111.6
598	M	29.9	Very low	26.3	Very low	167 Å²	167	127.1 Å²	127.1	82%	0.823	75%	0.751	S	S	*	*			trans	75.6	139.3	159.2	-72.7	-152.2	173.9	0	0	119.3
599	A	27.4	Very low	26.3	Very low	75 Å²	75	128.7 Å²	128.7	62%	0.62	75%	0.751	S	S	*	*			cis	-160.6	147.2	-11	0	0	0	0	0	112.7
600	S	27.1	Very low	26.2	Very low	108 Å²	108	129.2 Å²	129.2	76%	0.755	75%	0.75	S	S	*	*				45	146.9	126.7	-56.7	0	0	0	0	121.8
601	L	26.2	Very low	26.2	Very low	155 Å²	155	130.4 Å²	130.4	81%	0.812	75%	0.748	S	S	*	*			cis	-163.2	148.1	9.8	-125.1	163.2	0	0	0	109.8
602	A	24.8	Very low	26	Very low	88 Å²	88	131.3 Å²	131.3	73%	0.727	74%	0.744	S	S	*	*			trans	35.6	160.9	146.1	0	0	0	0	0	123.9
603	A	28.6	Very low	26	Very low	82 Å²	82	134 Å²	134	68%	0.678	74%	0.743	S	S	*	*			cis	-173.8	153	-29.3	0	0	0	0	0	110.1
604	L	27.2	Very low	25.8	Very low	151 Å²	151	132.1 Å²	132.1	79%	0.791	73%	0.733	S	S	*	*			trans	59.9	126.6	156.3	-90.9	78.9	0	0	0	122.5
605	H	27.1	Very low	25.8	Very low	140 Å²	140	134.2 Å²	134.2	65%	0.648	74%	0.736	S	S	*	*			trans	90	105	130.9	-87	-133.4	0	0	0	123.8
606	Q	25.8	Very low	25.9	Very low	147 Å²	147	134.9 Å²	134.9	69%	0.687	74%	0.742	S	S	*	*				93.6	126.1	115.8	-84	-175.9	-23.1	0	0	123
607	L	26.3	Very low	25.9	Very low	141 Å²	141	129.7 Å²	129.7	74%	0.738	73%	0.732	S	S	*	*			trans	79.4	92.3	140.7	-64.6	169.6	0	0	0	121.7
608	D	22.8	Very low	25.9	Very low	138 Å²	138	131.8 Å²	131.8	74%	0.738	74%	0.738	S	S	*	*				78.8	156.8	106.3	-156.8	20.8	0	0	0	121.4
609	I	25.8	Very low	25.7	Very low	127 Å²	127	129.6 Å²	129.6	65%	0.651	73%	0.734	S	S	*	*			trans	62.6	104.4	166.1	-35.8	-176.6	0	0	0	118.2
610	K	23.9	Very low	25.6	Very low	202 Å²	202	130.3 Å²	130.3	88%	0.878	74%	0.74	S	S	*	*				167.4	175.3	95.1	-138.4	151.7	-168.1	171.1	0	113
611	S	23.5	Very low	25.6	Very low	93 Å²	93	134.1 Å²	134.1	65%	0.65	74%	0.743	S	S	*	*			trans	-121.3	164.9	-174.7	59.3	0	0	0	0	114.2
612	Q	23.5	Very low	25.6	Very low	157 Å²	157	133.7 Å²	133.7	73%	0.734	75%	0.747	S	S	*	*			trans	78.1	109.6	137.7	-176.8	175.7	-13.6	0	0	121.1
613	R	25.2	Very low	25.7	Very low	198 Å²	198	134.5 Å²	134.5	75%	0.747	75%	0.748	S	S	*	*			trans	65.7	168.2	144.2	-71.9	178.1	173.9	-140.6	-2.6	117.3
614	E	23.2	Very low	25.7	Very low	134 Å²	134	137 Å²	137	63%	0.626	76%	0.755	S	S	*	*			cis	-151.5	164.6	-3.1	-132.8	160.1	-166.8	0	0	113.8
615	S	23.7	Very low	25.8	Very low	119 Å²	119	133 Å²	133	83%	0.832	75%	0.749	S	S	*	*			trans	31.5	132.7	146.6	-68.3	0	0	0	0	124.4
616	G	24.7	Very low	25.8	Very low	78 Å²	78	132.5 Å²	132.5	80%	0.804	76%	0.756	S	S	*	*				146.5	157.4	129.5	0	0	0	0	0	116.2
617	A	28.7	Very low	25.8	Very low	84 Å²	84	131 Å²	131	69%	0.694	76%	0.757	S	S	*	*			cis	-172.9	137.4	-28.8	0	0	0	0	0	110.4
618	Q	27.5	Very low	25.9	Very low	183 Å²	183	132 Å²	132	86%	0.855	76%	0.762	S	S	*	*			trans	65	157.5	159.7	-60.2	170.3	20.5	0	0	115.9
619	T	26	Very low	26.1	Very low	122 Å²	122	137.2 Å²	137.2	75%	0.748	77%	0.772	S	S	*	*			cis	-142.8	-167.5	6.1	-13.6	0	0	0	0	107
620	A	26.8	Very low	26.1	Very low	90 Å²	90	134.6 Å²	134.6	74%	0.744	78%	0.776	S	S	*	*			cis	-153.3	-159.9	12	0	0	0	0	0	113
621	F	26.1	Very low	26.3	Very low	187 Å²	187	133.1 Å²	133.1	82%	0.82	78%	0.778	S	S	*	*			trans	-81.4	160.8	180	-59	-87.4	0	0	0	113
622	T	27.3	Very low	26.4	Very low	147 Å²	147	134.7 Å²	134.7	90%	0.902	79%	0.789	S	S	*	*				-155.5	-178.8	60.5	37.5	0	0	0	0	115.7
623	S	26.7	Very low	26.5	Very low	105 Å²	105	130.6 Å²	130.6	73%	0.734	79%	0.788	S	S	*	*			trans	-89.7	154.7	-162.8	170.3	0	0	0	0	116.1
624	T	28.9	Very low	26.8	Very low	135 Å²	135	129 Å²	129	83%	0.828	80%	0.795	S	S	*	*				147	143.1	118.8	-57.9	0	0	0	0	113.1
625	G	28.3	Very low	27.2	Very low	65 Å²	65	134.8 Å²	134.8	67%	0.67	81%	0.811	S	S	*	*			trans	122.9	69.2	149.3	0	0	0	0	0	121.6
626	V	26.3	Very low	27.3	Very low	130 Å²	130	134.9 Å²	134.9	79%	0.788	81%	0.811	S	S	*	*				46.8	128.8	123.4	-172.6	0	0	0	0	122
627	T	27.6	Very low	27.9	Very low	115 Å²	115	136.3 Å²	136.3	71%	0.706	81%	0.809	S	S	*	*			trans	75	116.2	155.6	49.2	0	0	0	0	125
628	L	28	Very low	28.3	Very low	164 Å²	164	143.2 Å²	143.2	86%	0.859	82%	0.817	S	S	*	*				74.9	155.4	124.4	-66.4	172.4	0	0	0	124.1
629	R	26.2	Very low	28.5	Very low	247 Å²	247	146.1 Å²	146.1	93%	0.932	82%	0.82	S	S	*	*			trans	-60.9	155.4	-176	-61.8	174.6	170.9	-172.1	-2.3	114.6
630	G	25.7	Very low	28.7	Very low	72 Å²	72	144.3 Å²	144.3	74%	0.742	82%	0.818	S	S	*	*			trans	162.6	110.6	148.3	0	0	0	0	0	116.2
631	N	28.8	Very low	29.1	Very low	171 Å²	171	151.2 Å²	151.2	91%	0.914	83%	0.825	S	S	*	*			trans	-57.3	131.6	-179.2	-64.3	-10.5	0	0	0	115.2
632	S	26.1	Very low	29.5	Very low	126 Å²	126	152.9 Å²	152.9	88%	0.881	83%	0.826	S	S	*	*			trans	174.6	157.6	132.8	47.7	0	0	0	0	110.1
633	G	25	Very low	29.6	Very low	70 Å²	70	151.8 Å²	151.8	72%	0.722	82%	0.818	S	S	*	*			cis	-170.6	-177.2	-2.3	0	0	0	0	0	112
634	N	31.6	Very low	30.1	Very low	166 Å²	166	152.3 Å²	152.3	89%	0.888	82%	0.822	S	S	*	*			trans	-54.7	148.8	-172	-60	-20	0	0	0	115.6
635	R	30.2	Very low	30.3	Very low	255 Å²	255	151.1 Å²	151.1	96%	0.962	83%	0.826	S	S	*	*			trans	-136.1	147	139.6	-77.6	-154.4	163.4	-170	-4.4	112.5
636	S	27.5	Very low	30.5	Very low	121 Å²	121	151.3 Å²	151.3	85%	0.846	83%	0.827	S	S	*	*			trans	-106.3	167.2	-167.1	-172.5	0	0	0	0	113.4
637	S	37.5	Very low	30.6	Very low	108 Å²	108	151.6 Å²	151.6	76%	0.755	83%	0.83	S	S	*	*			trans	-71.9	171.3	177.8	-171.7	0	0	0	0	114.2
638	R	35.1	Very low	30.8	Very low	229 Å²	229	150.6 Å²	150.6	86%	0.864	83%	0.827	S	S	*	*			trans	-148.7	138.3	171.6	-70.4	-172.8	175.7	-159.2	-1.6	106.3
639	R	32.8	Very low	31.1	Very low	243 Å²	243	150.7 Å²	150.7	92%	0.917	82%	0.823	S	S	*	*			cis	-145.4	-179.8	22.3	-97.7	160.1	-68	-167.1	0.8	107.9
640	A	30.4	Very low	31.5	Very low	85 Å²	85	146.1 Å²	146.1	70%	0.702	82%	0.817	S	S	*	*			cis	-151.6	161.3	2.9	0	0	0	0	0	107.7
641	R	35.3	Very low	32	Very low	235 Å²	235	146.5 Å²	146.5	89%	0.887	81%	0.814	S	S	*	*				52.8	124.8	70.8	-75.5	-170.9	-179.8	-149.9	-3	114.2
642	R	33.7	Very low	32.4	Very low	222 Å²	222	146.5 Å²	146.5	84%	0.838	81%	0.812	S	S	*	*			cis	-154.3	167.5	16.9	-104	-177	-55.5	174.2	3.5	108.1
643	V	29.4	Very low	32.9	Very low	124 Å²	124	144.5 Å²	144.5	75%	0.752	80%	0.803	S	S	*	*			cis	-151.7	-179.5	-0.2	-98	0	0	0	0	107.8
644	S	37.3	Very low	33.2	Very low	115 Å²	115	148 Å²	148	80%	0.804	81%	0.811	S	S	*	*			cis	159.3	65.3	-48.8	-74.8	0	0	0	0	113.1
645	A	34	Very low	33.2	Very low	111 Å²	111	146.7 Å²	146.7	92%	0.917	80%	0.804	S	S	*	*			trans	-156.2	142.1	166.2	0	0	0	0	0	111.2
646	G	31.8	Very low	33.4	Very low	68 Å²	68	139.1 Å²	139.1	70%	0.701	79%	0.79	S	S	*	*			cis	174.8	159.3	-8	0	0	0	0	0	113
647	V	28.1	Very low	33.4	Very low	137 Å²	137	136.6 Å²	136.6	83%	0.83	78%	0.783	S	S	*	*			trans	75.7	107.1	-175.1	-172.1	0	0	0	0	113.4
648	S	31.7	Very low	32.9	Very low	93 Å²	93	137.9 Å²	137.9	65%	0.65	79%	0.786	S	S	*	*			cis	83.8	146.4	34.7	91.5	0	0	0	0	113.4
649	E	34.5	Very low	32.5	Very low	166 Å²	166	135.4 Å²	135.4	78%	0.776	78%	0.782	S	S	*	*			cis	-143.2	150.6	26.2	-119.3	155.9	-157.4	0	0	113.2
650	D	34.6	Very low	32.4	Very low	151 Å²	151	132.3 Å²	132.3	81%	0.807	78%	0.778	S	S	*	*			trans	35.9	149.3	132.3	-69.5	17	0	0	0	123.1
651	A	35.9	Very low	32.5	Very low	81 Å²	81	131.7 Å²	131.7	67%	0.669	77%	0.773	S	S	*	*			cis	-170.1	-169.7	-10.4	0	0	0	0	0	110.3
652	L	37.3	Very low	32.2	Very low	170 Å²	170	132.8 Å²	132.8	89%	0.89	78%	0.778	S	S	*	*			trans	83	97.3	165.4	-56.7	174.3	0	0	0	119.4
653	A	37.2	Very low	32.1	Very low	84 Å²	84	125.6 Å²	125.6	69%	0.694	77%	0.772	S	S	*	*			trans	-6	175.1	141.2	0	0	0	0	0	123
654	T	32	Very low	31.9	Very low	144 Å²	144	129.6 Å²	129.6	88%	0.883	78%	0.78	S	S	*	*			trans	72.8	149.9	174.2	63.6	0	0	0	0	114.9
655	D	30.5	Very low	31.4	Very low	139 Å²	139	135 Å²	135	74%	0.743	78%	0.782	S	S	*	*			cis	-157.9	-168.1	-16.2	171	42.4	0	0	0	106.4
656	S	34.1	Very low	31.8	Very low	95 Å²	95	133.9 Å²	133.9	66%	0.664	77%	0.766	S	S	*	*			trans	25.2	138.4	149.9	48.5	0	0	0	0	120.8
657	G	28.2	Very low	31.6	Very low	68 Å²	68	138.5 Å²	138.5	70%	0.701	77%	0.769	S	S	*	*			cis	122.3	172.1	22	0	0	0	0	0	110.6
658	V	27.5	Very low	31.8	Very low	135 Å²	135	140.1 Å²	140.1	82%	0.818	77%	0.768	S	S	*	*			trans	65.8	97.2	158.3	-174.9	0	0	0	0	118.2
659	F	25.9	Very low	31.6	Very low	178 Å²	178	146.4 Å²	146.4	78%	0.781	78%	0.779	S	S	*	*				22	126.2	116.9	-92.3	-99.2	0	0	0	118.8
660	E	31.1	Very low	31.3	Very low	177 Å²	177	145.6 Å²	145.6	83%	0.827	78%	0.78	S	S	*	*				-179.3	126.8	92.7	-116.8	170.3	-153	0	0	116.6
661	A	31.9	Very low	30.9	Very low	73 Å²	73	147.7 Å²	147.7	60%	0.603	79%	0.785	S	S	*	*			trans	21.1	128.8	133.6	0	0	0	0	0	124.6
662	W	30.4	Very low	31	Very low	258 Å²	258	149.2 Å²	149.2	98%	0.977	79%	0.786	S	S	*	*				78.5	101.4	126.3	-66.4	23.8	0	0	0	121.9
663	G	29.9	Very low	30.4	Very low	71 Å²	71	147 Å²	147	73%	0.732	78%	0.784	S	S	*	*				119.9	170.4	89	0	0	0	0	0	120.8
664	K	26.7	Very low	30.3	Very low	207 Å²	207	153.9 Å²	153.9	90%	0.9	79%	0.794	S	S	*	*			trans	80.5	119.3	177	-50.4	175.7	-174.5	174	0	115.3
665	R	26.3	Very low	30.1	Very low	228 Å²	228	152 Å²	152	86%	0.86	79%	0.793	S	S	*	*				51.3	142.7	69.2	-77.8	-116.6	-164	-175.8	2.1	114.4
666	P	41.6	Very low	30.2	Very low	88 Å²	88	153.9 Å²	153.9	57%	0.571	79%	0.794	S	S	*	*			cis	-141.3	-169.7	-23.4	41.7	-23	0	0	0	114.6
667	E	29	Very low	30	Very low	165 Å²	165	156.2 Å²	156.2	77%	0.771	80%	0.795	S	S	*	*			trans	70.9	132.7	148.5	-79	147.5	-154.2	0	0	122.8
668	E	30.9	Very low	30.5	Very low	171 Å²	171	159.8 Å²	159.8	80%	0.799	80%	0.803	S	S	*	*			trans	14.5	125.1	149.7	-57.2	176.7	172.7	0	0	121.3
669	Y	27.6	Very low	30.7	Very low	226 Å²	226	158.9 Å²	158.9	89%	0.886	80%	0.802	S	S	*	*				-167.2	161.2	108.8	-124.7	-103	0	0	0	112.9
670	D	28.4	Very low	31.3	Very low	149 Å²	149	156 Å²	156	80%	0.797	80%	0.802	S	S	*	*			trans	-73	150.5	165.4	-82.5	-56.1	0	0	0	111.8
671	E	27.6	Very low	31.7	Very low	195 Å²	195	152.5 Å²	152.5	91%	0.911	80%	0.803	S	S	*	*				-179.1	152.6	106.8	-170.3	156.7	-154.2	0	0	111.5
672	V	37.3	Very low	33	Very low	113 Å²	113	153.6 Å²	153.6	69%	0.685	81%	0.806	S	S	*	*			trans	-90.6	139.2	-172	175.9	0	0	0	0	112.3	Y674	V672-Y674 HydrophobicContact CG1-CD2 4.33Å; V672-Y674 HydrophobicContact CG1-CE2 4.46Å
673	S	25.5	Very low	34.7	Very low	123 Å²	123	147.2 Å²	147.2	86%	0.86	79%	0.787	S	S	*	*			trans	-150	134.2	159.8	-84.4	0	0	0	0	112.8
674	Y	34.5	Very low	37.1	Very low	229 Å²	229	145.7 Å²	145.7	90%	0.898	76%	0.764	S	S	*	*			trans	-84.5	124	-175.7	-91	-118.5	0	0	0	112.5	V672	V672-Y674 HydrophobicContact CG1-CD2 4.33Å; V672-Y674 HydrophobicContact CG1-CE2 4.46Å
675	A	27.6	Very low	40.1	Very low	104 Å²	104	136.3 Å²	136.3	86%	0.86	73%	0.725	S	S	*	*			trans	-153	133.4	148.4	0	0	0	0	0	112.2
676	K	32.6	Very low	43.3	Very low	178 Å²	178	128.1 Å²	128.1	77%	0.774	70%	0.696	S	S	*	*			trans	-62.7	150.9	-173.4	-177.1	171.8	-179.4	-93.1	0	115.1
677	E	30.4	Very low	45.7	Very low	145 Å²	145	124 Å²	124	68%	0.678	67%	0.669	S	S	*	*	S	Bend	trans	89.6	131.1	159.7	-94.5	153.1	-127.1	0	0	122
678	T	37.4	Very low	48.8	Very low	143 Å²	143	118.9 Å²	118.9	88%	0.877	65%	0.645	S	S	*	*			trans	58.7	99.7	170.1	53.8	0	0	0	0	118.7
679	S	32.3	Very low	51.9	Low	115 Å²	115	110.7 Å²	110.7	80%	0.804	61%	0.607	S	S	*	*			trans	-126.2	169.3	163	68.7	0	0	0	0	109.5
680	P	38.8	Very low	55	Low	118 Å²	118	100 Å²	100	77%	0.766	57%	0.565	S	S	*	*			trans	-76.6	160.5	-134	29.8	-38.2	0	0	0	115.7	S682	P680-S682 PolarHBondContact O-N 2.69Å
681	A	39.7	Very low	58	Low	103 Å²	103	92.9 Å²	92.9	85%	0.851	53%	0.527	S	S	*	.			trans	-60.7	102.9	163.1	0	0	0	0	0	109.3	E683	A681-E683 PolarHBondContact O-N 2.7Å
682	S	58	Low	61	Low	96 Å²	96	85 Å²	85	67%	0.671	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-51.1	128.9	176.3	-177.8	0	0	0	0	109.9	P680	P680-S682 PolarHBondContact O-N 2.69Å
683	E	67.2	Low	63.5	Low	124 Å²	124	80.8 Å²	80.8	58%	0.579	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-53.5	138.7	164.1	-74.5	-163.5	150.7	0	0	109.1	A681 S709	A681-E683 PolarHBondContact O-N 2.7Å; E683-S709 PolarHBondContact OE2-OG 3.42Å
684	P	79.9	Confident	66.5	Low	39 Å²	39	77 Å²	77	25%	0.253	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-72	139.2	176.5	31.6	-34.8	0	0	0	109.6	Q686 R808	P684-Q686 WeakPolarHBondContact O-CG 3.33Å; P684-Q686 PolarHBondContact O-N 3.2Å; P684-Q686 PolarHBondContact O-NE2 2.75Å; P684-R808 HydrophobicContact CB-CG 3.84Å; P684-R808 HydrophobicContact CG-CG 4.17Å
685	T	89.6	Confident	68.7	Low	10 Å²	10	70 Å²	70	6%	0.061	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-53.6	130.4	172.9	-49.7	0	0	0	0	110.2	L707 K708 S709 L710 V809 M811	T685-L707 HydrophobicContact CG2-CD1 3.81Å; T685-L707 HydrophobicContact CG2-CG 4.13Å; T685-K708 CarbonylContact C-O 3.58Å; T685-K708 VanDerWaalsContact CA-O 3.29Å; T685-K708 WeakPolarHBondContact CA-O 3.34Å; T685-S709 VanDerWaalsContact CA-O 3.28Å; T685-S709 WeakPolarHBondContact CA-O 3.32Å; T685-S709 WeakPolarHBondContact CB-O 3.38Å; T685-S709 PolarHBondContact OG1-O 3.31Å; T685-L710 HydrophobicContact CG2-CB 4.25Å; T685-L710 HydrophobicContact CG2-CD1 4.25Å; T685-V809 HydrophobicContact CG2-CB 4.23Å; T685-V809 HydrophobicContact CG2-CG2 4.39Å; T685-V809 PolarHBondContact O-N 2.7Å; T685-M811 HydrophobicContact CG2-SD 4.04Å
686	Q	92.5	Very high	71.3	Confident	57 Å²	57	71.1 Å²	71.1	27%	0.266	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	141.8	-173.5	-83.7	169.6	73.5	0	0	110.8	P684 L707 K708 C806 L807	P684-Q686 WeakPolarHBondContact O-CG 3.33Å; P684-Q686 PolarHBondContact O-N 3.2Å; P684-Q686 PolarHBondContact O-NE2 2.75Å; Q686-L707 CarbonylContact O-C 3.57Å; Q686-L707 WeakPolarHBondContact O-CA 3.3Å; Q686-K708 PolarHBondContact N-O 2.9Å; Q686-K708 PolarHBondContact O-N 3.34Å; Q686-C806 PolarHBondContact OE1-SG 3.19Å; Q686-C806 VanDerWaalsContact OE1-SG 3.33Å; Q686-L807 CarbonylContact C-O 3.54Å; Q686-L807 VanDerWaalsContact CA-O 3.27Å; Q686-L807 WeakPolarHBondContact CA-O 3.44Å
687	I	93.9	Very high	73.7	Confident	1 Å²	1	65 Å²	65	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	129.2	177.1	-169.2	171.3	0	0	0	110.9	L689 V704 L707 V723 L772 C806 L807 V809	I687-L689 HydrophobicContact CD1-CD2 4.02Å; I687-L689 HydrophobicContact CG1-CD2 3.9Å; I687-V704 HydrophobicContact CD1-CG1 4.06Å; I687-V704 HydrophobicContact CG1-CG1 4.49Å; I687-L707 HydrophobicContact CB-CD1 3.96Å; I687-L707 HydrophobicContact CG1-CD1 4.36Å; I687-V723 HydrophobicContact CD1-CB 4.34Å; I687-V723 HydrophobicContact CD1-CG1 3.72Å; I687-V723 HydrophobicContact CD1-CG2 3.74Å; I687-L772 HydrophobicContact CG2-CD1 4.36Å; I687-C806 WeakPolarHBondContact O-CA 3.4Å; I687-L807 HydrophobicContact CG2-CB 3.9Å; I687-L807 PolarHBondContact N-O 3.49Å; I687-L807 PolarHBondContact O-N 2.92Å; I687-V809 HydrophobicContact CB-CG2 4.06Å; I687-V809 HydrophobicContact CG2-CG2 3.86Å
688	Q	93.7	Very high	76.3	Confident	57 Å²	57	65.3 Å²	65.3	27%	0.266	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	130.3	179.6	-61.2	-163.4	-49.3	0	0	110.5	L705 Q706 K708 H805	Q688-L705 HydrophobicContact CB-CB 4.31Å; Q688-L705 WeakPolarHBondContact O-CB 3.44Å; Q688-L705 PolarHBondContact O-N 3.02Å; Q688-Q706 PolarHBondContact N-O 3.02Å; Q688-Q706 PolarHBondContact O-N 3.49Å; Q688-K708 VanDerWaalsContact NE2-NZ 3.19Å; Q688-K708 VanDerWaalsContact OE1-NZ 3.11Å; Q688-H805 WeakPolarHBondContact CA-O 3.5Å
689	L	94.5	Very high	78.8	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	152.3	-170.8	-48.9	167.3	0	0	0	110.3	I687 L702 H703 V704 L772 Y804 H805 L807	I687-L689 HydrophobicContact CD1-CD2 4.02Å; I687-L689 HydrophobicContact CG1-CD2 3.9Å; L689-L702 HydrophobicContact CB-CD1 4.35Å; L689-L702 HydrophobicContact CD2-CD1 4.32Å; L689-H703 CarbonylContact C-O 3.54Å; L689-H703 WeakPolarHBondContact CA-O 3.25Å; L689-V704 HydrophobicContact CD2-CB 4.44Å; L689-V704 HydrophobicContact CD2-CG1 4.35Å; L689-V704 HydrophobicContact CD2-CG2 4.04Å; L689-L772 HydrophobicContact CD1-CD1 3.45Å; L689-L772 VanDerWaalsContact CD1-CD1 3.45Å; L689-L772 HydrophobicContact CD2-CD1 3.97Å; L689-L772 HydrophobicContact CG-CD1 4.32Å; L689-Y804 CarbonylContact O-C 3.55Å; L689-Y804 VanDerWaalsContact O-CA 3.24Å; L689-Y804 WeakPolarHBondContact O-CA 3.42Å; L689-H805 HydrophobicContact CB-CB 4.44Å; L689-H805 PolarHBondContact N-O 2.81Å; L689-H805 PolarHBondContact O-N 2.84Å; L689-L807 HydrophobicContact CD1-CD1 3.54Å; L689-L807 HydrophobicContact CD1-CG 3.97Å
690	G	93.3	Very high	81.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	137.4	161.1	0	0	0	0	0	110.6	L702 H703	G690-L702 CarbonylContact O-C 3.6Å; G690-L702 WeakPolarHBondContact O-CA 3.29Å; G690-H703 PolarHBondContact N-O 2.84Å; G690-H703 PolarHBondContact O-N 2.85Å
691	L	92.4	Very high	84	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132.8	175	-69.8	178.8	0	0	0	111.3	L700 R701 L702 L770 L791 L793 M802 V803	L691-L700 HydrophobicContact CD2-CD1 4.17Å; L691-L700 HydrophobicContact CD2-CD2 4.11Å; L691-L700 HydrophobicContact CD2-CG 4.23Å; L691-R701 WeakPolarHBondContact CA-O 3.45Å; L691-L702 HydrophobicContact CD2-CB 4.02Å; L691-L702 HydrophobicContact CD2-CD1 3.58Å; L691-L702 HydrophobicContact CD2-CG 4.38Å; L691-L770 HydrophobicContact CD2-CD2 4.43Å; L691-L791 HydrophobicContact CD1-CD2 3.6Å; L691-L793 HydrophobicContact CD1-CD2 3.74Å; L691-M802 PolarHBondContact N-SD 2.79Å; L691-M802 VanDerWaalsContact N-SD 3.42Å; L691-V803 PolarHBondContact N-O 2.78Å; L691-V803 PolarHBondContact O-N 2.92Å
692	L	90.9	Very high	86.6	Confident	28 Å²	28	46.4 Å²	46.4	15%	0.147	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	124	172.4	174.6	65.9	0	0	0	109.9	R701 M802	L692-R701 HydrophobicContact CB-CB 4.34Å; L692-R701 PolarHBondContact N-O 2.73Å; L692-R701 PolarHBondContact O-N 3.35Å; L692-M802 HydrophobicContact CB-CE 3.83Å; L692-M802 HydrophobicContact CB-SD 3.74Å; L692-M802 HydrophobicContact CD2-CE 4.28Å
693	W	89	Confident	88.3	Confident	25 Å²	25	44.5 Å²	44.5	10%	0.095	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	120.6	172.4	175.9	-131	0	0	0	110.6	R698 S699 L700 V760 L765 C796	W693-R698 HydrophobicContact CH2-CB 4.27Å; W693-S699 VanDerWaalsContact CZ3-C 3.46Å; W693-L700 HydrophobicContact CE3-CB 4.47Å; W693-V760 HydrophobicContact CH2-CB 4.02Å; W693-V760 HydrophobicContact CZ3-CB 3.8Å; W693-V760 HydrophobicContact CZ3-CG2 4.1Å; W693-L765 HydrophobicContact CB-CD2 3.92Å; W693-L765 HydrophobicContact CD2-CD2 3.71Å; W693-L765 HydrophobicContact CE3-CD1 4.13Å; W693-L765 HydrophobicContact CE3-CD2 4.12Å; W693-L765 HydrophobicContact CG-CD2 3.61Å; W693-L765 HydrophobicContact CZ3-CD1 4.39Å; W693-C796 WeakPolarHBondContact CB-O 3.21Å
694	E	88.3	Confident	89.6	Confident	43 Å²	43	38.6 Å²	38.6	20%	0.201	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	85.3	-179	-167.9	172.4	-152.4	0	0	109.4	T696 S697 R698 S699 R701 R757	E694-T696 PolarHBondContact O-N 2.75Å; E694-S697 WeakPolarHBondContact CB-OG 3.38Å; E694-S697 VanDerWaalsContact CG-OG 3.23Å; E694-S697 WeakPolarHBondContact CG-OG 3.21Å; E694-S697 PolarHBondContact O-N 3Å; E694-S697 VanDerWaalsContact O-N 3.07Å; E694-S697 PolarHBondContact O-OG 3.41Å; E694-S697 PolarHBondContact OE2-OG 3.17Å; E694-R698 PolarHBondContact O-N 3.36Å; E694-S699 WeakPolarHBondContact CB-O 3.47Å; E694-S699 PolarHBondContact N-O 3.42Å; E694-S699 PolarHBondContact O-N 2.69Å; E694-R701 IonicContact OE1-NH2 2.8Å; E694-R701 PolarHBondContact OE1-NH2 2.85Å; E694-R701 IonicContact OE2-CZ 2.8Å; E694-R701 IonicContact OE2-NE 3.04Å; E694-R701 IonicContact OE2-NH2 3.21Å; E694-R701 PolarHBondContact OE2-NH2 3.07Å; E694-R757 VanDerWaalsContact CD-NH2 3.27Å; E694-R757 IonicContact OE1-NH2 3.59Å; E694-R757 PolarHBondContact OE1-NH2 2.91Å; E694-R757 IonicContact OE2-CZ 2.94Å; E694-R757 IonicContact OE2-NE 3.17Å; E694-R757 PolarHBondContact OE2-NE 3.45Å; E694-R757 IonicContact OE2-NH2 2.65Å; E694-R757 PolarHBondContact OE2-NH2 3.19Å
695	S	80.5	Confident	90.2	Very high	83 Å²	83	38.8 Å²	38.8	58%	0.58	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-30.5	-171.8	58.9	0	0	0	0	114.2
696	T	83.3	Confident	90.4	Very high	128 Å²	128	39.8 Å²	39.8	79%	0.785	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-37	176	50.8	0	0	0	0	113	E694	E694-T696 PolarHBondContact O-N 2.75Å
697	S	82.4	Confident	90.4	Very high	48 Å²	48	37.1 Å²	37.1	34%	0.336	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-6.7	178.3	64.4	0	0	0	0	113.7	E694 S699	E694-S697 WeakPolarHBondContact CB-OG 3.38Å; E694-S697 VanDerWaalsContact CG-OG 3.23Å; E694-S697 WeakPolarHBondContact CG-OG 3.21Å; E694-S697 PolarHBondContact O-N 3Å; E694-S697 VanDerWaalsContact O-N 3.07Å; E694-S697 PolarHBondContact O-OG 3.41Å; E694-S697 PolarHBondContact OE2-OG 3.17Å; S697-S699 PolarHBondContact O-N 3.45Å; S697-S699 PolarHBondContact OG-OG 2.87Å
698	R	85.8	Confident	90.2	Very high	152 Å²	152	39.9 Å²	39.9	57%	0.574	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	43	-173.3	-58	176.2	176.4	-177.5	-4.8	111.9	W693 E694 V760	W693-R698 HydrophobicContact CH2-CB 4.27Å; E694-R698 PolarHBondContact O-N 3.36Å; R698-V760 PolarHBondContact O-N 3.34Å; R698-V760 VanDerWaalsContact O-O 3.07Å
699	S	89.3	Confident	89.8	Confident	6 Å²	6	38.6 Å²	38.6	4%	0.042	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	138.5	179.5	67.1	0	0	0	0	112.6	W693 E694 S697 R757 I758	W693-S699 VanDerWaalsContact CZ3-C 3.46Å; E694-S699 WeakPolarHBondContact CB-O 3.47Å; E694-S699 PolarHBondContact N-O 3.42Å; E694-S699 PolarHBondContact O-N 2.69Å; S697-S699 PolarHBondContact O-N 3.45Å; S697-S699 PolarHBondContact OG-OG 2.87Å; S699-R757 WeakPolarHBondContact OG-CG 3.33Å; S699-R757 PolarHBondContact OG-NE 2.92Å; S699-I758 CarbonylContact C-O 3.59Å; S699-I758 VanDerWaalsContact CA-O 3.28Å; S699-I758 WeakPolarHBondContact CA-O 3.28Å
700	L	89.3	Confident	89.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	121.3	167	-176.9	68.4	0	0	0	108.8	L691 W693 I758 V760 L765 L793	L691-L700 HydrophobicContact CD2-CD1 4.17Å; L691-L700 HydrophobicContact CD2-CD2 4.11Å; L691-L700 HydrophobicContact CD2-CG 4.23Å; W693-L700 HydrophobicContact CE3-CB 4.47Å; L700-I758 PolarHBondContact N-O 3Å; L700-I758 PolarHBondContact O-N 3.05Å; L700-V760 HydrophobicContact CB-CG2 3.98Å; L700-L765 HydrophobicContact CD1-CD1 4.32Å; L700-L793 HydrophobicContact CD2-CD1 3.75Å; L700-L793 HydrophobicContact CD2-CD2 3.93Å
701	R	91.3	Very high	88.9	Confident	77 Å²	77	42.2 Å²	42.2	29%	0.291	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	111.1	169.6	-166.4	179.1	-56.3	170.6	6.1	108.2	L691 L692 E694 F756	L691-R701 WeakPolarHBondContact CA-O 3.45Å; L692-R701 HydrophobicContact CB-CB 4.34Å; L692-R701 PolarHBondContact N-O 2.73Å; L692-R701 PolarHBondContact O-N 3.35Å; E694-R701 IonicContact OE1-NH2 2.8Å; E694-R701 PolarHBondContact OE1-NH2 2.85Å; E694-R701 IonicContact OE2-CZ 2.8Å; E694-R701 IonicContact OE2-NE 3.04Å; E694-R701 IonicContact OE2-NH2 3.21Å; E694-R701 PolarHBondContact OE2-NH2 3.07Å; R701-F756 WeakPolarHBondContact CA-O 3.47Å
702	L	93.3	Very high	88.3	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128	176.8	164.7	66.8	0	0	0	108.8	L689 G690 L691 V704 V725 G755 F756 I758 L770	L689-L702 HydrophobicContact CB-CD1 4.35Å; L689-L702 HydrophobicContact CD2-CD1 4.32Å; G690-L702 CarbonylContact O-C 3.6Å; G690-L702 WeakPolarHBondContact O-CA 3.29Å; L691-L702 HydrophobicContact CD2-CB 4.02Å; L691-L702 HydrophobicContact CD2-CD1 3.58Å; L691-L702 HydrophobicContact CD2-CG 4.38Å; L702-V704 HydrophobicContact CD1-CG2 4.45Å; L702-V704 HydrophobicContact CD2-CG2 4.36Å; L702-V704 HydrophobicContact CG-CG2 4.33Å; L702-V725 HydrophobicContact CD2-CB 4.3Å; L702-V725 HydrophobicContact CD2-CG1 3.49Å; L702-V725 VanDerWaalsContact CD2-CG1 3.49Å; L702-V725 HydrophobicContact CD2-CG2 3.85Å; L702-G755 CarbonylContact O-C 3.54Å; L702-G755 WeakPolarHBondContact O-CA 3.49Å; L702-F756 HydrophobicContact CD2-CD2 4.13Å; L702-F756 HydrophobicContact CG-CD2 4.33Å; L702-F756 PolarHBondContact N-O 2.93Å; L702-F756 PolarHBondContact O-N 3.47Å; L702-I758 HydrophobicContact CB-CD1 4.47Å; L702-I758 HydrophobicContact CD2-CD1 4.18Å; L702-L770 HydrophobicContact CD1-CD2 4.08Å; L702-L770 HydrophobicContact CD2-CD1 4.43Å; L702-L770 HydrophobicContact CD2-CD2 4.01Å
