A0A3Q0KBG3_SCHMA Loading...

Eukaryotic translation initiation factor 3 subunit A

RNA-binding component of the eukaryotic translation initiation factor 3 (eIF-3) complex, which is involved in protein synthesis of a specialized repertoire of mRNAs and, together with other initiation factors, stimulates binding of mRNA and methionyl-tRNAi to the 40S ribosome. The eIF-3 complex specifically targets and initiates translation of a subset of mRNAs involved in cell proliferation.

AlphaFold DB , UniProt , Accession A0A3Q0KBG3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,066 aa.

						>A0A3Q0KBG3_SCHMA|A0A3Q0KBG3
MPPSQYHKPETALTKARELIKCDKKANALEILYEVMRVRRTKQWQKVLEELMMLFVELCVELRKNIHFRKAIYTYKNMSVLENTVSLEQVIRSYLNQIKGKTEEAQEVSKSAIMEIEDLDVLETPESLMLNAVSMEGTQDRSARTILMPWLKFLWDSYRLVLDLLRSNSKLEKLYHEVAHDAYNFCLKYGRKTEFKKLCELIRQHTQKVQNQLQPNALNAINLNNAETQTLHLETRLRQLDCAMELDMYNEAFKTVEDIWSFMMISRIHAMPSLMTNYYSKTAELFRRCGCHLYHAAALHKLYTLYRDQKKNITREELSDLGSRVLCATVAIPLPNAKLNADKFLSGEYTIMKQKTLAGLLGLIQVPTRQSLIRDLVRHKVHTVVPSNLAKLYQVLEADFQPLKLWELVQPALAHITTCSDLQVYITQLHDVIVAKTLLQLSQVYQSLNFDEFVKLCPFMEPIRLERIVLELIHNLELPIRVNHLQQAIFFDKFTDLGISQCEYGGQLVSQSTHVNDPDKLSRQLTMFAQVMQQITDILEVGQSLANCRRALVHDYRKNEKVLRSELLNRRCLIEARKEEIETYQVKRDQYYSIVEERRQAEQERLLKAEETNLANEAIQRERMKTEDEKARLKLRMARTSLKMFLDLKIDTKLDLKELTEEQLENFDADKLINKQKQEVKKKRKELAEKAKTMAKKLDYYTRACRIEEIPLLQANVEPEAMESRELFEQSVREIEEHSKAEHARQLKERNRLIRMKSDVQRLVSQLKEARDNRYRAKLAEWEALCDQTRSERLAERRAKHEAELEAEARRRAAQEAIEREEQKKRELAAEAERQKREQEAKEAAEREVARLEEESKSWTRGDIKKVTMTSEKLSLENSEADTNTYEPVSANPFARHRQSEISNTSGNAFRDFRRDDTSRYSDFGRLSGSKRVGFDNTPNTRSDPSKDIWSRSGPRRTVPSEFDSLYEDDSGNAGGWTQVGSRRENERTKPFGRGGSTMGGGFNRGPKNPDMDTGSSTPWRREGPNAAGGKSQVFEEMRGGNVKRPFGSSGFPSRISSGLSDDRKY
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.5	Very low	62.4	Low	188 Å²	188	100 Å²	100	93%	0.926	52%	0.522	S	S	*	.				0	105.1	0	-77.3	-85	162	0	0	107.4
2	P	41.5	Very low	64.4	Low	102 Å²	102	91.7 Å²	91.7	66%	0.662	48%	0.478	S	S	*	.			trans	-66.9	160.8	170.6	30.7	-34.5	0	0	0	110.8
3	P	45.4	Very low	66.2	Low	113 Å²	113	85.4 Å²	85.4	73%	0.734	45%	0.445	S	S	*	.			trans	-66.9	144.5	178.6	-19.2	32.8	0	0	0	112.3	Q5	P3-Q5 PolarHBondContact O-N 2.78Å
4	S	52.3	Low	67.8	Low	57 Å²	57	84.1 Å²	84.1	40%	0.399	44%	0.443	S	S	.	.			trans	-68.4	90.4	-177	-51.4	0	0	0	0	112.7	Y6	S4-Y6 VanDerWaalsContact C-N 3.29Å; S4-Y6 PolarHBondContact O-N 3.12Å
5	Q	57.8	Low	69.2	Low	154 Å²	154	83.9 Å²	83.9	72%	0.72	44%	0.437	S	S	*	.			trans	-69.9	-16.5	-175.2	-75.3	-178.8	-20.2	0	0	114.8	P3 H7	P3-Q5 PolarHBondContact O-N 2.78Å; Q5-H7 PolarHBondContact O-N 2.93Å; Q5-H7 VanDerWaalsContact O-N 3.14Å
6	Y	62.2	Low	70.6	Confident	48 Å²	48	78.6 Å²	78.6	19%	0.188	41%	0.41	C	S	.	.			trans	-83.3	91.1	-175.8	-59.3	-71.4	0	0	0	112.3	S4 A12 K15 I31 V35	S4-Y6 VanDerWaalsContact C-N 3.29Å; S4-Y6 PolarHBondContact O-N 3.12Å; Y6-A12 HydrophobicContact CD1-CB 3.92Å; Y6-A12 HydrophobicContact CG-CB 4.04Å; Y6-K15 HydrophobicContact CE1-CD 3.78Å; Y6-K15 HydrophobicContact CE1-CG 4.49Å; Y6-K15 WeakPolarHBondContact OH-CD 3.34Å; Y6-K15 PolarHBondContact OH-NZ 3.46Å; Y6-K15 VanDerWaalsContact OH-NZ 3.12Å; Y6-I31 HydrophobicContact CD2-CG2 4.28Å; Y6-I31 HydrophobicContact CE2-CD1 4.46Å; Y6-I31 HydrophobicContact CE2-CG1 4.36Å; Y6-I31 HydrophobicContact CE2-CG2 3.98Å; Y6-V35 HydrophobicContact CG-CG2 4.49Å
7	H	61.5	Low	71.8	Confident	148 Å²	148	80.8 Å²	80.8	69%	0.685	41%	0.411	S	S	*	.			trans	-83.7	-15.3	177.4	-83.4	46	0	0	0	114.5	Q5 R40	Q5-H7 PolarHBondContact O-N 2.93Å; Q5-H7 VanDerWaalsContact O-N 3.14Å; H7-R40 PolarHBondContact NE2-NH1 3.33Å
8	K	75	Confident	73	Confident	123 Å²	123	82.3 Å²	82.3	54%	0.535	42%	0.416	S	S	.	.	S	Bend	trans	-127.4	139.7	173.8	-67.6	-171.2	172.9	-166.7	0	109.8	E10 T11	K8-E10 VanDerWaalsContact C-N 3.26Å; K8-E10 WeakPolarHBondContact CD-OE2 3.24Å; K8-E10 IonicContact NZ-OE2 2.88Å; K8-E10 PolarHBondContact O-N 3.42Å; K8-T11 HydrophobicContact CB-CG2 4.32Å; K8-T11 PolarHBondContact O-N 3.27Å; K8-T11 PolarHBondContact O-OG1 3.09Å
9	P	81.1	Confident	73.9	Confident	12 Å²	12	79.9 Å²	79.9	8%	0.078	41%	0.405	C	S	.	.	H	α-helix	trans	-64.3	-33.5	178.7	26	-33.3	0	0	0	112.1	T11 A12 L13 V47 L48 L51	P9-T11 VanDerWaalsContact C-N 3.3Å; P9-T11 PolarHBondContact O-N 3.04Å; P9-A12 PolarHBondContact O-N 3.13Å; P9-A12 VanDerWaalsContact O-N 3.16Å; P9-L13 PolarHBondContact O-N 2.93Å; P9-V47 HydrophobicContact CB-CG1 4.15Å; P9-V47 HydrophobicContact CG-CB 4.39Å; P9-V47 HydrophobicContact CG-CG1 4.14Å; P9-L48 HydrophobicContact CB-CD2 3.81Å; P9-L48 HydrophobicContact CG-CD2 4.35Å; P9-L51 HydrophobicContact CB-CD1 4.06Å
10	E	85	Confident	74.9	Confident	95 Å²	95	78.1 Å²	78.1	44%	0.444	40%	0.396	S	S	.	.	H	α-helix	trans	-49.7	-46.9	174.1	-59.1	164.6	160.2	0	0	112.2	K8 A12 L13 T14 V47	K8-E10 VanDerWaalsContact C-N 3.26Å; K8-E10 WeakPolarHBondContact CD-OE2 3.24Å; K8-E10 IonicContact NZ-OE2 2.88Å; K8-E10 PolarHBondContact O-N 3.42Å; E10-A12 VanDerWaalsContact C-N 3.31Å; E10-A12 PolarHBondContact O-N 2.87Å; E10-L13 PolarHBondContact O-N 3.46Å; E10-T14 PolarHBondContact O-N 2.91Å; E10-T14 PolarHBondContact O-OG1 3.27Å; E10-V47 HydrophobicContact CG-CG1 4Å; E10-V47 HydrophobicContact CG-CG2 4.25Å
11	T	86.6	Confident	75.7	Confident	60 Å²	60	83.1 Å²	83.1	37%	0.368	42%	0.415	S	S	.	.	H	α-helix	trans	-78.5	-13.9	-174.7	63.6	0	0	0	0	113.9	K8 P9 T14 K15	K8-T11 HydrophobicContact CB-CG2 4.32Å; K8-T11 PolarHBondContact O-N 3.27Å; K8-T11 PolarHBondContact O-OG1 3.09Å; P9-T11 VanDerWaalsContact C-N 3.3Å; P9-T11 PolarHBondContact O-N 3.04Å; T11-T14 PolarHBondContact O-OG1 3.39Å; T11-K15 WeakPolarHBondContact O-CG 3.3Å
12	A	85.5	Confident	78.2	Confident	0 Å²	0	78 Å²	78	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-85.1	-37.9	168.1	0	0	0	0	0	111.1	Y6 P9 E10 K15 A16 I31 V35	Y6-A12 HydrophobicContact CD1-CB 3.92Å; Y6-A12 HydrophobicContact CG-CB 4.04Å; P9-A12 PolarHBondContact O-N 3.13Å; P9-A12 VanDerWaalsContact O-N 3.16Å; E10-A12 VanDerWaalsContact C-N 3.31Å; E10-A12 PolarHBondContact O-N 2.87Å; A12-K15 PolarHBondContact O-N 2.95Å; A12-A16 VanDerWaalsContact O-CB 3.29Å; A12-A16 WeakPolarHBondContact O-CB 3.02Å; A12-A16 PolarHBondContact O-N 3.33Å; A12-I31 HydrophobicContact CB-CG2 3.91Å; A12-V35 HydrophobicContact CB-CG2 3.47Å; A12-V35 VanDerWaalsContact CB-CG2 3.47Å
13	L	87.7	Confident	80.4	Confident	10 Å²	10	79.4 Å²	79.4	5%	0.052	40%	0.399	C	S	.	.	H	α-helix	trans	-65.9	-39.7	176.9	174.6	157.4	0	0	0	112	P9 E10 A16 R17 V47 E50 L51	P9-L13 PolarHBondContact O-N 2.93Å; E10-L13 PolarHBondContact O-N 3.46Å; L13-A16 PolarHBondContact O-N 3.18Å; L13-R17 VanDerWaalsContact CD2-CZ 3.47Å; L13-R17 WeakPolarHBondContact O-CG 3.33Å; L13-R17 PolarHBondContact O-N 3.32Å; L13-V47 HydrophobicContact CD1-CG1 4.29Å; L13-E50 HydrophobicContact CD1-CB 3.78Å; L13-L51 HydrophobicContact CD1-CB 4.31Å
14	T	89.7	Confident	82.7	Confident	68 Å²	68	79.7 Å²	79.7	42%	0.417	39%	0.388	S	S	.	.	H	α-helix	trans	-63.2	-50.9	172.7	55.5	0	0	0	0	111.7	E10 T11 A16 R17 E18	E10-T14 PolarHBondContact O-N 2.91Å; E10-T14 PolarHBondContact O-OG1 3.27Å; T11-T14 PolarHBondContact O-OG1 3.39Å; T14-A16 VanDerWaalsContact C-N 3.29Å; T14-A16 PolarHBondContact O-N 2.84Å; T14-R17 CarbonylContact O-C 3.59Å; T14-R17 WeakPolarHBondContact O-CB 3.49Å; T14-R17 PolarHBondContact O-N 3.48Å; T14-R17 VanDerWaalsContact O-N 3.09Å; T14-E18 WeakPolarHBondContact O-CG 3.05Å; T14-E18 PolarHBondContact O-N 2.83Å
15	K	88.8	Confident	84.5	Confident	80 Å²	80	79.5 Å²	79.5	35%	0.348	38%	0.38	S	S	.	.	H	α-helix	trans	-64.2	-30.5	178.1	-69.4	-159.4	-159.3	173.2	0	113.8	Y6 T11 A12 E18 L19	Y6-K15 HydrophobicContact CE1-CD 3.78Å; Y6-K15 HydrophobicContact CE1-CG 4.49Å; Y6-K15 WeakPolarHBondContact OH-CD 3.34Å; Y6-K15 PolarHBondContact OH-NZ 3.46Å; Y6-K15 VanDerWaalsContact OH-NZ 3.12Å; T11-K15 WeakPolarHBondContact O-CG 3.3Å; A12-K15 PolarHBondContact O-N 2.95Å; K15-E18 PolarHBondContact O-N 3.01Å; K15-L19 WeakPolarHBondContact O-CB 3.4Å; K15-L19 WeakPolarHBondContact O-CG 3.42Å; K15-L19 PolarHBondContact O-N 3.28Å
16	A	90.6	Very high	86.2	Confident	0 Å²	0	74 Å²	74	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-65.5	-46.4	171.3	0	0	0	0	0	110.9	A12 L13 T14 E18 L19 I20 A28 L32 L54	A12-A16 VanDerWaalsContact O-CB 3.29Å; A12-A16 WeakPolarHBondContact O-CB 3.02Å; A12-A16 PolarHBondContact O-N 3.33Å; L13-A16 PolarHBondContact O-N 3.18Å; T14-A16 VanDerWaalsContact C-N 3.29Å; T14-A16 PolarHBondContact O-N 2.84Å; A16-E18 VanDerWaalsContact C-N 3.29Å; A16-E18 PolarHBondContact O-N 2.64Å; A16-L19 PolarHBondContact O-N 3.26Å; A16-I20 VanDerWaalsContact O-CG1 3.22Å; A16-I20 WeakPolarHBondContact O-CG1 3.5Å; A16-I20 PolarHBondContact O-N 2.85Å; A16-A28 HydrophobicContact CB-CB 4.28Å; A16-L32 HydrophobicContact CB-CD1 4.06Å; A16-L32 HydrophobicContact CB-CD2 3.53Å; A16-L32 HydrophobicContact CB-CG 3.79Å; A16-L54 HydrophobicContact CB-CD2 4.14Å
17	R	92.3	Very high	87.5	Confident	115 Å²	115	75.7 Å²	75.7	43%	0.434	37%	0.373	S	S	.	.	H	α-helix	trans	-61.1	-35.4	173.5	-69.9	178.2	-179.2	163.8	6.6	112.2	L13 T14 K21 E50 L54	L13-R17 VanDerWaalsContact CD2-CZ 3.47Å; L13-R17 WeakPolarHBondContact O-CG 3.33Å; L13-R17 PolarHBondContact O-N 3.32Å; T14-R17 CarbonylContact O-C 3.59Å; T14-R17 WeakPolarHBondContact O-CB 3.49Å; T14-R17 PolarHBondContact O-N 3.48Å; T14-R17 VanDerWaalsContact O-N 3.09Å; R17-K21 WeakPolarHBondContact O-CG 3.3Å; R17-K21 PolarHBondContact O-N 3.22Å; R17-E50 IonicContact NH2-OE2 3.86Å; R17-E50 PolarHBondContact NH2-OE2 2.93Å; R17-L54 HydrophobicContact CG-CD2 3.88Å
18	E	92.1	Very high	88.9	Confident	108 Å²	108	68.6 Å²	68.6	51%	0.505	34%	0.34	S	S	.	.	H	α-helix	trans	-65.7	-47.6	172.5	-70.1	159.2	-161.1	0	0	112.3	T14 K15 A16 I20 K21 C22	T14-E18 WeakPolarHBondContact O-CG 3.05Å; T14-E18 PolarHBondContact O-N 2.83Å; K15-E18 PolarHBondContact O-N 3.01Å; A16-E18 VanDerWaalsContact C-N 3.29Å; A16-E18 PolarHBondContact O-N 2.64Å; E18-I20 VanDerWaalsContact C-N 3.3Å; E18-I20 PolarHBondContact O-N 2.77Å; E18-K21 WeakPolarHBondContact O-CB 3.02Å; E18-K21 PolarHBondContact O-N 2.8Å; E18-K21 VanDerWaalsContact O-N 3.16Å; E18-C22 PolarHBondContact O-N 3.34Å
19	L	91.5	Very high	89.7	Confident	38 Å²	38	62.8 Å²	62.8	20%	0.199	32%	0.315	C	S	.	.	H	α-helix	trans	-65.5	-31.8	178	-75.1	172.4	0	0	0	113	K15 A16 C22 D23 K24 N27 A28 I31	K15-L19 WeakPolarHBondContact O-CB 3.4Å; K15-L19 WeakPolarHBondContact O-CG 3.42Å; K15-L19 PolarHBondContact O-N 3.28Å; A16-L19 PolarHBondContact O-N 3.26Å; L19-C22 CarbonylContact O-C 3.5Å; L19-C22 PolarHBondContact O-N 3Å; L19-D23 PolarHBondContact O-N 3.11Å; L19-K24 HydrophobicContact CB-CB 4.32Å; L19-K24 HydrophobicContact CD2-CB 3.97Å; L19-K24 HydrophobicContact CD2-CD 4.24Å; L19-K24 PolarHBondContact O-N 3.41Å; L19-N27 HydrophobicContact CD1-CB 4.02Å; L19-A28 HydrophobicContact CB-CB 3.9Å; L19-I31 HydrophobicContact CD1-CD1 3.57Å
20	I	92.2	Very high	90.2	Very high	43 Å²	43	67 Å²	67	22%	0.221	33%	0.334	C	S	.	.	H	α-helix	trans	-63.9	-42.7	171.9	-69	165.3	0	0	0	110.8	A16 E18 C22 D23 A28 L54 L58	A16-I20 VanDerWaalsContact O-CG1 3.22Å; A16-I20 WeakPolarHBondContact O-CG1 3.5Å; A16-I20 PolarHBondContact O-N 2.85Å; E18-I20 VanDerWaalsContact C-N 3.3Å; E18-I20 PolarHBondContact O-N 2.77Å; I20-C22 PolarHBondContact O-N 2.85Å; I20-C22 VanDerWaalsContact O-N 3.13Å; I20-D23 PolarHBondContact O-N 2.93Å; I20-A28 HydrophobicContact CG1-CB 4Å; I20-L54 HydrophobicContact CD1-CD1 3.71Å; I20-L54 HydrophobicContact CD1-CD2 4.16Å; I20-L54 HydrophobicContact CD1-CG 4.09Å; I20-L58 HydrophobicContact CD1-CD1 4.15Å; I20-L58 HydrophobicContact CD1-CD2 4.06Å; I20-L58 HydrophobicContact CD1-CG 4.36Å; I20-L58 HydrophobicContact CG1-CD1 4.49Å; I20-L58 HydrophobicContact CG1-CD2 4.02Å
21	K	92.3	Very high	90.3	Very high	183 Å²	183	63.8 Å²	63.8	80%	0.796	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-12.7	173.5	-70.3	176.9	178.3	-173.7	0	114	R17 E18	R17-K21 WeakPolarHBondContact O-CG 3.3Å; R17-K21 PolarHBondContact O-N 3.22Å; E18-K21 WeakPolarHBondContact O-CB 3.02Å; E18-K21 PolarHBondContact O-N 2.8Å; E18-K21 VanDerWaalsContact O-N 3.16Å
22	C	91.5	Very high	90.4	Very high	80 Å²	80	60.9 Å²	60.9	54%	0.541	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	19.8	174.5	-58.8	0	0	0	0	112.6	E18 L19 I20 K24	E18-C22 PolarHBondContact O-N 3.34Å; L19-C22 CarbonylContact O-C 3.5Å; L19-C22 PolarHBondContact O-N 3Å; I20-C22 PolarHBondContact O-N 2.85Å; I20-C22 VanDerWaalsContact O-N 3.13Å; C22-K24 PolarHBondContact O-N 3.09Å
23	D	88.7	Confident	90.6	Very high	133 Å²	133	63.2 Å²	63.2	71%	0.711	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	10.5	-176.1	-72.3	-53	0	0	0	116.4	L19 I20 K25	L19-D23 PolarHBondContact O-N 3.11Å; I20-D23 PolarHBondContact O-N 2.93Å; D23-K25 PolarHBondContact O-N 2.82Å
24	K	91.9	Very high	90.5	Very high	118 Å²	118	64.9 Å²	64.9	51%	0.513	32%	0.318	S	S	.	.			trans	-82.2	46.2	178.2	-73	167.4	-174.9	173.8	0	111.2	L19 C22 A26 N27 A28	L19-K24 HydrophobicContact CB-CB 4.32Å; L19-K24 HydrophobicContact CD2-CB 3.97Å; L19-K24 HydrophobicContact CD2-CD 4.24Å; L19-K24 PolarHBondContact O-N 3.41Å; C22-K24 PolarHBondContact O-N 3.09Å; K24-A26 PolarHBondContact O-N 2.96Å; K24-N27 HydrophobicContact CB-CB 4.38Å; K24-N27 PolarHBondContact O-N 3.19Å; K24-A28 PolarHBondContact O-N 2.87Å
25	K	91.8	Very high	90.2	Very high	54 Å²	54	62.1 Å²	62.1	24%	0.235	30%	0.301	C	S	.	.	H	α-helix	trans	-52.2	-37.9	-178.5	-68.1	-175.9	171.1	-164.1	0	113	D23 A28 L29 L58 E61 L62	D23-K25 PolarHBondContact O-N 2.82Å; K25-A28 PolarHBondContact O-N 3.28Å; K25-L29 PolarHBondContact O-N 3.5Å; K25-L58 HydrophobicContact CB-CD2 3.92Å; K25-L58 HydrophobicContact CD-CD2 4.47Å; K25-L58 HydrophobicContact CG-CD2 4.06Å; K25-E61 VanDerWaalsContact CD-OE2 3.32Å; K25-E61 WeakPolarHBondContact CD-OE2 3.28Å; K25-E61 WeakPolarHBondContact CE-OE2 3.48Å; K25-E61 IonicContact NZ-OE1 3.03Å; K25-E61 PolarHBondContact NZ-OE1 3.46Å; K25-E61 IonicContact NZ-OE2 2.62Å; K25-E61 PolarHBondContact NZ-OE2 2.84Å; K25-L62 HydrophobicContact CB-CD1 4.29Å; K25-L62 HydrophobicContact CB-CD2 4.49Å
26	A	91.7	Very high	89.9	Confident	37 Å²	37	58.4 Å²	58.4	31%	0.306	29%	0.285	S	S	.	.	H	α-helix	trans	-62.7	-44.4	175.8	0	0	0	0	0	112.7	K24 L29 E30 L62	K24-A26 PolarHBondContact O-N 2.96Å; A26-L29 PolarHBondContact O-N 3.43Å; A26-E30 PolarHBondContact O-N 2.97Å; A26-E30 VanDerWaalsContact O-N 3.14Å; A26-L62 HydrophobicContact CB-CD1 4.4Å
27	N	90.5	Very high	89.4	Confident	84 Å²	84	64.3 Å²	64.3	45%	0.449	31%	0.308	S	S	.	.	H	α-helix	trans	-72.1	-35.3	179.4	-59.8	23.5	0	0	0	111.1	L19 K24 E30 I31	L19-N27 HydrophobicContact CD1-CB 4.02Å; K24-N27 HydrophobicContact CB-CB 4.38Å; K24-N27 PolarHBondContact O-N 3.19Å; N27-E30 PolarHBondContact O-N 3.43Å; N27-I31 PolarHBondContact O-N 3.4Å
28	A	91.2	Very high	88.5	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.6	-48.4	172.1	0	0	0	0	0	110.9	A16 L19 I20 K24 K25 E30 I31 L32 L58	A16-A28 HydrophobicContact CB-CB 4.28Å; L19-A28 HydrophobicContact CB-CB 3.9Å; I20-A28 HydrophobicContact CG1-CB 4Å; K24-A28 PolarHBondContact O-N 2.87Å; K25-A28 PolarHBondContact O-N 3.28Å; A28-E30 VanDerWaalsContact C-N 3.29Å; A28-E30 PolarHBondContact O-N 3.07Å; A28-I31 PolarHBondContact O-N 2.92Å; A28-L32 WeakPolarHBondContact O-CG 3.43Å; A28-L32 PolarHBondContact O-N 3.45Å; A28-L32 VanDerWaalsContact O-N 3.11Å; A28-L58 HydrophobicContact CB-CD1 3.77Å
29	L	91.5	Very high	87.1	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.8	-40	176.5	-178.5	151.9	0	0	0	112	K25 A26 L32 Y33 F55 L58 C59 L62 K64 H67	K25-L29 PolarHBondContact O-N 3.5Å; A26-L29 PolarHBondContact O-N 3.43Å; L29-L32 PolarHBondContact O-N 2.99Å; L29-Y33 VanDerWaalsContact O-CB 3.22Å; L29-Y33 WeakPolarHBondContact O-CB 3.47Å; L29-Y33 PolarHBondContact O-N 2.86Å; L29-F55 HydrophobicContact CD2-CE2 4.22Å; L29-F55 HydrophobicContact CG-CD2 4.22Å; L29-F55 HydrophobicContact CG-CE2 3.89Å; L29-L58 HydrophobicContact CB-CB 4.16Å; L29-L58 HydrophobicContact CB-CD1 4.17Å; L29-L58 HydrophobicContact CD1-CB 4.05Å; L29-C59 HydrophobicContact CD1-CB 4.5Å; L29-L62 HydrophobicContact CB-CD1 4.42Å; L29-L62 HydrophobicContact CD1-CD1 4.07Å; L29-K64 HydrophobicContact CD1-CB 4.27Å; L29-K64 HydrophobicContact CD1-CD 3.87Å; L29-K64 HydrophobicContact CD2-CD 4.03Å; L29-H67 HydrophobicContact CD2-CB 4.22Å
30	E	90.6	Very high	85.7	Confident	102 Å²	102	74.3 Å²	74.3	48%	0.477	34%	0.343	S	S	.	.	H	α-helix	trans	-67.4	-40.5	178.6	-75.3	178.3	-164.6	0	0	112.9	A26 N27 A28 L32 Y33 E34	A26-E30 PolarHBondContact O-N 2.97Å; A26-E30 VanDerWaalsContact O-N 3.14Å; N27-E30 PolarHBondContact O-N 3.43Å; A28-E30 VanDerWaalsContact C-N 3.29Å; A28-E30 PolarHBondContact O-N 3.07Å; E30-L32 PolarHBondContact O-N 3.47Å; E30-Y33 PolarHBondContact O-N 2.97Å; E30-E34 WeakPolarHBondContact O-CG 3.32Å; E30-E34 PolarHBondContact O-N 2.93Å
31	I	88.6	Confident	84.2	Confident	26 Å²	26	73.7 Å²	73.7	13%	0.133	34%	0.341	C	S	.	.	H	α-helix	trans	-61.1	-45.3	173.6	-70.7	-179.1	0	0	0	111.2	Y6 A12 L19 N27 A28 Y33 E34 V35	Y6-I31 HydrophobicContact CD2-CG2 4.28Å; Y6-I31 HydrophobicContact CE2-CD1 4.46Å; Y6-I31 HydrophobicContact CE2-CG1 4.36Å; Y6-I31 HydrophobicContact CE2-CG2 3.98Å; A12-I31 HydrophobicContact CB-CG2 3.91Å; L19-I31 HydrophobicContact CD1-CD1 3.57Å; N27-I31 PolarHBondContact O-N 3.4Å; A28-I31 PolarHBondContact O-N 2.92Å; I31-Y33 VanDerWaalsContact C-N 3.35Å; I31-E34 PolarHBondContact O-N 3.27Å; I31-V35 PolarHBondContact O-N 3.49Å
32	L	89	Confident	82.9	Confident	0 Å²	0	73 Å²	73	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-65.5	-39.5	177.9	-62	-169	0	0	0	111.8	A16 A28 L29 E30 V35 M36 L51 L54 F55 L58	A16-L32 HydrophobicContact CB-CD1 4.06Å; A16-L32 HydrophobicContact CB-CD2 3.53Å; A16-L32 HydrophobicContact CB-CG 3.79Å; A28-L32 WeakPolarHBondContact O-CG 3.43Å; A28-L32 PolarHBondContact O-N 3.45Å; A28-L32 VanDerWaalsContact O-N 3.11Å; L29-L32 PolarHBondContact O-N 2.99Å; E30-L32 PolarHBondContact O-N 3.47Å; L32-V35 PolarHBondContact O-N 2.94Å; L32-M36 PolarHBondContact O-N 3.18Å; L32-M36 VanDerWaalsContact O-N 3.14Å; L32-L51 HydrophobicContact CB-CD2 4.13Å; L32-L51 HydrophobicContact CD2-CD1 4.27Å; L32-L51 HydrophobicContact CD2-CD2 4.13Å; L32-L51 HydrophobicContact CD2-CG 3.86Å; L32-L54 HydrophobicContact CD1-CB 4.26Å; L32-L54 HydrophobicContact CD1-CD2 4.15Å; L32-L54 HydrophobicContact CD1-CG 4.17Å; L32-F55 HydrophobicContact CB-CB 4.22Å; L32-F55 HydrophobicContact CB-CD2 3.84Å; L32-F55 HydrophobicContact CB-CG 4.42Å; L32-F55 HydrophobicContact CD1-CB 3.86Å; L32-L58 HydrophobicContact CD1-CD1 4.31Å
33	Y	88.4	Confident	82.2	Confident	49 Å²	49	75.9 Å²	75.9	19%	0.192	34%	0.343	C	S	.	.	H	α-helix	trans	-65.1	-37.2	175.6	-176.3	-104	0	0	0	112.9	L29 E30 I31 M36 R37 F55 K70 A71	L29-Y33 VanDerWaalsContact O-CB 3.22Å; L29-Y33 WeakPolarHBondContact O-CB 3.47Å; L29-Y33 PolarHBondContact O-N 2.86Å; E30-Y33 PolarHBondContact O-N 2.97Å; I31-Y33 VanDerWaalsContact C-N 3.35Å; Y33-M36 PolarHBondContact O-N 2.94Å; Y33-R37 PolarHBondContact O-N 3.34Å; Y33-R37 VanDerWaalsContact O-N 3.15Å; Y33-F55 HydrophobicContact CD2-CE2 4.28Å; Y33-F55 HydrophobicContact CD2-CZ 4.1Å; Y33-K70 HydrophobicContact CE2-CB 3.81Å; Y33-K70 WeakPolarHBondContact OH-CB 3.29Å; Y33-K70 WeakPolarHBondContact OH-CD 3.37Å; Y33-A71 HydrophobicContact CD2-CB 4.29Å; Y33-A71 HydrophobicContact CE2-CB 4.49Å
34	E	86	Confident	81.9	Confident	45 Å²	45	72.2 Å²	72.2	21%	0.21	32%	0.319	C	S	.	.	H	α-helix	trans	-61.4	-46.4	174	-74.6	-128.2	112.4	0	0	111.8	E30 I31 M36 R37 V38	E30-E34 WeakPolarHBondContact O-CG 3.32Å; E30-E34 PolarHBondContact O-N 2.93Å; I31-E34 PolarHBondContact O-N 3.27Å; E34-M36 VanDerWaalsContact C-N 3.31Å; E34-M36 PolarHBondContact O-N 3.13Å; E34-R37 WeakPolarHBondContact O-CA 3.44Å; E34-R37 WeakPolarHBondContact O-CB 3.41Å; E34-R37 PolarHBondContact O-N 3.42Å; E34-R37 IonicContact OE1-CZ 3.3Å; E34-R37 IonicContact OE1-NH2 3.3Å; E34-R37 PolarHBondContact OE1-NH2 3.01Å; E34-V38 WeakPolarHBondContact O-CG2 3.46Å; E34-V38 PolarHBondContact O-N 2.87Å
35	V	83.8	Confident	81.5	Confident	9 Å²	9	71 Å²	71	6%	0.055	32%	0.316	C	S	.	.	H	α-helix	trans	-60.1	-42.9	177	174	0	0	0	0	111.2	Y6 A12 I31 L32 R37 V38 L51	Y6-V35 HydrophobicContact CG-CG2 4.49Å; A12-V35 HydrophobicContact CB-CG2 3.47Å; A12-V35 VanDerWaalsContact CB-CG2 3.47Å; I31-V35 PolarHBondContact O-N 3.49Å; L32-V35 PolarHBondContact O-N 2.94Å; V35-R37 PolarHBondContact O-N 3.16Å; V35-R37 VanDerWaalsContact O-N 3.17Å; V35-V38 PolarHBondContact O-N 3.23Å; V35-L51 HydrophobicContact CG1-CD1 4.04Å
36	M	82.6	Confident	81.2	Confident	3 Å²	3	75.5 Å²	75.5	2%	0.015	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-8.7	175.3	-69.2	-52.8	-50.4	0	0	114.6	L32 Y33 E34 L51 M52 A71 Y75 M78	L32-M36 PolarHBondContact O-N 3.18Å; L32-M36 VanDerWaalsContact O-N 3.14Å; Y33-M36 PolarHBondContact O-N 2.94Å; E34-M36 VanDerWaalsContact C-N 3.31Å; E34-M36 PolarHBondContact O-N 3.13Å; M36-L51 HydrophobicContact CG-CD2 4.15Å; M36-L51 HydrophobicContact SD-CD2 4.28Å; M36-M52 HydrophobicContact CE-CE 3.65Å; M36-M52 HydrophobicContact CG-CE 3.72Å; M36-M52 HydrophobicContact SD-CE 3.59Å; M36-M52 VanDerWaalsContact SD-CE 3.59Å; M36-A71 HydrophobicContact CB-CB 4.22Å; M36-A71 HydrophobicContact CG-CB 4.49Å; M36-Y75 HydrophobicContact CE-CD2 3.9Å; M36-Y75 HydrophobicContact CE-CG 4.41Å; M36-M78 HydrophobicContact CE-CE 4.16Å; M36-M78 HydrophobicContact CE-SD 3.93Å
37	R	80.5	Confident	81	Confident	124 Å²	124	75.4 Å²	75.4	47%	0.468	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-21	175.3	-172.1	176.8	66.8	157.2	-3.4	113.1	Y33 E34 V35 R39	Y33-R37 PolarHBondContact O-N 3.34Å; Y33-R37 VanDerWaalsContact O-N 3.15Å; E34-R37 WeakPolarHBondContact O-CA 3.44Å; E34-R37 WeakPolarHBondContact O-CB 3.41Å; E34-R37 PolarHBondContact O-N 3.42Å; E34-R37 IonicContact OE1-CZ 3.3Å; E34-R37 IonicContact OE1-NH2 3.3Å; E34-R37 PolarHBondContact OE1-NH2 3.01Å; V35-R37 PolarHBondContact O-N 3.16Å; V35-R37 VanDerWaalsContact O-N 3.17Å; R37-R39 PolarHBondContact O-N 2.91Å
38	V	73.3	Confident	80.9	Confident	42 Å²	42	71.4 Å²	71.4	26%	0.255	31%	0.309	S	S	.	.			trans	-76.6	116.1	-174.5	172	0	0	0	0	111.2	E34 V35 R40 T41	E34-V38 WeakPolarHBondContact O-CG2 3.46Å; E34-V38 PolarHBondContact O-N 2.87Å; V35-V38 PolarHBondContact O-N 3.23Å; V38-R40 HydrophobicContact CG1-CB 4.02Å; V38-R40 HydrophobicContact CG1-CG 4.14Å; V38-R40 PolarHBondContact O-N 2.94Å; V38-T41 PolarHBondContact O-N 3.33Å; V38-T41 PolarHBondContact O-OG1 2.89Å; V38-T41 VanDerWaalsContact O-OG1 3.1Å
39	R	62.2	Low	80.8	Confident	234 Å²	234	73.9 Å²	73.9	88%	0.883	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	2.2	-177.7	-68.8	-176	174.8	-179.3	-1.3	116.7	R37	R37-R39 PolarHBondContact O-N 2.91Å
40	R	61.3	Low	80.8	Confident	195 Å²	195	78.1 Å²	78.1	74%	0.736	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-29	-177.8	-66.3	-175.4	177.2	176.7	-1.3	113	H7 V38 K42	H7-R40 PolarHBondContact NE2-NH1 3.33Å; V38-R40 HydrophobicContact CG1-CB 4.02Å; V38-R40 HydrophobicContact CG1-CG 4.14Å; V38-R40 PolarHBondContact O-N 2.94Å; R40-K42 PolarHBondContact O-N 2.85Å
41	T	61.1	Low	80.8	Confident	30 Å²	30	73.3 Å²	73.3	18%	0.184	32%	0.318	C	S	.	.			trans	-79.6	50.4	-179.4	42	0	0	0	0	112.6	V38 Q43 M78	V38-T41 PolarHBondContact O-N 3.33Å; V38-T41 PolarHBondContact O-OG1 2.89Å; V38-T41 VanDerWaalsContact O-OG1 3.1Å; T41-Q43 PolarHBondContact O-N 3.18Å; T41-M78 WeakPolarHBondContact O-CE 3.33Å
42	K	64.9	Low	80.9	Confident	168 Å²	168	72 Å²	72	73%	0.73	31%	0.312	S	S	*	.			trans	-68.2	-33.8	-174.6	-76.7	-170.3	175.1	-176.5	0	114.6	R40	R40-K42 PolarHBondContact O-N 2.85Å
43	Q	76.6	Confident	81.1	Confident	141 Å²	141	74.7 Å²	74.7	66%	0.659	33%	0.325	S	S	*	.	S	Bend	trans	-87.7	142.6	177.7	-69.2	172.8	-50.4	0	0	109.8	T41	T41-Q43 PolarHBondContact O-N 3.18Å
44	W	82.8	Confident	81.3	Confident	55 Å²	55	73.3 Å²	73.3	21%	0.208	32%	0.321	C	S	.	.			trans	-74.2	147.3	175.4	177	97	0	0	0	110.3	K46 Y75 E82 N83 S86	W44-K46 HydrophobicContact CH2-CB 4.32Å; W44-Y75 AromaticContact NE1-CZ 3.95Å; W44-Y75 PolarHBondContact NE1-OH 2.82Å; W44-E82 WeakPolarHBondContact CA-OE2 3.32Å; W44-E82 HydrophobicContact CB-CB 4.24Å; W44-E82 WeakPolarHBondContact CB-OE2 3.44Å; W44-E82 PolarHBondContact N-OE2 3.02Å; W44-N83 HydrophobicContact CD2-CB 4.17Å; W44-N83 HydrophobicContact CE3-CB 4.28Å; W44-N83 HydrophobicContact CH2-CB 4.48Å; W44-N83 WeakPolarHBondContact CH2-ND2 3.42Å; W44-N83 HydrophobicContact CZ2-CB 4.35Å; W44-N83 VanDerWaalsContact CZ2-ND2 3.28Å; W44-N83 WeakPolarHBondContact CZ2-ND2 3.33Å; W44-N83 HydrophobicContact CZ3-CB 4.43Å; W44-S86 WeakPolarHBondContact CZ2-OG 3.36Å; W44-S86 PolarHBondContact NE1-OG 2.89Å
45	Q	83.4	Confident	81.6	Confident	93 Å²	93	71.1 Å²	71.1	44%	0.435	31%	0.311	S	S	.	.			trans	-143.7	145.5	178.9	-63.7	-178.1	-16.2	0	0	107.8	V47 L48	Q45-V47 PolarHBondContact O-N 3.39Å; Q45-V47 VanDerWaalsContact O-N 3.12Å; Q45-L48 HydrophobicContact CB-CD1 4.38Å; Q45-L48 HydrophobicContact CB-CG 4.31Å; Q45-L48 WeakPolarHBondContact O-CA 3.48Å; Q45-L48 VanDerWaalsContact O-CB 3.32Å; Q45-L48 WeakPolarHBondContact O-CB 3.32Å; Q45-L48 PolarHBondContact O-N 3.24Å
46	K	85.8	Confident	82.1	Confident	149 Å²	149	70.7 Å²	70.7	65%	0.648	31%	0.308	S	S	*	.	H	α-helix	trans	-55.3	-34.2	179.9	-171.9	177.4	177	-177	0	113	W44 L48 E49 E50	W44-K46 HydrophobicContact CH2-CB 4.32Å; K46-L48 PolarHBondContact O-N 3.14Å; K46-E49 WeakPolarHBondContact O-CB 3.44Å; K46-E49 PolarHBondContact O-N 3.28Å; K46-E50 PolarHBondContact O-N 3.2Å
47	V	87.6	Confident	82.6	Confident	35 Å²	35	75 Å²	75	21%	0.212	33%	0.328	C	S	.	.	H	α-helix	trans	-60.4	-29.6	175.2	-174.6	0	0	0	0	112.4	P9 E10 L13 Q45 E49 L51	P9-V47 HydrophobicContact CB-CG1 4.15Å; P9-V47 HydrophobicContact CG-CB 4.39Å; P9-V47 HydrophobicContact CG-CG1 4.14Å; E10-V47 HydrophobicContact CG-CG1 4Å; E10-V47 HydrophobicContact CG-CG2 4.25Å; L13-V47 HydrophobicContact CD1-CG1 4.29Å; Q45-V47 PolarHBondContact O-N 3.39Å; Q45-V47 VanDerWaalsContact O-N 3.12Å; V47-E49 VanDerWaalsContact C-N 3.31Å; V47-L51 VanDerWaalsContact O-CB 3.27Å; V47-L51 WeakPolarHBondContact O-CB 3.4Å; V47-L51 PolarHBondContact O-N 3.45Å
48	L	87.2	Confident	83.2	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-72.5	-23.4	175.6	-61.8	174.1	0	0	0	112.6	P9 Q45 K46 M52 Y75	P9-L48 HydrophobicContact CB-CD2 3.81Å; P9-L48 HydrophobicContact CG-CD2 4.35Å; Q45-L48 HydrophobicContact CB-CD1 4.38Å; Q45-L48 HydrophobicContact CB-CG 4.31Å; Q45-L48 WeakPolarHBondContact O-CA 3.48Å; Q45-L48 VanDerWaalsContact O-CB 3.32Å; Q45-L48 WeakPolarHBondContact O-CB 3.32Å; Q45-L48 PolarHBondContact O-N 3.24Å; K46-L48 PolarHBondContact O-N 3.14Å; L48-M52 WeakPolarHBondContact O-CB 3.47Å; L48-M52 PolarHBondContact O-N 3.09Å; L48-Y75 HydrophobicContact CB-CE2 4.11Å
49	E	90	Very high	84.2	Confident	51 Å²	51	67.2 Å²	67.2	24%	0.238	29%	0.294	C	S	.	.	H	α-helix	trans	-71	-50	170.9	-170	176.9	129.9	0	0	110.6	K46 V47 L51 M52 M53 Y75 S86	K46-E49 WeakPolarHBondContact O-CB 3.44Å; K46-E49 PolarHBondContact O-N 3.28Å; V47-E49 VanDerWaalsContact C-N 3.31Å; E49-L51 VanDerWaalsContact C-N 3.28Å; E49-L51 PolarHBondContact O-N 2.97Å; E49-M52 PolarHBondContact O-N 3.01Å; E49-M52 VanDerWaalsContact O-N 3.12Å; E49-M53 VanDerWaalsContact O-CG 3.25Å; E49-M53 WeakPolarHBondContact O-CG 3.09Å; E49-M53 PolarHBondContact O-N 3.3Å; E49-Y75 WeakPolarHBondContact CA-OH 3.31Å; E49-S86 WeakPolarHBondContact CG-OG 3.19Å; E49-S86 VanDerWaalsContact OE2-CB 3.22Å; E49-S86 WeakPolarHBondContact OE2-CB 3.32Å; E49-S86 PolarHBondContact OE2-OG 2.97Å
50	E	90.6	Very high	85.7	Confident	90 Å²	90	56.2 Å²	56.2	42%	0.421	25%	0.253	S	S	.	.	H	α-helix	trans	-57.8	-40.9	173.9	-71.7	-173.3	-134.2	0	0	112.4	L13 R17 K46 M53 L54	L13-E50 HydrophobicContact CD1-CB 3.78Å; R17-E50 IonicContact NH2-OE2 3.86Å; R17-E50 PolarHBondContact NH2-OE2 2.93Å; K46-E50 PolarHBondContact O-N 3.2Å; E50-M53 PolarHBondContact O-N 2.82Å; E50-L54 PolarHBondContact O-N 3.11Å; E50-L54 VanDerWaalsContact O-N 3.1Å
51	L	91.1	Very high	87.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.5	-44.5	175.9	-168.4	156.5	0	0	0	111.2	P9 L13 L32 V35 M36 V47 E49 F55	P9-L51 HydrophobicContact CB-CD1 4.06Å; L13-L51 HydrophobicContact CD1-CB 4.31Å; L32-L51 HydrophobicContact CB-CD2 4.13Å; L32-L51 HydrophobicContact CD2-CD1 4.27Å; L32-L51 HydrophobicContact CD2-CD2 4.13Å; L32-L51 HydrophobicContact CD2-CG 3.86Å; V35-L51 HydrophobicContact CG1-CD1 4.04Å; M36-L51 HydrophobicContact CG-CD2 4.15Å; M36-L51 HydrophobicContact SD-CD2 4.28Å; V47-L51 VanDerWaalsContact O-CB 3.27Å; V47-L51 WeakPolarHBondContact O-CB 3.4Å; V47-L51 PolarHBondContact O-N 3.45Å; E49-L51 VanDerWaalsContact C-N 3.28Å; E49-L51 PolarHBondContact O-N 2.97Å; L51-F55 VanDerWaalsContact O-CB 3.24Å; L51-F55 WeakPolarHBondContact O-CB 3.42Å; L51-F55 PolarHBondContact O-N 2.78Å
52	M	91.3	Very high	88.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-69.8	-35.7	179.9	-172.2	58	50.5	0	0	112.4	M36 L48 E49 F55 V56 A71 I72 Y75 V90	M36-M52 HydrophobicContact CE-CE 3.65Å; M36-M52 HydrophobicContact CG-CE 3.72Å; M36-M52 HydrophobicContact SD-CE 3.59Å; M36-M52 VanDerWaalsContact SD-CE 3.59Å; L48-M52 WeakPolarHBondContact O-CB 3.47Å; L48-M52 PolarHBondContact O-N 3.09Å; E49-M52 PolarHBondContact O-N 3.01Å; E49-M52 VanDerWaalsContact O-N 3.12Å; M52-F55 HydrophobicContact CE-CD1 4.45Å; M52-F55 PolarHBondContact O-N 3.02Å; M52-F55 HydrophobicContact SD-CD1 3.76Å; M52-F55 HydrophobicContact SD-CE1 4.43Å; M52-V56 WeakPolarHBondContact O-CB 3.31Å; M52-V56 WeakPolarHBondContact O-CG2 3.38Å; M52-V56 PolarHBondContact O-N 3.1Å; M52-A71 HydrophobicContact CE-CB 4.49Å; M52-I72 HydrophobicContact SD-CD1 4.3Å; M52-Y75 HydrophobicContact CB-CE2 4.25Å; M52-Y75 HydrophobicContact CE-CD2 3.88Å; M52-Y75 HydrophobicContact CE-CG 3.92Å; M52-Y75 HydrophobicContact CG-CD1 4.17Å; M52-Y75 HydrophobicContact CG-CD2 4.5Å; M52-Y75 HydrophobicContact CG-CE1 4.22Å; M52-Y75 HydrophobicContact CG-CG 4.31Å; M52-V90 HydrophobicContact CB-CG2 4.02Å; M52-V90 HydrophobicContact CG-CB 4.2Å; M52-V90 HydrophobicContact CG-CG1 3.43Å; M52-V90 VanDerWaalsContact CG-CG1 3.43Å; M52-V90 HydrophobicContact CG-CG2 3.66Å; M52-V90 HydrophobicContact SD-CG1 4.37Å
53	M	93.2	Very high	89.8	Confident	55 Å²	55	49.6 Å²	49.6	27%	0.271	23%	0.228	S	C	.	.	H	α-helix	trans	-64.4	-45.9	174.7	-69.5	-72.5	-72.2	0	0	111.6	E49 E50 F55 V56 E57 V90 S93	E49-M53 VanDerWaalsContact O-CG 3.25Å; E49-M53 WeakPolarHBondContact O-CG 3.09Å; E49-M53 PolarHBondContact O-N 3.3Å; E50-M53 PolarHBondContact O-N 2.82Å; M53-F55 VanDerWaalsContact C-N 3.33Å; M53-F55 PolarHBondContact O-N 3.15Å; M53-V56 WeakPolarHBondContact O-CB 3.5Å; M53-V56 PolarHBondContact O-N 3.23Å; M53-E57 PolarHBondContact O-N 2.85Å; M53-E57 VanDerWaalsContact O-N 3.07Å; M53-V90 HydrophobicContact CG-CG2 4.47Å; M53-V90 HydrophobicContact SD-CG2 4.25Å; M53-S93 WeakPolarHBondContact CE-OG 3.38Å
54	L	92	Very high	90.4	Very high	20 Å²	20	45.3 Å²	45.3	11%	0.105	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-35.9	174.6	-170.7	66.9	0	0	0	112.1	A16 R17 I20 L32 E50 E57 L58	A16-L54 HydrophobicContact CB-CD2 4.14Å; R17-L54 HydrophobicContact CG-CD2 3.88Å; I20-L54 HydrophobicContact CD1-CD1 3.71Å; I20-L54 HydrophobicContact CD1-CD2 4.16Å; I20-L54 HydrophobicContact CD1-CG 4.09Å; L32-L54 HydrophobicContact CD1-CB 4.26Å; L32-L54 HydrophobicContact CD1-CD2 4.15Å; L32-L54 HydrophobicContact CD1-CG 4.17Å; E50-L54 PolarHBondContact O-N 3.11Å; E50-L54 VanDerWaalsContact O-N 3.1Å; L54-E57 PolarHBondContact O-N 2.91Å; L54-L58 WeakPolarHBondContact O-CG 3.49Å; L54-L58 PolarHBondContact O-N 2.69Å
55	F	92.9	Very high	90.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-69.5	-35.1	175.1	174.3	-98.8	0	0	0	112.7	L29 L32 Y33 L51 M52 M53 C59 H67 F68 A71	L29-F55 HydrophobicContact CD2-CE2 4.22Å; L29-F55 HydrophobicContact CG-CD2 4.22Å; L29-F55 HydrophobicContact CG-CE2 3.89Å; L32-F55 HydrophobicContact CB-CB 4.22Å; L32-F55 HydrophobicContact CB-CD2 3.84Å; L32-F55 HydrophobicContact CB-CG 4.42Å; L32-F55 HydrophobicContact CD1-CB 3.86Å; Y33-F55 HydrophobicContact CD2-CE2 4.28Å; Y33-F55 HydrophobicContact CD2-CZ 4.1Å; L51-F55 VanDerWaalsContact O-CB 3.24Å; L51-F55 WeakPolarHBondContact O-CB 3.42Å; L51-F55 PolarHBondContact O-N 2.78Å; M52-F55 HydrophobicContact CE-CD1 4.45Å; M52-F55 PolarHBondContact O-N 3.02Å; M52-F55 HydrophobicContact SD-CD1 3.76Å; M52-F55 HydrophobicContact SD-CE1 4.43Å; M53-F55 VanDerWaalsContact C-N 3.33Å; M53-F55 PolarHBondContact O-N 3.15Å; F55-C59 VanDerWaalsContact CE1-SG 3.57Å; F55-C59 WeakPolarHBondContact CZ-SG 3.36Å; F55-C59 WeakPolarHBondContact O-CB 3.43Å; F55-C59 PolarHBondContact O-N 3.42Å; F55-C59 PolarHBondContact O-SG 3.44Å; F55-H67 HydrophobicContact CZ-CB 4.29Å; F55-F68 HydrophobicContact CE1-CD2 4.32Å; F55-A71 HydrophobicContact CD1-CB 4.23Å; F55-A71 HydrophobicContact CE1-CB 3.36Å; F55-A71 HydrophobicContact CZ-CB 3.61Å
56	V	94	Very high	90.9	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60	-51	171	154	0	0	0	0	110.4	M52 M53 L58 C59 V60 F68 V90 Y94	M52-V56 WeakPolarHBondContact O-CB 3.31Å; M52-V56 WeakPolarHBondContact O-CG2 3.38Å; M52-V56 PolarHBondContact O-N 3.1Å; M53-V56 WeakPolarHBondContact O-CB 3.5Å; M53-V56 PolarHBondContact O-N 3.23Å; V56-L58 PolarHBondContact O-N 3.23Å; V56-C59 WeakPolarHBondContact O-CA 3.35Å; V56-C59 WeakPolarHBondContact O-CB 3.18Å; V56-C59 PolarHBondContact O-N 2.96Å; V56-V60 WeakPolarHBondContact O-CG2 3.44Å; V56-V60 PolarHBondContact O-N 3.22Å; V56-F68 HydrophobicContact CG2-CD2 4.02Å; V56-F68 HydrophobicContact CG2-CE2 3.54Å; V56-F68 HydrophobicContact CG2-CZ 4.49Å; V56-V90 HydrophobicContact CG2-CG1 4.08Å; V56-Y94 HydrophobicContact CG1-CD2 4.12Å; V56-Y94 HydrophobicContact CG1-CG 4.49Å; V56-Y94 HydrophobicContact CG2-CD2 4.19Å
57	E	93.5	Very high	91.1	Very high	93 Å²	93	40.5 Å²	40.5	44%	0.435	19%	0.192	S	C	.	.	H	α-helix	trans	-54.1	-52.8	179.6	-173.3	174	-153.7	0	0	111.5	M53 L54 C59 V60 E61 Q97	M53-E57 PolarHBondContact O-N 2.85Å; M53-E57 VanDerWaalsContact O-N 3.07Å; L54-E57 PolarHBondContact O-N 2.91Å; E57-C59 VanDerWaalsContact C-N 3.3Å; E57-C59 PolarHBondContact O-N 3.19Å; E57-V60 PolarHBondContact O-N 2.76Å; E57-V60 VanDerWaalsContact O-N 3.16Å; E57-E61 PolarHBondContact O-N 2.85Å; E57-Q97 VanDerWaalsContact CA-OE1 3.31Å
58	L	92.6	Very high	91.4	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-62.8	-32.5	175.4	-64.5	175.5	0	0	0	113.6	I20 K25 A28 L29 L32 L54 V56 L62	I20-L58 HydrophobicContact CD1-CD1 4.15Å; I20-L58 HydrophobicContact CD1-CD2 4.06Å; I20-L58 HydrophobicContact CD1-CG 4.36Å; I20-L58 HydrophobicContact CG1-CD1 4.49Å; I20-L58 HydrophobicContact CG1-CD2 4.02Å; K25-L58 HydrophobicContact CB-CD2 3.92Å; K25-L58 HydrophobicContact CD-CD2 4.47Å; K25-L58 HydrophobicContact CG-CD2 4.06Å; A28-L58 HydrophobicContact CB-CD1 3.77Å; L29-L58 HydrophobicContact CB-CB 4.16Å; L29-L58 HydrophobicContact CB-CD1 4.17Å; L29-L58 HydrophobicContact CD1-CB 4.05Å; L32-L58 HydrophobicContact CD1-CD1 4.31Å; L54-L58 WeakPolarHBondContact O-CG 3.49Å; L54-L58 PolarHBondContact O-N 2.69Å; V56-L58 PolarHBondContact O-N 3.23Å; L58-L62 VanDerWaalsContact O-CB 3.28Å; L58-L62 WeakPolarHBondContact O-CB 3.37Å; L58-L62 WeakPolarHBondContact O-CG 3.13Å; L58-L62 PolarHBondContact O-N 3.45Å; L58-L62 VanDerWaalsContact O-N 3.14Å
59	C	93.3	Very high	91.6	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.007	20%	0.204	C	C	.	.	H	α-helix	trans	-69.9	-34.7	176	-78.2	0	0	0	0	112.5	L29 F55 V56 E57 R63 K64 F68	L29-C59 HydrophobicContact CD1-CB 4.5Å; F55-C59 VanDerWaalsContact CE1-SG 3.57Å; F55-C59 WeakPolarHBondContact CZ-SG 3.36Å; F55-C59 WeakPolarHBondContact O-CB 3.43Å; F55-C59 PolarHBondContact O-N 3.42Å; F55-C59 PolarHBondContact O-SG 3.44Å; V56-C59 WeakPolarHBondContact O-CA 3.35Å; V56-C59 WeakPolarHBondContact O-CB 3.18Å; V56-C59 PolarHBondContact O-N 2.96Å; E57-C59 VanDerWaalsContact C-N 3.3Å; E57-C59 PolarHBondContact O-N 3.19Å; C59-R63 CarbonylContact O-C 3.08Å; C59-R63 WeakPolarHBondContact O-CA 3.26Å; C59-R63 PolarHBondContact O-N 3.39Å; C59-K64 PolarHBondContact O-N 3.48Å; C59-F68 HydrophobicContact CB-CB 4.16Å
60	V	93.6	Very high	91.6	Very high	2 Å²	2	48 Å²	48	1%	0.012	22%	0.218	C	C	.	.	H	α-helix	trans	-73	-50.4	177.5	173.7	0	0	0	0	110.5	V56 E57 L62 R63 Y94 Q97 I98 K101 F153	V56-V60 WeakPolarHBondContact O-CG2 3.44Å; V56-V60 PolarHBondContact O-N 3.22Å; E57-V60 PolarHBondContact O-N 2.76Å; E57-V60 VanDerWaalsContact O-N 3.16Å; V60-L62 PolarHBondContact O-N 2.91Å; V60-R63 PolarHBondContact O-N 2.85Å; V60-R63 VanDerWaalsContact O-N 3.15Å; V60-Y94 HydrophobicContact CG2-CD2 4.13Å; V60-Y94 HydrophobicContact CG2-CE2 4.34Å; V60-Q97 HydrophobicContact CG1-CB 4.22Å; V60-Q97 HydrophobicContact CG2-CB 4.21Å; V60-I98 HydrophobicContact CB-CG1 4.3Å; V60-I98 HydrophobicContact CG1-CG1 3.85Å; V60-I98 HydrophobicContact CG2-CD1 4.02Å; V60-I98 HydrophobicContact CG2-CG1 3.52Å; V60-K101 HydrophobicContact CG1-CG 4.23Å; V60-F153 HydrophobicContact CG1-CE1 4.49Å
61	E	91.2	Very high	91.6	Very high	79 Å²	79	43.7 Å²	43.7	37%	0.369	20%	0.198	S	C	.	.	H	α-helix	trans	-56.7	-47.6	177.6	-70.4	-166.2	122.4	0	0	112.4	K25 E57 R63	K25-E61 VanDerWaalsContact CD-OE2 3.32Å; K25-E61 WeakPolarHBondContact CD-OE2 3.28Å; K25-E61 WeakPolarHBondContact CE-OE2 3.48Å; K25-E61 IonicContact NZ-OE1 3.03Å; K25-E61 PolarHBondContact NZ-OE1 3.46Å; K25-E61 IonicContact NZ-OE2 2.62Å; K25-E61 PolarHBondContact NZ-OE2 2.84Å; E57-E61 PolarHBondContact O-N 2.85Å; E61-R63 VanDerWaalsContact C-N 3.25Å; E61-R63 PolarHBondContact O-N 3.01Å
62	L	91.5	Very high	91.7	Very high	63 Å²	63	43.7 Å²	43.7	33%	0.33	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	6	-178	-59	173.8	0	0	0	113.4	K25 A26 L29 L58 V60 K64	K25-L62 HydrophobicContact CB-CD1 4.29Å; K25-L62 HydrophobicContact CB-CD2 4.49Å; A26-L62 HydrophobicContact CB-CD1 4.4Å; L29-L62 HydrophobicContact CB-CD1 4.42Å; L29-L62 HydrophobicContact CD1-CD1 4.07Å; L58-L62 VanDerWaalsContact O-CB 3.28Å; L58-L62 WeakPolarHBondContact O-CB 3.37Å; L58-L62 WeakPolarHBondContact O-CG 3.13Å; L58-L62 PolarHBondContact O-N 3.45Å; L58-L62 VanDerWaalsContact O-N 3.14Å; V60-L62 PolarHBondContact O-N 2.91Å; L62-K64 HydrophobicContact CB-CD 4.11Å; L62-K64 HydrophobicContact CB-CG 4.11Å; L62-K64 HydrophobicContact CD1-CD 4.45Å; L62-K64 PolarHBondContact O-N 2.79Å; L62-K64 VanDerWaalsContact O-N 3.14Å
63	R	91.1	Very high	91.6	Very high	112 Å²	112	47 Å²	47	42%	0.423	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	34.9	-176.1	-57.3	-175.5	-172.2	151.8	2.8	114.7	C59 V60 E61 N65 W150 F153	C59-R63 CarbonylContact O-C 3.08Å; C59-R63 WeakPolarHBondContact O-CA 3.26Å; C59-R63 PolarHBondContact O-N 3.39Å; V60-R63 PolarHBondContact O-N 2.85Å; V60-R63 VanDerWaalsContact O-N 3.15Å; E61-R63 VanDerWaalsContact C-N 3.25Å; E61-R63 PolarHBondContact O-N 3.01Å; R63-N65 PolarHBondContact O-N 3.37Å; R63-W150 HydrophobicContact CG-CE3 4.5Å; R63-W150 HydrophobicContact CG-CH2 4.12Å; R63-W150 HydrophobicContact CG-CZ3 3.91Å; R63-W150 VanDerWaalsContact NH2-CZ2 3.28Å; R63-F153 VanDerWaalsContact CA-CZ 3.49Å; R63-F153 HydrophobicContact CB-CD2 3.94Å; R63-F153 HydrophobicContact CB-CE2 3.78Å; R63-F153 HydrophobicContact CB-CG 4.45Å; R63-F153 HydrophobicContact CB-CZ 4.16Å; R63-F153 HydrophobicContact CG-CD1 4.49Å; R63-F153 HydrophobicContact CG-CD2 4.48Å; R63-F153 HydrophobicContact CG-CE1 4.47Å; R63-F153 HydrophobicContact CG-CE2 4.48Å; R63-F153 VanDerWaalsContact O-CE2 3.31Å; R63-F153 WeakPolarHBondContact O-CE2 3.41Å
64	K	89.6	Confident	91.3	Very high	52 Å²	52	46.9 Å²	46.9	23%	0.226	21%	0.214	C	C	.	.			trans	-90.4	51.3	-169.1	-87.6	-176.8	176.9	-171.7	0	114.4	L29 C59 L62 I66 H67 F68	L29-K64 HydrophobicContact CD1-CB 4.27Å; L29-K64 HydrophobicContact CD1-CD 3.87Å; L29-K64 HydrophobicContact CD2-CD 4.03Å; C59-K64 PolarHBondContact O-N 3.48Å; L62-K64 HydrophobicContact CB-CD 4.11Å; L62-K64 HydrophobicContact CB-CG 4.11Å; L62-K64 HydrophobicContact CD1-CD 4.45Å; L62-K64 PolarHBondContact O-N 2.79Å; L62-K64 VanDerWaalsContact O-N 3.14Å; K64-I66 PolarHBondContact O-N 3.33Å; K64-H67 HydrophobicContact CB-CB 4.33Å; K64-H67 WeakPolarHBondContact O-CB 3.38Å; K64-H67 PolarHBondContact O-N 3.44Å; K64-F68 PolarHBondContact O-N 2.87Å
65	N	88	Confident	91.2	Very high	23 Å²	23	46 Å²	46	12%	0.123	21%	0.209	C	C	.	.	H	α-helix	trans	-44.9	-38.5	-178.2	-91.1	-4.8	0	0	0	115.3	R63 H67 F68 R69 Y94 F153 S157	R63-N65 PolarHBondContact O-N 3.37Å; N65-H67 VanDerWaalsContact C-N 3.32Å; N65-H67 PolarHBondContact O-N 3.36Å; N65-F68 PolarHBondContact O-N 2.93Å; N65-R69 WeakPolarHBondContact O-CB 3.24Å; N65-R69 PolarHBondContact O-N 2.67Å; N65-Y94 PolarHBondContact OD1-OH 2.95Å; N65-F153 HydrophobicContact CB-CD2 4.45Å; N65-F153 HydrophobicContact CB-CE2 4.05Å; N65-F153 VanDerWaalsContact ND2-CD2 3.35Å; N65-F153 WeakPolarHBondContact ND2-CD2 3.33Å; N65-F153 PolarHBondContact ND2-O 3Å; N65-F153 WeakPolarHBondContact OD1-CE2 3.32Å; N65-F153 WeakPolarHBondContact OD1-CZ 3.13Å; N65-S157 PolarHBondContact OD1-OG 3.47Å
66	I	89.6	Confident	91	Very high	117 Å²	117	47.6 Å²	47.6	60%	0.6	22%	0.216	S	C	*	.	H	α-helix	trans	-66.9	-32.4	-179	-59.2	174.2	0	0	0	112.2	K64 K70	K64-I66 PolarHBondContact O-N 3.33Å; I66-K70 WeakPolarHBondContact O-CG 3.46Å; I66-K70 PolarHBondContact O-N 3.5Å
67	H	89.8	Confident	90.5	Very high	55 Å²	55	53.5 Å²	53.5	26%	0.255	25%	0.247	S	C	.	.	H	α-helix	trans	-74.8	-46.8	177.2	-63.8	80.7	0	0	0	110.1	L29 F55 K64 N65 R69 K70 A71	L29-H67 HydrophobicContact CD2-CB 4.22Å; F55-H67 HydrophobicContact CZ-CB 4.29Å; K64-H67 HydrophobicContact CB-CB 4.33Å; K64-H67 WeakPolarHBondContact O-CB 3.38Å; K64-H67 PolarHBondContact O-N 3.44Å; N65-H67 VanDerWaalsContact C-N 3.32Å; N65-H67 PolarHBondContact O-N 3.36Å; H67-R69 VanDerWaalsContact C-N 3.33Å; H67-R69 PolarHBondContact O-N 2.92Å; H67-K70 PolarHBondContact O-N 2.96Å; H67-A71 PolarHBondContact O-N 3.26Å
68	F	92.8	Very high	90.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-53.8	-49.9	173.3	-179.9	-108.5	0	0	0	111.4	F55 V56 C59 K64 N65 K70 A71 I72 Y94 L160	F55-F68 HydrophobicContact CE1-CD2 4.32Å; V56-F68 HydrophobicContact CG2-CD2 4.02Å; V56-F68 HydrophobicContact CG2-CE2 3.54Å; V56-F68 HydrophobicContact CG2-CZ 4.49Å; C59-F68 HydrophobicContact CB-CB 4.16Å; K64-F68 PolarHBondContact O-N 2.87Å; N65-F68 PolarHBondContact O-N 2.93Å; F68-K70 PolarHBondContact O-N 3.02Å; F68-A71 PolarHBondContact O-N 3Å; F68-I72 HydrophobicContact CD1-CG2 4.25Å; F68-I72 HydrophobicContact CD2-CB 4.42Å; F68-I72 HydrophobicContact CE1-CB 4.16Å; F68-I72 HydrophobicContact CE1-CG1 4.3Å; F68-I72 HydrophobicContact CE1-CG2 3.93Å; F68-I72 HydrophobicContact CE2-CB 3.94Å; F68-I72 HydrophobicContact CE2-CD1 3.94Å; F68-I72 HydrophobicContact CE2-CG1 4.07Å; F68-I72 HydrophobicContact CZ-CB 3.81Å; F68-I72 HydrophobicContact CZ-CD1 3.89Å; F68-I72 HydrophobicContact CZ-CG1 3.68Å; F68-I72 HydrophobicContact CZ-CG2 4.1Å; F68-I72 WeakPolarHBondContact O-CB 3.28Å; F68-I72 VanDerWaalsContact O-CG2 3.3Å; F68-I72 WeakPolarHBondContact O-CG2 3.49Å; F68-I72 PolarHBondContact O-N 2.87Å; F68-Y94 HydrophobicContact CB-CE2 4.02Å; F68-Y94 HydrophobicContact CD1-CD1 4.24Å; F68-Y94 AromaticContact CD1-CD2 3.89Å; F68-Y94 HydrophobicContact CD1-CD2 3.89Å; F68-Y94 AromaticContact CD1-CE1 3.71Å; F68-Y94 HydrophobicContact CD1-CE1 3.71Å; F68-Y94 AromaticContact CD1-CE2 3.3Å; F68-Y94 HydrophobicContact CD1-CE2 3.3Å; F68-Y94 HydrophobicContact CD1-CG 4.31Å; F68-Y94 AromaticContact CD1-CZ 3.2Å; F68-Y94 WeakPolarHBondContact CD1-OH 3.37Å; F68-Y94 AromaticContact CD2-CD2 3.84Å; F68-Y94 HydrophobicContact CD2-CD2 3.84Å; F68-Y94 AromaticContact CD2-CE2 3.83Å; F68-Y94 HydrophobicContact CD2-CE2 3.83Å; F68-Y94 AromaticContact CE1-CD1 3.58Å; F68-Y94 HydrophobicContact CE1-CD1 3.58Å; F68-Y94 AromaticContact CE1-CD2 3.78Å; F68-Y94 HydrophobicContact CE1-CD2 3.78Å; F68-Y94 AromaticContact CE1-CE1 3.41Å; F68-Y94 HydrophobicContact CE1-CE1 3.41Å; F68-Y94 VanDerWaalsContact CE1-CE1 3.41Å; F68-Y94 AromaticContact CE1-CE2 3.62Å; F68-Y94 HydrophobicContact CE1-CE2 3.62Å; F68-Y94 AromaticContact CE1-CG 3.75Å; F68-Y94 HydrophobicContact CE1-CG 3.75Å; F68-Y94 AromaticContact CE1-CZ 3.44Å; F68-Y94 VanDerWaalsContact CE1-CZ 3.44Å; F68-Y94 AromaticContact CE2-CD2 3.75Å; F68-Y94 HydrophobicContact CE2-CD2 3.75Å; F68-Y94 HydrophobicContact CE2-CE2 4.12Å; F68-Y94 HydrophobicContact CE2-CG 4.04Å; F68-Y94 AromaticContact CG-CD2 3.91Å; F68-Y94 HydrophobicContact CG-CD2 3.91Å; F68-Y94 AromaticContact CG-CE2 3.41Å; F68-Y94 HydrophobicContact CG-CE2 3.41Å; F68-Y94 VanDerWaalsContact CG-CE2 3.41Å; F68-Y94 AromaticContact CG-CZ 3.83Å; F68-Y94 AromaticContact CZ-CD1 3.83Å; F68-Y94 HydrophobicContact CZ-CD1 3.83Å; F68-Y94 AromaticContact CZ-CD2 3.71Å; F68-Y94 HydrophobicContact CZ-CD2 3.71Å; F68-Y94 HydrophobicContact CZ-CE1 4.14Å; F68-Y94 HydrophobicContact CZ-CE2 4.02Å; F68-Y94 AromaticContact CZ-CG 3.6Å; F68-Y94 HydrophobicContact CZ-CG 3.6Å; F68-L160 HydrophobicContact CD1-CD1 3.89Å; F68-L160 HydrophobicContact CD1-CD2 3.89Å; F68-L160 HydrophobicContact CE1-CD2 3.75Å
69	R	92.1	Very high	89.8	Confident	121 Å²	121	49.8 Å²	49.8	46%	0.457	23%	0.23	S	C	.	.	H	α-helix	trans	-51.2	-51.2	176.6	-169.5	175.7	-178.1	178.6	4.8	112.3	N65 H67 Y73 L160	N65-R69 WeakPolarHBondContact O-CB 3.24Å; N65-R69 PolarHBondContact O-N 2.67Å; H67-R69 VanDerWaalsContact C-N 3.33Å; H67-R69 PolarHBondContact O-N 2.92Å; R69-Y73 HydrophobicContact CG-CD2 4.14Å; R69-Y73 HydrophobicContact CG-CE2 4.05Å; R69-Y73 VanDerWaalsContact O-CD2 3.27Å; R69-Y73 WeakPolarHBondContact O-CD2 3.47Å; R69-Y73 PolarHBondContact O-N 2.83Å; R69-L160 HydrophobicContact CB-CD1 3.69Å; R69-L160 HydrophobicContact CB-CG 4.15Å; R69-L160 HydrophobicContact CG-CD1 4.19Å; R69-L160 HydrophobicContact CG-CG 4.11Å
70	K	90	Very high	89.1	Confident	122 Å²	122	50.6 Å²	50.6	53%	0.53	24%	0.235	S	C	.	.	H	α-helix	trans	-67.8	-37.9	-175.9	-71.8	176.6	-174.1	176	0	112.2	Y33 I66 H67 F68 T74	Y33-K70 HydrophobicContact CE2-CB 3.81Å; Y33-K70 WeakPolarHBondContact OH-CB 3.29Å; Y33-K70 WeakPolarHBondContact OH-CD 3.37Å; I66-K70 WeakPolarHBondContact O-CG 3.46Å; I66-K70 PolarHBondContact O-N 3.5Å; H67-K70 PolarHBondContact O-N 2.96Å; F68-K70 PolarHBondContact O-N 3.02Å; K70-T74 PolarHBondContact O-OG1 3.46Å
71	A	90.5	Very high	88.3	Confident	1 Å²	1	57 Å²	57	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-73.2	-43.6	178.5	0	0	0	0	0	113	Y33 M36 M52 F55 H67 F68 Y73 T74 Y75	Y33-A71 HydrophobicContact CD2-CB 4.29Å; Y33-A71 HydrophobicContact CE2-CB 4.49Å; M36-A71 HydrophobicContact CB-CB 4.22Å; M36-A71 HydrophobicContact CG-CB 4.49Å; M52-A71 HydrophobicContact CE-CB 4.49Å; F55-A71 HydrophobicContact CD1-CB 4.23Å; F55-A71 HydrophobicContact CE1-CB 3.36Å; F55-A71 HydrophobicContact CZ-CB 3.61Å; H67-A71 PolarHBondContact O-N 3.26Å; F68-A71 PolarHBondContact O-N 3Å; A71-Y73 VanDerWaalsContact C-N 3.35Å; A71-Y73 PolarHBondContact O-N 3.43Å; A71-T74 PolarHBondContact O-N 2.87Å; A71-T74 VanDerWaalsContact O-N 3.09Å; A71-Y75 PolarHBondContact O-N 3.43Å
72	I	92.2	Very high	87.8	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-69.5	-30.2	-175	-160.9	68.5	0	0	0	112.7	M52 F68 Y75 K76 L87 V90 L160 L164	M52-I72 HydrophobicContact SD-CD1 4.3Å; F68-I72 HydrophobicContact CD1-CG2 4.25Å; F68-I72 HydrophobicContact CD2-CB 4.42Å; F68-I72 HydrophobicContact CE1-CB 4.16Å; F68-I72 HydrophobicContact CE1-CG1 4.3Å; F68-I72 HydrophobicContact CE1-CG2 3.93Å; F68-I72 HydrophobicContact CE2-CB 3.94Å; F68-I72 HydrophobicContact CE2-CD1 3.94Å; F68-I72 HydrophobicContact CE2-CG1 4.07Å; F68-I72 HydrophobicContact CZ-CB 3.81Å; F68-I72 HydrophobicContact CZ-CD1 3.89Å; F68-I72 HydrophobicContact CZ-CG1 3.68Å; F68-I72 HydrophobicContact CZ-CG2 4.1Å; F68-I72 WeakPolarHBondContact O-CB 3.28Å; F68-I72 VanDerWaalsContact O-CG2 3.3Å; F68-I72 WeakPolarHBondContact O-CG2 3.49Å; F68-I72 PolarHBondContact O-N 2.87Å; I72-Y75 HydrophobicContact CD1-CD1 4.08Å; I72-Y75 PolarHBondContact O-N 3.25Å; I72-K76 VanDerWaalsContact O-CB 3.31Å; I72-K76 WeakPolarHBondContact O-CB 3.45Å; I72-K76 PolarHBondContact O-N 2.91Å; I72-L87 HydrophobicContact CD1-CD1 3.97Å; I72-L87 HydrophobicContact CG1-CD1 4.37Å; I72-V90 HydrophobicContact CD1-CG1 3.54Å; I72-L160 HydrophobicContact CG2-CD2 4.12Å; I72-L164 HydrophobicContact CB-CD2 4.4Å; I72-L164 HydrophobicContact CG1-CD2 3.65Å; I72-L164 HydrophobicContact CG2-CD1 4.28Å; I72-L164 HydrophobicContact CG2-CD2 3.85Å
73	Y	89.7	Confident	87.4	Confident	69 Å²	69	57.2 Å²	57.2	27%	0.271	27%	0.269	S	S	.	.	H	α-helix	trans	-65.8	-37.4	170.1	-89.5	-94.6	0	0	0	111.9	R69 A71 N77 D163 L164	R69-Y73 HydrophobicContact CG-CD2 4.14Å; R69-Y73 HydrophobicContact CG-CE2 4.05Å; R69-Y73 VanDerWaalsContact O-CD2 3.27Å; R69-Y73 WeakPolarHBondContact O-CD2 3.47Å; R69-Y73 PolarHBondContact O-N 2.83Å; A71-Y73 VanDerWaalsContact C-N 3.35Å; A71-Y73 PolarHBondContact O-N 3.43Å; Y73-N77 VanDerWaalsContact O-CG 3.24Å; Y73-N77 PolarHBondContact O-N 3.15Å; Y73-N77 PolarHBondContact O-ND2 2.88Å; Y73-D163 VanDerWaalsContact OH-C 3.27Å; Y73-D163 PolarHBondContact OH-O 3.12Å; Y73-L164 HydrophobicContact CD1-CD1 3.88Å; Y73-L164 HydrophobicContact CD2-CD1 3.65Å; Y73-L164 HydrophobicContact CE1-CD1 3.98Å; Y73-L164 HydrophobicContact CE2-CB 4.27Å; Y73-L164 HydrophobicContact CE2-CD1 3.79Å; Y73-L164 HydrophobicContact CG-CD1 3.73Å
74	T	87.8	Confident	87.3	Confident	53 Å²	53	53.5 Å²	53.5	33%	0.325	26%	0.259	S	S	.	.	H	α-helix	trans	-69.5	-42.7	173	-40.4	0	0	0	0	111.2	K70 A71 K76 N77 M78	K70-T74 PolarHBondContact O-OG1 3.46Å; A71-T74 PolarHBondContact O-N 2.87Å; A71-T74 VanDerWaalsContact O-N 3.09Å; T74-K76 PolarHBondContact O-N 2.73Å; T74-N77 WeakPolarHBondContact O-CB 3.25Å; T74-N77 PolarHBondContact O-N 3.34Å; T74-N77 VanDerWaalsContact O-N 3.12Å; T74-M78 HydrophobicContact CG2-CE 3.89Å; T74-M78 PolarHBondContact O-N 3.27Å
75	Y	89.8	Confident	87.3	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.7	-46.7	177.7	-166.9	-114.9	0	0	0	111.8	M36 W44 L48 E49 M52 A71 I72 N77 M78 S79 S86 L87 V90	M36-Y75 HydrophobicContact CE-CD2 3.9Å; M36-Y75 HydrophobicContact CE-CG 4.41Å; W44-Y75 AromaticContact NE1-CZ 3.95Å; W44-Y75 PolarHBondContact NE1-OH 2.82Å; L48-Y75 HydrophobicContact CB-CE2 4.11Å; E49-Y75 WeakPolarHBondContact CA-OH 3.31Å; M52-Y75 HydrophobicContact CB-CE2 4.25Å; M52-Y75 HydrophobicContact CE-CD2 3.88Å; M52-Y75 HydrophobicContact CE-CG 3.92Å; M52-Y75 HydrophobicContact CG-CD1 4.17Å; M52-Y75 HydrophobicContact CG-CD2 4.5Å; M52-Y75 HydrophobicContact CG-CE1 4.22Å; M52-Y75 HydrophobicContact CG-CG 4.31Å; A71-Y75 PolarHBondContact O-N 3.43Å; I72-Y75 HydrophobicContact CD1-CD1 4.08Å; I72-Y75 PolarHBondContact O-N 3.25Å; Y75-N77 PolarHBondContact O-N 3.33Å; Y75-M78 WeakPolarHBondContact O-CB 3.39Å; Y75-M78 PolarHBondContact O-N 3.38Å; Y75-S79 PolarHBondContact O-N 2.83Å; Y75-S79 PolarHBondContact O-OG 3.41Å; Y75-S86 PolarHBondContact OH-OG 3.19Å; Y75-L87 HydrophobicContact CD1-CD1 3.8Å; Y75-L87 HydrophobicContact CE1-CD1 4.39Å; Y75-V90 HydrophobicContact CE1-CB 4.43Å; Y75-V90 HydrophobicContact CE1-CG2 3.93Å
76	K	88.3	Confident	87.5	Confident	35 Å²	35	54.8 Å²	54.8	15%	0.152	27%	0.272	C	S	.	.	H	α-helix	trans	-51.3	-43.7	172.6	177.5	-176	176.2	-177.1	0	111.9	I72 T74 M78 S79 V80 L87 L164	I72-K76 VanDerWaalsContact O-CB 3.31Å; I72-K76 WeakPolarHBondContact O-CB 3.45Å; I72-K76 PolarHBondContact O-N 2.91Å; T74-K76 PolarHBondContact O-N 2.73Å; K76-M78 VanDerWaalsContact C-N 3.25Å; K76-M78 PolarHBondContact O-N 2.65Å; K76-S79 PolarHBondContact O-N 3.29Å; K76-V80 HydrophobicContact CD-CG2 4.48Å; K76-V80 HydrophobicContact CG-CG2 3.54Å; K76-V80 VanDerWaalsContact O-CB 3.28Å; K76-V80 WeakPolarHBondContact O-CB 3.26Å; K76-V80 WeakPolarHBondContact O-CG2 3.16Å; K76-V80 PolarHBondContact O-N 2.91Å; K76-L87 HydrophobicContact CB-CD1 4.28Å; K76-L87 HydrophobicContact CB-CD2 4.06Å; K76-L87 HydrophobicContact CG-CD2 3.89Å; K76-L164 HydrophobicContact CB-CD1 4.2Å; K76-L164 HydrophobicContact CD-CD1 3.67Å; K76-L164 HydrophobicContact CD-CG 4.17Å; K76-L164 PolarHBondContact NZ-O 2.69Å
77	N	84.4	Confident	87.6	Confident	123 Å²	123	49.2 Å²	49.2	66%	0.658	24%	0.243	S	C	*	.	H	α-helix	trans	-70.3	-20.9	-178.5	-67	-15.7	0	0	0	113.4	Y73 T74 Y75	Y73-N77 VanDerWaalsContact O-CG 3.24Å; Y73-N77 PolarHBondContact O-N 3.15Å; Y73-N77 PolarHBondContact O-ND2 2.88Å; T74-N77 WeakPolarHBondContact O-CB 3.25Å; T74-N77 PolarHBondContact O-N 3.34Å; T74-N77 VanDerWaalsContact O-N 3.12Å; Y75-N77 PolarHBondContact O-N 3.33Å
78	M	85.2	Confident	87.7	Confident	17 Å²	17	48.5 Å²	48.5	8%	0.084	24%	0.24	C	C	.	.	H	α-helix	trans	-83.2	-46.9	170.6	-59.4	160.5	174.8	0	0	110.8	M36 T41 T74 Y75 K76	M36-M78 HydrophobicContact CE-CE 4.16Å; M36-M78 HydrophobicContact CE-SD 3.93Å; T41-M78 WeakPolarHBondContact O-CE 3.33Å; T74-M78 HydrophobicContact CG2-CE 3.89Å; T74-M78 PolarHBondContact O-N 3.27Å; Y75-M78 WeakPolarHBondContact O-CB 3.39Å; Y75-M78 PolarHBondContact O-N 3.38Å; K76-M78 VanDerWaalsContact C-N 3.25Å; K76-M78 PolarHBondContact O-N 2.65Å
79	S	85.1	Confident	87.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-85.9	-25	-167.8	57.7	0	0	0	0	115.6	Y75 K76 L81 E82 N83 T84	Y75-S79 PolarHBondContact O-N 2.83Å; Y75-S79 PolarHBondContact O-OG 3.41Å; K76-S79 PolarHBondContact O-N 3.29Å; S79-L81 PolarHBondContact O-N 3.14Å; S79-L81 VanDerWaalsContact O-N 3.15Å; S79-E82 PolarHBondContact O-N 3.15Å; S79-N83 WeakPolarHBondContact CB-O 3.45Å; S79-N83 CarbonylContact O-C 3.43Å; S79-N83 PolarHBondContact O-N 3.12Å; S79-T84 PolarHBondContact O-N 2.97Å
80	V	79.7	Confident	87.8	Confident	19 Å²	19	47.4 Å²	47.4	12%	0.115	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-24.9	-174.9	159.6	0	0	0	0	114.5	K76 L87 L171	K76-V80 HydrophobicContact CD-CG2 4.48Å; K76-V80 HydrophobicContact CG-CG2 3.54Å; K76-V80 VanDerWaalsContact O-CB 3.28Å; K76-V80 WeakPolarHBondContact O-CB 3.26Å; K76-V80 WeakPolarHBondContact O-CG2 3.16Å; K76-V80 PolarHBondContact O-N 2.91Å; V80-L87 HydrophobicContact CG2-CD2 4.02Å; V80-L171 HydrophobicContact CG2-CD1 4.28Å
81	L	76.9	Confident	88	Confident	136 Å²	136	41.6 Å²	41.6	71%	0.712	22%	0.215	S	C	*	.	H	α-helix	trans	-91.9	-38.2	175.6	-63.5	-179.9	0	0	0	112.8	S79	S79-L81 PolarHBondContact O-N 3.14Å; S79-L81 VanDerWaalsContact O-N 3.15Å
82	E	79	Confident	88.2	Confident	102 Å²	102	45.7 Å²	45.7	48%	0.477	23%	0.23	S	C	.	.	H	α-helix	trans	-97.4	-41.9	-169.6	-63.6	-179.1	-167.9	0	0	113.6	W44 S79	W44-E82 WeakPolarHBondContact CA-OE2 3.32Å; W44-E82 HydrophobicContact CB-CB 4.24Å; W44-E82 WeakPolarHBondContact CB-OE2 3.44Å; W44-E82 PolarHBondContact N-OE2 3.02Å; S79-E82 PolarHBondContact O-N 3.15Å
83	N	84.6	Confident	88.3	Confident	44 Å²	44	46.8 Å²	46.8	24%	0.235	24%	0.238	C	C	.	.			trans	-156.5	93.4	-179.7	-176.2	-7.4	0	0	0	112	W44 S79 V85 S86	W44-N83 HydrophobicContact CD2-CB 4.17Å; W44-N83 HydrophobicContact CE3-CB 4.28Å; W44-N83 HydrophobicContact CH2-CB 4.48Å; W44-N83 WeakPolarHBondContact CH2-ND2 3.42Å; W44-N83 HydrophobicContact CZ2-CB 4.35Å; W44-N83 VanDerWaalsContact CZ2-ND2 3.28Å; W44-N83 WeakPolarHBondContact CZ2-ND2 3.33Å; W44-N83 HydrophobicContact CZ3-CB 4.43Å; S79-N83 WeakPolarHBondContact CB-O 3.45Å; S79-N83 CarbonylContact O-C 3.43Å; S79-N83 PolarHBondContact O-N 3.12Å; N83-V85 PolarHBondContact OD1-N 3.47Å; N83-V85 VanDerWaalsContact OD1-N 3.13Å; N83-S86 PolarHBondContact OD1-N 3.32Å; N83-S86 VanDerWaalsContact OD1-N 3.1Å
84	T	87.7	Confident	88.6	Confident	34 Å²	34	43.5 Å²	43.5	21%	0.209	23%	0.225	C	C	.	.	H	α-helix	trans	-69	-29.9	177	44.7	0	0	0	0	113.5	S79 S86 L87 E88 K170 L171	S79-T84 PolarHBondContact O-N 2.97Å; T84-S86 VanDerWaalsContact C-N 3.3Å; T84-S86 PolarHBondContact O-N 3.45Å; T84-L87 WeakPolarHBondContact O-CB 3.45Å; T84-L87 PolarHBondContact O-N 3.3Å; T84-L87 VanDerWaalsContact O-N 3.1Å; T84-E88 PolarHBondContact O-N 3.14Å; T84-E88 VanDerWaalsContact O-N 3.08Å; T84-K170 HydrophobicContact CG2-CB 4.24Å; T84-K170 HydrophobicContact CG2-CD 3.97Å; T84-L171 HydrophobicContact CG2-CD2 4.42Å
85	V	90.8	Very high	89	Confident	101 Å²	101	41.2 Å²	41.2	61%	0.612	21%	0.211	S	C	*	.	H	α-helix	trans	-64.2	-37.9	-177.8	-174.9	0	0	0	0	111.1	N83 L87 E88 Q89	N83-V85 PolarHBondContact OD1-N 3.47Å; N83-V85 VanDerWaalsContact OD1-N 3.13Å; V85-L87 VanDerWaalsContact C-N 3.3Å; V85-L87 PolarHBondContact O-N 2.89Å; V85-E88 PolarHBondContact O-N 2.88Å; V85-E88 VanDerWaalsContact O-N 3.14Å; V85-Q89 PolarHBondContact O-N 3.38Å
86	S	91.2	Very high	89.2	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.014	23%	0.234	C	C	.	.	H	α-helix	trans	-58.4	-39.3	173.4	-170.7	0	0	0	0	112.6	W44 E49 Y75 N83 T84 V90	W44-S86 WeakPolarHBondContact CZ2-OG 3.36Å; W44-S86 PolarHBondContact NE1-OG 2.89Å; E49-S86 WeakPolarHBondContact CG-OG 3.19Å; E49-S86 VanDerWaalsContact OE2-CB 3.22Å; E49-S86 WeakPolarHBondContact OE2-CB 3.32Å; E49-S86 PolarHBondContact OE2-OG 2.97Å; Y75-S86 PolarHBondContact OH-OG 3.19Å; N83-S86 PolarHBondContact OD1-N 3.32Å; N83-S86 VanDerWaalsContact OD1-N 3.1Å; T84-S86 VanDerWaalsContact C-N 3.3Å; T84-S86 PolarHBondContact O-N 3.45Å; S86-V90 WeakPolarHBondContact O-CG2 3.34Å; S86-V90 PolarHBondContact O-N 3.28Å; S86-V90 VanDerWaalsContact O-N 3.17Å
87	L	91.9	Very high	89.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-68.1	-40.7	174.1	-177.2	65	0	0	0	112	I72 Y75 K76 V80 T84 V85 I91 L171	I72-L87 HydrophobicContact CD1-CD1 3.97Å; I72-L87 HydrophobicContact CG1-CD1 4.37Å; Y75-L87 HydrophobicContact CD1-CD1 3.8Å; Y75-L87 HydrophobicContact CE1-CD1 4.39Å; K76-L87 HydrophobicContact CB-CD1 4.28Å; K76-L87 HydrophobicContact CB-CD2 4.06Å; K76-L87 HydrophobicContact CG-CD2 3.89Å; V80-L87 HydrophobicContact CG2-CD2 4.02Å; T84-L87 WeakPolarHBondContact O-CB 3.45Å; T84-L87 PolarHBondContact O-N 3.3Å; T84-L87 VanDerWaalsContact O-N 3.1Å; V85-L87 VanDerWaalsContact C-N 3.3Å; V85-L87 PolarHBondContact O-N 2.89Å; L87-I91 HydrophobicContact CD1-CD1 4Å; L87-I91 HydrophobicContact CG-CD1 3.93Å; L87-I91 VanDerWaalsContact O-CG1 3.3Å; L87-I91 WeakPolarHBondContact O-CG1 3.35Å; L87-I91 PolarHBondContact O-N 2.97Å; L87-I91 VanDerWaalsContact O-N 3.11Å; L87-L171 HydrophobicContact CD2-CD1 3.73Å; L87-L171 HydrophobicContact CD2-CD2 4.48Å
88	E	92.5	Very high	90	Very high	39 Å²	39	40.8 Å²	40.8	18%	0.182	21%	0.208	C	C	.	.	H	α-helix	trans	-62	-45.2	175.6	-59.6	-148.9	166.8	0	0	111.6	T84 V85 V90 I91 R92 L171 L174	T84-E88 PolarHBondContact O-N 3.14Å; T84-E88 VanDerWaalsContact O-N 3.08Å; V85-E88 PolarHBondContact O-N 2.88Å; V85-E88 VanDerWaalsContact O-N 3.14Å; E88-V90 PolarHBondContact O-N 2.85Å; E88-I91 PolarHBondContact O-N 2.86Å; E88-I91 VanDerWaalsContact O-N 3.16Å; E88-R92 WeakPolarHBondContact O-CB 3.3Å; E88-R92 VanDerWaalsContact O-CG 3.29Å; E88-R92 WeakPolarHBondContact O-CG 3.47Å; E88-R92 PolarHBondContact O-N 2.88Å; E88-R92 IonicContact OE2-CZ 2.66Å; E88-R92 IonicContact OE2-NE 3.04Å; E88-R92 IonicContact OE2-NH2 3.89Å; E88-R92 PolarHBondContact OE2-NH2 3.47Å; E88-L171 HydrophobicContact CG-CD2 4.14Å; E88-L174 HydrophobicContact CB-CD2 3.94Å; E88-L174 HydrophobicContact CG-CD2 3.8Å
89	Q	92.9	Very high	90.5	Very high	98 Å²	98	42.2 Å²	42.2	46%	0.458	21%	0.214	S	C	.	.	H	α-helix	trans	-63.3	-42.5	-177.8	-174.5	65.3	-6.7	0	0	112.1	V85 I91 R92 S93	V85-Q89 PolarHBondContact O-N 3.38Å; Q89-I91 PolarHBondContact O-N 3.46Å; Q89-R92 PolarHBondContact O-N 3.35Å; Q89-S93 WeakPolarHBondContact O-CB 3.49Å; Q89-S93 PolarHBondContact O-N 2.81Å
90	V	93.9	Very high	91	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59	-44.9	172.4	163.3	0	0	0	0	111.6	M52 M53 V56 I72 Y75 S86 E88 S93 Y94	M52-V90 HydrophobicContact CB-CG2 4.02Å; M52-V90 HydrophobicContact CG-CB 4.2Å; M52-V90 HydrophobicContact CG-CG1 3.43Å; M52-V90 VanDerWaalsContact CG-CG1 3.43Å; M52-V90 HydrophobicContact CG-CG2 3.66Å; M52-V90 HydrophobicContact SD-CG1 4.37Å; M53-V90 HydrophobicContact CG-CG2 4.47Å; M53-V90 HydrophobicContact SD-CG2 4.25Å; V56-V90 HydrophobicContact CG2-CG1 4.08Å; I72-V90 HydrophobicContact CD1-CG1 3.54Å; Y75-V90 HydrophobicContact CE1-CB 4.43Å; Y75-V90 HydrophobicContact CE1-CG2 3.93Å; S86-V90 WeakPolarHBondContact O-CG2 3.34Å; S86-V90 PolarHBondContact O-N 3.28Å; S86-V90 VanDerWaalsContact O-N 3.17Å; E88-V90 PolarHBondContact O-N 2.85Å; V90-S93 PolarHBondContact O-N 3.43Å; V90-Y94 WeakPolarHBondContact O-CB 3.29Å; V90-Y94 PolarHBondContact O-N 3.46Å
91	I	94.4	Very high	91.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-70.5	-40.9	-178.7	-70.6	171.3	0	0	0	111.6	L87 E88 Q89 Y94 L95 V161 L164 L165 L174	L87-I91 HydrophobicContact CD1-CD1 4Å; L87-I91 HydrophobicContact CG-CD1 3.93Å; L87-I91 VanDerWaalsContact O-CG1 3.3Å; L87-I91 WeakPolarHBondContact O-CG1 3.35Å; L87-I91 PolarHBondContact O-N 2.97Å; L87-I91 VanDerWaalsContact O-N 3.11Å; E88-I91 PolarHBondContact O-N 2.86Å; E88-I91 VanDerWaalsContact O-N 3.16Å; Q89-I91 PolarHBondContact O-N 3.46Å; I91-Y94 PolarHBondContact O-N 2.82Å; I91-L95 HydrophobicContact CG2-CD1 4.31Å; I91-L95 PolarHBondContact O-N 3.31Å; I91-V161 HydrophobicContact CG2-CG1 3.54Å; I91-V161 HydrophobicContact CG2-CG2 4.09Å; I91-L164 HydrophobicContact CD1-CD2 3.77Å; I91-L165 HydrophobicContact CD1-CD2 3.68Å; I91-L165 HydrophobicContact CD1-CG 4.39Å; I91-L174 HydrophobicContact CB-CD2 4.36Å; I91-L174 HydrophobicContact CG2-CD2 4.14Å
92	R	94.9	Very high	92.4	Very high	87 Å²	87	39.2 Å²	39.2	33%	0.328	20%	0.201	S	C	.	.	H	α-helix	trans	-61.2	-45	173.9	-71.6	175.7	-169.3	-83.8	-3.3	110.6	E88 Q89 N96 L174 E177	E88-R92 WeakPolarHBondContact O-CB 3.3Å; E88-R92 VanDerWaalsContact O-CG 3.29Å; E88-R92 WeakPolarHBondContact O-CG 3.47Å; E88-R92 PolarHBondContact O-N 2.88Å; E88-R92 IonicContact OE2-CZ 2.66Å; E88-R92 IonicContact OE2-NE 3.04Å; E88-R92 IonicContact OE2-NH2 3.89Å; E88-R92 PolarHBondContact OE2-NH2 3.47Å; Q89-R92 PolarHBondContact O-N 3.35Å; R92-N96 VanDerWaalsContact O-CB 3.27Å; R92-N96 WeakPolarHBondContact O-CB 3.19Å; R92-N96 PolarHBondContact O-N 3.38Å; R92-N96 PolarHBondContact O-ND2 2.91Å; R92-L174 HydrophobicContact CG-CD1 4.21Å; R92-E177 IonicContact CZ-OE2 2.68Å; R92-E177 VanDerWaalsContact CZ-OE2 3.24Å; R92-E177 IonicContact NH1-OE2 3.81Å; R92-E177 PolarHBondContact NH1-OE2 3.32Å; R92-E177 IonicContact NH2-OE1 3.17Å; R92-E177 IonicContact NH2-OE2 3.7Å; R92-E177 PolarHBondContact NH2-OE2 2.84Å
93	S	93.8	Very high	93.1	Very high	23 Å²	23	38.9 Å²	38.9	16%	0.161	20%	0.199	C	C	.	.	H	α-helix	trans	-62.3	-48.3	176.1	-166.7	0	0	0	0	111.8	M53 Q89 V90 L95 N96 Q97	M53-S93 WeakPolarHBondContact CE-OG 3.38Å; Q89-S93 WeakPolarHBondContact O-CB 3.49Å; Q89-S93 PolarHBondContact O-N 2.81Å; V90-S93 PolarHBondContact O-N 3.43Å; S93-L95 PolarHBondContact O-N 3.39Å; S93-N96 PolarHBondContact O-N 2.92Å; S93-Q97 WeakPolarHBondContact O-CB 3.45Å; S93-Q97 WeakPolarHBondContact O-CG 3.49Å; S93-Q97 PolarHBondContact O-N 3.1Å; S93-Q97 PolarHBondContact OG-NE2 2.8Å
94	Y	95.4	Very high	93.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-55	-51.1	177.4	174	-100.3	0	0	0	112.5	V56 V60 N65 F68 V90 I91 I98 S157 V161	V56-Y94 HydrophobicContact CG1-CD2 4.12Å; V56-Y94 HydrophobicContact CG1-CG 4.49Å; V56-Y94 HydrophobicContact CG2-CD2 4.19Å; V60-Y94 HydrophobicContact CG2-CD2 4.13Å; V60-Y94 HydrophobicContact CG2-CE2 4.34Å; N65-Y94 PolarHBondContact OD1-OH 2.95Å; F68-Y94 HydrophobicContact CB-CE2 4.02Å; F68-Y94 HydrophobicContact CD1-CD1 4.24Å; F68-Y94 AromaticContact CD1-CD2 3.89Å; F68-Y94 HydrophobicContact CD1-CD2 3.89Å; F68-Y94 AromaticContact CD1-CE1 3.71Å; F68-Y94 HydrophobicContact CD1-CE1 3.71Å; F68-Y94 AromaticContact CD1-CE2 3.3Å; F68-Y94 HydrophobicContact CD1-CE2 3.3Å; F68-Y94 HydrophobicContact CD1-CG 4.31Å; F68-Y94 AromaticContact CD1-CZ 3.2Å; F68-Y94 WeakPolarHBondContact CD1-OH 3.37Å; F68-Y94 AromaticContact CD2-CD2 3.84Å; F68-Y94 HydrophobicContact CD2-CD2 3.84Å; F68-Y94 AromaticContact CD2-CE2 3.83Å; F68-Y94 HydrophobicContact CD2-CE2 3.83Å; F68-Y94 AromaticContact CE1-CD1 3.58Å; F68-Y94 HydrophobicContact CE1-CD1 3.58Å; F68-Y94 AromaticContact CE1-CD2 3.78Å; F68-Y94 HydrophobicContact CE1-CD2 3.78Å; F68-Y94 AromaticContact CE1-CE1 3.41Å; F68-Y94 HydrophobicContact CE1-CE1 3.41Å; F68-Y94 VanDerWaalsContact CE1-CE1 3.41Å; F68-Y94 AromaticContact CE1-CE2 3.62Å; F68-Y94 HydrophobicContact CE1-CE2 3.62Å; F68-Y94 AromaticContact CE1-CG 3.75Å; F68-Y94 HydrophobicContact CE1-CG 3.75Å; F68-Y94 AromaticContact CE1-CZ 3.44Å; F68-Y94 VanDerWaalsContact CE1-CZ 3.44Å; F68-Y94 AromaticContact CE2-CD2 3.75Å; F68-Y94 HydrophobicContact CE2-CD2 3.75Å; F68-Y94 HydrophobicContact CE2-CE2 4.12Å; F68-Y94 HydrophobicContact CE2-CG 4.04Å; F68-Y94 AromaticContact CG-CD2 3.91Å; F68-Y94 HydrophobicContact CG-CD2 3.91Å; F68-Y94 AromaticContact CG-CE2 3.41Å; F68-Y94 HydrophobicContact CG-CE2 3.41Å; F68-Y94 VanDerWaalsContact CG-CE2 3.41Å; F68-Y94 AromaticContact CG-CZ 3.83Å; F68-Y94 AromaticContact CZ-CD1 3.83Å; F68-Y94 HydrophobicContact CZ-CD1 3.83Å; F68-Y94 AromaticContact CZ-CD2 3.71Å; F68-Y94 HydrophobicContact CZ-CD2 3.71Å; F68-Y94 HydrophobicContact CZ-CE1 4.14Å; F68-Y94 HydrophobicContact CZ-CE2 4.02Å; F68-Y94 AromaticContact CZ-CG 3.6Å; F68-Y94 HydrophobicContact CZ-CG 3.6Å; V90-Y94 WeakPolarHBondContact O-CB 3.29Å; V90-Y94 PolarHBondContact O-N 3.46Å; I91-Y94 PolarHBondContact O-N 2.82Å; Y94-I98 HydrophobicContact CD1-CD1 4.18Å; Y94-I98 HydrophobicContact CD2-CD1 4.15Å; Y94-I98 HydrophobicContact CE1-CD1 3.76Å; Y94-I98 HydrophobicContact CE2-CD1 3.74Å; Y94-I98 HydrophobicContact CG-CD1 4.37Å; Y94-I98 VanDerWaalsContact O-CG1 3.27Å; Y94-I98 WeakPolarHBondContact O-CG1 3.41Å; Y94-I98 PolarHBondContact O-N 3.11Å; Y94-S157 PolarHBondContact OH-OG 3.49Å; Y94-V161 HydrophobicContact CD1-CG2 4.31Å; Y94-V161 HydrophobicContact CE1-CG2 4.31Å
95	L	95.6	Very high	93.7	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-40.3	178.9	-68.9	176	0	0	0	112.3	I91 S93 I98 K99 Y158 V161 V178	I91-L95 HydrophobicContact CG2-CD1 4.31Å; I91-L95 PolarHBondContact O-N 3.31Å; S93-L95 PolarHBondContact O-N 3.39Å; L95-I98 PolarHBondContact O-N 3.1Å; L95-K99 WeakPolarHBondContact O-CG 3.19Å; L95-K99 PolarHBondContact O-N 3.49Å; L95-Y158 HydrophobicContact CD1-CD1 4.47Å; L95-Y158 HydrophobicContact CD1-CE1 4.42Å; L95-Y158 HydrophobicContact CD2-CD1 4.04Å; L95-Y158 HydrophobicContact CD2-CE1 4.19Å; L95-V161 HydrophobicContact CD1-CG1 4.37Å; L95-V161 HydrophobicContact CD1-CG2 4.41Å; L95-V161 HydrophobicContact CD2-CG2 4.17Å; L95-V161 HydrophobicContact CG-CG2 4.35Å; L95-V178 HydrophobicContact CD1-CB 4.48Å; L95-V178 HydrophobicContact CD1-CG1 3.95Å; L95-V178 HydrophobicContact CD1-CG2 3.67Å
96	N	95.5	Very high	93.7	Very high	92 Å²	92	38 Å²	38	49%	0.492	19%	0.186	S	C	.	.	H	α-helix	trans	-68.7	-38.3	-178.5	-71.8	-9.2	0	0	0	112.9	R92 S93 I98 K99 G100	R92-N96 VanDerWaalsContact O-CB 3.27Å; R92-N96 WeakPolarHBondContact O-CB 3.19Å; R92-N96 PolarHBondContact O-N 3.38Å; R92-N96 PolarHBondContact O-ND2 2.91Å; S93-N96 PolarHBondContact O-N 2.92Å; N96-I98 VanDerWaalsContact C-N 3.32Å; N96-I98 PolarHBondContact O-N 3.44Å; N96-K99 PolarHBondContact O-N 3Å; N96-G100 PolarHBondContact O-N 2.96Å
97	Q	94.6	Very high	93.7	Very high	57 Å²	57	43 Å²	43	27%	0.266	21%	0.209	S	C	.	.	H	α-helix	trans	-62.9	-39.2	174.2	-70.7	-179.3	36	0	0	111.7	E57 V60 S93 K101	E57-Q97 VanDerWaalsContact CA-OE1 3.31Å; V60-Q97 HydrophobicContact CG1-CB 4.22Å; V60-Q97 HydrophobicContact CG2-CB 4.21Å; S93-Q97 WeakPolarHBondContact O-CB 3.45Å; S93-Q97 WeakPolarHBondContact O-CG 3.49Å; S93-Q97 PolarHBondContact O-N 3.1Å; S93-Q97 PolarHBondContact OG-NE2 2.8Å; Q97-K101 WeakPolarHBondContact O-CB 3.49Å; Q97-K101 WeakPolarHBondContact O-CG 3.43Å; Q97-K101 PolarHBondContact O-N 3.39Å
98	I	95.4	Very high	93.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-72	-38.9	177.7	-57.4	172.5	0	0	0	111.3	V60 Y94 L95 N96 K101 T102 F153 L154 S157	V60-I98 HydrophobicContact CB-CG1 4.3Å; V60-I98 HydrophobicContact CG1-CG1 3.85Å; V60-I98 HydrophobicContact CG2-CD1 4.02Å; V60-I98 HydrophobicContact CG2-CG1 3.52Å; Y94-I98 HydrophobicContact CD1-CD1 4.18Å; Y94-I98 HydrophobicContact CD2-CD1 4.15Å; Y94-I98 HydrophobicContact CE1-CD1 3.76Å; Y94-I98 HydrophobicContact CE2-CD1 3.74Å; Y94-I98 HydrophobicContact CG-CD1 4.37Å; Y94-I98 VanDerWaalsContact O-CG1 3.27Å; Y94-I98 WeakPolarHBondContact O-CG1 3.41Å; Y94-I98 PolarHBondContact O-N 3.11Å; L95-I98 PolarHBondContact O-N 3.1Å; N96-I98 VanDerWaalsContact C-N 3.32Å; N96-I98 PolarHBondContact O-N 3.44Å; I98-K101 PolarHBondContact O-N 2.7Å; I98-T102 WeakPolarHBondContact O-CB 3.41Å; I98-T102 PolarHBondContact O-N 3.25Å; I98-T102 PolarHBondContact O-OG1 3.47Å; I98-F153 HydrophobicContact CD1-CD1 4.35Å; I98-F153 HydrophobicContact CD1-CE1 3.76Å; I98-F153 HydrophobicContact CD1-CZ 4.23Å; I98-F153 HydrophobicContact CG1-CD1 4.39Å; I98-F153 HydrophobicContact CG1-CE1 3.8Å; I98-F153 HydrophobicContact CG2-CD1 3.73Å; I98-F153 HydrophobicContact CG2-CE1 4.02Å; I98-L154 HydrophobicContact CB-CD1 4.23Å; I98-L154 HydrophobicContact CG2-CB 3.8Å; I98-L154 HydrophobicContact CG2-CD1 3.79Å; I98-L154 HydrophobicContact CG2-CG 4.32Å; I98-S157 VanDerWaalsContact CD1-OG 3.24Å; I98-S157 WeakPolarHBondContact CD1-OG 3.48Å
99	K	94.8	Very high	93.3	Very high	47 Å²	47	45.2 Å²	45.2	20%	0.204	23%	0.225	C	C	.	.	H	α-helix	trans	-55	-54.2	171.4	-73.5	172	-174.7	175.7	0	110.2	L95 N96 K101 T102 E103 L154 Y158 D181	L95-K99 WeakPolarHBondContact O-CG 3.19Å; L95-K99 PolarHBondContact O-N 3.49Å; N96-K99 PolarHBondContact O-N 3Å; K99-K101 PolarHBondContact O-N 3.2Å; K99-T102 WeakPolarHBondContact O-CA 3.37Å; K99-T102 WeakPolarHBondContact O-CB 3.31Å; K99-T102 PolarHBondContact O-N 3.17Å; K99-E103 WeakPolarHBondContact O-CG 3.3Å; K99-E103 PolarHBondContact O-N 2.75Å; K99-L154 HydrophobicContact CG-CD1 4.39Å; K99-Y158 WeakPolarHBondContact CE-OH 3.46Å; K99-D181 VanDerWaalsContact NZ-CG 3.31Å; K99-D181 IonicContact NZ-OD1 3.15Å; K99-D181 PolarHBondContact NZ-OD1 3.02Å; K99-D181 IonicContact NZ-OD2 2.8Å; K99-D181 PolarHBondContact NZ-OD2 3.4Å
