A0A5K4FCF2_SCHMA Loading...

DC_STAMP domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FCF2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,007 aa.

						>A0A5K4FCF2_SCHMA|A0A5K4FCF2
MATLPSCMYWTFTNSGLLIQDWLLKPVRPINLNDAINQYYLSSIIDTKNQLSNTIKKLNENTTTTNHHHNDSIQQIIQIMFYFSLPLLPAITMLLSMINIFIEFKYYIYSKYLLYIRPYIYRLSHYFIVFYILTCINSFIIWLIILPRYIPMSIGYYNIITNEFHWNDTSIYMNISSSSSSSSNNHTPKYLTQLPAILTMQIVLRLTLCWLIIGLLTNRIYILNELYINPLKKSFGYYINYLYTMVKENLYDDHCYNNNTTTTNNNNSNNGTLLNDRSNTNKQYNHPLNSIFQCLFKFGANLCSIKKCPIKSCPICKQLNYNWSVEYLCFKCKPNYYHNNTNLLNHQIIQKNQKNNPIYLSSIINMKKINYKTIGYLILIISLLITCLLLICLPQIWSYQLIGMNLKIKLFNQYTTTTNTEHMSSISSSNHEKYYPAWRLLNKTGQTIYEYCFAVIHFVIPCCTMIVTVLLLIIRLIKIKYELKSIILHNINMNKKDIKLYMNIIQYCIIYLIQDSVLILMMGIIQLCCTIPYLMINSIHRLECLLINNQSRNGFMPTSPVAVGATVAAGATAAAAVTSKDDLIWPTRQNWLFIEMNYLFGDFLIQLIILSINLCDTNHLLIRNYSIENFQKIYLSNINRNKQNYHRIQCQMNDVMKFQEMENHQDAQQRDNDDDDNDGSDDDGGEDDHHHHDIDEDDDDDNNNLHDDMNIENGVRKKFYTYRMKTPTDSGQTSKNISPLPISHTISDVLLSPKFRTKQTIYRLNQQNRIHRSIPSTLPSPLLQRIPEMINYDTSHHHNYHHQQQQQRNNNCNSFTTKYPTNSYVEPKTNMASLTYSPRSRHPCRLQNKILLHDSSKTINNNNNSTSIHMSNPSSLIQSTKLITTPNMNLTRIQQNRQIRNNSPPPLPPPPKHLIQMLGGDSSIYSTPHGSPQQVNTHKLMILNNSNSNTPNNNISVDYSPDLLHVSSISKHESSTTGSFRQTDSGVTNMGGSLIDSEQYEPNTIVT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.9	Very low	27.8	Very low	194 Å²	194	144.4 Å²	144.4	96%	0.956	78%	0.777	S	S	*	*				0	90.8	0	-59	168	177.9	0	0	106.2
2	A	26.2	Very low	28	Very low	88 Å²	88	148.9 Å²	148.9	73%	0.727	79%	0.785	S	S	*	*			cis	59.9	121.5	22.5	0	0	0	0	0	112.6
3	T	30.6	Very low	27.7	Very low	137 Å²	137	143.2 Å²	143.2	84%	0.84	76%	0.76	S	S	*	*			trans	61.6	64.6	-178.9	66.9	0	0	0	0	117.7
4	L	26.8	Very low	27.7	Very low	143 Å²	143	144.6 Å²	144.6	75%	0.749	77%	0.768	S	S	*	*			trans	-138.2	78.7	155.3	-111.6	168.3	0	0	0	110.5	S6	L4-S6 PolarHBondContact O-N 3.42Å
5	P	26.4	Very low	27.9	Very low	125 Å²	125	140.4 Å²	140.4	81%	0.812	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	84.9	-178.3	34.3	-32.2	0	0	0	111.2
6	S	31	Very low	28	Very low	97 Å²	97	133.9 Å²	133.9	68%	0.678	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-171	-26.7	168.4	35.8	0	0	0	0	115.3	L4 M8	L4-S6 PolarHBondContact O-N 3.42Å; S6-M8 PolarHBondContact O-N 2.89Å
7	C	28.5	Very low	28.1	Very low	105 Å²	105	133.2 Å²	133.2	71%	0.709	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	17.8	-166.8	-58.8	0	0	0	0	116.8
8	M	26.8	Very low	28.3	Very low	169 Å²	169	133.4 Å²	133.4	83%	0.833	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	3.1	-173.1	-155.6	165.9	173	0	0	115.1	S6	S6-M8 PolarHBondContact O-N 2.89Å
9	Y	25.7	Very low	28.8	Very low	185 Å²	185	131.1 Å²	131.1	73%	0.725	71%	0.711	S	S	*	*			trans	-126.7	44.4	-172.7	-90.1	-80.3	0	0	0	114.8
10	W	28.9	Very low	29	Very low	257 Å²	257	130.8 Å²	130.8	97%	0.973	71%	0.705	S	S	*	*			trans	-115.4	24.2	158.9	-88.7	62.3	0	0	0	112.2
11	T	25.5	Very low	29.2	Very low	88 Å²	88	128.7 Å²	128.7	54%	0.54	69%	0.693	S	S	.	*	S	Bend	trans	-66.7	141.4	152.3	42.3	0	0	0	0	108.8	T13	T11-T13 PolarHBondContact O-N 3.11Å; T11-T13 PolarHBondContact O-OG1 2.94Å
12	F	29.2	Very low	29.7	Very low	199 Å²	199	125 Å²	125	87%	0.873	67%	0.669	S	S	*	*			trans	-68.5	71.5	-176.1	-75.8	-105.2	0	0	0	112.5
13	T	24.8	Very low	30.2	Very low	75 Å²	75	126.7 Å²	126.7	46%	0.46	67%	0.665	S	S	.	*			trans	-103.6	108.9	-178.7	54.8	0	0	0	0	111.4	T11 S15	T11-T13 PolarHBondContact O-N 3.11Å; T11-T13 PolarHBondContact O-OG1 2.94Å; T13-S15 PolarHBondContact O-N 3.2Å
14	N	28.1	Very low	30.4	Very low	163 Å²	163	126.3 Å²	126.3	87%	0.872	66%	0.657	S	S	*	*	S	Bend	trans	58	-9.2	167	-66.6	-2.5	0	0	0	120.1	G16	N14-G16 PolarHBondContact O-N 3.3Å
15	S	29.6	Very low	30.9	Very low	81 Å²	81	126.8 Å²	126.8	57%	0.566	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	3.3	169.5	55.3	0	0	0	0	114.3	T13 L17 L18	T13-S15 PolarHBondContact O-N 3.2Å; S15-L17 VanDerWaalsContact C-N 3.26Å; S15-L17 PolarHBondContact O-N 3.24Å; S15-L18 PolarHBondContact O-N 2.87Å
16	G	29.9	Very low	31.5	Very low	37 Å²	37	123.7 Å²	123.7	38%	0.381	63%	0.633	S	S	.	*	H	α-helix	trans	-63	-19.7	-175	0	0	0	0	0	116.1	N14 L18 I19 Q20	N14-G16 PolarHBondContact O-N 3.3Å; G16-L18 PolarHBondContact O-N 2.81Å; G16-I19 PolarHBondContact O-N 3.08Å; G16-Q20 PolarHBondContact O-N 2.99Å
17	L	29.5	Very low	31.9	Very low	121 Å²	121	124.1 Å²	124.1	63%	0.634	63%	0.631	S	S	*	*	H	α-helix	trans	-60.6	-43.7	177.4	-103	105.3	0	0	0	112.5	S15 I19 Q20 D21	S15-L17 VanDerWaalsContact C-N 3.26Å; S15-L17 PolarHBondContact O-N 3.24Å; L17-I19 VanDerWaalsContact C-N 3.26Å; L17-I19 PolarHBondContact O-N 3.08Å; L17-Q20 PolarHBondContact O-N 3.16Å; L17-D21 PolarHBondContact O-N 3.43Å
18	L	32.5	Very low	32.2	Very low	137 Å²	137	129.4 Å²	129.4	72%	0.717	64%	0.636	S	S	*	*	H	α-helix	trans	-63.3	-33.3	-178.9	-94.2	162	0	0	0	112.6	S15 G16 W22	S15-L18 PolarHBondContact O-N 2.87Å; G16-L18 PolarHBondContact O-N 2.81Å; L18-W22 WeakPolarHBondContact O-CB 3.23Å; L18-W22 PolarHBondContact O-N 2.76Å
19	I	36.8	Very low	32.8	Very low	90 Å²	90	125.8 Å²	125.8	46%	0.462	63%	0.625	S	S	.	*	H	α-helix	trans	-80.7	-38.6	177.9	-63.5	174.7	0	0	0	110.7	G16 L17 W22 L23	G16-I19 PolarHBondContact O-N 3.08Å; L17-I19 VanDerWaalsContact C-N 3.26Å; L17-I19 PolarHBondContact O-N 3.08Å; I19-W22 PolarHBondContact O-N 2.95Å; I19-L23 HydrophobicContact CG2-CD1 3.73Å; I19-L23 WeakPolarHBondContact O-CB 3.21Å; I19-L23 PolarHBondContact O-N 3.22Å
20	Q	32.6	Very low	33.5	Very low	125 Å²	125	120.5 Å²	120.5	58%	0.584	61%	0.609	S	S	*	*	H	α-helix	trans	-63.1	-46.5	175	-96.2	-176.2	-36	0	0	112.2	G16 L17 W22 L23 L24	G16-Q20 PolarHBondContact O-N 2.99Å; L17-Q20 PolarHBondContact O-N 3.16Å; Q20-W22 PolarHBondContact O-N 3.27Å; Q20-L23 PolarHBondContact O-N 3.37Å; Q20-L24 HydrophobicContact CB-CD1 4.3Å; Q20-L24 HydrophobicContact CG-CD1 4.47Å; Q20-L24 VanDerWaalsContact O-CB 3.26Å; Q20-L24 WeakPolarHBondContact O-CB 3.14Å; Q20-L24 WeakPolarHBondContact O-CD1 3.42Å; Q20-L24 WeakPolarHBondContact O-CG 3.3Å; Q20-L24 PolarHBondContact O-N 3.16Å
21	D	34.7	Very low	34	Very low	87 Å²	87	112.1 Å²	112.1	47%	0.465	58%	0.583	S	S	.	*	H	α-helix	trans	-65.8	-37.5	178	-85.5	-40.5	0	0	0	112.1	L17 L23 L24 K25	L17-D21 PolarHBondContact O-N 3.43Å; D21-L23 PolarHBondContact O-N 2.88Å; D21-L24 PolarHBondContact O-N 3.29Å; D21-K25 PolarHBondContact O-N 2.86Å
22	W	39.3	Very low	34.8	Very low	117 Å²	117	111 Å²	111	44%	0.443	57%	0.573	S	S	.	*	H	α-helix	trans	-60.5	-40.3	172.6	-113	61.3	0	0	0	113.4	L18 I19 Q20 Y82 A196	L18-W22 WeakPolarHBondContact O-CB 3.23Å; L18-W22 PolarHBondContact O-N 2.76Å; I19-W22 PolarHBondContact O-N 2.95Å; Q20-W22 PolarHBondContact O-N 3.27Å; W22-Y82 HydrophobicContact CH2-CD2 4.2Å; W22-Y82 AromaticContact CH2-CE2 3.42Å; W22-Y82 HydrophobicContact CH2-CE2 3.42Å; W22-Y82 VanDerWaalsContact CH2-CE2 3.42Å; W22-Y82 AromaticContact CH2-CZ 3.74Å; W22-Y82 AromaticContact CZ2-CD2 3.76Å; W22-Y82 HydrophobicContact CZ2-CD2 3.76Å; W22-Y82 AromaticContact CZ2-CE2 3.28Å; W22-Y82 HydrophobicContact CZ2-CE2 3.28Å; W22-A196 HydrophobicContact CE3-CB 4.41Å; W22-A196 HydrophobicContact CZ3-CB 4.09Å
23	L	36.4	Very low	35.3	Very low	123 Å²	123	104.4 Å²	104.4	64%	0.644	55%	0.547	S	S	*	.	H	α-helix	trans	-79.3	-32.7	179.9	-97.5	134.6	0	0	0	113.3	I19 Q20 D21	I19-L23 HydrophobicContact CG2-CD1 3.73Å; I19-L23 WeakPolarHBondContact O-CB 3.21Å; I19-L23 PolarHBondContact O-N 3.22Å; Q20-L23 PolarHBondContact O-N 3.37Å; D21-L23 PolarHBondContact O-N 2.88Å
24	L	36	Very low	36.2	Very low	129 Å²	129	104.8 Å²	104.8	68%	0.675	55%	0.546	S	S	*	.	H	α-helix	trans	-89.6	-23.1	-176.5	-71.9	162.3	0	0	0	113.3	Q20 D21	Q20-L24 HydrophobicContact CB-CD1 4.3Å; Q20-L24 HydrophobicContact CG-CD1 4.47Å; Q20-L24 VanDerWaalsContact O-CB 3.26Å; Q20-L24 WeakPolarHBondContact O-CB 3.14Å; Q20-L24 WeakPolarHBondContact O-CD1 3.42Å; Q20-L24 WeakPolarHBondContact O-CG 3.3Å; Q20-L24 PolarHBondContact O-N 3.16Å; D21-L24 PolarHBondContact O-N 3.29Å
25	K	37.3	Very low	36.7	Very low	152 Å²	152	98.6 Å²	98.6	66%	0.661	52%	0.518	S	S	*	.	S	Bend	trans	-136.2	93	173.6	-70.3	176.3	-174.9	162.9	0	109.9	D21 V27	D21-K25 PolarHBondContact O-N 2.86Å; K25-V27 PolarHBondContact O-N 3.4Å; K25-V27 VanDerWaalsContact O-N 3.11Å
26	P	37.9	Very low	37.4	Very low	60 Å²	60	98.9 Å²	98.9	39%	0.39	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-57.1	123.1	164.5	25.3	-33	0	0	0	108.3	R28	P26-R28 PolarHBondContact O-N 2.8Å
27	V	41.1	Very low	37.9	Very low	106 Å²	106	99.8 Å²	99.8	64%	0.642	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-54.5	130.6	172.4	-179	0	0	0	0	107.1	K25	K25-V27 PolarHBondContact O-N 3.4Å; K25-V27 VanDerWaalsContact O-N 3.11Å
28	R	32.9	Very low	38.7	Very low	217 Å²	217	100.4 Å²	100.4	82%	0.819	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-52.5	142.3	179.7	-74.5	-178.3	178.8	173	-0.3	108.8	P26 I30	P26-R28 PolarHBondContact O-N 2.8Å; R28-I30 PolarHBondContact O-N 3.28Å
29	P	39.5	Very low	39.2	Very low	92 Å²	92	101.6 Å²	101.6	60%	0.597	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-54.8	116.7	171.4	25.6	-33.9	0	0	0	107.3	N31 T192	P29-N31 PolarHBondContact O-N 2.92Å; P29-T192 HydrophobicContact CB-CG2 4.36Å; P29-T192 HydrophobicContact CG-CG2 3.74Å
30	I	40.8	Very low	39.5	Very low	75 Å²	75	104.5 Å²	104.5	39%	0.385	51%	0.51	S	S	.	.			trans	-64.2	113.9	177.9	-64.1	174.5	0	0	0	105.2	R28 L32	R28-I30 PolarHBondContact O-N 3.28Å; I30-L32 PolarHBondContact O-N 3.47Å
31	N	40.2	Very low	40	Very low	81 Å²	81	103.4 Å²	103.4	43%	0.433	51%	0.508	S	S	.	.			trans	-71.3	87.1	174.8	-168.4	8.2	0	0	0	107.3	P29 N33 D34 A35	P29-N31 PolarHBondContact O-N 2.92Å; N31-N33 PolarHBondContact O-N 2.85Å; N31-N33 VanDerWaalsContact O-N 3.12Å; N31-N33 VanDerWaalsContact OD1-CB 3.23Å; N31-N33 WeakPolarHBondContact OD1-CB 3.41Å; N31-N33 PolarHBondContact OD1-N 3.27Å; N31-D34 HydrophobicContact CB-CB 4.11Å; N31-D34 PolarHBondContact ND2-OD1 2.84Å; N31-D34 PolarHBondContact ND2-OD2 3.08Å; N31-D34 WeakPolarHBondContact O-CA 3.46Å; N31-D34 PolarHBondContact O-N 2.95Å; N31-A35 PolarHBondContact O-N 2.96Å
32	L	41.8	Very low	40.5	Very low	64 Å²	64	101.8 Å²	101.8	34%	0.335	50%	0.503	S	S	.	.	H	α-helix	trans	-54.8	-26.9	175.1	-86.4	150.8	0	0	0	111	I30 A35 I36 P151	I30-L32 PolarHBondContact O-N 3.47Å; L32-A35 PolarHBondContact O-N 2.97Å; L32-I36 WeakPolarHBondContact O-CB 3.46Å; L32-I36 WeakPolarHBondContact O-CD1 3.42Å; L32-I36 WeakPolarHBondContact O-CG1 3.35Å; L32-I36 PolarHBondContact O-N 3.28Å; L32-P151 HydrophobicContact CB-CG 4.27Å; L32-P151 HydrophobicContact CD1-CG 4.4Å
33	N	40.4	Very low	40.9	Very low	60 Å²	60	98.6 Å²	98.6	32%	0.321	50%	0.499	S	S	.	.	H	α-helix	trans	-64.7	-39.4	171.2	-122.4	36.5	0	0	0	112.4	N31 N37	N31-N33 PolarHBondContact O-N 2.85Å; N31-N33 VanDerWaalsContact O-N 3.12Å; N31-N33 VanDerWaalsContact OD1-CB 3.23Å; N31-N33 WeakPolarHBondContact OD1-CB 3.41Å; N31-N33 PolarHBondContact OD1-N 3.27Å; N33-N37 WeakPolarHBondContact O-CB 3.46Å; N33-N37 PolarHBondContact O-N 3.49Å; N33-N37 PolarHBondContact O-ND2 3.31Å; N33-N37 VanDerWaalsContact O-ND2 3.11Å
34	D	42.6	Very low	41.2	Very low	84 Å²	84	96.4 Å²	96.4	45%	0.449	49%	0.487	S	S	.	.	H	α-helix	trans	-74.1	-37.2	174.6	-69.3	-24.2	0	0	0	111.9	N31 N37 Q38	N31-D34 HydrophobicContact CB-CB 4.11Å; N31-D34 PolarHBondContact ND2-OD1 2.84Å; N31-D34 PolarHBondContact ND2-OD2 3.08Å; N31-D34 WeakPolarHBondContact O-CA 3.46Å; N31-D34 PolarHBondContact O-N 2.95Å; D34-N37 PolarHBondContact O-N 2.77Å; D34-Q38 WeakPolarHBondContact O-CB 3.38Å; D34-Q38 VanDerWaalsContact O-CG 3.28Å; D34-Q38 WeakPolarHBondContact O-CG 3.45Å; D34-Q38 PolarHBondContact O-N 2.94Å
35	A	39.5	Very low	41.6	Very low	32 Å²	32	94.5 Å²	94.5	26%	0.264	48%	0.476	S	S	.	.	H	α-helix	trans	-66.7	-42.8	176.4	0	0	0	0	0	111.7	N31 L32 Q38 Y39	N31-A35 PolarHBondContact O-N 2.96Å; L32-A35 PolarHBondContact O-N 2.97Å; A35-Q38 PolarHBondContact O-N 3.2Å; A35-Y39 WeakPolarHBondContact O-CB 3.25Å; A35-Y39 PolarHBondContact O-N 2.79Å
36	I	43.4	Very low	41.9	Very low	87 Å²	87	91 Å²	91	45%	0.446	47%	0.465	S	S	.	.	H	α-helix	trans	-68.1	-43.5	173.6	-67.2	165.7	0	0	0	109.9	L32 Q38 Y39 Y40	L32-I36 WeakPolarHBondContact O-CB 3.46Å; L32-I36 WeakPolarHBondContact O-CD1 3.42Å; L32-I36 WeakPolarHBondContact O-CG1 3.35Å; L32-I36 PolarHBondContact O-N 3.28Å; I36-Q38 VanDerWaalsContact C-N 3.32Å; I36-Q38 PolarHBondContact O-N 3.41Å; I36-Y39 CarbonylContact O-C 3.6Å; I36-Y39 PolarHBondContact O-N 3.34Å; I36-Y39 VanDerWaalsContact O-N 3.15Å; I36-Y40 WeakPolarHBondContact O-CB 3.41Å; I36-Y40 PolarHBondContact O-N 2.83Å
37	N	41.3	Very low	42.2	Very low	56 Å²	56	93.4 Å²	93.4	30%	0.299	48%	0.479	S	S	.	.	H	α-helix	trans	-59.7	-40.1	174.3	-79	-24.1	0	0	0	111.9	N33 D34 Y40 L41	N33-N37 WeakPolarHBondContact O-CB 3.46Å; N33-N37 PolarHBondContact O-N 3.49Å; N33-N37 PolarHBondContact O-ND2 3.31Å; N33-N37 VanDerWaalsContact O-ND2 3.11Å; D34-N37 PolarHBondContact O-N 2.77Å; N37-Y40 PolarHBondContact O-N 2.93Å; N37-L41 VanDerWaalsContact O-CB 3.27Å; N37-L41 WeakPolarHBondContact O-CB 3.38Å; N37-L41 WeakPolarHBondContact O-CD1 3.34Å; N37-L41 PolarHBondContact O-N 3.44Å