703	H	93.4	Very high	87.5	Confident	56 Å²	56	47.3 Å²	47.3	26%	0.259	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.3	165.5	-72.3	-93.4	0	0	0	110	L689 G690 L705 E754	L689-H703 CarbonylContact C-O 3.54Å; L689-H703 WeakPolarHBondContact CA-O 3.25Å; G690-H703 PolarHBondContact N-O 2.84Å; G690-H703 PolarHBondContact O-N 2.85Å; H703-L705 HydrophobicContact CB-CD2 4.04Å; H703-E754 CarbonylContact C-O 3.47Å; H703-E754 VanDerWaalsContact CA-O 3.26Å; H703-E754 WeakPolarHBondContact CA-O 3.38Å
704	V	94.3	Very high	86.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	108.5	169.8	-180	0	0	0	0	107.2	I687 L689 L702 V723 V725 F752 N753 E754 F756	I687-V704 HydrophobicContact CD1-CG1 4.06Å; I687-V704 HydrophobicContact CG1-CG1 4.49Å; L689-V704 HydrophobicContact CD2-CB 4.44Å; L689-V704 HydrophobicContact CD2-CG1 4.35Å; L689-V704 HydrophobicContact CD2-CG2 4.04Å; L702-V704 HydrophobicContact CD1-CG2 4.45Å; L702-V704 HydrophobicContact CD2-CG2 4.36Å; L702-V704 HydrophobicContact CG-CG2 4.33Å; V704-V723 HydrophobicContact CG1-CB 4.44Å; V704-V723 HydrophobicContact CG1-CG2 4.38Å; V704-V725 HydrophobicContact CG2-CG2 4.32Å; V704-F752 HydrophobicContact CG1-CB 4.26Å; V704-F752 HydrophobicContact CG1-CD2 4.06Å; V704-F752 HydrophobicContact CG1-CG 4.37Å; V704-N753 CarbonylContact O-C 3.53Å; V704-N753 VanDerWaalsContact O-CA 3.25Å; V704-N753 WeakPolarHBondContact O-CA 3.23Å; V704-N753 PolarHBondContact O-N 3.32Å; V704-E754 PolarHBondContact N-O 2.67Å; V704-E754 PolarHBondContact O-N 3.04Å; V704-E754 VanDerWaalsContact O-N 3.08Å; V704-F756 HydrophobicContact CG2-CD2 4.38Å; V704-F756 HydrophobicContact CG2-CE2 3.93Å
705	L	93.2	Very high	86.4	Confident	42 Å²	42	47.3 Å²	47.3	22%	0.22	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-64.3	-170.5	-57.4	176.2	0	0	0	111.1	Q688 H703 F752 N753 Y804	Q688-L705 HydrophobicContact CB-CB 4.31Å; Q688-L705 WeakPolarHBondContact O-CB 3.44Å; Q688-L705 PolarHBondContact O-N 3.02Å; H703-L705 HydrophobicContact CB-CD2 4.04Å; L705-F752 PolarHBondContact O-N 2.91Å; L705-N753 PolarHBondContact O-N 3.49Å; L705-N753 VanDerWaalsContact O-N 3.09Å; L705-N753 PolarHBondContact O-OD1 3.17Å; L705-Y804 HydrophobicContact CD1-CD1 3.79Å; L705-Y804 HydrophobicContact CD1-CE1 3.88Å
706	Q	93.1	Very high	86.5	Confident	32 Å²	32	49 Å²	49	15%	0.15	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	138.7	-169.5	-176.2	168.1	77	0	0	112.1	Q688 K708 Q749 M750 T751	Q688-Q706 PolarHBondContact N-O 3.02Å; Q688-Q706 PolarHBondContact O-N 3.49Å; Q706-K708 HydrophobicContact CG-CG 4.12Å; Q706-Q749 VanDerWaalsContact CD-NE2 3.27Å; Q706-Q749 HydrophobicContact CG-CG 4.07Å; Q706-Q749 VanDerWaalsContact NE2-NE2 3.18Å; Q706-M750 CarbonylContact C-O 3.6Å; Q706-M750 VanDerWaalsContact CA-O 3.26Å; Q706-M750 WeakPolarHBondContact CA-O 3.31Å; Q706-M750 WeakPolarHBondContact CG-O 3.28Å; Q706-T751 HydrophobicContact CG-CG2 4.34Å
707	L	92.8	Very high	86	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	136.5	163.3	-170.3	71.7	0	0	0	108.5	T685 Q686 I687 L710 Q749 M750 F752 V774 V809	T685-L707 HydrophobicContact CG2-CD1 3.81Å; T685-L707 HydrophobicContact CG2-CG 4.13Å; Q686-L707 CarbonylContact O-C 3.57Å; Q686-L707 WeakPolarHBondContact O-CA 3.3Å; I687-L707 HydrophobicContact CB-CD1 3.96Å; I687-L707 HydrophobicContact CG1-CD1 4.36Å; L707-L710 HydrophobicContact CD2-CB 4.18Å; L707-L710 HydrophobicContact CD2-CD1 4.36Å; L707-L710 HydrophobicContact CD2-CD2 4.02Å; L707-L710 HydrophobicContact CD2-CG 4.41Å; L707-Q749 CarbonylContact O-C 3.51Å; L707-Q749 WeakPolarHBondContact O-CA 3.44Å; L707-M750 HydrophobicContact CB-CB 4.32Å; L707-M750 HydrophobicContact CD2-SD 4.36Å; L707-M750 PolarHBondContact N-O 3.17Å; L707-M750 PolarHBondContact O-N 3.11Å; L707-F752 HydrophobicContact CB-CE2 4.08Å; L707-V774 HydrophobicContact CD1-CG2 4.03Å; L707-V774 HydrophobicContact CD2-CG1 3.96Å; L707-V774 HydrophobicContact CD2-CG2 4.46Å; L707-V809 HydrophobicContact CD1-CG2 4.12Å
708	K	90.5	Very high	85.8	Confident	60 Å²	60	54.7 Å²	54.7	26%	0.261	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	151.6	-179.6	-68.7	-178.6	176.8	173.1	0	110.5	T685 Q686 Q688 Q706 L710 S748 Q749	T685-K708 CarbonylContact C-O 3.58Å; T685-K708 VanDerWaalsContact CA-O 3.29Å; T685-K708 WeakPolarHBondContact CA-O 3.34Å; Q686-K708 PolarHBondContact N-O 2.9Å; Q686-K708 PolarHBondContact O-N 3.34Å; Q688-K708 VanDerWaalsContact NE2-NZ 3.19Å; Q688-K708 VanDerWaalsContact OE1-NZ 3.11Å; Q706-K708 HydrophobicContact CG-CG 4.12Å; K708-L710 PolarHBondContact O-N 3.48Å; K708-S748 CarbonylContact C-O 3.45Å; K708-Q749 HydrophobicContact CG-CG 4.31Å
709	S	85.8	Confident	86	Confident	30 Å²	30	48.8 Å²	48.8	21%	0.21	25%	0.254	C	S	.	.	S	Bend	trans	54.1	41.9	174	-44.5	0	0	0	0	111.9	E683 T685 S748	E683-S709 PolarHBondContact OE2-OG 3.42Å; T685-S709 VanDerWaalsContact CA-O 3.28Å; T685-S709 WeakPolarHBondContact CA-O 3.32Å; T685-S709 WeakPolarHBondContact CB-O 3.38Å; T685-S709 PolarHBondContact OG1-O 3.31Å; S709-S748 WeakPolarHBondContact CA-O 3.33Å; S709-S748 PolarHBondContact N-O 2.98Å
710	L	85.2	Confident	86.1	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.016	27%	0.271	C	S	.	.			trans	-76.7	126	169.3	176.8	66.5	0	0	0	108.9	T685 L707 K708 C712 V721 S748 M750 M811	T685-L710 HydrophobicContact CG2-CB 4.25Å; T685-L710 HydrophobicContact CG2-CD1 4.25Å; L707-L710 HydrophobicContact CD2-CB 4.18Å; L707-L710 HydrophobicContact CD2-CD1 4.36Å; L707-L710 HydrophobicContact CD2-CD2 4.02Å; L707-L710 HydrophobicContact CD2-CG 4.41Å; K708-L710 PolarHBondContact O-N 3.48Å; L710-C712 PolarHBondContact O-N 2.61Å; L710-V721 HydrophobicContact CD2-CG1 4.31Å; L710-S748 PolarHBondContact N-O 3Å; L710-S748 VanDerWaalsContact N-O 3.09Å; L710-S748 WeakPolarHBondContact O-CA 3.34Å; L710-M750 HydrophobicContact CD2-SD 3.71Å; L710-M811 HydrophobicContact CD1-CE 3.73Å
711	N	83.3	Confident	86.3	Confident	73 Å²	73	52.8 Å²	52.8	39%	0.39	27%	0.271	S	S	.	.			trans	-77.8	105.2	169.8	-177.7	16.1	0	0	0	110.2	S713 N714	N711-S713 PolarHBondContact ND2-OG 2.98Å; N711-S713 PolarHBondContact O-N 2.91Å; N711-S713 PolarHBondContact OD1-N 3.3Å; N711-S713 VanDerWaalsContact OD1-N 3.13Å; N711-S713 PolarHBondContact OD1-OG 2.77Å; N711-N714 PolarHBondContact ND2-OD1 2.76Å; N711-N714 WeakPolarHBondContact O-CB 3.29Å; N711-N714 PolarHBondContact O-N 2.67Å; N711-N714 VanDerWaalsContact O-N 3.13Å
712	C	79.1	Confident	86.4	Confident	38 Å²	38	50 Å²	50	26%	0.257	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-63.3	-24.1	179.8	-63.9	0	0	0	0	113.3	L710 N714 V715 Q747 S748	L710-C712 PolarHBondContact O-N 2.61Å; C712-N714 PolarHBondContact O-N 3.29Å; C712-N714 VanDerWaalsContact O-N 3.13Å; C712-V715 WeakPolarHBondContact O-CB 3.32Å; C712-V715 PolarHBondContact O-N 3.49Å; C712-Q747 VanDerWaalsContact SG-CA 3.53Å; C712-S748 PolarHBondContact SG-N 2.93Å; C712-S748 VanDerWaalsContact SG-N 3.42Å
713	S	73.7	Confident	86.5	Confident	97 Å²	97	50 Å²	50	68%	0.678	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-67.4	-11.4	176.3	86.2	0	0	0	0	113.6	N711 V715	N711-S713 PolarHBondContact ND2-OG 2.98Å; N711-S713 PolarHBondContact O-N 2.91Å; N711-S713 PolarHBondContact OD1-N 3.3Å; N711-S713 VanDerWaalsContact OD1-N 3.13Å; N711-S713 PolarHBondContact OD1-OG 2.77Å; S713-V715 VanDerWaalsContact C-N 3.31Å
714	N	74.4	Confident	86.5	Confident	53 Å²	53	49.1 Å²	49.1	28%	0.283	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-85.2	-6.1	174.2	-68.9	-5.1	0	0	0	112.7	N711 C712 R817	N711-N714 PolarHBondContact ND2-OD1 2.76Å; N711-N714 WeakPolarHBondContact O-CB 3.29Å; N711-N714 PolarHBondContact O-N 2.67Å; N711-N714 VanDerWaalsContact O-N 3.13Å; C712-N714 PolarHBondContact O-N 3.29Å; C712-N714 VanDerWaalsContact O-N 3.13Å; N714-R817 PolarHBondContact O-NH1 2.9Å
715	V	81.5	Confident	86.4	Confident	16 Å²	16	49.1 Å²	49.1	10%	0.097	26%	0.256	C	S	.	.	S	Bend	trans	-104.9	138.5	179.9	-167.7	0	0	0	0	108.7	C712 S713 V721 P746 L786	C712-V715 WeakPolarHBondContact O-CB 3.32Å; C712-V715 PolarHBondContact O-N 3.49Å; S713-V715 VanDerWaalsContact C-N 3.31Å; V715-V721 HydrophobicContact CG1-CG2 3.89Å; V715-V721 HydrophobicContact CG2-CG2 3.93Å; V715-P746 HydrophobicContact CB-CB 4.12Å; V715-P746 HydrophobicContact CB-CG 4.37Å; V715-P746 HydrophobicContact CG1-CB 4.03Å; V715-P746 HydrophobicContact CG1-CG 4.04Å; V715-P746 HydrophobicContact CG2-CB 4.02Å; V715-L786 HydrophobicContact CG2-CD1 3.81Å
716	R	81.1	Confident	86.3	Confident	118 Å²	118	48.7 Å²	48.7	45%	0.445	25%	0.253	S	S	.	.			trans	-74.8	151.1	178.9	-54.2	-176.4	-164.9	-173.5	5.1	110.9	Y719 E784	R716-Y719 HydrophobicContact CB-CD1 4.35Å; R716-Y719 HydrophobicContact CB-CD2 3.69Å; R716-Y719 HydrophobicContact CB-CE2 3.91Å; R716-Y719 HydrophobicContact CB-CG 3.94Å; R716-Y719 PolarHBondContact NH1-OH 3.19Å; R716-Y719 WeakPolarHBondContact O-CB 3.28Å; R716-Y719 PolarHBondContact O-N 3.12Å; R716-Y719 VanDerWaalsContact O-N 3.12Å; R716-E784 IonicContact CZ-OE2 3.88Å; R716-E784 VanDerWaalsContact CZ-OE2 3.3Å; R716-E784 IonicContact NE-OE2 3.63Å; R716-E784 PolarHBondContact NE-OE2 3.49Å; R716-E784 IonicContact NH2-OE2 3.61Å; R716-E784 PolarHBondContact NH2-OE2 3.31Å
717	E	74.3	Confident	85.9	Confident	186 Å²	186	48.2 Å²	48.2	87%	0.869	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	140.9	174.3	-64.3	179.2	165.2	0	0	111.2	Y719	E717-Y719 WeakPolarHBondContact O-CD2 3.37Å; E717-Y719 PolarHBondContact O-N 3.47Å
718	S	77	Confident	85.4	Confident	110 Å²	110	50.8 Å²	50.8	77%	0.769	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	8.1	-174	-49.1	0	0	0	0	116.8
719	Y	89.9	Confident	84.4	Confident	27 Å²	27	50.2 Å²	50.2	11%	0.106	27%	0.267	C	S	.	.			trans	-89.7	143.9	171.9	-76.3	-136.5	0	0	0	110.6	R716 E717 P746 L777 Q782	R716-Y719 HydrophobicContact CB-CD1 4.35Å; R716-Y719 HydrophobicContact CB-CD2 3.69Å; R716-Y719 HydrophobicContact CB-CE2 3.91Å; R716-Y719 HydrophobicContact CB-CG 3.94Å; R716-Y719 PolarHBondContact NH1-OH 3.19Å; R716-Y719 WeakPolarHBondContact O-CB 3.28Å; R716-Y719 PolarHBondContact O-N 3.12Å; R716-Y719 VanDerWaalsContact O-N 3.12Å; E717-Y719 WeakPolarHBondContact O-CD2 3.37Å; E717-Y719 PolarHBondContact O-N 3.47Å; Y719-P746 VanDerWaalsContact O-CD 3.29Å; Y719-P746 WeakPolarHBondContact O-CD 3.2Å; Y719-L777 WeakPolarHBondContact CA-O 3.48Å; Y719-Q782 PolarHBondContact OH-OE1 3.06Å; Y719-Q782 VanDerWaalsContact OH-OE1 3.13Å
720	K	92.8	Very high	83.1	Confident	91 Å²	91	55.7 Å²	55.7	40%	0.396	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	151.7	174.8	-66.3	-172.2	176	-169.6	0	110.9	A743 L744 S776 L777	K720-A743 HydrophobicContact CB-CB 3.86Å; K720-L744 CarbonylContact C-O 3.57Å; K720-L744 VanDerWaalsContact CA-O 3.28Å; K720-L744 WeakPolarHBondContact CA-O 3.43Å; K720-L744 WeakPolarHBondContact CB-O 3.39Å; K720-S776 CarbonylContact O-C 3.59Å; K720-S776 WeakPolarHBondContact O-CA 3.31Å; K720-L777 PolarHBondContact N-O 2.72Å; K720-L777 PolarHBondContact O-N 2.86Å
721	V	92.6	Very high	81.8	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	138.9	-178.9	174.4	0	0	0	0	111.2	L710 V715 L744 P746 M750 V774 C775 L786	L710-V721 HydrophobicContact CD2-CG1 4.31Å; V715-V721 HydrophobicContact CG1-CG2 3.89Å; V715-V721 HydrophobicContact CG2-CG2 3.93Å; V721-L744 PolarHBondContact N-O 3.44Å; V721-L744 PolarHBondContact O-N 3.33Å; V721-P746 HydrophobicContact CG2-CB 4.07Å; V721-M750 HydrophobicContact CB-CE 3.94Å; V721-M750 HydrophobicContact CB-SD 4.04Å; V721-M750 HydrophobicContact CG1-CE 4.32Å; V721-M750 HydrophobicContact CG1-SD 4.01Å; V721-V774 HydrophobicContact CG1-CG1 3.73Å; V721-C775 CarbonylContact C-O 3.5Å; V721-C775 VanDerWaalsContact CA-O 3.31Å; V721-C775 WeakPolarHBondContact CA-O 3.35Å; V721-L786 HydrophobicContact CG1-CD1 4.42Å; V721-L786 HydrophobicContact CG2-CD1 3.9Å
722	Y	94.1	Very high	80.3	Confident	18 Å²	18	63.3 Å²	63.3	7%	0.071	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	170.9	176.7	67.3	-73.1	0	0	0	111.3	K724 C740 A743 C775 L777 E783	Y722-K724 HydrophobicContact CD2-CB 4.44Å; Y722-K724 HydrophobicContact CE2-CB 4.05Å; Y722-K724 HydrophobicContact CE2-CD 4.42Å; Y722-C740 HydrophobicContact CD2-CB 4Å; Y722-C740 HydrophobicContact CE2-CB 4.13Å; Y722-A743 HydrophobicContact CD1-CB 4.47Å; Y722-C775 HydrophobicContact CD1-CB 3.99Å; Y722-C775 WeakPolarHBondContact CD1-O 3.22Å; Y722-C775 HydrophobicContact CE1-CB 3.49Å; Y722-C775 VanDerWaalsContact CE1-CB 3.49Å; Y722-C775 HydrophobicContact CE2-CB 4.13Å; Y722-C775 HydrophobicContact CG-CB 4.5Å; Y722-C775 PolarHBondContact N-O 3.11Å; Y722-C775 PolarHBondContact O-N 3.39Å; Y722-L777 HydrophobicContact CD1-CB 4.36Å; Y722-L777 HydrophobicContact CE1-CB 3.98Å; Y722-E783 VanDerWaalsContact OH-CG 3.31Å; Y722-E783 WeakPolarHBondContact OH-CG 3.49Å; Y722-E783 PolarHBondContact OH-OE1 2.9Å; Y722-E783 PolarHBondContact OH-OE2 2.97Å
723	V	94.1	Very high	78.8	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.4	174.1	-177.3	0	0	0	0	109.3	I687 V704 C740 C741 F752 L772 S773	I687-V723 HydrophobicContact CD1-CB 4.34Å; I687-V723 HydrophobicContact CD1-CG1 3.72Å; I687-V723 HydrophobicContact CD1-CG2 3.74Å; V704-V723 HydrophobicContact CG1-CB 4.44Å; V704-V723 HydrophobicContact CG1-CG2 4.38Å; V723-C740 WeakPolarHBondContact O-CA 3.43Å; V723-C741 PolarHBondContact O-N 3.35Å; V723-F752 HydrophobicContact CG2-CD2 4.36Å; V723-F752 HydrophobicContact CG2-CE2 3.78Å; V723-F752 HydrophobicContact CG2-CZ 3.99Å; V723-L772 HydrophobicContact CG1-CB 4.38Å; V723-L772 HydrophobicContact CG1-CD2 4.01Å; V723-S773 WeakPolarHBondContact CA-O 3.38Å
724	K	93.9	Very high	77.8	Confident	37 Å²	37	70 Å²	70	16%	0.161	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	109.3	177.6	-175.1	169.8	-177.8	177.9	0	108.7	Y722 F738 S773 E783	Y722-K724 HydrophobicContact CD2-CB 4.44Å; Y722-K724 HydrophobicContact CE2-CB 4.05Å; Y722-K724 HydrophobicContact CE2-CD 4.42Å; K724-F738 HydrophobicContact CG-CD1 4.24Å; K724-S773 PolarHBondContact N-O 2.98Å; K724-S773 PolarHBondContact O-N 3.43Å; K724-E783 WeakPolarHBondContact CD-OE1 3.25Å; K724-E783 IonicContact NZ-OE1 3.14Å; K724-E783 PolarHBondContact NZ-OE1 3.18Å; K724-E783 IonicContact NZ-OE2 2.75Å; K724-E783 PolarHBondContact NZ-OE2 3.18Å
725	V	93.2	Very high	76.7	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	135.4	179.9	-171.2	0	0	0	0	109.6	L702 V704 F738 Y739 F756 I758 L770 L772	L702-V725 HydrophobicContact CD2-CB 4.3Å; L702-V725 HydrophobicContact CD2-CG1 3.49Å; L702-V725 VanDerWaalsContact CD2-CG1 3.49Å; L702-V725 HydrophobicContact CD2-CG2 3.85Å; V704-V725 HydrophobicContact CG2-CG2 4.32Å; V725-F738 WeakPolarHBondContact O-CA 3.5Å; V725-Y739 WeakPolarHBondContact CA-O 3.36Å; V725-Y739 VanDerWaalsContact CB-O 3.29Å; V725-Y739 WeakPolarHBondContact CB-O 3.37Å; V725-Y739 WeakPolarHBondContact CG2-O 3.3Å; V725-Y739 PolarHBondContact N-O 2.94Å; V725-Y739 PolarHBondContact O-N 2.89Å; V725-F756 HydrophobicContact CG2-CD2 4.32Å; V725-F756 HydrophobicContact CG2-CE2 4.17Å; V725-I758 HydrophobicContact CG1-CD1 4.23Å; V725-L770 HydrophobicContact CG1-CD1 3.58Å; V725-L770 HydrophobicContact CG1-CG 4.16Å; V725-L772 HydrophobicContact CB-CD2 4.08Å; V725-L772 HydrophobicContact CG1-CD2 3.93Å; V725-L772 HydrophobicContact CG2-CD2 3.69Å
726	H	89.2	Confident	75.5	Confident	34 Å²	34	74.9 Å²	74.9	16%	0.157	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	121.9	176.4	-177.9	-124.9	0	0	0	109.9	I728 C736 F738 Q771	H726-I728 WeakPolarHBondContact ND1-CG1 3.33Å; H726-C736 WeakPolarHBondContact NE2-CB 3.37Å; H726-F738 HydrophobicContact CB-CD1 3.92Å; H726-F738 HydrophobicContact CB-CE1 3.87Å; H726-F738 AromaticContact CD2-CD1 3.7Å; H726-F738 AromaticContact CD2-CE1 3.25Å; H726-F738 WeakPolarHBondContact CD2-CE1 3.38Å; H726-F738 AromaticContact CD2-CZ 3.71Å; H726-F738 AromaticContact CG-CE1 3.62Å; H726-F738 AromaticContact NE2-CE1 3.94Å; H726-F738 AromaticContact NE2-CZ 3.98Å; H726-Q771 HydrophobicContact CB-CB 4.39Å; H726-Q771 PolarHBondContact N-O 2.73Å; H726-Q771 PolarHBondContact O-N 2.79Å
727	L	86.3	Confident	74.9	Confident	22 Å²	22	71.7 Å²	71.7	12%	0.115	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	120.2	172	-174.2	71	0	0	0	109	P729 I758 V760 C768 L770 L793	L727-P729 VanDerWaalsContact O-CD 3.22Å; L727-P729 WeakPolarHBondContact O-CD 3.48Å; L727-I758 HydrophobicContact CB-CG2 4.38Å; L727-I758 HydrophobicContact CD2-CG2 3.82Å; L727-V760 HydrophobicContact CD2-CG2 3.98Å; L727-C768 HydrophobicContact CD1-CB 3.9Å; L727-C768 HydrophobicContact CG-CB 4.39Å; L727-L770 HydrophobicContact CD1-CD1 4.2Å; L727-L793 HydrophobicContact CD1-CD1 3.45Å; L727-L793 VanDerWaalsContact CD1-CD1 3.45Å
728	I	81.2	Confident	75.4	Confident	53 Å²	53	68.3 Å²	68.3	27%	0.272	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	105.1	178.6	-57.6	170.6	0	0	0	108.6	H726 C768 A769 Q771	H726-I728 WeakPolarHBondContact ND1-CG1 3.33Å; I728-C768 WeakPolarHBondContact O-CA 3.46Å; I728-A769 PolarHBondContact N-O 3.01Å; I728-A769 PolarHBondContact O-N 3.47Å; I728-Q771 HydrophobicContact CD1-CB 3.86Å; I728-Q771 HydrophobicContact CG1-CB 4.49Å
729	P	70.1	Confident	75.9	Confident	48 Å²	48	65.6 Å²	65.6	31%	0.312	37%	0.369	S	S	.	.			trans	-76.7	156.5	163.5	34.2	-34.9	0	0	0	110.6	L727	L727-P729 VanDerWaalsContact O-CD 3.22Å; L727-P729 WeakPolarHBondContact O-CD 3.48Å
730	L	58.6	Low	76	Confident	146 Å²	146	67.1 Å²	67.1	76%	0.764	38%	0.383	S	S	*	.	S	Bend	trans	-73	-26	172.1	-86.3	166	0	0	0	113.5	A767	L730-A767 HydrophobicContact CD1-CB 4.17Å
731	D	56.6	Low	76	Confident	125 Å²	125	63.1 Å²	63.1	67%	0.668	37%	0.366	S	S	*	.			trans	-89.5	109.3	177	-67.1	-40.2	0	0	0	111.5	S733	D731-S733 PolarHBondContact O-N 3.41Å
732	A	51.8	Low	75.9	Confident	111 Å²	111	66.9 Å²	66.9	92%	0.917	39%	0.389	S	S	*	.			trans	-73.4	24.7	-177.2	0	0	0	0	0	115.2
733	S	47.8	Very low	75.8	Confident	99 Å²	99	67.7 Å²	67.7	69%	0.692	40%	0.4	S	S	*	.			trans	-100.8	9.9	-169.9	60.7	0	0	0	0	114.9	D731	D731-S733 PolarHBondContact O-N 3.41Å
734	R	54.3	Low	75.6	Confident	177 Å²	177	70.5 Å²	70.5	67%	0.668	41%	0.414	S	S	*	.	S	Bend	trans	-134	145.3	-177.2	-63.8	-173.6	179.5	-157.4	-1.6	112.3	C736	R734-C736 PolarHBondContact O-N 3.09Å
735	A	49.6	Very low	75.5	Confident	106 Å²	106	74.9 Å²	74.9	88%	0.876	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-59.5	127	170.5	0	0	0	0	0	110.3
736	C	57.3	Low	75.2	Confident	64 Å²	64	76.9 Å²	76.9	43%	0.432	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-82.6	123.1	-177.1	-67.8	0	0	0	0	110.8	H726 R734	H726-C736 WeakPolarHBondContact NE2-CB 3.37Å; R734-C736 PolarHBondContact O-N 3.09Å
737	A	68.8	Low	75.1	Confident	51 Å²	51	80.8 Å²	80.8	42%	0.421	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-87	123.5	175.7	0	0	0	0	0	110.6	Y739	A737-Y739 HydrophobicContact CB-CE2 3.86Å
738	F	84.2	Confident	75	Confident	116 Å²	116	83.3 Å²	83.3	51%	0.509	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	141.1	169.6	-62.2	-83.9	0	0	0	110.2	K724 V725 H726	K724-F738 HydrophobicContact CG-CD1 4.24Å; V725-F738 WeakPolarHBondContact O-CA 3.5Å; H726-F738 HydrophobicContact CB-CD1 3.92Å; H726-F738 HydrophobicContact CB-CE1 3.87Å; H726-F738 AromaticContact CD2-CD1 3.7Å; H726-F738 AromaticContact CD2-CE1 3.25Å; H726-F738 WeakPolarHBondContact CD2-CE1 3.38Å; H726-F738 AromaticContact CD2-CZ 3.71Å; H726-F738 AromaticContact CG-CE1 3.62Å; H726-F738 AromaticContact NE2-CE1 3.94Å; H726-F738 AromaticContact NE2-CZ 3.98Å
739	Y	88.6	Confident	75.3	Confident	52 Å²	52	86 Å²	86	20%	0.204	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120	173.6	-54.8	-99.8	0	0	0	108	V725 A737 F756 I758 P759	V725-Y739 WeakPolarHBondContact CA-O 3.36Å; V725-Y739 VanDerWaalsContact CB-O 3.29Å; V725-Y739 WeakPolarHBondContact CB-O 3.37Å; V725-Y739 WeakPolarHBondContact CG2-O 3.3Å; V725-Y739 PolarHBondContact N-O 2.94Å; V725-Y739 PolarHBondContact O-N 2.89Å; A737-Y739 HydrophobicContact CB-CE2 3.86Å; Y739-F756 HydrophobicContact CD1-CB 4.25Å; Y739-F756 HydrophobicContact CD1-CD1 4.12Å; Y739-F756 HydrophobicContact CD1-CG 4.44Å; Y739-F756 HydrophobicContact CG-CB 4.46Å; Y739-F756 HydrophobicContact CG-CD1 4.33Å; Y739-F756 HydrophobicContact CG-CG 4.45Å; Y739-I758 HydrophobicContact CD2-CD1 3.95Å; Y739-I758 HydrophobicContact CD2-CG1 4.01Å; Y739-I758 HydrophobicContact CE1-CG1 4.28Å; Y739-I758 HydrophobicContact CE2-CB 4.29Å; Y739-I758 HydrophobicContact CE2-CD1 4.05Å; Y739-I758 HydrophobicContact CE2-CG1 3.76Å; Y739-I758 HydrophobicContact CE2-CG2 3.81Å; Y739-I758 HydrophobicContact CG-CG1 4.4Å; Y739-P759 WeakPolarHBondContact OH-CD 3.28Å
740	C	91.7	Very high	76.3	Confident	59 Å²	59	84 Å²	84	40%	0.399	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137.2	-177.7	-62.2	0	0	0	0	110	Y722 V723	Y722-C740 HydrophobicContact CD2-CB 4Å; Y722-C740 HydrophobicContact CE2-CB 4.13Å; V723-C740 WeakPolarHBondContact O-CA 3.43Å
741	C	92.2	Very high	77.8	Confident	7 Å²	7	80.7 Å²	80.7	5%	0.047	47%	0.47	C	S	.	.			trans	-71.9	162.4	164.5	-53	0	0	0	0	110.2	V723 F752 E754	V723-C741 PolarHBondContact O-N 3.35Å; C741-F752 HydrophobicContact CB-CB 4.48Å; C741-F752 HydrophobicContact CB-CD1 3.6Å; C741-F752 HydrophobicContact CB-CE1 4.08Å; C741-F752 HydrophobicContact CB-CG 4.16Å; C741-E754 VanDerWaalsContact CA-OE2 3.29Å; C741-E754 WeakPolarHBondContact CA-OE2 3.33Å
742	T	90.9	Very high	79.5	Confident	79 Å²	79	75.5 Å²	75.5	49%	0.485	44%	0.442	S	S	.	.			trans	-58.5	144.6	170	59.4	0	0	0	0	111.7	L744 F752 E754	T742-L744 PolarHBondContact O-N 2.97Å; T742-F752 WeakPolarHBondContact O-CE1 3.44Å; T742-E754 WeakPolarHBondContact CB-OE1 3.46Å; T742-E754 VanDerWaalsContact N-CD 3.33Å; T742-E754 PolarHBondContact N-OE1 3.45Å; T742-E754 PolarHBondContact N-OE2 2.96Å; T742-E754 VanDerWaalsContact N-OE2 3.09Å; T742-E754 PolarHBondContact OG1-OE1 3.31Å
743	A	91.8	Very high	81.4	Confident	36 Å²	36	75.2 Å²	75.2	30%	0.298	43%	0.425	S	S	.	.			trans	-84.7	114.2	179.2	0	0	0	0	0	110.8	K720 Y722 L777	K720-A743 HydrophobicContact CB-CB 3.86Å; Y722-A743 HydrophobicContact CD1-CB 4.47Å; A743-L777 HydrophobicContact CB-CD2 4.47Å
744	L	90.6	Very high	83.5	Confident	58 Å²	58	72.5 Å²	72.5	30%	0.304	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-108.2	162.8	-175.7	-58.5	177.8	0	0	0	110.7	K720 V721 T742 M750 T751 F752	K720-L744 CarbonylContact C-O 3.57Å; K720-L744 VanDerWaalsContact CA-O 3.28Å; K720-L744 WeakPolarHBondContact CA-O 3.43Å; K720-L744 WeakPolarHBondContact CB-O 3.39Å; V721-L744 PolarHBondContact N-O 3.44Å; V721-L744 PolarHBondContact O-N 3.33Å; T742-L744 PolarHBondContact O-N 2.97Å; L744-M750 HydrophobicContact CB-CE 3.57Å; L744-T751 VanDerWaalsContact CD1-O 3.24Å; L744-T751 WeakPolarHBondContact CD1-O 3.37Å; L744-F752 HydrophobicContact CD1-CD1 3.7Å; L744-F752 HydrophobicContact CD1-CE1 3.77Å; L744-F752 HydrophobicContact CD1-CG 4.41Å; L744-F752 HydrophobicContact CG-CD1 4.31Å; L744-F752 HydrophobicContact CG-CE1 4.11Å
745	E	90.1	Very high	85.3	Confident	129 Å²	129	66.3 Å²	66.3	60%	0.603	39%	0.393	S	S	*	.			trans	-71.9	141	176.7	-74.7	163.1	-162.7	0	0	110.9	Q747 M750	E745-Q747 PolarHBondContact O-N 3.48Å; E745-M750 VanDerWaalsContact O-CE 3.29Å; E745-M750 WeakPolarHBondContact O-CE 3.43Å
746	P	88.2	Confident	87.3	Confident	42 Å²	42	62.6 Å²	62.6	27%	0.273	36%	0.357	S	S	.	.			trans	-67.6	116.1	-171.7	26.1	-33.9	0	0	0	111.2	V715 Y719 V721	V715-P746 HydrophobicContact CB-CB 4.12Å; V715-P746 HydrophobicContact CB-CG 4.37Å; V715-P746 HydrophobicContact CG1-CB 4.03Å; V715-P746 HydrophobicContact CG1-CG 4.04Å; V715-P746 HydrophobicContact CG2-CB 4.02Å; Y719-P746 VanDerWaalsContact O-CD 3.29Å; Y719-P746 WeakPolarHBondContact O-CD 3.2Å; V721-P746 HydrophobicContact CG2-CB 4.07Å