100	G	94.8	Very high	93	Very high	25 Å²	25	44.9 Å²	44.9	26%	0.258	22%	0.222	S	C	.	.	H	α-helix	trans	-55.7	-50.2	178.3	0	0	0	0	0	113	N96 T102 E103 E104	N96-G100 PolarHBondContact O-N 2.96Å; G100-T102 PolarHBondContact O-N 3.26Å; G100-E103 PolarHBondContact O-N 2.72Å; G100-E104 WeakPolarHBondContact O-CG 3.15Å; G100-E104 PolarHBondContact O-N 3.35Å
101	K	93.6	Very high	92.7	Very high	68 Å²	68	47.1 Å²	47.1	30%	0.296	24%	0.238	S	C	.	.	H	α-helix	trans	-63.9	-25.7	176.9	-72.4	-82	167.7	-99.4	0	113.9	V60 Q97 I98 K99 E104 A105 W150	V60-K101 HydrophobicContact CG1-CG 4.23Å; Q97-K101 WeakPolarHBondContact O-CB 3.49Å; Q97-K101 WeakPolarHBondContact O-CG 3.43Å; Q97-K101 PolarHBondContact O-N 3.39Å; I98-K101 PolarHBondContact O-N 2.7Å; K99-K101 PolarHBondContact O-N 3.2Å; K101-E104 WeakPolarHBondContact CD-OE2 3.15Å; K101-E104 IonicContact NZ-OE1 3.23Å; K101-E104 PolarHBondContact NZ-OE1 2.78Å; K101-E104 IonicContact NZ-OE2 2.75Å; K101-E104 PolarHBondContact NZ-OE2 3.28Å; K101-A105 WeakPolarHBondContact O-CB 3.4Å; K101-A105 PolarHBondContact O-N 2.73Å; K101-W150 HydrophobicContact CB-CE3 4.15Å; K101-W150 HydrophobicContact CB-CH2 3.91Å; K101-W150 HydrophobicContact CB-CZ2 4.27Å; K101-W150 HydrophobicContact CB-CZ3 3.84Å; K101-W150 HydrophobicContact CD-CH2 4.2Å; K101-W150 HydrophobicContact CD-CZ2 4.42Å; K101-W150 HydrophobicContact CG-CH2 4.32Å
102	T	93.7	Very high	92	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-78.2	-33.2	173.5	-53.9	0	0	0	0	111.7	I98 K99 G100 Q106 L147 W150 L151 L154	I98-T102 WeakPolarHBondContact O-CB 3.41Å; I98-T102 PolarHBondContact O-N 3.25Å; I98-T102 PolarHBondContact O-OG1 3.47Å; K99-T102 WeakPolarHBondContact O-CA 3.37Å; K99-T102 WeakPolarHBondContact O-CB 3.31Å; K99-T102 PolarHBondContact O-N 3.17Å; G100-T102 PolarHBondContact O-N 3.26Å; T102-Q106 WeakPolarHBondContact O-CB 3.06Å; T102-Q106 PolarHBondContact O-N 2.79Å; T102-L147 HydrophobicContact CG2-CD1 3.97Å; T102-W150 HydrophobicContact CG2-CB 4.14Å; T102-L151 HydrophobicContact CG2-CD2 3.76Å; T102-L151 HydrophobicContact CG2-CG 4.49Å; T102-L154 HydrophobicContact CG2-CD2 4.04Å
103	E	93.2	Very high	91	Very high	94 Å²	94	44.8 Å²	44.8	44%	0.439	23%	0.233	S	C	.	.	H	α-helix	trans	-76.4	-40.4	176.5	-70.1	175.3	150.7	0	0	111.6	K99 G100 A105 Q106 E107 K188	K99-E103 WeakPolarHBondContact O-CG 3.3Å; K99-E103 PolarHBondContact O-N 2.75Å; G100-E103 PolarHBondContact O-N 2.72Å; E103-A105 VanDerWaalsContact C-N 3.32Å; E103-A105 PolarHBondContact O-N 3.06Å; E103-Q106 WeakPolarHBondContact O-CB 3.43Å; E103-Q106 PolarHBondContact O-N 2.9Å; E103-Q106 VanDerWaalsContact O-N 3.13Å; E103-E107 PolarHBondContact O-N 2.78Å; E103-K188 IonicContact OE1-NZ 2.7Å; E103-K188 PolarHBondContact OE1-NZ 3.37Å
104	E	93.4	Very high	89.9	Confident	101 Å²	101	51.6 Å²	51.6	47%	0.472	27%	0.265	S	S	.	.	H	α-helix	trans	-52.8	-49.6	166.1	-72	168.5	-137.9	0	0	111.2	G100 K101 Q106 E107 V108	G100-E104 WeakPolarHBondContact O-CG 3.15Å; G100-E104 PolarHBondContact O-N 3.35Å; K101-E104 WeakPolarHBondContact CD-OE2 3.15Å; K101-E104 IonicContact NZ-OE1 3.23Å; K101-E104 PolarHBondContact NZ-OE1 2.78Å; K101-E104 IonicContact NZ-OE2 2.75Å; K101-E104 PolarHBondContact NZ-OE2 3.28Å; E104-Q106 VanDerWaalsContact C-N 3.29Å; E104-Q106 PolarHBondContact O-N 2.87Å; E104-E107 PolarHBondContact O-N 3.3Å; E104-E107 VanDerWaalsContact O-N 3.17Å; E104-V108 WeakPolarHBondContact O-CG2 3.13Å; E104-V108 PolarHBondContact O-N 2.81Å
105	A	92	Very high	88.6	Confident	7 Å²	7	59.1 Å²	59.1	6%	0.058	30%	0.3	C	S	.	.	H	α-helix	trans	-70	-24.5	179.2	0	0	0	0	0	113.9	K101 E103 S109 I146 W150	K101-A105 WeakPolarHBondContact O-CB 3.4Å; K101-A105 PolarHBondContact O-N 2.73Å; E103-A105 VanDerWaalsContact C-N 3.32Å; E103-A105 PolarHBondContact O-N 3.06Å; A105-S109 WeakPolarHBondContact O-CB 3.19Å; A105-S109 PolarHBondContact O-N 2.73Å; A105-I146 HydrophobicContact CB-CG2 4.46Å; A105-W150 HydrophobicContact CB-CB 4.49Å; A105-W150 HydrophobicContact CB-CG 3.93Å
106	Q	90.2	Very high	87.2	Confident	53 Å²	53	64.7 Å²	64.7	25%	0.248	33%	0.329	C	S	.	.	H	α-helix	trans	-68.9	-38	171.2	-178.5	173.8	2.8	0	0	110.5	T102 E103 E104 K110 L147 Y189	T102-Q106 WeakPolarHBondContact O-CB 3.06Å; T102-Q106 PolarHBondContact O-N 2.79Å; E103-Q106 WeakPolarHBondContact O-CB 3.43Å; E103-Q106 PolarHBondContact O-N 2.9Å; E103-Q106 VanDerWaalsContact O-N 3.13Å; E104-Q106 VanDerWaalsContact C-N 3.29Å; E104-Q106 PolarHBondContact O-N 2.87Å; Q106-K110 PolarHBondContact O-N 3.23Å; Q106-L147 HydrophobicContact CB-CD1 3.98Å; Q106-L147 HydrophobicContact CB-CD2 4.22Å; Q106-L147 HydrophobicContact CG-CD2 4.16Å; Q106-Y189 VanDerWaalsContact OE1-CE1 3.24Å; Q106-Y189 PolarHBondContact OE1-OH 2.79Å
107	E	90.1	Very high	85.6	Confident	107 Å²	107	64.4 Å²	64.4	50%	0.5	32%	0.324	S	S	.	.	H	α-helix	trans	-73.4	-44.9	177.5	-148.6	61	-142.4	0	0	112.2	E103 E104 S109 K110 S111	E103-E107 PolarHBondContact O-N 2.78Å; E104-E107 PolarHBondContact O-N 3.3Å; E104-E107 VanDerWaalsContact O-N 3.17Å; E107-S109 PolarHBondContact O-N 2.85Å; E107-K110 WeakPolarHBondContact O-CA 3.24Å; E107-K110 WeakPolarHBondContact O-CB 3.32Å; E107-K110 PolarHBondContact O-N 2.95Å; E107-K110 IonicContact OE1-NZ 2.65Å; E107-K110 PolarHBondContact OE1-NZ 2.95Å; E107-K110 WeakPolarHBondContact OE2-CE 3.39Å; E107-K110 IonicContact OE2-NZ 2.66Å; E107-K110 PolarHBondContact OE2-NZ 2.86Å; E107-S111 PolarHBondContact O-N 3.48Å
108	V	90.3	Very high	84.3	Confident	79 Å²	79	66.1 Å²	66.1	48%	0.479	34%	0.335	S	S	.	.	H	α-helix	trans	-58.8	-33.8	173.2	175.3	0	0	0	0	111.4	E104 K110 S111 A112 I146	E104-V108 WeakPolarHBondContact O-CG2 3.13Å; E104-V108 PolarHBondContact O-N 2.81Å; V108-K110 VanDerWaalsContact C-N 3.27Å; V108-K110 PolarHBondContact O-N 2.83Å; V108-S111 PolarHBondContact O-OG 3.26Å; V108-A112 VanDerWaalsContact O-CB 3.27Å; V108-A112 WeakPolarHBondContact O-CB 3.43Å; V108-A112 PolarHBondContact O-N 3.45Å; V108-A112 VanDerWaalsContact O-N 3.08Å; V108-I146 HydrophobicContact CB-CG2 4.44Å; V108-I146 HydrophobicContact CG1-CG2 4.18Å
109	S	87.1	Confident	82.8	Confident	7 Å²	7	73.3 Å²	73.3	5%	0.049	37%	0.373	C	S	.	.	H	α-helix	trans	-70.1	-19.5	174.5	-167.6	0	0	0	0	114.1	A105 E107 S142 A143	A105-S109 WeakPolarHBondContact O-CB 3.19Å; A105-S109 PolarHBondContact O-N 2.73Å; E107-S109 PolarHBondContact O-N 2.85Å; S109-S142 PolarHBondContact O-OG 2.86Å; S109-S142 PolarHBondContact OG-OG 2.9Å; S109-A143 WeakPolarHBondContact OG-CA 2.9Å; S109-A143 PolarHBondContact OG-N 3.45Å
110	K	87	Confident	81.2	Confident	90 Å²	90	78.4 Å²	78.4	39%	0.391	40%	0.402	S	S	.	.	H	α-helix	trans	-86.2	-46.9	171	-61.8	-178.6	-141.1	154.2	0	111.3	Q106 E107 V108 A112 I113	Q106-K110 PolarHBondContact O-N 3.23Å; E107-K110 WeakPolarHBondContact O-CA 3.24Å; E107-K110 WeakPolarHBondContact O-CB 3.32Å; E107-K110 PolarHBondContact O-N 2.95Å; E107-K110 IonicContact OE1-NZ 2.65Å; E107-K110 PolarHBondContact OE1-NZ 2.95Å; E107-K110 WeakPolarHBondContact OE2-CE 3.39Å; E107-K110 IonicContact OE2-NZ 2.66Å; E107-K110 PolarHBondContact OE2-NZ 2.86Å; V108-K110 VanDerWaalsContact C-N 3.27Å; V108-K110 PolarHBondContact O-N 2.83Å; K110-A112 VanDerWaalsContact C-N 3.25Å; K110-A112 PolarHBondContact O-N 3.28Å; K110-I113 VanDerWaalsContact O-CB 3.31Å; K110-I113 WeakPolarHBondContact O-CB 3.33Å; K110-I113 PolarHBondContact O-N 2.85Å
111	S	86	Confident	79.7	Confident	48 Å²	48	80.9 Å²	80.9	34%	0.336	41%	0.412	S	S	.	.	H	α-helix	trans	-60.7	-38.1	-178.6	67.3	0	0	0	0	111.5	E107 V108 I113 M114 E115	E107-S111 PolarHBondContact O-N 3.48Å; V108-S111 PolarHBondContact O-OG 3.26Å; S111-I113 PolarHBondContact O-N 3.05Å; S111-I113 VanDerWaalsContact O-N 3.09Å; S111-M114 WeakPolarHBondContact O-CB 3.39Å; S111-M114 PolarHBondContact O-N 3.15Å; S111-E115 PolarHBondContact O-N 3.39Å
112	A	81.2	Confident	78.3	Confident	11 Å²	11	83.7 Å²	83.7	9%	0.091	43%	0.43	C	S	.	.	H	α-helix	trans	-59.8	-18.6	174.2	0	0	0	0	0	114.3	V108 K110 I116 I146	V108-A112 VanDerWaalsContact O-CB 3.27Å; V108-A112 WeakPolarHBondContact O-CB 3.43Å; V108-A112 PolarHBondContact O-N 3.45Å; V108-A112 VanDerWaalsContact O-N 3.08Å; K110-A112 VanDerWaalsContact C-N 3.25Å; K110-A112 PolarHBondContact O-N 3.28Å; A112-I116 WeakPolarHBondContact O-CB 3.42Å; A112-I116 VanDerWaalsContact O-CD1 3.25Å; A112-I116 WeakPolarHBondContact O-CD1 3.34Å; A112-I116 WeakPolarHBondContact O-CG1 3.28Å; A112-I116 PolarHBondContact O-N 3.43Å; A112-I146 HydrophobicContact CB-CD1 3.87Å
113	I	72.5	Confident	77.1	Confident	26 Å²	26	91 Å²	91	13%	0.133	46%	0.464	C	S	.	.	H	α-helix	trans	-73	-45.4	172.8	-54.1	165.2	0	0	0	109.1	K110 S111 E115 I116 E117 Q139	K110-I113 VanDerWaalsContact O-CB 3.31Å; K110-I113 WeakPolarHBondContact O-CB 3.33Å; K110-I113 PolarHBondContact O-N 2.85Å; S111-I113 PolarHBondContact O-N 3.05Å; S111-I113 VanDerWaalsContact O-N 3.09Å; I113-E115 PolarHBondContact O-N 2.85Å; I113-E115 VanDerWaalsContact O-N 3.16Å; I113-I116 PolarHBondContact O-N 3.15Å; I113-E117 HydrophobicContact CG2-CB 4.24Å; I113-E117 VanDerWaalsContact O-CB 3.26Å; I113-E117 WeakPolarHBondContact O-CB 3.33Å; I113-E117 PolarHBondContact O-N 3.44Å; I113-Q139 HydrophobicContact CD1-CB 3.71Å; I113-Q139 HydrophobicContact CD1-CG 3.78Å
114	M	70.7	Confident	76.2	Confident	166 Å²	166	89.6 Å²	89.6	82%	0.818	46%	0.462	S	S	*	.	H	α-helix	trans	-64.9	-16.5	177.3	-56.3	175.4	63.2	0	0	113.5	S111	S111-M114 WeakPolarHBondContact O-CB 3.39Å; S111-M114 PolarHBondContact O-N 3.15Å
115	E	68.8	Low	75.7	Confident	158 Å²	158	89.6 Å²	89.6	74%	0.738	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-14.6	175.8	-67	170.5	-165.1	0	0	113.4	S111 I113	S111-E115 PolarHBondContact O-N 3.39Å; I113-E115 PolarHBondContact O-N 2.85Å; I113-E115 VanDerWaalsContact O-N 3.16Å
116	I	66.4	Low	75.2	Confident	123 Å²	123	96.3 Å²	96.3	63%	0.631	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	-33	-173.8	-68.2	171.8	0	0	0	112	A112 I113 D118	A112-I116 WeakPolarHBondContact O-CB 3.42Å; A112-I116 VanDerWaalsContact O-CD1 3.25Å; A112-I116 WeakPolarHBondContact O-CD1 3.34Å; A112-I116 WeakPolarHBondContact O-CG1 3.28Å; A112-I116 PolarHBondContact O-N 3.43Å; I113-I116 PolarHBondContact O-N 3.15Å; I116-D118 PolarHBondContact O-N 3.3Å
117	E	62.5	Low	74.8	Confident	86 Å²	86	94.7 Å²	94.7	40%	0.402	50%	0.495	S	S	.	.			trans	-88.5	89.6	-173.5	-160.4	154.8	-95.9	0	0	110	I113 L119 T138	I113-E117 HydrophobicContact CG2-CB 4.24Å; I113-E117 VanDerWaalsContact O-CB 3.26Å; I113-E117 WeakPolarHBondContact O-CB 3.33Å; I113-E117 PolarHBondContact O-N 3.44Å; E117-L119 PolarHBondContact O-N 3.32Å; E117-T138 VanDerWaalsContact OE1-CB 3.28Å; E117-T138 WeakPolarHBondContact OE1-CB 3.04Å; E117-T138 VanDerWaalsContact OE1-CG2 3.26Å; E117-T138 WeakPolarHBondContact OE1-CG2 3.4Å; E117-T138 PolarHBondContact OE1-OG1 2.72Å
118	D	65.8	Low	74.4	Confident	93 Å²	93	94.5 Å²	94.5	50%	0.497	50%	0.497	S	S	.	.			trans	-63	113.2	174.8	-171.4	-11.9	0	0	0	110.1	I116 D120 V121	I116-D118 PolarHBondContact O-N 3.3Å; D118-D120 PolarHBondContact O-N 2.89Å; D118-D120 PolarHBondContact OD1-N 2.87Å; D118-V121 CarbonylContact O-C 3.56Å; D118-V121 PolarHBondContact O-N 3.2Å; D118-V121 VanDerWaalsContact O-N 3.1Å
119	L	63.7	Low	74.1	Confident	151 Å²	151	97.6 Å²	97.6	79%	0.791	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-25.6	-177.8	-73.8	163	0	0	0	112.7	E117	E117-L119 PolarHBondContact O-N 3.32Å
120	D	62	Low	74	Confident	154 Å²	154	101.5 Å²	101.5	82%	0.824	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-14.7	179.9	-68.9	-23.4	0	0	0	112.6	D118	D118-D120 PolarHBondContact O-N 2.89Å; D118-D120 PolarHBondContact OD1-N 2.87Å
121	V	64	Low	73.9	Confident	77 Å²	77	100.8 Å²	100.8	47%	0.467	53%	0.528	S	S	.	.			trans	-138.7	68.5	-177.1	-165	0	0	0	0	112.4	D118 E123 T124	D118-V121 CarbonylContact O-C 3.56Å; D118-V121 PolarHBondContact O-N 3.2Å; D118-V121 VanDerWaalsContact O-N 3.1Å; V121-E123 VanDerWaalsContact C-N 3.26Å; V121-E123 PolarHBondContact O-N 3.36Å; V121-T124 HydrophobicContact CG1-CG2 4.36Å
122	L	62.9	Low	74	Confident	127 Å²	127	102.7 Å²	102.7	67%	0.665	55%	0.547	S	S	*	.	S	Bend	trans	-58.5	-30.5	179.8	-60.5	175.4	0	0	0	114.6
123	E	68.5	Low	74.4	Confident	154 Å²	154	108.3 Å²	108.3	72%	0.72	58%	0.58	S	S	*	*			trans	-117.9	80.7	-175.7	-66.4	-167.7	168.2	0	0	112.2	V121	V121-E123 VanDerWaalsContact C-N 3.26Å; V121-E123 PolarHBondContact O-N 3.36Å
124	T	76.1	Confident	74.9	Confident	63 Å²	63	109.2 Å²	109.2	39%	0.387	59%	0.589	S	S	.	*			trans	-70.2	149.1	164.7	67.2	0	0	0	0	110.4	V121 E126 S127 L128	V121-T124 HydrophobicContact CG1-CG2 4.36Å; T124-E126 PolarHBondContact O-N 2.66Å; T124-S127 WeakPolarHBondContact O-CA 3.32Å; T124-S127 WeakPolarHBondContact O-CB 3.42Å; T124-S127 PolarHBondContact O-N 3.22Å; T124-S127 VanDerWaalsContact OG1-CB 3.28Å; T124-S127 WeakPolarHBondContact OG1-CB 3.41Å; T124-S127 PolarHBondContact OG1-N 3.48Å; T124-L128 PolarHBondContact O-N 3Å
125	P	81.8	Confident	75.4	Confident	101 Å²	101	110.3 Å²	110.3	66%	0.656	59%	0.594	S	S	*	*	H	α-helix	trans	-62	-30.6	-179.1	23.6	-33.8	0	0	0	112.8	L128 M129	P125-L128 PolarHBondContact O-N 2.81Å; P125-M129 WeakPolarHBondContact O-CB 3.24Å; P125-M129 WeakPolarHBondContact O-CG 3.3Å; P125-M129 PolarHBondContact O-N 3.44Å
126	E	82.6	Confident	76	Confident	149 Å²	149	106 Å²	106	70%	0.696	57%	0.574	S	S	*	*	H	α-helix	trans	-68.4	-39.3	172.4	-62.2	-172	176.5	0	0	112.1	T124 M129 L130	T124-E126 PolarHBondContact O-N 2.66Å; E126-M129 PolarHBondContact O-N 3.03Å; E126-L130 WeakPolarHBondContact O-CB 3.29Å; E126-L130 VanDerWaalsContact O-CG 3.3Å; E126-L130 WeakPolarHBondContact O-CG 3.31Å; E126-L130 PolarHBondContact O-N 2.79Å
127	S	80.6	Confident	76.6	Confident	19 Å²	19	101.5 Å²	101.5	13%	0.133	56%	0.558	C	S	.	*	H	α-helix	trans	-61.2	-48.1	172.9	-169	0	0	0	0	110.5	T124 M129 L130 N131	T124-S127 WeakPolarHBondContact O-CA 3.32Å; T124-S127 WeakPolarHBondContact O-CB 3.42Å; T124-S127 PolarHBondContact O-N 3.22Å; T124-S127 VanDerWaalsContact OG1-CB 3.28Å; T124-S127 WeakPolarHBondContact OG1-CB 3.41Å; T124-S127 PolarHBondContact OG1-N 3.48Å; S127-M129 PolarHBondContact O-N 2.69Å; S127-L130 PolarHBondContact O-N 2.97Å; S127-N131 WeakPolarHBondContact O-CB 3.47Å; S127-N131 PolarHBondContact O-N 3.11Å; S127-N131 PolarHBondContact O-ND2 2.61Å; S127-N131 PolarHBondContact O-OD1 2.71Å
128	L	81	Confident	77.4	Confident	103 Å²	103	99.6 Å²	99.6	54%	0.539	55%	0.553	S	S	.	*	H	α-helix	trans	-59.7	-45.9	177.8	-174.9	64.6	0	0	0	112.4	T124 P125 L130 N131 A132	T124-L128 PolarHBondContact O-N 3Å; P125-L128 PolarHBondContact O-N 2.81Å; L128-L130 VanDerWaalsContact C-N 3.35Å; L128-L130 PolarHBondContact O-N 3.1Å; L128-N131 PolarHBondContact O-N 3.25Å; L128-A132 WeakPolarHBondContact O-CB 3.25Å; L128-A132 PolarHBondContact O-N 3.41Å
129	M	85.6	Confident	78.2	Confident	143 Å²	143	101.2 Å²	101.2	70%	0.704	56%	0.557	S	S	*	*	H	α-helix	trans	-61.8	-39.9	175.8	-77.4	-175.1	68.4	0	0	112.7	P125 E126 S127 V133	P125-M129 WeakPolarHBondContact O-CB 3.24Å; P125-M129 WeakPolarHBondContact O-CG 3.3Å; P125-M129 PolarHBondContact O-N 3.44Å; E126-M129 PolarHBondContact O-N 3.03Å; S127-M129 PolarHBondContact O-N 2.69Å; M129-V133 WeakPolarHBondContact O-CG2 3.44Å
130	L	85	Confident	79.2	Confident	90 Å²	90	98.3 Å²	98.3	47%	0.471	54%	0.542	S	S	.	.	H	α-helix	trans	-71.8	-38.3	177.6	-71.9	169.9	0	0	0	111.8	E126 S127 L128 A132 V133 S134	E126-L130 WeakPolarHBondContact O-CB 3.29Å; E126-L130 VanDerWaalsContact O-CG 3.3Å; E126-L130 WeakPolarHBondContact O-CG 3.31Å; E126-L130 PolarHBondContact O-N 2.79Å; S127-L130 PolarHBondContact O-N 2.97Å; L128-L130 VanDerWaalsContact C-N 3.35Å; L128-L130 PolarHBondContact O-N 3.1Å; L130-A132 VanDerWaalsContact C-N 3.3Å; L130-A132 PolarHBondContact O-N 3.32Å; L130-V133 PolarHBondContact O-N 3.05Å; L130-S134 PolarHBondContact O-N 2.92Å; L130-S134 VanDerWaalsContact O-O 3.14Å
131	N	84.7	Confident	80.2	Confident	74 Å²	74	94.1 Å²	94.1	40%	0.396	52%	0.515	S	S	.	.	H	α-helix	trans	-66.1	-32.4	177.4	-63.8	-7.1	0	0	0	111.9	S127 L128 V133 S134 R141	S127-N131 WeakPolarHBondContact O-CB 3.47Å; S127-N131 PolarHBondContact O-N 3.11Å; S127-N131 PolarHBondContact O-ND2 2.61Å; S127-N131 PolarHBondContact O-OD1 2.71Å; L128-N131 PolarHBondContact O-N 3.25Å; N131-V133 PolarHBondContact O-N 2.94Å; N131-S134 WeakPolarHBondContact CA-O 3.45Å; N131-R141 PolarHBondContact OD1-NH2 3.12Å
132	A	86.8	Confident	81.2	Confident	89 Å²	89	91 Å²	91	74%	0.736	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-18	172.3	0	0	0	0	0	114	L128 L130	L128-A132 WeakPolarHBondContact O-CB 3.25Å; L128-A132 PolarHBondContact O-N 3.41Å; L130-A132 VanDerWaalsContact C-N 3.3Å; L130-A132 PolarHBondContact O-N 3.32Å
133	V	89.7	Confident	82.5	Confident	129 Å²	129	86 Å²	86	78%	0.782	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-29.9	178.5	176	0	0	0	0	112.1	M129 L130 N131	M129-V133 WeakPolarHBondContact O-CG2 3.44Å; L130-V133 PolarHBondContact O-N 3.05Å; N131-V133 PolarHBondContact O-N 2.94Å
134	S	83.5	Confident	83.4	Confident	45 Å²	45	85.8 Å²	85.8	32%	0.315	47%	0.466	S	S	.	.			trans	-154.9	135.7	-177.3	179.9	0	0	0	0	111.9	L130 N131 E136	L130-S134 PolarHBondContact O-N 2.92Å; L130-S134 VanDerWaalsContact O-O 3.14Å; N131-S134 WeakPolarHBondContact CA-O 3.45Å; S134-E136 PolarHBondContact O-N 3.4Å; S134-E136 VanDerWaalsContact O-N 3.11Å; S134-E136 WeakPolarHBondContact OG-CG 3.2Å; S134-E136 PolarHBondContact OG-N 2.83Å
135	M	81.4	Confident	84	Confident	189 Å²	189	87.7 Å²	87.7	93%	0.931	48%	0.477	S	S	*	.			trans	-74.8	11.4	173.9	-58.2	-105.7	-71.5	0	0	113.4	G137	M135-G137 PolarHBondContact O-N 2.83Å
136	E	81.3	Confident	84.5	Confident	66 Å²	66	85.2 Å²	85.2	31%	0.308	46%	0.458	S	S	.	.			trans	-71.8	106.7	175.1	-77	-178.1	-139.5	0	0	110.9	S134 D140 R141 R144	S134-E136 PolarHBondContact O-N 3.4Å; S134-E136 VanDerWaalsContact O-N 3.11Å; S134-E136 WeakPolarHBondContact OG-CG 3.2Å; S134-E136 PolarHBondContact OG-N 2.83Å; E136-D140 HydrophobicContact CB-CB 4.25Å; E136-D140 HydrophobicContact CG-CB 4.47Å; E136-R141 PolarHBondContact O-NE 3.47Å; E136-R141 PolarHBondContact O-NH2 2.97Å; E136-R144 IonicContact OE1-CZ 3.4Å; E136-R144 IonicContact OE1-NH1 2.73Å; E136-R144 PolarHBondContact OE1-NH1 3.44Å; E136-R144 IonicContact OE2-CZ 3.28Å; E136-R144 IonicContact OE2-NH1 3.17Å; E136-R144 PolarHBondContact OE2-NH1 3.45Å
137	G	79.1	Confident	85	Confident	29 Å²	29	78.8 Å²	78.8	30%	0.299	43%	0.429	S	S	.	.			trans	-72	176.9	179.8	0	0	0	0	0	114.8	M135 Q139 D140 R141	M135-G137 PolarHBondContact O-N 2.83Å; G137-Q139 VanDerWaalsContact C-N 3.3Å; G137-Q139 PolarHBondContact O-N 2.85Å; G137-D140 PolarHBondContact O-N 2.76Å; G137-D140 VanDerWaalsContact O-N 3.07Å; G137-R141 WeakPolarHBondContact O-CG 3.15Å; G137-R141 PolarHBondContact O-N 3.32Å; G137-R141 VanDerWaalsContact O-N 3.09Å
138	T	79.9	Confident	85.5	Confident	47 Å²	47	80 Å²	80	29%	0.288	43%	0.433	S	S	.	.	H	α-helix	trans	-51.1	-46.3	175.4	47	0	0	0	0	112.3	E117 D140 R141 S142	E117-T138 VanDerWaalsContact OE1-CB 3.28Å; E117-T138 WeakPolarHBondContact OE1-CB 3.04Å; E117-T138 VanDerWaalsContact OE1-CG2 3.26Å; E117-T138 WeakPolarHBondContact OE1-CG2 3.4Å; E117-T138 PolarHBondContact OE1-OG1 2.72Å; T138-D140 PolarHBondContact O-N 3.03Å; T138-R141 PolarHBondContact O-N 2.78Å; T138-S142 PolarHBondContact O-N 3.35Å
139	Q	81.6	Confident	86.1	Confident	126 Å²	126	77.4 Å²	77.4	59%	0.589	42%	0.422	S	S	*	.	H	α-helix	trans	-57.1	-43.1	174.5	178	169.1	0.7	0	0	113.6	I113 G137 S142 A143	I113-Q139 HydrophobicContact CD1-CB 3.71Å; I113-Q139 HydrophobicContact CD1-CG 3.78Å; G137-Q139 VanDerWaalsContact C-N 3.3Å; G137-Q139 PolarHBondContact O-N 2.85Å; Q139-S142 PolarHBondContact O-OG 3.36Å; Q139-S142 VanDerWaalsContact O-OG 3.08Å; Q139-A143 VanDerWaalsContact O-CB 3.24Å; Q139-A143 WeakPolarHBondContact O-CB 3.33Å; Q139-A143 PolarHBondContact O-N 2.8Å
140	D	84.8	Confident	86.5	Confident	90 Å²	90	72 Å²	72	48%	0.481	39%	0.394	S	S	.	.	H	α-helix	trans	-69.9	-36.5	179.4	-76.7	-47.7	0	0	0	111.2	E136 G137 T138 A143 R144	E136-D140 HydrophobicContact CB-CB 4.25Å; E136-D140 HydrophobicContact CG-CB 4.47Å; G137-D140 PolarHBondContact O-N 2.76Å; G137-D140 VanDerWaalsContact O-N 3.07Å; T138-D140 PolarHBondContact O-N 3.03Å; D140-A143 PolarHBondContact O-N 2.73Å; D140-R144 WeakPolarHBondContact O-CB 3.45Å; D140-R144 PolarHBondContact O-N 2.75Å
141	R	84.5	Confident	87	Confident	67 Å²	67	68 Å²	68	25%	0.253	37%	0.373	S	S	.	.	H	α-helix	trans	-66	-41.5	176.4	-62	169.4	-157.5	176	8	111.5	N131 E136 G137 T138 T145	N131-R141 PolarHBondContact OD1-NH2 3.12Å; E136-R141 PolarHBondContact O-NE 3.47Å; E136-R141 PolarHBondContact O-NH2 2.97Å; G137-R141 WeakPolarHBondContact O-CG 3.15Å; G137-R141 PolarHBondContact O-N 3.32Å; G137-R141 VanDerWaalsContact O-N 3.09Å; T138-R141 PolarHBondContact O-N 2.78Å; R141-T145 PolarHBondContact O-N 3.32Å; R141-T145 PolarHBondContact O-OG1 2.69Å
142	S	84.6	Confident	87.4	Confident	12 Å²	12	70 Å²	70	8%	0.084	38%	0.378	C	S	.	.	H	α-helix	trans	-66.5	-45.9	173.8	80.7	0	0	0	0	111.2	S109 T138 Q139 R144 T145 I146	S109-S142 PolarHBondContact O-OG 2.86Å; S109-S142 PolarHBondContact OG-OG 2.9Å; T138-S142 PolarHBondContact O-N 3.35Å; Q139-S142 PolarHBondContact O-OG 3.36Å; Q139-S142 VanDerWaalsContact O-OG 3.08Å; S142-R144 PolarHBondContact O-N 2.81Å; S142-T145 PolarHBondContact O-N 2.78Å; S142-T145 VanDerWaalsContact O-N 3.09Å; S142-I146 PolarHBondContact O-N 3.41Å
143	A	88.6	Confident	87.8	Confident	20 Å²	20	66.4 Å²	66.4	17%	0.165	35%	0.346	C	S	.	.	H	α-helix	trans	-63.8	-37.4	179	0	0	0	0	0	113	S109 Q139 D140 T145 L147 M148	S109-A143 WeakPolarHBondContact OG-CA 2.9Å; S109-A143 PolarHBondContact OG-N 3.45Å; Q139-A143 VanDerWaalsContact O-CB 3.24Å; Q139-A143 WeakPolarHBondContact O-CB 3.33Å; Q139-A143 PolarHBondContact O-N 2.8Å; D140-A143 PolarHBondContact O-N 2.73Å; A143-T145 VanDerWaalsContact C-N 3.25Å; A143-T145 PolarHBondContact O-N 3.23Å; A143-L147 CarbonylContact O-C 3.59Å; A143-L147 WeakPolarHBondContact O-CB 3.33Å; A143-L147 PolarHBondContact O-N 3.36Å; A143-L147 VanDerWaalsContact O-N 3.15Å; A143-M148 PolarHBondContact O-N 2.98Å
144	R	88.7	Confident	88	Confident	150 Å²	150	60.4 Å²	60.4	57%	0.566	31%	0.31	S	S	*	.	H	α-helix	trans	-64.4	-30	174.6	-173.9	174.5	-175.6	141.9	-4.4	112.5	E136 D140 S142	E136-R144 IonicContact OE1-CZ 3.4Å; E136-R144 IonicContact OE1-NH1 2.73Å; E136-R144 PolarHBondContact OE1-NH1 3.44Å; E136-R144 IonicContact OE2-CZ 3.28Å; E136-R144 IonicContact OE2-NH1 3.17Å; E136-R144 PolarHBondContact OE2-NH1 3.45Å; D140-R144 WeakPolarHBondContact O-CB 3.45Å; D140-R144 PolarHBondContact O-N 2.75Å; S142-R144 PolarHBondContact O-N 2.81Å
145	T	89	Confident	88.6	Confident	103 Å²	103	59 Å²	59	63%	0.632	30%	0.297	S	S	*	.	H	α-helix	trans	-89.3	-50.3	-177.4	-55	0	0	0	0	112.4	R141 S142 A143 P149	R141-T145 PolarHBondContact O-N 3.32Å; R141-T145 PolarHBondContact O-OG1 2.69Å; S142-T145 PolarHBondContact O-N 2.78Å; S142-T145 VanDerWaalsContact O-N 3.09Å; A143-T145 VanDerWaalsContact C-N 3.25Å; A143-T145 PolarHBondContact O-N 3.23Å; T145-P149 WeakPolarHBondContact O-CD 3.17Å; T145-P149 WeakPolarHBondContact O-CG 3.45Å
146	I	91	Very high	89.2	Confident	49 Å²	49	53.4 Å²	53.4	25%	0.251	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-53.6	-170.6	-61.3	167.8	0	0	0	111.3	A105 V108 A112 S142	A105-I146 HydrophobicContact CB-CG2 4.46Å; V108-I146 HydrophobicContact CB-CG2 4.44Å; V108-I146 HydrophobicContact CG1-CG2 4.18Å; A112-I146 HydrophobicContact CB-CD1 3.87Å; S142-I146 PolarHBondContact O-N 3.41Å
147	L	92.7	Very high	89.9	Confident	15 Å²	15	50.3 Å²	50.3	8%	0.079	26%	0.257	C	S	.	.	H	α-helix	trans	-83.1	-39.5	-170.9	175.3	58.4	0	0	0	112.7	T102 Q106 A143 W150 L151	T102-L147 HydrophobicContact CG2-CD1 3.97Å; Q106-L147 HydrophobicContact CB-CD1 3.98Å; Q106-L147 HydrophobicContact CB-CD2 4.22Å; Q106-L147 HydrophobicContact CG-CD2 4.16Å; A143-L147 CarbonylContact O-C 3.59Å; A143-L147 WeakPolarHBondContact O-CB 3.33Å; A143-L147 PolarHBondContact O-N 3.36Å; A143-L147 VanDerWaalsContact O-N 3.15Å; L147-W150 WeakPolarHBondContact O-CA 3.43Å; L147-W150 WeakPolarHBondContact O-CB 3.29Å; L147-W150 PolarHBondContact O-N 3.36Å; L147-L151 HydrophobicContact CD1-CD1 4.39Å; L147-L151 HydrophobicContact CD1-CD2 4.13Å; L147-L151 HydrophobicContact CD1-CG 3.93Å; L147-L151 HydrophobicContact CD2-CD1 4.22Å; L147-L151 HydrophobicContact CG-CD1 3.82Å; L147-L151 HydrophobicContact CG-CD2 4.45Å; L147-L151 HydrophobicContact CG-CG 3.88Å; L147-L151 PolarHBondContact O-N 2.76Å
148	M	92.1	Very high	90.7	Very high	45 Å²	45	49.2 Å²	49.2	22%	0.222	24%	0.244	C	C	.	.	H	α-helix	trans	-63.1	-33.4	-173.7	-163.9	143.1	-57.5	0	0	115.5	A143 W150 L151 K152 R191	A143-M148 PolarHBondContact O-N 2.98Å; M148-W150 VanDerWaalsContact C-N 3.31Å; M148-W150 PolarHBondContact O-N 3.4Å; M148-L151 HydrophobicContact CE-CD1 4.46Å; M148-L151 PolarHBondContact O-N 3.02Å; M148-K152 HydrophobicContact CG-CD 4.37Å; M148-K152 HydrophobicContact CG-CG 4.44Å; M148-K152 WeakPolarHBondContact O-CB 3.21Å; M148-K152 WeakPolarHBondContact O-CG 3.38Å; M148-K152 PolarHBondContact O-N 2.73Å; M148-R191 VanDerWaalsContact CE-NH1 3.29Å
149	P	93.2	Very high	91.5	Very high	48 Å²	48	52.6 Å²	52.6	31%	0.312	25%	0.251	S	S	.	.	H	α-helix	trans	-57.8	-40.9	168.8	-26.8	36.3	0	0	0	113	T145 F153	T145-P149 WeakPolarHBondContact O-CD 3.17Å; T145-P149 WeakPolarHBondContact O-CG 3.45Å; P149-F153 VanDerWaalsContact O-CB 3.29Å; P149-F153 WeakPolarHBondContact O-CB 3.41Å; P149-F153 PolarHBondContact O-N 2.67Å; P149-F153 VanDerWaalsContact O-N 3.08Å
150	W	94.7	Very high	92.1	Very high	28 Å²	28	47.2 Å²	47.2	11%	0.106	23%	0.226	C	C	.	.	H	α-helix	trans	-71.7	-41.8	176.3	-69.6	111	0	0	0	112.3	R63 K101 T102 A105 L147 M148 K152 F153 L154	R63-W150 HydrophobicContact CG-CE3 4.5Å; R63-W150 HydrophobicContact CG-CH2 4.12Å; R63-W150 HydrophobicContact CG-CZ3 3.91Å; R63-W150 VanDerWaalsContact NH2-CZ2 3.28Å; K101-W150 HydrophobicContact CB-CE3 4.15Å; K101-W150 HydrophobicContact CB-CH2 3.91Å; K101-W150 HydrophobicContact CB-CZ2 4.27Å; K101-W150 HydrophobicContact CB-CZ3 3.84Å; K101-W150 HydrophobicContact CD-CH2 4.2Å; K101-W150 HydrophobicContact CD-CZ2 4.42Å; K101-W150 HydrophobicContact CG-CH2 4.32Å; T102-W150 HydrophobicContact CG2-CB 4.14Å; A105-W150 HydrophobicContact CB-CB 4.49Å; A105-W150 HydrophobicContact CB-CG 3.93Å; L147-W150 WeakPolarHBondContact O-CA 3.43Å; L147-W150 WeakPolarHBondContact O-CB 3.29Å; L147-W150 PolarHBondContact O-N 3.36Å; M148-W150 VanDerWaalsContact C-N 3.31Å; M148-W150 PolarHBondContact O-N 3.4Å; W150-K152 VanDerWaalsContact C-N 3.33Å; W150-K152 PolarHBondContact O-N 2.74Å; W150-F153 AromaticContact CE3-CD1 3.88Å; W150-F153 HydrophobicContact CE3-CD1 3.88Å; W150-F153 HydrophobicContact CE3-CE1 4.48Å; W150-F153 HydrophobicContact CZ3-CD1 4.01Å; W150-F153 HydrophobicContact CZ3-CE1 4.16Å; W150-F153 WeakPolarHBondContact O-CB 3.43Å; W150-F153 PolarHBondContact O-N 2.7Å; W150-F153 VanDerWaalsContact O-N 3.11Å; W150-L154 WeakPolarHBondContact O-CB 3.41Å; W150-L154 PolarHBondContact O-N 2.88Å
151	L	94.7	Very high	92.6	Very high	7 Å²	7	42.9 Å²	42.9	4%	0.037	20%	0.203	C	C	.	.	H	α-helix	trans	-58.4	-43.4	175.1	-66.5	176.9	0	0	0	112.2	T102 L147 M148 L154 W155 F185 Y189	T102-L151 HydrophobicContact CG2-CD2 3.76Å; T102-L151 HydrophobicContact CG2-CG 4.49Å; L147-L151 HydrophobicContact CD1-CD1 4.39Å; L147-L151 HydrophobicContact CD1-CD2 4.13Å; L147-L151 HydrophobicContact CD1-CG 3.93Å; L147-L151 HydrophobicContact CD2-CD1 4.22Å; L147-L151 HydrophobicContact CG-CD1 3.82Å; L147-L151 HydrophobicContact CG-CD2 4.45Å; L147-L151 HydrophobicContact CG-CG 3.88Å; L147-L151 PolarHBondContact O-N 2.76Å; M148-L151 HydrophobicContact CE-CD1 4.46Å; M148-L151 PolarHBondContact O-N 3.02Å; L151-L154 PolarHBondContact O-N 3.41Å; L151-W155 WeakPolarHBondContact O-CB 3.22Å; L151-W155 PolarHBondContact O-N 3.24Å; L151-F185 HydrophobicContact CD2-CE2 3.83Å; L151-Y189 HydrophobicContact CD1-CD1 4.29Å; L151-Y189 HydrophobicContact CD1-CG 4.41Å; L151-Y189 HydrophobicContact CD2-CD1 3.62Å; L151-Y189 HydrophobicContact CD2-CD2 3.56Å; L151-Y189 HydrophobicContact CD2-CE1 3.83Å; L151-Y189 HydrophobicContact CD2-CE2 3.78Å; L151-Y189 HydrophobicContact CD2-CG 3.48Å; L151-Y189 VanDerWaalsContact CD2-CG 3.48Å
152	K	93.7	Very high	93.1	Very high	116 Å²	116	39.7 Å²	39.7	50%	0.504	19%	0.191	S	C	.	.	H	α-helix	trans	-62.9	-42.9	174.1	-73.2	171.9	178.9	171.6	0	111.8	M148 W150 W155 D156	M148-K152 HydrophobicContact CG-CD 4.37Å; M148-K152 HydrophobicContact CG-CG 4.44Å; M148-K152 WeakPolarHBondContact O-CB 3.21Å; M148-K152 WeakPolarHBondContact O-CG 3.38Å; M148-K152 PolarHBondContact O-N 2.73Å; W150-K152 VanDerWaalsContact C-N 3.33Å; W150-K152 PolarHBondContact O-N 2.74Å; K152-W155 PolarHBondContact O-N 3.07Å; K152-D156 PolarHBondContact O-N 2.86Å
153	F	94.3	Very high	93.5	Very high	13 Å²	13	40.3 Å²	40.3	6%	0.057	19%	0.194	C	C	.	.	H	α-helix	trans	-65.2	-38.8	179.5	-177.3	-111.5	0	0	0	112.8	V60 R63 N65 I98 P149 W150 S157	V60-F153 HydrophobicContact CG1-CE1 4.49Å; R63-F153 VanDerWaalsContact CA-CZ 3.49Å; R63-F153 HydrophobicContact CB-CD2 3.94Å; R63-F153 HydrophobicContact CB-CE2 3.78Å; R63-F153 HydrophobicContact CB-CG 4.45Å; R63-F153 HydrophobicContact CB-CZ 4.16Å; R63-F153 HydrophobicContact CG-CD1 4.49Å; R63-F153 HydrophobicContact CG-CD2 4.48Å; R63-F153 HydrophobicContact CG-CE1 4.47Å; R63-F153 HydrophobicContact CG-CE2 4.48Å; R63-F153 VanDerWaalsContact O-CE2 3.31Å; R63-F153 WeakPolarHBondContact O-CE2 3.41Å; N65-F153 HydrophobicContact CB-CD2 4.45Å; N65-F153 HydrophobicContact CB-CE2 4.05Å; N65-F153 VanDerWaalsContact ND2-CD2 3.35Å; N65-F153 WeakPolarHBondContact ND2-CD2 3.33Å; N65-F153 PolarHBondContact ND2-O 3Å; N65-F153 WeakPolarHBondContact OD1-CE2 3.32Å; N65-F153 WeakPolarHBondContact OD1-CZ 3.13Å; I98-F153 HydrophobicContact CD1-CD1 4.35Å; I98-F153 HydrophobicContact CD1-CE1 3.76Å; I98-F153 HydrophobicContact CD1-CZ 4.23Å; I98-F153 HydrophobicContact CG1-CD1 4.39Å; I98-F153 HydrophobicContact CG1-CE1 3.8Å; I98-F153 HydrophobicContact CG2-CD1 3.73Å; I98-F153 HydrophobicContact CG2-CE1 4.02Å; P149-F153 VanDerWaalsContact O-CB 3.29Å; P149-F153 WeakPolarHBondContact O-CB 3.41Å; P149-F153 PolarHBondContact O-N 2.67Å; P149-F153 VanDerWaalsContact O-N 3.08Å; W150-F153 AromaticContact CE3-CD1 3.88Å; W150-F153 HydrophobicContact CE3-CD1 3.88Å; W150-F153 HydrophobicContact CE3-CE1 4.48Å; W150-F153 HydrophobicContact CZ3-CD1 4.01Å; W150-F153 HydrophobicContact CZ3-CE1 4.16Å; W150-F153 WeakPolarHBondContact O-CB 3.43Å; W150-F153 PolarHBondContact O-N 2.7Å; W150-F153 VanDerWaalsContact O-N 3.11Å; F153-S157 WeakPolarHBondContact O-CB 3.3Å; F153-S157 PolarHBondContact O-N 2.88Å; F153-S157 VanDerWaalsContact O-N 3.12Å; F153-S157 PolarHBondContact O-OG 2.94Å
154	L	95.1	Very high	93.7	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-69.5	-44.6	173.5	179.1	54.6	0	0	0	111.9	I98 K99 T102 W150 L151 S157 Y158 F185	I98-L154 HydrophobicContact CB-CD1 4.23Å; I98-L154 HydrophobicContact CG2-CB 3.8Å; I98-L154 HydrophobicContact CG2-CD1 3.79Å; I98-L154 HydrophobicContact CG2-CG 4.32Å; K99-L154 HydrophobicContact CG-CD1 4.39Å; T102-L154 HydrophobicContact CG2-CD2 4.04Å; W150-L154 WeakPolarHBondContact O-CB 3.41Å; W150-L154 PolarHBondContact O-N 2.88Å; L151-L154 PolarHBondContact O-N 3.41Å; L154-S157 WeakPolarHBondContact O-CB 3.16Å; L154-S157 PolarHBondContact O-N 2.96Å; L154-S157 VanDerWaalsContact O-N 3.16Å; L154-Y158 HydrophobicContact CD1-CD2 4.05Å; L154-Y158 HydrophobicContact CD1-CE2 3.52Å; L154-Y158 HydrophobicContact CD2-CE2 4.22Å; L154-Y158 HydrophobicContact CG-CD2 4.09Å; L154-Y158 HydrophobicContact CG-CE2 3.62Å; L154-Y158 WeakPolarHBondContact O-CD2 3.41Å; L154-Y158 PolarHBondContact O-N 3.32Å; L154-F185 HydrophobicContact CB-CE2 4.3Å; L154-F185 HydrophobicContact CD2-CD2 3.58Å; L154-F185 HydrophobicContact CD2-CE2 3.76Å; L154-F185 HydrophobicContact CG-CD2 3.97Å; L154-F185 HydrophobicContact CG-CE2 3.97Å
155	W	95.8	Very high	93.9	Very high	14 Å²	14	32.3 Å²	32.3	5%	0.053	16%	0.159	C	C	.	.	H	α-helix	trans	-58	-51.3	173.8	164.3	-104.8	0	0	0	112.4	L151 K152 S157 Y158 R159 F185 E194 K197 L198	L151-W155 WeakPolarHBondContact O-CB 3.22Å; L151-W155 PolarHBondContact O-N 3.24Å; K152-W155 PolarHBondContact O-N 3.07Å; W155-S157 PolarHBondContact O-N 2.73Å; W155-Y158 PolarHBondContact O-N 2.59Å; W155-R159 HydrophobicContact CZ2-CB 4.48Å; W155-R159 WeakPolarHBondContact O-CB 3.45Å; W155-R159 PolarHBondContact O-N 3.17Å; W155-F185 HydrophobicContact CB-CE1 3.89Å; W155-F185 HydrophobicContact CB-CZ 3.92Å; W155-F185 HydrophobicContact CE3-CE1 4.12Å; W155-E194 HydrophobicContact CD2-CB 3.82Å; W155-E194 HydrophobicContact CD2-CG 3.75Å; W155-E194 HydrophobicContact CE3-CB 3.85Å; W155-E194 HydrophobicContact CE3-CG 4.3Å; W155-E194 HydrophobicContact CG-CB 4.34Å; W155-E194 HydrophobicContact CG-CG 3.8Å; W155-E194 WeakPolarHBondContact CH2-O 3.46Å; W155-E194 HydrophobicContact CZ2-CB 4.5Å; W155-E194 HydrophobicContact CZ3-CB 4.2Å; W155-K197 HydrophobicContact CH2-CB 4.2Å; W155-K197 HydrophobicContact CZ2-CB 3.83Å; W155-K197 HydrophobicContact CZ2-CD 4.5Å; W155-L198 HydrophobicContact CH2-CB 3.81Å; W155-L198 HydrophobicContact CH2-CD1 4.37Å; W155-L198 HydrophobicContact CZ3-CB 3.96Å; W155-L198 HydrophobicContact CZ3-CD1 4.32Å; W155-L198 HydrophobicContact CZ3-CD2 4.46Å; W155-L198 HydrophobicContact CZ3-CG 4.48Å
156	D	94.8	Very high	93.9	Very high	73 Å²	73	30.7 Å²	30.7	39%	0.39	14%	0.141	S	C	.	.	H	α-helix	trans	-64	-26.2	178.2	-86.8	-25.7	0	0	0	111.9	K152 L160	K152-D156 PolarHBondContact O-N 2.86Å; D156-L160 WeakPolarHBondContact O-CB 3.35Å; D156-L160 PolarHBondContact O-N 3.46Å
157	S	94.7	Very high	93.3	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-71.7	-45.8	173.6	-68.1	0	0	0	0	112.8	N65 Y94 I98 F153 L154 W155 R159 L160 V161	N65-S157 PolarHBondContact OD1-OG 3.47Å; Y94-S157 PolarHBondContact OH-OG 3.49Å; I98-S157 VanDerWaalsContact CD1-OG 3.24Å; I98-S157 WeakPolarHBondContact CD1-OG 3.48Å; F153-S157 WeakPolarHBondContact O-CB 3.3Å; F153-S157 PolarHBondContact O-N 2.88Å; F153-S157 VanDerWaalsContact O-N 3.12Å; F153-S157 PolarHBondContact O-OG 2.94Å; L154-S157 WeakPolarHBondContact O-CB 3.16Å; L154-S157 PolarHBondContact O-N 2.96Å; L154-S157 VanDerWaalsContact O-N 3.16Å; W155-S157 PolarHBondContact O-N 2.73Å; S157-R159 VanDerWaalsContact C-N 3.33Å; S157-R159 PolarHBondContact O-N 2.83Å; S157-L160 PolarHBondContact O-N 3.38Å; S157-V161 WeakPolarHBondContact O-CG2 3.36Å; S157-V161 PolarHBondContact O-N 2.81Å
158	Y	96.5	Very high	93	Very high	7 Å²	7	30.6 Å²	30.6	3%	0.027	15%	0.146	C	C	.	.	H	α-helix	trans	-57.5	-48.2	170.8	-75.4	-56	0	0	0	111.1	L95 K99 L154 W155 L160 V161 L162 V178 D181 A182 F185	L95-Y158 HydrophobicContact CD1-CD1 4.47Å; L95-Y158 HydrophobicContact CD1-CE1 4.42Å; L95-Y158 HydrophobicContact CD2-CD1 4.04Å; L95-Y158 HydrophobicContact CD2-CE1 4.19Å; K99-Y158 WeakPolarHBondContact CE-OH 3.46Å; L154-Y158 HydrophobicContact CD1-CD2 4.05Å; L154-Y158 HydrophobicContact CD1-CE2 3.52Å; L154-Y158 HydrophobicContact CD2-CE2 4.22Å; L154-Y158 HydrophobicContact CG-CD2 4.09Å; L154-Y158 HydrophobicContact CG-CE2 3.62Å; L154-Y158 WeakPolarHBondContact O-CD2 3.41Å; L154-Y158 PolarHBondContact O-N 3.32Å; W155-Y158 PolarHBondContact O-N 2.59Å; Y158-L160 PolarHBondContact O-N 3.18Å; Y158-V161 PolarHBondContact O-N 3.04Å; Y158-L162 WeakPolarHBondContact O-CG 3.25Å; Y158-L162 PolarHBondContact O-N 2.68Å; Y158-V178 HydrophobicContact CD1-CG1 4.02Å; Y158-D181 HydrophobicContact CE1-CB 3.72Å; Y158-A182 HydrophobicContact CD1-CB 4.02Å; Y158-A182 HydrophobicContact CD2-CB 4.27Å; Y158-A182 HydrophobicContact CG-CB 3.85Å; Y158-F185 HydrophobicContact CD2-CB 4.28Å; Y158-F185 HydrophobicContact CD2-CD1 4.15Å; Y158-F185 HydrophobicContact CD2-CG 4.1Å; Y158-F185 HydrophobicContact CE2-CB 3.52Å; Y158-F185 HydrophobicContact CE2-CD1 4.13Å; Y158-F185 HydrophobicContact CE2-CD2 4.04Å; Y158-F185 AromaticContact CE2-CG 3.62Å; Y158-F185 HydrophobicContact CE2-CG 3.62Å
159	R	95.6	Very high	92.7	Very high	118 Å²	118	30.7 Å²	30.7	45%	0.445	15%	0.151	S	C	.	.	H	α-helix	trans	-56.1	-48.9	176.8	-179.3	-175.5	176.4	-172.7	4.1	111.9	W155 S157 L162 D163 L201	W155-R159 HydrophobicContact CZ2-CB 4.48Å; W155-R159 WeakPolarHBondContact O-CB 3.45Å; W155-R159 PolarHBondContact O-N 3.17Å; S157-R159 VanDerWaalsContact C-N 3.33Å; S157-R159 PolarHBondContact O-N 2.83Å; R159-L162 PolarHBondContact O-N 2.93Å; R159-D163 WeakPolarHBondContact O-CB 3.26Å; R159-D163 PolarHBondContact O-N 3.39Å; R159-L201 HydrophobicContact CG-CD1 3.8Å
160	L	94.5	Very high	92.4	Very high	12 Å²	12	33.4 Å²	33.4	6%	0.063	16%	0.158	C	C	.	.	H	α-helix	trans	-58.6	-46.2	178.8	-179.5	170.9	0	0	0	111.5	F68 R69 I72 D156 S157 Y158 D163 L164	F68-L160 HydrophobicContact CD1-CD1 3.89Å; F68-L160 HydrophobicContact CD1-CD2 3.89Å; F68-L160 HydrophobicContact CE1-CD2 3.75Å; R69-L160 HydrophobicContact CB-CD1 3.69Å; R69-L160 HydrophobicContact CB-CG 4.15Å; R69-L160 HydrophobicContact CG-CD1 4.19Å; R69-L160 HydrophobicContact CG-CG 4.11Å; I72-L160 HydrophobicContact CG2-CD2 4.12Å; D156-L160 WeakPolarHBondContact O-CB 3.35Å; D156-L160 PolarHBondContact O-N 3.46Å; S157-L160 PolarHBondContact O-N 3.38Å; Y158-L160 PolarHBondContact O-N 3.18Å; L160-D163 PolarHBondContact O-N 2.77Å; L160-L164 VanDerWaalsContact O-CB 3.31Å; L160-L164 WeakPolarHBondContact O-CB 3.45Å; L160-L164 PolarHBondContact O-N 2.76Å
161	V	95.4	Very high	92.2	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67.1	-40.9	179.4	174.3	0	0	0	0	111.2	I91 Y94 L95 S157 Y158 L164 L165 V178	I91-V161 HydrophobicContact CG2-CG1 3.54Å; I91-V161 HydrophobicContact CG2-CG2 4.09Å; Y94-V161 HydrophobicContact CD1-CG2 4.31Å; Y94-V161 HydrophobicContact CE1-CG2 4.31Å; L95-V161 HydrophobicContact CD1-CG1 4.37Å; L95-V161 HydrophobicContact CD1-CG2 4.41Å; L95-V161 HydrophobicContact CD2-CG2 4.17Å; L95-V161 HydrophobicContact CG-CG2 4.35Å; S157-V161 WeakPolarHBondContact O-CG2 3.36Å; S157-V161 PolarHBondContact O-N 2.81Å; Y158-V161 PolarHBondContact O-N 3.04Å; V161-L164 WeakPolarHBondContact O-CB 3.44Å; V161-L164 PolarHBondContact O-N 3.42Å; V161-L164 VanDerWaalsContact O-N 3.16Å; V161-L165 HydrophobicContact CG1-CD1 3.55Å; V161-L165 HydrophobicContact CG1-CG 3.94Å; V161-L165 WeakPolarHBondContact O-CB 3.44Å; V161-L165 WeakPolarHBondContact O-CG 3.39Å; V161-L165 PolarHBondContact O-N 2.77Å; V161-V178 HydrophobicContact CB-CG1 4.3Å; V161-V178 HydrophobicContact CG1-CB 4.47Å; V161-V178 HydrophobicContact CG1-CG1 3.89Å; V161-V178 HydrophobicContact CG1-CG2 4.12Å
162	L	95.8	Very high	92	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-65.3	-40.3	174.5	-66	169.9	0	0	0	112.2	Y158 R159 L164 R166 Y175 V178 A179 A182 L198 L201 H205	Y158-L162 WeakPolarHBondContact O-CG 3.25Å; Y158-L162 PolarHBondContact O-N 2.68Å; R159-L162 PolarHBondContact O-N 2.93Å; L162-L164 PolarHBondContact O-N 3.28Å; L162-R166 PolarHBondContact O-N 3.33Å; L162-Y175 HydrophobicContact CB-CE2 4.05Å; L162-Y175 HydrophobicContact CD2-CD2 3.66Å; L162-Y175 HydrophobicContact CD2-CE2 3.56Å; L162-Y175 HydrophobicContact CD2-CG 4.36Å; L162-Y175 HydrophobicContact CG-CE2 4.41Å; L162-V178 HydrophobicContact CD2-CB 4.34Å; L162-V178 HydrophobicContact CD2-CG1 4.04Å; L162-V178 HydrophobicContact CG-CG1 4.17Å; L162-A179 HydrophobicContact CD2-CB 4.15Å; L162-A182 HydrophobicContact CD1-CB 4.49Å; L162-L198 HydrophobicContact CD1-CD1 3.58Å; L162-L201 HydrophobicContact CB-CD2 3.98Å; L162-L201 HydrophobicContact CD1-CD2 4.17Å; L162-H205 PolarHBondContact O-CE1 3.28Å; L162-H205 VanDerWaalsContact O-CE1 3.31Å
163	D	93.6	Very high	92	Very high	25 Å²	25	33 Å²	33	13%	0.134	16%	0.157	C	C	.	.	H	α-helix	trans	-62.4	-28.7	172.3	-108.6	-49.6	0	0	0	112.6	Y73 R159 L160 R166	Y73-D163 VanDerWaalsContact OH-C 3.27Å; Y73-D163 PolarHBondContact OH-O 3.12Å; R159-D163 WeakPolarHBondContact O-CB 3.26Å; R159-D163 PolarHBondContact O-N 3.39Å; L160-D163 PolarHBondContact O-N 2.77Å; D163-R166 PolarHBondContact O-NE 2.68Å; D163-R166 IonicContact OD1-CZ 2.6Å; D163-R166 IonicContact OD1-NH1 2.73Å; D163-R166 PolarHBondContact OD1-NH1 3.28Å; D163-R166 IonicContact OD1-NH2 3.39Å; D163-R166 PolarHBondContact OD1-NH2 2.73Å
164	L	92.2	Very high	92	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-83.1	-46.3	179.6	177.4	73.7	0	0	0	112.5	I72 Y73 K76 I91 L160 V161 L162	I72-L164 HydrophobicContact CB-CD2 4.4Å; I72-L164 HydrophobicContact CG1-CD2 3.65Å; I72-L164 HydrophobicContact CG2-CD1 4.28Å; I72-L164 HydrophobicContact CG2-CD2 3.85Å; Y73-L164 HydrophobicContact CD1-CD1 3.88Å; Y73-L164 HydrophobicContact CD2-CD1 3.65Å; Y73-L164 HydrophobicContact CE1-CD1 3.98Å; Y73-L164 HydrophobicContact CE2-CB 4.27Å; Y73-L164 HydrophobicContact CE2-CD1 3.79Å; Y73-L164 HydrophobicContact CG-CD1 3.73Å; K76-L164 HydrophobicContact CB-CD1 4.2Å; K76-L164 HydrophobicContact CD-CD1 3.67Å; K76-L164 HydrophobicContact CD-CG 4.17Å; K76-L164 PolarHBondContact NZ-O 2.69Å; I91-L164 HydrophobicContact CD1-CD2 3.77Å; L160-L164 VanDerWaalsContact O-CB 3.31Å; L160-L164 WeakPolarHBondContact O-CB 3.45Å; L160-L164 PolarHBondContact O-N 2.76Å; V161-L164 WeakPolarHBondContact O-CB 3.44Å; V161-L164 PolarHBondContact O-N 3.42Å; V161-L164 VanDerWaalsContact O-N 3.16Å; L162-L164 PolarHBondContact O-N 3.28Å
165	L	91.9	Very high	92	Very high	1 Å²	1	33 Å²	33	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-80.4	-24.2	-170.7	-67.7	-178.4	0	0	0	114	I91 V161 L171 L174 Y175 V178	I91-L165 HydrophobicContact CD1-CD2 3.68Å; I91-L165 HydrophobicContact CD1-CG 4.39Å; V161-L165 HydrophobicContact CG1-CD1 3.55Å; V161-L165 HydrophobicContact CG1-CG 3.94Å; V161-L165 WeakPolarHBondContact O-CB 3.44Å; V161-L165 WeakPolarHBondContact O-CG 3.39Å; V161-L165 PolarHBondContact O-N 2.77Å; L165-L171 HydrophobicContact CD2-CB 4.13Å; L165-L171 HydrophobicContact CD2-CD1 3.79Å; L165-L171 HydrophobicContact CD2-CG 4.43Å; L165-L174 HydrophobicContact CD1-CB 4.24Å; L165-L174 HydrophobicContact CD1-CD2 3.85Å; L165-L174 HydrophobicContact CD1-CG 3.72Å; L165-L174 HydrophobicContact CD2-CD2 4.24Å; L165-Y175 HydrophobicContact CB-CD2 4.06Å; L165-V178 HydrophobicContact CD1-CG2 4.49Å
166	R	89	Confident	92	Very high	68 Å²	68	32.8 Å²	32.8	26%	0.257	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.9	152	-177.8	71.4	-173.3	180	-155.8	-14.9	114.4	L162 D163 N168 Y175 H205	L162-R166 PolarHBondContact O-N 3.33Å; D163-R166 PolarHBondContact O-NE 2.68Å; D163-R166 IonicContact OD1-CZ 2.6Å; D163-R166 IonicContact OD1-NH1 2.73Å; D163-R166 PolarHBondContact OD1-NH1 3.28Å; D163-R166 IonicContact OD1-NH2 3.39Å; D163-R166 PolarHBondContact OD1-NH2 2.73Å; R166-N168 PolarHBondContact O-N 3.26Å; R166-Y175 HydrophobicContact CB-CE2 4.33Å; R166-H205 WeakPolarHBondContact CD-NE2 3.13Å; R166-H205 PolarHBondContact NH1-NE2 2.73Å
167	S	79.7	Confident	92.1	Very high	56 Å²	56	32.2 Å²	32.2	39%	0.392	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	25.7	172.5	55.3	0	0	0	0	115.6
168	N	85.7	Confident	92.2	Very high	6 Å²	6	32.4 Å²	32.4	3%	0.032	15%	0.152	C	C	.	.			trans	-124.1	113.8	170	-178.3	-1.7	0	0	0	109.9	R166 K170 L171 E172 N219	R166-N168 PolarHBondContact O-N 3.26Å; N168-K170 VanDerWaalsContact C-N 3.32Å; N168-K170 PolarHBondContact O-N 2.74Å; N168-K170 PolarHBondContact OD1-N 3.12Å; N168-K170 VanDerWaalsContact OD1-N 3.11Å; N168-L171 HydrophobicContact CB-CB 4.39Å; N168-L171 HydrophobicContact CB-CD1 4.41Å; N168-L171 VanDerWaalsContact ND2-CD1 3.27Å; N168-L171 WeakPolarHBondContact ND2-CD1 2.96Å; N168-L171 WeakPolarHBondContact ND2-CG 2.95Å; N168-L171 CarbonylContact O-C 3.57Å; N168-L171 PolarHBondContact O-N 3.14Å; N168-L171 VanDerWaalsContact O-N 3.12Å; N168-E172 PolarHBondContact O-N 2.7Å; N168-N219 WeakPolarHBondContact CA-O 3.09Å
169	S	86.6	Confident	92.2	Very high	47 Å²	47	32 Å²	32	33%	0.329	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-59.1	-38.1	-180	50.7	0	0	0	0	113.4	L171 E172 N219 A220	S169-L171 PolarHBondContact O-N 2.83Å; S169-L171 VanDerWaalsContact O-N 3.14Å; S169-E172 WeakPolarHBondContact O-CB 3.39Å; S169-E172 PolarHBondContact O-N 3.37Å; S169-N219 PolarHBondContact N-O 3.11Å; S169-N219 PolarHBondContact OG-O 3.39Å; S169-A220 WeakPolarHBondContact CB-O 3.4Å; S169-A220 PolarHBondContact OG-O 3.33Å
170	K	86.3	Confident	92.2	Very high	105 Å²	105	29.1 Å²	29.1	46%	0.457	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-64.7	-17.9	178	-64.7	-170.8	-178.6	-178.3	0	114.3	T84 N168 N219	T84-K170 HydrophobicContact CG2-CB 4.24Å; T84-K170 HydrophobicContact CG2-CD 3.97Å; N168-K170 VanDerWaalsContact C-N 3.32Å; N168-K170 PolarHBondContact O-N 2.74Å; N168-K170 PolarHBondContact OD1-N 3.12Å; N168-K170 VanDerWaalsContact OD1-N 3.11Å; K170-N219 VanDerWaalsContact CE-OD1 3.28Å; K170-N219 WeakPolarHBondContact CE-OD1 3.35Å
171	L	90.5	Very high	92.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-117.4	9.7	-178.4	-58.1	174.2	0	0	0	112	V80 T84 L87 E88 L165 N168 S169 K173 L174 Y175	V80-L171 HydrophobicContact CG2-CD1 4.28Å; T84-L171 HydrophobicContact CG2-CD2 4.42Å; L87-L171 HydrophobicContact CD2-CD1 3.73Å; L87-L171 HydrophobicContact CD2-CD2 4.48Å; E88-L171 HydrophobicContact CG-CD2 4.14Å; L165-L171 HydrophobicContact CD2-CB 4.13Å; L165-L171 HydrophobicContact CD2-CD1 3.79Å; L165-L171 HydrophobicContact CD2-CG 4.43Å; N168-L171 HydrophobicContact CB-CB 4.39Å; N168-L171 HydrophobicContact CB-CD1 4.41Å; N168-L171 VanDerWaalsContact ND2-CD1 3.27Å; N168-L171 WeakPolarHBondContact ND2-CD1 2.96Å; N168-L171 WeakPolarHBondContact ND2-CG 2.95Å; N168-L171 CarbonylContact O-C 3.57Å; N168-L171 PolarHBondContact O-N 3.14Å; N168-L171 VanDerWaalsContact O-N 3.12Å; S169-L171 PolarHBondContact O-N 2.83Å; S169-L171 VanDerWaalsContact O-N 3.14Å; L171-K173 PolarHBondContact O-N 2.91Å; L171-L174 PolarHBondContact O-N 3.33Å; L171-Y175 PolarHBondContact O-N 3.28Å
172	E	91.1	Very high	92.4	Very high	8 Å²	8	31.1 Å²	31.1	4%	0.037	15%	0.153	C	C	.	.	H	α-helix	trans	-60.2	-46.2	-176.8	-178.8	170.2	-176.5	0	0	110.8	N168 S169 L174 Y175 H176 T228 L231 H232	N168-E172 PolarHBondContact O-N 2.7Å; S169-E172 WeakPolarHBondContact O-CB 3.39Å; S169-E172 PolarHBondContact O-N 3.37Å; E172-L174 PolarHBondContact O-N 3.31Å; E172-Y175 WeakPolarHBondContact O-CB 3.44Å; E172-Y175 PolarHBondContact O-N 2.77Å; E172-Y175 VanDerWaalsContact O-N 3.11Å; E172-H176 PolarHBondContact O-CD2 2.79Å; E172-H176 PolarHBondContact O-N 3.34Å; E172-H176 IonicContact OE1-NE2 3.76Å; E172-T228 VanDerWaalsContact OE1-CA 3.24Å; E172-T228 WeakPolarHBondContact OE1-CA 3.29Å; E172-T228 WeakPolarHBondContact OE1-CB 3.4Å; E172-T228 VanDerWaalsContact OE1-CG2 3.27Å; E172-T228 WeakPolarHBondContact OE1-CG2 3.18Å; E172-T228 PolarHBondContact OE1-OG1 2.79Å; E172-T228 PolarHBondContact OE2-OG1 2.73Å; E172-L231 HydrophobicContact CG-CD1 4.15Å; E172-H232 IonicContact OE1-CE1 3.84Å; E172-H232 PolarHBondContact OE1-CE1 3.18Å; E172-H232 IonicContact OE1-ND1 3.94Å; E172-H232 PolarHBondContact OE1-ND1 2.85Å; E172-H232 VanDerWaalsContact OE1-ND1 3.1Å
173	K	93.2	Very high	92.4	Very high	136 Å²	136	31.1 Å²	31.1	59%	0.591	15%	0.153	S	C	*	.	H	α-helix	trans	-56.8	-49	177.7	-171	179.5	179.4	-175	0	112.5	L171 Y175 H176 E177	L171-K173 PolarHBondContact O-N 2.91Å; K173-Y175 VanDerWaalsContact C-N 3.32Å; K173-Y175 PolarHBondContact O-N 3.42Å; K173-H176 PolarHBondContact O-N 2.66Å; K173-E177 WeakPolarHBondContact CE-OE1 3.02Å; K173-E177 WeakPolarHBondContact O-CG 3.42Å; K173-E177 PolarHBondContact O-N 3.49Å
174	L	94.3	Very high	92.5	Very high	3 Å²	3	33 Å²	33	2%	0.016	16%	0.163	C	C	.	.	H	α-helix	trans	-63.9	-36	177	-176.8	66.1	0	0	0	112.1	E88 I91 R92 L165 L171 E172 H176 E177 V178	E88-L174 HydrophobicContact CB-CD2 3.94Å; E88-L174 HydrophobicContact CG-CD2 3.8Å; I91-L174 HydrophobicContact CB-CD2 4.36Å; I91-L174 HydrophobicContact CG2-CD2 4.14Å; R92-L174 HydrophobicContact CG-CD1 4.21Å; L165-L174 HydrophobicContact CD1-CB 4.24Å; L165-L174 HydrophobicContact CD1-CD2 3.85Å; L165-L174 HydrophobicContact CD1-CG 3.72Å; L165-L174 HydrophobicContact CD2-CD2 4.24Å; L171-L174 PolarHBondContact O-N 3.33Å; E172-L174 PolarHBondContact O-N 3.31Å; L174-H176 VanDerWaalsContact C-N 3.32Å; L174-H176 PolarHBondContact O-N 3.17Å; L174-E177 PolarHBondContact O-N 3.12Å; L174-V178 HydrophobicContact CD1-CG2 4.12Å; L174-V178 HydrophobicContact CG-CG2 4.29Å; L174-V178 WeakPolarHBondContact O-CB 3.17Å; L174-V178 VanDerWaalsContact O-CG2 3.22Å; L174-V178 WeakPolarHBondContact O-CG2 2.97Å; L174-V178 PolarHBondContact O-N 2.81Å
175	Y	96	Very high	92.7	Very high	13 Å²	13	33.3 Å²	33.3	5%	0.051	16%	0.164	C	C	.	.	H	α-helix	trans	-59.8	-42.2	174	172.2	-92.7	0	0	0	111.9	L162 L165 R166 L171 E172 K173 A179 H205	L162-Y175 HydrophobicContact CB-CE2 4.05Å; L162-Y175 HydrophobicContact CD2-CD2 3.66Å; L162-Y175 HydrophobicContact CD2-CE2 3.56Å; L162-Y175 HydrophobicContact CD2-CG 4.36Å; L162-Y175 HydrophobicContact CG-CE2 4.41Å; L165-Y175 HydrophobicContact CB-CD2 4.06Å; R166-Y175 HydrophobicContact CB-CE2 4.33Å; L171-Y175 PolarHBondContact O-N 3.28Å; E172-Y175 WeakPolarHBondContact O-CB 3.44Å; E172-Y175 PolarHBondContact O-N 2.77Å; E172-Y175 VanDerWaalsContact O-N 3.11Å; K173-Y175 VanDerWaalsContact C-N 3.32Å; K173-Y175 PolarHBondContact O-N 3.42Å; Y175-A179 WeakPolarHBondContact O-CB 3.01Å; Y175-A179 PolarHBondContact O-N 3.05Å; Y175-H205 AromaticContact CE2-ND1 3.58Å; Y175-H205 AromaticContact CZ-ND1 3.68Å; Y175-H205 WeakPolarHBondContact OH-CB 3.17Å; Y175-H205 PolarHBondContact OH-ND1 2.75Å
176	H	95.5	Very high	92.9	Very high	9 Å²	9	33.2 Å²	33.2	4%	0.042	16%	0.164	C	C	.	.	H	α-helix	trans	-74.1	-39.6	177.8	-68.1	-71.6	0	0	0	112.8	E172 K173 L174 V178 A179 H180 L231 H232 T235	E172-H176 PolarHBondContact O-CD2 2.79Å; E172-H176 PolarHBondContact O-N 3.34Å; E172-H176 IonicContact OE1-NE2 3.76Å; K173-H176 PolarHBondContact O-N 2.66Å; L174-H176 VanDerWaalsContact C-N 3.32Å; L174-H176 PolarHBondContact O-N 3.17Å; H176-V178 VanDerWaalsContact C-N 3.34Å; H176-V178 PolarHBondContact O-N 3.03Å; H176-A179 PolarHBondContact O-N 3.02Å; H176-H180 PolarHBondContact O-CD2 3.17Å; H176-H180 VanDerWaalsContact O-CD2 3.28Å; H176-H180 PolarHBondContact O-N 2.84Å; H176-L231 HydrophobicContact CB-CB 4.49Å; H176-L231 PolarHBondContact ND1-O 2.8Å; H176-H232 AromaticContact CE1-CE1 3.81Å; H176-H232 AromaticContact CE1-CG 3.88Å; H176-H232 AromaticContact CE1-ND1 3.6Å; H176-H232 AromaticContact NE2-CE1 3.49Å; H176-H232 PolarHBondContact NE2-CE1 3.46Å; H176-H232 AromaticContact NE2-ND1 3.39Å; H176-H232 PolarHBondContact NE2-ND1 2.87Å; H176-T235 PolarHBondContact ND1-OG1 2.87Å
177	E	95.9	Very high	93.2	Very high	61 Å²	61	32.6 Å²	32.6	29%	0.285	17%	0.165	S	C	.	.	H	α-helix	trans	-55.1	-48.2	170.2	-74	175.4	-159.6	0	0	111.1	R92 K173 L174 A179 H180 D181	R92-E177 IonicContact CZ-OE2 2.68Å; R92-E177 VanDerWaalsContact CZ-OE2 3.24Å; R92-E177 IonicContact NH1-OE2 3.81Å; R92-E177 PolarHBondContact NH1-OE2 3.32Å; R92-E177 IonicContact NH2-OE1 3.17Å; R92-E177 IonicContact NH2-OE2 3.7Å; R92-E177 PolarHBondContact NH2-OE2 2.84Å; K173-E177 WeakPolarHBondContact CE-OE1 3.02Å; K173-E177 WeakPolarHBondContact O-CG 3.42Å; K173-E177 PolarHBondContact O-N 3.49Å; L174-E177 PolarHBondContact O-N 3.12Å; E177-A179 VanDerWaalsContact C-N 3.34Å; E177-A179 PolarHBondContact O-N 3.25Å; E177-H180 PolarHBondContact O-N 2.82Å; E177-D181 PolarHBondContact O-N 2.84Å
178	V	96.7	Very high	93.8	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.024	17%	0.168	C	C	.	.	H	α-helix	trans	-68	-30.5	178.3	174.7	0	0	0	0	112.4	L95 Y158 V161 L162 L165 L174 H176 A182	L95-V178 HydrophobicContact CD1-CB 4.48Å; L95-V178 HydrophobicContact CD1-CG1 3.95Å; L95-V178 HydrophobicContact CD1-CG2 3.67Å; Y158-V178 HydrophobicContact CD1-CG1 4.02Å; V161-V178 HydrophobicContact CB-CG1 4.3Å; V161-V178 HydrophobicContact CG1-CB 4.47Å; V161-V178 HydrophobicContact CG1-CG1 3.89Å; V161-V178 HydrophobicContact CG1-CG2 4.12Å; L162-V178 HydrophobicContact CD2-CB 4.34Å; L162-V178 HydrophobicContact CD2-CG1 4.04Å; L162-V178 HydrophobicContact CG-CG1 4.17Å; L165-V178 HydrophobicContact CD1-CG2 4.49Å; L174-V178 HydrophobicContact CD1-CG2 4.12Å; L174-V178 HydrophobicContact CG-CG2 4.29Å; L174-V178 WeakPolarHBondContact O-CB 3.17Å; L174-V178 VanDerWaalsContact O-CG2 3.22Å; L174-V178 WeakPolarHBondContact O-CG2 2.97Å; L174-V178 PolarHBondContact O-N 2.81Å; H176-V178 VanDerWaalsContact C-N 3.34Å; H176-V178 PolarHBondContact O-N 3.03Å; V178-A182 WeakPolarHBondContact O-CB 3.15Å; V178-A182 PolarHBondContact O-N 2.72Å
179	A	96.9	Very high	94.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68.6	-41.7	173.7	0	0	0	0	0	111.9	L162 Y175 H176 E177 A182 Y183 I202 T235	L162-A179 HydrophobicContact CD2-CB 4.15Å; Y175-A179 WeakPolarHBondContact O-CB 3.01Å; Y175-A179 PolarHBondContact O-N 3.05Å; H176-A179 PolarHBondContact O-N 3.02Å; E177-A179 VanDerWaalsContact C-N 3.34Å; E177-A179 PolarHBondContact O-N 3.25Å; A179-A182 PolarHBondContact O-N 2.92Å; A179-Y183 WeakPolarHBondContact O-CD2 3.21Å; A179-Y183 PolarHBondContact O-N 2.89Å; A179-I202 HydrophobicContact CB-CD1 3.93Å; A179-T235 HydrophobicContact CB-CG2 3.84Å
180	H	96.5	Very high	94.4	Very high	57 Å²	57	36.2 Å²	36.2	26%	0.264	18%	0.18	S	C	.	.	H	α-helix	trans	-62.4	-43.8	173.2	-82	-126.8	0	0	0	111.5	H176 E177 A182 Y183 N184 T235	H176-H180 PolarHBondContact O-CD2 3.17Å; H176-H180 VanDerWaalsContact O-CD2 3.28Å; H176-H180 PolarHBondContact O-N 2.84Å; E177-H180 PolarHBondContact O-N 2.82Å; H180-A182 PolarHBondContact O-N 2.78Å; H180-Y183 PolarHBondContact O-N 2.9Å; H180-N184 WeakPolarHBondContact O-CB 3.2Å; H180-N184 VanDerWaalsContact O-CG 3.23Å; H180-N184 PolarHBondContact O-N 3.1Å; H180-N184 PolarHBondContact O-ND2 3.22Å; H180-T235 WeakPolarHBondContact NE2-CA 3.48Å
181	D	95.8	Very high	94.7	Very high	53 Å²	53	33.2 Å²	33.2	28%	0.283	17%	0.165	S	C	.	.	H	α-helix	trans	-59	-43.8	173	-92.3	-16.7	0	0	0	112.5	K99 Y158 E177 Y183 N184 F185	K99-D181 VanDerWaalsContact NZ-CG 3.31Å; K99-D181 IonicContact NZ-OD1 3.15Å; K99-D181 PolarHBondContact NZ-OD1 3.02Å; K99-D181 IonicContact NZ-OD2 2.8Å; K99-D181 PolarHBondContact NZ-OD2 3.4Å; Y158-D181 HydrophobicContact CE1-CB 3.72Å; E177-D181 PolarHBondContact O-N 2.84Å; D181-Y183 VanDerWaalsContact C-N 3.33Å; D181-Y183 PolarHBondContact O-N 3.49Å; D181-N184 PolarHBondContact O-N 2.82Å; D181-F185 WeakPolarHBondContact O-CB 3.48Å; D181-F185 PolarHBondContact O-N 3.35Å
182	A	97	Very high	94.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.2	-35.6	178.4	0	0	0	0	0	112.3	Y158 L162 V178 A179 H180 C186 L198	Y158-A182 HydrophobicContact CD1-CB 4.02Å; Y158-A182 HydrophobicContact CD2-CB 4.27Å; Y158-A182 HydrophobicContact CG-CB 3.85Å; L162-A182 HydrophobicContact CD1-CB 4.49Å; V178-A182 WeakPolarHBondContact O-CB 3.15Å; V178-A182 PolarHBondContact O-N 2.72Å; A179-A182 PolarHBondContact O-N 2.92Å; H180-A182 PolarHBondContact O-N 2.78Å; A182-C186 PolarHBondContact O-N 3.2Å; A182-C186 PolarHBondContact O-SG 2.85Å; A182-L198 HydrophobicContact CB-CD1 4.12Å; A182-L198 HydrophobicContact CB-CD2 3.66Å
183	Y	96.8	Very high	95.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-68.1	-43.3	171.8	-75.9	-49.8	0	0	0	112.5	A179 H180 D181 F185 C186 L187 F195 L198 I202 T235 R238 Q239	A179-Y183 WeakPolarHBondContact O-CD2 3.21Å; A179-Y183 PolarHBondContact O-N 2.89Å; H180-Y183 PolarHBondContact O-N 2.9Å; D181-Y183 VanDerWaalsContact C-N 3.33Å; D181-Y183 PolarHBondContact O-N 3.49Å; Y183-F185 VanDerWaalsContact C-N 3.32Å; Y183-F185 PolarHBondContact O-N 2.79Å; Y183-C186 PolarHBondContact O-N 3.23Å; Y183-L187 PolarHBondContact O-N 3.38Å; Y183-F195 AromaticContact CD1-CD2 3.88Å; Y183-F195 HydrophobicContact CD1-CD2 3.88Å; Y183-F195 AromaticContact CD1-CE2 3.5Å; Y183-F195 HydrophobicContact CD1-CE2 3.5Å; Y183-F195 VanDerWaalsContact CD1-CE2 3.5Å; Y183-F195 HydrophobicContact CE1-CD2 4.12Å; Y183-F195 AromaticContact CE1-CE2 3.63Å; Y183-F195 HydrophobicContact CE1-CE2 3.63Å; Y183-F195 HydrophobicContact CE1-CZ 4.39Å; Y183-L198 HydrophobicContact CD1-CD2 3.4Å; Y183-L198 HydrophobicContact CD1-CG 4.18Å; Y183-L198 HydrophobicContact CE1-CB 4.41Å; Y183-L198 HydrophobicContact CE1-CD2 3.48Å; Y183-L198 VanDerWaalsContact CE1-CD2 3.48Å; Y183-L198 HydrophobicContact CE1-CG 3.72Å; Y183-L198 HydrophobicContact CG-CD2 3.97Å; Y183-I202 HydrophobicContact CE2-CD1 4.13Å; Y183-T235 HydrophobicContact CE2-CG2 4.1Å; Y183-R238 HydrophobicContact CD2-CG 4.47Å; Y183-Q239 HydrophobicContact CE1-CB 4.09Å; Y183-Q239 HydrophobicContact CE1-CG 3.96Å; Y183-Q239 HydrophobicContact CE2-CB 3.82Å; Y183-Q239 HydrophobicContact CE2-CG 4.45Å; Y183-Q239 WeakPolarHBondContact OH-CB 3.05Å; Y183-Q239 VanDerWaalsContact OH-CD 3.27Å; Y183-Q239 WeakPolarHBondContact OH-CG 3.31Å; Y183-Q239 PolarHBondContact OH-OE1 3.36Å
184	N	95.8	Very high	95.2	Very high	66 Å²	66	35.5 Å²	35.5	35%	0.353	18%	0.183	S	C	.	.	H	α-helix	trans	-64.5	-36.2	175.8	-68.5	-22.1	0	0	0	111.8	H180 D181 L187 K188 R238	H180-N184 WeakPolarHBondContact O-CB 3.2Å; H180-N184 VanDerWaalsContact O-CG 3.23Å; H180-N184 PolarHBondContact O-N 3.1Å; H180-N184 PolarHBondContact O-ND2 3.22Å; D181-N184 PolarHBondContact O-N 2.82Å; N184-L187 PolarHBondContact O-N 3.31Å; N184-K188 WeakPolarHBondContact O-CB 3.27Å; N184-K188 PolarHBondContact O-N 3.29Å; N184-R238 PolarHBondContact OD1-NE 2.9Å; N184-R238 VanDerWaalsContact OD1-NE 3.14Å; N184-R238 PolarHBondContact OD1-NH2 3.41Å
185	F	95.5	Very high	95.4	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-61.4	-48	170.1	159	-94.1	0	0	0	112.3	L151 L154 W155 Y158 D181 Y183 L187 K188 Y189 R191	L151-F185 HydrophobicContact CD2-CE2 3.83Å; L154-F185 HydrophobicContact CB-CE2 4.3Å; L154-F185 HydrophobicContact CD2-CD2 3.58Å; L154-F185 HydrophobicContact CD2-CE2 3.76Å; L154-F185 HydrophobicContact CG-CD2 3.97Å; L154-F185 HydrophobicContact CG-CE2 3.97Å; W155-F185 HydrophobicContact CB-CE1 3.89Å; W155-F185 HydrophobicContact CB-CZ 3.92Å; W155-F185 HydrophobicContact CE3-CE1 4.12Å; Y158-F185 HydrophobicContact CD2-CB 4.28Å; Y158-F185 HydrophobicContact CD2-CD1 4.15Å; Y158-F185 HydrophobicContact CD2-CG 4.1Å; Y158-F185 HydrophobicContact CE2-CB 3.52Å; Y158-F185 HydrophobicContact CE2-CD1 4.13Å; Y158-F185 HydrophobicContact CE2-CD2 4.04Å; Y158-F185 AromaticContact CE2-CG 3.62Å; Y158-F185 HydrophobicContact CE2-CG 3.62Å; D181-F185 WeakPolarHBondContact O-CB 3.48Å; D181-F185 PolarHBondContact O-N 3.35Å; Y183-F185 VanDerWaalsContact C-N 3.32Å; Y183-F185 PolarHBondContact O-N 2.79Å; F185-L187 PolarHBondContact O-N 3.24Å; F185-K188 PolarHBondContact O-N 2.76Å; F185-Y189 AromaticContact CD2-CD2 3.63Å; F185-Y189 HydrophobicContact CD2-CD2 3.63Å; F185-Y189 AromaticContact CD2-CE2 4Å; F185-Y189 HydrophobicContact CD2-CE2 4Å; F185-Y189 AromaticContact CE2-CD2 3.84Å; F185-Y189 HydrophobicContact CE2-CD2 3.84Å; F185-Y189 HydrophobicContact CE2-CE2 4.34Å; F185-Y189 PolarHBondContact O-N 3.48Å; F185-R191 HydrophobicContact CE1-CG 4.35Å; F185-R191 HydrophobicContact CZ-CG 4.31Å
186	C	95.9	Very high	95.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.3	-33.3	178.3	-69.4	0	0	0	0	111.7	A182 Y183 G190 R191 F195	A182-C186 PolarHBondContact O-N 3.2Å; A182-C186 PolarHBondContact O-SG 2.85Å; Y183-C186 PolarHBondContact O-N 3.23Å; C186-G190 CarbonylContact O-C 3.58Å; C186-G190 PolarHBondContact O-N 2.8Å; C186-R191 PolarHBondContact O-N 2.93Å; C186-F195 HydrophobicContact CB-CB 4.11Å; C186-F195 HydrophobicContact CB-CD2 4.1Å
187	L	94.8	Very high	95.4	Very high	54 Å²	54	45.5 Å²	45.5	28%	0.283	23%	0.226	S	C	.	.	H	α-helix	trans	-76.4	-53.5	177.9	-168.5	139.8	0	0	0	112.5	Y183 N184 F185 Y189 G190 C242 E245	Y183-L187 PolarHBondContact O-N 3.38Å; N184-L187 PolarHBondContact O-N 3.31Å; F185-L187 PolarHBondContact O-N 3.24Å; L187-Y189 PolarHBondContact O-N 2.86Å; L187-G190 PolarHBondContact O-N 3.01Å; L187-G190 VanDerWaalsContact O-N 3.08Å; L187-C242 HydrophobicContact CD1-CB 4.48Å; L187-E245 HydrophobicContact CD1-CB 3.54Å; L187-E245 HydrophobicContact CD1-CG 4.08Å; L187-E245 WeakPolarHBondContact CD1-OE2 3.36Å
188	K	93.8	Very high	95.5	Very high	103 Å²	103	42.6 Å²	42.6	45%	0.448	21%	0.213	S	C	.	.	H	α-helix	trans	-53.3	-30.1	-179.7	-173.2	-177.5	180	-156.2	0	113.3	E103 N184 F185	E103-K188 IonicContact OE1-NZ 2.7Å; E103-K188 PolarHBondContact OE1-NZ 3.37Å; N184-K188 WeakPolarHBondContact O-CB 3.27Å; N184-K188 PolarHBondContact O-N 3.29Å; F185-K188 PolarHBondContact O-N 2.76Å
189	Y	92.1	Very high	95.4	Very high	38 Å²	38	42.4 Å²	42.4	15%	0.149	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	15.7	-177.8	-59.6	-71.4	0	0	0	114.1	Q106 L151 F185 L187 R191	Q106-Y189 VanDerWaalsContact OE1-CE1 3.24Å; Q106-Y189 PolarHBondContact OE1-OH 2.79Å; L151-Y189 HydrophobicContact CD1-CD1 4.29Å; L151-Y189 HydrophobicContact CD1-CG 4.41Å; L151-Y189 HydrophobicContact CD2-CD1 3.62Å; L151-Y189 HydrophobicContact CD2-CD2 3.56Å; L151-Y189 HydrophobicContact CD2-CE1 3.83Å; L151-Y189 HydrophobicContact CD2-CE2 3.78Å; L151-Y189 HydrophobicContact CD2-CG 3.48Å; L151-Y189 VanDerWaalsContact CD2-CG 3.48Å; F185-Y189 AromaticContact CD2-CD2 3.63Å; F185-Y189 HydrophobicContact CD2-CD2 3.63Å; F185-Y189 AromaticContact CD2-CE2 4Å; F185-Y189 HydrophobicContact CD2-CE2 4Å; F185-Y189 AromaticContact CE2-CD2 3.84Å; F185-Y189 HydrophobicContact CE2-CD2 3.84Å; F185-Y189 HydrophobicContact CE2-CE2 4.34Å; F185-Y189 PolarHBondContact O-N 3.48Å; L187-Y189 PolarHBondContact O-N 2.86Å; Y189-R191 WeakPolarHBondContact O-CD 3.31Å; Y189-R191 WeakPolarHBondContact O-CG 3.25Å; Y189-R191 PolarHBondContact O-N 3.22Å; Y189-R191 VanDerWaalsContact O-N 3.12Å
190	G	92.4	Very high	95.4	Very high	45 Å²	45	46.2 Å²	46.2	46%	0.464	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	24.1	173.9	0	0	0	0	0	116	C186 L187 K192	C186-G190 CarbonylContact O-C 3.58Å; C186-G190 PolarHBondContact O-N 2.8Å; L187-G190 PolarHBondContact O-N 3.01Å; L187-G190 VanDerWaalsContact O-N 3.08Å; G190-K192 VanDerWaalsContact C-N 3.29Å; G190-K192 PolarHBondContact O-N 2.88Å
191	R	92.9	Very high	95.3	Very high	41 Å²	41	44.4 Å²	44.4	16%	0.155	22%	0.221	C	C	.	.			trans	-80.3	61.1	-164.3	-53.3	-62.5	-66.6	168.8	-2.2	113.7	M148 F185 C186 Y189 T193 E194 F195	M148-R191 VanDerWaalsContact CE-NH1 3.29Å; F185-R191 HydrophobicContact CE1-CG 4.35Å; F185-R191 HydrophobicContact CZ-CG 4.31Å; C186-R191 PolarHBondContact O-N 2.93Å; Y189-R191 WeakPolarHBondContact O-CD 3.31Å; Y189-R191 WeakPolarHBondContact O-CG 3.25Å; Y189-R191 PolarHBondContact O-N 3.22Å; Y189-R191 VanDerWaalsContact O-N 3.12Å; R191-T193 PolarHBondContact O-N 2.98Å; R191-E194 HydrophobicContact CB-CB 4.04Å; R191-E194 WeakPolarHBondContact CB-OE2 3.24Å; R191-E194 WeakPolarHBondContact CG-OE2 3.47Å; R191-E194 IonicContact CZ-OE1 2.69Å; R191-E194 IonicContact CZ-OE2 3.23Å; R191-E194 IonicContact NE-OE1 3.76Å; R191-E194 PolarHBondContact NE-OE1 3.4Å; R191-E194 IonicContact NE-OE2 2.79Å; R191-E194 PolarHBondContact NE-OE2 2.73Å; R191-E194 IonicContact NH2-OE1 2.7Å; R191-E194 PolarHBondContact NH2-OE1 2.67Å; R191-E194 IonicContact NH2-OE2 2.84Å; R191-E194 PolarHBondContact O-N 3.49Å; R191-F195 PolarHBondContact O-N 3.34Å
192	K	95.3	Very high	95.3	Very high	94 Å²	94	42 Å²	42	41%	0.409	21%	0.209	S	C	.	.	H	α-helix	trans	-52.5	-29.1	-176.3	-56.5	-163.8	-171.4	-163.5	0	114.5	G190 K196 L246 M248	G190-K192 VanDerWaalsContact C-N 3.29Å; G190-K192 PolarHBondContact O-N 2.88Å; K192-K196 PolarHBondContact O-N 2.81Å; K192-L246 WeakPolarHBondContact CE-O 3.4Å; K192-L246 HydrophobicContact CG-CB 4.46Å; K192-L246 HydrophobicContact CG-CD2 4.34Å; K192-L246 PolarHBondContact NZ-O 3.23Å; K192-M248 HydrophobicContact CB-CE 4.09Å; K192-M248 HydrophobicContact CB-SD 3.64Å; K192-M248 HydrophobicContact CD-CG 4.3Å; K192-M248 HydrophobicContact CD-SD 4.23Å; K192-M248 HydrophobicContact CG-SD 3.9Å; K192-M248 WeakPolarHBondContact O-CE 3.44Å
193	T	95	Very high	95.1	Very high	87 Å²	87	43.1 Å²	43.1	53%	0.534	21%	0.213	S	C	.	.	H	α-helix	trans	-81.2	-28.9	177.9	56.2	0	0	0	0	114.2	R191 K197	R191-T193 PolarHBondContact O-N 2.98Å; T193-K197 WeakPolarHBondContact O-CG 3.18Å
194	E	95.2	Very high	95	Very high	11 Å²	11	46.8 Å²	46.8	5%	0.051	23%	0.23	C	C	.	.	H	α-helix	trans	-81.2	-36.7	174.2	-75	149.7	-162.2	0	0	110	W155 R191 K196 K197 L198	W155-E194 HydrophobicContact CD2-CB 3.82Å; W155-E194 HydrophobicContact CD2-CG 3.75Å; W155-E194 HydrophobicContact CE3-CB 3.85Å; W155-E194 HydrophobicContact CE3-CG 4.3Å; W155-E194 HydrophobicContact CG-CB 4.34Å; W155-E194 HydrophobicContact CG-CG 3.8Å; W155-E194 WeakPolarHBondContact CH2-O 3.46Å; W155-E194 HydrophobicContact CZ2-CB 4.5Å; W155-E194 HydrophobicContact CZ3-CB 4.2Å; R191-E194 HydrophobicContact CB-CB 4.04Å; R191-E194 WeakPolarHBondContact CB-OE2 3.24Å; R191-E194 WeakPolarHBondContact CG-OE2 3.47Å; R191-E194 IonicContact CZ-OE1 2.69Å; R191-E194 IonicContact CZ-OE2 3.23Å; R191-E194 IonicContact NE-OE1 3.76Å; R191-E194 PolarHBondContact NE-OE1 3.4Å; R191-E194 IonicContact NE-OE2 2.79Å; R191-E194 PolarHBondContact NE-OE2 2.73Å; R191-E194 IonicContact NH2-OE1 2.7Å; R191-E194 PolarHBondContact NH2-OE1 2.67Å; R191-E194 IonicContact NH2-OE2 2.84Å; R191-E194 PolarHBondContact O-N 3.49Å; E194-K196 PolarHBondContact O-N 2.73Å; E194-K197 CarbonylContact O-C 3.42Å; E194-K197 WeakPolarHBondContact O-CA 3.33Å; E194-K197 WeakPolarHBondContact O-CB 3.5Å; E194-K197 PolarHBondContact O-N 3.46Å; E194-L198 PolarHBondContact O-N 3.41Å
195	F	96.9	Very high	94.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-53.3	-49.1	169.7	-175.4	-99.1	0	0	0	112.9	Y183 C186 R191 K197 L198 C199 Q239 C242 A243 L246 M248 E251	Y183-F195 AromaticContact CD1-CD2 3.88Å; Y183-F195 HydrophobicContact CD1-CD2 3.88Å; Y183-F195 AromaticContact CD1-CE2 3.5Å; Y183-F195 HydrophobicContact CD1-CE2 3.5Å; Y183-F195 VanDerWaalsContact CD1-CE2 3.5Å; Y183-F195 HydrophobicContact CE1-CD2 4.12Å; Y183-F195 AromaticContact CE1-CE2 3.63Å; Y183-F195 HydrophobicContact CE1-CE2 3.63Å; Y183-F195 HydrophobicContact CE1-CZ 4.39Å; C186-F195 HydrophobicContact CB-CB 4.11Å; C186-F195 HydrophobicContact CB-CD2 4.1Å; R191-F195 PolarHBondContact O-N 3.34Å; F195-K197 VanDerWaalsContact C-N 3.29Å; F195-K197 PolarHBondContact O-N 2.7Å; F195-L198 WeakPolarHBondContact O-CB 3.36Å; F195-L198 PolarHBondContact O-N 3.27Å; F195-L198 VanDerWaalsContact O-N 3.1Å; F195-C199 VanDerWaalsContact CE1-SG 3.55Å; F195-C199 VanDerWaalsContact CZ-SG 3.57Å; F195-C199 PolarHBondContact O-N 2.67Å; F195-C199 PolarHBondContact O-SG 2.95Å; F195-Q239 HydrophobicContact CZ-CG 4.49Å; F195-Q239 WeakPolarHBondContact CZ-O 3.26Å; F195-C242 HydrophobicContact CD2-CB 4.34Å; F195-C242 HydrophobicContact CE2-CB 3.53Å; F195-C242 HydrophobicContact CZ-CB 4.14Å; F195-A243 HydrophobicContact CE1-CB 3.79Å; F195-A243 HydrophobicContact CZ-CB 3.7Å; F195-L246 HydrophobicContact CB-CD1 4.06Å; F195-L246 HydrophobicContact CD1-CD1 4.32Å; F195-L246 HydrophobicContact CD2-CD1 3.89Å; F195-L246 HydrophobicContact CE2-CD1 4.47Å; F195-L246 HydrophobicContact CG-CD1 3.82Å; F195-M248 HydrophobicContact CB-SD 4.37Å; F195-M248 HydrophobicContact CD1-CE 4.21Å; F195-M248 HydrophobicContact CD1-SD 3.52Å; F195-M248 VanDerWaalsContact CD1-SD 3.52Å; F195-M248 HydrophobicContact CE1-SD 4.21Å; F195-M248 HydrophobicContact CG-SD 4.23Å; F195-E251 HydrophobicContact CE1-CB 4.33Å
196	K	96.3	Very high	94.6	Very high	115 Å²	115	44.3 Å²	44.3	50%	0.5	22%	0.217	S	C	.	.	H	α-helix	trans	-56	-42.1	174.5	-74.4	-178.1	-179	-177.3	0	112.6	K192 E194 L198 E200 M248 E251	K192-K196 PolarHBondContact O-N 2.81Å; E194-K196 PolarHBondContact O-N 2.73Å; K196-L198 VanDerWaalsContact C-N 3.34Å; K196-E200 WeakPolarHBondContact O-CB 3.44Å; K196-E200 PolarHBondContact O-N 2.81Å; K196-M248 HydrophobicContact CD-CE 4.08Å; K196-M248 HydrophobicContact CG-CE 3.63Å; K196-E251 HydrophobicContact CG-CG 4.17Å
197	K	96.5	Very high	94.2	Very high	121 Å²	121	49.1 Å²	49.1	53%	0.526	24%	0.24	S	C	.	.	H	α-helix	trans	-68.8	-33.5	178.8	-65.7	167.5	-173.5	170.2	0	111.7	W155 T193 E194 F195 L201	W155-K197 HydrophobicContact CH2-CB 4.2Å; W155-K197 HydrophobicContact CZ2-CB 3.83Å; W155-K197 HydrophobicContact CZ2-CD 4.5Å; T193-K197 WeakPolarHBondContact O-CG 3.18Å; E194-K197 CarbonylContact O-C 3.42Å; E194-K197 WeakPolarHBondContact O-CA 3.33Å; E194-K197 WeakPolarHBondContact O-CB 3.5Å; E194-K197 PolarHBondContact O-N 3.46Å; F195-K197 VanDerWaalsContact C-N 3.29Å; F195-K197 PolarHBondContact O-N 2.7Å; K197-L201 WeakPolarHBondContact O-CB 3.46Å; K197-L201 PolarHBondContact O-N 3.32Å
198	L	96.8	Very high	93.8	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-68	-50.4	176.3	-174.3	55.9	0	0	0	111.5	W155 L162 A182 Y183 E194 F195 K196 E200 L201 I202	W155-L198 HydrophobicContact CH2-CB 3.81Å; W155-L198 HydrophobicContact CH2-CD1 4.37Å; W155-L198 HydrophobicContact CZ3-CB 3.96Å; W155-L198 HydrophobicContact CZ3-CD1 4.32Å; W155-L198 HydrophobicContact CZ3-CD2 4.46Å; W155-L198 HydrophobicContact CZ3-CG 4.48Å; L162-L198 HydrophobicContact CD1-CD1 3.58Å; A182-L198 HydrophobicContact CB-CD1 4.12Å; A182-L198 HydrophobicContact CB-CD2 3.66Å; Y183-L198 HydrophobicContact CD1-CD2 3.4Å; Y183-L198 HydrophobicContact CD1-CG 4.18Å; Y183-L198 HydrophobicContact CE1-CB 4.41Å; Y183-L198 HydrophobicContact CE1-CD2 3.48Å; Y183-L198 VanDerWaalsContact CE1-CD2 3.48Å; Y183-L198 HydrophobicContact CE1-CG 3.72Å; Y183-L198 HydrophobicContact CG-CD2 3.97Å; E194-L198 PolarHBondContact O-N 3.41Å; F195-L198 WeakPolarHBondContact O-CB 3.36Å; F195-L198 PolarHBondContact O-N 3.27Å; F195-L198 VanDerWaalsContact O-N 3.1Å; K196-L198 VanDerWaalsContact C-N 3.34Å; L198-E200 VanDerWaalsContact C-N 3.29Å; L198-E200 PolarHBondContact O-N 3.22Å; L198-L201 PolarHBondContact O-N 2.81Å; L198-I202 HydrophobicContact CD1-CD1 3.8Å; L198-I202 HydrophobicContact CD1-CG1 4.22Å; L198-I202 HydrophobicContact CG-CD1 4.14Å; L198-I202 WeakPolarHBondContact O-CG1 3.22Å; L198-I202 PolarHBondContact O-N 2.76Å
199	C	96.2	Very high	93.4	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-55.4	-46.7	176.8	-62.2	0	0	0	0	111.3	F195 I202 R203	F195-C199 VanDerWaalsContact CE1-SG 3.55Å; F195-C199 VanDerWaalsContact CZ-SG 3.57Å; F195-C199 PolarHBondContact O-N 2.67Å; F195-C199 PolarHBondContact O-SG 2.95Å; C199-I202 PolarHBondContact O-N 3.45Å; C199-R203 WeakPolarHBondContact O-CG 3.2Å; C199-R203 PolarHBondContact O-N 2.71Å