38	Q	46.4	Very low	42.3	Very low	135 Å²	135	96.6 Å²	96.6	63%	0.631	48%	0.484	S	S	*	.	H	α-helix	trans	-67.3	-36.9	175.4	-76.6	178.4	3.2	0	0	112.2	D34 A35 I36 S42	D34-Q38 WeakPolarHBondContact O-CB 3.38Å; D34-Q38 VanDerWaalsContact O-CG 3.28Å; D34-Q38 WeakPolarHBondContact O-CG 3.45Å; D34-Q38 PolarHBondContact O-N 2.94Å; A35-Q38 PolarHBondContact O-N 3.2Å; I36-Q38 VanDerWaalsContact C-N 3.32Å; I36-Q38 PolarHBondContact O-N 3.41Å; Q38-S42 WeakPolarHBondContact O-CB 3.47Å; Q38-S42 PolarHBondContact O-N 2.91Å; Q38-S42 PolarHBondContact O-OG 3.43Å; Q38-S42 VanDerWaalsContact O-OG 3.08Å
39	Y	42.2	Very low	42.9	Very low	161 Å²	161	91.5 Å²	91.5	63%	0.631	47%	0.473	S	S	*	.	H	α-helix	trans	-72.9	-33	176.5	-152.9	-88.2	0	0	0	113	A35 I36 S42 S43	A35-Y39 WeakPolarHBondContact O-CB 3.25Å; A35-Y39 PolarHBondContact O-N 2.79Å; I36-Y39 CarbonylContact O-C 3.6Å; I36-Y39 PolarHBondContact O-N 3.34Å; I36-Y39 VanDerWaalsContact O-N 3.15Å; Y39-S42 PolarHBondContact O-OG 3.46Å; Y39-S42 VanDerWaalsContact O-OG 3.11Å; Y39-S43 WeakPolarHBondContact O-CB 3.43Å; Y39-S43 PolarHBondContact O-N 2.91Å; Y39-S43 PolarHBondContact O-OG 3.26Å
40	Y	43.3	Very low	43.1	Very low	151 Å²	151	90.7 Å²	90.7	59%	0.592	46%	0.461	S	S	*	.	H	α-helix	trans	-79.2	-38.3	174.6	-118.8	-98	0	0	0	112	I36 N37 S43 I44	I36-Y40 WeakPolarHBondContact O-CB 3.41Å; I36-Y40 PolarHBondContact O-N 2.83Å; N37-Y40 PolarHBondContact O-N 2.93Å; Y40-S43 WeakPolarHBondContact CA-OG 3.28Å; Y40-S43 PolarHBondContact O-OG 2.86Å; Y40-I44 HydrophobicContact CD1-CD1 3.6Å; Y40-I44 HydrophobicContact CD1-CG1 4.32Å; Y40-I44 HydrophobicContact CE1-CD1 4.03Å; Y40-I44 VanDerWaalsContact O-CB 3.28Å; Y40-I44 WeakPolarHBondContact O-CB 3.39Å; Y40-I44 VanDerWaalsContact O-CG1 3.27Å; Y40-I44 WeakPolarHBondContact O-CG1 3.45Å; Y40-I44 PolarHBondContact O-N 3.4Å
41	L	42.3	Very low	43.1	Very low	102 Å²	102	94 Å²	94	53%	0.534	48%	0.479	S	S	.	.	H	α-helix	trans	-65.8	-43.3	171.9	-95.8	81.6	0	0	0	111.2	N37 I44 I45	N37-L41 VanDerWaalsContact O-CB 3.27Å; N37-L41 WeakPolarHBondContact O-CB 3.38Å; N37-L41 WeakPolarHBondContact O-CD1 3.34Å; N37-L41 PolarHBondContact O-N 3.44Å; L41-I44 PolarHBondContact O-N 3.44Å; L41-I45 HydrophobicContact CB-CD1 4.18Å; L41-I45 HydrophobicContact CD2-CD1 4.29Å; L41-I45 HydrophobicContact CG-CD1 4.4Å; L41-I45 WeakPolarHBondContact O-CB 3.43Å; L41-I45 WeakPolarHBondContact O-CD1 3.45Å; L41-I45 WeakPolarHBondContact O-CG1 3.16Å; L41-I45 PolarHBondContact O-N 3.34Å
42	S	45.4	Very low	43.1	Very low	53 Å²	53	95 Å²	95	37%	0.371	49%	0.492	S	S	.	.	H	α-helix	trans	-62.2	-49.5	177.6	62.7	0	0	0	0	111.2	Q38 Y39 I44 I45 D46	Q38-S42 WeakPolarHBondContact O-CB 3.47Å; Q38-S42 PolarHBondContact O-N 2.91Å; Q38-S42 PolarHBondContact O-OG 3.43Å; Q38-S42 VanDerWaalsContact O-OG 3.08Å; Y39-S42 PolarHBondContact O-OG 3.46Å; Y39-S42 VanDerWaalsContact O-OG 3.11Å; S42-I44 PolarHBondContact O-N 3.33Å; S42-I45 PolarHBondContact O-N 2.78Å; S42-D46 VanDerWaalsContact O-CB 3.24Å; S42-D46 WeakPolarHBondContact O-CB 3.37Å; S42-D46 VanDerWaalsContact O-CG 3.23Å; S42-D46 PolarHBondContact O-N 3.47Å
43	S	47.8	Very low	43.3	Very low	50 Å²	50	96.8 Å²	96.8	35%	0.35	50%	0.502	S	S	.	.	H	α-helix	trans	-65.5	-32.1	179.5	54	0	0	0	0	114.4	Y39 Y40 T47	Y39-S43 WeakPolarHBondContact O-CB 3.43Å; Y39-S43 PolarHBondContact O-N 2.91Å; Y39-S43 PolarHBondContact O-OG 3.26Å; Y40-S43 WeakPolarHBondContact CA-OG 3.28Å; Y40-S43 PolarHBondContact O-OG 2.86Å; S43-T47 WeakPolarHBondContact O-CB 3.46Å; S43-T47 WeakPolarHBondContact O-CG2 3.46Å; S43-T47 PolarHBondContact O-N 3.28Å; S43-T47 PolarHBondContact O-OG1 2.8Å
44	I	43.6	Very low	43.5	Very low	77 Å²	77	95.5 Å²	95.5	40%	0.395	50%	0.496	S	S	.	.	H	α-helix	trans	-79.6	-37.1	175.7	-69.2	176.9	0	0	0	112.3	Y40 L41 S42 T47 K48	Y40-I44 HydrophobicContact CD1-CD1 3.6Å; Y40-I44 HydrophobicContact CD1-CG1 4.32Å; Y40-I44 HydrophobicContact CE1-CD1 4.03Å; Y40-I44 VanDerWaalsContact O-CB 3.28Å; Y40-I44 WeakPolarHBondContact O-CB 3.39Å; Y40-I44 VanDerWaalsContact O-CG1 3.27Å; Y40-I44 WeakPolarHBondContact O-CG1 3.45Å; Y40-I44 PolarHBondContact O-N 3.4Å; L41-I44 PolarHBondContact O-N 3.44Å; S42-I44 PolarHBondContact O-N 3.33Å; I44-T47 PolarHBondContact O-OG1 3.44Å; I44-K48 WeakPolarHBondContact O-CB 3.21Å; I44-K48 PolarHBondContact O-N 2.85Å
45	I	44.6	Very low	43.7	Very low	89 Å²	89	97.7 Å²	97.7	46%	0.456	51%	0.507	S	S	.	.	H	α-helix	trans	-70.4	-37.9	178.1	-68.4	168.2	0	0	0	110.3	L41 S42 T47 N49	L41-I45 HydrophobicContact CB-CD1 4.18Å; L41-I45 HydrophobicContact CD2-CD1 4.29Å; L41-I45 HydrophobicContact CG-CD1 4.4Å; L41-I45 WeakPolarHBondContact O-CB 3.43Å; L41-I45 WeakPolarHBondContact O-CD1 3.45Å; L41-I45 WeakPolarHBondContact O-CG1 3.16Å; L41-I45 PolarHBondContact O-N 3.34Å; S42-I45 PolarHBondContact O-N 2.78Å; I45-T47 VanDerWaalsContact C-N 3.35Å; I45-T47 PolarHBondContact O-N 3.11Å; I45-N49 PolarHBondContact O-N 2.84Å
46	D	44.2	Very low	43.8	Very low	80 Å²	80	104.7 Å²	104.7	43%	0.428	53%	0.531	S	S	.	.	H	α-helix	trans	-77	-17.9	179.6	-66.9	-9.8	0	0	0	113.6	S42 Q50	S42-D46 VanDerWaalsContact O-CB 3.24Å; S42-D46 WeakPolarHBondContact O-CB 3.37Å; S42-D46 VanDerWaalsContact O-CG 3.23Å; S42-D46 PolarHBondContact O-N 3.47Å; D46-Q50 VanDerWaalsContact CG-NE2 3.29Å; D46-Q50 WeakPolarHBondContact O-CB 3.3Å; D46-Q50 PolarHBondContact OD1-NE2 3.43Å
47	T	43.2	Very low	44	Very low	110 Å²	110	108.3 Å²	108.3	68%	0.675	54%	0.544	S	S	*	.	H	α-helix	trans	-90.9	-24.1	173.1	46.1	0	0	0	0	113.9	S43 I44 I45	S43-T47 WeakPolarHBondContact O-CB 3.46Å; S43-T47 WeakPolarHBondContact O-CG2 3.46Å; S43-T47 PolarHBondContact O-N 3.28Å; S43-T47 PolarHBondContact O-OG1 2.8Å; I44-T47 PolarHBondContact O-OG1 3.44Å; I45-T47 VanDerWaalsContact C-N 3.35Å; I45-T47 PolarHBondContact O-N 3.11Å
48	K	42.4	Very low	44	Very low	172 Å²	172	111.7 Å²	111.7	75%	0.748	56%	0.561	S	S	*	*	H	α-helix	trans	-103.5	-25.7	-172.9	-144.2	171.6	-172	177.1	0	115.8	I44	I44-K48 WeakPolarHBondContact O-CB 3.21Å; I44-K48 PolarHBondContact O-N 2.85Å
49	N	45.8	Very low	43.9	Very low	111 Å²	111	112.6 Å²	112.6	59%	0.594	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.7	-14.4	-178.3	-82.2	-31	0	0	0	115.2	I45	I45-N49 PolarHBondContact O-N 2.84Å
50	Q	43.8	Very low	44	Very low	75 Å²	75	112.3 Å²	112.3	35%	0.35	58%	0.575	S	S	.	*	H	α-helix	trans	-86.6	-30.6	-177.1	-74.2	-146.8	35.2	0	0	114.8	D46 S52 N53 T54	D46-Q50 VanDerWaalsContact CG-NE2 3.29Å; D46-Q50 WeakPolarHBondContact O-CB 3.3Å; D46-Q50 PolarHBondContact OD1-NE2 3.43Å; Q50-S52 VanDerWaalsContact C-N 3.27Å; Q50-S52 PolarHBondContact O-N 2.88Å; Q50-N53 PolarHBondContact O-N 2.82Å; Q50-T54 VanDerWaalsContact CA-OG1 3.29Å; Q50-T54 WeakPolarHBondContact CA-OG1 3.19Å; Q50-T54 WeakPolarHBondContact CB-OG1 3.38Å; Q50-T54 VanDerWaalsContact CG-OG1 3.27Å; Q50-T54 WeakPolarHBondContact CG-OG1 3.28Å; Q50-T54 WeakPolarHBondContact O-CA 3.3Å; Q50-T54 WeakPolarHBondContact O-CB 3.2Å; Q50-T54 PolarHBondContact O-N 3.39Å; Q50-T54 PolarHBondContact O-OG1 2.77Å; Q50-T54 VanDerWaalsContact O-OG1 3.09Å; Q50-T54 PolarHBondContact OE1-OG1 2.88Å
51	L	40.8	Very low	43.8	Very low	145 Å²	145	111.6 Å²	111.6	76%	0.759	58%	0.581	S	S	*	*	H	α-helix	trans	-64.1	-29.5	-174.3	-156.7	72.5	0	0	0	113.9	I55	L51-I55 WeakPolarHBondContact O-CD1 3.36Å
52	S	41.4	Very low	43.4	Very low	100 Å²	100	112.9 Å²	112.9	70%	0.699	59%	0.593	S	S	*	*	H	α-helix	trans	-94.7	-29.9	179	-171.2	0	0	0	0	114.1	Q50	Q50-S52 VanDerWaalsContact C-N 3.27Å; Q50-S52 PolarHBondContact O-N 2.88Å
53	N	44.3	Very low	43.1	Very low	102 Å²	102	116.8 Å²	116.8	55%	0.545	62%	0.615	S	S	.	*	H	α-helix	trans	-104.5	-23.9	-175.2	-75.2	-43.1	0	0	0	114.5	Q50 K56 K57	Q50-N53 PolarHBondContact O-N 2.82Å; N53-K56 PolarHBondContact O-N 3.46Å; N53-K57 PolarHBondContact O-N 2.93Å
54	T	45.3	Very low	42.9	Very low	34 Å²	34	120.2 Å²	120.2	21%	0.209	63%	0.634	C	S	.	*	T	Hydrogen-bonded Turn	trans	-77	-33.1	-179.6	-54.7	0	0	0	0	111.4	Q50 K56 K57 L58	Q50-T54 VanDerWaalsContact CA-OG1 3.29Å; Q50-T54 WeakPolarHBondContact CA-OG1 3.19Å; Q50-T54 WeakPolarHBondContact CB-OG1 3.38Å; Q50-T54 VanDerWaalsContact CG-OG1 3.27Å; Q50-T54 WeakPolarHBondContact CG-OG1 3.28Å; Q50-T54 WeakPolarHBondContact O-CA 3.3Å; Q50-T54 WeakPolarHBondContact O-CB 3.2Å; Q50-T54 PolarHBondContact O-N 3.39Å; Q50-T54 PolarHBondContact O-OG1 2.77Å; Q50-T54 VanDerWaalsContact O-OG1 3.09Å; Q50-T54 PolarHBondContact OE1-OG1 2.88Å; T54-K56 PolarHBondContact O-N 2.87Å; T54-K56 VanDerWaalsContact O-N 3.13Å; T54-K57 PolarHBondContact O-N 2.86Å; T54-L58 HydrophobicContact CG2-CB 4.43Å; T54-L58 HydrophobicContact CG2-CD1 3.63Å; T54-L58 WeakPolarHBondContact O-CB 3.36Å; T54-L58 PolarHBondContact O-N 3.47Å
55	I	46.8	Very low	42.9	Very low	129 Å²	129	122.1 Å²	122.1	66%	0.662	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-28.9	172.9	-61.5	178.5	0	0	0	111.9	L51	L51-I55 WeakPolarHBondContact O-CD1 3.36Å
56	K	42.4	Very low	42.7	Very low	180 Å²	180	124.4 Å²	124.4	78%	0.783	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-7.4	174.6	-83.8	-176.7	173.2	178.3	0	115.4	N53 T54	N53-K56 PolarHBondContact O-N 3.46Å; T54-K56 PolarHBondContact O-N 2.87Å; T54-K56 VanDerWaalsContact O-N 3.13Å
57	K	46.8	Very low	42.4	Very low	163 Å²	163	128 Å²	128	71%	0.709	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.9	-12.9	-179	-77.2	-172.9	173.2	-177.4	0	114.9	N53 T54 N59	N53-K57 PolarHBondContact O-N 2.93Å; T54-K57 PolarHBondContact O-N 2.86Å; K57-N59 PolarHBondContact O-N 2.81Å
58	L	41	Very low	42.2	Very low	127 Å²	127	130.1 Å²	130.1	67%	0.665	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-16.7	178.7	-147.7	83.7	0	0	0	113.3	T54	T54-L58 HydrophobicContact CG2-CB 4.43Å; T54-L58 HydrophobicContact CG2-CD1 3.63Å; T54-L58 WeakPolarHBondContact O-CB 3.36Å; T54-L58 PolarHBondContact O-N 3.47Å
59	N	43.9	Very low	42	Very low	153 Å²	153	127.9 Å²	127.9	82%	0.818	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-7.7	-177.6	-85.8	2.9	0	0	0	115.4	K57	K57-N59 PolarHBondContact O-N 2.81Å
60	E	44.4	Very low	41.8	Very low	156 Å²	156	127 Å²	127	73%	0.729	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.8	-15.4	-167	-70.8	-172.5	154.6	0	0	117
61	N	39.6	Very low	41.9	Very low	136 Å²	136	127.2 Å²	127.2	73%	0.727	67%	0.669	S	S	*	*			trans	-145.2	67.3	-176	-79.3	-73.2	0	0	0	114.8	T63	N61-T63 PolarHBondContact O-N 3.46Å
62	T	34.2	Very low	42.2	Very low	128 Å²	128	121.9 Å²	121.9	79%	0.785	64%	0.644	S	S	*	*			trans	-76.4	106	164.3	29.8	0	0	0	0	111.1
63	T	38.2	Very low	42.3	Very low	135 Å²	135	120.6 Å²	120.6	83%	0.828	63%	0.628	S	S	*	*	S	Bend	trans	-171.5	-17	155.5	10.9	0	0	0	0	117.4	N61	N61-T63 PolarHBondContact O-N 3.46Å
64	T	43.2	Very low	42.4	Very low	122 Å²	122	121.4 Å²	121.4	75%	0.748	63%	0.629	S	S	*	*	S	Bend	trans	-117.3	-0.1	-158.8	50.8	0	0	0	0	118.1
65	T	43.7	Very low	42.5	Very low	118 Å²	118	123.5 Å²	123.5	72%	0.724	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-12.5	-169	45.1	0	0	0	0	116.6	H67	T65-H67 VanDerWaalsContact C-N 3.33Å; T65-H67 PolarHBondContact O-N 3.05Å
66	N	40.3	Very low	42.6	Very low	137 Å²	137	122.2 Å²	122.2	73%	0.733	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-11.1	-170.6	-75.6	-8.8	0	0	0	115.9
67	H	39.4	Very low	42.9	Very low	155 Å²	155	117 Å²	117	72%	0.718	61%	0.61	S	S	*	*	H	α-helix	trans	-77.7	-31.2	-173	-123	-46.9	0	0	0	114	T65 H69	T65-H67 VanDerWaalsContact C-N 3.33Å; T65-H67 PolarHBondContact O-N 3.05Å; H67-H69 PolarHBondContact O-N 3.28Å
68	H	39.2	Very low	43.1	Very low	154 Å²	154	115 Å²	115	71%	0.713	60%	0.603	S	S	*	*	H	α-helix	trans	-78.9	-20.2	-169.1	-130.7	-43	0	0	0	114.3
69	H	36.6	Very low	43.6	Very low	126 Å²	126	111.9 Å²	111.9	58%	0.583	59%	0.587	S	S	*	*	H	α-helix	trans	-83.7	-29.9	-177.7	-155.5	48.2	0	0	0	112.6	H67 D71 S72 I73	H67-H69 PolarHBondContact O-N 3.28Å; H69-D71 VanDerWaalsContact C-N 3.35Å; H69-D71 PolarHBondContact O-N 3.43Å; H69-S72 PolarHBondContact O-N 2.89Å; H69-S72 PolarHBondContact O-OG 3.49Å; H69-I73 PolarHBondContact O-N 3.1Å
70	N	42.5	Very low	43.8	Very low	91 Å²	91	110.4 Å²	110.4	49%	0.487	58%	0.576	S	S	.	*	H	α-helix	trans	-67.3	-34	178.8	-77.4	-21.1	0	0	0	112.7	S72 I73 Q74	N70-S72 PolarHBondContact O-N 2.87Å; N70-I73 PolarHBondContact O-N 2.87Å; N70-Q74 WeakPolarHBondContact O-CB 3.44Å; N70-Q74 WeakPolarHBondContact O-CG 3.45Å; N70-Q74 PolarHBondContact O-N 2.85Å
71	D	45.5	Very low	44.1	Very low	80 Å²	80	109.4 Å²	109.4	43%	0.428	57%	0.569	S	S	.	*	H	α-helix	trans	-66.4	-37.3	179.7	-73.8	-3.2	0	0	0	112.4	H69 Q75	H69-D71 VanDerWaalsContact C-N 3.35Å; H69-D71 PolarHBondContact O-N 3.43Å; D71-Q75 VanDerWaalsContact O-CG 3.25Å; D71-Q75 WeakPolarHBondContact O-CG 3.38Å; D71-Q75 PolarHBondContact O-N 3.44Å
72	S	46.7	Very low	44.6	Very low	33 Å²	33	107.8 Å²	107.8	23%	0.231	55%	0.554	C	S	.	*	H	α-helix	trans	-70.9	-39.8	177.6	64.8	0	0	0	0	111.6	H69 N70 Q75 I76	H69-S72 PolarHBondContact O-N 2.89Å; H69-S72 PolarHBondContact O-OG 3.49Å; N70-S72 PolarHBondContact O-N 2.87Å; S72-Q75 PolarHBondContact O-N 3.42Å; S72-I76 WeakPolarHBondContact O-CG1 3.11Å; S72-I76 PolarHBondContact O-N 3.47Å