747	Q	86.5	Confident	88.9	Confident	116 Å²	116	66.2 Å²	66.2	54%	0.542	36%	0.362	S	S	.	.			trans	-130	152.6	176.1	-63.1	179	7.4	0	0	109.2	C712 E745 Q749 M750	C712-Q747 VanDerWaalsContact SG-CA 3.53Å; E745-Q747 PolarHBondContact O-N 3.48Å; Q747-Q749 PolarHBondContact O-N 3.34Å; Q747-Q749 VanDerWaalsContact O-N 3.09Å; Q747-M750 HydrophobicContact CB-CG 4.15Å; Q747-M750 WeakPolarHBondContact O-CG 3.5Å
748	S	83.9	Confident	89.9	Confident	76 Å²	76	64 Å²	64	53%	0.531	34%	0.342	S	S	.	.	S	Bend	trans	-63	-20.7	-178.1	-49	0	0	0	0	113.2	K708 S709 L710 C712	K708-S748 CarbonylContact C-O 3.45Å; S709-S748 WeakPolarHBondContact CA-O 3.33Å; S709-S748 PolarHBondContact N-O 2.98Å; L710-S748 PolarHBondContact N-O 3Å; L710-S748 VanDerWaalsContact N-O 3.09Å; L710-S748 WeakPolarHBondContact O-CA 3.34Å; C712-S748 PolarHBondContact SG-N 2.93Å; C712-S748 VanDerWaalsContact SG-N 3.42Å
749	Q	88.3	Confident	90	Very high	109 Å²	109	62.8 Å²	62.8	51%	0.509	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	118.5	171.9	-178.3	173.9	13.3	0	0	108.5	Q706 L707 K708 Q747	Q706-Q749 VanDerWaalsContact CD-NE2 3.27Å; Q706-Q749 HydrophobicContact CG-CG 4.07Å; Q706-Q749 VanDerWaalsContact NE2-NE2 3.18Å; L707-Q749 CarbonylContact O-C 3.51Å; L707-Q749 WeakPolarHBondContact O-CA 3.44Å; K708-Q749 HydrophobicContact CG-CG 4.31Å; Q747-Q749 PolarHBondContact O-N 3.34Å; Q747-Q749 VanDerWaalsContact O-N 3.09Å
750	M	90.7	Very high	89.7	Confident	5 Å²	5	60.6 Å²	60.6	3%	0.025	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	118	-173.2	-53.6	-178.4	61.9	0	0	110.8	Q706 L707 L710 V721 L744 E745 Q747 F752	Q706-M750 CarbonylContact C-O 3.6Å; Q706-M750 VanDerWaalsContact CA-O 3.26Å; Q706-M750 WeakPolarHBondContact CA-O 3.31Å; Q706-M750 WeakPolarHBondContact CG-O 3.28Å; L707-M750 HydrophobicContact CB-CB 4.32Å; L707-M750 HydrophobicContact CD2-SD 4.36Å; L707-M750 PolarHBondContact N-O 3.17Å; L707-M750 PolarHBondContact O-N 3.11Å; L710-M750 HydrophobicContact CD2-SD 3.71Å; V721-M750 HydrophobicContact CB-CE 3.94Å; V721-M750 HydrophobicContact CB-SD 4.04Å; V721-M750 HydrophobicContact CG1-CE 4.32Å; V721-M750 HydrophobicContact CG1-SD 4.01Å; L744-M750 HydrophobicContact CB-CE 3.57Å; E745-M750 VanDerWaalsContact O-CE 3.29Å; E745-M750 WeakPolarHBondContact O-CE 3.43Å; Q747-M750 HydrophobicContact CB-CG 4.15Å; Q747-M750 WeakPolarHBondContact O-CG 3.5Å; M750-F752 HydrophobicContact CB-CE2 4.19Å; M750-F752 HydrophobicContact CB-CZ 4.39Å; M750-F752 HydrophobicContact CE-CZ 4.18Å
751	T	91	Very high	88.8	Confident	77 Å²	77	60.4 Å²	60.4	47%	0.472	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	124.1	173.1	49.2	0	0	0	0	111.4	Q706 L744	Q706-T751 HydrophobicContact CG-CG2 4.34Å; L744-T751 VanDerWaalsContact CD1-O 3.24Å; L744-T751 WeakPolarHBondContact CD1-O 3.37Å
752	F	91.4	Very high	87.3	Confident	17 Å²	17	62.2 Å²	62.2	8%	0.075	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	-51.9	169.9	-61.9	-81.5	0	0	0	110.4	V704 L705 L707 V723 C741 T742 L744 M750 E754	V704-F752 HydrophobicContact CG1-CB 4.26Å; V704-F752 HydrophobicContact CG1-CD2 4.06Å; V704-F752 HydrophobicContact CG1-CG 4.37Å; L705-F752 PolarHBondContact O-N 2.91Å; L707-F752 HydrophobicContact CB-CE2 4.08Å; V723-F752 HydrophobicContact CG2-CD2 4.36Å; V723-F752 HydrophobicContact CG2-CE2 3.78Å; V723-F752 HydrophobicContact CG2-CZ 3.99Å; C741-F752 HydrophobicContact CB-CB 4.48Å; C741-F752 HydrophobicContact CB-CD1 3.6Å; C741-F752 HydrophobicContact CB-CE1 4.08Å; C741-F752 HydrophobicContact CB-CG 4.16Å; T742-F752 WeakPolarHBondContact O-CE1 3.44Å; L744-F752 HydrophobicContact CD1-CD1 3.7Å; L744-F752 HydrophobicContact CD1-CE1 3.77Å; L744-F752 HydrophobicContact CD1-CG 4.41Å; L744-F752 HydrophobicContact CG-CD1 4.31Å; L744-F752 HydrophobicContact CG-CE1 4.11Å; M750-F752 HydrophobicContact CB-CE2 4.19Å; M750-F752 HydrophobicContact CB-CZ 4.39Å; M750-F752 HydrophobicContact CE-CZ 4.18Å; F752-E754 PolarHBondContact O-N 2.74Å
753	N	90.6	Very high	86.1	Confident	105 Å²	105	65.5 Å²	65.5	56%	0.561	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54.1	25.6	-174.1	-64.1	-39.1	0	0	0	114.7	V704 L705	V704-N753 CarbonylContact O-C 3.53Å; V704-N753 VanDerWaalsContact O-CA 3.25Å; V704-N753 WeakPolarHBondContact O-CA 3.23Å; V704-N753 PolarHBondContact O-N 3.32Å; L705-N753 PolarHBondContact O-N 3.49Å; L705-N753 VanDerWaalsContact O-N 3.09Å; L705-N753 PolarHBondContact O-OD1 3.17Å
754	E	92.8	Very high	85.2	Confident	41 Å²	41	64.9 Å²	64.9	19%	0.192	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	144.7	-176.4	-72.4	177.2	-122.4	0	0	112.1	H703 V704 C741 T742 F752 F756	H703-E754 CarbonylContact C-O 3.47Å; H703-E754 VanDerWaalsContact CA-O 3.26Å; H703-E754 WeakPolarHBondContact CA-O 3.38Å; V704-E754 PolarHBondContact N-O 2.67Å; V704-E754 PolarHBondContact O-N 3.04Å; V704-E754 VanDerWaalsContact O-N 3.08Å; C741-E754 VanDerWaalsContact CA-OE2 3.29Å; C741-E754 WeakPolarHBondContact CA-OE2 3.33Å; T742-E754 WeakPolarHBondContact CB-OE1 3.46Å; T742-E754 VanDerWaalsContact N-CD 3.33Å; T742-E754 PolarHBondContact N-OE1 3.45Å; T742-E754 PolarHBondContact N-OE2 2.96Å; T742-E754 VanDerWaalsContact N-OE2 3.09Å; T742-E754 PolarHBondContact OG1-OE1 3.31Å; F752-E754 PolarHBondContact O-N 2.74Å; E754-F756 HydrophobicContact CB-CE2 4.4Å; E754-F756 HydrophobicContact CB-CZ 4.17Å
755	G	92.2	Very high	84.5	Confident	48 Å²	48	62.2 Å²	62.2	50%	0.495	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.3	-175.1	0	0	0	0	0	113	L702	L702-G755 CarbonylContact O-C 3.54Å; L702-G755 WeakPolarHBondContact O-CA 3.49Å
756	F	92.4	Very high	83.9	Confident	27 Å²	27	58.5 Å²	58.5	12%	0.118	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	140.6	178.1	-51.7	-71.9	0	0	0	110.9	R701 L702 V704 V725 Y739 E754 I758	R701-F756 WeakPolarHBondContact CA-O 3.47Å; L702-F756 HydrophobicContact CD2-CD2 4.13Å; L702-F756 HydrophobicContact CG-CD2 4.33Å; L702-F756 PolarHBondContact N-O 2.93Å; L702-F756 PolarHBondContact O-N 3.47Å; V704-F756 HydrophobicContact CG2-CD2 4.38Å; V704-F756 HydrophobicContact CG2-CE2 3.93Å; V725-F756 HydrophobicContact CG2-CD2 4.32Å; V725-F756 HydrophobicContact CG2-CE2 4.17Å; Y739-F756 HydrophobicContact CD1-CB 4.25Å; Y739-F756 HydrophobicContact CD1-CD1 4.12Å; Y739-F756 HydrophobicContact CD1-CG 4.44Å; Y739-F756 HydrophobicContact CG-CB 4.46Å; Y739-F756 HydrophobicContact CG-CD1 4.33Å; Y739-F756 HydrophobicContact CG-CG 4.45Å; E754-F756 HydrophobicContact CB-CE2 4.4Å; E754-F756 HydrophobicContact CB-CZ 4.17Å; F756-I758 HydrophobicContact CB-CG1 4.25Å
757	R	91	Very high	83.3	Confident	141 Å²	141	58.8 Å²	58.8	53%	0.532	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	96.1	173.7	-165.4	-177.3	-152.7	168.9	8.4	109	E694 S699	E694-R757 VanDerWaalsContact CD-NH2 3.27Å; E694-R757 IonicContact OE1-NH2 3.59Å; E694-R757 PolarHBondContact OE1-NH2 2.91Å; E694-R757 IonicContact OE2-CZ 2.94Å; E694-R757 IonicContact OE2-NE 3.17Å; E694-R757 PolarHBondContact OE2-NE 3.45Å; E694-R757 IonicContact OE2-NH2 2.65Å; E694-R757 PolarHBondContact OE2-NH2 3.19Å; S699-R757 WeakPolarHBondContact OG-CG 3.33Å; S699-R757 PolarHBondContact OG-NE 2.92Å
758	I	89.6	Confident	83.1	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.015	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	116.9	-172.8	-51.9	179.7	0	0	0	108.3	S699 L700 L702 V725 L727 Y739 F756 L770	S699-I758 CarbonylContact C-O 3.59Å; S699-I758 VanDerWaalsContact CA-O 3.28Å; S699-I758 WeakPolarHBondContact CA-O 3.28Å; L700-I758 PolarHBondContact N-O 3Å; L700-I758 PolarHBondContact O-N 3.05Å; L702-I758 HydrophobicContact CB-CD1 4.47Å; L702-I758 HydrophobicContact CD2-CD1 4.18Å; V725-I758 HydrophobicContact CG1-CD1 4.23Å; L727-I758 HydrophobicContact CB-CG2 4.38Å; L727-I758 HydrophobicContact CD2-CG2 3.82Å; Y739-I758 HydrophobicContact CD2-CD1 3.95Å; Y739-I758 HydrophobicContact CD2-CG1 4.01Å; Y739-I758 HydrophobicContact CE1-CG1 4.28Å; Y739-I758 HydrophobicContact CE2-CB 4.29Å; Y739-I758 HydrophobicContact CE2-CD1 4.05Å; Y739-I758 HydrophobicContact CE2-CG1 3.76Å; Y739-I758 HydrophobicContact CE2-CG2 3.81Å; Y739-I758 HydrophobicContact CG-CG1 4.4Å; F756-I758 HydrophobicContact CB-CG1 4.25Å; I758-L770 HydrophobicContact CD1-CD1 4.38Å
759	P	86.3	Confident	83.3	Confident	92 Å²	92	51.5 Å²	51.5	60%	0.597	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	132.3	176.7	29.5	-32.8	0	0	0	110.3	Y739	Y739-P759 WeakPolarHBondContact OH-CD 3.28Å
760	V	81.9	Confident	83.4	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.03	28%	0.284	C	S	.	.			trans	-125.9	134.6	179.8	-170.8	0	0	0	0	108.7	W693 R698 L700 L727 A764 L765	W693-V760 HydrophobicContact CH2-CB 4.02Å; W693-V760 HydrophobicContact CZ3-CB 3.8Å; W693-V760 HydrophobicContact CZ3-CG2 4.1Å; R698-V760 PolarHBondContact O-N 3.34Å; R698-V760 VanDerWaalsContact O-O 3.07Å; L700-V760 HydrophobicContact CB-CG2 3.98Å; L727-V760 HydrophobicContact CD2-CG2 3.98Å; V760-A764 HydrophobicContact CG1-CB 4.47Å; V760-L765 HydrophobicContact CG1-CB 4.43Å; V760-L765 HydrophobicContact CG1-CD1 4.27Å; V760-L765 HydrophobicContact CG2-CD1 4.29Å
761	P	72.1	Confident	83.4	Confident	56 Å²	56	48 Å²	48	36%	0.364	29%	0.292	S	S	.	.			trans	-57.2	146.4	176.3	-22.2	32.6	0	0	0	111.9	N763 A764	P761-N763 PolarHBondContact O-N 2.79Å; P761-A764 HydrophobicContact CB-CB 3.83Å; P761-A764 HydrophobicContact CG-CB 4.22Å; P761-A764 WeakPolarHBondContact O-CB 3.31Å; P761-A764 PolarHBondContact O-N 3.17Å; P761-A764 VanDerWaalsContact O-N 3.11Å
762	A	60.5	Low	83.5	Confident	44 Å²	44	44.4 Å²	44.4	36%	0.364	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	136.7	174.4	0	0	0	0	0	110.1	A764	A762-A764 PolarHBondContact O-N 2.89Å
763	N	65.4	Low	83.6	Confident	149 Å²	149	44.3 Å²	44.3	80%	0.797	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	7.8	-178.3	-45	-0.2	0	0	0	115.1	P761	P761-N763 PolarHBondContact O-N 2.79Å
764	A	72.9	Confident	83.8	Confident	23 Å²	23	39.4 Å²	39.4	19%	0.19	25%	0.245	C	C	.	.			trans	-100.3	-7.2	179.4	0	0	0	0	0	114.4	V760 P761 A762 A766 A767 C768	V760-A764 HydrophobicContact CG1-CB 4.47Å; P761-A764 HydrophobicContact CB-CB 3.83Å; P761-A764 HydrophobicContact CG-CB 4.22Å; P761-A764 WeakPolarHBondContact O-CB 3.31Å; P761-A764 PolarHBondContact O-N 3.17Å; P761-A764 VanDerWaalsContact O-N 3.11Å; A762-A764 PolarHBondContact O-N 2.89Å; A764-A766 PolarHBondContact O-N 2.78Å; A764-A767 CarbonylContact O-C 3.57Å; A764-A767 WeakPolarHBondContact O-CA 3.45Å; A764-A767 WeakPolarHBondContact O-CB 3.2Å; A764-A767 PolarHBondContact O-N 3.28Å; A764-C768 PolarHBondContact O-N 2.96Å; A764-C768 PolarHBondContact O-SG 2.74Å
765	L	77.6	Confident	83.8	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-58.9	-49.4	-174.4	-174.1	72.9	0	0	0	112.2	W693 L700 V760 A767 C768 L793 C796 E797	W693-L765 HydrophobicContact CB-CD2 3.92Å; W693-L765 HydrophobicContact CD2-CD2 3.71Å; W693-L765 HydrophobicContact CE3-CD1 4.13Å; W693-L765 HydrophobicContact CE3-CD2 4.12Å; W693-L765 HydrophobicContact CG-CD2 3.61Å; W693-L765 HydrophobicContact CZ3-CD1 4.39Å; L700-L765 HydrophobicContact CD1-CD1 4.32Å; V760-L765 HydrophobicContact CG1-CB 4.43Å; V760-L765 HydrophobicContact CG1-CD1 4.27Å; V760-L765 HydrophobicContact CG2-CD1 4.29Å; L765-A767 PolarHBondContact O-N 3.27Å; L765-A767 VanDerWaalsContact O-N 3.16Å; L765-C768 PolarHBondContact O-N 3.12Å; L765-L793 HydrophobicContact CD1-CB 4.09Å; L765-L793 HydrophobicContact CD1-CD1 4.13Å; L765-L793 HydrophobicContact CG-CB 4.17Å; L765-L793 WeakPolarHBondContact O-CB 3.39Å; L765-C796 HydrophobicContact CD2-CB 4.03Å; L765-E797 HydrophobicContact CD2-CB 4.26Å
766	A	76.4	Confident	83.8	Confident	52 Å²	52	35.2 Å²	35.2	43%	0.43	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-67.8	-12.5	178.6	0	0	0	0	0	114.4	A764 A794	A764-A766 PolarHBondContact O-N 2.78Å; A766-A794 HydrophobicContact CB-CB 4.33Å
767	A	75.9	Confident	83.8	Confident	47 Å²	47	36.7 Å²	36.7	39%	0.388	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-96	3.8	174.2	0	0	0	0	0	113.1	L730 A764 L765	L730-A767 HydrophobicContact CD1-CB 4.17Å; A764-A767 CarbonylContact O-C 3.57Å; A764-A767 WeakPolarHBondContact O-CA 3.45Å; A764-A767 WeakPolarHBondContact O-CB 3.2Å; A764-A767 PolarHBondContact O-N 3.28Å; L765-A767 PolarHBondContact O-N 3.27Å; L765-A767 VanDerWaalsContact O-N 3.16Å
768	C	83.1	Confident	83.7	Confident	6 Å²	6	30.3 Å²	30.3	4%	0.041	20%	0.199	C	C	.	.			trans	-109.4	146.1	-179.9	-66.7	0	0	0	0	112.3	L727 I728 A764 L765 L793	L727-C768 HydrophobicContact CD1-CB 3.9Å; L727-C768 HydrophobicContact CG-CB 4.39Å; I728-C768 WeakPolarHBondContact O-CA 3.46Å; A764-C768 PolarHBondContact O-N 2.96Å; A764-C768 PolarHBondContact O-SG 2.74Å; L765-C768 PolarHBondContact O-N 3.12Å; C768-L793 HydrophobicContact CB-CD1 4.02Å; C768-L793 WeakPolarHBondContact O-CB 3.37Å; C768-L793 PolarHBondContact O-N 2.88Å
769	A	86.9	Confident	83.1	Confident	33 Å²	33	35.2 Å²	35.2	27%	0.273	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	137.6	170.5	0	0	0	0	0	110.7	I728 L791	I728-A769 PolarHBondContact N-O 3.01Å; I728-A769 PolarHBondContact O-N 3.47Å; A769-L791 CarbonylContact C-O 3.56Å; A769-L791 WeakPolarHBondContact CA-O 3.36Å
770	L	89.9	Confident	82.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	116.8	173.2	-163.8	74.8	0	0	0	109.1	L691 L702 V725 L727 I758 L772 K790 L791 L793	L691-L770 HydrophobicContact CD2-CD2 4.43Å; L702-L770 HydrophobicContact CD1-CD2 4.08Å; L702-L770 HydrophobicContact CD2-CD1 4.43Å; L702-L770 HydrophobicContact CD2-CD2 4.01Å; V725-L770 HydrophobicContact CG1-CD1 3.58Å; V725-L770 HydrophobicContact CG1-CG 4.16Å; L727-L770 HydrophobicContact CD1-CD1 4.2Å; I758-L770 HydrophobicContact CD1-CD1 4.38Å; L770-L772 HydrophobicContact CD2-CD1 4.45Å; L770-L772 HydrophobicContact CD2-CD2 4.38Å; L770-L772 HydrophobicContact CD2-CG 4.45Å; L770-K790 CarbonylContact O-C 3.51Å; L770-K790 WeakPolarHBondContact O-CA 3.18Å; L770-L791 PolarHBondContact N-O 2.82Å; L770-L791 PolarHBondContact O-N 2.89Å; L770-L793 HydrophobicContact CB-CD2 4.37Å; L770-L793 HydrophobicContact CB-CG 4.5Å
771	Q	91.4	Very high	82.7	Confident	40 Å²	40	43.1 Å²	43.1	19%	0.187	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	139.6	166.8	177.6	173.1	-33.7	0	0	109.7	H726 I728 K790	H726-Q771 HydrophobicContact CB-CB 4.39Å; H726-Q771 PolarHBondContact N-O 2.73Å; H726-Q771 PolarHBondContact O-N 2.79Å; I728-Q771 HydrophobicContact CD1-CB 3.86Å; I728-Q771 HydrophobicContact CG1-CB 4.49Å; Q771-K790 HydrophobicContact CB-CG 4.21Å; Q771-K790 HydrophobicContact CG-CG 4.22Å; Q771-K790 VanDerWaalsContact OE1-NZ 3.14Å
772	L	93.5	Very high	83.2	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124.5	177	-63.8	161.2	0	0	0	107.8	I687 L689 V723 V725 L770 T788 A789 L807	I687-L772 HydrophobicContact CG2-CD1 4.36Å; L689-L772 HydrophobicContact CD1-CD1 3.45Å; L689-L772 VanDerWaalsContact CD1-CD1 3.45Å; L689-L772 HydrophobicContact CD2-CD1 3.97Å; L689-L772 HydrophobicContact CG-CD1 4.32Å; V723-L772 HydrophobicContact CG1-CB 4.38Å; V723-L772 HydrophobicContact CG1-CD2 4.01Å; V725-L772 HydrophobicContact CB-CD2 4.08Å; V725-L772 HydrophobicContact CG1-CD2 3.93Å; V725-L772 HydrophobicContact CG2-CD2 3.69Å; L770-L772 HydrophobicContact CD2-CD1 4.45Å; L770-L772 HydrophobicContact CD2-CD2 4.38Å; L770-L772 HydrophobicContact CD2-CG 4.45Å; L772-T788 CarbonylContact O-C 3.54Å; L772-T788 WeakPolarHBondContact O-CA 3.46Å; L772-A789 HydrophobicContact CB-CB 4.46Å; L772-A789 PolarHBondContact N-O 3.49Å; L772-A789 PolarHBondContact O-N 3.14Å; L772-L807 HydrophobicContact CD1-CD1 3.92Å
773	S	93.9	Very high	84.5	Confident	16 Å²	16	45.7 Å²	45.7	11%	0.112	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125.6	173	-62.2	0	0	0	0	108.8	V723 K724 G787	V723-S773 WeakPolarHBondContact CA-O 3.38Å; K724-S773 PolarHBondContact N-O 2.98Å; K724-S773 PolarHBondContact O-N 3.43Å; S773-G787 WeakPolarHBondContact CA-O 3.29Å
774	V	93.6	Very high	85.6	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.9	168.3	-178.3	0	0	0	0	106.6	L707 V721 L786 G787 V809	L707-V774 HydrophobicContact CD1-CG2 4.03Å; L707-V774 HydrophobicContact CD2-CG1 3.96Å; L707-V774 HydrophobicContact CD2-CG2 4.46Å; V721-V774 HydrophobicContact CG1-CG1 3.73Å; V774-L786 HydrophobicContact CG1-CB 4.46Å; V774-L786 HydrophobicContact CG1-CD1 4.36Å; V774-L786 WeakPolarHBondContact O-CB 3.5Å; V774-L786 PolarHBondContact O-N 3.14Å; V774-G787 PolarHBondContact N-O 2.7Å; V774-G787 PolarHBondContact O-N 3.45Å; V774-V809 HydrophobicContact CG2-CG1 3.91Å; V774-V809 HydrophobicContact CG2-CG2 4.28Å
775	C	93.8	Very high	86.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	147.5	-173.1	-61.4	0	0	0	0	110.4	V721 Y722 E783	V721-C775 CarbonylContact C-O 3.5Å; V721-C775 VanDerWaalsContact CA-O 3.31Å; V721-C775 WeakPolarHBondContact CA-O 3.35Å; Y722-C775 HydrophobicContact CD1-CB 3.99Å; Y722-C775 WeakPolarHBondContact CD1-O 3.22Å; Y722-C775 HydrophobicContact CE1-CB 3.49Å; Y722-C775 VanDerWaalsContact CE1-CB 3.49Å; Y722-C775 HydrophobicContact CE2-CB 4.13Å; Y722-C775 HydrophobicContact CG-CB 4.5Å; Y722-C775 PolarHBondContact N-O 3.11Å; Y722-C775 PolarHBondContact O-N 3.39Å; C775-E783 HydrophobicContact CB-CG 4.05Å; C775-E783 PolarHBondContact SG-OE1 3.4Å
776	S	92.4	Very high	87	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.007	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	147.7	166.7	61.6	0	0	0	0	110.8	K720 E783 E784	K720-S776 CarbonylContact O-C 3.59Å; K720-S776 WeakPolarHBondContact O-CA 3.31Å; S776-E783 CarbonylContact O-C 3.53Å; S776-E783 WeakPolarHBondContact O-CA 3.36Å; S776-E784 PolarHBondContact N-O 2.94Å; S776-E784 PolarHBondContact O-N 3.09Å; S776-E784 PolarHBondContact OG-O 3.38Å; S776-E784 VanDerWaalsContact OG-O 3.14Å
777	L	92.5	Very high	87.6	Confident	58 Å²	58	37.6 Å²	37.6	30%	0.304	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	116.5	-175.2	-173.5	65.1	0	0	0	109.6	Y719 K720 Y722 A743 Q782	Y719-L777 WeakPolarHBondContact CA-O 3.48Å; K720-L777 PolarHBondContact N-O 2.72Å; K720-L777 PolarHBondContact O-N 2.86Å; Y722-L777 HydrophobicContact CD1-CB 4.36Å; Y722-L777 HydrophobicContact CE1-CB 3.98Å; A743-L777 HydrophobicContact CB-CD2 4.47Å; L777-Q782 WeakPolarHBondContact CA-O 3.21Å
778	G	87.9	Confident	88.4	Confident	6 Å²	6	37.1 Å²	37.1	6%	0.062	21%	0.212	C	C	.	.			trans	-81.6	165.9	176.6	0	0	0	0	0	113.8	Q780 A781 Q782	G778-Q780 PolarHBondContact O-N 2.85Å; G778-Q780 VanDerWaalsContact O-N 3.1Å; G778-A781 PolarHBondContact O-N 2.96Å; G778-Q782 PolarHBondContact N-O 3.31Å
779	P	77.8	Confident	88.9	Confident	107 Å²	107	37.2 Å²	37.2	70%	0.695	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-13.8	-179.3	26.3	-35.4	0	0	0	114.5
780	Q	79.4	Confident	89	Confident	183 Å²	183	42 Å²	42	86%	0.855	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.4	26.8	171.8	-64.7	-179.3	-13.9	0	0	112.3	G778 Q782	G778-Q780 PolarHBondContact O-N 2.85Å; G778-Q780 VanDerWaalsContact O-N 3.1Å; Q780-Q782 PolarHBondContact O-N 3.16Å; Q780-Q782 VanDerWaalsContact O-N 3.16Å
781	A	79.2	Confident	89	Confident	80 Å²	80	43.2 Å²	43.2	66%	0.661	23%	0.234	S	C	*	.			trans	57.6	21.8	-176.5	0	0	0	0	0	115.7	G778 E783	G778-A781 PolarHBondContact O-N 2.96Å; A781-E783 PolarHBondContact O-N 3.44Å
782	Q	82.3	Confident	88.7	Confident	79 Å²	79	44.2 Å²	44.2	37%	0.369	25%	0.245	S	C	.	.			trans	-73.2	111.9	176	-178.9	166.4	37	0	0	110.8	Y719 L777 G778 Q780	Y719-Q782 PolarHBondContact OH-OE1 3.06Å; Y719-Q782 VanDerWaalsContact OH-OE1 3.13Å; L777-Q782 WeakPolarHBondContact CA-O 3.21Å; G778-Q782 PolarHBondContact N-O 3.31Å; Q780-Q782 PolarHBondContact O-N 3.16Å; Q780-Q782 VanDerWaalsContact O-N 3.16Å
783	E	88.6	Confident	88.3	Confident	75 Å²	75	44.1 Å²	44.1	35%	0.35	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	128.9	170.8	-174.4	176.9	159.2	0	0	110.8	Y722 K724 C775 S776 A781	Y722-E783 VanDerWaalsContact OH-CG 3.31Å; Y722-E783 WeakPolarHBondContact OH-CG 3.49Å; Y722-E783 PolarHBondContact OH-OE1 2.9Å; Y722-E783 PolarHBondContact OH-OE2 2.97Å; K724-E783 WeakPolarHBondContact CD-OE1 3.25Å; K724-E783 IonicContact NZ-OE1 3.14Å; K724-E783 PolarHBondContact NZ-OE1 3.18Å; K724-E783 IonicContact NZ-OE2 2.75Å; K724-E783 PolarHBondContact NZ-OE2 3.18Å; C775-E783 HydrophobicContact CB-CG 4.05Å; C775-E783 PolarHBondContact SG-OE1 3.4Å; S776-E783 CarbonylContact O-C 3.53Å; S776-E783 WeakPolarHBondContact O-CA 3.36Å; A781-E783 PolarHBondContact O-N 3.44Å
784	E	88.8	Confident	87.6	Confident	31 Å²	31	45.3 Å²	45.3	15%	0.145	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	117.7	169.9	-175.1	-173.4	129.2	0	0	110	R716 S776 L786 R817	R716-E784 IonicContact CZ-OE2 3.88Å; R716-E784 VanDerWaalsContact CZ-OE2 3.3Å; R716-E784 IonicContact NE-OE2 3.63Å; R716-E784 PolarHBondContact NE-OE2 3.49Å; R716-E784 IonicContact NH2-OE2 3.61Å; R716-E784 PolarHBondContact NH2-OE2 3.31Å; S776-E784 PolarHBondContact N-O 2.94Å; S776-E784 PolarHBondContact O-N 3.09Å; S776-E784 PolarHBondContact OG-O 3.38Å; S776-E784 VanDerWaalsContact OG-O 3.14Å; E784-L786 PolarHBondContact O-N 3.02Å; E784-R817 WeakPolarHBondContact OE1-CD 3.31Å; E784-R817 IonicContact OE1-CZ 3.3Å; E784-R817 IonicContact OE1-NE 2.66Å; E784-R817 IonicContact OE1-NH1 3.21Å; E784-R817 PolarHBondContact OE1-NH1 2.95Å
785	V	90.6	Very high	86.6	Confident	23 Å²	23	52.2 Å²	52.2	14%	0.139	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	118.5	179.4	-171.4	0	0	0	0	110.1	T788 L812	V785-T788 HydrophobicContact CG1-CG2 4.13Å; V785-L812 HydrophobicContact CB-CD1 4.19Å; V785-L812 HydrophobicContact CG1-CD1 3.87Å; V785-L812 WeakPolarHBondContact O-CD1 3.4Å
786	L	88.9	Confident	85.6	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-28.3	-178.8	-57.1	179	0	0	0	112.8	V715 V721 V774 E784 M811 L812	V715-L786 HydrophobicContact CG2-CD1 3.81Å; V721-L786 HydrophobicContact CG1-CD1 4.42Å; V721-L786 HydrophobicContact CG2-CD1 3.9Å; V774-L786 HydrophobicContact CG1-CB 4.46Å; V774-L786 HydrophobicContact CG1-CD1 4.36Å; V774-L786 WeakPolarHBondContact O-CB 3.5Å; V774-L786 PolarHBondContact O-N 3.14Å; E784-L786 PolarHBondContact O-N 3.02Å; L786-M811 HydrophobicContact CB-CE 3.84Å; L786-M811 CarbonylContact O-C 3.49Å; L786-M811 WeakPolarHBondContact O-CA 3.19Å; L786-M811 WeakPolarHBondContact O-CE 3.45Å; L786-L812 PolarHBondContact O-N 2.8Å
787	G	90.1	Very high	84.4	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.9	167.7	-179.3	0	0	0	0	0	113.1	S773 V774 Q810	S773-G787 WeakPolarHBondContact CA-O 3.29Å; V774-G787 PolarHBondContact N-O 2.7Å; V774-G787 PolarHBondContact O-N 3.45Å; G787-Q810 CarbonylContact C-O 3.55Å; G787-Q810 WeakPolarHBondContact CA-O 3.39Å
788	T	92.1	Very high	83.1	Confident	37 Å²	37	58 Å²	58	23%	0.227	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	155.9	179.8	66.1	0	0	0	0	113.5	L772 V785 Q810	L772-T788 CarbonylContact O-C 3.54Å; L772-T788 WeakPolarHBondContact O-CA 3.46Å; V785-T788 HydrophobicContact CG1-CG2 4.13Å; T788-Q810 PolarHBondContact N-O 3.18Å; T788-Q810 PolarHBondContact O-N 3.39Å
789	A	92.6	Very high	82.2	Confident	7 Å²	7	59.9 Å²	59.9	6%	0.058	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	155.9	169.2	0	0	0	0	0	109.9	L772 L807 V809	L772-A789 HydrophobicContact CB-CB 4.46Å; L772-A789 PolarHBondContact N-O 3.49Å; L772-A789 PolarHBondContact O-N 3.14Å; A789-L807 HydrophobicContact CB-CB 4.17Å; A789-L807 HydrophobicContact CB-CD1 4.26Å; A789-V809 HydrophobicContact CB-CG2 4.5Å
790	K	89.9	Confident	81.9	Confident	133 Å²	133	59.5 Å²	59.5	58%	0.578	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.5	144.9	176.4	-68.4	-172.6	174.8	-168.6	0	110.9	L770 Q771	L770-K790 CarbonylContact O-C 3.51Å; L770-K790 WeakPolarHBondContact O-CA 3.18Å; Q771-K790 HydrophobicContact CB-CG 4.21Å; Q771-K790 HydrophobicContact CG-CG 4.22Å; Q771-K790 VanDerWaalsContact OE1-NZ 3.14Å