200	E	95.5	Very high	93	Very high	80 Å²	80	48.4 Å²	48.4	37%	0.374	24%	0.237	S	C	.	.	H	α-helix	trans	-66.1	-42.7	178.2	-177.9	52	-148	0	0	112.9	K196 L198 I202 R203 Q204	K196-E200 WeakPolarHBondContact O-CB 3.44Å; K196-E200 PolarHBondContact O-N 2.81Å; L198-E200 VanDerWaalsContact C-N 3.29Å; L198-E200 PolarHBondContact O-N 3.22Å; E200-I202 VanDerWaalsContact C-N 3.32Å; E200-I202 PolarHBondContact O-N 3.3Å; E200-R203 WeakPolarHBondContact O-CB 3.31Å; E200-R203 PolarHBondContact O-N 3.22Å; E200-Q204 WeakPolarHBondContact O-CG 3.29Å; E200-Q204 PolarHBondContact O-N 2.76Å; E200-Q204 WeakPolarHBondContact OE1-CG 3.31Å; E200-Q204 PolarHBondContact OE1-NE2 3.49Å
201	L	95.7	Very high	92.4	Very high	18 Å²	18	52.2 Å²	52.2	9%	0.094	25%	0.247	C	C	.	.	H	α-helix	trans	-58.9	-43.4	174.1	177	151.6	0	0	0	111.5	R159 L162 K197 L198 Q204 H205	R159-L201 HydrophobicContact CG-CD1 3.8Å; L162-L201 HydrophobicContact CB-CD2 3.98Å; L162-L201 HydrophobicContact CD1-CD2 4.17Å; K197-L201 WeakPolarHBondContact O-CB 3.46Å; K197-L201 PolarHBondContact O-N 3.32Å; L198-L201 PolarHBondContact O-N 2.81Å; L201-Q204 PolarHBondContact O-N 3.45Å; L201-H205 VanDerWaalsContact CD2-CE1 3.46Å; L201-H205 WeakPolarHBondContact CD2-CE1 3.26Å; L201-H205 PolarHBondContact O-CD2 3.36Å; L201-H205 VanDerWaalsContact O-CG 3.3Å; L201-H205 PolarHBondContact O-N 2.88Å
202	I	95	Very high	91.5	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-74.7	-31.5	-179.8	-59	178.8	0	0	0	110.8	A179 Y183 L198 C199 E200 H205 T206 R236	A179-I202 HydrophobicContact CB-CD1 3.93Å; Y183-I202 HydrophobicContact CE2-CD1 4.13Å; L198-I202 HydrophobicContact CD1-CD1 3.8Å; L198-I202 HydrophobicContact CD1-CG1 4.22Å; L198-I202 HydrophobicContact CG-CD1 4.14Å; L198-I202 WeakPolarHBondContact O-CG1 3.22Å; L198-I202 PolarHBondContact O-N 2.76Å; C199-I202 PolarHBondContact O-N 3.45Å; E200-I202 VanDerWaalsContact C-N 3.32Å; E200-I202 PolarHBondContact O-N 3.3Å; I202-H205 PolarHBondContact O-N 3.47Å; I202-T206 PolarHBondContact O-N 3.29Å; I202-T206 PolarHBondContact O-OG1 2.74Å; I202-R236 VanDerWaalsContact C-NH2 3.28Å; I202-R236 PolarHBondContact O-NH2 2.9Å
203	R	93.7	Very high	89.8	Confident	22 Å²	22	56.5 Å²	56.5	8%	0.083	28%	0.275	C	S	.	.	H	α-helix	trans	-56.5	-53.1	166.3	-76.7	176	-172.5	122	14.6	111.3	C199 E200 H205 T206 Q207 E251 K254 D258	C199-R203 WeakPolarHBondContact O-CG 3.2Å; C199-R203 PolarHBondContact O-N 2.71Å; E200-R203 WeakPolarHBondContact O-CB 3.31Å; E200-R203 PolarHBondContact O-N 3.22Å; R203-H205 PolarHBondContact O-N 3.4Å; R203-T206 PolarHBondContact O-N 3.4Å; R203-Q207 WeakPolarHBondContact O-CG 3.41Å; R203-Q207 PolarHBondContact O-N 2.84Å; R203-E251 IonicContact CZ-OE2 3.2Å; R203-E251 IonicContact NH1-OE2 2.62Å; R203-E251 PolarHBondContact NH1-OE2 3.22Å; R203-E251 IonicContact NH2-OE2 2.89Å; R203-E251 PolarHBondContact NH2-OE2 2.64Å; R203-K254 VanDerWaalsContact NH2-CB 3.27Å; R203-D258 WeakPolarHBondContact CG-OD1 3.48Å; R203-D258 IonicContact CZ-OD2 2.69Å; R203-D258 VanDerWaalsContact CZ-OD2 3.29Å; R203-D258 IonicContact NE-OD1 3.63Å; R203-D258 PolarHBondContact NE-OD1 2.76Å; R203-D258 VanDerWaalsContact NE-OD1 3.16Å; R203-D258 IonicContact NE-OD2 3.59Å; R203-D258 PolarHBondContact NE-OD2 3.36Å; R203-D258 IonicContact NH2-OD2 3.12Å; R203-D258 PolarHBondContact NH2-OD2 3.39Å
204	Q	93.7	Very high	88.2	Confident	78 Å²	78	59.4 Å²	59.4	36%	0.364	28%	0.282	S	S	.	.	H	α-helix	trans	-61.4	-30.9	178.1	-68	176.6	21.2	0	0	112.7	E200 L201 K208	E200-Q204 WeakPolarHBondContact O-CG 3.29Å; E200-Q204 PolarHBondContact O-N 2.76Å; E200-Q204 WeakPolarHBondContact OE1-CG 3.31Å; E200-Q204 PolarHBondContact OE1-NE2 3.49Å; L201-Q204 PolarHBondContact O-N 3.45Å; Q204-K208 WeakPolarHBondContact O-CB 3.2Å; Q204-K208 VanDerWaalsContact O-CD 3.28Å; Q204-K208 WeakPolarHBondContact O-CD 3.41Å; Q204-K208 WeakPolarHBondContact O-CG 2.96Å; Q204-K208 PolarHBondContact O-N 2.84Å; Q204-K208 VanDerWaalsContact O-N 3.09Å
205	H	93.3	Very high	86.6	Confident	9 Å²	9	62.9 Å²	62.9	4%	0.042	31%	0.306	C	S	.	.	H	α-helix	trans	-71.5	-45.6	173.5	-72.6	-177.9	0	0	0	112.5	L162 R166 Y175 L201 I202 R203 Q207 K208 V209	L162-H205 PolarHBondContact O-CE1 3.28Å; L162-H205 VanDerWaalsContact O-CE1 3.31Å; R166-H205 WeakPolarHBondContact CD-NE2 3.13Å; R166-H205 PolarHBondContact NH1-NE2 2.73Å; Y175-H205 AromaticContact CE2-ND1 3.58Å; Y175-H205 AromaticContact CZ-ND1 3.68Å; Y175-H205 WeakPolarHBondContact OH-CB 3.17Å; Y175-H205 PolarHBondContact OH-ND1 2.75Å; L201-H205 VanDerWaalsContact CD2-CE1 3.46Å; L201-H205 WeakPolarHBondContact CD2-CE1 3.26Å; L201-H205 PolarHBondContact O-CD2 3.36Å; L201-H205 VanDerWaalsContact O-CG 3.3Å; L201-H205 PolarHBondContact O-N 2.88Å; I202-H205 PolarHBondContact O-N 3.47Å; R203-H205 PolarHBondContact O-N 3.4Å; H205-Q207 PolarHBondContact O-N 3.42Å; H205-K208 CarbonylContact O-C 3.53Å; H205-K208 PolarHBondContact O-N 2.85Å; H205-V209 WeakPolarHBondContact O-CG2 3.2Å; H205-V209 PolarHBondContact O-N 2.92Å
206	T	89	Confident	84.9	Confident	11 Å²	11	70.2 Å²	70.2	7%	0.067	35%	0.345	C	S	.	.	H	α-helix	trans	-61.9	-42.2	174.8	-59.4	0	0	0	0	111.6	I202 R203 K208 V209 Q210 R236 F262	I202-T206 PolarHBondContact O-N 3.29Å; I202-T206 PolarHBondContact O-OG1 2.74Å; R203-T206 PolarHBondContact O-N 3.4Å; T206-K208 VanDerWaalsContact C-N 3.33Å; T206-K208 PolarHBondContact O-N 3.27Å; T206-V209 PolarHBondContact O-N 3.49Å; T206-Q210 HydrophobicContact CG2-CG 4.38Å; T206-Q210 WeakPolarHBondContact O-CG 3.45Å; T206-Q210 PolarHBondContact O-N 3.44Å; T206-R236 PolarHBondContact OG1-NH2 2.87Å; T206-F262 HydrophobicContact CG2-CD2 3.98Å; T206-F262 HydrophobicContact CG2-CE2 4.12Å
207	Q	88.5	Confident	83.7	Confident	100 Å²	100	67.1 Å²	67.1	47%	0.467	34%	0.341	S	S	.	.	H	α-helix	trans	-60	-39.9	173.6	-70.8	172.9	-1.7	0	0	112.4	R203 H205 V209 Q210 N211	R203-Q207 WeakPolarHBondContact O-CG 3.41Å; R203-Q207 PolarHBondContact O-N 2.84Å; H205-Q207 PolarHBondContact O-N 3.42Å; Q207-V209 PolarHBondContact O-N 3.38Å; Q207-Q210 PolarHBondContact O-N 3.39Å; Q207-N211 WeakPolarHBondContact O-CB 3.18Å; Q207-N211 PolarHBondContact O-N 2.95Å; Q207-N211 PolarHBondContact O-ND2 2.8Å
208	K	86.8	Confident	82.4	Confident	101 Å²	101	69.5 Å²	69.5	44%	0.439	36%	0.359	S	S	.	.	H	α-helix	trans	-69.7	-15.2	174	-75.3	165	-172.8	159.1	0	114	Q204 H205 T206 Q212	Q204-K208 WeakPolarHBondContact O-CB 3.2Å; Q204-K208 VanDerWaalsContact O-CD 3.28Å; Q204-K208 WeakPolarHBondContact O-CD 3.41Å; Q204-K208 WeakPolarHBondContact O-CG 2.96Å; Q204-K208 PolarHBondContact O-N 2.84Å; Q204-K208 VanDerWaalsContact O-N 3.09Å; H205-K208 CarbonylContact O-C 3.53Å; H205-K208 PolarHBondContact O-N 2.85Å; T206-K208 VanDerWaalsContact C-N 3.33Å; T206-K208 PolarHBondContact O-N 3.27Å; K208-Q212 WeakPolarHBondContact O-CG 3.19Å; K208-Q212 PolarHBondContact O-NE2 3.38Å
209	V	85	Confident	81.4	Confident	12 Å²	12	71.5 Å²	71.5	7%	0.073	37%	0.369	C	S	.	.	H	α-helix	trans	-91.1	-39	171.7	175.7	0	0	0	0	110.8	H205 T206 Q207 Q212 I221 L223	H205-V209 WeakPolarHBondContact O-CG2 3.2Å; H205-V209 PolarHBondContact O-N 2.92Å; T206-V209 PolarHBondContact O-N 3.49Å; Q207-V209 PolarHBondContact O-N 3.38Å; V209-Q212 WeakPolarHBondContact O-CG 3.43Å; V209-I221 HydrophobicContact CG1-CB 3.87Å; V209-I221 HydrophobicContact CG1-CG2 3.82Å; V209-I221 HydrophobicContact CG2-CD1 4.3Å; V209-L223 HydrophobicContact CG1-CD1 4.02Å; V209-L223 HydrophobicContact CG1-CD2 3.7Å; V209-L223 HydrophobicContact CG1-CG 3.72Å
210	Q	82.6	Confident	80.7	Confident	68 Å²	68	72.3 Å²	72.3	32%	0.318	38%	0.376	S	S	.	.	H	α-helix	trans	-63.2	-42.4	173.8	-71.3	166.9	-24.6	0	0	112.4	T206 Q207 Q212 L223 I265	T206-Q210 HydrophobicContact CG2-CG 4.38Å; T206-Q210 WeakPolarHBondContact O-CG 3.45Å; T206-Q210 PolarHBondContact O-N 3.44Å; Q207-Q210 PolarHBondContact O-N 3.39Å; Q210-Q212 VanDerWaalsContact C-N 3.28Å; Q210-Q212 PolarHBondContact O-N 3.28Å; Q210-L223 HydrophobicContact CB-CD1 4.33Å; Q210-L223 HydrophobicContact CG-CD1 3.6Å; Q210-I265 VanDerWaalsContact NE2-CD1 3.34Å
211	N	81.4	Confident	80.1	Confident	124 Å²	124	69.1 Å²	69.1	66%	0.663	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	24.6	-176.2	-64.1	-24.8	0	0	0	113.8	Q207 L213	Q207-N211 WeakPolarHBondContact O-CB 3.18Å; Q207-N211 PolarHBondContact O-N 2.95Å; Q207-N211 PolarHBondContact O-ND2 2.8Å; N211-L213 PolarHBondContact O-N 3.23Å; N211-L213 VanDerWaalsContact O-N 3.1Å
212	Q	73.3	Confident	79.4	Confident	52 Å²	52	72 Å²	72	24%	0.243	38%	0.377	C	S	.	.			trans	-74.6	102.5	179.3	-69.3	-171.4	3.9	0	0	111.5	K208 V209 Q210 Q214	K208-Q212 WeakPolarHBondContact O-CG 3.19Å; K208-Q212 PolarHBondContact O-NE2 3.38Å; V209-Q212 WeakPolarHBondContact O-CG 3.43Å; Q210-Q212 VanDerWaalsContact C-N 3.28Å; Q210-Q212 PolarHBondContact O-N 3.28Å; Q212-Q214 PolarHBondContact O-N 3.44Å
213	L	59	Low	78.8	Confident	174 Å²	174	73.2 Å²	73.2	91%	0.911	38%	0.383	S	S	*	.	S	Bend	trans	-57.2	-14.5	178.7	-64.1	170.1	0	0	0	114.7	N211	N211-L213 PolarHBondContact O-N 3.23Å; N211-L213 VanDerWaalsContact O-N 3.1Å
214	Q	61	Low	78.1	Confident	148 Å²	148	76.8 Å²	76.8	69%	0.692	40%	0.404	S	S	*	.			trans	-135.9	84.7	178.8	-67.1	-173.5	-2.1	0	0	110.5	Q212 N216 A217	Q212-Q214 PolarHBondContact O-N 3.44Å; Q214-N216 PolarHBondContact O-N 2.98Å; Q214-N216 VanDerWaalsContact O-N 3.14Å; Q214-A217 PolarHBondContact O-N 3.43Å
215	P	62.6	Low	77.7	Confident	84 Å²	84	76 Å²	76	55%	0.545	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.7	178	26.5	-35.2	0	0	0	113.6
216	N	62.3	Low	77.3	Confident	153 Å²	153	77.7 Å²	77.7	82%	0.818	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	8.4	-176.8	-64.5	7.6	0	0	0	114.1	Q214	Q214-N216 PolarHBondContact O-N 2.98Å; Q214-N216 VanDerWaalsContact O-N 3.14Å
217	A	69.5	Low	77.2	Confident	51 Å²	51	83.9 Å²	83.9	42%	0.421	45%	0.446	S	S	.	.	S	Bend	trans	-69.2	134	174.2	0	0	0	0	0	110.5	Q214 N219 A220	Q214-A217 PolarHBondContact O-N 3.43Å; A217-N219 PolarHBondContact O-N 2.91Å; A217-A220 HydrophobicContact CB-CB 4.2Å; A217-A220 VanDerWaalsContact O-CB 3.3Å; A217-A220 WeakPolarHBondContact O-CB 3.04Å; A217-A220 PolarHBondContact O-N 2.84Å
218	L	68.7	Low	77.2	Confident	171 Å²	171	79.4 Å²	79.4	90%	0.895	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-20.4	-165.1	-76.3	163.3	0	0	0	117.3
219	N	77.2	Confident	77.2	Confident	41 Å²	41	75 Å²	75	22%	0.219	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.5	18.4	177.3	-59.2	-67.8	0	0	0	112.6	N168 S169 K170 A217	N168-N219 WeakPolarHBondContact CA-O 3.09Å; S169-N219 PolarHBondContact N-O 3.11Å; S169-N219 PolarHBondContact OG-O 3.39Å; K170-N219 VanDerWaalsContact CE-OD1 3.28Å; K170-N219 WeakPolarHBondContact CE-OD1 3.35Å; A217-N219 PolarHBondContact O-N 2.91Å
220	A	81.3	Confident	77.4	Confident	17 Å²	17	76.1 Å²	76.1	14%	0.14	41%	0.413	C	S	.	.			trans	-67.1	152.8	177.2	0	0	0	0	0	111.8	S169 A217 N222	S169-A220 WeakPolarHBondContact CB-O 3.4Å; S169-A220 PolarHBondContact OG-O 3.33Å; A217-A220 HydrophobicContact CB-CB 4.2Å; A217-A220 VanDerWaalsContact O-CB 3.3Å; A217-A220 WeakPolarHBondContact O-CB 3.04Å; A217-A220 PolarHBondContact O-N 2.84Å; A220-N222 PolarHBondContact O-N 2.94Å
221	I	82.3	Confident	77.8	Confident	13 Å²	13	75 Å²	75	7%	0.067	41%	0.409	C	S	.	.			trans	-86.9	106.4	176.2	-63.3	177.9	0	0	0	108	V209 L223 T228	V209-I221 HydrophobicContact CG1-CB 3.87Å; V209-I221 HydrophobicContact CG1-CG2 3.82Å; V209-I221 HydrophobicContact CG2-CD1 4.3Å; I221-L223 PolarHBondContact O-N 3.43Å; I221-T228 HydrophobicContact CG2-CG2 3.53Å
222	N	81.8	Confident	78.2	Confident	80 Å²	80	69.7 Å²	69.7	43%	0.428	38%	0.38	S	S	.	.			trans	-83.8	103.2	178.7	-177.2	0.7	0	0	0	110.4	A220 N224 N225	A220-N222 PolarHBondContact O-N 2.94Å; N222-N224 PolarHBondContact O-N 3.33Å; N222-N224 WeakPolarHBondContact OD1-CB 2.93Å; N222-N224 PolarHBondContact OD1-N 2.98Å; N222-N224 PolarHBondContact OD1-ND2 3.11Å; N222-N225 WeakPolarHBondContact O-CB 3.34Å; N222-N225 PolarHBondContact O-N 3.35Å
223	L	81.3	Confident	79	Confident	28 Å²	28	67.6 Å²	67.6	15%	0.147	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-5.3	177.8	-67.2	178.2	0	0	0	114.9	V209 Q210 I221 N225 T228 Q229 F262	V209-L223 HydrophobicContact CG1-CD1 4.02Å; V209-L223 HydrophobicContact CG1-CD2 3.7Å; V209-L223 HydrophobicContact CG1-CG 3.72Å; Q210-L223 HydrophobicContact CB-CD1 4.33Å; Q210-L223 HydrophobicContact CG-CD1 3.6Å; I221-L223 PolarHBondContact O-N 3.43Å; L223-N225 VanDerWaalsContact C-N 3.35Å; L223-T228 HydrophobicContact CD2-CG2 4.16Å; L223-Q229 WeakPolarHBondContact O-CG 3.05Å; L223-Q229 PolarHBondContact O-NE2 2.73Å; L223-F262 HydrophobicContact CD2-CE2 3.96Å; L223-F262 HydrophobicContact CD2-CZ 4.13Å
224	N	80.7	Confident	80.6	Confident	98 Å²	98	63 Å²	63	52%	0.524	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-6.5	170.7	-56.8	-83.6	0	0	0	113.1	N222 I268	N222-N224 PolarHBondContact O-N 3.33Å; N222-N224 WeakPolarHBondContact OD1-CB 2.93Å; N222-N224 PolarHBondContact OD1-N 2.98Å; N222-N224 PolarHBondContact OD1-ND2 3.11Å; N224-I268 WeakPolarHBondContact O-CD1 3.42Å
225	N	84.6	Confident	82.2	Confident	62 Å²	62	56.1 Å²	56.1	33%	0.332	31%	0.312	S	S	.	.			trans	-78.5	130.8	173.5	178.5	25.3	0	0	0	111	N222 L223 E227 T228 Q229	N222-N225 WeakPolarHBondContact O-CB 3.34Å; N222-N225 PolarHBondContact O-N 3.35Å; L223-N225 VanDerWaalsContact C-N 3.35Å; N225-E227 PolarHBondContact O-N 3.46Å; N225-E227 PolarHBondContact OD1-N 3.11Å; N225-T228 PolarHBondContact ND2-OG1 2.76Å; N225-Q229 WeakPolarHBondContact O-CG 3.35Å; N225-Q229 PolarHBondContact O-N 2.86Å
226	A	83.9	Confident	83.7	Confident	43 Å²	43	52.7 Å²	52.7	36%	0.355	29%	0.289	S	S	.	.	H	α-helix	trans	-67.4	-32.3	-179.4	0	0	0	0	0	113.1	T230 I268	A226-T230 WeakPolarHBondContact O-CB 3.5Å; A226-T230 PolarHBondContact O-N 2.75Å; A226-T230 PolarHBondContact O-OG1 3.41Å; A226-I268 HydrophobicContact CB-CD1 4.23Å
227	E	87.5	Confident	85.2	Confident	142 Å²	142	45.7 Å²	45.7	66%	0.664	25%	0.251	S	S	*	.	H	α-helix	trans	-69.8	-47.9	177.1	-57.4	177.2	153.5	0	0	110.8	N225 Q229 T230 L231	N225-E227 PolarHBondContact O-N 3.46Å; N225-E227 PolarHBondContact OD1-N 3.11Å; E227-Q229 VanDerWaalsContact C-N 3.33Å; E227-Q229 PolarHBondContact O-N 2.7Å; E227-T230 WeakPolarHBondContact O-CB 3.19Å; E227-T230 PolarHBondContact O-N 2.81Å; E227-T230 VanDerWaalsContact O-N 3.08Å; E227-L231 WeakPolarHBondContact O-CG 3.17Å; E227-L231 PolarHBondContact O-N 3.34Å
228	T	88.4	Confident	86.4	Confident	6 Å²	6	45.6 Å²	45.6	4%	0.037	24%	0.24	C	C	.	.	H	α-helix	trans	-52.4	-47.8	171.2	-71.2	0	0	0	0	111.7	E172 I221 L223 N225 T230 H232	E172-T228 VanDerWaalsContact OE1-CA 3.24Å; E172-T228 WeakPolarHBondContact OE1-CA 3.29Å; E172-T228 WeakPolarHBondContact OE1-CB 3.4Å; E172-T228 VanDerWaalsContact OE1-CG2 3.27Å; E172-T228 WeakPolarHBondContact OE1-CG2 3.18Å; E172-T228 PolarHBondContact OE1-OG1 2.79Å; E172-T228 PolarHBondContact OE2-OG1 2.73Å; I221-T228 HydrophobicContact CG2-CG2 3.53Å; L223-T228 HydrophobicContact CD2-CG2 4.16Å; N225-T228 PolarHBondContact ND2-OG1 2.76Å; T228-T230 PolarHBondContact O-N 2.7Å; T228-H232 WeakPolarHBondContact O-CB 3.48Å; T228-H232 PolarHBondContact O-N 2.72Å; T228-H232 VanDerWaalsContact O-N 3.09Å; T228-H232 PolarHBondContact O-ND1 2.71Å
229	Q	86	Confident	87.7	Confident	7 Å²	7	37.4 Å²	37.4	3%	0.033	20%	0.197	C	C	.	.	H	α-helix	trans	-62.4	-40.5	175.8	-72.4	171.3	12.6	0	0	112.6	L223 N225 E227 H232 L233 F262	L223-Q229 WeakPolarHBondContact O-CG 3.05Å; L223-Q229 PolarHBondContact O-NE2 2.73Å; N225-Q229 WeakPolarHBondContact O-CG 3.35Å; N225-Q229 PolarHBondContact O-N 2.86Å; E227-Q229 VanDerWaalsContact C-N 3.33Å; E227-Q229 PolarHBondContact O-N 2.7Å; Q229-H232 PolarHBondContact O-N 2.87Å; Q229-L233 WeakPolarHBondContact O-CB 3.14Å; Q229-L233 VanDerWaalsContact O-CG 3.31Å; Q229-L233 WeakPolarHBondContact O-CG 3.28Å; Q229-L233 PolarHBondContact O-N 2.85Å; Q229-F262 HydrophobicContact CB-CE1 4.33Å; Q229-F262 HydrophobicContact CG-CE1 4.36Å; Q229-F262 HydrophobicContact CG-CZ 4.48Å
230	T	89.5	Confident	88.5	Confident	37 Å²	37	35.5 Å²	35.5	23%	0.227	19%	0.187	C	C	.	.	H	α-helix	trans	-61.4	-53.2	178.4	-65.2	0	0	0	0	110.8	A226 E227 T228 H232 L233 E234 L274	A226-T230 WeakPolarHBondContact O-CB 3.5Å; A226-T230 PolarHBondContact O-N 2.75Å; A226-T230 PolarHBondContact O-OG1 3.41Å; E227-T230 WeakPolarHBondContact O-CB 3.19Å; E227-T230 PolarHBondContact O-N 2.81Å; E227-T230 VanDerWaalsContact O-N 3.08Å; T228-T230 PolarHBondContact O-N 2.7Å; T230-H232 VanDerWaalsContact C-N 3.31Å; T230-H232 PolarHBondContact O-N 2.89Å; T230-L233 PolarHBondContact O-N 2.94Å; T230-L233 VanDerWaalsContact O-N 3.13Å; T230-E234 HydrophobicContact CG2-CG 4.44Å; T230-E234 WeakPolarHBondContact O-CG 3.12Å; T230-E234 PolarHBondContact O-N 2.79Å; T230-L274 HydrophobicContact CG2-CD1 4.18Å
231	L	91	Very high	89.2	Confident	45 Å²	45	35.7 Å²	35.7	24%	0.236	19%	0.186	C	C	.	.	H	α-helix	trans	-59.6	-40	178.8	-66.2	171.3	0	0	0	112.6	E172 H176 E227 T235	E172-L231 HydrophobicContact CG-CD1 4.15Å; H176-L231 HydrophobicContact CB-CB 4.49Å; H176-L231 PolarHBondContact ND1-O 2.8Å; E227-L231 WeakPolarHBondContact O-CG 3.17Å; E227-L231 PolarHBondContact O-N 3.34Å; L231-T235 WeakPolarHBondContact O-CB 3.22Å; L231-T235 PolarHBondContact O-N 2.99Å; L231-T235 VanDerWaalsContact O-N 3.08Å; L231-T235 PolarHBondContact O-OG1 2.83Å
232	H	90.8	Very high	89.8	Confident	12 Å²	12	35.1 Å²	35.1	6%	0.056	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-47.2	174.1	-83.1	70.8	0	0	0	112.1	E172 H176 T228 Q229 T230 T235 R236 F262	E172-H232 IonicContact OE1-CE1 3.84Å; E172-H232 PolarHBondContact OE1-CE1 3.18Å; E172-H232 IonicContact OE1-ND1 3.94Å; E172-H232 PolarHBondContact OE1-ND1 2.85Å; E172-H232 VanDerWaalsContact OE1-ND1 3.1Å; H176-H232 AromaticContact CE1-CE1 3.81Å; H176-H232 AromaticContact CE1-CG 3.88Å; H176-H232 AromaticContact CE1-ND1 3.6Å; H176-H232 AromaticContact NE2-CE1 3.49Å; H176-H232 PolarHBondContact NE2-CE1 3.46Å; H176-H232 AromaticContact NE2-ND1 3.39Å; H176-H232 PolarHBondContact NE2-ND1 2.87Å; T228-H232 WeakPolarHBondContact O-CB 3.48Å; T228-H232 PolarHBondContact O-N 2.72Å; T228-H232 VanDerWaalsContact O-N 3.09Å; T228-H232 PolarHBondContact O-ND1 2.71Å; Q229-H232 PolarHBondContact O-N 2.87Å; T230-H232 VanDerWaalsContact C-N 3.31Å; T230-H232 PolarHBondContact O-N 2.89Å; H232-T235 PolarHBondContact O-N 2.78Å; H232-R236 WeakPolarHBondContact O-CG 3.25Å; H232-R236 PolarHBondContact O-N 3.02Å; H232-R236 VanDerWaalsContact O-N 3.13Å; H232-F262 HydrophobicContact CB-CE1 3.86Å; H232-F262 HydrophobicContact CB-CE2 4.2Å; H232-F262 HydrophobicContact CB-CZ 3.52Å; H232-F262 AromaticContact CG-CZ 3.89Å
233	L	90.4	Very high	90.4	Very high	8 Å²	8	31.3 Å²	31.3	4%	0.042	16%	0.162	C	C	.	.	H	α-helix	trans	-65.6	-43.5	178.5	-75.5	169.5	0	0	0	112.1	Q229 T230 T235 R236 L237 I259 F262 M263 A270 L274	Q229-L233 WeakPolarHBondContact O-CB 3.14Å; Q229-L233 VanDerWaalsContact O-CG 3.31Å; Q229-L233 WeakPolarHBondContact O-CG 3.28Å; Q229-L233 PolarHBondContact O-N 2.85Å; T230-L233 PolarHBondContact O-N 2.94Å; T230-L233 VanDerWaalsContact O-N 3.13Å; L233-T235 VanDerWaalsContact C-N 3.32Å; L233-T235 PolarHBondContact O-N 3.26Å; L233-R236 PolarHBondContact O-N 2.97Å; L233-R236 VanDerWaalsContact O-N 3.14Å; L233-L237 WeakPolarHBondContact O-CG 3.44Å; L233-L237 PolarHBondContact O-N 2.91Å; L233-I259 HydrophobicContact CD2-CG2 4.06Å; L233-F262 HydrophobicContact CD2-CD1 3.92Å; L233-F262 HydrophobicContact CD2-CE1 4.49Å; L233-F262 HydrophobicContact CG-CD1 4.09Å; L233-F262 HydrophobicContact CG-CE1 4.15Å; L233-M263 HydrophobicContact CD2-CG 4.26Å; L233-A270 HydrophobicContact CD1-CB 3.96Å; L233-L274 HydrophobicContact CB-CD1 3.95Å; L233-L274 HydrophobicContact CD1-CD1 4Å
234	E	92.7	Very high	91	Very high	78 Å²	78	30.1 Å²	30.1	36%	0.364	16%	0.156	S	C	.	.	H	α-helix	trans	-58.3	-43.3	176	-73.1	174.9	164.8	0	0	111.8	T230 R236 L237 R238 L274	T230-E234 HydrophobicContact CG2-CG 4.44Å; T230-E234 WeakPolarHBondContact O-CG 3.12Å; T230-E234 PolarHBondContact O-N 2.79Å; E234-R236 VanDerWaalsContact C-N 3.34Å; E234-R236 PolarHBondContact O-N 3.18Å; E234-L237 PolarHBondContact O-N 3.31Å; E234-R238 PolarHBondContact O-N 3.03Å; E234-L274 HydrophobicContact CG-CD2 3.55Å
235	T	94.2	Very high	91.7	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.012	15%	0.154	C	C	.	.	H	α-helix	trans	-64.6	-36.5	176.1	-61.1	0	0	0	0	112.5	H176 A179 H180 Y183 L231 H232 L233 Q239	H176-T235 PolarHBondContact ND1-OG1 2.87Å; A179-T235 HydrophobicContact CB-CG2 3.84Å; H180-T235 WeakPolarHBondContact NE2-CA 3.48Å; Y183-T235 HydrophobicContact CE2-CG2 4.1Å; L231-T235 WeakPolarHBondContact O-CB 3.22Å; L231-T235 PolarHBondContact O-N 2.99Å; L231-T235 VanDerWaalsContact O-N 3.08Å; L231-T235 PolarHBondContact O-OG1 2.83Å; H232-T235 PolarHBondContact O-N 2.78Å; L233-T235 VanDerWaalsContact C-N 3.32Å; L233-T235 PolarHBondContact O-N 3.26Å; T235-Q239 WeakPolarHBondContact O-CB 3.34Å; T235-Q239 PolarHBondContact O-N 2.89Å
236	R	93.8	Very high	92.1	Very high	13 Å²	13	27.9 Å²	27.9	5%	0.049	14%	0.141	C	C	.	.	H	α-helix	trans	-75	-30.2	175.2	-63.5	-59.7	-175.1	179.7	3.6	112.7	I202 T206 H232 L233 E234 Q239 L240 T255 I259	I202-R236 VanDerWaalsContact C-NH2 3.28Å; I202-R236 PolarHBondContact O-NH2 2.9Å; T206-R236 PolarHBondContact OG1-NH2 2.87Å; H232-R236 WeakPolarHBondContact O-CG 3.25Å; H232-R236 PolarHBondContact O-N 3.02Å; H232-R236 VanDerWaalsContact O-N 3.13Å; L233-R236 PolarHBondContact O-N 2.97Å; L233-R236 VanDerWaalsContact O-N 3.14Å; E234-R236 VanDerWaalsContact C-N 3.34Å; E234-R236 PolarHBondContact O-N 3.18Å; R236-Q239 WeakPolarHBondContact O-CB 3.45Å; R236-Q239 PolarHBondContact O-N 2.85Å; R236-L240 PolarHBondContact O-N 3.27Å; R236-T255 WeakPolarHBondContact O-CG2 3.22Å; R236-I259 HydrophobicContact CB-CD1 4Å; R236-I259 HydrophobicContact CB-CG1 3.47Å; R236-I259 VanDerWaalsContact CB-CG1 3.47Å; R236-I259 HydrophobicContact CG-CG1 4.32Å
237	L	93.7	Very high	92.6	Very high	6 Å²	6	30.2 Å²	30.2	3%	0.031	15%	0.147	C	C	.	.	H	α-helix	trans	-67.5	-42.1	171.5	-71.4	165.9	0	0	0	110.9	L233 E234 Q239 L240 D241 I259 L274 N277 Y278	L233-L237 WeakPolarHBondContact O-CG 3.44Å; L233-L237 PolarHBondContact O-N 2.91Å; E234-L237 PolarHBondContact O-N 3.31Å; L237-Q239 VanDerWaalsContact C-N 3.34Å; L237-Q239 PolarHBondContact O-N 3.22Å; L237-L240 WeakPolarHBondContact O-CB 3.22Å; L237-L240 PolarHBondContact O-N 2.88Å; L237-D241 PolarHBondContact O-N 2.72Å; L237-I259 HydrophobicContact CD2-CD1 4.29Å; L237-L274 HydrophobicContact CD1-CB 4.24Å; L237-L274 HydrophobicContact CD1-CD2 4.11Å; L237-N277 HydrophobicContact CD1-CB 4.21Å; L237-N277 HydrophobicContact CD2-CB 4.48Å; L237-Y278 HydrophobicContact CD2-CD2 4.47Å
238	R	94.7	Very high	92.9	Very high	48 Å²	48	24.4 Å²	24.4	18%	0.181	12%	0.12	C	C	.	.	H	α-helix	trans	-66.7	-34	172.5	-171.7	62.9	-171.7	135.9	-0.7	112.7	Y183 N184 E234 D241 C242 E245	Y183-R238 HydrophobicContact CD2-CG 4.47Å; N184-R238 PolarHBondContact OD1-NE 2.9Å; N184-R238 VanDerWaalsContact OD1-NE 3.14Å; N184-R238 PolarHBondContact OD1-NH2 3.41Å; E234-R238 PolarHBondContact O-N 3.03Å; R238-D241 PolarHBondContact O-N 3.25Å; R238-C242 PolarHBondContact NH2-SG 2.72Å; R238-C242 VanDerWaalsContact NH2-SG 3.45Å; R238-C242 PolarHBondContact O-N 3.45Å; R238-E245 IonicContact CZ-OE1 3.49Å; R238-E245 IonicContact NH1-OE1 2.61Å; R238-E245 PolarHBondContact NH1-OE1 3.47Å; R238-E245 IonicContact NH2-OE1 2.63Å
239	Q	95.7	Very high	93.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.5	-44.2	170	-177.9	-175.9	-36.8	0	0	111.6	Y183 F195 T235 R236 L237 A243 T255	Y183-Q239 HydrophobicContact CE1-CB 4.09Å; Y183-Q239 HydrophobicContact CE1-CG 3.96Å; Y183-Q239 HydrophobicContact CE2-CB 3.82Å; Y183-Q239 HydrophobicContact CE2-CG 4.45Å; Y183-Q239 WeakPolarHBondContact OH-CB 3.05Å; Y183-Q239 VanDerWaalsContact OH-CD 3.27Å; Y183-Q239 WeakPolarHBondContact OH-CG 3.31Å; Y183-Q239 PolarHBondContact OH-OE1 3.36Å; F195-Q239 HydrophobicContact CZ-CG 4.49Å; F195-Q239 WeakPolarHBondContact CZ-O 3.26Å; T235-Q239 WeakPolarHBondContact O-CB 3.34Å; T235-Q239 PolarHBondContact O-N 2.89Å; R236-Q239 WeakPolarHBondContact O-CB 3.45Å; R236-Q239 PolarHBondContact O-N 2.85Å; L237-Q239 VanDerWaalsContact C-N 3.34Å; L237-Q239 PolarHBondContact O-N 3.22Å; Q239-A243 WeakPolarHBondContact O-CB 3.41Å; Q239-A243 PolarHBondContact O-N 2.87Å; Q239-T255 HydrophobicContact CB-CG2 3.92Å; Q239-T255 HydrophobicContact CG-CG2 3.71Å; Q239-T255 PolarHBondContact NE2-OG1 3.23Å
240	L	95.2	Very high	93.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.3	-45	178	177.4	57.9	0	0	0	111.2	R236 L237 A243 M244 A252 T255 V256 I259 K281 L285	R236-L240 PolarHBondContact O-N 3.27Å; L237-L240 WeakPolarHBondContact O-CB 3.22Å; L237-L240 PolarHBondContact O-N 2.88Å; L240-A243 WeakPolarHBondContact O-CB 2.99Å; L240-A243 PolarHBondContact O-N 3.31Å; L240-M244 HydrophobicContact CD1-CG 4.43Å; L240-M244 HydrophobicContact CD1-SD 3.96Å; L240-M244 HydrophobicContact CG-SD 4.03Å; L240-M244 WeakPolarHBondContact O-CG 3.48Å; L240-M244 PolarHBondContact O-N 2.64Å; L240-A252 HydrophobicContact CD1-CB 3.9Å; L240-T255 HydrophobicContact CB-CG2 3.94Å; L240-V256 HydrophobicContact CD1-CG2 3.88Å; L240-V256 HydrophobicContact CD2-CG2 4.04Å; L240-I259 HydrophobicContact CD2-CD1 4.38Å; L240-K281 HydrophobicContact CD2-CB 3.76Å; L240-K281 HydrophobicContact CG-CB 4.29Å; L240-L285 HydrophobicContact CD1-CD2 4.27Å
241	D	94.6	Very high	93.5	Very high	22 Å²	22	32.5 Å²	32.5	12%	0.118	16%	0.157	C	C	.	.	H	α-helix	trans	-57.6	-55.4	175.7	-74.9	-11.7	0	0	0	111.8	L237 R238 A243 M244 E245 K281	L237-D241 PolarHBondContact O-N 2.72Å; R238-D241 PolarHBondContact O-N 3.25Å; D241-A243 PolarHBondContact O-N 3.4Å; D241-M244 CarbonylContact O-C 3.6Å; D241-M244 PolarHBondContact O-N 3.48Å; D241-E245 WeakPolarHBondContact O-CG 3.38Å; D241-E245 PolarHBondContact O-N 3.39Å; D241-K281 WeakPolarHBondContact OD1-CD 3.38Å; D241-K281 WeakPolarHBondContact OD1-CE 3.24Å; D241-K281 WeakPolarHBondContact OD1-CG 3.37Å; D241-K281 IonicContact OD1-NZ 2.68Å; D241-K281 PolarHBondContact OD1-NZ 3.12Å; D241-K281 IonicContact OD2-NZ 2.93Å; D241-K281 PolarHBondContact OD2-NZ 2.77Å
242	C	95.1	Very high	93.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.1	-29.6	178.1	-74.3	0	0	0	0	112.8	L187 F195 R238 L246	L187-C242 HydrophobicContact CD1-CB 4.48Å; F195-C242 HydrophobicContact CD2-CB 4.34Å; F195-C242 HydrophobicContact CE2-CB 3.53Å; F195-C242 HydrophobicContact CZ-CB 4.14Å; R238-C242 PolarHBondContact NH2-SG 2.72Å; R238-C242 VanDerWaalsContact NH2-SG 3.45Å; R238-C242 PolarHBondContact O-N 3.45Å; C242-L246 VanDerWaalsContact O-CB 3.27Å; C242-L246 WeakPolarHBondContact O-CB 3.49Å; C242-L246 VanDerWaalsContact O-CG 3.26Å; C242-L246 WeakPolarHBondContact O-CG 3.37Å; C242-L246 PolarHBondContact O-N 2.77Å
243	A	95.7	Very high	93.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-68.3	-34.6	173.4	0	0	0	0	0	112.2	F195 Q239 L240 D241 M248 A252	F195-A243 HydrophobicContact CE1-CB 3.79Å; F195-A243 HydrophobicContact CZ-CB 3.7Å; Q239-A243 WeakPolarHBondContact O-CB 3.41Å; Q239-A243 PolarHBondContact O-N 2.87Å; L240-A243 WeakPolarHBondContact O-CB 2.99Å; L240-A243 PolarHBondContact O-N 3.31Å; D241-A243 PolarHBondContact O-N 3.4Å; A243-M248 WeakPolarHBondContact O-CA 3Å; A243-M248 WeakPolarHBondContact O-CB 3.49Å; A243-M248 PolarHBondContact O-N 2.76Å; A243-A252 HydrophobicContact CB-CB 3.7Å
244	M	93.2	Very high	93.9	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.02	17%	0.171	C	C	.	.	H	α-helix	trans	-78.9	-36.6	176.6	-71	166.6	52.5	0	0	112.5	L240 D241 L246 D247 A252 K281 E284 L285 R288	L240-M244 HydrophobicContact CD1-CG 4.43Å; L240-M244 HydrophobicContact CD1-SD 3.96Å; L240-M244 HydrophobicContact CG-SD 4.03Å; L240-M244 WeakPolarHBondContact O-CG 3.48Å; L240-M244 PolarHBondContact O-N 2.64Å; D241-M244 CarbonylContact O-C 3.6Å; D241-M244 PolarHBondContact O-N 3.48Å; M244-L246 VanDerWaalsContact C-N 3.3Å; M244-L246 PolarHBondContact O-N 2.73Å; M244-D247 PolarHBondContact O-N 2.8Å; M244-A252 HydrophobicContact CG-CB 4.22Å; M244-K281 HydrophobicContact SD-CB 4.37Å; M244-E284 HydrophobicContact CE-CB 3.8Å; M244-E284 HydrophobicContact CE-CG 4.02Å; M244-E284 VanDerWaalsContact CE-OE2 3.29Å; M244-E284 WeakPolarHBondContact CE-OE2 3.24Å; M244-L285 HydrophobicContact CG-CD1 4.36Å; M244-L285 HydrophobicContact SD-CB 4.08Å; M244-R288 PolarHBondContact O-NH1 2.75Å
245	E	94.4	Very high	94	Very high	101 Å²	101	32.6 Å²	32.6	47%	0.472	15%	0.154	S	C	.	.	H	α-helix	trans	-69.4	-26	174.6	-68.2	175	-92.1	0	0	112.5	L187 R238 D241	L187-E245 HydrophobicContact CD1-CB 3.54Å; L187-E245 HydrophobicContact CD1-CG 4.08Å; L187-E245 WeakPolarHBondContact CD1-OE2 3.36Å; R238-E245 IonicContact CZ-OE1 3.49Å; R238-E245 IonicContact NH1-OE1 2.61Å; R238-E245 PolarHBondContact NH1-OE1 3.47Å; R238-E245 IonicContact NH2-OE1 2.63Å; D241-E245 WeakPolarHBondContact O-CG 3.38Å; D241-E245 PolarHBondContact O-N 3.39Å
246	L	94.1	Very high	94	Very high	12 Å²	12	32.5 Å²	32.5	6%	0.063	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	8.9	174.8	-67.9	172	0	0	0	114	K192 F195 C242 M244 M248	K192-L246 WeakPolarHBondContact CE-O 3.4Å; K192-L246 HydrophobicContact CG-CB 4.46Å; K192-L246 HydrophobicContact CG-CD2 4.34Å; K192-L246 PolarHBondContact NZ-O 3.23Å; F195-L246 HydrophobicContact CB-CD1 4.06Å; F195-L246 HydrophobicContact CD1-CD1 4.32Å; F195-L246 HydrophobicContact CD2-CD1 3.89Å; F195-L246 HydrophobicContact CE2-CD1 4.47Å; F195-L246 HydrophobicContact CG-CD1 3.82Å; C242-L246 VanDerWaalsContact O-CB 3.27Å; C242-L246 WeakPolarHBondContact O-CB 3.49Å; C242-L246 VanDerWaalsContact O-CG 3.26Å; C242-L246 WeakPolarHBondContact O-CG 3.37Å; C242-L246 PolarHBondContact O-N 2.77Å; M244-L246 VanDerWaalsContact C-N 3.3Å; M244-L246 PolarHBondContact O-N 2.73Å; L246-M248 HydrophobicContact CB-CG 3.67Å; L246-M248 HydrophobicContact CB-SD 3.98Å; L246-M248 HydrophobicContact CD1-SD 4.27Å; L246-M248 VanDerWaalsContact O-CG 3.24Å; L246-M248 WeakPolarHBondContact O-CG 2.99Å; L246-M248 PolarHBondContact O-N 2.8Å
247	D	93.4	Very high	93.9	Very high	91 Å²	91	35 Å²	35	49%	0.487	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	31.1	-174.4	-67.8	-62.6	0	0	0	114.6	M244 Y249	M244-D247 PolarHBondContact O-N 2.8Å; D247-Y249 VanDerWaalsContact C-N 3.32Å; D247-Y249 HydrophobicContact CB-CD2 4.47Å; D247-Y249 HydrophobicContact CB-CE2 3.73Å; D247-Y249 WeakPolarHBondContact O-CD2 3.46Å; D247-Y249 PolarHBondContact O-N 2.74Å; D247-Y249 WeakPolarHBondContact OD1-CE2 3.5Å; D247-Y249 VanDerWaalsContact OD1-CZ 3.31Å; D247-Y249 PolarHBondContact OD1-OH 2.71Å
248	M	93.8	Very high	93.8	Very high	20 Å²	20	36.6 Å²	36.6	10%	0.099	17%	0.174	C	C	.	.			trans	-95.5	52.1	-175.4	-56.6	-163.1	65.1	0	0	111.7	K192 F195 K196 A243 L246 N250 E251 A252	K192-M248 HydrophobicContact CB-CE 4.09Å; K192-M248 HydrophobicContact CB-SD 3.64Å; K192-M248 HydrophobicContact CD-CG 4.3Å; K192-M248 HydrophobicContact CD-SD 4.23Å; K192-M248 HydrophobicContact CG-SD 3.9Å; K192-M248 WeakPolarHBondContact O-CE 3.44Å; F195-M248 HydrophobicContact CB-SD 4.37Å; F195-M248 HydrophobicContact CD1-CE 4.21Å; F195-M248 HydrophobicContact CD1-SD 3.52Å; F195-M248 VanDerWaalsContact CD1-SD 3.52Å; F195-M248 HydrophobicContact CE1-SD 4.21Å; F195-M248 HydrophobicContact CG-SD 4.23Å; K196-M248 HydrophobicContact CD-CE 4.08Å; K196-M248 HydrophobicContact CG-CE 3.63Å; A243-M248 WeakPolarHBondContact O-CA 3Å; A243-M248 WeakPolarHBondContact O-CB 3.49Å; A243-M248 PolarHBondContact O-N 2.76Å; L246-M248 HydrophobicContact CB-CG 3.67Å; L246-M248 HydrophobicContact CB-SD 3.98Å; L246-M248 HydrophobicContact CD1-SD 4.27Å; L246-M248 VanDerWaalsContact O-CG 3.24Å; L246-M248 WeakPolarHBondContact O-CG 2.99Å; L246-M248 PolarHBondContact O-N 2.8Å; M248-N250 PolarHBondContact O-N 2.71Å; M248-E251 HydrophobicContact CB-CB 4.49Å; M248-E251 PolarHBondContact O-N 3.29Å; M248-A252 PolarHBondContact O-N 2.74Å
249	Y	92.9	Very high	93.7	Very high	64 Å²	64	34.4 Å²	34.4	25%	0.251	17%	0.166	S	C	.	.	H	α-helix	trans	-49.8	-33.1	-172.6	-61.2	-70.8	0	0	0	114.8	D247 A252 F253 L285 R288	D247-Y249 VanDerWaalsContact C-N 3.32Å; D247-Y249 HydrophobicContact CB-CD2 4.47Å; D247-Y249 HydrophobicContact CB-CE2 3.73Å; D247-Y249 WeakPolarHBondContact O-CD2 3.46Å; D247-Y249 PolarHBondContact O-N 2.74Å; D247-Y249 WeakPolarHBondContact OD1-CE2 3.5Å; D247-Y249 VanDerWaalsContact OD1-CZ 3.31Å; D247-Y249 PolarHBondContact OD1-OH 2.71Å; Y249-A252 PolarHBondContact O-N 3.33Å; Y249-F253 WeakPolarHBondContact O-CB 3.22Å; Y249-F253 PolarHBondContact O-N 2.73Å; Y249-L285 HydrophobicContact CD1-CD1 3.74Å; Y249-L285 HydrophobicContact CE1-CD1 4.44Å; Y249-R288 HydrophobicContact CE1-CB 3.76Å; Y249-R288 HydrophobicContact CE1-CG 4.38Å; Y249-R288 WeakPolarHBondContact OH-CD 3.33Å; Y249-R288 PolarHBondContact OH-NH1 3.38Å; Y249-R288 VanDerWaalsContact OH-NH1 3.1Å
250	N	91.9	Very high	93.4	Very high	138 Å²	138	36.3 Å²	36.3	74%	0.738	17%	0.174	S	C	*	.	H	α-helix	trans	-70.7	-32	175.1	-70.7	-36.4	0	0	0	114.3	M248 K254	M248-N250 PolarHBondContact O-N 2.71Å; N250-K254 WeakPolarHBondContact O-CG 3.35Å; N250-K254 PolarHBondContact O-N 3.27Å
251	E	93.2	Very high	93	Very high	18 Å²	18	39.4 Å²	39.4	8%	0.084	20%	0.195	C	C	.	.	H	α-helix	trans	-84.2	-30.5	170.9	-70.4	-56.1	136	0	0	111.6	F195 K196 R203 M248 F253 K254 T255	F195-E251 HydrophobicContact CE1-CB 4.33Å; K196-E251 HydrophobicContact CG-CG 4.17Å; R203-E251 IonicContact CZ-OE2 3.2Å; R203-E251 IonicContact NH1-OE2 2.62Å; R203-E251 PolarHBondContact NH1-OE2 3.22Å; R203-E251 IonicContact NH2-OE2 2.89Å; R203-E251 PolarHBondContact NH2-OE2 2.64Å; M248-E251 HydrophobicContact CB-CB 4.49Å; M248-E251 PolarHBondContact O-N 3.29Å; E251-F253 VanDerWaalsContact C-N 3.33Å; E251-K254 PolarHBondContact O-N 2.67Å; E251-K254 IonicContact OE1-NZ 3.27Å; E251-K254 PolarHBondContact OE1-NZ 2.69Å; E251-K254 IonicContact OE2-NZ 2.67Å; E251-T255 WeakPolarHBondContact O-CB 3.35Å; E251-T255 PolarHBondContact O-N 3.43Å; E251-T255 PolarHBondContact O-OG1 2.81Å
252	A	94.9	Very high	92.6	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.9	-47.8	170.1	0	0	0	0	0	110.4	L240 A243 M244 M248 Y249 T255 V256 L285	L240-A252 HydrophobicContact CD1-CB 3.9Å; A243-A252 HydrophobicContact CB-CB 3.7Å; M244-A252 HydrophobicContact CG-CB 4.22Å; M248-A252 PolarHBondContact O-N 2.74Å; Y249-A252 PolarHBondContact O-N 3.33Å; A252-T255 WeakPolarHBondContact O-CA 3.4Å; A252-T255 WeakPolarHBondContact O-CB 3.27Å; A252-T255 PolarHBondContact O-N 3.25Å; A252-V256 PolarHBondContact O-N 2.7Å; A252-L285 HydrophobicContact CB-CD1 3.79Å; A252-L285 HydrophobicContact CB-CD2 4.16Å
253	F	91.8	Very high	92	Very high	59 Å²	59	40.4 Å²	40.4	26%	0.259	20%	0.199	S	C	.	.	H	α-helix	trans	-58	-52.1	176.6	-174.9	-103.8	0	0	0	112.7	Y249 E251 T255 V256 E257 L357 L360	Y249-F253 WeakPolarHBondContact O-CB 3.22Å; Y249-F253 PolarHBondContact O-N 2.73Å; E251-F253 VanDerWaalsContact C-N 3.33Å; F253-T255 PolarHBondContact O-N 2.82Å; F253-V256 WeakPolarHBondContact O-CA 3.3Å; F253-V256 WeakPolarHBondContact O-CB 3.42Å; F253-V256 PolarHBondContact O-N 2.67Å; F253-E257 HydrophobicContact CD1-CG 4.39Å; F253-E257 HydrophobicContact CE1-CG 3.97Å; F253-E257 VanDerWaalsContact CE1-OE1 3.3Å; F253-E257 WeakPolarHBondContact CE1-OE1 3.15Å; F253-E257 HydrophobicContact CZ-CG 4.22Å; F253-E257 PolarHBondContact O-N 3.39Å; F253-L357 HydrophobicContact CE2-CD2 3.61Å; F253-L357 HydrophobicContact CZ-CD2 4.25Å; F253-L360 HydrophobicContact CE2-CD1 3.62Å; F253-L360 HydrophobicContact CZ-CD1 3.77Å
254	K	93.3	Very high	91.4	Very high	86 Å²	86	46.1 Å²	46.1	37%	0.374	23%	0.228	S	C	.	.	H	α-helix	trans	-57.7	-32	174	-67.5	172.6	-172.5	175.2	0	112.8	R203 N250 E251 E257 D258	R203-K254 VanDerWaalsContact NH2-CB 3.27Å; N250-K254 WeakPolarHBondContact O-CG 3.35Å; N250-K254 PolarHBondContact O-N 3.27Å; E251-K254 PolarHBondContact O-N 2.67Å; E251-K254 IonicContact OE1-NZ 3.27Å; E251-K254 PolarHBondContact OE1-NZ 2.69Å; E251-K254 IonicContact OE2-NZ 2.67Å; K254-E257 CarbonylContact O-C 3.5Å; K254-E257 WeakPolarHBondContact O-CB 3.21Å; K254-E257 PolarHBondContact O-N 3.36Å; K254-D258 WeakPolarHBondContact O-CB 3.46Å; K254-D258 PolarHBondContact O-N 3.33Å; K254-D258 VanDerWaalsContact O-OD2 3.09Å
255	T	94.6	Very high	90.8	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-69.9	-34.4	176.7	-52.5	0	0	0	0	111.6	R236 Q239 L240 E251 A252 F253 D258 I259	R236-T255 WeakPolarHBondContact O-CG2 3.22Å; Q239-T255 HydrophobicContact CB-CG2 3.92Å; Q239-T255 HydrophobicContact CG-CG2 3.71Å; Q239-T255 PolarHBondContact NE2-OG1 3.23Å; L240-T255 HydrophobicContact CB-CG2 3.94Å; E251-T255 WeakPolarHBondContact O-CB 3.35Å; E251-T255 PolarHBondContact O-N 3.43Å; E251-T255 PolarHBondContact O-OG1 2.81Å; A252-T255 WeakPolarHBondContact O-CA 3.4Å; A252-T255 WeakPolarHBondContact O-CB 3.27Å; A252-T255 PolarHBondContact O-N 3.25Å; F253-T255 PolarHBondContact O-N 2.82Å; T255-D258 PolarHBondContact O-N 3.44Å; T255-I259 HydrophobicContact CG2-CD1 4.23Å; T255-I259 WeakPolarHBondContact O-CD1 3.23Å; T255-I259 VanDerWaalsContact O-CG1 3.22Å; T255-I259 WeakPolarHBondContact O-CG1 3.4Å; T255-I259 PolarHBondContact O-N 2.69Å
256	V	93.5	Very high	89.8	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-65.6	-39.6	170.1	179.3	0	0	0	0	110.7	L240 A252 F253 I259 W260 Y278 T282 L285 L360	L240-V256 HydrophobicContact CD1-CG2 3.88Å; L240-V256 HydrophobicContact CD2-CG2 4.04Å; A252-V256 PolarHBondContact O-N 2.7Å; F253-V256 WeakPolarHBondContact O-CA 3.3Å; F253-V256 WeakPolarHBondContact O-CB 3.42Å; F253-V256 PolarHBondContact O-N 2.67Å; V256-I259 PolarHBondContact O-N 3.17Å; V256-W260 WeakPolarHBondContact O-CB 3.48Å; V256-W260 PolarHBondContact O-N 3.42Å; V256-Y278 HydrophobicContact CG1-CE2 3.98Å; V256-Y278 VanDerWaalsContact CG1-OH 3.29Å; V256-Y278 WeakPolarHBondContact CG1-OH 3.47Å; V256-T282 HydrophobicContact CG1-CG2 4.26Å; V256-L285 HydrophobicContact CG2-CD2 3.74Å; V256-L360 HydrophobicContact CG1-CB 4.17Å; V256-L360 HydrophobicContact CG1-CD1 4.05Å; V256-L360 HydrophobicContact CG1-CD2 4.42Å; V256-L360 HydrophobicContact CG1-CG 4.43Å
257	E	91.9	Very high	88.3	Confident	65 Å²	65	56.5 Å²	56.5	30%	0.304	27%	0.27	S	S	.	.	H	α-helix	trans	-63.9	-42.2	172.1	-61.5	-179.9	126.8	0	0	112.3	F253 K254 S261 L360	F253-E257 HydrophobicContact CD1-CG 4.39Å; F253-E257 HydrophobicContact CE1-CG 3.97Å; F253-E257 VanDerWaalsContact CE1-OE1 3.3Å; F253-E257 WeakPolarHBondContact CE1-OE1 3.15Å; F253-E257 HydrophobicContact CZ-CG 4.22Å; F253-E257 PolarHBondContact O-N 3.39Å; K254-E257 CarbonylContact O-C 3.5Å; K254-E257 WeakPolarHBondContact O-CB 3.21Å; K254-E257 PolarHBondContact O-N 3.36Å; E257-S261 VanDerWaalsContact O-CB 3.22Å; E257-S261 WeakPolarHBondContact O-CB 3.27Å; E257-S261 PolarHBondContact O-N 2.88Å; E257-S261 PolarHBondContact O-OG 2.69Å; E257-L360 HydrophobicContact CB-CD2 4.39Å; E257-L360 HydrophobicContact CG-CD1 3.99Å; E257-L360 HydrophobicContact CG-CD2 4.03Å
258	D	92.2	Very high	86.9	Confident	39 Å²	39	55.7 Å²	55.7	21%	0.209	27%	0.265	C	S	.	.	H	α-helix	trans	-59	-48.2	174.8	-69.1	-48.1	0	0	0	110.7	R203 K254 T255 F262	R203-D258 WeakPolarHBondContact CG-OD1 3.48Å; R203-D258 IonicContact CZ-OD2 2.69Å; R203-D258 VanDerWaalsContact CZ-OD2 3.29Å; R203-D258 IonicContact NE-OD1 3.63Å; R203-D258 PolarHBondContact NE-OD1 2.76Å; R203-D258 VanDerWaalsContact NE-OD1 3.16Å; R203-D258 IonicContact NE-OD2 3.59Å; R203-D258 PolarHBondContact NE-OD2 3.36Å; R203-D258 IonicContact NH2-OD2 3.12Å; R203-D258 PolarHBondContact NH2-OD2 3.39Å; K254-D258 WeakPolarHBondContact O-CB 3.46Å; K254-D258 PolarHBondContact O-N 3.33Å; K254-D258 VanDerWaalsContact O-OD2 3.09Å; T255-D258 PolarHBondContact O-N 3.44Å; D258-F262 WeakPolarHBondContact O-CB 3.35Å; D258-F262 PolarHBondContact O-N 2.89Å
259	I	91.9	Very high	85.5	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-63.3	-50.7	179.3	-68.4	162.6	0	0	0	110.8	L233 R236 L237 L240 T255 V256 S261 F262 M263 Y278	L233-I259 HydrophobicContact CD2-CG2 4.06Å; R236-I259 HydrophobicContact CB-CD1 4Å; R236-I259 HydrophobicContact CB-CG1 3.47Å; R236-I259 VanDerWaalsContact CB-CG1 3.47Å; R236-I259 HydrophobicContact CG-CG1 4.32Å; L237-I259 HydrophobicContact CD2-CD1 4.29Å; L240-I259 HydrophobicContact CD2-CD1 4.38Å; T255-I259 HydrophobicContact CG2-CD1 4.23Å; T255-I259 WeakPolarHBondContact O-CD1 3.23Å; T255-I259 VanDerWaalsContact O-CG1 3.22Å; T255-I259 WeakPolarHBondContact O-CG1 3.4Å; T255-I259 PolarHBondContact O-N 2.69Å; V256-I259 PolarHBondContact O-N 3.17Å; I259-S261 VanDerWaalsContact C-N 3.33Å; I259-S261 PolarHBondContact O-N 3.37Å; I259-F262 PolarHBondContact O-N 3.46Å; I259-M263 HydrophobicContact CG2-CG 4.43Å; I259-M263 HydrophobicContact CG2-SD 4.09Å; I259-M263 WeakPolarHBondContact O-CG 3.24Å; I259-M263 PolarHBondContact O-N 2.73Å; I259-Y278 HydrophobicContact CB-CD2 4.31Å; I259-Y278 HydrophobicContact CB-CE2 3.94Å; I259-Y278 HydrophobicContact CD1-CD2 4.04Å; I259-Y278 HydrophobicContact CD1-CE2 4.18Å; I259-Y278 HydrophobicContact CG2-CD2 3.6Å; I259-Y278 HydrophobicContact CG2-CE2 3.55Å; I259-Y278 HydrophobicContact CG2-CG 4.42Å
260	W	89.1	Confident	84.2	Confident	41 Å²	41	61.1 Å²	61.1	16%	0.155	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-40.8	-177.7	-173	-102.1	0	0	0	111.6	V256 F262 M263 M264 Y278 G359 L360	V256-W260 WeakPolarHBondContact O-CB 3.48Å; V256-W260 PolarHBondContact O-N 3.42Å; W260-F262 VanDerWaalsContact C-N 3.34Å; W260-F262 PolarHBondContact O-N 2.71Å; W260-M263 HydrophobicContact CE3-CE 4.02Å; W260-M263 HydrophobicContact CE3-SD 4.1Å; W260-M263 HydrophobicContact CZ3-CE 3.7Å; W260-M263 HydrophobicContact CZ3-SD 4.36Å; W260-M263 WeakPolarHBondContact O-CB 3.3Å; W260-M263 PolarHBondContact O-N 3.35Å; W260-M264 HydrophobicContact CD2-CE 4.48Å; W260-M264 HydrophobicContact CH2-CE 3.87Å; W260-M264 HydrophobicContact CZ2-CE 3.47Å; W260-M264 VanDerWaalsContact CZ2-CE 3.47Å; W260-M264 HydrophobicContact CZ2-SD 4.07Å; W260-M264 WeakPolarHBondContact O-CG 3.27Å; W260-M264 PolarHBondContact O-N 2.85Å; W260-Y278 HydrophobicContact CE3-CE1 4.37Å; W260-G359 VanDerWaalsContact CZ2-O 3.31Å; W260-G359 WeakPolarHBondContact CZ2-O 3.48Å; W260-G359 PolarHBondContact NE1-O 2.67Å; W260-L360 HydrophobicContact CB-CD2 3.63Å; W260-L360 HydrophobicContact CG-CD2 3.93Å
261	S	87.7	Confident	83.4	Confident	65 Å²	65	59.4 Å²	59.4	46%	0.455	28%	0.284	S	S	.	.	H	α-helix	trans	-63.3	-39.3	175.5	-57.3	0	0	0	0	112	E257 I259 M264 I265	E257-S261 VanDerWaalsContact O-CB 3.22Å; E257-S261 WeakPolarHBondContact O-CB 3.27Å; E257-S261 PolarHBondContact O-N 2.88Å; E257-S261 PolarHBondContact O-OG 2.69Å; I259-S261 VanDerWaalsContact C-N 3.33Å; I259-S261 PolarHBondContact O-N 3.37Å; S261-M264 PolarHBondContact O-N 2.79Å; S261-I265 WeakPolarHBondContact O-CD1 3.27Å; S261-I265 WeakPolarHBondContact O-CG1 3.24Å; S261-I265 PolarHBondContact O-N 2.98Å
262	F	85.6	Confident	82.9	Confident	14 Å²	14	61.3 Å²	61.3	6%	0.061	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-42.8	174.4	-170.1	-98.1	0	0	0	111.7	T206 L223 Q229 H232 L233 D258 I259 W260 M264 I265 S266	T206-F262 HydrophobicContact CG2-CD2 3.98Å; T206-F262 HydrophobicContact CG2-CE2 4.12Å; L223-F262 HydrophobicContact CD2-CE2 3.96Å; L223-F262 HydrophobicContact CD2-CZ 4.13Å; Q229-F262 HydrophobicContact CB-CE1 4.33Å; Q229-F262 HydrophobicContact CG-CE1 4.36Å; Q229-F262 HydrophobicContact CG-CZ 4.48Å; H232-F262 HydrophobicContact CB-CE1 3.86Å; H232-F262 HydrophobicContact CB-CE2 4.2Å; H232-F262 HydrophobicContact CB-CZ 3.52Å; H232-F262 AromaticContact CG-CZ 3.89Å; L233-F262 HydrophobicContact CD2-CD1 3.92Å; L233-F262 HydrophobicContact CD2-CE1 4.49Å; L233-F262 HydrophobicContact CG-CD1 4.09Å; L233-F262 HydrophobicContact CG-CE1 4.15Å; D258-F262 WeakPolarHBondContact O-CB 3.35Å; D258-F262 PolarHBondContact O-N 2.89Å; I259-F262 PolarHBondContact O-N 3.46Å; W260-F262 VanDerWaalsContact C-N 3.34Å; W260-F262 PolarHBondContact O-N 2.71Å; F262-M264 VanDerWaalsContact C-N 3.32Å; F262-M264 PolarHBondContact O-N 2.63Å; F262-I265 PolarHBondContact O-N 3.44Å; F262-S266 PolarHBondContact O-N 3.44Å; F262-S266 PolarHBondContact O-OG 3.09Å
263	M	83.6	Confident	82.4	Confident	29 Å²	29	64.9 Å²	64.9	14%	0.143	32%	0.323	C	S	.	.	H	α-helix	trans	-60.5	-35.8	175.7	-74.7	176.7	54.9	0	0	113.6	L233 I259 W260 I265 S266 M275	L233-M263 HydrophobicContact CD2-CG 4.26Å; I259-M263 HydrophobicContact CG2-CG 4.43Å; I259-M263 HydrophobicContact CG2-SD 4.09Å; I259-M263 WeakPolarHBondContact O-CG 3.24Å; I259-M263 PolarHBondContact O-N 2.73Å; W260-M263 HydrophobicContact CE3-CE 4.02Å; W260-M263 HydrophobicContact CE3-SD 4.1Å; W260-M263 HydrophobicContact CZ3-CE 3.7Å; W260-M263 HydrophobicContact CZ3-SD 4.36Å; W260-M263 WeakPolarHBondContact O-CB 3.3Å; W260-M263 PolarHBondContact O-N 3.35Å; M263-I265 VanDerWaalsContact C-N 3.26Å; M263-I265 PolarHBondContact O-N 3.05Å; M263-S266 WeakPolarHBondContact CA-OG 3.25Å; M263-S266 PolarHBondContact O-OG 2.67Å; M263-M275 HydrophobicContact CE-CE 3.48Å; M263-M275 VanDerWaalsContact CE-CE 3.48Å; M263-M275 HydrophobicContact CE-SD 3.44Å; M263-M275 WeakPolarHBondContact CE-SD 3.16Å; M263-M275 HydrophobicContact SD-CE 3.87Å; M263-M275 HydrophobicContact SD-SD 3.65Å; M263-M275 VanDerWaalsContact SD-SD 3.65Å
264	M	82.4	Confident	82.2	Confident	120 Å²	120	62.8 Å²	62.8	59%	0.591	32%	0.315	S	S	*	.	H	α-helix	trans	-71.3	-20.8	175.8	-65.8	-64.7	96.6	0	0	113	W260 S261 F262	W260-M264 HydrophobicContact CD2-CE 4.48Å; W260-M264 HydrophobicContact CH2-CE 3.87Å; W260-M264 HydrophobicContact CZ2-CE 3.47Å; W260-M264 VanDerWaalsContact CZ2-CE 3.47Å; W260-M264 HydrophobicContact CZ2-SD 4.07Å; W260-M264 WeakPolarHBondContact O-CG 3.27Å; W260-M264 PolarHBondContact O-N 2.85Å; S261-M264 PolarHBondContact O-N 2.79Å; F262-M264 VanDerWaalsContact C-N 3.32Å; F262-M264 PolarHBondContact O-N 2.63Å
265	I	80.5	Confident	82	Confident	95 Å²	95	59.5 Å²	59.5	49%	0.487	30%	0.301	S	S	.	.	H	α-helix	trans	-89.5	-35.5	177.8	-66.7	166	0	0	0	111	Q210 S261 F262 M263 R267	Q210-I265 VanDerWaalsContact NE2-CD1 3.34Å; S261-I265 WeakPolarHBondContact O-CD1 3.27Å; S261-I265 WeakPolarHBondContact O-CG1 3.24Å; S261-I265 PolarHBondContact O-N 2.98Å; F262-I265 PolarHBondContact O-N 3.44Å; M263-I265 VanDerWaalsContact C-N 3.26Å; M263-I265 PolarHBondContact O-N 3.05Å; I265-R267 PolarHBondContact O-N 3.33Å
266	S	73.3	Confident	81.7	Confident	17 Å²	17	60.7 Å²	60.7	12%	0.119	31%	0.308	C	S	.	.			trans	-68.2	113.9	174.1	54.5	0	0	0	0	111.4	F262 M263 I268	F262-S266 PolarHBondContact O-N 3.44Å; F262-S266 PolarHBondContact O-OG 3.09Å; M263-S266 WeakPolarHBondContact CA-OG 3.25Å; M263-S266 PolarHBondContact O-OG 2.67Å; S266-I268 PolarHBondContact O-N 2.82Å
267	R	64	Low	81.6	Confident	222 Å²	222	63.3 Å²	63.3	84%	0.838	32%	0.322	S	S	*	.			trans	-72.3	-10.3	175	-65.9	-177.7	177.8	-178.7	-0.4	114.3	I265	I265-R267 PolarHBondContact O-N 3.33Å
268	I	62.2	Low	81.6	Confident	74 Å²	74	60.3 Å²	60.3	38%	0.379	31%	0.308	S	S	.	.	S	Bend	trans	-95.2	142.9	180	-61.1	176.5	0	0	0	108.6	N224 A226 S266 A270	N224-I268 WeakPolarHBondContact O-CD1 3.42Å; A226-I268 HydrophobicContact CB-CD1 4.23Å; S266-I268 PolarHBondContact O-N 2.82Å; I268-A270 PolarHBondContact O-N 2.76Å
269	H	66	Low	81.7	Confident	178 Å²	178	59.4 Å²	59.4	82%	0.824	30%	0.302	S	S	*	.			trans	-67.1	115.2	177.7	-38.3	-49.4	0	0	0	109.5
270	A	65.7	Low	81.8	Confident	21 Å²	21	61.9 Å²	61.9	17%	0.174	32%	0.319	C	S	.	.			trans	-56.6	141.6	178.8	0	0	0	0	0	111.4	L233 I268 M275	L233-A270 HydrophobicContact CD1-CB 3.96Å; I268-A270 PolarHBondContact O-N 2.76Å; A270-M275 HydrophobicContact CB-CG 4.06Å; A270-M275 HydrophobicContact CB-SD 3.86Å
271	M	75.2	Confident	82	Confident	102 Å²	102	62.2 Å²	62.2	50%	0.502	32%	0.322	S	S	.	.			trans	-57.2	134.7	-170.8	-73.1	-68.9	-79.3	0	0	112.3	S273 L274 M275	M271-S273 VanDerWaalsContact C-N 3.27Å; M271-S273 PolarHBondContact O-N 3.12Å; M271-S273 VanDerWaalsContact O-N 3.11Å; M271-L274 HydrophobicContact CB-CD1 4.04Å; M271-L274 HydrophobicContact CB-CG 4.04Å; M271-L274 WeakPolarHBondContact O-CB 3.14Å; M271-L274 PolarHBondContact O-N 2.62Å; M271-M275 PolarHBondContact O-N 2.73Å; M271-M275 VanDerWaalsContact O-N 3.1Å
272	P	81.3	Confident	82.3	Confident	57 Å²	57	59.1 Å²	59.1	37%	0.37	30%	0.3	S	S	.	.	H	α-helix	trans	-39.2	-48.5	175.5	-39.5	40.6	0	0	0	115.8	M275 T276 Q309	P272-M275 PolarHBondContact O-N 2.76Å; P272-T276 WeakPolarHBondContact O-CB 3.31Å; P272-T276 PolarHBondContact O-N 2.91Å; P272-T276 PolarHBondContact O-OG1 3.04Å; P272-Q309 HydrophobicContact CB-CB 4.44Å
273	S	85.4	Confident	82.7	Confident	76 Å²	76	58.6 Å²	58.6	53%	0.531	30%	0.298	S	S	.	.	H	α-helix	trans	-62.5	-41.9	179.9	45.2	0	0	0	0	113.3	M271 T276 N277	M271-S273 VanDerWaalsContact C-N 3.27Å; M271-S273 PolarHBondContact O-N 3.12Å; M271-S273 VanDerWaalsContact O-N 3.11Å; S273-T276 WeakPolarHBondContact O-CB 3.45Å; S273-T276 PolarHBondContact O-N 3.44Å; S273-N277 PolarHBondContact O-N 2.95Å
274	L	86.7	Confident	83.1	Confident	15 Å²	15	59.8 Å²	59.8	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-68.7	-40.3	178.4	-57.5	179.6	0	0	0	111.1	T230 L233 E234 L237 M271 T276 N277 Y278	T230-L274 HydrophobicContact CG2-CD1 4.18Å; L233-L274 HydrophobicContact CB-CD1 3.95Å; L233-L274 HydrophobicContact CD1-CD1 4Å; E234-L274 HydrophobicContact CG-CD2 3.55Å; L237-L274 HydrophobicContact CD1-CB 4.24Å; L237-L274 HydrophobicContact CD1-CD2 4.11Å; M271-L274 HydrophobicContact CB-CD1 4.04Å; M271-L274 HydrophobicContact CB-CG 4.04Å; M271-L274 WeakPolarHBondContact O-CB 3.14Å; M271-L274 PolarHBondContact O-N 2.62Å; L274-T276 VanDerWaalsContact C-N 3.35Å; L274-N277 PolarHBondContact O-N 3.28Å; L274-Y278 WeakPolarHBondContact O-CB 3.22Å; L274-Y278 PolarHBondContact O-N 3.4Å
275	M	88.3	Confident	83.6	Confident	16 Å²	16	54.1 Å²	54.1	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-66.4	-37	176.5	-69.7	-49.7	-47.5	0	0	112.4	M263 A270 M271 P272 Y278 Y279 L305	M263-M275 HydrophobicContact CE-CE 3.48Å; M263-M275 VanDerWaalsContact CE-CE 3.48Å; M263-M275 HydrophobicContact CE-SD 3.44Å; M263-M275 WeakPolarHBondContact CE-SD 3.16Å; M263-M275 HydrophobicContact SD-CE 3.87Å; M263-M275 HydrophobicContact SD-SD 3.65Å; M263-M275 VanDerWaalsContact SD-SD 3.65Å; A270-M275 HydrophobicContact CB-CG 4.06Å; A270-M275 HydrophobicContact CB-SD 3.86Å; M271-M275 PolarHBondContact O-N 2.73Å; M271-M275 VanDerWaalsContact O-N 3.1Å; P272-M275 PolarHBondContact O-N 2.76Å; M275-Y278 HydrophobicContact CE-CD1 3.67Å; M275-Y278 HydrophobicContact CE-CE1 4.38Å; M275-Y278 HydrophobicContact CE-CG 4.34Å; M275-Y278 PolarHBondContact O-N 3.09Å; M275-Y279 HydrophobicContact CE-CD2 4.18Å; M275-Y279 HydrophobicContact CE-CE2 3.51Å; M275-Y279 WeakPolarHBondContact O-CD2 3.05Å; M275-Y279 PolarHBondContact O-N 3.02Å; M275-L305 HydrophobicContact CB-CD1 4.31Å; M275-L305 HydrophobicContact CB-CD2 3.58Å
276	T	89.2	Confident	84.2	Confident	26 Å²	26	49.8 Å²	49.8	16%	0.16	25%	0.253	C	S	.	.	H	α-helix	trans	-59.4	-46.9	170.4	-80.4	0	0	0	0	111.4	P272 S273 L274 S280 L302 L305 Y306	P272-T276 WeakPolarHBondContact O-CB 3.31Å; P272-T276 PolarHBondContact O-N 2.91Å; P272-T276 PolarHBondContact O-OG1 3.04Å; S273-T276 WeakPolarHBondContact O-CB 3.45Å; S273-T276 PolarHBondContact O-N 3.44Å; L274-T276 VanDerWaalsContact C-N 3.35Å; T276-S280 VanDerWaalsContact O-CB 3.28Å; T276-S280 WeakPolarHBondContact O-CB 3.41Å; T276-S280 PolarHBondContact O-N 3.45Å; T276-L302 HydrophobicContact CG2-CD1 4.17Å; T276-L302 VanDerWaalsContact O-CD1 3.29Å; T276-L302 WeakPolarHBondContact O-CD1 3.38Å; T276-L305 VanDerWaalsContact N-CD2 3.33Å; T276-L305 WeakPolarHBondContact OG1-CD2 3.31Å; T276-Y306 HydrophobicContact CG2-CD2 4.41Å; T276-Y306 HydrophobicContact CG2-CE2 3.5Å; T276-Y306 VanDerWaalsContact CG2-CE2 3.5Å; T276-Y306 WeakPolarHBondContact CG2-OH 3.46Å
277	N	90.6	Very high	85	Confident	55 Å²	55	52.8 Å²	52.8	29%	0.294	26%	0.262	S	S	.	.	H	α-helix	trans	-64	-46.6	176.8	-164.9	15.5	0	0	0	111.3	L237 S273 L274 Y279 S280 K281	L237-N277 HydrophobicContact CD1-CB 4.21Å; L237-N277 HydrophobicContact CD2-CB 4.48Å; S273-N277 PolarHBondContact O-N 2.95Å; L274-N277 PolarHBondContact O-N 3.28Å; N277-Y279 PolarHBondContact O-N 3.4Å; N277-S280 WeakPolarHBondContact O-CB 3.27Å; N277-S280 PolarHBondContact O-N 3.42Å; N277-K281 WeakPolarHBondContact O-CG 3.3Å; N277-K281 PolarHBondContact O-N 2.87Å; N277-K281 WeakPolarHBondContact OD1-CE 3.3Å; N277-K281 WeakPolarHBondContact OD1-CG 3.16Å
278	Y	93.2	Very high	86.3	Confident	3 Å²	3	46.9 Å²	46.9	1%	0.012	24%	0.24	C	C	.	.	H	α-helix	trans	-53.2	-53.4	177.2	175.5	-107.8	0	0	0	112.9	L237 V256 I259 W260 L274 M275 S280 T282 L360	L237-Y278 HydrophobicContact CD2-CD2 4.47Å; V256-Y278 HydrophobicContact CG1-CE2 3.98Å; V256-Y278 VanDerWaalsContact CG1-OH 3.29Å; V256-Y278 WeakPolarHBondContact CG1-OH 3.47Å; I259-Y278 HydrophobicContact CB-CD2 4.31Å; I259-Y278 HydrophobicContact CB-CE2 3.94Å; I259-Y278 HydrophobicContact CD1-CD2 4.04Å; I259-Y278 HydrophobicContact CD1-CE2 4.18Å; I259-Y278 HydrophobicContact CG2-CD2 3.6Å; I259-Y278 HydrophobicContact CG2-CE2 3.55Å; I259-Y278 HydrophobicContact CG2-CG 4.42Å; W260-Y278 HydrophobicContact CE3-CE1 4.37Å; L274-Y278 WeakPolarHBondContact O-CB 3.22Å; L274-Y278 PolarHBondContact O-N 3.4Å; M275-Y278 HydrophobicContact CE-CD1 3.67Å; M275-Y278 HydrophobicContact CE-CE1 4.38Å; M275-Y278 HydrophobicContact CE-CG 4.34Å; M275-Y278 PolarHBondContact O-N 3.09Å; Y278-S280 VanDerWaalsContact C-N 3.34Å; Y278-S280 PolarHBondContact O-N 3.19Å; Y278-T282 WeakPolarHBondContact O-CB 3.16Å; Y278-T282 PolarHBondContact O-N 2.92Å; Y278-T282 PolarHBondContact O-OG1 3.5Å; Y278-L360 PolarHBondContact OH-O 2.83Å
279	Y	94.1	Very high	87.4	Confident	20 Å²	20	46.1 Å²	46.1	8%	0.078	24%	0.24	C	C	.	.	H	α-helix	trans	-69.1	-32.1	-179.7	-68.7	-57.4	0	0	0	112.4	M275 N277 A283 K301 L305 L361	M275-Y279 HydrophobicContact CE-CD2 4.18Å; M275-Y279 HydrophobicContact CE-CE2 3.51Å; M275-Y279 WeakPolarHBondContact O-CD2 3.05Å; M275-Y279 PolarHBondContact O-N 3.02Å; N277-Y279 PolarHBondContact O-N 3.4Å; Y279-A283 WeakPolarHBondContact O-CB 3.12Å; Y279-A283 PolarHBondContact O-N 2.87Å; Y279-K301 HydrophobicContact CD1-CB 3.86Å; Y279-K301 HydrophobicContact CD2-CB 4.2Å; Y279-K301 HydrophobicContact CE1-CB 3.81Å; Y279-K301 HydrophobicContact CE1-CG 4.14Å; Y279-K301 HydrophobicContact CE2-CB 4.16Å; Y279-K301 HydrophobicContact CG-CB 4.07Å; Y279-L305 HydrophobicContact CD2-CD2 4.07Å; Y279-L305 HydrophobicContact CE2-CD2 4.37Å; Y279-L361 HydrophobicContact CD1-CD2 4.12Å; Y279-L361 HydrophobicContact CE1-CD2 4.23Å
280	S	93.2	Very high	88.4	Confident	53 Å²	53	39.4 Å²	39.4	37%	0.371	22%	0.219	S	C	.	.	H	α-helix	trans	-62.5	-53.2	174.4	-172.9	0	0	0	0	111.8	T276 N277 Y278 A283 E284	T276-S280 VanDerWaalsContact O-CB 3.28Å; T276-S280 WeakPolarHBondContact O-CB 3.41Å; T276-S280 PolarHBondContact O-N 3.45Å; N277-S280 WeakPolarHBondContact O-CB 3.27Å; N277-S280 PolarHBondContact O-N 3.42Å; Y278-S280 VanDerWaalsContact C-N 3.34Å; Y278-S280 PolarHBondContact O-N 3.19Å; S280-A283 WeakPolarHBondContact O-CB 3.5Å; S280-A283 PolarHBondContact O-N 2.87Å; S280-E284 PolarHBondContact O-N 3.24Å
281	K	93.3	Very high	89.4	Confident	49 Å²	49	39.3 Å²	39.3	21%	0.213	22%	0.217	C	C	.	.	H	α-helix	trans	-68.5	-37.5	179.4	-57.4	-57	-178.7	124.4	0	112.5	L240 D241 M244 N277 E284 L285	L240-K281 HydrophobicContact CD2-CB 3.76Å; L240-K281 HydrophobicContact CG-CB 4.29Å; D241-K281 WeakPolarHBondContact OD1-CD 3.38Å; D241-K281 WeakPolarHBondContact OD1-CE 3.24Å; D241-K281 WeakPolarHBondContact OD1-CG 3.37Å; D241-K281 IonicContact OD1-NZ 2.68Å; D241-K281 PolarHBondContact OD1-NZ 3.12Å; D241-K281 IonicContact OD2-NZ 2.93Å; D241-K281 PolarHBondContact OD2-NZ 2.77Å; M244-K281 HydrophobicContact SD-CB 4.37Å; N277-K281 WeakPolarHBondContact O-CG 3.3Å; N277-K281 PolarHBondContact O-N 2.87Å; N277-K281 WeakPolarHBondContact OD1-CE 3.3Å; N277-K281 WeakPolarHBondContact OD1-CG 3.16Å; K281-E284 PolarHBondContact O-N 3.46Å; K281-L285 WeakPolarHBondContact O-CB 3.42Å; K281-L285 PolarHBondContact O-N 3.02Å
282	T	93.6	Very high	90.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.6	-38	174.3	-58.8	0	0	0	0	111.8	V256 Y278 F286 L361	V256-T282 HydrophobicContact CG1-CG2 4.26Å; Y278-T282 WeakPolarHBondContact O-CB 3.16Å; Y278-T282 PolarHBondContact O-N 2.92Å; Y278-T282 PolarHBondContact O-OG1 3.5Å; T282-F286 HydrophobicContact CG2-CD2 3.88Å; T282-F286 HydrophobicContact CG2-CE2 3.39Å; T282-F286 HydrophobicContact CG2-CZ 3.9Å; T282-F286 VanDerWaalsContact O-CD2 3.28Å; T282-F286 WeakPolarHBondContact O-CD2 3.22Å; T282-F286 WeakPolarHBondContact O-CG 3.27Å; T282-F286 PolarHBondContact O-N 2.86Å; T282-L361 HydrophobicContact CG2-CD2 3.96Å
283	A	94.1	Very high	90.6	Very high	2 Å²	2	35.6 Å²	35.6	2%	0.017	20%	0.195	C	C	.	.	H	α-helix	trans	-62.8	-46.7	171.9	0	0	0	0	0	111.2	Y279 S280 F286 R287 H295 A298 L299	Y279-A283 WeakPolarHBondContact O-CB 3.12Å; Y279-A283 PolarHBondContact O-N 2.87Å; S280-A283 WeakPolarHBondContact O-CB 3.5Å; S280-A283 PolarHBondContact O-N 2.87Å; A283-F286 PolarHBondContact O-N 3.02Å; A283-R287 PolarHBondContact O-N 3.01Å; A283-H295 PolarHBondContact O-ND1 3.39Å; A283-A298 HydrophobicContact CB-CB 3.7Å; A283-L299 HydrophobicContact CB-CD2 3.96Å; A283-L299 HydrophobicContact CB-CG 4.11Å
284	E	92.8	Very high	91	Very high	54 Å²	54	32.6 Å²	32.6	25%	0.252	17%	0.172	S	C	.	.	H	α-helix	trans	-64.2	-40.8	178.1	-163.8	-158.3	159.1	0	0	112.2	M244 S280 K281 F286 R287 R288	M244-E284 HydrophobicContact CE-CB 3.8Å; M244-E284 HydrophobicContact CE-CG 4.02Å; M244-E284 VanDerWaalsContact CE-OE2 3.29Å; M244-E284 WeakPolarHBondContact CE-OE2 3.24Å; S280-E284 PolarHBondContact O-N 3.24Å; K281-E284 PolarHBondContact O-N 3.46Å; E284-F286 PolarHBondContact O-N 2.97Å; E284-R287 WeakPolarHBondContact O-CB 3.13Å; E284-R287 PolarHBondContact O-N 3.1Å; E284-R287 VanDerWaalsContact O-N 3.15Å; E284-R287 IonicContact OE1-NH2 2.63Å; E284-R288 WeakPolarHBondContact O-CG 3.36Å; E284-R288 PolarHBondContact O-N 3.4Å; E284-R288 IonicContact OE1-CZ 3.17Å; E284-R288 IonicContact OE1-NE 2.76Å; E284-R288 PolarHBondContact OE1-NE 3.39Å; E284-R288 IonicContact OE1-NH2 2.63Å; E284-R288 PolarHBondContact OE1-NH2 3.43Å
285	L	93	Very high	91.3	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-55.4	-51.6	172.8	176	61.7	0	0	0	111.2	L240 M244 Y249 A252 V256 K281 R287 R288 C289	L240-L285 HydrophobicContact CD1-CD2 4.27Å; M244-L285 HydrophobicContact CG-CD1 4.36Å; M244-L285 HydrophobicContact SD-CB 4.08Å; Y249-L285 HydrophobicContact CD1-CD1 3.74Å; Y249-L285 HydrophobicContact CE1-CD1 4.44Å; A252-L285 HydrophobicContact CB-CD1 3.79Å; A252-L285 HydrophobicContact CB-CD2 4.16Å; V256-L285 HydrophobicContact CG2-CD2 3.74Å; K281-L285 WeakPolarHBondContact O-CB 3.42Å; K281-L285 PolarHBondContact O-N 3.02Å; L285-R287 VanDerWaalsContact C-N 3.26Å; L285-R287 PolarHBondContact O-N 2.87Å; L285-R288 PolarHBondContact O-N 3.39Å; L285-C289 WeakPolarHBondContact O-CB 3.26Å; L285-C289 PolarHBondContact O-N 3.48Å; L285-C289 PolarHBondContact O-SG 3.01Å
286	F	92.4	Very high	91.6	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.018	17%	0.166	C	C	.	.	H	α-helix	trans	-64.9	-28.5	178.3	-67.5	-36.1	0	0	0	113.3	T282 A283 E284 G290 C291 H295 L357 L361	T282-F286 HydrophobicContact CG2-CD2 3.88Å; T282-F286 HydrophobicContact CG2-CE2 3.39Å; T282-F286 HydrophobicContact CG2-CZ 3.9Å; T282-F286 VanDerWaalsContact O-CD2 3.28Å; T282-F286 WeakPolarHBondContact O-CD2 3.22Å; T282-F286 WeakPolarHBondContact O-CG 3.27Å; T282-F286 PolarHBondContact O-N 2.86Å; A283-F286 PolarHBondContact O-N 3.02Å; E284-F286 PolarHBondContact O-N 2.97Å; F286-G290 PolarHBondContact O-N 3.29Å; F286-C291 HydrophobicContact CB-CB 4.26Å; F286-C291 CarbonylContact O-C 3.6Å; F286-C291 WeakPolarHBondContact O-CA 3.45Å; F286-C291 WeakPolarHBondContact O-CB 3.29Å; F286-C291 PolarHBondContact O-N 3.45Å; F286-H295 HydrophobicContact CB-CB 3.91Å; F286-L357 HydrophobicContact CE1-CD2 3.59Å; F286-L357 HydrophobicContact CZ-CD2 4Å; F286-L361 HydrophobicContact CE2-CD1 4.02Å; F286-L361 HydrophobicContact CE2-CD2 4.08Å; F286-L361 HydrophobicContact CE2-CG 4.1Å
287	R	91.5	Very high	91.9	Very high	80 Å²	80	30.3 Å²	30.3	30%	0.302	16%	0.159	S	C	.	.	H	α-helix	trans	-66.2	-50.9	171.8	-171.7	-177.7	63.4	73	0.2	111.2	A283 E284 L285 C289 G290	A283-R287 PolarHBondContact O-N 3.01Å; E284-R287 WeakPolarHBondContact O-CB 3.13Å; E284-R287 PolarHBondContact O-N 3.1Å; E284-R287 VanDerWaalsContact O-N 3.15Å; E284-R287 IonicContact OE1-NH2 2.63Å; L285-R287 VanDerWaalsContact C-N 3.26Å; L285-R287 PolarHBondContact O-N 2.87Å; R287-C289 VanDerWaalsContact C-N 3.27Å; R287-C289 PolarHBondContact O-N 2.82Å; R287-G290 PolarHBondContact O-N 3.27Å; R287-G290 VanDerWaalsContact O-N 3.16Å
288	R	90	Very high	92.1	Very high	98 Å²	98	27.7 Å²	27.7	37%	0.37	15%	0.145	S	C	.	.	H	α-helix	trans	-61.8	-34.1	177.8	-67.3	179.1	178.6	-145.2	13.7	112.1	M244 Y249 E284 L285 G290	M244-R288 PolarHBondContact O-NH1 2.75Å; Y249-R288 HydrophobicContact CE1-CB 3.76Å; Y249-R288 HydrophobicContact CE1-CG 4.38Å; Y249-R288 WeakPolarHBondContact OH-CD 3.33Å; Y249-R288 PolarHBondContact OH-NH1 3.38Å; Y249-R288 VanDerWaalsContact OH-NH1 3.1Å; E284-R288 WeakPolarHBondContact O-CG 3.36Å; E284-R288 PolarHBondContact O-N 3.4Å; E284-R288 IonicContact OE1-CZ 3.17Å; E284-R288 IonicContact OE1-NE 2.76Å; E284-R288 PolarHBondContact OE1-NE 3.39Å; E284-R288 IonicContact OE1-NH2 2.63Å; E284-R288 PolarHBondContact OE1-NH2 3.43Å; L285-R288 PolarHBondContact O-N 3.39Å; R288-G290 VanDerWaalsContact C-N 3.3Å; R288-G290 PolarHBondContact O-N 2.88Å
289	C	86.7	Confident	92.2	Very high	57 Å²	57	28.1 Å²	28.1	39%	0.385	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	15.9	176	-61.1	0	0	0	0	115.1	L285 R287 C291	L285-C289 WeakPolarHBondContact O-CB 3.26Å; L285-C289 PolarHBondContact O-N 3.48Å; L285-C289 PolarHBondContact O-SG 3.01Å; R287-C289 VanDerWaalsContact C-N 3.27Å; R287-C289 PolarHBondContact O-N 2.82Å; C289-C291 PolarHBondContact O-N 3.37Å; C289-C291 VanDerWaalsContact O-N 3.17Å; C289-C291 PolarHBondContact O-SG 3.37Å
290	G	86.1	Confident	92.2	Very high	37 Å²	37	27.9 Å²	27.9	38%	0.381	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	27.8	177.5	0	0	0	0	0	114.3	F286 R287 R288	F286-G290 PolarHBondContact O-N 3.29Å; R287-G290 PolarHBondContact O-N 3.27Å; R287-G290 VanDerWaalsContact O-N 3.16Å; R288-G290 VanDerWaalsContact C-N 3.3Å; R288-G290 PolarHBondContact O-N 2.88Å
291	C	87.4	Confident	92.1	Very high	20 Å²	20	28 Å²	28	14%	0.135	14%	0.141	C	C	.	.			trans	-110.5	53.3	-174.6	-71.7	0	0	0	0	111.2	F286 C289 L293 Y294 H295 K338	F286-C291 HydrophobicContact CB-CB 4.26Å; F286-C291 CarbonylContact O-C 3.6Å; F286-C291 WeakPolarHBondContact O-CA 3.45Å; F286-C291 WeakPolarHBondContact O-CB 3.29Å; F286-C291 PolarHBondContact O-N 3.45Å; C289-C291 PolarHBondContact O-N 3.37Å; C289-C291 VanDerWaalsContact O-N 3.17Å; C289-C291 PolarHBondContact O-SG 3.37Å; C291-L293 PolarHBondContact O-N 3.16Å; C291-Y294 HydrophobicContact CB-CD2 4.36Å; C291-Y294 PolarHBondContact O-N 3.11Å; C291-H295 PolarHBondContact O-N 3.03Å; C291-K338 PolarHBondContact SG-NZ 2.92Å; C291-K338 VanDerWaalsContact SG-NZ 3.45Å
292	H	90.5	Very high	92.1	Very high	38 Å²	38	25.9 Å²	25.9	18%	0.176	13%	0.132	C	C	.	.	H	α-helix	trans	-45.5	-40.9	-175	-56.4	-75.9	0	0	0	114.4	Y294 H295 A296	H292-Y294 PolarHBondContact O-N 2.96Å; H292-H295 WeakPolarHBondContact O-CB 3.26Å; H292-H295 PolarHBondContact O-N 2.6Å; H292-A296 WeakPolarHBondContact O-CB 3.22Å; H292-A296 PolarHBondContact O-N 3.36Å
293	L	91.1	Very high	92	Very high	43 Å²	43	26.2 Å²	26.2	23%	0.225	13%	0.133	C	C	.	.	H	α-helix	trans	-58.6	-43.3	176.1	179.1	60.6	0	0	0	113.7	C291 A297 I332 P367 L372	C291-L293 PolarHBondContact O-N 3.16Å; L293-A297 WeakPolarHBondContact O-CB 3.27Å; L293-A297 PolarHBondContact O-N 3.47Å; L293-A297 VanDerWaalsContact O-N 3.13Å; L293-I332 HydrophobicContact CD1-CD1 4.03Å; L293-P367 WeakPolarHBondContact CD2-O 3.34Å; L293-L372 HydrophobicContact CD1-CD1 4.1Å
294	Y	92.8	Very high	91.8	Very high	13 Å²	13	27.9 Å²	27.9	5%	0.051	14%	0.143	C	C	.	.	H	α-helix	trans	-81	-31.7	178.6	-66	-85.2	0	0	0	111.9	C291 H292 A297 A298 Q354 L357 A358 L361 P367	C291-Y294 HydrophobicContact CB-CD2 4.36Å; C291-Y294 PolarHBondContact O-N 3.11Å; H292-Y294 PolarHBondContact O-N 2.96Å; Y294-A297 PolarHBondContact O-N 3.34Å; Y294-A298 WeakPolarHBondContact O-CB 3.23Å; Y294-A298 PolarHBondContact O-N 2.89Å; Y294-Q354 WeakPolarHBondContact OH-CA 3.09Å; Y294-Q354 WeakPolarHBondContact OH-CB 3.46Å; Y294-Q354 PolarHBondContact OH-O 2.87Å; Y294-L357 HydrophobicContact CD1-CB 3.79Å; Y294-L357 HydrophobicContact CD2-CD1 4.42Å; Y294-L357 HydrophobicContact CE1-CB 3.4Å; Y294-L357 VanDerWaalsContact CE1-CB 3.4Å; Y294-L357 HydrophobicContact CE2-CB 4.32Å; Y294-L357 HydrophobicContact CE2-CD1 4.02Å; Y294-L357 HydrophobicContact CG-CB 4.4Å; Y294-A358 HydrophobicContact CE1-CB 4.44Å; Y294-L361 HydrophobicContact CD1-CD1 4.36Å; Y294-P367 HydrophobicContact CD1-CG 4.27Å; Y294-P367 HydrophobicContact CE1-CG 4.11Å
295	H	94.1	Very high	91.6	Very high	7 Å²	7	26.6 Å²	26.6	3%	0.032	14%	0.138	C	C	.	.	H	α-helix	trans	-58.6	-50.1	169.6	165.7	70.6	0	0	0	111.4	A283 F286 C291 H292 A297 A298 L299 Y425	A283-H295 PolarHBondContact O-ND1 3.39Å; F286-H295 HydrophobicContact CB-CB 3.91Å; C291-H295 PolarHBondContact O-N 3.03Å; H292-H295 WeakPolarHBondContact O-CB 3.26Å; H292-H295 PolarHBondContact O-N 2.6Å; H295-A297 PolarHBondContact O-N 2.83Å; H295-A298 WeakPolarHBondContact O-CB 3.21Å; H295-A298 PolarHBondContact O-N 3.15Å; H295-L299 PolarHBondContact O-N 3.24Å; H295-Y425 AromaticContact NE2-CE1 3.41Å; H295-Y425 WeakPolarHBondContact NE2-CE1 3.1Å; H295-Y425 AromaticContact NE2-CZ 3.75Å; H295-Y425 PolarHBondContact NE2-OH 2.73Å
296	A	94.6	Very high	91.3	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.4	-41.8	175.8	0	0	0	0	0	112.2	H292 A298 L299 H300 A328 T329 I332 L372	H292-A296 WeakPolarHBondContact O-CB 3.22Å; H292-A296 PolarHBondContact O-N 3.36Å; A296-A298 VanDerWaalsContact C-N 3.33Å; A296-A298 PolarHBondContact O-N 3.15Å; A296-L299 PolarHBondContact O-N 3.15Å; A296-H300 PolarHBondContact O-CD2 2.85Å; A296-H300 PolarHBondContact O-N 2.65Å; A296-A328 HydrophobicContact CB-CB 4.28Å; A296-T329 HydrophobicContact CB-CG2 3.89Å; A296-I332 HydrophobicContact CB-CD1 3.93Å; A296-I332 HydrophobicContact CB-CG1 4.29Å; A296-L372 HydrophobicContact CB-CD1 3.85Å
297	A	94.3	Very high	91	Very high	2 Å²	2	34.4 Å²	34.4	2%	0.017	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-37	174.9	0	0	0	0	0	113.1	L293 Y294 H295 H300 K301 L361 L363 P367 L372	L293-A297 WeakPolarHBondContact O-CB 3.27Å; L293-A297 PolarHBondContact O-N 3.47Å; L293-A297 VanDerWaalsContact O-N 3.13Å; Y294-A297 PolarHBondContact O-N 3.34Å; H295-A297 PolarHBondContact O-N 2.83Å; A297-H300 WeakPolarHBondContact O-CB 2.91Å; A297-H300 PolarHBondContact O-N 3.48Å; A297-K301 WeakPolarHBondContact O-CG 3.43Å; A297-K301 PolarHBondContact O-N 2.76Å; A297-K301 VanDerWaalsContact O-N 3.15Å; A297-L361 HydrophobicContact CB-CD1 3.83Å; A297-L363 HydrophobicContact CB-CD1 4.11Å; A297-P367 HydrophobicContact CB-CB 4.16Å; A297-P367 HydrophobicContact CB-CG 4.01Å; A297-L372 HydrophobicContact CB-CD1 4.34Å; A297-L372 HydrophobicContact CB-CD2 4.09Å
298	A	95.1	Very high	90.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-67.1	-39.8	173.5	0	0	0	0	0	111.9	A283 Y294 H295 A296 K301 L302 L361	A283-A298 HydrophobicContact CB-CB 3.7Å; Y294-A298 WeakPolarHBondContact O-CB 3.23Å; Y294-A298 PolarHBondContact O-N 2.89Å; H295-A298 WeakPolarHBondContact O-CB 3.21Å; H295-A298 PolarHBondContact O-N 3.15Å; A296-A298 VanDerWaalsContact C-N 3.33Å; A296-A298 PolarHBondContact O-N 3.15Å; A298-K301 WeakPolarHBondContact O-CB 3.22Å; A298-K301 PolarHBondContact O-N 3.48Å; A298-L302 WeakPolarHBondContact O-CB 3.02Å; A298-L302 PolarHBondContact O-N 3.41Å; A298-L361 HydrophobicContact CB-CD1 4.32Å; A298-L361 HydrophobicContact CB-CD2 3.76Å
299	L	95	Very high	90.1	Very high	11 Å²	11	35 Å²	35	6%	0.058	18%	0.181	C	C	.	.	H	α-helix	trans	-66	-35.9	173.1	-69.6	179.9	0	0	0	112.7	A283 H295 A296 K301 L302 Y303 V325 A328	A283-L299 HydrophobicContact CB-CD2 3.96Å; A283-L299 HydrophobicContact CB-CG 4.11Å; H295-L299 PolarHBondContact O-N 3.24Å; A296-L299 PolarHBondContact O-N 3.15Å; L299-K301 VanDerWaalsContact C-N 3.35Å; L299-K301 PolarHBondContact O-N 2.8Å; L299-L302 HydrophobicContact CD2-CD2 3.91Å; L299-L302 WeakPolarHBondContact O-CB 3.07Å; L299-L302 PolarHBondContact O-N 2.87Å; L299-Y303 WeakPolarHBondContact O-CB 3.24Å; L299-Y303 PolarHBondContact O-N 2.9Å; L299-V325 HydrophobicContact CB-CG2 3.88Å; L299-A328 HydrophobicContact CD1-CB 3.6Å
300	H	94.2	Very high	89.6	Confident	16 Å²	16	35.9 Å²	35.9	7%	0.074	18%	0.179	C	C	.	.	H	α-helix	trans	-59.2	-44.5	171.1	-93.4	-110.7	0	0	0	112	A296 A297 Y303 T304 V325 T329 L372	A296-H300 PolarHBondContact O-CD2 2.85Å; A296-H300 PolarHBondContact O-N 2.65Å; A297-H300 WeakPolarHBondContact O-CB 2.91Å; A297-H300 PolarHBondContact O-N 3.48Å; H300-Y303 PolarHBondContact O-N 2.8Å; H300-T304 WeakPolarHBondContact O-CB 3.45Å; H300-T304 PolarHBondContact O-N 2.87Å; H300-T304 PolarHBondContact O-OG1 3.34Å; H300-V325 VanDerWaalsContact CD2-CG1 3.43Å; H300-V325 WeakPolarHBondContact CD2-CG1 3.44Å; H300-T329 VanDerWaalsContact NE2-CG2 3.27Å; H300-T329 WeakPolarHBondContact NE2-CG2 3.42Å; H300-L372 HydrophobicContact CB-CD2 4.49Å; H300-L372 PolarHBondContact CE1-O 3.37Å