73	I	45.2	Very low	45.4	Very low	73 Å²	73	105.9 Å²	105.9	37%	0.374	54%	0.535	S	S	.	.	H	α-helix	trans	-65.6	-42.3	175	-64.2	170.9	0	0	0	110.6	H69 N70 Q75 I76 I77	H69-I73 PolarHBondContact O-N 3.1Å; N70-I73 PolarHBondContact O-N 2.87Å; I73-Q75 PolarHBondContact O-N 3.47Å; I73-I76 PolarHBondContact O-N 3.42Å; I73-I77 HydrophobicContact CG2-CD1 3.72Å; I73-I77 HydrophobicContact CG2-CG1 4.4Å; I73-I77 WeakPolarHBondContact O-CB 3.35Å; I73-I77 VanDerWaalsContact O-CG1 3.28Å; I73-I77 WeakPolarHBondContact O-CG1 3.34Å; I73-I77 PolarHBondContact O-N 3.28Å
74	Q	46.1	Very low	46.2	Very low	120 Å²	120	101.9 Å²	101.9	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-62.6	-38.9	174.6	-78.6	-170	-1.1	0	0	112.7	N70 I77 Q78	N70-Q74 WeakPolarHBondContact O-CB 3.44Å; N70-Q74 WeakPolarHBondContact O-CG 3.45Å; N70-Q74 PolarHBondContact O-N 2.85Å; Q74-I77 PolarHBondContact O-N 3.46Å; Q74-Q78 WeakPolarHBondContact O-CB 3.18Å; Q74-Q78 WeakPolarHBondContact O-CG 3.43Å; Q74-Q78 PolarHBondContact O-N 3.5Å
75	Q	47.2	Very low	46.8	Very low	77 Å²	77	102 Å²	102	36%	0.36	51%	0.508	S	S	.	.	H	α-helix	trans	-65.7	-43.1	175.5	-73.6	171.3	39.3	0	0	111.9	D71 S72 I73 I77 Q78 I79	D71-Q75 VanDerWaalsContact O-CG 3.25Å; D71-Q75 WeakPolarHBondContact O-CG 3.38Å; D71-Q75 PolarHBondContact O-N 3.44Å; S72-Q75 PolarHBondContact O-N 3.42Å; I73-Q75 PolarHBondContact O-N 3.47Å; Q75-I77 PolarHBondContact O-N 3.37Å; Q75-Q78 PolarHBondContact O-N 3.29Å; Q75-I79 WeakPolarHBondContact O-CB 3.28Å; Q75-I79 WeakPolarHBondContact O-CD1 3.37Å; Q75-I79 VanDerWaalsContact O-CG1 3.26Å; Q75-I79 WeakPolarHBondContact O-CG1 3.33Å; Q75-I79 PolarHBondContact O-N 3.35Å
76	I	49.2	Very low	47.4	Very low	102 Å²	102	98.2 Å²	98.2	52%	0.523	49%	0.485	S	S	.	.	H	α-helix	trans	-63.2	-41.4	175.5	-67.8	164.9	0	0	0	111.1	S72 I73 I79 M80	S72-I76 WeakPolarHBondContact O-CG1 3.11Å; S72-I76 PolarHBondContact O-N 3.47Å; I73-I76 PolarHBondContact O-N 3.42Å; I76-I79 WeakPolarHBondContact O-CB 3.23Å; I76-I79 PolarHBondContact O-N 2.79Å; I76-M80 WeakPolarHBondContact O-CG 3.35Å; I76-M80 PolarHBondContact O-N 3.05Å
77	I	48.5	Very low	48.1	Very low	72 Å²	72	95.2 Å²	95.2	37%	0.369	47%	0.469	S	S	.	.	H	α-helix	trans	-67.1	-43.3	176.7	-70.8	171.5	0	0	0	111.2	I73 Q74 Q75 I79 M80 F81	I73-I77 HydrophobicContact CG2-CD1 3.72Å; I73-I77 HydrophobicContact CG2-CG1 4.4Å; I73-I77 WeakPolarHBondContact O-CB 3.35Å; I73-I77 VanDerWaalsContact O-CG1 3.28Å; I73-I77 WeakPolarHBondContact O-CG1 3.34Å; I73-I77 PolarHBondContact O-N 3.28Å; Q74-I77 PolarHBondContact O-N 3.46Å; Q75-I77 PolarHBondContact O-N 3.37Å; I77-I79 VanDerWaalsContact C-N 3.31Å; I77-I79 PolarHBondContact O-N 2.91Å; I77-M80 PolarHBondContact O-N 3.17Å; I77-F81 HydrophobicContact CG2-CD2 3.65Å; I77-F81 HydrophobicContact CG2-CE2 3.74Å; I77-F81 WeakPolarHBondContact O-CD2 3.41Å; I77-F81 PolarHBondContact O-N 3.43Å
78	Q	50.3	Low	48.8	Very low	121 Å²	121	93.4 Å²	93.4	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-60.3	-41.3	173.8	-81	-175.2	-9.5	0	0	111.8	Q74 Q75 F81 Y82	Q74-Q78 WeakPolarHBondContact O-CB 3.18Å; Q74-Q78 WeakPolarHBondContact O-CG 3.43Å; Q74-Q78 PolarHBondContact O-N 3.5Å; Q75-Q78 PolarHBondContact O-N 3.29Å; Q78-F81 PolarHBondContact O-N 3.01Å; Q78-Y82 VanDerWaalsContact O-CB 3.29Å; Q78-Y82 WeakPolarHBondContact O-CB 3.33Å; Q78-Y82 PolarHBondContact O-N 3.31Å
79	I	52.6	Low	49.5	Very low	61 Å²	61	88.3 Å²	88.3	31%	0.313	44%	0.444	S	S	.	.	H	α-helix	trans	-57.2	-52	172.2	-79.1	167	0	0	0	110.2	Q75 I76 I77 F81 Y82 F83	Q75-I79 WeakPolarHBondContact O-CB 3.28Å; Q75-I79 WeakPolarHBondContact O-CD1 3.37Å; Q75-I79 VanDerWaalsContact O-CG1 3.26Å; Q75-I79 WeakPolarHBondContact O-CG1 3.33Å; Q75-I79 PolarHBondContact O-N 3.35Å; I76-I79 WeakPolarHBondContact O-CB 3.23Å; I76-I79 PolarHBondContact O-N 2.79Å; I77-I79 VanDerWaalsContact C-N 3.31Å; I77-I79 PolarHBondContact O-N 2.91Å; I79-F81 PolarHBondContact O-N 3.29Å; I79-Y82 PolarHBondContact O-N 3.35Å; I79-F83 HydrophobicContact CG2-CD2 3.82Å; I79-F83 HydrophobicContact CG2-CE2 3.89Å; I79-F83 WeakPolarHBondContact O-CD2 3.44Å; I79-F83 PolarHBondContact O-N 3.46Å
80	M	47.4	Very low	50.2	Low	121 Å²	121	84.2 Å²	84.2	60%	0.596	43%	0.433	S	S	*	.	H	α-helix	trans	-60.5	-40.9	177.7	-67.7	-148.3	-49.9	0	0	113.1	I76 I77 F83 S84	I76-M80 WeakPolarHBondContact O-CG 3.35Å; I76-M80 PolarHBondContact O-N 3.05Å; I77-M80 PolarHBondContact O-N 3.17Å; M80-F83 PolarHBondContact O-N 3.3Å; M80-S84 VanDerWaalsContact O-CB 3.28Å; M80-S84 WeakPolarHBondContact O-CB 3.33Å; M80-S84 PolarHBondContact O-N 3.02Å; M80-S84 PolarHBondContact O-OG 2.9Å
81	F	50.4	Low	50.9	Low	135 Å²	135	83.9 Å²	83.9	59%	0.592	43%	0.43	S	S	*	.	H	α-helix	trans	-67.2	-39.6	176.6	-87.9	-72.5	0	0	0	112.2	I77 Q78 I79 F83 S84 L85	I77-F81 HydrophobicContact CG2-CD2 3.65Å; I77-F81 HydrophobicContact CG2-CE2 3.74Å; I77-F81 WeakPolarHBondContact O-CD2 3.41Å; I77-F81 PolarHBondContact O-N 3.43Å; Q78-F81 PolarHBondContact O-N 3.01Å; I79-F81 PolarHBondContact O-N 3.29Å; F81-F83 VanDerWaalsContact C-N 3.33Å; F81-F83 PolarHBondContact O-N 3.47Å; F81-S84 WeakPolarHBondContact CA-OG 3.16Å; F81-S84 PolarHBondContact O-N 3.04Å; F81-S84 PolarHBondContact O-OG 2.91Å; F81-L85 WeakPolarHBondContact O-CB 3.42Å; F81-L85 PolarHBondContact O-N 3Å
82	Y	50.6	Low	51.3	Low	103 Å²	103	83.8 Å²	83.8	40%	0.404	43%	0.432	S	S	.	.	H	α-helix	trans	-62.2	-39.4	176	-161.4	-80.2	0	0	0	111.9	W22 Q78 I79 P86	W22-Y82 HydrophobicContact CH2-CD2 4.2Å; W22-Y82 AromaticContact CH2-CE2 3.42Å; W22-Y82 HydrophobicContact CH2-CE2 3.42Å; W22-Y82 VanDerWaalsContact CH2-CE2 3.42Å; W22-Y82 AromaticContact CH2-CZ 3.74Å; W22-Y82 AromaticContact CZ2-CD2 3.76Å; W22-Y82 HydrophobicContact CZ2-CD2 3.76Å; W22-Y82 AromaticContact CZ2-CE2 3.28Å; W22-Y82 HydrophobicContact CZ2-CE2 3.28Å; Q78-Y82 VanDerWaalsContact O-CB 3.29Å; Q78-Y82 WeakPolarHBondContact O-CB 3.33Å; Q78-Y82 PolarHBondContact O-N 3.31Å; I79-Y82 PolarHBondContact O-N 3.35Å; Y82-P86 WeakPolarHBondContact O-CD 3.35Å
83	F	50.8	Low	51.6	Low	88 Å²	88	83 Å²	83	39%	0.386	43%	0.425	S	S	.	.	H	α-helix	trans	-81.2	-26.1	179	-74.8	-64.3	0	0	0	114.6	I79 M80 F81 W142	I79-F83 HydrophobicContact CG2-CD2 3.82Å; I79-F83 HydrophobicContact CG2-CE2 3.89Å; I79-F83 WeakPolarHBondContact O-CD2 3.44Å; I79-F83 PolarHBondContact O-N 3.46Å; M80-F83 PolarHBondContact O-N 3.3Å; F81-F83 VanDerWaalsContact C-N 3.33Å; F81-F83 PolarHBondContact O-N 3.47Å; F83-W142 HydrophobicContact CD1-CZ2 4.24Å
84	S	55.5	Low	52.1	Low	51 Å²	51	84 Å²	84	36%	0.357	43%	0.43	S	S	.	.	H	α-helix	trans	-90.8	-26.8	-178.7	56.9	0	0	0	0	114.7	M80 F81 L87 L88	M80-S84 VanDerWaalsContact O-CB 3.28Å; M80-S84 WeakPolarHBondContact O-CB 3.33Å; M80-S84 PolarHBondContact O-N 3.02Å; M80-S84 PolarHBondContact O-OG 2.9Å; F81-S84 WeakPolarHBondContact CA-OG 3.16Å; F81-S84 PolarHBondContact O-N 3.04Å; F81-S84 PolarHBondContact O-OG 2.91Å; S84-L87 VanDerWaalsContact O-CB 3.29Å; S84-L87 WeakPolarHBondContact O-CB 3.42Å; S84-L87 PolarHBondContact O-N 3.49Å; S84-L88 PolarHBondContact O-N 3.27Å
85	L	55	Low	52.7	Low	124 Å²	124	82.5 Å²	82.5	65%	0.649	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-41.6	-180	-138.4	80.9	0	0	0	114	F81 L87 P89	F81-L85 WeakPolarHBondContact O-CB 3.42Å; F81-L85 PolarHBondContact O-N 3Å; L85-L87 VanDerWaalsContact C-N 3.25Å; L85-L87 PolarHBondContact O-N 3.18Å; L85-P89 WeakPolarHBondContact O-CD 3.18Å
86	P	55.4	Low	53	Low	39 Å²	39	80.3 Å²	80.3	25%	0.253	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-17.3	176.8	-19.2	33.8	0	0	0	114.3	Y82	Y82-P86 WeakPolarHBondContact O-CD 3.35Å
87	L	55	Low	53.3	Low	74 Å²	74	77.3 Å²	77.3	39%	0.387	40%	0.403	S	S	.	.	H	α-helix	trans	-80.1	-30	-180	-142.4	81.3	0	0	0	112	S84 L85 A90 I91	S84-L87 VanDerWaalsContact O-CB 3.29Å; S84-L87 WeakPolarHBondContact O-CB 3.42Å; S84-L87 PolarHBondContact O-N 3.49Å; L85-L87 VanDerWaalsContact C-N 3.25Å; L85-L87 PolarHBondContact O-N 3.18Å; L87-A90 PolarHBondContact O-N 3.31Å; L87-A90 VanDerWaalsContact O-N 3.17Å; L87-I91 HydrophobicContact CD2-CD1 4.04Å; L87-I91 HydrophobicContact CG-CD1 4.28Å; L87-I91 WeakPolarHBondContact O-CG1 3.4Å; L87-I91 PolarHBondContact O-N 3.47Å
88	L	55	Low	53.7	Low	117 Å²	117	77.6 Å²	77.6	61%	0.613	41%	0.405	S	S	*	.	H	α-helix	trans	-59.5	-45.9	-179.3	-128.8	90.4	0	0	0	113.3	S84 A90 I91 T92	S84-L88 PolarHBondContact O-N 3.27Å; L88-A90 VanDerWaalsContact C-N 3.33Å; L88-A90 PolarHBondContact O-N 3.12Å; L88-I91 PolarHBondContact O-N 3.46Å; L88-T92 WeakPolarHBondContact O-CB 3.27Å; L88-T92 WeakPolarHBondContact O-CG2 3.46Å; L88-T92 PolarHBondContact O-N 3.12Å; L88-T92 PolarHBondContact O-OG1 3.44Å
89	P	53.7	Low	54	Low	46 Å²	46	76.5 Å²	76.5	30%	0.299	40%	0.403	S	S	.	.	H	α-helix	trans	-60.5	-38	173.2	-26.6	36.7	0	0	0	113.3	L85 T92 M93 L206	L85-P89 WeakPolarHBondContact O-CD 3.18Å; P89-T92 VanDerWaalsContact CA-OG1 3.31Å; P89-T92 WeakPolarHBondContact CA-OG1 3.16Å; P89-T92 PolarHBondContact O-OG1 3.34Å; P89-T92 VanDerWaalsContact O-OG1 3.06Å; P89-M93 WeakPolarHBondContact O-CB 3.22Å; P89-M93 WeakPolarHBondContact O-CG 3.45Å; P89-M93 PolarHBondContact O-N 3.37Å; P89-L206 HydrophobicContact CB-CD1 4.19Å
90	A	52.3	Low	54.1	Low	41 Å²	41	76.1 Å²	76.1	34%	0.339	40%	0.401	S	S	.	.	H	α-helix	trans	-67.4	-43.5	178.8	0	0	0	0	0	111.9	L87 L88 M93 L94	L87-A90 PolarHBondContact O-N 3.31Å; L87-A90 VanDerWaalsContact O-N 3.17Å; L88-A90 VanDerWaalsContact C-N 3.33Å; L88-A90 PolarHBondContact O-N 3.12Å; A90-M93 PolarHBondContact O-N 3.28Å; A90-L94 WeakPolarHBondContact O-CB 3.41Å; A90-L94 PolarHBondContact O-N 3.36Å
91	I	56.1	Low	54.3	Low	84 Å²	84	75.7 Å²	75.7	43%	0.431	40%	0.396	S	S	.	.	H	α-helix	trans	-66.6	-43.5	177.2	-68	168.8	0	0	0	111.2	L87 L88 M93 L94 L95	L87-I91 HydrophobicContact CD2-CD1 4.04Å; L87-I91 HydrophobicContact CG-CD1 4.28Å; L87-I91 WeakPolarHBondContact O-CG1 3.4Å; L87-I91 PolarHBondContact O-N 3.47Å; L88-I91 PolarHBondContact O-N 3.46Å; I91-M93 PolarHBondContact O-N 2.97Å; I91-L94 WeakPolarHBondContact O-CB 3.49Å; I91-L94 PolarHBondContact O-N 3.49Å; I91-L95 HydrophobicContact CG2-CD1 3.97Å; I91-L95 WeakPolarHBondContact O-CG 3.1Å; I91-L95 PolarHBondContact O-N 3.46Å
92	T	55	Low	54.5	Low	77 Å²	77	73.1 Å²	73.1	47%	0.472	39%	0.388	S	S	.	.	H	α-helix	trans	-66.6	-35.6	178	48.9	0	0	0	0	112.5	L88 P89 S96	L88-T92 WeakPolarHBondContact O-CB 3.27Å; L88-T92 WeakPolarHBondContact O-CG2 3.46Å; L88-T92 PolarHBondContact O-N 3.12Å; L88-T92 PolarHBondContact O-OG1 3.44Å; P89-T92 VanDerWaalsContact CA-OG1 3.31Å; P89-T92 WeakPolarHBondContact CA-OG1 3.16Å; P89-T92 PolarHBondContact O-OG1 3.34Å; P89-T92 VanDerWaalsContact O-OG1 3.06Å; T92-S96 WeakPolarHBondContact O-CB 3.47Å; T92-S96 PolarHBondContact O-N 3.22Å
93	M	52.8	Low	54.6	Low	17 Å²	17	74.2 Å²	74.2	8%	0.084	40%	0.396	C	S	.	.	H	α-helix	trans	-67.8	-41.3	170.8	-71.9	-162.1	-165.9	0	0	112.6	P89 A90 I91 L95 S96 M97 Y131 L206 W210	P89-M93 WeakPolarHBondContact O-CB 3.22Å; P89-M93 WeakPolarHBondContact O-CG 3.45Å; P89-M93 PolarHBondContact O-N 3.37Å; A90-M93 PolarHBondContact O-N 3.28Å; I91-M93 PolarHBondContact O-N 2.97Å; M93-L95 VanDerWaalsContact C-N 3.35Å; M93-L95 PolarHBondContact O-N 3.19Å; M93-S96 WeakPolarHBondContact CA-OG 3.24Å; M93-S96 PolarHBondContact O-N 3.08Å; M93-S96 PolarHBondContact O-OG 2.89Å; M93-M97 WeakPolarHBondContact O-CG 3.49Å; M93-M97 PolarHBondContact O-N 3.25Å; M93-Y131 WeakPolarHBondContact CB-OH 3.02Å; M93-L206 HydrophobicContact CE-CB 3.99Å; M93-L206 HydrophobicContact CE-CD2 4.44Å; M93-L206 WeakPolarHBondContact CE-O 3.09Å; M93-L206 HydrophobicContact SD-CD2 4.25Å; M93-W210 HydrophobicContact CE-CB 3.94Å; M93-W210 HydrophobicContact CE-CG 4.01Å
94	L	55.5	Low	54.5	Low	93 Å²	93	72.7 Å²	72.7	49%	0.487	39%	0.39	S	S	.	.	H	α-helix	trans	-56	-49.3	173.3	-171.1	86.8	0	0	0	111	A90 I91 S96 M97 I98	A90-L94 WeakPolarHBondContact O-CB 3.41Å; A90-L94 PolarHBondContact O-N 3.36Å; I91-L94 WeakPolarHBondContact O-CB 3.49Å; I91-L94 PolarHBondContact O-N 3.49Å; L94-S96 PolarHBondContact O-N 3.44Å; L94-M97 PolarHBondContact O-N 3.22Å; L94-I98 HydrophobicContact CD2-CD1 4.25Å; L94-I98 HydrophobicContact CG-CD1 4.06Å; L94-I98 VanDerWaalsContact O-CG1 3.32Å; L94-I98 WeakPolarHBondContact O-CG1 3.32Å; L94-I98 PolarHBondContact O-N 3.39Å
95	L	58.7	Low	54.3	Low	89 Å²	89	76.3 Å²	76.3	47%	0.466	40%	0.399	S	S	.	.	H	α-helix	trans	-60.6	-41	176.1	-75	163.9	0	0	0	112.4	I91 M93 M97 I98 N99	I91-L95 HydrophobicContact CG2-CD1 3.97Å; I91-L95 WeakPolarHBondContact O-CG 3.1Å; I91-L95 PolarHBondContact O-N 3.46Å; M93-L95 VanDerWaalsContact C-N 3.35Å; M93-L95 PolarHBondContact O-N 3.19Å; L95-M97 VanDerWaalsContact C-N 3.34Å; L95-M97 PolarHBondContact O-N 2.82Å; L95-I98 PolarHBondContact O-N 3.49Å; L95-N99 PolarHBondContact O-N 3.13Å
96	S	54	Low	54	Low	32 Å²	32	79.6 Å²	79.6	22%	0.224	40%	0.404	C	S	.	.	H	α-helix	trans	-63.9	-38.9	176.3	78.3	0	0	0	0	112.3	T92 M93 L94 N99 I100	T92-S96 WeakPolarHBondContact O-CB 3.47Å; T92-S96 PolarHBondContact O-N 3.22Å; M93-S96 WeakPolarHBondContact CA-OG 3.24Å; M93-S96 PolarHBondContact O-N 3.08Å; M93-S96 PolarHBondContact O-OG 2.89Å; L94-S96 PolarHBondContact O-N 3.44Å; S96-N99 PolarHBondContact O-N 2.78Å; S96-I100 WeakPolarHBondContact O-CB 3.23Å; S96-I100 VanDerWaalsContact O-CG1 3.24Å; S96-I100 WeakPolarHBondContact O-CG1 3.09Å; S96-I100 PolarHBondContact O-N 3.4Å