791	L	90.2	Very high	82	Confident	26 Å²	26	58.2 Å²	58.2	14%	0.136	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	132.5	179.5	175.6	56.8	0	0	0	110	L691 A769 L770 H805 L807	L691-L791 HydrophobicContact CD1-CD2 3.6Å; A769-L791 CarbonylContact C-O 3.56Å; A769-L791 WeakPolarHBondContact CA-O 3.36Å; L770-L791 PolarHBondContact N-O 2.82Å; L770-L791 PolarHBondContact O-N 2.89Å; L791-H805 HydrophobicContact CD2-CB 4.18Å; L791-L807 HydrophobicContact CB-CD1 3.81Å; L791-L807 HydrophobicContact CB-CD2 4.37Å; L791-L807 HydrophobicContact CD1-CD2 4.22Å; L791-L807 HydrophobicContact CD2-CD1 4.16Å; L791-L807 HydrophobicContact CD2-CD2 4.29Å
792	S	85.4	Confident	82.5	Confident	61 Å²	61	56.4 Å²	56.4	43%	0.427	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	143.7	169.3	-175.4	0	0	0	0	110	A794	S792-A794 PolarHBondContact OG-N 3.38Å
793	L	84.8	Confident	82.8	Confident	0 Å²	0	55 Å²	55	0%	0	33%	0.325	C	S	.	.	S	Bend	trans	-100.3	6.3	175.6	-60.9	172.1	0	0	0	113.1	L691 L700 L727 L765 C768 L770 D795 C796	L691-L793 HydrophobicContact CD1-CD2 3.74Å; L700-L793 HydrophobicContact CD2-CD1 3.75Å; L700-L793 HydrophobicContact CD2-CD2 3.93Å; L727-L793 HydrophobicContact CD1-CD1 3.45Å; L727-L793 VanDerWaalsContact CD1-CD1 3.45Å; L765-L793 HydrophobicContact CD1-CB 4.09Å; L765-L793 HydrophobicContact CD1-CD1 4.13Å; L765-L793 HydrophobicContact CG-CB 4.17Å; L765-L793 WeakPolarHBondContact O-CB 3.39Å; C768-L793 HydrophobicContact CB-CD1 4.02Å; C768-L793 WeakPolarHBondContact O-CB 3.37Å; C768-L793 PolarHBondContact O-N 2.88Å; L770-L793 HydrophobicContact CB-CD2 4.37Å; L770-L793 HydrophobicContact CB-CG 4.5Å; L793-D795 VanDerWaalsContact C-N 3.31Å; L793-D795 PolarHBondContact O-N 3.49Å; L793-C796 WeakPolarHBondContact O-CB 3.45Å; L793-C796 PolarHBondContact O-N 2.96Å
794	A	78	Confident	82.9	Confident	42 Å²	42	59.1 Å²	59.1	35%	0.347	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-53	-44.1	176.9	0	0	0	0	0	113.4	A766 S792 C796	A766-A794 HydrophobicContact CB-CB 4.33Å; S792-A794 PolarHBondContact OG-N 3.38Å; A794-C796 PolarHBondContact O-N 2.95Å
795	D	72.9	Confident	82.9	Confident	147 Å²	147	59.8 Å²	59.8	79%	0.786	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-82.8	2.2	-175.3	-49.5	-62.2	0	0	0	113.5	L793	L793-D795 VanDerWaalsContact C-N 3.31Å; L793-D795 PolarHBondContact O-N 3.49Å
796	C	72.9	Confident	82.9	Confident	6 Å²	6	61.7 Å²	61.7	4%	0.041	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-89.1	-9.5	-178.6	-66.8	0	0	0	0	114	W693 L765 L793 A794 G798	W693-C796 WeakPolarHBondContact CB-O 3.21Å; L765-C796 HydrophobicContact CD2-CB 4.03Å; L793-C796 WeakPolarHBondContact O-CB 3.45Å; L793-C796 PolarHBondContact O-N 2.96Å; A794-C796 PolarHBondContact O-N 2.95Å; C796-G798 PolarHBondContact O-N 2.82Å
797	E	68.2	Low	83.1	Confident	104 Å²	104	62.8 Å²	62.8	49%	0.486	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	99	-176.3	-171.9	151.8	-143.9	0	0	111.9	L765	L765-E797 HydrophobicContact CD2-CB 4.26Å
798	G	64.9	Low	83.1	Confident	71 Å²	71	71.5 Å²	71.5	73%	0.732	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	129.3	-8.6	170.2	0	0	0	0	0	116	C796 A800	C796-G798 PolarHBondContact O-N 2.82Å; G798-A800 PolarHBondContact O-N 3.35Å
799	S	68.1	Low	83	Confident	44 Å²	44	70.1 Å²	70.1	31%	0.308	39%	0.385	S	S	.	.			trans	-71.1	128.8	174	-173	0	0	0	0	111.6	E801	S799-E801 VanDerWaalsContact C-N 3.32Å; S799-E801 PolarHBondContact OG-N 2.98Å; S799-E801 VanDerWaalsContact OG-N 3.14Å; S799-E801 PolarHBondContact OG-O 3.34Å
800	A	71.4	Confident	82.9	Confident	99 Å²	99	76.7 Å²	76.7	82%	0.818	41%	0.414	S	S	*	.	S	Bend	trans	-82	-11.8	168.4	0	0	0	0	0	112.9	G798	G798-A800 PolarHBondContact O-N 3.35Å
801	E	82.9	Confident	82.8	Confident	156 Å²	156	72.5 Å²	72.5	73%	0.729	40%	0.398	S	S	*	.	S	Bend	trans	-117	158.9	-177	-62.8	-172.1	170.3	0	0	111.8	S799 V803	S799-E801 VanDerWaalsContact C-N 3.32Å; S799-E801 PolarHBondContact OG-N 2.98Å; S799-E801 VanDerWaalsContact OG-N 3.14Å; S799-E801 PolarHBondContact OG-O 3.34Å; E801-V803 PolarHBondContact O-N 2.72Å
802	M	89.2	Confident	82.4	Confident	42 Å²	42	72.9 Å²	72.9	21%	0.207	40%	0.4	C	S	.	.			trans	-69.4	114	-179.5	-172.8	71.2	66.9	0	0	110.8	L691 L692 Y804	L691-M802 PolarHBondContact N-SD 2.79Å; L691-M802 VanDerWaalsContact N-SD 3.42Å; L692-M802 HydrophobicContact CB-CE 3.83Å; L692-M802 HydrophobicContact CB-SD 3.74Å; L692-M802 HydrophobicContact CD2-CE 4.28Å; M802-Y804 HydrophobicContact CB-CE2 4.16Å; M802-Y804 HydrophobicContact CG-CD1 4.4Å; M802-Y804 HydrophobicContact CG-CE1 3.76Å; M802-Y804 HydrophobicContact CG-CE2 4.14Å; M802-Y804 WeakPolarHBondContact O-CD2 3.29Å; M802-Y804 WeakPolarHBondContact O-CE2 3.33Å; M802-Y804 PolarHBondContact O-N 2.71Å
803	V	88.2	Confident	81.6	Confident	51 Å²	51	73.8 Å²	73.8	31%	0.309	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	110.4	-179.3	-170.2	0	0	0	0	110	L691 E801 H805	L691-V803 PolarHBondContact N-O 2.78Å; L691-V803 PolarHBondContact O-N 2.92Å; E801-V803 PolarHBondContact O-N 2.72Å; V803-H805 VanDerWaalsContact CG1-CE1 3.47Å; V803-H805 WeakPolarHBondContact CG1-CE1 3.33Å; V803-H805 PolarHBondContact O-ND1 2.78Å; V803-H805 VanDerWaalsContact O-ND1 3.1Å
804	Y	90.5	Very high	80.3	Confident	161 Å²	161	78.7 Å²	78.7	63%	0.631	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	130.9	-178.8	-62.5	-76.5	0	0	0	112.4	L689 L705 M802	L689-Y804 CarbonylContact O-C 3.55Å; L689-Y804 VanDerWaalsContact O-CA 3.24Å; L689-Y804 WeakPolarHBondContact O-CA 3.42Å; L705-Y804 HydrophobicContact CD1-CD1 3.79Å; L705-Y804 HydrophobicContact CD1-CE1 3.88Å; M802-Y804 HydrophobicContact CB-CE2 4.16Å; M802-Y804 HydrophobicContact CG-CD1 4.4Å; M802-Y804 HydrophobicContact CG-CE1 3.76Å; M802-Y804 HydrophobicContact CG-CE2 4.14Å; M802-Y804 WeakPolarHBondContact O-CD2 3.29Å; M802-Y804 WeakPolarHBondContact O-CE2 3.33Å; M802-Y804 PolarHBondContact O-N 2.71Å
805	H	89.1	Confident	78.9	Confident	44 Å²	44	81.2 Å²	81.2	20%	0.204	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140	-179	-68.3	77.9	0	0	0	110.3	Q688 L689 L791 V803 L807	Q688-H805 WeakPolarHBondContact CA-O 3.5Å; L689-H805 HydrophobicContact CB-CB 4.44Å; L689-H805 PolarHBondContact N-O 2.81Å; L689-H805 PolarHBondContact O-N 2.84Å; L791-H805 HydrophobicContact CD2-CB 4.18Å; V803-H805 VanDerWaalsContact CG1-CE1 3.47Å; V803-H805 WeakPolarHBondContact CG1-CE1 3.33Å; V803-H805 PolarHBondContact O-ND1 2.78Å; V803-H805 VanDerWaalsContact O-ND1 3.1Å; H805-L807 HydrophobicContact CB-CD2 4.41Å
806	C	90.9	Very high	78.1	Confident	63 Å²	63	78.5 Å²	78.5	43%	0.426	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	108.4	169.8	-162	0	0	0	0	108.3	Q686 I687	Q686-C806 PolarHBondContact OE1-SG 3.19Å; Q686-C806 VanDerWaalsContact OE1-SG 3.33Å; I687-C806 WeakPolarHBondContact O-CA 3.4Å
807	L	91.8	Very high	77.3	Confident	24 Å²	24	79.6 Å²	79.6	13%	0.126	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	137.3	-176.2	-53.2	-178.6	0	0	0	110.7	Q686 I687 L689 L772 A789 L791 H805 V809	Q686-L807 CarbonylContact C-O 3.54Å; Q686-L807 VanDerWaalsContact CA-O 3.27Å; Q686-L807 WeakPolarHBondContact CA-O 3.44Å; I687-L807 HydrophobicContact CG2-CB 3.9Å; I687-L807 PolarHBondContact N-O 3.49Å; I687-L807 PolarHBondContact O-N 2.92Å; L689-L807 HydrophobicContact CD1-CD1 3.54Å; L689-L807 HydrophobicContact CD1-CG 3.97Å; L772-L807 HydrophobicContact CD1-CD1 3.92Å; A789-L807 HydrophobicContact CB-CB 4.17Å; A789-L807 HydrophobicContact CB-CD1 4.26Å; L791-L807 HydrophobicContact CB-CD1 3.81Å; L791-L807 HydrophobicContact CB-CD2 4.37Å; L791-L807 HydrophobicContact CD1-CD2 4.22Å; L791-L807 HydrophobicContact CD2-CD1 4.16Å; L791-L807 HydrophobicContact CD2-CD2 4.29Å; H805-L807 HydrophobicContact CB-CD2 4.41Å; L807-V809 PolarHBondContact O-N 2.88Å
808	R	90.8	Very high	76.2	Confident	184 Å²	184	78.9 Å²	78.9	69%	0.694	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.3	123.1	169.6	-166.1	178	-174.7	153.6	4.6	109.1	P684	P684-R808 HydrophobicContact CB-CG 3.84Å; P684-R808 HydrophobicContact CG-CG 4.17Å
809	V	90.9	Very high	75.3	Confident	7 Å²	7	80.9 Å²	80.9	4%	0.042	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-84.1	124.8	174.6	-175.3	0	0	0	0	108.7	T685 I687 L707 V774 A789 L807 M811	T685-V809 HydrophobicContact CG2-CB 4.23Å; T685-V809 HydrophobicContact CG2-CG2 4.39Å; T685-V809 PolarHBondContact O-N 2.7Å; I687-V809 HydrophobicContact CB-CG2 4.06Å; I687-V809 HydrophobicContact CG2-CG2 3.86Å; L707-V809 HydrophobicContact CD1-CG2 4.12Å; V774-V809 HydrophobicContact CG2-CG1 3.91Å; V774-V809 HydrophobicContact CG2-CG2 4.28Å; A789-V809 HydrophobicContact CB-CG2 4.5Å; L807-V809 PolarHBondContact O-N 2.88Å; V809-M811 HydrophobicContact CB-SD 4.36Å; V809-M811 HydrophobicContact CG1-SD 3.73Å; V809-M811 PolarHBondContact O-N 3.32Å
810	Q	89.6	Confident	74.2	Confident	145 Å²	145	80.4 Å²	80.4	68%	0.678	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	98.6	171.9	-171.7	171.3	14.6	0	0	108.9	G787 T788	G787-Q810 CarbonylContact C-O 3.55Å; G787-Q810 WeakPolarHBondContact CA-O 3.39Å; T788-Q810 PolarHBondContact N-O 3.18Å; T788-Q810 PolarHBondContact O-N 3.39Å
811	M	87.4	Confident	72.9	Confident	45 Å²	45	83.3 Å²	83.3	22%	0.222	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	141.1	177.9	-58.3	-58.1	-71.7	0	0	111.2	T685 L710 L786 V809	T685-M811 HydrophobicContact CG2-SD 4.04Å; L710-M811 HydrophobicContact CD1-CE 3.73Å; L786-M811 HydrophobicContact CB-CE 3.84Å; L786-M811 CarbonylContact O-C 3.49Å; L786-M811 WeakPolarHBondContact O-CA 3.19Å; L786-M811 WeakPolarHBondContact O-CE 3.45Å; V809-M811 HydrophobicContact CB-SD 4.36Å; V809-M811 HydrophobicContact CG1-SD 3.73Å; V809-M811 PolarHBondContact O-N 3.32Å
812	L	81.8	Confident	70.5	Confident	35 Å²	35	84.1 Å²	84.1	18%	0.183	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-89.6	122.9	-176.8	-74.9	155.5	0	0	0	110.9	V785 L786 Q816 R817	V785-L812 HydrophobicContact CB-CD1 4.19Å; V785-L812 HydrophobicContact CG1-CD1 3.87Å; V785-L812 WeakPolarHBondContact O-CD1 3.4Å; L786-L812 PolarHBondContact O-N 2.8Å; L812-Q816 HydrophobicContact CD2-CB 3.83Å; L812-R817 HydrophobicContact CB-CG 3.81Å; L812-R817 PolarHBondContact O-NE 3.42Å; L812-R817 VanDerWaalsContact O-NE 3.1Å
813	T	69.5	Low	68.2	Low	79 Å²	79	86 Å²	86	49%	0.485	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-67	154.3	170.4	60.8	0	0	0	0	110.7	S815 Q816 R817	T813-S815 PolarHBondContact O-N 2.91Å; T813-Q816 VanDerWaalsContact N-OE1 3.16Å; T813-Q816 CarbonylContact O-C 3.53Å; T813-Q816 VanDerWaalsContact O-CA 3.31Å; T813-Q816 WeakPolarHBondContact O-CA 2.89Å; T813-Q816 WeakPolarHBondContact O-CB 3.47Å; T813-Q816 PolarHBondContact O-N 3.38Å; T813-Q816 VanDerWaalsContact OG1-CD 3.27Å; T813-Q816 WeakPolarHBondContact OG1-CG 2.91Å; T813-Q816 PolarHBondContact OG1-OE1 3.39Å; T813-R817 PolarHBondContact O-N 3.05Å
814	D	56.3	Low	66	Low	103 Å²	103	88 Å²	88	55%	0.551	43%	0.428	S	S	*	.	H	α-helix	trans	-64.1	-31	-171.7	-52.1	-27.1	0	0	0	112.7	Q816 R817 T818	D814-Q816 PolarHBondContact O-N 3.1Å; D814-R817 PolarHBondContact O-N 2.94Å; D814-R817 IonicContact OD1-CZ 2.68Å; D814-R817 IonicContact OD1-NE 2.69Å; D814-R817 PolarHBondContact OD1-NE 2.91Å; D814-R817 IonicContact OD1-NH2 3.27Å; D814-R817 PolarHBondContact OD1-NH2 3.31Å; D814-T818 PolarHBondContact O-N 3Å; D814-T818 PolarHBondContact O-OG1 2.65Å
815	S	49.2	Very low	63.3	Low	96 Å²	96	83.7 Å²	83.7	67%	0.671	42%	0.417	S	S	*	.	H	α-helix	trans	-60.9	-28.6	168.7	-49.1	0	0	0	0	113.4	T813 T818	T813-S815 PolarHBondContact O-N 2.91Å; S815-T818 PolarHBondContact O-OG1 3.22Å
816	Q	55.4	Low	60.6	Low	90 Å²	90	86.3 Å²	86.3	42%	0.421	43%	0.432	S	S	.	.	H	α-helix	trans	-89.5	-32.6	174.1	-66.8	167.7	-46.6	0	0	112.1	L812 T813 D814 T818 L819 S820	L812-Q816 HydrophobicContact CD2-CB 3.83Å; T813-Q816 VanDerWaalsContact N-OE1 3.16Å; T813-Q816 CarbonylContact O-C 3.53Å; T813-Q816 VanDerWaalsContact O-CA 3.31Å; T813-Q816 WeakPolarHBondContact O-CA 2.89Å; T813-Q816 WeakPolarHBondContact O-CB 3.47Å; T813-Q816 PolarHBondContact O-N 3.38Å; T813-Q816 VanDerWaalsContact OG1-CD 3.27Å; T813-Q816 WeakPolarHBondContact OG1-CG 2.91Å; T813-Q816 PolarHBondContact OG1-OE1 3.39Å; D814-Q816 PolarHBondContact O-N 3.1Å; Q816-T818 VanDerWaalsContact C-N 3.33Å; Q816-T818 PolarHBondContact O-N 3.36Å; Q816-L819 PolarHBondContact O-N 3.29Å; Q816-S820 VanDerWaalsContact O-CB 3.26Å; Q816-S820 WeakPolarHBondContact O-CB 3.33Å; Q816-S820 PolarHBondContact O-N 3.46Å
817	R	57	Low	57.8	Low	28 Å²	28	91.3 Å²	91.3	11%	0.106	45%	0.449	C	S	.	.	H	α-helix	trans	-62.3	-41.7	174.5	-60.3	-168.4	-138.7	175.9	15.3	111.4	N714 E784 L812 T813 D814 L819 S820 R821	N714-R817 PolarHBondContact O-NH1 2.9Å; E784-R817 WeakPolarHBondContact OE1-CD 3.31Å; E784-R817 IonicContact OE1-CZ 3.3Å; E784-R817 IonicContact OE1-NE 2.66Å; E784-R817 IonicContact OE1-NH1 3.21Å; E784-R817 PolarHBondContact OE1-NH1 2.95Å; L812-R817 HydrophobicContact CB-CG 3.81Å; L812-R817 PolarHBondContact O-NE 3.42Å; L812-R817 VanDerWaalsContact O-NE 3.1Å; T813-R817 PolarHBondContact O-N 3.05Å; D814-R817 PolarHBondContact O-N 2.94Å; D814-R817 IonicContact OD1-CZ 2.68Å; D814-R817 IonicContact OD1-NE 2.69Å; D814-R817 PolarHBondContact OD1-NE 2.91Å; D814-R817 IonicContact OD1-NH2 3.27Å; D814-R817 PolarHBondContact OD1-NH2 3.31Å; R817-L819 VanDerWaalsContact C-N 3.33Å; R817-L819 PolarHBondContact O-N 2.69Å; R817-S820 PolarHBondContact O-N 3.48Å; R817-R821 WeakPolarHBondContact O-CB 3.31Å; R817-R821 PolarHBondContact O-N 3.16Å
818	T	46.2	Very low	55	Low	90 Å²	90	97.3 Å²	97.3	55%	0.552	48%	0.477	S	S	*	.	H	α-helix	trans	-66	-30.9	174.4	47.5	0	0	0	0	113.5	D814 S815 Q816	D814-T818 PolarHBondContact O-N 3Å; D814-T818 PolarHBondContact O-OG1 2.65Å; S815-T818 PolarHBondContact O-OG1 3.22Å; Q816-T818 VanDerWaalsContact C-N 3.33Å; Q816-T818 PolarHBondContact O-N 3.36Å
819	L	45.8	Very low	52.2	Low	112 Å²	112	94.3 Å²	94.3	59%	0.586	47%	0.47	S	S	*	.	H	α-helix	trans	-77.3	-40.2	172.7	-148.5	83.3	0	0	0	112.2	Q816 R817 R821 R822 T823	Q816-L819 PolarHBondContact O-N 3.29Å; R817-L819 VanDerWaalsContact C-N 3.33Å; R817-L819 PolarHBondContact O-N 2.69Å; L819-R821 VanDerWaalsContact C-N 3.32Å; L819-R821 PolarHBondContact O-N 2.88Å; L819-R822 WeakPolarHBondContact O-CA 3.47Å; L819-R822 WeakPolarHBondContact O-CB 3.41Å; L819-R822 PolarHBondContact O-N 2.67Å; L819-R822 VanDerWaalsContact O-N 3.07Å; L819-T823 PolarHBondContact O-N 2.79Å; L819-T823 PolarHBondContact O-OG1 3.23Å
820	S	44	Very low	49.1	Very low	34 Å²	34	102 Å²	102	24%	0.238	51%	0.506	C	S	.	.	H	α-helix	trans	-64.9	-37.4	-180	-174.3	0	0	0	0	111.7	Q816 R817 T823 H824	Q816-S820 VanDerWaalsContact O-CB 3.26Å; Q816-S820 WeakPolarHBondContact O-CB 3.33Å; Q816-S820 PolarHBondContact O-N 3.46Å; R817-S820 PolarHBondContact O-N 3.48Å; S820-T823 VanDerWaalsContact CA-OG1 3.31Å; S820-T823 WeakPolarHBondContact CA-OG1 3.42Å; S820-T823 PolarHBondContact O-N 2.97Å; S820-T823 PolarHBondContact O-OG1 3.4Å; S820-H824 PolarHBondContact O-N 3.02Å
821	R	43.3	Very low	46.4	Very low	160 Å²	160	99.8 Å²	99.8	60%	0.604	51%	0.512	S	S	*	.	H	α-helix	trans	-54	-50.1	167.5	178.9	173.8	168.2	-173.2	-2.8	111.5	R817 L819 T823 H824 D825	R817-R821 WeakPolarHBondContact O-CB 3.31Å; R817-R821 PolarHBondContact O-N 3.16Å; L819-R821 VanDerWaalsContact C-N 3.32Å; L819-R821 PolarHBondContact O-N 2.88Å; R821-T823 VanDerWaalsContact C-N 3.32Å; R821-T823 PolarHBondContact O-N 3.32Å; R821-H824 PolarHBondContact O-N 3.45Å; R821-D825 WeakPolarHBondContact O-CB 3.28Å; R821-D825 PolarHBondContact O-N 3.38Å
822	R	33.7	Very low	43.8	Very low	174 Å²	174	107.7 Å²	107.7	66%	0.657	54%	0.54	S	S	*	.	H	α-helix	trans	-63.8	-31.1	176.7	-71.3	-178.9	173.8	178.8	-1.5	114	L819 N826	L819-R822 WeakPolarHBondContact O-CA 3.47Å; L819-R822 WeakPolarHBondContact O-CB 3.41Å; L819-R822 PolarHBondContact O-N 2.67Å; L819-R822 VanDerWaalsContact O-N 3.07Å; R822-N826 VanDerWaalsContact O-CB 3.25Å; R822-N826 WeakPolarHBondContact O-CB 3.39Å; R822-N826 PolarHBondContact O-N 2.88Å; R822-N826 PolarHBondContact O-OD1 3.2Å
823	T	40.7	Very low	41.1	Very low	81 Å²	81	110.6 Å²	110.6	50%	0.497	56%	0.563	S	S	.	*	H	α-helix	trans	-76.7	-30.8	174.2	46.5	0	0	0	0	113.3	L819 S820 R821 Q827	L819-T823 PolarHBondContact O-N 2.79Å; L819-T823 PolarHBondContact O-OG1 3.23Å; S820-T823 VanDerWaalsContact CA-OG1 3.31Å; S820-T823 WeakPolarHBondContact CA-OG1 3.42Å; S820-T823 PolarHBondContact O-N 2.97Å; S820-T823 PolarHBondContact O-OG1 3.4Å; R821-T823 VanDerWaalsContact C-N 3.32Å; R821-T823 PolarHBondContact O-N 3.32Å; T823-Q827 PolarHBondContact O-N 3.25Å; T823-Q827 VanDerWaalsContact O-N 3.09Å
824	H	41.3	Very low	39.2	Very low	92 Å²	92	118.8 Å²	118.8	43%	0.426	59%	0.585	S	S	.	*	H	α-helix	trans	-69	-49.5	169.9	-109.7	-74	0	0	0	110.6	S820 R821 N826 Q827 E828	S820-H824 PolarHBondContact O-N 3.02Å; R821-H824 PolarHBondContact O-N 3.45Å; H824-N826 VanDerWaalsContact C-N 3.3Å; H824-N826 PolarHBondContact O-N 2.88Å; H824-Q827 PolarHBondContact O-N 3.29Å; H824-E828 PolarHBondContact O-N 3.35Å
825	D	34.3	Very low	37.8	Very low	72 Å²	72	118.3 Å²	118.3	39%	0.385	60%	0.595	S	S	.	*	H	α-helix	trans	-52.9	-47.9	173.9	-62.7	-27.1	0	0	0	110.2	R821 Q827 E828 H829	R821-D825 WeakPolarHBondContact O-CB 3.28Å; R821-D825 PolarHBondContact O-N 3.38Å; D825-Q827 PolarHBondContact O-N 3.22Å; D825-E828 PolarHBondContact O-N 3.49Å; D825-H829 VanDerWaalsContact O-CB 3.28Å; D825-H829 WeakPolarHBondContact O-CB 3.47Å; D825-H829 PolarHBondContact O-CD2 3.39Å; D825-H829 VanDerWaalsContact O-CD2 3.29Å; D825-H829 PolarHBondContact O-N 2.8Å
826	N	31.9	Very low	37	Very low	99 Å²	99	120.3 Å²	120.3	53%	0.529	60%	0.604	S	S	.	*	H	α-helix	trans	-66.9	-34.8	179.8	-83.7	15.9	0	0	0	114.4	R822 H824 E828 H829 E830	R822-N826 VanDerWaalsContact O-CB 3.25Å; R822-N826 WeakPolarHBondContact O-CB 3.39Å; R822-N826 PolarHBondContact O-N 2.88Å; R822-N826 PolarHBondContact O-OD1 3.2Å; H824-N826 VanDerWaalsContact C-N 3.3Å; H824-N826 PolarHBondContact O-N 2.88Å; N826-E828 PolarHBondContact O-N 3.12Å; N826-H829 PolarHBondContact O-N 3.28Å; N826-E830 PolarHBondContact O-N 3.05Å
827	Q	32.4	Very low	35.8	Very low	168 Å²	168	123.1 Å²	123.1	79%	0.785	62%	0.621	S	S	*	*	H	α-helix	trans	-70.3	-22.8	176.8	-104.8	-176.4	-10.9	0	0	112.9	T823 H824 D825	T823-Q827 PolarHBondContact O-N 3.25Å; T823-Q827 VanDerWaalsContact O-N 3.09Å; H824-Q827 PolarHBondContact O-N 3.29Å; D825-Q827 PolarHBondContact O-N 3.22Å
828	E	32.9	Very low	34.6	Very low	149 Å²	149	128 Å²	128	70%	0.696	66%	0.655	S	S	*	*	H	α-helix	trans	-89.5	-25.5	171.1	-65.1	-177.8	-175	0	0	112.4	H824 D825 N826	H824-E828 PolarHBondContact O-N 3.35Å; D825-E828 PolarHBondContact O-N 3.49Å; N826-E828 PolarHBondContact O-N 3.12Å
829	H	31.6	Very low	34	Very low	121 Å²	121	130.7 Å²	130.7	56%	0.56	66%	0.664	S	S	*	*	H	α-helix	trans	-92.7	-24	-178.6	-87.3	-81.2	0	0	0	116.7	D825 N826 A831 R832	D825-H829 VanDerWaalsContact O-CB 3.28Å; D825-H829 WeakPolarHBondContact O-CB 3.47Å; D825-H829 PolarHBondContact O-CD2 3.39Å; D825-H829 VanDerWaalsContact O-CD2 3.29Å; D825-H829 PolarHBondContact O-N 2.8Å; N826-H829 PolarHBondContact O-N 3.28Å; H829-A831 PolarHBondContact O-N 2.7Å; H829-A831 VanDerWaalsContact O-N 3.08Å; H829-R832 PolarHBondContact O-N 3.35Å
830	E	27.4	Very low	33	Very low	168 Å²	168	129.8 Å²	129.8	79%	0.785	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-16.2	-178.7	-96.6	-165.1	134.8	0	0	114	N826 R832	N826-E830 PolarHBondContact O-N 3.05Å; E830-R832 VanDerWaalsContact C-N 3.29Å; E830-R832 PolarHBondContact O-N 3.36Å
831	A	32	Very low	32.2	Very low	99 Å²	99	133.7 Å²	133.7	82%	0.818	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-7.1	170.8	0	0	0	0	0	114.3	H829	H829-A831 PolarHBondContact O-N 2.7Å; H829-A831 VanDerWaalsContact O-N 3.08Å
832	R	33.2	Very low	31.5	Very low	211 Å²	211	133.3 Å²	133.3	80%	0.796	70%	0.699	S	S	*	*	S	Bend	trans	-144.7	38.1	-160.7	-145.7	177.1	-169	173.5	5.4	117	H829 E830	H829-R832 PolarHBondContact O-N 3.35Å; E830-R832 VanDerWaalsContact C-N 3.29Å; E830-R832 PolarHBondContact O-N 3.36Å
833	S	26.1	Very low	31.1	Very low	96 Å²	96	132.2 Å²	132.2	67%	0.671	71%	0.705	S	S	*	*			trans	-149.4	68.5	175.9	64.7	0	0	0	0	117.4
834	R	28.4	Very low	30.5	Very low	252 Å²	252	133.2 Å²	133.2	95%	0.951	72%	0.716	S	S	*	*			trans	-150.2	125.2	150.2	-78.4	-175	175.7	152.3	-0.8	106.9
835	A	27.5	Very low	29.8	Very low	92 Å²	92	139.7 Å²	139.7	76%	0.76	74%	0.736	S	S	*	*	S	Bend	cis	-146.3	174.4	-3	0	0	0	0	0	107.9
836	T	31.1	Very low	29.4	Very low	139 Å²	139	141.6 Å²	141.6	85%	0.853	76%	0.755	S	S	*	*			cis	-154.9	150.5	12.1	-26.1	0	0	0	0	109.8
837	D	30.9	Very low	29	Very low	148 Å²	148	141.5 Å²	141.5	79%	0.791	76%	0.762	S	S	*	*			trans	-73.4	157.6	165.9	-77.1	-62.5	0	0	0	113.2
838	T	32.8	Very low	28.6	Very low	132 Å²	132	139.6 Å²	139.6	81%	0.81	76%	0.762	S	S	*	*			trans	159.6	135.5	141.5	35.9	0	0	0	0	107.9
839	I	31.9	Very low	28.1	Very low	146 Å²	146	141 Å²	141	75%	0.749	77%	0.768	S	S	*	*			cis	-148.5	132.5	2.1	-110.8	152.5	0	0	0	105.9
840	S	26.1	Very low	28.4	Very low	93 Å²	93	139.9 Å²	139.9	65%	0.65	77%	0.772	S	S	*	*				50	137.9	99.8	-104.2	0	0	0	0	116.5
841	T	27.7	Very low	28.3	Very low	116 Å²	116	139.8 Å²	139.8	71%	0.712	77%	0.772	S	S	*	*			cis	-170.3	-176.2	-5.6	2.8	0	0	0	0	109.4
842	L	26.7	Very low	28.1	Very low	151 Å²	151	141.3 Å²	141.3	79%	0.791	76%	0.762	S	S	*	*			trans	102.4	135.3	153.4	-56.5	178.9	0	0	0	119.8
843	L	26.4	Very low	27.7	Very low	152 Å²	152	141.5 Å²	141.5	80%	0.796	76%	0.762	S	S	*	*			trans	62	109.5	161.2	-59.6	165.7	0	0	0	116.3
844	S	27.7	Very low	27.6	Very low	102 Å²	102	140.8 Å²	140.8	71%	0.713	77%	0.77	S	S	*	*			cis	76.3	100.4	27.8	-36.7	0	0	0	0	116.6
845	R	27	Very low	27.5	Very low	228 Å²	228	133.9 Å²	133.9	86%	0.86	76%	0.76	S	S	*	*				150.6	144.7	126.3	-81.1	163.3	67	160.7	3.2	114
846	S	25.6	Very low	27.2	Very low	111 Å²	111	137.8 Å²	137.8	78%	0.776	76%	0.763	S	S	*	*			trans	65.5	150.9	158.9	22.7	0	0	0	0	118.3
847	S	24.5	Very low	27	Very low	97 Å²	97	137.6 Å²	137.6	68%	0.678	76%	0.756	S	S	*	*			cis	-170.1	151.2	-13.6	43.5	0	0	0	0	112.8
848	T	23.3	Very low	26.7	Very low	129 Å²	129	138.5 Å²	138.5	79%	0.791	76%	0.755	S	S	*	*			trans	62.5	133.6	148.5	49.4	0	0	0	0	123.2
849	H	22.7	Very low	26.3	Very low	177 Å²	177	138.7 Å²	138.7	82%	0.819	75%	0.751	S	S	*	*			trans	-30	168.1	150	-70	-91.6	0	0	0	117.7
850	P	37.2	Very low	26	Very low	98 Å²	98	139.8 Å²	139.8	64%	0.636	75%	0.753	S	S	*	*			cis	-140	-176.8	19.2	47.8	-30.8	0	0	0	117.2
851	E	25.7	Very low	25.9	Very low	167 Å²	167	146.8 Å²	146.8	78%	0.78	77%	0.765	S	S	*	*				28.7	156.9	128.1	-62.2	171.3	158.1	0	0	121.7
852	E	27	Very low	25.7	Very low	130 Å²	130	145.5 Å²	145.5	61%	0.607	76%	0.761	S	S	*	*			cis	-156.1	-166.1	4.8	-132.3	-164.4	171	0	0	113.9
853	R	25.3	Very low	25.5	Very low	216 Å²	216	147.1 Å²	147.1	82%	0.815	76%	0.764	S	S	*	*			trans	-42.4	159.2	176.4	-49.9	165.7	-139.9	-160.8	4.1	117.1
854	G	24	Very low	25.4	Very low	80 Å²	80	150.2 Å²	150.2	83%	0.825	77%	0.771	S	S	*	*			trans	176.8	131	155.5	0	0	0	0	0	114.6
855	S	25.4	Very low	25.4	Very low	108 Å²	108	152.3 Å²	152.3	76%	0.755	77%	0.774	S	S	*	*			trans	-104.2	161	-178.3	-58.3	0	0	0	0	113.7
856	E	22.8	Very low	25.3	Very low	173 Å²	173	146 Å²	146	81%	0.808	76%	0.761	S	S	*	*			trans	80.3	148	138.3	-89.6	170.7	132.1	0	0	123.6
857	L	26.5	Very low	25.2	Very low	135 Å²	135	151.8 Å²	151.8	71%	0.707	77%	0.766	S	S	*	*			trans	73.2	99.2	153.9	-66.9	164.2	0	0	0	122.3
858	E	24	Very low	25.2	Very low	167 Å²	167	150.5 Å²	150.5	78%	0.78	77%	0.767	S	S	*	*				59	162.3	110.8	-74	-161.5	143.3	0	0	125.2
859	L	24.5	Very low	25.1	Very low	137 Å²	137	154 Å²	154	72%	0.717	78%	0.775	S	S	*	*			trans	77	85.5	162	-98.5	75.4	0	0	0	121.7
860	Q	26.5	Very low	25.3	Very low	168 Å²	168	150.2 Å²	150.2	79%	0.785	77%	0.774	S	S	*	*				41.5	118.1	103.3	-168.2	-179.4	50.6	0	0	120.6
861	R	23	Very low	24.5	Very low	240 Å²	240	152.6 Å²	152.6	91%	0.906	79%	0.787	S	S	*	*			trans	-158.3	118.3	146.7	-104.3	-179.1	167.3	-169.3	-3.8	108.1
862	S	23.4	Very low	24.5	Very low	89 Å²	89	149.7 Å²	149.7	62%	0.622	79%	0.785	S	S	*	*				81.3	92.8	60.2	-60.9	0	0	0	0	114.8
863	E	23.8	Very low	24.4	Very low	185 Å²	185	151.2 Å²	151.2	86%	0.864	79%	0.792	S	S	*	*			trans	50.1	123.7	130.3	-60	174.7	144	0	0	121.2