301	K	92.2	Very high	89	Confident	54 Å²	54	43.9 Å²	43.9	24%	0.235	20%	0.203	C	C	.	.	H	α-helix	trans	-62	-46.8	175.3	-70	-80.5	178.3	142.2	0	111.2	Y279 A297 A298 L299 T304 L305 L361 G362 L363	Y279-K301 HydrophobicContact CD1-CB 3.86Å; Y279-K301 HydrophobicContact CD2-CB 4.2Å; Y279-K301 HydrophobicContact CE1-CB 3.81Å; Y279-K301 HydrophobicContact CE1-CG 4.14Å; Y279-K301 HydrophobicContact CE2-CB 4.16Å; Y279-K301 HydrophobicContact CG-CB 4.07Å; A297-K301 WeakPolarHBondContact O-CG 3.43Å; A297-K301 PolarHBondContact O-N 2.76Å; A297-K301 VanDerWaalsContact O-N 3.15Å; A298-K301 WeakPolarHBondContact O-CB 3.22Å; A298-K301 PolarHBondContact O-N 3.48Å; L299-K301 VanDerWaalsContact C-N 3.35Å; L299-K301 PolarHBondContact O-N 2.8Å; K301-T304 PolarHBondContact O-N 3.15Å; K301-L305 VanDerWaalsContact O-CB 3.28Å; K301-L305 WeakPolarHBondContact O-CB 3.4Å; K301-L305 PolarHBondContact O-N 2.77Å; K301-L361 WeakPolarHBondContact CE-O 3.36Å; K301-L361 PolarHBondContact NZ-O 3.04Å; K301-G362 PolarHBondContact NZ-O 3.19Å; K301-L363 VanDerWaalsContact CE-CD2 3.45Å
302	L	92.4	Very high	88.5	Confident	6 Å²	6	49.7 Å²	49.7	3%	0.031	23%	0.232	C	C	.	.	H	α-helix	trans	-57.4	-48.7	175.8	-172	65.5	0	0	0	112.2	T276 A298 L299 T304 L305 Y306 L321	T276-L302 HydrophobicContact CG2-CD1 4.17Å; T276-L302 VanDerWaalsContact O-CD1 3.29Å; T276-L302 WeakPolarHBondContact O-CD1 3.38Å; A298-L302 WeakPolarHBondContact O-CB 3.02Å; A298-L302 PolarHBondContact O-N 3.41Å; L299-L302 HydrophobicContact CD2-CD2 3.91Å; L299-L302 WeakPolarHBondContact O-CB 3.07Å; L299-L302 PolarHBondContact O-N 2.87Å; L302-T304 PolarHBondContact O-N 3.34Å; L302-L305 PolarHBondContact O-N 3.26Å; L302-Y306 HydrophobicContact CD1-CD2 3.95Å; L302-Y306 HydrophobicContact CD1-CE2 3.77Å; L302-Y306 HydrophobicContact CG-CD2 4.02Å; L302-Y306 HydrophobicContact CG-CE2 4.08Å; L302-Y306 WeakPolarHBondContact O-CD2 3.44Å; L302-Y306 PolarHBondContact O-N 3.07Å; L302-L321 HydrophobicContact CD2-CD1 3.92Å; L302-L321 HydrophobicContact CG-CD1 4.27Å
303	Y	92.2	Very high	88	Confident	6 Å²	6	50 Å²	50	2%	0.024	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-43.8	178.3	178.6	-91.8	0	0	0	112.6	L299 H300 R307 L318 L321 V325 H379 V381	L299-Y303 WeakPolarHBondContact O-CB 3.24Å; L299-Y303 PolarHBondContact O-N 2.9Å; H300-Y303 PolarHBondContact O-N 2.8Å; Y303-R307 VanDerWaalsContact O-CB 3.3Å; Y303-R307 WeakPolarHBondContact O-CB 3.03Å; Y303-R307 PolarHBondContact O-N 2.93Å; Y303-L318 HydrophobicContact CD2-CD1 4.13Å; Y303-L318 HydrophobicContact CE2-CD1 3.48Å; Y303-L318 VanDerWaalsContact CE2-CD1 3.48Å; Y303-L318 HydrophobicContact CE2-CG 4.05Å; Y303-L321 HydrophobicContact CD2-CB 4.46Å; Y303-L321 HydrophobicContact CD2-CD2 4.24Å; Y303-L321 HydrophobicContact CD2-CG 4.1Å; Y303-V325 HydrophobicContact CD2-CG2 4.38Å; Y303-V325 HydrophobicContact CG-CG2 4.36Å; Y303-H379 HydrophobicContact CE1-CB 4.27Å; Y303-V381 HydrophobicContact CD1-CG2 4.38Å; Y303-V381 HydrophobicContact CE1-CG2 3.82Å
304	T	90.2	Very high	87.7	Confident	38 Å²	38	50.9 Å²	50.9	23%	0.233	24%	0.242	C	C	.	.	H	α-helix	trans	-63.2	-45.7	177.6	-53	0	0	0	0	110.5	H300 K301 L302 R307 D308 H379	H300-T304 WeakPolarHBondContact O-CB 3.45Å; H300-T304 PolarHBondContact O-N 2.87Å; H300-T304 PolarHBondContact O-OG1 3.34Å; K301-T304 PolarHBondContact O-N 3.15Å; L302-T304 PolarHBondContact O-N 3.34Å; T304-R307 PolarHBondContact O-N 2.93Å; T304-D308 WeakPolarHBondContact CG2-OD2 3.17Å; T304-D308 VanDerWaalsContact O-CB 3.31Å; T304-D308 WeakPolarHBondContact O-CB 3.45Å; T304-D308 PolarHBondContact O-N 3.44Å; T304-H379 PolarHBondContact OG1-CE1 3.04Å
305	L	88.5	Confident	87.4	Confident	26 Å²	26	59.2 Å²	59.2	14%	0.136	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-49.6	178.5	-169.6	79	0	0	0	112.1	M275 T276 Y279 K301 L302 D308 Q309	M275-L305 HydrophobicContact CB-CD1 4.31Å; M275-L305 HydrophobicContact CB-CD2 3.58Å; T276-L305 VanDerWaalsContact N-CD2 3.33Å; T276-L305 WeakPolarHBondContact OG1-CD2 3.31Å; Y279-L305 HydrophobicContact CD2-CD2 4.07Å; Y279-L305 HydrophobicContact CE2-CD2 4.37Å; K301-L305 VanDerWaalsContact O-CB 3.28Å; K301-L305 WeakPolarHBondContact O-CB 3.4Å; K301-L305 PolarHBondContact O-N 2.77Å; L302-L305 PolarHBondContact O-N 3.26Å; L305-D308 PolarHBondContact O-N 2.89Å; L305-Q309 VanDerWaalsContact CD1-CD 3.47Å; L305-Q309 VanDerWaalsContact O-CB 3.29Å; L305-Q309 WeakPolarHBondContact O-CB 3.07Å; L305-Q309 WeakPolarHBondContact O-CG 3.33Å; L305-Q309 PolarHBondContact O-N 3.31Å; L305-Q309 VanDerWaalsContact O-N 3.09Å
306	Y	86.5	Confident	87.1	Confident	75 Å²	75	65.9 Å²	65.9	29%	0.294	31%	0.305	S	S	.	.	H	α-helix	trans	-58	-50.4	177.2	-99.7	-83.5	0	0	0	112	T276 L302 D308 Q309 K310 I313 L321	T276-Y306 HydrophobicContact CG2-CD2 4.41Å; T276-Y306 HydrophobicContact CG2-CE2 3.5Å; T276-Y306 VanDerWaalsContact CG2-CE2 3.5Å; T276-Y306 WeakPolarHBondContact CG2-OH 3.46Å; L302-Y306 HydrophobicContact CD1-CD2 3.95Å; L302-Y306 HydrophobicContact CD1-CE2 3.77Å; L302-Y306 HydrophobicContact CG-CD2 4.02Å; L302-Y306 HydrophobicContact CG-CE2 4.08Å; L302-Y306 WeakPolarHBondContact O-CD2 3.44Å; L302-Y306 PolarHBondContact O-N 3.07Å; Y306-D308 VanDerWaalsContact C-N 3.32Å; Y306-D308 PolarHBondContact O-N 3.34Å; Y306-Q309 PolarHBondContact O-N 2.9Å; Y306-K310 HydrophobicContact CD1-CD 4.38Å; Y306-K310 WeakPolarHBondContact O-CB 3.01Å; Y306-K310 PolarHBondContact O-N 3.08Å; Y306-I313 HydrophobicContact CD1-CD1 4.2Å; Y306-L321 HydrophobicContact CD2-CD2 3.56Å; Y306-L321 HydrophobicContact CE2-CD2 4.23Å; Y306-L321 HydrophobicContact CG-CD2 3.76Å
307	R	84.9	Confident	86.8	Confident	96 Å²	96	69.4 Å²	69.4	36%	0.362	32%	0.321	S	S	.	.	H	α-helix	trans	-62	-39.2	-177.9	-172.4	-161.3	68.7	176	-1.8	112.2	Y303 T304 L318 H379	Y303-R307 VanDerWaalsContact O-CB 3.3Å; Y303-R307 WeakPolarHBondContact O-CB 3.03Å; Y303-R307 PolarHBondContact O-N 2.93Å; T304-R307 PolarHBondContact O-N 2.93Å; R307-L318 HydrophobicContact CB-CD1 4.31Å; R307-H379 PolarHBondContact NH1-ND1 3.37Å
308	D	84.6	Confident	86.5	Confident	100 Å²	100	70.6 Å²	70.6	54%	0.535	33%	0.327	S	S	.	.	H	α-helix	trans	-87.1	-15.4	-173	-63.7	-2.6	0	0	0	112.7	T304 L305 Y306	T304-D308 WeakPolarHBondContact CG2-OD2 3.17Å; T304-D308 VanDerWaalsContact O-CB 3.31Å; T304-D308 WeakPolarHBondContact O-CB 3.45Å; T304-D308 PolarHBondContact O-N 3.44Å; L305-D308 PolarHBondContact O-N 2.89Å; Y306-D308 VanDerWaalsContact C-N 3.32Å; Y306-D308 PolarHBondContact O-N 3.34Å
309	Q	78.5	Confident	86.4	Confident	90 Å²	90	71.4 Å²	71.4	42%	0.421	33%	0.333	S	S	.	.	H	α-helix	trans	-118	-32.9	-174.3	-60.8	-178.2	-22.5	0	0	114.8	P272 L305 Y306 K311	P272-Q309 HydrophobicContact CB-CB 4.44Å; L305-Q309 VanDerWaalsContact CD1-CD 3.47Å; L305-Q309 VanDerWaalsContact O-CB 3.29Å; L305-Q309 WeakPolarHBondContact O-CB 3.07Å; L305-Q309 WeakPolarHBondContact O-CG 3.33Å; L305-Q309 PolarHBondContact O-N 3.31Å; L305-Q309 VanDerWaalsContact O-N 3.09Å; Y306-Q309 PolarHBondContact O-N 2.9Å; Q309-K311 PolarHBondContact O-N 3Å; Q309-K311 VanDerWaalsContact O-N 3.16Å
310	K	77	Confident	86.1	Confident	76 Å²	76	75 Å²	75	33%	0.33	35%	0.352	S	S	.	.			trans	-85.8	89.4	-178.8	-168.7	-178.4	-178.5	-171.3	0	110.9	Y306 N312 I313 E317	Y306-K310 HydrophobicContact CD1-CD 4.38Å; Y306-K310 WeakPolarHBondContact O-CB 3.01Å; Y306-K310 PolarHBondContact O-N 3.08Å; K310-N312 VanDerWaalsContact CE-O 3.3Å; K310-N312 WeakPolarHBondContact CE-O 3.27Å; K310-N312 PolarHBondContact O-N 3.33Å; K310-N312 VanDerWaalsContact O-N 3.08Å; K310-I313 HydrophobicContact CB-CB 4.21Å; K310-I313 HydrophobicContact CD-CB 4.03Å; K310-I313 HydrophobicContact CD-CG1 4.25Å; K310-I313 HydrophobicContact CG-CB 4.15Å; K310-I313 PolarHBondContact O-N 3.02Å; K310-E317 IonicContact NZ-OE1 2.79Å; K310-E317 PolarHBondContact NZ-OE1 2.95Å; K310-E317 IonicContact NZ-OE2 3.47Å; K310-E317 PolarHBondContact NZ-OE2 3.48Å
311	K	72.6	Confident	86	Confident	205 Å²	205	74.6 Å²	74.6	89%	0.891	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-34.1	179.1	-65.4	-175	179.4	-178.7	0	114.5	Q309	Q309-K311 PolarHBondContact O-N 3Å; Q309-K311 VanDerWaalsContact O-N 3.16Å
312	N	77.7	Confident	86	Confident	141 Å²	141	72 Å²	72	75%	0.754	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	56.9	-179.8	-59.8	14.7	0	0	0	110.2	K310	K310-N312 VanDerWaalsContact CE-O 3.3Å; K310-N312 WeakPolarHBondContact CE-O 3.27Å; K310-N312 PolarHBondContact O-N 3.33Å; K310-N312 VanDerWaalsContact O-N 3.08Å
313	I	80	Confident	86.1	Confident	44 Å²	44	72 Å²	72	23%	0.226	34%	0.339	C	S	.	.			trans	-82.2	133.8	172.9	-168.6	158.7	0	0	0	110.1	Y306 K310 E317 L318	Y306-I313 HydrophobicContact CD1-CD1 4.2Å; K310-I313 HydrophobicContact CB-CB 4.21Å; K310-I313 HydrophobicContact CD-CB 4.03Å; K310-I313 HydrophobicContact CD-CG1 4.25Å; K310-I313 HydrophobicContact CG-CB 4.15Å; K310-I313 PolarHBondContact O-N 3.02Å; I313-E317 HydrophobicContact CG1-CB 4.12Å; I313-L318 HydrophobicContact CD1-CB 4.17Å; I313-L318 HydrophobicContact CD1-CD1 3.9Å; I313-L318 HydrophobicContact CG1-CB 4.27Å
314	T	85.2	Confident	86.1	Confident	62 Å²	62	75.6 Å²	75.6	38%	0.38	35%	0.353	S	S	.	.			trans	-78.1	156.2	175.7	77.6	0	0	0	0	110.4	E316 E317 L318	T314-E316 PolarHBondContact O-N 3.37Å; T314-E316 PolarHBondContact OG1-N 2.99Å; T314-E317 PolarHBondContact N-OE2 2.95Å; T314-E317 PolarHBondContact O-N 2.9Å; T314-E317 WeakPolarHBondContact OG1-CG 3.29Å; T314-E317 PolarHBondContact OG1-N 3.33Å; T314-L318 PolarHBondContact O-N 3.34Å
315	R	85.8	Confident	86.4	Confident	189 Å²	189	73.8 Å²	73.8	71%	0.713	34%	0.342	S	S	*	.	H	α-helix	trans	-62.4	-32.6	174.7	-175.4	174.6	179.7	166.7	1.9	111.5	S319	R315-S319 WeakPolarHBondContact O-CB 3.26Å; R315-S319 PolarHBondContact O-N 3.23Å
316	E	87	Confident	86.6	Confident	146 Å²	146	72.7 Å²	72.7	68%	0.682	34%	0.336	S	S	*	.	H	α-helix	trans	-67	-52.4	177.3	-67.3	159.4	176.5	0	0	110.9	T314 L318 S319 D320	T314-E316 PolarHBondContact O-N 3.37Å; T314-E316 PolarHBondContact OG1-N 2.99Å; E316-L318 VanDerWaalsContact C-N 3.28Å; E316-L318 PolarHBondContact O-N 2.87Å; E316-S319 CarbonylContact O-C 3.55Å; E316-S319 WeakPolarHBondContact O-CA 3.37Å; E316-S319 WeakPolarHBondContact O-CB 3.21Å; E316-S319 PolarHBondContact O-N 2.72Å; E316-D320 VanDerWaalsContact O-CG 3.29Å; E316-D320 PolarHBondContact O-N 3.03Å
317	E	88.1	Confident	87	Confident	75 Å²	75	69.2 Å²	69.2	35%	0.35	32%	0.322	S	S	.	.	H	α-helix	trans	-55.6	-41.8	176.2	-73.3	175.7	139.6	0	0	112.8	K310 I313 T314 L321	K310-E317 IonicContact NZ-OE1 2.79Å; K310-E317 PolarHBondContact NZ-OE1 2.95Å; K310-E317 IonicContact NZ-OE2 3.47Å; K310-E317 PolarHBondContact NZ-OE2 3.48Å; I313-E317 HydrophobicContact CG1-CB 4.12Å; T314-E317 PolarHBondContact N-OE2 2.95Å; T314-E317 PolarHBondContact O-N 2.9Å; T314-E317 WeakPolarHBondContact OG1-CG 3.29Å; T314-E317 PolarHBondContact OG1-N 3.33Å; E317-L321 VanDerWaalsContact O-CB 3.25Å; E317-L321 WeakPolarHBondContact O-CB 3.49Å; E317-L321 PolarHBondContact O-N 3.34Å
318	L	89.3	Confident	87.4	Confident	26 Å²	26	64.7 Å²	64.7	14%	0.136	31%	0.306	C	S	.	.	H	α-helix	trans	-73.9	-31.8	178.6	-168.1	69.2	0	0	0	112	Y303 R307 I313 T314 E316 G322 V384	Y303-L318 HydrophobicContact CD2-CD1 4.13Å; Y303-L318 HydrophobicContact CE2-CD1 3.48Å; Y303-L318 VanDerWaalsContact CE2-CD1 3.48Å; Y303-L318 HydrophobicContact CE2-CG 4.05Å; R307-L318 HydrophobicContact CB-CD1 4.31Å; I313-L318 HydrophobicContact CD1-CB 4.17Å; I313-L318 HydrophobicContact CD1-CD1 3.9Å; I313-L318 HydrophobicContact CG1-CB 4.27Å; T314-L318 PolarHBondContact O-N 3.34Å; E316-L318 VanDerWaalsContact C-N 3.28Å; E316-L318 PolarHBondContact O-N 2.87Å; L318-G322 WeakPolarHBondContact O-CA 3.38Å; L318-G322 PolarHBondContact O-N 3.43Å; L318-V384 HydrophobicContact CB-CG1 4.15Å; L318-V384 HydrophobicContact CD2-CG1 4Å; L318-V384 HydrophobicContact CD2-CG2 4.3Å; L318-V384 HydrophobicContact CG-CG1 3.95Å
319	S	91.4	Very high	87.9	Confident	17 Å²	17	60 Å²	60	12%	0.119	28%	0.281	C	S	.	.	H	α-helix	trans	-66.1	-47.4	172.2	167.7	0	0	0	0	111.2	R315 E316 G322 S323	R315-S319 WeakPolarHBondContact O-CB 3.26Å; R315-S319 PolarHBondContact O-N 3.23Å; E316-S319 CarbonylContact O-C 3.55Å; E316-S319 WeakPolarHBondContact O-CA 3.37Å; E316-S319 WeakPolarHBondContact O-CB 3.21Å; E316-S319 PolarHBondContact O-N 2.72Å; S319-G322 PolarHBondContact O-N 3.43Å; S319-S323 VanDerWaalsContact O-CB 3.29Å; S319-S323 WeakPolarHBondContact O-CB 3.36Å; S319-S323 PolarHBondContact O-N 3.32Å; S319-S323 PolarHBondContact O-OG 3.17Å
320	D	90.6	Very high	88.5	Confident	87 Å²	87	55.8 Å²	55.8	47%	0.465	26%	0.261	S	S	.	.	H	α-helix	trans	-66.7	-47.1	-179.2	-64.3	-17.6	0	0	0	110.9	E316 G322 S323 R324	E316-D320 VanDerWaalsContact O-CG 3.29Å; E316-D320 PolarHBondContact O-N 3.03Å; D320-G322 VanDerWaalsContact C-N 3.35Å; D320-G322 PolarHBondContact O-N 2.84Å; D320-S323 WeakPolarHBondContact O-CB 3.33Å; D320-S323 PolarHBondContact O-N 3.17Å; D320-S323 VanDerWaalsContact O-N 3.16Å; D320-R324 WeakPolarHBondContact O-CG 3.46Å; D320-R324 PolarHBondContact O-N 2.71Å
321	L	90.9	Very high	89.2	Confident	8 Å²	8	52.2 Å²	52.2	4%	0.042	25%	0.246	C	C	.	.	H	α-helix	trans	-63.2	-42.4	175.7	-171.5	62.6	0	0	0	111.2	L302 Y303 Y306 E317 S323 R324 V325	L302-L321 HydrophobicContact CD2-CD1 3.92Å; L302-L321 HydrophobicContact CG-CD1 4.27Å; Y303-L321 HydrophobicContact CD2-CB 4.46Å; Y303-L321 HydrophobicContact CD2-CD2 4.24Å; Y303-L321 HydrophobicContact CD2-CG 4.1Å; Y306-L321 HydrophobicContact CD2-CD2 3.56Å; Y306-L321 HydrophobicContact CE2-CD2 4.23Å; Y306-L321 HydrophobicContact CG-CD2 3.76Å; E317-L321 VanDerWaalsContact O-CB 3.25Å; E317-L321 WeakPolarHBondContact O-CB 3.49Å; E317-L321 PolarHBondContact O-N 3.34Å; L321-S323 VanDerWaalsContact C-N 3.3Å; L321-S323 PolarHBondContact O-N 3.29Å; L321-R324 PolarHBondContact O-N 3.33Å; L321-V325 WeakPolarHBondContact O-CG2 3.39Å; L321-V325 PolarHBondContact O-N 2.89Å
322	G	92.7	Very high	90	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.4	-36.4	173.1	0	0	0	0	0	113	L318 S319 D320 V325 L326 V381	L318-G322 WeakPolarHBondContact O-CA 3.38Å; L318-G322 PolarHBondContact O-N 3.43Å; S319-G322 PolarHBondContact O-N 3.43Å; D320-G322 VanDerWaalsContact C-N 3.35Å; D320-G322 PolarHBondContact O-N 2.84Å; G322-V325 PolarHBondContact O-N 3.43Å; G322-L326 WeakPolarHBondContact O-CB 3.48Å; G322-L326 PolarHBondContact O-N 2.86Å; G322-V381 WeakPolarHBondContact O-CG1 3.48Å
323	S	93.6	Very high	90.2	Very high	4 Å²	4	38.1 Å²	38.1	3%	0.028	18%	0.182	C	C	.	.	H	α-helix	trans	-69.3	-44.9	178.6	-60.9	0	0	0	0	110.8	S319 D320 L321 V325 L326 C327 P386	S319-S323 VanDerWaalsContact O-CB 3.29Å; S319-S323 WeakPolarHBondContact O-CB 3.36Å; S319-S323 PolarHBondContact O-N 3.32Å; S319-S323 PolarHBondContact O-OG 3.17Å; D320-S323 WeakPolarHBondContact O-CB 3.33Å; D320-S323 PolarHBondContact O-N 3.17Å; D320-S323 VanDerWaalsContact O-N 3.16Å; L321-S323 VanDerWaalsContact C-N 3.3Å; L321-S323 PolarHBondContact O-N 3.29Å; S323-V325 VanDerWaalsContact C-N 3.32Å; S323-V325 PolarHBondContact O-N 2.9Å; S323-L326 PolarHBondContact O-N 2.85Å; S323-C327 WeakPolarHBondContact O-CB 3.37Å; S323-C327 PolarHBondContact O-N 2.87Å; S323-C327 PolarHBondContact O-SG 2.68Å; S323-C327 VanDerWaalsContact O-SG 3.38Å; S323-P386 WeakPolarHBondContact OG-CD 3.4Å
324	R	93.7	Very high	89.8	Confident	83 Å²	83	36.5 Å²	36.5	31%	0.313	17%	0.174	S	C	.	.	H	α-helix	trans	-57.2	-44.5	171.6	-66.2	-179.6	-163.8	142.3	1.8	111.3	D320 L321 A328 D421 L422	D320-R324 WeakPolarHBondContact O-CG 3.46Å; D320-R324 PolarHBondContact O-N 2.71Å; L321-R324 PolarHBondContact O-N 3.33Å; R324-A328 WeakPolarHBondContact O-CB 3.29Å; R324-A328 PolarHBondContact O-N 2.82Å; R324-D421 IonicContact CZ-OD2 2.85Å; R324-D421 IonicContact NE-OD2 3.36Å; R324-D421 PolarHBondContact NE-OD2 3.07Å; R324-D421 IonicContact NH2-OD2 3.24Å; R324-D421 PolarHBondContact NH2-OD2 3.12Å; R324-L422 HydrophobicContact CB-CD2 4.3Å; R324-L422 HydrophobicContact CG-CD2 3.8Å
325	V	94.8	Very high	88.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.9	-44.7	178.8	177.6	0	0	0	0	111.7	L299 H300 Y303 L321 G322 S323 A328 T329 L376	L299-V325 HydrophobicContact CB-CG2 3.88Å; H300-V325 VanDerWaalsContact CD2-CG1 3.43Å; H300-V325 WeakPolarHBondContact CD2-CG1 3.44Å; Y303-V325 HydrophobicContact CD2-CG2 4.38Å; Y303-V325 HydrophobicContact CG-CG2 4.36Å; L321-V325 WeakPolarHBondContact O-CG2 3.39Å; L321-V325 PolarHBondContact O-N 2.89Å; G322-V325 PolarHBondContact O-N 3.43Å; S323-V325 VanDerWaalsContact C-N 3.32Å; S323-V325 PolarHBondContact O-N 2.9Å; V325-A328 PolarHBondContact O-N 2.85Å; V325-T329 PolarHBondContact O-N 3.1Å; V325-T329 PolarHBondContact O-OG1 3.46Å; V325-L376 HydrophobicContact CG1-CD2 3.9Å
326	L	94.3	Very high	87	Confident	3 Å²	3	29.8 Å²	29.8	2%	0.016	15%	0.151	C	C	.	.	H	α-helix	trans	-66	-47.2	179.4	-169.9	62.9	0	0	0	111.6	G322 S323 T329 V330 L376 V385 L389 Y393	G322-L326 WeakPolarHBondContact O-CB 3.48Å; G322-L326 PolarHBondContact O-N 2.86Å; S323-L326 PolarHBondContact O-N 2.85Å; L326-T329 PolarHBondContact O-N 3.3Å; L326-T329 PolarHBondContact O-OG1 3Å; L326-V330 HydrophobicContact CD1-CG2 4.33Å; L326-V330 WeakPolarHBondContact O-CB 3.26Å; L326-V330 VanDerWaalsContact O-CG2 3.26Å; L326-V330 WeakPolarHBondContact O-CG2 3.4Å; L326-V330 PolarHBondContact O-N 2.62Å; L326-L376 HydrophobicContact CD1-CD1 3.5Å; L326-L376 VanDerWaalsContact CD1-CD1 3.5Å; L326-L376 HydrophobicContact CD1-CD2 4.04Å; L326-L376 HydrophobicContact CD1-CG 4.35Å; L326-V385 HydrophobicContact CD2-CG1 3.8Å; L326-L389 HydrophobicContact CD2-CB 4.18Å; L326-L389 WeakPolarHBondContact CD2-O 3.47Å; L326-Y393 HydrophobicContact CD1-CD2 4.03Å; L326-Y393 HydrophobicContact CD1-CG 4.16Å
327	C	93.9	Very high	85.2	Confident	1 Å²	1	26 Å²	26	1%	0.007	14%	0.144	C	C	.	.	H	α-helix	trans	-60.3	-48.7	174.2	-69.2	0	0	0	0	111.2	S323 T329 V330 A331 L422 Y425	S323-C327 WeakPolarHBondContact O-CB 3.37Å; S323-C327 PolarHBondContact O-N 2.87Å; S323-C327 PolarHBondContact O-SG 2.68Å; S323-C327 VanDerWaalsContact O-SG 3.38Å; C327-T329 VanDerWaalsContact C-N 3.3Å; C327-T329 PolarHBondContact O-N 2.85Å; C327-V330 PolarHBondContact O-N 3.03Å; C327-A331 WeakPolarHBondContact O-CB 3.44Å; C327-A331 PolarHBondContact O-N 2.75Å; C327-L422 HydrophobicContact CB-CD2 4.44Å; C327-Y425 HydrophobicContact CB-CD2 3.56Å; C327-Y425 HydrophobicContact CB-CE2 4.08Å; C327-Y425 HydrophobicContact CB-CG 4.05Å
328	A	94.3	Very high	83.5	Confident	2 Å²	2	28 Å²	28	2%	0.017	15%	0.152	C	C	.	.	H	α-helix	trans	-62.5	-30.6	-178.2	0	0	0	0	0	114.6	A296 L299 R324 V325 I332 Y425	A296-A328 HydrophobicContact CB-CB 4.28Å; L299-A328 HydrophobicContact CD1-CB 3.6Å; R324-A328 WeakPolarHBondContact O-CB 3.29Å; R324-A328 PolarHBondContact O-N 2.82Å; V325-A328 PolarHBondContact O-N 2.85Å; A328-I332 WeakPolarHBondContact O-CG1 3.44Å; A328-Y425 HydrophobicContact CB-CD1 4.36Å; A328-Y425 HydrophobicContact CB-CE1 3.66Å
329	T	93.6	Very high	81.7	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-81.3	-43.9	176.9	39.9	0	0	0	0	113.1	A296 H300 V325 L326 C327 A331 I332 L372	A296-T329 HydrophobicContact CB-CG2 3.89Å; H300-T329 VanDerWaalsContact NE2-CG2 3.27Å; H300-T329 WeakPolarHBondContact NE2-CG2 3.42Å; V325-T329 PolarHBondContact O-N 3.1Å; V325-T329 PolarHBondContact O-OG1 3.46Å; L326-T329 PolarHBondContact O-N 3.3Å; L326-T329 PolarHBondContact O-OG1 3Å; C327-T329 VanDerWaalsContact C-N 3.3Å; C327-T329 PolarHBondContact O-N 2.85Å; T329-A331 VanDerWaalsContact C-N 3.3Å; T329-I332 WeakPolarHBondContact O-CB 3.34Å; T329-I332 WeakPolarHBondContact O-CG1 3.41Å; T329-I332 PolarHBondContact O-N 2.88Å; T329-L372 HydrophobicContact CG2-CB 3.78Å; T329-L372 HydrophobicContact CG2-CD1 4.28Å
330	V	91.6	Very high	79.5	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-63.8	-41	176.3	172.9	0	0	0	0	109.9	L326 C327 I332 R369 Y393 L396 L429	L326-V330 HydrophobicContact CD1-CG2 4.33Å; L326-V330 WeakPolarHBondContact O-CB 3.26Å; L326-V330 VanDerWaalsContact O-CG2 3.26Å; L326-V330 WeakPolarHBondContact O-CG2 3.4Å; L326-V330 PolarHBondContact O-N 2.62Å; C327-V330 PolarHBondContact O-N 3.03Å; V330-I332 PolarHBondContact O-N 2.92Å; V330-R369 PolarHBondContact O-NH2 3.05Å; V330-Y393 HydrophobicContact CG2-CD2 4.29Å; V330-L396 HydrophobicContact CG1-CD1 3.4Å; V330-L429 HydrophobicContact CB-CD2 4.36Å; V330-L429 HydrophobicContact CG1-CD2 3.8Å
331	A	91.9	Very high	77.5	Confident	2 Å²	2	31.6 Å²	31.6	2%	0.017	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	10.7	177	0	0	0	0	0	115.2	C327 T329 P333 Y425 Q428 L429	C327-A331 WeakPolarHBondContact O-CB 3.44Å; C327-A331 PolarHBondContact O-N 2.75Å; T329-A331 VanDerWaalsContact C-N 3.3Å; A331-P333 VanDerWaalsContact O-CD 3.25Å; A331-P333 WeakPolarHBondContact O-CD 3.32Å; A331-Y425 HydrophobicContact CB-CD1 4.4Å; A331-Q428 HydrophobicContact CB-CB 4.24Å; A331-Q428 WeakPolarHBondContact O-CB 3.03Å; A331-L429 HydrophobicContact CB-CD2 3.71Å; A331-L429 HydrophobicContact CB-CG 3.74Å
332	I	90.6	Very high	75.5	Confident	11 Å²	11	33.5 Å²	33.5	6%	0.056	19%	0.191	C	C	.	.	S	Bend	trans	-67.6	118.7	165.9	-64.8	170	0	0	0	107.1	L293 A296 A328 T329 V330 R369 L372 V432	L293-I332 HydrophobicContact CD1-CD1 4.03Å; A296-I332 HydrophobicContact CB-CD1 3.93Å; A296-I332 HydrophobicContact CB-CG1 4.29Å; A328-I332 WeakPolarHBondContact O-CG1 3.44Å; T329-I332 WeakPolarHBondContact O-CB 3.34Å; T329-I332 WeakPolarHBondContact O-CG1 3.41Å; T329-I332 PolarHBondContact O-N 2.88Å; V330-I332 PolarHBondContact O-N 2.92Å; I332-R369 HydrophobicContact CB-CG 4.05Å; I332-R369 HydrophobicContact CD1-CB 4.33Å; I332-R369 HydrophobicContact CD1-CG 4.14Å; I332-R369 HydrophobicContact CG2-CB 4.21Å; I332-R369 HydrophobicContact CG2-CG 4.14Å; I332-R369 PolarHBondContact O-NE 3.22Å; I332-R369 VanDerWaalsContact O-NE 3.15Å; I332-L372 HydrophobicContact CD1-CD1 3.82Å; I332-V432 WeakPolarHBondContact O-CG2 3.39Å
333	P	81.4	Confident	73.5	Confident	38 Å²	38	40 Å²	40	25%	0.247	22%	0.219	C	C	.	.			trans	-56.1	151.7	-176.6	-27.8	36.8	0	0	0	114	A331 Q428	A331-P333 VanDerWaalsContact O-CD 3.25Å; A331-P333 WeakPolarHBondContact O-CD 3.32Å; P333-Q428 HydrophobicContact CG-CB 4.43Å; P333-Q428 HydrophobicContact CG-CG 4.44Å
334	L	71.6	Confident	71.5	Confident	10 Å²	10	49 Å²	49	5%	0.052	26%	0.258	C	S	.	.	S	Bend	trans	-121.3	78.6	173.4	-60.5	173.4	0	0	0	105.4	V432 A435 K436 Y504 L508	L334-V432 HydrophobicContact CD1-CG1 4.15Å; L334-A435 HydrophobicContact CB-CB 3.85Å; L334-A435 WeakPolarHBondContact O-CB 3.29Å; L334-K436 HydrophobicContact CD1-CD 4.07Å; L334-K436 HydrophobicContact CD1-CG 3.89Å; L334-Y504 HydrophobicContact CD2-CE1 4.29Å; L334-L508 HydrophobicContact CD1-CD1 4.49Å; L334-L508 HydrophobicContact CD2-CD1 4.09Å
335	P	56.5	Low	69.6	Low	16 Å²	16	50.2 Å²	50.2	10%	0.104	27%	0.27	C	S	.	.	S	Bend		-112.3	170.2	74.1	-8.3	28.8	0	0	0	115.7	A337 L472 N475 E477	P335-A337 PolarHBondContact O-N 3.08Å; P335-L472 HydrophobicContact CG-CD2 4.14Å; P335-N475 HydrophobicContact CB-CB 4.11Å; P335-E477 WeakPolarHBondContact CA-OE1 3.35Å; P335-E477 WeakPolarHBondContact CA-OE2 3.31Å; P335-E477 WeakPolarHBondContact CB-OE1 3.03Å; P335-E477 WeakPolarHBondContact CB-OE2 3.13Å
336	N	55.8	Low	67.6	Low	95 Å²	95	54.1 Å²	54.1	51%	0.508	30%	0.298	S	S	.	.			trans	-71.5	65	163.5	-79	-61.3	0	0	0	111.2	K338 E477	N336-K338 PolarHBondContact O-N 3.03Å; N336-E477 PolarHBondContact N-OE1 2.98Å
337	A	48.1	Very low	66.2	Low	66 Å²	66	55.8 Å²	55.8	55%	0.545	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	42.5	-161.4	0	0	0	0	0	116.7	P335	P335-A337 PolarHBondContact O-N 3.08Å
338	K	53.1	Low	65.1	Low	116 Å²	116	62 Å²	62	50%	0.504	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.1	6.6	174.1	-61.8	-167.7	179.4	-174	0	114.6	C291 N336	C291-K338 PolarHBondContact SG-NZ 2.92Å; C291-K338 VanDerWaalsContact SG-NZ 3.45Å; N336-K338 PolarHBondContact O-N 3.03Å
339	L	50.4	Low	64.1	Low	104 Å²	104	68.9 Å²	68.9	55%	0.545	37%	0.371	S	S	.	.	S	Bend	trans	-79.3	-21.6	179.1	-88.5	165.9	0	0	0	115
340	N	46.6	Very low	63	Low	21 Å²	21	70 Å²	70	11%	0.112	38%	0.378	C	S	.	.	S	Bend	trans	-101.8	-41.9	-167.2	-82.8	-42.2	0	0	0	115.3	D342 K343 H474 N475	N340-D342 PolarHBondContact O-N 3.21Å; N340-K343 WeakPolarHBondContact O-CB 3.47Å; N340-K343 PolarHBondContact O-N 3.02Å; N340-K343 WeakPolarHBondContact OD1-CD 3.47Å; N340-K343 WeakPolarHBondContact OD1-CE 3.31Å; N340-K343 PolarHBondContact OD1-NZ 3.41Å; N340-H474 WeakPolarHBondContact CB-NE2 3.31Å; N340-H474 PolarHBondContact ND2-CD2 3.46Å; N340-H474 VanDerWaalsContact ND2-CD2 3.27Å; N340-H474 PolarHBondContact ND2-NE2 2.65Å; N340-H474 PolarHBondContact ND2-O 2.93Å; N340-N475 PolarHBondContact ND2-OD1 2.91Å
341	A	47.6	Very low	62.3	Low	81 Å²	81	74 Å²	74	67%	0.669	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-60.5	-37	176.8	0	0	0	0	0	111.9	K343	A341-K343 VanDerWaalsContact C-N 3.27Å; A341-K343 PolarHBondContact O-N 3.32Å
342	D	49.2	Very low	61.7	Low	49 Å²	49	79.7 Å²	79.7	26%	0.262	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-79.9	3.8	177.8	-66.1	-51.3	0	0	0	113.8	N340 F344 L345 T350	N340-D342 PolarHBondContact O-N 3.21Å; D342-F344 PolarHBondContact O-N 2.7Å; D342-F344 VanDerWaalsContact O-N 3.17Å; D342-L345 CarbonylContact O-C 3.59Å; D342-L345 PolarHBondContact O-N 2.79Å; D342-T350 HydrophobicContact CB-CG2 3.46Å; D342-T350 VanDerWaalsContact CB-CG2 3.46Å; D342-T350 VanDerWaalsContact OD2-CG2 3.22Å; D342-T350 WeakPolarHBondContact OD2-CG2 3.24Å
343	K	51.5	Low	61.3	Low	136 Å²	136	85 Å²	85	59%	0.591	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-63.6	-18.8	171.1	-79.4	177	175.8	168.8	0	113.1	N340 A341	N340-K343 WeakPolarHBondContact O-CB 3.47Å; N340-K343 PolarHBondContact O-N 3.02Å; N340-K343 WeakPolarHBondContact OD1-CD 3.47Å; N340-K343 WeakPolarHBondContact OD1-CE 3.31Å; N340-K343 PolarHBondContact OD1-NZ 3.41Å; A341-K343 VanDerWaalsContact C-N 3.27Å; A341-K343 PolarHBondContact O-N 3.32Å
344	F	50.4	Low	61.4	Low	193 Å²	193	86.4 Å²	86.4	85%	0.846	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-95.5	-2.6	173.2	-59	-80.1	0	0	0	113.6	D342	D342-F344 PolarHBondContact O-N 2.7Å; D342-F344 VanDerWaalsContact O-N 3.17Å
345	L	53.8	Low	62.1	Low	108 Å²	108	92.3 Å²	92.3	57%	0.565	48%	0.477	S	S	*	.	S	Bend	trans	-137.6	103.3	-173.2	-81.1	162	0	0	0	110.5	D342 G347	D342-L345 CarbonylContact O-C 3.59Å; D342-L345 PolarHBondContact O-N 2.79Å; L345-G347 PolarHBondContact O-N 3.23Å
346	S	54.3	Low	63.5	Low	83 Å²	83	94.7 Å²	94.7	58%	0.58	49%	0.492	S	S	*	.			trans	-27.1	115	-170.8	-175.2	0	0	0	0	115.1	E348 Y349	S346-E348 PolarHBondContact O-N 3.39Å; S346-Y349 WeakPolarHBondContact O-CB 3.39Å; S346-Y349 PolarHBondContact O-N 3.35Å
347	G	64.3	Low	65	Low	37 Å²	37	91 Å²	91	38%	0.381	47%	0.472	S	S	.	.	H	α-helix	trans	-57.3	-16.1	-173.6	0	0	0	0	0	115.5	L345 Y349 T350 I351	L345-G347 PolarHBondContact O-N 3.23Å; G347-Y349 VanDerWaalsContact C-N 3.27Å; G347-Y349 PolarHBondContact O-N 3.04Å; G347-T350 PolarHBondContact O-N 3.4Å; G347-T350 PolarHBondContact O-OG1 3.46Å; G347-I351 WeakPolarHBondContact O-CG1 3.27Å; G347-I351 PolarHBondContact O-N 2.92Å
348	E	70.3	Confident	67	Low	133 Å²	133	88 Å²	88	62%	0.621	45%	0.447	S	S	*	.	H	α-helix	trans	-57.8	-40.4	169.8	-60.4	-172.8	138.5	0	0	112.1	S346 T350 I351 M352	S346-E348 PolarHBondContact O-N 3.39Å; E348-T350 VanDerWaalsContact C-N 3.33Å; E348-T350 PolarHBondContact O-N 2.99Å; E348-I351 PolarHBondContact O-N 3.06Å; E348-M352 WeakPolarHBondContact O-CG 3.22Å; E348-M352 PolarHBondContact O-N 3.32Å
349	Y	72.7	Confident	68.8	Low	146 Å²	146	83.7 Å²	83.7	57%	0.573	44%	0.435	S	S	*	.	H	α-helix	trans	-63.8	-38.4	179.9	177.3	-115	0	0	0	111.9	S346 G347 M352 K353	S346-Y349 WeakPolarHBondContact O-CB 3.39Å; S346-Y349 PolarHBondContact O-N 3.35Å; G347-Y349 VanDerWaalsContact C-N 3.27Å; G347-Y349 PolarHBondContact O-N 3.04Å; Y349-M352 PolarHBondContact O-N 3.32Å; Y349-K353 WeakPolarHBondContact O-CB 3.44Å; Y349-K353 PolarHBondContact O-N 3.44Å
350	T	70.4	Confident	70.6	Confident	23 Å²	23	79.1 Å²	79.1	14%	0.141	41%	0.412	C	S	.	.	H	α-helix	trans	-69.2	-42.4	179.8	82.2	0	0	0	0	110.7	D342 G347 E348 K353 Q354	D342-T350 HydrophobicContact CB-CG2 3.46Å; D342-T350 VanDerWaalsContact CB-CG2 3.46Å; D342-T350 VanDerWaalsContact OD2-CG2 3.22Å; D342-T350 WeakPolarHBondContact OD2-CG2 3.24Å; G347-T350 PolarHBondContact O-N 3.4Å; G347-T350 PolarHBondContact O-OG1 3.46Å; E348-T350 VanDerWaalsContact C-N 3.33Å; E348-T350 PolarHBondContact O-N 2.99Å; T350-K353 PolarHBondContact O-N 3.35Å; T350-Q354 WeakPolarHBondContact O-CB 3.3Å; T350-Q354 VanDerWaalsContact O-CG 3.27Å; T350-Q354 WeakPolarHBondContact O-CG 3.42Å; T350-Q354 PolarHBondContact O-N 3.36Å
351	I	77.5	Confident	72.6	Confident	87 Å²	87	78.1 Å²	78.1	45%	0.446	41%	0.406	S	S	.	.	H	α-helix	trans	-64.5	-41.2	176.1	-65.2	167.1	0	0	0	110.7	G347 E348 K355	G347-I351 WeakPolarHBondContact O-CG1 3.27Å; G347-I351 PolarHBondContact O-N 2.92Å; E348-I351 PolarHBondContact O-N 3.06Å; I351-K355 HydrophobicContact CG2-CD 4.23Å; I351-K355 WeakPolarHBondContact O-CG 3.36Å; I351-K355 PolarHBondContact O-N 3.46Å
352	M	80.4	Confident	74.5	Confident	120 Å²	120	75.7 Å²	75.7	59%	0.591	39%	0.389	S	S	*	.	H	α-helix	trans	-61.9	-48.8	173.3	-71.4	-174.7	-164.4	0	0	111.3	E348 Y349 Q354 K355 T356	E348-M352 WeakPolarHBondContact O-CG 3.22Å; E348-M352 PolarHBondContact O-N 3.32Å; Y349-M352 PolarHBondContact O-N 3.32Å; M352-Q354 VanDerWaalsContact C-N 3.33Å; M352-Q354 PolarHBondContact O-N 3.09Å; M352-K355 WeakPolarHBondContact O-CB 3.49Å; M352-K355 PolarHBondContact O-N 3.27Å; M352-K355 VanDerWaalsContact O-N 3.13Å; M352-T356 PolarHBondContact O-N 3.07Å; M352-T356 PolarHBondContact O-OG1 2.99Å
353	K	81.9	Confident	76.4	Confident	122 Å²	122	75.6 Å²	75.6	53%	0.53	39%	0.388	S	S	.	.	H	α-helix	trans	-58.8	-41.6	177.9	-174.5	175.2	-179.1	177.6	0	112.5	Y349 T350 T356 L357	Y349-K353 WeakPolarHBondContact O-CB 3.44Å; Y349-K353 PolarHBondContact O-N 3.44Å; T350-K353 PolarHBondContact O-N 3.35Å; K353-T356 PolarHBondContact O-N 3.11Å; K353-L357 HydrophobicContact CG-CD1 4.31Å; K353-L357 VanDerWaalsContact O-CG 3.31Å; K353-L357 WeakPolarHBondContact O-CG 3.38Å; K353-L357 PolarHBondContact O-N 3.41Å
354	Q	82.9	Confident	78.2	Confident	68 Å²	68	77.7 Å²	77.7	32%	0.318	40%	0.404	S	S	.	.	H	α-helix	trans	-64.4	-41.5	174.7	-71.8	176.9	25	0	0	112.3	Y294 T350 M352 L357 A358 V366	Y294-Q354 WeakPolarHBondContact OH-CA 3.09Å; Y294-Q354 WeakPolarHBondContact OH-CB 3.46Å; Y294-Q354 PolarHBondContact OH-O 2.87Å; T350-Q354 WeakPolarHBondContact O-CB 3.3Å; T350-Q354 VanDerWaalsContact O-CG 3.27Å; T350-Q354 WeakPolarHBondContact O-CG 3.42Å; T350-Q354 PolarHBondContact O-N 3.36Å; M352-Q354 VanDerWaalsContact C-N 3.33Å; M352-Q354 PolarHBondContact O-N 3.09Å; Q354-L357 PolarHBondContact O-N 2.95Å; Q354-A358 WeakPolarHBondContact O-CB 3.25Å; Q354-A358 PolarHBondContact O-N 3.37Å; Q354-V366 HydrophobicContact CB-CG1 4.22Å; Q354-V366 HydrophobicContact CB-CG2 4.02Å
355	K	86.4	Confident	79.9	Confident	135 Å²	135	76.3 Å²	76.3	59%	0.587	40%	0.4	S	S	*	.	H	α-helix	trans	-63.3	-41.3	174.7	-74.5	172.2	179.1	176.9	0	112.1	I351 M352 A358 G359 V366	I351-K355 HydrophobicContact CG2-CD 4.23Å; I351-K355 WeakPolarHBondContact O-CG 3.36Å; I351-K355 PolarHBondContact O-N 3.46Å; M352-K355 WeakPolarHBondContact O-CB 3.49Å; M352-K355 PolarHBondContact O-N 3.27Å; M352-K355 VanDerWaalsContact O-N 3.13Å; K355-A358 PolarHBondContact O-N 2.88Å; K355-G359 PolarHBondContact O-N 3.13Å; K355-V366 HydrophobicContact CG-CG2 4.16Å
356	T	86.1	Confident	81.5	Confident	66 Å²	66	73.3 Å²	73.3	41%	0.405	39%	0.386	S	S	.	.	H	α-helix	trans	-61.1	-48.2	173.6	-54.4	0	0	0	0	111.2	M352 K353 A358 G359 L360	M352-T356 PolarHBondContact O-N 3.07Å; M352-T356 PolarHBondContact O-OG1 2.99Å; K353-T356 PolarHBondContact O-N 3.11Å; T356-A358 VanDerWaalsContact C-N 3.32Å; T356-A358 PolarHBondContact O-N 3.42Å; T356-G359 WeakPolarHBondContact O-CA 3.48Å; T356-G359 PolarHBondContact O-N 3.05Å; T356-G359 VanDerWaalsContact O-N 3.1Å; T356-L360 WeakPolarHBondContact O-CG 3.45Å; T356-L360 PolarHBondContact O-N 2.89Å
357	L	87.8	Confident	83.1	Confident	18 Å²	18	69.8 Å²	69.8	9%	0.094	36%	0.361	C	S	.	.	H	α-helix	trans	-59.7	-38.6	177.9	-73.5	165.2	0	0	0	113.1	F253 F286 Y294 K353 Q354	F253-L357 HydrophobicContact CE2-CD2 3.61Å; F253-L357 HydrophobicContact CZ-CD2 4.25Å; F286-L357 HydrophobicContact CE1-CD2 3.59Å; F286-L357 HydrophobicContact CZ-CD2 4Å; Y294-L357 HydrophobicContact CD1-CB 3.79Å; Y294-L357 HydrophobicContact CD2-CD1 4.42Å; Y294-L357 HydrophobicContact CE1-CB 3.4Å; Y294-L357 VanDerWaalsContact CE1-CB 3.4Å; Y294-L357 HydrophobicContact CE2-CB 4.32Å; Y294-L357 HydrophobicContact CE2-CD1 4.02Å; Y294-L357 HydrophobicContact CG-CB 4.4Å; K353-L357 HydrophobicContact CG-CD1 4.31Å; K353-L357 VanDerWaalsContact O-CG 3.31Å; K353-L357 WeakPolarHBondContact O-CG 3.38Å; K353-L357 PolarHBondContact O-N 3.41Å; Q354-L357 PolarHBondContact O-N 2.95Å
358	A	89.7	Confident	84.1	Confident	2 Å²	2	71.5 Å²	71.5	2%	0.017	36%	0.364	C	S	.	.	H	α-helix	trans	-68	-41.8	173.5	0	0	0	0	0	111.8	Y294 Q354 K355 T356 L360 L361 G362 L363 V366	Y294-A358 HydrophobicContact CE1-CB 4.44Å; Q354-A358 WeakPolarHBondContact O-CB 3.25Å; Q354-A358 PolarHBondContact O-N 3.37Å; K355-A358 PolarHBondContact O-N 2.88Å; T356-A358 VanDerWaalsContact C-N 3.32Å; T356-A358 PolarHBondContact O-N 3.42Å; A358-L360 VanDerWaalsContact C-N 3.33Å; A358-L360 PolarHBondContact O-N 2.82Å; A358-L361 PolarHBondContact O-N 3.01Å; A358-G362 PolarHBondContact O-N 3.38Å; A358-L363 CarbonylContact C-O 3.56Å; A358-L363 HydrophobicContact CB-CB 4.16Å; A358-L363 WeakPolarHBondContact O-CB 3.49Å; A358-L363 PolarHBondContact O-N 2.94Å; A358-V366 HydrophobicContact CB-CG2 4.36Å
359	G	89.6	Confident	85	Confident	26 Å²	26	66.2 Å²	66.2	27%	0.268	34%	0.339	S	S	.	.	H	α-helix	trans	-55.6	-43.5	176.6	0	0	0	0	0	113.1	W260 K355 T356 L361 G362	W260-G359 VanDerWaalsContact CZ2-O 3.31Å; W260-G359 WeakPolarHBondContact CZ2-O 3.48Å; W260-G359 PolarHBondContact NE1-O 2.67Å; K355-G359 PolarHBondContact O-N 3.13Å; T356-G359 WeakPolarHBondContact O-CA 3.48Å; T356-G359 PolarHBondContact O-N 3.05Å; T356-G359 VanDerWaalsContact O-N 3.1Å; G359-L361 PolarHBondContact O-N 3.35Å; G359-G362 WeakPolarHBondContact O-CA 3.39Å; G359-G362 PolarHBondContact O-N 2.83Å
360	L	89	Confident	85.5	Confident	8 Å²	8	61.3 Å²	61.3	4%	0.042	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.2	177.5	-63.9	174.4	0	0	0	114.1	F253 V256 E257 W260 Y278 T356 A358	F253-L360 HydrophobicContact CE2-CD1 3.62Å; F253-L360 HydrophobicContact CZ-CD1 3.77Å; V256-L360 HydrophobicContact CG1-CB 4.17Å; V256-L360 HydrophobicContact CG1-CD1 4.05Å; V256-L360 HydrophobicContact CG1-CD2 4.42Å; V256-L360 HydrophobicContact CG1-CG 4.43Å; E257-L360 HydrophobicContact CB-CD2 4.39Å; E257-L360 HydrophobicContact CG-CD1 3.99Å; E257-L360 HydrophobicContact CG-CD2 4.03Å; W260-L360 HydrophobicContact CB-CD2 3.63Å; W260-L360 HydrophobicContact CG-CD2 3.93Å; Y278-L360 PolarHBondContact OH-O 2.83Å; T356-L360 WeakPolarHBondContact O-CG 3.45Å; T356-L360 PolarHBondContact O-N 2.89Å; A358-L360 VanDerWaalsContact C-N 3.33Å; A358-L360 PolarHBondContact O-N 2.82Å
361	L	89.8	Confident	86.4	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	5.9	172.5	-67.3	178	0	0	0	112.9	Y279 T282 F286 Y294 A297 A298 K301 A358 G359 L363	Y279-L361 HydrophobicContact CD1-CD2 4.12Å; Y279-L361 HydrophobicContact CE1-CD2 4.23Å; T282-L361 HydrophobicContact CG2-CD2 3.96Å; F286-L361 HydrophobicContact CE2-CD1 4.02Å; F286-L361 HydrophobicContact CE2-CD2 4.08Å; F286-L361 HydrophobicContact CE2-CG 4.1Å; Y294-L361 HydrophobicContact CD1-CD1 4.36Å; A297-L361 HydrophobicContact CB-CD1 3.83Å; A298-L361 HydrophobicContact CB-CD1 4.32Å; A298-L361 HydrophobicContact CB-CD2 3.76Å; K301-L361 WeakPolarHBondContact CE-O 3.36Å; K301-L361 PolarHBondContact NZ-O 3.04Å; A358-L361 PolarHBondContact O-N 3.01Å; G359-L361 PolarHBondContact O-N 3.35Å; L361-L363 VanDerWaalsContact C-N 3.35Å; L361-L363 HydrophobicContact CB-CD1 4.02Å; L361-L363 HydrophobicContact CB-CG 4.08Å; L361-L363 HydrophobicContact CD1-CD1 4.33Å
362	G	86.6	Confident	87.1	Confident	29 Å²	29	57.9 Å²	57.9	30%	0.299	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	43.4	-170	0	0	0	0	0	112.1	K301 A358 G359	K301-G362 PolarHBondContact NZ-O 3.19Å; A358-G362 PolarHBondContact O-N 3.38Å; G359-G362 WeakPolarHBondContact O-CA 3.39Å; G359-G362 PolarHBondContact O-N 2.83Å
363	L	89.3	Confident	87.6	Confident	47 Å²	47	52.5 Å²	52.5	25%	0.246	28%	0.279	C	S	.	.			trans	-112.8	120.8	174.1	-62	172.3	0	0	0	109.3	A297 K301 A358 L361 Q365 P367	A297-L363 HydrophobicContact CB-CD1 4.11Å; K301-L363 VanDerWaalsContact CE-CD2 3.45Å; A358-L363 CarbonylContact C-O 3.56Å; A358-L363 HydrophobicContact CB-CB 4.16Å; A358-L363 WeakPolarHBondContact O-CB 3.49Å; A358-L363 PolarHBondContact O-N 2.94Å; L361-L363 VanDerWaalsContact C-N 3.35Å; L361-L363 HydrophobicContact CB-CD1 4.02Å; L361-L363 HydrophobicContact CB-CG 4.08Å; L361-L363 HydrophobicContact CD1-CD1 4.33Å; L363-Q365 VanDerWaalsContact C-N 3.31Å; L363-Q365 WeakPolarHBondContact CB-O 3.38Å; L363-P367 HydrophobicContact CD1-CB 4.18Å; L363-P367 HydrophobicContact CD1-CG 3.97Å
364	I	88.2	Confident	88	Confident	181 Å²	181	53.4 Å²	53.4	93%	0.928	28%	0.279	S	S	*	.	S	Bend	trans	-72.9	-29.1	179.3	-58.6	173.2	0	0	0	111
365	Q	86.9	Confident	88.4	Confident	163 Å²	163	52 Å²	52	76%	0.762	27%	0.273	S	S	*	.	S	Bend	trans	-112	146.9	176.7	-65.4	-179.2	-9.7	0	0	109.5	L363	L363-Q365 VanDerWaalsContact C-N 3.31Å; L363-Q365 WeakPolarHBondContact CB-O 3.38Å
366	V	87.1	Confident	88.6	Confident	45 Å²	45	45.6 Å²	45.6	27%	0.273	25%	0.246	S	C	.	.			trans	-63	124.5	172.5	178	0	0	0	0	108.4	Q354 K355 A358	Q354-V366 HydrophobicContact CB-CG1 4.22Å; Q354-V366 HydrophobicContact CB-CG2 4.02Å; K355-V366 HydrophobicContact CG-CG2 4.16Å; A358-V366 HydrophobicContact CB-CG2 4.36Å
367	P	88.2	Confident	88.8	Confident	10 Å²	10	45.7 Å²	45.7	7%	0.065	25%	0.246	C	C	.	.			trans	-65.6	143.3	179.5	27.2	-33.8	0	0	0	110.3	L293 Y294 A297 L363 L372	L293-P367 WeakPolarHBondContact CD2-O 3.34Å; Y294-P367 HydrophobicContact CD1-CG 4.27Å; Y294-P367 HydrophobicContact CE1-CG 4.11Å; A297-P367 HydrophobicContact CB-CB 4.16Å; A297-P367 HydrophobicContact CB-CG 4.01Å; L363-P367 HydrophobicContact CD1-CB 4.18Å; L363-P367 HydrophobicContact CD1-CG 3.97Å; P367-L372 HydrophobicContact CB-CD2 4.47Å
368	T	86.5	Confident	89	Confident	73 Å²	73	54 Å²	54	45%	0.448	28%	0.276	S	S	.	.			trans	-116.6	155.9	169.7	65.1	0	0	0	0	109.6	Q370 S371 L372	T368-Q370 PolarHBondContact O-N 3.46Å; T368-S371 PolarHBondContact O-N 3.36Å; T368-S371 PolarHBondContact OG1-N 2.77Å; T368-S371 VanDerWaalsContact OG1-N 3.12Å; T368-L372 PolarHBondContact O-N 2.77Å; T368-L372 VanDerWaalsContact O-N 3.09Å
369	R	87.2	Confident	88.9	Confident	22 Å²	22	55.4 Å²	55.4	8%	0.083	28%	0.282	C	S	.	.	H	α-helix	trans	-49	-43.6	174.5	-172.1	177.8	-172.2	-81	-3.5	111.1	V330 I332 L372 I373 E397	V330-R369 PolarHBondContact O-NH2 3.05Å; I332-R369 HydrophobicContact CB-CG 4.05Å; I332-R369 HydrophobicContact CD1-CB 4.33Å; I332-R369 HydrophobicContact CD1-CG 4.14Å; I332-R369 HydrophobicContact CG2-CB 4.21Å; I332-R369 HydrophobicContact CG2-CG 4.14Å; I332-R369 PolarHBondContact O-NE 3.22Å; I332-R369 VanDerWaalsContact O-NE 3.15Å; R369-L372 PolarHBondContact O-N 3.44Å; R369-I373 HydrophobicContact CG-CD1 4.08Å; R369-I373 WeakPolarHBondContact O-CG1 3.2Å; R369-I373 PolarHBondContact O-N 3.13Å; R369-E397 IonicContact CZ-OE1 2.7Å; R369-E397 VanDerWaalsContact CZ-OE1 3.23Å; R369-E397 IonicContact NH1-OE1 2.8Å; R369-E397 PolarHBondContact NH1-OE1 3.42Å; R369-E397 IonicContact NH1-OE2 3.68Å; R369-E397 PolarHBondContact NH1-OE2 2.93Å; R369-E397 VanDerWaalsContact NH1-OE2 3.07Å; R369-E397 IonicContact NH2-OE1 2.95Å; R369-E397 PolarHBondContact NH2-OE1 3.3Å
370	Q	83.8	Confident	88.9	Confident	42 Å²	42	60.8 Å²	60.8	20%	0.196	30%	0.298	C	S	.	.	H	α-helix	trans	-71.3	-27	178.6	-165.1	58.7	16.9	0	0	114.4	T368 R374 Q507	T368-Q370 PolarHBondContact O-N 3.46Å; Q370-R374 VanDerWaalsContact O-CG 3.3Å; Q370-R374 WeakPolarHBondContact O-CG 3.16Å; Q370-R374 PolarHBondContact O-N 2.99Å; Q370-R374 PolarHBondContact O-NE 2.81Å; Q370-Q507 HydrophobicContact CG-CB 3.84Å; Q370-Q507 HydrophobicContact CG-CG 4.34Å
371	S	89.5	Confident	89	Confident	31 Å²	31	60.4 Å²	60.4	22%	0.217	30%	0.296	C	S	.	.	H	α-helix	trans	-68.6	-46.9	170.2	-153.9	0	0	0	0	111.2	T368 I373 R374 D375	T368-S371 PolarHBondContact O-N 3.36Å; T368-S371 PolarHBondContact OG1-N 2.77Å; T368-S371 VanDerWaalsContact OG1-N 3.12Å; S371-I373 VanDerWaalsContact C-N 3.33Å; S371-I373 PolarHBondContact O-N 3.23Å; S371-R374 PolarHBondContact O-N 2.92Å; S371-R374 VanDerWaalsContact O-N 3.14Å; S371-R374 PolarHBondContact OG-NH2 2.63Å; S371-D375 PolarHBondContact O-N 2.93Å
372	L	91.6	Very high	88.8	Confident	8 Å²	8	63.6 Å²	63.6	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-63	-39.1	179.4	-60	175.7	0	0	0	111.7	L293 A296 A297 H300 T329 I332 P367 T368 R369 R374 D375 L376	L293-L372 HydrophobicContact CD1-CD1 4.1Å; A296-L372 HydrophobicContact CB-CD1 3.85Å; A297-L372 HydrophobicContact CB-CD1 4.34Å; A297-L372 HydrophobicContact CB-CD2 4.09Å; H300-L372 HydrophobicContact CB-CD2 4.49Å; H300-L372 PolarHBondContact CE1-O 3.37Å; T329-L372 HydrophobicContact CG2-CB 3.78Å; T329-L372 HydrophobicContact CG2-CD1 4.28Å; I332-L372 HydrophobicContact CD1-CD1 3.82Å; P367-L372 HydrophobicContact CB-CD2 4.47Å; T368-L372 PolarHBondContact O-N 2.77Å; T368-L372 VanDerWaalsContact O-N 3.09Å; R369-L372 PolarHBondContact O-N 3.44Å; L372-R374 PolarHBondContact O-N 3.43Å; L372-D375 CarbonylContact O-C 3.55Å; L372-D375 PolarHBondContact O-N 2.78Å; L372-D375 VanDerWaalsContact O-N 3.13Å; L372-L376 PolarHBondContact O-N 2.8Å
373	I	90.9	Very high	89	Confident	7 Å²	7	66.2 Å²	66.2	4%	0.036	32%	0.321	C	S	.	.	H	α-helix	trans	-59.2	-44.9	172.5	-75	166.6	0	0	0	112.1	R369 S371 D375 L376 V377 Y393 E397	R369-I373 HydrophobicContact CG-CD1 4.08Å; R369-I373 WeakPolarHBondContact O-CG1 3.2Å; R369-I373 PolarHBondContact O-N 3.13Å; S371-I373 VanDerWaalsContact C-N 3.33Å; S371-I373 PolarHBondContact O-N 3.23Å; I373-D375 VanDerWaalsContact C-N 3.29Å; I373-D375 PolarHBondContact O-N 3.29Å; I373-L376 WeakPolarHBondContact O-CB 3.23Å; I373-L376 PolarHBondContact O-N 3Å; I373-V377 PolarHBondContact O-N 3.49Å; I373-Y393 HydrophobicContact CG2-CE2 4.14Å; I373-E397 HydrophobicContact CD1-CG 4.12Å
374	R	90.3	Very high	88.9	Confident	141 Å²	141	65.2 Å²	65.2	53%	0.532	32%	0.317	S	S	.	.	H	α-helix	trans	-64.2	-35.4	174.9	-68.4	175.8	-55.7	166.9	10.9	111.8	Q370 S371 L372 V377 R378	Q370-R374 VanDerWaalsContact O-CG 3.3Å; Q370-R374 WeakPolarHBondContact O-CG 3.16Å; Q370-R374 PolarHBondContact O-N 2.99Å; Q370-R374 PolarHBondContact O-NE 2.81Å; S371-R374 PolarHBondContact O-N 2.92Å; S371-R374 VanDerWaalsContact O-N 3.14Å; S371-R374 PolarHBondContact OG-NH2 2.63Å; L372-R374 PolarHBondContact O-N 3.43Å; R374-V377 PolarHBondContact O-N 2.75Å; R374-R378 WeakPolarHBondContact O-CB 3.13Å; R374-R378 PolarHBondContact O-N 3Å
375	D	91.1	Very high	89.1	Confident	37 Å²	37	57.1 Å²	57.1	20%	0.198	28%	0.276	C	S	.	.	H	α-helix	trans	-69	-35.4	174.9	-71.2	-46.2	0	0	0	112.6	S371 L372 I373 V377 R378 H379	S371-D375 PolarHBondContact O-N 2.93Å; L372-D375 CarbonylContact O-C 3.55Å; L372-D375 PolarHBondContact O-N 2.78Å; L372-D375 VanDerWaalsContact O-N 3.13Å; I373-D375 VanDerWaalsContact C-N 3.29Å; I373-D375 PolarHBondContact O-N 3.29Å; D375-V377 VanDerWaalsContact C-N 3.31Å; D375-V377 PolarHBondContact O-N 3.49Å; D375-R378 PolarHBondContact O-N 3.4Å; D375-R378 IonicContact OD1-NH1 3.14Å; D375-H379 WeakPolarHBondContact O-CB 3.14Å; D375-H379 PolarHBondContact O-CD2 2.9Å; D375-H379 PolarHBondContact O-N 3.49Å
376	L	91.6	Very high	89.2	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-56.9	-44.7	172.2	-70.1	172.8	0	0	0	111.9	V325 L326 L372 I373 K380 V381 Y393	V325-L376 HydrophobicContact CG1-CD2 3.9Å; L326-L376 HydrophobicContact CD1-CD1 3.5Å; L326-L376 VanDerWaalsContact CD1-CD1 3.5Å; L326-L376 HydrophobicContact CD1-CD2 4.04Å; L326-L376 HydrophobicContact CD1-CG 4.35Å; L372-L376 PolarHBondContact O-N 2.8Å; I373-L376 WeakPolarHBondContact O-CB 3.23Å; I373-L376 PolarHBondContact O-N 3Å; L376-K380 PolarHBondContact O-N 2.83Å; L376-K380 VanDerWaalsContact O-N 3.09Å; L376-V381 HydrophobicContact CD2-CB 4.1Å; L376-V381 HydrophobicContact CD2-CG1 4.32Å; L376-V381 HydrophobicContact CD2-CG2 4.04Å; L376-V381 PolarHBondContact O-N 2.87Å; L376-Y393 HydrophobicContact CD1-CD2 4.21Å; L376-Y393 HydrophobicContact CD1-CE2 4.12Å
377	V	90.7	Very high	89.3	Confident	68 Å²	68	53.5 Å²	53.5	41%	0.412	27%	0.27	S	S	.	.	H	α-helix	trans	-67.7	-47	178.6	178.7	0	0	0	0	110.2	I373 R374 D375 H379 K380 Y393	I373-V377 PolarHBondContact O-N 3.49Å; R374-V377 PolarHBondContact O-N 2.75Å; D375-V377 VanDerWaalsContact C-N 3.31Å; D375-V377 PolarHBondContact O-N 3.49Å; V377-H379 VanDerWaalsContact C-N 3.34Å; V377-H379 PolarHBondContact O-N 2.98Å; V377-K380 PolarHBondContact O-N 3.23Å; V377-Y393 VanDerWaalsContact CG2-OH 3.29Å; V377-Y393 WeakPolarHBondContact CG2-OH 3.26Å
378	R	91	Very high	89.4	Confident	191 Å²	191	56.3 Å²	56.3	72%	0.721	29%	0.285	S	S	*	.	H	α-helix	trans	-58.5	-41.3	177.6	-176.4	-174.4	-179.5	-164.4	0.6	113.1	R374 D375 K380	R374-R378 WeakPolarHBondContact O-CB 3.13Å; R374-R378 PolarHBondContact O-N 3Å; D375-R378 PolarHBondContact O-N 3.4Å; D375-R378 IonicContact OD1-NH1 3.14Å; R378-K380 VanDerWaalsContact C-N 3.3Å
379	H	88.4	Confident	89.7	Confident	33 Å²	33	52.9 Å²	52.9	15%	0.153	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	1.3	177.9	-73.2	-101.4	0	0	0	113.4	Y303 T304 R307 D375 V377 V381	Y303-H379 HydrophobicContact CE1-CB 4.27Å; T304-H379 PolarHBondContact OG1-CE1 3.04Å; R307-H379 PolarHBondContact NH1-ND1 3.37Å; D375-H379 WeakPolarHBondContact O-CB 3.14Å; D375-H379 PolarHBondContact O-CD2 2.9Å; D375-H379 PolarHBondContact O-N 3.49Å; V377-H379 VanDerWaalsContact C-N 3.34Å; V377-H379 PolarHBondContact O-N 2.98Å; H379-V381 HydrophobicContact CB-CG2 4.03Å; H379-V381 PolarHBondContact O-N 3.38Å
380	K	89.7	Confident	89.8	Confident	138 Å²	138	53 Å²	53	60%	0.6	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	34	-179.6	-59	-173.3	178.7	-176	0	114.4	L376 V377 R378 H382 T383	L376-K380 PolarHBondContact O-N 2.83Å; L376-K380 VanDerWaalsContact O-N 3.09Å; V377-K380 PolarHBondContact O-N 3.23Å; R378-K380 VanDerWaalsContact C-N 3.3Å; K380-H382 PolarHBondContact O-N 2.81Å; K380-T383 HydrophobicContact CB-CG2 4.34Å; K380-T383 PolarHBondContact O-N 3.09Å; K380-T383 PolarHBondContact O-OG1 3.15Å
381	V	90.6	Very high	90.2	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.006	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-56.9	-38.2	-176	-174.9	0	0	0	0	111.3	Y303 G322 L376 H379 T383 V384 V385	Y303-V381 HydrophobicContact CD1-CG2 4.38Å; Y303-V381 HydrophobicContact CE1-CG2 3.82Å; G322-V381 WeakPolarHBondContact O-CG1 3.48Å; L376-V381 HydrophobicContact CD2-CB 4.1Å; L376-V381 HydrophobicContact CD2-CG1 4.32Å; L376-V381 HydrophobicContact CD2-CG2 4.04Å; L376-V381 PolarHBondContact O-N 2.87Å; H379-V381 HydrophobicContact CB-CG2 4.03Å; H379-V381 PolarHBondContact O-N 3.38Å; V381-T383 PolarHBondContact O-N 3.36Å; V381-T383 VanDerWaalsContact O-N 3.09Å; V381-V384 PolarHBondContact O-N 3.46Å; V381-V385 HydrophobicContact CG1-CG2 3.86Å; V381-V385 WeakPolarHBondContact O-CG2 3.06Å; V381-V385 PolarHBondContact O-N 3.2Å
382	H	86.9	Confident	90.2	Very high	67 Å²	67	53.1 Å²	53.1	31%	0.31	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-60.6	-13.9	176.8	62.8	-95.7	0	0	0	115.4	K380	K380-H382 PolarHBondContact O-N 2.81Å
383	T	88.9	Confident	90.2	Very high	83 Å²	83	54.7 Å²	54.7	51%	0.509	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-93.4	-9.9	175.4	69.6	0	0	0	0	113.7	K380 V381	K380-T383 HydrophobicContact CB-CG2 4.34Å; K380-T383 PolarHBondContact O-N 3.09Å; K380-T383 PolarHBondContact O-OG1 3.15Å; V381-T383 PolarHBondContact O-N 3.36Å; V381-T383 VanDerWaalsContact O-N 3.09Å
384	V	88.7	Confident	90.2	Very high	27 Å²	27	58.2 Å²	58.2	16%	0.164	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-39.5	-179.2	-168	0	0	0	0	111.2	L318 V381	L318-V384 HydrophobicContact CB-CG1 4.15Å; L318-V384 HydrophobicContact CD2-CG1 4Å; L318-V384 HydrophobicContact CD2-CG2 4.3Å; L318-V384 HydrophobicContact CG-CG1 3.95Å; V381-V384 PolarHBondContact O-N 3.46Å
385	V	91.1	Very high	90.1	Very high	10 Å²	10	51.5 Å²	51.5	6%	0.061	26%	0.262	C	S	.	.	S	Bend	trans	-67.8	151.8	-177	167.5	0	0	0	0	112.5	L326 V381 L389	L326-V385 HydrophobicContact CD2-CG1 3.8Å; V381-V385 HydrophobicContact CG1-CG2 3.86Å; V381-V385 WeakPolarHBondContact O-CG2 3.06Å; V381-V385 PolarHBondContact O-N 3.2Å; V385-L389 HydrophobicContact CG1-CB 3.57Å; V385-L389 HydrophobicContact CG1-CD1 4.1Å; V385-L389 HydrophobicContact CG1-CG 4.38Å
386	P	90	Very high	89.9	Confident	41 Å²	41	49.9 Å²	49.9	27%	0.266	25%	0.253	S	S	.	.			trans	-56.3	145.1	177.3	-27.6	37.5	0	0	0	113.8	S323 N388 L389 A390	S323-P386 WeakPolarHBondContact OG-CD 3.4Å; P386-N388 PolarHBondContact O-N 3.29Å; P386-N388 VanDerWaalsContact O-N 3.13Å; P386-L389 PolarHBondContact O-N 3.28Å; P386-A390 PolarHBondContact O-N 2.93Å
387	S	89.3	Confident	89.6	Confident	92 Å²	92	51.8 Å²	51.8	64%	0.643	26%	0.262	S	S	*	.	H	α-helix	trans	-52.9	-37.6	-174.7	49.1	0	0	0	0	114	L389 A390 K391	S387-L389 VanDerWaalsContact C-N 3.34Å; S387-L389 PolarHBondContact O-N 3.13Å; S387-A390 PolarHBondContact O-N 3.04Å; S387-K391 WeakPolarHBondContact O-CB 3.28Å; S387-K391 PolarHBondContact O-N 3.29Å
388	N	90.5	Very high	89.2	Confident	69 Å²	69	51 Å²	51	37%	0.369	26%	0.263	S	S	.	.	H	α-helix	trans	-60.3	-41.5	178.1	-63	-11	0	0	0	112.1	P386 K391 L392 A412	P386-N388 PolarHBondContact O-N 3.29Å; P386-N388 VanDerWaalsContact O-N 3.13Å; N388-K391 PolarHBondContact O-N 2.89Å; N388-L392 PolarHBondContact O-N 3.14Å; N388-A412 WeakPolarHBondContact O-CB 3.5Å
389	L	91.4	Very high	88.9	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-80.9	-32.6	179.7	-54.8	-178.5	0	0	0	111.7	L326 V385 P386 S387 K391 L392 Y393 A412 I416 L422	L326-L389 HydrophobicContact CD2-CB 4.18Å; L326-L389 WeakPolarHBondContact CD2-O 3.47Å; V385-L389 HydrophobicContact CG1-CB 3.57Å; V385-L389 HydrophobicContact CG1-CD1 4.1Å; V385-L389 HydrophobicContact CG1-CG 4.38Å; P386-L389 PolarHBondContact O-N 3.28Å; S387-L389 VanDerWaalsContact C-N 3.34Å; S387-L389 PolarHBondContact O-N 3.13Å; L389-K391 VanDerWaalsContact C-N 3.28Å; L389-K391 PolarHBondContact O-N 3.49Å; L389-L392 HydrophobicContact CD2-CD2 4.42Å; L389-L392 WeakPolarHBondContact O-CB 3.05Å; L389-L392 PolarHBondContact O-N 3.05Å; L389-Y393 PolarHBondContact O-N 2.91Å; L389-Y393 VanDerWaalsContact O-N 3.13Å; L389-A412 HydrophobicContact CD2-CB 4.36Å; L389-I416 HydrophobicContact CD2-CD1 3.79Å; L389-I416 HydrophobicContact CD2-CG1 3.64Å; L389-L422 HydrophobicContact CD1-CD1 4.12Å
390	A	90.5	Very high	88.8	Confident	24 Å²	24	45.5 Å²	45.5	20%	0.198	25%	0.245	C	C	.	.	H	α-helix	trans	-61.6	-38	168.8	0	0	0	0	0	111.4	P386 S387 Q394	P386-A390 PolarHBondContact O-N 2.93Å; S387-A390 PolarHBondContact O-N 3.04Å; A390-Q394 PolarHBondContact O-N 3.3Å
391	K	90.8	Very high	88.6	Confident	72 Å²	72	42.9 Å²	42.9	31%	0.313	24%	0.235	S	C	.	.	H	α-helix	trans	-71	-38.3	173.7	-173.3	53.1	176.1	164.9	0	112.4	S387 N388 L389 Y393 Q394 V395 D399	S387-K391 WeakPolarHBondContact O-CB 3.28Å; S387-K391 PolarHBondContact O-N 3.29Å; N388-K391 PolarHBondContact O-N 2.89Å; L389-K391 VanDerWaalsContact C-N 3.28Å; L389-K391 PolarHBondContact O-N 3.49Å; K391-Y393 VanDerWaalsContact C-N 3.29Å; K391-Y393 PolarHBondContact O-N 3.41Å; K391-Q394 HydrophobicContact CD-CB 4.28Å; K391-Q394 VanDerWaalsContact CD-OE1 3.32Å; K391-Q394 PolarHBondContact O-N 3.25Å; K391-Q394 VanDerWaalsContact O-N 3.14Å; K391-V395 HydrophobicContact CD-CG2 3.8Å; K391-V395 VanDerWaalsContact CE-CG2 3.47Å; K391-V395 HydrophobicContact CG-CG2 4Å; K391-V395 WeakPolarHBondContact O-CB 3.2Å; K391-V395 VanDerWaalsContact O-CG2 3.26Å; K391-V395 WeakPolarHBondContact O-CG2 3.2Å; K391-V395 PolarHBondContact O-N 3.13Å; K391-D399 IonicContact NZ-OD2 3.1Å; K391-D399 PolarHBondContact NZ-OD2 3.26Å
392	L	91.2	Very high	88.3	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-53	-46	171.8	177.4	61.7	0	0	0	112.1	N388 L389 V395 L396 V409 A412 I416	N388-L392 PolarHBondContact O-N 3.14Å; L389-L392 HydrophobicContact CD2-CD2 4.42Å; L389-L392 WeakPolarHBondContact O-CB 3.05Å; L389-L392 PolarHBondContact O-N 3.05Å; L392-V395 PolarHBondContact O-N 3.27Å; L392-L396 HydrophobicContact CD1-CD1 3.53Å; L392-L396 HydrophobicContact CD1-CG 4.2Å; L392-L396 HydrophobicContact CG-CD1 4.12Å; L392-L396 PolarHBondContact O-N 3.01Å; L392-L396 VanDerWaalsContact O-N 3.08Å; L392-V409 HydrophobicContact CD1-CB 4.26Å; L392-V409 HydrophobicContact CD1-CG1 3.66Å; L392-V409 HydrophobicContact CD1-CG2 3.8Å; L392-A412 HydrophobicContact CB-CB 3.79Å; L392-A412 HydrophobicContact CD1-CB 4.28Å; L392-A412 HydrophobicContact CD2-CB 4.14Å; L392-A412 HydrophobicContact CG-CB 4.3Å; L392-I416 HydrophobicContact CD2-CD1 3.88Å
393	Y	90.9	Very high	88.4	Confident	41 Å²	41	44.9 Å²	44.9	16%	0.161	25%	0.248	C	C	.	.	H	α-helix	trans	-61.3	-46.9	175.4	167.3	-97.2	0	0	0	112.5	L326 V330 I373 L376 V377 L389 K391 V395 L396 E397	L326-Y393 HydrophobicContact CD1-CD2 4.03Å; L326-Y393 HydrophobicContact CD1-CG 4.16Å; V330-Y393 HydrophobicContact CG2-CD2 4.29Å; I373-Y393 HydrophobicContact CG2-CE2 4.14Å; L376-Y393 HydrophobicContact CD1-CD2 4.21Å; L376-Y393 HydrophobicContact CD1-CE2 4.12Å; V377-Y393 VanDerWaalsContact CG2-OH 3.29Å; V377-Y393 WeakPolarHBondContact CG2-OH 3.26Å; L389-Y393 PolarHBondContact O-N 2.91Å; L389-Y393 VanDerWaalsContact O-N 3.13Å; K391-Y393 VanDerWaalsContact C-N 3.29Å; K391-Y393 PolarHBondContact O-N 3.41Å; Y393-V395 PolarHBondContact O-N 3.13Å; Y393-L396 PolarHBondContact O-N 3.37Å; Y393-E397 HydrophobicContact CD2-CG 4.28Å; Y393-E397 HydrophobicContact CE2-CB 4.29Å; Y393-E397 HydrophobicContact CE2-CG 4.15Å; Y393-E397 PolarHBondContact O-N 3Å
394	Q	89.8	Confident	88.4	Confident	81 Å²	81	46.3 Å²	46.3	38%	0.379	25%	0.247	S	C	.	.	H	α-helix	trans	-60.3	-45.8	176.5	-172.2	-163.2	-11.9	0	0	111.4	A390 K391 L396 A398 D399	A390-Q394 PolarHBondContact O-N 3.3Å; K391-Q394 HydrophobicContact CD-CB 4.28Å; K391-Q394 VanDerWaalsContact CD-OE1 3.32Å; K391-Q394 PolarHBondContact O-N 3.25Å; K391-Q394 VanDerWaalsContact O-N 3.14Å; Q394-L396 VanDerWaalsContact C-N 3.33Å; Q394-L396 PolarHBondContact O-N 2.88Å; Q394-A398 HydrophobicContact CG-CB 4.25Å; Q394-A398 CarbonylContact O-C 3.58Å; Q394-A398 WeakPolarHBondContact O-CA 3.12Å; Q394-A398 WeakPolarHBondContact O-CB 3.13Å; Q394-A398 PolarHBondContact O-N 2.99Å; Q394-D399 PolarHBondContact NE2-OD1 2.98Å; Q394-D399 PolarHBondContact NE2-OD2 3.45Å; Q394-D399 PolarHBondContact O-N 3.45Å
395	V	88.8	Confident	88.4	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.8	-34.2	-175.2	171.5	0	0	0	0	112.1	K391 L392 Y393 L405 L408 V409	K391-V395 HydrophobicContact CD-CG2 3.8Å; K391-V395 VanDerWaalsContact CE-CG2 3.47Å; K391-V395 HydrophobicContact CG-CG2 4Å; K391-V395 WeakPolarHBondContact O-CB 3.2Å; K391-V395 VanDerWaalsContact O-CG2 3.26Å; K391-V395 WeakPolarHBondContact O-CG2 3.2Å; K391-V395 PolarHBondContact O-N 3.13Å; L392-V395 PolarHBondContact O-N 3.27Å; Y393-V395 PolarHBondContact O-N 3.13Å; V395-L405 HydrophobicContact CG1-CD1 3.65Å; V395-L405 HydrophobicContact CG1-CG 4.37Å; V395-L405 WeakPolarHBondContact O-CD1 3.08Å; V395-L408 HydrophobicContact CG1-CB 3.9Å; V395-L408 HydrophobicContact CG1-CD1 4.32Å; V395-L408 HydrophobicContact CG2-CB 4.04Å; V395-L408 HydrophobicContact CG2-CD1 4.31Å; V395-V409 HydrophobicContact CB-CG2 4.46Å; V395-V409 HydrophobicContact CG1-CG2 3.75Å
396	L	87.9	Confident	88.3	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-88	-29.1	-179.6	-69.4	172.1	0	0	0	114	V330 L392 Y393 Q394 L405 I433 K436	V330-L396 HydrophobicContact CG1-CD1 3.4Å; L392-L396 HydrophobicContact CD1-CD1 3.53Å; L392-L396 HydrophobicContact CD1-CG 4.2Å; L392-L396 HydrophobicContact CG-CD1 4.12Å; L392-L396 PolarHBondContact O-N 3.01Å; L392-L396 VanDerWaalsContact O-N 3.08Å; Y393-L396 PolarHBondContact O-N 3.37Å; Q394-L396 VanDerWaalsContact C-N 3.33Å; Q394-L396 PolarHBondContact O-N 2.88Å; L396-L405 HydrophobicContact CD2-CD1 4.43Å; L396-L405 HydrophobicContact CD2-CD2 4.03Å; L396-L405 HydrophobicContact CD2-CG 4.35Å; L396-I433 HydrophobicContact CD2-CG1 4.18Å; L396-K436 HydrophobicContact CD2-CB 4.31Å; L396-K436 HydrophobicContact CD2-CG 4.26Å; L396-K436 WeakPolarHBondContact O-CD 3.28Å; L396-K436 VanDerWaalsContact O-CE 3.23Å; L396-K436 WeakPolarHBondContact O-CE 3.37Å; L396-K436 PolarHBondContact O-NZ 3.05Å
397	E	84.2	Confident	88.3	Confident	43 Å²	43	50.9 Å²	50.9	20%	0.201	26%	0.26	C	S	.	.	H	α-helix	trans	-115	-11.1	-174	-53.5	-53.9	145.5	0	0	115.7	R369 I373 Y393 K436	R369-E397 IonicContact CZ-OE1 2.7Å; R369-E397 VanDerWaalsContact CZ-OE1 3.23Å; R369-E397 IonicContact NH1-OE1 2.8Å; R369-E397 PolarHBondContact NH1-OE1 3.42Å; R369-E397 IonicContact NH1-OE2 3.68Å; R369-E397 PolarHBondContact NH1-OE2 2.93Å; R369-E397 VanDerWaalsContact NH1-OE2 3.07Å; R369-E397 IonicContact NH2-OE1 2.95Å; R369-E397 PolarHBondContact NH2-OE1 3.3Å; I373-E397 HydrophobicContact CD1-CG 4.12Å; Y393-E397 HydrophobicContact CD2-CG 4.28Å; Y393-E397 HydrophobicContact CE2-CB 4.29Å; Y393-E397 HydrophobicContact CE2-CG 4.15Å; Y393-E397 PolarHBondContact O-N 3Å; E397-K436 WeakPolarHBondContact OE1-CE 3.23Å; E397-K436 IonicContact OE1-NZ 3.63Å; E397-K436 PolarHBondContact OE1-NZ 2.91Å; E397-K436 IonicContact OE2-NZ 3.62Å; E397-K436 PolarHBondContact OE2-NZ 3.2Å
398	A	82.2	Confident	88.4	Confident	52 Å²	52	49.2 Å²	49.2	43%	0.43	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.1	-42	-178.7	0	0	0	0	0	114.3	Q394	Q394-A398 HydrophobicContact CG-CB 4.25Å; Q394-A398 CarbonylContact O-C 3.58Å; Q394-A398 WeakPolarHBondContact O-CA 3.12Å; Q394-A398 WeakPolarHBondContact O-CB 3.13Å; Q394-A398 PolarHBondContact O-N 2.99Å
399	D	85.5	Confident	88.4	Confident	27 Å²	27	46 Å²	46	14%	0.144	23%	0.226	C	C	.	.			trans	-80.3	128.4	-178	-56.2	-32.5	0	0	0	111.4	K391 Q394 Q440	K391-D399 IonicContact NZ-OD2 3.1Å; K391-D399 PolarHBondContact NZ-OD2 3.26Å; Q394-D399 PolarHBondContact NE2-OD1 2.98Å; Q394-D399 PolarHBondContact NE2-OD2 3.45Å; Q394-D399 PolarHBondContact O-N 3.45Å; D399-Q440 PolarHBondContact O-NE2 3.07Å; D399-Q440 VanDerWaalsContact O-NE2 3.1Å
400	F	85.2	Confident	88.3	Confident	81 Å²	81	51 Å²	51	36%	0.355	25%	0.25	S	C	.	.			trans	-98.1	94.5	174.7	-173.4	-89.5	0	0	0	110.5	P402 Q440 Q443 V444	F400-P402 HydrophobicContact CE1-CG 4.38Å; F400-Q440 HydrophobicContact CD2-CB 4.26Å; F400-Q440 HydrophobicContact CD2-CG 3.79Å; F400-Q440 HydrophobicContact CE2-CB 3.74Å; F400-Q440 HydrophobicContact CE2-CG 3.71Å; F400-Q440 HydrophobicContact CZ-CB 4.12Å; F400-Q440 WeakPolarHBondContact CZ-O 3.2Å; F400-Q443 HydrophobicContact CE2-CB 4.35Å; F400-Q443 HydrophobicContact CZ-CB 4.14Å; F400-V444 HydrophobicContact CE1-CG2 3.84Å; F400-V444 HydrophobicContact CZ-CG2 3.79Å
401	Q	86	Confident	88.3	Confident	83 Å²	83	53.3 Å²	53.3	39%	0.388	26%	0.263	S	S	.	.			trans	-147.5	66.6	-174.4	-61.8	-166.8	23.9	0	0	112.3	L403 K404 L405	Q401-L403 VanDerWaalsContact C-N 3.29Å; Q401-L403 PolarHBondContact O-N 3.1Å; Q401-L403 VanDerWaalsContact O-N 3.14Å; Q401-K404 HydrophobicContact CB-CB 4.48Å; Q401-K404 PolarHBondContact O-N 3.46Å; Q401-L405 PolarHBondContact O-N 2.98Å
402	P	84.9	Confident	88.3	Confident	15 Å²	15	50 Å²	50	10%	0.097	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-38.7	-170.4	14.4	-27.7	0	0	0	114.5	F400 Q440 L441	F400-P402 HydrophobicContact CE1-CG 4.38Å; P402-Q440 HydrophobicContact CB-CB 3.74Å; P402-Q440 HydrophobicContact CG-CB 4.08Å; P402-Q440 VanDerWaalsContact N-OE1 3.14Å; P402-L441 HydrophobicContact CB-CD2 3.86Å; P402-L441 HydrophobicContact CB-CG 3.86Å
403	L	88.7	Confident	88.3	Confident	95 Å²	95	50.2 Å²	50.2	50%	0.497	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-19.6	-177.1	-57	178	0	0	0	113.9	Q401 L441 L456	Q401-L403 VanDerWaalsContact C-N 3.29Å; Q401-L403 PolarHBondContact O-N 3.1Å; Q401-L403 VanDerWaalsContact O-N 3.14Å; L403-L441 HydrophobicContact CD2-CD2 4.35Å; L403-L456 HydrophobicContact CB-CD2 4.46Å; L403-L456 HydrophobicContact CD2-CD1 3.97Å; L403-L456 HydrophobicContact CD2-CD2 3.92Å
404	K	89.2	Confident	88.3	Confident	113 Å²	113	51 Å²	51	49%	0.491	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	1.1	-176.8	-61.8	-162.5	173.2	-164.1	0	113.9	Q401 W406 E407 L408	Q401-K404 HydrophobicContact CB-CB 4.48Å; Q401-K404 PolarHBondContact O-N 3.46Å; K404-W406 PolarHBondContact O-N 3.27Å; K404-E407 WeakPolarHBondContact CG-OE2 3.25Å; K404-E407 PolarHBondContact O-N 2.88Å; K404-L408 HydrophobicContact CB-CD1 4.25Å; K404-L408 HydrophobicContact CB-CG 4.45Å; K404-L408 WeakPolarHBondContact O-CG 3.15Å; K404-L408 PolarHBondContact O-N 2.85Å
405	L	88.7	Confident	88.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-56.7	-40.8	-175.5	-157	78	0	0	0	111.7	V395 L396 Q401 V409 I433 K436 T437	V395-L405 HydrophobicContact CG1-CD1 3.65Å; V395-L405 HydrophobicContact CG1-CG 4.37Å; V395-L405 WeakPolarHBondContact O-CD1 3.08Å; L396-L405 HydrophobicContact CD2-CD1 4.43Å; L396-L405 HydrophobicContact CD2-CD2 4.03Å; L396-L405 HydrophobicContact CD2-CG 4.35Å; Q401-L405 PolarHBondContact O-N 2.98Å; L405-V409 VanDerWaalsContact O-CB 3.27Å; L405-V409 WeakPolarHBondContact O-CB 3.42Å; L405-V409 WeakPolarHBondContact O-CG2 3.44Å; L405-V409 PolarHBondContact O-N 3.46Å; L405-I433 HydrophobicContact CD2-CG2 4.35Å; L405-K436 HydrophobicContact CD2-CB 3.92Å; L405-T437 HydrophobicContact CB-CG2 3.94Å; L405-T437 HydrophobicContact CD2-CG2 3.57Å; L405-T437 HydrophobicContact CG-CG2 4.39Å
406	W	89.7	Confident	88.3	Confident	58 Å²	58	49.8 Å²	49.8	22%	0.22	26%	0.259	C	S	.	.	H	α-helix	trans	-64.4	-51.8	176	174.7	-120.5	0	0	0	112.7	K404 L408 V409 Q410 L413 F459	K404-W406 PolarHBondContact O-N 3.27Å; W406-L408 VanDerWaalsContact C-N 3.27Å; W406-L408 PolarHBondContact O-N 3.47Å; W406-V409 PolarHBondContact O-N 3.4Å; W406-V409 VanDerWaalsContact O-N 3.11Å; W406-Q410 PolarHBondContact O-N 3.42Å; W406-L413 HydrophobicContact CE3-CD1 4.46Å; W406-L413 HydrophobicContact CH2-CD1 4.18Å; W406-L413 HydrophobicContact CZ3-CD1 3.54Å; W406-F459 AromaticContact CD2-CD1 3.61Å; W406-F459 HydrophobicContact CD2-CD1 3.61Å; W406-F459 AromaticContact CD2-CE1 3.93Å; W406-F459 HydrophobicContact CD2-CE1 3.93Å; W406-F459 AromaticContact CE2-CD1 3.93Å; W406-F459 AromaticContact CE3-CD1 3.25Å; W406-F459 HydrophobicContact CE3-CD1 3.25Å; W406-F459 AromaticContact CE3-CE1 3.41Å; W406-F459 HydrophobicContact CE3-CE1 3.41Å; W406-F459 VanDerWaalsContact CE3-CE1 3.41Å; W406-F459 HydrophobicContact CE3-CG 4.22Å; W406-F459 HydrophobicContact CE3-CZ 4.47Å; W406-F459 HydrophobicContact CG-CD1 4.46Å; W406-F459 HydrophobicContact CH2-CB 3.69Å; W406-F459 AromaticContact CH2-CD1 3.63Å; W406-F459 HydrophobicContact CH2-CD1 3.63Å; W406-F459 AromaticContact CH2-CG 3.9Å; W406-F459 HydrophobicContact CH2-CG 3.9Å; W406-F459 HydrophobicContact CZ2-CB 4.08Å; W406-F459 AromaticContact CZ2-CD1 3.96Å; W406-F459 HydrophobicContact CZ2-CD1 3.96Å; W406-F459 HydrophobicContact CZ2-CG 4.44Å; W406-F459 HydrophobicContact CZ3-CB 4.1Å; W406-F459 AromaticContact CZ3-CD1 3.25Å; W406-F459 HydrophobicContact CZ3-CD1 3.25Å; W406-F459 AromaticContact CZ3-CE1 3.76Å; W406-F459 HydrophobicContact CZ3-CE1 3.76Å; W406-F459 AromaticContact CZ3-CG 3.76Å; W406-F459 HydrophobicContact CZ3-CG 3.76Å
407	E	89.8	Confident	88.3	Confident	116 Å²	116	53.3 Å²	53.3	54%	0.542	28%	0.28	S	S	.	.	H	α-helix	trans	-55	-42.5	179.7	-55.1	-178.8	148.8	0	0	112	K404 P411	K404-E407 WeakPolarHBondContact CG-OE2 3.25Å; K404-E407 PolarHBondContact O-N 2.88Å; E407-P411 WeakPolarHBondContact O-CD 3.23Å
408	L	90.1	Very high	88.6	Confident	57 Å²	57	56.9 Å²	56.9	30%	0.298	31%	0.306	S	S	.	.	H	α-helix	trans	-75.5	-24.1	-178.3	-67.8	173.3	0	0	0	113.6	V395 K404 W406	V395-L408 HydrophobicContact CG1-CB 3.9Å; V395-L408 HydrophobicContact CG1-CD1 4.32Å; V395-L408 HydrophobicContact CG2-CB 4.04Å; V395-L408 HydrophobicContact CG2-CD1 4.31Å; K404-L408 HydrophobicContact CB-CD1 4.25Å; K404-L408 HydrophobicContact CB-CG 4.45Å; K404-L408 WeakPolarHBondContact O-CG 3.15Å; K404-L408 PolarHBondContact O-N 2.85Å; W406-L408 VanDerWaalsContact C-N 3.27Å; W406-L408 PolarHBondContact O-N 3.47Å
409	V	91.4	Very high	88.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-93.6	-25.6	-178.1	167.8	0	0	0	0	112.4	L392 V395 L405 W406 P411 A412 L413 I433	L392-V409 HydrophobicContact CD1-CB 4.26Å; L392-V409 HydrophobicContact CD1-CG1 3.66Å; L392-V409 HydrophobicContact CD1-CG2 3.8Å; V395-V409 HydrophobicContact CB-CG2 4.46Å; V395-V409 HydrophobicContact CG1-CG2 3.75Å; L405-V409 VanDerWaalsContact O-CB 3.27Å; L405-V409 WeakPolarHBondContact O-CB 3.42Å; L405-V409 WeakPolarHBondContact O-CG2 3.44Å; L405-V409 PolarHBondContact O-N 3.46Å; W406-V409 PolarHBondContact O-N 3.4Å; W406-V409 VanDerWaalsContact O-N 3.11Å; V409-P411 VanDerWaalsContact C-CD 3.48Å; V409-A412 WeakPolarHBondContact O-CB 3.25Å; V409-A412 PolarHBondContact O-N 2.72Å; V409-L413 HydrophobicContact CG1-CD1 3.76Å; V409-L413 HydrophobicContact CG1-CD2 4.49Å; V409-L413 HydrophobicContact CG1-CG 3.76Å; V409-L413 PolarHBondContact O-N 3.26Å; V409-I433 HydrophobicContact CG1-CD1 3.55Å; V409-I433 HydrophobicContact CG1-CG1 4.22Å
410	Q	90	Very high	88.7	Confident	107 Å²	107	59.5 Å²	59.5	50%	0.5	32%	0.322	S	S	.	.	H	α-helix	trans	-50.6	-43.2	179.7	-173.7	-179.9	1.9	0	0	114.5	W406 A412 L413 A414	W406-Q410 PolarHBondContact O-N 3.42Å; Q410-A412 VanDerWaalsContact C-N 3.3Å; Q410-A412 PolarHBondContact O-N 2.97Å; Q410-L413 PolarHBondContact O-N 3.17Å; Q410-A414 PolarHBondContact O-N 2.65Å
411	P	90.5	Very high	88.7	Confident	72 Å²	72	59.7 Å²	59.7	47%	0.468	33%	0.327	S	S	.	.	H	α-helix	trans	-65.8	-30.8	177.6	-21	34.1	0	0	0	113.7	E407 V409 H415	E407-P411 WeakPolarHBondContact O-CD 3.23Å; V409-P411 VanDerWaalsContact C-CD 3.48Å; P411-H415 PolarHBondContact O-N 3.05Å
412	A	90.2	Very high	88.9	Confident	2 Å²	2	56.2 Å²	56.2	2%	0.017	31%	0.311	C	S	.	.	H	α-helix	trans	-74.7	-42.4	176.4	0	0	0	0	0	111.4	N388 L389 L392 V409 Q410 A414 H415 I416	N388-A412 WeakPolarHBondContact O-CB 3.5Å; L389-A412 HydrophobicContact CD2-CB 4.36Å; L392-A412 HydrophobicContact CB-CB 3.79Å; L392-A412 HydrophobicContact CD1-CB 4.28Å; L392-A412 HydrophobicContact CD2-CB 4.14Å; L392-A412 HydrophobicContact CG-CB 4.3Å; V409-A412 WeakPolarHBondContact O-CB 3.25Å; V409-A412 PolarHBondContact O-N 2.72Å; Q410-A412 VanDerWaalsContact C-N 3.3Å; Q410-A412 PolarHBondContact O-N 2.97Å; A412-A414 VanDerWaalsContact C-N 3.34Å; A412-A414 PolarHBondContact O-N 3.35Å; A412-H415 PolarHBondContact O-N 2.99Å; A412-I416 VanDerWaalsContact O-CG1 3.27Å; A412-I416 WeakPolarHBondContact O-CG1 3.07Å; A412-I416 PolarHBondContact O-N 3.32Å
413	L	91.2	Very high	89.2	Confident	10 Å²	10	60.5 Å²	60.5	5%	0.052	33%	0.33	C	S	.	.	H	α-helix	trans	-64.2	-37.3	175.4	-68.9	175.9	0	0	0	112.5	W406 V409 Q410 H415 I416 T417 L429 I433	W406-L413 HydrophobicContact CE3-CD1 4.46Å; W406-L413 HydrophobicContact CH2-CD1 4.18Å; W406-L413 HydrophobicContact CZ3-CD1 3.54Å; V409-L413 HydrophobicContact CG1-CD1 3.76Å; V409-L413 HydrophobicContact CG1-CD2 4.49Å; V409-L413 HydrophobicContact CG1-CG 3.76Å; V409-L413 PolarHBondContact O-N 3.26Å; Q410-L413 PolarHBondContact O-N 3.17Å; L413-H415 PolarHBondContact O-N 3.19Å; L413-I416 HydrophobicContact CD2-CD1 4.47Å; L413-I416 PolarHBondContact O-N 3.48Å; L413-T417 WeakPolarHBondContact O-CB 3.15Å; L413-T417 PolarHBondContact O-N 3.18Å; L413-T417 PolarHBondContact O-OG1 3.37Å; L413-L429 HydrophobicContact CD2-CB 4.22Å; L413-L429 HydrophobicContact CD2-CD1 4.13Å; L413-I433 HydrophobicContact CD1-CD1 3.96Å
414	A	90.1	Very high	89.3	Confident	56 Å²	56	58.9 Å²	58.9	46%	0.463	32%	0.324	S	S	.	.	H	α-helix	trans	-58.8	-47.5	173.2	0	0	0	0	0	111.3	Q410 A412 T417 T418	Q410-A414 PolarHBondContact O-N 2.65Å; A412-A414 VanDerWaalsContact C-N 3.34Å; A412-A414 PolarHBondContact O-N 3.35Å; A414-T417 WeakPolarHBondContact O-CB 3.38Å; A414-T417 PolarHBondContact O-N 3.1Å; A414-T418 PolarHBondContact O-N 3.36Å; A414-T418 PolarHBondContact O-OG1 3.41Å
415	H	88	Confident	89.5	Confident	56 Å²	56	54.1 Å²	54.1	26%	0.259	30%	0.303	S	S	.	.	H	α-helix	trans	-63.5	-42.2	177	-177.4	51.7	0	0	0	112.7	P411 A412 L413 T417 T418 C419	P411-H415 PolarHBondContact O-N 3.05Å; A412-H415 PolarHBondContact O-N 2.99Å; L413-H415 PolarHBondContact O-N 3.19Å; H415-T417 VanDerWaalsContact C-N 3.27Å; H415-T417 PolarHBondContact O-N 2.91Å; H415-T418 PolarHBondContact O-N 3.19Å; H415-C419 PolarHBondContact O-N 2.95Å
416	I	90.5	Very high	89.7	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-59.7	-37.5	173.8	-71.5	169.7	0	0	0	111.3	L389 L392 A412 L413 T418 C419 L422 Q423 I426 L429	L389-I416 HydrophobicContact CD2-CD1 3.79Å; L389-I416 HydrophobicContact CD2-CG1 3.64Å; L392-I416 HydrophobicContact CD2-CD1 3.88Å; A412-I416 VanDerWaalsContact O-CG1 3.27Å; A412-I416 WeakPolarHBondContact O-CG1 3.07Å; A412-I416 PolarHBondContact O-N 3.32Å; L413-I416 HydrophobicContact CD2-CD1 4.47Å; L413-I416 PolarHBondContact O-N 3.48Å; I416-T418 VanDerWaalsContact C-N 3.35Å; I416-C419 PolarHBondContact O-N 3.35Å; I416-C419 VanDerWaalsContact O-O 3.09Å; I416-L422 HydrophobicContact CB-CB 4.39Å; I416-L422 HydrophobicContact CG1-CB 4.44Å; I416-L422 HydrophobicContact CG2-CB 3.91Å; I416-L422 WeakPolarHBondContact CG2-O 3.06Å; I416-Q423 PolarHBondContact O-N 3.09Å; I416-I426 HydrophobicContact CG2-CD1 4.03Å; I416-I426 HydrophobicContact CG2-CG1 3.51Å; I416-L429 HydrophobicContact CD1-CD1 3.62Å
417	T	89.3	Confident	89.7	Confident	76 Å²	76	56 Å²	56	47%	0.466	32%	0.319	S	S	.	.	H	α-helix	trans	-69	-30.6	178.7	-52.1	0	0	0	0	112.6	L413 A414 H415 C419 I426	L413-T417 WeakPolarHBondContact O-CB 3.15Å; L413-T417 PolarHBondContact O-N 3.18Å; L413-T417 PolarHBondContact O-OG1 3.37Å; A414-T417 WeakPolarHBondContact O-CB 3.38Å; A414-T417 PolarHBondContact O-N 3.1Å; H415-T417 VanDerWaalsContact C-N 3.27Å; H415-T417 PolarHBondContact O-N 2.91Å; T417-C419 VanDerWaalsContact C-N 3.31Å; T417-I426 HydrophobicContact CG2-CD1 4.4Å; T417-I426 WeakPolarHBondContact OG1-CD1 3.37Å