97	M	54.3	Low	53.6	Low	38 Å²	38	85 Å²	85	19%	0.187	42%	0.421	C	S	.	.	H	α-helix	trans	-70.9	-37.2	177.2	-73.6	-70.3	-78.9	0	0	111.6	M93 L94 L95 I100 F101 Y131 I213	M93-M97 WeakPolarHBondContact O-CG 3.49Å; M93-M97 PolarHBondContact O-N 3.25Å; L94-M97 PolarHBondContact O-N 3.22Å; L95-M97 VanDerWaalsContact C-N 3.34Å; L95-M97 PolarHBondContact O-N 2.82Å; M97-I100 PolarHBondContact O-N 2.94Å; M97-F101 VanDerWaalsContact O-CB 3.31Å; M97-F101 WeakPolarHBondContact O-CB 3.13Å; M97-F101 PolarHBondContact O-N 3.21Å; M97-Y131 HydrophobicContact CE-CD1 4.48Å; M97-Y131 HydrophobicContact CE-CG 4.28Å; M97-Y131 HydrophobicContact CG-CD1 4.47Å; M97-Y131 HydrophobicContact CG-CE1 4.32Å; M97-I213 HydrophobicContact SD-CD1 4.27Å
98	I	58.1	Low	53	Low	79 Å²	79	85 Å²	85	41%	0.405	42%	0.421	S	S	.	.	H	α-helix	trans	-61.6	-46.2	172	-70.4	164.6	0	0	0	110.3	L94 L95 F101 I102	L94-I98 HydrophobicContact CD2-CD1 4.25Å; L94-I98 HydrophobicContact CG-CD1 4.06Å; L94-I98 VanDerWaalsContact O-CG1 3.32Å; L94-I98 WeakPolarHBondContact O-CG1 3.32Å; L94-I98 PolarHBondContact O-N 3.39Å; L95-I98 PolarHBondContact O-N 3.49Å; I98-F101 WeakPolarHBondContact O-CB 2.81Å; I98-F101 PolarHBondContact O-N 3.32Å; I98-I102 HydrophobicContact CG2-CD1 3.82Å; I98-I102 HydrophobicContact CG2-CG1 4.48Å; I98-I102 VanDerWaalsContact O-CG1 3.31Å; I98-I102 WeakPolarHBondContact O-CG1 3.3Å; I98-I102 PolarHBondContact O-N 2.92Å
99	N	55.4	Low	52.2	Low	98 Å²	98	88.1 Å²	88.1	52%	0.524	43%	0.425	S	S	.	.	H	α-helix	trans	-63.4	-45.3	177.7	-73.6	-11.5	0	0	0	112.2	L95 S96 F101 I102 E103	L95-N99 PolarHBondContact O-N 3.13Å; S96-N99 PolarHBondContact O-N 2.78Å; N99-F101 VanDerWaalsContact C-N 3.27Å; N99-F101 PolarHBondContact O-N 3.21Å; N99-I102 PolarHBondContact O-N 3.41Å; N99-E103 PolarHBondContact O-N 3.26Å
100	I	55.1	Low	51.5	Low	52 Å²	52	89.3 Å²	89.3	27%	0.267	44%	0.435	S	S	.	.	H	α-helix	trans	-56.8	-43.2	172.9	-72.6	165.9	0	0	0	110.2	S96 M97 E103 F104	S96-I100 WeakPolarHBondContact O-CB 3.23Å; S96-I100 VanDerWaalsContact O-CG1 3.24Å; S96-I100 WeakPolarHBondContact O-CG1 3.09Å; S96-I100 PolarHBondContact O-N 3.4Å; M97-I100 PolarHBondContact O-N 2.94Å; I100-E103 PolarHBondContact O-N 3.19Å; I100-F104 HydrophobicContact CG2-CD2 3.6Å; I100-F104 HydrophobicContact CG2-CE2 3.71Å; I100-F104 WeakPolarHBondContact O-CB 3.32Å; I100-F104 VanDerWaalsContact O-CD2 3.3Å; I100-F104 WeakPolarHBondContact O-CD2 3.48Å; I100-F104 PolarHBondContact O-N 3.47Å
101	F	51	Low	50.9	Low	112 Å²	112	96.3 Å²	96.3	49%	0.491	46%	0.457	S	S	.	.	H	α-helix	trans	-67	-37.4	178.7	-166.9	-96	0	0	0	113.1	M97 I98 N99 F104 K105 I128	M97-F101 VanDerWaalsContact O-CB 3.31Å; M97-F101 WeakPolarHBondContact O-CB 3.13Å; M97-F101 PolarHBondContact O-N 3.21Å; I98-F101 WeakPolarHBondContact O-CB 2.81Å; I98-F101 PolarHBondContact O-N 3.32Å; N99-F101 VanDerWaalsContact C-N 3.27Å; N99-F101 PolarHBondContact O-N 3.21Å; F101-F104 PolarHBondContact O-N 3.04Å; F101-K105 WeakPolarHBondContact O-CB 3.45Å; F101-K105 PolarHBondContact O-N 3.15Å; F101-I128 HydrophobicContact CD2-CD1 3.7Å; F101-I128 HydrophobicContact CE2-CD1 3.55Å
102	I	55.8	Low	50.2	Low	82 Å²	82	102.9 Å²	102.9	42%	0.421	48%	0.478	S	S	.	.	H	α-helix	trans	-63.3	-46.9	173.7	-69.8	164.6	0	0	0	110.2	I98 N99 K105 Y106	I98-I102 HydrophobicContact CG2-CD1 3.82Å; I98-I102 HydrophobicContact CG2-CG1 4.48Å; I98-I102 VanDerWaalsContact O-CG1 3.31Å; I98-I102 WeakPolarHBondContact O-CG1 3.3Å; I98-I102 PolarHBondContact O-N 2.92Å; N99-I102 PolarHBondContact O-N 3.41Å; I102-K105 WeakPolarHBondContact O-CB 3.36Å; I102-K105 PolarHBondContact O-N 3.48Å; I102-Y106 HydrophobicContact CG2-CD2 4.23Å; I102-Y106 HydrophobicContact CG2-CE2 4.2Å; I102-Y106 WeakPolarHBondContact O-CD2 3.32Å; I102-Y106 PolarHBondContact O-N 3.34Å; I102-Y106 VanDerWaalsContact O-N 3.15Å
103	E	52.3	Low	49.5	Very low	125 Å²	125	103.3 Å²	103.3	58%	0.584	48%	0.478	S	S	*	.	H	α-helix	trans	-62.4	-45.5	174.7	-71.3	-165.3	166	0	0	111.9	N99 I100 K105 Y106 Y107	N99-E103 PolarHBondContact O-N 3.26Å; I100-E103 PolarHBondContact O-N 3.19Å; E103-K105 VanDerWaalsContact C-N 3.27Å; E103-K105 PolarHBondContact O-N 2.89Å; E103-Y106 PolarHBondContact O-N 3.22Å; E103-Y106 VanDerWaalsContact O-N 3.08Å; E103-Y107 HydrophobicContact CB-CD2 4.47Å; E103-Y107 VanDerWaalsContact O-CD2 3.25Å; E103-Y107 WeakPolarHBondContact O-CD2 3.46Å; E103-Y107 PolarHBondContact O-N 3Å
104	F	49.2	Very low	48.8	Very low	56 Å²	56	110.2 Å²	110.2	25%	0.246	51%	0.514	C	S	.	.	H	α-helix	trans	-57.4	-38.5	174.4	-95	-73.9	0	0	0	112.3	I100 F101 Y106 Y107 I108 I220	I100-F104 HydrophobicContact CG2-CD2 3.6Å; I100-F104 HydrophobicContact CG2-CE2 3.71Å; I100-F104 WeakPolarHBondContact O-CB 3.32Å; I100-F104 VanDerWaalsContact O-CD2 3.3Å; I100-F104 WeakPolarHBondContact O-CD2 3.48Å; I100-F104 PolarHBondContact O-N 3.47Å; F101-F104 PolarHBondContact O-N 3.04Å; F104-Y106 PolarHBondContact O-N 3.34Å; F104-Y107 PolarHBondContact O-N 3.16Å; F104-I108 HydrophobicContact CB-CD1 4.39Å; F104-I108 HydrophobicContact CD1-CD1 4.3Å; F104-I108 VanDerWaalsContact O-CB 3.31Å; F104-I108 WeakPolarHBondContact O-CB 3.32Å; F104-I108 WeakPolarHBondContact O-CD1 3.47Å; F104-I108 WeakPolarHBondContact O-CG1 3.31Å; F104-I108 PolarHBondContact O-N 3.15Å; F104-I220 HydrophobicContact CZ-CD1 4.34Å; F104-I220 HydrophobicContact CZ-CG2 4.22Å
105	K	50.1	Low	47.9	Very low	127 Å²	127	116.7 Å²	116.7	55%	0.552	53%	0.533	S	S	*	.	H	α-helix	trans	-61.1	-43.2	175.2	-170.5	-179.6	179.5	-176.8	0	111.2	F101 I102 E103 I108 Y109	F101-K105 WeakPolarHBondContact O-CB 3.45Å; F101-K105 PolarHBondContact O-N 3.15Å; I102-K105 WeakPolarHBondContact O-CB 3.36Å; I102-K105 PolarHBondContact O-N 3.48Å; E103-K105 VanDerWaalsContact C-N 3.27Å; E103-K105 PolarHBondContact O-N 2.89Å; K105-I108 PolarHBondContact O-N 3.46Å; K105-Y109 HydrophobicContact CG-CD2 4.28Å; K105-Y109 HydrophobicContact CG-CE2 4.46Å; K105-Y109 PolarHBondContact O-N 3.07Å
106	Y	49.9	Very low	47.1	Very low	193 Å²	193	118.1 Å²	118.1	76%	0.757	54%	0.54	S	S	*	.	H	α-helix	trans	-65.7	-41.9	174.2	-84.3	-75.4	0	0	0	112.8	I102 E103 F104 I108	I102-Y106 HydrophobicContact CG2-CD2 4.23Å; I102-Y106 HydrophobicContact CG2-CE2 4.2Å; I102-Y106 WeakPolarHBondContact O-CD2 3.32Å; I102-Y106 PolarHBondContact O-N 3.34Å; I102-Y106 VanDerWaalsContact O-N 3.15Å; E103-Y106 PolarHBondContact O-N 3.22Å; E103-Y106 VanDerWaalsContact O-N 3.08Å; F104-Y106 PolarHBondContact O-N 3.34Å; Y106-I108 VanDerWaalsContact C-N 3.31Å; Y106-I108 PolarHBondContact O-N 3.44Å
107	Y	45.3	Very low	46.8	Very low	153 Å²	153	120.6 Å²	120.6	60%	0.6	55%	0.545	S	S	*	.	H	α-helix	trans	-72.7	-16.9	178.3	-79.4	-70.2	0	0	0	114.8	E103 F104	E103-Y107 HydrophobicContact CB-CD2 4.47Å; E103-Y107 VanDerWaalsContact O-CD2 3.25Å; E103-Y107 WeakPolarHBondContact O-CD2 3.46Å; E103-Y107 PolarHBondContact O-N 3Å; F104-Y107 PolarHBondContact O-N 3.16Å
108	I	43.4	Very low	46.5	Very low	75 Å²	75	122.5 Å²	122.5	39%	0.385	56%	0.56	S	S	.	*	H	α-helix	trans	-90.8	-25.7	179.1	-71.8	165.4	0	0	0	112.3	F104 K105 Y106 S110	F104-I108 HydrophobicContact CB-CD1 4.39Å; F104-I108 HydrophobicContact CD1-CD1 4.3Å; F104-I108 VanDerWaalsContact O-CB 3.31Å; F104-I108 WeakPolarHBondContact O-CB 3.32Å; F104-I108 WeakPolarHBondContact O-CD1 3.47Å; F104-I108 WeakPolarHBondContact O-CG1 3.31Å; F104-I108 PolarHBondContact O-N 3.15Å; K105-I108 PolarHBondContact O-N 3.46Å; Y106-I108 VanDerWaalsContact C-N 3.31Å; Y106-I108 PolarHBondContact O-N 3.44Å; I108-S110 PolarHBondContact O-N 3.49Å
109	Y	37.6	Very low	45.7	Very low	181 Å²	181	125.6 Å²	125.6	71%	0.71	57%	0.568	S	S	*	*			trans	-78.6	24.1	-171.5	-106.9	-83.9	0	0	0	116.6	K105 K111	K105-Y109 HydrophobicContact CG-CD2 4.28Å; K105-Y109 HydrophobicContact CG-CE2 4.46Å; K105-Y109 PolarHBondContact O-N 3.07Å; Y109-K111 PolarHBondContact O-N 3.34Å
110	S	39.3	Very low	45.3	Very low	71 Å²	71	123.6 Å²	123.6	50%	0.497	56%	0.556	S	S	.	*			trans	-76.9	113.8	170.5	-174	0	0	0	0	111	I108 Y112 L113	I108-S110 PolarHBondContact O-N 3.49Å; S110-Y112 PolarHBondContact O-N 2.99Å; S110-L113 PolarHBondContact O-N 3.01Å
111	K	40	Very low	44.8	Very low	188 Å²	188	127.7 Å²	127.7	82%	0.817	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.2	-4.7	-168	-88.6	179.2	173.6	172.9	0	117.9	Y109	Y109-K111 PolarHBondContact O-N 3.34Å
112	Y	40.5	Very low	44.6	Very low	222 Å²	222	129.2 Å²	129.2	87%	0.871	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	1.8	-170.7	-67.1	-77.2	0	0	0	115.5	S110	S110-Y112 PolarHBondContact O-N 2.99Å
113	L	40.6	Very low	44.1	Very low	87 Å²	87	128 Å²	128	46%	0.455	57%	0.566	S	S	.	*			trans	-118.1	17.4	-165.5	-114.2	148	0	0	0	115.8	S110 Y115	S110-L113 PolarHBondContact O-N 3.01Å; L113-Y115 VanDerWaalsContact C-N 3.31Å; L113-Y115 PolarHBondContact O-N 3.33Å
114	L	38.1	Very low	43.8	Very low	161 Å²	161	123.4 Å²	123.4	84%	0.843	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.2	-171.4	-108.4	113	0	0	0	116.3
115	Y	37.3	Very low	43.8	Very low	230 Å²	230	124.2 Å²	124.2	90%	0.902	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-9.3	-167.4	-119.7	-92	0	0	0	116.1	L113	L113-Y115 VanDerWaalsContact C-N 3.31Å; L113-Y115 PolarHBondContact O-N 3.33Å
116	I	41.8	Very low	43.8	Very low	118 Å²	118	122.8 Å²	122.8	61%	0.605	54%	0.544	S	S	*	.	S	Bend	trans	-125.6	-2.8	-166.6	-60.2	178.8	0	0	0	113.7	P118	I116-P118 VanDerWaalsContact O-CD 3.24Å; I116-P118 WeakPolarHBondContact O-CD 3.22Å
117	R	47	Very low	43.8	Very low	84 Å²	84	116.9 Å²	116.9	32%	0.317	52%	0.522	S	S	.	.			trans	-107.5	33.6	-168.8	-95.5	-174.4	174.5	-169.2	-2.2	118.9	Y119 N224	R117-Y119 VanDerWaalsContact C-N 3.29Å; R117-Y119 PolarHBondContact O-N 3.17Å; R117-N224 PolarHBondContact NH2-OD1 3.07Å
118	P	49	Very low	44	Very low	79 Å²	79	111.8 Å²	111.8	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-67.7	-26.2	176.6	30.3	-34	0	0	0	113.3	I116 R122	I116-P118 VanDerWaalsContact O-CD 3.24Å; I116-P118 WeakPolarHBondContact O-CD 3.22Å; P118-R122 VanDerWaalsContact O-CB 3.3Å; P118-R122 WeakPolarHBondContact O-CB 3.38Å; P118-R122 WeakPolarHBondContact O-CG 3.41Å; P118-R122 PolarHBondContact O-N 2.83Å
119	Y	41.1	Very low	44.3	Very low	144 Å²	144	112.3 Å²	112.3	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-68.8	-52.8	-175.9	-178.4	-102.9	0	0	0	113.2	R117 Y121 R122 L123 L620	R117-Y119 VanDerWaalsContact C-N 3.29Å; R117-Y119 PolarHBondContact O-N 3.17Å; Y119-Y121 VanDerWaalsContact C-N 3.31Å; Y119-Y121 PolarHBondContact O-N 3.43Å; Y119-R122 PolarHBondContact O-N 3.5Å; Y119-L123 HydrophobicContact CE1-CD2 4.21Å; Y119-L123 VanDerWaalsContact O-CB 3.28Å; Y119-L123 WeakPolarHBondContact O-CB 3.3Å; Y119-L123 PolarHBondContact O-N 3.37Å; Y119-L620 HydrophobicContact CD2-CD1 4.37Å; Y119-L620 HydrophobicContact CE2-CD1 4.36Å
120	I	46.3	Very low	44.8	Very low	56 Å²	56	108.1 Å²	108.1	29%	0.287	50%	0.497	S	S	.	.	H	α-helix	trans	-65.2	-38.6	-178.5	-61	174.4	0	0	0	110.5	S124	I120-S124 PolarHBondContact O-N 2.92Å; I120-S124 PolarHBondContact O-OG 3.49Å; I120-S124 VanDerWaalsContact O-OG 3.06Å
121	Y	44.5	Very low	45.4	Very low	137 Å²	137	106 Å²	106	54%	0.537	48%	0.478	S	S	.	.	H	α-helix	trans	-66.5	-43.3	177.2	-169.1	-97.9	0	0	0	112.3	Y119 S124 H125	Y119-Y121 VanDerWaalsContact C-N 3.31Å; Y119-Y121 PolarHBondContact O-N 3.43Å; Y121-S124 PolarHBondContact O-OG 3.43Å; Y121-S124 VanDerWaalsContact O-OG 3.08Å; Y121-H125 AromaticContact CD1-CD2 3.68Å; Y121-H125 AromaticContact CE1-CD2 3.32Å; Y121-H125 WeakPolarHBondContact CE1-CD2 3.42Å; Y121-H125 AromaticContact CE1-NE2 3.31Å; Y121-H125 VanDerWaalsContact CE1-NE2 3.31Å; Y121-H125 WeakPolarHBondContact CE1-NE2 3.32Å; Y121-H125 AromaticContact CE2-NE2 3.9Å; Y121-H125 AromaticContact CZ-CD2 3.56Å; Y121-H125 AromaticContact CZ-NE2 3.16Å; Y121-H125 WeakPolarHBondContact O-CB 3.32Å; Y121-H125 PolarHBondContact O-CD2 2.8Å; Y121-H125 VanDerWaalsContact O-CD2 3.29Å; Y121-H125 PolarHBondContact O-N 2.93Å; Y121-H125 VanDerWaalsContact O-N 3.07Å; Y121-H125 PolarHBondContact OH-NE2 3.42Å
122	R	46.8	Very low	46	Very low	144 Å²	144	101.2 Å²	101.2	54%	0.543	46%	0.461	S	S	.	.	H	α-helix	trans	-66.4	-43.5	174.8	-75.3	175.9	-178.1	-161.7	-2.5	111.9	P118 Y119 S124 H125 Y126	P118-R122 VanDerWaalsContact O-CB 3.3Å; P118-R122 WeakPolarHBondContact O-CB 3.38Å; P118-R122 WeakPolarHBondContact O-CG 3.41Å; P118-R122 PolarHBondContact O-N 2.83Å; Y119-R122 PolarHBondContact O-N 3.5Å; R122-S124 PolarHBondContact O-N 3.25Å; R122-H125 PolarHBondContact O-N 3.22Å; R122-Y126 HydrophobicContact CB-CD2 4.35Å; R122-Y126 HydrophobicContact CB-CE2 3.97Å; R122-Y126 WeakPolarHBondContact O-CD2 3.33Å; R122-Y126 PolarHBondContact O-N 3.3Å