864	K	24.3	Very low	24.5	Very low	217 Å²	217	152.2 Å²	152.2	94%	0.943	80%	0.796	S	S	*	*				-152.1	167.7	122.1	-115.1	166.8	-174.2	175.2	0	111.9
865	D	26.3	Very low	24.6	Very low	146 Å²	146	151.7 Å²	151.7	78%	0.781	79%	0.791	S	S	*	*			trans	-140.6	177.4	-142.5	177.3	35.2	0	0	0	112.4
866	V	26	Very low	24.6	Very low	95 Å²	95	157 Å²	157	58%	0.576	80%	0.795	S	S	*	*			trans	80.4	124.7	170.1	-176.3	0	0	0	0	113.4
867	R	24	Very low	24.6	Very low	234 Å²	234	157.3 Å²	157.3	88%	0.883	80%	0.796	S	S	*	*			cis	-157.2	152.9	18.2	-163.3	174.5	-67.9	-95	-5.5	111.4
868	G	23.5	Very low	24.5	Very low	69 Å²	69	155.8 Å²	155.8	71%	0.711	80%	0.803	S	S	*	*			trans	167.1	64.9	162.8	0	0	0	0	0	119.8
869	E	21.7	Very low	24.5	Very low	204 Å²	204	157 Å²	157	95%	0.953	81%	0.809	S	S	*	*			trans	56.5	170.5	163.7	-62.2	-169.9	132.5	0	0	118.6
870	A	25.6	Very low	24.6	Very low	97 Å²	97	155.7 Å²	155.7	80%	0.802	81%	0.811	S	S	*	*			trans	-158.6	129.8	-170.8	0	0	0	0	0	113.7
871	T	22	Very low	24.6	Very low	147 Å²	147	152.1 Å²	152.1	90%	0.902	81%	0.81	S	S	*	*			trans	-150.3	144.9	155	26.1	0	0	0	0	111.4
872	S	25.1	Very low	24.8	Very low	107 Å²	107	149 Å²	149	75%	0.748	81%	0.805	S	S	*	*			trans	-58.5	138.4	174.6	142.8	0	0	0	0	113.3
873	E	25.6	Very low	24.9	Very low	162 Å²	162	149.2 Å²	149.2	76%	0.757	81%	0.807	S	S	*	*			trans	-116	142.1	151.6	-74.8	-155.3	162.8	0	0	112.3
874	R	25.7	Very low	24.9	Very low	236 Å²	236	146.4 Å²	146.4	89%	0.891	80%	0.798	S	S	*	*			trans	-139.6	117.2	-180	165.9	-156.5	-80.7	-121.1	-5.5	107.6
875	G	26.1	Very low	25.2	Very low	70 Å²	70	145.9 Å²	145.9	72%	0.722	79%	0.792	S	S	*	*			trans	69.4	117.9	157.3	0	0	0	0	0	115.9	Q877	G875-Q877 PolarHBondContact O-N 2.95Å
876	W	25.8	Very low	25.3	Very low	220 Å²	220	143.2 Å²	143.2	83%	0.833	79%	0.785	S	S	*	*			trans	-92.7	97.7	167.2	-77.6	95	0	0	0	110.4
877	Q	22.3	Very low	25.2	Very low	178 Å²	178	145.6 Å²	145.6	83%	0.832	79%	0.794	S	S	*	*			trans	-74.4	149.5	145.7	-68.3	179.5	-104	0	0	108.1	G875	G875-Q877 PolarHBondContact O-N 2.95Å
878	A	26.3	Very low	25.3	Very low	104 Å²	104	141.3 Å²	141.3	86%	0.86	79%	0.787	S	S	*	*			trans	-116.5	134.7	162.8	0	0	0	0	0	107.9
879	E	23.6	Very low	25.4	Very low	192 Å²	192	143.9 Å²	143.9	90%	0.897	79%	0.789	S	S	*	*			trans	-89.9	173.3	-168.7	-69.7	-168.5	114.9	0	0	114.1
880	S	26.8	Very low	25.5	Very low	110 Å²	110	137.9 Å²	137.9	77%	0.769	77%	0.774	S	S	*	*			trans	-85.1	175.2	-176.2	55.5	0	0	0	0	113.6
881	A	25.1	Very low	25.3	Very low	92 Å²	92	142.7 Å²	142.7	76%	0.76	78%	0.778	S	S	*	*			trans	-122.8	132.9	155.6	0	0	0	0	0	110.2
882	H	27	Very low	25.8	Very low	174 Å²	174	141.5 Å²	141.5	81%	0.806	77%	0.773	S	S	*	*			trans	-42.4	155.3	175.6	-49.6	-75.5	0	0	0	115.9
883	S	25.8	Very low	25.7	Very low	95 Å²	95	141.5 Å²	141.5	66%	0.664	77%	0.768	S	S	*	*			cis	-164	-152.6	-10.4	46.5	0	0	0	0	108
884	D	25.3	Very low	25.6	Very low	126 Å²	126	142 Å²	142	67%	0.674	77%	0.77	S	S	*	*			cis	-165.8	-167.3	10.4	-141.7	-63.3	0	0	0	111.9
885	Y	28.9	Very low	25.5	Very low	205 Å²	205	135.7 Å²	135.7	80%	0.804	76%	0.762	S	S	*	*			trans	65.1	77.9	163.4	-78.7	-72	0	0	0	120.2
886	S	28.8	Very low	25.5	Very low	91 Å²	91	136.8 Å²	136.8	64%	0.636	76%	0.759	S	S	*	*				51.3	104.9	112.5	-59.3	0	0	0	0	122.2
887	N	24.9	Very low	25.4	Very low	145 Å²	145	134.9 Å²	134.9	78%	0.775	76%	0.759	S	S	*	*				77.2	136.7	117.5	-77.3	-19.6	0	0	0	124.7
888	I	26.4	Very low	25.6	Very low	144 Å²	144	129.7 Å²	129.7	74%	0.738	75%	0.753	S	S	*	*			trans	99.8	111.8	134.9	-79.1	166	0	0	0	121.6
889	T	23.9	Very low	25.5	Very low	123 Å²	123	133 Å²	133	76%	0.755	76%	0.755	S	S	*	*			trans	61.6	109.1	149.5	57.1	0	0	0	0	124.4
890	A	23.9	Very low	25.5	Very low	77 Å²	77	129.3 Å²	129.3	64%	0.636	75%	0.751	S	S	*	*				72.9	127	107.8	0	0	0	0	0	123.2
891	F	21.9	Very low	25.5	Very low	198 Å²	198	130.6 Å²	130.6	87%	0.868	75%	0.754	S	S	*	*			trans	67	166	161	-63.5	-58.4	0	0	0	115.6
892	P	32.7	Very low	25.6	Very low	123 Å²	123	135.7 Å²	135.7	80%	0.799	76%	0.762	S	S	*	*			cis	-131.1	-170	11.5	44.8	-28.2	0	0	0	116.7
893	T	22.4	Very low	25.7	Very low	106 Å²	106	130.7 Å²	130.7	65%	0.65	76%	0.758	S	S	*	*			trans	-92.2	166.6	177.8	-37.7	0	0	0	0	112.2
894	H	24.1	Very low	25.8	Very low	173 Å²	173	131.3 Å²	131.3	80%	0.801	76%	0.757	S	S	*	*			trans	107.3	141.5	152	-66.8	-69.4	0	0	0	120.8
895	S	22.8	Very low	25.8	Very low	104 Å²	104	134.6 Å²	134.6	73%	0.727	76%	0.761	S	S	*	*			trans	-75.8	158.2	167.5	51	0	0	0	0	111.5
896	S	26.2	Very low	25.6	Very low	93 Å²	93	132.9 Å²	132.9	65%	0.65	77%	0.765	S	S	*	*				-170.1	-165.8	69.9	-143.2	0	0	0	0	114.3
897	E	24.8	Very low	26.6	Very low	180 Å²	180	133.2 Å²	133.2	84%	0.841	77%	0.765	S	S	*	*			trans	-30	158.8	173.9	-59.8	128.6	122.5	0	0	118.4
898	G	25.1	Very low	27	Very low	68 Å²	68	133 Å²	133	70%	0.701	77%	0.77	S	S	*	*			trans	-132.8	170.2	170.8	0	0	0	0	0	113
899	L	25.7	Very low	27	Very low	174 Å²	174	130 Å²	130	91%	0.911	77%	0.774	S	S	*	*			trans	-164.4	148.6	168.9	-144.7	77	0	0	0	111.7
900	S	22.4	Very low	27	Very low	114 Å²	114	127.6 Å²	127.6	80%	0.797	77%	0.774	S	S	*	*			trans	134.5	141.6	150	-60.2	0	0	0	0	114.8
901	T	28.2	Very low	27.1	Very low	137 Å²	137	135.3 Å²	135.3	84%	0.84	79%	0.787	S	S	*	*			trans	-156.3	134.6	-174.4	48.9	0	0	0	0	112.3
902	E	25.9	Very low	27.3	Very low	200 Å²	200	129.8 Å²	129.8	94%	0.935	77%	0.772	S	S	*	*			trans	-175.4	162.1	161.4	-107.6	173.6	167.1	0	0	108
903	G	28.6	Very low	26.9	Very low	69 Å²	69	130.2 Å²	130.2	71%	0.711	77%	0.767	S	S	*	*			cis	156.2	157.1	1.2	0	0	0	0	0	109.7
904	V	28.4	Very low	27.1	Very low	107 Å²	107	134.6 Å²	134.6	65%	0.648	78%	0.78	S	S	*	*			cis	-159.6	-161.4	-10.4	-147.8	0	0	0	0	108.1
905	Y	25.1	Very low	27	Very low	195 Å²	195	132.7 Å²	132.7	77%	0.765	78%	0.781	S	S	*	*			trans	87.3	144.1	161.2	-47.1	-65.3	0	0	0	118.8
906	L	24.5	Very low	27.8	Very low	169 Å²	169	133.3 Å²	133.3	89%	0.885	78%	0.783	S	S	*	*			cis	-128.3	172.3	24.9	-94.9	90.1	0	0	0	115.9
907	P	51.3	Low	27.6	Very low	98 Å²	98	133.6 Å²	133.6	64%	0.636	79%	0.785	S	S	*	*			trans	-142.2	-170.5	-149.5	43	-23.2	0	0	0	120.1
908	T	31.8	Very low	27.6	Very low	142 Å²	142	135 Å²	135	87%	0.871	78%	0.782	S	S	*	*			trans	77.8	144.8	157.5	21.4	0	0	0	0	120.5
909	G	26.4	Very low	27.5	Very low	79 Å²	79	138.1 Å²	138.1	81%	0.814	78%	0.778	S	S	*	*			cis	178.9	178.4	-2.9	0	0	0	0	0	111.2
910	G	24.3	Very low	27.3	Very low	74 Å²	74	138.8 Å²	138.8	76%	0.763	77%	0.774	S	S	*	*			cis	169.6	173.9	-5.3	0	0	0	0	0	113.2
911	R	27	Very low	27.5	Very low	239 Å²	239	138.1 Å²	138.1	90%	0.902	77%	0.769	S	S	*	*			trans	64.8	154.7	171.9	-76.1	-173.6	169.5	-98.7	5.4	118.6
912	C	25	Very low	27.4	Very low	82 Å²	82	137.7 Å²	137.7	55%	0.554	77%	0.766	S	S	*	*			cis	-160.2	147.3	-15.7	-121	0	0	0	0	111.9
913	D	24.3	Very low	27.5	Very low	132 Å²	132	137.4 Å²	137.4	71%	0.706	76%	0.762	S	S	*	*			trans	28	120.1	152.2	-42.8	-44	0	0	0	124.2
914	Q	26.5	Very low	27.4	Very low	197 Å²	197	140.3 Å²	140.3	92%	0.921	77%	0.766	S	S	*	*				179.2	166.1	104.3	-96.4	172.4	95.6	0	0	114
915	T	23.5	Very low	27.5	Very low	133 Å²	133	143.9 Å²	143.9	82%	0.816	78%	0.775	S	S	*	*			trans	-108.8	179.6	-173.3	59.4	0	0	0	0	111.3
916	P	39.1	Very low	27.9	Very low	118 Å²	118	144.5 Å²	144.5	77%	0.766	78%	0.782	S	S	*	*			cis	-143.2	-170.1	9.8	44.4	-24.5	0	0	0	117.8
917	S	21.8	Very low	28.3	Very low	99 Å²	99	141 Å²	141	69%	0.692	78%	0.777	S	S	*	*			trans	84.6	99.6	143	-171.8	0	0	0	0	122.6
918	R	24.2	Very low	27.5	Very low	208 Å²	208	142.6 Å²	142.6	79%	0.785	79%	0.785	S	S	*	*				57.6	143.4	129.7	-81.1	176.4	164.3	-156	7.9	123.2
919	H	22.6	Very low	27.3	Very low	134 Å²	134	143.5 Å²	143.5	62%	0.62	78%	0.782	S	S	*	*			trans	102.4	121.6	137.9	-74.6	-40.6	0	0	0	122.3
920	F	21.8	Very low	27.6	Very low	189 Å²	189	144.6 Å²	144.6	83%	0.829	77%	0.773	S	S	*	*			trans	71.8	155.9	138.4	-85.3	-75.4	0	0	0	123.3
921	S	27.1	Very low	27.8	Very low	99 Å²	99	149.5 Å²	149.5	69%	0.692	78%	0.775	S	S	*	*			trans	-96.5	159.3	175.8	56.9	0	0	0	0	113
922	V	25.5	Very low	28	Very low	128 Å²	128	142.5 Å²	142.5	78%	0.776	77%	0.769	S	S	*	*			trans	-175.6	121.6	149	132.5	0	0	0	0	107.3
923	K	29.1	Very low	29.3	Very low	194 Å²	194	143.7 Å²	143.7	84%	0.843	78%	0.775	S	S	*	*				66.7	124.2	77.4	-77.5	-167.9	179.5	-174.8	0	116.2
924	V	26.8	Very low	29.5	Very low	131 Å²	131	147.1 Å²	147.1	79%	0.794	79%	0.785	S	S	*	*			trans	-153.7	132.4	157.5	172.5	0	0	0	0	105.1
925	E	29	Very low	30.6	Very low	181 Å²	181	143.6 Å²	143.6	85%	0.846	78%	0.779	S	S	*	*			cis	-158.2	165.8	-7.7	-126.6	176.3	-145.3	0	0	111.9
926	K	33.2	Very low	30.8	Very low	209 Å²	209	145.6 Å²	145.6	91%	0.909	78%	0.779	S	S	*	*			trans	137.7	134.8	142.8	-158.7	162.8	-168.3	172.3	0	112.4
927	A	33.7	Very low	31.4	Very low	94 Å²	94	144.6 Å²	144.6	78%	0.777	77%	0.772	S	S	*	*			trans	-148	148.7	-165.9	0	0	0	0	0	114.7
928	T	33.9	Very low	31.6	Very low	132 Å²	132	145.3 Å²	145.3	81%	0.81	77%	0.772	S	S	*	*			trans	-174.7	167.5	156.8	42.8	0	0	0	0	107.5
929	M	28.3	Very low	31.8	Very low	162 Å²	162	144 Å²	144	80%	0.798	78%	0.775	S	S	*	*			cis	-164.2	159.4	-36	-95.2	-178.2	74.9	0	0	106.6
930	T	32.8	Very low	31.9	Very low	102 Å²	102	143.9 Å²	143.9	63%	0.626	78%	0.784	S	S	*	*			cis	-174.4	115.1	-26.6	-87.2	0	0	0	0	107.7
931	E	28.7	Very low	32.2	Very low	176 Å²	176	145.9 Å²	145.9	82%	0.822	79%	0.786	S	S	*	*			trans	62	168	166.8	-49.5	-58.9	105.6	0	0	117.6
932	A	31	Very low	33	Very low	93 Å²	93	146.9 Å²	146.9	77%	0.769	79%	0.79	S	S	*	*			cis	-150.4	173.4	7.3	0	0	0	0	0	112.5
933	P	51.3	Low	33	Very low	106 Å²	106	149.3 Å²	149.3	69%	0.688	79%	0.79	S	S	*	*			trans	-127.6	165.2	-160.1	42.4	-30.4	0	0	0	119.9
934	F	30.1	Very low	32.8	Very low	205 Å²	205	147.3 Å²	147.3	90%	0.899	78%	0.784	S	S	*	*			trans	41.6	168.6	146.8	-74.1	-65.6	0	0	0	122.3
935	P	50.1	Low	32.8	Very low	123 Å²	123	153.1 Å²	153.1	80%	0.799	79%	0.791	S	S	*	*			cis	-132.6	-166.2	5.7	42.8	-23.3	0	0	0	116.9
936	E	26	Very low	32.8	Very low	175 Å²	175	148.3 Å²	148.3	82%	0.818	79%	0.79	S	S	*	*			trans	-100.2	-168.4	176.3	-125.8	-160.2	142.5	0	0	111.7
937	P	51.6	Low	32.4	Very low	96 Å²	96	142.5 Å²	142.5	62%	0.623	79%	0.789	S	S	*	*			cis	-143.1	-168.8	-7.3	27.9	-0.2	0	0	0	117.7
938	V	26.5	Very low	32.3	Very low	115 Å²	115	149.2 Å²	149.2	70%	0.697	80%	0.795	S	S	*	*			trans	89.2	108.9	152.7	-169.4	0	0	0	0	122.8
939	Q	28.6	Very low	32	Very low	179 Å²	179	155.1 Å²	155.1	84%	0.836	80%	0.802	S	S	*	*			trans	45.9	157.9	140.9	-51.8	-178.5	22.3	0	0	121.7
940	V	24.3	Very low	31.9	Very low	133 Å²	133	149.9 Å²	149.9	81%	0.806	79%	0.79	S	S	*	*			cis	-143.5	168.4	26.6	-174.7	0	0	0	0	111.8
941	R	29.6	Very low	31.6	Very low	231 Å²	231	153.8 Å²	153.8	87%	0.872	80%	0.801	S	S	*	*			trans	-83.9	-172.2	174.7	-70.7	-178	171	153.3	-0.8	112.9
942	P	43.8	Very low	31.4	Very low	119 Å²	119	149.7 Å²	149.7	77%	0.773	80%	0.797	S	S	*	*			cis	-135.5	176.7	-3.5	43.3	-26.9	0	0	0	116.6
943	K	25.3	Very low	31.9	Very low	180 Å²	180	150.9 Å²	150.9	78%	0.783	80%	0.8	S	S	*	*				168.9	137.9	110.9	-167.2	159.5	-172.2	173.4	0	115.3
944	E	24.6	Very low	31.2	Very low	152 Å²	152	150.5 Å²	150.5	71%	0.71	80%	0.798	S	S	*	*			trans	-12.2	132	166.2	-54.3	161.3	142.2	0	0	121.5
945	R	26.8	Very low	31	Very low	252 Å²	252	149.4 Å²	149.4	95%	0.951	79%	0.793	S	S	*	*				-175.7	147.3	101.4	-99.6	-177.8	-175.5	-158.7	1.7	113.6
946	G	28.2	Very low	29.9	Very low	81 Å²	81	149.1 Å²	149.1	84%	0.835	78%	0.782	S	S	*	*			trans	84.8	119.4	152.4	0	0	0	0	0	119.1
947	G	26.5	Very low	30.1	Very low	86 Å²	86	151.4 Å²	151.4	89%	0.887	78%	0.783	S	S	*	*			trans	94.6	50	144.7	0	0	0	0	0	120.3
948	R	30.4	Very low	28.9	Very low	236 Å²	236	149.8 Å²	149.8	89%	0.891	78%	0.783	S	S	*	*			trans	-115.8	141.8	148.5	-66	-165.9	-153.8	-96.4	7.6	109.9
949	W	28.1	Very low	29.1	Very low	255 Å²	255	149.6 Å²	149.6	97%	0.966	79%	0.787	S	S	*	*			trans	171.1	142.7	147.7	-86.9	110.6	0	0	0	105.8
950	G	26.5	Very low	29.4	Very low	53 Å²	53	146.8 Å²	146.8	55%	0.546	78%	0.782	S	S	.	*			cis	-151.6	160.1	-11.7	0	0	0	0	0	107.8
951	H	24.8	Very low	29.7	Very low	184 Å²	184	146.3 Å²	146.3	85%	0.852	77%	0.774	S	S	*	*				39.5	121.2	79.2	-61	-76.8	0	0	0	111.9
952	A	24.9	Very low	30	Very low	90 Å²	90	141.3 Å²	141.3	74%	0.744	77%	0.769	S	S	*	*			cis	-172.6	173.6	39.8	0	0	0	0	0	111.9
953	S	41.8	Very low	29.7	Very low	117 Å²	117	144.7 Å²	144.7	82%	0.818	77%	0.767	S	S	*	*			trans	-92	130.4	144.9	55	0	0	0	0	109.3
954	P	37.2	Very low	30.3	Very low	99 Å²	99	141.7 Å²	141.7	64%	0.643	77%	0.768	S	S	*	*				-137.7	158.8	127.8	33.8	-16.6	0	0	0	110.3
955	F	24.7	Very low	30.6	Very low	181 Å²	181	140.1 Å²	140.1	79%	0.794	76%	0.76	S	S	*	*				52.1	133	64.1	-77.9	-98.7	0	0	0	112.2
956	M	28.6	Very low	30.7	Very low	117 Å²	117	132.5 Å²	132.5	58%	0.576	74%	0.742	S	S	*	*			cis	-170.6	155.7	-3.7	-145	-166.2	-18	0	0	109.9
957	R	29.2	Very low	30.7	Very low	224 Å²	224	136.9 Å²	136.9	85%	0.845	74%	0.739	S	S	*	*			trans	67.1	158.3	162.2	-55.5	172.6	-165.5	-173.9	4.3	116.4
958	G	27.3	Very low	31.5	Very low	61 Å²	61	138.3 Å²	138.3	63%	0.629	74%	0.735	S	S	*	*			cis	160.9	-170.3	-10.2	0	0	0	0	0	114.4
959	S	29.4	Very low	32	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	73%	0.732	S	S	*	*			trans	74.4	146.7	-174.8	78.3	0	0	0	0	115.1
960	T	36.5	Very low	32.1	Very low	120 Å²	120	124.5 Å²	124.5	74%	0.736	72%	0.722	S	S	*	*			cis	-123	145.9	12.4	40.5	0	0	0	0	111.4
961	I	30.1	Very low	32.9	Very low	124 Å²	124	127.1 Å²	127.1	64%	0.636	74%	0.738	S	S	*	*				64.9	113.4	60.5	-55.1	164.5	0	0	0	110.1
962	V	35	Very low	33.4	Very low	126 Å²	126	129.9 Å²	129.9	76%	0.764	74%	0.741	S	S	*	*				-150.4	123.5	58.6	174.1	0	0	0	0	109.1
963	R	37.6	Very low	33.8	Very low	190 Å²	190	131.3 Å²	131.3	72%	0.717	75%	0.746	S	S	*	*				57.5	146.8	93	-68.5	177.1	162.2	122.2	-0.2	115.8	H965	R963-H965 PolarHBondContact NE-NE2 3.3Å
964	S	37.7	Very low	34	Very low	116 Å²	116	134 Å²	134	81%	0.811	75%	0.745	S	S	*	*			cis	-101.9	134.8	31.6	34	0	0	0	0	115.8
965	H	30.5	Very low	33.7	Very low	119 Å²	119	140.1 Å²	140.1	55%	0.551	76%	0.757	S	S	*	*				74.2	124.3	70.9	-98.8	-105.6	0	0	0	114.1	R963	R963-H965 PolarHBondContact NE-NE2 3.3Å
966	T	30.8	Very low	34.6	Very low	93 Å²	93	135.5 Å²	135.5	57%	0.571	74%	0.743	S	S	*	*			cis	-167.7	169.3	-6.6	6.5	0	0	0	0	107.8
967	F	27.5	Very low	35	Very low	173 Å²	173	135.9 Å²	135.9	76%	0.759	76%	0.756	S	S	*	*			cis	-146.2	160.3	10.3	-112.9	-65.9	0	0	0	109.7
968	S	43.1	Very low	35.6	Very low	115 Å²	115	133.3 Å²	133.3	80%	0.804	75%	0.747	S	S	*	*			trans	-134.9	134.3	162.4	-51.6	0	0	0	0	110.1
969	P	41.7	Very low	35.8	Very low	129 Å²	129	138.6 Å²	138.6	84%	0.838	76%	0.76	S	S	*	*			trans	-107.2	140.4	155.7	-1.5	22.8	0	0	0	110.8
970	G	30.1	Very low	35.9	Very low	73 Å²	73	142.5 Å²	142.5	75%	0.753	76%	0.759	S	S	*	*			trans	-92.3	-178.7	175	0	0	0	0	0	113.4	R972	G970-R972 PolarHBondContact O-N 3.17Å; G970-R972 VanDerWaalsContact O-N 3.11Å
971	A	42.4	Very low	35.8	Very low	108 Å²	108	147.6 Å²	147.6	89%	0.893	77%	0.765	S	S	*	*	S	Bend	trans	-70.5	103.1	-174.8	0	0	0	0	0	114.1
972	R	36	Very low	35.9	Very low	242 Å²	242	146.3 Å²	146.3	91%	0.913	77%	0.767	S	S	*	*			trans	-166.3	157.5	143.7	-112.6	175.1	-179.1	-169.5	-1.1	111.1	G970	G970-R972 PolarHBondContact O-N 3.17Å; G970-R972 VanDerWaalsContact O-N 3.11Å
973	S	32.8	Very low	35.9	Very low	120 Å²	120	147.5 Å²	147.5	84%	0.839	77%	0.768	S	S	*	*	S	Bend	trans	74.8	148.3	-171.3	-153.1	0	0	0	0	115.3
974	H	45.2	Very low	35.6	Very low	172 Å²	172	144.2 Å²	144.2	80%	0.796	78%	0.775	S	S	*	*			trans	-87.1	149.9	-178.9	-58.3	-110.2	0	0	0	110.1
975	Y	31.8	Very low	35.5	Very low	228 Å²	228	146.4 Å²	146.4	89%	0.894	78%	0.777	S	S	*	*			trans	-140.8	130.9	153.7	-122.7	-85.7	0	0	0	111.4
976	V	43.4	Very low	35.6	Very low	84 Å²	84	146.1 Å²	146.1	51%	0.509	79%	0.789	S	S	.	*			trans	-90.6	128.6	-179.4	173.3	0	0	0	0	109.1	R978	V976-R978 HydrophobicContact CG1-CG 4.06Å
977	C	36.5	Very low	35.6	Very low	126 Å²	126	146.3 Å²	146.3	85%	0.851	79%	0.794	S	S	*	*			trans	-109.2	87	164.5	-77.1	0	0	0	0	109.8	L979	C977-L979 PolarHBondContact O-N 3.46Å
978	R	42.1	Very low	35.9	Very low	169 Å²	169	144.4 Å²	144.4	64%	0.638	80%	0.797	S	S	*	*			trans	-67.2	120.1	158.9	-77.1	175	167.6	107.6	-6.5	107.4	E269 V976	E269-R978 IonicContact OE1-NH1 3.6Å; E269-R978 IonicContact OE2-NH1 2.62Å; V976-R978 HydrophobicContact CG1-CG 4.06Å
979	L	32.3	Very low	35.6	Very low	173 Å²	173	146.8 Å²	146.8	91%	0.906	80%	0.799	S	S	*	*			trans	-112.2	135.6	154.2	-135.8	78.7	0	0	0	108.5	C977	C977-L979 PolarHBondContact O-N 3.46Å
980	Y	31.5	Very low	36.2	Very low	192 Å²	192	145.6 Å²	145.6	75%	0.753	79%	0.792	S	S	*	*			trans	-79.7	134.1	-165.1	-80	-111.6	0	0	0	111.9
981	R	33.2	Very low	36.7	Very low	228 Å²	228	150.8 Å²	150.8	86%	0.86	79%	0.794	S	S	*	*			trans	-83.8	133.8	143.7	-76	-178.6	172.5	-99.3	-1	107.5
982	S	33.2	Very low	36.7	Very low	97 Å²	97	154.4 Å²	154.4	68%	0.678	79%	0.789	S	S	*	*			trans	-136.5	107.5	167.4	-63.1	0	0	0	0	107.7
983	D	34.2	Very low	36.5	Very low	150 Å²	150	149.3 Å²	149.3	80%	0.802	78%	0.78	S	S	*	*			trans	-69.1	138.2	167.8	-50.5	-71	0	0	0	109.1
984	S	32	Very low	37.1	Very low	122 Å²	122	149 Å²	149	85%	0.853	77%	0.774	S	S	*	*			trans	-159.3	103.2	170.6	-80.6	0	0	0	0	109.9
985	D	35.6	Very low	36.5	Very low	162 Å²	162	150.1 Å²	150.1	87%	0.866	78%	0.777	S	S	*	*			trans	-110.5	115.9	174.9	-171.1	8.7	0	0	0	108.4
986	S	32.2	Very low	36.5	Very low	113 Å²	113	145.9 Å²	145.9	79%	0.79	78%	0.775	S	S	*	*			trans	174.4	127.5	161.2	-88.4	0	0	0	0	117.2
987	S	31.3	Very low	36.2	Very low	97 Å²	97	152.3 Å²	152.3	68%	0.678	79%	0.79	S	S	*	*				79.9	119.5	127.8	-154.3	0	0	0	0	123.7
988	T	33	Very low	35.8	Very low	133 Å²	133	153.6 Å²	153.6	82%	0.816	79%	0.789	S	S	*	*			trans	76.1	123.6	136.8	45.4	0	0	0	0	124.3
989	L	37	Very low	35.3	Very low	164 Å²	164	151.2 Å²	151.2	86%	0.859	79%	0.793	S	S	*	*			trans	-59.2	174.2	154.7	-64.8	171.3	0	0	0	112.3
990	P	55	Low	35.2	Very low	105 Å²	105	150.5 Å²	150.5	68%	0.682	79%	0.789	S	S	*	*			cis	-155.2	-173.6	30.4	40.8	-16.6	0	0	0	120.5
991	K	39.9	Very low	35.4	Very low	181 Å²	181	147.6 Å²	147.6	79%	0.787	78%	0.783	S	S	*	*			trans	105.6	104.4	160.1	-62.8	165.4	-177.1	172.3	0	115.9
992	K	42	Very low	35.4	Very low	184 Å²	184	148.6 Å²	148.6	80%	0.8	79%	0.786	S	S	*	*				93.1	152	103.9	-77.7	-163.7	160.6	-168.9	0	111.7
993	L	32.1	Very low	35.5	Very low	136 Å²	136	153.6 Å²	153.6	71%	0.712	79%	0.79	S	S	*	*			cis	-164.7	171.5	-12	-104.5	176.7	0	0	0	106.5
994	P	45.3	Very low	35.4	Very low	112 Å²	112	153 Å²	153	73%	0.727	79%	0.792	S	S	*	*			cis	-122.6	-172.6	-14.6	41.2	-26	0	0	0	113.3
995	F	32.7	Very low	35.2	Very low	196 Å²	196	155.8 Å²	155.8	86%	0.86	80%	0.797	S	S	*	*			trans	-98.2	153.4	174.1	-104.5	-95.3	0	0	0	112.7
996	V	33	Very low	35.2	Very low	140 Å²	140	159.3 Å²	159.3	85%	0.848	80%	0.798	S	S	*	*			trans	-122.9	154.1	153.6	-179.1	0	0	0	0	108.4
997	R	36.2	Very low	35.1	Very low	219 Å²	219	165.1 Å²	165.1	83%	0.826	80%	0.804	S	S	*	*			trans	-118.6	164.1	-170.4	-82.1	-176.1	164.4	121.7	-7.2	113.2
998	N	28.7	Very low	35.2	Very low	153 Å²	153	168.7 Å²	168.7	82%	0.818	81%	0.807	S	S	*	*			trans	116.2	138.6	162.6	-62.3	-13.7	0	0	0	112.2
999	T	30.3	Very low	34.9	Very low	119 Å²	119	171.4 Å²	171.4	73%	0.73	81%	0.811	S	S	*	*			cis	-140.1	130.6	4.9	22.7	0	0	0	0	109.7
1000	L	30.1	Very low	34.5	Very low	157 Å²	157	170.4 Å²	170.4	82%	0.822	80%	0.802	S	S	*	*				72.8	130.1	99.7	-85.6	165.7	0	0	0	118.4
1001	E	35.8	Very low	33.3	Very low	132 Å²	132	170.2 Å²	170.2	62%	0.617	80%	0.803	S	S	*	*			trans	66.8	94.2	158.3	-58	-119.7	81.2	0	0	120.8	R1003	E1001-R1003 VanDerWaalsContact CD-NH2 3.28Å; E1001-R1003 IonicContact OE1-CZ 3.57Å; E1001-R1003 IonicContact OE1-NE 2.79Å; E1001-R1003 PolarHBondContact OE1-NE 3.33Å; E1001-R1003 IonicContact OE1-NH2 2.69Å; E1001-R1003 PolarHBondContact OE1-NH2 3.4Å; E1001-R1003 IonicContact OE2-CZ 3.38Å; E1001-R1003 IonicContact OE2-NE 2.66Å; E1001-R1003 IonicContact OE2-NH2 2.72Å; E1001-R1003 PolarHBondContact OE2-NH2 3.49Å
1002	R	33.9	Very low	32.8	Very low	249 Å²	249	173.1 Å²	173.1	94%	0.94	81%	0.81	S	S	*	*			trans	-89.6	131.7	144.7	-88.6	-174.2	168.6	-163.1	-2.5	109.6
1003	R	35.3	Very low	32.4	Very low	202 Å²	202	176.6 Å²	176.6	76%	0.762	82%	0.818	S	S	*	*			trans	-141.7	112.9	158.3	-60.7	-172.3	-164.4	-178.4	11.6	110.9	E1001	E1001-R1003 VanDerWaalsContact CD-NH2 3.28Å; E1001-R1003 IonicContact OE1-CZ 3.57Å; E1001-R1003 IonicContact OE1-NE 2.79Å; E1001-R1003 PolarHBondContact OE1-NE 3.33Å; E1001-R1003 IonicContact OE1-NH2 2.69Å; E1001-R1003 PolarHBondContact OE1-NH2 3.4Å; E1001-R1003 IonicContact OE2-CZ 3.38Å; E1001-R1003 IonicContact OE2-NE 2.66Å; E1001-R1003 IonicContact OE2-NH2 2.72Å; E1001-R1003 PolarHBondContact OE2-NH2 3.49Å
1004	T	31.1	Very low	32.1	Very low	138 Å²	138	175.7 Å²	175.7	85%	0.847	82%	0.823	S	S	*	*			trans	-128.1	127.4	162.5	44.5	0	0	0	0	109
1005	L	28.5	Very low	31.7	Very low	180 Å²	180	175.8 Å²	175.8	94%	0.942	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-77.9	140.8	178.9	-76.2	164.5	0	0	0	110
1006	R	36.5	Very low	31.8	Very low	235 Å²	235	174.1 Å²	174.1	89%	0.887	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-86.9	123.5	172.6	-61.3	-177.1	-175.8	-164.5	0.3	109.6
1007	Y	28.7	Very low	31.9	Very low	235 Å²	235	171.8 Å²	171.8	92%	0.922	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-81.6	146.7	148.7	-105.7	-98.4	0	0	0	109.5
1008	K	34.1	Very low	31.8	Very low	172 Å²	172	171.1 Å²	171.1	75%	0.748	83%	0.828	S	S	*	*			trans	-105.4	145.4	175.3	-83.4	-176.5	170.9	-174.2	0	109.6
1009	Q	27.5	Very low	32.1	Very low	191 Å²	191	171.1 Å²	171.1	89%	0.893	82%	0.823	S	S	*	*			trans	-135	141.4	145.4	-163.3	165.4	-0.6	0	0	109.5
1010	Q	27.8	Very low	32.5	Very low	143 Å²	143	171 Å²	171	67%	0.668	82%	0.824	S	S	*	*			trans	-103.1	113.5	177	-80.3	164.5	-122.1	0	0	106.4
1011	S	29.8	Very low	32.9	Very low	100 Å²	100	170.1 Å²	170.1	70%	0.699	83%	0.826	S	S	*	*				80.2	94.4	71.5	77.1	0	0	0	0	113.5
1012	Y	29.2	Very low	33.8	Very low	242 Å²	242	169.6 Å²	169.6	95%	0.949	82%	0.818	S	S	*	*			trans	-105.8	149.5	150.2	-87.3	-92	0	0	0	109
1013	R	32.9	Very low	35.2	Very low	257 Å²	257	161.1 Å²	161.1	97%	0.97	79%	0.794	S	S	*	*			trans	-87.2	137.8	-175.7	-69.9	-179.3	175.7	178.3	-1	111.7
1014	S	26.3	Very low	36.5	Very low	117 Å²	117	153.7 Å²	153.7	82%	0.818	77%	0.773	S	S	*	*			trans	-137	149.9	143.1	-173.3	0	0	0	0	108.1
1015	S	38.2	Very low	38.1	Very low	114 Å²	114	152.4 Å²	152.4	80%	0.797	76%	0.76	S	S	*	*			trans	-126.8	85.9	-171.9	60.5	0	0	0	0	111.9
1016	L	34.4	Very low	40.1	Very low	162 Å²	162	147 Å²	147	85%	0.848	73%	0.732	S	S	*	*			trans	-109	156.9	155.4	-96.3	75.7	0	0	0	109.2
1017	A	34	Very low	42	Very low	91 Å²	91	136.5 Å²	136.5	75%	0.752	69%	0.694	S	S	*	*			trans	-73.9	160.1	175.9	0	0	0	0	0	111.4	Q1019	A1017-Q1019 PolarHBondContact O-N 3.48Å
1018	E	34.4	Very low	44.2	Very low	204 Å²	204	128.2 Å²	128.2	95%	0.953	66%	0.663	S	S	*	*			trans	-63.6	95.5	171.9	-68.7	163.9	123.6	0	0	110.2
1019	Q	35.8	Very low	46.1	Very low	153 Å²	153	124.4 Å²	124.4	72%	0.715	65%	0.651	S	S	*	*			trans	-92	148.7	150.4	-69.8	-171.6	-31.5	0	0	107.9	A1017 T1021	A1017-Q1019 PolarHBondContact O-N 3.48Å; Q1019-T1021 PolarHBondContact O-N 3.04Å
1020	P	37.2	Very low	48.6	Very low	117 Å²	117	118 Å²	118	76%	0.76	62%	0.623	S	S	*	*			trans	-56	139.4	169.3	25.7	-34.1	0	0	0	109.3	R1022	P1020-R1022 PolarHBondContact O-N 3.31Å
1021	T	38.3	Very low	51.2	Low	139 Å²	139	111.3 Å²	111.3	85%	0.853	59%	0.591	S	S	*	*			trans	-65.6	94.4	179.9	38.3	0	0	0	0	110.2	Q1019 T1023	Q1019-T1021 PolarHBondContact O-N 3.04Å; T1021-T1023 PolarHBondContact O-N 3.29Å
1022	R	55.8	Low	53.8	Low	121 Å²	121	112.1 Å²	112.1	46%	0.457	58%	0.584	S	S	.	*			trans	-54.5	127.8	173.6	-74	175.8	151	-136	-15.1	110.4	P1020 D1026 D1030	P1020-R1022 PolarHBondContact O-N 3.31Å; R1022-D1026 HydrophobicContact CB-CB 4.3Å; R1022-D1030 IonicContact CZ-OD2 2.67Å; R1022-D1030 IonicContact NH1-OD2 3.38Å; R1022-D1030 PolarHBondContact NH1-OD2 2.96Å; R1022-D1030 IonicContact NH2-OD1 3.29Å; R1022-D1030 PolarHBondContact NH2-OD1 3.02Å; R1022-D1030 IonicContact NH2-OD2 3.82Å; R1022-D1030 PolarHBondContact NH2-OD2 3.03Å