418	T	89.1	Confident	89.7	Confident	119 Å²	119	52.3 Å²	52.3	73%	0.73	30%	0.302	S	S	*	.	H	α-helix	trans	-71.4	-26.1	174	-45.3	0	0	0	0	112.5	A414 H415 I416	A414-T418 PolarHBondContact O-N 3.36Å; A414-T418 PolarHBondContact O-OG1 3.41Å; H415-T418 PolarHBondContact O-N 3.19Å; I416-T418 VanDerWaalsContact C-N 3.35Å
419	C	85.6	Confident	89.8	Confident	43 Å²	43	49.6 Å²	49.6	29%	0.291	29%	0.288	S	S	.	.			trans	-99.6	102.5	-176.1	-66.1	0	0	0	0	111.6	H415 I416 T417 D421 L422 Q423	H415-C419 PolarHBondContact O-N 2.95Å; I416-C419 PolarHBondContact O-N 3.35Å; I416-C419 VanDerWaalsContact O-O 3.09Å; T417-C419 VanDerWaalsContact C-N 3.31Å; C419-D421 VanDerWaalsContact C-N 3.29Å; C419-D421 PolarHBondContact O-N 3.32Å; C419-D421 VanDerWaalsContact O-N 3.12Å; C419-L422 HydrophobicContact CB-CB 4.06Å; C419-L422 HydrophobicContact CB-CD1 3.88Å; C419-L422 HydrophobicContact CB-CG 3.92Å; C419-L422 WeakPolarHBondContact O-CA 3.01Å; C419-L422 PolarHBondContact O-N 2.92Å; C419-Q423 PolarHBondContact O-N 3.17Å
420	S	84.4	Confident	89.9	Confident	90 Å²	90	51.4 Å²	51.4	63%	0.629	30%	0.296	S	S	*	.	H	α-helix	trans	-43.1	-47.9	179.7	-175	0	0	0	0	114.3	L422 Q423	S420-L422 PolarHBondContact O-N 3.06Å; S420-Q423 WeakPolarHBondContact O-CB 3.43Å; S420-Q423 PolarHBondContact O-N 3.21Å
421	D	84.9	Confident	89.8	Confident	86 Å²	86	48.1 Å²	48.1	46%	0.46	28%	0.282	S	S	.	.	H	α-helix	trans	-61.4	-27.1	178	-73.2	-4.2	0	0	0	114.9	R324 C419	R324-D421 IonicContact CZ-OD2 2.85Å; R324-D421 IonicContact NE-OD2 3.36Å; R324-D421 PolarHBondContact NE-OD2 3.07Å; R324-D421 IonicContact NH2-OD2 3.24Å; R324-D421 PolarHBondContact NH2-OD2 3.12Å; C419-D421 VanDerWaalsContact C-N 3.29Å; C419-D421 PolarHBondContact O-N 3.32Å; C419-D421 VanDerWaalsContact O-N 3.12Å
422	L	90.4	Very high	89.8	Confident	10 Å²	10	44.7 Å²	44.7	5%	0.052	26%	0.26	C	S	.	.	H	α-helix	trans	-97.7	-26.3	-177.2	-54.4	-177.2	0	0	0	111.9	R324 C327 L389 I416 C419 S420 V424 Y425	R324-L422 HydrophobicContact CB-CD2 4.3Å; R324-L422 HydrophobicContact CG-CD2 3.8Å; C327-L422 HydrophobicContact CB-CD2 4.44Å; L389-L422 HydrophobicContact CD1-CD1 4.12Å; I416-L422 HydrophobicContact CB-CB 4.39Å; I416-L422 HydrophobicContact CG1-CB 4.44Å; I416-L422 HydrophobicContact CG2-CB 3.91Å; I416-L422 WeakPolarHBondContact CG2-O 3.06Å; C419-L422 HydrophobicContact CB-CB 4.06Å; C419-L422 HydrophobicContact CB-CD1 3.88Å; C419-L422 HydrophobicContact CB-CG 3.92Å; C419-L422 WeakPolarHBondContact O-CA 3.01Å; C419-L422 PolarHBondContact O-N 2.92Å; S420-L422 PolarHBondContact O-N 3.06Å; L422-V424 PolarHBondContact O-N 2.9Å; L422-Y425 HydrophobicContact CD2-CD2 4.48Å; L422-Y425 HydrophobicContact CD2-CE2 4.2Å; L422-Y425 VanDerWaalsContact O-CD2 3.27Å; L422-Y425 WeakPolarHBondContact O-CD2 3.37Å; L422-Y425 PolarHBondContact O-N 3.46Å
423	Q	91.7	Very high	89.8	Confident	104 Å²	104	44.6 Å²	44.6	49%	0.486	26%	0.259	S	S	.	.	H	α-helix	trans	-50.4	-32.6	177.4	-165.6	-174.1	4.2	0	0	112.4	I416 C419 S420 Y425 I426	I416-Q423 PolarHBondContact O-N 3.09Å; C419-Q423 PolarHBondContact O-N 3.17Å; S420-Q423 WeakPolarHBondContact O-CB 3.43Å; S420-Q423 PolarHBondContact O-N 3.21Å; Q423-Y425 PolarHBondContact O-N 2.74Å; Q423-Y425 VanDerWaalsContact O-N 3.15Å; Q423-I426 HydrophobicContact CB-CD1 4.3Å; Q423-I426 HydrophobicContact CG-CD1 3.76Å; Q423-I426 WeakPolarHBondContact O-CB 3.49Å; Q423-I426 WeakPolarHBondContact O-CG1 3.16Å; Q423-I426 PolarHBondContact O-N 3.07Å; Q423-I426 VanDerWaalsContact O-N 3.13Å
424	V	91.2	Very high	89.8	Confident	61 Å²	61	44.1 Å²	44.1	37%	0.37	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-21.9	178.7	-168	0	0	0	0	113.9	L422 Q428	L422-V424 PolarHBondContact O-N 2.9Å; V424-Q428 PolarHBondContact O-OE1 3.27Å
425	Y	93.6	Very high	89.7	Confident	13 Å²	13	41.7 Å²	41.7	5%	0.051	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-10	178.9	-53.8	-67	0	0	0	114.1	H295 C327 A328 A331 L422 Q423 T427 Q428 L429	H295-Y425 AromaticContact NE2-CE1 3.41Å; H295-Y425 WeakPolarHBondContact NE2-CE1 3.1Å; H295-Y425 AromaticContact NE2-CZ 3.75Å; H295-Y425 PolarHBondContact NE2-OH 2.73Å; C327-Y425 HydrophobicContact CB-CD2 3.56Å; C327-Y425 HydrophobicContact CB-CE2 4.08Å; C327-Y425 HydrophobicContact CB-CG 4.05Å; A328-Y425 HydrophobicContact CB-CD1 4.36Å; A328-Y425 HydrophobicContact CB-CE1 3.66Å; A331-Y425 HydrophobicContact CB-CD1 4.4Å; L422-Y425 HydrophobicContact CD2-CD2 4.48Å; L422-Y425 HydrophobicContact CD2-CE2 4.2Å; L422-Y425 VanDerWaalsContact O-CD2 3.27Å; L422-Y425 WeakPolarHBondContact O-CD2 3.37Å; L422-Y425 PolarHBondContact O-N 3.46Å; Q423-Y425 PolarHBondContact O-N 2.74Å; Q423-Y425 VanDerWaalsContact O-N 3.15Å; Y425-T427 VanDerWaalsContact C-N 3.32Å; Y425-T427 PolarHBondContact O-N 2.71Å; Y425-Q428 PolarHBondContact O-N 3.07Å; Y425-Q428 PolarHBondContact O-OE1 3.22Å; Y425-L429 WeakPolarHBondContact O-CB 3.02Å; Y425-L429 WeakPolarHBondContact O-CG 3.38Å; Y425-L429 PolarHBondContact O-N 2.73Å
426	I	92.1	Very high	89.6	Confident	27 Å²	27	39.4 Å²	39.4	14%	0.138	23%	0.226	C	C	.	.	H	α-helix	trans	-56.9	-45.2	-171	-70.9	173.9	0	0	0	111.5	I416 T417 Q423 Q428 L429 H430	I416-I426 HydrophobicContact CG2-CD1 4.03Å; I416-I426 HydrophobicContact CG2-CG1 3.51Å; T417-I426 HydrophobicContact CG2-CD1 4.4Å; T417-I426 WeakPolarHBondContact OG1-CD1 3.37Å; Q423-I426 HydrophobicContact CB-CD1 4.3Å; Q423-I426 HydrophobicContact CG-CD1 3.76Å; Q423-I426 WeakPolarHBondContact O-CB 3.49Å; Q423-I426 WeakPolarHBondContact O-CG1 3.16Å; Q423-I426 PolarHBondContact O-N 3.07Å; Q423-I426 VanDerWaalsContact O-N 3.13Å; I426-Q428 PolarHBondContact O-N 2.84Å; I426-L429 PolarHBondContact O-N 2.81Å; I426-H430 VanDerWaalsContact CG2-CD2 3.43Å; I426-H430 WeakPolarHBondContact CG2-CD2 3.22Å; I426-H430 WeakPolarHBondContact CG2-NE2 3.5Å; I426-H430 PolarHBondContact O-CD2 2.89Å; I426-H430 PolarHBondContact O-N 3.29Å
427	T	90	Very high	89.5	Confident	71 Å²	71	39.4 Å²	39.4	44%	0.436	23%	0.226	S	C	.	.	H	α-helix	trans	-58.6	-48.4	-178.6	-49.4	0	0	0	0	112	Y425 H430 D431	Y425-T427 VanDerWaalsContact C-N 3.32Å; Y425-T427 PolarHBondContact O-N 2.71Å; T427-H430 PolarHBondContact O-N 3.24Å; T427-D431 PolarHBondContact O-N 3.02Å; T427-D431 VanDerWaalsContact O-OD2 3.1Å
428	Q	90.6	Very high	89.4	Confident	38 Å²	38	35.8 Å²	35.8	18%	0.178	20%	0.204	C	C	.	.	H	α-helix	trans	-74.9	-29.2	-179.2	-56	80.1	12.6	0	0	112	A331 P333 V424 Y425 I426 D431 V432	A331-Q428 HydrophobicContact CB-CB 4.24Å; A331-Q428 WeakPolarHBondContact O-CB 3.03Å; P333-Q428 HydrophobicContact CG-CB 4.43Å; P333-Q428 HydrophobicContact CG-CG 4.44Å; V424-Q428 PolarHBondContact O-OE1 3.27Å; Y425-Q428 PolarHBondContact O-N 3.07Å; Y425-Q428 PolarHBondContact O-OE1 3.22Å; I426-Q428 PolarHBondContact O-N 2.84Å; Q428-D431 PolarHBondContact O-N 3.17Å; Q428-V432 WeakPolarHBondContact O-CB 3.1Å; Q428-V432 VanDerWaalsContact O-CG2 3.27Å; Q428-V432 WeakPolarHBondContact O-CG2 3.18Å; Q428-V432 PolarHBondContact O-N 3.15Å
429	L	92.2	Very high	89.2	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.3	-43.1	170.6	-74.2	170.1	0	0	0	111.2	V330 A331 L413 I416 Y425 I426 D431 V432 I433	V330-L429 HydrophobicContact CB-CD2 4.36Å; V330-L429 HydrophobicContact CG1-CD2 3.8Å; A331-L429 HydrophobicContact CB-CD2 3.71Å; A331-L429 HydrophobicContact CB-CG 3.74Å; L413-L429 HydrophobicContact CD2-CB 4.22Å; L413-L429 HydrophobicContact CD2-CD1 4.13Å; I416-L429 HydrophobicContact CD1-CD1 3.62Å; Y425-L429 WeakPolarHBondContact O-CB 3.02Å; Y425-L429 WeakPolarHBondContact O-CG 3.38Å; Y425-L429 PolarHBondContact O-N 2.73Å; I426-L429 PolarHBondContact O-N 2.81Å; L429-D431 PolarHBondContact O-N 2.89Å; L429-V432 PolarHBondContact O-N 3.08Å; L429-I433 WeakPolarHBondContact O-CB 3.13Å; L429-I433 VanDerWaalsContact O-CD1 3.26Å; L429-I433 WeakPolarHBondContact O-CD1 3.45Å; L429-I433 WeakPolarHBondContact O-CG1 3.47Å; L429-I433 PolarHBondContact O-N 3.16Å
430	H	91.8	Very high	89.1	Confident	38 Å²	38	29.8 Å²	29.8	18%	0.176	16%	0.163	C	C	.	.	H	α-helix	trans	-59.1	-45.9	174.4	-76	-62.2	0	0	0	112.2	I426 T427 V432 I433 V434 F459 M460	I426-H430 VanDerWaalsContact CG2-CD2 3.43Å; I426-H430 WeakPolarHBondContact CG2-CD2 3.22Å; I426-H430 WeakPolarHBondContact CG2-NE2 3.5Å; I426-H430 PolarHBondContact O-CD2 2.89Å; I426-H430 PolarHBondContact O-N 3.29Å; T427-H430 PolarHBondContact O-N 3.24Å; H430-V432 PolarHBondContact O-N 3.42Å; H430-I433 PolarHBondContact O-N 3.36Å; H430-V434 WeakPolarHBondContact O-CG2 3.49Å; H430-V434 PolarHBondContact O-N 2.92Å; H430-F459 HydrophobicContact CB-CD2 4.12Å; H430-F459 HydrophobicContact CB-CE2 3.83Å; H430-F459 AromaticContact CE1-CD2 3.66Å; H430-F459 AromaticContact CE1-CG 3.89Å; H430-F459 AromaticContact CG-CD2 3.74Å; H430-F459 AromaticContact CG-CE2 3.88Å; H430-F459 AromaticContact ND1-CD2 3Å; H430-F459 WeakPolarHBondContact ND1-CD2 3.39Å; H430-F459 AromaticContact ND1-CE2 3.28Å; H430-F459 VanDerWaalsContact ND1-CE2 3.28Å; H430-F459 WeakPolarHBondContact ND1-CE2 3.48Å; H430-F459 AromaticContact ND1-CG 3.61Å; H430-M460 HydrophobicContact CB-CE 4.04Å
431	D	89.6	Confident	89.3	Confident	39 Å²	39	25.5 Å²	25.5	21%	0.209	13%	0.133	C	C	.	.	H	α-helix	trans	-63.5	-40.5	177.5	-58.5	-40.3	0	0	0	111.7	T427 Q428 L429 V434 A435 M460 R464 I468	T427-D431 PolarHBondContact O-N 3.02Å; T427-D431 VanDerWaalsContact O-OD2 3.1Å; Q428-D431 PolarHBondContact O-N 3.17Å; L429-D431 PolarHBondContact O-N 2.89Å; D431-V434 PolarHBondContact O-N 3.26Å; D431-A435 WeakPolarHBondContact O-CB 3.33Å; D431-A435 PolarHBondContact O-N 2.84Å; D431-M460 WeakPolarHBondContact OD1-CE 3.33Å; D431-R464 IonicContact OD1-CZ 2.63Å; D431-R464 IonicContact OD1-NE 3.06Å; D431-R464 PolarHBondContact OD1-NE 2.72Å; D431-R464 IonicContact OD1-NH2 2.68Å; D431-R464 PolarHBondContact OD1-NH2 3.05Å; D431-R464 IonicContact OD2-NH2 3.59Å; D431-R464 PolarHBondContact OD2-NH2 3.49Å; D431-I468 HydrophobicContact CB-CD1 4.44Å
432	V	89.1	Confident	89.3	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.9	-39.5	173.9	166.6	0	0	0	0	112.4	I332 L334 Q428 L429 H430 A435 K436	I332-V432 WeakPolarHBondContact O-CG2 3.39Å; L334-V432 HydrophobicContact CD1-CG1 4.15Å; Q428-V432 WeakPolarHBondContact O-CB 3.1Å; Q428-V432 VanDerWaalsContact O-CG2 3.27Å; Q428-V432 WeakPolarHBondContact O-CG2 3.18Å; Q428-V432 PolarHBondContact O-N 3.15Å; L429-V432 PolarHBondContact O-N 3.08Å; H430-V432 PolarHBondContact O-N 3.42Å; V432-A435 PolarHBondContact O-N 3.47Å; V432-K436 HydrophobicContact CG1-CG 4.29Å; V432-K436 VanDerWaalsContact O-CB 3.31Å; V432-K436 WeakPolarHBondContact O-CB 3.32Å; V432-K436 VanDerWaalsContact O-CG 3.26Å; V432-K436 WeakPolarHBondContact O-CG 3.2Å; V432-K436 PolarHBondContact O-N 2.9Å
433	I	90.6	Very high	88.7	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.4	-46	177.3	-69.7	156.3	0	0	0	109.9	L396 L405 V409 L413 L429 H430 K436 T437 F459	L396-I433 HydrophobicContact CD2-CG1 4.18Å; L405-I433 HydrophobicContact CD2-CG2 4.35Å; V409-I433 HydrophobicContact CG1-CD1 3.55Å; V409-I433 HydrophobicContact CG1-CG1 4.22Å; L413-I433 HydrophobicContact CD1-CD1 3.96Å; L429-I433 WeakPolarHBondContact O-CB 3.13Å; L429-I433 VanDerWaalsContact O-CD1 3.26Å; L429-I433 WeakPolarHBondContact O-CD1 3.45Å; L429-I433 WeakPolarHBondContact O-CG1 3.47Å; L429-I433 PolarHBondContact O-N 3.16Å; H430-I433 PolarHBondContact O-N 3.36Å; I433-K436 PolarHBondContact O-N 3.29Å; I433-T437 PolarHBondContact O-N 3.14Å; I433-T437 PolarHBondContact O-OG1 3.4Å; I433-F459 HydrophobicContact CB-CZ 4.4Å; I433-F459 HydrophobicContact CG2-CE1 4.23Å; I433-F459 HydrophobicContact CG2-CZ 3.9Å
434	V	90.9	Very high	88.4	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.3	-42.4	177.7	178.2	0	0	0	0	111.4	H430 D431 K436 T437 L438 F453 C457 F459 M460 L465 I468	H430-V434 WeakPolarHBondContact O-CG2 3.49Å; H430-V434 PolarHBondContact O-N 2.92Å; D431-V434 PolarHBondContact O-N 3.26Å; V434-K436 VanDerWaalsContact C-N 3.34Å; V434-K436 PolarHBondContact O-N 3.06Å; V434-T437 PolarHBondContact O-N 2.93Å; V434-T437 PolarHBondContact O-OG1 3.27Å; V434-L438 HydrophobicContact CG1-CD1 4.17Å; V434-L438 WeakPolarHBondContact O-CB 3.12Å; V434-L438 WeakPolarHBondContact O-CG 3.47Å; V434-L438 PolarHBondContact O-N 3.26Å; V434-F453 HydrophobicContact CG1-CE2 4.4Å; V434-F453 HydrophobicContact CG1-CZ 3.76Å; V434-C457 HydrophobicContact CG2-CB 4.43Å; V434-F459 HydrophobicContact CG2-CE2 3.8Å; V434-F459 HydrophobicContact CG2-CZ 3.69Å; V434-M460 HydrophobicContact CG2-CE 4.12Å; V434-M460 HydrophobicContact CG2-SD 4.1Å; V434-L465 HydrophobicContact CB-CD2 4.37Å; V434-L465 HydrophobicContact CG1-CD2 3.7Å; V434-L465 HydrophobicContact CG2-CD2 3.62Å; V434-I468 HydrophobicContact CB-CD1 4.03Å; V434-I468 HydrophobicContact CB-CG2 4.4Å; V434-I468 HydrophobicContact CG1-CB 4.2Å; V434-I468 HydrophobicContact CG1-CD1 3.96Å; V434-I468 HydrophobicContact CG1-CG2 3.82Å; V434-I468 HydrophobicContact CG2-CD1 4.35Å
435	A	87.7	Confident	88.2	Confident	4 Å²	4	24.1 Å²	24.1	3%	0.033	13%	0.126	C	C	.	.	H	α-helix	trans	-63.8	-38.8	174.8	0	0	0	0	0	112.4	L334 D431 V432 L439 L472	L334-A435 HydrophobicContact CB-CB 3.85Å; L334-A435 WeakPolarHBondContact O-CB 3.29Å; D431-A435 WeakPolarHBondContact O-CB 3.33Å; D431-A435 PolarHBondContact O-N 2.84Å; V432-A435 PolarHBondContact O-N 3.47Å; A435-L439 VanDerWaalsContact O-CB 3.25Å; A435-L439 WeakPolarHBondContact O-CB 3.41Å; A435-L439 PolarHBondContact O-N 2.95Å; A435-L472 HydrophobicContact CB-CD1 4.48Å
436	K	86	Confident	87.9	Confident	8 Å²	8	30.8 Å²	30.8	4%	0.035	16%	0.158	C	C	.	.	H	α-helix	trans	-70.1	-39.5	176.3	-76.1	-81.7	-173.3	160.6	0	112.7	L334 L396 E397 L405 V432 I433 V434 L439 Q440	L334-K436 HydrophobicContact CD1-CD 4.07Å; L334-K436 HydrophobicContact CD1-CG 3.89Å; L396-K436 HydrophobicContact CD2-CB 4.31Å; L396-K436 HydrophobicContact CD2-CG 4.26Å; L396-K436 WeakPolarHBondContact O-CD 3.28Å; L396-K436 VanDerWaalsContact O-CE 3.23Å; L396-K436 WeakPolarHBondContact O-CE 3.37Å; L396-K436 PolarHBondContact O-NZ 3.05Å; E397-K436 WeakPolarHBondContact OE1-CE 3.23Å; E397-K436 IonicContact OE1-NZ 3.63Å; E397-K436 PolarHBondContact OE1-NZ 2.91Å; E397-K436 IonicContact OE2-NZ 3.62Å; E397-K436 PolarHBondContact OE2-NZ 3.2Å; L405-K436 HydrophobicContact CD2-CB 3.92Å; V432-K436 HydrophobicContact CG1-CG 4.29Å; V432-K436 VanDerWaalsContact O-CB 3.31Å; V432-K436 WeakPolarHBondContact O-CB 3.32Å; V432-K436 VanDerWaalsContact O-CG 3.26Å; V432-K436 WeakPolarHBondContact O-CG 3.2Å; V432-K436 PolarHBondContact O-N 2.9Å; I433-K436 PolarHBondContact O-N 3.29Å; V434-K436 VanDerWaalsContact C-N 3.34Å; V434-K436 PolarHBondContact O-N 3.06Å; K436-L439 PolarHBondContact O-N 3.24Å; K436-Q440 WeakPolarHBondContact O-CB 3.41Å; K436-Q440 WeakPolarHBondContact O-CG 3.33Å; K436-Q440 PolarHBondContact O-N 3.19Å
437	T	89.2	Confident	87.8	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.006	17%	0.173	C	C	.	.	H	α-helix	trans	-63.1	-48	173.5	54.5	0	0	0	0	110.5	L405 I433 V434 L439 Q440 L441	L405-T437 HydrophobicContact CB-CG2 3.94Å; L405-T437 HydrophobicContact CD2-CG2 3.57Å; L405-T437 HydrophobicContact CG-CG2 4.39Å; I433-T437 PolarHBondContact O-N 3.14Å; I433-T437 PolarHBondContact O-OG1 3.4Å; V434-T437 PolarHBondContact O-N 2.93Å; V434-T437 PolarHBondContact O-OG1 3.27Å; T437-L439 PolarHBondContact O-N 3.18Å; T437-Q440 PolarHBondContact O-N 2.82Å; T437-L441 VanDerWaalsContact O-CB 3.3Å; T437-L441 WeakPolarHBondContact O-CB 3.28Å; T437-L441 WeakPolarHBondContact O-CD1 3.13Å; T437-L441 WeakPolarHBondContact O-CG 3.5Å; T437-L441 PolarHBondContact O-N 3.43Å
438	L	87.9	Confident	87.9	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.5	-45.2	176.8	-75	170.4	0	0	0	112.7	V434 Q440 L441 S442 F453 I468 V469 L472 L478 F491	V434-L438 HydrophobicContact CG1-CD1 4.17Å; V434-L438 WeakPolarHBondContact O-CB 3.12Å; V434-L438 WeakPolarHBondContact O-CG 3.47Å; V434-L438 PolarHBondContact O-N 3.26Å; L438-Q440 PolarHBondContact O-N 3.39Å; L438-L441 PolarHBondContact O-N 3.36Å; L438-S442 WeakPolarHBondContact O-CB 3.34Å; L438-S442 PolarHBondContact O-N 3.49Å; L438-S442 PolarHBondContact O-OG 2.82Å; L438-F453 HydrophobicContact CD1-CE2 4.37Å; L438-F453 HydrophobicContact CD1-CZ 3.78Å; L438-F453 HydrophobicContact CD2-CD2 4.16Å; L438-F453 HydrophobicContact CD2-CE1 4.17Å; L438-F453 HydrophobicContact CD2-CE2 3.53Å; L438-F453 HydrophobicContact CD2-CZ 3.54Å; L438-F453 HydrophobicContact CG-CE2 3.7Å; L438-F453 HydrophobicContact CG-CZ 3.63Å; L438-I468 HydrophobicContact CD1-CG2 4.37Å; L438-V469 HydrophobicContact CD1-CG2 3.63Å; L438-V469 HydrophobicContact CD2-CG2 4.03Å; L438-V469 HydrophobicContact CG-CG2 4.49Å; L438-L472 HydrophobicContact CB-CD1 4.32Å; L438-L472 HydrophobicContact CD1-CD1 3.56Å; L438-L478 HydrophobicContact CB-CD1 4.38Å; L438-F491 HydrophobicContact CD2-CZ 4.39Å
439	L	82.9	Confident	88	Confident	19 Å²	19	31.1 Å²	31.1	10%	0.099	16%	0.163	C	C	.	.	H	α-helix	trans	-67.2	-31.8	178.8	-179.8	63.5	0	0	0	113.6	A435 K436 T437 S442 Q443 L478 L508	A435-L439 VanDerWaalsContact O-CB 3.25Å; A435-L439 WeakPolarHBondContact O-CB 3.41Å; A435-L439 PolarHBondContact O-N 2.95Å; K436-L439 PolarHBondContact O-N 3.24Å; T437-L439 PolarHBondContact O-N 3.18Å; L439-S442 PolarHBondContact O-OG 3.35Å; L439-S442 VanDerWaalsContact O-OG 3.11Å; L439-Q443 PolarHBondContact O-NE2 3.04Å; L439-L478 HydrophobicContact CD1-CD2 3.9Å; L439-L508 HydrophobicContact CD2-CB 4.02Å; L439-L508 HydrophobicContact CD2-CD1 3.78Å
440	Q	85.4	Confident	87.9	Confident	16 Å²	16	32.1 Å²	32.1	8%	0.075	17%	0.168	C	C	.	.	H	α-helix	trans	-78.9	-37.8	173.6	-70.7	-171.8	2.1	0	0	111.4	D399 F400 P402 K436 T437 L438 Q443	D399-Q440 PolarHBondContact O-NE2 3.07Å; D399-Q440 VanDerWaalsContact O-NE2 3.1Å; F400-Q440 HydrophobicContact CD2-CB 4.26Å; F400-Q440 HydrophobicContact CD2-CG 3.79Å; F400-Q440 HydrophobicContact CE2-CB 3.74Å; F400-Q440 HydrophobicContact CE2-CG 3.71Å; F400-Q440 HydrophobicContact CZ-CB 4.12Å; F400-Q440 WeakPolarHBondContact CZ-O 3.2Å; P402-Q440 HydrophobicContact CB-CB 3.74Å; P402-Q440 HydrophobicContact CG-CB 4.08Å; P402-Q440 VanDerWaalsContact N-OE1 3.14Å; K436-Q440 WeakPolarHBondContact O-CB 3.41Å; K436-Q440 WeakPolarHBondContact O-CG 3.33Å; K436-Q440 PolarHBondContact O-N 3.19Å; T437-Q440 PolarHBondContact O-N 2.82Å; L438-Q440 PolarHBondContact O-N 3.39Å; Q440-Q443 PolarHBondContact O-N 2.99Å
441	L	88.6	Confident	87.8	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.4	-40.6	176	-72.3	163.1	0	0	0	111.5	P402 L403 T437 L438 Q443 V444 Y445 L448 L456 F491	P402-L441 HydrophobicContact CB-CD2 3.86Å; P402-L441 HydrophobicContact CB-CG 3.86Å; L403-L441 HydrophobicContact CD2-CD2 4.35Å; T437-L441 VanDerWaalsContact O-CB 3.3Å; T437-L441 WeakPolarHBondContact O-CB 3.28Å; T437-L441 WeakPolarHBondContact O-CD1 3.13Å; T437-L441 WeakPolarHBondContact O-CG 3.5Å; T437-L441 PolarHBondContact O-N 3.43Å; L438-L441 PolarHBondContact O-N 3.36Å; L441-Q443 PolarHBondContact O-N 3.21Å; L441-Q443 VanDerWaalsContact O-N 3.09Å; L441-V444 PolarHBondContact O-N 3.44Å; L441-Y445 HydrophobicContact CD2-CD2 3.69Å; L441-Y445 HydrophobicContact CD2-CE2 3.66Å; L441-Y445 PolarHBondContact O-N 2.99Å; L441-L448 HydrophobicContact CD1-CD2 3.9Å; L441-L456 HydrophobicContact CD1-CD1 4.03Å; L441-L456 HydrophobicContact CD2-CD1 4.31Å; L441-F491 HydrophobicContact CB-CE2 4.41Å; L441-F491 HydrophobicContact CB-CZ 4.17Å
442	S	83.7	Confident	87.9	Confident	26 Å²	26	37 Å²	37	18%	0.182	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-12	179.2	70.4	0	0	0	0	114.9	L438 L439	L438-S442 WeakPolarHBondContact O-CB 3.34Å; L438-S442 PolarHBondContact O-N 3.49Å; L438-S442 PolarHBondContact O-OG 2.82Å; L439-S442 PolarHBondContact O-OG 3.35Å; L439-S442 VanDerWaalsContact O-OG 3.11Å
443	Q	78.4	Confident	88	Confident	34 Å²	34	37 Å²	37	16%	0.159	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-11.7	175	-68.5	169.4	50.4	0	0	113	F400 L439 Q440 L441 V509	F400-Q443 HydrophobicContact CE2-CB 4.35Å; F400-Q443 HydrophobicContact CZ-CB 4.14Å; L439-Q443 PolarHBondContact O-NE2 3.04Å; Q440-Q443 PolarHBondContact O-N 2.99Å; L441-Q443 PolarHBondContact O-N 3.21Å; L441-Q443 VanDerWaalsContact O-N 3.09Å; Q443-V509 VanDerWaalsContact OE1-CG1 3.29Å
444	V	85.5	Confident	88	Confident	95 Å²	95	38.8 Å²	38.8	58%	0.576	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.7	-39.8	-171.9	178.9	0	0	0	0	112.1	F400 L441	F400-V444 HydrophobicContact CE1-CG2 3.84Å; F400-V444 HydrophobicContact CZ-CG2 3.79Å; L441-V444 PolarHBondContact O-N 3.44Å
445	Y	87.1	Confident	88	Confident	77 Å²	77	46 Å²	46	30%	0.302	24%	0.235	S	C	.	.			trans	-100	137.3	-177.9	-72.2	-102.5	0	0	0	111	L441 L448 F491	L441-Y445 HydrophobicContact CD2-CD2 3.69Å; L441-Y445 HydrophobicContact CD2-CE2 3.66Å; L441-Y445 PolarHBondContact O-N 2.99Å; Y445-L448 HydrophobicContact CD1-CD1 4.44Å; Y445-F491 WeakPolarHBondContact O-CB 3.28Å; Y445-F491 WeakPolarHBondContact O-CD2 3.3Å
446	Q	86.3	Confident	88.1	Confident	154 Å²	154	47.4 Å²	47.4	72%	0.72	24%	0.242	S	C	*	.	S	Bend	trans	-89.3	-29.4	166.5	-172.8	177.6	6.8	0	0	111.7	F491	Q446-F491 PolarHBondContact O-N 2.66Å
447	S	89.7	Confident	88.3	Confident	63 Å²	63	47.1 Å²	47.1	44%	0.441	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	141.2	177.4	55.9	0	0	0	0	110.1	I489	S447-I489 CarbonylContact C-O 3.59Å; S447-I489 VanDerWaalsContact CA-O 3.32Å; S447-I489 WeakPolarHBondContact CA-O 3.26Å
448	L	91.8	Very high	88.2	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	133.5	-178.3	175.9	66.4	0	0	0	109.2	L441 Y445 E452 F453 A488 I489 F491	L441-L448 HydrophobicContact CD1-CD2 3.9Å; Y445-L448 HydrophobicContact CD1-CD1 4.44Å; L448-E452 HydrophobicContact CD1-CB 3.94Å; L448-F453 HydrophobicContact CD2-CB 3.97Å; L448-F453 HydrophobicContact CD2-CD2 4.38Å; L448-F453 HydrophobicContact CD2-CG 4.44Å; L448-F453 HydrophobicContact CG-CB 4.43Å; L448-A488 WeakPolarHBondContact O-CA 3.19Å; L448-I489 PolarHBondContact N-O 3.35Å; L448-I489 PolarHBondContact O-N 3.13Å; L448-F491 HydrophobicContact CB-CE2 4.03Å; L448-F491 HydrophobicContact CD2-CE2 4.36Å; L448-F491 HydrophobicContact CD2-CZ 4.49Å
449	N	92.8	Very high	88.2	Confident	75 Å²	75	53.3 Å²	53.3	40%	0.401	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	140.6	175.7	-61.9	-44.4	0	0	0	110	D451 E452 F453	N449-D451 VanDerWaalsContact C-N 3.28Å; N449-D451 PolarHBondContact O-N 3.46Å; N449-E452 HydrophobicContact CB-CB 4.35Å; N449-E452 HydrophobicContact CB-CG 4.09Å; N449-E452 PolarHBondContact ND2-OE1 3.48Å; N449-E452 WeakPolarHBondContact O-CB 3.34Å; N449-E452 PolarHBondContact O-N 3.46Å; N449-F453 PolarHBondContact O-N 3.5Å
450	F	90.6	Very high	88.4	Confident	21 Å²	21	53.3 Å²	53.3	9%	0.092	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-37.2	-178	-165.9	-102.1	0	0	0	111.3	E452 F453 V454 P462 E466 Q487 I489	F450-E452 VanDerWaalsContact C-N 3.25Å; F450-E452 PolarHBondContact O-N 3.41Å; F450-F453 HydrophobicContact CD2-CD1 4.38Å; F450-F453 HydrophobicContact CE2-CD1 4.22Å; F450-F453 WeakPolarHBondContact O-CB 3.47Å; F450-F453 PolarHBondContact O-N 3.19Å; F450-F453 VanDerWaalsContact O-N 3.14Å; F450-V454 HydrophobicContact CD1-CG2 4.04Å; F450-V454 HydrophobicContact CE1-CG2 3.87Å; F450-V454 HydrophobicContact CZ-CG2 4.46Å; F450-V454 WeakPolarHBondContact O-CG2 3.48Å; F450-V454 PolarHBondContact O-N 3.05Å; F450-P462 HydrophobicContact CE1-CB 4.05Å; F450-E466 HydrophobicContact CE2-CB 4.26Å; F450-E466 HydrophobicContact CE2-CG 4.49Å; F450-E466 HydrophobicContact CZ-CB 4.03Å; F450-Q487 HydrophobicContact CB-CB 4.46Å; F450-Q487 VanDerWaalsContact CB-O 3.31Å; F450-Q487 WeakPolarHBondContact CB-O 3.43Å; F450-Q487 PolarHBondContact N-O 2.95Å; F450-I489 HydrophobicContact CD2-CD1 4.02Å; F450-I489 HydrophobicContact CD2-CG1 4.22Å
451	D	91	Very high	88.7	Confident	99 Å²	99	58.4 Å²	58.4	53%	0.529	30%	0.299	S	S	.	.	H	α-helix	trans	-61.2	-29.5	171.8	-68.1	-16.7	0	0	0	113.6	N449 K455	N449-D451 VanDerWaalsContact C-N 3.28Å; N449-D451 PolarHBondContact O-N 3.46Å; D451-K455 WeakPolarHBondContact O-CD 3.47Å; D451-K455 VanDerWaalsContact O-CE 3.3Å; D451-K455 WeakPolarHBondContact O-CE 3.43Å; D451-K455 WeakPolarHBondContact O-CG 3.35Å; D451-K455 PolarHBondContact O-N 2.69Å
452	E	90.3	Very high	88.7	Confident	80 Å²	80	61.2 Å²	61.2	37%	0.374	32%	0.318	S	S	.	.	H	α-helix	trans	-76.6	-39.6	174.2	-71.2	161.1	-157.4	0	0	110.7	L448 N449 F450 K455 L456	L448-E452 HydrophobicContact CD1-CB 3.94Å; N449-E452 HydrophobicContact CB-CB 4.35Å; N449-E452 HydrophobicContact CB-CG 4.09Å; N449-E452 PolarHBondContact ND2-OE1 3.48Å; N449-E452 WeakPolarHBondContact O-CB 3.34Å; N449-E452 PolarHBondContact O-N 3.46Å; F450-E452 VanDerWaalsContact C-N 3.25Å; F450-E452 PolarHBondContact O-N 3.41Å; E452-K455 PolarHBondContact O-N 3.22Å; E452-L456 WeakPolarHBondContact O-CG 3.38Å; E452-L456 PolarHBondContact O-N 2.9Å
453	F	91.1	Very high	89.1	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-42.7	174.4	-178.8	-130.7	0	0	0	112.4	V434 L438 L448 N449 F450 K455 L456 C457 L465 V469 I489	V434-F453 HydrophobicContact CG1-CE2 4.4Å; V434-F453 HydrophobicContact CG1-CZ 3.76Å; L438-F453 HydrophobicContact CD1-CE2 4.37Å; L438-F453 HydrophobicContact CD1-CZ 3.78Å; L438-F453 HydrophobicContact CD2-CD2 4.16Å; L438-F453 HydrophobicContact CD2-CE1 4.17Å; L438-F453 HydrophobicContact CD2-CE2 3.53Å; L438-F453 HydrophobicContact CD2-CZ 3.54Å; L438-F453 HydrophobicContact CG-CE2 3.7Å; L438-F453 HydrophobicContact CG-CZ 3.63Å; L448-F453 HydrophobicContact CD2-CB 3.97Å; L448-F453 HydrophobicContact CD2-CD2 4.38Å; L448-F453 HydrophobicContact CD2-CG 4.44Å; L448-F453 HydrophobicContact CG-CB 4.43Å; N449-F453 PolarHBondContact O-N 3.5Å; F450-F453 HydrophobicContact CD2-CD1 4.38Å; F450-F453 HydrophobicContact CE2-CD1 4.22Å; F450-F453 WeakPolarHBondContact O-CB 3.47Å; F450-F453 PolarHBondContact O-N 3.19Å; F450-F453 VanDerWaalsContact O-N 3.14Å; F453-K455 PolarHBondContact O-N 2.97Å; F453-L456 PolarHBondContact O-N 2.79Å; F453-C457 PolarHBondContact O-N 3.2Å; F453-C457 VanDerWaalsContact O-N 3.17Å; F453-L465 HydrophobicContact CD1-CB 4.49Å; F453-L465 HydrophobicContact CE1-CB 3.87Å; F453-L465 HydrophobicContact CE1-CD2 4.31Å; F453-L465 HydrophobicContact CZ-CD2 4.18Å; F453-V469 HydrophobicContact CE1-CG2 3.82Å; F453-V469 HydrophobicContact CZ-CG2 4.26Å; F453-I489 HydrophobicContact CB-CD1 4.43Å; F453-I489 HydrophobicContact CD1-CD1 3.83Å; F453-I489 HydrophobicContact CE1-CD1 4.36Å; F453-I489 HydrophobicContact CG-CD1 4.24Å
454	V	91.5	Very high	89.7	Confident	38 Å²	38	67.2 Å²	67.2	23%	0.23	34%	0.341	C	S	.	.	H	α-helix	trans	-61.6	-41.3	173.7	173.2	0	0	0	0	111.4	F450 L456 C457 P462 L465	F450-V454 HydrophobicContact CD1-CG2 4.04Å; F450-V454 HydrophobicContact CE1-CG2 3.87Å; F450-V454 HydrophobicContact CZ-CG2 4.46Å; F450-V454 WeakPolarHBondContact O-CG2 3.48Å; F450-V454 PolarHBondContact O-N 3.05Å; V454-L456 VanDerWaalsContact C-N 3.28Å; V454-L456 PolarHBondContact O-N 3.37Å; V454-C457 CarbonylContact O-C 3.56Å; V454-C457 PolarHBondContact O-N 2.87Å; V454-P462 HydrophobicContact CG1-CG 4.23Å; V454-P462 HydrophobicContact CG2-CB 4.12Å; V454-P462 HydrophobicContact CG2-CG 4.16Å; V454-L465 HydrophobicContact CG2-CD1 4.1Å
455	K	90.5	Very high	90	Very high	153 Å²	153	62.7 Å²	62.7	67%	0.665	31%	0.313	S	S	*	.	H	α-helix	trans	-63.6	-30.9	175.3	-72	160.8	-162.6	158.5	0	113.1	D451 E452 F453	D451-K455 WeakPolarHBondContact O-CD 3.47Å; D451-K455 VanDerWaalsContact O-CE 3.3Å; D451-K455 WeakPolarHBondContact O-CE 3.43Å; D451-K455 WeakPolarHBondContact O-CG 3.35Å; D451-K455 PolarHBondContact O-N 2.69Å; E452-K455 PolarHBondContact O-N 3.22Å; F453-K455 PolarHBondContact O-N 2.97Å
456	L	90.6	Very high	90.2	Very high	33 Å²	33	61.8 Å²	61.8	17%	0.173	31%	0.312	C	S	.	.	H	α-helix	trans	-76.9	-22.8	175.8	-70.2	173.6	0	0	0	113.4	L403 L441 E452 F453 V454 P458	L403-L456 HydrophobicContact CB-CD2 4.46Å; L403-L456 HydrophobicContact CD2-CD1 3.97Å; L403-L456 HydrophobicContact CD2-CD2 3.92Å; L441-L456 HydrophobicContact CD1-CD1 4.03Å; L441-L456 HydrophobicContact CD2-CD1 4.31Å; E452-L456 WeakPolarHBondContact O-CG 3.38Å; E452-L456 PolarHBondContact O-N 2.9Å; F453-L456 PolarHBondContact O-N 2.79Å; V454-L456 VanDerWaalsContact C-N 3.28Å; V454-L456 PolarHBondContact O-N 3.37Å; L456-P458 VanDerWaalsContact C-CD 3.43Å
457	C	89.6	Confident	90.4	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.007	31%	0.305	C	S	.	.			trans	-127	57.7	-178.6	-67.5	0	0	0	0	112.5	V434 F453 V454 F459 M460 L465	V434-C457 HydrophobicContact CG2-CB 4.43Å; F453-C457 PolarHBondContact O-N 3.2Å; F453-C457 VanDerWaalsContact O-N 3.17Å; V454-C457 CarbonylContact O-C 3.56Å; V454-C457 PolarHBondContact O-N 2.87Å; C457-F459 HydrophobicContact CB-CE1 3.9Å; C457-F459 HydrophobicContact CB-CZ 4.01Å; C457-F459 PolarHBondContact O-N 3.13Å; C457-M460 PolarHBondContact O-N 3.48Å; C457-L465 HydrophobicContact CB-CD1 4.1Å; C457-L465 HydrophobicContact CB-CD2 3.71Å
458	P	87	Confident	90.3	Very high	81 Å²	81	59.4 Å²	59.4	53%	0.526	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-2	-169.3	32.1	-38.8	0	0	0	114.8	L456	L456-P458 VanDerWaalsContact C-CD 3.43Å
459	F	87.4	Confident	90.2	Very high	50 Å²	50	59.3 Å²	59.3	22%	0.219	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-3.3	179.1	56.8	-94.7	0	0	0	113.7	W406 H430 I433 V434 C457	W406-F459 AromaticContact CD2-CD1 3.61Å; W406-F459 HydrophobicContact CD2-CD1 3.61Å; W406-F459 AromaticContact CD2-CE1 3.93Å; W406-F459 HydrophobicContact CD2-CE1 3.93Å; W406-F459 AromaticContact CE2-CD1 3.93Å; W406-F459 AromaticContact CE3-CD1 3.25Å; W406-F459 HydrophobicContact CE3-CD1 3.25Å; W406-F459 AromaticContact CE3-CE1 3.41Å; W406-F459 HydrophobicContact CE3-CE1 3.41Å; W406-F459 VanDerWaalsContact CE3-CE1 3.41Å; W406-F459 HydrophobicContact CE3-CG 4.22Å; W406-F459 HydrophobicContact CE3-CZ 4.47Å; W406-F459 HydrophobicContact CG-CD1 4.46Å; W406-F459 HydrophobicContact CH2-CB 3.69Å; W406-F459 AromaticContact CH2-CD1 3.63Å; W406-F459 HydrophobicContact CH2-CD1 3.63Å; W406-F459 AromaticContact CH2-CG 3.9Å; W406-F459 HydrophobicContact CH2-CG 3.9Å; W406-F459 HydrophobicContact CZ2-CB 4.08Å; W406-F459 AromaticContact CZ2-CD1 3.96Å; W406-F459 HydrophobicContact CZ2-CD1 3.96Å; W406-F459 HydrophobicContact CZ2-CG 4.44Å; W406-F459 HydrophobicContact CZ3-CB 4.1Å; W406-F459 AromaticContact CZ3-CD1 3.25Å; W406-F459 HydrophobicContact CZ3-CD1 3.25Å; W406-F459 AromaticContact CZ3-CE1 3.76Å; W406-F459 HydrophobicContact CZ3-CE1 3.76Å; W406-F459 AromaticContact CZ3-CG 3.76Å; W406-F459 HydrophobicContact CZ3-CG 3.76Å; H430-F459 HydrophobicContact CB-CD2 4.12Å; H430-F459 HydrophobicContact CB-CE2 3.83Å; H430-F459 AromaticContact CE1-CD2 3.66Å; H430-F459 AromaticContact CE1-CG 3.89Å; H430-F459 AromaticContact CG-CD2 3.74Å; H430-F459 AromaticContact CG-CE2 3.88Å; H430-F459 AromaticContact ND1-CD2 3Å; H430-F459 WeakPolarHBondContact ND1-CD2 3.39Å; H430-F459 AromaticContact ND1-CE2 3.28Å; H430-F459 VanDerWaalsContact ND1-CE2 3.28Å; H430-F459 WeakPolarHBondContact ND1-CE2 3.48Å; H430-F459 AromaticContact ND1-CG 3.61Å; I433-F459 HydrophobicContact CB-CZ 4.4Å; I433-F459 HydrophobicContact CG2-CE1 4.23Å; I433-F459 HydrophobicContact CG2-CZ 3.9Å; V434-F459 HydrophobicContact CG2-CE2 3.8Å; V434-F459 HydrophobicContact CG2-CZ 3.69Å; C457-F459 HydrophobicContact CB-CE1 3.9Å; C457-F459 HydrophobicContact CB-CZ 4.01Å; C457-F459 PolarHBondContact O-N 3.13Å
460	M	88.2	Confident	90	Very high	20 Å²	20	59.6 Å²	59.6	10%	0.099	29%	0.288	C	S	.	.	S	Bend	trans	-132.3	141.1	-172.7	-172.6	172.5	-71.4	0	0	111.7	H430 D431 V434 C457 R464 L465 I468	H430-M460 HydrophobicContact CB-CE 4.04Å; D431-M460 WeakPolarHBondContact OD1-CE 3.33Å; V434-M460 HydrophobicContact CG2-CE 4.12Å; V434-M460 HydrophobicContact CG2-SD 4.1Å; C457-M460 PolarHBondContact O-N 3.48Å; M460-R464 HydrophobicContact CE-CG 4.36Å; M460-R464 HydrophobicContact CG-CB 3.83Å; M460-R464 HydrophobicContact CG-CG 4Å; M460-R464 HydrophobicContact SD-CB 3.95Å; M460-R464 HydrophobicContact SD-CG 3.56Å; M460-R464 VanDerWaalsContact SD-CG 3.56Å; M460-L465 HydrophobicContact CB-CD2 3.93Å; M460-L465 HydrophobicContact CB-CG 4Å; M460-L465 HydrophobicContact CG-CD2 4.06Å; M460-L465 HydrophobicContact CG-CG 3.97Å; M460-L465 HydrophobicContact SD-CD2 3.71Å; M460-L465 HydrophobicContact SD-CG 4.1Å; M460-I468 HydrophobicContact CE-CD1 3.92Å; M460-I468 HydrophobicContact SD-CD1 3.56Å; M460-I468 VanDerWaalsContact SD-CD1 3.56Å
461	E	90.2	Very high	89.7	Confident	122 Å²	122	63.1 Å²	63.1	57%	0.57	31%	0.305	S	S	*	.			trans	-59.7	136.5	175.2	-173.8	-175.7	-172.5	0	0	111.2	I463 R464 L465	E461-I463 HydrophobicContact CG-CB 4.38Å; E461-I463 PolarHBondContact O-N 3.34Å; E461-I463 VanDerWaalsContact O-N 3.13Å; E461-R464 PolarHBondContact O-N 2.95Å; E461-L465 PolarHBondContact O-N 3.41Å
462	P	90.1	Very high	89.2	Confident	59 Å²	59	58.6 Å²	58.6	38%	0.383	28%	0.281	S	S	.	.	H	α-helix	trans	-52.5	-37.2	179.9	-29.1	35.9	0	0	0	114.2	F450 V454 R464 L465 E466	F450-P462 HydrophobicContact CE1-CB 4.05Å; V454-P462 HydrophobicContact CG1-CG 4.23Å; V454-P462 HydrophobicContact CG2-CB 4.12Å; V454-P462 HydrophobicContact CG2-CG 4.16Å; P462-R464 VanDerWaalsContact C-N 3.32Å; P462-R464 PolarHBondContact O-N 3.14Å; P462-L465 WeakPolarHBondContact O-CB 3.24Å; P462-L465 PolarHBondContact O-N 3.42Å; P462-E466 PolarHBondContact O-N 3.32Å
463	I	91.6	Very high	88.7	Confident	92 Å²	92	57.1 Å²	57.1	47%	0.472	28%	0.275	S	S	.	.	H	α-helix	trans	-64.5	-35.4	177.8	-59.8	177.5	0	0	0	111.5	E461 R467	E461-I463 HydrophobicContact CG-CB 4.38Å; E461-I463 PolarHBondContact O-N 3.34Å; E461-I463 VanDerWaalsContact O-N 3.13Å; I463-R467 WeakPolarHBondContact O-CG 3.22Å; I463-R467 PolarHBondContact O-N 2.98Å; I463-R467 VanDerWaalsContact O-N 3.13Å
464	R	90.6	Very high	88.1	Confident	95 Å²	95	62.9 Å²	62.9	36%	0.358	30%	0.301	S	S	.	.	H	α-helix	trans	-77.1	-35.9	176.3	-173	-179.8	169.4	160.7	-1.3	111.6	D431 M460 E461 P462 E466 R467 I468	D431-R464 IonicContact OD1-CZ 2.63Å; D431-R464 IonicContact OD1-NE 3.06Å; D431-R464 PolarHBondContact OD1-NE 2.72Å; D431-R464 IonicContact OD1-NH2 2.68Å; D431-R464 PolarHBondContact OD1-NH2 3.05Å; D431-R464 IonicContact OD2-NH2 3.59Å; D431-R464 PolarHBondContact OD2-NH2 3.49Å; M460-R464 HydrophobicContact CE-CG 4.36Å; M460-R464 HydrophobicContact CG-CB 3.83Å; M460-R464 HydrophobicContact CG-CG 4Å; M460-R464 HydrophobicContact SD-CB 3.95Å; M460-R464 HydrophobicContact SD-CG 3.56Å; M460-R464 VanDerWaalsContact SD-CG 3.56Å; E461-R464 PolarHBondContact O-N 2.95Å; P462-R464 VanDerWaalsContact C-N 3.32Å; P462-R464 PolarHBondContact O-N 3.14Å; R464-E466 VanDerWaalsContact C-N 3.32Å; R464-E466 PolarHBondContact O-N 3.41Å; R464-R467 PolarHBondContact O-N 2.8Å; R464-I468 WeakPolarHBondContact O-CG1 3.27Å; R464-I468 PolarHBondContact O-N 2.91Å; R464-I468 VanDerWaalsContact O-N 3.09Å
465	L	91.8	Very high	87.2	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.7	-44	170.6	-70.3	174.1	0	0	0	111.4	V434 F453 V454 C457 M460 E461 P462 I468 V469	V434-L465 HydrophobicContact CB-CD2 4.37Å; V434-L465 HydrophobicContact CG1-CD2 3.7Å; V434-L465 HydrophobicContact CG2-CD2 3.62Å; F453-L465 HydrophobicContact CD1-CB 4.49Å; F453-L465 HydrophobicContact CE1-CB 3.87Å; F453-L465 HydrophobicContact CE1-CD2 4.31Å; F453-L465 HydrophobicContact CZ-CD2 4.18Å; V454-L465 HydrophobicContact CG2-CD1 4.1Å; C457-L465 HydrophobicContact CB-CD1 4.1Å; C457-L465 HydrophobicContact CB-CD2 3.71Å; M460-L465 HydrophobicContact CB-CD2 3.93Å; M460-L465 HydrophobicContact CB-CG 4Å; M460-L465 HydrophobicContact CG-CD2 4.06Å; M460-L465 HydrophobicContact CG-CG 3.97Å; M460-L465 HydrophobicContact SD-CD2 3.71Å; M460-L465 HydrophobicContact SD-CG 4.1Å; E461-L465 PolarHBondContact O-N 3.41Å; P462-L465 WeakPolarHBondContact O-CB 3.24Å; P462-L465 PolarHBondContact O-N 3.42Å; L465-I468 PolarHBondContact O-N 2.82Å; L465-V469 WeakPolarHBondContact O-CG2 3.34Å; L465-V469 PolarHBondContact O-N 2.9Å
466	E	91	Very high	86.2	Confident	57 Å²	57	57.1 Å²	57.1	27%	0.266	28%	0.276	S	S	.	.	H	α-helix	trans	-62.6	-43.2	175.3	-163.9	-174.5	126.8	0	0	112.2	F450 P462 R464 I468 V469 L470 H484	F450-E466 HydrophobicContact CE2-CB 4.26Å; F450-E466 HydrophobicContact CE2-CG 4.49Å; F450-E466 HydrophobicContact CZ-CB 4.03Å; P462-E466 PolarHBondContact O-N 3.32Å; R464-E466 VanDerWaalsContact C-N 3.32Å; R464-E466 PolarHBondContact O-N 3.41Å; E466-I468 VanDerWaalsContact C-N 3.33Å; E466-I468 PolarHBondContact O-N 2.8Å; E466-V469 WeakPolarHBondContact O-CB 3.27Å; E466-V469 PolarHBondContact O-N 3.06Å; E466-V469 VanDerWaalsContact O-N 3.15Å; E466-L470 HydrophobicContact CG-CD1 4.33Å; E466-L470 WeakPolarHBondContact O-CG 3.2Å; E466-L470 PolarHBondContact O-N 3.19Å; E466-H484 IonicContact OE1-CE1 3.29Å; E466-H484 PolarHBondContact OE1-CE1 3.26Å; E466-H484 IonicContact OE2-CE1 2.67Å
467	R	90.8	Very high	85.2	Confident	156 Å²	156	56.4 Å²	56.4	59%	0.589	27%	0.272	S	S	*	.	H	α-helix	trans	-58.3	-42.1	175.9	-73.3	172.6	-169.1	-170.3	5.3	112.5	I463 R464 V469 L470 E471	I463-R467 WeakPolarHBondContact O-CG 3.22Å; I463-R467 PolarHBondContact O-N 2.98Å; I463-R467 VanDerWaalsContact O-N 3.13Å; R464-R467 PolarHBondContact O-N 2.8Å; R467-V469 VanDerWaalsContact C-N 3.34Å; R467-V469 PolarHBondContact O-N 3.2Å; R467-L470 PolarHBondContact O-N 3.29Å; R467-E471 WeakPolarHBondContact O-CG 3.19Å; R467-E471 PolarHBondContact O-N 3.45Å
468	I	87.9	Confident	84.5	Confident	12 Å²	12	56.6 Å²	56.6	6%	0.062	27%	0.273	C	S	.	.	H	α-helix	trans	-64.2	-39.2	177.2	-65.6	168.8	0	0	0	111.1	D431 V434 L438 M460 R464 L465 E466 E471 L472	D431-I468 HydrophobicContact CB-CD1 4.44Å; V434-I468 HydrophobicContact CB-CD1 4.03Å; V434-I468 HydrophobicContact CB-CG2 4.4Å; V434-I468 HydrophobicContact CG1-CB 4.2Å; V434-I468 HydrophobicContact CG1-CD1 3.96Å; V434-I468 HydrophobicContact CG1-CG2 3.82Å; V434-I468 HydrophobicContact CG2-CD1 4.35Å; L438-I468 HydrophobicContact CD1-CG2 4.37Å; M460-I468 HydrophobicContact CE-CD1 3.92Å; M460-I468 HydrophobicContact SD-CD1 3.56Å; M460-I468 VanDerWaalsContact SD-CD1 3.56Å; R464-I468 WeakPolarHBondContact O-CG1 3.27Å; R464-I468 PolarHBondContact O-N 2.91Å; R464-I468 VanDerWaalsContact O-N 3.09Å; L465-I468 PolarHBondContact O-N 2.82Å; E466-I468 VanDerWaalsContact C-N 3.33Å; E466-I468 PolarHBondContact O-N 2.8Å; I468-E471 PolarHBondContact O-N 3.45Å; I468-L472 HydrophobicContact CG2-CD1 4.06Å; I468-L472 WeakPolarHBondContact O-CD1 3.39Å; I468-L472 WeakPolarHBondContact O-CG 3.42Å; I468-L472 PolarHBondContact O-N 3Å
469	V	89.5	Confident	84.1	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-46	172.5	174.7	0	0	0	0	110.9	L438 F453 L465 E466 R467 L472 I473 I480 V482 I489	L438-V469 HydrophobicContact CD1-CG2 3.63Å; L438-V469 HydrophobicContact CD2-CG2 4.03Å; L438-V469 HydrophobicContact CG-CG2 4.49Å; F453-V469 HydrophobicContact CE1-CG2 3.82Å; F453-V469 HydrophobicContact CZ-CG2 4.26Å; L465-V469 WeakPolarHBondContact O-CG2 3.34Å; L465-V469 PolarHBondContact O-N 2.9Å; E466-V469 WeakPolarHBondContact O-CB 3.27Å; E466-V469 PolarHBondContact O-N 3.06Å; E466-V469 VanDerWaalsContact O-N 3.15Å; R467-V469 VanDerWaalsContact C-N 3.34Å; R467-V469 PolarHBondContact O-N 3.2Å; V469-L472 PolarHBondContact O-N 2.88Å; V469-I473 HydrophobicContact CG1-CD1 4.08Å; V469-I473 WeakPolarHBondContact O-CG1 3.45Å; V469-I473 PolarHBondContact O-N 3.4Å; V469-I473 VanDerWaalsContact O-N 3.13Å; V469-I480 HydrophobicContact CG1-CD1 4.26Å; V469-I480 HydrophobicContact CG1-CG2 3.89Å; V469-V482 HydrophobicContact CG1-CG2 3.92Å; V469-I489 HydrophobicContact CG2-CD1 4.19Å
470	L	88.5	Confident	84	Confident	80 Å²	80	51.6 Å²	51.6	42%	0.419	25%	0.245	S	C	.	.	H	α-helix	trans	-66.1	-36	178.5	-66.5	171.1	0	0	0	112.8	E466 R467 I473 H474	E466-L470 HydrophobicContact CG-CD1 4.33Å; E466-L470 WeakPolarHBondContact O-CG 3.2Å; E466-L470 PolarHBondContact O-N 3.19Å; R467-L470 PolarHBondContact O-N 3.29Å; L470-I473 HydrophobicContact CD2-CD1 4.4Å; L470-I473 PolarHBondContact O-N 3.13Å; L470-H474 VanDerWaalsContact O-CB 3.31Å; L470-H474 WeakPolarHBondContact O-CB 3.46Å; L470-H474 PolarHBondContact O-N 2.75Å
471	E	83.8	Confident	83.9	Confident	95 Å²	95	57.2 Å²	57.2	44%	0.444	27%	0.265	S	S	.	.	H	α-helix	trans	-66	-40	174.5	-76.2	176.1	-151	0	0	112.1	R467 I468 I473 H474 N475	R467-E471 WeakPolarHBondContact O-CG 3.19Å; R467-E471 PolarHBondContact O-N 3.45Å; I468-E471 PolarHBondContact O-N 3.45Å; E471-I473 VanDerWaalsContact C-N 3.34Å; E471-H474 PolarHBondContact O-N 2.96Å; E471-N475 WeakPolarHBondContact O-CB 3.21Å; E471-N475 PolarHBondContact O-N 2.82Å; E471-N475 PolarHBondContact O-ND2 3.05Å
472	L	80.4	Confident	83.9	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.026	25%	0.25	C	C	.	.	H	α-helix	trans	-66.6	-34.6	176	-71.7	162.5	0	0	0	112.3	P335 A435 L438 I468 V469 E477 L478	P335-L472 HydrophobicContact CG-CD2 4.14Å; A435-L472 HydrophobicContact CB-CD1 4.48Å; L438-L472 HydrophobicContact CB-CD1 4.32Å; L438-L472 HydrophobicContact CD1-CD1 3.56Å; I468-L472 HydrophobicContact CG2-CD1 4.06Å; I468-L472 WeakPolarHBondContact O-CD1 3.39Å; I468-L472 WeakPolarHBondContact O-CG 3.42Å; I468-L472 PolarHBondContact O-N 3Å; V469-L472 PolarHBondContact O-N 2.88Å; L472-E477 HydrophobicContact CD2-CB 4.32Å; L472-E477 PolarHBondContact O-N 3.35Å; L472-L478 HydrophobicContact CD1-CD1 4.42Å; L472-L478 PolarHBondContact O-N 3.15Å
473	I	81.2	Confident	84	Confident	49 Å²	49	52.9 Å²	52.9	25%	0.251	24%	0.244	S	C	.	.	H	α-helix	trans	-66.7	-51.7	170.9	-65.5	163	0	0	0	110.4	V469 L470 E471 N475 L476 I480 V482	V469-I473 HydrophobicContact CG1-CD1 4.08Å; V469-I473 WeakPolarHBondContact O-CG1 3.45Å; V469-I473 PolarHBondContact O-N 3.4Å; V469-I473 VanDerWaalsContact O-N 3.13Å; L470-I473 HydrophobicContact CD2-CD1 4.4Å; L470-I473 PolarHBondContact O-N 3.13Å; E471-I473 VanDerWaalsContact C-N 3.34Å; I473-N475 VanDerWaalsContact C-N 3.3Å; I473-N475 PolarHBondContact O-N 3.48Å; I473-L476 PolarHBondContact O-N 3.02Å; I473-I480 HydrophobicContact CD1-CB 3.83Å; I473-I480 HydrophobicContact CD1-CG2 3.96Å; I473-I480 WeakPolarHBondContact CD1-O 3.34Å; I473-I480 HydrophobicContact CG1-CB 3.71Å; I473-I480 HydrophobicContact CG1-CG2 4.39Å; I473-V482 HydrophobicContact CD1-CG2 4.25Å
474	H	78.5	Confident	84	Confident	121 Å²	121	53.1 Å²	53.1	56%	0.56	24%	0.243	S	C	*	.	H	α-helix	trans	-63.5	-33.5	-175.6	-178.3	75.9	0	0	0	113	N340 L470 E471 L476	N340-H474 WeakPolarHBondContact CB-NE2 3.31Å; N340-H474 PolarHBondContact ND2-CD2 3.46Å; N340-H474 VanDerWaalsContact ND2-CD2 3.27Å; N340-H474 PolarHBondContact ND2-NE2 2.65Å; N340-H474 PolarHBondContact ND2-O 2.93Å; L470-H474 VanDerWaalsContact O-CB 3.31Å; L470-H474 WeakPolarHBondContact O-CB 3.46Å; L470-H474 PolarHBondContact O-N 2.75Å; E471-H474 PolarHBondContact O-N 2.96Å; H474-L476 PolarHBondContact O-N 3.48Å
475	N	71.5	Confident	83.9	Confident	16 Å²	16	56.7 Å²	56.7	9%	0.086	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	2.5	175.5	-65.3	-51.7	0	0	0	113.9	P335 N340 E471 I473 E477 C502	P335-N475 HydrophobicContact CB-CB 4.11Å; N340-N475 PolarHBondContact ND2-OD1 2.91Å; E471-N475 WeakPolarHBondContact O-CB 3.21Å; E471-N475 PolarHBondContact O-N 2.82Å; E471-N475 PolarHBondContact O-ND2 3.05Å; I473-N475 VanDerWaalsContact C-N 3.3Å; I473-N475 PolarHBondContact O-N 3.48Å; N475-E477 HydrophobicContact CB-CG 4.09Å; N475-E477 PolarHBondContact O-N 3.36Å; N475-C502 PolarHBondContact O-SG 3.35Å; N475-C502 VanDerWaalsContact O-SG 3.4Å
476	L	70.4	Confident	83.7	Confident	54 Å²	54	62.4 Å²	62.4	28%	0.283	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	31.8	-179.6	-54.1	175.6	0	0	0	113.4	I473 H474 I499 C502	I473-L476 PolarHBondContact O-N 3.02Å; H474-L476 PolarHBondContact O-N 3.48Å; L476-I499 HydrophobicContact CD1-CG2 4.33Å; L476-I499 HydrophobicContact CD2-CG2 4.11Å; L476-C502 PolarHBondContact O-N 3.1Å
477	E	69.3	Low	83.6	Confident	17 Å²	17	64 Å²	64	8%	0.079	30%	0.302	C	S	.	.	S	Bend	trans	-90.2	-33.1	179.7	-62.6	-164.9	175.5	0	0	112	P335 N336 L472 N475 Y504	P335-E477 WeakPolarHBondContact CA-OE1 3.35Å; P335-E477 WeakPolarHBondContact CA-OE2 3.31Å; P335-E477 WeakPolarHBondContact CB-OE1 3.03Å; P335-E477 WeakPolarHBondContact CB-OE2 3.13Å; N336-E477 PolarHBondContact N-OE1 2.98Å; L472-E477 HydrophobicContact CD2-CB 4.32Å; L472-E477 PolarHBondContact O-N 3.35Å; N475-E477 HydrophobicContact CB-CG 4.09Å; N475-E477 PolarHBondContact O-N 3.36Å; E477-Y504 HydrophobicContact CB-CE2 4.17Å; E477-Y504 VanDerWaalsContact CD-CE2 3.44Å; E477-Y504 VanDerWaalsContact CD-OH 3.23Å; E477-Y504 HydrophobicContact CG-CE2 4.02Å; E477-Y504 PolarHBondContact OE1-OH 3.12Å; E477-Y504 WeakPolarHBondContact OE2-CE2 3.2Å; E477-Y504 VanDerWaalsContact OE2-CZ 3.27Å; E477-Y504 PolarHBondContact OE2-OH 3.13Å
478	L	75.3	Confident	83.7	Confident	5 Å²	5	56.9 Å²	56.9	3%	0.026	28%	0.277	C	S	.	.	S	Bend	trans	-134.5	131.8	175	-73.4	176.5	0	0	0	113	L438 L439 L472 I480	L438-L478 HydrophobicContact CB-CD1 4.38Å; L439-L478 HydrophobicContact CD1-CD2 3.9Å; L472-L478 HydrophobicContact CD1-CD1 4.42Å; L472-L478 PolarHBondContact O-N 3.15Å; L478-I480 HydrophobicContact CB-CD1 3.8Å; L478-I480 HydrophobicContact CB-CG1 4Å; L478-I480 HydrophobicContact CD1-CD1 4.04Å; L478-I480 PolarHBondContact O-N 3.32Å
479	P	78.6	Confident	83.8	Confident	14 Å²	14	56.4 Å²	56.4	9%	0.091	27%	0.274	C	S	.	.			trans	-74.3	91.8	170	29.4	-32.1	0	0	0	110.5	D492 F494	P479-D492 WeakPolarHBondContact CB-O 3.35Å; P479-D492 WeakPolarHBondContact CG-O 3.42Å; P479-D492 PolarHBondContact O-N 2.84Å; P479-F494 HydrophobicContact CB-CD1 4.07Å; P479-F494 HydrophobicContact CB-CD2 3.75Å; P479-F494 HydrophobicContact CB-CE1 3.97Å; P479-F494 HydrophobicContact CB-CE2 3.64Å; P479-F494 HydrophobicContact CB-CG 3.96Å; P479-F494 HydrophobicContact CB-CZ 3.75Å; P479-F494 HydrophobicContact CG-CD2 4.15Å; P479-F494 HydrophobicContact CG-CE2 4.09Å
480	I	84.8	Confident	83.8	Confident	12 Å²	12	59 Å²	59	6%	0.062	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	137.2	178.2	-63	167.9	0	0	0	110	V469 I473 L478 V482 I489 F490 F491	V469-I480 HydrophobicContact CG1-CD1 4.26Å; V469-I480 HydrophobicContact CG1-CG2 3.89Å; I473-I480 HydrophobicContact CD1-CB 3.83Å; I473-I480 HydrophobicContact CD1-CG2 3.96Å; I473-I480 WeakPolarHBondContact CD1-O 3.34Å; I473-I480 HydrophobicContact CG1-CB 3.71Å; I473-I480 HydrophobicContact CG1-CG2 4.39Å; L478-I480 HydrophobicContact CB-CD1 3.8Å; L478-I480 HydrophobicContact CB-CG1 4Å; L478-I480 HydrophobicContact CD1-CD1 4.04Å; L478-I480 PolarHBondContact O-N 3.32Å; I480-V482 HydrophobicContact CG2-CG2 4.32Å; I480-I489 HydrophobicContact CG2-CG2 3.45Å; I480-I489 VanDerWaalsContact CG2-CG2 3.45Å; I480-F490 CarbonylContact C-O 3.57Å; I480-F490 WeakPolarHBondContact CA-O 3.4Å; I480-F491 HydrophobicContact CD1-CD1 4.16Å; I480-F491 HydrophobicContact CD1-CE1 3.85Å; I480-F491 HydrophobicContact CG1-CD1 3.73Å; I480-F491 HydrophobicContact CG1-CE1 3.93Å
481	R	86.9	Confident	83.7	Confident	139 Å²	139	56 Å²	56	53%	0.525	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	122.9	166.7	-59.6	-174	-62.1	-140.3	-10.5	109.2	F490 D492	R481-F490 HydrophobicContact CB-CB 4.35Å; R481-F490 PolarHBondContact N-O 3.29Å; R481-F490 PolarHBondContact O-N 3.41Å; R481-D492 HydrophobicContact CG-CB 4.3Å; R481-D492 IonicContact CZ-OD1 3.16Å; R481-D492 VanDerWaalsContact CZ-OD1 3.3Å; R481-D492 IonicContact CZ-OD2 3.72Å; R481-D492 IonicContact NE-OD2 3.95Å; R481-D492 PolarHBondContact NE-OD2 3.23Å; R481-D492 VanDerWaalsContact NH1-CG 3.34Å; R481-D492 IonicContact NH1-OD1 2.71Å; R481-D492 PolarHBondContact NH1-OD1 2.99Å; R481-D492 IonicContact NH1-OD2 2.66Å; R481-D492 PolarHBondContact NH1-OD2 3.24Å; R481-D492 IonicContact NH2-OD1 2.68Å; R481-D492 PolarHBondContact NH2-OD1 2.77Å; R481-D492 IonicContact NH2-OD2 2.8Å; R481-D492 PolarHBondContact NH2-OD2 3.31Å
482	V	90.4	Very high	83.1	Confident	42 Å²	42	54 Å²	54	26%	0.255	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	130.5	176	-175.6	0	0	0	0	109.3	V469 I473 I480	V469-V482 HydrophobicContact CG1-CG2 3.92Å; I473-V482 HydrophobicContact CD1-CG2 4.25Å; I480-V482 HydrophobicContact CG2-CG2 4.32Å
483	N	90.8	Very high	82.4	Confident	47 Å²	47	58.2 Å²	58.2	25%	0.251	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	93.5	176.2	-175	5.6	0	0	0	111.3	L485 Q486 Q487 A488 F490	N483-L485 PolarHBondContact O-N 2.88Å; N483-L485 WeakPolarHBondContact OD1-CB 3.49Å; N483-L485 PolarHBondContact OD1-N 2.86Å; N483-L485 VanDerWaalsContact OD1-N 3.15Å; N483-Q486 PolarHBondContact ND2-OE1 3.49Å; N483-Q486 PolarHBondContact O-N 3.41Å; N483-Q486 VanDerWaalsContact O-N 3.15Å; N483-Q487 PolarHBondContact O-N 3.27Å; N483-A488 PolarHBondContact N-O 3.48Å; N483-A488 PolarHBondContact O-N 3.22Å; N483-A488 VanDerWaalsContact O-N 3.1Å; N483-F490 HydrophobicContact CB-CD2 4.16Å; N483-F490 HydrophobicContact CB-CE2 3.86Å
484	H	91.3	Very high	81.5	Confident	98 Å²	98	58.6 Å²	58.6	45%	0.454	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-20.5	179.2	-53.6	-87.2	0	0	0	113.9	E466 Q486 Q487	E466-H484 IonicContact OE1-CE1 3.29Å; E466-H484 PolarHBondContact OE1-CE1 3.26Å; E466-H484 IonicContact OE2-CE1 2.67Å; H484-Q486 VanDerWaalsContact C-N 3.29Å; H484-Q486 PolarHBondContact O-N 3.04Å; H484-Q487 PolarHBondContact O-N 3.07Å; H484-Q487 PolarHBondContact O-NE2 3.46Å
485	L	89.8	Confident	80.4	Confident	169 Å²	169	58.1 Å²	58.1	89%	0.885	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-26.3	175.3	-65.3	176.3	0	0	0	112.7	N483	N483-L485 PolarHBondContact O-N 2.88Å; N483-L485 WeakPolarHBondContact OD1-CB 3.49Å; N483-L485 PolarHBondContact OD1-N 2.86Å; N483-L485 VanDerWaalsContact OD1-N 3.15Å
486	Q	88	Confident	79.6	Confident	121 Å²	121	62.5 Å²	62.5	57%	0.565	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	-0.7	176.2	-70.1	179.5	-44.5	0	0	112.3	N483 H484 A488	N483-Q486 PolarHBondContact ND2-OE1 3.49Å; N483-Q486 PolarHBondContact O-N 3.41Å; N483-Q486 VanDerWaalsContact O-N 3.15Å; H484-Q486 VanDerWaalsContact C-N 3.29Å; H484-Q486 PolarHBondContact O-N 3.04Å; Q486-A488 HydrophobicContact CB-CB 4.02Å; Q486-A488 PolarHBondContact O-N 3.14Å
487	Q	88.9	Confident	78.7	Confident	91 Å²	91	69 Å²	69	43%	0.425	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.8	48.1	-168.1	-66	-64.5	-43.3	0	0	111.6	F450 N483 H484	F450-Q487 HydrophobicContact CB-CB 4.46Å; F450-Q487 VanDerWaalsContact CB-O 3.31Å; F450-Q487 WeakPolarHBondContact CB-O 3.43Å; F450-Q487 PolarHBondContact N-O 2.95Å; N483-Q487 PolarHBondContact O-N 3.27Å; H484-Q487 PolarHBondContact O-N 3.07Å; H484-Q487 PolarHBondContact O-NE2 3.46Å
488	A	91.3	Very high	77.8	Confident	6 Å²	6	71.7 Å²	71.7	5%	0.05	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	140.8	-171.4	0	0	0	0	0	112.9	L448 N483 Q486 F490	L448-A488 WeakPolarHBondContact O-CA 3.19Å; N483-A488 PolarHBondContact N-O 3.48Å; N483-A488 PolarHBondContact O-N 3.22Å; N483-A488 VanDerWaalsContact O-N 3.1Å; Q486-A488 HydrophobicContact CB-CB 4.02Å; Q486-A488 PolarHBondContact O-N 3.14Å; A488-F490 HydrophobicContact CB-CD2 4.5Å; A488-F490 HydrophobicContact CB-CE2 3.85Å; A488-F490 HydrophobicContact CB-CZ 4.24Å
489	I	90.5	Very high	76.7	Confident	1 Å²	1	74.4 Å²	74.4	1%	0.005	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122	172.5	-58.4	179.4	0	0	0	107.5	S447 L448 F450 F453 V469 I480 F491	S447-I489 CarbonylContact C-O 3.59Å; S447-I489 VanDerWaalsContact CA-O 3.32Å; S447-I489 WeakPolarHBondContact CA-O 3.26Å; L448-I489 PolarHBondContact N-O 3.35Å; L448-I489 PolarHBondContact O-N 3.13Å; F450-I489 HydrophobicContact CD2-CD1 4.02Å; F450-I489 HydrophobicContact CD2-CG1 4.22Å; F453-I489 HydrophobicContact CB-CD1 4.43Å; F453-I489 HydrophobicContact CD1-CD1 3.83Å; F453-I489 HydrophobicContact CE1-CD1 4.36Å; F453-I489 HydrophobicContact CG-CD1 4.24Å; V469-I489 HydrophobicContact CG2-CD1 4.19Å; I480-I489 HydrophobicContact CG2-CG2 3.45Å; I480-I489 VanDerWaalsContact CG2-CG2 3.45Å; I489-F491 HydrophobicContact CG2-CE1 4.32Å; I489-F491 HydrophobicContact CG2-CE2 4.4Å; I489-F491 HydrophobicContact CG2-CZ 4.12Å
490	F	89.9	Confident	75.5	Confident	58 Å²	58	78.5 Å²	78.5	25%	0.254	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	119.5	174.5	-68.8	-87	0	0	0	110.3	I480 R481 N483 A488 D492	I480-F490 CarbonylContact C-O 3.57Å; I480-F490 WeakPolarHBondContact CA-O 3.4Å; R481-F490 HydrophobicContact CB-CB 4.35Å; R481-F490 PolarHBondContact N-O 3.29Å; R481-F490 PolarHBondContact O-N 3.41Å; N483-F490 HydrophobicContact CB-CD2 4.16Å; N483-F490 HydrophobicContact CB-CE2 3.86Å; A488-F490 HydrophobicContact CB-CD2 4.5Å; A488-F490 HydrophobicContact CB-CE2 3.85Å; A488-F490 HydrophobicContact CB-CZ 4.24Å; F490-D492 PolarHBondContact O-N 2.77Å
491	F	85.2	Confident	74	Confident	17 Å²	17	80.3 Å²	80.3	8%	0.075	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	110.1	169.6	-58.9	-76	0	0	0	107.8	L438 L441 Y445 Q446 L448 I480 I489	L438-F491 HydrophobicContact CD2-CZ 4.39Å; L441-F491 HydrophobicContact CB-CE2 4.41Å; L441-F491 HydrophobicContact CB-CZ 4.17Å; Y445-F491 WeakPolarHBondContact O-CB 3.28Å; Y445-F491 WeakPolarHBondContact O-CD2 3.3Å; Q446-F491 PolarHBondContact O-N 2.66Å; L448-F491 HydrophobicContact CB-CE2 4.03Å; L448-F491 HydrophobicContact CD2-CE2 4.36Å; L448-F491 HydrophobicContact CD2-CZ 4.49Å; I480-F491 HydrophobicContact CD1-CD1 4.16Å; I480-F491 HydrophobicContact CD1-CE1 3.85Å; I480-F491 HydrophobicContact CG1-CD1 3.73Å; I480-F491 HydrophobicContact CG1-CE1 3.93Å; I489-F491 HydrophobicContact CG2-CE1 4.32Å; I489-F491 HydrophobicContact CG2-CE2 4.4Å; I489-F491 HydrophobicContact CG2-CZ 4.12Å
492	D	71.5	Confident	72.4	Confident	51 Å²	51	75.9 Å²	75.9	27%	0.273	42%	0.416	S	S	.	.			trans	-106.5	-173.1	-171.2	-160.3	32.3	0	0	0	111	P479 R481 F490	P479-D492 WeakPolarHBondContact CB-O 3.35Å; P479-D492 WeakPolarHBondContact CG-O 3.42Å; P479-D492 PolarHBondContact O-N 2.84Å; R481-D492 HydrophobicContact CG-CB 4.3Å; R481-D492 IonicContact CZ-OD1 3.16Å; R481-D492 VanDerWaalsContact CZ-OD1 3.3Å; R481-D492 IonicContact CZ-OD2 3.72Å; R481-D492 IonicContact NE-OD2 3.95Å; R481-D492 PolarHBondContact NE-OD2 3.23Å; R481-D492 VanDerWaalsContact NH1-CG 3.34Å; R481-D492 IonicContact NH1-OD1 2.71Å; R481-D492 PolarHBondContact NH1-OD1 2.99Å; R481-D492 IonicContact NH1-OD2 2.66Å; R481-D492 PolarHBondContact NH1-OD2 3.24Å; R481-D492 IonicContact NH2-OD1 2.68Å; R481-D492 PolarHBondContact NH2-OD1 2.77Å; R481-D492 IonicContact NH2-OD2 2.8Å; R481-D492 PolarHBondContact NH2-OD2 3.31Å; F490-D492 PolarHBondContact O-N 2.77Å
493	K	66.5	Low	70.4	Confident	95 Å²	95	81.7 Å²	81.7	41%	0.413	44%	0.44	S	S	.	.			trans	-120.7	131.9	172.8	-52.7	-174.6	-165.5	-173.3	0	108.1	T495 D517 P518	K493-T495 VanDerWaalsContact C-N 3.35Å; K493-T495 PolarHBondContact O-N 3.37Å; K493-D517 HydrophobicContact CD-CB 4.32Å; K493-D517 WeakPolarHBondContact CE-OD2 3.44Å; K493-D517 IonicContact NZ-OD2 3.68Å; K493-D517 PolarHBondContact NZ-OD2 2.93Å; K493-P518 HydrophobicContact CB-CB 4.29Å
494	F	62	Low	68.4	Low	57 Å²	57	82.3 Å²	82.3	25%	0.25	44%	0.439	C	S	.	.			trans	-65.6	97.5	169.3	-68.9	-57.8	0	0	0	108.5	P479 I499 Q501	P479-F494 HydrophobicContact CB-CD1 4.07Å; P479-F494 HydrophobicContact CB-CD2 3.75Å; P479-F494 HydrophobicContact CB-CE1 3.97Å; P479-F494 HydrophobicContact CB-CE2 3.64Å; P479-F494 HydrophobicContact CB-CG 3.96Å; P479-F494 HydrophobicContact CB-CZ 3.75Å; P479-F494 HydrophobicContact CG-CD2 4.15Å; P479-F494 HydrophobicContact CG-CE2 4.09Å; F494-I499 HydrophobicContact CD1-CD1 4.41Å; F494-I499 HydrophobicContact CD1-CG2 4.08Å; F494-I499 HydrophobicContact CE1-CG2 4.17Å; F494-I499 HydrophobicContact CG-CG2 4.32Å; F494-I499 HydrophobicContact CZ-CG2 4.48Å; F494-Q501 HydrophobicContact CD2-CG 3.62Å; F494-Q501 HydrophobicContact CE2-CG 3.91Å
495	T	54.6	Low	65.8	Low	110 Å²	110	80.5 Å²	80.5	68%	0.675	45%	0.447	S	S	*	.			trans	-85.1	-14.2	174.7	49.2	0	0	0	0	112.6	K493 L497	K493-T495 VanDerWaalsContact C-N 3.35Å; K493-T495 PolarHBondContact O-N 3.37Å; T495-L497 PolarHBondContact O-N 3.25Å
496	D	55.8	Low	63.3	Low	108 Å²	108	76 Å²	76	58%	0.578	44%	0.441	S	S	*	.			trans	-77.7	109.1	178.8	-68.6	-30.2	0	0	0	110.9	G498 I499	D496-G498 PolarHBondContact O-N 2.93Å; D496-I499 HydrophobicContact CB-CD1 4.08Å; D496-I499 HydrophobicContact CB-CG1 4.13Å; D496-I499 PolarHBondContact O-N 2.74Å
497	L	50.6	Low	61.1	Low	190 Å²	190	73.7 Å²	73.7	100%	0.995	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-7.4	-179.2	-67.7	165.3	0	0	0	115.1	T495	T495-L497 PolarHBondContact O-N 3.25Å
498	G	50.8	Low	59	Low	75 Å²	75	70.8 Å²	70.8	77%	0.773	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-8.5	174.6	0	0	0	0	0	115.2	D496	D496-G498 PolarHBondContact O-N 2.93Å
499	I	53.6	Low	56.7	Low	62 Å²	62	72.3 Å²	72.3	32%	0.318	43%	0.426	S	S	.	.			trans	-105.6	84.9	-177.6	-51.7	-179.7	0	0	0	109.4	L476 F494 D496 Q501	L476-I499 HydrophobicContact CD1-CG2 4.33Å; L476-I499 HydrophobicContact CD2-CG2 4.11Å; F494-I499 HydrophobicContact CD1-CD1 4.41Å; F494-I499 HydrophobicContact CD1-CG2 4.08Å; F494-I499 HydrophobicContact CE1-CG2 4.17Å; F494-I499 HydrophobicContact CG-CG2 4.32Å; F494-I499 HydrophobicContact CZ-CG2 4.48Å; D496-I499 HydrophobicContact CB-CD1 4.08Å; D496-I499 HydrophobicContact CB-CG1 4.13Å; D496-I499 PolarHBondContact O-N 2.74Å; I499-Q501 PolarHBondContact O-N 2.56Å
500	S	51.8	Low	53.9	Low	99 Å²	99	74.8 Å²	74.8	69%	0.692	44%	0.443	S	S	*	.			trans	-63.7	123.7	167	56.5	0	0	0	0	109.7
501	Q	54.4	Low	51.5	Low	51 Å²	51	80.3 Å²	80.3	24%	0.238	47%	0.47	C	S	.	.			trans	-57.2	143.3	168	-71.4	-170	-32.1	0	0	110	F494 I499 E503	F494-Q501 HydrophobicContact CD2-CG 3.62Å; F494-Q501 HydrophobicContact CE2-CG 3.91Å; I499-Q501 PolarHBondContact O-N 2.56Å; Q501-E503 PolarHBondContact O-N 3.26Å
502	C	52.6	Low	49.1	Very low	45 Å²	45	81.6 Å²	81.6	30%	0.304	48%	0.481	S	S	.	.			trans	-63.5	107.9	166.4	-72.3	0	0	0	0	108.4	N475 L476 Y504	N475-C502 PolarHBondContact O-SG 3.35Å; N475-C502 VanDerWaalsContact O-SG 3.4Å; L476-C502 PolarHBondContact O-N 3.1Å; C502-Y504 PolarHBondContact O-N 3.26Å
503	E	49.3	Very low	47.5	Very low	165 Å²	165	85.3 Å²	85.3	77%	0.771	51%	0.506	S	S	*	.			trans	-61.2	104.9	178	-73.3	-162.6	146.9	0	0	110.4	Q501 G505	Q501-E503 PolarHBondContact O-N 3.26Å; E503-G505 PolarHBondContact O-N 2.93Å
504	Y	48.3	Very low	46.4	Very low	60 Å²	60	85.5 Å²	85.5	24%	0.235	51%	0.508	C	S	.	.			trans	-67.9	77.9	163.5	-100.6	-66.1	0	0	0	109.5	L334 E477 C502 G506 Q507 L508	L334-Y504 HydrophobicContact CD2-CE1 4.29Å; E477-Y504 HydrophobicContact CB-CE2 4.17Å; E477-Y504 VanDerWaalsContact CD-CE2 3.44Å; E477-Y504 VanDerWaalsContact CD-OH 3.23Å; E477-Y504 HydrophobicContact CG-CE2 4.02Å; E477-Y504 PolarHBondContact OE1-OH 3.12Å; E477-Y504 WeakPolarHBondContact OE2-CE2 3.2Å; E477-Y504 VanDerWaalsContact OE2-CZ 3.27Å; E477-Y504 PolarHBondContact OE2-OH 3.13Å; C502-Y504 PolarHBondContact O-N 3.26Å; Y504-G506 PolarHBondContact O-N 3Å; Y504-Q507 PolarHBondContact O-N 3.29Å; Y504-Q507 VanDerWaalsContact O-N 3.13Å; Y504-L508 HydrophobicContact CD1-CB 4.45Å; Y504-L508 HydrophobicContact CD1-CD1 3.43Å; Y504-L508 VanDerWaalsContact CD1-CD1 3.43Å; Y504-L508 HydrophobicContact CD1-CG 3.62Å; Y504-L508 HydrophobicContact CD2-CD1 3.97Å; Y504-L508 HydrophobicContact CE1-CD1 3.32Å; Y504-L508 HydrophobicContact CE1-CG 3.96Å; Y504-L508 HydrophobicContact CE2-CD1 3.86Å; Y504-L508 HydrophobicContact CG-CB 4.38Å; Y504-L508 HydrophobicContact CG-CD1 3.76Å; Y504-L508 HydrophobicContact CG-CG 4.01Å
505	G	37	Very low	45.7	Very low	60 Å²	60	86.2 Å²	86.2	62%	0.619	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-26.2	86.2	-167.3	0	0	0	0	0	115.4	E503 Q507	E503-G505 PolarHBondContact O-N 2.93Å; G505-Q507 PolarHBondContact O-N 3.04Å
506	G	37.5	Very low	45.5	Very low	73 Å²	73	82.8 Å²	82.8	75%	0.753	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	-8.5	176.8	0	0	0	0	0	118.9	Y504 S510	Y504-G506 PolarHBondContact O-N 3Å; G506-S510 WeakPolarHBondContact O-CB 3.24Å
507	Q	41.1	Very low	45.2	Very low	74 Å²	74	81.1 Å²	81.1	35%	0.346	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.2	-10.4	-149.3	-118	162.1	18.5	0	0	121.5	Q370 Y504 G505 V509 S510	Q370-Q507 HydrophobicContact CG-CB 3.84Å; Q370-Q507 HydrophobicContact CG-CG 4.34Å; Y504-Q507 PolarHBondContact O-N 3.29Å; Y504-Q507 VanDerWaalsContact O-N 3.13Å; G505-Q507 PolarHBondContact O-N 3.04Å; Q507-V509 PolarHBondContact O-N 2.96Å; Q507-S510 WeakPolarHBondContact CG-OG 3.31Å; Q507-S510 PolarHBondContact O-N 3.11Å
508	L	44.2	Very low	45.2	Very low	29 Å²	29	73.1 Å²	73.1	15%	0.152	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-7.9	169.6	-77.6	-163.5	0	0	0	114.2	L334 L439 Y504	L334-L508 HydrophobicContact CD1-CD1 4.49Å; L334-L508 HydrophobicContact CD2-CD1 4.09Å; L439-L508 HydrophobicContact CD2-CB 4.02Å; L439-L508 HydrophobicContact CD2-CD1 3.78Å; Y504-L508 HydrophobicContact CD1-CB 4.45Å; Y504-L508 HydrophobicContact CD1-CD1 3.43Å; Y504-L508 VanDerWaalsContact CD1-CD1 3.43Å; Y504-L508 HydrophobicContact CD1-CG 3.62Å; Y504-L508 HydrophobicContact CD2-CD1 3.97Å; Y504-L508 HydrophobicContact CE1-CD1 3.32Å; Y504-L508 HydrophobicContact CE1-CG 3.96Å; Y504-L508 HydrophobicContact CE2-CD1 3.86Å; Y504-L508 HydrophobicContact CG-CB 4.38Å; Y504-L508 HydrophobicContact CG-CD1 3.76Å; Y504-L508 HydrophobicContact CG-CG 4.01Å
509	V	42.7	Very low	45.4	Very low	39 Å²	39	71.5 Å²	71.5	24%	0.236	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.1	19.7	175	-159.2	0	0	0	0	111.3	Q443 Q507 Q511 S512	Q443-V509 VanDerWaalsContact OE1-CG1 3.29Å; Q507-V509 PolarHBondContact O-N 2.96Å; V509-Q511 VanDerWaalsContact C-N 3.32Å; V509-Q511 PolarHBondContact O-N 3.28Å; V509-S512 WeakPolarHBondContact CG1-OG 3.39Å
510	S	33.3	Very low	45.9	Very low	52 Å²	52	72.8 Å²	72.8	36%	0.364	42%	0.422	S	S	.	.	S	Bend	trans	-84	71.7	179.7	84.6	0	0	0	0	113.4	G506 Q507	G506-S510 WeakPolarHBondContact O-CB 3.24Å; Q507-S510 WeakPolarHBondContact CG-OG 3.31Å; Q507-S510 PolarHBondContact O-N 3.11Å
511	Q	37.9	Very low	46.5	Very low	174 Å²	174	73.7 Å²	73.7	81%	0.813	42%	0.419	S	S	*	.	S	Bend	trans	-169	-20.1	145.1	-111.1	155.3	84.2	0	0	113.3	V509	V509-Q511 VanDerWaalsContact C-N 3.32Å; V509-Q511 PolarHBondContact O-N 3.28Å
512	S	35.7	Very low	47	Very low	44 Å²	44	75.2 Å²	75.2	31%	0.308	44%	0.435	S	S	.	.	S	Bend	trans	-80.8	141	167.3	48.6	0	0	0	0	111.1	V509 H514	V509-S512 WeakPolarHBondContact CG1-OG 3.39Å; S512-H514 PolarHBondContact O-N 2.68Å
513	T	38.5	Very low	47.8	Very low	129 Å²	129	78.5 Å²	78.5	79%	0.791	44%	0.441	S	S	*	.	S	Bend	trans	-72.8	13.1	179.4	42.3	0	0	0	0	114.3	V515	T513-V515 PolarHBondContact O-N 2.71Å
514	H	42.2	Very low	49.3	Very low	100 Å²	100	76.1 Å²	76.1	46%	0.463	43%	0.43	S	S	.	.			trans	-106.3	74.2	-171.4	-69.7	-105.6	0	0	0	110.3	S512 N516	S512-H514 PolarHBondContact O-N 2.68Å; H514-N516 PolarHBondContact O-N 3.26Å
515	V	47.5	Very low	51	Low	72 Å²	72	80.1 Å²	80.1	44%	0.436	45%	0.454	S	S	.	.			trans	-49	133.7	162.5	-179.7	0	0	0	0	108.5	T513 D517 D519 K520	T513-V515 PolarHBondContact O-N 2.71Å; V515-D517 PolarHBondContact O-N 3.11Å; V515-D519 HydrophobicContact CG1-CB 3.95Å; V515-K520 HydrophobicContact CB-CG 4.42Å; V515-K520 HydrophobicContact CG1-CG 4.49Å; V515-K520 WeakPolarHBondContact O-CE 3.31Å
516	N	51.7	Low	53.3	Low	37 Å²	37	81 Å²	81	20%	0.198	45%	0.448	C	S	.	.			trans	-51.7	132.1	178.2	-77.5	-18.4	0	0	0	110.5	H514 P518 D519 K520	H514-N516 PolarHBondContact O-N 3.26Å; N516-P518 VanDerWaalsContact C-CD 3.44Å; N516-P518 HydrophobicContact CB-CG 4.36Å; N516-D519 WeakPolarHBondContact O-CA 3.49Å; N516-D519 WeakPolarHBondContact O-CB 3.34Å; N516-D519 PolarHBondContact O-N 2.75Å; N516-K520 PolarHBondContact O-N 3.15Å
517	D	48.4	Very low	55.4	Low	73 Å²	73	82.2 Å²	82.2	39%	0.39	44%	0.435	S	S	.	.	H	α-helix	trans	-52.4	-36	-173.7	-118.4	52	0	0	0	117.1	K493 V515 D519 K520	K493-D517 HydrophobicContact CD-CB 4.32Å; K493-D517 WeakPolarHBondContact CE-OD2 3.44Å; K493-D517 IonicContact NZ-OD2 3.68Å; K493-D517 PolarHBondContact NZ-OD2 2.93Å; V515-D517 PolarHBondContact O-N 3.11Å; D517-D519 VanDerWaalsContact C-N 3.28Å; D517-D519 PolarHBondContact O-N 2.82Å; D517-K520 WeakPolarHBondContact O-CB 3.27Å; D517-K520 PolarHBondContact O-N 3.23Å; D517-K520 WeakPolarHBondContact OD1-CD 3.48Å; D517-K520 WeakPolarHBondContact OD1-CE 3.5Å; D517-K520 IonicContact OD1-NZ 3.7Å; D517-K520 PolarHBondContact OD1-NZ 3.26Å
518	P	50.7	Low	57.8	Low	23 Å²	23	85.1 Å²	85.1	15%	0.149	45%	0.447	C	S	.	.	H	α-helix	trans	-60.7	-36	170.3	21.8	-34.4	0	0	0	113.3	K493 N516 K520 L521 S522	K493-P518 HydrophobicContact CB-CB 4.29Å; N516-P518 VanDerWaalsContact C-CD 3.44Å; N516-P518 HydrophobicContact CB-CG 4.36Å; P518-K520 VanDerWaalsContact C-N 3.27Å; P518-K520 PolarHBondContact O-N 3Å; P518-L521 WeakPolarHBondContact O-CB 3.22Å; P518-L521 PolarHBondContact O-N 3.36Å; P518-L521 VanDerWaalsContact O-N 3.11Å; P518-S522 PolarHBondContact O-N 3.49Å
519	D	56.1	Low	59.9	Low	40 Å²	40	86.5 Å²	86.5	21%	0.214	46%	0.462	C	S	.	.	H	α-helix	trans	-81	-11.2	-176.8	-150.8	23.4	0	0	0	112.1	V515 N516 D517 L521 S522 R523	V515-D519 HydrophobicContact CG1-CB 3.95Å; N516-D519 WeakPolarHBondContact O-CA 3.49Å; N516-D519 WeakPolarHBondContact O-CB 3.34Å; N516-D519 PolarHBondContact O-N 2.75Å; D517-D519 VanDerWaalsContact C-N 3.28Å; D517-D519 PolarHBondContact O-N 2.82Å; D519-L521 VanDerWaalsContact C-N 3.34Å; D519-S522 VanDerWaalsContact CA-OG 3.3Å; D519-S522 WeakPolarHBondContact CA-OG 3.48Å; D519-S522 PolarHBondContact O-OG 3.23Å; D519-S522 PolarHBondContact OD1-OG 3.1Å; D519-R523 VanDerWaalsContact O-CB 3.25Å; D519-R523 WeakPolarHBondContact O-CB 3.41Å; D519-R523 WeakPolarHBondContact O-CG 3.25Å; D519-R523 PolarHBondContact O-N 2.93Å; D519-R523 IonicContact OD1-CZ 2.79Å; D519-R523 IonicContact OD1-NE 2.75Å; D519-R523 PolarHBondContact OD1-NE 2.86Å; D519-R523 IonicContact OD1-NH2 3.21Å; D519-R523 IonicContact OD2-CZ 2.81Å; D519-R523 IonicContact OD2-NE 2.64Å; D519-R523 PolarHBondContact OD2-NE 3.28Å; D519-R523 IonicContact OD2-NH2 3.56Å; D519-R523 PolarHBondContact OD2-NH2 3.06Å
520	K	62.1	Low	62.2	Low	90 Å²	90	89.5 Å²	89.5	39%	0.391	47%	0.474	S	S	.	.	H	α-helix	trans	-70.9	-28.5	163.6	-64.1	-179.7	-174.2	156.2	0	112.5	V515 N516 D517 P518 Q524	V515-K520 HydrophobicContact CB-CG 4.42Å; V515-K520 HydrophobicContact CG1-CG 4.49Å; V515-K520 WeakPolarHBondContact O-CE 3.31Å; N516-K520 PolarHBondContact O-N 3.15Å; D517-K520 WeakPolarHBondContact O-CB 3.27Å; D517-K520 PolarHBondContact O-N 3.23Å; D517-K520 WeakPolarHBondContact OD1-CD 3.48Å; D517-K520 WeakPolarHBondContact OD1-CE 3.5Å; D517-K520 IonicContact OD1-NZ 3.7Å; D517-K520 PolarHBondContact OD1-NZ 3.26Å; P518-K520 VanDerWaalsContact C-N 3.27Å; P518-K520 PolarHBondContact O-N 3Å; K520-Q524 WeakPolarHBondContact O-CA 3.38Å; K520-Q524 WeakPolarHBondContact O-CB 3.3Å; K520-Q524 PolarHBondContact O-N 3.4Å
521	L	64.8	Low	64.9	Low	118 Å²	118	90.2 Å²	90.2	62%	0.618	48%	0.476	S	S	*	.	H	α-helix	trans	-78.7	-48.7	178.5	-177.8	63.8	0	0	0	110.9	P518 D519 R523 Q524	P518-L521 WeakPolarHBondContact O-CB 3.22Å; P518-L521 PolarHBondContact O-N 3.36Å; P518-L521 VanDerWaalsContact O-N 3.11Å; D519-L521 VanDerWaalsContact C-N 3.34Å; L521-R523 VanDerWaalsContact C-N 3.29Å; L521-R523 PolarHBondContact O-N 2.95Å; L521-Q524 WeakPolarHBondContact O-CB 3.46Å; L521-Q524 PolarHBondContact O-N 3.46Å; L521-Q524 VanDerWaalsContact O-N 3.16Å
522	S	65.8	Low	67.3	Low	82 Å²	82	85.9 Å²	85.9	57%	0.573	46%	0.456	S	S	*	.	H	α-helix	trans	-57.1	-42.1	175.2	60.3	0	0	0	0	111.9	P518 D519	P518-S522 PolarHBondContact O-N 3.49Å; D519-S522 VanDerWaalsContact CA-OG 3.3Å; D519-S522 WeakPolarHBondContact CA-OG 3.48Å; D519-S522 PolarHBondContact O-OG 3.23Å; D519-S522 PolarHBondContact OD1-OG 3.1Å
523	R	69.6	Low	69.7	Low	114 Å²	114	88.7 Å²	88.7	43%	0.43	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	4.2	179.6	-54.6	176.3	-164.5	-117.2	1.2	113.4	D519 L521 L525 T526 M527	D519-R523 VanDerWaalsContact O-CB 3.25Å; D519-R523 WeakPolarHBondContact O-CB 3.41Å; D519-R523 WeakPolarHBondContact O-CG 3.25Å; D519-R523 PolarHBondContact O-N 2.93Å; D519-R523 IonicContact OD1-CZ 2.79Å; D519-R523 IonicContact OD1-NE 2.75Å; D519-R523 PolarHBondContact OD1-NE 2.86Å; D519-R523 IonicContact OD1-NH2 3.21Å; D519-R523 IonicContact OD2-CZ 2.81Å; D519-R523 IonicContact OD2-NE 2.64Å; D519-R523 PolarHBondContact OD2-NE 3.28Å; D519-R523 IonicContact OD2-NH2 3.56Å; D519-R523 PolarHBondContact OD2-NH2 3.06Å; L521-R523 VanDerWaalsContact C-N 3.29Å; L521-R523 PolarHBondContact O-N 2.95Å; R523-L525 VanDerWaalsContact C-N 3.32Å; R523-L525 PolarHBondContact O-N 3.09Å; R523-T526 WeakPolarHBondContact O-CA 3.45Å; R523-T526 WeakPolarHBondContact O-CB 3.47Å; R523-T526 PolarHBondContact O-N 3.36Å; R523-M527 HydrophobicContact CB-CG 4.41Å; R523-M527 WeakPolarHBondContact O-CG 3.17Å; R523-M527 PolarHBondContact O-N 3.2Å
524	Q	79.4	Confident	72	Confident	116 Å²	116	88.1 Å²	88.1	54%	0.542	45%	0.453	S	S	.	.	H	α-helix	trans	-57.8	-44.7	-170.4	-166.5	173.4	-15.2	0	0	112	K520 L521 T526 M527 F528	K520-Q524 WeakPolarHBondContact O-CA 3.38Å; K520-Q524 WeakPolarHBondContact O-CB 3.3Å; K520-Q524 PolarHBondContact O-N 3.4Å; L521-Q524 WeakPolarHBondContact O-CB 3.46Å; L521-Q524 PolarHBondContact O-N 3.46Å; L521-Q524 VanDerWaalsContact O-N 3.16Å; Q524-T526 VanDerWaalsContact C-N 3.35Å; Q524-M527 PolarHBondContact O-N 3.4Å; Q524-F528 VanDerWaalsContact O-CB 3.27Å; Q524-F528 WeakPolarHBondContact O-CB 3.43Å; Q524-F528 PolarHBondContact O-N 3.18Å
525	L	84.6	Confident	74.2	Confident	143 Å²	143	86.8 Å²	86.8	75%	0.749	45%	0.449	S	S	*	.	H	α-helix	trans	-65.5	-37.5	178	-62.9	175.6	0	0	0	111.9	R523 A529	R523-L525 VanDerWaalsContact C-N 3.32Å; R523-L525 PolarHBondContact O-N 3.09Å; L525-A529 VanDerWaalsContact O-CB 3.24Å; L525-A529 WeakPolarHBondContact O-CB 3.49Å; L525-A529 PolarHBondContact O-N 3.39Å
526	T	85.4	Confident	75.9	Confident	79 Å²	79	86.2 Å²	86.2	49%	0.485	45%	0.445	S	S	.	.	H	α-helix	trans	-67.3	-45.5	176.5	-49	0	0	0	0	111.6	R523 Q524 A529 Q530	R523-T526 WeakPolarHBondContact O-CA 3.45Å; R523-T526 WeakPolarHBondContact O-CB 3.47Å; R523-T526 PolarHBondContact O-N 3.36Å; Q524-T526 VanDerWaalsContact C-N 3.35Å; T526-A529 PolarHBondContact O-N 3.43Å; T526-Q530 WeakPolarHBondContact O-CB 3.42Å; T526-Q530 VanDerWaalsContact O-CG 3.31Å; T526-Q530 WeakPolarHBondContact O-CG 3.47Å; T526-Q530 PolarHBondContact O-N 3.02Å