123	L	46.4	Very low	46.4	Very low	56 Å²	56	93.6 Å²	93.6	29%	0.293	44%	0.435	S	S	.	.	H	α-helix	trans	-62.9	-43.1	-179.9	-171.4	67.5	0	0	0	111.7	Y119 Y126 F127	Y119-L123 HydrophobicContact CE1-CD2 4.21Å; Y119-L123 VanDerWaalsContact O-CB 3.28Å; Y119-L123 WeakPolarHBondContact O-CB 3.3Å; Y119-L123 PolarHBondContact O-N 3.37Å; L123-Y126 PolarHBondContact O-N 2.81Å; L123-F127 HydrophobicContact CD1-CD2 4.34Å; L123-F127 HydrophobicContact CD1-CE2 3.77Å; L123-F127 HydrophobicContact CD1-CZ 4.48Å; L123-F127 HydrophobicContact CD2-CE2 4.21Å; L123-F127 HydrophobicContact CG-CD2 4.02Å; L123-F127 HydrophobicContact CG-CE2 3.68Å; L123-F127 WeakPolarHBondContact O-CD2 3.38Å; L123-F127 PolarHBondContact O-N 2.95Å
124	S	46.3	Very low	46.9	Very low	29 Å²	29	91.1 Å²	91.1	20%	0.203	42%	0.423	C	S	.	.	H	α-helix	trans	-66.6	-39.4	174.8	59.8	0	0	0	0	112.4	I120 Y121 R122 F127 I128	I120-S124 PolarHBondContact O-N 2.92Å; I120-S124 PolarHBondContact O-OG 3.49Å; I120-S124 VanDerWaalsContact O-OG 3.06Å; Y121-S124 PolarHBondContact O-OG 3.43Å; Y121-S124 VanDerWaalsContact O-OG 3.08Å; R122-S124 PolarHBondContact O-N 3.25Å; S124-F127 PolarHBondContact O-N 3.41Å; S124-I128 WeakPolarHBondContact O-CD1 3.41Å; S124-I128 VanDerWaalsContact O-CG1 3.28Å; S124-I128 WeakPolarHBondContact O-CG1 3.29Å; S124-I128 PolarHBondContact O-N 3.46Å
125	H	49.2	Very low	47.5	Very low	73 Å²	73	85.5 Å²	85.5	34%	0.338	40%	0.397	S	S	.	.	H	α-helix	trans	-60	-44	171	-94.6	-79.6	0	0	0	112.7	Y121 R122 F127 I128 V129	Y121-H125 AromaticContact CD1-CD2 3.68Å; Y121-H125 AromaticContact CE1-CD2 3.32Å; Y121-H125 WeakPolarHBondContact CE1-CD2 3.42Å; Y121-H125 AromaticContact CE1-NE2 3.31Å; Y121-H125 VanDerWaalsContact CE1-NE2 3.31Å; Y121-H125 WeakPolarHBondContact CE1-NE2 3.32Å; Y121-H125 AromaticContact CE2-NE2 3.9Å; Y121-H125 AromaticContact CZ-CD2 3.56Å; Y121-H125 AromaticContact CZ-NE2 3.16Å; Y121-H125 WeakPolarHBondContact O-CB 3.32Å; Y121-H125 PolarHBondContact O-CD2 2.8Å; Y121-H125 VanDerWaalsContact O-CD2 3.29Å; Y121-H125 PolarHBondContact O-N 2.93Å; Y121-H125 VanDerWaalsContact O-N 3.07Å; Y121-H125 PolarHBondContact OH-NE2 3.42Å; R122-H125 PolarHBondContact O-N 3.22Å; H125-F127 VanDerWaalsContact C-N 3.33Å; H125-F127 PolarHBondContact O-N 2.83Å; H125-I128 PolarHBondContact O-N 3.23Å; H125-V129 WeakPolarHBondContact O-CG2 3.31Å; H125-V129 PolarHBondContact O-N 3.42Å
126	Y	49.3	Very low	48.2	Very low	98 Å²	98	78.4 Å²	78.4	38%	0.384	37%	0.374	S	S	.	.	H	α-helix	trans	-64.2	-36.4	175.9	-68.1	-50.2	0	0	0	112.4	R122 L123 F130	R122-Y126 HydrophobicContact CB-CD2 4.35Å; R122-Y126 HydrophobicContact CB-CE2 3.97Å; R122-Y126 WeakPolarHBondContact O-CD2 3.33Å; R122-Y126 PolarHBondContact O-N 3.3Å; L123-Y126 PolarHBondContact O-N 2.81Å; Y126-F130 WeakPolarHBondContact O-CB 3.25Å; Y126-F130 PolarHBondContact O-N 2.97Å
127	F	49.6	Very low	48.6	Very low	69 Å²	69	74.5 Å²	74.5	30%	0.303	35%	0.354	S	S	.	.	H	α-helix	trans	-67.3	-37	172.4	-79.9	-59.6	0	0	0	113	L123 S124 H125 Y131 L216	L123-F127 HydrophobicContact CD1-CD2 4.34Å; L123-F127 HydrophobicContact CD1-CE2 3.77Å; L123-F127 HydrophobicContact CD1-CZ 4.48Å; L123-F127 HydrophobicContact CD2-CE2 4.21Å; L123-F127 HydrophobicContact CG-CD2 4.02Å; L123-F127 HydrophobicContact CG-CE2 3.68Å; L123-F127 WeakPolarHBondContact O-CD2 3.38Å; L123-F127 PolarHBondContact O-N 2.95Å; S124-F127 PolarHBondContact O-N 3.41Å; H125-F127 VanDerWaalsContact C-N 3.33Å; H125-F127 PolarHBondContact O-N 2.83Å; F127-Y131 WeakPolarHBondContact O-CB 3.33Å; F127-Y131 PolarHBondContact O-N 3.3Å; F127-L216 HydrophobicContact CD1-CD1 4.29Å; F127-L216 HydrophobicContact CE1-CD1 3.47Å; F127-L216 VanDerWaalsContact CE1-CD1 3.47Å; F127-L216 HydrophobicContact CE2-CD1 3.98Å; F127-L216 HydrophobicContact CE2-CD2 4.33Å; F127-L216 HydrophobicContact CZ-CD1 3.3Å; F127-L216 HydrophobicContact CZ-CD2 3.91Å; F127-L216 HydrophobicContact CZ-CG 4.25Å
128	I	50.4	Low	48.8	Very low	46 Å²	46	73.6 Å²	73.6	24%	0.236	36%	0.361	C	S	.	.	H	α-helix	trans	-65.2	-48	174.2	-69.3	160.7	0	0	0	110.4	F101 S124 H125 Y131 I132	F101-I128 HydrophobicContact CD2-CD1 3.7Å; F101-I128 HydrophobicContact CE2-CD1 3.55Å; S124-I128 WeakPolarHBondContact O-CD1 3.41Å; S124-I128 VanDerWaalsContact O-CG1 3.28Å; S124-I128 WeakPolarHBondContact O-CG1 3.29Å; S124-I128 PolarHBondContact O-N 3.46Å; H125-I128 PolarHBondContact O-N 3.23Å; I128-Y131 PolarHBondContact O-N 3.32Å; I128-I132 HydrophobicContact CG2-CD1 3.65Å; I128-I132 HydrophobicContact CG2-CG1 4.4Å; I128-I132 WeakPolarHBondContact O-CB 3.16Å; I128-I132 VanDerWaalsContact O-CG1 3.25Å; I128-I132 WeakPolarHBondContact O-CG1 3.31Å; I128-I132 PolarHBondContact O-N 3.35Å
129	V	49.5	Very low	49	Very low	85 Å²	85	75.1 Å²	75.1	52%	0.515	36%	0.359	S	S	.	.	H	α-helix	trans	-62.8	-45.3	177.6	172.4	0	0	0	0	111.1	H125 L133	H125-V129 WeakPolarHBondContact O-CG2 3.31Å; H125-V129 PolarHBondContact O-N 3.42Å; V129-L133 VanDerWaalsContact O-CB 3.27Å; V129-L133 WeakPolarHBondContact O-CB 2.97Å; V129-L133 PolarHBondContact O-N 3.24Å
130	F	48	Very low	49.5	Very low	94 Å²	94	71.7 Å²	71.7	41%	0.412	35%	0.35	S	S	.	.	H	α-helix	trans	-59.6	-47.7	175.2	177.3	-96.6	0	0	0	111.4	Y126 L133 T134 I609	Y126-F130 WeakPolarHBondContact O-CB 3.25Å; Y126-F130 PolarHBondContact O-N 2.97Å; F130-L133 PolarHBondContact O-N 3.46Å; F130-T134 HydrophobicContact CD1-CG2 4.27Å; F130-T134 HydrophobicContact CD2-CG2 4.44Å; F130-T134 HydrophobicContact CE1-CG2 3.87Å; F130-T134 HydrophobicContact CE2-CG2 4.05Å; F130-T134 HydrophobicContact CZ-CG2 3.75Å; F130-T134 WeakPolarHBondContact O-CG2 3.39Å; F130-T134 PolarHBondContact O-N 3.48Å; F130-T134 PolarHBondContact O-OG1 2.92Å; F130-I609 HydrophobicContact CD2-CD1 4.47Å; F130-I609 HydrophobicContact CE2-CD1 3.9Å; F130-I609 HydrophobicContact CE2-CG1 4.41Å
131	Y	51.4	Low	49.9	Very low	25 Å²	25	70.3 Å²	70.3	10%	0.098	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-49.5	179.7	-175	-102.1	0	0	0	111.5	M93 M97 F127 I128 L133 T134 C135	M93-Y131 WeakPolarHBondContact CB-OH 3.02Å; M97-Y131 HydrophobicContact CE-CD1 4.48Å; M97-Y131 HydrophobicContact CE-CG 4.28Å; M97-Y131 HydrophobicContact CG-CD1 4.47Å; M97-Y131 HydrophobicContact CG-CE1 4.32Å; F127-Y131 WeakPolarHBondContact O-CB 3.33Å; F127-Y131 PolarHBondContact O-N 3.3Å; I128-Y131 PolarHBondContact O-N 3.32Å; Y131-L133 VanDerWaalsContact C-N 3.31Å; Y131-L133 PolarHBondContact O-N 3.12Å; Y131-T134 WeakPolarHBondContact CA-OG1 3.39Å; Y131-T134 PolarHBondContact O-N 3.23Å; Y131-T134 PolarHBondContact O-OG1 3.12Å; Y131-C135 WeakPolarHBondContact CE1-SG 3.22Å; Y131-C135 WeakPolarHBondContact O-CB 3.29Å; Y131-C135 PolarHBondContact O-N 3.07Å; Y131-C135 PolarHBondContact O-SG 2.86Å; Y131-C135 VanDerWaalsContact O-SG 3.4Å
132	I	52	Low	50.3	Low	88 Å²	88	67.1 Å²	67.1	45%	0.451	33%	0.33	S	S	.	.	H	α-helix	trans	-55.2	-46.4	174.6	-71	169.5	0	0	0	110.6	I128 C135 I136	I128-I132 HydrophobicContact CG2-CD1 3.65Å; I128-I132 HydrophobicContact CG2-CG1 4.4Å; I128-I132 WeakPolarHBondContact O-CB 3.16Å; I128-I132 VanDerWaalsContact O-CG1 3.25Å; I128-I132 WeakPolarHBondContact O-CG1 3.31Å; I128-I132 PolarHBondContact O-N 3.35Å; I132-C135 PolarHBondContact O-N 3.46Å; I132-I136 HydrophobicContact CG2-CD1 3.66Å; I132-I136 HydrophobicContact CG2-CG1 4.36Å; I132-I136 WeakPolarHBondContact O-CB 3.45Å; I132-I136 VanDerWaalsContact O-CG1 3.28Å; I132-I136 WeakPolarHBondContact O-CG1 3.41Å; I132-I136 PolarHBondContact O-N 3.04Å
133	L	50.2	Low	50.5	Low	63 Å²	63	64 Å²	64	33%	0.33	32%	0.324	S	S	.	.	H	α-helix	trans	-65.1	-42.1	179.4	-158.6	70.4	0	0	0	111.5	V129 F130 Y131 C135 I136 N137 I605	V129-L133 VanDerWaalsContact O-CB 3.27Å; V129-L133 WeakPolarHBondContact O-CB 2.97Å; V129-L133 PolarHBondContact O-N 3.24Å; F130-L133 PolarHBondContact O-N 3.46Å; Y131-L133 VanDerWaalsContact C-N 3.31Å; Y131-L133 PolarHBondContact O-N 3.12Å; L133-C135 PolarHBondContact O-N 2.89Å; L133-I136 PolarHBondContact O-N 2.91Å; L133-N137 WeakPolarHBondContact O-CB 3.35Å; L133-N137 PolarHBondContact O-N 3.4Å; L133-N137 PolarHBondContact O-ND2 3.48Å; L133-N137 VanDerWaalsContact O-ND2 3.09Å; L133-N137 PolarHBondContact O-OD1 3.38Å; L133-I605 HydrophobicContact CD2-CG1 4.06Å
134	T	50.9	Low	50.7	Low	35 Å²	35	64 Å²	64	22%	0.215	32%	0.323	C	S	.	.	H	α-helix	trans	-67.2	-32.8	175	56.3	0	0	0	0	113.4	F130 Y131 S138	F130-T134 HydrophobicContact CD1-CG2 4.27Å; F130-T134 HydrophobicContact CD2-CG2 4.44Å; F130-T134 HydrophobicContact CE1-CG2 3.87Å; F130-T134 HydrophobicContact CE2-CG2 4.05Å; F130-T134 HydrophobicContact CZ-CG2 3.75Å; F130-T134 WeakPolarHBondContact O-CG2 3.39Å; F130-T134 PolarHBondContact O-N 3.48Å; F130-T134 PolarHBondContact O-OG1 2.92Å; Y131-T134 WeakPolarHBondContact CA-OG1 3.39Å; Y131-T134 PolarHBondContact O-N 3.23Å; Y131-T134 PolarHBondContact O-OG1 3.12Å; T134-S138 VanDerWaalsContact O-CB 3.27Å; T134-S138 WeakPolarHBondContact O-CB 3.44Å; T134-S138 PolarHBondContact O-N 2.83Å; T134-S138 PolarHBondContact O-OG 3.4Å
135	C	49.8	Very low	51	Low	43 Å²	43	64.4 Å²	64.4	29%	0.291	32%	0.323	S	S	.	.	H	α-helix	trans	-69.1	-46.4	172.5	-74	0	0	0	0	111.1	Y131 I132 L133 N137 S138 F139	Y131-C135 WeakPolarHBondContact CE1-SG 3.22Å; Y131-C135 WeakPolarHBondContact O-CB 3.29Å; Y131-C135 PolarHBondContact O-N 3.07Å; Y131-C135 PolarHBondContact O-SG 2.86Å; Y131-C135 VanDerWaalsContact O-SG 3.4Å; I132-C135 PolarHBondContact O-N 3.46Å; L133-C135 PolarHBondContact O-N 2.89Å; C135-N137 VanDerWaalsContact C-N 3.33Å; C135-N137 PolarHBondContact O-N 2.9Å; C135-S138 PolarHBondContact O-N 2.95Å; C135-F139 WeakPolarHBondContact O-CB 3.24Å; C135-F139 PolarHBondContact O-N 3.31Å
136	I	52.6	Low	50.8	Low	80 Å²	80	63.3 Å²	63.3	41%	0.41	32%	0.32	S	S	.	.	H	α-helix	trans	-58	-47	174	-71.5	168.7	0	0	0	109.9	I132 L133 S138 F139 I140	I132-I136 HydrophobicContact CG2-CD1 3.66Å; I132-I136 HydrophobicContact CG2-CG1 4.36Å; I132-I136 WeakPolarHBondContact O-CB 3.45Å; I132-I136 VanDerWaalsContact O-CG1 3.28Å; I132-I136 WeakPolarHBondContact O-CG1 3.41Å; I132-I136 PolarHBondContact O-N 3.04Å; L133-I136 PolarHBondContact O-N 2.91Å; I136-S138 PolarHBondContact O-N 3.42Å; I136-F139 PolarHBondContact O-N 3.29Å; I136-I140 HydrophobicContact CG2-CD1 3.55Å; I136-I140 HydrophobicContact CG2-CG1 4.26Å; I136-I140 WeakPolarHBondContact O-CB 3.34Å; I136-I140 VanDerWaalsContact O-CG1 3.24Å; I136-I140 WeakPolarHBondContact O-CG1 3.25Å; I136-I140 PolarHBondContact O-N 3.08Å
137	N	50.2	Low	50.4	Low	36 Å²	36	62 Å²	62	19%	0.193	32%	0.323	C	S	.	.	H	α-helix	trans	-62.9	-44.7	177	-65.9	-25.2	0	0	0	112	L133 C135 F139 I140 I141 I605	L133-N137 WeakPolarHBondContact O-CB 3.35Å; L133-N137 PolarHBondContact O-N 3.4Å; L133-N137 PolarHBondContact O-ND2 3.48Å; L133-N137 VanDerWaalsContact O-ND2 3.09Å; L133-N137 PolarHBondContact O-OD1 3.38Å; C135-N137 VanDerWaalsContact C-N 3.33Å; C135-N137 PolarHBondContact O-N 2.9Å; N137-F139 VanDerWaalsContact C-N 3.29Å; N137-F139 PolarHBondContact O-N 3.06Å; N137-I140 PolarHBondContact O-N 3.28Å; N137-I141 VanDerWaalsContact O-CB 3.27Å; N137-I141 WeakPolarHBondContact O-CB 3.37Å; N137-I141 WeakPolarHBondContact O-CD1 3.05Å; N137-I141 WeakPolarHBondContact O-CG1 3.44Å; N137-I141 PolarHBondContact O-N 3.29Å; N137-I605 WeakPolarHBondContact ND2-CD1 3.32Å
138	S	51.7	Low	50.2	Low	66 Å²	66	64.4 Å²	64.4	46%	0.462	33%	0.33	S	S	.	.	H	α-helix	trans	-64.6	-36.8	178.6	-58.2	0	0	0	0	111.6	T134 C135 I136 W142	T134-S138 VanDerWaalsContact O-CB 3.27Å; T134-S138 WeakPolarHBondContact O-CB 3.44Å; T134-S138 PolarHBondContact O-N 2.83Å; T134-S138 PolarHBondContact O-OG 3.4Å; C135-S138 PolarHBondContact O-N 2.95Å; I136-S138 PolarHBondContact O-N 3.42Å; S138-W142 VanDerWaalsContact O-CB 3.29Å; S138-W142 WeakPolarHBondContact O-CB 3.28Å; S138-W142 PolarHBondContact O-N 3.27Å
139	F	52.3	Low	50	Low	110 Å²	110	67 Å²	67	48%	0.482	34%	0.338	S	S	.	.	H	α-helix	trans	-72	-40.4	176.1	-175.1	-110.7	0	0	0	112.2	C135 I136 N137 W142 L143	C135-F139 WeakPolarHBondContact O-CB 3.24Å; C135-F139 PolarHBondContact O-N 3.31Å; I136-F139 PolarHBondContact O-N 3.29Å; N137-F139 VanDerWaalsContact C-N 3.29Å; N137-F139 PolarHBondContact O-N 3.06Å; F139-W142 PolarHBondContact O-N 3.07Å; F139-L143 HydrophobicContact CD1-CD1 3.81Å; F139-L143 HydrophobicContact CD1-CG 4.38Å; F139-L143 HydrophobicContact CE1-CD1 3.34Å; F139-L143 HydrophobicContact CE1-CG 4.11Å; F139-L143 HydrophobicContact CE2-CD1 4.42Å; F139-L143 HydrophobicContact CE2-CG 4.37Å; F139-L143 HydrophobicContact CZ-CD1 3.69Å; F139-L143 HydrophobicContact CZ-CD2 4.39Å; F139-L143 HydrophobicContact CZ-CG 4.09Å; F139-L143 WeakPolarHBondContact O-CB 3.47Å; F139-L143 WeakPolarHBondContact O-CG 3.5Å; F139-L143 PolarHBondContact O-N 2.98Å
140	I	52.6	Low	49.5	Very low	73 Å²	73	65.8 Å²	65.8	37%	0.374	33%	0.327	S	S	.	.	H	α-helix	trans	-65.1	-44.4	172.9	-73	172.4	0	0	0	110.4	I136 N137 W142 L143 I144	I136-I140 HydrophobicContact CG2-CD1 3.55Å; I136-I140 HydrophobicContact CG2-CG1 4.26Å; I136-I140 WeakPolarHBondContact O-CB 3.34Å; I136-I140 VanDerWaalsContact O-CG1 3.24Å; I136-I140 WeakPolarHBondContact O-CG1 3.25Å; I136-I140 PolarHBondContact O-N 3.08Å; N137-I140 PolarHBondContact O-N 3.28Å; I140-W142 VanDerWaalsContact C-N 3.3Å; I140-W142 PolarHBondContact O-N 3.49Å; I140-L143 PolarHBondContact O-N 2.87Å; I140-I144 HydrophobicContact CG2-CD1 3.49Å; I140-I144 VanDerWaalsContact CG2-CD1 3.49Å; I140-I144 HydrophobicContact CG2-CG1 4.23Å; I140-I144 WeakPolarHBondContact O-CB 3.35Å; I140-I144 VanDerWaalsContact O-CG1 3.26Å; I140-I144 WeakPolarHBondContact O-CG1 3.25Å; I140-I144 PolarHBondContact O-N 3.42Å