1023	T	62.9	Low	56.3	Low	71 Å²	71	103.5 Å²	103.5	44%	0.436	56%	0.563	S	S	.	*			trans	-77.2	172	176.5	66.2	0	0	0	0	111.3	T1021 L1025 D1026	T1021-T1023 PolarHBondContact O-N 3.29Å; T1023-L1025 VanDerWaalsContact C-N 3.28Å; T1023-L1025 PolarHBondContact O-N 3.38Å; T1023-L1025 PolarHBondContact OG1-N 3.16Å; T1023-D1026 WeakPolarHBondContact CB-OD2 3.37Å; T1023-D1026 PolarHBondContact N-OD2 3.41Å; T1023-D1026 PolarHBondContact O-N 2.86Å; T1023-D1026 PolarHBondContact OG1-N 3.2Å; T1023-D1026 VanDerWaalsContact OG1-N 3.12Å; T1023-D1026 PolarHBondContact OG1-OD2 3.41Å
1024	S	62.7	Low	58.8	Low	45 Å²	45	92.7 Å²	92.7	32%	0.315	53%	0.526	S	S	.	.	H	α-helix	trans	-56.3	-42.8	167	38.2	0	0	0	0	111.9	Y217 L1027	Y217-S1024 WeakPolarHBondContact CE2-O 3.5Å; S1024-L1027 PolarHBondContact O-N 3.09Å
1025	L	64	Low	61.6	Low	112 Å²	112	91.9 Å²	91.9	59%	0.586	51%	0.505	S	S	*	.	H	α-helix	trans	-65.1	-41.6	180	-178.5	60	0	0	0	112.4	T1023 L1027 E1028 L1029	T1023-L1025 VanDerWaalsContact C-N 3.28Å; T1023-L1025 PolarHBondContact O-N 3.38Å; T1023-L1025 PolarHBondContact OG1-N 3.16Å; L1025-L1027 PolarHBondContact O-N 2.96Å; L1025-E1028 PolarHBondContact O-N 2.93Å; L1025-L1029 HydrophobicContact CD1-CD1 4.17Å; L1025-L1029 HydrophobicContact CD1-CG 4.19Å; L1025-L1029 HydrophobicContact CG-CD1 3.9Å; L1025-L1029 HydrophobicContact CG-CG 4.36Å; L1025-L1029 WeakPolarHBondContact O-CG 3.46Å; L1025-L1029 PolarHBondContact O-N 3.03Å
1026	D	72.4	Confident	63.8	Low	66 Å²	66	89.3 Å²	89.3	35%	0.353	49%	0.485	S	S	.	.	H	α-helix	trans	-58.8	-30.8	178	-63.9	-53.3	0	0	0	112.6	R1022 T1023 D1030	R1022-D1026 HydrophobicContact CB-CB 4.3Å; T1023-D1026 WeakPolarHBondContact CB-OD2 3.37Å; T1023-D1026 PolarHBondContact N-OD2 3.41Å; T1023-D1026 PolarHBondContact O-N 2.86Å; T1023-D1026 PolarHBondContact OG1-N 3.2Å; T1023-D1026 VanDerWaalsContact OG1-N 3.12Å; T1023-D1026 PolarHBondContact OG1-OD2 3.41Å; D1026-D1030 VanDerWaalsContact O-CB 3.32Å; D1026-D1030 WeakPolarHBondContact O-CB 3.38Å; D1026-D1030 PolarHBondContact O-N 3.4Å
1027	L	74.9	Confident	66.4	Low	14 Å²	14	88 Å²	88	7%	0.073	47%	0.469	C	S	.	.	H	α-helix	trans	-74.9	-39.7	-178.8	-73.5	165	0	0	0	112.9	I225 F226 L229 S1024 L1025 L1031	I225-L1027 HydrophobicContact CG2-CB 4.2Å; F226-L1027 HydrophobicContact CD1-CD2 4.36Å; F226-L1027 HydrophobicContact CD2-CD2 4.46Å; F226-L1027 HydrophobicContact CE1-CD2 3.75Å; F226-L1027 HydrophobicContact CE2-CD1 4.11Å; F226-L1027 HydrophobicContact CE2-CD2 3.86Å; F226-L1027 HydrophobicContact CZ-CD1 4.37Å; F226-L1027 HydrophobicContact CZ-CD2 3.48Å; F226-L1027 VanDerWaalsContact CZ-CD2 3.48Å; L229-L1027 HydrophobicContact CD1-CD2 4.35Å; S1024-L1027 PolarHBondContact O-N 3.09Å; L1025-L1027 PolarHBondContact O-N 2.96Å; L1027-L1031 WeakPolarHBondContact O-CB 3.48Å; L1027-L1031 PolarHBondContact O-N 3.24Å
1028	E	75.7	Confident	69.1	Low	61 Å²	61	86 Å²	86	29%	0.285	44%	0.444	S	S	.	.	H	α-helix	trans	-72.4	-38.3	176	-163.3	66.4	-124.4	0	0	111	Y217 L1025 L1031 Q1032 R1035	Y217-E1028 WeakPolarHBondContact OH-CB 3.21Å; Y217-E1028 PolarHBondContact OH-OE2 3.42Å; L1025-E1028 PolarHBondContact O-N 2.93Å; E1028-L1031 WeakPolarHBondContact O-CB 3.49Å; E1028-L1031 PolarHBondContact O-N 3.45Å; E1028-Q1032 WeakPolarHBondContact O-CB 3.28Å; E1028-Q1032 PolarHBondContact O-N 3.48Å; E1028-R1035 IonicContact OE1-NH1 3.74Å
1029	L	73.1	Confident	71.7	Confident	93 Å²	93	84 Å²	84	49%	0.487	43%	0.428	S	S	.	.	H	α-helix	trans	-64.5	-44.4	174.6	-68.6	175.8	0	0	0	111.9	L1025 L1031 Q1032 A1033	L1025-L1029 HydrophobicContact CD1-CD1 4.17Å; L1025-L1029 HydrophobicContact CD1-CG 4.19Å; L1025-L1029 HydrophobicContact CG-CD1 3.9Å; L1025-L1029 HydrophobicContact CG-CG 4.36Å; L1025-L1029 WeakPolarHBondContact O-CG 3.46Å; L1025-L1029 PolarHBondContact O-N 3.03Å; L1029-L1031 VanDerWaalsContact C-N 3.28Å; L1029-L1031 PolarHBondContact O-N 3.3Å; L1029-Q1032 PolarHBondContact O-N 3.36Å; L1029-A1033 VanDerWaalsContact O-CB 3.28Å; L1029-A1033 WeakPolarHBondContact O-CB 3.19Å; L1029-A1033 PolarHBondContact O-N 3.09Å
1030	D	79.7	Confident	74.1	Confident	57 Å²	57	81.9 Å²	81.9	31%	0.305	42%	0.418	S	S	.	.	H	α-helix	trans	-57.3	-42.4	170.6	-107.5	24.5	0	0	0	110.9	L229 R1022 D1026 C1034	L229-D1030 HydrophobicContact CD1-CB 4.37Å; L229-D1030 HydrophobicContact CD2-CB 4.14Å; R1022-D1030 IonicContact CZ-OD2 2.67Å; R1022-D1030 IonicContact NH1-OD2 3.38Å; R1022-D1030 PolarHBondContact NH1-OD2 2.96Å; R1022-D1030 IonicContact NH2-OD1 3.29Å; R1022-D1030 PolarHBondContact NH2-OD1 3.02Å; R1022-D1030 IonicContact NH2-OD2 3.82Å; R1022-D1030 PolarHBondContact NH2-OD2 3.03Å; D1026-D1030 VanDerWaalsContact O-CB 3.32Å; D1026-D1030 WeakPolarHBondContact O-CB 3.38Å; D1026-D1030 PolarHBondContact O-N 3.4Å; D1030-C1034 VanDerWaalsContact O-CB 3.29Å; D1030-C1034 WeakPolarHBondContact O-CB 3.28Å; D1030-C1034 PolarHBondContact O-N 3.28Å; D1030-C1034 PolarHBondContact O-SG 2.96Å
1031	L	83.3	Confident	76.6	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.005	38%	0.384	C	S	.	.	H	α-helix	trans	-67	-46.2	-178.2	-176.5	66.2	0	0	0	111.7	I225 E228 L229 I232 L1027 E1028 L1029 C1034 R1035	I225-L1031 HydrophobicContact CG1-CD2 4.2Å; I225-L1031 HydrophobicContact CG2-CB 4.44Å; I225-L1031 HydrophobicContact CG2-CD2 4.16Å; E228-L1031 HydrophobicContact CB-CD1 4.08Å; E228-L1031 HydrophobicContact CG-CD1 4.12Å; L229-L1031 HydrophobicContact CD2-CB 4.23Å; L229-L1031 HydrophobicContact CD2-CD1 4.14Å; L229-L1031 HydrophobicContact CG-CB 4.39Å; L229-L1031 HydrophobicContact CG-CD1 3.98Å; I232-L1031 HydrophobicContact CD1-CD1 3.63Å; L1027-L1031 WeakPolarHBondContact O-CB 3.48Å; L1027-L1031 PolarHBondContact O-N 3.24Å; E1028-L1031 WeakPolarHBondContact O-CB 3.49Å; E1028-L1031 PolarHBondContact O-N 3.45Å; L1029-L1031 VanDerWaalsContact C-N 3.28Å; L1029-L1031 PolarHBondContact O-N 3.3Å; L1031-C1034 PolarHBondContact O-N 2.9Å; L1031-R1035 WeakPolarHBondContact O-CB 3.17Å; L1031-R1035 WeakPolarHBondContact O-CG 3.48Å; L1031-R1035 PolarHBondContact O-N 3.36Å
1032	Q	83.4	Confident	79	Confident	118 Å²	118	75.8 Å²	75.8	55%	0.551	37%	0.371	S	S	*	.	H	α-helix	trans	-63.8	-42.2	176.4	-173	175.8	-2.5	0	0	111.7	E1028 L1029 R1035 T1036	E1028-Q1032 WeakPolarHBondContact O-CB 3.28Å; E1028-Q1032 PolarHBondContact O-N 3.48Å; L1029-Q1032 PolarHBondContact O-N 3.36Å; Q1032-R1035 PolarHBondContact O-N 3Å; Q1032-T1036 WeakPolarHBondContact O-CB 3.29Å; Q1032-T1036 PolarHBondContact O-N 2.95Å; Q1032-T1036 PolarHBondContact O-OG1 3.48Å
1033	A	82.9	Confident	80.5	Confident	60 Å²	60	75.1 Å²	75.1	50%	0.496	37%	0.373	S	S	.	.	H	α-helix	trans	-62.2	-43.6	174.4	0	0	0	0	0	111.6	L1029 T1036 R1037	L1029-A1033 VanDerWaalsContact O-CB 3.28Å; L1029-A1033 WeakPolarHBondContact O-CB 3.19Å; L1029-A1033 PolarHBondContact O-N 3.09Å; A1033-T1036 PolarHBondContact O-N 2.78Å; A1033-R1037 PolarHBondContact O-N 3.21Å
1034	C	85	Confident	81.6	Confident	30 Å²	30	75.9 Å²	75.9	20%	0.203	37%	0.371	C	S	.	.	H	α-helix	trans	-63.5	-48.7	176.4	-71.7	0	0	0	0	112.2	L229 I232 D1030 L1031 T1036 R1037 Q1038	L229-C1034 HydrophobicContact CD2-CB 4.05Å; I232-C1034 HydrophobicContact CB-CB 4.41Å; I232-C1034 HydrophobicContact CD1-CB 4.5Å; I232-C1034 HydrophobicContact CG2-CB 3.7Å; D1030-C1034 VanDerWaalsContact O-CB 3.29Å; D1030-C1034 WeakPolarHBondContact O-CB 3.28Å; D1030-C1034 PolarHBondContact O-N 3.28Å; D1030-C1034 PolarHBondContact O-SG 2.96Å; L1031-C1034 PolarHBondContact O-N 2.9Å; C1034-T1036 PolarHBondContact O-N 2.8Å; C1034-R1037 PolarHBondContact O-N 2.75Å; C1034-Q1038 WeakPolarHBondContact O-CB 3.23Å; C1034-Q1038 PolarHBondContact O-N 3.09Å
1035	R	85.6	Confident	82.8	Confident	100 Å²	100	74.1 Å²	74.1	38%	0.377	36%	0.358	S	S	.	.	H	α-helix	trans	-56.8	-39	175.2	-73.5	173.3	175.9	159.2	-5.4	111.6	E228 I232 E1028 L1031 Q1032 R1039	E228-R1035 IonicContact OE1-CZ 3.89Å; E228-R1035 VanDerWaalsContact OE1-CZ 3.23Å; E228-R1035 IonicContact OE1-NE 2.84Å; E228-R1035 PolarHBondContact OE1-NE 3.33Å; E228-R1035 IonicContact OE1-NH2 3.75Å; E228-R1035 PolarHBondContact OE1-NH2 2.81Å; E228-R1035 IonicContact OE2-CZ 2.71Å; E228-R1035 IonicContact OE2-NH2 3.82Å; E228-R1035 PolarHBondContact OE2-NH2 2.81Å; I232-R1035 HydrophobicContact CD1-CG 3.65Å; E1028-R1035 IonicContact OE1-NH1 3.74Å; L1031-R1035 WeakPolarHBondContact O-CB 3.17Å; L1031-R1035 WeakPolarHBondContact O-CG 3.48Å; L1031-R1035 PolarHBondContact O-N 3.36Å; Q1032-R1035 PolarHBondContact O-N 3Å; R1035-R1039 PolarHBondContact O-N 2.94Å; R1035-R1039 VanDerWaalsContact O-N 3.11Å
1036	T	84.9	Confident	83.9	Confident	61 Å²	61	71.9 Å²	71.9	37%	0.374	35%	0.353	S	S	.	.	H	α-helix	trans	-68.1	-48.7	179.2	-55.8	0	0	0	0	111.9	Q1032 A1033 C1034 Q1038 R1039 Q1040	Q1032-T1036 WeakPolarHBondContact O-CB 3.29Å; Q1032-T1036 PolarHBondContact O-N 2.95Å; Q1032-T1036 PolarHBondContact O-OG1 3.48Å; A1033-T1036 PolarHBondContact O-N 2.78Å; C1034-T1036 PolarHBondContact O-N 2.8Å; T1036-Q1038 VanDerWaalsContact C-N 3.3Å; T1036-Q1038 PolarHBondContact O-N 2.99Å; T1036-R1039 PolarHBondContact O-N 3.14Å; T1036-R1039 VanDerWaalsContact O-N 3.17Å; T1036-Q1040 PolarHBondContact O-N 2.8Å; T1036-Q1040 VanDerWaalsContact O-N 3.1Å
1037	R	88.5	Confident	84.4	Confident	134 Å²	134	70.2 Å²	70.2	51%	0.506	35%	0.348	S	S	.	.	H	α-helix	trans	-59.9	-39	174.6	178.1	173.2	173.1	167.7	-3.7	112	I236 E240 A1033 C1034 L1041	I236-R1037 HydrophobicContact CD1-CB 4.15Å; I236-R1037 HydrophobicContact CD1-CG 4.03Å; I236-R1037 HydrophobicContact CG2-CG 4.48Å; E240-R1037 IonicContact OE1-CZ 2.72Å; E240-R1037 IonicContact OE1-NE 2.84Å; E240-R1037 PolarHBondContact OE1-NE 2.77Å; E240-R1037 IonicContact OE1-NH2 3.98Å; E240-R1037 PolarHBondContact OE1-NH2 3.01Å; E240-R1037 IonicContact OE2-NH2 3.84Å; E240-R1037 PolarHBondContact OE2-NH2 3.16Å; A1033-R1037 PolarHBondContact O-N 3.21Å; C1034-R1037 PolarHBondContact O-N 2.75Å; R1037-L1041 WeakPolarHBondContact O-CB 3.46Å; R1037-L1041 PolarHBondContact O-N 2.69Å
1038	Q	90.9	Very high	84.9	Confident	48 Å²	48	70.3 Å²	70.3	22%	0.224	35%	0.348	C	S	.	.	H	α-helix	trans	-62.7	-41.9	175.8	-174.7	-177	-1.4	0	0	112	I232 I236 C1034 T1036 L1041 M1042	I232-Q1038 HydrophobicContact CG2-CB 4.02Å; I236-Q1038 HydrophobicContact CD1-CB 4.24Å; I236-Q1038 HydrophobicContact CG1-CB 3.95Å; I236-Q1038 HydrophobicContact CG1-CG 4.44Å; C1034-Q1038 WeakPolarHBondContact O-CB 3.23Å; C1034-Q1038 PolarHBondContact O-N 3.09Å; T1036-Q1038 VanDerWaalsContact C-N 3.3Å; T1036-Q1038 PolarHBondContact O-N 2.99Å; Q1038-L1041 PolarHBondContact O-N 2.98Å; Q1038-M1042 HydrophobicContact CG-SD 4.23Å; Q1038-M1042 WeakPolarHBondContact O-CG 3.2Å; Q1038-M1042 PolarHBondContact O-N 3.03Å
1039	R	88.8	Confident	85.5	Confident	164 Å²	164	73.5 Å²	73.5	62%	0.619	36%	0.358	S	S	*	.	H	α-helix	trans	-64.3	-50.7	178.7	-169	-171.4	-62.3	158.8	2	111.6	R1035 T1036 L1041 M1042 E1043	R1035-R1039 PolarHBondContact O-N 2.94Å; R1035-R1039 VanDerWaalsContact O-N 3.11Å; T1036-R1039 PolarHBondContact O-N 3.14Å; T1036-R1039 VanDerWaalsContact O-N 3.17Å; R1039-L1041 VanDerWaalsContact C-N 3.27Å; R1039-L1041 PolarHBondContact O-N 3.39Å; R1039-M1042 WeakPolarHBondContact O-CB 3.47Å; R1039-M1042 PolarHBondContact O-N 3.13Å; R1039-E1043 WeakPolarHBondContact CD-OE1 3.25Å; R1039-E1043 VanDerWaalsContact CG-OE1 3.31Å; R1039-E1043 WeakPolarHBondContact CG-OE1 3.42Å; R1039-E1043 WeakPolarHBondContact O-CG 3.2Å; R1039-E1043 PolarHBondContact O-N 3.12Å
1040	Q	86.1	Confident	86.1	Confident	108 Å²	108	73.6 Å²	73.6	51%	0.505	36%	0.356	S	S	.	.	H	α-helix	trans	-55.5	-43.8	176.4	-69.6	170.8	-30.6	0	0	111.5	T1036 M1042 E1043 E1044	T1036-Q1040 PolarHBondContact O-N 2.8Å; T1036-Q1040 VanDerWaalsContact O-N 3.1Å; Q1040-M1042 PolarHBondContact O-N 2.66Å; Q1040-E1043 PolarHBondContact O-N 2.99Å; Q1040-E1044 WeakPolarHBondContact O-CG 3.23Å; Q1040-E1044 PolarHBondContact O-N 3.39Å
1041	L	89.1	Confident	86.1	Confident	12 Å²	12	71.2 Å²	71.2	6%	0.063	34%	0.343	C	S	.	.	H	α-helix	trans	-62.9	-39.4	175.8	178.9	66.3	0	0	0	113	I236 E240 R243 R1037 Q1038 R1039 L1045	I236-L1041 HydrophobicContact CB-CD2 4.26Å; I236-L1041 HydrophobicContact CG1-CD2 4.35Å; I236-L1041 HydrophobicContact CG2-CD2 4.22Å; I236-L1041 WeakPolarHBondContact O-CD2 3.14Å; E240-L1041 HydrophobicContact CG-CD1 3.78Å; E240-L1041 HydrophobicContact CG-CD2 3.89Å; E240-L1041 HydrophobicContact CG-CG 4.5Å; R243-L1041 HydrophobicContact CB-CD1 4.33Å; R243-L1041 HydrophobicContact CG-CD1 4.42Å; R1037-L1041 WeakPolarHBondContact O-CB 3.46Å; R1037-L1041 PolarHBondContact O-N 2.69Å; Q1038-L1041 PolarHBondContact O-N 2.98Å; R1039-L1041 VanDerWaalsContact C-N 3.27Å; R1039-L1041 PolarHBondContact O-N 3.39Å; L1041-L1045 HydrophobicContact CG-CD1 4.3Å; L1041-L1045 WeakPolarHBondContact O-CB 3.37Å; L1041-L1045 WeakPolarHBondContact O-CG 3.39Å; L1041-L1045 PolarHBondContact O-N 2.88Å
1042	M	89.1	Confident	86.1	Confident	116 Å²	116	73.6 Å²	73.6	57%	0.571	35%	0.353	S	S	*	.	H	α-helix	trans	-68.5	-37.8	175.6	-76	176.8	57.8	0	0	112.4	Q1038 R1039 Q1040 L1045 S1046	Q1038-M1042 HydrophobicContact CG-SD 4.23Å; Q1038-M1042 WeakPolarHBondContact O-CG 3.2Å; Q1038-M1042 PolarHBondContact O-N 3.03Å; R1039-M1042 WeakPolarHBondContact O-CB 3.47Å; R1039-M1042 PolarHBondContact O-N 3.13Å; Q1040-M1042 PolarHBondContact O-N 2.66Å; M1042-L1045 PolarHBondContact O-N 2.88Å; M1042-S1046 WeakPolarHBondContact O-CB 3.28Å; M1042-S1046 PolarHBondContact O-N 3.45Å
1043	E	87.7	Confident	86.2	Confident	107 Å²	107	73.9 Å²	73.9	50%	0.5	36%	0.358	S	S	.	.	H	α-helix	trans	-62.8	-49.8	173.7	-71.1	164	-171.7	0	0	110.3	R1039 Q1040 L1045 S1046 A1047	R1039-E1043 WeakPolarHBondContact CD-OE1 3.25Å; R1039-E1043 VanDerWaalsContact CG-OE1 3.31Å; R1039-E1043 WeakPolarHBondContact CG-OE1 3.42Å; R1039-E1043 WeakPolarHBondContact O-CG 3.2Å; R1039-E1043 PolarHBondContact O-N 3.12Å; Q1040-E1043 PolarHBondContact O-N 2.99Å; E1043-L1045 PolarHBondContact O-N 3.36Å; E1043-S1046 PolarHBondContact O-N 2.91Å; E1043-S1046 VanDerWaalsContact O-N 3.16Å; E1043-S1046 PolarHBondContact O-OG 2.84Å; E1043-A1047 PolarHBondContact O-N 2.94Å
1044	E	84.8	Confident	85.8	Confident	86 Å²	86	76.1 Å²	76.1	40%	0.402	35%	0.354	S	S	.	.	H	α-helix	trans	-59.1	-42.7	174.2	-74.8	-173.4	-149.8	0	0	112.9	R243 Q1040 S1046 A1047 L1048	R243-E1044 VanDerWaalsContact CD-OE2 3.29Å; R243-E1044 WeakPolarHBondContact CD-OE2 3.34Å; R243-E1044 IonicContact CZ-OE2 3.26Å; R243-E1044 IonicContact NE-OE2 3.45Å; R243-E1044 IonicContact NH1-OE2 3.07Å; R243-E1044 PolarHBondContact NH1-OE2 3.31Å; Q1040-E1044 WeakPolarHBondContact O-CG 3.23Å; Q1040-E1044 PolarHBondContact O-N 3.39Å; E1044-S1046 VanDerWaalsContact C-N 3.34Å; E1044-S1046 PolarHBondContact O-N 3.33Å; E1044-A1047 PolarHBondContact O-N 2.92Å; E1044-L1048 WeakPolarHBondContact O-CB 3.27Å; E1044-L1048 VanDerWaalsContact O-CG 3.25Å; E1044-L1048 WeakPolarHBondContact O-CG 3.36Å; E1044-L1048 PolarHBondContact O-N 2.98Å
1045	L	88.5	Confident	85.3	Confident	8 Å²	8	75.6 Å²	75.6	4%	0.042	35%	0.349	C	S	.	.	H	α-helix	trans	-61.8	-40.6	174.9	-77.8	171.8	0	0	0	112.1	E242 R243 L246 L1041 M1042 E1043 L1048 R1049	E242-L1045 HydrophobicContact CB-CD2 3.88Å; E242-L1045 HydrophobicContact CG-CD2 3.94Å; R243-L1045 HydrophobicContact CB-CD2 3.9Å; R243-L1045 HydrophobicContact CG-CD2 4.31Å; L246-L1045 HydrophobicContact CD1-CD2 3.78Å; L1041-L1045 HydrophobicContact CG-CD1 4.3Å; L1041-L1045 WeakPolarHBondContact O-CB 3.37Å; L1041-L1045 WeakPolarHBondContact O-CG 3.39Å; L1041-L1045 PolarHBondContact O-N 2.88Å; M1042-L1045 PolarHBondContact O-N 2.88Å; E1043-L1045 PolarHBondContact O-N 3.36Å; L1045-L1048 PolarHBondContact O-N 2.93Å; L1045-R1049 WeakPolarHBondContact O-CB 3.41Å; L1045-R1049 WeakPolarHBondContact O-CG 3.24Å; L1045-R1049 PolarHBondContact O-N 2.9Å
1046	S	87.4	Confident	84.8	Confident	66 Å²	66	75.6 Å²	75.6	46%	0.462	35%	0.353	S	S	.	.	H	α-helix	trans	-62.9	-44.9	177.5	75.6	0	0	0	0	111.4	M1042 E1043 E1044 R1049 E1050	M1042-S1046 WeakPolarHBondContact O-CB 3.28Å; M1042-S1046 PolarHBondContact O-N 3.45Å; E1043-S1046 PolarHBondContact O-N 2.91Å; E1043-S1046 VanDerWaalsContact O-N 3.16Å; E1043-S1046 PolarHBondContact O-OG 2.84Å; E1044-S1046 VanDerWaalsContact C-N 3.34Å; E1044-S1046 PolarHBondContact O-N 3.33Å; S1046-R1049 PolarHBondContact O-N 3.42Å; S1046-E1050 WeakPolarHBondContact O-CB 3.32Å; S1046-E1050 PolarHBondContact O-N 3.08Å
1047	A	83.5	Confident	84.3	Confident	30 Å²	30	79.4 Å²	79.4	25%	0.248	37%	0.366	C	S	.	.	H	α-helix	trans	-64.5	-41.6	176.6	0	0	0	0	0	112.1	E1043 E1044 E1050 L1051	E1043-A1047 PolarHBondContact O-N 2.94Å; E1044-A1047 PolarHBondContact O-N 2.92Å; A1047-E1050 PolarHBondContact O-N 3.27Å; A1047-L1051 WeakPolarHBondContact O-CB 3.5Å; A1047-L1051 PolarHBondContact O-N 3.19Å
1048	L	85	Confident	82.8	Confident	17 Å²	17	78.7 Å²	78.7	9%	0.089	38%	0.379	C	S	.	.	H	α-helix	trans	-68.9	-35.4	177.5	-71.1	166.3	0	0	0	112.7	R243 L246 I247 L250 E1044 L1045 K1052 A1083	R243-L1048 HydrophobicContact CG-CD1 3.47Å; R243-L1048 VanDerWaalsContact CG-CD1 3.47Å; L246-L1048 HydrophobicContact CB-CB 4.16Å; L246-L1048 HydrophobicContact CD1-CB 3.94Å; I247-L1048 HydrophobicContact CD1-CD1 4.15Å; I247-L1048 HydrophobicContact CG1-CD1 3.95Å; I247-L1048 HydrophobicContact CG1-CD2 3.89Å; L250-L1048 HydrophobicContact CD1-CB 4.45Å; L250-L1048 HydrophobicContact CD1-CD2 3.61Å; E1044-L1048 WeakPolarHBondContact O-CB 3.27Å; E1044-L1048 VanDerWaalsContact O-CG 3.25Å; E1044-L1048 WeakPolarHBondContact O-CG 3.36Å; E1044-L1048 PolarHBondContact O-N 2.98Å; L1045-L1048 PolarHBondContact O-N 2.93Å; L1048-K1052 VanDerWaalsContact O-CB 3.23Å; L1048-K1052 WeakPolarHBondContact O-CB 3.33Å; L1048-K1052 PolarHBondContact O-N 2.79Å; L1048-A1083 HydrophobicContact CD2-CB 4.46Å
1049	R	88.4	Confident	81	Confident	127 Å²	127	82 Å²	82	48%	0.479	40%	0.395	S	S	.	.	H	α-helix	trans	-66	-44.8	172.7	-73.1	168.7	-175.2	170.7	2.5	111.4	E242 L246 L1045 S1046 K1052 L1053	E242-R1049 IonicContact OE1-CZ 2.65Å; E242-R1049 IonicContact OE1-NE 2.85Å; E242-R1049 PolarHBondContact OE1-NE 2.84Å; E242-R1049 IonicContact OE1-NH2 3.2Å; E242-R1049 PolarHBondContact OE1-NH2 3.27Å; E242-R1049 IonicContact OE2-CZ 3.86Å; E242-R1049 IonicContact OE2-NH2 3.81Å; E242-R1049 PolarHBondContact OE2-NH2 2.84Å; L246-R1049 HydrophobicContact CD1-CG 3.82Å; L246-R1049 HydrophobicContact CD2-CG 4.46Å; L1045-R1049 WeakPolarHBondContact O-CB 3.41Å; L1045-R1049 WeakPolarHBondContact O-CG 3.24Å; L1045-R1049 PolarHBondContact O-N 2.9Å; S1046-R1049 PolarHBondContact O-N 3.42Å; R1049-K1052 PolarHBondContact O-N 3.32Å; R1049-L1053 WeakPolarHBondContact O-CB 3.47Å; R1049-L1053 PolarHBondContact O-N 3.35Å
1050	E	85.6	Confident	79.2	Confident	96 Å²	96	79.5 Å²	79.5	45%	0.449	41%	0.409	S	S	.	.	H	α-helix	trans	-63.2	-47.5	176	-178.2	179.2	-165.7	0	0	111.6	S1046 A1047 K1052 L1053 R1054	S1046-E1050 WeakPolarHBondContact O-CB 3.32Å; S1046-E1050 PolarHBondContact O-N 3.08Å; A1047-E1050 PolarHBondContact O-N 3.27Å; E1050-K1052 PolarHBondContact O-N 2.78Å; E1050-L1053 PolarHBondContact O-N 3.19Å; E1050-R1054 WeakPolarHBondContact O-CG 3.32Å; E1050-R1054 PolarHBondContact O-N 3.47Å; E1050-R1054 IonicContact OE1-CZ 3.11Å; E1050-R1054 VanDerWaalsContact OE1-CZ 3.26Å; E1050-R1054 IonicContact OE1-NE 2.68Å; E1050-R1054 PolarHBondContact OE1-NE 3.4Å; E1050-R1054 IonicContact OE1-NH2 2.76Å; E1050-R1054 PolarHBondContact OE1-NH2 2.83Å
1051	L	79.6	Confident	77.4	Confident	6 Å²	6	78.5 Å²	78.5	3%	0.031	41%	0.414	C	S	.	.	H	α-helix	trans	-60.4	-36.3	178.2	-162.4	108	0	0	0	111.6	L250 A1047 L1055 F1076 L1079 L1080	L250-L1051 HydrophobicContact CD1-CD2 3.7Å; L250-L1051 HydrophobicContact CD2-CD2 3.85Å; L250-L1051 HydrophobicContact CG-CD2 4.34Å; A1047-L1051 WeakPolarHBondContact O-CB 3.5Å; A1047-L1051 PolarHBondContact O-N 3.19Å; L1051-L1055 WeakPolarHBondContact O-CD1 3.35Å; L1051-L1055 WeakPolarHBondContact O-CG 3.41Å; L1051-L1055 PolarHBondContact O-N 2.89Å; L1051-F1076 HydrophobicContact CD1-CD2 3.33Å; L1051-F1076 HydrophobicContact CD1-CE2 3.35Å; L1051-F1076 HydrophobicContact CD1-CG 4.06Å; L1051-F1076 HydrophobicContact CD1-CZ 4.1Å; L1051-F1076 HydrophobicContact CG-CD2 4.09Å; L1051-F1076 HydrophobicContact CG-CE2 3.55Å; L1051-F1076 HydrophobicContact CG-CZ 4.08Å; L1051-L1079 HydrophobicContact CD1-CB 3.82Å; L1051-L1079 HydrophobicContact CD1-CD1 4.08Å; L1051-L1080 HydrophobicContact CD2-CD2 3.75Å; L1051-L1080 HydrophobicContact CD2-CG 4.15Å
1052	K	83.9	Confident	75.7	Confident	51 Å²	51	86.5 Å²	86.5	22%	0.222	46%	0.457	C	S	.	.	H	α-helix	trans	-68.5	-49.9	173.3	178.8	176.3	170.3	165.2	0	111.5	L246 S249 L250 L1048 R1049 E1050 R1054 L1055 E1056	L246-K1052 HydrophobicContact CD2-CD 3.64Å; S249-K1052 PolarHBondContact OG-NZ 2.68Å; S249-K1052 VanDerWaalsContact OG-NZ 3.09Å; L250-K1052 HydrophobicContact CD2-CB 3.87Å; L250-K1052 HydrophobicContact CD2-CG 4.48Å; L250-K1052 HydrophobicContact CG-CB 4.38Å; L1048-K1052 VanDerWaalsContact O-CB 3.23Å; L1048-K1052 WeakPolarHBondContact O-CB 3.33Å; L1048-K1052 PolarHBondContact O-N 2.79Å; R1049-K1052 PolarHBondContact O-N 3.32Å; E1050-K1052 PolarHBondContact O-N 2.78Å; K1052-R1054 VanDerWaalsContact C-N 3.32Å; K1052-R1054 PolarHBondContact O-N 2.86Å; K1052-L1055 CarbonylContact O-C 3.55Å; K1052-L1055 WeakPolarHBondContact O-CA 3.28Å; K1052-L1055 PolarHBondContact O-N 3.45Å; K1052-E1056 WeakPolarHBondContact CE-OE1 3.5Å; K1052-E1056 WeakPolarHBondContact CE-OE2 3.28Å; K1052-E1056 HydrophobicContact CG-CG 4.34Å; K1052-E1056 IonicContact NZ-OE1 2.74Å; K1052-E1056 PolarHBondContact NZ-OE1 3.43Å; K1052-E1056 IonicContact NZ-OE2 3.24Å; K1052-E1056 PolarHBondContact O-N 2.84Å
1053	L	84	Confident	73.8	Confident	125 Å²	125	83.4 Å²	83.4	65%	0.654	45%	0.449	S	S	*	.	H	α-helix	trans	-56.6	-45.2	-179.6	-177.8	64.7	0	0	0	111.7	R1049 E1050 L1055 E1056 E1057	R1049-L1053 WeakPolarHBondContact O-CB 3.47Å; R1049-L1053 PolarHBondContact O-N 3.35Å; E1050-L1053 PolarHBondContact O-N 3.19Å; L1053-L1055 PolarHBondContact O-N 2.93Å; L1053-E1056 PolarHBondContact O-N 3.24Å; L1053-E1057 PolarHBondContact O-N 3.07Å
1054	R	75.6	Confident	72.3	Confident	107 Å²	107	84.9 Å²	84.9	40%	0.404	46%	0.461	S	S	.	.	H	α-helix	trans	-68.7	-17	176.7	-63.7	-177	-175	-154.7	3.6	114.1	E1050 K1052 W1069	E1050-R1054 WeakPolarHBondContact O-CG 3.32Å; E1050-R1054 PolarHBondContact O-N 3.47Å; E1050-R1054 IonicContact OE1-CZ 3.11Å; E1050-R1054 VanDerWaalsContact OE1-CZ 3.26Å; E1050-R1054 IonicContact OE1-NE 2.68Å; E1050-R1054 PolarHBondContact OE1-NE 3.4Å; E1050-R1054 IonicContact OE1-NH2 2.76Å; E1050-R1054 PolarHBondContact OE1-NH2 2.83Å; K1052-R1054 VanDerWaalsContact C-N 3.32Å; K1052-R1054 PolarHBondContact O-N 2.86Å; R1054-W1069 HydrophobicContact CB-CH2 3.67Å; R1054-W1069 HydrophobicContact CB-CZ2 3.99Å; R1054-W1069 WeakPolarHBondContact O-CZ2 3.5Å
1055	L	73.7	Confident	71.1	Confident	19 Å²	19	88 Å²	88	10%	0.099	48%	0.475	C	S	.	.	H	α-helix	trans	-96.1	-17	174.6	-76.8	170.3	0	0	0	113.6	L250 L253 T254 L1051 K1052 L1053 F1076 L1080	L250-L1055 HydrophobicContact CD2-CD1 3.78Å; L253-L1055 HydrophobicContact CD1-CB 4.48Å; T254-L1055 HydrophobicContact CG2-CD1 4.46Å; L1051-L1055 WeakPolarHBondContact O-CD1 3.35Å; L1051-L1055 WeakPolarHBondContact O-CG 3.41Å; L1051-L1055 PolarHBondContact O-N 2.89Å; K1052-L1055 CarbonylContact O-C 3.55Å; K1052-L1055 WeakPolarHBondContact O-CA 3.28Å; K1052-L1055 PolarHBondContact O-N 3.45Å; L1053-L1055 PolarHBondContact O-N 2.93Å; L1055-F1076 HydrophobicContact CD1-CZ 3.92Å; L1055-F1076 HydrophobicContact CD2-CZ 3.95Å; L1055-F1076 HydrophobicContact CG-CZ 3.83Å; L1055-L1080 HydrophobicContact CD1-CD2 4.31Å
1056	E	76.1	Confident	70	Confident	100 Å²	100	88.9 Å²	88.9	47%	0.467	48%	0.48	S	S	.	.	H	α-helix	trans	-96.9	-7.1	173.3	-68.6	-177.3	154	0	0	112.6	L253 K1052 L1053	L253-E1056 HydrophobicContact CD1-CG 3.9Å; L253-E1056 HydrophobicContact CD2-CG 4.44Å; K1052-E1056 WeakPolarHBondContact CE-OE1 3.5Å; K1052-E1056 WeakPolarHBondContact CE-OE2 3.28Å; K1052-E1056 HydrophobicContact CG-CG 4.34Å; K1052-E1056 IonicContact NZ-OE1 2.74Å; K1052-E1056 PolarHBondContact NZ-OE1 3.43Å; K1052-E1056 IonicContact NZ-OE2 3.24Å; K1052-E1056 PolarHBondContact O-N 2.84Å; L1053-E1056 PolarHBondContact O-N 3.24Å