527	M	82.5	Confident	77.3	Confident	99 Å²	99	89.6 Å²	89.6	49%	0.488	46%	0.464	S	S	.	.	H	α-helix	trans	-64.3	-43.4	176.2	-66.9	-56.8	-57.4	0	0	111.2	R523 Q524 Q530 V531	R523-M527 HydrophobicContact CB-CG 4.41Å; R523-M527 WeakPolarHBondContact O-CG 3.17Å; R523-M527 PolarHBondContact O-N 3.2Å; Q524-M527 PolarHBondContact O-N 3.4Å; M527-Q530 PolarHBondContact O-N 3.03Å; M527-V531 WeakPolarHBondContact O-CG2 3.4Å; M527-V531 PolarHBondContact O-N 3.38Å
528	F	89.9	Confident	79	Confident	134 Å²	134	92.5 Å²	92.5	59%	0.588	48%	0.478	S	S	*	.	H	α-helix	trans	-62.5	-44.2	175.8	-175.7	-102.6	0	0	0	111.5	Q524 Q530 V531 M532	Q524-F528 VanDerWaalsContact O-CB 3.27Å; Q524-F528 WeakPolarHBondContact O-CB 3.43Å; Q524-F528 PolarHBondContact O-N 3.18Å; F528-Q530 PolarHBondContact O-N 3.46Å; F528-V531 PolarHBondContact O-N 3.44Å; F528-M532 HydrophobicContact CD1-CG 3.99Å; F528-M532 HydrophobicContact CD2-CG 4.37Å; F528-M532 HydrophobicContact CE1-CG 3.64Å; F528-M532 HydrophobicContact CE1-SD 4.36Å; F528-M532 HydrophobicContact CE2-CG 4.05Å; F528-M532 HydrophobicContact CE2-SD 4.25Å; F528-M532 HydrophobicContact CG-CG 4.34Å; F528-M532 HydrophobicContact CZ-CG 3.67Å; F528-M532 HydrophobicContact CZ-SD 3.87Å; F528-M532 VanDerWaalsContact O-CB 3.27Å; F528-M532 WeakPolarHBondContact O-CB 3.38Å; F528-M532 WeakPolarHBondContact O-CG 3.19Å; F528-M532 PolarHBondContact O-N 2.93Å
529	A	90.1	Very high	80.3	Confident	58 Å²	58	97 Å²	97	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-62.4	-40.7	175.7	0	0	0	0	0	112.6	L525 T526 Q533	L525-A529 VanDerWaalsContact O-CB 3.24Å; L525-A529 WeakPolarHBondContact O-CB 3.49Å; L525-A529 PolarHBondContact O-N 3.39Å; T526-A529 PolarHBondContact O-N 3.43Å; A529-Q533 WeakPolarHBondContact O-CB 3.32Å; A529-Q533 PolarHBondContact O-N 3.26Å
530	Q	89.6	Confident	80.6	Confident	102 Å²	102	101.9 Å²	101.9	48%	0.477	52%	0.521	S	S	.	.	H	α-helix	trans	-64.6	-45.2	175.8	-74.7	174.7	1	0	0	112.4	T526 M527 F528 Q533 Q534	T526-Q530 WeakPolarHBondContact O-CB 3.42Å; T526-Q530 VanDerWaalsContact O-CG 3.31Å; T526-Q530 WeakPolarHBondContact O-CG 3.47Å; T526-Q530 PolarHBondContact O-N 3.02Å; M527-Q530 PolarHBondContact O-N 3.03Å; F528-Q530 PolarHBondContact O-N 3.46Å; Q530-Q533 PolarHBondContact O-N 2.9Å; Q530-Q534 WeakPolarHBondContact O-CG 3.41Å; Q530-Q534 PolarHBondContact O-N 2.84Å
531	V	90.8	Very high	80.4	Confident	67 Å²	67	101.7 Å²	101.7	41%	0.406	53%	0.528	S	S	.	.	H	α-helix	trans	-67.6	-40.7	177.5	171.7	0	0	0	0	111.1	M527 F528 Q533 Q534 I535	M527-V531 WeakPolarHBondContact O-CG2 3.4Å; M527-V531 PolarHBondContact O-N 3.38Å; F528-V531 PolarHBondContact O-N 3.44Å; V531-Q533 VanDerWaalsContact C-N 3.35Å; V531-Q533 PolarHBondContact O-N 2.74Å; V531-Q534 PolarHBondContact O-N 3.4Å; V531-I535 HydrophobicContact CG1-CD1 3.79Å; V531-I535 HydrophobicContact CG1-CG1 4.45Å; V531-I535 WeakPolarHBondContact O-CB 3.41Å; V531-I535 VanDerWaalsContact O-CG1 3.27Å; V531-I535 WeakPolarHBondContact O-CG1 3.33Å; V531-I535 PolarHBondContact O-N 2.96Å
532	M	87.5	Confident	80.1	Confident	83 Å²	83	97.9 Å²	97.9	41%	0.409	52%	0.516	S	S	.	.	H	α-helix	trans	-62.2	-40.7	173.9	-75.1	-64.8	-65.6	0	0	112	F528 I535 T536	F528-M532 HydrophobicContact CD1-CG 3.99Å; F528-M532 HydrophobicContact CD2-CG 4.37Å; F528-M532 HydrophobicContact CE1-CG 3.64Å; F528-M532 HydrophobicContact CE1-SD 4.36Å; F528-M532 HydrophobicContact CE2-CG 4.05Å; F528-M532 HydrophobicContact CE2-SD 4.25Å; F528-M532 HydrophobicContact CG-CG 4.34Å; F528-M532 HydrophobicContact CZ-CG 3.67Å; F528-M532 HydrophobicContact CZ-SD 3.87Å; F528-M532 VanDerWaalsContact O-CB 3.27Å; F528-M532 WeakPolarHBondContact O-CB 3.38Å; F528-M532 WeakPolarHBondContact O-CG 3.19Å; F528-M532 PolarHBondContact O-N 2.93Å; M532-I535 PolarHBondContact O-N 2.92Å; M532-T536 WeakPolarHBondContact O-CG2 3.4Å; M532-T536 PolarHBondContact O-N 3.26Å; M532-T536 PolarHBondContact O-OG1 2.95Å
533	Q	86.3	Confident	79.8	Confident	104 Å²	104	100.5 Å²	100.5	49%	0.486	52%	0.52	S	S	.	.	H	α-helix	trans	-60.8	-49.6	174.6	-177.8	58.6	57.2	0	0	110.9	A529 Q530 V531 I535 T536 D537	A529-Q533 WeakPolarHBondContact O-CB 3.32Å; A529-Q533 PolarHBondContact O-N 3.26Å; Q530-Q533 PolarHBondContact O-N 2.9Å; V531-Q533 VanDerWaalsContact C-N 3.35Å; V531-Q533 PolarHBondContact O-N 2.74Å; Q533-I535 VanDerWaalsContact C-N 3.3Å; Q533-I535 PolarHBondContact O-N 3.47Å; Q533-T536 WeakPolarHBondContact CA-OG1 3.16Å; Q533-T536 PolarHBondContact O-N 3.31Å; Q533-T536 VanDerWaalsContact O-N 3.08Å; Q533-T536 PolarHBondContact O-OG1 3.4Å; Q533-D537 VanDerWaalsContact NE2-CG 3.29Å; Q533-D537 PolarHBondContact NE2-OD1 3.45Å; Q533-D537 PolarHBondContact NE2-OD2 3.2Å; Q533-D537 VanDerWaalsContact NE2-OD2 3.07Å; Q533-D537 VanDerWaalsContact O-CG 3.25Å; Q533-D537 PolarHBondContact O-N 2.95Å
534	Q	88	Confident	79.5	Confident	117 Å²	117	98.4 Å²	98.4	55%	0.547	52%	0.522	S	S	.	.	H	α-helix	trans	-57	-41.9	175.6	-70.9	170	0.6	0	0	112.1	Q530 V531 D537 I538	Q530-Q534 WeakPolarHBondContact O-CG 3.41Å; Q530-Q534 PolarHBondContact O-N 2.84Å; V531-Q534 PolarHBondContact O-N 3.4Å; Q534-D537 PolarHBondContact O-N 3.18Å; Q534-I538 WeakPolarHBondContact O-CD1 3.41Å; Q534-I538 VanDerWaalsContact O-CG1 3.24Å; Q534-I538 WeakPolarHBondContact O-CG1 3.46Å; Q534-I538 PolarHBondContact O-N 3.31Å
535	I	88.2	Confident	79	Confident	72 Å²	72	97.4 Å²	97.4	37%	0.369	52%	0.52	S	S	.	.	H	α-helix	trans	-64	-42.4	175.3	-70.9	166.6	0	0	0	111.3	V531 M532 Q533 D537 I538 L539	V531-I535 HydrophobicContact CG1-CD1 3.79Å; V531-I535 HydrophobicContact CG1-CG1 4.45Å; V531-I535 WeakPolarHBondContact O-CB 3.41Å; V531-I535 VanDerWaalsContact O-CG1 3.27Å; V531-I535 WeakPolarHBondContact O-CG1 3.33Å; V531-I535 PolarHBondContact O-N 2.96Å; M532-I535 PolarHBondContact O-N 2.92Å; Q533-I535 VanDerWaalsContact C-N 3.3Å; Q533-I535 PolarHBondContact O-N 3.47Å; I535-D537 VanDerWaalsContact C-N 3.3Å; I535-D537 PolarHBondContact O-N 3.16Å; I535-I538 PolarHBondContact O-N 2.84Å; I535-L539 HydrophobicContact CG2-CD1 3.57Å; I535-L539 HydrophobicContact CG2-CG 4.22Å; I535-L539 WeakPolarHBondContact O-CB 3.36Å; I535-L539 VanDerWaalsContact O-CG 3.31Å; I535-L539 WeakPolarHBondContact O-CG 3.49Å; I535-L539 PolarHBondContact O-N 2.93Å
536	T	82.7	Confident	78.4	Confident	59 Å²	59	92.5 Å²	92.5	36%	0.362	50%	0.5	S	S	.	.	H	α-helix	trans	-67.7	-29.3	176.8	52.8	0	0	0	0	113.6	M532 Q533	M532-T536 WeakPolarHBondContact O-CG2 3.4Å; M532-T536 PolarHBondContact O-N 3.26Å; M532-T536 PolarHBondContact O-OG1 2.95Å; Q533-T536 WeakPolarHBondContact CA-OG1 3.16Å; Q533-T536 PolarHBondContact O-N 3.31Å; Q533-T536 VanDerWaalsContact O-N 3.08Å; Q533-T536 PolarHBondContact O-OG1 3.4Å
537	D	80.9	Confident	78.2	Confident	109 Å²	109	93 Å²	93	58%	0.583	50%	0.5	S	S	*	.	H	α-helix	trans	-74.4	-35.9	175.1	-64.5	-31.9	0	0	0	111.4	Q533 Q534 I535	Q533-D537 VanDerWaalsContact NE2-CG 3.29Å; Q533-D537 PolarHBondContact NE2-OD1 3.45Å; Q533-D537 PolarHBondContact NE2-OD2 3.2Å; Q533-D537 VanDerWaalsContact NE2-OD2 3.07Å; Q533-D537 VanDerWaalsContact O-CG 3.25Å; Q533-D537 PolarHBondContact O-N 2.95Å; Q534-D537 PolarHBondContact O-N 3.18Å; I535-D537 VanDerWaalsContact C-N 3.3Å; I535-D537 PolarHBondContact O-N 3.16Å
538	I	83.6	Confident	78	Confident	134 Å²	134	91.8 Å²	91.8	69%	0.687	50%	0.501	S	S	*	.	H	α-helix	trans	-72.7	-38.3	176.4	-69.6	164.2	0	0	0	112.5	Q534 I535 E540	Q534-I538 WeakPolarHBondContact O-CD1 3.41Å; Q534-I538 VanDerWaalsContact O-CG1 3.24Å; Q534-I538 WeakPolarHBondContact O-CG1 3.46Å; Q534-I538 PolarHBondContact O-N 3.31Å; I535-I538 PolarHBondContact O-N 2.84Å; I538-E540 PolarHBondContact O-N 2.95Å; I538-E540 VanDerWaalsContact O-N 3.15Å
539	L	78.2	Confident	77.8	Confident	117 Å²	117	93.9 Å²	93.9	61%	0.613	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	11.8	-173.2	-72.6	175.2	0	0	0	115.3	I535 V541	I535-L539 HydrophobicContact CG2-CD1 3.57Å; I535-L539 HydrophobicContact CG2-CG 4.22Å; I535-L539 WeakPolarHBondContact O-CB 3.36Å; I535-L539 VanDerWaalsContact O-CG 3.31Å; I535-L539 WeakPolarHBondContact O-CG 3.49Å; I535-L539 PolarHBondContact O-N 2.93Å; L539-V541 HydrophobicContact CB-CG2 3.9Å; L539-V541 PolarHBondContact O-N 3.48Å
540	E	62.2	Low	77.7	Confident	143 Å²	143	98.8 Å²	98.8	67%	0.668	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	24.2	-179.4	-65.2	-156.1	158.3	0	0	116.4	I538 G542 Q543	I538-E540 PolarHBondContact O-N 2.95Å; I538-E540 VanDerWaalsContact O-N 3.15Å; E540-G542 PolarHBondContact O-N 3.39Å; E540-Q543 PolarHBondContact O-N 2.79Å; E540-Q543 VanDerWaalsContact O-N 3.1Å
541	V	58.8	Low	77.6	Confident	86 Å²	86	96.7 Å²	96.7	52%	0.521	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-13.1	177	-167.4	0	0	0	0	111.9	L539 Q543 S544	L539-V541 HydrophobicContact CB-CG2 3.9Å; L539-V541 PolarHBondContact O-N 3.48Å; V541-Q543 PolarHBondContact O-N 2.97Å; V541-S544 WeakPolarHBondContact O-CB 3.31Å; V541-S544 PolarHBondContact O-N 2.93Å
542	G	57.8	Low	77.5	Confident	37 Å²	37	99.8 Å²	99.8	38%	0.381	52%	0.524	S	S	.	.	H	α-helix	trans	-50.2	-14.7	165.8	0	0	0	0	0	116.4	E540 S544 L545 A546	E540-G542 PolarHBondContact O-N 3.39Å; G542-S544 PolarHBondContact O-N 3.15Å; G542-L545 CarbonylContact O-C 3.6Å; G542-L545 WeakPolarHBondContact O-CA 3.41Å; G542-L545 WeakPolarHBondContact O-CB 3.21Å; G542-L545 PolarHBondContact O-N 2.8Å; G542-A546 PolarHBondContact O-N 3.03Å
543	Q	59.2	Low	77.7	Confident	138 Å²	138	98.7 Å²	98.7	65%	0.645	52%	0.522	S	S	*	.	H	α-helix	trans	-55.7	-36.2	166.3	-65.1	-166.1	20.6	0	0	112.3	E540 V541 A546 N547	E540-Q543 PolarHBondContact O-N 2.79Å; E540-Q543 VanDerWaalsContact O-N 3.1Å; V541-Q543 PolarHBondContact O-N 2.97Å; Q543-A546 PolarHBondContact O-N 3.48Å; Q543-N547 PolarHBondContact O-N 3.41Å
544	S	63.5	Low	78	Confident	69 Å²	69	99.7 Å²	99.7	48%	0.483	53%	0.527	S	S	.	.	H	α-helix	trans	-64.6	-43	172	-177.9	0	0	0	0	111.7	V541 G542 A546 N547 C548	V541-S544 WeakPolarHBondContact O-CB 3.31Å; V541-S544 PolarHBondContact O-N 2.93Å; G542-S544 PolarHBondContact O-N 3.15Å; S544-A546 VanDerWaalsContact C-N 3.34Å; S544-A546 PolarHBondContact O-N 3.48Å; S544-N547 PolarHBondContact O-N 3.28Å; S544-C548 WeakPolarHBondContact O-CB 3.42Å; S544-C548 PolarHBondContact O-N 3.38Å; S544-C548 PolarHBondContact O-SG 3.09Å; S544-C548 VanDerWaalsContact O-SG 3.36Å
545	L	68.5	Low	78.1	Confident	96 Å²	96	97.9 Å²	97.9	50%	0.503	52%	0.521	S	S	.	.	H	α-helix	trans	-63.4	-37.7	175.3	-65	176	0	0	0	112.3	G542 C548 R549 K1031	G542-L545 CarbonylContact O-C 3.6Å; G542-L545 WeakPolarHBondContact O-CA 3.41Å; G542-L545 WeakPolarHBondContact O-CB 3.21Å; G542-L545 PolarHBondContact O-N 2.8Å; L545-C548 PolarHBondContact O-N 3.04Å; L545-R549 VanDerWaalsContact O-CB 3.3Å; L545-R549 WeakPolarHBondContact O-CB 3.4Å; L545-R549 PolarHBondContact O-N 3.05Å; L545-K1031 VanDerWaalsContact CD2-NZ 3.3Å
546	A	73.1	Confident	78.2	Confident	40 Å²	40	101 Å²	101	33%	0.331	53%	0.529	S	S	.	.	H	α-helix	trans	-64.9	-41.4	174.6	0	0	0	0	0	111.8	G542 Q543 S544 R549 R550	G542-A546 PolarHBondContact O-N 3.03Å; Q543-A546 PolarHBondContact O-N 3.48Å; S544-A546 VanDerWaalsContact C-N 3.34Å; S544-A546 PolarHBondContact O-N 3.48Å; A546-R549 PolarHBondContact O-N 3.27Å; A546-R550 WeakPolarHBondContact O-CB 3.38Å; A546-R550 WeakPolarHBondContact O-CG 3.31Å; A546-R550 PolarHBondContact O-N 3.4Å
547	N	80.2	Confident	78.6	Confident	90 Å²	90	107 Å²	107	48%	0.481	55%	0.545	S	S	.	.	H	α-helix	trans	-65	-47	174.1	-75.4	-20.3	0	0	0	112	Q543 S544 R549 R550 A551	Q543-N547 PolarHBondContact O-N 3.41Å; S544-N547 PolarHBondContact O-N 3.28Å; N547-R549 VanDerWaalsContact C-N 3.33Å; N547-R549 PolarHBondContact O-N 2.88Å; N547-R550 PolarHBondContact O-N 2.94Å; N547-R550 PolarHBondContact OD1-NE 3.38Å; N547-R550 PolarHBondContact OD1-NH2 3.23Å; N547-A551 WeakPolarHBondContact O-CB 3.34Å; N547-A551 PolarHBondContact O-N 2.95Å
548	C	79.7	Confident	79	Confident	73 Å²	73	108.7 Å²	108.7	49%	0.493	55%	0.547	S	S	.	.	H	α-helix	trans	-60.5	-39.8	175	-70.2	0	0	0	0	112.4	S544 L545 A551 L552	S544-C548 WeakPolarHBondContact O-CB 3.42Å; S544-C548 PolarHBondContact O-N 3.38Å; S544-C548 PolarHBondContact O-SG 3.09Å; S544-C548 VanDerWaalsContact O-SG 3.36Å; L545-C548 PolarHBondContact O-N 3.04Å; C548-A551 PolarHBondContact O-N 2.82Å; C548-L552 WeakPolarHBondContact O-CB 3.22Å; C548-L552 PolarHBondContact O-N 2.73Å
549	R	84.7	Confident	79.4	Confident	178 Å²	178	104.3 Å²	104.3	67%	0.672	53%	0.525	S	S	*	.	H	α-helix	trans	-66.2	-40.2	174.9	-171.9	174.1	-178.2	167.7	1.1	111.8	L545 A546 N547 V553	L545-R549 VanDerWaalsContact O-CB 3.3Å; L545-R549 WeakPolarHBondContact O-CB 3.4Å; L545-R549 PolarHBondContact O-N 3.05Å; A546-R549 PolarHBondContact O-N 3.27Å; N547-R549 VanDerWaalsContact C-N 3.33Å; N547-R549 PolarHBondContact O-N 2.88Å; R549-V553 WeakPolarHBondContact O-CB 3.27Å; R549-V553 VanDerWaalsContact O-CG2 3.28Å; R549-V553 WeakPolarHBondContact O-CG2 3.34Å; R549-V553 PolarHBondContact O-N 3.43Å
550	R	87.8	Confident	79.9	Confident	160 Å²	160	103 Å²	103	60%	0.604	52%	0.516	S	S	*	.	H	α-helix	trans	-62.2	-46.1	173.2	-78.5	-174.3	-79.5	-117.8	4.9	111.6	A546 N547 V553 H554	A546-R550 WeakPolarHBondContact O-CB 3.38Å; A546-R550 WeakPolarHBondContact O-CG 3.31Å; A546-R550 PolarHBondContact O-N 3.4Å; N547-R550 PolarHBondContact O-N 2.94Å; N547-R550 PolarHBondContact OD1-NE 3.38Å; N547-R550 PolarHBondContact OD1-NH2 3.23Å; R550-V553 PolarHBondContact O-N 3.23Å; R550-H554 WeakPolarHBondContact O-CB 3.46Å; R550-H554 PolarHBondContact O-N 2.87Å
551	A	88.6	Confident	81.3	Confident	59 Å²	59	104.7 Å²	104.7	49%	0.488	52%	0.521	S	S	.	.	H	α-helix	trans	-62.1	-45	178.3	0	0	0	0	0	112.3	N547 C548 H554 D555	N547-A551 WeakPolarHBondContact O-CB 3.34Å; N547-A551 PolarHBondContact O-N 2.95Å; C548-A551 PolarHBondContact O-N 2.82Å; A551-H554 WeakPolarHBondContact O-CB 3.47Å; A551-H554 PolarHBondContact O-N 3.02Å; A551-D555 PolarHBondContact O-N 3.22Å
552	L	88.6	Confident	82.8	Confident	131 Å²	131	104.1 Å²	104.1	69%	0.686	52%	0.518	S	S	*	.	H	α-helix	trans	-68.1	-36.1	179.5	-169.3	135.3	0	0	0	112.7	C548 Y556	C548-L552 WeakPolarHBondContact O-CB 3.22Å; C548-L552 PolarHBondContact O-N 2.73Å; L552-Y556 WeakPolarHBondContact O-CB 3.34Å; L552-Y556 PolarHBondContact O-N 3.35Å
553	V	91.2	Very high	84.3	Confident	60 Å²	60	106.2 Å²	106.2	36%	0.364	52%	0.52	S	S	.	.	H	α-helix	trans	-69.6	-35.4	171.9	169.9	0	0	0	0	111.8	R549 R550 R557	R549-V553 WeakPolarHBondContact O-CB 3.27Å; R549-V553 VanDerWaalsContact O-CG2 3.28Å; R549-V553 WeakPolarHBondContact O-CG2 3.34Å; R549-V553 PolarHBondContact O-N 3.43Å; R550-V553 PolarHBondContact O-N 3.23Å; V553-R557 WeakPolarHBondContact O-CG 3.5Å; V553-R557 PolarHBondContact O-N 3.34Å; V553-R557 VanDerWaalsContact O-N 3.09Å
554	H	91.6	Very high	85.8	Confident	126 Å²	126	107.5 Å²	107.5	58%	0.583	52%	0.519	S	S	*	.	H	α-helix	trans	-66.5	-47.7	174.8	174.7	-85.8	0	0	0	111.7	R550 A551 R557 K558	R550-H554 WeakPolarHBondContact O-CB 3.46Å; R550-H554 PolarHBondContact O-N 2.87Å; A551-H554 WeakPolarHBondContact O-CB 3.47Å; A551-H554 PolarHBondContact O-N 3.02Å; H554-R557 PolarHBondContact O-N 2.9Å; H554-K558 WeakPolarHBondContact O-CB 3.14Å; H554-K558 PolarHBondContact O-N 3.2Å
555	D	90.4	Very high	87.1	Confident	78 Å²	78	106.7 Å²	106.7	42%	0.417	51%	0.513	S	S	.	.	H	α-helix	trans	-65.2	-40.9	178.8	-169.7	64.5	0	0	0	112	A551 R557 K558 N559	A551-D555 PolarHBondContact O-N 3.22Å; D555-R557 PolarHBondContact O-N 2.99Å; D555-K558 PolarHBondContact O-N 2.86Å; D555-N559 WeakPolarHBondContact O-CB 3.37Å; D555-N559 VanDerWaalsContact O-CG 3.25Å; D555-N559 PolarHBondContact O-N 3.31Å; D555-N559 PolarHBondContact O-ND2 3.01Å; D555-N559 PolarHBondContact OD1-ND2 3.22Å; D555-N559 PolarHBondContact OD2-ND2 2.85Å
556	Y	90.1	Very high	88.2	Confident	139 Å²	139	107.1 Å²	107.1	55%	0.545	51%	0.512	S	S	.	.	H	α-helix	trans	-53.5	-50.6	169.4	174.3	-91.2	0	0	0	111.9	L552 K558 N559 E560	L552-Y556 WeakPolarHBondContact O-CB 3.34Å; L552-Y556 PolarHBondContact O-N 3.35Å; Y556-K558 PolarHBondContact O-N 3.1Å; Y556-N559 PolarHBondContact O-N 2.98Å; Y556-E560 WeakPolarHBondContact O-CA 3.37Å; Y556-E560 WeakPolarHBondContact O-CB 3.25Å; Y556-E560 PolarHBondContact O-N 3.29Å
557	R	91.3	Very high	89.1	Confident	183 Å²	183	110.9 Å²	110.9	69%	0.691	53%	0.526	S	S	*	.	H	α-helix	trans	-64.8	-36	179.6	-76.3	175.7	174.5	-169.3	-1.8	113.3	V553 H554 D555	V553-R557 WeakPolarHBondContact O-CG 3.5Å; V553-R557 PolarHBondContact O-N 3.34Å; V553-R557 VanDerWaalsContact O-N 3.09Å; H554-R557 PolarHBondContact O-N 2.9Å; D555-R557 PolarHBondContact O-N 2.99Å
558	K	91	Very high	89.6	Confident	146 Å²	146	110.6 Å²	110.6	64%	0.635	52%	0.524	S	S	*	.	H	α-helix	trans	-64.9	-44.6	175.8	-177.1	-166.6	173.4	-162.7	0	110.9	H554 D555 Y556	H554-K558 WeakPolarHBondContact O-CB 3.14Å; H554-K558 PolarHBondContact O-N 3.2Å; D555-K558 PolarHBondContact O-N 2.86Å; Y556-K558 PolarHBondContact O-N 3.1Å
559	N	90.6	Very high	90.2	Very high	41 Å²	41	112.4 Å²	112.4	22%	0.219	53%	0.529	C	S	.	.	H	α-helix	trans	-93.9	-9.9	-170	-56.9	-22.7	0	0	0	112.9	D555 Y556 K561 V562 L563	D555-N559 WeakPolarHBondContact O-CB 3.37Å; D555-N559 VanDerWaalsContact O-CG 3.25Å; D555-N559 PolarHBondContact O-N 3.31Å; D555-N559 PolarHBondContact O-ND2 3.01Å; D555-N559 PolarHBondContact OD1-ND2 3.22Å; D555-N559 PolarHBondContact OD2-ND2 2.85Å; Y556-N559 PolarHBondContact O-N 2.98Å; N559-K561 VanDerWaalsContact C-N 3.32Å; N559-K561 PolarHBondContact O-N 2.77Å; N559-V562 PolarHBondContact O-N 3.02Å; N559-L563 HydrophobicContact CB-CD1 3.96Å; N559-L563 HydrophobicContact CB-CG 4.25Å; N559-L563 WeakPolarHBondContact O-CG 3.35Å; N559-L563 PolarHBondContact O-N 3.3Å
560	E	89.5	Confident	90.6	Very high	91 Å²	91	112 Å²	112	43%	0.425	53%	0.527	S	S	.	.	H	α-helix	trans	-46.4	-49.3	-177.1	-171.1	-171.4	147	0	0	113.2	Y556 R564	Y556-E560 WeakPolarHBondContact O-CA 3.37Å; Y556-E560 WeakPolarHBondContact O-CB 3.25Å; Y556-E560 PolarHBondContact O-N 3.29Å; E560-R564 WeakPolarHBondContact O-CB 3.47Å; E560-R564 PolarHBondContact O-N 3.2Å
561	K	90.4	Very high	90.8	Very high	177 Å²	177	111.2 Å²	111.2	77%	0.77	52%	0.524	S	S	*	.	H	α-helix	trans	-67.8	-37.2	-179	-66.4	-174.9	-179.3	179.8	0	112.6	N559 S565	N559-K561 VanDerWaalsContact C-N 3.32Å; N559-K561 PolarHBondContact O-N 2.77Å; K561-S565 WeakPolarHBondContact O-CB 3.17Å; K561-S565 PolarHBondContact O-N 2.92Å
562	V	91.4	Very high	91	Very high	75 Å²	75	112.1 Å²	112.1	46%	0.455	53%	0.526	S	S	.	.	H	α-helix	trans	-69.4	-55.3	179.3	-176.4	0	0	0	0	109	N559 R564 S565 E566	N559-V562 PolarHBondContact O-N 3.02Å; V562-R564 VanDerWaalsContact C-N 3.27Å; V562-R564 PolarHBondContact O-N 3.49Å; V562-S565 CarbonylContact O-C 3.58Å; V562-S565 WeakPolarHBondContact O-CA 3.41Å; V562-S565 WeakPolarHBondContact O-CB 3.3Å; V562-S565 PolarHBondContact O-N 2.88Å; V562-S565 PolarHBondContact O-OG 2.86Å; V562-E566 HydrophobicContact CG1-CG 4.44Å; V562-E566 WeakPolarHBondContact O-CG 3.39Å; V562-E566 PolarHBondContact O-N 3.41Å
563	L	89.1	Confident	91.2	Very high	81 Å²	81	111.9 Å²	111.9	42%	0.424	53%	0.525	S	S	.	.	H	α-helix	trans	-57.1	-38.6	177.2	-67.2	170.7	0	0	0	112	N559 E566 L567	N559-L563 HydrophobicContact CB-CD1 3.96Å; N559-L563 HydrophobicContact CB-CG 4.25Å; N559-L563 WeakPolarHBondContact O-CG 3.35Å; N559-L563 PolarHBondContact O-N 3.3Å; L563-E566 PolarHBondContact O-N 3.02Å; L563-L567 VanDerWaalsContact O-CB 3.3Å; L563-L567 WeakPolarHBondContact O-CB 3.37Å; L563-L567 VanDerWaalsContact O-CG 3.25Å; L563-L567 WeakPolarHBondContact O-CG 3.49Å; L563-L567 PolarHBondContact O-N 3.38Å
564	R	90.8	Very high	91.1	Very high	165 Å²	165	113.4 Å²	113.4	62%	0.623	53%	0.53	S	S	*	.	H	α-helix	trans	-63.3	-43.1	172.8	-176.8	-179	179.1	95.7	2.4	112.1	E560 V562 L568	E560-R564 WeakPolarHBondContact O-CB 3.47Å; E560-R564 PolarHBondContact O-N 3.2Å; V562-R564 VanDerWaalsContact C-N 3.27Å; V562-R564 PolarHBondContact O-N 3.49Å; R564-L568 HydrophobicContact CG-CD1 4.22Å; R564-L568 WeakPolarHBondContact O-CB 3.39Å; R564-L568 VanDerWaalsContact O-CG 3.28Å; R564-L568 WeakPolarHBondContact O-CG 3.49Å; R564-L568 PolarHBondContact O-N 3.38Å
565	S	91.3	Very high	91.1	Very high	52 Å²	52	111.1 Å²	111.1	36%	0.364	52%	0.52	S	S	.	.	H	α-helix	trans	-67	-39	177	75	0	0	0	0	112.1	K561 V562 L568 N569	K561-S565 WeakPolarHBondContact O-CB 3.17Å; K561-S565 PolarHBondContact O-N 2.92Å; V562-S565 CarbonylContact O-C 3.58Å; V562-S565 WeakPolarHBondContact O-CA 3.41Å; V562-S565 WeakPolarHBondContact O-CB 3.3Å; V562-S565 PolarHBondContact O-N 2.88Å; V562-S565 PolarHBondContact O-OG 2.86Å; S565-L568 PolarHBondContact O-N 3.33Å; S565-N569 WeakPolarHBondContact O-CB 3.47Å; S565-N569 PolarHBondContact O-N 3.05Å; S565-N569 PolarHBondContact O-ND2 3.46Å
566	E	91.3	Very high	91.2	Very high	105 Å²	105	109.8 Å²	109.8	49%	0.491	52%	0.52	S	S	.	.	H	α-helix	trans	-67	-41	175.6	-70.6	175.9	170.4	0	0	111.8	V562 L563 N569 R570	V562-E566 HydrophobicContact CG1-CG 4.44Å; V562-E566 WeakPolarHBondContact O-CG 3.39Å; V562-E566 PolarHBondContact O-N 3.41Å; L563-E566 PolarHBondContact O-N 3.02Å; E566-N569 PolarHBondContact O-N 3.36Å; E566-R570 WeakPolarHBondContact O-CB 3.39Å; E566-R570 PolarHBondContact O-N 2.85Å
567	L	90.9	Very high	91.3	Very high	118 Å²	118	109.9 Å²	109.9	62%	0.618	52%	0.519	S	S	*	.	H	α-helix	trans	-63.8	-38.6	173.6	-78.4	166.7	0	0	0	112.4	L563 R571	L563-L567 VanDerWaalsContact O-CB 3.3Å; L563-L567 WeakPolarHBondContact O-CB 3.37Å; L563-L567 VanDerWaalsContact O-CG 3.25Å; L563-L567 WeakPolarHBondContact O-CG 3.49Å; L563-L567 PolarHBondContact O-N 3.38Å; L567-R571 WeakPolarHBondContact O-CB 3.5Å; L567-R571 PolarHBondContact O-N 3.49Å
568	L	92.4	Very high	91.4	Very high	85 Å²	85	106.4 Å²	106.4	45%	0.445	51%	0.509	S	S	.	.	H	α-helix	trans	-68.7	-47.1	174.9	-72	168.6	0	0	0	111.6	R564 S565 R570 R571 C572	R564-L568 HydrophobicContact CG-CD1 4.22Å; R564-L568 WeakPolarHBondContact O-CB 3.39Å; R564-L568 VanDerWaalsContact O-CG 3.28Å; R564-L568 WeakPolarHBondContact O-CG 3.49Å; R564-L568 PolarHBondContact O-N 3.38Å; S565-L568 PolarHBondContact O-N 3.33Å; L568-R570 VanDerWaalsContact C-N 3.31Å; L568-R570 PolarHBondContact O-N 3.31Å; L568-R571 WeakPolarHBondContact O-CB 3.32Å; L568-R571 PolarHBondContact O-N 2.98Å; L568-R571 VanDerWaalsContact O-N 3.11Å; L568-C572 PolarHBondContact O-N 3.31Å; L568-C572 PolarHBondContact O-SG 3.4Å; L568-C572 VanDerWaalsContact O-SG 3.35Å
569	N	92.3	Very high	91.4	Very high	110 Å²	110	105.5 Å²	105.5	59%	0.588	51%	0.507	S	S	*	.	H	α-helix	trans	-61.8	-39.8	176	-68.8	-15.3	0	0	0	111.5	S565 E566 C572 L573	S565-N569 WeakPolarHBondContact O-CB 3.47Å; S565-N569 PolarHBondContact O-N 3.05Å; S565-N569 PolarHBondContact O-ND2 3.46Å; E566-N569 PolarHBondContact O-N 3.36Å; N569-C572 PolarHBondContact O-N 2.94Å; N569-L573 WeakPolarHBondContact O-CB 3.39Å; N569-L573 PolarHBondContact O-N 2.97Å
570	R	92.3	Very high	91.3	Very high	169 Å²	169	108.5 Å²	108.5	64%	0.638	52%	0.52	S	S	*	.	H	α-helix	trans	-65.3	-36.8	173.4	-176.6	178.4	177.6	117.8	-0.2	111.8	E566 L568 L573 I574	E566-R570 WeakPolarHBondContact O-CB 3.39Å; E566-R570 PolarHBondContact O-N 2.85Å; L568-R570 VanDerWaalsContact C-N 3.31Å; L568-R570 PolarHBondContact O-N 3.31Å; R570-L573 PolarHBondContact O-N 3.36Å; R570-I574 HydrophobicContact CG-CD1 3.87Å; R570-I574 HydrophobicContact CG-CG1 4.43Å; R570-I574 WeakPolarHBondContact O-CB 3.16Å; R570-I574 WeakPolarHBondContact O-CG1 3.14Å; R570-I574 PolarHBondContact O-N 3.05Å
571	R	92.1	Very high	91.4	Very high	144 Å²	144	107.9 Å²	107.9	54%	0.543	52%	0.519	S	S	.	.	H	α-helix	trans	-61	-50.8	171.4	178.7	-176.8	167.3	-138.5	-18.2	110.5	L567 L568 L573 I574 E575	L567-R571 WeakPolarHBondContact O-CB 3.5Å; L567-R571 PolarHBondContact O-N 3.49Å; L568-R571 WeakPolarHBondContact O-CB 3.32Å; L568-R571 PolarHBondContact O-N 2.98Å; L568-R571 VanDerWaalsContact O-N 3.11Å; R571-L573 VanDerWaalsContact C-N 3.28Å; R571-L573 PolarHBondContact O-N 3.22Å; R571-I574 PolarHBondContact O-N 3.05Å; R571-I574 VanDerWaalsContact O-N 3.11Å; R571-E575 HydrophobicContact CG-CG 4.36Å; R571-E575 IonicContact CZ-OE1 3.2Å; R571-E575 IonicContact CZ-OE2 3.67Å; R571-E575 IonicContact NE-OE1 2.82Å; R571-E575 PolarHBondContact NE-OE1 2.75Å; R571-E575 IonicContact NE-OE2 3.29Å; R571-E575 PolarHBondContact NE-OE2 3.49Å; R571-E575 IonicContact NH2-OE1 2.91Å; R571-E575 PolarHBondContact NH2-OE1 2.72Å; R571-E575 IonicContact NH2-OE2 3.47Å; R571-E575 PolarHBondContact NH2-OE2 3.01Å; R571-E575 WeakPolarHBondContact O-CG 3.3Å; R571-E575 PolarHBondContact O-N 2.84Å
572	C	93.4	Very high	91.4	Very high	79 Å²	79	103.5 Å²	103.5	53%	0.534	50%	0.501	S	S	.	.	H	α-helix	trans	-57.9	-40.9	177.7	-61	0	0	0	0	112	L568 N569 E575 A576	L568-C572 PolarHBondContact O-N 3.31Å; L568-C572 PolarHBondContact O-SG 3.4Å; L568-C572 VanDerWaalsContact O-SG 3.35Å; N569-C572 PolarHBondContact O-N 2.94Å; C572-E575 PolarHBondContact O-N 2.97Å; C572-A576 WeakPolarHBondContact O-CB 3.5Å; C572-A576 PolarHBondContact O-N 2.85Å
573	L	91.4	Very high	91.4	Very high	125 Å²	125	103.5 Å²	103.5	65%	0.654	50%	0.501	S	S	*	.	H	α-helix	trans	-70.1	-33	177.1	-171.2	140	0	0	0	112.9	N569 R570 R571 R577	N569-L573 WeakPolarHBondContact O-CB 3.39Å; N569-L573 PolarHBondContact O-N 2.97Å; R570-L573 PolarHBondContact O-N 3.36Å; R571-L573 VanDerWaalsContact C-N 3.28Å; R571-L573 PolarHBondContact O-N 3.22Å; L573-R577 WeakPolarHBondContact O-CB 3.4Å; L573-R577 PolarHBondContact O-N 3.12Å
574	I	89.4	Confident	91.5	Very high	93 Å²	93	107.4 Å²	107.4	48%	0.477	51%	0.511	S	S	.	.	H	α-helix	trans	-70.3	-40.1	172	-73.3	167.6	0	0	0	111	R570 R571 R577 K578	R570-I574 HydrophobicContact CG-CD1 3.87Å; R570-I574 HydrophobicContact CG-CG1 4.43Å; R570-I574 WeakPolarHBondContact O-CB 3.16Å; R570-I574 WeakPolarHBondContact O-CG1 3.14Å; R570-I574 PolarHBondContact O-N 3.05Å; R571-I574 PolarHBondContact O-N 3.05Å; R571-I574 VanDerWaalsContact O-N 3.11Å; I574-R577 PolarHBondContact O-N 3.5Å; I574-K578 VanDerWaalsContact O-CB 3.24Å; I574-K578 WeakPolarHBondContact O-CB 3.31Å; I574-K578 PolarHBondContact O-N 3.01Å
575	E	91.2	Very high	91.2	Very high	77 Å²	77	104 Å²	104	36%	0.36	50%	0.503	S	S	.	.	H	α-helix	trans	-66.7	-49.2	178	-73.8	174.5	163.4	0	0	110.7	R571 C572 R577 K578 E579	R571-E575 HydrophobicContact CG-CG 4.36Å; R571-E575 IonicContact CZ-OE1 3.2Å; R571-E575 IonicContact CZ-OE2 3.67Å; R571-E575 IonicContact NE-OE1 2.82Å; R571-E575 PolarHBondContact NE-OE1 2.75Å; R571-E575 IonicContact NE-OE2 3.29Å; R571-E575 PolarHBondContact NE-OE2 3.49Å; R571-E575 IonicContact NH2-OE1 2.91Å; R571-E575 PolarHBondContact NH2-OE1 2.72Å; R571-E575 IonicContact NH2-OE2 3.47Å; R571-E575 PolarHBondContact NH2-OE2 3.01Å; R571-E575 WeakPolarHBondContact O-CG 3.3Å; R571-E575 PolarHBondContact O-N 2.84Å; C572-E575 PolarHBondContact O-N 2.97Å; E575-R577 VanDerWaalsContact C-N 3.34Å; E575-R577 PolarHBondContact O-N 3.35Å; E575-K578 WeakPolarHBondContact O-CB 3.33Å; E575-K578 PolarHBondContact O-N 2.79Å; E575-K578 VanDerWaalsContact O-N 3.11Å; E575-E579 PolarHBondContact O-N 2.95Å
576	A	93.7	Very high	91.1	Very high	50 Å²	50	105.5 Å²	105.5	41%	0.413	51%	0.509	S	S	.	.	H	α-helix	trans	-58.3	-43	172.5	0	0	0	0	0	112.4	C572 K578 E579 E580	C572-A576 WeakPolarHBondContact O-CB 3.5Å; C572-A576 PolarHBondContact O-N 2.85Å; A576-K578 VanDerWaalsContact C-N 3.31Å; A576-K578 PolarHBondContact O-N 2.81Å; A576-E579 PolarHBondContact O-N 3.41Å; A576-E580 WeakPolarHBondContact O-CG 2.99Å; A576-E580 PolarHBondContact O-N 3.36Å
577	R	92	Very high	91	Very high	142 Å²	142	107 Å²	107	54%	0.536	51%	0.514	S	S	.	.	H	α-helix	trans	-69.5	-27.9	177.4	-172	54.8	173	-172.5	-0	112.9	L573 I574 E575 E580 I581	L573-R577 WeakPolarHBondContact O-CB 3.4Å; L573-R577 PolarHBondContact O-N 3.12Å; I574-R577 PolarHBondContact O-N 3.5Å; E575-R577 VanDerWaalsContact C-N 3.34Å; E575-R577 PolarHBondContact O-N 3.35Å; R577-E580 WeakPolarHBondContact CD-OE2 3.23Å; R577-E580 IonicContact CZ-OE2 3.97Å; R577-E580 IonicContact NE-OE2 3.23Å; R577-E580 IonicContact NH1-OE2 2.71Å; R577-E580 PolarHBondContact NH1-OE2 2.72Å; R577-I581 HydrophobicContact CG-CD1 4.11Å; R577-I581 WeakPolarHBondContact O-CB 3.44Å; R577-I581 WeakPolarHBondContact O-CD1 3.38Å; R577-I581 WeakPolarHBondContact O-CG1 3.45Å; R577-I581 PolarHBondContact O-N 3.5Å
578	K	92.2	Very high	90.8	Very high	109 Å²	109	106.6 Å²	106.6	47%	0.474	50%	0.504	S	S	.	.	H	α-helix	trans	-69.2	-42.6	172	179.6	178	171.9	-64.5	0	110.5	I574 E575 A576 I581 E582	I574-K578 VanDerWaalsContact O-CB 3.24Å; I574-K578 WeakPolarHBondContact O-CB 3.31Å; I574-K578 PolarHBondContact O-N 3.01Å; E575-K578 WeakPolarHBondContact O-CB 3.33Å; E575-K578 PolarHBondContact O-N 2.79Å; E575-K578 VanDerWaalsContact O-N 3.11Å; A576-K578 VanDerWaalsContact C-N 3.31Å; A576-K578 PolarHBondContact O-N 2.81Å; K578-I581 PolarHBondContact O-N 3.02Å; K578-E582 WeakPolarHBondContact CE-OE1 3.46Å; K578-E582 HydrophobicContact CG-CG 4.5Å; K578-E582 IonicContact NZ-OE1 2.67Å; K578-E582 PolarHBondContact NZ-OE1 2.96Å; K578-E582 IonicContact NZ-OE2 2.93Å; K578-E582 PolarHBondContact NZ-OE2 2.98Å; K578-E582 VanDerWaalsContact NZ-OE2 3.12Å; K578-E582 WeakPolarHBondContact O-CB 3.17Å; K578-E582 WeakPolarHBondContact O-CG 3.38Å; K578-E582 PolarHBondContact O-N 3.15Å
579	E	91	Very high	90.4	Very high	127 Å²	127	106 Å²	106	59%	0.593	50%	0.502	S	S	*	.	H	α-helix	trans	-62.8	-40.9	172.6	-68.5	174.6	178.4	0	0	112.2	E575 A576 I581 E582 T583	E575-E579 PolarHBondContact O-N 2.95Å; A576-E579 PolarHBondContact O-N 3.41Å; E579-I581 PolarHBondContact O-N 3.36Å; E579-E582 PolarHBondContact O-N 2.92Å; E579-T583 WeakPolarHBondContact O-CB 3.26Å; E579-T583 VanDerWaalsContact O-CG2 3.31Å; E579-T583 WeakPolarHBondContact O-CG2 3.31Å; E579-T583 PolarHBondContact O-N 3.36Å; E579-T583 PolarHBondContact O-OG1 2.93Å
580	E	90	Very high	90.1	Very high	105 Å²	105	106.2 Å²	106.2	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-61.4	-41.4	172.1	-73.8	-176	149.9	0	0	112.3	A576 R577 T583 Y584	A576-E580 WeakPolarHBondContact O-CG 2.99Å; A576-E580 PolarHBondContact O-N 3.36Å; R577-E580 WeakPolarHBondContact CD-OE2 3.23Å; R577-E580 IonicContact CZ-OE2 3.97Å; R577-E580 IonicContact NE-OE2 3.23Å; R577-E580 IonicContact NH1-OE2 2.71Å; R577-E580 PolarHBondContact NH1-OE2 2.72Å; E580-T583 PolarHBondContact O-OG1 3.37Å; E580-Y584 WeakPolarHBondContact O-CB 3.48Å; E580-Y584 PolarHBondContact O-N 3.33Å
581	I	91.7	Very high	89.7	Confident	78 Å²	78	105.4 Å²	105.4	40%	0.4	50%	0.497	S	S	.	.	H	α-helix	trans	-70.7	-40.8	178.4	-72.6	166.9	0	0	0	111	R577 K578 E579 Y584 Q585	R577-I581 HydrophobicContact CG-CD1 4.11Å; R577-I581 WeakPolarHBondContact O-CB 3.44Å; R577-I581 WeakPolarHBondContact O-CD1 3.38Å; R577-I581 WeakPolarHBondContact O-CG1 3.45Å; R577-I581 PolarHBondContact O-N 3.5Å; K578-I581 PolarHBondContact O-N 3.02Å; E579-I581 PolarHBondContact O-N 3.36Å; I581-Y584 PolarHBondContact O-N 3.43Å; I581-Q585 HydrophobicContact CG2-CG 4.43Å; I581-Q585 WeakPolarHBondContact O-CB 3.47Å; I581-Q585 VanDerWaalsContact O-CG 3.27Å; I581-Q585 WeakPolarHBondContact O-CG 3.46Å; I581-Q585 PolarHBondContact O-N 3.09Å
582	E	89.7	Confident	89.3	Confident	85 Å²	85	104.4 Å²	104.4	40%	0.397	49%	0.494	S	S	.	.	H	α-helix	trans	-67.8	-43.7	177.7	-76.8	171.1	-179.6	0	0	111.1	K578 E579 Y584 Q585 V586	K578-E582 WeakPolarHBondContact CE-OE1 3.46Å; K578-E582 HydrophobicContact CG-CG 4.5Å; K578-E582 IonicContact NZ-OE1 2.67Å; K578-E582 PolarHBondContact NZ-OE1 2.96Å; K578-E582 IonicContact NZ-OE2 2.93Å; K578-E582 PolarHBondContact NZ-OE2 2.98Å; K578-E582 VanDerWaalsContact NZ-OE2 3.12Å; K578-E582 WeakPolarHBondContact O-CB 3.17Å; K578-E582 WeakPolarHBondContact O-CG 3.38Å; K578-E582 PolarHBondContact O-N 3.15Å; E579-E582 PolarHBondContact O-N 2.92Å; E582-Y584 VanDerWaalsContact C-N 3.34Å; E582-Y584 PolarHBondContact O-N 3.25Å; E582-Q585 PolarHBondContact O-N 3.48Å; E582-V586 WeakPolarHBondContact O-CB 3.47Å; E582-V586 WeakPolarHBondContact O-CG2 3.38Å; E582-V586 PolarHBondContact O-N 3.44Å
583	T	92.1	Very high	88.8	Confident	75 Å²	75	103.4 Å²	103.4	46%	0.46	49%	0.488	S	S	.	.	H	α-helix	trans	-67.7	-31.8	173.8	56.6	0	0	0	0	112.9	E579 E580 K587	E579-T583 WeakPolarHBondContact O-CB 3.26Å; E579-T583 VanDerWaalsContact O-CG2 3.31Å; E579-T583 WeakPolarHBondContact O-CG2 3.31Å; E579-T583 PolarHBondContact O-N 3.36Å; E579-T583 PolarHBondContact O-OG1 2.93Å; E580-T583 PolarHBondContact O-OG1 3.37Å; T583-K587 WeakPolarHBondContact O-CB 3.5Å; T583-K587 WeakPolarHBondContact O-CD 3.5Å; T583-K587 VanDerWaalsContact O-CG 3.26Å; T583-K587 WeakPolarHBondContact O-CG 3.44Å; T583-K587 PolarHBondContact O-N 3.27Å
584	Y	89.9	Confident	88.5	Confident	162 Å²	162	101.6 Å²	101.6	64%	0.635	48%	0.478	S	S	*	.	H	α-helix	trans	-69.6	-41.5	170.5	-173.9	-92.9	0	0	0	112.1	E580 I581 E582 K587 R588	E580-Y584 WeakPolarHBondContact O-CB 3.48Å; E580-Y584 PolarHBondContact O-N 3.33Å; I581-Y584 PolarHBondContact O-N 3.43Å; E582-Y584 VanDerWaalsContact C-N 3.34Å; E582-Y584 PolarHBondContact O-N 3.25Å; Y584-K587 PolarHBondContact O-N 3.33Å; Y584-R588 VanDerWaalsContact O-CB 3.22Å; Y584-R588 WeakPolarHBondContact O-CB 3.3Å; Y584-R588 PolarHBondContact O-N 2.99Å
585	Q	86.1	Confident	88.2	Confident	95 Å²	95	99.3 Å²	99.3	44%	0.444	47%	0.469	S	S	.	.	H	α-helix	trans	-62.4	-47	174.6	-76.3	176	17.1	0	0	111.1	I581 E582 K587 R588 D589	I581-Q585 HydrophobicContact CG2-CG 4.43Å; I581-Q585 WeakPolarHBondContact O-CB 3.47Å; I581-Q585 VanDerWaalsContact O-CG 3.27Å; I581-Q585 WeakPolarHBondContact O-CG 3.46Å; I581-Q585 PolarHBondContact O-N 3.09Å; E582-Q585 PolarHBondContact O-N 3.48Å; Q585-K587 PolarHBondContact O-N 3.22Å; Q585-R588 PolarHBondContact O-N 3.26Å; Q585-D589 VanDerWaalsContact O-CB 3.31Å; Q585-D589 WeakPolarHBondContact O-CB 3.48Å; Q585-D589 VanDerWaalsContact O-CG 3.25Å; Q585-D589 PolarHBondContact O-N 2.98Å
586	V	88.1	Confident	87.5	Confident	82 Å²	82	100.9 Å²	100.9	50%	0.497	48%	0.476	S	S	.	.	H	α-helix	trans	-58.2	-45.7	174.9	169.9	0	0	0	0	111.4	E582 D589 Q590	E582-V586 WeakPolarHBondContact O-CB 3.47Å; E582-V586 WeakPolarHBondContact O-CG2 3.38Å; E582-V586 PolarHBondContact O-N 3.44Å; V586-D589 PolarHBondContact O-N 3.07Å; V586-Q590 HydrophobicContact CG1-CG 4.45Å; V586-Q590 VanDerWaalsContact O-CB 3.29Å; V586-Q590 WeakPolarHBondContact O-CB 3.42Å; V586-Q590 WeakPolarHBondContact O-CG 3.3Å; V586-Q590 PolarHBondContact O-N 3.32Å
587	K	89.1	Confident	86.8	Confident	138 Å²	138	104 Å²	104	60%	0.6	48%	0.482	S	S	*	.	H	α-helix	trans	-64.3	-39.3	175.7	-75.7	167	-177.6	167.4	0	112.9	T583 Y584 Q585 Y591	T583-K587 WeakPolarHBondContact O-CB 3.5Å; T583-K587 WeakPolarHBondContact O-CD 3.5Å; T583-K587 VanDerWaalsContact O-CG 3.26Å; T583-K587 WeakPolarHBondContact O-CG 3.44Å; T583-K587 PolarHBondContact O-N 3.27Å; Y584-K587 PolarHBondContact O-N 3.33Å; Q585-K587 PolarHBondContact O-N 3.22Å; K587-Y591 WeakPolarHBondContact O-CB 3.4Å; K587-Y591 PolarHBondContact O-N 3.26Å
588	R	86.9	Confident	86.4	Confident	108 Å²	108	105.9 Å²	105.9	41%	0.408	49%	0.489	S	S	.	.	H	α-helix	trans	-67.7	-38.2	177.7	-170.7	-156.3	70.8	166.1	-3.1	111.3	Y584 Q585 Y591 Y592	Y584-R588 VanDerWaalsContact O-CB 3.22Å; Y584-R588 WeakPolarHBondContact O-CB 3.3Å; Y584-R588 PolarHBondContact O-N 2.99Å; Q585-R588 PolarHBondContact O-N 3.26Å; R588-Y591 CarbonylContact O-C 3.56Å; R588-Y591 WeakPolarHBondContact O-CB 3.45Å; R588-Y591 PolarHBondContact O-N 2.87Å; R588-Y592 HydrophobicContact CG-CD2 3.95Å; R588-Y592 HydrophobicContact CG-CE2 3.68Å; R588-Y592 VanDerWaalsContact O-CD2 3.23Å; R588-Y592 WeakPolarHBondContact O-CD2 3.44Å; R588-Y592 PolarHBondContact O-N 3.02Å
589	D	83.4	Confident	85.7	Confident	73 Å²	73	107.9 Å²	107.9	39%	0.39	49%	0.493	S	S	.	.	H	α-helix	trans	-84.1	-30.3	-176.1	-65.8	-0	0	0	0	110.9	Q585 V586 Y592 S593	Q585-D589 VanDerWaalsContact O-CB 3.31Å; Q585-D589 WeakPolarHBondContact O-CB 3.48Å; Q585-D589 VanDerWaalsContact O-CG 3.25Å; Q585-D589 PolarHBondContact O-N 2.98Å; V586-D589 PolarHBondContact O-N 3.07Å; D589-Y592 PolarHBondContact O-N 3.06Å; D589-S593 WeakPolarHBondContact O-CB 3.42Å; D589-S593 PolarHBondContact O-N 3.37Å
590	Q	86	Confident	85	Confident	114 Å²	114	107.5 Å²	107.5	53%	0.533	49%	0.492	S	S	.	.	H	α-helix	trans	-58.7	-45.9	159.7	-76.8	172.5	-9.1	0	0	111.4	V586 S593 I594	V586-Q590 HydrophobicContact CG1-CG 4.45Å; V586-Q590 VanDerWaalsContact O-CB 3.29Å; V586-Q590 WeakPolarHBondContact O-CB 3.42Å; V586-Q590 WeakPolarHBondContact O-CG 3.3Å; V586-Q590 PolarHBondContact O-N 3.32Å; Q590-S593 PolarHBondContact O-N 2.95Å; Q590-I594 WeakPolarHBondContact O-CB 3.46Å; Q590-I594 VanDerWaalsContact O-CG1 3.28Å; Q590-I594 WeakPolarHBondContact O-CG1 3.39Å; Q590-I594 PolarHBondContact O-N 3.29Å
591	Y	85.4	Confident	84.7	Confident	153 Å²	153	104.9 Å²	104.9	60%	0.6	49%	0.488	S	S	*	.	H	α-helix	trans	-63.5	-41.8	176.3	177.6	-94	0	0	0	112.1	K587 R588 I594 V595	K587-Y591 WeakPolarHBondContact O-CB 3.4Å; K587-Y591 PolarHBondContact O-N 3.26Å; R588-Y591 CarbonylContact O-C 3.56Å; R588-Y591 WeakPolarHBondContact O-CB 3.45Å; R588-Y591 PolarHBondContact O-N 2.87Å; Y591-I594 PolarHBondContact O-N 3.36Å; Y591-V595 HydrophobicContact CD1-CG2 4.19Å; Y591-V595 HydrophobicContact CE1-CG2 3.76Å; Y591-V595 HydrophobicContact CE2-CG2 4.2Å; Y591-V595 WeakPolarHBondContact O-CB 3.33Å; Y591-V595 VanDerWaalsContact O-CG2 3.27Å; Y591-V595 WeakPolarHBondContact O-CG2 3.44Å; Y591-V595 PolarHBondContact O-N 3Å
592	Y	83.3	Confident	84	Confident	122 Å²	122	107.5 Å²	107.5	48%	0.478	50%	0.498	S	S	.	.	H	α-helix	trans	-63.8	-42.2	172.9	-80.2	-57.1	0	0	0	111.9	R588 D589 I594 V595 E596	R588-Y592 HydrophobicContact CG-CD2 3.95Å; R588-Y592 HydrophobicContact CG-CE2 3.68Å; R588-Y592 VanDerWaalsContact O-CD2 3.23Å; R588-Y592 WeakPolarHBondContact O-CD2 3.44Å; R588-Y592 PolarHBondContact O-N 3.02Å; D589-Y592 PolarHBondContact O-N 3.06Å; Y592-I594 PolarHBondContact O-N 3.43Å; Y592-V595 CarbonylContact O-C 3.56Å; Y592-V595 PolarHBondContact O-N 2.63Å; Y592-V595 VanDerWaalsContact O-N 3.12Å; Y592-E596 WeakPolarHBondContact O-CB 3.32Å; Y592-E596 WeakPolarHBondContact O-CG 3.47Å; Y592-E596 PolarHBondContact O-N 2.95Å
593	S	81.4	Confident	83.3	Confident	58 Å²	58	108.8 Å²	108.8	41%	0.406	51%	0.505	S	S	.	.	H	α-helix	trans	-59.9	-45.4	174.8	-160.8	0	0	0	0	111.2	D589 Q590 V595 E596 E597	D589-S593 WeakPolarHBondContact O-CB 3.42Å; D589-S593 PolarHBondContact O-N 3.37Å; Q590-S593 PolarHBondContact O-N 2.95Å; S593-V595 VanDerWaalsContact C-N 3.28Å; S593-V595 PolarHBondContact O-N 3Å; S593-E596 PolarHBondContact O-N 3.44Å; S593-E597 VanDerWaalsContact O-CB 3.26Å; S593-E597 WeakPolarHBondContact O-CB 3.41Å; S593-E597 VanDerWaalsContact O-CG 3.27Å; S593-E597 WeakPolarHBondContact O-CG 3.46Å; S593-E597 PolarHBondContact O-N 3.24Å
594	I	87	Confident	82.6	Confident	88 Å²	88	110.3 Å²	110.3	45%	0.451	51%	0.506	S	S	.	.	H	α-helix	trans	-64.7	-31.8	175.9	-68.3	163.5	0	0	0	111.8	Q590 Y591 Y592 R598	Q590-I594 WeakPolarHBondContact O-CB 3.46Å; Q590-I594 VanDerWaalsContact O-CG1 3.28Å; Q590-I594 WeakPolarHBondContact O-CG1 3.39Å; Q590-I594 PolarHBondContact O-N 3.29Å; Y591-I594 PolarHBondContact O-N 3.36Å; Y592-I594 PolarHBondContact O-N 3.43Å; I594-R598 VanDerWaalsContact O-CB 3.25Å; I594-R598 WeakPolarHBondContact O-CB 3.25Å; I594-R598 VanDerWaalsContact O-CG 3.22Å; I594-R598 WeakPolarHBondContact O-CG 3.27Å; I594-R598 PolarHBondContact O-N 3Å
595	V	83.1	Confident	82.2	Confident	45 Å²	45	112 Å²	112	27%	0.273	51%	0.512	S	S	.	.	H	α-helix	trans	-77.7	-35.4	176	167.4	0	0	0	0	112	Y591 Y592 S593 R598 R599	Y591-V595 HydrophobicContact CD1-CG2 4.19Å; Y591-V595 HydrophobicContact CE1-CG2 3.76Å; Y591-V595 HydrophobicContact CE2-CG2 4.2Å; Y591-V595 WeakPolarHBondContact O-CB 3.33Å; Y591-V595 VanDerWaalsContact O-CG2 3.27Å; Y591-V595 WeakPolarHBondContact O-CG2 3.44Å; Y591-V595 PolarHBondContact O-N 3Å; Y592-V595 CarbonylContact O-C 3.56Å; Y592-V595 PolarHBondContact O-N 2.63Å; Y592-V595 VanDerWaalsContact O-N 3.12Å; S593-V595 VanDerWaalsContact C-N 3.28Å; S593-V595 PolarHBondContact O-N 3Å; V595-R598 PolarHBondContact O-N 3.42Å; V595-R599 WeakPolarHBondContact O-CB 3.42Å; V595-R599 PolarHBondContact O-N 2.94Å
596	E	76.1	Confident	81.8	Confident	110 Å²	110	112.8 Å²	112.8	51%	0.514	52%	0.518	S	S	.	.	H	α-helix	trans	-74.7	-40.7	174.6	-71.6	-167.7	161.2	0	0	111.2	Y592 S593 R598 R599 Q600	Y592-E596 WeakPolarHBondContact O-CB 3.32Å; Y592-E596 WeakPolarHBondContact O-CG 3.47Å; Y592-E596 PolarHBondContact O-N 2.95Å; S593-E596 PolarHBondContact O-N 3.44Å; E596-R598 VanDerWaalsContact C-N 3.33Å; E596-R598 PolarHBondContact O-N 3.33Å; E596-R599 CarbonylContact O-C 3.58Å; E596-R599 PolarHBondContact O-N 3.49Å; E596-Q600 VanDerWaalsContact O-CB 3.31Å; E596-Q600 WeakPolarHBondContact O-CB 3.13Å; E596-Q600 VanDerWaalsContact O-CG 3.29Å; E596-Q600 WeakPolarHBondContact O-CG 3.46Å; E596-Q600 PolarHBondContact O-N 3.37Å
597	E	79.4	Confident	81.3	Confident	114 Å²	114	113.9 Å²	113.9	53%	0.533	52%	0.521	S	S	.	.	H	α-helix	trans	-57.7	-43.5	166.6	-76.9	171.9	-170.3	0	0	111.3	S593 Q600 A601	S593-E597 VanDerWaalsContact O-CB 3.26Å; S593-E597 WeakPolarHBondContact O-CB 3.41Å; S593-E597 VanDerWaalsContact O-CG 3.27Å; S593-E597 WeakPolarHBondContact O-CG 3.46Å; S593-E597 PolarHBondContact O-N 3.24Å; E597-Q600 PolarHBondContact O-N 3.29Å; E597-A601 WeakPolarHBondContact O-CB 3.27Å; E597-A601 PolarHBondContact O-N 3.05Å
598	R	82.2	Confident	80.8	Confident	182 Å²	182	112.1 Å²	112.1	69%	0.687	51%	0.513	S	S	*	.	H	α-helix	trans	-64.9	-39.4	173.8	-84.1	-179.8	176.7	-154	1	112.7	I594 V595 E596 A601 E602	I594-R598 VanDerWaalsContact O-CB 3.25Å; I594-R598 WeakPolarHBondContact O-CB 3.25Å; I594-R598 VanDerWaalsContact O-CG 3.22Å; I594-R598 WeakPolarHBondContact O-CG 3.27Å; I594-R598 PolarHBondContact O-N 3Å; V595-R598 PolarHBondContact O-N 3.42Å; E596-R598 VanDerWaalsContact C-N 3.33Å; E596-R598 PolarHBondContact O-N 3.33Å; R598-A601 PolarHBondContact O-N 2.93Å; R598-E602 WeakPolarHBondContact O-CB 3.46Å; R598-E602 PolarHBondContact O-N 2.93Å
599	R	78	Confident	80.4	Confident	151 Å²	151	108.5 Å²	108.5	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-70.5	-39.2	177.5	-177.9	-179.2	-74.2	166.4	-4.4	111.4	V595 E596 E602 Q603	V595-R599 WeakPolarHBondContact O-CB 3.42Å; V595-R599 PolarHBondContact O-N 2.94Å; E596-R599 CarbonylContact O-C 3.58Å; E596-R599 PolarHBondContact O-N 3.49Å; R599-E602 CarbonylContact O-C 3.59Å; R599-E602 PolarHBondContact O-N 3.26Å; R599-Q603 WeakPolarHBondContact O-CB 3.35Å; R599-Q603 WeakPolarHBondContact O-CG 3.26Å; R599-Q603 PolarHBondContact O-N 2.97Å
600	Q	76.2	Confident	79.9	Confident	120 Å²	120	110.9 Å²	110.9	56%	0.561	52%	0.515	S	S	*	.	H	α-helix	trans	-67.5	-38.4	172.9	-73.3	178.1	9.8	0	0	110.8	E596 E597 Q603 E604	E596-Q600 VanDerWaalsContact O-CB 3.31Å; E596-Q600 WeakPolarHBondContact O-CB 3.13Å; E596-Q600 VanDerWaalsContact O-CG 3.29Å; E596-Q600 WeakPolarHBondContact O-CG 3.46Å; E596-Q600 PolarHBondContact O-N 3.37Å; E597-Q600 PolarHBondContact O-N 3.29Å; Q600-Q603 CarbonylContact O-C 3.43Å; Q600-Q603 PolarHBondContact O-N 2.99Å; Q600-E604 WeakPolarHBondContact O-CB 3.28Å; Q600-E604 PolarHBondContact O-N 3.17Å
601	A	83.7	Confident	79.3	Confident	50 Å²	50	111.6 Å²	111.6	41%	0.413	52%	0.518	S	S	.	.	H	α-helix	trans	-71.2	-28.5	172.8	0	0	0	0	0	112.7	E597 R598 R605	E597-A601 WeakPolarHBondContact O-CB 3.27Å; E597-A601 PolarHBondContact O-N 3.05Å; R598-A601 PolarHBondContact O-N 2.93Å; A601-R605 WeakPolarHBondContact O-CB 3Å; A601-R605 WeakPolarHBondContact O-CG 3.37Å; A601-R605 PolarHBondContact O-N 3.33Å
602	E	77.8	Confident	78.8	Confident	132 Å²	132	107.9 Å²	107.9	62%	0.617	51%	0.512	S	S	*	.	H	α-helix	trans	-72.5	-39.9	167.3	-87.5	-172.6	148.8	0	0	111.6	R598 R599 R605 L606	R598-E602 WeakPolarHBondContact O-CB 3.46Å; R598-E602 PolarHBondContact O-N 2.93Å; R599-E602 CarbonylContact O-C 3.59Å; R599-E602 PolarHBondContact O-N 3.26Å; E602-R605 CarbonylContact O-C 3.57Å; E602-R605 PolarHBondContact O-N 3.31Å; E602-L606 VanDerWaalsContact O-CB 3.3Å; E602-L606 WeakPolarHBondContact O-CB 3.36Å; E602-L606 VanDerWaalsContact O-CG 3.22Å; E602-L606 WeakPolarHBondContact O-CG 3.47Å; E602-L606 PolarHBondContact O-N 2.97Å
603	Q	75.4	Confident	78.5	Confident	113 Å²	113	107 Å²	107	53%	0.528	52%	0.515	S	S	.	.	H	α-helix	trans	-70.2	-38.5	175.4	-76	-177.8	-62.2	0	0	112.2	R599 Q600 L606 L607	R599-Q603 WeakPolarHBondContact O-CB 3.35Å; R599-Q603 WeakPolarHBondContact O-CG 3.26Å; R599-Q603 PolarHBondContact O-N 2.97Å; Q600-Q603 CarbonylContact O-C 3.43Å; Q600-Q603 PolarHBondContact O-N 2.99Å; Q603-L606 PolarHBondContact O-N 2.93Å; Q603-L607 VanDerWaalsContact O-CB 3.32Å; Q603-L607 WeakPolarHBondContact O-CB 3.22Å; Q603-L607 WeakPolarHBondContact O-CG 3.5Å; Q603-L607 PolarHBondContact O-N 3.23Å
604	E	76.7	Confident	78.1	Confident	106 Å²	106	109.8 Å²	109.8	50%	0.495	53%	0.525	S	S	.	.	H	α-helix	trans	-66	-38.2	168	-83.7	-148.5	153.7	0	0	111.1	Q600 L606 K608	Q600-E604 WeakPolarHBondContact O-CB 3.28Å; Q600-E604 PolarHBondContact O-N 3.17Å; E604-L606 VanDerWaalsContact C-N 3.3Å; E604-K608 WeakPolarHBondContact O-CA 3.31Å; E604-K608 WeakPolarHBondContact O-CB 3.49Å; E604-K608 WeakPolarHBondContact O-CD 3.46Å; E604-K608 WeakPolarHBondContact O-CG 3.39Å; E604-K608 PolarHBondContact O-N 2.85Å; E604-K608 IonicContact OE1-NZ 2.68Å; E604-K608 PolarHBondContact OE1-NZ 3.4Å; E604-K608 IonicContact OE2-NZ 3.58Å; E604-K608 PolarHBondContact OE2-NZ 3.43Å
605	R	80.3	Confident	77.6	Confident	198 Å²	198	107.6 Å²	107.6	75%	0.747	52%	0.52	S	S	*	.	H	α-helix	trans	-69	-29.5	173.5	-85.3	177.5	165.1	-163.8	-4.2	112.5	A601 E602 A609	A601-R605 WeakPolarHBondContact O-CB 3Å; A601-R605 WeakPolarHBondContact O-CG 3.37Å; A601-R605 PolarHBondContact O-N 3.33Å; E602-R605 CarbonylContact O-C 3.57Å; E602-R605 PolarHBondContact O-N 3.31Å; R605-A609 WeakPolarHBondContact O-CA 3.42Å; R605-A609 WeakPolarHBondContact O-CB 3.48Å; R605-A609 PolarHBondContact O-N 3.14Å
606	L	79.3	Confident	77.2	Confident	111 Å²	111	109.2 Å²	109.2	58%	0.581	53%	0.528	S	S	*	.	H	α-helix	trans	-77.7	-43.5	175.3	-77.1	166.4	0	0	0	110.9	E602 Q603 E604 A609 E610	E602-L606 VanDerWaalsContact O-CB 3.3Å; E602-L606 WeakPolarHBondContact O-CB 3.36Å; E602-L606 VanDerWaalsContact O-CG 3.22Å; E602-L606 WeakPolarHBondContact O-CG 3.47Å; E602-L606 PolarHBondContact O-N 2.97Å; Q603-L606 PolarHBondContact O-N 2.93Å; E604-L606 VanDerWaalsContact C-N 3.3Å; L606-A609 CarbonylContact O-C 3.54Å; L606-A609 WeakPolarHBondContact O-CA 3.29Å; L606-A609 WeakPolarHBondContact O-CB 3.4Å; L606-A609 PolarHBondContact O-N 2.98Å; L606-A609 VanDerWaalsContact O-N 3.12Å; L606-E610 WeakPolarHBondContact O-CG 3.48Å; L606-E610 PolarHBondContact O-N 2.89Å
607	L	76.1	Confident	77	Confident	105 Å²	105	108.2 Å²	108.2	55%	0.55	52%	0.523	S	S	.	.	H	α-helix	trans	-65.7	-43.9	172.4	-77.2	168.5	0	0	0	111.2	Q603 A609 E610 E611	Q603-L607 VanDerWaalsContact O-CB 3.32Å; Q603-L607 WeakPolarHBondContact O-CB 3.22Å; Q603-L607 WeakPolarHBondContact O-CG 3.5Å; Q603-L607 PolarHBondContact O-N 3.23Å; L607-A609 PolarHBondContact O-N 3.42Å; L607-E610 CarbonylContact O-C 3.6Å; L607-E610 PolarHBondContact O-N 3.48Å; L607-E610 VanDerWaalsContact O-N 3.14Å; L607-E611 WeakPolarHBondContact O-CB 3.49Å; L607-E611 WeakPolarHBondContact O-CG 3.36Å; L607-E611 PolarHBondContact O-N 2.93Å
608	K	78.7	Confident	76.7	Confident	102 Å²	102	105 Å²	105	44%	0.443	52%	0.516	S	S	.	.	H	α-helix	trans	-69.2	-21.6	171.4	-67.2	164.2	-176.6	166.8	0	111.6	E604 T612	E604-K608 WeakPolarHBondContact O-CA 3.31Å; E604-K608 WeakPolarHBondContact O-CB 3.49Å; E604-K608 WeakPolarHBondContact O-CD 3.46Å; E604-K608 WeakPolarHBondContact O-CG 3.39Å; E604-K608 PolarHBondContact O-N 2.85Å; E604-K608 IonicContact OE1-NZ 2.68Å; E604-K608 PolarHBondContact OE1-NZ 3.4Å; E604-K608 IonicContact OE2-NZ 3.58Å; E604-K608 PolarHBondContact OE2-NZ 3.43Å; K608-T612 WeakPolarHBondContact O-CA 3.28Å; K608-T612 WeakPolarHBondContact O-CB 3.44Å; K608-T612 WeakPolarHBondContact O-CG2 3.39Å; K608-T612 PolarHBondContact O-N 2.95Å; K608-T612 PolarHBondContact O-OG1 3.05Å
609	A	79.9	Confident	76.2	Confident	32 Å²	32	99.8 Å²	99.8	26%	0.264	50%	0.501	S	S	.	.	H	α-helix	trans	-80.3	-28.9	168.2	0	0	0	0	0	112.5	R605 L606 L607 T612 N613	R605-A609 WeakPolarHBondContact O-CA 3.42Å; R605-A609 WeakPolarHBondContact O-CB 3.48Å; R605-A609 PolarHBondContact O-N 3.14Å; L606-A609 CarbonylContact O-C 3.54Å; L606-A609 WeakPolarHBondContact O-CA 3.29Å; L606-A609 WeakPolarHBondContact O-CB 3.4Å; L606-A609 PolarHBondContact O-N 2.98Å; L606-A609 VanDerWaalsContact O-N 3.12Å; L607-A609 PolarHBondContact O-N 3.42Å; A609-T612 WeakPolarHBondContact CA-OG1 3.27Å; A609-N613 WeakPolarHBondContact O-CA 3.45Å; A609-N613 WeakPolarHBondContact O-CB 3.41Å; A609-N613 PolarHBondContact O-N 2.85Å; A609-N613 PolarHBondContact O-ND2 3.48Å
610	E	72.6	Confident	75.7	Confident	122 Å²	122	98.7 Å²	98.7	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-78.6	-41.2	172.9	-77.3	-172.4	139.7	0	0	111	L606 L607 N613 L614	L606-E610 WeakPolarHBondContact O-CG 3.48Å; L606-E610 PolarHBondContact O-N 2.89Å; L607-E610 CarbonylContact O-C 3.6Å; L607-E610 PolarHBondContact O-N 3.48Å; L607-E610 VanDerWaalsContact O-N 3.14Å; E610-N613 PolarHBondContact O-N 2.89Å; E610-L614 VanDerWaalsContact O-CB 3.26Å; E610-L614 WeakPolarHBondContact O-CB 3.41Å; E610-L614 WeakPolarHBondContact O-CG 3.4Å; E610-L614 PolarHBondContact O-N 3.39Å
611	E	73.1	Confident	75.4	Confident	129 Å²	129	100.1 Å²	100.1	60%	0.603	50%	0.503	S	S	*	.	H	α-helix	trans	-63.6	-45.7	168.4	-73.4	-173.4	141.2	0	0	110.7	L607 N613 A615	L607-E611 WeakPolarHBondContact O-CB 3.49Å; L607-E611 WeakPolarHBondContact O-CG 3.36Å; L607-E611 PolarHBondContact O-N 2.93Å; E611-N613 VanDerWaalsContact C-N 3.33Å; E611-A615 WeakPolarHBondContact O-CA 3.47Å; E611-A615 WeakPolarHBondContact O-CB 3.02Å; E611-A615 PolarHBondContact O-N 3.29Å
612	T	74.7	Confident	74.6	Confident	76 Å²	76	103.8 Å²	103.8	47%	0.466	51%	0.511	S	S	.	.	H	α-helix	trans	-74.9	-17.1	173	61.5	0	0	0	0	113.3	K608 A609 N616	K608-T612 WeakPolarHBondContact O-CA 3.28Å; K608-T612 WeakPolarHBondContact O-CB 3.44Å; K608-T612 WeakPolarHBondContact O-CG2 3.39Å; K608-T612 PolarHBondContact O-N 2.95Å; K608-T612 PolarHBondContact O-OG1 3.05Å; A609-T612 WeakPolarHBondContact CA-OG1 3.27Å; T612-N616 WeakPolarHBondContact O-CA 3.26Å; T612-N616 WeakPolarHBondContact O-CB 3.43Å; T612-N616 PolarHBondContact O-N 3.18Å; T612-N616 PolarHBondContact O-ND2 3.09Å
613	N	77.7	Confident	74.2	Confident	102 Å²	102	103.5 Å²	103.5	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-80.2	-41.7	169.1	-79.1	-24.5	0	0	0	111.2	A609 E610 E611 N616 E617	A609-N613 WeakPolarHBondContact O-CA 3.45Å; A609-N613 WeakPolarHBondContact O-CB 3.41Å; A609-N613 PolarHBondContact O-N 2.85Å; A609-N613 PolarHBondContact O-ND2 3.48Å; E610-N613 PolarHBondContact O-N 2.89Å; E611-N613 VanDerWaalsContact C-N 3.33Å; N613-N616 CarbonylContact O-C 3.56Å; N613-N616 PolarHBondContact O-N 3.07Å; N613-E617 VanDerWaalsContact O-CB 3.24Å; N613-E617 WeakPolarHBondContact O-CB 3.46Å; N613-E617 PolarHBondContact O-N 3.36Å
614	L	71.8	Confident	73.7	Confident	117 Å²	117	105.2 Å²	105.2	61%	0.613	51%	0.514	S	S	*	.	H	α-helix	trans	-66.5	-39.7	172.5	-79.2	163.3	0	0	0	111	E610 E617 A618	E610-L614 VanDerWaalsContact O-CB 3.26Å; E610-L614 WeakPolarHBondContact O-CB 3.41Å; E610-L614 WeakPolarHBondContact O-CG 3.4Å; E610-L614 PolarHBondContact O-N 3.39Å; L614-E617 PolarHBondContact O-N 3.2Å; L614-A618 VanDerWaalsContact O-CB 3.29Å; L614-A618 WeakPolarHBondContact O-CB 3.24Å; L614-A618 PolarHBondContact O-N 2.98Å
615	A	77	Confident	73.1	Confident	43 Å²	43	107 Å²	107	36%	0.355	52%	0.521	S	S	.	.	H	α-helix	trans	-72.2	-34.4	171.1	0	0	0	0	0	111.3	E611 E617 I619	E611-A615 WeakPolarHBondContact O-CA 3.47Å; E611-A615 WeakPolarHBondContact O-CB 3.02Å; E611-A615 PolarHBondContact O-N 3.29Å; A615-E617 VanDerWaalsContact C-N 3.3Å; A615-I619 WeakPolarHBondContact O-CA 3.48Å; A615-I619 WeakPolarHBondContact O-CB 3.4Å; A615-I619 WeakPolarHBondContact O-CD1 3.39Å; A615-I619 WeakPolarHBondContact O-CG1 3.26Å; A615-I619 PolarHBondContact O-N 3.48Å
616	N	74.5	Confident	72.2	Confident	79 Å²	79	99.4 Å²	99.4	42%	0.422	50%	0.496	S	S	.	.	H	α-helix	trans	-73.2	-19.9	169.8	-77.7	-36.2	0	0	0	112.3	T612 N613 I619 Q620	T612-N616 WeakPolarHBondContact O-CA 3.26Å; T612-N616 WeakPolarHBondContact O-CB 3.43Å; T612-N616 PolarHBondContact O-N 3.18Å; T612-N616 PolarHBondContact O-ND2 3.09Å; N613-N616 CarbonylContact O-C 3.56Å; N613-N616 PolarHBondContact O-N 3.07Å; N616-I619 CarbonylContact O-C 3.53Å; N616-Q620 WeakPolarHBondContact O-CA 3.34Å; N616-Q620 WeakPolarHBondContact O-CB 3.36Å; N616-Q620 WeakPolarHBondContact O-CG 3.34Å; N616-Q620 PolarHBondContact O-N 2.98Å
617	E	72.9	Confident	71.4	Confident	88 Å²	88	98.7 Å²	98.7	41%	0.411	49%	0.489	S	S	.	.	H	α-helix	trans	-85.6	-36.8	174.1	-155	-160.6	166.8	0	0	110.2	N613 L614 A615 Q620 R621	N613-E617 VanDerWaalsContact O-CB 3.24Å; N613-E617 WeakPolarHBondContact O-CB 3.46Å; N613-E617 PolarHBondContact O-N 3.36Å; L614-E617 PolarHBondContact O-N 3.2Å; A615-E617 VanDerWaalsContact C-N 3.3Å; E617-Q620 CarbonylContact O-C 3.55Å; E617-Q620 PolarHBondContact O-N 3.44Å; E617-R621 WeakPolarHBondContact O-CB 3.15Å; E617-R621 VanDerWaalsContact O-CG 3.24Å; E617-R621 WeakPolarHBondContact O-CG 3.38Å; E617-R621 PolarHBondContact O-N 2.98Å; E617-R621 IonicContact OE1-CZ 2.9Å; E617-R621 IonicContact OE1-NE 3.75Å; E617-R621 IonicContact OE1-NH2 2.66Å; E617-R621 PolarHBondContact OE1-NH2 3.43Å; E617-R621 IonicContact OE2-CZ 3.25Å; E617-R621 IonicContact OE2-NH2 3.54Å; E617-R621 PolarHBondContact OE2-NH2 2.92Å
618	A	72.7	Confident	70.7	Confident	48 Å²	48	98.8 Å²	98.8	40%	0.397	49%	0.491	S	S	.	.	H	α-helix	trans	-63.9	-47.6	166.3	0	0	0	0	0	110.6	L614 Q620 R621 E622	L614-A618 VanDerWaalsContact O-CB 3.29Å; L614-A618 WeakPolarHBondContact O-CB 3.24Å; L614-A618 PolarHBondContact O-N 2.98Å; A618-Q620 VanDerWaalsContact C-N 3.28Å; A618-Q620 PolarHBondContact O-N 2.68Å; A618-R621 CarbonylContact O-C 3.51Å; A618-R621 PolarHBondContact O-N 3.06Å; A618-R621 VanDerWaalsContact O-N 3.12Å; A618-E622 PolarHBondContact O-N 3.44Å
619	I	71.9	Confident	69.8	Low	71 Å²	71	99.7 Å²	99.7	36%	0.364	50%	0.496	S	S	.	.	H	α-helix	trans	-69.4	-21.1	172.4	-66	163.4	0	0	0	111	A615 N616 E622 R623	A615-I619 WeakPolarHBondContact O-CA 3.48Å; A615-I619 WeakPolarHBondContact O-CB 3.4Å; A615-I619 WeakPolarHBondContact O-CD1 3.39Å; A615-I619 WeakPolarHBondContact O-CG1 3.26Å; A615-I619 PolarHBondContact O-N 3.48Å; N616-I619 CarbonylContact O-C 3.53Å; I619-E622 CarbonylContact O-C 3.57Å; I619-R623 HydrophobicContact CG2-CG 4.04Å; I619-R623 WeakPolarHBondContact O-CA 3.35Å; I619-R623 WeakPolarHBondContact O-CB 3.38Å; I619-R623 WeakPolarHBondContact O-CG 3.49Å; I619-R623 PolarHBondContact O-N 3.16Å
620	Q	66.9	Low	68.9	Low	129 Å²	129	102.9 Å²	102.9	60%	0.603	50%	0.504	S	S	*	.	H	α-helix	trans	-83.5	-24.2	167.3	-87.7	-168.6	-0.5	0	0	112.5	N616 E617 A618 M624	N616-Q620 WeakPolarHBondContact O-CA 3.34Å; N616-Q620 WeakPolarHBondContact O-CB 3.36Å; N616-Q620 WeakPolarHBondContact O-CG 3.34Å; N616-Q620 PolarHBondContact O-N 2.98Å; E617-Q620 CarbonylContact O-C 3.55Å; E617-Q620 PolarHBondContact O-N 3.44Å; A618-Q620 VanDerWaalsContact C-N 3.28Å; A618-Q620 PolarHBondContact O-N 2.68Å; Q620-M624 WeakPolarHBondContact O-CA 3.48Å; Q620-M624 WeakPolarHBondContact O-CB 3.39Å; Q620-M624 WeakPolarHBondContact O-CG 3.43Å; Q620-M624 PolarHBondContact O-N 2.98Å
621	R	69.7	Low	68.4	Low	150 Å²	150	99.7 Å²	99.7	57%	0.566	50%	0.499	S	S	*	.	H	α-helix	trans	-74.1	-38.1	166.7	-68.6	166.6	-162.3	158.7	2.9	110.3	E617 A618 K625	E617-R621 WeakPolarHBondContact O-CB 3.15Å; E617-R621 VanDerWaalsContact O-CG 3.24Å; E617-R621 WeakPolarHBondContact O-CG 3.38Å; E617-R621 PolarHBondContact O-N 2.98Å; E617-R621 IonicContact OE1-CZ 2.9Å; E617-R621 IonicContact OE1-NE 3.75Å; E617-R621 IonicContact OE1-NH2 2.66Å; E617-R621 PolarHBondContact OE1-NH2 3.43Å; E617-R621 IonicContact OE2-CZ 3.25Å; E617-R621 IonicContact OE2-NH2 3.54Å; E617-R621 PolarHBondContact OE2-NH2 2.92Å; A618-R621 CarbonylContact O-C 3.51Å; A618-R621 PolarHBondContact O-N 3.06Å; A618-R621 VanDerWaalsContact O-N 3.12Å; R621-K625 WeakPolarHBondContact O-CG 3.44Å; R621-K625 PolarHBondContact O-N 3.13Å; R621-K625 VanDerWaalsContact O-N 3.07Å
622	E	67.9	Low	67.7	Low	126 Å²	126	103 Å²	103	59%	0.589	51%	0.506	S	S	*	.	H	α-helix	trans	-78.5	-19.5	171.9	-67.3	-154	145.1	0	0	114.1	A618 I619 T626	A618-E622 PolarHBondContact O-N 3.44Å; I619-E622 CarbonylContact O-C 3.57Å; E622-T626 WeakPolarHBondContact O-CA 3.3Å; E622-T626 WeakPolarHBondContact O-CB 3.42Å; E622-T626 WeakPolarHBondContact O-CG2 3.34Å; E622-T626 PolarHBondContact O-N 3.42Å; E622-T626 PolarHBondContact O-OG1 2.95Å
623	R	67.9	Low	66.9	Low	126 Å²	126	103.6 Å²	103.6	48%	0.475	51%	0.506	S	S	.	.	H	α-helix	trans	-87.8	-31.6	165.9	-77.9	176.5	-172.3	-153.3	13.7	111.7	I619 K625 T626 E627	I619-R623 HydrophobicContact CG2-CG 4.04Å; I619-R623 WeakPolarHBondContact O-CA 3.35Å; I619-R623 WeakPolarHBondContact O-CB 3.38Å; I619-R623 WeakPolarHBondContact O-CG 3.49Å; I619-R623 PolarHBondContact O-N 3.16Å; R623-K625 PolarHBondContact O-N 2.68Å; R623-T626 PolarHBondContact O-N 2.78Å; R623-E627 HydrophobicContact CB-CG 3.87Å; R623-E627 WeakPolarHBondContact CD-OE1 3.33Å; R623-E627 HydrophobicContact CG-CG 4.18Å; R623-E627 IonicContact NH1-OE1 3.07Å; R623-E627 WeakPolarHBondContact O-CA 3.34Å; R623-E627 WeakPolarHBondContact O-CB 3.28Å; R623-E627 VanDerWaalsContact O-CG 3.29Å; R623-E627 WeakPolarHBondContact O-CG 3.46Å; R623-E627 PolarHBondContact O-N 3.24Å
624	M	64.8	Low	65.8	Low	149 Å²	149	105.5 Å²	105.5	73%	0.734	51%	0.509	S	S	*	.	H	α-helix	trans	-58.8	-40.6	167	-77.2	-77.6	-74	0	0	109.4	Q620 D628	Q620-M624 WeakPolarHBondContact O-CA 3.48Å; Q620-M624 WeakPolarHBondContact O-CB 3.39Å; Q620-M624 WeakPolarHBondContact O-CG 3.43Å; Q620-M624 PolarHBondContact O-N 2.98Å; M624-D628 WeakPolarHBondContact O-CB 3.39Å; M624-D628 PolarHBondContact O-N 3.17Å; M624-D628 VanDerWaalsContact O-N 3.1Å
625	K	64.5	Low	65	Low	145 Å²	145	106.2 Å²	106.2	63%	0.63	51%	0.513	S	S	*	.	H	α-helix	trans	-66.3	-62.9	167.8	-69.9	176	179.4	-177.6	0	113.1	R621 R623 E627 D628 E629	R621-K625 WeakPolarHBondContact O-CG 3.44Å; R621-K625 PolarHBondContact O-N 3.13Å; R621-K625 VanDerWaalsContact O-N 3.07Å; R623-K625 PolarHBondContact O-N 2.68Å; K625-E627 VanDerWaalsContact C-N 3.25Å; K625-E627 PolarHBondContact O-N 3.24Å; K625-D628 WeakPolarHBondContact O-CB 3.15Å; K625-D628 PolarHBondContact O-N 3.47Å; K625-D628 VanDerWaalsContact O-N 3.11Å; K625-E629 WeakPolarHBondContact O-CG 3.4Å; K625-E629 PolarHBondContact O-N 3.07Å
626	T	62.6	Low	63.8	Low	38 Å²	38	113.4 Å²	113.4	23%	0.233	53%	0.531	C	S	.	.	H	α-helix	trans	-77.7	-3.1	-171.9	69.8	0	0	0	0	114.2	E622 R623 K630	E622-T626 WeakPolarHBondContact O-CA 3.3Å; E622-T626 WeakPolarHBondContact O-CB 3.42Å; E622-T626 WeakPolarHBondContact O-CG2 3.34Å; E622-T626 PolarHBondContact O-N 3.42Å; E622-T626 PolarHBondContact O-OG1 2.95Å; R623-T626 PolarHBondContact O-N 2.78Å; T626-K630 WeakPolarHBondContact O-CA 3.47Å; T626-K630 WeakPolarHBondContact O-CB 3.37Å; T626-K630 WeakPolarHBondContact O-CD 3.1Å; T626-K630 WeakPolarHBondContact O-CG 3.48Å; T626-K630 PolarHBondContact O-N 3.24Å; T626-K630 PolarHBondContact OG1-NZ 3.45Å
627	E	61	Low	62.7	Low	95 Å²	95	114.4 Å²	114.4	44%	0.444	53%	0.534	S	S	.	.	H	α-helix	trans	-105.6	-12.8	166.8	-55.5	179.7	164.8	0	0	111.7	R623 K625 A631	R623-E627 HydrophobicContact CB-CG 3.87Å; R623-E627 WeakPolarHBondContact CD-OE1 3.33Å; R623-E627 HydrophobicContact CG-CG 4.18Å; R623-E627 IonicContact NH1-OE1 3.07Å; R623-E627 WeakPolarHBondContact O-CA 3.34Å; R623-E627 WeakPolarHBondContact O-CB 3.28Å; R623-E627 VanDerWaalsContact O-CG 3.29Å; R623-E627 WeakPolarHBondContact O-CG 3.46Å; R623-E627 PolarHBondContact O-N 3.24Å; K625-E627 VanDerWaalsContact C-N 3.25Å; K625-E627 PolarHBondContact O-N 3.24Å; E627-A631 WeakPolarHBondContact O-CA 3.34Å; E627-A631 WeakPolarHBondContact O-CB 3.28Å; E627-A631 PolarHBondContact O-N 2.7Å
628	D	62.9	Low	61.6	Low	107 Å²	107	113.1 Å²	113.1	57%	0.572	54%	0.539	S	S	*	.	H	α-helix	trans	-66	-47.1	151.9	-121.3	-11.1	0	0	0	108.7	M624 K625 R632	M624-D628 WeakPolarHBondContact O-CB 3.39Å; M624-D628 PolarHBondContact O-N 3.17Å; M624-D628 VanDerWaalsContact O-N 3.1Å; K625-D628 WeakPolarHBondContact O-CB 3.15Å; K625-D628 PolarHBondContact O-N 3.47Å; K625-D628 VanDerWaalsContact O-N 3.11Å; D628-R632 WeakPolarHBondContact O-CB 3.4Å; D628-R632 VanDerWaalsContact O-CG 3.26Å; D628-R632 WeakPolarHBondContact O-CG 3.49Å; D628-R632 PolarHBondContact O-N 3.08Å
629	E	59.6	Low	60.6	Low	121 Å²	121	120.6 Å²	120.6	57%	0.565	56%	0.557	S	S	*	*	H	α-helix	trans	-65.9	-43.9	174.7	-63.1	173.8	155	0	0	112.2	K625 R632 L633	K625-E629 WeakPolarHBondContact O-CG 3.4Å; K625-E629 PolarHBondContact O-N 3.07Å; E629-R632 CarbonylContact O-C 3.6Å; E629-R632 WeakPolarHBondContact O-CB 3.47Å; E629-R632 PolarHBondContact O-N 3.11Å; E629-L633 WeakPolarHBondContact O-CB 3.4Å; E629-L633 PolarHBondContact O-N 3.43Å
630	K	60	Low	59.4	Low	100 Å²	100	120.9 Å²	120.9	44%	0.435	56%	0.562	S	S	.	*	H	α-helix	trans	-85	-9	176.9	-66.3	160.8	-162.3	147.5	0	114.2	T626 K634	T626-K630 WeakPolarHBondContact O-CA 3.47Å; T626-K630 WeakPolarHBondContact O-CB 3.37Å; T626-K630 WeakPolarHBondContact O-CD 3.1Å; T626-K630 WeakPolarHBondContact O-CG 3.48Å; T626-K630 PolarHBondContact O-N 3.24Å; T626-K630 PolarHBondContact OG1-NZ 3.45Å; K630-K634 WeakPolarHBondContact O-CA 3.29Å; K630-K634 WeakPolarHBondContact O-CB 3.43Å; K630-K634 WeakPolarHBondContact O-CG 3.46Å; K630-K634 PolarHBondContact O-N 3.38Å
631	A	61.9	Low	58.3	Low	55 Å²	55	117.1 Å²	117.1	46%	0.455	55%	0.55	S	S	.	.	H	α-helix	trans	-74.6	-45.7	160.3	0	0	0	0	0	108.4	E627 L633 K634 L635	E627-A631 WeakPolarHBondContact O-CA 3.34Å; E627-A631 WeakPolarHBondContact O-CB 3.28Å; E627-A631 PolarHBondContact O-N 2.7Å; A631-L633 PolarHBondContact O-N 2.95Å; A631-K634 PolarHBondContact O-N 3.01Å; A631-L635 WeakPolarHBondContact O-CB 3.49Å; A631-L635 PolarHBondContact O-N 2.9Å
632	R	59.3	Low	57	Low	198 Å²	198	117.1 Å²	117.1	75%	0.747	56%	0.56	S	S	*	*	H	α-helix	trans	-56.7	-37.9	169.9	-69.8	169.9	177.6	-160.7	-1.9	112	D628 E629	D628-R632 WeakPolarHBondContact O-CB 3.4Å; D628-R632 VanDerWaalsContact O-CG 3.26Å; D628-R632 WeakPolarHBondContact O-CG 3.49Å; D628-R632 PolarHBondContact O-N 3.08Å; E629-R632 CarbonylContact O-C 3.6Å; E629-R632 WeakPolarHBondContact O-CB 3.47Å; E629-R632 PolarHBondContact O-N 3.11Å
633	L	57	Low	56.1	Low	89 Å²	89	119.5 Å²	119.5	47%	0.466	57%	0.569	S	S	.	*	H	α-helix	trans	-80.2	-40.3	176.9	-156.2	71.6	0	0	0	113.7	E629 A631 R636 M637	E629-L633 WeakPolarHBondContact O-CB 3.4Å; E629-L633 PolarHBondContact O-N 3.43Å; A631-L633 PolarHBondContact O-N 2.95Å; L633-R636 CarbonylContact O-C 3.52Å; L633-R636 WeakPolarHBondContact O-CA 3.49Å; L633-R636 VanDerWaalsContact O-CB 3.25Å; L633-R636 WeakPolarHBondContact O-CB 3.36Å; L633-R636 PolarHBondContact O-N 3.49Å; L633-M637 HydrophobicContact CG-SD 4.47Å; L633-M637 WeakPolarHBondContact O-CG 3.37Å; L633-M637 PolarHBondContact O-N 3.08Å
634	K	54.5	Low	54.9	Low	142 Å²	142	120.9 Å²	120.9	62%	0.617	58%	0.582	S	S	*	*	H	α-helix	trans	-75	-30.9	177.8	-75.9	179.8	173.3	179.8	0	112.7	K630 A631 R636 M637 A638	K630-K634 WeakPolarHBondContact O-CA 3.29Å; K630-K634 WeakPolarHBondContact O-CB 3.43Å; K630-K634 WeakPolarHBondContact O-CG 3.46Å; K630-K634 PolarHBondContact O-N 3.38Å; A631-K634 PolarHBondContact O-N 3.01Å; K634-R636 PolarHBondContact O-N 2.8Å; K634-M637 PolarHBondContact O-N 3.04Å; K634-A638 WeakPolarHBondContact O-CB 3.44Å; K634-A638 PolarHBondContact O-N 3.23Å
635	L	55	Low	53.8	Low	132 Å²	132	123.2 Å²	123.2	69%	0.691	59%	0.588	S	S	*	*	H	α-helix	trans	-63.7	-23.7	168.8	-160.9	97	0	0	0	111	A631	A631-L635 WeakPolarHBondContact O-CB 3.49Å; A631-L635 PolarHBondContact O-N 2.9Å
636	R	53.5	Low	52.8	Low	194 Å²	194	123.1 Å²	123.1	73%	0.732	59%	0.594	S	S	*	*	H	α-helix	trans	-83.3	-45.6	171.4	-154	173.6	-174.4	164.1	0.6	112	L633 K634 R639	L633-R636 CarbonylContact O-C 3.52Å; L633-R636 WeakPolarHBondContact O-CA 3.49Å; L633-R636 VanDerWaalsContact O-CB 3.25Å; L633-R636 WeakPolarHBondContact O-CB 3.36Å; L633-R636 PolarHBondContact O-N 3.49Å; K634-R636 PolarHBondContact O-N 2.8Å; R636-R639 VanDerWaalsContact O-CB 3.31Å; R636-R639 WeakPolarHBondContact O-CB 3.22Å; R636-R639 PolarHBondContact O-N 3.2Å
637	M	51.3	Low	51.7	Low	100 Å²	100	127.3 Å²	127.3	49%	0.493	62%	0.615	S	S	.	*	H	α-helix	trans	-78.5	-36.1	-176.8	-70.8	-168.3	76.8	0	0	114.4	L633 K634 R639 T640 S641	L633-M637 HydrophobicContact CG-SD 4.47Å; L633-M637 WeakPolarHBondContact O-CG 3.37Å; L633-M637 PolarHBondContact O-N 3.08Å; K634-M637 PolarHBondContact O-N 3.04Å; M637-R639 PolarHBondContact O-N 3.12Å; M637-T640 WeakPolarHBondContact CA-OG1 3.38Å; M637-T640 CarbonylContact O-C 3.39Å; M637-T640 PolarHBondContact O-N 3.23Å; M637-T640 PolarHBondContact O-OG1 3.26Å; M637-S641 WeakPolarHBondContact O-CB 3.35Å; M637-S641 PolarHBondContact O-N 3.38Å; M637-S641 PolarHBondContact O-OG 3.38Å
638	A	49.6	Very low	50.6	Low	61 Å²	61	130.7 Å²	130.7	50%	0.504	64%	0.635	S	S	.	*	H	α-helix	trans	-59.4	-34.5	170.4	0	0	0	0	0	110.5	K634 T640 L642	K634-A638 WeakPolarHBondContact O-CB 3.44Å; K634-A638 PolarHBondContact O-N 3.23Å; A638-T640 PolarHBondContact O-N 3.35Å; A638-L642 WeakPolarHBondContact O-CB 3.46Å; A638-L642 PolarHBondContact O-N 3.2Å; A638-L642 VanDerWaalsContact O-N 3.14Å
639	R	50.8	Low	49.4	Very low	205 Å²	205	134.8 Å²	134.8	77%	0.774	65%	0.648	S	S	*	*	H	α-helix	trans	-66.5	-15.1	172.8	-120.1	173.9	176.9	165.3	-1.2	114.8	R636 M637	R636-R639 VanDerWaalsContact O-CB 3.31Å; R636-R639 WeakPolarHBondContact O-CB 3.22Å; R636-R639 PolarHBondContact O-N 3.2Å; M637-R639 PolarHBondContact O-N 3.12Å
640	T	46.6	Very low	48.2	Very low	77 Å²	77	136.3 Å²	136.3	47%	0.472	66%	0.658	S	S	.	*	H	α-helix	trans	-113.1	-35.4	177.4	51.1	0	0	0	0	113.6	M637 A638 K643 M644	M637-T640 WeakPolarHBondContact CA-OG1 3.38Å; M637-T640 CarbonylContact O-C 3.39Å; M637-T640 PolarHBondContact O-N 3.23Å; M637-T640 PolarHBondContact O-OG1 3.26Å; A638-T640 PolarHBondContact O-N 3.35Å; T640-K643 CarbonylContact O-C 3.42Å; T640-K643 WeakPolarHBondContact O-CA 3.22Å; T640-K643 WeakPolarHBondContact O-CB 3.4Å; T640-K643 PolarHBondContact O-N 3.21Å; T640-M644 PolarHBondContact O-N 2.82Å
641	S	44.8	Very low	47	Very low	50 Å²	50	137.8 Å²	137.8	35%	0.35	67%	0.671	S	S	.	*	H	α-helix	trans	-73.7	-30.2	176.6	-62.1	0	0	0	0	112.4	M637 K643 M644 F645	M637-S641 WeakPolarHBondContact O-CB 3.35Å; M637-S641 PolarHBondContact O-N 3.38Å; M637-S641 PolarHBondContact O-OG 3.38Å; S641-K643 PolarHBondContact O-N 3.43Å; S641-K643 VanDerWaalsContact O-N 3.12Å; S641-M644 PolarHBondContact O-N 3.47Å; S641-F645 PolarHBondContact O-N 3.19Å
642	L	42.2	Very low	45.8	Very low	150 Å²	150	140.7 Å²	140.7	79%	0.785	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-10.3	166.2	-168.9	139.8	0	0	0	112.4	A638	A638-L642 WeakPolarHBondContact O-CB 3.46Å; A638-L642 PolarHBondContact O-N 3.2Å; A638-L642 VanDerWaalsContact O-N 3.14Å
643	K	47.8	Very low	44.8	Very low	176 Å²	176	140.5 Å²	140.5	77%	0.765	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	-0.9	172.8	-145.9	-176.8	-177.7	-174.2	0	113.7	T640 S641	T640-K643 CarbonylContact O-C 3.42Å; T640-K643 WeakPolarHBondContact O-CA 3.22Å; T640-K643 WeakPolarHBondContact O-CB 3.4Å; T640-K643 PolarHBondContact O-N 3.21Å; S641-K643 PolarHBondContact O-N 3.43Å; S641-K643 VanDerWaalsContact O-N 3.12Å
644	M	44	Very low	43.6	Very low	154 Å²	154	142.2 Å²	142.2	76%	0.759	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	-8.9	179.7	-73.8	179.9	158.4	0	0	113.5	T640 S641 L646	T640-M644 PolarHBondContact O-N 2.82Å; S641-M644 PolarHBondContact O-N 3.47Å; M644-L646 PolarHBondContact O-N 3.21Å; M644-L646 VanDerWaalsContact O-N 3.15Å
645	F	41.4	Very low	42.7	Very low	198 Å²	198	143.7 Å²	143.7	87%	0.868	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	22.4	176.2	-112.3	-82.3	0	0	0	113.8	S641	S641-F645 PolarHBondContact O-N 3.19Å
646	L	42.8	Very low	41.7	Very low	143 Å²	143	143.4 Å²	143.4	75%	0.749	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-24.6	-167.7	-140.4	79.8	0	0	0	114.5	M644	M644-L646 PolarHBondContact O-N 3.21Å; M644-L646 VanDerWaalsContact O-N 3.15Å
647	D	40.9	Very low	40.9	Very low	127 Å²	127	142.4 Å²	142.4	68%	0.679	71%	0.711	S	S	*	*	S	Bend	trans	-127.1	123.8	-161.8	-61.7	-62.9	0	0	0	113.5
648	L	37.7	Very low	40.4	Very low	165 Å²	165	146.5 Å²	146.5	86%	0.864	73%	0.729	S	S	*	*			trans	68.4	115.3	164.5	-50.4	155.6	0	0	0	115.8
649	K	35.8	Very low	39.8	Very low	194 Å²	194	149.5 Å²	149.5	84%	0.843	74%	0.736	S	S	*	*			cis	85.6	142.8	22.1	-61.5	-164.9	172	-174.7	0	118.2
650	I	35.7	Very low	39.1	Very low	152 Å²	152	146 Å²	146	78%	0.779	74%	0.737	S	S	*	*			trans	76.3	142.4	168.3	-57.6	175.3	0	0	0	115
651	D	34.1	Very low	38.9	Very low	132 Å²	132	149.1 Å²	149.1	71%	0.706	75%	0.747	S	S	*	*			cis	-171.7	-175.3	-33.1	-87.9	-32	0	0	0	106.5
652	T	37.2	Very low	38.9	Very low	116 Å²	116	155.8 Å²	155.8	71%	0.712	77%	0.772	S	S	*	*			cis	-158	-179.8	4	-9.6	0	0	0	0	109.9
653	K	38.9	Very low	38.9	Very low	194 Å²	194	156.2 Å²	156.2	84%	0.843	77%	0.77	S	S	*	*			trans	83	125.5	165	-56.9	-179.7	-176.4	175.6	0	118.7
654	L	31.2	Very low	38.9	Very low	125 Å²	125	154 Å²	154	65%	0.654	77%	0.766	S	S	*	*			cis	-175.7	119.6	-34.6	-113.8	168.3	0	0	0	107.6	L656	L654-L656 HydrophobicContact CD2-CB 4.21Å; L654-L656 HydrophobicContact CD2-CD1 3.61Å; L654-L656 HydrophobicContact CD2-CG 3.97Å
655	D	36.5	Very low	39	Very low	173 Å²	173	155.7 Å²	155.7	93%	0.925	77%	0.772	S	S	*	*			trans	-157.4	131.5	149.4	-101.9	-31.9	0	0	0	106