141	I	53.5	Low	48.9	Very low	27 Å²	27	64.9 Å²	64.9	14%	0.138	33%	0.331	C	S	.	.	H	α-helix	trans	-56.4	-47.5	172.6	-74.3	163.6	0	0	0	109.7	N137 I144 I145 Y598	N137-I141 VanDerWaalsContact O-CB 3.27Å; N137-I141 WeakPolarHBondContact O-CB 3.37Å; N137-I141 WeakPolarHBondContact O-CD1 3.05Å; N137-I141 WeakPolarHBondContact O-CG1 3.44Å; N137-I141 PolarHBondContact O-N 3.29Å; I141-I144 PolarHBondContact O-N 3.16Å; I141-I145 HydrophobicContact CG2-CD1 3.63Å; I141-I145 HydrophobicContact CG2-CG1 4.49Å; I141-I145 WeakPolarHBondContact O-CB 3.23Å; I141-I145 WeakPolarHBondContact O-CG1 3.28Å; I141-I145 PolarHBondContact O-N 3.35Å; I141-Y598 HydrophobicContact CD1-CE2 4.08Å; I141-Y598 HydrophobicContact CG1-CE2 3.7Å
142	W	54.4	Low	47.9	Very low	69 Å²	69	70.4 Å²	70.4	26%	0.261	36%	0.359	S	S	.	.	H	α-helix	trans	-63.3	-45.8	178.1	-168.2	82.5	0	0	0	112.2	F83 S138 F139 I140 I144 I145 L146	F83-W142 HydrophobicContact CD1-CZ2 4.24Å; S138-W142 VanDerWaalsContact O-CB 3.29Å; S138-W142 WeakPolarHBondContact O-CB 3.28Å; S138-W142 PolarHBondContact O-N 3.27Å; F139-W142 PolarHBondContact O-N 3.07Å; I140-W142 VanDerWaalsContact C-N 3.3Å; I140-W142 PolarHBondContact O-N 3.49Å; W142-I144 PolarHBondContact O-N 2.9Å; W142-I145 PolarHBondContact O-N 3.46Å; W142-L146 HydrophobicContact CE3-CD1 4.14Å; W142-L146 HydrophobicContact CH2-CD1 3.73Å; W142-L146 HydrophobicContact CZ2-CD1 4.25Å; W142-L146 HydrophobicContact CZ3-CD1 3.67Å; W142-L146 VanDerWaalsContact O-CB 3.28Å; W142-L146 WeakPolarHBondContact O-CB 3.39Å; W142-L146 PolarHBondContact O-N 3.44Å
143	L	50.1	Low	46.9	Very low	78 Å²	78	69.4 Å²	69.4	41%	0.408	36%	0.36	S	S	.	.	H	α-helix	trans	-68.2	-28.2	177.1	-75.9	-177.7	0	0	0	114.5	F139 I140 P147	F139-L143 HydrophobicContact CD1-CD1 3.81Å; F139-L143 HydrophobicContact CD1-CG 4.38Å; F139-L143 HydrophobicContact CE1-CD1 3.34Å; F139-L143 HydrophobicContact CE1-CG 4.11Å; F139-L143 HydrophobicContact CE2-CD1 4.42Å; F139-L143 HydrophobicContact CE2-CG 4.37Å; F139-L143 HydrophobicContact CZ-CD1 3.69Å; F139-L143 HydrophobicContact CZ-CD2 4.39Å; F139-L143 HydrophobicContact CZ-CG 4.09Å; F139-L143 WeakPolarHBondContact O-CB 3.47Å; F139-L143 WeakPolarHBondContact O-CG 3.5Å; F139-L143 PolarHBondContact O-N 2.98Å; I140-L143 PolarHBondContact O-N 2.87Å; L143-P147 WeakPolarHBondContact O-CD 3.29Å
144	I	51.2	Low	45.9	Very low	56 Å²	56	73.7 Å²	73.7	29%	0.287	38%	0.382	S	S	.	.	H	α-helix	trans	-82.4	-31.6	175.1	-69.6	172.5	0	0	0	110.8	I140 I141 W142 I594	I140-I144 HydrophobicContact CG2-CD1 3.49Å; I140-I144 VanDerWaalsContact CG2-CD1 3.49Å; I140-I144 HydrophobicContact CG2-CG1 4.23Å; I140-I144 WeakPolarHBondContact O-CB 3.35Å; I140-I144 VanDerWaalsContact O-CG1 3.26Å; I140-I144 WeakPolarHBondContact O-CG1 3.25Å; I140-I144 PolarHBondContact O-N 3.42Å; I141-I144 PolarHBondContact O-N 3.16Å; W142-I144 PolarHBondContact O-N 2.9Å; I144-I594 HydrophobicContact CD1-CG2 4.05Å; I144-I594 HydrophobicContact CG1-CG2 4.45Å; I144-I594 HydrophobicContact CG2-CG2 3.97Å
145	I	52.5	Low	44.9	Very low	39 Å²	39	74 Å²	74	20%	0.2	39%	0.392	C	S	.	.	H	α-helix	trans	-68.6	-39	171.6	-77.8	174.1	0	0	0	110.4	I141 W142 R148 Y149	I141-I145 HydrophobicContact CG2-CD1 3.63Å; I141-I145 HydrophobicContact CG2-CG1 4.49Å; I141-I145 WeakPolarHBondContact O-CB 3.23Å; I141-I145 WeakPolarHBondContact O-CG1 3.28Å; I141-I145 PolarHBondContact O-N 3.35Å; W142-I145 PolarHBondContact O-N 3.46Å; I145-R148 WeakPolarHBondContact O-CA 3.25Å; I145-R148 VanDerWaalsContact O-CB 3.22Å; I145-R148 WeakPolarHBondContact O-CB 3.44Å; I145-R148 PolarHBondContact O-N 3.12Å; I145-Y149 HydrophobicContact CG2-CD2 3.83Å; I145-Y149 HydrophobicContact CG2-CE2 3.67Å; I145-Y149 WeakPolarHBondContact O-CD2 3.29Å
146	L	45.1	Very low	43.8	Very low	50 Å²	50	82.8 Å²	82.8	26%	0.262	42%	0.421	S	S	.	.	H	α-helix	trans	-55.5	-46.4	-172.4	-174.4	149.9	0	0	0	114.3	W142 R148 Y149 I150	W142-L146 HydrophobicContact CE3-CD1 4.14Å; W142-L146 HydrophobicContact CH2-CD1 3.73Å; W142-L146 HydrophobicContact CZ2-CD1 4.25Å; W142-L146 HydrophobicContact CZ3-CD1 3.67Å; W142-L146 VanDerWaalsContact O-CB 3.28Å; W142-L146 WeakPolarHBondContact O-CB 3.39Å; W142-L146 PolarHBondContact O-N 3.44Å; L146-R148 PolarHBondContact O-N 2.92Å; L146-Y149 PolarHBondContact O-N 3.37Å; L146-I150 HydrophobicContact CD2-CD1 3.6Å; L146-I150 HydrophobicContact CG-CD1 4.1Å; L146-I150 WeakPolarHBondContact O-CG1 3.27Å; L146-I150 PolarHBondContact O-N 2.91Å
147	P	41.4	Very low	42.6	Very low	70 Å²	70	87.4 Å²	87.4	46%	0.455	43%	0.434	S	S	.	.	H	α-helix	trans	-67.5	-16.3	172.1	-21.9	32.6	0	0	0	115.3	L143 Y149	L143-P147 WeakPolarHBondContact O-CD 3.29Å; P147-Y149 VanDerWaalsContact C-N 3.32Å
148	R	44.3	Very low	41.5	Very low	119 Å²	119	91.7 Å²	91.7	45%	0.449	46%	0.458	S	S	.	.	H	α-helix	trans	-80.7	-13.8	-178.4	-151.2	178.9	-165.1	155.4	10.7	112.7	I145 L146 W591 E595	I145-R148 WeakPolarHBondContact O-CA 3.25Å; I145-R148 VanDerWaalsContact O-CB 3.22Å; I145-R148 WeakPolarHBondContact O-CB 3.44Å; I145-R148 PolarHBondContact O-N 3.12Å; L146-R148 PolarHBondContact O-N 2.92Å; R148-W591 HydrophobicContact CB-CH2 4.28Å; R148-W591 HydrophobicContact CG-CH2 4.11Å; R148-E595 IonicContact NH2-OE1 3.68Å
149	Y	45.4	Very low	40.4	Very low	101 Å²	101	94.3 Å²	94.3	40%	0.396	47%	0.465	S	S	.	.	H	α-helix	trans	-124.1	-6.9	179.9	-56.9	-82.2	0	0	0	114	I145 L146 P147 P151 L194	I145-Y149 HydrophobicContact CG2-CD2 3.83Å; I145-Y149 HydrophobicContact CG2-CE2 3.67Å; I145-Y149 WeakPolarHBondContact O-CD2 3.29Å; L146-Y149 PolarHBondContact O-N 3.37Å; P147-Y149 VanDerWaalsContact C-N 3.32Å; Y149-P151 WeakPolarHBondContact O-CD 3.21Å; Y149-L194 HydrophobicContact CE1-CD2 4.41Å; Y149-L194 VanDerWaalsContact OH-CD2 3.3Å; Y149-L194 WeakPolarHBondContact OH-CD2 3.36Å
150	I	40.5	Very low	39.3	Very low	59 Å²	59	95 Å²	95	30%	0.303	47%	0.472	S	S	.	.	S	Bend	trans	-92.2	115.5	163.5	-59.5	173	0	0	0	107.4	L146 M152	L146-I150 HydrophobicContact CD2-CD1 3.6Å; L146-I150 HydrophobicContact CG-CD1 4.1Å; L146-I150 WeakPolarHBondContact O-CG1 3.27Å; L146-I150 PolarHBondContact O-N 2.91Å; I150-M152 HydrophobicContact CG2-CG 4.07Å; I150-M152 PolarHBondContact O-N 2.79Å
151	P	34.7	Very low	38.2	Very low	75 Å²	75	96.2 Å²	96.2	49%	0.487	48%	0.483	S	S	.	.			trans	-67.9	89.6	165.3	29	-32.3	0	0	0	108.7	L32 Y149 S153	L32-P151 HydrophobicContact CB-CG 4.27Å; L32-P151 HydrophobicContact CD1-CG 4.4Å; Y149-P151 WeakPolarHBondContact O-CD 3.21Å; P151-S153 PolarHBondContact O-N 2.95Å
152	M	31.3	Very low	37.1	Very low	141 Å²	141	101.7 Å²	101.7	70%	0.695	51%	0.513	S	S	*	.			trans	-71.1	51.2	166	-79.6	-83.4	-158	0	0	110.2	I150 I154	I150-M152 HydrophobicContact CG2-CG 4.07Å; I150-M152 PolarHBondContact O-N 2.79Å; M152-I154 PolarHBondContact O-N 3.21Å; M152-I154 HydrophobicContact SD-CD1 4.31Å
153	S	31	Very low	36	Very low	67 Å²	67	106.9 Å²	106.9	47%	0.469	54%	0.54	S	S	.	.			trans	-78.2	69.2	169.2	55.4	0	0	0	0	109.3	P151 G155	P151-S153 PolarHBondContact O-N 2.95Å; S153-G155 PolarHBondContact O-N 3.44Å
154	I	28.7	Very low	34.9	Very low	153 Å²	153	111.5 Å²	111.5	79%	0.785	56%	0.557	S	S	*	*			trans	-74.1	66.7	161.1	-54.9	174.9	0	0	0	106.5	M152	M152-I154 PolarHBondContact O-N 3.21Å; M152-I154 HydrophobicContact SD-CD1 4.31Å
155	G	29.6	Very low	33.8	Very low	42 Å²	42	116.9 Å²	116.9	43%	0.433	58%	0.581	S	S	.	*			trans	-103	113.9	178.5	0	0	0	0	0	108.6	S153 Y157	S153-G155 PolarHBondContact O-N 3.44Å; G155-Y157 PolarHBondContact O-N 3.19Å
156	Y	26.9	Very low	32.8	Very low	228 Å²	228	125.3 Å²	125.3	89%	0.894	61%	0.61	S	S	*	*			trans	-53.4	108.7	168.3	-105.1	-105.1	0	0	0	108.9	N158	Y156-N158 VanDerWaalsContact C-N 3.31Å; Y156-N158 PolarHBondContact O-N 3Å
157	Y	27.4	Very low	31.9	Very low	176 Å²	176	129.2 Å²	129.2	69%	0.69	63%	0.631	S	S	*	*			trans	-67.7	99.3	160.9	-93.3	-85.1	0	0	0	107	G155 I159	G155-Y157 PolarHBondContact O-N 3.19Å; Y157-I159 VanDerWaalsContact C-N 3.25Å; Y157-I159 PolarHBondContact O-N 3.45Å
158	N	26.1	Very low	31.3	Very low	127 Å²	127	132.9 Å²	132.9	68%	0.679	65%	0.647	S	S	*	*			trans	-65.7	96.7	165.1	-156.6	29.2	0	0	0	105.8	Y156 I160	Y156-N158 VanDerWaalsContact C-N 3.31Å; Y156-N158 PolarHBondContact O-N 3Å; N158-I160 VanDerWaalsContact C-N 3.26Å; N158-I160 PolarHBondContact O-N 2.85Å
159	I	29.3	Very low	30.6	Very low	120 Å²	120	134.6 Å²	134.6	62%	0.615	67%	0.671	S	S	*	*			trans	-63.6	99.2	173.2	-53.4	177.1	0	0	0	104.7	Y157 T161	Y157-I159 VanDerWaalsContact C-N 3.25Å; Y157-I159 PolarHBondContact O-N 3.45Å; I159-T161 HydrophobicContact CG2-CG2 3.71Å; I159-T161 PolarHBondContact O-N 3.22Å
160	I	29.6	Very low	29.8	Very low	125 Å²	125	134.4 Å²	134.4	64%	0.641	69%	0.685	S	S	*	*			trans	-69.4	79.2	161.4	-62	177.8	0	0	0	104.9	N158 N162	N158-I160 VanDerWaalsContact C-N 3.26Å; N158-I160 PolarHBondContact O-N 2.85Å; I160-N162 HydrophobicContact CG2-CB 4.2Å; I160-N162 WeakPolarHBondContact CG2-OD1 3.28Å; I160-N162 PolarHBondContact O-N 3.38Å
161	T	28.9	Very low	29.3	Very low	98 Å²	98	139.3 Å²	139.3	60%	0.601	71%	0.71	S	S	*	*			trans	-62.1	79	147.3	49.7	0	0	0	0	105.5	I159 E163	I159-T161 HydrophobicContact CG2-CG2 3.71Å; I159-T161 PolarHBondContact O-N 3.22Å; T161-E163 PolarHBondContact O-N 3.01Å; T161-E163 VanDerWaalsContact O-N 3.08Å
162	N	30.4	Very low	28.9	Very low	142 Å²	142	145.9 Å²	145.9	76%	0.759	73%	0.726	S	S	*	*			trans	-56.8	118.1	155.9	-94.4	-0.2	0	0	0	105.1	I160 F164	I160-N162 HydrophobicContact CG2-CB 4.2Å; I160-N162 WeakPolarHBondContact CG2-OD1 3.28Å; I160-N162 PolarHBondContact O-N 3.38Å; N162-F164 PolarHBondContact O-N 2.97Å
163	E	31.7	Very low	28.7	Very low	179 Å²	179	147.4 Å²	147.4	84%	0.836	73%	0.734	S	S	*	*			trans	-46.5	131	178.7	-68.4	164.4	133.2	0	0	109.9	T161 H165	T161-E163 PolarHBondContact O-N 3.01Å; T161-E163 VanDerWaalsContact O-N 3.08Å; E163-H165 PolarHBondContact O-N 3.27Å
164	F	27.5	Very low	28.5	Very low	175 Å²	175	151.1 Å²	151.1	77%	0.768	75%	0.748	S	S	*	*				39	87.3	123.5	-100.8	-94.3	0	0	0	115.7	N162 W166	N162-F164 PolarHBondContact O-N 2.97Å; F164-W166 AromaticContact CD1-CD1 3.98Å; F164-W166 AromaticContact CE1-CD1 3.86Å
165	H	28.1	Very low	28.5	Very low	168 Å²	168	152.4 Å²	152.4	78%	0.778	76%	0.755	S	S	*	*				-137.4	105.2	129.2	-143.3	-73.8	0	0	0	111	E163 N167	E163-H165 PolarHBondContact O-N 3.27Å; H165-N167 VanDerWaalsContact C-N 3.35Å; H165-N167 PolarHBondContact O-N 3.47Å; H165-N167 VanDerWaalsContact O-N 3.07Å
166	W	30	Very low	28.3	Very low	217 Å²	217	154.5 Å²	154.5	82%	0.822	76%	0.763	S	S	*	*			trans	-74.8	91.4	166.5	-75.6	80.6	0	0	0	108	F164	F164-W166 AromaticContact CD1-CD1 3.98Å; F164-W166 AromaticContact CE1-CD1 3.86Å
167	N	27.2	Very low	28.2	Very low	132 Å²	132	149 Å²	149	71%	0.706	76%	0.758	S	S	*	*			trans	-179.7	93.5	154.8	-93.5	-15.1	0	0	0	108.3	H165	H165-N167 VanDerWaalsContact C-N 3.35Å; H165-N167 PolarHBondContact O-N 3.47Å; H165-N167 VanDerWaalsContact O-N 3.07Å
168	D	29.3	Very low	28.3	Very low	147 Å²	147	146.3 Å²	146.3	79%	0.786	77%	0.765	S	S	*	*			trans	178.4	83.1	141	-93.2	-14.2	0	0	0	109.9	S170	D168-S170 PolarHBondContact O-N 3.37Å
169	T	29.1	Very low	28.3	Very low	154 Å²	154	145.1 Å²	145.1	95%	0.945	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	62.5	174.7	47.7	0	0	0	0	111.8
170	S	29.5	Very low	28.2	Very low	98 Å²	98	144.7 Å²	144.7	69%	0.685	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.9	27.1	177.5	60.8	0	0	0	0	118.3	D168	D168-S170 PolarHBondContact O-N 3.37Å
171	I	29	Very low	28	Very low	162 Å²	162	144.4 Å²	144.4	83%	0.831	78%	0.783	S	S	*	*			trans	-122.1	63.4	165.7	-45.7	-177	0	0	0	111.7
172	Y	26.2	Very low	27.9	Very low	213 Å²	213	144.6 Å²	144.6	84%	0.835	79%	0.789	S	S	*	*			trans	-89.2	145.8	156.3	-119.4	-105.4	0	0	0	108.6
173	M	27	Very low	27.8	Very low	172 Å²	172	142.6 Å²	142.6	85%	0.847	79%	0.786	S	S	*	*			trans	61.4	85.8	164.8	-60.2	-76.6	-140.6	0	0	117.8
174	N	26.6	Very low	27.5	Very low	145 Å²	145	140.2 Å²	140.2	78%	0.775	78%	0.779	S	S	*	*			trans	-152.8	57.3	144.7	-133	-7	0	0	0	114.5
175	I	28.8	Very low	27.5	Very low	180 Å²	180	138.8 Å²	138.8	92%	0.923	78%	0.779	S	S	*	*			trans	-107.7	67.8	165.6	-53.9	179.9	0	0	0	108.3
176	S	25.4	Very low	27.6	Very low	87 Å²	87	138.6 Å²	138.6	61%	0.608	78%	0.778	S	S	*	*			trans	-158.4	129.6	173.6	45.5	0	0	0	0	112.7
177	S	25.7	Very low	27.8	Very low	113 Å²	113	133.8 Å²	133.8	79%	0.79	77%	0.773	S	S	*	*			trans	60.3	87.1	160.9	55.5	0	0	0	0	119.6
178	S	28.1	Very low	28.2	Very low	119 Å²	119	129.8 Å²	129.8	83%	0.832	75%	0.754	S	S	*	*			trans	157.4	147.7	140.2	48.1	0	0	0	0	109
179	S	27.3	Very low	28.5	Very low	102 Å²	102	131 Å²	131	71%	0.713	75%	0.752	S	S	*	*			cis	-162.1	146.6	-24.2	40.5	0	0	0	0	108.2