1057	E	74.4	Confident	69	Low	140 Å²	140	86.5 Å²	86.5	65%	0.654	46%	0.463	S	S	*	.	S	Bend	trans	-62.4	122.7	172.7	-171.1	169.9	-152.3	0	0	110.6	L1053 Q1059	L1053-E1057 PolarHBondContact O-N 3.07Å; E1057-Q1059 PolarHBondContact O-N 3.47Å
1058	P	56.1	Low	67.9	Low	120 Å²	120	88.6 Å²	88.6	78%	0.779	48%	0.476	S	S	*	.			trans	-74.6	94.8	-165.2	28.3	-35.7	0	0	0	112.5	A1060	P1058-A1060 PolarHBondContact O-N 2.82Å
1059	Q	54.3	Low	67.2	Low	117 Å²	117	91.7 Å²	91.7	55%	0.547	49%	0.487	S	S	.	.			trans	-68.2	116.2	170.5	-173.2	155.1	70.4	0	0	109.9	E1057 S1061	E1057-Q1059 PolarHBondContact O-N 3.47Å; Q1059-S1061 PolarHBondContact O-N 3.17Å
1060	A	50.1	Low	66.1	Low	112 Å²	112	85.7 Å²	85.7	93%	0.926	46%	0.464	S	S	*	.	S	Bend	trans	-76.6	47.4	-172.1	0	0	0	0	0	114.2	P1058	P1058-A1060 PolarHBondContact O-N 2.82Å
1061	S	49.3	Very low	65	Low	86 Å²	86	85.1 Å²	85.1	60%	0.601	46%	0.463	S	S	*	.	S	Bend	trans	-152.1	124.3	179.2	-166.7	0	0	0	0	110.3	Q1059 A1063	Q1059-S1061 PolarHBondContact O-N 3.17Å; S1061-A1063 VanDerWaalsContact C-N 3.3Å; S1061-A1063 PolarHBondContact O-N 3.49Å
1062	D	52.6	Low	64.1	Low	181 Å²	181	94.5 Å²	94.5	97%	0.968	50%	0.498	S	S	*	.			trans	-71.5	77.7	-179.7	-65	-62.3	0	0	0	111.9
1063	A	49.5	Very low	63.6	Low	50 Å²	50	94.7 Å²	94.7	41%	0.413	50%	0.502	S	S	.	.			trans	-127.2	122.9	178.6	0	0	0	0	0	111.6	S1061 E1065	S1061-A1063 VanDerWaalsContact C-N 3.3Å; S1061-A1063 PolarHBondContact O-N 3.49Å; A1063-E1065 PolarHBondContact O-N 3.33Å
1064	N	56.9	Low	62.9	Low	139 Å²	139	95.7 Å²	95.7	74%	0.743	50%	0.503	S	S	*	.			trans	-77.1	35.4	172	-69.9	-28.3	0	0	0	112.3
1065	E	59.1	Low	62.5	Low	150 Å²	150	100.5 Å²	100.5	70%	0.701	52%	0.521	S	S	*	.	S	Bend	trans	-119.7	145	-179.5	-63.8	-166.5	169	0	0	111.8	F257 A1063	F257-E1065 WeakPolarHBondContact CD1-O 3.44Å; F257-E1065 WeakPolarHBondContact CE1-O 3.46Å; A1063-E1065 PolarHBondContact O-N 3.33Å
1066	L	64.6	Low	62.3	Low	28 Å²	28	99.9 Å²	99.9	15%	0.147	52%	0.518	C	S	.	.			trans	-66	133.1	-179.6	-153.5	80.2	0	0	0	110.1	T254 F257 A1070 L1071 L1080	T254-L1066 HydrophobicContact CG2-CD1 4.48Å; F257-L1066 HydrophobicContact CB-CB 4.5Å; F257-L1066 HydrophobicContact CB-CD1 3.97Å; F257-L1066 HydrophobicContact CD2-CD1 3.71Å; F257-L1066 HydrophobicContact CE2-CD1 4.41Å; F257-L1066 HydrophobicContact CG-CD1 3.96Å; L1066-A1070 HydrophobicContact CD2-CB 4.17Å; L1066-A1070 HydrophobicContact CG-CB 4.29Å; L1066-L1071 HydrophobicContact CB-CD2 4.3Å; L1066-L1071 HydrophobicContact CB-CG 4.44Å; L1066-L1071 HydrophobicContact CD2-CD2 4.07Å; L1066-L1080 HydrophobicContact CD2-CD1 4.15Å
1067	P	67.1	Low	61.9	Low	15 Å²	15	100.6 Å²	100.6	10%	0.097	52%	0.516	C	S	.	.			trans	-51.1	140.3	-174	-31.7	35.6	0	0	0	114.7	W1069 A1070 L1071	P1067-W1069 HydrophobicContact CB-CG 4.41Å; P1067-W1069 HydrophobicContact CB-CZ2 4.5Å; P1067-W1069 PolarHBondContact O-N 2.84Å; P1067-A1070 HydrophobicContact CB-CB 4.39Å; P1067-A1070 WeakPolarHBondContact O-CA 3.47Å; P1067-A1070 VanDerWaalsContact O-CB 3.32Å; P1067-A1070 WeakPolarHBondContact O-CB 3.45Å; P1067-A1070 PolarHBondContact O-N 3Å; P1067-L1071 PolarHBondContact O-N 3.2Å
1068	S	60.2	Low	61.8	Low	75 Å²	75	96.8 Å²	96.8	52%	0.524	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-9.3	-171.8	71.3	0	0	0	0	115.4	R1072	S1068-R1072 WeakPolarHBondContact O-CG 3.49Å; S1068-R1072 PolarHBondContact O-NE 2.93Å
1069	W	70.4	Confident	62.6	Low	82 Å²	82	95.1 Å²	95.1	31%	0.311	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-42.4	166.6	64.4	-100.4	0	0	0	111.4	R1054 P1067 L1071 R1072 D1073 F1076	R1054-W1069 HydrophobicContact CB-CH2 3.67Å; R1054-W1069 HydrophobicContact CB-CZ2 3.99Å; R1054-W1069 WeakPolarHBondContact O-CZ2 3.5Å; P1067-W1069 HydrophobicContact CB-CG 4.41Å; P1067-W1069 HydrophobicContact CB-CZ2 4.5Å; P1067-W1069 PolarHBondContact O-N 2.84Å; W1069-L1071 PolarHBondContact O-N 3.09Å; W1069-R1072 PolarHBondContact O-N 3.04Å; W1069-D1073 PolarHBondContact O-N 3.13Å; W1069-F1076 HydrophobicContact CH2-CD2 4.01Å; W1069-F1076 HydrophobicContact CH2-CE1 4.25Å; W1069-F1076 AromaticContact CH2-CE2 3.45Å; W1069-F1076 HydrophobicContact CH2-CE2 3.45Å; W1069-F1076 VanDerWaalsContact CH2-CE2 3.45Å; W1069-F1076 AromaticContact CH2-CZ 3.59Å; W1069-F1076 HydrophobicContact CH2-CZ 3.59Å; W1069-F1076 HydrophobicContact CZ3-CD1 4.29Å; W1069-F1076 AromaticContact CZ3-CD2 3.62Å; W1069-F1076 HydrophobicContact CZ3-CD2 3.62Å; W1069-F1076 HydrophobicContact CZ3-CE1 4.25Å; W1069-F1076 AromaticContact CZ3-CE2 3.57Å; W1069-F1076 HydrophobicContact CZ3-CE2 3.57Å; W1069-F1076 AromaticContact CZ3-CG 3.99Å; W1069-F1076 HydrophobicContact CZ3-CG 3.99Å; W1069-F1076 AromaticContact CZ3-CZ 3.9Å; W1069-F1076 HydrophobicContact CZ3-CZ 3.9Å
1070	A	64.8	Low	63.4	Low	0 Å²	0	90.2 Å²	90.2	0%	0	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-23.7	176.7	0	0	0	0	0	112.8	L1066 P1067 F1076 R1077	L1066-A1070 HydrophobicContact CD2-CB 4.17Å; L1066-A1070 HydrophobicContact CG-CB 4.29Å; P1067-A1070 HydrophobicContact CB-CB 4.39Å; P1067-A1070 WeakPolarHBondContact O-CA 3.47Å; P1067-A1070 VanDerWaalsContact O-CB 3.32Å; P1067-A1070 WeakPolarHBondContact O-CB 3.45Å; P1067-A1070 PolarHBondContact O-N 3Å; A1070-F1076 HydrophobicContact CB-CD1 3.58Å; A1070-F1076 HydrophobicContact CB-CE1 3.31Å; A1070-F1076 HydrophobicContact CB-CZ 4.09Å; A1070-R1077 VanDerWaalsContact O-CG 3.3Å; A1070-R1077 WeakPolarHBondContact O-CG 3.32Å
1071	L	63.2	Low	64.4	Low	84 Å²	84	92.1 Å²	92.1	44%	0.44	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-15.1	171.6	-67.6	175.6	0	0	0	114	L1066 P1067 W1069 R1077	L1066-L1071 HydrophobicContact CB-CD2 4.3Å; L1066-L1071 HydrophobicContact CB-CG 4.44Å; L1066-L1071 HydrophobicContact CD2-CD2 4.07Å; P1067-L1071 PolarHBondContact O-N 3.2Å; W1069-L1071 PolarHBondContact O-N 3.09Å; L1071-R1077 WeakPolarHBondContact O-CD 3.4Å; L1071-R1077 PolarHBondContact O-NH1 3.24Å
1072	R	60	Low	65.4	Low	204 Å²	204	91.3 Å²	91.3	77%	0.77	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-35.6	178.2	-63.4	-177.3	-142.8	-160.7	4.8	113.6	S1068 W1069 E1074	S1068-R1072 WeakPolarHBondContact O-CG 3.49Å; S1068-R1072 PolarHBondContact O-NE 2.93Å; W1069-R1072 PolarHBondContact O-N 3.04Å; R1072-E1074 PolarHBondContact O-N 3.04Å; R1072-E1074 VanDerWaalsContact O-N 3.15Å
1073	D	73.1	Confident	66.2	Low	55 Å²	55	83 Å²	83	29%	0.294	39%	0.392	S	S	.	.			trans	-70.2	108	179.1	-177.4	-21.8	0	0	0	110.5	W1069 R1075 F1076 R1077	W1069-D1073 PolarHBondContact O-N 3.13Å; D1073-R1075 VanDerWaalsContact C-N 3.34Å; D1073-R1075 PolarHBondContact O-N 3.14Å; D1073-R1075 WeakPolarHBondContact OD1-CA 3.35Å; D1073-R1075 VanDerWaalsContact OD1-CB 3.31Å; D1073-R1075 WeakPolarHBondContact OD1-CB 3.26Å; D1073-R1075 PolarHBondContact OD1-N 3.41Å; D1073-F1076 HydrophobicContact CB-CB 3.69Å; D1073-F1076 VanDerWaalsContact CG-CB 3.49Å; D1073-F1076 PolarHBondContact O-N 2.99Å; D1073-F1076 PolarHBondContact OD1-N 3.22Å; D1073-R1077 VanDerWaalsContact O-CG 3.27Å; D1073-R1077 WeakPolarHBondContact O-CG 3.31Å; D1073-R1077 PolarHBondContact O-N 2.85Å
1074	E	70.1	Confident	67.2	Low	146 Å²	146	83.8 Å²	83.8	68%	0.682	39%	0.387	S	S	*	.	H	α-helix	trans	-67.8	-32.1	-179.5	-173.9	161.4	-135.4	0	0	112.8	R1072 R1077 C1078	R1072-E1074 PolarHBondContact O-N 3.04Å; R1072-E1074 VanDerWaalsContact O-N 3.15Å; E1074-R1077 PolarHBondContact O-N 2.87Å; E1074-C1078 WeakPolarHBondContact O-CB 3.29Å; E1074-C1078 PolarHBondContact O-N 2.9Å; E1074-C1078 PolarHBondContact O-SG 2.66Å
1075	R	66.9	Low	67.9	Low	207 Å²	207	82.4 Å²	82.4	78%	0.781	37%	0.372	S	S	*	.	H	α-helix	trans	-66.6	-46.1	176	-56.3	179.7	-178.9	-179.7	1.5	109.6	D1073 R1077 C1078 L1079	D1073-R1075 VanDerWaalsContact C-N 3.34Å; D1073-R1075 PolarHBondContact O-N 3.14Å; D1073-R1075 WeakPolarHBondContact OD1-CA 3.35Å; D1073-R1075 VanDerWaalsContact OD1-CB 3.31Å; D1073-R1075 WeakPolarHBondContact OD1-CB 3.26Å; D1073-R1075 PolarHBondContact OD1-N 3.41Å; R1075-R1077 PolarHBondContact O-N 2.91Å; R1075-C1078 PolarHBondContact O-N 2.97Å; R1075-C1078 VanDerWaalsContact O-N 3.17Å; R1075-L1079 WeakPolarHBondContact O-CG 3.41Å; R1075-L1079 PolarHBondContact O-N 3.49Å
1076	F	68.9	Low	68.4	Low	6 Å²	6	77.1 Å²	77.1	3%	0.026	35%	0.347	C	S	.	.	H	α-helix	trans	-58.8	-44.8	174.2	-168.4	-91.2	0	0	0	111.9	L1051 L1055 W1069 A1070 D1073 C1078 L1079 L1080	L1051-F1076 HydrophobicContact CD1-CD2 3.33Å; L1051-F1076 HydrophobicContact CD1-CE2 3.35Å; L1051-F1076 HydrophobicContact CD1-CG 4.06Å; L1051-F1076 HydrophobicContact CD1-CZ 4.1Å; L1051-F1076 HydrophobicContact CG-CD2 4.09Å; L1051-F1076 HydrophobicContact CG-CE2 3.55Å; L1051-F1076 HydrophobicContact CG-CZ 4.08Å; L1055-F1076 HydrophobicContact CD1-CZ 3.92Å; L1055-F1076 HydrophobicContact CD2-CZ 3.95Å; L1055-F1076 HydrophobicContact CG-CZ 3.83Å; W1069-F1076 HydrophobicContact CH2-CD2 4.01Å; W1069-F1076 HydrophobicContact CH2-CE1 4.25Å; W1069-F1076 AromaticContact CH2-CE2 3.45Å; W1069-F1076 HydrophobicContact CH2-CE2 3.45Å; W1069-F1076 VanDerWaalsContact CH2-CE2 3.45Å; W1069-F1076 AromaticContact CH2-CZ 3.59Å; W1069-F1076 HydrophobicContact CH2-CZ 3.59Å; W1069-F1076 HydrophobicContact CZ3-CD1 4.29Å; W1069-F1076 AromaticContact CZ3-CD2 3.62Å; W1069-F1076 HydrophobicContact CZ3-CD2 3.62Å; W1069-F1076 HydrophobicContact CZ3-CE1 4.25Å; W1069-F1076 AromaticContact CZ3-CE2 3.57Å; W1069-F1076 HydrophobicContact CZ3-CE2 3.57Å; W1069-F1076 AromaticContact CZ3-CG 3.99Å; W1069-F1076 HydrophobicContact CZ3-CG 3.99Å; W1069-F1076 AromaticContact CZ3-CZ 3.9Å; W1069-F1076 HydrophobicContact CZ3-CZ 3.9Å; A1070-F1076 HydrophobicContact CB-CD1 3.58Å; A1070-F1076 HydrophobicContact CB-CE1 3.31Å; A1070-F1076 HydrophobicContact CB-CZ 4.09Å; D1073-F1076 HydrophobicContact CB-CB 3.69Å; D1073-F1076 VanDerWaalsContact CG-CB 3.49Å; D1073-F1076 PolarHBondContact O-N 2.99Å; D1073-F1076 PolarHBondContact OD1-N 3.22Å; F1076-C1078 VanDerWaalsContact C-N 3.32Å; F1076-C1078 PolarHBondContact O-N 3.48Å; F1076-L1079 PolarHBondContact O-N 3.46Å; F1076-L1080 HydrophobicContact CD1-CD1 3.9Å; F1076-L1080 HydrophobicContact CD1-CG 4.3Å; F1076-L1080 HydrophobicContact CE1-CD1 3.34Å; F1076-L1080 HydrophobicContact CE1-CG 3.93Å; F1076-L1080 HydrophobicContact CZ-CD1 4.12Å; F1076-L1080 HydrophobicContact CZ-CG 4.42Å; F1076-L1080 WeakPolarHBondContact O-CB 3.35Å; F1076-L1080 PolarHBondContact O-N 3.34Å
1077	R	69.1	Low	68.6	Low	115 Å²	115	75.9 Å²	75.9	43%	0.434	34%	0.34	S	S	.	.	H	α-helix	trans	-65.4	-30.6	175.6	-69.6	173.3	69.7	117.3	10.2	113.3	A1070 L1071 D1073 E1074 R1075 R1081	A1070-R1077 VanDerWaalsContact O-CG 3.3Å; A1070-R1077 WeakPolarHBondContact O-CG 3.32Å; L1071-R1077 WeakPolarHBondContact O-CD 3.4Å; L1071-R1077 PolarHBondContact O-NH1 3.24Å; D1073-R1077 VanDerWaalsContact O-CG 3.27Å; D1073-R1077 WeakPolarHBondContact O-CG 3.31Å; D1073-R1077 PolarHBondContact O-N 2.85Å; E1074-R1077 PolarHBondContact O-N 2.87Å; R1075-R1077 PolarHBondContact O-N 2.91Å; R1077-R1081 WeakPolarHBondContact O-CB 3.42Å; R1077-R1081 VanDerWaalsContact O-CG 3.32Å; R1077-R1081 WeakPolarHBondContact O-CG 3.46Å; R1077-R1081 PolarHBondContact O-N 2.93Å; R1077-R1081 PolarHBondContact O-NE 2.87Å
1078	C	71.9	Confident	68.5	Low	60 Å²	60	79.1 Å²	79.1	41%	0.405	36%	0.357	S	S	.	.	H	α-helix	trans	-72.1	-50.8	172.3	-74.6	0	0	0	0	111.1	E1074 R1075 F1076 L1080 R1081 E1082	E1074-C1078 WeakPolarHBondContact O-CB 3.29Å; E1074-C1078 PolarHBondContact O-N 2.9Å; E1074-C1078 PolarHBondContact O-SG 2.66Å; R1075-C1078 PolarHBondContact O-N 2.97Å; R1075-C1078 VanDerWaalsContact O-N 3.17Å; F1076-C1078 VanDerWaalsContact C-N 3.32Å; F1076-C1078 PolarHBondContact O-N 3.48Å; C1078-L1080 VanDerWaalsContact C-N 3.31Å; C1078-L1080 PolarHBondContact O-N 3.38Å; C1078-R1081 PolarHBondContact O-N 2.73Å; C1078-R1081 PolarHBondContact SG-NH2 3.42Å; C1078-E1082 VanDerWaalsContact O-CB 3.29Å; C1078-E1082 WeakPolarHBondContact O-CB 3.27Å; C1078-E1082 PolarHBondContact O-N 3.41Å
1079	L	71.8	Confident	68.7	Low	85 Å²	85	79.7 Å²	79.7	45%	0.445	35%	0.351	S	S	.	.	H	α-helix	trans	-57.9	-40.3	177.2	-71	169.7	0	0	0	112.4	L1051 R1075 F1076 E1082 A1083	L1051-L1079 HydrophobicContact CD1-CB 3.82Å; L1051-L1079 HydrophobicContact CD1-CD1 4.08Å; R1075-L1079 WeakPolarHBondContact O-CG 3.41Å; R1075-L1079 PolarHBondContact O-N 3.49Å; F1076-L1079 PolarHBondContact O-N 3.46Å; L1079-E1082 PolarHBondContact O-N 2.83Å; L1079-A1083 VanDerWaalsContact O-CB 3.28Å; L1079-A1083 WeakPolarHBondContact O-CB 3.28Å; L1079-A1083 PolarHBondContact O-N 2.88Å
1080	L	71.1	Confident	68.2	Low	15 Å²	15	77.2 Å²	77.2	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-67	-44.8	175.4	-90.7	-173.5	0	0	0	113.6	T254 L1051 L1055 L1066 F1076 C1078 E1082 H1084	T254-L1080 HydrophobicContact CG2-CD1 4.07Å; T254-L1080 HydrophobicContact CG2-CD2 3.5Å; T254-L1080 VanDerWaalsContact CG2-CD2 3.5Å; T254-L1080 HydrophobicContact CG2-CG 4.46Å; L1051-L1080 HydrophobicContact CD2-CD2 3.75Å; L1051-L1080 HydrophobicContact CD2-CG 4.15Å; L1055-L1080 HydrophobicContact CD1-CD2 4.31Å; L1066-L1080 HydrophobicContact CD2-CD1 4.15Å; F1076-L1080 HydrophobicContact CD1-CD1 3.9Å; F1076-L1080 HydrophobicContact CD1-CG 4.3Å; F1076-L1080 HydrophobicContact CE1-CD1 3.34Å; F1076-L1080 HydrophobicContact CE1-CG 3.93Å; F1076-L1080 HydrophobicContact CZ-CD1 4.12Å; F1076-L1080 HydrophobicContact CZ-CG 4.42Å; F1076-L1080 WeakPolarHBondContact O-CB 3.35Å; F1076-L1080 PolarHBondContact O-N 3.34Å; C1078-L1080 VanDerWaalsContact C-N 3.31Å; C1078-L1080 PolarHBondContact O-N 3.38Å; L1080-E1082 VanDerWaalsContact C-N 3.26Å; L1080-E1082 PolarHBondContact O-N 3.17Å; L1080-H1084 WeakPolarHBondContact O-CB 3.38Å; L1080-H1084 PolarHBondContact O-N 3.42Å
1081	R	71.4	Confident	68	Low	152 Å²	152	82.3 Å²	82.3	57%	0.574	37%	0.369	S	S	*	.	H	α-helix	trans	-61.5	-40.2	175.5	-79.3	178.1	-71.1	172.9	-2.3	110.8	R1077 C1078 H1084 R1085	R1077-R1081 WeakPolarHBondContact O-CB 3.42Å; R1077-R1081 VanDerWaalsContact O-CG 3.32Å; R1077-R1081 WeakPolarHBondContact O-CG 3.46Å; R1077-R1081 PolarHBondContact O-N 2.93Å; R1077-R1081 PolarHBondContact O-NE 2.87Å; C1078-R1081 PolarHBondContact O-N 2.73Å; C1078-R1081 PolarHBondContact SG-NH2 3.42Å; R1081-H1084 PolarHBondContact O-N 3.43Å; R1081-R1085 VanDerWaalsContact O-CB 3.26Å; R1081-R1085 WeakPolarHBondContact O-CB 3.32Å; R1081-R1085 PolarHBondContact O-N 2.83Å
1082	E	70.1	Confident	67.9	Low	68 Å²	68	83.2 Å²	83.2	32%	0.318	37%	0.371	S	S	.	.	H	α-helix	trans	-69.7	-45.5	179.7	-174.5	57.5	-162.9	0	0	112	C1078 L1079 L1080 H1084 R1085 Q1086	C1078-E1082 VanDerWaalsContact O-CB 3.29Å; C1078-E1082 WeakPolarHBondContact O-CB 3.27Å; C1078-E1082 PolarHBondContact O-N 3.41Å; L1079-E1082 PolarHBondContact O-N 2.83Å; L1080-E1082 VanDerWaalsContact C-N 3.26Å; L1080-E1082 PolarHBondContact O-N 3.17Å; E1082-H1084 VanDerWaalsContact C-N 3.34Å; E1082-H1084 PolarHBondContact O-N 3.47Å; E1082-R1085 WeakPolarHBondContact O-CB 3.41Å; E1082-R1085 PolarHBondContact O-N 2.9Å; E1082-R1085 IonicContact OE1-CZ 3.38Å; E1082-R1085 IonicContact OE1-NE 3.5Å; E1082-R1085 PolarHBondContact OE1-NE 3.24Å; E1082-R1085 IonicContact OE1-NH2 3.92Å; E1082-R1085 PolarHBondContact OE1-NH2 3.02Å; E1082-R1085 IonicContact OE2-CZ 3.51Å; E1082-R1085 IonicContact OE2-NE 2.7Å; E1082-R1085 PolarHBondContact OE2-NE 3.21Å; E1082-R1085 IonicContact OE2-NH2 3.47Å; E1082-R1085 PolarHBondContact OE2-NH2 2.92Å; E1082-Q1086 WeakPolarHBondContact O-CB 3.45Å; E1082-Q1086 VanDerWaalsContact O-CG 3.27Å; E1082-Q1086 WeakPolarHBondContact O-CG 3.44Å; E1082-Q1086 PolarHBondContact O-N 2.92Å; E1082-Q1086 PolarHBondContact OE1-NE2 3.26Å
1083	A	70.3	Confident	67.8	Low	6 Å²	6	79.3 Å²	79.3	5%	0.05	36%	0.361	C	S	.	.	H	α-helix	trans	-58.8	-43.6	172.5	0	0	0	0	0	111.7	I247 L1048 L1079 Q1086 A1087	I247-A1083 HydrophobicContact CG1-CB 4.37Å; I247-A1083 WeakPolarHBondContact CG2-O 3.46Å; L1048-A1083 HydrophobicContact CD2-CB 4.46Å; L1079-A1083 VanDerWaalsContact O-CB 3.28Å; L1079-A1083 WeakPolarHBondContact O-CB 3.28Å; L1079-A1083 PolarHBondContact O-N 2.88Å; A1083-Q1086 PolarHBondContact O-N 2.87Å; A1083-A1087 VanDerWaalsContact O-CB 3.26Å; A1083-A1087 WeakPolarHBondContact O-CB 3.26Å; A1083-A1087 PolarHBondContact O-N 3.25Å
1084	H	69.9	Low	67.2	Low	67 Å²	67	81.5 Å²	81.5	31%	0.31	37%	0.37	S	S	.	.	H	α-helix	trans	-66.5	-40.2	176.7	-168.3	102.9	0	0	0	112.3	L1080 R1081 E1082 A1087 N1088	L1080-H1084 WeakPolarHBondContact O-CB 3.38Å; L1080-H1084 PolarHBondContact O-N 3.42Å; R1081-H1084 PolarHBondContact O-N 3.43Å; E1082-H1084 VanDerWaalsContact C-N 3.34Å; E1082-H1084 PolarHBondContact O-N 3.47Å; H1084-A1087 PolarHBondContact O-N 3.25Å; H1084-N1088 PolarHBondContact CD2-ND2 3.41Å; H1084-N1088 PolarHBondContact NE2-ND2 3.33Å; H1084-N1088 PolarHBondContact O-N 3.44Å; H1084-N1088 PolarHBondContact O-ND2 2.89Å
1085	R	72.7	Confident	67.1	Low	111 Å²	111	82.5 Å²	82.5	42%	0.419	37%	0.367	S	S	.	.	H	α-helix	trans	-58.7	-49.2	173.9	-170.8	-175.3	76.3	74.1	0.2	110.9	R1081 E1082 N1088 Q1089	R1081-R1085 VanDerWaalsContact O-CB 3.26Å; R1081-R1085 WeakPolarHBondContact O-CB 3.32Å; R1081-R1085 PolarHBondContact O-N 2.83Å; E1082-R1085 WeakPolarHBondContact O-CB 3.41Å; E1082-R1085 PolarHBondContact O-N 2.9Å; E1082-R1085 IonicContact OE1-CZ 3.38Å; E1082-R1085 IonicContact OE1-NE 3.5Å; E1082-R1085 PolarHBondContact OE1-NE 3.24Å; E1082-R1085 IonicContact OE1-NH2 3.92Å; E1082-R1085 PolarHBondContact OE1-NH2 3.02Å; E1082-R1085 IonicContact OE2-CZ 3.51Å; E1082-R1085 IonicContact OE2-NE 2.7Å; E1082-R1085 PolarHBondContact OE2-NE 3.21Å; E1082-R1085 IonicContact OE2-NH2 3.47Å; E1082-R1085 PolarHBondContact OE2-NH2 2.92Å; R1085-N1088 PolarHBondContact O-N 2.76Å; R1085-Q1089 VanDerWaalsContact NH1-CD 3.25Å; R1085-Q1089 VanDerWaalsContact NH1-NE2 3.15Å; R1085-Q1089 WeakPolarHBondContact O-CG 3.49Å; R1085-Q1089 PolarHBondContact O-N 2.83Å
1086	Q	69.2	Low	66.7	Low	39 Å²	39	78.4 Å²	78.4	18%	0.182	36%	0.357	C	S	.	.	H	α-helix	trans	-68.7	-35.7	179.1	-66.9	-179	13	0	0	112.6	R243 I247 E1082 A1083 N1088 Q1089 S1090	R243-Q1086 VanDerWaalsContact CZ-OE1 3.22Å; I247-Q1086 HydrophobicContact CD1-CB 4.45Å; E1082-Q1086 WeakPolarHBondContact O-CB 3.45Å; E1082-Q1086 VanDerWaalsContact O-CG 3.27Å; E1082-Q1086 WeakPolarHBondContact O-CG 3.44Å; E1082-Q1086 PolarHBondContact O-N 2.92Å; E1082-Q1086 PolarHBondContact OE1-NE2 3.26Å; A1083-Q1086 PolarHBondContact O-N 2.87Å; Q1086-N1088 PolarHBondContact O-N 3.22Å; Q1086-Q1089 PolarHBondContact O-N 3.39Å; Q1086-S1090 WeakPolarHBondContact O-CB 3.47Å; Q1086-S1090 PolarHBondContact O-N 3.31Å; Q1086-S1090 PolarHBondContact O-OG 3.33Å
1087	A	69.5	Low	66.4	Low	1 Å²	1	84.9 Å²	84.9	1%	0.008	39%	0.387	C	S	.	.	H	α-helix	trans	-62.3	-30.1	174.8	0	0	0	0	0	113.5	I247 A251 A1083 H1084 S1090	I247-A1087 HydrophobicContact CG2-CB 3.58Å; A251-A1087 HydrophobicContact CB-CB 3.97Å; A1083-A1087 VanDerWaalsContact O-CB 3.26Å; A1083-A1087 WeakPolarHBondContact O-CB 3.26Å; A1083-A1087 PolarHBondContact O-N 3.25Å; H1084-A1087 PolarHBondContact O-N 3.25Å; A1087-S1090 PolarHBondContact O-OG 2.7Å
1088	N	65	Low	66.3	Low	83 Å²	83	83.7 Å²	83.7	44%	0.444	39%	0.387	S	S	.	.	H	α-helix	trans	-87.6	-32.6	177.2	-69.4	-26.8	0	0	0	112.1	H1084 R1085 Q1086	H1084-N1088 PolarHBondContact CD2-ND2 3.41Å; H1084-N1088 PolarHBondContact NE2-ND2 3.33Å; H1084-N1088 PolarHBondContact O-N 3.44Å; H1084-N1088 PolarHBondContact O-ND2 2.89Å; R1085-N1088 PolarHBondContact O-N 2.76Å; Q1086-N1088 PolarHBondContact O-N 3.22Å
1089	Q	62.5	Low	66.3	Low	87 Å²	87	82 Å²	82	41%	0.407	38%	0.377	S	S	.	.	H	α-helix	trans	-70	-44.4	174	-74.7	-176.2	-26.6	0	0	112.7	R1085 Q1086 K1091 Q1092 E1093	R1085-Q1089 VanDerWaalsContact NH1-CD 3.25Å; R1085-Q1089 VanDerWaalsContact NH1-NE2 3.15Å; R1085-Q1089 WeakPolarHBondContact O-CG 3.49Å; R1085-Q1089 PolarHBondContact O-N 2.83Å; Q1086-Q1089 PolarHBondContact O-N 3.39Å; Q1089-K1091 VanDerWaalsContact C-N 3.28Å; Q1089-K1091 PolarHBondContact O-N 3.37Å; Q1089-Q1092 WeakPolarHBondContact O-CA 3.08Å; Q1089-Q1092 WeakPolarHBondContact O-CB 3.43Å; Q1089-Q1092 PolarHBondContact O-N 3.4Å; Q1089-E1093 PolarHBondContact O-N 2.83Å
1090	S	60.9	Low	65.9	Low	30 Å²	30	80.2 Å²	80.2	21%	0.21	38%	0.375	C	S	.	.	H	α-helix	trans	-58.1	-38.2	-178.1	64.6	0	0	0	0	112.8	Q1086 A1087 Q1092 E1093 Q1094	Q1086-S1090 WeakPolarHBondContact O-CB 3.47Å; Q1086-S1090 PolarHBondContact O-N 3.31Å; Q1086-S1090 PolarHBondContact O-OG 3.33Å; A1087-S1090 PolarHBondContact O-OG 2.7Å; S1090-Q1092 PolarHBondContact O-N 2.87Å; S1090-E1093 PolarHBondContact O-N 2.86Å; S1090-Q1094 WeakPolarHBondContact O-CB 3.42Å; S1090-Q1094 PolarHBondContact O-N 3.48Å
1091	K	60.5	Low	66	Low	108 Å²	108	83.6 Å²	83.6	47%	0.47	39%	0.39	S	S	.	.	H	α-helix	trans	-62.7	-24.6	174.5	-68	171.8	-172.5	163.7	0	113.9	Q1089 R1095	Q1089-K1091 VanDerWaalsContact C-N 3.28Å; Q1089-K1091 PolarHBondContact O-N 3.37Å; K1091-R1095 WeakPolarHBondContact O-CD 3.4Å; K1091-R1095 VanDerWaalsContact O-CG 3.26Å; K1091-R1095 WeakPolarHBondContact O-CG 3.46Å
1092	Q	60.8	Low	66.4	Low	102 Å²	102	83.2 Å²	83.2	48%	0.477	39%	0.389	S	S	.	.	H	α-helix	trans	-93	-41.8	178	-178.6	66.3	-6.8	0	0	111.2	Q1089 S1090 R1095 Q1096	Q1089-Q1092 WeakPolarHBondContact O-CA 3.08Å; Q1089-Q1092 WeakPolarHBondContact O-CB 3.43Å; Q1089-Q1092 PolarHBondContact O-N 3.4Å; S1090-Q1092 PolarHBondContact O-N 2.87Å; Q1092-R1095 PolarHBondContact O-N 2.81Å; Q1092-Q1096 WeakPolarHBondContact O-CG 3.36Å; Q1092-Q1096 PolarHBondContact O-N 3.26Å; Q1092-Q1096 VanDerWaalsContact O-N 3.13Å
1093	E	58.1	Low	66.5	Low	122 Å²	122	88 Å²	88	57%	0.57	40%	0.403	S	S	*	.	H	α-helix	trans	-64.3	-45.9	174.8	-71.3	179.7	120.5	0	0	111.5	Q1089 S1090 R1095 Q1096 E1097	Q1089-E1093 PolarHBondContact O-N 2.83Å; S1090-E1093 PolarHBondContact O-N 2.86Å; E1093-R1095 PolarHBondContact O-N 3.13Å; E1093-Q1096 CarbonylContact O-C 3.51Å; E1093-Q1096 WeakPolarHBondContact O-CA 3.26Å; E1093-Q1096 WeakPolarHBondContact O-CB 3.46Å; E1093-Q1096 PolarHBondContact O-N 3.11Å; E1093-E1097 WeakPolarHBondContact O-CB 3.44Å; E1093-E1097 PolarHBondContact O-N 2.86Å
1094	Q	60.2	Low	66.4	Low	102 Å²	102	94 Å²	94	48%	0.477	43%	0.434	S	S	.	.	H	α-helix	trans	-56.4	-37.3	175.8	-174.1	177	27.7	0	0	112.1	S1090 E1098	S1090-Q1094 WeakPolarHBondContact O-CB 3.42Å; S1090-Q1094 PolarHBondContact O-N 3.48Å; Q1094-E1098 WeakPolarHBondContact O-CB 3.42Å; Q1094-E1098 WeakPolarHBondContact O-CG 3.36Å; Q1094-E1098 PolarHBondContact O-N 2.75Å
1095	R	67.6	Low	66.7	Low	167 Å²	167	98 Å²	98	63%	0.63	45%	0.447	S	S	*	.	H	α-helix	trans	-69.3	-34.3	174.2	-72.8	172.5	176.7	174.4	-3.3	112.8	K1091 Q1092 E1093 A1099	K1091-R1095 WeakPolarHBondContact O-CD 3.4Å; K1091-R1095 VanDerWaalsContact O-CG 3.26Å; K1091-R1095 WeakPolarHBondContact O-CG 3.46Å; Q1092-R1095 PolarHBondContact O-N 2.81Å; E1093-R1095 PolarHBondContact O-N 3.13Å; R1095-A1099 VanDerWaalsContact O-CB 3.26Å; R1095-A1099 WeakPolarHBondContact O-CB 3.19Å; R1095-A1099 PolarHBondContact O-N 2.79Å
1096	Q	59.4	Low	67.3	Low	121 Å²	121	98.7 Å²	98.7	57%	0.565	45%	0.453	S	S	*	.	H	α-helix	trans	-74.5	-39.6	175.3	-69.3	-176.8	13.4	0	0	111.6	Q1092 E1093 A1099 A1100	Q1092-Q1096 WeakPolarHBondContact O-CG 3.36Å; Q1092-Q1096 PolarHBondContact O-N 3.26Å; Q1092-Q1096 VanDerWaalsContact O-N 3.13Å; E1093-Q1096 CarbonylContact O-C 3.51Å; E1093-Q1096 WeakPolarHBondContact O-CA 3.26Å; E1093-Q1096 WeakPolarHBondContact O-CB 3.46Å; E1093-Q1096 PolarHBondContact O-N 3.11Å; Q1096-A1099 CarbonylContact O-C 3.55Å; Q1096-A1099 PolarHBondContact O-N 3.05Å; Q1096-A1100 WeakPolarHBondContact O-CB 3.43Å; Q1096-A1100 PolarHBondContact O-N 3.19Å