656	L	33	Very low	39.3	Very low	126 Å²	126	151.9 Å²	151.9	66%	0.66	76%	0.761	S	S	*	*			trans	-145.1	141.1	-148.1	-122.3	-171.8	0	0	0	115.5	L654	L654-L656 HydrophobicContact CD2-CB 4.21Å; L654-L656 HydrophobicContact CD2-CD1 3.61Å; L654-L656 HydrophobicContact CD2-CG 3.97Å
657	K	37	Very low	39.4	Very low	172 Å²	172	152.1 Å²	152.1	75%	0.748	76%	0.756	S	S	*	*			trans	108.9	148.1	161	-61.1	153.2	-174.6	177.2	0	115.3
658	E	39.8	Very low	39.9	Very low	186 Å²	186	150.2 Å²	150.2	87%	0.869	75%	0.746	S	S	*	*			trans	62.5	77.8	178.8	-64	167.2	-138.3	0	0	112.7
659	L	38.2	Very low	40.6	Very low	124 Å²	124	145.7 Å²	145.7	65%	0.649	73%	0.733	S	S	*	*			cis	58.7	128.4	44.6	-84.3	152.9	0	0	0	112.2	E661	L659-E661 HydrophobicContact CD2-CG 3.68Å; L659-E661 WeakPolarHBondContact CD2-OE2 3.34Å
660	T	35.9	Very low	41.6	Very low	131 Å²	131	141.3 Å²	141.3	80%	0.804	72%	0.719	S	S	*	*				-122.4	164.5	50.5	51.1	0	0	0	0	116.9
661	E	42.1	Very low	42.9	Very low	144 Å²	144	139.2 Å²	139.2	67%	0.673	70%	0.704	S	S	*	*			trans	-84.8	-22.5	-163.5	-78.1	144.5	128.3	0	0	117.9	L659 Q663 L664	L659-E661 HydrophobicContact CD2-CG 3.68Å; L659-E661 WeakPolarHBondContact CD2-OE2 3.34Å; E661-Q663 PolarHBondContact O-N 2.81Å; E661-L664 PolarHBondContact O-N 2.85Å; E661-L664 VanDerWaalsContact O-N 3.12Å
662	E	43.9	Very low	43.9	Very low	189 Å²	189	137.8 Å²	137.8	88%	0.883	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-14.5	-162.7	-65.9	-171	140.9	0	0	116.8
663	Q	42.2	Very low	45.3	Very low	159 Å²	159	135.7 Å²	135.7	74%	0.743	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-4.5	179.8	-63.3	-164.7	-2.3	0	0	114.4	E661 E665 F667	E661-Q663 PolarHBondContact O-N 2.81Å; Q663-E665 PolarHBondContact O-N 3.09Å; Q663-F667 VanDerWaalsContact O-CD2 3.24Å; Q663-F667 WeakPolarHBondContact O-CD2 3.47Å; Q663-F667 WeakPolarHBondContact O-CE2 3.13Å
664	L	48.6	Very low	46.8	Very low	130 Å²	130	130.2 Å²	130.2	68%	0.681	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-70.1	-31.2	-171.3	-121.3	73.3	0	0	0	114.5	E661 N666	E661-L664 PolarHBondContact O-N 2.85Å; E661-L664 VanDerWaalsContact O-N 3.12Å; L664-N666 VanDerWaalsContact C-N 3.31Å; L664-N666 PolarHBondContact O-N 3.4Å
665	E	46.4	Very low	48.7	Very low	189 Å²	189	131.2 Å²	131.2	88%	0.883	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-77	-9	-174.4	-65.6	-166.1	125	0	0	114.8	Q663	Q663-E665 PolarHBondContact O-N 3.09Å
666	N	47.6	Very low	50.3	Low	118 Å²	118	129 Å²	129	63%	0.631	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-113.6	26.7	-174.4	-82.4	-73.4	0	0	0	114.3	L664 D668 K671	L664-N666 VanDerWaalsContact C-N 3.31Å; L664-N666 PolarHBondContact O-N 3.4Å; N666-D668 PolarHBondContact O-N 3.3Å; N666-K671 PolarHBondContact O-NZ 3.4Å
667	F	45.6	Very low	52.2	Low	149 Å²	149	128.4 Å²	128.4	65%	0.654	63%	0.634	S	S	*	*			trans	-84	80.2	-179.1	-94.3	-94.9	0	0	0	113.6	Q663 A669	Q663-F667 VanDerWaalsContact O-CD2 3.24Å; Q663-F667 WeakPolarHBondContact O-CD2 3.47Å; Q663-F667 WeakPolarHBondContact O-CE2 3.13Å; F667-A669 PolarHBondContact O-N 2.81Å
668	D	51.4	Low	54.1	Low	86 Å²	86	126.6 Å²	126.6	46%	0.46	63%	0.629	S	S	.	*			trans	-57.5	133.7	169.1	-62.4	-64.1	0	0	0	111.8	N666 D670 K671 L672	N666-D668 PolarHBondContact O-N 3.3Å; D668-D670 HydrophobicContact CB-CB 4.43Å; D668-D670 PolarHBondContact O-N 2.84Å; D668-K671 HydrophobicContact CB-CB 4.04Å; D668-K671 HydrophobicContact CB-CD 3.98Å; D668-K671 HydrophobicContact CB-CG 3.89Å; D668-K671 WeakPolarHBondContact O-CB 3.17Å; D668-K671 PolarHBondContact O-N 2.96Å; D668-K671 VanDerWaalsContact OD2-CD 3.28Å; D668-K671 WeakPolarHBondContact OD2-CD 3.49Å; D668-K671 WeakPolarHBondContact OD2-CE 3.45Å; D668-K671 IonicContact OD2-NZ 2.87Å; D668-K671 PolarHBondContact OD2-NZ 2.86Å; D668-L672 PolarHBondContact O-N 3.25Å
669	A	52	Low	55.9	Low	71 Å²	71	123 Å²	123	59%	0.587	61%	0.612	S	S	*	*	H	α-helix	trans	-54.8	-34.8	164.7	0	0	0	0	0	111.3	F667 L672 I673	F667-A669 PolarHBondContact O-N 2.81Å; A669-L672 PolarHBondContact O-N 2.56Å; A669-I673 WeakPolarHBondContact O-CB 3.45Å; A669-I673 VanDerWaalsContact O-CG1 3.31Å; A669-I673 WeakPolarHBondContact O-CG1 3.48Å; A669-I673 PolarHBondContact O-N 3.15Å
670	D	57.5	Low	57.7	Low	102 Å²	102	121.3 Å²	121.3	55%	0.545	61%	0.606	S	S	.	*	H	α-helix	trans	-68.9	-27.9	174.3	-82.7	-55.1	0	0	0	114.3	D668 N674	D668-D670 HydrophobicContact CB-CB 4.43Å; D668-D670 PolarHBondContact O-N 2.84Å; D670-N674 WeakPolarHBondContact O-CB 3.46Å; D670-N674 VanDerWaalsContact O-CG 3.29Å; D670-N674 PolarHBondContact O-N 3.21Å; D670-N674 PolarHBondContact O-ND2 3.21Å
671	K	61.7	Low	59.8	Low	107 Å²	107	122.1 Å²	122.1	47%	0.465	60%	0.599	S	S	.	*	H	α-helix	trans	-68.2	-39.8	170	-77.6	166.6	-179.1	138.5	0	110.3	N666 D668 N674 K675	N666-K671 PolarHBondContact O-NZ 3.4Å; D668-K671 HydrophobicContact CB-CB 4.04Å; D668-K671 HydrophobicContact CB-CD 3.98Å; D668-K671 HydrophobicContact CB-CG 3.89Å; D668-K671 WeakPolarHBondContact O-CB 3.17Å; D668-K671 PolarHBondContact O-N 2.96Å; D668-K671 VanDerWaalsContact OD2-CD 3.28Å; D668-K671 WeakPolarHBondContact OD2-CD 3.49Å; D668-K671 WeakPolarHBondContact OD2-CE 3.45Å; D668-K671 IonicContact OD2-NZ 2.87Å; D668-K671 PolarHBondContact OD2-NZ 2.86Å; K671-N674 PolarHBondContact O-N 2.98Å; K671-K675 WeakPolarHBondContact O-CB 3.43Å; K671-K675 PolarHBondContact O-N 3.08Å
672	L	56.1	Low	61.7	Low	103 Å²	103	121.7 Å²	121.7	54%	0.539	60%	0.595	S	S	.	*	H	α-helix	trans	-68.3	-45.9	176.2	-174	63.4	0	0	0	112	D668 A669 N674 K675 Q676	D668-L672 PolarHBondContact O-N 3.25Å; A669-L672 PolarHBondContact O-N 2.56Å; L672-N674 VanDerWaalsContact C-N 3.31Å; L672-N674 PolarHBondContact O-N 3.24Å; L672-K675 WeakPolarHBondContact O-CB 3.39Å; L672-K675 PolarHBondContact O-N 3.05Å; L672-Q676 PolarHBondContact O-N 2.87Å
673	I	64.8	Low	63.5	Low	71 Å²	71	118.2 Å²	118.2	36%	0.364	58%	0.577	S	S	.	*	H	α-helix	trans	-62	-39.2	175	-70.3	166.8	0	0	0	110.6	A669 Q676 K677	A669-I673 WeakPolarHBondContact O-CB 3.45Å; A669-I673 VanDerWaalsContact O-CG1 3.31Å; A669-I673 WeakPolarHBondContact O-CG1 3.48Å; A669-I673 PolarHBondContact O-N 3.15Å; I673-Q676 PolarHBondContact O-N 3.43Å; I673-K677 HydrophobicContact CG2-CD 3.91Å; I673-K677 VanDerWaalsContact CG2-CE 3.42Å; I673-K677 HydrophobicContact CG2-CG 4.46Å; I673-K677 WeakPolarHBondContact O-CB 3.49Å; I673-K677 VanDerWaalsContact O-CG 3.25Å; I673-K677 WeakPolarHBondContact O-CG 3.39Å; I673-K677 PolarHBondContact O-N 2.87Å
674	N	71.4	Confident	65.2	Low	80 Å²	80	120 Å²	120	43%	0.428	58%	0.577	S	S	.	*	H	α-helix	trans	-71.4	-34.1	174.2	-77.7	-49	0	0	0	113	D670 K671 L672 K677 Q678	D670-N674 WeakPolarHBondContact O-CB 3.46Å; D670-N674 VanDerWaalsContact O-CG 3.29Å; D670-N674 PolarHBondContact O-N 3.21Å; D670-N674 PolarHBondContact O-ND2 3.21Å; K671-N674 PolarHBondContact O-N 2.98Å; L672-N674 VanDerWaalsContact C-N 3.31Å; L672-N674 PolarHBondContact O-N 3.24Å; N674-K677 PolarHBondContact O-N 3.18Å; N674-Q678 VanDerWaalsContact O-CB 3.32Å; N674-Q678 WeakPolarHBondContact O-CB 3.36Å; N674-Q678 VanDerWaalsContact O-CG 3.29Å; N674-Q678 WeakPolarHBondContact O-CG 3.4Å; N674-Q678 PolarHBondContact O-N 3.1Å
675	K	71.8	Confident	66.9	Low	145 Å²	145	120.9 Å²	120.9	63%	0.63	58%	0.575	S	S	*	*	H	α-helix	trans	-59.8	-47	168.7	-107.3	-176.8	176	178.6	0	111.2	K671 L672 Q678 E679	K671-K675 WeakPolarHBondContact O-CB 3.43Å; K671-K675 PolarHBondContact O-N 3.08Å; L672-K675 WeakPolarHBondContact O-CB 3.39Å; L672-K675 PolarHBondContact O-N 3.05Å; K675-Q678 PolarHBondContact O-N 3.41Å; K675-E679 PolarHBondContact O-N 3.14Å
676	Q	69.6	Low	68.8	Low	128 Å²	128	115.9 Å²	115.9	60%	0.598	55%	0.551	S	S	*	*	H	α-helix	trans	-63.3	-44.2	175	-73.2	-171.1	-7.7	0	0	112.3	L672 I673 Q678 E679 V680	L672-Q676 PolarHBondContact O-N 2.87Å; I673-Q676 PolarHBondContact O-N 3.43Å; Q676-Q678 VanDerWaalsContact C-N 3.28Å; Q676-Q678 PolarHBondContact O-N 3.34Å; Q676-E679 PolarHBondContact O-N 2.94Å; Q676-V680 WeakPolarHBondContact O-CB 3.42Å; Q676-V680 WeakPolarHBondContact O-CG2 3.43Å; Q676-V680 PolarHBondContact O-N 2.77Å
677	K	73.4	Confident	70.5	Confident	112 Å²	112	116 Å²	116	49%	0.487	55%	0.552	S	S	.	*	H	α-helix	trans	-60.7	-35.6	173.9	-73.6	167.1	-179.8	168	0	112	I673 N674 K681	I673-K677 HydrophobicContact CG2-CD 3.91Å; I673-K677 VanDerWaalsContact CG2-CE 3.42Å; I673-K677 HydrophobicContact CG2-CG 4.46Å; I673-K677 WeakPolarHBondContact O-CB 3.49Å; I673-K677 VanDerWaalsContact O-CG 3.25Å; I673-K677 WeakPolarHBondContact O-CG 3.39Å; I673-K677 PolarHBondContact O-N 2.87Å; N674-K677 PolarHBondContact O-N 3.18Å; K677-K681 WeakPolarHBondContact O-CB 3.41Å; K677-K681 VanDerWaalsContact O-CG 3.26Å; K677-K681 WeakPolarHBondContact O-CG 3.14Å; K677-K681 PolarHBondContact O-N 3.48Å
678	Q	75.9	Confident	72.2	Confident	134 Å²	134	111.5 Å²	111.5	63%	0.626	54%	0.542	S	S	*	.	H	α-helix	trans	-70.6	-44.7	174.2	-78.3	-177.2	1.2	0	0	111.9	N674 K675 Q676 K681 K682	N674-Q678 VanDerWaalsContact O-CB 3.32Å; N674-Q678 WeakPolarHBondContact O-CB 3.36Å; N674-Q678 VanDerWaalsContact O-CG 3.29Å; N674-Q678 WeakPolarHBondContact O-CG 3.4Å; N674-Q678 PolarHBondContact O-N 3.1Å; K675-Q678 PolarHBondContact O-N 3.41Å; Q676-Q678 VanDerWaalsContact C-N 3.28Å; Q676-Q678 PolarHBondContact O-N 3.34Å; Q678-K681 CarbonylContact O-C 3.55Å; Q678-K681 PolarHBondContact O-N 2.93Å; Q678-K682 WeakPolarHBondContact O-CB 3.34Å; Q678-K682 PolarHBondContact O-N 3.04Å
679	E	76.8	Confident	74	Confident	111 Å²	111	113.5 Å²	113.5	52%	0.519	55%	0.548	S	S	.	.	H	α-helix	trans	-60.6	-44.7	174.2	-84.7	-151.3	-169.6	0	0	112.5	K675 Q676 K681 K682 K683	K675-E679 PolarHBondContact O-N 3.14Å; Q676-E679 PolarHBondContact O-N 2.94Å; E679-K681 VanDerWaalsContact C-N 3.33Å; E679-K681 PolarHBondContact O-N 3.03Å; E679-K682 WeakPolarHBondContact O-CB 3.43Å; E679-K682 PolarHBondContact O-N 3.21Å; E679-K682 VanDerWaalsContact O-N 3.11Å; E679-K683 WeakPolarHBondContact O-CB 3.27Å; E679-K683 PolarHBondContact O-N 3.48Å; E679-K683 IonicContact OE2-NZ 2.64Å; E679-K683 PolarHBondContact OE2-NZ 3.14Å
680	V	77.6	Confident	75.7	Confident	88 Å²	88	116.6 Å²	116.6	53%	0.533	55%	0.548	S	S	.	.	H	α-helix	trans	-64.7	-38.8	176.9	171.7	0	0	0	0	110.6	Q676 R684	Q676-V680 WeakPolarHBondContact O-CB 3.42Å; Q676-V680 WeakPolarHBondContact O-CG2 3.43Å; Q676-V680 PolarHBondContact O-N 2.77Å; V680-R684 WeakPolarHBondContact O-CB 3.4Å; V680-R684 PolarHBondContact O-N 3.1Å
681	K	78.3	Confident	76.9	Confident	149 Å²	149	114.5 Å²	114.5	65%	0.648	55%	0.545	S	S	*	.	H	α-helix	trans	-64.1	-37	170.3	-79.9	176	176.6	-179.9	0	112.3	K677 Q678 E679 K685	K677-K681 WeakPolarHBondContact O-CB 3.41Å; K677-K681 VanDerWaalsContact O-CG 3.26Å; K677-K681 WeakPolarHBondContact O-CG 3.14Å; K677-K681 PolarHBondContact O-N 3.48Å; Q678-K681 CarbonylContact O-C 3.55Å; Q678-K681 PolarHBondContact O-N 2.93Å; E679-K681 VanDerWaalsContact C-N 3.33Å; E679-K681 PolarHBondContact O-N 3.03Å; K681-K685 PolarHBondContact O-N 3.08Å
682	K	83.8	Confident	78.2	Confident	134 Å²	134	116.5 Å²	116.5	58%	0.583	55%	0.554	S	S	*	*	H	α-helix	trans	-69.2	-50.8	178.7	-162.9	-172.6	175.7	-173.4	0	111.1	Q678 E679 R684 K685 E686	Q678-K682 WeakPolarHBondContact O-CB 3.34Å; Q678-K682 PolarHBondContact O-N 3.04Å; E679-K682 WeakPolarHBondContact O-CB 3.43Å; E679-K682 PolarHBondContact O-N 3.21Å; E679-K682 VanDerWaalsContact O-N 3.11Å; K682-R684 VanDerWaalsContact C-N 3.3Å; K682-R684 PolarHBondContact O-N 3.22Å; K682-K685 WeakPolarHBondContact O-CA 3.26Å; K682-K685 WeakPolarHBondContact O-CB 3.27Å; K682-K685 PolarHBondContact O-N 2.88Å; K682-E686 VanDerWaalsContact CE-OE1 3.3Å; K682-E686 WeakPolarHBondContact CE-OE1 3.29Å; K682-E686 WeakPolarHBondContact CG-OE1 3.46Å; K682-E686 WeakPolarHBondContact O-CG 3.46Å; K682-E686 PolarHBondContact O-N 3.09Å
683	K	81.3	Confident	79.7	Confident	116 Å²	116	115.4 Å²	115.4	50%	0.504	55%	0.552	S	S	.	*	H	α-helix	trans	-58.7	-37.1	173	-73.1	164.3	176.2	157.1	0	111.9	E679 L687	E679-K683 WeakPolarHBondContact O-CB 3.27Å; E679-K683 PolarHBondContact O-N 3.48Å; E679-K683 IonicContact OE2-NZ 2.64Å; E679-K683 PolarHBondContact OE2-NZ 3.14Å; K683-L687 WeakPolarHBondContact O-CB 3.27Å; K683-L687 PolarHBondContact O-N 3.43Å
684	R	78.6	Confident	80.6	Confident	197 Å²	197	118.6 Å²	118.6	74%	0.743	57%	0.567	S	S	*	*	H	α-helix	trans	-65.4	-41	169.8	-96.1	-174.8	162.3	179.7	-4.5	113.3	V680 K682 A688	V680-R684 WeakPolarHBondContact O-CB 3.4Å; V680-R684 PolarHBondContact O-N 3.1Å; K682-R684 VanDerWaalsContact C-N 3.3Å; K682-R684 PolarHBondContact O-N 3.22Å; R684-A688 WeakPolarHBondContact O-CB 3.5Å; R684-A688 PolarHBondContact O-N 3.09Å
685	K	83.1	Confident	81.2	Confident	149 Å²	149	117.6 Å²	117.6	65%	0.648	57%	0.57	S	S	*	*	H	α-helix	trans	-63	-47.7	173.6	-82.3	-170.9	172.7	-170.3	0	111.4	K681 K682 L687 A688 E689	K681-K685 PolarHBondContact O-N 3.08Å; K682-K685 WeakPolarHBondContact O-CA 3.26Å; K682-K685 WeakPolarHBondContact O-CB 3.27Å; K682-K685 PolarHBondContact O-N 2.88Å; K685-L687 VanDerWaalsContact C-N 3.34Å; K685-L687 PolarHBondContact O-N 3.47Å; K685-A688 CarbonylContact O-C 3.57Å; K685-A688 PolarHBondContact O-N 2.95Å; K685-A688 VanDerWaalsContact O-N 3.09Å; K685-E689 PolarHBondContact O-N 3.39Å
686	E	86.5	Confident	82.1	Confident	83 Å²	83	117 Å²	117	39%	0.388	57%	0.567	S	S	.	*	H	α-helix	trans	-60.6	-40.4	178.9	-70.2	166.6	-164.8	0	0	112	K682 K690	K682-E686 VanDerWaalsContact CE-OE1 3.3Å; K682-E686 WeakPolarHBondContact CE-OE1 3.29Å; K682-E686 WeakPolarHBondContact CG-OE1 3.46Å; K682-E686 WeakPolarHBondContact O-CG 3.46Å; K682-E686 PolarHBondContact O-N 3.09Å; E686-K690 WeakPolarHBondContact O-CB 3.18Å; E686-K690 VanDerWaalsContact O-CG 3.32Å; E686-K690 WeakPolarHBondContact O-CG 3.32Å; E686-K690 PolarHBondContact O-N 3.49Å
687	L	82.8	Confident	83	Confident	122 Å²	122	118.4 Å²	118.4	64%	0.639	57%	0.571	S	S	*	*	H	α-helix	trans	-66.8	-40	171.5	-85.9	166.8	0	0	0	112.7	K683 K685 E689 K690 A691	K683-L687 WeakPolarHBondContact O-CB 3.27Å; K683-L687 PolarHBondContact O-N 3.43Å; K685-L687 VanDerWaalsContact C-N 3.34Å; K685-L687 PolarHBondContact O-N 3.47Å; L687-E689 VanDerWaalsContact C-N 3.33Å; L687-E689 PolarHBondContact O-N 3.43Å; L687-K690 PolarHBondContact O-N 3.39Å; L687-A691 WeakPolarHBondContact O-CB 3.44Å; L687-A691 PolarHBondContact O-N 3.13Å
688	A	82.6	Confident	83.7	Confident	53 Å²	53	118.4 Å²	118.4	44%	0.438	58%	0.576	S	S	.	*	H	α-helix	trans	-67.5	-32.2	176.6	0	0	0	0	0	112.7	R684 K685 K692	R684-A688 WeakPolarHBondContact O-CB 3.5Å; R684-A688 PolarHBondContact O-N 3.09Å; K685-A688 CarbonylContact O-C 3.57Å; K685-A688 PolarHBondContact O-N 2.95Å; K685-A688 VanDerWaalsContact O-N 3.09Å; A688-K692 WeakPolarHBondContact O-CB 3.45Å; A688-K692 WeakPolarHBondContact O-CG 3.47Å; A688-K692 PolarHBondContact O-N 3.45Å
689	E	88.5	Confident	84.3	Confident	129 Å²	129	115.6 Å²	115.6	60%	0.603	57%	0.565	S	S	*	*	H	α-helix	trans	-74.5	-40.6	173.6	-74.1	-177	174.5	0	0	111.9	K685 L687 A691 K692 T693	K685-E689 PolarHBondContact O-N 3.39Å; L687-E689 VanDerWaalsContact C-N 3.33Å; L687-E689 PolarHBondContact O-N 3.43Å; E689-A691 VanDerWaalsContact C-N 3.32Å; E689-A691 PolarHBondContact O-N 2.94Å; E689-K692 PolarHBondContact O-N 3.42Å; E689-T693 PolarHBondContact O-N 2.72Å; E689-T693 PolarHBondContact O-OG1 3.34Å
690	K	87	Confident	84.9	Confident	135 Å²	135	117.3 Å²	117.3	59%	0.587	57%	0.568	S	S	*	*	H	α-helix	trans	-59.9	-41	169.1	-74	173.4	-178.7	177.6	0	111.6	E686 L687 T693 M694	E686-K690 WeakPolarHBondContact O-CB 3.18Å; E686-K690 VanDerWaalsContact O-CG 3.32Å; E686-K690 WeakPolarHBondContact O-CG 3.32Å; E686-K690 PolarHBondContact O-N 3.49Å; L687-K690 PolarHBondContact O-N 3.39Å; K690-T693 PolarHBondContact O-N 3.04Å; K690-T693 PolarHBondContact O-OG1 3.33Å; K690-T693 VanDerWaalsContact O-OG1 3.07Å; K690-M694 WeakPolarHBondContact O-CB 3.37Å; K690-M694 WeakPolarHBondContact O-CG 3.46Å; K690-M694 PolarHBondContact O-N 3.48Å
691	A	83.8	Confident	85.5	Confident	58 Å²	58	120.8 Å²	120.8	48%	0.479	57%	0.573	S	S	.	*	H	α-helix	trans	-63.4	-42.8	173	0	0	0	0	0	112	L687 E689 M694 A695	L687-A691 WeakPolarHBondContact O-CB 3.44Å; L687-A691 PolarHBondContact O-N 3.13Å; E689-A691 VanDerWaalsContact C-N 3.32Å; E689-A691 PolarHBondContact O-N 2.94Å; A691-M694 PolarHBondContact O-N 3.08Å; A691-A695 VanDerWaalsContact O-CB 3.31Å; A691-A695 WeakPolarHBondContact O-CB 3.1Å; A691-A695 PolarHBondContact O-N 2.94Å
692	K	87.5	Confident	85.9	Confident	149 Å²	149	116.2 Å²	116.2	65%	0.648	56%	0.557	S	S	*	*	H	α-helix	trans	-64.1	-37	174.9	-82.1	-179	174.9	-178.9	0	113.4	A688 E689 K696	A688-K692 WeakPolarHBondContact O-CB 3.45Å; A688-K692 WeakPolarHBondContact O-CG 3.47Å; A688-K692 PolarHBondContact O-N 3.45Å; E689-K692 PolarHBondContact O-N 3.42Å; K692-K696 WeakPolarHBondContact O-CG 3.32Å; K692-K696 PolarHBondContact O-N 3.42Å
693	T	88.6	Confident	86.2	Confident	81 Å²	81	116.2 Å²	116.2	50%	0.497	55%	0.554	S	S	.	*	H	α-helix	trans	-74.5	-35.9	176.9	55.5	0	0	0	0	112.1	E689 K690 K696 K697	E689-T693 PolarHBondContact O-N 2.72Å; E689-T693 PolarHBondContact O-OG1 3.34Å; K690-T693 PolarHBondContact O-N 3.04Å; K690-T693 PolarHBondContact O-OG1 3.33Å; K690-T693 VanDerWaalsContact O-OG1 3.07Å; T693-K696 PolarHBondContact O-N 2.86Å; T693-K697 PolarHBondContact O-N 3.13Å
694	M	83.9	Confident	86.6	Confident	138 Å²	138	113 Å²	113	68%	0.68	55%	0.549	S	S	*	.	H	α-helix	trans	-63	-45.5	170.5	-66.4	-91.9	-84.9	0	0	111.4	K690 A691 K696 K697 L698	K690-M694 WeakPolarHBondContact O-CB 3.37Å; K690-M694 WeakPolarHBondContact O-CG 3.46Å; K690-M694 PolarHBondContact O-N 3.48Å; A691-M694 PolarHBondContact O-N 3.08Å; M694-K696 PolarHBondContact O-N 3.45Å; M694-K697 WeakPolarHBondContact O-CB 3.36Å; M694-K697 PolarHBondContact O-N 3.25Å; M694-L698 PolarHBondContact O-N 3.11Å
695	A	84	Confident	87.1	Confident	59 Å²	59	106.2 Å²	106.2	49%	0.488	53%	0.531	S	S	.	.	H	α-helix	trans	-62.1	-41.1	175.8	0	0	0	0	0	112.4	A691 L698 D699	A691-A695 VanDerWaalsContact O-CB 3.31Å; A691-A695 WeakPolarHBondContact O-CB 3.1Å; A691-A695 PolarHBondContact O-N 2.94Å; A695-L698 WeakPolarHBondContact O-CB 3.13Å; A695-L698 PolarHBondContact O-N 3.36Å; A695-D699 PolarHBondContact O-N 2.95Å
696	K	90.3	Very high	87.3	Confident	133 Å²	133	105.4 Å²	105.4	58%	0.578	52%	0.524	S	S	*	.	H	α-helix	trans	-60.6	-44.5	171.4	-78.5	-178.8	176.6	-172.2	0	112.2	K692 T693 M694 L698 D699 Y700	K692-K696 WeakPolarHBondContact O-CG 3.32Å; K692-K696 PolarHBondContact O-N 3.42Å; T693-K696 PolarHBondContact O-N 2.86Å; M694-K696 PolarHBondContact O-N 3.45Å; K696-L698 VanDerWaalsContact C-N 3.29Å; K696-L698 PolarHBondContact O-N 2.97Å; K696-D699 PolarHBondContact O-N 3.1Å; K696-Y700 HydrophobicContact CB-CD2 4.5Å; K696-Y700 HydrophobicContact CB-CE2 4.15Å; K696-Y700 WeakPolarHBondContact O-CD2 3.39Å; K696-Y700 PolarHBondContact O-N 3.38Å
697	K	88.8	Confident	87.4	Confident	156 Å²	156	106.4 Å²	106.4	68%	0.678	53%	0.531	S	S	*	.	H	α-helix	trans	-60.2	-39.1	175.4	-78	-174.3	173.8	-170.5	0	112	T693 M694 Y700 Y701	T693-K697 PolarHBondContact O-N 3.13Å; M694-K697 WeakPolarHBondContact O-CB 3.36Å; M694-K697 PolarHBondContact O-N 3.25Å; K697-Y700 PolarHBondContact O-N 2.84Å; K697-Y701 WeakPolarHBondContact O-CB 3.26Å; K697-Y701 PolarHBondContact O-N 2.97Å
698	L	88.1	Confident	87.5	Confident	113 Å²	113	107.1 Å²	107.1	59%	0.592	53%	0.531	S	S	*	.	H	α-helix	trans	-65.1	-44	174.9	-168.1	72.1	0	0	0	112.1	M694 A695 K696 Y701 T702	M694-L698 PolarHBondContact O-N 3.11Å; A695-L698 WeakPolarHBondContact O-CB 3.13Å; A695-L698 PolarHBondContact O-N 3.36Å; K696-L698 VanDerWaalsContact C-N 3.29Å; K696-L698 PolarHBondContact O-N 2.97Å; L698-Y701 PolarHBondContact O-N 3.38Å; L698-T702 WeakPolarHBondContact O-CG2 3.41Å; L698-T702 PolarHBondContact O-N 3.16Å; L698-T702 PolarHBondContact O-OG1 2.86Å
699	D	88.5	Confident	87.8	Confident	74 Å²	74	109.2 Å²	109.2	40%	0.396	53%	0.532	S	S	.	.	H	α-helix	trans	-66.5	-33.9	176.9	-171	67.4	0	0	0	112.7	A695 K696 T702 R703	A695-D699 PolarHBondContact O-N 2.95Å; K696-D699 PolarHBondContact O-N 3.1Å; D699-T702 PolarHBondContact O-OG1 2.9Å; D699-R703 WeakPolarHBondContact O-CB 3.36Å; D699-R703 PolarHBondContact O-N 3.39Å; D699-R703 VanDerWaalsContact O-N 3.13Å; D699-R703 IonicContact OD2-CZ 2.78Å; D699-R703 IonicContact OD2-NH2 3.88Å; D699-R703 PolarHBondContact OD2-NH2 3.41Å
700	Y	89	Confident	87.6	Confident	147 Å²	147	107.3 Å²	107.3	58%	0.576	53%	0.525	S	S	*	.	H	α-helix	trans	-69	-40.6	170.5	-67.2	-51.9	0	0	0	112.1	K696 K697 R703 A704	K696-Y700 HydrophobicContact CB-CD2 4.5Å; K696-Y700 HydrophobicContact CB-CE2 4.15Å; K696-Y700 WeakPolarHBondContact O-CD2 3.39Å; K696-Y700 PolarHBondContact O-N 3.38Å; K697-Y700 PolarHBondContact O-N 2.84Å; Y700-R703 PolarHBondContact O-N 3.35Å; Y700-A704 WeakPolarHBondContact O-CB 3.44Å; Y700-A704 PolarHBondContact O-N 2.97Å
701	Y	90	Very high	87.8	Confident	161 Å²	161	103.9 Å²	103.9	63%	0.631	52%	0.516	S	S	*	.	H	α-helix	trans	-66.8	-48.7	178.9	-178.7	-97.7	0	0	0	112.1	K697 L698 R703 A704 C705	K697-Y701 WeakPolarHBondContact O-CB 3.26Å; K697-Y701 PolarHBondContact O-N 2.97Å; L698-Y701 PolarHBondContact O-N 3.38Å; Y701-R703 VanDerWaalsContact C-N 3.26Å; Y701-R703 PolarHBondContact O-N 2.99Å; Y701-A704 WeakPolarHBondContact O-CB 3.44Å; Y701-A704 PolarHBondContact O-N 2.92Å; Y701-A704 VanDerWaalsContact O-N 3.13Å; Y701-C705 PolarHBondContact O-N 2.89Å; Y701-C705 PolarHBondContact O-SG 3.3Å; Y701-C705 VanDerWaalsContact O-SG 3.33Å
702	T	86.9	Confident	87.9	Confident	53 Å²	53	106.7 Å²	106.7	33%	0.325	52%	0.523	S	S	.	.	H	α-helix	trans	-65.5	-30.2	177	58.7	0	0	0	0	112.3	L698 D699 R706	L698-T702 WeakPolarHBondContact O-CG2 3.41Å; L698-T702 PolarHBondContact O-N 3.16Å; L698-T702 PolarHBondContact O-OG1 2.86Å; D699-T702 PolarHBondContact O-OG1 2.9Å; T702-R706 WeakPolarHBondContact O-CB 3.33Å; T702-R706 WeakPolarHBondContact O-CG 3.41Å; T702-R706 PolarHBondContact O-N 2.93Å
703	R	89.7	Confident	87.7	Confident	134 Å²	134	103.9 Å²	103.9	51%	0.506	51%	0.514	S	S	.	.	H	α-helix	trans	-68.2	-42.1	170.6	-172.1	-176.3	-51.5	-137.5	0.1	112.4	D699 Y700 Y701 R706 I707	D699-R703 WeakPolarHBondContact O-CB 3.36Å; D699-R703 PolarHBondContact O-N 3.39Å; D699-R703 VanDerWaalsContact O-N 3.13Å; D699-R703 IonicContact OD2-CZ 2.78Å; D699-R703 IonicContact OD2-NH2 3.88Å; D699-R703 PolarHBondContact OD2-NH2 3.41Å; Y700-R703 PolarHBondContact O-N 3.35Å; Y701-R703 VanDerWaalsContact C-N 3.26Å; Y701-R703 PolarHBondContact O-N 2.99Å; R703-R706 PolarHBondContact O-N 2.78Å; R703-I707 HydrophobicContact CG-CD1 4.09Å; R703-I707 VanDerWaalsContact O-CG1 3.3Å; R703-I707 WeakPolarHBondContact O-CG1 3.39Å; R703-I707 PolarHBondContact O-N 2.93Å
704	A	90.5	Very high	87.6	Confident	50 Å²	50	105.8 Å²	105.8	41%	0.413	52%	0.517	S	S	.	.	H	α-helix	trans	-61.4	-49	173.9	0	0	0	0	0	111	Y700 Y701 R706 I707 E708	Y700-A704 WeakPolarHBondContact O-CB 3.44Å; Y700-A704 PolarHBondContact O-N 2.97Å; Y701-A704 WeakPolarHBondContact O-CB 3.44Å; Y701-A704 PolarHBondContact O-N 2.92Å; Y701-A704 VanDerWaalsContact O-N 3.13Å; A704-R706 VanDerWaalsContact C-N 3.28Å; A704-R706 PolarHBondContact O-N 3.07Å; A704-I707 PolarHBondContact O-N 3.18Å; A704-E708 PolarHBondContact O-N 3.23Å; A704-E708 VanDerWaalsContact O-N 3.09Å
705	C	88.2	Confident	87.8	Confident	54 Å²	54	101.9 Å²	101.9	37%	0.365	51%	0.507	S	S	.	.	H	α-helix	trans	-55.4	-41.8	174.5	-63	0	0	0	0	112.4	Y701 E708 E709	Y701-C705 PolarHBondContact O-N 2.89Å; Y701-C705 PolarHBondContact O-SG 3.3Å; Y701-C705 VanDerWaalsContact O-SG 3.33Å; C705-E708 PolarHBondContact O-N 3.39Å; C705-E709 VanDerWaalsContact O-CB 3.26Å; C705-E709 WeakPolarHBondContact O-CB 3.5Å; C705-E709 PolarHBondContact O-N 3.02Å
706	R	87.5	Confident	87.8	Confident	131 Å²	131	103.6 Å²	103.6	49%	0.494	51%	0.508	S	S	.	.	H	α-helix	trans	-67.3	-33.4	175.8	-79.5	173.9	172.2	152.6	-2.1	113.8	T702 R703 A704 E708 E709 I710	T702-R706 WeakPolarHBondContact O-CB 3.33Å; T702-R706 WeakPolarHBondContact O-CG 3.41Å; T702-R706 PolarHBondContact O-N 2.93Å; R703-R706 PolarHBondContact O-N 2.78Å; A704-R706 VanDerWaalsContact C-N 3.28Å; A704-R706 PolarHBondContact O-N 3.07Å; R706-E708 VanDerWaalsContact C-N 3.34Å; R706-E709 PolarHBondContact O-N 3.19Å; R706-I710 WeakPolarHBondContact O-CD1 3.22Å; R706-I710 WeakPolarHBondContact O-CG1 3.31Å; R706-I710 PolarHBondContact O-N 3.3Å
707	I	89.4	Confident	87.4	Confident	104 Å²	104	101.3 Å²	101.3	53%	0.533	51%	0.505	S	S	.	.	H	α-helix	trans	-67.9	-36.9	176.5	-72.4	164.7	0	0	0	110.6	R703 A704 P711	R703-I707 HydrophobicContact CG-CD1 4.09Å; R703-I707 VanDerWaalsContact O-CG1 3.3Å; R703-I707 WeakPolarHBondContact O-CG1 3.39Å; R703-I707 PolarHBondContact O-N 2.93Å; A704-I707 PolarHBondContact O-N 3.18Å; I707-P711 WeakPolarHBondContact O-CD 3.44Å
708	E	85.5	Confident	87.2	Confident	138 Å²	138	100.3 Å²	100.3	65%	0.645	50%	0.503	S	S	*	.	H	α-helix	trans	-73	-32.5	171.2	-60.3	-62.1	145.3	0	0	112.6	A704 C705 R706 P711	A704-E708 PolarHBondContact O-N 3.23Å; A704-E708 VanDerWaalsContact O-N 3.09Å; C705-E708 PolarHBondContact O-N 3.39Å; R706-E708 VanDerWaalsContact C-N 3.34Å; E708-P711 WeakPolarHBondContact O-CD 3.4Å; E708-P711 WeakPolarHBondContact O-CG 3.3Å
709	E	88.5	Confident	87.1	Confident	97 Å²	97	96.9 Å²	96.9	45%	0.453	49%	0.488	S	S	.	.	H	α-helix	trans	-74.2	-36	-179.9	-171.1	179	-154.9	0	0	112.9	C705 R706 L712 L713	C705-E709 VanDerWaalsContact O-CB 3.26Å; C705-E709 WeakPolarHBondContact O-CB 3.5Å; C705-E709 PolarHBondContact O-N 3.02Å; R706-E709 PolarHBondContact O-N 3.19Å; E709-L712 PolarHBondContact O-N 2.9Å; E709-L713 HydrophobicContact CG-CD1 3.85Å; E709-L713 HydrophobicContact CG-CG 4.04Å; E709-L713 WeakPolarHBondContact O-CG 3.31Å; E709-L713 PolarHBondContact O-N 3.42Å
710	I	84.2	Confident	86.7	Confident	88 Å²	88	98.1 Å²	98.1	45%	0.451	49%	0.491	S	S	.	.	H	α-helix	trans	-53.2	-53	179.8	-77.6	160.7	0	0	0	113.8	R706 L712 L713 Q714	R706-I710 WeakPolarHBondContact O-CD1 3.22Å; R706-I710 WeakPolarHBondContact O-CG1 3.31Å; R706-I710 PolarHBondContact O-N 3.3Å; I710-L712 VanDerWaalsContact C-N 3.29Å; I710-L712 PolarHBondContact O-N 3.32Å; I710-L713 PolarHBondContact O-N 2.93Å; I710-Q714 WeakPolarHBondContact O-CG 3.16Å; I710-Q714 PolarHBondContact O-N 3.29Å
711	P	90.3	Very high	86.5	Confident	64 Å²	64	93.1 Å²	93.1	42%	0.416	48%	0.48	S	S	.	.	H	α-helix	trans	-66.1	-31.3	179.2	25.5	-34.3	0	0	0	112.3	I707 E708 Q714 A715	I707-P711 WeakPolarHBondContact O-CD 3.44Å; E708-P711 WeakPolarHBondContact O-CD 3.4Å; E708-P711 WeakPolarHBondContact O-CG 3.3Å; P711-Q714 PolarHBondContact O-N 2.97Å; P711-A715 WeakPolarHBondContact O-CB 3.28Å; P711-A715 PolarHBondContact O-N 2.94Å
712	L	86	Confident	86.3	Confident	116 Å²	116	90.9 Å²	90.9	61%	0.607	48%	0.477	S	S	*	.	H	α-helix	trans	-69.4	-36.3	174	-62.9	175.3	0	0	0	111.8	E709 I710 N716	E709-L712 PolarHBondContact O-N 2.9Å; I710-L712 VanDerWaalsContact C-N 3.29Å; I710-L712 PolarHBondContact O-N 3.32Å; L712-N716 PolarHBondContact O-N 3.3Å; L712-N716 VanDerWaalsContact O-N 3.14Å; L712-N716 PolarHBondContact O-ND2 2.97Å
713	L	84.5	Confident	86.2	Confident	91 Å²	91	91.8 Å²	91.8	48%	0.476	48%	0.477	S	S	.	.	H	α-helix	trans	-68.8	-41.9	172.8	-71.5	172.8	0	0	0	111.4	E709 I710 N716 V717	E709-L713 HydrophobicContact CG-CD1 3.85Å; E709-L713 HydrophobicContact CG-CG 4.04Å; E709-L713 WeakPolarHBondContact O-CG 3.31Å; E709-L713 PolarHBondContact O-N 3.42Å; I710-L713 PolarHBondContact O-N 2.93Å; L713-N716 PolarHBondContact O-N 2.99Å; L713-V717 WeakPolarHBondContact O-CG2 3.46Å; L713-V717 PolarHBondContact O-N 3.48Å
714	Q	86.5	Confident	85.8	Confident	120 Å²	120	89 Å²	89	56%	0.561	48%	0.478	S	S	*	.	H	α-helix	trans	-60.2	-48.1	175.1	-72.1	174.5	-48.8	0	0	111.3	I710 P711 N716 V717 E718	I710-Q714 WeakPolarHBondContact O-CG 3.16Å; I710-Q714 PolarHBondContact O-N 3.29Å; P711-Q714 PolarHBondContact O-N 2.97Å; Q714-N716 VanDerWaalsContact C-N 3.26Å; Q714-N716 PolarHBondContact O-N 3.31Å; Q714-V717 PolarHBondContact O-N 3.02Å; Q714-V717 VanDerWaalsContact O-N 3.09Å; Q714-E718 PolarHBondContact O-N 3.43Å
715	A	86.9	Confident	85.7	Confident	56 Å²	56	95.1 Å²	95.1	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-64.8	-23.8	177.2	0	0	0	0	0	114.2	P711 P719	P711-A715 WeakPolarHBondContact O-CB 3.28Å; P711-A715 PolarHBondContact O-N 2.94Å; A715-P719 WeakPolarHBondContact O-CD 3.41Å
716	N	84.3	Confident	85.8	Confident	96 Å²	96	98 Å²	98	51%	0.513	50%	0.499	S	S	.	.	H	α-helix	trans	-82.1	-31.1	171.3	-77.7	-57.8	0	0	0	112.7	L712 L713 Q714 P719	L712-N716 PolarHBondContact O-N 3.3Å; L712-N716 VanDerWaalsContact O-N 3.14Å; L712-N716 PolarHBondContact O-ND2 2.97Å; L713-N716 PolarHBondContact O-N 2.99Å; Q714-N716 VanDerWaalsContact C-N 3.26Å; Q714-N716 PolarHBondContact O-N 3.31Å; N716-P719 WeakPolarHBondContact O-CD 3.47Å; N716-P719 WeakPolarHBondContact O-CG 3.41Å
717	V	82.5	Confident	85.8	Confident	85 Å²	85	97.1 Å²	97.1	52%	0.515	50%	0.503	S	S	.	.	H	α-helix	trans	-76.2	-30.5	178.3	168.8	0	0	0	0	112.1	L713 Q714 E720 A721	L713-V717 WeakPolarHBondContact O-CG2 3.46Å; L713-V717 PolarHBondContact O-N 3.48Å; Q714-V717 PolarHBondContact O-N 3.02Å; Q714-V717 VanDerWaalsContact O-N 3.09Å; V717-E720 PolarHBondContact O-N 2.98Å; V717-A721 VanDerWaalsContact O-CB 3.24Å; V717-A721 WeakPolarHBondContact O-CB 3.28Å; V717-A721 PolarHBondContact O-N 2.81Å
718	E	84.5	Confident	85.6	Confident	135 Å²	135	98.8 Å²	98.8	63%	0.631	51%	0.507	S	S	*	.	H	α-helix	trans	-53.8	-53.4	176.4	-78.2	179.4	175.7	0	0	114.4	Q714 A721 M722	Q714-E718 PolarHBondContact O-N 3.43Å; E718-A721 PolarHBondContact O-N 3.43Å; E718-M722 WeakPolarHBondContact O-CG 3.39Å; E718-M722 PolarHBondContact O-N 2.82Å
719	P	86.6	Confident	85.9	Confident	41 Å²	41	96.8 Å²	96.8	27%	0.266	50%	0.498	S	S	.	.	H	α-helix	trans	-65.9	-38.8	176.7	25.1	-34	0	0	0	112.5	A715 N716 A721 M722 E723	A715-P719 WeakPolarHBondContact O-CD 3.41Å; N716-P719 WeakPolarHBondContact O-CD 3.47Å; N716-P719 WeakPolarHBondContact O-CG 3.41Å; P719-A721 VanDerWaalsContact C-N 3.26Å; P719-A721 PolarHBondContact O-N 3.34Å; P719-M722 PolarHBondContact O-N 2.75Å; P719-M722 VanDerWaalsContact O-N 3.1Å; P719-E723 WeakPolarHBondContact O-CB 3.43Å; P719-E723 WeakPolarHBondContact O-CG 3.35Å; P719-E723 PolarHBondContact O-N 2.88Å
720	E	79.9	Confident	85.9	Confident	99 Å²	99	96.4 Å²	96.4	46%	0.463	50%	0.496	S	S	.	.	H	α-helix	trans	-64.8	-31.9	176.8	-66.7	-178.3	177.6	0	0	111.8	V717 S724 R1045	V717-E720 PolarHBondContact O-N 2.98Å; E720-S724 WeakPolarHBondContact O-CB 3.29Å; E720-S724 PolarHBondContact O-N 3.46Å; E720-S724 PolarHBondContact O-OG 3.18Å; E720-R1045 IonicContact OE1-NH2 2.76Å
721	A	83.4	Confident	85.9	Confident	42 Å²	42	94.3 Å²	94.3	35%	0.347	49%	0.489	S	S	.	.	H	α-helix	trans	-74.2	-29.5	172.5	0	0	0	0	0	113.1	V717 E718 P719 R725	V717-A721 VanDerWaalsContact O-CB 3.24Å; V717-A721 WeakPolarHBondContact O-CB 3.28Å; V717-A721 PolarHBondContact O-N 2.81Å; E718-A721 PolarHBondContact O-N 3.43Å; P719-A721 VanDerWaalsContact C-N 3.26Å; P719-A721 PolarHBondContact O-N 3.34Å; A721-R725 WeakPolarHBondContact O-CB 3.49Å; A721-R725 VanDerWaalsContact O-CG 3.28Å; A721-R725 WeakPolarHBondContact O-CG 3.49Å; A721-R725 PolarHBondContact O-N 3.21Å; A721-R725 VanDerWaalsContact O-N 3.11Å
722	M	86.9	Confident	85.8	Confident	115 Å²	115	93.7 Å²	93.7	57%	0.567	48%	0.484	S	S	*	.	H	α-helix	trans	-73	-50.3	170.2	-65.3	-155.8	-53.8	0	0	111.3	E718 P719 S724 R725 E726	E718-M722 WeakPolarHBondContact O-CG 3.39Å; E718-M722 PolarHBondContact O-N 2.82Å; P719-M722 PolarHBondContact O-N 2.75Å; P719-M722 VanDerWaalsContact O-N 3.1Å; M722-S724 PolarHBondContact O-N 3.12Å; M722-R725 WeakPolarHBondContact O-CA 3.48Å; M722-R725 WeakPolarHBondContact O-CB 3.37Å; M722-R725 PolarHBondContact O-N 2.82Å; M722-E726 PolarHBondContact O-N 2.93Å
723	E	84.2	Confident	86.1	Confident	71 Å²	71	94.6 Å²	94.6	33%	0.332	48%	0.479	S	S	.	.	H	α-helix	trans	-53.2	-43.1	174	-69.5	170.3	-159.5	0	0	110.5	P719 R725 E726 L727 R1045	P719-E723 WeakPolarHBondContact O-CB 3.43Å; P719-E723 WeakPolarHBondContact O-CG 3.35Å; P719-E723 PolarHBondContact O-N 2.88Å; E723-R725 PolarHBondContact O-N 3.24Å; E723-E726 PolarHBondContact O-N 3.48Å; E723-L727 WeakPolarHBondContact O-CB 3.49Å; E723-L727 VanDerWaalsContact O-CG 3.3Å; E723-L727 WeakPolarHBondContact O-CG 3.39Å; E723-L727 PolarHBondContact O-N 3.27Å; E723-R1045 IonicContact OE1-NH1 3.75Å; E723-R1045 PolarHBondContact OE1-NH1 3.16Å; E723-R1045 IonicContact OE1-NH2 2.7Å
724	S	82.5	Confident	86.3	Confident	75 Å²	75	96.5 Å²	96.5	52%	0.524	49%	0.486	S	S	.	.	H	α-helix	trans	-66.7	-33.7	175.4	-61.8	0	0	0	0	114	E720 M722 F728	E720-S724 WeakPolarHBondContact O-CB 3.29Å; E720-S724 PolarHBondContact O-N 3.46Å; E720-S724 PolarHBondContact O-OG 3.18Å; M722-S724 PolarHBondContact O-N 3.12Å; S724-F728 VanDerWaalsContact O-CB 3.29Å; S724-F728 WeakPolarHBondContact O-CB 3.07Å; S724-F728 PolarHBondContact O-N 3.16Å
725	R	87.3	Confident	86.3	Confident	179 Å²	179	96.5 Å²	96.5	68%	0.675	49%	0.488	S	S	*	.	H	α-helix	trans	-71.8	-42.7	174.5	-81	174.6	-178.7	-178.9	2.8	111.4	A721 M722 E723 F728 E729	A721-R725 WeakPolarHBondContact O-CB 3.49Å; A721-R725 VanDerWaalsContact O-CG 3.28Å; A721-R725 WeakPolarHBondContact O-CG 3.49Å; A721-R725 PolarHBondContact O-N 3.21Å; A721-R725 VanDerWaalsContact O-N 3.11Å; M722-R725 WeakPolarHBondContact O-CA 3.48Å; M722-R725 WeakPolarHBondContact O-CB 3.37Å; M722-R725 PolarHBondContact O-N 2.82Å; E723-R725 PolarHBondContact O-N 3.24Å; R725-F728 PolarHBondContact O-N 2.9Å; R725-E729 WeakPolarHBondContact O-CB 3.14Å; R725-E729 PolarHBondContact O-N 2.83Å
726	E	90	Very high	86.3	Confident	115 Å²	115	98.5 Å²	98.5	54%	0.537	49%	0.488	S	S	.	.	H	α-helix	trans	-62.4	-44.2	177.2	-71.4	-178.5	-171.9	0	0	111.3	M722 E723 E729 Q730	M722-E726 PolarHBondContact O-N 2.93Å; E723-E726 PolarHBondContact O-N 3.48Å; E726-E729 PolarHBondContact O-N 3.34Å; E726-Q730 WeakPolarHBondContact O-CB 3.41Å; E726-Q730 WeakPolarHBondContact O-CG 3.21Å; E726-Q730 PolarHBondContact O-N 3.14Å
727	L	87.1	Confident	86.7	Confident	113 Å²	113	100.3 Å²	100.3	59%	0.592	49%	0.493	S	S	*	.	H	α-helix	trans	-64.2	-39.5	173.7	-71.2	169.8	0	0	0	112.4	E723 Q730 S731	E723-L727 WeakPolarHBondContact O-CB 3.49Å; E723-L727 VanDerWaalsContact O-CG 3.3Å; E723-L727 WeakPolarHBondContact O-CG 3.39Å; E723-L727 PolarHBondContact O-N 3.27Å; L727-Q730 PolarHBondContact O-N 2.63Å; L727-S731 PolarHBondContact O-N 2.86Å
728	F	86.4	Confident	87	Confident	139 Å²	139	102.2 Å²	102.2	61%	0.61	50%	0.496	S	S	*	.	H	α-helix	trans	-63.4	-48.4	174.4	179.8	-102.7	0	0	0	111.4	S724 R725 Q730 S731 V732	S724-F728 VanDerWaalsContact O-CB 3.29Å; S724-F728 WeakPolarHBondContact O-CB 3.07Å; S724-F728 PolarHBondContact O-N 3.16Å; R725-F728 PolarHBondContact O-N 2.9Å; F728-Q730 VanDerWaalsContact C-N 3.34Å; F728-Q730 PolarHBondContact O-N 3.14Å; F728-S731 PolarHBondContact O-N 3.46Å; F728-S731 PolarHBondContact O-OG 3.29Å; F728-V732 HydrophobicContact CD1-CG2 4.22Å; F728-V732 HydrophobicContact CE1-CG2 3.81Å; F728-V732 HydrophobicContact CE2-CG2 4.17Å; F728-V732 HydrophobicContact CZ-CG2 3.78Å; F728-V732 WeakPolarHBondContact O-CG2 3.4Å; F728-V732 PolarHBondContact O-N 3.04Å
729	E	91.1	Very high	87.2	Confident	96 Å²	96	99.5 Å²	99.5	45%	0.449	49%	0.492	S	S	.	.	H	α-helix	trans	-61	-40	176	-77.5	-171	-147.4	0	0	112.6	R725 E726 V732 R733	R725-E729 WeakPolarHBondContact O-CB 3.14Å; R725-E729 PolarHBondContact O-N 2.83Å; E726-E729 PolarHBondContact O-N 3.34Å; E729-V732 PolarHBondContact O-N 3.43Å; E729-R733 WeakPolarHBondContact O-CB 3.34Å; E729-R733 WeakPolarHBondContact O-CG 3.48Å; E729-R733 PolarHBondContact O-N 3Å; E729-R733 IonicContact OE2-CZ 2.92Å; E729-R733 IonicContact OE2-NH2 3.13Å; E729-R733 PolarHBondContact OE2-NH2 2.93Å
730	Q	89.2	Confident	87.4	Confident	89 Å²	89	103.2 Å²	103.2	42%	0.416	50%	0.504	S	S	.	.	H	α-helix	trans	-58.7	-50.1	172.9	-73.9	165.6	33.4	0	0	110.6	E726 L727 F728 V732 R733 E734	E726-Q730 WeakPolarHBondContact O-CB 3.41Å; E726-Q730 WeakPolarHBondContact O-CG 3.21Å; E726-Q730 PolarHBondContact O-N 3.14Å; L727-Q730 PolarHBondContact O-N 2.63Å; F728-Q730 VanDerWaalsContact C-N 3.34Å; F728-Q730 PolarHBondContact O-N 3.14Å; Q730-V732 VanDerWaalsContact C-N 3.31Å; Q730-V732 PolarHBondContact O-N 2.86Å; Q730-R733 PolarHBondContact O-N 2.94Å; Q730-R733 VanDerWaalsContact O-N 3.15Å; Q730-E734 WeakPolarHBondContact O-CG 3.16Å; Q730-E734 PolarHBondContact O-N 2.78Å
731	S	84.5	Confident	88	Confident	43 Å²	43	101.4 Å²	101.4	30%	0.301	51%	0.506	S	S	.	.	H	α-helix	trans	-61.9	-35.2	177.9	74.8	0	0	0	0	113.4	L727 F728 I735	L727-S731 PolarHBondContact O-N 2.86Å; F728-S731 PolarHBondContact O-N 3.46Å; F728-S731 PolarHBondContact O-OG 3.29Å; S731-I735 WeakPolarHBondContact O-CB 3.16Å; S731-I735 WeakPolarHBondContact O-CD1 3.48Å; S731-I735 WeakPolarHBondContact O-CG1 3.35Å; S731-I735 PolarHBondContact O-N 2.82Å
732	V	88.4	Confident	88.2	Confident	52 Å²	52	101.8 Å²	101.8	32%	0.315	50%	0.501	S	S	.	.	H	α-helix	trans	-68.8	-41.5	175	171	0	0	0	0	111	F728 E729 Q730 I735 E736	F728-V732 HydrophobicContact CD1-CG2 4.22Å; F728-V732 HydrophobicContact CE1-CG2 3.81Å; F728-V732 HydrophobicContact CE2-CG2 4.17Å; F728-V732 HydrophobicContact CZ-CG2 3.78Å; F728-V732 WeakPolarHBondContact O-CG2 3.4Å; F728-V732 PolarHBondContact O-N 3.04Å; E729-V732 PolarHBondContact O-N 3.43Å; Q730-V732 VanDerWaalsContact C-N 3.31Å; Q730-V732 PolarHBondContact O-N 2.86Å; V732-I735 PolarHBondContact O-N 3.24Å; V732-E736 WeakPolarHBondContact O-CB 3.44Å; V732-E736 PolarHBondContact O-N 3.08Å
733	R	91.5	Very high	88.2	Confident	134 Å²	134	101.7 Å²	101.7	51%	0.506	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-43.8	174.6	-67.3	166.5	-155.2	178.3	7.1	111.3	E729 Q730 E736 E737	E729-R733 WeakPolarHBondContact O-CB 3.34Å; E729-R733 WeakPolarHBondContact O-CG 3.48Å; E729-R733 PolarHBondContact O-N 3Å; E729-R733 IonicContact OE2-CZ 2.92Å; E729-R733 IonicContact OE2-NH2 3.13Å; E729-R733 PolarHBondContact OE2-NH2 2.93Å; Q730-R733 PolarHBondContact O-N 2.94Å; Q730-R733 VanDerWaalsContact O-N 3.15Å; R733-E736 PolarHBondContact O-N 3.4Å; R733-E737 WeakPolarHBondContact O-CB 3.33Å; R733-E737 WeakPolarHBondContact O-CG 3.29Å; R733-E737 PolarHBondContact O-N 3.42Å
734	E	88	Confident	88.6	Confident	132 Å²	132	100.3 Å²	100.3	62%	0.617	50%	0.5	S	S	*	.	H	α-helix	trans	-60.8	-44.1	175	-72.7	177	173.1	0	0	112.2	Q730 E737 H738	Q730-E734 WeakPolarHBondContact O-CG 3.16Å; Q730-E734 PolarHBondContact O-N 2.78Å; E734-E737 PolarHBondContact O-N 3.05Å; E734-H738 WeakPolarHBondContact O-CB 3.37Å; E734-H738 PolarHBondContact O-N 3.25Å
735	I	86.3	Confident	88.9	Confident	119 Å²	119	102.5 Å²	102.5	61%	0.61	50%	0.497	S	S	*	.	H	α-helix	trans	-64	-41.9	175.7	-70.9	164.6	0	0	0	110.9	S731 V732 S739	S731-I735 WeakPolarHBondContact O-CB 3.16Å; S731-I735 WeakPolarHBondContact O-CD1 3.48Å; S731-I735 WeakPolarHBondContact O-CG1 3.35Å; S731-I735 PolarHBondContact O-N 2.82Å; V732-I735 PolarHBondContact O-N 3.24Å; I735-S739 VanDerWaalsContact O-CB 3.24Å; I735-S739 WeakPolarHBondContact O-CB 3.44Å; I735-S739 PolarHBondContact O-N 3.24Å
736	E	88.7	Confident	88.9	Confident	99 Å²	99	98.7 Å²	98.7	46%	0.463	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-43.6	174.6	-87	-163.7	-150.5	0	0	112.5	V732 R733 S739 K740	V732-E736 WeakPolarHBondContact O-CB 3.44Å; V732-E736 PolarHBondContact O-N 3.08Å; R733-E736 PolarHBondContact O-N 3.4Å; E736-S739 PolarHBondContact O-N 3.38Å; E736-K740 WeakPolarHBondContact O-CB 3.5Å; E736-K740 VanDerWaalsContact O-CD 3.3Å; E736-K740 WeakPolarHBondContact O-CD 3.37Å; E736-K740 WeakPolarHBondContact O-CG 3.37Å; E736-K740 PolarHBondContact O-N 2.91Å; E736-K740 WeakPolarHBondContact OE2-CE 3.46Å; E736-K740 IonicContact OE2-NZ 2.69Å; E736-K740 PolarHBondContact OE2-NZ 2.99Å
737	E	91.4	Very high	88.9	Confident	133 Å²	133	96.3 Å²	96.3	62%	0.621	48%	0.477	S	S	*	.	H	α-helix	trans	-67.1	-42.7	178.4	-75.8	-177.2	-175	0	0	111.5	R733 E734 S739 K740 A741	R733-E737 WeakPolarHBondContact O-CB 3.33Å; R733-E737 WeakPolarHBondContact O-CG 3.29Å; R733-E737 PolarHBondContact O-N 3.42Å; E734-E737 PolarHBondContact O-N 3.05Å; E737-S739 VanDerWaalsContact C-N 3.31Å; E737-S739 PolarHBondContact O-N 3.33Å; E737-K740 PolarHBondContact O-N 2.97Å; E737-A741 VanDerWaalsContact O-CB 3.28Å; E737-A741 WeakPolarHBondContact O-CB 3.33Å; E737-A741 PolarHBondContact O-N 3.27Å
738	H	88.8	Confident	89	Confident	126 Å²	126	98.4 Å²	98.4	58%	0.583	48%	0.481	S	S	*	.	H	α-helix	trans	-61.9	-38.6	171.6	-168.4	-42.8	0	0	0	111.4	E734 A741 E742	E734-H738 WeakPolarHBondContact O-CB 3.37Å; E734-H738 PolarHBondContact O-N 3.25Å; H738-A741 PolarHBondContact O-N 3.06Å; H738-E742 WeakPolarHBondContact O-CB 3.44Å; H738-E742 PolarHBondContact O-N 3.16Å
739	S	88.1	Confident	88.9	Confident	77 Å²	77	95.4 Å²	95.4	54%	0.538	47%	0.469	S	S	.	.	H	α-helix	trans	-66.9	-42.6	176	-171.1	0	0	0	0	112	I735 E736 E737 E742 H743	I735-S739 VanDerWaalsContact O-CB 3.24Å; I735-S739 WeakPolarHBondContact O-CB 3.44Å; I735-S739 PolarHBondContact O-N 3.24Å; E736-S739 PolarHBondContact O-N 3.38Å; E737-S739 VanDerWaalsContact C-N 3.31Å; E737-S739 PolarHBondContact O-N 3.33Å; S739-E742 PolarHBondContact O-N 2.87Å; S739-H743 WeakPolarHBondContact O-CB 3.45Å; S739-H743 PolarHBondContact O-N 3.09Å
740	K	92.4	Very high	88.8	Confident	119 Å²	119	97.5 Å²	97.5	52%	0.517	47%	0.473	S	S	.	.	H	α-helix	trans	-64	-40.6	174.6	-69.8	158.2	-165.7	166.8	0	111.3	E736 E737 A744	E736-K740 WeakPolarHBondContact O-CB 3.5Å; E736-K740 VanDerWaalsContact O-CD 3.3Å; E736-K740 WeakPolarHBondContact O-CD 3.37Å; E736-K740 WeakPolarHBondContact O-CG 3.37Å; E736-K740 PolarHBondContact O-N 2.91Å; E736-K740 WeakPolarHBondContact OE2-CE 3.46Å; E736-K740 IonicContact OE2-NZ 2.69Å; E736-K740 PolarHBondContact OE2-NZ 2.99Å; E737-K740 PolarHBondContact O-N 2.97Å; K740-A744 VanDerWaalsContact O-CB 3.3Å; K740-A744 WeakPolarHBondContact O-CB 3.37Å; K740-A744 PolarHBondContact O-N 3.22Å
741	A	90.8	Very high	88.7	Confident	62 Å²	62	97.1 Å²	97.1	51%	0.512	47%	0.474	S	S	.	.	H	α-helix	trans	-67.3	-44.3	176.2	0	0	0	0	0	112.4	E737 H738 A744 R745	E737-A741 VanDerWaalsContact O-CB 3.28Å; E737-A741 WeakPolarHBondContact O-CB 3.33Å; E737-A741 PolarHBondContact O-N 3.27Å; H738-A741 PolarHBondContact O-N 3.06Å; A741-A744 PolarHBondContact O-N 3.14Å; A741-R745 WeakPolarHBondContact O-CB 3.2Å; A741-R745 PolarHBondContact O-N 3.25Å
742	E	88	Confident	88.8	Confident	50 Å²	50	103.7 Å²	103.7	23%	0.234	49%	0.492	C	S	.	.	H	α-helix	trans	-58.9	-49.8	172.1	-93.2	-61.7	128.8	0	0	111.4	H738 S739 A744 R745 Q746	H738-E742 WeakPolarHBondContact O-CB 3.44Å; H738-E742 PolarHBondContact O-N 3.16Å; S739-E742 PolarHBondContact O-N 2.87Å; E742-A744 VanDerWaalsContact C-N 3.3Å; E742-A744 PolarHBondContact O-N 3.18Å; E742-R745 VanDerWaalsContact CD-NH2 3.29Å; E742-R745 WeakPolarHBondContact O-CB 3.34Å; E742-R745 PolarHBondContact O-N 2.87Å; E742-R745 VanDerWaalsContact O-N 3.1Å; E742-R745 IonicContact OE1-CZ 2.65Å; E742-R745 VanDerWaalsContact OE1-CZ 3.25Å; E742-R745 IonicContact OE1-NE 2.74Å; E742-R745 PolarHBondContact OE1-NE 3.32Å; E742-R745 IonicContact OE1-NH2 3.59Å; E742-R745 PolarHBondContact OE1-NH2 3.29Å; E742-R745 IonicContact OE2-CZ 3.26Å; E742-R745 IonicContact OE2-NE 3.5Å; E742-R745 IonicContact OE2-NH2 2.72Å; E742-R745 PolarHBondContact OE2-NH2 2.95Å; E742-Q746 WeakPolarHBondContact O-CB 3.36Å; E742-Q746 VanDerWaalsContact O-CG 3.24Å; E742-Q746 WeakPolarHBondContact O-CG 3.14Å; E742-Q746 PolarHBondContact O-N 3.42Å; E742-Q746 PolarHBondContact OE2-NE2 3.33Å
743	H	88.2	Confident	88.6	Confident	112 Å²	112	106.1 Å²	106.1	52%	0.519	50%	0.502	S	S	.	.	H	α-helix	trans	-61.3	-38.6	177.8	-177	-121.5	0	0	0	111.9	S739 Q746 L747	S739-H743 WeakPolarHBondContact O-CB 3.45Å; S739-H743 PolarHBondContact O-N 3.09Å; H743-Q746 PolarHBondContact O-N 3.11Å; H743-L747 VanDerWaalsContact O-CB 3.32Å; H743-L747 WeakPolarHBondContact O-CB 3.42Å; H743-L747 WeakPolarHBondContact O-CG 3.37Å; H743-L747 PolarHBondContact O-N 3.36Å
744	A	92.4	Very high	88.4	Confident	43 Å²	43	103.7 Å²	103.7	36%	0.355	50%	0.499	S	S	.	.	H	α-helix	trans	-66.7	-36.2	173.9	0	0	0	0	0	112.9	K740 A741 E742 K748	K740-A744 VanDerWaalsContact O-CB 3.3Å; K740-A744 WeakPolarHBondContact O-CB 3.37Å; K740-A744 PolarHBondContact O-N 3.22Å; A741-A744 PolarHBondContact O-N 3.14Å; E742-A744 VanDerWaalsContact C-N 3.3Å; E742-A744 PolarHBondContact O-N 3.18Å; A744-K748 VanDerWaalsContact O-CG 3.29Å; A744-K748 WeakPolarHBondContact O-CG 3.47Å; A744-K748 PolarHBondContact O-N 3.12Å; A744-K748 VanDerWaalsContact O-N 3.11Å
745	R	88	Confident	88.1	Confident	121 Å²	121	107.3 Å²	107.3	46%	0.457	51%	0.507	S	S	.	.	H	α-helix	trans	-65.1	-50.7	172.4	-178.7	172.8	75.7	95.8	-10.5	110.8	A741 E742 L747 K748 E749	A741-R745 WeakPolarHBondContact O-CB 3.2Å; A741-R745 PolarHBondContact O-N 3.25Å; E742-R745 VanDerWaalsContact CD-NH2 3.29Å; E742-R745 WeakPolarHBondContact O-CB 3.34Å; E742-R745 PolarHBondContact O-N 2.87Å; E742-R745 VanDerWaalsContact O-N 3.1Å; E742-R745 IonicContact OE1-CZ 2.65Å; E742-R745 VanDerWaalsContact OE1-CZ 3.25Å; E742-R745 IonicContact OE1-NE 2.74Å; E742-R745 PolarHBondContact OE1-NE 3.32Å; E742-R745 IonicContact OE1-NH2 3.59Å; E742-R745 PolarHBondContact OE1-NH2 3.29Å; E742-R745 IonicContact OE2-CZ 3.26Å; E742-R745 IonicContact OE2-NE 3.5Å; E742-R745 IonicContact OE2-NH2 2.72Å; E742-R745 PolarHBondContact OE2-NH2 2.95Å; R745-L747 VanDerWaalsContact C-N 3.32Å; R745-L747 PolarHBondContact O-N 3.33Å; R745-K748 WeakPolarHBondContact O-CB 3.24Å; R745-K748 PolarHBondContact O-N 3.26Å; R745-K748 VanDerWaalsContact O-N 3.1Å; R745-E749 WeakPolarHBondContact CG-OE1 3.25Å; R745-E749 IonicContact CZ-OE1 2.7Å; R745-E749 IonicContact NH1-OE1 3.54Å; R745-E749 PolarHBondContact NH1-OE1 2.94Å; R745-E749 IonicContact NH1-OE2 3.56Å; R745-E749 WeakPolarHBondContact O-CG 3.3Å; R745-E749 PolarHBondContact O-N 2.77Å
746	Q	87.8	Confident	88	Confident	99 Å²	99	106.6 Å²	106.6	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-62.1	-36.6	178.4	-67.6	170.2	28.2	0	0	112	E742 H743 E749 R750	E742-Q746 WeakPolarHBondContact O-CB 3.36Å; E742-Q746 VanDerWaalsContact O-CG 3.24Å; E742-Q746 WeakPolarHBondContact O-CG 3.14Å; E742-Q746 PolarHBondContact O-N 3.42Å; E742-Q746 PolarHBondContact OE2-NE2 3.33Å; H743-Q746 PolarHBondContact O-N 3.11Å; Q746-E749 PolarHBondContact O-N 2.77Å; Q746-R750 WeakPolarHBondContact O-CB 3.28Å; Q746-R750 PolarHBondContact O-N 3.16Å
747	L	89.8	Confident	87.8	Confident	64 Å²	64	107.9 Å²	107.9	34%	0.335	51%	0.506	S	S	.	.	H	α-helix	trans	-65.5	-41.4	171.8	-81.7	176.9	0	0	0	112.6	H743 R745 N751	H743-L747 VanDerWaalsContact O-CB 3.32Å; H743-L747 WeakPolarHBondContact O-CB 3.42Å; H743-L747 WeakPolarHBondContact O-CG 3.37Å; H743-L747 PolarHBondContact O-N 3.36Å; R745-L747 VanDerWaalsContact C-N 3.32Å; R745-L747 PolarHBondContact O-N 3.33Å; L747-N751 VanDerWaalsContact O-CB 3.31Å; L747-N751 WeakPolarHBondContact O-CB 3.34Å; L747-N751 PolarHBondContact O-N 2.98Å; L747-N751 PolarHBondContact O-ND2 3.08Å; L747-N751 PolarHBondContact O-OD1 3.17Å
748	K	88.9	Confident	87.5	Confident	158 Å²	158	105 Å²	105	69%	0.687	50%	0.501	S	S	*	.	H	α-helix	trans	-63.1	-45.8	174	-73.2	168.3	-178.5	177	0	111.1	A744 R745 N751 R752	A744-K748 VanDerWaalsContact O-CG 3.29Å; A744-K748 WeakPolarHBondContact O-CG 3.47Å; A744-K748 PolarHBondContact O-N 3.12Å; A744-K748 VanDerWaalsContact O-N 3.11Å; R745-K748 WeakPolarHBondContact O-CB 3.24Å; R745-K748 PolarHBondContact O-N 3.26Å; R745-K748 VanDerWaalsContact O-N 3.1Å; K748-N751 PolarHBondContact O-N 3.36Å; K748-R752 WeakPolarHBondContact O-CB 3.42Å; K748-R752 PolarHBondContact O-N 2.98Å
749	E	85.1	Confident	87.3	Confident	75 Å²	75	102.3 Å²	102.3	35%	0.35	49%	0.491	S	S	.	.	H	α-helix	trans	-63.1	-45.6	176.3	-71.8	172.4	-169.4	0	0	111.5	R745 Q746 N751 R752 L753	R745-E749 WeakPolarHBondContact CG-OE1 3.25Å; R745-E749 IonicContact CZ-OE1 2.7Å; R745-E749 IonicContact NH1-OE1 3.54Å; R745-E749 PolarHBondContact NH1-OE1 2.94Å; R745-E749 IonicContact NH1-OE2 3.56Å; R745-E749 WeakPolarHBondContact O-CG 3.3Å; R745-E749 PolarHBondContact O-N 2.77Å; Q746-E749 PolarHBondContact O-N 2.77Å; E749-N751 PolarHBondContact O-N 3.21Å; E749-R752 WeakPolarHBondContact O-CB 3.26Å; E749-R752 PolarHBondContact O-N 3.12Å; E749-L753 WeakPolarHBondContact O-CB 3.35Å; E749-L753 VanDerWaalsContact O-CG 3.29Å; E749-L753 WeakPolarHBondContact O-CG 3.27Å; E749-L753 PolarHBondContact O-N 3.46Å
750	R	88	Confident	87.1	Confident	140 Å²	140	102.2 Å²	102.2	53%	0.528	49%	0.487	S	S	.	.	H	α-helix	trans	-57.6	-47.3	173.9	-168.8	-156.5	75.9	148.8	5.5	111.5	Q746 R752 L753 I754	Q746-R750 WeakPolarHBondContact O-CB 3.28Å; Q746-R750 PolarHBondContact O-N 3.16Å; R750-R752 VanDerWaalsContact C-N 3.31Å; R750-R752 PolarHBondContact O-N 3.03Å; R750-L753 PolarHBondContact O-N 3.11Å; R750-I754 HydrophobicContact CG-CD1 3.89Å; R750-I754 HydrophobicContact CG-CG1 4.41Å; R750-I754 WeakPolarHBondContact O-CB 3.42Å; R750-I754 WeakPolarHBondContact O-CG1 3.21Å; R750-I754 PolarHBondContact O-N 3.4Å
751	N	88.2	Confident	86.8	Confident	81 Å²	81	102 Å²	102	43%	0.433	49%	0.487	S	S	.	.	H	α-helix	trans	-70.2	-27.3	-179.1	-67.4	-10.9	0	0	0	112.6	L747 K748 E749	L747-N751 VanDerWaalsContact O-CB 3.31Å; L747-N751 WeakPolarHBondContact O-CB 3.34Å; L747-N751 PolarHBondContact O-N 2.98Å; L747-N751 PolarHBondContact O-ND2 3.08Å; L747-N751 PolarHBondContact O-OD1 3.17Å; K748-N751 PolarHBondContact O-N 3.36Å; E749-N751 PolarHBondContact O-N 3.21Å
752	R	85.1	Confident	86.7	Confident	181 Å²	181	105.5 Å²	105.5	68%	0.683	49%	0.487	S	S	*	.	H	α-helix	trans	-68.2	-49.1	167.4	166.4	-178.1	160.9	-159.2	-5.9	111.3	K748 E749 R750 R755	K748-R752 WeakPolarHBondContact O-CB 3.42Å; K748-R752 PolarHBondContact O-N 2.98Å; E749-R752 WeakPolarHBondContact O-CB 3.26Å; E749-R752 PolarHBondContact O-N 3.12Å; R750-R752 VanDerWaalsContact C-N 3.31Å; R750-R752 PolarHBondContact O-N 3.03Å; R752-R755 WeakPolarHBondContact O-CB 3.42Å; R752-R755 PolarHBondContact O-N 3.09Å
753	L	85.4	Confident	86.6	Confident	103 Å²	103	107.8 Å²	107.8	54%	0.539	50%	0.501	S	S	.	.	H	α-helix	trans	-72	-30.3	-176.4	-69.5	169.7	0	0	0	113.5	E749 R750 R755 M756	E749-L753 WeakPolarHBondContact O-CB 3.35Å; E749-L753 VanDerWaalsContact O-CG 3.29Å; E749-L753 WeakPolarHBondContact O-CG 3.27Å; E749-L753 PolarHBondContact O-N 3.46Å; R750-L753 PolarHBondContact O-N 3.11Å; L753-R755 PolarHBondContact O-N 3.15Å; L753-R755 VanDerWaalsContact O-N 3.15Å; L753-M756 PolarHBondContact O-N 3.19Å
754	I	86.6	Confident	86.5	Confident	84 Å²	84	105.4 Å²	105.4	43%	0.431	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-55.7	-30.9	174.3	-81.2	165.9	0	0	0	111.8	R750 M756 K757	R750-I754 HydrophobicContact CG-CD1 3.89Å; R750-I754 HydrophobicContact CG-CG1 4.41Å; R750-I754 WeakPolarHBondContact O-CB 3.42Å; R750-I754 WeakPolarHBondContact O-CG1 3.21Å; R750-I754 PolarHBondContact O-N 3.4Å; I754-M756 PolarHBondContact O-N 3.42Å; I754-K757 WeakPolarHBondContact O-CB 3.37Å; I754-K757 PolarHBondContact O-N 2.87Å
755	R	82.3	Confident	86.3	Confident	207 Å²	207	106.2 Å²	106.2	78%	0.781	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-61.5	-30.9	175.8	-59.5	-179.5	-179.7	-169.3	-2.8	112.9	R752 L753 K757	R752-R755 WeakPolarHBondContact O-CB 3.42Å; R752-R755 PolarHBondContact O-N 3.09Å; L753-R755 PolarHBondContact O-N 3.15Å; L753-R755 VanDerWaalsContact O-N 3.15Å; R755-K757 VanDerWaalsContact C-N 3.33Å
756	M	83.6	Confident	86.4	Confident	104 Å²	104	105.4 Å²	105.4	51%	0.512	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-87.3	0.2	177.6	-59.7	177.3	68.6	0	0	112.7	L753 I754 S758 D759 V760	L753-M756 PolarHBondContact O-N 3.19Å; I754-M756 PolarHBondContact O-N 3.42Å; M756-S758 VanDerWaalsContact C-N 3.27Å; M756-S758 PolarHBondContact O-N 3.42Å; M756-D759 PolarHBondContact O-N 3.41Å; M756-D759 VanDerWaalsContact O-N 3.15Å; M756-V760 HydrophobicContact CB-CG2 4.48Å; M756-V760 WeakPolarHBondContact O-CB 3.4Å; M756-V760 WeakPolarHBondContact O-CG2 3.24Å; M756-V760 PolarHBondContact O-N 2.86Å
757	K	84	Confident	86.3	Confident	127 Å²	127	105.8 Å²	105.8	55%	0.552	50%	0.503	S	S	*	.	H	α-helix	trans	-60.1	-37.1	-175	-172.8	-177.1	175.3	-174.1	0	112.1	I754 R755 Q761	I754-K757 WeakPolarHBondContact O-CB 3.37Å; I754-K757 PolarHBondContact O-N 2.87Å; R755-K757 VanDerWaalsContact C-N 3.33Å; K757-Q761 VanDerWaalsContact O-CB 3.3Å; K757-Q761 WeakPolarHBondContact O-CB 3.29Å; K757-Q761 WeakPolarHBondContact O-CG 3.38Å; K757-Q761 PolarHBondContact O-N 3.46Å; K757-Q761 PolarHBondContact O-OE1 3.2Å
758	S	85.9	Confident	86.2	Confident	73 Å²	73	108.9 Å²	108.9	51%	0.51	51%	0.514	S	S	.	.	H	α-helix	trans	-63.1	-47.3	173.8	41.6	0	0	0	0	112.6	M756 Q761 R762	M756-S758 VanDerWaalsContact C-N 3.27Å; M756-S758 PolarHBondContact O-N 3.42Å; S758-Q761 PolarHBondContact O-N 2.93Å; S758-R762 PolarHBondContact O-N 2.97Å
759	D	84.5	Confident	86.2	Confident	68 Å²	68	106.8 Å²	106.8	36%	0.364	51%	0.506	S	S	.	.	H	α-helix	trans	-67.1	-39.9	178.1	-64	-62.8	0	0	0	112	M756 R762 L763	M756-D759 PolarHBondContact O-N 3.41Å; M756-D759 VanDerWaalsContact O-N 3.15Å; D759-R762 PolarHBondContact O-N 3.43Å; D759-R762 IonicContact OD1-CZ 3.44Å; D759-R762 IonicContact OD1-NH1 3.06Å; D759-R762 PolarHBondContact OD1-NH1 3.17Å; D759-R762 IonicContact OD1-NH2 3.97Å; D759-R762 PolarHBondContact OD1-NH2 2.63Å; D759-L763 VanDerWaalsContact O-CB 3.31Å; D759-L763 WeakPolarHBondContact O-CB 3.36Å; D759-L763 PolarHBondContact O-N 2.7Å
760	V	84.1	Confident	86.3	Confident	76 Å²	76	105.5 Å²	105.5	46%	0.461	51%	0.509	S	S	.	.	H	α-helix	trans	-65	-40.4	173.3	172.4	0	0	0	0	110.8	M756 L763 V764	M756-V760 HydrophobicContact CB-CG2 4.48Å; M756-V760 WeakPolarHBondContact O-CB 3.4Å; M756-V760 WeakPolarHBondContact O-CG2 3.24Å; M756-V760 PolarHBondContact O-N 2.86Å; V760-L763 PolarHBondContact O-N 3.03Å; V760-V764 HydrophobicContact CG1-CG2 4.18Å; V760-V764 VanDerWaalsContact O-CB 3.25Å; V760-V764 WeakPolarHBondContact O-CB 3.49Å; V760-V764 WeakPolarHBondContact O-CG2 3.49Å; V760-V764 PolarHBondContact O-N 2.69Å
761	Q	86.7	Confident	86.2	Confident	113 Å²	113	108 Å²	108	53%	0.528	52%	0.518	S	S	.	.	H	α-helix	trans	-64.6	-43.4	174	-77.5	177	-64.4	0	0	111.6	K757 S758 V764 S765	K757-Q761 VanDerWaalsContact O-CB 3.3Å; K757-Q761 WeakPolarHBondContact O-CB 3.29Å; K757-Q761 WeakPolarHBondContact O-CG 3.38Å; K757-Q761 PolarHBondContact O-N 3.46Å; K757-Q761 PolarHBondContact O-OE1 3.2Å; S758-Q761 PolarHBondContact O-N 2.93Å; Q761-V764 PolarHBondContact O-N 3.46Å; Q761-S765 WeakPolarHBondContact O-CB 3.45Å; Q761-S765 PolarHBondContact O-N 2.91Å; Q761-S765 PolarHBondContact O-OG 3.28Å
762	R	88.1	Confident	86.1	Confident	136 Å²	136	107.6 Å²	107.6	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-59.3	-49.1	174	-174.1	178.8	67.9	-115.6	-9	111.5	S758 D759 S765 Q766	S758-R762 PolarHBondContact O-N 2.97Å; D759-R762 PolarHBondContact O-N 3.43Å; D759-R762 IonicContact OD1-CZ 3.44Å; D759-R762 IonicContact OD1-NH1 3.06Å; D759-R762 PolarHBondContact OD1-NH1 3.17Å; D759-R762 IonicContact OD1-NH2 3.97Å; D759-R762 PolarHBondContact OD1-NH2 2.63Å; R762-S765 PolarHBondContact O-N 3.22Å; R762-Q766 WeakPolarHBondContact O-CB 3.31Å; R762-Q766 VanDerWaalsContact O-CG 3.31Å; R762-Q766 WeakPolarHBondContact O-CG 3.33Å; R762-Q766 PolarHBondContact O-N 3.01Å
763	L	85.4	Confident	86.3	Confident	99 Å²	99	103.4 Å²	103.4	52%	0.518	51%	0.507	S	S	.	.	H	α-helix	trans	-64.7	-41.3	179.6	-169.7	105.4	0	0	0	112	D759 V760 Q766 L767	D759-L763 VanDerWaalsContact O-CB 3.31Å; D759-L763 WeakPolarHBondContact O-CB 3.36Å; D759-L763 PolarHBondContact O-N 2.7Å; V760-L763 PolarHBondContact O-N 3.03Å; L763-Q766 PolarHBondContact O-N 3.45Å; L763-L767 HydrophobicContact CD2-CD1 3.79Å; L763-L767 HydrophobicContact CG-CD1 4.03Å; L763-L767 VanDerWaalsContact O-CB 3.31Å; L763-L767 WeakPolarHBondContact O-CB 3.44Å; L763-L767 VanDerWaalsContact O-CG 3.25Å; L763-L767 WeakPolarHBondContact O-CG 3.42Å; L763-L767 PolarHBondContact O-N 3.35Å
764	V	87	Confident	86.4	Confident	62 Å²	62	107.9 Å²	107.9	38%	0.376	52%	0.517	S	S	.	.	H	α-helix	trans	-68.7	-36.6	177.1	168.7	0	0	0	0	111.4	V760 Q761 K768	V760-V764 HydrophobicContact CG1-CG2 4.18Å; V760-V764 VanDerWaalsContact O-CB 3.25Å; V760-V764 WeakPolarHBondContact O-CB 3.49Å; V760-V764 WeakPolarHBondContact O-CG2 3.49Å; V760-V764 PolarHBondContact O-N 2.69Å; Q761-V764 PolarHBondContact O-N 3.46Å; V764-K768 HydrophobicContact CG1-CD 4.29Å; V764-K768 WeakPolarHBondContact O-CB 3.45Å; V764-K768 VanDerWaalsContact O-CG 3.27Å; V764-K768 WeakPolarHBondContact O-CG 3.42Å; V764-K768 PolarHBondContact O-N 3.05Å
765	S	88.5	Confident	86.4	Confident	59 Å²	59	111.1 Å²	111.1	41%	0.413	53%	0.525	S	S	.	.	H	α-helix	trans	-64	-48.5	170.6	-68.6	0	0	0	0	111.2	Q761 R762 L767 K768 E769	Q761-S765 WeakPolarHBondContact O-CB 3.45Å; Q761-S765 PolarHBondContact O-N 2.91Å; Q761-S765 PolarHBondContact O-OG 3.28Å; R762-S765 PolarHBondContact O-N 3.22Å; S765-L767 VanDerWaalsContact C-N 3.33Å; S765-L767 PolarHBondContact O-N 3.5Å; S765-K768 CarbonylContact O-C 3.54Å; S765-K768 WeakPolarHBondContact O-CB 3.42Å; S765-K768 PolarHBondContact O-N 3.3Å; S765-K768 VanDerWaalsContact O-N 3.12Å; S765-E769 WeakPolarHBondContact O-CB 3.36Å; S765-E769 WeakPolarHBondContact O-CG 3.27Å; S765-E769 PolarHBondContact O-N 3.49Å
766	Q	88.9	Confident	86.7	Confident	104 Å²	104	109.2 Å²	109.2	49%	0.486	52%	0.518	S	S	.	.	H	α-helix	trans	-59.8	-39.4	176.7	-73.7	173.4	-33.6	0	0	112.8	R762 L763 A770	R762-Q766 WeakPolarHBondContact O-CB 3.31Å; R762-Q766 VanDerWaalsContact O-CG 3.31Å; R762-Q766 WeakPolarHBondContact O-CG 3.33Å; R762-Q766 PolarHBondContact O-N 3.01Å; L763-Q766 PolarHBondContact O-N 3.45Å; Q766-A770 WeakPolarHBondContact O-CB 3.43Å; Q766-A770 PolarHBondContact O-N 3.03Å
767	L	86.9	Confident	87	Confident	108 Å²	108	106.3 Å²	106.3	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-71	-33.2	175.7	-74.7	169.5	0	0	0	112.6	L763 S765 R771	L763-L767 HydrophobicContact CD2-CD1 3.79Å; L763-L767 HydrophobicContact CG-CD1 4.03Å; L763-L767 VanDerWaalsContact O-CB 3.31Å; L763-L767 WeakPolarHBondContact O-CB 3.44Å; L763-L767 VanDerWaalsContact O-CG 3.25Å; L763-L767 WeakPolarHBondContact O-CG 3.42Å; L763-L767 PolarHBondContact O-N 3.35Å; S765-L767 VanDerWaalsContact C-N 3.33Å; S765-L767 PolarHBondContact O-N 3.5Å; L767-R771 VanDerWaalsContact O-CB 3.24Å; L767-R771 WeakPolarHBondContact O-CB 3.25Å; L767-R771 PolarHBondContact O-N 3.15Å
768	K	86.9	Confident	87.1	Confident	128 Å²	128	107.4 Å²	107.4	56%	0.557	52%	0.515	S	S	*	.	H	α-helix	trans	-68.7	-51.5	171.2	-78.3	178.4	176.4	-169.5	0	110.9	V764 S765 A770 R771 D772	V764-K768 HydrophobicContact CG1-CD 4.29Å; V764-K768 WeakPolarHBondContact O-CB 3.45Å; V764-K768 VanDerWaalsContact O-CG 3.27Å; V764-K768 WeakPolarHBondContact O-CG 3.42Å; V764-K768 PolarHBondContact O-N 3.05Å; S765-K768 CarbonylContact O-C 3.54Å; S765-K768 WeakPolarHBondContact O-CB 3.42Å; S765-K768 PolarHBondContact O-N 3.3Å; S765-K768 VanDerWaalsContact O-N 3.12Å; K768-A770 VanDerWaalsContact C-N 3.3Å; K768-A770 PolarHBondContact O-N 2.92Å; K768-R771 CarbonylContact O-C 3.58Å; K768-R771 WeakPolarHBondContact O-CA 3.41Å; K768-R771 WeakPolarHBondContact O-CB 3.21Å; K768-R771 PolarHBondContact O-N 3.34Å; K768-D772 WeakPolarHBondContact O-CB 3.48Å; K768-D772 PolarHBondContact O-N 2.68Å
769	E	89.4	Confident	87.2	Confident	114 Å²	114	106.6 Å²	106.6	53%	0.533	51%	0.505	S	S	.	.	H	α-helix	trans	-56.1	-43	175.4	-72	164.6	-169.6	0	0	111.6	S765 D772 N773	S765-E769 WeakPolarHBondContact O-CB 3.36Å; S765-E769 WeakPolarHBondContact O-CG 3.27Å; S765-E769 PolarHBondContact O-N 3.49Å; E769-D772 PolarHBondContact O-N 3.15Å; E769-N773 WeakPolarHBondContact O-CB 3.47Å; E769-N773 PolarHBondContact O-N 3.37Å; E769-N773 PolarHBondContact O-ND2 3.41Å
770	A	87.1	Confident	87.5	Confident	48 Å²	48	105.9 Å²	105.9	40%	0.397	51%	0.508	S	S	.	.	H	α-helix	trans	-66.8	-36.6	175	0	0	0	0	0	113	Q766 K768 R774	Q766-A770 WeakPolarHBondContact O-CB 3.43Å; Q766-A770 PolarHBondContact O-N 3.03Å; K768-A770 VanDerWaalsContact C-N 3.3Å; K768-A770 PolarHBondContact O-N 2.92Å; A770-R774 WeakPolarHBondContact O-CB 3.13Å; A770-R774 VanDerWaalsContact O-CG 3.27Å; A770-R774 WeakPolarHBondContact O-CG 3.32Å; A770-R774 PolarHBondContact O-N 3.16Å
771	R	85.7	Confident	87.6	Confident	192 Å²	192	108.4 Å²	108.4	73%	0.725	52%	0.515	S	S	*	.	H	α-helix	trans	-68.4	-44.4	173.5	175.7	176.8	174.7	138.8	2.4	111.5	L767 K768 R774 Y775	L767-R771 VanDerWaalsContact O-CB 3.24Å; L767-R771 WeakPolarHBondContact O-CB 3.25Å; L767-R771 PolarHBondContact O-N 3.15Å; K768-R771 CarbonylContact O-C 3.58Å; K768-R771 WeakPolarHBondContact O-CA 3.41Å; K768-R771 WeakPolarHBondContact O-CB 3.21Å; K768-R771 PolarHBondContact O-N 3.34Å; R771-R774 PolarHBondContact O-N 3.4Å; R771-Y775 VanDerWaalsContact O-CB 3.31Å; R771-Y775 WeakPolarHBondContact O-CB 3.37Å; R771-Y775 PolarHBondContact O-N 3.14Å
772	D	86.8	Confident	87.6	Confident	74 Å²	74	110.5 Å²	110.5	40%	0.396	52%	0.518	S	S	.	.	H	α-helix	trans	-72.3	-34.5	-177	-64.5	-13.4	0	0	0	110.5	K768 E769 Y775 R776	K768-D772 WeakPolarHBondContact O-CB 3.48Å; K768-D772 PolarHBondContact O-N 2.68Å; E769-D772 PolarHBondContact O-N 3.15Å; D772-Y775 PolarHBondContact O-N 3.2Å; D772-R776 VanDerWaalsContact O-CB 3.29Å; D772-R776 WeakPolarHBondContact O-CB 3.4Å; D772-R776 WeakPolarHBondContact O-CG 3.48Å; D772-R776 PolarHBondContact O-N 2.92Å
773	N	89.4	Confident	87.6	Confident	93 Å²	93	108.6 Å²	108.6	50%	0.497	52%	0.515	S	S	.	.	H	α-helix	trans	-69.4	-40.6	170.1	-71.1	-19.9	0	0	0	111.9	E769 Y775 R776 A777	E769-N773 WeakPolarHBondContact O-CB 3.47Å; E769-N773 PolarHBondContact O-N 3.37Å; E769-N773 PolarHBondContact O-ND2 3.41Å; N773-Y775 VanDerWaalsContact C-N 3.33Å; N773-R776 PolarHBondContact O-N 3.46Å; N773-A777 VanDerWaalsContact O-CB 3.3Å; N773-A777 WeakPolarHBondContact O-CB 3.45Å; N773-A777 PolarHBondContact O-N 2.99Å
774	R	86.9	Confident	87.8	Confident	196 Å²	196	106.4 Å²	106.4	74%	0.74	51%	0.511	S	S	*	.	H	α-helix	trans	-64.4	-36.8	171.2	-78.8	176.6	175.6	-166.6	-1.2	112.4	A770 R771 K778	A770-R774 WeakPolarHBondContact O-CB 3.13Å; A770-R774 VanDerWaalsContact O-CG 3.27Å; A770-R774 WeakPolarHBondContact O-CG 3.32Å; A770-R774 PolarHBondContact O-N 3.16Å; R771-R774 PolarHBondContact O-N 3.4Å; R774-K778 WeakPolarHBondContact O-CB 3.24Å; R774-K778 WeakPolarHBondContact O-CG 3.32Å; R774-K778 PolarHBondContact O-N 3.38Å
775	Y	85.8	Confident	87.8	Confident	152 Å²	152	108 Å²	108	60%	0.596	52%	0.517	S	S	*	.	H	α-helix	trans	-68.3	-45.9	175.5	178.8	-99.8	0	0	0	111	R771 D772 N773 K778 L779	R771-Y775 VanDerWaalsContact O-CB 3.31Å; R771-Y775 WeakPolarHBondContact O-CB 3.37Å; R771-Y775 PolarHBondContact O-N 3.14Å; D772-Y775 PolarHBondContact O-N 3.2Å; N773-Y775 VanDerWaalsContact C-N 3.33Å; Y775-K778 PolarHBondContact O-N 3.46Å; Y775-L779 HydrophobicContact CE1-CD2 4.27Å; Y775-L779 WeakPolarHBondContact O-CB 3.35Å; Y775-L779 PolarHBondContact O-N 2.68Å
776	R	89	Confident	87.6	Confident	167 Å²	167	107.3 Å²	107.3	63%	0.63	51%	0.512	S	S	*	.	H	α-helix	trans	-63.2	-38.6	174.5	-75.7	168.7	177.6	173	-1.5	112.9	D772 N773 L779 A780	D772-R776 VanDerWaalsContact O-CB 3.29Å; D772-R776 WeakPolarHBondContact O-CB 3.4Å; D772-R776 WeakPolarHBondContact O-CG 3.48Å; D772-R776 PolarHBondContact O-N 2.92Å; N773-R776 PolarHBondContact O-N 3.46Å; R776-L779 PolarHBondContact O-N 2.94Å; R776-A780 VanDerWaalsContact O-CB 3.31Å; R776-A780 WeakPolarHBondContact O-CB 3.33Å; R776-A780 PolarHBondContact O-N 3.25Å
777	A	89.4	Confident	87.4	Confident	44 Å²	44	106.4 Å²	106.4	36%	0.364	51%	0.51	S	S	.	.	H	α-helix	trans	-61.9	-52	173.6	0	0	0	0	0	110.6	N773 L779 A780 E781	N773-A777 VanDerWaalsContact O-CB 3.3Å; N773-A777 WeakPolarHBondContact O-CB 3.45Å; N773-A777 PolarHBondContact O-N 2.99Å; A777-L779 VanDerWaalsContact C-N 3.3Å; A777-L779 PolarHBondContact O-N 3.05Å; A777-A780 PolarHBondContact O-N 3.23Å; A777-E781 WeakPolarHBondContact O-CB 3.44Å; A777-E781 VanDerWaalsContact O-CG 3.25Å; A777-E781 WeakPolarHBondContact O-CG 3.46Å; A777-E781 PolarHBondContact O-N 3.42Å
778	K	86.5	Confident	87.4	Confident	150 Å²	150	106.7 Å²	106.7	65%	0.652	51%	0.509	S	S	*	.	H	α-helix	trans	-62.6	-33.3	175.3	-76.1	-164.3	168	-153.7	0	113.9	R774 Y775 W782	R774-K778 WeakPolarHBondContact O-CB 3.24Å; R774-K778 WeakPolarHBondContact O-CG 3.32Å; R774-K778 PolarHBondContact O-N 3.38Å; Y775-K778 PolarHBondContact O-N 3.46Å; K778-W782 WeakPolarHBondContact O-CB 3.35Å; K778-W782 PolarHBondContact O-N 2.63Å
779	L	88.4	Confident	87.1	Confident	56 Å²	56	102.7 Å²	102.7	29%	0.293	50%	0.495	S	S	.	.	H	α-helix	trans	-68.7	-45.2	175.7	-172.4	70.6	0	0	0	110	Y775 R776 A777 W782 E783	Y775-L779 HydrophobicContact CE1-CD2 4.27Å; Y775-L779 WeakPolarHBondContact O-CB 3.35Å; Y775-L779 PolarHBondContact O-N 2.68Å; R776-L779 PolarHBondContact O-N 2.94Å; A777-L779 VanDerWaalsContact C-N 3.3Å; A777-L779 PolarHBondContact O-N 3.05Å; L779-W782 HydrophobicContact CD1-CE3 4.42Å; L779-W782 CarbonylContact O-C 3.59Å; L779-W782 PolarHBondContact O-N 3.07Å; L779-E783 HydrophobicContact CG-CG 4.36Å; L779-E783 VanDerWaalsContact O-CB 3.27Å; L779-E783 WeakPolarHBondContact O-CB 3.34Å; L779-E783 VanDerWaalsContact O-CG 3.24Å; L779-E783 WeakPolarHBondContact O-CG 3.39Å; L779-E783 PolarHBondContact O-N 3.42Å
780	A	89.8	Confident	87	Confident	52 Å²	52	104.5 Å²	104.5	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-67.1	-37.5	175.9	0	0	0	0	0	112.6	R776 A777 A784	R776-A780 VanDerWaalsContact O-CB 3.31Å; R776-A780 WeakPolarHBondContact O-CB 3.33Å; R776-A780 PolarHBondContact O-N 3.25Å; A777-A780 PolarHBondContact O-N 3.23Å; A780-A784 WeakPolarHBondContact O-CB 3.41Å; A780-A784 PolarHBondContact O-N 2.98Å
781	E	87.9	Confident	86.8	Confident	129 Å²	129	105.4 Å²	105.4	60%	0.603	50%	0.5	S	S	*	.	H	α-helix	trans	-60.5	-44.5	170.4	-73.3	162.3	-170.5	0	0	110.9	A777 L785	A777-E781 WeakPolarHBondContact O-CB 3.44Å; A777-E781 VanDerWaalsContact O-CG 3.25Å; A777-E781 WeakPolarHBondContact O-CG 3.46Å; A777-E781 PolarHBondContact O-N 3.42Å; E781-L785 VanDerWaalsContact O-CB 3.27Å; E781-L785 WeakPolarHBondContact O-CB 2.9Å; E781-L785 PolarHBondContact O-N 2.92Å
782	W	85.4	Confident	86.7	Confident	157 Å²	157	101.4 Å²	101.4	60%	0.595	49%	0.49	S	S	*	.	H	α-helix	trans	-74.1	-35.7	179.5	-179	85.3	0	0	0	113.3	K778 L779 L785 C786	K778-W782 WeakPolarHBondContact O-CB 3.35Å; K778-W782 PolarHBondContact O-N 2.63Å; L779-W782 HydrophobicContact CD1-CE3 4.42Å; L779-W782 CarbonylContact O-C 3.59Å; L779-W782 PolarHBondContact O-N 3.07Å; W782-L785 PolarHBondContact O-N 3.4Å; W782-C786 VanDerWaalsContact CZ2-SG 3.57Å; W782-C786 VanDerWaalsContact O-CB 3.24Å; W782-C786 WeakPolarHBondContact O-CB 3.34Å; W782-C786 PolarHBondContact O-N 3.13Å; W782-C786 PolarHBondContact O-SG 3.1Å
783	E	88.1	Confident	86.5	Confident	96 Å²	96	105.4 Å²	105.4	45%	0.449	50%	0.499	S	S	.	.	H	α-helix	trans	-67.3	-45.5	172.9	-76.7	172.3	167.4	0	0	110	L779 L785 C786 D787	L779-E783 HydrophobicContact CG-CG 4.36Å; L779-E783 VanDerWaalsContact O-CB 3.27Å; L779-E783 WeakPolarHBondContact O-CB 3.34Å; L779-E783 VanDerWaalsContact O-CG 3.24Å; L779-E783 WeakPolarHBondContact O-CG 3.39Å; L779-E783 PolarHBondContact O-N 3.42Å; E783-L785 PolarHBondContact O-N 3.05Å; E783-C786 PolarHBondContact O-N 3.15Å; E783-D787 WeakPolarHBondContact O-CB 3.47Å; E783-D787 PolarHBondContact O-N 2.83Å
784	A	89.2	Confident	86.2	Confident	53 Å²	53	104.5 Å²	104.5	44%	0.438	49%	0.494	S	S	.	.	H	α-helix	trans	-62.2	-40.6	173.6	0	0	0	0	0	112.1	A780 D787 Q788	A780-A784 WeakPolarHBondContact O-CB 3.41Å; A780-A784 PolarHBondContact O-N 2.98Å; A784-D787 PolarHBondContact O-N 3.37Å; A784-Q788 VanDerWaalsContact O-CB 3.3Å; A784-Q788 WeakPolarHBondContact O-CB 3.31Å; A784-Q788 VanDerWaalsContact O-CG 3.27Å; A784-Q788 WeakPolarHBondContact O-CG 3.45Å; A784-Q788 PolarHBondContact O-N 3.17Å
785	L	87.9	Confident	86	Confident	96 Å²	96	97.7 Å²	97.7	50%	0.503	48%	0.48	S	S	.	.	H	α-helix	trans	-66	-42	173.5	-176.1	66.1	0	0	0	111.4	E781 W782 E783 Q788 T789	E781-L785 VanDerWaalsContact O-CB 3.27Å; E781-L785 WeakPolarHBondContact O-CB 2.9Å; E781-L785 PolarHBondContact O-N 2.92Å; W782-L785 PolarHBondContact O-N 3.4Å; E783-L785 PolarHBondContact O-N 3.05Å; L785-Q788 PolarHBondContact O-N 2.61Å; L785-T789 WeakPolarHBondContact O-CB 3.29Å; L785-T789 PolarHBondContact O-N 2.98Å; L785-T789 PolarHBondContact O-OG1 2.79Å; L785-T789 VanDerWaalsContact O-OG1 3.1Å
786	C	83.9	Confident	85.9	Confident	44 Å²	44	95.4 Å²	95.4	30%	0.297	48%	0.475	S	S	.	.	H	α-helix	trans	-65.2	-38.9	176.5	-77.4	0	0	0	0	112.4	W782 E783 R790	W782-C786 VanDerWaalsContact CZ2-SG 3.57Å; W782-C786 VanDerWaalsContact O-CB 3.24Å; W782-C786 WeakPolarHBondContact O-CB 3.34Å; W782-C786 PolarHBondContact O-N 3.13Å; W782-C786 PolarHBondContact O-SG 3.1Å; E783-C786 PolarHBondContact O-N 3.15Å; C786-R790 WeakPolarHBondContact O-CB 3.46Å; C786-R790 PolarHBondContact O-N 3.39Å
787	D	86.1	Confident	85.4	Confident	85 Å²	85	95.9 Å²	95.9	46%	0.455	48%	0.476	S	S	.	.	H	α-helix	trans	-77.1	-29.6	175.9	-85.1	-23.8	0	0	0	112.5	E783 A784 R790 S791	E783-D787 WeakPolarHBondContact O-CB 3.47Å; E783-D787 PolarHBondContact O-N 2.83Å; A784-D787 PolarHBondContact O-N 3.37Å; D787-R790 IonicContact OD1-CZ 3.72Å; D787-R790 IonicContact OD1-NE 2.73Å; D787-R790 IonicContact OD1-NH1 3.69Å; D787-R790 PolarHBondContact OD1-NH1 3.37Å; D787-S791 WeakPolarHBondContact O-CB 3.5Å; D787-S791 PolarHBondContact O-N 3Å; D787-S791 PolarHBondContact O-OG 2.98Å
788	Q	85.2	Confident	85.2	Confident	115 Å²	115	101.9 Å²	101.9	54%	0.537	49%	0.49	S	S	.	.	H	α-helix	trans	-60.6	-59.6	164.8	-81.1	176.8	-6.4	0	0	109.9	A784 L785 R790 S791 E792	A784-Q788 VanDerWaalsContact O-CB 3.3Å; A784-Q788 WeakPolarHBondContact O-CB 3.31Å; A784-Q788 VanDerWaalsContact O-CG 3.27Å; A784-Q788 WeakPolarHBondContact O-CG 3.45Å; A784-Q788 PolarHBondContact O-N 3.17Å; L785-Q788 PolarHBondContact O-N 2.61Å; Q788-R790 PolarHBondContact O-N 2.9Å; Q788-S791 CarbonylContact O-C 3.6Å; Q788-S791 WeakPolarHBondContact O-CA 3.47Å; Q788-S791 WeakPolarHBondContact O-CB 3.22Å; Q788-S791 PolarHBondContact O-N 3.25Å; Q788-S791 PolarHBondContact O-OG 3.49Å; Q788-E792 WeakPolarHBondContact O-CG 3.27Å; Q788-E792 PolarHBondContact O-N 2.86Å