180	S	25.8	Very low	28.9	Very low	111 Å²	111	130.7 Å²	130.7	78%	0.776	74%	0.735	S	S	*	*			trans	51	90.7	161.8	57.5	0	0	0	0	119.9
181	S	27	Very low	29.3	Very low	118 Å²	118	130.4 Å²	130.4	83%	0.825	73%	0.725	S	S	*	*				-179.4	146	115.7	41.8	0	0	0	0	111.9	S183	S181-S183 PolarHBondContact O-N 2.89Å; S181-S183 VanDerWaalsContact O-N 3.17Å
182	S	26.5	Very low	29.9	Very low	103 Å²	103	125 Å²	125	72%	0.72	70%	0.7	S	S	*	*			trans	-42.6	102.6	-167.6	51.7	0	0	0	0	117.9	N184	S182-N184 PolarHBondContact O-N 3.21Å
183	S	27.3	Very low	30.8	Very low	100 Å²	100	118.6 Å²	118.6	70%	0.699	68%	0.678	S	S	*	*			trans	-83.3	93.4	158.8	49.2	0	0	0	0	110.5	S181 N185	S181-S183 PolarHBondContact O-N 2.89Å; S181-S183 VanDerWaalsContact O-N 3.17Å; S183-N185 PolarHBondContact O-N 3.04Å
184	N	26.1	Very low	31.9	Very low	129 Å²	129	110.8 Å²	110.8	69%	0.69	64%	0.639	S	S	*	*			trans	-71.9	73.9	176.6	-78.6	-20.3	0	0	0	111.6	S182 H186	S182-N184 PolarHBondContact O-N 3.21Å; N184-H186 PolarHBondContact O-N 3.01Å
185	N	27.5	Very low	32.9	Very low	145 Å²	145	105.7 Å²	105.7	78%	0.775	61%	0.614	S	S	*	*			trans	-73.2	52.5	169.8	-77	-8.5	0	0	0	111.7	S183	S183-N185 PolarHBondContact O-N 3.04Å
186	H	29.5	Very low	34	Very low	163 Å²	163	98.7 Å²	98.7	76%	0.755	58%	0.583	S	S	*	*			trans	-97	75.7	169.8	-79.9	-47	0	0	0	109.7	N184 P188	N184-H186 PolarHBondContact O-N 3.01Å; H186-P188 WeakPolarHBondContact O-CD 3.4Å
187	T	35.1	Very low	35.4	Very low	117 Å²	117	98 Å²	98	72%	0.718	57%	0.572	S	S	*	*			trans	-59	119.1	150.2	44.5	0	0	0	0	106.8	K189	T187-K189 PolarHBondContact O-N 3.36Å
188	P	34.7	Very low	36.7	Very low	47 Å²	47	93.6 Å²	93.6	31%	0.305	54%	0.539	S	S	.	.			trans	-64.2	127.2	-173.5	23.3	-31.6	0	0	0	108.8	H186 Y190 L191	H186-P188 WeakPolarHBondContact O-CD 3.4Å; P188-Y190 PolarHBondContact O-N 3.14Å; P188-L191 HydrophobicContact CG-CB 4.48Å; P188-L191 HydrophobicContact CG-CD1 4.26Å; P188-L191 PolarHBondContact O-N 3.06Å
189	K	37.2	Very low	37.8	Very low	173 Å²	173	89.7 Å²	89.7	75%	0.752	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-20.7	179.4	-69.8	178.7	176.9	176.6	0	113.2	T187 T192 Q193	T187-K189 PolarHBondContact O-N 3.36Å; K189-T192 PolarHBondContact O-OG1 2.92Å; K189-Q193 WeakPolarHBondContact O-CG 3.42Å; K189-Q193 PolarHBondContact O-N 3.39Å
190	Y	36.6	Very low	39	Very low	147 Å²	147	90.4 Å²	90.4	58%	0.576	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-43.1	171.4	-109.9	-92.6	0	0	0	113.5	P188 T192 Q193 L194	P188-Y190 PolarHBondContact O-N 3.14Å; Y190-T192 PolarHBondContact O-N 2.87Å; Y190-Q193 PolarHBondContact O-N 3.46Å; Y190-Q193 VanDerWaalsContact O-N 3.09Å; Y190-L194 PolarHBondContact O-N 3.4Å; Y190-L194 VanDerWaalsContact O-N 3.14Å
191	L	38.6	Very low	40.4	Very low	92 Å²	92	86.6 Å²	86.6	48%	0.482	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-35.8	-177.2	-128.7	86.9	0	0	0	111.7	P188	P188-L191 HydrophobicContact CG-CB 4.48Å; P188-L191 HydrophobicContact CG-CD1 4.26Å; P188-L191 PolarHBondContact O-N 3.06Å
192	T	40.4	Very low	41.7	Very low	48 Å²	48	83.8 Å²	83.8	29%	0.294	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-12.6	-179.4	62.1	0	0	0	0	113.5	P29 K189 Y190	P29-T192 HydrophobicContact CB-CG2 4.36Å; P29-T192 HydrophobicContact CG-CG2 3.74Å; K189-T192 PolarHBondContact O-OG1 2.92Å; Y190-T192 PolarHBondContact O-N 2.87Å
193	Q	45.9	Very low	43	Very low	79 Å²	79	82.5 Å²	82.5	37%	0.369	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-17.4	178.7	-71.1	177.6	-20.1	0	0	112.7	K189 Y190 A196 I197	K189-Q193 WeakPolarHBondContact O-CG 3.42Å; K189-Q193 PolarHBondContact O-N 3.39Å; Y190-Q193 PolarHBondContact O-N 3.46Å; Y190-Q193 VanDerWaalsContact O-N 3.09Å; Q193-A196 PolarHBondContact O-N 3.36Å; Q193-I197 HydrophobicContact CB-CD1 4.35Å; Q193-I197 WeakPolarHBondContact O-CG1 3.08Å; Q193-I197 PolarHBondContact O-N 3.23Å; Q193-I197 VanDerWaalsContact O-N 3.14Å
194	L	48.9	Very low	44.2	Very low	9 Å²	9	81.7 Å²	81.7	5%	0.047	42%	0.424	C	S	.	.	H	α-helix	trans	-55.8	-44	-176	-149.6	89.2	0	0	0	114.2	Y149 Y190 A196 I197 L198 I536	Y149-L194 HydrophobicContact CE1-CD2 4.41Å; Y149-L194 VanDerWaalsContact OH-CD2 3.3Å; Y149-L194 WeakPolarHBondContact OH-CD2 3.36Å; Y190-L194 PolarHBondContact O-N 3.4Å; Y190-L194 VanDerWaalsContact O-N 3.14Å; L194-A196 VanDerWaalsContact C-N 3.33Å; L194-A196 PolarHBondContact O-N 2.83Å; L194-I197 PolarHBondContact O-N 2.9Å; L194-L198 HydrophobicContact CD2-CD1 4.24Å; L194-L198 HydrophobicContact CG-CD1 4.38Å; L194-L198 VanDerWaalsContact O-CG 3.29Å; L194-L198 WeakPolarHBondContact O-CG 3.27Å; L194-L198 PolarHBondContact O-N 2.92Å; L194-I536 HydrophobicContact CD1-CG2 3.88Å
195	P	49.5	Very low	45.5	Very low	38 Å²	38	78.6 Å²	78.6	25%	0.247	40%	0.403	C	S	.	.	H	α-helix	trans	-61.6	-39.1	178.5	-24.3	35.9	0	0	0	113	L198 T199	P195-L198 PolarHBondContact O-N 3.2Å; P195-T199 WeakPolarHBondContact O-CG2 3.47Å; P195-T199 PolarHBondContact O-N 2.87Å; P195-T199 PolarHBondContact O-OG1 2.89Å
196	A	50.8	Low	46.7	Very low	33 Å²	33	73.4 Å²	73.4	27%	0.273	38%	0.375	S	S	.	.	H	α-helix	trans	-68.4	-35.9	178	0	0	0	0	0	112.4	W22 Q193 L194 T199 M200	W22-A196 HydrophobicContact CE3-CB 4.41Å; W22-A196 HydrophobicContact CZ3-CB 4.09Å; Q193-A196 PolarHBondContact O-N 3.36Å; L194-A196 VanDerWaalsContact C-N 3.33Å; L194-A196 PolarHBondContact O-N 2.83Å; A196-T199 WeakPolarHBondContact CA-OG1 3.24Å; A196-T199 PolarHBondContact O-OG1 2.98Å; A196-T199 VanDerWaalsContact O-OG1 3.09Å; A196-M200 WeakPolarHBondContact O-CB 3.28Å; A196-M200 VanDerWaalsContact O-CG 3.28Å; A196-M200 WeakPolarHBondContact O-CG 3.47Å; A196-M200 PolarHBondContact O-N 3.41Å
197	I	54.1	Low	47.9	Very low	71 Å²	71	69.4 Å²	69.4	36%	0.364	36%	0.362	S	S	.	.	H	α-helix	trans	-65.9	-42.9	174	-65.2	166.2	0	0	0	110.2	Q193 L194 Q201	Q193-I197 HydrophobicContact CB-CD1 4.35Å; Q193-I197 WeakPolarHBondContact O-CG1 3.08Å; Q193-I197 PolarHBondContact O-N 3.23Å; Q193-I197 VanDerWaalsContact O-N 3.14Å; L194-I197 PolarHBondContact O-N 2.9Å; I197-Q201 WeakPolarHBondContact O-CB 3.33Å; I197-Q201 PolarHBondContact O-N 2.82Å
198	L	52.8	Low	48.6	Very low	21 Å²	21	65.4 Å²	65.4	11%	0.11	34%	0.336	C	S	.	.	H	α-helix	trans	-66.1	-43.4	178.1	-68.4	170.3	0	0	0	112.4	L194 P195 Q201 I202 Y533	L194-L198 HydrophobicContact CD2-CD1 4.24Å; L194-L198 HydrophobicContact CG-CD1 4.38Å; L194-L198 VanDerWaalsContact O-CG 3.29Å; L194-L198 WeakPolarHBondContact O-CG 3.27Å; L194-L198 PolarHBondContact O-N 2.92Å; P195-L198 PolarHBondContact O-N 3.2Å; L198-Q201 PolarHBondContact O-N 3.15Å; L198-I202 WeakPolarHBondContact O-CG1 3.27Å; L198-I202 PolarHBondContact O-N 3.49Å; L198-Y533 HydrophobicContact CD2-CD2 4.01Å; L198-Y533 HydrophobicContact CD2-CE2 3.58Å
199	T	52.7	Low	49.5	Very low	38 Å²	38	65.2 Å²	65.2	23%	0.233	34%	0.335	C	S	.	.	H	α-helix	trans	-65.3	-41.9	176.4	53	0	0	0	0	112	P195 A196 Q201 I202 V203	P195-T199 WeakPolarHBondContact O-CG2 3.47Å; P195-T199 PolarHBondContact O-N 2.87Å; P195-T199 PolarHBondContact O-OG1 2.89Å; A196-T199 WeakPolarHBondContact CA-OG1 3.24Å; A196-T199 PolarHBondContact O-OG1 2.98Å; A196-T199 VanDerWaalsContact O-OG1 3.09Å; T199-Q201 VanDerWaalsContact C-N 3.31Å; T199-Q201 PolarHBondContact O-N 3.28Å; T199-I202 PolarHBondContact O-N 3.46Å; T199-V203 WeakPolarHBondContact O-CG2 3.3Å; T199-V203 PolarHBondContact O-N 3.27Å
200	M	52.8	Low	50.5	Low	116 Å²	116	63.6 Å²	63.6	57%	0.571	33%	0.325	S	S	*	.	H	α-helix	trans	-60.8	-38.6	173.4	-75.3	-69.4	-109.7	0	0	112.3	A196 V203 L204	A196-M200 WeakPolarHBondContact O-CB 3.28Å; A196-M200 VanDerWaalsContact O-CG 3.28Å; A196-M200 WeakPolarHBondContact O-CG 3.47Å; A196-M200 PolarHBondContact O-N 3.41Å; M200-V203 PolarHBondContact O-N 3.45Å; M200-L204 WeakPolarHBondContact O-CB 3.2Å; M200-L204 PolarHBondContact O-N 3.11Å
201	Q	53.5	Low	51.2	Low	31 Å²	31	61.4 Å²	61.4	15%	0.145	32%	0.322	C	S	.	.	H	α-helix	trans	-68.8	-37.6	176.3	-163	-173.4	11.1	0	0	112.5	I197 L198 T199 L204 R205 C529	I197-Q201 WeakPolarHBondContact O-CB 3.33Å; I197-Q201 PolarHBondContact O-N 2.82Å; L198-Q201 PolarHBondContact O-N 3.15Å; T199-Q201 VanDerWaalsContact C-N 3.31Å; T199-Q201 PolarHBondContact O-N 3.28Å; Q201-L204 PolarHBondContact O-N 3.34Å; Q201-R205 WeakPolarHBondContact O-CG 3.41Å; Q201-R205 PolarHBondContact O-N 2.89Å; Q201-C529 PolarHBondContact NE2-O 3.36Å
202	I	55.7	Low	51.8	Low	59 Å²	59	60.2 Å²	60.2	30%	0.303	32%	0.316	S	S	.	.	H	α-helix	trans	-63.9	-46.7	174.2	-69.6	165.2	0	0	0	110.3	L198 T199 L204 R205 L206	L198-I202 WeakPolarHBondContact O-CG1 3.27Å; L198-I202 PolarHBondContact O-N 3.49Å; T199-I202 PolarHBondContact O-N 3.46Å; I202-L204 VanDerWaalsContact C-N 3.32Å; I202-L204 PolarHBondContact O-N 2.9Å; I202-R205 PolarHBondContact O-N 3.3Å; I202-L206 HydrophobicContact CG2-CD1 3.94Å; I202-L206 WeakPolarHBondContact O-CG 3.5Å; I202-L206 PolarHBondContact O-N 3.4Å
203	V	52.8	Low	52.5	Low	77 Å²	77	59.6 Å²	59.6	47%	0.467	31%	0.31	S	S	.	.	H	α-helix	trans	-58.7	-43.7	175.8	171.6	0	0	0	0	111	T199 M200 L206 T207	T199-V203 WeakPolarHBondContact O-CG2 3.3Å; T199-V203 PolarHBondContact O-N 3.27Å; M200-V203 PolarHBondContact O-N 3.45Å; V203-L206 PolarHBondContact O-N 3.05Å; V203-T207 HydrophobicContact CG1-CG2 4.45Å; V203-T207 WeakPolarHBondContact O-CG2 3.47Å; V203-T207 PolarHBondContact O-N 3.28Å; V203-T207 PolarHBondContact O-OG1 3.24Å
204	L	52.7	Low	52.7	Low	83 Å²	83	57.4 Å²	57.4	44%	0.435	31%	0.309	S	S	.	.	H	α-helix	trans	-67.7	-34.8	178.8	-170.3	140.2	0	0	0	113.2	M200 Q201 I202 T207 L208	M200-L204 WeakPolarHBondContact O-CB 3.2Å; M200-L204 PolarHBondContact O-N 3.11Å; Q201-L204 PolarHBondContact O-N 3.34Å; I202-L204 VanDerWaalsContact C-N 3.32Å; I202-L204 PolarHBondContact O-N 2.9Å; L204-T207 WeakPolarHBondContact CA-OG1 3.15Å; L204-T207 PolarHBondContact O-OG1 3.47Å; L204-T207 VanDerWaalsContact O-OG1 3.12Å; L204-L208 HydrophobicContact CD2-CD1 3.81Å; L204-L208 WeakPolarHBondContact O-CB 3.45Å; L204-L208 VanDerWaalsContact O-CG 3.3Å; L204-L208 WeakPolarHBondContact O-CG 3.28Å; L204-L208 PolarHBondContact O-N 3.38Å; L204-L208 VanDerWaalsContact O-N 3.17Å
205	R	53.3	Low	52.8	Low	64 Å²	64	59.9 Å²	59.9	24%	0.242	32%	0.322	C	S	.	.	H	α-helix	trans	-67.2	-40.7	171.7	-72.7	178.1	-171.7	-168.2	8.2	111.8	Q201 I202 C209	Q201-R205 WeakPolarHBondContact O-CG 3.41Å; Q201-R205 PolarHBondContact O-N 2.89Å; I202-R205 PolarHBondContact O-N 3.3Å; R205-C209 PolarHBondContact O-N 3.37Å; R205-C209 PolarHBondContact O-SG 2.91Å
206	L	53.5	Low	52.8	Low	36 Å²	36	60.2 Å²	60.2	19%	0.188	32%	0.321	C	S	.	.	H	α-helix	trans	-66.4	-44.5	177.4	-73.5	169.7	0	0	0	111.9	P89 M93 I202 V203 L208 C209 W210	P89-L206 HydrophobicContact CB-CD1 4.19Å; M93-L206 HydrophobicContact CE-CB 3.99Å; M93-L206 HydrophobicContact CE-CD2 4.44Å; M93-L206 WeakPolarHBondContact CE-O 3.09Å; M93-L206 HydrophobicContact SD-CD2 4.25Å; I202-L206 HydrophobicContact CG2-CD1 3.94Å; I202-L206 WeakPolarHBondContact O-CG 3.5Å; I202-L206 PolarHBondContact O-N 3.4Å; V203-L206 PolarHBondContact O-N 3.05Å; L206-L208 VanDerWaalsContact C-N 3.35Å; L206-L208 PolarHBondContact O-N 3.49Å; L206-C209 WeakPolarHBondContact O-CB 3.43Å; L206-C209 PolarHBondContact O-N 2.99Å; L206-C209 VanDerWaalsContact O-N 3.16Å; L206-W210 PolarHBondContact O-N 2.79Å
207	T	53.4	Low	52.9	Low	79 Å²	79	61.4 Å²	61.4	49%	0.485	33%	0.325	S	S	.	.	H	α-helix	trans	-64.7	-37.6	177.5	54.7	0	0	0	0	112.4	V203 L204 W210 L211	V203-T207 HydrophobicContact CG1-CG2 4.45Å; V203-T207 WeakPolarHBondContact O-CG2 3.47Å; V203-T207 PolarHBondContact O-N 3.28Å; V203-T207 PolarHBondContact O-OG1 3.24Å; L204-T207 WeakPolarHBondContact CA-OG1 3.15Å; L204-T207 PolarHBondContact O-OG1 3.47Å; L204-T207 VanDerWaalsContact O-OG1 3.12Å; T207-W210 PolarHBondContact O-N 3.01Å; T207-L211 PolarHBondContact O-N 3.38Å
208	L	51	Low	52.7	Low	33 Å²	33	62.5 Å²	62.5	17%	0.173	33%	0.332	C	S	.	.	H	α-helix	trans	-60.8	-43.2	170.8	-75.4	170	0	0	0	112	L204 L206 W210 L211 I212 M522 I525	L204-L208 HydrophobicContact CD2-CD1 3.81Å; L204-L208 WeakPolarHBondContact O-CB 3.45Å; L204-L208 VanDerWaalsContact O-CG 3.3Å; L204-L208 WeakPolarHBondContact O-CG 3.28Å; L204-L208 PolarHBondContact O-N 3.38Å; L204-L208 VanDerWaalsContact O-N 3.17Å; L206-L208 VanDerWaalsContact C-N 3.35Å; L206-L208 PolarHBondContact O-N 3.49Å; L208-W210 VanDerWaalsContact C-N 3.32Å; L208-W210 PolarHBondContact O-N 3.41Å; L208-L211 PolarHBondContact O-N 2.82Å; L208-I212 WeakPolarHBondContact O-CG1 3.22Å; L208-I212 PolarHBondContact O-N 2.79Å; L208-M522 HydrophobicContact CD2-CE 4.01Å; L208-I525 HydrophobicContact CD1-CG2 3.76Å; L208-I525 HydrophobicContact CD2-CG2 4.11Å
209	C	53.6	Low	52.6	Low	42 Å²	42	64.6 Å²	64.6	28%	0.284	34%	0.338	S	S	.	.	H	α-helix	trans	-61	-40.3	174.6	-67.1	0	0	0	0	112.1	R205 L206 I212 I213	R205-C209 PolarHBondContact O-N 3.37Å; R205-C209 PolarHBondContact O-SG 2.91Å; L206-C209 WeakPolarHBondContact O-CB 3.43Å; L206-C209 PolarHBondContact O-N 2.99Å; L206-C209 VanDerWaalsContact O-N 3.16Å; C209-I212 WeakPolarHBondContact O-CB 3.45Å; C209-I212 PolarHBondContact O-N 3.32Å; C209-I213 WeakPolarHBondContact O-CG1 3.42Å; C209-I213 PolarHBondContact O-N 2.86Å