1097	E	61.5	Low	67.3	Low	142 Å²	142	99.1 Å²	99.1	66%	0.664	46%	0.463	S	S	*	.	H	α-helix	trans	-67	-47.7	176.3	-172.9	174.1	-156	0	0	111.2	E1093 A1099 A1100 E1101	E1093-E1097 WeakPolarHBondContact O-CB 3.44Å; E1093-E1097 PolarHBondContact O-N 2.86Å; E1097-A1099 PolarHBondContact O-N 3.25Å; E1097-A1100 CarbonylContact O-C 3.54Å; E1097-A1100 WeakPolarHBondContact O-CA 3.36Å; E1097-A1100 WeakPolarHBondContact O-CB 3.24Å; E1097-A1100 PolarHBondContact O-N 3.12Å; E1097-E1101 PolarHBondContact O-N 2.87Å
1098	E	67.9	Low	67.3	Low	90 Å²	90	102.3 Å²	102.3	42%	0.421	49%	0.485	S	S	.	.	H	α-helix	trans	-57.4	-36.9	170.9	-79.7	-174.2	-164.4	0	0	112.1	Q1094 R1102	Q1094-E1098 WeakPolarHBondContact O-CB 3.42Å; Q1094-E1098 WeakPolarHBondContact O-CG 3.36Å; Q1094-E1098 PolarHBondContact O-N 2.75Å; E1098-R1102 WeakPolarHBondContact O-CB 3.49Å; E1098-R1102 WeakPolarHBondContact O-CG 3.26Å; E1098-R1102 PolarHBondContact O-N 2.86Å; E1098-R1102 PolarHBondContact O-NE 3.04Å; E1098-R1102 VanDerWaalsContact O-NE 3.12Å; E1098-R1102 IonicContact OE2-CZ 3.79Å; E1098-R1102 IonicContact OE2-NH2 2.61Å; E1098-R1102 PolarHBondContact OE2-NH2 3.44Å
1099	A	71.1	Confident	67.8	Low	24 Å²	24	105.9 Å²	105.9	20%	0.198	50%	0.497	C	S	.	.	H	α-helix	trans	-72.6	-32.4	176.8	0	0	0	0	0	111.9	R1095 Q1096 E1097 R1103	R1095-A1099 VanDerWaalsContact O-CB 3.26Å; R1095-A1099 WeakPolarHBondContact O-CB 3.19Å; R1095-A1099 PolarHBondContact O-N 2.79Å; Q1096-A1099 CarbonylContact O-C 3.55Å; Q1096-A1099 PolarHBondContact O-N 3.05Å; E1097-A1099 PolarHBondContact O-N 3.25Å; A1099-R1103 VanDerWaalsContact O-CG 3.26Å; A1099-R1103 WeakPolarHBondContact O-CG 3.21Å; A1099-R1103 PolarHBondContact O-N 3.23Å; A1099-R1103 VanDerWaalsContact O-N 3.11Å; A1099-R1103 PolarHBondContact O-NH1 3.26Å
1100	A	65.1	Low	68	Low	48 Å²	48	106 Å²	106	40%	0.397	50%	0.497	S	S	.	.	H	α-helix	trans	-69	-46	171.7	0	0	0	0	0	110.7	Q1096 E1097 R1102 R1103 L1104	Q1096-A1100 WeakPolarHBondContact O-CB 3.43Å; Q1096-A1100 PolarHBondContact O-N 3.19Å; E1097-A1100 CarbonylContact O-C 3.54Å; E1097-A1100 WeakPolarHBondContact O-CA 3.36Å; E1097-A1100 WeakPolarHBondContact O-CB 3.24Å; E1097-A1100 PolarHBondContact O-N 3.12Å; A1100-R1102 PolarHBondContact O-N 2.69Å; A1100-R1103 CarbonylContact O-C 3.55Å; A1100-R1103 WeakPolarHBondContact O-CB 3.25Å; A1100-R1103 PolarHBondContact O-N 2.77Å; A1100-R1103 VanDerWaalsContact O-N 3.13Å; A1100-L1104 PolarHBondContact O-N 3.49Å
1101	E	72.1	Confident	68.2	Low	86 Å²	86	109.2 Å²	109.2	40%	0.402	52%	0.516	S	S	.	.	H	α-helix	trans	-64.8	-40.2	177.2	-153.7	-148.1	-179	0	0	111.5	E1097 R1103 L1104 R1105	E1097-E1101 PolarHBondContact O-N 2.87Å; E1101-R1103 VanDerWaalsContact C-N 3.32Å; E1101-R1103 PolarHBondContact O-N 3.06Å; E1101-L1104 PolarHBondContact O-N 2.94Å; E1101-R1105 VanDerWaalsContact CD-CZ 3.5Å; E1101-R1105 VanDerWaalsContact CD-NH2 3.26Å; E1101-R1105 HydrophobicContact CG-CG 4.43Å; E1101-R1105 WeakPolarHBondContact O-CB 3.48Å; E1101-R1105 VanDerWaalsContact O-CG 3.32Å; E1101-R1105 WeakPolarHBondContact O-CG 2.76Å; E1101-R1105 PolarHBondContact O-N 3.38Å; E1101-R1105 IonicContact OE1-CZ 3.49Å; E1101-R1105 IonicContact OE1-NE 2.66Å; E1101-R1105 PolarHBondContact OE1-NE 3.33Å; E1101-R1105 IonicContact OE1-NH2 3.51Å; E1101-R1105 PolarHBondContact OE1-NH2 3.33Å; E1101-R1105 IonicContact OE2-CZ 2.69Å; E1101-R1105 VanDerWaalsContact OE2-CZ 3.26Å; E1101-R1105 IonicContact OE2-NE 3.7Å; E1101-R1105 PolarHBondContact OE2-NE 3.47Å; E1101-R1105 IonicContact OE2-NH2 2.73Å; E1101-R1105 PolarHBondContact OE2-NH2 3.29Å; E1101-R1105 VanDerWaalsContact OE2-NH2 3.07Å
1102	R	81.1	Confident	68.1	Low	144 Å²	144	109.2 Å²	109.2	54%	0.543	52%	0.52	S	S	.	.	H	α-helix	trans	-61	-38.4	171.9	-79.3	178.2	-94.4	157	-14.4	112.1	E1098 A1100 K1106	E1098-R1102 WeakPolarHBondContact O-CB 3.49Å; E1098-R1102 WeakPolarHBondContact O-CG 3.26Å; E1098-R1102 PolarHBondContact O-N 2.86Å; E1098-R1102 PolarHBondContact O-NE 3.04Å; E1098-R1102 VanDerWaalsContact O-NE 3.12Å; E1098-R1102 IonicContact OE2-CZ 3.79Å; E1098-R1102 IonicContact OE2-NH2 2.61Å; E1098-R1102 PolarHBondContact OE2-NH2 3.44Å; A1100-R1102 PolarHBondContact O-N 2.69Å; R1102-K1106 VanDerWaalsContact O-CB 3.25Å; R1102-K1106 WeakPolarHBondContact O-CB 3.17Å; R1102-K1106 PolarHBondContact O-N 3.4Å
1103	R	70.4	Confident	68.2	Low	167 Å²	167	110.4 Å²	110.4	63%	0.63	53%	0.526	S	S	*	.	H	α-helix	trans	-66.8	-42.7	171.4	-71.9	174.6	-165.2	105.9	-12.7	111.8	A1099 A1100 E1101 K1106 A1107	A1099-R1103 VanDerWaalsContact O-CG 3.26Å; A1099-R1103 WeakPolarHBondContact O-CG 3.21Å; A1099-R1103 PolarHBondContact O-N 3.23Å; A1099-R1103 VanDerWaalsContact O-N 3.11Å; A1099-R1103 PolarHBondContact O-NH1 3.26Å; A1100-R1103 CarbonylContact O-C 3.55Å; A1100-R1103 WeakPolarHBondContact O-CB 3.25Å; A1100-R1103 PolarHBondContact O-N 2.77Å; A1100-R1103 VanDerWaalsContact O-N 3.13Å; E1101-R1103 VanDerWaalsContact C-N 3.32Å; E1101-R1103 PolarHBondContact O-N 3.06Å; R1103-K1106 PolarHBondContact O-N 2.62Å; R1103-A1107 WeakPolarHBondContact O-CB 3.21Å; R1103-A1107 PolarHBondContact O-N 3.49Å
1104	L	68.3	Low	67.9	Low	134 Å²	134	110.5 Å²	110.5	70%	0.702	53%	0.527	S	S	*	.	H	α-helix	trans	-66.2	-44.4	179.9	-134.6	90.7	0	0	0	111.9	A1100 E1101 K1106 A1107 S1108	A1100-L1104 PolarHBondContact O-N 3.49Å; E1101-L1104 PolarHBondContact O-N 2.94Å; L1104-K1106 VanDerWaalsContact C-N 3.31Å; L1104-K1106 PolarHBondContact O-N 3.34Å; L1104-A1107 PolarHBondContact O-N 2.73Å; L1104-S1108 VanDerWaalsContact O-CB 3.24Å; L1104-S1108 WeakPolarHBondContact O-CB 3.37Å; L1104-S1108 PolarHBondContact O-N 2.77Å
1105	R	77.8	Confident	67.6	Low	151 Å²	151	114.3 Å²	114.3	57%	0.57	54%	0.538	S	S	*	.	H	α-helix	trans	-63.6	-35.3	173.3	-71.2	178.9	-179.9	-164.2	9.1	111.5	E1101 K1109	E1101-R1105 VanDerWaalsContact CD-CZ 3.5Å; E1101-R1105 VanDerWaalsContact CD-NH2 3.26Å; E1101-R1105 HydrophobicContact CG-CG 4.43Å; E1101-R1105 WeakPolarHBondContact O-CB 3.48Å; E1101-R1105 VanDerWaalsContact O-CG 3.32Å; E1101-R1105 WeakPolarHBondContact O-CG 2.76Å; E1101-R1105 PolarHBondContact O-N 3.38Å; E1101-R1105 IonicContact OE1-CZ 3.49Å; E1101-R1105 IonicContact OE1-NE 2.66Å; E1101-R1105 PolarHBondContact OE1-NE 3.33Å; E1101-R1105 IonicContact OE1-NH2 3.51Å; E1101-R1105 PolarHBondContact OE1-NH2 3.33Å; E1101-R1105 IonicContact OE2-CZ 2.69Å; E1101-R1105 VanDerWaalsContact OE2-CZ 3.26Å; E1101-R1105 IonicContact OE2-NE 3.7Å; E1101-R1105 PolarHBondContact OE2-NE 3.47Å; E1101-R1105 IonicContact OE2-NH2 2.73Å; E1101-R1105 PolarHBondContact OE2-NH2 3.29Å; E1101-R1105 VanDerWaalsContact OE2-NH2 3.07Å; R1105-K1109 WeakPolarHBondContact O-CB 3.32Å; R1105-K1109 WeakPolarHBondContact O-CG 3.45Å; R1105-K1109 PolarHBondContact O-N 2.94Å
1106	K	83.4	Confident	66.7	Low	125 Å²	125	108.2 Å²	108.2	54%	0.543	53%	0.526	S	S	.	.	H	α-helix	trans	-66.7	-52.9	172.6	-179.3	178.9	168.2	-178.6	0	111.2	R1102 R1103 L1104 S1108 K1109 E1110	R1102-K1106 VanDerWaalsContact O-CB 3.25Å; R1102-K1106 WeakPolarHBondContact O-CB 3.17Å; R1102-K1106 PolarHBondContact O-N 3.4Å; R1103-K1106 PolarHBondContact O-N 2.62Å; L1104-K1106 VanDerWaalsContact C-N 3.31Å; L1104-K1106 PolarHBondContact O-N 3.34Å; K1106-S1108 VanDerWaalsContact C-N 3.3Å; K1106-S1108 PolarHBondContact O-N 2.95Å; K1106-K1109 CarbonylContact O-C 3.51Å; K1106-K1109 WeakPolarHBondContact O-CA 3.27Å; K1106-K1109 WeakPolarHBondContact O-CB 3.2Å; K1106-K1109 PolarHBondContact O-N 2.98Å; K1106-K1109 VanDerWaalsContact O-N 3.09Å; K1106-E1110 VanDerWaalsContact CE-CD 3.4Å; K1106-E1110 WeakPolarHBondContact CE-OE1 3.45Å; K1106-E1110 HydrophobicContact CG-CG 4.46Å; K1106-E1110 IonicContact NZ-OE1 3.44Å; K1106-E1110 WeakPolarHBondContact O-CG 3.49Å; K1106-E1110 PolarHBondContact O-N 3.29Å
1107	A	70.1	Confident	66.4	Low	48 Å²	48	109.5 Å²	109.5	40%	0.397	53%	0.533	S	S	.	.	H	α-helix	trans	-59.2	-40.2	178.3	0	0	0	0	0	112.1	R1103 L1104 E1110 V1111	R1103-A1107 WeakPolarHBondContact O-CB 3.21Å; R1103-A1107 PolarHBondContact O-N 3.49Å; L1104-A1107 PolarHBondContact O-N 2.73Å; A1107-E1110 PolarHBondContact O-N 2.8Å; A1107-V1111 WeakPolarHBondContact O-CB 3.46Å; A1107-V1111 WeakPolarHBondContact O-CG2 3.32Å; A1107-V1111 PolarHBondContact O-N 2.91Å
1108	S	70.1	Confident	65.8	Low	68 Å²	68	108.9 Å²	108.9	48%	0.476	53%	0.534	S	S	.	.	H	α-helix	trans	-63.4	-42.5	174.1	-176.5	0	0	0	0	112.2	L1104 K1106 L1112	L1104-S1108 VanDerWaalsContact O-CB 3.24Å; L1104-S1108 WeakPolarHBondContact O-CB 3.37Å; L1104-S1108 PolarHBondContact O-N 2.77Å; K1106-S1108 VanDerWaalsContact C-N 3.3Å; K1106-S1108 PolarHBondContact O-N 2.95Å; S1108-L1112 WeakPolarHBondContact O-CB 3.44Å; S1108-L1112 VanDerWaalsContact O-CG 3.28Å; S1108-L1112 WeakPolarHBondContact O-CG 3.27Å; S1108-L1112 PolarHBondContact O-N 3.16Å
1109	K	76	Confident	65	Low	157 Å²	157	111.4 Å²	111.4	68%	0.683	55%	0.545	S	S	*	.	H	α-helix	trans	-62.4	-41.7	171.1	-82.4	-173.5	173.7	-173	0	112.5	R1105 K1106 L1112 Q1113	R1105-K1109 WeakPolarHBondContact O-CB 3.32Å; R1105-K1109 WeakPolarHBondContact O-CG 3.45Å; R1105-K1109 PolarHBondContact O-N 2.94Å; K1106-K1109 CarbonylContact O-C 3.51Å; K1106-K1109 WeakPolarHBondContact O-CA 3.27Å; K1106-K1109 WeakPolarHBondContact O-CB 3.2Å; K1106-K1109 PolarHBondContact O-N 2.98Å; K1106-K1109 VanDerWaalsContact O-N 3.09Å; K1109-L1112 PolarHBondContact O-N 3.29Å; K1109-Q1113 VanDerWaalsContact O-CB 3.28Å; K1109-Q1113 WeakPolarHBondContact O-CB 3.43Å; K1109-Q1113 PolarHBondContact O-N 3.15Å
1110	E	66.3	Low	64.2	Low	89 Å²	89	120 Å²	120	42%	0.416	58%	0.578	S	S	.	*	H	α-helix	trans	-67	-42	178.9	-73.3	171.2	154.9	0	0	111.4	K1106 A1107 L1112 Q1113 M1114	K1106-E1110 VanDerWaalsContact CE-CD 3.4Å; K1106-E1110 WeakPolarHBondContact CE-OE1 3.45Å; K1106-E1110 HydrophobicContact CG-CG 4.46Å; K1106-E1110 IonicContact NZ-OE1 3.44Å; K1106-E1110 WeakPolarHBondContact O-CG 3.49Å; K1106-E1110 PolarHBondContact O-N 3.29Å; A1107-E1110 PolarHBondContact O-N 2.8Å; E1110-L1112 PolarHBondContact O-N 2.89Å; E1110-Q1113 PolarHBondContact O-N 3.02Å; E1110-Q1113 VanDerWaalsContact O-N 3.17Å; E1110-M1114 VanDerWaalsContact O-CG 3.28Å; E1110-M1114 WeakPolarHBondContact O-CB 3.3Å; E1110-M1114 PolarHBondContact O-N 2.75Å; E1110-M1114 WeakPolarHBondContact O-CG 3.44Å
1111	V	64.4	Low	63.5	Low	99 Å²	99	123 Å²	123	60%	0.6	58%	0.584	S	S	*	*	H	α-helix	trans	-61.7	-42.7	171.7	169.1	0	0	0	0	111.4	A1107 Q1113 R1115	A1107-V1111 WeakPolarHBondContact O-CB 3.46Å; A1107-V1111 WeakPolarHBondContact O-CG2 3.32Å; A1107-V1111 PolarHBondContact O-N 2.91Å; V1111-Q1113 VanDerWaalsContact C-N 3.32Å; V1111-Q1113 PolarHBondContact O-N 3.44Å; V1111-R1115 VanDerWaalsContact O-CB 3.31Å; V1111-R1115 WeakPolarHBondContact O-CB 3.26Å; V1111-R1115 PolarHBondContact O-N 2.88Å
1112	L	58	Low	62.4	Low	108 Å²	108	123 Å²	123	57%	0.565	59%	0.592	S	S	*	*	H	α-helix	trans	-64.8	-34.4	173.9	-74.7	167	0	0	0	112.4	S1108 K1109 E1110 R1115 G1116	S1108-L1112 WeakPolarHBondContact O-CB 3.44Å; S1108-L1112 VanDerWaalsContact O-CG 3.28Å; S1108-L1112 WeakPolarHBondContact O-CG 3.27Å; S1108-L1112 PolarHBondContact O-N 3.16Å; K1109-L1112 PolarHBondContact O-N 3.29Å; E1110-L1112 PolarHBondContact O-N 2.89Å; L1112-R1115 CarbonylContact O-C 3.56Å; L1112-R1115 PolarHBondContact O-N 3.37Å; L1112-G1116 PolarHBondContact O-N 3.22Å
1113	Q	63.6	Low	61.1	Low	127 Å²	127	122.3 Å²	122.3	59%	0.593	60%	0.598	S	S	*	*	H	α-helix	trans	-73.1	-41.3	178.2	-168.5	167.3	9.6	0	0	111.9	K1109 E1110 V1111 R1115 G1116 Q1117	K1109-Q1113 VanDerWaalsContact O-CB 3.28Å; K1109-Q1113 WeakPolarHBondContact O-CB 3.43Å; K1109-Q1113 PolarHBondContact O-N 3.15Å; E1110-Q1113 PolarHBondContact O-N 3.02Å; E1110-Q1113 VanDerWaalsContact O-N 3.17Å; V1111-Q1113 VanDerWaalsContact C-N 3.32Å; V1111-Q1113 PolarHBondContact O-N 3.44Å; Q1113-R1115 VanDerWaalsContact C-N 3.29Å; Q1113-R1115 PolarHBondContact O-N 3.44Å; Q1113-G1116 WeakPolarHBondContact O-CA 3.45Å; Q1113-G1116 PolarHBondContact O-N 2.86Å; Q1113-Q1117 PolarHBondContact O-N 3.27Å
1114	M	51.3	Low	60.2	Low	123 Å²	123	118.9 Å²	118.9	61%	0.606	60%	0.598	S	S	*	*	H	α-helix	trans	-61.4	-37.7	169.6	-68.4	-66.1	-75.6	0	0	111.5	E1110 G1116 N1118	E1110-M1114 VanDerWaalsContact O-CG 3.28Å; E1110-M1114 WeakPolarHBondContact O-CB 3.3Å; E1110-M1114 PolarHBondContact O-N 2.75Å; E1110-M1114 WeakPolarHBondContact O-CG 3.44Å; M1114-G1116 VanDerWaalsContact C-N 3.29Å; M1114-N1118 PolarHBondContact O-ND2 2.8Å
1115	R	53.5	Low	59.3	Low	183 Å²	183	115.3 Å²	115.3	69%	0.691	58%	0.581	S	S	*	*	H	α-helix	trans	-73.6	-18.5	172.7	-153.2	178.8	-154.3	-173.2	9.5	113.3	V1111 L1112 Q1113 Q1119	V1111-R1115 VanDerWaalsContact O-CB 3.31Å; V1111-R1115 WeakPolarHBondContact O-CB 3.26Å; V1111-R1115 PolarHBondContact O-N 2.88Å; L1112-R1115 CarbonylContact O-C 3.56Å; L1112-R1115 PolarHBondContact O-N 3.37Å; Q1113-R1115 VanDerWaalsContact C-N 3.29Å; Q1113-R1115 PolarHBondContact O-N 3.44Å; R1115-Q1119 WeakPolarHBondContact O-CG 3.35Å; R1115-Q1119 PolarHBondContact O-NE2 3.36Å
1116	G	50.5	Low	57.8	Low	38 Å²	38	113.2 Å²	113.2	39%	0.392	58%	0.578	S	S	.	*	H	α-helix	trans	-86.5	-39.1	177.3	0	0	0	0	0	113.6	L1112 Q1113 M1114 N1118 Q1119	L1112-G1116 PolarHBondContact O-N 3.22Å; Q1113-G1116 WeakPolarHBondContact O-CA 3.45Å; Q1113-G1116 PolarHBondContact O-N 2.86Å; M1114-G1116 VanDerWaalsContact C-N 3.29Å; G1116-N1118 PolarHBondContact O-N 2.97Å; G1116-Q1119 PolarHBondContact O-N 3.18Å
1117	Q	51.3	Low	56.1	Low	149 Å²	149	110.4 Å²	110.4	70%	0.696	57%	0.571	S	S	*	*	H	α-helix	trans	-63.5	-24	176	-75.5	-175	-19.3	0	0	113	Q1113 Q1119	Q1113-Q1117 PolarHBondContact O-N 3.27Å; Q1117-Q1119 PolarHBondContact O-N 3.23Å
1118	N	48.7	Very low	54.9	Low	128 Å²	128	114.5 Å²	114.5	68%	0.684	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	31.8	179.4	-72.3	-77.8	0	0	0	114.2	M1114 G1116	M1114-N1118 PolarHBondContact O-ND2 2.8Å; G1116-N1118 PolarHBondContact O-N 2.97Å
1119	Q	52.3	Low	53.9	Low	143 Å²	143	119.2 Å²	119.2	67%	0.668	59%	0.588	S	S	*	*			trans	-116.3	28.4	-176.2	-63.5	-171.5	29.3	0	0	115.4	R1115 G1116 Q1117	R1115-Q1119 WeakPolarHBondContact O-CG 3.35Å; R1115-Q1119 PolarHBondContact O-NE2 3.36Å; G1116-Q1119 PolarHBondContact O-N 3.18Å; Q1117-Q1119 PolarHBondContact O-N 3.23Å
1120	K	54.4	Low	52.6	Low	204 Å²	204	118.1 Å²	118.1	89%	0.887	59%	0.585	S	S	*	*	S	Bend	trans	-128.3	24.5	173.9	-81.6	-164.1	174.4	-175.3	0	116.5
1121	E	49.9	Very low	51.5	Low	112 Å²	112	120.4 Å²	120.4	52%	0.523	59%	0.593	S	S	.	*	S	Bend	trans	-155.7	141.6	151.6	-118.5	176.8	-155.9	0	0	110.4
1122	P	49.6	Very low	50.3	Low	87 Å²	87	119.7 Å²	119.7	57%	0.565	59%	0.585	S	S	*	*			trans	-78.7	130.1	179	30.4	-33.3	0	0	0	111.8	P1124 V1125	P1122-P1124 VanDerWaalsContact C-N 3.31Å; P1122-P1124 VanDerWaalsContact O-CD 3.28Å; P1122-P1124 WeakPolarHBondContact O-CD 3.47Å; P1122-V1125 HydrophobicContact CG-CG2 4.12Å; P1122-V1125 PolarHBondContact O-N 3.48Å
1123	L	52.5	Low	49.5	Very low	129 Å²	129	117 Å²	117	68%	0.675	58%	0.578	S	S	*	*	H	α-helix	trans	-43.5	-32.8	-176.1	-72	158.6	0	0	0	117.8	V1125 T1127	L1123-V1125 VanDerWaalsContact C-N 3.25Å; L1123-V1125 PolarHBondContact O-N 3.04Å; L1123-T1127 PolarHBondContact O-OG1 2.94Å; L1123-T1127 VanDerWaalsContact O-OG1 3.11Å; L1123-T1127 PolarHBondContact O-N 2.86Å
1124	P	52	Low	48.5	Very low	95 Å²	95	119.1 Å²	119.1	62%	0.617	59%	0.585	S	S	*	*	H	α-helix	trans	-60	-30.3	174	-26.7	36.9	0	0	0	114.4	P1122 T1127 F1128	P1122-P1124 VanDerWaalsContact C-N 3.31Å; P1122-P1124 VanDerWaalsContact O-CD 3.28Å; P1122-P1124 WeakPolarHBondContact O-CD 3.47Å; P1124-T1127 PolarHBondContact O-OG1 2.88Å; P1124-F1128 VanDerWaalsContact O-CB 3.3Å; P1124-F1128 WeakPolarHBondContact O-CB 3.45Å; P1124-F1128 PolarHBondContact O-N 3.36Å
1125	V	49.1	Very low	48	Very low	58 Å²	58	121 Å²	121	35%	0.352	59%	0.591	S	S	.	*	H	α-helix	trans	-76	-40.6	-176.7	-179.5	0	0	0	0	111.3	P1122 L1123 F1128 R1129	P1122-V1125 HydrophobicContact CG-CG2 4.12Å; P1122-V1125 PolarHBondContact O-N 3.48Å; L1123-V1125 VanDerWaalsContact C-N 3.25Å; L1123-V1125 PolarHBondContact O-N 3.04Å; V1125-F1128 PolarHBondContact O-N 3.13Å; V1125-R1129 PolarHBondContact O-N 3.36Å
1126	Q	45.9	Very low	47.4	Very low	108 Å²	108	116.8 Å²	116.8	51%	0.505	59%	0.585	S	S	.	*	H	α-helix	trans	-66	-48.5	-178.8	-155.5	170.8	20.4	0	0	110.9	F1128 R1129 E1130	Q1126-F1128 VanDerWaalsContact C-N 3.26Å; Q1126-F1128 PolarHBondContact O-N 2.87Å; Q1126-R1129 PolarHBondContact O-N 3.03Å; Q1126-R1129 VanDerWaalsContact O-N 3.16Å; Q1126-E1130 PolarHBondContact O-N 3.19Å
1127	T	48.9	Very low	46.9	Very low	65 Å²	65	125.4 Å²	125.4	40%	0.399	61%	0.606	S	S	.	*	H	α-helix	trans	-68.2	-20.9	176	56.6	0	0	0	0	113.7	L1123 P1124 K1131	L1123-T1127 PolarHBondContact O-OG1 2.94Å; L1123-T1127 VanDerWaalsContact O-OG1 3.11Å; L1123-T1127 PolarHBondContact O-N 2.86Å; P1124-T1127 PolarHBondContact O-OG1 2.88Å; T1127-K1131 WeakPolarHBondContact O-CD 3.41Å; T1127-K1131 VanDerWaalsContact O-CG 3.29Å; T1127-K1131 WeakPolarHBondContact O-CG 3.37Å; T1127-K1131 PolarHBondContact O-N 3.36Å
1128	F	45.4	Very low	46.1	Very low	134 Å²	134	124.2 Å²	124.2	59%	0.588	61%	0.611	S	S	*	*	H	α-helix	trans	-75.3	-44.3	169.1	-178.4	-101	0	0	0	111.7	P1124 V1125 Q1126 E1130 K1131 M1132	P1124-F1128 VanDerWaalsContact O-CB 3.3Å; P1124-F1128 WeakPolarHBondContact O-CB 3.45Å; P1124-F1128 PolarHBondContact O-N 3.36Å; V1125-F1128 PolarHBondContact O-N 3.13Å; Q1126-F1128 VanDerWaalsContact C-N 3.26Å; Q1126-F1128 PolarHBondContact O-N 2.87Å; F1128-E1130 PolarHBondContact O-N 3.21Å; F1128-K1131 PolarHBondContact O-N 3.39Å; F1128-M1132 HydrophobicContact CE1-CG 3.89Å; F1128-M1132 PolarHBondContact O-N 3.2Å; F1128-M1132 WeakPolarHBondContact O-CG 3.41Å; F1128-M1132 HydrophobicContact CZ-SD 4.29Å; F1128-M1132 HydrophobicContact CZ-CG 3.82Å; F1128-M1132 HydrophobicContact CE2-SD 4.43Å; F1128-M1132 HydrophobicContact CE2-CG 4.17Å; F1128-M1132 HydrophobicContact CD1-CG 4.3Å
1129	R	48.9	Very low	45.8	Very low	168 Å²	168	129.4 Å²	129.4	63%	0.634	62%	0.621	S	S	*	*	H	α-helix	trans	-59.3	-45.3	175.3	-76.9	-171.9	176.5	-153	3.8	112.2	V1125 Q1126 K1131 M1132 A1133	V1125-R1129 PolarHBondContact O-N 3.36Å; Q1126-R1129 PolarHBondContact O-N 3.03Å; Q1126-R1129 VanDerWaalsContact O-N 3.16Å; R1129-K1131 PolarHBondContact O-N 3.05Å; R1129-M1132 PolarHBondContact O-N 3Å; R1129-A1133 WeakPolarHBondContact O-CB 3.09Å; R1129-A1133 PolarHBondContact O-N 3.16Å
1130	E	48.9	Very low	44.9	Very low	134 Å²	134	131.8 Å²	131.8	63%	0.626	63%	0.63	S	S	*	*	H	α-helix	trans	-61.6	-43.6	177.5	-70.5	-177.6	128.2	0	0	112.5	Q1126 F1128 A1133 F1134	Q1126-E1130 PolarHBondContact O-N 3.19Å; F1128-E1130 PolarHBondContact O-N 3.21Å; E1130-A1133 PolarHBondContact O-N 3.11Å; E1130-F1134 PolarHBondContact O-N 3.21Å
1131	K	42.7	Very low	43.8	Very low	137 Å²	137	128.8 Å²	128.8	60%	0.596	62%	0.623	S	S	*	*	H	α-helix	trans	-64.5	-42.8	176.8	-74.7	173.2	-176.7	173.5	0	112	T1127 F1128 R1129 A1133 F1134 F1135	T1127-K1131 WeakPolarHBondContact O-CD 3.41Å; T1127-K1131 VanDerWaalsContact O-CG 3.29Å; T1127-K1131 WeakPolarHBondContact O-CG 3.37Å; T1127-K1131 PolarHBondContact O-N 3.36Å; F1128-K1131 PolarHBondContact O-N 3.39Å; R1129-K1131 PolarHBondContact O-N 3.05Å; K1131-A1133 VanDerWaalsContact C-N 3.32Å; K1131-A1133 PolarHBondContact O-N 3.34Å; K1131-F1134 WeakPolarHBondContact O-CB 3.26Å; K1131-F1134 PolarHBondContact O-N 2.96Å; K1131-F1134 VanDerWaalsContact O-N 3.17Å; K1131-F1135 PolarHBondContact O-N 3.41Å; K1131-F1135 WeakPolarHBondContact O-CD2 3.25Å
1132	M	38.7	Very low	43.3	Very low	84 Å²	84	130.8 Å²	130.8	41%	0.414	64%	0.636	S	S	.	*	H	α-helix	trans	-66.5	-33.4	176.5	-71	-50.8	-51.4	0	0	112.7	F1128 R1129 F1134 F1135 T1136	F1128-M1132 HydrophobicContact CE1-CG 3.89Å; F1128-M1132 PolarHBondContact O-N 3.2Å; F1128-M1132 WeakPolarHBondContact O-CG 3.41Å; F1128-M1132 HydrophobicContact CZ-SD 4.29Å; F1128-M1132 HydrophobicContact CZ-CG 3.82Å; F1128-M1132 HydrophobicContact CE2-SD 4.43Å; F1128-M1132 HydrophobicContact CE2-CG 4.17Å; F1128-M1132 HydrophobicContact CD1-CG 4.3Å; R1129-M1132 PolarHBondContact O-N 3Å; M1132-F1134 VanDerWaalsContact C-N 3.25Å; M1132-F1134 PolarHBondContact O-N 2.92Å; M1132-F1135 PolarHBondContact O-N 3.27Å; M1132-T1136 HydrophobicContact CE-CG2 4.36Å; M1132-T1136 WeakPolarHBondContact O-CB 3.26Å; M1132-T1136 VanDerWaalsContact O-CG2 3.31Å; M1132-T1136 WeakPolarHBondContact O-CG2 3.21Å; M1132-T1136 PolarHBondContact O-N 3.42Å; M1132-T1136 PolarHBondContact O-OG1 3.5Å
1133	A	42.4	Very low	42.7	Very low	51 Å²	51	131.9 Å²	131.9	42%	0.421	64%	0.643	S	S	.	*	H	α-helix	trans	-65.6	-27.4	173.4	0	0	0	0	0	113	R1129 E1130 K1131	R1129-A1133 WeakPolarHBondContact O-CB 3.09Å; R1129-A1133 PolarHBondContact O-N 3.16Å; E1130-A1133 PolarHBondContact O-N 3.11Å; K1131-A1133 VanDerWaalsContact C-N 3.32Å; K1131-A1133 PolarHBondContact O-N 3.34Å
1134	F	42.4	Very low	42.1	Very low	172 Å²	172	131.6 Å²	131.6	75%	0.754	65%	0.649	S	S	*	*	H	α-helix	trans	-74.7	-37.7	175.6	-164.8	-94.7	0	0	0	112.4	E1130 K1131 M1132	E1130-F1134 PolarHBondContact O-N 3.21Å; K1131-F1134 WeakPolarHBondContact O-CB 3.26Å; K1131-F1134 PolarHBondContact O-N 2.96Å; K1131-F1134 VanDerWaalsContact O-N 3.17Å; M1132-F1134 VanDerWaalsContact C-N 3.25Å; M1132-F1134 PolarHBondContact O-N 2.92Å
1135	F	39.8	Very low	41.4	Very low	163 Å²	163	135.1 Å²	135.1	72%	0.715	66%	0.661	S	S	*	*	H	α-helix	trans	-83.5	-4.1	-178.8	-71.2	-66.8	0	0	0	115.4	K1131 M1132	K1131-F1135 PolarHBondContact O-N 3.41Å; K1131-F1135 WeakPolarHBondContact O-CD2 3.25Å; M1132-F1135 PolarHBondContact O-N 3.27Å
1136	T	42.2	Very low	41.1	Very low	94 Å²	94	138.3 Å²	138.3	58%	0.577	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	7	-171.8	48.7	0	0	0	0	115.4	M1132	M1132-T1136 HydrophobicContact CE-CG2 4.36Å; M1132-T1136 WeakPolarHBondContact O-CB 3.26Å; M1132-T1136 VanDerWaalsContact O-CG2 3.31Å; M1132-T1136 WeakPolarHBondContact O-CG2 3.21Å; M1132-T1136 PolarHBondContact O-N 3.42Å; M1132-T1136 PolarHBondContact O-OG1 3.5Å
1137	R	39.7	Very low	40.8	Very low	219 Å²	219	136.8 Å²	136.8	83%	0.826	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-97.1	119.1	175.8	-68.9	-171.6	174.5	-156.4	-2.5	111.9
1138	P	32.9	Very low	40.4	Very low	124 Å²	124	141 Å²	141	81%	0.805	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-77.6	160.8	-175.7	31.3	-35.7	0	0	0	113.6
1139	R	42.2	Very low	40.1	Very low	236 Å²	236	141.7 Å²	141.7	89%	0.891	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-74.5	138.3	170.9	-63.2	176.1	174	-176.6	-2.5	111.2
1140	F	33.7	Very low	39.5	Very low	194 Å²	194	143.6 Å²	143.6	85%	0.851	75%	0.749	S	S	*	*			trans	175	153.7	148.8	-85.8	-54.6	0	0	0	106.5
1141	N	31.8	Very low	39.1	Very low	140 Å²	140	144.1 Å²	144.1	75%	0.749	76%	0.755	S	S	*	*			cis	-148.2	168.1	-0.9	-128.4	-28.5	0	0	0	109.7
1142	I	39.7	Very low	38.9	Very low	155 Å²	155	144.5 Å²	144.5	80%	0.795	76%	0.764	S	S	*	*			trans	-105.5	128.8	178.4	-62.2	171.6	0	0	0	110.7
1143	P	35.9	Very low	38.9	Very low	110 Å²	110	147.8 Å²	147.8	71%	0.714	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-85.9	148.2	163.1	-7.6	26.6	0	0	0	112.1
1144	P	39.9	Very low	38.7	Very low	123 Å²	123	153.5 Å²	153.5	80%	0.799	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-84.5	164.8	-172.3	34.7	-37.1	0	0	0	114.8
1145	L	38.6	Very low	38.4	Very low	168 Å²	168	152.4 Å²	152.4	88%	0.88	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-82.3	143.4	166.7	-64.5	168	0	0	0	110.9
1146	P	42.6	Very low	38.3	Very low	125 Å²	125	151.7 Å²	151.7	81%	0.812	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-80.9	162.2	151	35.3	-31.3	0	0	0	110.7
1147	A	38.5	Very low	38.1	Very low	77 Å²	77	155.8 Å²	155.8	64%	0.636	83%	0.831	S	S	*	*			trans	-114.7	174.2	175.3	0	0	0	0	0	111
1148	D	40.8	Very low	37.9	Very low	154 Å²	154	150.9 Å²	150.9	82%	0.824	83%	0.831	S	S	*	*			trans	67.2	145.6	165.5	-40.7	-32.1	0	0	0	115.4
1149	D	38.9	Very low	38.4	Very low	148 Å²	148	153.2 Å²	153.2	79%	0.791	83%	0.833	S	S	*	*			cis	-154.6	170.5	-4.2	-144.8	-18.1	0	0	0	110.5
1150	V	37.9	Very low	38	Very low	208 Å²	208	145.6 Å²	145.6	100%	1.261	83%	0.828	S	S	*	*			trans	73	0	175.7	-166.8	0	0	0	0	117.3

Retrieved 1,150 of 1,150 residues in 297.2 ms (Link to these results)

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