789	T	82.1	Confident	84.9	Confident	43 Å²	43	97.3 Å²	97.3	26%	0.264	48%	0.479	S	S	.	.	H	α-helix	trans	-60.6	-30.5	178.8	-57.6	0	0	0	0	113.1	L785 E792 R793	L785-T789 WeakPolarHBondContact O-CB 3.29Å; L785-T789 PolarHBondContact O-N 2.98Å; L785-T789 PolarHBondContact O-OG1 2.79Å; L785-T789 VanDerWaalsContact O-OG1 3.1Å; T789-E792 WeakPolarHBondContact CA-OE2 3.43Å; T789-R793 HydrophobicContact CG2-CG 4.47Å; T789-R793 VanDerWaalsContact O-CB 3.22Å; T789-R793 WeakPolarHBondContact O-CB 3.37Å; T789-R793 WeakPolarHBondContact O-CD 3.43Å; T789-R793 WeakPolarHBondContact O-CG 3.18Å; T789-R793 PolarHBondContact O-N 3.49Å
790	R	85.6	Confident	84.6	Confident	153 Å²	153	100.2 Å²	100.2	58%	0.577	49%	0.49	S	S	*	.	H	α-helix	trans	-71.5	-40.1	171.4	179.4	-174	-78	155.5	-10.2	111.4	C786 D787 Q788 L794	C786-R790 WeakPolarHBondContact O-CB 3.46Å; C786-R790 PolarHBondContact O-N 3.39Å; D787-R790 IonicContact OD1-CZ 3.72Å; D787-R790 IonicContact OD1-NE 2.73Å; D787-R790 IonicContact OD1-NH1 3.69Å; D787-R790 PolarHBondContact OD1-NH1 3.37Å; Q788-R790 PolarHBondContact O-N 2.9Å; R790-L794 HydrophobicContact CG-CD1 4.1Å; R790-L794 VanDerWaalsContact O-CB 3.27Å; R790-L794 WeakPolarHBondContact O-CB 3.35Å; R790-L794 VanDerWaalsContact O-CG 3.26Å; R790-L794 WeakPolarHBondContact O-CG 3.42Å; R790-L794 PolarHBondContact O-N 3.41Å
791	S	83.8	Confident	84.1	Confident	66 Å²	66	103.2 Å²	103.2	46%	0.462	50%	0.495	S	S	.	.	H	α-helix	trans	-68.6	-40.5	176.3	79.2	0	0	0	0	111.5	D787 Q788 L794 A795	D787-S791 WeakPolarHBondContact O-CB 3.5Å; D787-S791 PolarHBondContact O-N 3Å; D787-S791 PolarHBondContact O-OG 2.98Å; Q788-S791 CarbonylContact O-C 3.6Å; Q788-S791 WeakPolarHBondContact O-CA 3.47Å; Q788-S791 WeakPolarHBondContact O-CB 3.22Å; Q788-S791 PolarHBondContact O-N 3.25Å; Q788-S791 PolarHBondContact O-OG 3.49Å; S791-L794 CarbonylContact O-C 3.59Å; S791-L794 PolarHBondContact O-N 3.14Å; S791-A795 VanDerWaalsContact O-CB 3.26Å; S791-A795 WeakPolarHBondContact O-CB 3.41Å; S791-A795 PolarHBondContact O-N 3.14Å
792	E	84.2	Confident	83.7	Confident	108 Å²	108	103 Å²	103	51%	0.505	49%	0.494	S	S	.	.	H	α-helix	trans	-62.8	-48.8	171.8	-69.4	170.1	156.4	0	0	110.6	Q788 T789 L794 A795 E796	Q788-E792 WeakPolarHBondContact O-CG 3.27Å; Q788-E792 PolarHBondContact O-N 2.86Å; T789-E792 WeakPolarHBondContact CA-OE2 3.43Å; E792-L794 VanDerWaalsContact C-N 3.26Å; E792-L794 PolarHBondContact O-N 3.39Å; E792-A795 CarbonylContact O-C 3.58Å; E792-A795 PolarHBondContact O-N 2.95Å; E792-A795 VanDerWaalsContact O-N 3.12Å; E792-E796 WeakPolarHBondContact O-CB 3.34Å; E792-E796 PolarHBondContact O-N 3.24Å
793	R	83.1	Confident	83.5	Confident	158 Å²	158	98.3 Å²	98.3	60%	0.596	49%	0.488	S	S	*	.	H	α-helix	trans	-64.6	-28	174.6	-73.5	170.9	-179.5	-174.8	1.9	112.9	T789 R797	T789-R793 HydrophobicContact CG2-CG 4.47Å; T789-R793 VanDerWaalsContact O-CB 3.22Å; T789-R793 WeakPolarHBondContact O-CB 3.37Å; T789-R793 WeakPolarHBondContact O-CD 3.43Å; T789-R793 WeakPolarHBondContact O-CG 3.18Å; T789-R793 PolarHBondContact O-N 3.49Å; R793-R797 VanDerWaalsContact O-CB 3.3Å; R793-R797 WeakPolarHBondContact O-CB 3.47Å; R793-R797 WeakPolarHBondContact O-CG 3.27Å; R793-R797 PolarHBondContact O-N 3.26Å
794	L	82.1	Confident	83.1	Confident	74 Å²	74	99.7 Å²	99.7	39%	0.387	50%	0.495	S	S	.	.	H	α-helix	trans	-79.5	-29.4	172.5	-80.1	168.2	0	0	0	112.7	R790 S791 E792 R798	R790-L794 HydrophobicContact CG-CD1 4.1Å; R790-L794 VanDerWaalsContact O-CB 3.27Å; R790-L794 WeakPolarHBondContact O-CB 3.35Å; R790-L794 VanDerWaalsContact O-CG 3.26Å; R790-L794 WeakPolarHBondContact O-CG 3.42Å; R790-L794 PolarHBondContact O-N 3.41Å; S791-L794 CarbonylContact O-C 3.59Å; S791-L794 PolarHBondContact O-N 3.14Å; E792-L794 VanDerWaalsContact C-N 3.26Å; E792-L794 PolarHBondContact O-N 3.39Å; L794-R798 WeakPolarHBondContact O-CB 3.31Å; L794-R798 WeakPolarHBondContact O-CG 3.41Å; L794-R798 PolarHBondContact O-N 2.84Å; L794-R798 PolarHBondContact O-NE 3.11Å
795	A	83.3	Confident	82.7	Confident	53 Å²	53	101.6 Å²	101.6	44%	0.438	50%	0.497	S	S	.	.	H	α-helix	trans	-75.2	-45.1	173.6	0	0	0	0	0	110.2	S791 E792 R797 R798 A799	S791-A795 VanDerWaalsContact O-CB 3.26Å; S791-A795 WeakPolarHBondContact O-CB 3.41Å; S791-A795 PolarHBondContact O-N 3.14Å; E792-A795 CarbonylContact O-C 3.58Å; E792-A795 PolarHBondContact O-N 2.95Å; E792-A795 VanDerWaalsContact O-N 3.12Å; A795-R797 PolarHBondContact O-N 3.23Å; A795-R798 CarbonylContact O-C 3.52Å; A795-R798 PolarHBondContact O-N 2.9Å; A795-A799 VanDerWaalsContact O-CB 3.26Å; A795-A799 WeakPolarHBondContact O-CB 3.36Å; A795-A799 PolarHBondContact O-N 3.39Å
796	E	82	Confident	82.3	Confident	105 Å²	105	101.5 Å²	101.5	49%	0.491	49%	0.494	S	S	.	.	H	α-helix	trans	-56.8	-46.4	168.2	-88.1	-162.9	-151.6	0	0	111.9	E792 R798 A799 K800	E792-E796 WeakPolarHBondContact O-CB 3.34Å; E792-E796 PolarHBondContact O-N 3.24Å; E796-R798 VanDerWaalsContact C-N 3.33Å; E796-A799 PolarHBondContact O-N 3.24Å; E796-K800 WeakPolarHBondContact O-CB 3.46Å; E796-K800 WeakPolarHBondContact O-CD 3.31Å; E796-K800 WeakPolarHBondContact O-CG 3.5Å; E796-K800 PolarHBondContact O-N 3.35Å; E796-K800 IonicContact OE2-NZ 3.7Å; E796-K800 PolarHBondContact OE2-NZ 2.82Å
797	R	79.6	Confident	82.1	Confident	177 Å²	177	101.5 Å²	101.5	67%	0.668	50%	0.497	S	S	*	.	H	α-helix	trans	-65	-38.4	176.9	-79.4	176.8	-162.5	-172.3	5.3	111.8	R793 A795 H801	R793-R797 VanDerWaalsContact O-CB 3.3Å; R793-R797 WeakPolarHBondContact O-CB 3.47Å; R793-R797 WeakPolarHBondContact O-CG 3.27Å; R793-R797 PolarHBondContact O-N 3.26Å; A795-R797 PolarHBondContact O-N 3.23Å; R797-H801 WeakPolarHBondContact O-CB 3.49Å; R797-H801 PolarHBondContact O-N 3.49Å
798	R	84.1	Confident	81.8	Confident	170 Å²	170	101.9 Å²	101.9	64%	0.642	50%	0.496	S	S	*	.	H	α-helix	trans	-65.4	-50.6	173.9	-83.8	-176.9	-101.2	-159.5	-3.9	111.2	L794 A795 E796 K800 H801 E802	L794-R798 WeakPolarHBondContact O-CB 3.31Å; L794-R798 WeakPolarHBondContact O-CG 3.41Å; L794-R798 PolarHBondContact O-N 2.84Å; L794-R798 PolarHBondContact O-NE 3.11Å; A795-R798 CarbonylContact O-C 3.52Å; A795-R798 PolarHBondContact O-N 2.9Å; E796-R798 VanDerWaalsContact C-N 3.33Å; R798-K800 VanDerWaalsContact C-N 3.33Å; R798-K800 PolarHBondContact O-N 2.86Å; R798-H801 CarbonylContact O-C 3.59Å; R798-H801 PolarHBondContact O-N 3.16Å; R798-E802 WeakPolarHBondContact O-CB 3.36Å; R798-E802 PolarHBondContact O-N 2.95Å
799	A	82.1	Confident	81.6	Confident	53 Å²	53	99 Å²	99	44%	0.438	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-33.9	177.6	0	0	0	0	0	113	A795 E796 A803	A795-A799 VanDerWaalsContact O-CB 3.26Å; A795-A799 WeakPolarHBondContact O-CB 3.36Å; A795-A799 PolarHBondContact O-N 3.39Å; E796-A799 PolarHBondContact O-N 3.24Å; A799-A803 WeakPolarHBondContact O-CB 3.49Å; A799-A803 PolarHBondContact O-N 2.8Å
800	K	80.5	Confident	81.5	Confident	118 Å²	118	105.3 Å²	105.3	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-70.7	-45.2	172.3	-75.9	165.7	178.6	166.7	0	111.1	E796 R798 E802 A803 E804	E796-K800 WeakPolarHBondContact O-CB 3.46Å; E796-K800 WeakPolarHBondContact O-CD 3.31Å; E796-K800 WeakPolarHBondContact O-CG 3.5Å; E796-K800 PolarHBondContact O-N 3.35Å; E796-K800 IonicContact OE2-NZ 3.7Å; E796-K800 PolarHBondContact OE2-NZ 2.82Å; R798-K800 VanDerWaalsContact C-N 3.33Å; R798-K800 PolarHBondContact O-N 2.86Å; K800-E802 VanDerWaalsContact C-N 3.33Å; K800-E802 PolarHBondContact O-N 3.32Å; K800-A803 CarbonylContact O-C 3.57Å; K800-A803 PolarHBondContact O-N 2.89Å; K800-E804 VanDerWaalsContact O-CB 3.23Å; K800-E804 WeakPolarHBondContact O-CB 3.35Å; K800-E804 WeakPolarHBondContact O-CG 3.38Å; K800-E804 PolarHBondContact O-N 3.37Å
801	H	80	Confident	81.2	Confident	115 Å²	115	106.4 Å²	106.4	53%	0.532	52%	0.515	S	S	.	.	H	α-helix	trans	-67.7	-31.7	175.6	-174.7	-79.6	0	0	0	112.5	R797 R798 L805	R797-H801 WeakPolarHBondContact O-CB 3.49Å; R797-H801 PolarHBondContact O-N 3.49Å; R798-H801 CarbonylContact O-C 3.59Å; R798-H801 PolarHBondContact O-N 3.16Å; H801-L805 VanDerWaalsContact O-CB 3.26Å; H801-L805 WeakPolarHBondContact O-CB 3.35Å; H801-L805 VanDerWaalsContact O-CG 3.23Å; H801-L805 WeakPolarHBondContact O-CG 3.48Å; H801-L805 PolarHBondContact O-N 3.42Å
802	E	79.9	Confident	80.9	Confident	125 Å²	125	109.7 Å²	109.7	58%	0.584	52%	0.518	S	S	*	.	H	α-helix	trans	-77.2	-38.3	176	-172.3	163.4	-142.4	0	0	110.6	R798 K800 L805 E806	R798-E802 WeakPolarHBondContact O-CB 3.36Å; R798-E802 PolarHBondContact O-N 2.95Å; K800-E802 VanDerWaalsContact C-N 3.33Å; K800-E802 PolarHBondContact O-N 3.32Å; E802-L805 PolarHBondContact O-N 3.47Å; E802-E806 VanDerWaalsContact O-CB 3.28Å; E802-E806 WeakPolarHBondContact O-CB 3.36Å; E802-E806 PolarHBondContact O-N 3.48Å
803	A	80.6	Confident	80.7	Confident	57 Å²	57	107 Å²	107	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-70.5	-29.4	168.8	0	0	0	0	0	113	A799 K800 A807	A799-A803 WeakPolarHBondContact O-CB 3.49Å; A799-A803 PolarHBondContact O-N 2.8Å; K800-A803 CarbonylContact O-C 3.57Å; K800-A803 PolarHBondContact O-N 2.89Å; A803-A807 WeakPolarHBondContact O-CA 3.32Å; A803-A807 WeakPolarHBondContact O-CB 3.22Å; A803-A807 PolarHBondContact O-N 2.79Å
804	E	80.1	Confident	80.5	Confident	126 Å²	126	101.8 Å²	101.8	59%	0.589	50%	0.504	S	S	*	.	H	α-helix	trans	-73.4	-42.1	171.1	-79.7	172	162.8	0	0	110.5	K800 A807 E808	K800-E804 VanDerWaalsContact O-CB 3.23Å; K800-E804 WeakPolarHBondContact O-CB 3.35Å; K800-E804 WeakPolarHBondContact O-CG 3.38Å; K800-E804 PolarHBondContact O-N 3.37Å; E804-A807 PolarHBondContact O-N 3.48Å; E804-E808 VanDerWaalsContact O-CB 3.29Å; E804-E808 WeakPolarHBondContact O-CB 3.22Å; E804-E808 WeakPolarHBondContact O-CG 3.43Å; E804-E808 PolarHBondContact O-N 3Å
805	L	80.1	Confident	80.2	Confident	92 Å²	92	103.6 Å²	103.6	48%	0.482	51%	0.511	S	S	.	.	H	α-helix	trans	-65.1	-37.3	170.9	-79.1	177.2	0	0	0	112.1	H801 E802 A809	H801-L805 VanDerWaalsContact O-CB 3.26Å; H801-L805 WeakPolarHBondContact O-CB 3.35Å; H801-L805 VanDerWaalsContact O-CG 3.23Å; H801-L805 WeakPolarHBondContact O-CG 3.48Å; H801-L805 PolarHBondContact O-N 3.42Å; E802-L805 PolarHBondContact O-N 3.47Å; L805-A809 WeakPolarHBondContact O-CB 3.41Å; L805-A809 PolarHBondContact O-N 3.11Å
806	E	80.3	Confident	79.8	Confident	95 Å²	95	105.2 Å²	105.2	44%	0.444	51%	0.509	S	S	.	.	H	α-helix	trans	-70.6	-39.6	172.2	-90	-152.6	-139.3	0	0	111.7	E802 E808 A809 R810	E802-E806 VanDerWaalsContact O-CB 3.28Å; E802-E806 WeakPolarHBondContact O-CB 3.36Å; E802-E806 PolarHBondContact O-N 3.48Å; E806-E808 VanDerWaalsContact C-N 3.34Å; E806-A809 PolarHBondContact O-N 3.28Å; E806-R810 WeakPolarHBondContact O-CB 3.3Å; E806-R810 WeakPolarHBondContact O-CG 3.14Å; E806-R810 PolarHBondContact O-N 3.05Å; E806-R810 IonicContact OE2-CZ 3.86Å; E806-R810 VanDerWaalsContact OE2-CZ 3.3Å; E806-R810 IonicContact OE2-NE 3.2Å; E806-R810 PolarHBondContact OE2-NE 3.29Å; E806-R810 VanDerWaalsContact OE2-NE 3.15Å; E806-R810 IonicContact OE2-NH2 3.27Å; E806-R810 PolarHBondContact OE2-NH2 3.14Å
807	A	79.7	Confident	79.6	Confident	44 Å²	44	102.5 Å²	102.5	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-68.7	-35.8	175.8	0	0	0	0	0	111	A803 E804 R811	A803-A807 WeakPolarHBondContact O-CA 3.32Å; A803-A807 WeakPolarHBondContact O-CB 3.22Å; A803-A807 PolarHBondContact O-N 2.79Å; E804-A807 PolarHBondContact O-N 3.48Å; A807-R811 WeakPolarHBondContact O-CB 3.3Å; A807-R811 WeakPolarHBondContact O-CG 3.42Å; A807-R811 PolarHBondContact O-N 3.5Å
808	E	78.9	Confident	79.4	Confident	92 Å²	92	98.9 Å²	98.9	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-69.1	-42	168.8	-81.4	-159.5	-169.3	0	0	111.8	E804 E806 R811 R812	E804-E808 VanDerWaalsContact O-CB 3.29Å; E804-E808 WeakPolarHBondContact O-CB 3.22Å; E804-E808 WeakPolarHBondContact O-CG 3.43Å; E804-E808 PolarHBondContact O-N 3Å; E806-E808 VanDerWaalsContact C-N 3.34Å; E808-R811 CarbonylContact O-C 3.6Å; E808-R811 PolarHBondContact O-N 3.49Å; E808-R812 VanDerWaalsContact O-CB 3.27Å; E808-R812 WeakPolarHBondContact O-CB 3.4Å; E808-R812 WeakPolarHBondContact O-CG 3.33Å; E808-R812 PolarHBondContact O-N 3.43Å; E808-R812 IonicContact OE2-CZ 2.73Å; E808-R812 IonicContact OE2-NE 3.29Å; E808-R812 IonicContact OE2-NH2 2.81Å; E808-R812 PolarHBondContact OE2-NH2 3.45Å
809	A	81.1	Confident	78.9	Confident	56 Å²	56	95.9 Å²	95.9	46%	0.463	49%	0.491	S	S	.	.	H	α-helix	trans	-66.9	-37.7	177.4	0	0	0	0	0	111.3	L805 E806 A813	L805-A809 WeakPolarHBondContact O-CB 3.41Å; L805-A809 PolarHBondContact O-N 3.11Å; E806-A809 PolarHBondContact O-N 3.28Å; A809-A813 WeakPolarHBondContact O-CB 3.27Å; A809-A813 PolarHBondContact O-N 2.92Å
810	R	79.8	Confident	78.5	Confident	174 Å²	174	99.5 Å²	99.5	66%	0.657	49%	0.493	S	S	*	.	H	α-helix	trans	-71.2	-36.9	172	-68.8	171.4	-165.8	-149.3	9.5	111.5	E806 A814	E806-R810 WeakPolarHBondContact O-CB 3.3Å; E806-R810 WeakPolarHBondContact O-CG 3.14Å; E806-R810 PolarHBondContact O-N 3.05Å; E806-R810 IonicContact OE2-CZ 3.86Å; E806-R810 VanDerWaalsContact OE2-CZ 3.3Å; E806-R810 IonicContact OE2-NE 3.2Å; E806-R810 PolarHBondContact OE2-NE 3.29Å; E806-R810 VanDerWaalsContact OE2-NE 3.15Å; E806-R810 IonicContact OE2-NH2 3.27Å; E806-R810 PolarHBondContact OE2-NH2 3.14Å; R810-A814 WeakPolarHBondContact O-CB 3.33Å; R810-A814 PolarHBondContact O-N 3.35Å
811	R	79.2	Confident	78.1	Confident	176 Å²	176	99.2 Å²	99.2	66%	0.664	49%	0.494	S	S	*	.	H	α-helix	trans	-67.4	-44.7	172.9	-82.2	171.6	175.8	-175.8	0.2	111.7	A807 E808 A814 Q815	A807-R811 WeakPolarHBondContact O-CB 3.3Å; A807-R811 WeakPolarHBondContact O-CG 3.42Å; A807-R811 PolarHBondContact O-N 3.5Å; E808-R811 CarbonylContact O-C 3.6Å; E808-R811 PolarHBondContact O-N 3.49Å; R811-A814 PolarHBondContact O-N 3.07Å; R811-Q815 WeakPolarHBondContact O-CB 3.21Å; R811-Q815 WeakPolarHBondContact O-CG 3.28Å; R811-Q815 PolarHBondContact O-N 3.01Å; R811-Q815 PolarHBondContact O-OE1 2.98Å
812	R	79.1	Confident	77.8	Confident	136 Å²	136	97.7 Å²	97.7	51%	0.513	49%	0.487	S	S	.	.	H	α-helix	trans	-65.2	-44.3	173.8	-69.6	-179	-144.5	179.4	6.3	110.6	E808 A814 Q815 E816	E808-R812 VanDerWaalsContact O-CB 3.27Å; E808-R812 WeakPolarHBondContact O-CB 3.4Å; E808-R812 WeakPolarHBondContact O-CG 3.33Å; E808-R812 PolarHBondContact O-N 3.43Å; E808-R812 IonicContact OE2-CZ 2.73Å; E808-R812 IonicContact OE2-NE 3.29Å; E808-R812 IonicContact OE2-NH2 2.81Å; E808-R812 PolarHBondContact OE2-NH2 3.45Å; R812-A814 VanDerWaalsContact C-N 3.34Å; R812-A814 PolarHBondContact O-N 3.29Å; R812-Q815 CarbonylContact O-C 3.38Å; R812-Q815 PolarHBondContact O-N 2.98Å; R812-E816 VanDerWaalsContact O-CB 3.25Å; R812-E816 WeakPolarHBondContact O-CB 3.34Å; R812-E816 WeakPolarHBondContact O-CG 3.33Å; R812-E816 PolarHBondContact O-N 3.44Å
813	A	80	Confident	77.2	Confident	51 Å²	51	96.2 Å²	96.2	42%	0.421	48%	0.48	S	S	.	.	H	α-helix	trans	-66.1	-34.3	175.5	0	0	0	0	0	112.6	A809 A817	A809-A813 WeakPolarHBondContact O-CB 3.27Å; A809-A813 PolarHBondContact O-N 2.92Å; A813-A817 WeakPolarHBondContact O-CB 3.33Å; A813-A817 PolarHBondContact O-N 2.91Å
814	A	78.5	Confident	76.8	Confident	48 Å²	48	100 Å²	100	40%	0.397	49%	0.486	S	S	.	.	H	α-helix	trans	-74.3	-38.4	173.4	0	0	0	0	0	112.2	R810 R811 R812 A817 I818	R810-A814 WeakPolarHBondContact O-CB 3.33Å; R810-A814 PolarHBondContact O-N 3.35Å; R811-A814 PolarHBondContact O-N 3.07Å; R812-A814 VanDerWaalsContact C-N 3.34Å; R812-A814 PolarHBondContact O-N 3.29Å; A814-A817 PolarHBondContact O-N 3.43Å; A814-I818 WeakPolarHBondContact O-CB 3.41Å; A814-I818 WeakPolarHBondContact O-CD1 3.34Å; A814-I818 WeakPolarHBondContact O-CG1 3.49Å; A814-I818 PolarHBondContact O-N 3.45Å
815	Q	74.9	Confident	76.2	Confident	113 Å²	113	100 Å²	100	53%	0.528	48%	0.484	S	S	.	.	H	α-helix	trans	-65.9	-44.5	172.3	-78.1	173	-50.3	0	0	110.3	R811 R812 A817 I818 E819	R811-Q815 WeakPolarHBondContact O-CB 3.21Å; R811-Q815 WeakPolarHBondContact O-CG 3.28Å; R811-Q815 PolarHBondContact O-N 3.01Å; R811-Q815 PolarHBondContact O-OE1 2.98Å; R812-Q815 CarbonylContact O-C 3.38Å; R812-Q815 PolarHBondContact O-N 2.98Å; Q815-A817 VanDerWaalsContact C-N 3.3Å; Q815-A817 PolarHBondContact O-N 3.02Å; Q815-I818 CarbonylContact O-C 3.55Å; Q815-I818 PolarHBondContact O-N 3.26Å; Q815-E819 WeakPolarHBondContact O-CA 3.46Å; Q815-E819 WeakPolarHBondContact O-CB 3.42Å; Q815-E819 VanDerWaalsContact O-CG 3.25Å; Q815-E819 WeakPolarHBondContact O-CG 3.36Å; Q815-E819 PolarHBondContact O-N 3.2Å
816	E	76.1	Confident	75.7	Confident	86 Å²	86	103.4 Å²	103.4	40%	0.402	49%	0.49	S	S	.	.	H	α-helix	trans	-67.5	-25.9	171.3	-70.1	176.5	-166.1	0	0	112.5	R812 R820	R812-E816 VanDerWaalsContact O-CB 3.25Å; R812-E816 WeakPolarHBondContact O-CB 3.34Å; R812-E816 WeakPolarHBondContact O-CG 3.33Å; R812-E816 PolarHBondContact O-N 3.44Å; E816-R820 VanDerWaalsContact CB-NH1 3.25Å; E816-R820 WeakPolarHBondContact O-CA 3.28Å; E816-R820 WeakPolarHBondContact O-CB 3.28Å; E816-R820 WeakPolarHBondContact O-CD 3.49Å; E816-R820 WeakPolarHBondContact O-CG 3.47Å; E816-R820 PolarHBondContact O-N 3.32Å; E816-R820 IonicContact OE2-CZ 2.66Å; E816-R820 IonicContact OE2-NH1 3.58Å; E816-R820 PolarHBondContact OE2-NH1 2.87Å; E816-R820 IonicContact OE2-NH2 3.67Å; E816-R820 PolarHBondContact OE2-NH2 2.9Å
817	A	77	Confident	75.1	Confident	49 Å²	49	104.4 Å²	104.4	41%	0.405	50%	0.495	S	S	.	.	H	α-helix	trans	-75.7	-43.4	173.4	0	0	0	0	0	110.8	A813 A814 Q815 R820 E821	A813-A817 WeakPolarHBondContact O-CB 3.33Å; A813-A817 PolarHBondContact O-N 2.91Å; A814-A817 PolarHBondContact O-N 3.43Å; Q815-A817 VanDerWaalsContact C-N 3.3Å; Q815-A817 PolarHBondContact O-N 3.02Å; A817-R820 PolarHBondContact O-N 2.98Å; A817-E821 WeakPolarHBondContact O-CB 3.3Å; A817-E821 PolarHBondContact O-N 2.91Å
818	I	75.3	Confident	74.6	Confident	100 Å²	100	108 Å²	108	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-64.9	-41.3	172.4	-68.6	163.5	0	0	0	110	A814 Q815 E821 E822	A814-I818 WeakPolarHBondContact O-CB 3.41Å; A814-I818 WeakPolarHBondContact O-CD1 3.34Å; A814-I818 WeakPolarHBondContact O-CG1 3.49Å; A814-I818 PolarHBondContact O-N 3.45Å; Q815-I818 CarbonylContact O-C 3.55Å; Q815-I818 PolarHBondContact O-N 3.26Å; I818-E821 CarbonylContact O-C 3.58Å; I818-E821 PolarHBondContact O-N 3Å; I818-E822 HydrophobicContact CG2-CG 4.49Å; I818-E822 WeakPolarHBondContact O-CA 3.41Å; I818-E822 VanDerWaalsContact O-CB 3.23Å; I818-E822 WeakPolarHBondContact O-CB 3.19Å; I818-E822 WeakPolarHBondContact O-CG 3.37Å; I818-E822 PolarHBondContact O-N 2.99Å
819	E	72.8	Confident	74.2	Confident	107 Å²	107	106.2 Å²	106.2	50%	0.5	51%	0.509	S	S	.	.	H	α-helix	trans	-72.7	-30.6	175.2	-76.7	-178.1	-170.8	0	0	112	Q815 Q823	Q815-E819 WeakPolarHBondContact O-CA 3.46Å; Q815-E819 WeakPolarHBondContact O-CB 3.42Å; Q815-E819 VanDerWaalsContact O-CG 3.25Å; Q815-E819 WeakPolarHBondContact O-CG 3.36Å; Q815-E819 PolarHBondContact O-N 3.2Å; E819-Q823 WeakPolarHBondContact O-CA 3.41Å; E819-Q823 WeakPolarHBondContact O-CB 3.35Å; E819-Q823 WeakPolarHBondContact O-CG 3.41Å; E819-Q823 PolarHBondContact O-N 2.66Å
820	R	74.6	Confident	73.5	Confident	129 Å²	129	105.3 Å²	105.3	49%	0.487	50%	0.501	S	S	.	.	H	α-helix	trans	-74	-32.9	169.2	-77.8	168.7	-168.4	117.2	5.9	111.9	E816 A817 K824	E816-R820 VanDerWaalsContact CB-NH1 3.25Å; E816-R820 WeakPolarHBondContact O-CA 3.28Å; E816-R820 WeakPolarHBondContact O-CB 3.28Å; E816-R820 WeakPolarHBondContact O-CD 3.49Å; E816-R820 WeakPolarHBondContact O-CG 3.47Å; E816-R820 PolarHBondContact O-N 3.32Å; E816-R820 IonicContact OE2-CZ 2.66Å; E816-R820 IonicContact OE2-NH1 3.58Å; E816-R820 PolarHBondContact OE2-NH1 2.87Å; E816-R820 IonicContact OE2-NH2 3.67Å; E816-R820 PolarHBondContact OE2-NH2 2.9Å; A817-R820 PolarHBondContact O-N 2.98Å; R820-K824 VanDerWaalsContact O-CB 3.22Å; R820-K824 WeakPolarHBondContact O-CB 3.19Å; R820-K824 WeakPolarHBondContact O-CD 3.2Å; R820-K824 WeakPolarHBondContact O-CG 3.44Å; R820-K824 PolarHBondContact O-N 3.01Å
821	E	73.2	Confident	72.9	Confident	113 Å²	113	102.5 Å²	102.5	53%	0.528	50%	0.495	S	S	.	.	H	α-helix	trans	-71.2	-42.3	171.1	-87.2	-155.9	-159.8	0	0	111.5	A817 I818 K824 K825	A817-E821 WeakPolarHBondContact O-CB 3.3Å; A817-E821 PolarHBondContact O-N 2.91Å; I818-E821 CarbonylContact O-C 3.58Å; I818-E821 PolarHBondContact O-N 3Å; E821-K824 PolarHBondContact O-N 2.8Å; E821-K825 WeakPolarHBondContact O-CB 3.29Å; E821-K825 VanDerWaalsContact O-CD 3.31Å; E821-K825 WeakPolarHBondContact O-CD 3.41Å; E821-K825 WeakPolarHBondContact O-CG 3.47Å; E821-K825 PolarHBondContact O-N 2.66Å; E821-K825 IonicContact OE2-NZ 3.95Å; E821-K825 PolarHBondContact OE2-NZ 2.77Å
822	E	72.5	Confident	72.3	Confident	82 Å²	82	96.5 Å²	96.5	38%	0.383	48%	0.484	S	S	.	.	H	α-helix	trans	-70.3	-37.3	174.8	-81.7	-159.9	-140.5	0	0	111.4	I818 K825 R826	I818-E822 HydrophobicContact CG2-CG 4.49Å; I818-E822 WeakPolarHBondContact O-CA 3.41Å; I818-E822 VanDerWaalsContact O-CB 3.23Å; I818-E822 WeakPolarHBondContact O-CB 3.19Å; I818-E822 WeakPolarHBondContact O-CG 3.37Å; I818-E822 PolarHBondContact O-N 2.99Å; E822-K825 PolarHBondContact O-N 2.7Å; E822-R826 WeakPolarHBondContact O-CA 3.41Å; E822-R826 WeakPolarHBondContact O-CB 3.27Å; E822-R826 WeakPolarHBondContact O-CD 3.5Å; E822-R826 WeakPolarHBondContact O-CG 3.32Å; E822-R826 PolarHBondContact O-N 3.26Å; E822-R826 IonicContact OE2-CZ 3.89Å; E822-R826 IonicContact OE2-NE 3.05Å; E822-R826 PolarHBondContact OE2-NE 2.94Å; E822-R826 IonicContact OE2-NH2 3.5Å; E822-R826 PolarHBondContact OE2-NH2 3.46Å
823	Q	68.3	Low	71.6	Confident	95 Å²	95	94.1 Å²	94.1	44%	0.444	48%	0.478	S	S	.	.	H	α-helix	trans	-65.2	-47.6	171.1	-76.5	163.7	15.9	0	0	109.2	E819 K825 R826 E827	E819-Q823 WeakPolarHBondContact O-CA 3.41Å; E819-Q823 WeakPolarHBondContact O-CB 3.35Å; E819-Q823 WeakPolarHBondContact O-CG 3.41Å; E819-Q823 PolarHBondContact O-N 2.66Å; Q823-K825 VanDerWaalsContact C-N 3.34Å; Q823-K825 PolarHBondContact O-N 2.84Å; Q823-R826 CarbonylContact O-C 3.4Å; Q823-R826 PolarHBondContact O-N 3.48Å; Q823-R826 VanDerWaalsContact O-N 3.17Å; Q823-E827 WeakPolarHBondContact O-CA 3.4Å; Q823-E827 WeakPolarHBondContact O-CB 3.48Å; Q823-E827 WeakPolarHBondContact O-CG 3.49Å; Q823-E827 PolarHBondContact O-N 3.1Å
824	K	71.4	Confident	70.9	Confident	135 Å²	135	100.2 Å²	100.2	59%	0.587	49%	0.49	S	S	*	.	H	α-helix	trans	-60.6	-38.9	173.7	-75.5	171.7	-179.4	-177.8	0	113.2	R820 E821 L828	R820-K824 VanDerWaalsContact O-CB 3.22Å; R820-K824 WeakPolarHBondContact O-CB 3.19Å; R820-K824 WeakPolarHBondContact O-CD 3.2Å; R820-K824 WeakPolarHBondContact O-CG 3.44Å; R820-K824 PolarHBondContact O-N 3.01Å; E821-K824 PolarHBondContact O-N 2.8Å; K824-L828 VanDerWaalsContact O-CB 3.26Å; K824-L828 WeakPolarHBondContact O-CB 3.4Å; K824-L828 WeakPolarHBondContact O-CD1 3.37Å; K824-L828 WeakPolarHBondContact O-CG 3.49Å; K824-L828 PolarHBondContact O-N 2.85Å
825	K	68.2	Low	70.2	Confident	126 Å²	126	103.9 Å²	103.9	55%	0.548	50%	0.499	S	S	.	.	H	α-helix	trans	-69.8	-37.4	175.5	-74.8	160.3	-179.7	160.9	0	111.6	E821 E822 Q823 A829	E821-K825 WeakPolarHBondContact O-CB 3.29Å; E821-K825 VanDerWaalsContact O-CD 3.31Å; E821-K825 WeakPolarHBondContact O-CD 3.41Å; E821-K825 WeakPolarHBondContact O-CG 3.47Å; E821-K825 PolarHBondContact O-N 2.66Å; E821-K825 IonicContact OE2-NZ 3.95Å; E821-K825 PolarHBondContact OE2-NZ 2.77Å; E822-K825 PolarHBondContact O-N 2.7Å; Q823-K825 VanDerWaalsContact C-N 3.34Å; Q823-K825 PolarHBondContact O-N 2.84Å; K825-A829 WeakPolarHBondContact O-CB 3.42Å; K825-A829 PolarHBondContact O-N 3.5Å
826	R	68.4	Low	69.7	Low	164 Å²	164	104.7 Å²	104.7	62%	0.619	50%	0.501	S	S	*	.	H	α-helix	trans	-76.8	-25.2	174.7	-70.3	167.1	-168.6	-152.2	9.8	112.4	E822 Q823 A830	E822-R826 WeakPolarHBondContact O-CA 3.41Å; E822-R826 WeakPolarHBondContact O-CB 3.27Å; E822-R826 WeakPolarHBondContact O-CD 3.5Å; E822-R826 WeakPolarHBondContact O-CG 3.32Å; E822-R826 PolarHBondContact O-N 3.26Å; E822-R826 IonicContact OE2-CZ 3.89Å; E822-R826 IonicContact OE2-NE 3.05Å; E822-R826 PolarHBondContact OE2-NE 2.94Å; E822-R826 IonicContact OE2-NH2 3.5Å; E822-R826 PolarHBondContact OE2-NH2 3.46Å; Q823-R826 CarbonylContact O-C 3.4Å; Q823-R826 PolarHBondContact O-N 3.48Å; Q823-R826 VanDerWaalsContact O-N 3.17Å; R826-A830 WeakPolarHBondContact O-CA 3.32Å; R826-A830 WeakPolarHBondContact O-CB 3.5Å; R826-A830 PolarHBondContact O-N 3.4Å
827	E	69.1	Low	69.1	Low	116 Å²	116	107.3 Å²	107.3	54%	0.542	51%	0.507	S	S	.	.	H	α-helix	trans	-80.5	-49.3	174.9	-77.8	173.7	152	0	0	108.8	Q823 A829 A830 E831	Q823-E827 WeakPolarHBondContact O-CA 3.4Å; Q823-E827 WeakPolarHBondContact O-CB 3.48Å; Q823-E827 WeakPolarHBondContact O-CG 3.49Å; Q823-E827 PolarHBondContact O-N 3.1Å; E827-A829 VanDerWaalsContact C-N 3.27Å; E827-A829 PolarHBondContact O-N 3.1Å; E827-A830 CarbonylContact O-C 3.32Å; E827-A830 PolarHBondContact O-N 3.31Å; E827-A830 VanDerWaalsContact O-N 3.09Å; E827-E831 WeakPolarHBondContact O-CB 3.39Å; E827-E831 WeakPolarHBondContact O-CG 3.32Å; E827-E831 PolarHBondContact O-N 3.13Å
828	L	68.4	Low	68.5	Low	119 Å²	119	111.2 Å²	111.2	62%	0.623	52%	0.517	S	S	*	.	H	α-helix	trans	-59.4	-39.1	169.8	-69.1	168.6	0	0	0	111.6	K824 A832	K824-L828 VanDerWaalsContact O-CB 3.26Å; K824-L828 WeakPolarHBondContact O-CB 3.4Å; K824-L828 WeakPolarHBondContact O-CD1 3.37Å; K824-L828 WeakPolarHBondContact O-CG 3.49Å; K824-L828 PolarHBondContact O-N 2.85Å; L828-A832 WeakPolarHBondContact O-CB 3.34Å; L828-A832 PolarHBondContact O-N 3.08Å
829	A	70	Confident	67.7	Low	56 Å²	56	112.8 Å²	112.8	46%	0.463	52%	0.522	S	S	.	.	H	α-helix	trans	-70.5	-36.9	172.4	0	0	0	0	0	112.7	K825 E827 A832 E833	K825-A829 WeakPolarHBondContact O-CB 3.42Å; K825-A829 PolarHBondContact O-N 3.5Å; E827-A829 VanDerWaalsContact C-N 3.27Å; E827-A829 PolarHBondContact O-N 3.1Å; A829-A832 CarbonylContact O-C 3.53Å; A829-E833 WeakPolarHBondContact O-CA 3.5Å; A829-E833 WeakPolarHBondContact O-CB 3.42Å; A829-E833 PolarHBondContact O-N 3.14Å
830	A	67	Low	67.2	Low	36 Å²	36	113 Å²	113	30%	0.298	52%	0.524	S	S	.	.	H	α-helix	trans	-82.9	-13.4	178.2	0	0	0	0	0	113.6	R826 E827 R834	R826-A830 WeakPolarHBondContact O-CA 3.32Å; R826-A830 WeakPolarHBondContact O-CB 3.5Å; R826-A830 PolarHBondContact O-N 3.4Å; E827-A830 CarbonylContact O-C 3.32Å; E827-A830 PolarHBondContact O-N 3.31Å; E827-A830 VanDerWaalsContact O-N 3.09Å; A830-R834 WeakPolarHBondContact O-CA 3.4Å; A830-R834 WeakPolarHBondContact O-CB 3.22Å; A830-R834 WeakPolarHBondContact O-CD 3.25Å; A830-R834 WeakPolarHBondContact O-CG 3.18Å; A830-R834 PolarHBondContact O-N 2.9Å
831	E	66.3	Low	66.7	Low	115 Å²	115	109.6 Å²	109.6	54%	0.537	52%	0.523	S	S	.	.	H	α-helix	trans	-80.7	-43.7	165.6	-75.5	-174.7	145.1	0	0	109.2	E827 E833 R834 Q835	E827-E831 WeakPolarHBondContact O-CB 3.39Å; E827-E831 WeakPolarHBondContact O-CG 3.32Å; E827-E831 PolarHBondContact O-N 3.13Å; E831-E833 VanDerWaalsContact C-N 3.3Å; E831-E833 PolarHBondContact O-N 3.22Å; E831-R834 PolarHBondContact O-N 3.01Å; E831-Q835 WeakPolarHBondContact O-CB 3.4Å; E831-Q835 VanDerWaalsContact O-CG 3.23Å; E831-Q835 WeakPolarHBondContact O-CG 3.43Å; E831-Q835 PolarHBondContact O-N 3.39Å
832	A	67.8	Low	66.1	Low	51 Å²	51	111.5 Å²	111.5	42%	0.421	53%	0.529	S	S	.	.	H	α-helix	trans	-61.5	-38.2	167.9	0	0	0	0	0	112.1	L828 A829 K836	L828-A832 WeakPolarHBondContact O-CB 3.34Å; L828-A832 PolarHBondContact O-N 3.08Å; A829-A832 CarbonylContact O-C 3.53Å; A832-K836 WeakPolarHBondContact O-CG 3.37Å; A832-K836 PolarHBondContact O-N 3.17Å
833	E	63.3	Low	65.4	Low	85 Å²	85	112.6 Å²	112.6	40%	0.397	53%	0.534	S	S	.	.	H	α-helix	trans	-78.5	-29.7	176.3	-157.3	-168	176.9	0	0	112	A829 E831 K836 R837	A829-E833 WeakPolarHBondContact O-CA 3.5Å; A829-E833 WeakPolarHBondContact O-CB 3.42Å; A829-E833 PolarHBondContact O-N 3.14Å; E831-E833 VanDerWaalsContact C-N 3.3Å; E831-E833 PolarHBondContact O-N 3.22Å; E833-K836 PolarHBondContact O-N 2.92Å; E833-R837 HydrophobicContact CG-CG 4.31Å; E833-R837 WeakPolarHBondContact O-CB 3.39Å; E833-R837 VanDerWaalsContact O-CG 3.24Å; E833-R837 WeakPolarHBondContact O-CG 3.47Å; E833-R837 PolarHBondContact O-N 2.97Å; E833-R837 IonicContact OE1-CZ 2.94Å; E833-R837 IonicContact OE1-NE 2.76Å; E833-R837 PolarHBondContact OE1-NE 2.86Å; E833-R837 IonicContact OE1-NH2 3.16Å; E833-R837 PolarHBondContact OE1-NH2 3.48Å; E833-R837 IonicContact OE2-CZ 3.88Å; E833-R837 IonicContact OE2-NE 2.72Å; E833-R837 IonicContact OE2-NH2 3.82Å; E833-R837 PolarHBondContact OE2-NH2 3.12Å
834	R	66	Low	65	Low	179 Å²	179	110.2 Å²	110.2	68%	0.675	53%	0.531	S	S	*	.	H	α-helix	trans	-68.7	-40.7	168.6	-83.7	168.5	-178.4	-160.2	2.2	111.1	A830 E831 K836 R837 E838	A830-R834 WeakPolarHBondContact O-CA 3.4Å; A830-R834 WeakPolarHBondContact O-CB 3.22Å; A830-R834 WeakPolarHBondContact O-CD 3.25Å; A830-R834 WeakPolarHBondContact O-CG 3.18Å; A830-R834 PolarHBondContact O-N 2.9Å; E831-R834 PolarHBondContact O-N 3.01Å; R834-K836 VanDerWaalsContact C-N 3.28Å; R834-K836 PolarHBondContact O-N 3.03Å; R834-R837 CarbonylContact O-C 3.43Å; R834-R837 PolarHBondContact O-N 3.33Å; R834-E838 WeakPolarHBondContact O-CB 3.24Å; R834-E838 WeakPolarHBondContact O-CG 3.27Å; R834-E838 PolarHBondContact O-N 2.98Å
835	Q	63.2	Low	64.6	Low	126 Å²	126	106.7 Å²	106.7	59%	0.589	53%	0.527	S	S	*	.	H	α-helix	trans	-61.8	-37.1	173.9	-73.1	171.9	18.2	0	0	111.5	E831 Q839	E831-Q835 WeakPolarHBondContact O-CB 3.4Å; E831-Q835 VanDerWaalsContact O-CG 3.23Å; E831-Q835 WeakPolarHBondContact O-CG 3.43Å; E831-Q835 PolarHBondContact O-N 3.39Å; Q835-Q839 VanDerWaalsContact O-CG 3.28Å; Q835-Q839 WeakPolarHBondContact O-CG 3.41Å; Q835-Q839 PolarHBondContact O-N 2.56Å
836	K	65.4	Low	64	Low	130 Å²	130	108.6 Å²	108.6	57%	0.565	54%	0.538	S	S	*	.	H	α-helix	trans	-68.2	-49.5	168.3	-75.7	-173.7	173.6	-169.4	0	112.9	A832 E833 R834 E838 Q839 E840	A832-K836 WeakPolarHBondContact O-CG 3.37Å; A832-K836 PolarHBondContact O-N 3.17Å; E833-K836 PolarHBondContact O-N 2.92Å; R834-K836 VanDerWaalsContact C-N 3.28Å; R834-K836 PolarHBondContact O-N 3.03Å; K836-E838 VanDerWaalsContact C-N 3.27Å; K836-E838 PolarHBondContact O-N 2.91Å; K836-Q839 CarbonylContact O-C 3.6Å; K836-Q839 WeakPolarHBondContact O-CA 3.29Å; K836-Q839 WeakPolarHBondContact O-CB 3.4Å; K836-Q839 PolarHBondContact O-N 2.94Å; K836-E840 WeakPolarHBondContact O-CG 3.22Å; K836-E840 PolarHBondContact O-N 3.12Å
837	R	62.7	Low	63.4	Low	141 Å²	141	108.1 Å²	108.1	53%	0.532	54%	0.536	S	S	.	.	H	α-helix	trans	-68.1	-21.1	-178.3	-73.1	-177.6	-167.2	-173.4	9.7	113.2	E833 R834 A841	E833-R837 HydrophobicContact CG-CG 4.31Å; E833-R837 WeakPolarHBondContact O-CB 3.39Å; E833-R837 VanDerWaalsContact O-CG 3.24Å; E833-R837 WeakPolarHBondContact O-CG 3.47Å; E833-R837 PolarHBondContact O-N 2.97Å; E833-R837 IonicContact OE1-CZ 2.94Å; E833-R837 IonicContact OE1-NE 2.76Å; E833-R837 PolarHBondContact OE1-NE 2.86Å; E833-R837 IonicContact OE1-NH2 3.16Å; E833-R837 PolarHBondContact OE1-NH2 3.48Å; E833-R837 IonicContact OE2-CZ 3.88Å; E833-R837 IonicContact OE2-NE 2.72Å; E833-R837 IonicContact OE2-NH2 3.82Å; E833-R837 PolarHBondContact OE2-NH2 3.12Å; R834-R837 CarbonylContact O-C 3.43Å; R834-R837 PolarHBondContact O-N 3.33Å; R837-A841 WeakPolarHBondContact O-CA 3.25Å; R837-A841 WeakPolarHBondContact O-CB 3.28Å; R837-A841 PolarHBondContact O-N 3.33Å
838	E	64.4	Low	62.7	Low	130 Å²	130	106.5 Å²	106.5	61%	0.607	53%	0.529	S	S	*	.	H	α-helix	trans	-80.6	-21.2	169.2	-77.2	-165.9	123.5	0	0	112.9	R834 K836 K842	R834-E838 WeakPolarHBondContact O-CB 3.24Å; R834-E838 WeakPolarHBondContact O-CG 3.27Å; R834-E838 PolarHBondContact O-N 2.98Å; K836-E838 VanDerWaalsContact C-N 3.27Å; K836-E838 PolarHBondContact O-N 2.91Å; E838-K842 WeakPolarHBondContact O-CD 3.48Å; E838-K842 WeakPolarHBondContact O-CG 3.34Å
839	Q	59	Low	62.3	Low	133 Å²	133	106.3 Å²	106.3	62%	0.621	53%	0.532	S	S	*	.	H	α-helix	trans	-77.3	-49.9	166.7	-66.2	165.1	3.8	0	0	109.1	Q835 K836 A841 K842 E843	Q835-Q839 VanDerWaalsContact O-CG 3.28Å; Q835-Q839 WeakPolarHBondContact O-CG 3.41Å; Q835-Q839 PolarHBondContact O-N 2.56Å; K836-Q839 CarbonylContact O-C 3.6Å; K836-Q839 WeakPolarHBondContact O-CA 3.29Å; K836-Q839 WeakPolarHBondContact O-CB 3.4Å; K836-Q839 PolarHBondContact O-N 2.94Å; Q839-A841 PolarHBondContact O-N 3.48Å; Q839-K842 PolarHBondContact O-N 3.48Å; Q839-E843 PolarHBondContact O-N 3.18Å
840	E	61.8	Low	61.6	Low	113 Å²	113	107.1 Å²	107.1	53%	0.528	54%	0.539	S	S	.	.	H	α-helix	trans	-64.7	-35.5	176.8	-65.2	169.3	168.1	0	0	112.9	K836 K842 E843 A844	K836-E840 WeakPolarHBondContact O-CG 3.22Å; K836-E840 PolarHBondContact O-N 3.12Å; E840-K842 PolarHBondContact O-N 2.85Å; E840-E843 CarbonylContact O-C 3.6Å; E840-E843 PolarHBondContact O-N 3.5Å; E840-A844 WeakPolarHBondContact O-CB 3.41Å; E840-A844 PolarHBondContact O-N 3.06Å
841	A	63.9	Low	61	Low	57 Å²	57	110.8 Å²	110.8	47%	0.471	55%	0.545	S	S	.	.	H	α-helix	trans	-67.1	-24	177.3	0	0	0	0	0	112.8	R837 Q839 A845	R837-A841 WeakPolarHBondContact O-CA 3.25Å; R837-A841 WeakPolarHBondContact O-CB 3.28Å; R837-A841 PolarHBondContact O-N 3.33Å; Q839-A841 PolarHBondContact O-N 3.48Å; A841-A845 WeakPolarHBondContact O-CB 3.43Å; A841-A845 PolarHBondContact O-N 3.4Å
842	K	61	Low	60.4	Low	153 Å²	153	111.1 Å²	111.1	67%	0.665	55%	0.55	S	S	*	.	H	α-helix	trans	-74.3	-45.5	171.7	-70.6	168.5	-174.8	166.6	0	110.3	E838 Q839 E840 A844	E838-K842 WeakPolarHBondContact O-CD 3.48Å; E838-K842 WeakPolarHBondContact O-CG 3.34Å; Q839-K842 PolarHBondContact O-N 3.48Å; E840-K842 PolarHBondContact O-N 2.85Å; K842-A844 VanDerWaalsContact C-N 3.32Å; K842-A844 PolarHBondContact O-N 3.26Å
843	E	58.6	Low	59.7	Low	104 Å²	104	117 Å²	117	49%	0.486	57%	0.568	S	S	.	*	H	α-helix	trans	-66.3	-28.1	173.2	-69.7	-164.1	-167.3	0	0	114.4	Q839 E840 R847	Q839-E843 PolarHBondContact O-N 3.18Å; E840-E843 CarbonylContact O-C 3.6Å; E840-E843 PolarHBondContact O-N 3.5Å; E843-R847 WeakPolarHBondContact O-CG 3.43Å; E843-R847 PolarHBondContact O-NE 3.1Å; E843-R847 IonicContact OE2-CZ 3.6Å; E843-R847 IonicContact OE2-NH1 3.87Å; E843-R847 IonicContact OE2-NH2 2.69Å; E843-R847 PolarHBondContact OE2-NH2 3.03Å
844	A	58.7	Low	59	Low	45 Å²	45	120.7 Å²	120.7	37%	0.372	59%	0.586	S	S	.	*	H	α-helix	trans	-87.6	-30.6	-178.2	0	0	0	0	0	112.6	E840 K842 E846 R847 E848	E840-A844 WeakPolarHBondContact O-CB 3.41Å; E840-A844 PolarHBondContact O-N 3.06Å; K842-A844 VanDerWaalsContact C-N 3.32Å; K842-A844 PolarHBondContact O-N 3.26Å; A844-E846 PolarHBondContact O-N 2.91Å; A844-R847 PolarHBondContact O-N 2.94Å; A844-E848 PolarHBondContact O-N 3.33Å
845	A	62.8	Low	58.1	Low	62 Å²	62	118.1 Å²	118.1	51%	0.512	58%	0.581	S	S	.	*	H	α-helix	trans	-60.9	-32	170.8	0	0	0	0	0	111.9	A841 R847 V849	A841-A845 WeakPolarHBondContact O-CB 3.43Å; A841-A845 PolarHBondContact O-N 3.4Å; A845-R847 PolarHBondContact O-N 3.44Å; A845-V849 WeakPolarHBondContact O-CG2 3.49Å
846	E	55.2	Low	57.5	Low	165 Å²	165	115.8 Å²	115.8	77%	0.771	58%	0.579	S	S	*	*	H	α-helix	trans	-71.6	-14.1	172.7	-66.3	-177.3	150.2	0	0	113.8	A844	A844-E846 PolarHBondContact O-N 2.91Å
847	R	56.8	Low	56.4	Low	154 Å²	154	118.4 Å²	118.4	58%	0.581	59%	0.59	S	S	*	*	H	α-helix	trans	-105	-45.1	-176	-64.6	173.1	-168.1	138.8	9.9	113.1	E843 A844 A845 V849 A850	E843-R847 WeakPolarHBondContact O-CG 3.43Å; E843-R847 PolarHBondContact O-NE 3.1Å; E843-R847 IonicContact OE2-CZ 3.6Å; E843-R847 IonicContact OE2-NH1 3.87Å; E843-R847 IonicContact OE2-NH2 2.69Å; E843-R847 PolarHBondContact OE2-NH2 3.03Å; A844-R847 PolarHBondContact O-N 2.94Å; A845-R847 PolarHBondContact O-N 3.44Å; R847-V849 PolarHBondContact O-N 3.17Å; R847-A850 WeakPolarHBondContact O-CB 3.44Å; R847-A850 PolarHBondContact O-N 3.31Å
848	E	54	Low	55.1	Low	83 Å²	83	117.6 Å²	117.6	39%	0.388	61%	0.606	S	S	.	*	H	α-helix	trans	-80.3	-18	-170	-165.2	66.9	177.6	0	0	113.9	A844 A850 R851 L852	A844-E848 PolarHBondContact O-N 3.33Å; E848-A850 PolarHBondContact O-N 3.13Å; E848-R851 PolarHBondContact O-N 3.4Å; E848-R851 IonicContact OE1-CZ 3.44Å; E848-R851 IonicContact OE1-NE 3.94Å; E848-R851 IonicContact OE1-NH1 3.72Å; E848-R851 PolarHBondContact OE1-NH1 2.85Å; E848-R851 IonicContact OE2-NH1 2.65Å; E848-L852 PolarHBondContact O-N 3.12Å
849	V	59.9	Low	53.7	Low	115 Å²	115	121 Å²	121	70%	0.697	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	-30.2	167.1	171.9	0	0	0	0	111.1	A845 R847	A845-V849 WeakPolarHBondContact O-CG2 3.49Å; R847-V849 PolarHBondContact O-N 3.17Å
850	A	56.1	Low	52.6	Low	72 Å²	72	120 Å²	120	60%	0.595	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	0.2	177.3	0	0	0	0	0	114.8	R847 E848	R847-A850 WeakPolarHBondContact O-CB 3.44Å; R847-A850 PolarHBondContact O-N 3.31Å; E848-A850 PolarHBondContact O-N 3.13Å
851	R	54.6	Low	51.4	Low	113 Å²	113	125 Å²	125	43%	0.426	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.1	-34	178.4	-118.1	-165.6	77.3	-138.5	3.5	114.3	E848 E853 E854 E855	E848-R851 PolarHBondContact O-N 3.4Å; E848-R851 IonicContact OE1-CZ 3.44Å; E848-R851 IonicContact OE1-NE 3.94Å; E848-R851 IonicContact OE1-NH1 3.72Å; E848-R851 PolarHBondContact OE1-NH1 2.85Å; E848-R851 IonicContact OE2-NH1 2.65Å; R851-E853 PolarHBondContact O-N 3.25Å; R851-E854 PolarHBondContact O-N 3.4Å; R851-E854 VanDerWaalsContact O-N 3.14Å; R851-E855 IonicContact CZ-OE2 3.46Å; R851-E855 IonicContact NE-OE2 3.38Å; R851-E855 IonicContact NH2-OE2 2.79Å; R851-E855 PolarHBondContact NH2-OE2 3.03Å
852	L	54.2	Low	50.2	Low	123 Å²	123	126.5 Å²	126.5	64%	0.644	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-3.8	-177.9	-81.2	170	0	0	0	114.7	E848	E848-L852 PolarHBondContact O-N 3.12Å
853	E	52.8	Low	49.3	Very low	173 Å²	173	125.6 Å²	125.6	81%	0.808	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-27.1	165.4	-64.8	-162.2	122.9	0	0	112.8	R851	R851-E853 PolarHBondContact O-N 3.25Å
854	E	48	Very low	48.6	Very low	163 Å²	163	126.4 Å²	126.4	76%	0.762	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-45.3	-173.7	-64.3	-165.6	120.7	0	0	114.1	R851	R851-E854 PolarHBondContact O-N 3.4Å; R851-E854 VanDerWaalsContact O-N 3.14Å
855	E	47.5	Very low	47.9	Very low	125 Å²	125	132.1 Å²	132.1	58%	0.584	68%	0.677	S	S	*	*	S	Bend	trans	-96.6	3.4	-165	-61.1	-171.4	106.8	0	0	115	R851 K857	R851-E855 IonicContact CZ-OE2 3.46Å; R851-E855 IonicContact NE-OE2 3.38Å; R851-E855 IonicContact NH2-OE2 2.79Å; R851-E855 PolarHBondContact NH2-OE2 3.03Å; E855-K857 PolarHBondContact O-N 3.3Å; E855-K857 VanDerWaalsContact O-N 3.15Å
856	S	50.8	Low	46.8	Very low	77 Å²	77	138.8 Å²	138.8	54%	0.538	69%	0.694	S	S	.	*			trans	-78.9	95.8	-179.5	-175.7	0	0	0	0	112.9
857	K	41.2	Very low	46.2	Very low	185 Å²	185	137.2 Å²	137.2	80%	0.804	70%	0.695	S	S	*	*			trans	-179.3	-22.7	139.8	-95.5	139.9	-149.4	147	0	118	E855 W859	E855-K857 PolarHBondContact O-N 3.3Å; E855-K857 VanDerWaalsContact O-N 3.15Å; K857-W859 PolarHBondContact O-N 3.37Å
858	S	36.6	Very low	45.7	Very low	124 Å²	124	136.7 Å²	136.7	87%	0.867	71%	0.709	S	S	*	*			trans	-76.8	90.1	-166.3	46.3	0	0	0	0	115.3
859	W	35	Very low	44.9	Very low	203 Å²	203	141 Å²	141	77%	0.769	73%	0.732	S	S	*	*			trans	-86.7	172.3	176.1	-95.7	69.8	0	0	0	115.1	K857	K857-W859 PolarHBondContact O-N 3.37Å
860	T	34.2	Very low	44.1	Very low	111 Å²	111	142 Å²	142	68%	0.681	74%	0.739	S	S	*	*			trans	89.1	152.5	152.5	70.4	0	0	0	0	122
861	R	37.8	Very low	42.9	Very low	219 Å²	219	144 Å²	144	83%	0.826	75%	0.748	S	S	*	*			cis	-175.2	168	-24.4	-101	169	-168.6	177.2	4.7	111.3
862	G	39.3	Very low	41.8	Very low	87 Å²	87	146 Å²	146	90%	0.897	76%	0.762	S	S	*	*			trans	179.3	155.9	166.7	0	0	0	0	0	119.3
863	D	41.8	Very low	41	Very low	134 Å²	134	148.3 Å²	148.3	72%	0.717	77%	0.767	S	S	*	*			trans	-131.6	167	-156.4	-140.7	39.6	0	0	0	112.8	K865	D863-K865 IonicContact OD2-NZ 3.27Å; D863-K865 PolarHBondContact OD2-NZ 3.41Å
864	I	43.8	Very low	40.1	Very low	121 Å²	121	147.1 Å²	147.1	62%	0.621	77%	0.765	S	S	*	*			cis	169.2	-179.7	-32.2	-163.1	175	0	0	0	112.4
865	K	42.9	Very low	39.7	Very low	165 Å²	165	144.3 Å²	144.3	72%	0.717	76%	0.763	S	S	*	*			trans	74.4	160.3	161.8	-65.5	145.8	-155.2	137.7	0	118.8	D863	D863-K865 IonicContact OD2-NZ 3.27Å; D863-K865 PolarHBondContact OD2-NZ 3.41Å
866	K	41.3	Very low	39.3	Very low	202 Å²	202	145.3 Å²	145.3	88%	0.878	77%	0.772	S	S	*	*			cis	-160.5	-147.2	-39.2	-146.4	-175.7	-175.6	-175.2	0	112.9
867	V	42.4	Very low	38.7	Very low	132 Å²	132	149.5 Å²	149.5	80%	0.8	78%	0.783	S	S	*	*			trans	-140.1	153.6	-166.8	170.6	0	0	0	0	114.3
868	T	45	Very low	38.5	Very low	143 Å²	143	146.6 Å²	146.6	88%	0.877	78%	0.776	S	S	*	*			trans	-144.3	-172.5	178.4	-6.3	0	0	0	0	115.2
869	M	37.5	Very low	38.4	Very low	174 Å²	174	146.1 Å²	146.1	86%	0.857	77%	0.773	S	S	*	*			trans	-158.6	-171.9	-165.2	-126.6	-74.8	-173.7	0	0	115.9
870	T	42.6	Very low	38.4	Very low	137 Å²	137	145.9 Å²	145.9	84%	0.84	78%	0.781	S	S	*	*			trans	85.8	-179.2	166.1	62.5	0	0	0	0	122.2
871	S	31.4	Very low	38.5	Very low	113 Å²	113	144.7 Å²	144.7	79%	0.79	78%	0.782	S	S	*	*			trans	-134.6	-176	-145.5	58.2	0	0	0	0	116.6
872	E	31.1	Very low	38.5	Very low	156 Å²	156	141.4 Å²	141.4	73%	0.729	78%	0.781	S	S	*	*			trans	104.8	150.2	155.3	-149.6	-173.4	-111	0	0	119.2
873	K	37.8	Very low	38.3	Very low	171 Å²	171	144.1 Å²	144.1	74%	0.743	78%	0.78	S	S	*	*			trans	82.5	148.5	166.3	-57.3	174.9	-177	159.8	0	119.2
874	L	35.2	Very low	38.1	Very low	148 Å²	148	144.9 Å²	144.9	78%	0.775	78%	0.784	S	S	*	*			cis	-172.6	176.7	-39.9	-118.1	170.2	0	0	0	110
875	S	39.1	Very low	37.7	Very low	103 Å²	103	144.2 Å²	144.2	72%	0.72	79%	0.786	S	S	*	*			trans	72.3	122.1	-176.6	61.3	0	0	0	0	116
876	L	39.2	Very low	37.4	Very low	146 Å²	146	146.3 Å²	146.3	76%	0.764	79%	0.791	S	S	*	*				75.4	132.6	53.8	-65.4	163.2	0	0	0	111.1
877	E	36.7	Very low	37.2	Very low	166 Å²	166	145.7 Å²	145.7	78%	0.776	79%	0.791	S	S	*	*			cis	-140	166.8	17.2	-74.9	-163.4	115.6	0	0	110.4
878	N	37.9	Very low	37	Very low	123 Å²	123	145.6 Å²	145.6	66%	0.658	79%	0.793	S	S	*	*			cis	-158	-159.7	-14.2	-95	-10.4	0	0	0	108.1
879	S	33.7	Very low	36.5	Very low	115 Å²	115	145.2 Å²	145.2	80%	0.804	79%	0.79	S	S	*	*			trans	-147.3	142	-167.1	59.5	0	0	0	0	116.4
880	E	36.1	Very low	36.4	Very low	198 Å²	198	142.3 Å²	142.3	93%	0.925	79%	0.787	S	S	*	*			trans	-162.4	158.8	158.8	-101.6	167.8	-153.9	0	0	107.6
881	A	36.3	Very low	36	Very low	85 Å²	85	139.9 Å²	139.9	70%	0.702	78%	0.781	S	S	*	*			cis	167.9	138	-42.7	0	0	0	0	0	106.7
882	D	36.8	Very low	36.3	Very low	151 Å²	151	142 Å²	142	81%	0.807	78%	0.783	S	S	*	*			trans	45.3	108.7	167.6	-62	-14.1	0	0	0	121.3
883	T	35.6	Very low	36.7	Very low	144 Å²	144	139.1 Å²	139.1	88%	0.883	78%	0.778	S	S	*	*				-175.9	159.6	102.1	25	0	0	0	0	114.7
884	N	37.3	Very low	36.5	Very low	150 Å²	150	139.9 Å²	139.9	80%	0.802	78%	0.782	S	S	*	*			trans	-61.4	163.8	173.2	-76.4	-71	0	0	0	114
885	T	35.9	Very low	36.4	Very low	106 Å²	106	137.1 Å²	137.1	65%	0.65	78%	0.78	S	S	*	*			cis	175	130	-16.9	-88.1	0	0	0	0	105.8
886	Y	37.4	Very low	36.1	Very low	210 Å²	210	143.1 Å²	143.1	82%	0.824	79%	0.787	S	S	*	*			cis	-151.1	-3.3	-3.8	-141.3	-95.4	0	0	0	114.5
887	E	35.6	Very low	35.7	Very low	188 Å²	188	144 Å²	144	88%	0.879	79%	0.787	S	S	*	*			trans	-67.6	147.7	171.6	-61.7	-170.4	147.1	0	0	109.9
888	P	38.8	Very low	35.5	Very low	130 Å²	130	145.3 Å²	145.3	84%	0.844	79%	0.785	S	S	*	*				-153.4	-144.1	91.1	42.3	-21.9	0	0	0	114.3
889	V	35.3	Very low	35.5	Very low	135 Å²	135	146.3 Å²	146.3	82%	0.818	79%	0.786	S	S	*	*			trans	-136.5	138.5	-153.9	163.8	0	0	0	0	113.6
890	S	34.7	Very low	35.4	Very low	114 Å²	114	145 Å²	145	80%	0.797	78%	0.777	S	S	*	*			trans	79.4	148.3	156	-162	0	0	0	0	121.5
891	A	34.5	Very low	35.1	Very low	86 Å²	86	143.2 Å²	143.2	71%	0.711	77%	0.768	S	S	*	*			trans	72.2	105.4	158.2	0	0	0	0	0	121.6
892	N	38	Very low	34.9	Very low	157 Å²	157	145.8 Å²	145.8	84%	0.84	77%	0.769	S	S	*	*				34.7	157	107.8	-96.4	5.4	0	0	0	121.5
893	P	39.6	Very low	34.6	Very low	95 Å²	95	142.7 Å²	142.7	62%	0.617	76%	0.759	S	S	*	*			cis	-140.1	-146.1	-3.5	40.3	-18.2	0	0	0	114.1
894	F	33	Very low	34.4	Very low	187 Å²	187	142.6 Å²	142.6	82%	0.82	75%	0.753	S	S	*	*			trans	85.5	103.9	178.4	-67.4	-81.1	0	0	0	115.7
895	A	32.9	Very low	33.9	Very low	90 Å²	90	140.6 Å²	140.6	74%	0.744	75%	0.746	S	S	*	*			cis	81.8	120.7	29.4	0	0	0	0	0	116
896	R	33	Very low	33.6	Very low	229 Å²	229	141.6 Å²	141.6	86%	0.864	76%	0.758	S	S	*	*			trans	-135.5	114.4	160.2	-90	-171.3	174.4	-177.4	-0.5	110.5
897	H	31.5	Very low	33.4	Very low	166 Å²	166	134.4 Å²	134.4	77%	0.769	75%	0.748	S	S	*	*			trans	67.7	150.3	140	-73.1	-3	0	0	0	119.2
898	R	32.5	Very low	33.2	Very low	193 Å²	193	133.7 Å²	133.7	73%	0.728	75%	0.75	S	S	*	*			cis	-149.6	147.7	14.7	-139.3	178.4	-173.2	176.5	-0.2	112.1
899	Q	36.5	Very low	32.9	Very low	143 Å²	143	131.6 Å²	131.6	67%	0.668	74%	0.744	S	S	*	*			trans	47.5	118.1	143.3	-76.8	165.8	-30.8	0	0	118.6
900	S	32	Very low	32.8	Very low	89 Å²	89	132.9 Å²	132.9	62%	0.622	74%	0.738	S	S	*	*				65.2	140.4	76.1	88.4	0	0	0	0	112.1
901	E	29.8	Very low	32.9	Very low	160 Å²	160	136.2 Å²	136.2	75%	0.748	73%	0.734	S	S	*	*			cis	-170.8	-164.1	12.8	-140.6	160.5	-123.6	0	0	109.3
902	I	32.5	Very low	33	Very low	138 Å²	138	137 Å²	137	71%	0.708	73%	0.726	S	S	*	*			trans	68.2	93.3	151.4	-65.1	152.4	0	0	0	119
903	S	30.3	Very low	32.8	Very low	87 Å²	87	137 Å²	137	61%	0.608	72%	0.719	S	S	*	*				78.7	154.8	127.3	84.6	0	0	0	0	122.9
904	N	30.7	Very low	32.6	Very low	142 Å²	142	141.9 Å²	141.9	76%	0.759	73%	0.725	S	S	*	*			trans	63.6	151.5	149.1	-68.8	-37.1	0	0	0	119.7
905	T	28.5	Very low	32.6	Very low	107 Å²	107	143 Å²	143	66%	0.656	72%	0.724	S	S	*	*			cis	168.1	123	-23.8	-92.5	0	0	0	0	102.8
906	S	29.3	Very low	32.7	Very low	127 Å²	127	145.3 Å²	145.3	89%	0.888	72%	0.723	S	S	*	*			trans	61.8	154	178.8	74.5	0	0	0	0	116.6
907	G	31.9	Very low	32.9	Very low	60 Å²	60	141 Å²	141	62%	0.619	72%	0.717	S	S	*	*			cis	162	169.9	-9	0	0	0	0	0	112.5
908	N	32.6	Very low	33.2	Very low	173 Å²	173	139.2 Å²	139.2	93%	0.925	72%	0.719	S	S	*	*			trans	64.5	152.4	173.8	-63.3	-15.9	0	0	0	116
909	A	32.3	Very low	33.5	Very low	86 Å²	86	134 Å²	134	71%	0.711	71%	0.712	S	S	*	*			cis	-156.4	172	-22.6	0	0	0	0	0	106.1
910	F	33.4	Very low	33.4	Very low	161 Å²	161	137.3 Å²	137.3	71%	0.706	72%	0.718	S	S	*	*				177.8	119.8	67.2	178.5	-99.7	0	0	0	111.5
911	R	36.8	Very low	33.6	Very low	184 Å²	184	141.9 Å²	141.9	69%	0.694	72%	0.723	S	S	*	*			trans	64.7	147.5	152.3	-64.5	-159.2	159.2	133	4.4	120.6
912	D	36.4	Very low	33.8	Very low	102 Å²	102	138.9 Å²	138.9	55%	0.545	72%	0.72	S	S	.	*			cis	-160.7	158.5	-17.7	-108.6	-12	0	0	0	110.5
913	F	33.2	Very low	33.9	Very low	158 Å²	158	138.4 Å²	138.4	69%	0.693	72%	0.719	S	S	*	*			trans	28.2	141.1	146.1	-60.8	-53.8	0	0	0	121.6
914	R	35.5	Very low	34.1	Very low	198 Å²	198	143.4 Å²	143.4	75%	0.747	73%	0.73	S	S	*	*			cis	-170.7	148.8	22.7	-127.9	162.9	-157.4	-172.6	4.9	112.6
915	R	34	Very low	34.2	Very low	210 Å²	210	139.8 Å²	139.8	79%	0.792	73%	0.726	S	S	*	*			trans	49.3	121.7	145.5	-74.4	-172.6	165.4	168.7	-2.3	120.3
916	D	34.2	Very low	34.5	Very low	138 Å²	138	145.8 Å²	145.8	74%	0.738	74%	0.736	S	S	*	*				70.1	122.4	70.7	-60.8	-45.4	0	0	0	111.9
917	D	37.1	Very low	34.6	Very low	138 Å²	138	147 Å²	147	74%	0.738	73%	0.732	S	S	*	*				-161.5	134.4	73	-102.3	-32.3	0	0	0	114.8
918	T	38.2	Very low	34.8	Very low	130 Å²	130	150.3 Å²	150.3	80%	0.798	75%	0.746	S	S	*	*			trans	54.2	155.2	138.3	76.1	0	0	0	0	121.8
919	S	37.9	Very low	34.8	Very low	84 Å²	84	145.2 Å²	145.2	59%	0.587	73%	0.734	S	S	*	*			cis	-166.6	143.9	-0.9	123.5	0	0	0	0	111.9
920	R	35.5	Very low	34.9	Very low	212 Å²	212	145.8 Å²	145.8	80%	0.8	73%	0.733	S	S	*	*			trans	65	156.4	152.9	-67.4	169.9	-177.5	-173.6	0.7	118.3
921	Y	34.6	Very low	35	Very low	185 Å²	185	146.9 Å²	146.9	73%	0.725	74%	0.737	S	S	*	*			cis	-148.5	122.3	-10	-117.5	-69.1	0	0	0	103.6
922	S	34.6	Very low	34.9	Very low	97 Å²	97	149.3 Å²	149.3	68%	0.678	75%	0.746	S	S	*	*				36.6	142.7	79.2	47.4	0	0	0	0	117.1
923	D	34.4	Very low	34.9	Very low	127 Å²	127	151.6 Å²	151.6	68%	0.679	76%	0.764	S	S	*	*			cis	-171.1	166.2	-19.4	-166.2	0.3	0	0	0	108.3
924	F	34.4	Very low	35	Very low	193 Å²	193	147.6 Å²	147.6	85%	0.846	77%	0.767	S	S	*	*			trans	59	166.8	175.5	-64.9	-84.7	0	0	0	116.8
925	G	33.2	Very low	35	Very low	65 Å²	65	144.7 Å²	144.7	67%	0.67	76%	0.76	S	S	*	*			cis	159.9	127.8	-15	0	0	0	0	0	114.3
926	R	34.3	Very low	35.3	Very low	233 Å²	233	140.2 Å²	140.2	88%	0.879	75%	0.751	S	S	*	*			trans	69.4	118.8	161.7	-65.9	-172.5	178.1	-124.9	0	122
927	L	31.4	Very low	35.6	Very low	152 Å²	152	139.2 Å²	139.2	80%	0.796	75%	0.746	S	S	*	*			trans	69.8	140.2	132.8	-84.8	89.4	0	0	0	124.1
928	S	36.3	Very low	35.8	Very low	131 Å²	131	138.6 Å²	138.6	92%	0.916	75%	0.747	S	S	*	*			trans	83.3	144.1	148.2	-155.1	0	0	0	0	119.3
929	G	33.8	Very low	35.9	Very low	65 Å²	65	137.5 Å²	137.5	67%	0.67	74%	0.743	S	S	*	*			trans	136.3	40.4	151.8	0	0	0	0	0	123.1
930	S	34.5	Very low	35.8	Very low	98 Å²	98	140.3 Å²	140.3	69%	0.685	75%	0.751	S	S	*	*			trans	56.7	113.4	138.8	-177.1	0	0	0	0	122.9
931	K	34.5	Very low	35.8	Very low	185 Å²	185	134.9 Å²	134.9	80%	0.804	74%	0.742	S	S	*	*			trans	59.2	108.4	133.5	-58	174.2	-177	171.4	0	121.8
932	R	34.2	Very low	35.8	Very low	235 Å²	235	133.6 Å²	133.6	89%	0.887	74%	0.735	S	S	*	*				164.6	123.3	113.1	-87.9	166.7	-170.7	-142	1.3	109.6
933	V	36.2	Very low	35.8	Very low	150 Å²	150	133.2 Å²	133.2	91%	0.909	73%	0.733	S	S	*	*				82.7	120.9	60.7	171.2	0	0	0	0	113
934	G	35.6	Very low	35.8	Very low	73 Å²	73	135 Å²	135	75%	0.753	74%	0.742	S	S	*	*			trans	122.1	108.7	-179.8	0	0	0	0	0	112
935	F	37	Very low	35.9	Very low	138 Å²	138	131.2 Å²	131.2	61%	0.605	74%	0.738	S	S	*	*			cis	139	155.1	-5.7	-179	-110.1	0	0	0	107.5
936	D	39.8	Very low	36	Very low	115 Å²	115	132.8 Å²	132.8	62%	0.615	74%	0.738	S	S	*	*			trans	66.4	123.6	-172.1	-67.9	-46.6	0	0	0	116.8
937	N	39.6	Very low	36	Very low	117 Å²	117	132 Å²	132	63%	0.626	74%	0.741	S	S	*	*			cis	98.4	141.9	38.5	-75.3	-30.5	0	0	0	111.6
938	T	41.8	Very low	36.2	Very low	125 Å²	125	130.7 Å²	130.7	77%	0.767	74%	0.735	S	S	*	*			cis	-153	-174.7	9.4	-1.9	0	0	0	0	110.2
939	P	41	Very low	35.9	Very low	108 Å²	108	131.3 Å²	131.3	70%	0.701	73%	0.727	S	S	*	*				-126.3	-175.6	-128.9	43.3	-25.4	0	0	0	115.9
940	N	35.4	Very low	36	Very low	142 Å²	142	140 Å²	140	76%	0.759	74%	0.739	S	S	*	*				-162.1	151	120.7	-123.6	-16.6	0	0	0	115.8
941	T	35.1	Very low	35.9	Very low	98 Å²	98	139.8 Å²	139.8	60%	0.601	74%	0.738	S	S	*	*			trans	-5.4	140.9	160.7	56.7	0	0	0	0	118.9
942	R	33.7	Very low	36	Very low	158 Å²	158	142.1 Å²	142.1	60%	0.596	74%	0.742	S	S	*	*			cis	-156.7	140	40.5	-140.7	170.3	-175.4	153	-0.3	110.2	M1038	R942-M1038 PolarHBondContact NH2-SD 3.16Å
943	S	35.5	Very low	36	Very low	90 Å²	90	136.5 Å²	136.5	63%	0.629	74%	0.739	S	S	*	*			trans	-123.6	130.9	-177.3	54.5	0	0	0	0	111.9
944	D	34	Very low	35.8	Very low	163 Å²	163	132.7 Å²	132.7	87%	0.872	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-103.5	123.5	158.1	-70.6	-47.7	0	0	0	108.1
945	P	36.1	Very low	35.9	Very low	115 Å²	115	135.8 Å²	135.8	75%	0.747	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-90.3	152.1	177.5	34.6	-32.9	0	0	0	112.2
946	S	35.5	Very low	35.6	Very low	98 Å²	98	140.2 Å²	140.2	69%	0.685	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-61.3	142.4	166.2	45.1	0	0	0	0	111.4
947	K	35.4	Very low	35.3	Very low	215 Å²	215	145.6 Å²	145.6	94%	0.935	76%	0.761	S	S	*	*			trans	-92.3	106.1	161.9	-90.6	-169.4	172.6	-175.6	0	109.4
948	D	35.8	Very low	34.9	Very low	126 Å²	126	145.9 Å²	145.9	67%	0.674	77%	0.767	S	S	*	*			trans	-78.8	137.2	164.9	-78	-66.4	0	0	0	111.5
949	I	30.4	Very low	34.6	Very low	144 Å²	144	146.5 Å²	146.5	74%	0.738	77%	0.77	S	S	*	*			trans	28.2	112	134.9	-43.3	176.1	0	0	0	117.6
950	W	34.1	Very low	34.2	Very low	246 Å²	246	147.3 Å²	147.3	93%	0.932	78%	0.776	S	S	*	*			trans	178.7	141	138.7	-88.9	16.1	0	0	0	104.9
951	S	34.3	Very low	33.8	Very low	94 Å²	94	146 Å²	146	66%	0.657	78%	0.778	S	S	*	*			cis	-157.8	158.7	4.1	-109.7	0	0	0	0	112
952	R	34.5	Very low	33.8	Very low	234 Å²	234	150 Å²	150	88%	0.883	79%	0.79	S	S	*	*			trans	14.1	139.4	135.9	-85.8	178.2	179.3	-145.3	2.3	119.1
953	S	34.8	Very low	33.7	Very low	118 Å²	118	151.4 Å²	151.4	83%	0.825	80%	0.8	S	S	*	*			cis	-159	158.1	13.2	-54.2	0	0	0	0	113.3
954	G	33.6	Very low	33.5	Very low	70 Å²	70	152.8 Å²	152.8	72%	0.722	80%	0.801	S	S	*	*			trans	-165.3	139.7	165	0	0	0	0	0	111.7
955	P	37.8	Very low	33.3	Very low	138 Å²	138	149.7 Å²	149.7	90%	0.896	79%	0.791	S	S	*	*			trans	-92.1	163.3	-163.7	35.2	-36.6	0	0	0	116.6
956	R	28.8	Very low	33.2	Very low	230 Å²	230	152.2 Å²	152.2	87%	0.868	80%	0.798	S	S	*	*			trans	-82.4	151	-179.9	-55.4	175.5	176.4	-154.5	-0.6	113.9
957	R	34.1	Very low	33	Very low	229 Å²	229	157.8 Å²	157.8	86%	0.864	81%	0.805	S	S	*	*				178.7	110.4	129.9	-94.5	157.5	-167.1	-120.4	3.7	108
958	T	31.7	Very low	33	Very low	123 Å²	123	156.5 Å²	156.5	76%	0.755	80%	0.803	S	S	*	*				57.1	91.6	70.9	69.4	0	0	0	0	114.4
959	V	34.7	Very low	32.8	Very low	137 Å²	137	157.9 Å²	157.9	83%	0.83	81%	0.81	S	S	*	*			trans	-139.8	143.8	160.6	-172.5	0	0	0	0	106.8
960	P	32.2	Very low	33	Very low	126 Å²	126	158.5 Å²	158.5	82%	0.818	82%	0.815	S	S	*	*			trans	-90.3	175.7	-156.9	-10.8	30.5	0	0	0	116.9
961	S	28.3	Very low	32.9	Very low	115 Å²	115	151.9 Å²	151.9	80%	0.804	81%	0.806	S	S	*	*			trans	-84.3	131.5	165.3	163.3	0	0	0	0	110.7
962	E	34.7	Very low	32.9	Very low	182 Å²	182	151.1 Å²	151.1	85%	0.85	81%	0.814	S	S	*	*			trans	-168.2	148.2	157.4	-121.3	165.5	-147.3	0	0	111.1
963	F	31.7	Very low	32.6	Very low	187 Å²	187	147.8 Å²	147.8	82%	0.82	81%	0.813	S	S	*	*			trans	61.3	139.8	175.9	-106.6	-122.7	0	0	0	117.4
964	D	32.4	Very low	32.6	Very low	119 Å²	119	146.5 Å²	146.5	64%	0.636	81%	0.809	S	S	*	*			cis	-141.9	159.1	1.1	-159.9	-3.2	0	0	0	110.4
965	S	29.3	Very low	32.5	Very low	97 Å²	97	146.9 Å²	146.9	68%	0.678	81%	0.813	S	S	*	*			trans	-136	110.3	-179.7	64.6	0	0	0	0	112.3
966	L	32.7	Very low	32	Very low	169 Å²	169	143.1 Å²	143.1	89%	0.885	80%	0.8	S	S	*	*			trans	-128.4	106.7	159.4	-85.2	169.3	0	0	0	109
967	Y	33	Very low	32.1	Very low	214 Å²	214	144.4 Å²	144.4	84%	0.839	81%	0.805	S	S	*	*			trans	-85.1	138.9	158.3	-85.9	-104.7	0	0	0	107.9
968	E	34.5	Very low	32	Very low	188 Å²	188	139.9 Å²	139.9	88%	0.879	80%	0.803	S	S	*	*			trans	-126.6	150.3	142.8	-81.2	-168.3	136.6	0	0	108.1
969	D	31.8	Very low	31.9	Very low	156 Å²	156	143.1 Å²	143.1	83%	0.834	81%	0.809	S	S	*	*			trans	-77.9	154.9	-172.5	-64	-76.4	0	0	0	112.8
970	D	33.6	Very low	31.9	Very low	156 Å²	156	143.5 Å²	143.5	83%	0.834	81%	0.812	S	S	*	*				-143.2	159.3	113.9	-156	1.1	0	0	0	110.9
971	S	33.2	Very low	31.9	Very low	107 Å²	107	140.7 Å²	140.7	75%	0.748	81%	0.806	S	S	*	*			trans	-104.8	146.3	-160.1	64.5	0	0	0	0	112.8
972	G	33.1	Very low	32.1	Very low	79 Å²	79	141 Å²	141	81%	0.814	81%	0.808	S	S	*	*			trans	-154.7	31.3	-173.5	0	0	0	0	0	114.5	A974	G972-A974 PolarHBondContact O-N 3.3Å
973	N	29.3	Very low	31.8	Very low	164 Å²	164	141.7 Å²	141.7	88%	0.877	80%	0.803	S	S	*	*			trans	-73.6	111.5	-175.8	178	21.5	0	0	0	112.5
974	A	33.5	Very low	31.8	Very low	90 Å²	90	144.2 Å²	144.2	74%	0.744	81%	0.807	S	S	*	*			trans	-141.2	133.9	162.8	0	0	0	0	0	110.5	G972	G972-A974 PolarHBondContact O-N 3.3Å
975	G	31.7	Very low	31.8	Very low	78 Å²	78	144.9 Å²	144.9	80%	0.804	81%	0.806	S	S	*	*			trans	-65.5	167.2	176.9	0	0	0	0	0	112.9
976	G	28.3	Very low	31.9	Very low	60 Å²	60	147.3 Å²	147.3	62%	0.619	81%	0.812	S	S	*	*			cis	124.2	153.7	21	0	0	0	0	0	109.2
977	W	30	Very low	31.9	Very low	256 Å²	256	147.9 Å²	147.9	97%	0.97	81%	0.81	S	S	*	*			trans	66.1	133.6	-172.2	-42.8	90.7	0	0	0	113.3
978	T	33	Very low	31.8	Very low	134 Å²	134	149 Å²	149	82%	0.822	81%	0.813	S	S	*	*			cis	-148.9	165.5	34.3	38.1	0	0	0	0	112.6
979	Q	30	Very low	31.8	Very low	191 Å²	191	146.4 Å²	146.4	89%	0.893	81%	0.81	S	S	*	*			trans	-112.6	113.6	-174.2	174	-172.4	-3.4	0	0	111.2
980	V	34.4	Very low	31.9	Very low	146 Å²	146	148.5 Å²	148.5	89%	0.885	81%	0.811	S	S	*	*			trans	-146.5	133.4	167.3	-172.6	0	0	0	0	107.8
981	G	30.9	Very low	32.1	Very low	67 Å²	67	146.8 Å²	146.8	69%	0.691	81%	0.809	S	S	*	*			cis	172.4	49	-0.7	0	0	0	0	0	112.3	R983	G981-R983 PolarHBondContact O-N 2.98Å
982	S	33.1	Very low	32.2	Very low	122 Å²	122	151.8 Å²	151.8	85%	0.853	82%	0.818	S	S	*	*			trans	-81.3	82.1	-172.7	-163.5	0	0	0	0	112.7	R984	S982-R984 PolarHBondContact O-N 3.03Å; S982-R984 VanDerWaalsContact O-N 3.08Å
983	R	28.9	Very low	32.3	Very low	196 Å²	196	151.2 Å²	151.2	74%	0.74	81%	0.812	S	S	*	*			trans	-76.2	87.7	175.5	-173.7	177	-179.4	164.1	-2.5	110.8	G981 E985	G981-R983 PolarHBondContact O-N 2.98Å; R983-E985 IonicContact CZ-OE1 3.52Å; R983-E985 VanDerWaalsContact CZ-OE1 3.27Å; R983-E985 IonicContact CZ-OE2 2.72Å; R983-E985 VanDerWaalsContact CZ-OE2 3.23Å; R983-E985 IonicContact NE-OE1 3.17Å; R983-E985 PolarHBondContact NE-OE1 3.4Å; R983-E985 IonicContact NE-OE2 3.49Å; R983-E985 PolarHBondContact NE-OE2 3.06Å; R983-E985 VanDerWaalsContact NH2-CD 3.29Å; R983-E985 IonicContact NH2-OE1 3.64Å; R983-E985 PolarHBondContact NH2-OE1 3.26Å; R983-E985 IonicContact NH2-OE2 2.95Å; R983-E985 PolarHBondContact NH2-OE2 3.5Å; R983-E985 PolarHBondContact O-N 3.04Å
984	R	30.7	Very low	32.5	Very low	240 Å²	240	155.8 Å²	155.8	91%	0.906	82%	0.817	S	S	*	*			trans	-75.1	96.3	160.9	-98.6	-172.9	171	177.3	-1.3	109.2	S982	S982-R984 PolarHBondContact O-N 3.03Å; S982-R984 VanDerWaalsContact O-N 3.08Å
985	E	32.3	Very low	32.5	Very low	132 Å²	132	155.5 Å²	155.5	62%	0.617	82%	0.822	S	S	*	*			trans	-77.4	135.1	170.3	-148.1	109.5	-110.4	0	0	109.8	R983	R983-E985 IonicContact CZ-OE1 3.52Å; R983-E985 VanDerWaalsContact CZ-OE1 3.27Å; R983-E985 IonicContact CZ-OE2 2.72Å; R983-E985 VanDerWaalsContact CZ-OE2 3.23Å; R983-E985 IonicContact NE-OE1 3.17Å; R983-E985 PolarHBondContact NE-OE1 3.4Å; R983-E985 IonicContact NE-OE2 3.49Å; R983-E985 PolarHBondContact NE-OE2 3.06Å; R983-E985 VanDerWaalsContact NH2-CD 3.29Å; R983-E985 IonicContact NH2-OE1 3.64Å; R983-E985 PolarHBondContact NH2-OE1 3.26Å; R983-E985 IonicContact NH2-OE2 2.95Å; R983-E985 PolarHBondContact NH2-OE2 3.5Å; R983-E985 PolarHBondContact O-N 3.04Å
986	N	31.7	Very low	32.6	Very low	148 Å²	148	155.2 Å²	155.2	79%	0.791	82%	0.819	S	S	*	*			trans	-90.8	115.2	174.3	-91.7	-54.9	0	0	0	109.8
987	E	32.5	Very low	32.9	Very low	182 Å²	182	158 Å²	158	85%	0.85	83%	0.829	S	S	*	*			trans	-116.6	111.3	153.1	-70.5	-150.8	137.2	0	0	110.4
988	R	31	Very low	32.9	Very low	238 Å²	238	151.4 Å²	151.4	90%	0.898	82%	0.817	S	S	*	*			trans	-100.7	102.7	170.3	-79.8	177.6	165.1	-177.1	-3	108.9
989	T	35.2	Very low	33.2	Very low	133 Å²	133	153.6 Å²	153.6	82%	0.816	82%	0.82	S	S	*	*			trans	-117	132.8	161.2	44.1	0	0	0	0	109.4
990	K	34.1	Very low	33.3	Very low	200 Å²	200	148.4 Å²	148.4	87%	0.87	82%	0.818	S	S	*	*			trans	-95.2	150.8	-175.5	-78.2	-175.7	175.3	-178.8	0	111.2
991	P	38	Very low	33.4	Very low	120 Å²	120	145.7 Å²	145.7	78%	0.779	82%	0.819	S	S	*	*			trans	-85.6	140.9	-173.6	33.2	-35.8	0	0	0	114.8
992	F	35.4	Very low	33.6	Very low	212 Å²	212	145.6 Å²	145.6	93%	0.93	82%	0.819	S	S	*	*			trans	-145.4	151.6	152.9	-79.8	-95.4	0	0	0	106
993	G	34.5	Very low	33.8	Very low	67 Å²	67	148.6 Å²	148.6	69%	0.691	82%	0.817	S	S	*	*			cis	157.9	111.7	-9.3	0	0	0	0	0	112.6
994	R	34.3	Very low	34.4	Very low	260 Å²	260	144.6 Å²	144.6	98%	0.981	81%	0.81	S	S	*	*			trans	65.8	146.2	174.8	-71.3	-176.6	165.5	-138	-1.5	118.7
995	G	33.4	Very low	34.8	Very low	84 Å²	84	142.5 Å²	142.5	87%	0.866	80%	0.802	S	S	*	*			trans	83.3	146.6	163.8	0	0	0	0	0	115.2
996	G	33.8	Very low	35	Very low	71 Å²	71	140 Å²	140	73%	0.732	81%	0.812	S	S	*	*			cis	163	125	-10.9	0	0	0	0	0	113.7
997	S	33.2	Very low	35.5	Very low	118 Å²	118	139.1 Å²	139.1	83%	0.825	81%	0.814	S	S	*	*			trans	64.5	121.5	154.2	-58.6	0	0	0	0	121.7
998	T	31.6	Very low	35.7	Very low	118 Å²	118	139.6 Å²	139.6	72%	0.724	81%	0.813	S	S	*	*			trans	88.6	152	136.2	-53.3	0	0	0	0	119.6
999	M	37.8	Very low	36	Very low	181 Å²	181	136 Å²	136	89%	0.892	81%	0.812	S	S	*	*			trans	70.7	133.6	-173.7	-49.8	-54.5	-175.6	0	0	115.3
1000	G	33	Very low	36.2	Very low	81 Å²	81	134 Å²	134	84%	0.835	80%	0.801	S	S	*	*			cis	148.9	106.8	-8.2	0	0	0	0	0	112.6
1001	G	35.7	Very low	36.5	Very low	89 Å²	89	131.3 Å²	131.3	92%	0.918	80%	0.796	S	S	*	*			trans	166.9	116.6	173.9	0	0	0	0	0	114.1
1002	G	35.3	Very low	36.6	Very low	66 Å²	66	134 Å²	134	68%	0.68	80%	0.8	S	S	*	*			trans	-169.1	145.4	176	0	0	0	0	0	114
1003	F	37.7	Very low	36.7	Very low	184 Å²	184	130 Å²	130	81%	0.807	79%	0.789	S	S	*	*			trans	-165.7	161.8	-179.8	-74.8	-44.2	0	0	0	107.9
1004	N	40.3	Very low	37	Very low	113 Å²	113	132.9 Å²	132.9	60%	0.604	79%	0.793	S	S	*	*			cis	-165.3	155.3	-12.7	-100.5	-26.2	0	0	0	106.5
1005	R	39.7	Very low	37	Very low	196 Å²	196	124.2 Å²	124.2	74%	0.74	79%	0.785	S	S	*	*			cis	-166.2	69.7	-20	-170	-178.5	-70.2	-152.1	-4.5	112.2
1006	G	37.7	Very low	37.2	Very low	80 Å²	80	125.9 Å²	125.9	83%	0.825	78%	0.783	S	S	*	*			trans	66.1	-146	165.3	0	0	0	0	0	115.3
1007	P	42.2	Very low	37.3	Very low	128 Å²	128	127.1 Å²	127.1	83%	0.831	78%	0.78	S	S	*	*			cis	-121	-171.7	6.4	41.7	-27.5	0	0	0	115.1
1008	K	35.2	Very low	37.4	Very low	193 Å²	193	127.6 Å²	127.6	84%	0.839	78%	0.778	S	S	*	*			trans	-92.8	165.5	-176.2	-50.2	167.3	179.5	177.4	0	112.2
1009	N	38.9	Very low	37.6	Very low	162 Å²	162	126.8 Å²	126.8	87%	0.866	78%	0.775	S	S	*	*				-154.4	158.1	120.4	-124.4	17.4	0	0	0	112.1
1010	P	38.8	Very low	37.2	Very low	91 Å²	91	129.4 Å²	129.4	59%	0.591	78%	0.775	S	S	*	*			trans	-119	-166.2	-175.2	42.7	-29.8	0	0	0	114.3
1011	D	40.4	Very low	37.2	Very low	143 Å²	143	134.8 Å²	134.8	77%	0.765	77%	0.771	S	S	*	*			trans	83.8	151.8	160.5	-54.8	-25.1	0	0	0	119.9
1012	M	39.2	Very low	36.9	Very low	176 Å²	176	142.3 Å²	142.3	87%	0.867	77%	0.771	S	S	*	*			trans	67.8	145	178.7	-55.4	-67.5	-173.8	0	0	118.4
1013	D	38.5	Very low	37	Very low	129 Å²	129	146 Å²	146	69%	0.69	77%	0.771	S	S	*	*			cis	-157.9	169.5	-45.8	-146.3	-21.9	0	0	0	109.6
1014	T	40.5	Very low	36.8	Very low	128 Å²	128	140.3 Å²	140.3	79%	0.785	76%	0.764	S	S	*	*			trans	31	116.9	159.3	58.9	0	0	0	0	120
1015	G	35	Very low	36.4	Very low	77 Å²	77	141.1 Å²	141.1	79%	0.794	78%	0.775	S	S	*	*			trans	173.8	106.2	159.2	0	0	0	0	0	117.6
1016	S	36.9	Very low	36.4	Very low	119 Å²	119	139.4 Å²	139.4	83%	0.832	78%	0.781	S	S	*	*			trans	47.7	109.7	154.7	-173.2	0	0	0	0	120.1
1017	S	35.5	Very low	36.4	Very low	97 Å²	97	139.1 Å²	139.1	68%	0.678	77%	0.77	S	S	*	*			trans	22.4	122.2	140	-148.5	0	0	0	0	118.2
1018	T	36	Very low	36.1	Very low	128 Å²	128	138 Å²	138	79%	0.785	77%	0.773	S	S	*	*			cis	-164.2	117.3	43.6	-47.4	0	0	0	0	112
1019	P	34.3	Very low	36	Very low	101 Å²	101	132.9 Å²	132.9	66%	0.656	77%	0.774	S	S	*	*			trans	-123.1	160.3	169.6	38	-26.4	0	0	0	114.2
1020	W	29.5	Very low	35.7	Very low	236 Å²	236	128.9 Å²	128.9	89%	0.894	77%	0.771	S	S	*	*			trans	69.3	82.9	169.5	-53.9	102.8	0	0	0	119.6
1021	R	33	Very low	35.5	Very low	195 Å²	195	132.8 Å²	132.8	74%	0.736	78%	0.779	S	S	*	*			trans	-126.4	135.5	136.7	-72.9	171.4	170.8	-98	25	106.1	E1023	R1021-E1023 HydrophobicContact CB-CG 4.34Å; R1021-E1023 WeakPolarHBondContact CD-OE2 3.42Å; R1021-E1023 IonicContact CZ-OE1 3.39Å; R1021-E1023 IonicContact NH1-OE1 3.36Å; R1021-E1023 PolarHBondContact NH1-OE1 2.88Å; R1021-E1023 IonicContact NH1-OE2 2.64Å
1022	R	31.2	Very low	35.1	Very low	247 Å²	247	130.8 Å²	130.8	93%	0.932	78%	0.776	S	S	*	*			cis	66.6	34.8	8.8	-127.5	179.5	-154.2	-106.9	2.8	116.9
1023	E	36.3	Very low	34.9	Very low	144 Å²	144	131.9 Å²	131.9	67%	0.673	78%	0.779	S	S	*	*			trans	-117.4	139.8	149.5	-69.1	170.8	138.4	0	0	107.3	R1021	R1021-E1023 HydrophobicContact CB-CG 4.34Å; R1021-E1023 WeakPolarHBondContact CD-OE2 3.42Å; R1021-E1023 IonicContact CZ-OE1 3.39Å; R1021-E1023 IonicContact NH1-OE1 3.36Å; R1021-E1023 PolarHBondContact NH1-OE1 2.88Å; R1021-E1023 IonicContact NH1-OE2 2.64Å
1024	G	33.3	Very low	34.7	Very low	64 Å²	64	131.1 Å²	131.1	66%	0.66	78%	0.778	S	S	*	*			cis	172.7	98.1	-9.9	0	0	0	0	0	112.3	N1026	G1024-N1026 PolarHBondContact O-N 3.22Å
1025	P	32.8	Very low	34.3	Very low	130 Å²	130	133.1 Å²	133.1	84%	0.844	78%	0.777	S	S	*	*			trans	-87.1	85.4	177.5	33.2	-32.1	0	0	0	111.2
1026	N	40.2	Very low	34.2	Very low	159 Å²	159	136.7 Å²	136.7	85%	0.85	77%	0.773	S	S	*	*			trans	-159.2	148	173.5	-91.8	-34.6	0	0	0	109.9	G1024	G1024-N1026 PolarHBondContact O-N 3.22Å
1027	A	36.9	Very low	34.1	Very low	74 Å²	74	140 Å²	140	61%	0.612	78%	0.775	S	S	*	*			cis	-166.5	64.5	-15.3	0	0	0	0	0	112.6
1028	A	35.6	Very low	34.2	Very low	106 Å²	106	142.4 Å²	142.4	88%	0.876	78%	0.777	S	S	*	*			trans	-159.4	135.7	166.2	0	0	0	0	0	110.4
1029	G	33.5	Very low	34.2	Very low	85 Å²	85	143.8 Å²	143.8	88%	0.876	77%	0.768	S	S	*	*			cis	-179.2	126.4	-12.2	0	0	0	0	0	110
1030	G	32.9	Very low	34.2	Very low	77 Å²	77	142.8 Å²	142.8	79%	0.794	78%	0.777	S	S	*	*			trans	168.7	117.4	-176.6	0	0	0	0	0	111.2	S1032	G1030-S1032 PolarHBondContact O-N 3.09Å
1031	K	34.3	Very low	34.5	Very low	174 Å²	174	134.8 Å²	134.8	76%	0.757	77%	0.767	S	S	*	*			trans	-64.7	124.1	-177.5	-61.5	167.8	-178.8	178	0	108.7	L545	L545-K1031 VanDerWaalsContact CD2-NZ 3.3Å
1032	S	32.7	Very low	34.6	Very low	100 Å²	100	133.1 Å²	133.1	70%	0.699	77%	0.773	S	S	*	*				67.3	88.5	68.4	-178.8	0	0	0	0	113.5	G1030	G1030-S1032 PolarHBondContact O-N 3.09Å
1033	Q	33.6	Very low	34.8	Very low	199 Å²	199	128 Å²	128	93%	0.93	77%	0.769	S	S	*	*			trans	-129.1	122.4	141.6	-141.1	173.8	7.5	0	0	107.8
1034	V	34.8	Very low	34.9	Very low	113 Å²	113	130.5 Å²	130.5	69%	0.685	78%	0.777	S	S	*	*			trans	-148.8	153.4	-166.7	167.9	0	0	0	0	107.4
1035	F	31.5	Very low	34.9	Very low	170 Å²	170	133.8 Å²	133.8	75%	0.746	77%	0.77	S	S	*	*			trans	70.5	132.2	-179.1	-93.9	-138.1	0	0	0	114.6
1036	E	33.3	Very low	35.3	Very low	152 Å²	152	133.6 Å²	133.6	71%	0.71	77%	0.769	S	S	*	*			cis	76.3	104.1	32.6	-167.1	-177.4	175.3	0	0	113
1037	E	34.6	Very low	35	Very low	188 Å²	188	134 Å²	134	88%	0.879	76%	0.763	S	S	*	*			trans	-151.8	115.1	156.8	-138	172.2	-132.2	0	0	112
1038	M	37.7	Very low	34.9	Very low	148 Å²	148	134.3 Å²	134.3	73%	0.729	77%	0.773	S	S	*	*			trans	-87.8	111.6	165.6	-78.6	-158.3	-174	0	0	110.1	R942	R942-M1038 PolarHBondContact NH2-SD 3.16Å
1039	R	36.6	Very low	34.8	Very low	157 Å²	157	135.4 Å²	135.4	59%	0.592	77%	0.774	S	S	*	*	S	Bend	trans	41	99.7	155.1	-66.3	-172.7	176.6	-157.9	-0.8	117.6
1040	G	34.8	Very low	35.2	Very low	81 Å²	81	137 Å²	137	84%	0.835	77%	0.773	S	S	*	*				122.2	141.4	121.7	0	0	0	0	0	116.7
1041	G	34.3	Very low	35.3	Very low	67 Å²	67	136.8 Å²	136.8	69%	0.691	77%	0.77	S	S	*	*			trans	150.7	15.2	165	0	0	0	0	0	120.9
1042	N	35.4	Very low	35.3	Very low	160 Å²	160	138 Å²	138	86%	0.856	78%	0.775	S	S	*	*			trans	43.5	93.4	148.1	-165	12.3	0	0	0	118.1
1043	V	36.4	Very low	35.7	Very low	141 Å²	141	139.3 Å²	139.3	86%	0.855	78%	0.782	S	S	*	*			trans	-126	150.4	165.4	-178.4	0	0	0	0	109.9
1044	K	38.8	Very low	35.8	Very low	195 Å²	195	134.4 Å²	134.4	85%	0.848	77%	0.769	S	S	*	*			trans	-82.8	157.3	-158.2	-62.8	173.9	177.8	178.6	0	115.8
1045	R	32.2	Very low	36	Very low	133 Å²	133	140.2 Å²	140.2	50%	0.502	78%	0.779	S	S	.	*			trans	-30.2	150.7	153.6	-77	-170.9	-167.2	-123.9	1.8	113	E720 E723	E720-R1045 IonicContact OE1-NH2 2.76Å; E723-R1045 IonicContact OE1-NH1 3.75Å; E723-R1045 PolarHBondContact OE1-NH1 3.16Å; E723-R1045 IonicContact OE1-NH2 2.7Å
1046	P	41.2	Very low	36.4	Very low	127 Å²	127	139.4 Å²	139.4	83%	0.825	78%	0.781	S	S	*	*				-144.4	172.2	57.8	41.8	-23.4	0	0	0	119.2
1047	F	33.8	Very low	36.7	Very low	168 Å²	168	137.3 Å²	137.3	74%	0.737	78%	0.783	S	S	*	*			trans	-62.7	157.2	167.9	-79.9	-124.8	0	0	0	112.3
1048	G	34.3	Very low	36.9	Very low	79 Å²	79	134 Å²	134	81%	0.814	78%	0.781	S	S	*	*			trans	-161.8	105	166.6	0	0	0	0	0	111.5
1049	S	35	Very low	37	Very low	129 Å²	129	130.2 Å²	130.2	90%	0.902	78%	0.779	S	S	*	*			trans	-100.9	132.5	-179.4	-179.9	0	0	0	0	111.9
1050	S	40.2	Very low	37.2	Very low	120 Å²	120	130.7 Å²	130.7	84%	0.839	79%	0.793	S	S	*	*			trans	-165.2	137.2	166.4	60.1	0	0	0	0	109.3
1051	G	35.5	Very low	37.5	Very low	72 Å²	72	131.2 Å²	131.2	74%	0.742	78%	0.783	S	S	*	*			cis	178.4	144.9	-6.3	0	0	0	0	0	110.5
1052	F	35.4	Very low	37.8	Very low	198 Å²	198	134.9 Å²	134.9	87%	0.868	79%	0.788	S	S	*	*			trans	-67.5	156.9	173	-92.4	-89.5	0	0	0	111.3
1053	P	41.1	Very low	38.2	Very low	128 Å²	128	132.7 Å²	132.7	83%	0.831	78%	0.776	S	S	*	*				-144	151.9	97.7	37.4	-22.9	0	0	0	115.5
1054	S	34.3	Very low	38.5	Very low	96 Å²	96	135 Å²	135	67%	0.671	77%	0.769	S	S	*	*			trans	-103.8	150.3	168.6	50.7	0	0	0	0	112
1055	R	39.1	Very low	39	Very low	235 Å²	235	134.3 Å²	134.3	89%	0.887	77%	0.766	S	S	*	*			trans	-144.9	119.1	160.6	-74.1	-164.1	171.4	-175.6	-2.7	107.6
1056	I	39.6	Very low	39.6	Very low	153 Å²	153	142.5 Å²	142.5	79%	0.785	80%	0.799	S	S	*	*				81.4	88.5	69.4	-64.9	164.5	0	0	0	113
1057	S	40	Very low	39.6	Very low	108 Å²	108	143.3 Å²	143.3	76%	0.755	80%	0.798	S	S	*	*			trans	175.6	128.5	138.5	51.2	0	0	0	0	107.3
1058	S	39.3	Very low	39.9	Very low	120 Å²	120	141.9 Å²	141.9	84%	0.839	80%	0.801	S	S	*	*			cis	88	98.5	37.6	77.6	0	0	0	0	114
1059	G	40.8	Very low	40.2	Very low	67 Å²	67	145.4 Å²	145.4	69%	0.691	80%	0.8	S	S	*	*			trans	147.6	92.9	176.8	0	0	0	0	0	109.8
1060	L	40.3	Very low	40.5	Very low	168 Å²	168	146.4 Å²	146.4	88%	0.88	79%	0.794	S	S	*	*				76.1	108.2	78.7	-79.1	167.9	0	0	0	114.8
1061	S	40.9	Very low	40.5	Very low	91 Å²	91	148.1 Å²	148.1	64%	0.636	79%	0.791	S	S	*	*			trans	56.7	115.4	138.9	-81.4	0	0	0	0	122.6
1062	D	40.7	Very low	40.8	Very low	145 Å²	145	153.1 Å²	153.1	78%	0.775	80%	0.795	S	S	*	*				80.2	139.3	123.6	-57.8	-45.5	0	0	0	123
1063	D	43.6	Very low	41.2	Very low	113 Å²	113	149.9 Å²	149.9	60%	0.604	79%	0.789	S	S	*	*			trans	68.2	110.2	151.9	-96.9	-20.4	0	0	0	122.4
1064	R	42	Very low	41.2	Very low	191 Å²	191	151.6 Å²	151.6	72%	0.721	79%	0.786	S	S	*	*			trans	83.6	123.2	130.8	-69.1	164.7	-158.5	176.8	18.3	121.7
1065	K	50	Low	41.8	Very low	180 Å²	180	156.3 Å²	156.3	78%	0.783	80%	0.796	S	S	*	*			trans	57.6	108.3	133.6	-60.4	178.8	179.2	-174.9	0	117.3
1066	Y	45.6	Very low	42.1	Very low	304 Å²	304	149.1 Å²	149.1	100%	1.192	79%	0.787	S	S	*	*				-140.8	0	87	-108	-80.3	0	0	0	110.7

Retrieved 1,066 of 1,066 residues in 2499.4 ms (Link to these results)

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