210	W	57.3	Low	52.5	Low	140 Å²	140	65.3 Å²	65.3	53%	0.53	34%	0.34	S	S	.	.	H	α-helix	trans	-66.2	-38.9	177.5	-144.8	76.9	0	0	0	112.4	M93 L206 T207 L208 I212 I213 G214	M93-W210 HydrophobicContact CE-CB 3.94Å; M93-W210 HydrophobicContact CE-CG 4.01Å; L206-W210 PolarHBondContact O-N 2.79Å; T207-W210 PolarHBondContact O-N 3.01Å; L208-W210 VanDerWaalsContact C-N 3.32Å; L208-W210 PolarHBondContact O-N 3.41Å; W210-I212 VanDerWaalsContact C-N 3.34Å; W210-I212 PolarHBondContact O-N 2.77Å; W210-I213 PolarHBondContact O-N 3.43Å; W210-G214 PolarHBondContact O-N 3.08Å
211	L	51.2	Low	52.4	Low	101 Å²	101	65.8 Å²	65.8	53%	0.529	34%	0.336	S	S	.	.	H	α-helix	trans	-62.1	-40	173.3	-120.4	169.2	0	0	0	112	T207 L208 L215	T207-L211 PolarHBondContact O-N 3.38Å; L208-L211 PolarHBondContact O-N 2.82Å; L211-L215 HydrophobicContact CD2-CD1 4.09Å; L211-L215 HydrophobicContact CD2-CG 4.32Å; L211-L215 WeakPolarHBondContact O-CB 3.5Å; L211-L215 VanDerWaalsContact O-CG 3.29Å; L211-L215 WeakPolarHBondContact O-CG 3.43Å; L211-L215 PolarHBondContact O-N 3.24Å
212	I	52.3	Low	52.1	Low	66 Å²	66	67.5 Å²	67.5	34%	0.338	35%	0.346	S	S	.	.	H	α-helix	trans	-61.7	-49.2	173.6	-66.9	165.6	0	0	0	110.5	L208 C209 W210 G214 L215 L216 M522	L208-I212 WeakPolarHBondContact O-CG1 3.22Å; L208-I212 PolarHBondContact O-N 2.79Å; C209-I212 WeakPolarHBondContact O-CB 3.45Å; C209-I212 PolarHBondContact O-N 3.32Å; W210-I212 VanDerWaalsContact C-N 3.34Å; W210-I212 PolarHBondContact O-N 2.77Å; I212-G214 PolarHBondContact O-N 3.49Å; I212-L215 PolarHBondContact O-N 2.96Å; I212-L216 HydrophobicContact CG2-CD1 3.63Å; I212-L216 HydrophobicContact CG2-CG 4.38Å; I212-L216 WeakPolarHBondContact O-CB 3.39Å; I212-L216 WeakPolarHBondContact O-CD1 3.25Å; I212-L216 VanDerWaalsContact O-CG 3.26Å; I212-L216 WeakPolarHBondContact O-CG 3.45Å; I212-L216 PolarHBondContact O-N 3.43Å; I212-M522 HydrophobicContact CD1-CE 3.84Å; I212-M522 HydrophobicContact CG1-CE 3.43Å; I212-M522 VanDerWaalsContact CG1-CE 3.43Å
213	I	54.7	Low	51.9	Low	35 Å²	35	70.1 Å²	70.1	18%	0.179	36%	0.36	C	S	.	.	H	α-helix	trans	-61.3	-45	-180	-67.5	166.2	0	0	0	111	M97 C209 W210 L216 T217	M97-I213 HydrophobicContact SD-CD1 4.27Å; C209-I213 WeakPolarHBondContact O-CG1 3.42Å; C209-I213 PolarHBondContact O-N 2.86Å; W210-I213 PolarHBondContact O-N 3.43Å; I213-L216 PolarHBondContact O-N 3.15Å; I213-T217 PolarHBondContact O-N 3.3Å; I213-T217 PolarHBondContact O-OG1 3.44Å
214	G	50.6	Low	51.6	Low	33 Å²	33	69 Å²	69	34%	0.34	35%	0.351	S	S	.	.	H	α-helix	trans	-64.5	-38.1	178	0	0	0	0	0	113.9	W210 I212 T217 N218	W210-G214 PolarHBondContact O-N 3.08Å; I212-G214 PolarHBondContact O-N 3.49Å; G214-T217 PolarHBondContact O-OG1 2.86Å; G214-N218 WeakPolarHBondContact O-CB 3.47Å; G214-N218 PolarHBondContact O-N 3.39Å
215	L	49.9	Very low	51.5	Low	61 Å²	61	70.7 Å²	70.7	32%	0.319	36%	0.357	S	S	.	.	H	α-helix	trans	-67.5	-40.9	173.5	-73.6	169.3	0	0	0	111.4	L211 I212 R219 L518	L211-L215 HydrophobicContact CD2-CD1 4.09Å; L211-L215 HydrophobicContact CD2-CG 4.32Å; L211-L215 WeakPolarHBondContact O-CB 3.5Å; L211-L215 VanDerWaalsContact O-CG 3.29Å; L211-L215 WeakPolarHBondContact O-CG 3.43Å; L211-L215 PolarHBondContact O-N 3.24Å; I212-L215 PolarHBondContact O-N 2.96Å; L215-R219 WeakPolarHBondContact O-CB 3.3Å; L215-R219 WeakPolarHBondContact O-CD 3.38Å; L215-R219 WeakPolarHBondContact O-CG 3.31Å; L215-R219 PolarHBondContact O-N 2.97Å; L215-L518 HydrophobicContact CD1-CD1 4.39Å; L215-L518 HydrophobicContact CD1-CD2 4.16Å
216	L	50.6	Low	51	Low	46 Å²	46	70.3 Å²	70.3	24%	0.241	36%	0.359	C	S	.	.	H	α-helix	trans	-66.7	-44	178.6	-73.9	165.2	0	0	0	112.9	F127 I212 I213 R219 I220	F127-L216 HydrophobicContact CD1-CD1 4.29Å; F127-L216 HydrophobicContact CE1-CD1 3.47Å; F127-L216 VanDerWaalsContact CE1-CD1 3.47Å; F127-L216 HydrophobicContact CE2-CD1 3.98Å; F127-L216 HydrophobicContact CE2-CD2 4.33Å; F127-L216 HydrophobicContact CZ-CD1 3.3Å; F127-L216 HydrophobicContact CZ-CD2 3.91Å; F127-L216 HydrophobicContact CZ-CG 4.25Å; I212-L216 HydrophobicContact CG2-CD1 3.63Å; I212-L216 HydrophobicContact CG2-CG 4.38Å; I212-L216 WeakPolarHBondContact O-CB 3.39Å; I212-L216 WeakPolarHBondContact O-CD1 3.25Å; I212-L216 VanDerWaalsContact O-CG 3.26Å; I212-L216 WeakPolarHBondContact O-CG 3.45Å; I212-L216 PolarHBondContact O-N 3.43Å; I213-L216 PolarHBondContact O-N 3.15Å; L216-R219 PolarHBondContact O-N 3.22Å; L216-I220 VanDerWaalsContact O-CG1 3.3Å; L216-I220 WeakPolarHBondContact O-CG1 3.16Å; L216-I220 PolarHBondContact O-N 3.44Å
217	T	52.5	Low	50.4	Low	57 Å²	57	76.3 Å²	76.3	35%	0.35	38%	0.381	S	S	.	.	H	α-helix	trans	-64.3	-42.1	176.9	45.1	0	0	0	0	111.7	I213 G214 R219 I220 Y221	I213-T217 PolarHBondContact O-N 3.3Å; I213-T217 PolarHBondContact O-OG1 3.44Å; G214-T217 PolarHBondContact O-OG1 2.86Å; T217-R219 VanDerWaalsContact C-N 3.31Å; T217-R219 PolarHBondContact O-N 2.89Å; T217-I220 PolarHBondContact O-N 3Å; T217-Y221 WeakPolarHBondContact O-CB 3.17Å; T217-Y221 PolarHBondContact O-N 3.38Å
218	N	50.1	Low	50.3	Low	95 Å²	95	77.6 Å²	77.6	51%	0.508	38%	0.383	S	S	.	.	H	α-helix	trans	-61.6	-38.8	174.3	-164.7	8.1	0	0	0	111.8	G214 Y221 I222	G214-N218 WeakPolarHBondContact O-CB 3.47Å; G214-N218 PolarHBondContact O-N 3.39Å; N218-Y221 WeakPolarHBondContact O-CB 3.3Å; N218-Y221 PolarHBondContact O-N 2.87Å; N218-I222 WeakPolarHBondContact O-CG1 3.28Å; N218-I222 PolarHBondContact O-N 3.45Å
219	R	49.5	Very low	49.9	Very low	65 Å²	65	80.5 Å²	80.5	25%	0.245	40%	0.399	C	S	.	.	H	α-helix	trans	-67.7	-41.9	174.9	-72.6	160	173.7	-124	-22.7	113	L215 L216 T217 Y221 I222 L223 D515	L215-R219 WeakPolarHBondContact O-CB 3.3Å; L215-R219 WeakPolarHBondContact O-CD 3.38Å; L215-R219 WeakPolarHBondContact O-CG 3.31Å; L215-R219 PolarHBondContact O-N 2.97Å; L216-R219 PolarHBondContact O-N 3.22Å; T217-R219 VanDerWaalsContact C-N 3.31Å; T217-R219 PolarHBondContact O-N 2.89Å; R219-Y221 VanDerWaalsContact C-N 3.29Å; R219-Y221 PolarHBondContact O-N 3.21Å; R219-I222 PolarHBondContact O-N 2.93Å; R219-L223 WeakPolarHBondContact O-CB 3.39Å; R219-L223 PolarHBondContact O-N 3.28Å; R219-D515 IonicContact CZ-OD1 3.54Å; R219-D515 IonicContact NH1-OD1 3.11Å; R219-D515 PolarHBondContact NH1-OD1 2.85Å; R219-D515 IonicContact NH1-OD2 2.67Å; R219-D515 PolarHBondContact NH1-OD2 3.44Å; R219-D515 IonicContact NH2-OD1 3.57Å; R219-D515 PolarHBondContact NH2-OD1 3.19Å
220	I	52.2	Low	49.6	Very low	52 Å²	52	82.8 Å²	82.8	27%	0.267	41%	0.414	S	S	.	.	H	α-helix	trans	-62.4	-39.8	174.6	-68.8	164.8	0	0	0	110.2	F104 L216 T217 L223 N224	F104-I220 HydrophobicContact CZ-CD1 4.34Å; F104-I220 HydrophobicContact CZ-CG2 4.22Å; L216-I220 VanDerWaalsContact O-CG1 3.3Å; L216-I220 WeakPolarHBondContact O-CG1 3.16Å; L216-I220 PolarHBondContact O-N 3.44Å; T217-I220 PolarHBondContact O-N 3Å; I220-L223 PolarHBondContact O-N 2.99Å; I220-N224 VanDerWaalsContact O-CB 3.24Å; I220-N224 WeakPolarHBondContact O-CB 3.27Å; I220-N224 PolarHBondContact O-N 3.43Å
221	Y	49.5	Very low	48.8	Very low	126 Å²	126	83.9 Å²	83.9	49%	0.494	43%	0.429	S	S	.	.	H	α-helix	trans	-59.4	-52.4	173.9	179.4	-85.3	0	0	0	111.5	T217 N218 R219 L223 N224 E225	T217-Y221 WeakPolarHBondContact O-CB 3.17Å; T217-Y221 PolarHBondContact O-N 3.38Å; N218-Y221 WeakPolarHBondContact O-CB 3.3Å; N218-Y221 PolarHBondContact O-N 2.87Å; R219-Y221 VanDerWaalsContact C-N 3.29Å; R219-Y221 PolarHBondContact O-N 3.21Å; Y221-L223 PolarHBondContact O-N 3.29Å; Y221-N224 PolarHBondContact O-N 3.48Å; Y221-N224 VanDerWaalsContact O-N 3.16Å; Y221-E225 VanDerWaalsContact CE1-OE2 3.3Å; Y221-E225 WeakPolarHBondContact CE1-OE2 3.19Å; Y221-E225 PolarHBondContact O-N 3.01Å
222	I	48.7	Very low	48.6	Very low	68 Å²	68	83.7 Å²	83.7	35%	0.349	42%	0.424	S	S	.	.	H	α-helix	trans	-60.7	-43.5	178.6	-66.4	164	0	0	0	111.4	N218 R219 N224 E225 L226	N218-I222 WeakPolarHBondContact O-CG1 3.28Å; N218-I222 PolarHBondContact O-N 3.45Å; R219-I222 PolarHBondContact O-N 2.93Å; I222-N224 VanDerWaalsContact C-N 3.33Å; I222-N224 PolarHBondContact O-N 2.88Å; I222-E225 PolarHBondContact O-N 3.48Å; I222-L226 HydrophobicContact CG2-CD1 3.94Å; I222-L226 HydrophobicContact CG2-CG 4.49Å; I222-L226 WeakPolarHBondContact O-CB 3.42Å; I222-L226 WeakPolarHBondContact O-CD1 3.22Å; I222-L226 VanDerWaalsContact O-CG 3.22Å; I222-L226 WeakPolarHBondContact O-CG 3.45Å; I222-L226 PolarHBondContact O-N 3.39Å
223	L	50.4	Low	48.1	Very low	113 Å²	113	89 Å²	89	59%	0.592	44%	0.444	S	S	*	.	H	α-helix	trans	-63.7	-34.9	176	-85.5	156	0	0	0	113.1	R219 I220 Y221 Y227	R219-L223 WeakPolarHBondContact O-CB 3.39Å; R219-L223 PolarHBondContact O-N 3.28Å; I220-L223 PolarHBondContact O-N 2.99Å; Y221-L223 PolarHBondContact O-N 3.29Å; L223-Y227 WeakPolarHBondContact O-CB 3.44Å; L223-Y227 PolarHBondContact O-N 2.86Å; L223-Y227 VanDerWaalsContact O-N 3.12Å
224	N	46.2	Very low	47.4	Very low	54 Å²	54	89.9 Å²	89.9	29%	0.289	45%	0.454	S	S	.	.	H	α-helix	trans	-74.8	-38.3	177.2	-163.1	49.4	0	0	0	111.1	R117 I220 Y221 I222 Y227 I228	R117-N224 PolarHBondContact NH2-OD1 3.07Å; I220-N224 VanDerWaalsContact O-CB 3.24Å; I220-N224 WeakPolarHBondContact O-CB 3.27Å; I220-N224 PolarHBondContact O-N 3.43Å; Y221-N224 PolarHBondContact O-N 3.48Å; Y221-N224 VanDerWaalsContact O-N 3.16Å; I222-N224 VanDerWaalsContact C-N 3.33Å; I222-N224 PolarHBondContact O-N 2.88Å; N224-Y227 PolarHBondContact O-N 3.35Å; N224-I228 WeakPolarHBondContact O-CB 3.16Å; N224-I228 WeakPolarHBondContact O-CD1 3.19Å; N224-I228 WeakPolarHBondContact O-CG1 3.44Å; N224-I228 PolarHBondContact O-N 2.83Å
225	E	50.7	Low	47.1	Very low	118 Å²	118	90.7 Å²	90.7	55%	0.551	45%	0.448	S	S	*	.	H	α-helix	trans	-64.8	-40.9	173.4	-167.3	170	-172.5	0	0	111.8	Y221 I222 Y227 N229	Y221-E225 VanDerWaalsContact CE1-OE2 3.3Å; Y221-E225 WeakPolarHBondContact CE1-OE2 3.19Å; Y221-E225 PolarHBondContact O-N 3.01Å; I222-E225 PolarHBondContact O-N 3.48Å; E225-Y227 VanDerWaalsContact C-N 3.34Å; E225-Y227 PolarHBondContact O-N 2.91Å; E225-N229 PolarHBondContact O-N 3.33Å
226	L	42.2	Very low	46.8	Very low	56 Å²	56	90 Å²	90	29%	0.293	46%	0.455	S	S	.	.	H	α-helix	trans	-57.4	-41.3	171.1	-79.7	165	0	0	0	113.1	I222 F235	I222-L226 HydrophobicContact CG2-CD1 3.94Å; I222-L226 HydrophobicContact CG2-CG 4.49Å; I222-L226 WeakPolarHBondContact O-CB 3.42Å; I222-L226 WeakPolarHBondContact O-CD1 3.22Å; I222-L226 VanDerWaalsContact O-CG 3.22Å; I222-L226 WeakPolarHBondContact O-CG 3.45Å; I222-L226 PolarHBondContact O-N 3.39Å; L226-F235 HydrophobicContact CD2-CD2 4.26Å; L226-F235 HydrophobicContact CD2-CE1 4.2Å; L226-F235 HydrophobicContact CD2-CE2 3.25Å; L226-F235 HydrophobicContact CD2-CZ 3.19Å
227	Y	42.3	Very low	46.4	Very low	162 Å²	162	96.1 Å²	96.1	64%	0.635	48%	0.476	S	S	*	.	H	α-helix	trans	-81.8	-30.3	-175.2	-162	-94.7	0	0	0	113.3	L223 N224 E225	L223-Y227 WeakPolarHBondContact O-CB 3.44Å; L223-Y227 PolarHBondContact O-N 2.86Å; L223-Y227 VanDerWaalsContact O-N 3.12Å; N224-Y227 PolarHBondContact O-N 3.35Å; E225-Y227 VanDerWaalsContact C-N 3.34Å; E225-Y227 PolarHBondContact O-N 2.91Å
228	I	50.1	Low	46	Very low	106 Å²	106	97.3 Å²	97.3	54%	0.544	48%	0.475	S	S	.	.	H	α-helix	trans	-75.1	-28.1	-178.5	-70.7	166.9	0	0	0	112.2	N224	N224-I228 WeakPolarHBondContact O-CB 3.16Å; N224-I228 WeakPolarHBondContact O-CD1 3.19Å; N224-I228 WeakPolarHBondContact O-CG1 3.44Å; N224-I228 PolarHBondContact O-N 2.83Å
229	N	43.8	Very low	45.8	Very low	95 Å²	95	93.9 Å²	93.9	51%	0.508	46%	0.457	S	S	.	.			trans	-143.2	68.4	-178.4	-89	-59.6	0	0	0	113.9	E225 L231 K232	E225-N229 PolarHBondContact O-N 3.33Å; N229-L231 PolarHBondContact O-N 2.85Å; N229-L231 VanDerWaalsContact O-N 3.07Å; N229-K232 HydrophobicContact CB-CB 4.43Å
230	P	46.7	Very low	45.6	Very low	90 Å²	90	95.3 Å²	95.3	58%	0.584	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-13	-178.9	27.4	-36.3	0	0	0	114.8
231	L	40.9	Very low	45.3	Very low	162 Å²	162	97.2 Å²	97.2	85%	0.848	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	2.9	-171.5	-73.7	167.8	0	0	0	114.9	N229 K233	N229-L231 PolarHBondContact O-N 2.85Å; N229-L231 VanDerWaalsContact O-N 3.07Å; L231-K233 PolarHBondContact O-N 2.89Å
232	K	47	Very low	45.1	Very low	98 Å²	98	91.9 Å²	91.9	43%	0.426	45%	0.454	S	S	.	.			trans	-68.1	118.8	-179.8	-150.4	174.6	-173.4	-178.5	0	108.7	N229 S234 F235	N229-K232 HydrophobicContact CB-CB 4.43Å; K232-S234 WeakPolarHBondContact CG-OG 3.37Å; K232-S234 PolarHBondContact O-N 3.37Å; K232-F235 VanDerWaalsContact O-CB 3.25Å; K232-F235 WeakPolarHBondContact O-CB 3.34Å; K232-F235 PolarHBondContact O-N 3.18Å
233	K	41.4	Very low	45	Very low	177 Å²	177	95.1 Å²	95.1	77%	0.77	46%	0.463	S	S	*	.	H	α-helix	trans	-51.3	-29	-177	-75.5	-177.4	177.8	177	0	113.5	L231 F235 G236 Y237	L231-K233 PolarHBondContact O-N 2.89Å; K233-F235 PolarHBondContact O-N 2.7Å; K233-G236 PolarHBondContact O-N 3.41Å; K233-Y237 VanDerWaalsContact O-CD2 3.25Å; K233-Y237 WeakPolarHBondContact O-CD2 3.32Å; K233-Y237 PolarHBondContact O-N 2.86Å
234	S	40.7	Very low	45	Very low	54 Å²	54	92.2 Å²	92.2	38%	0.378	45%	0.449	S	S	.	.	H	α-helix	trans	-54.2	-29.5	171.5	54.5	0	0	0	0	114.1	K232 Y237 Y238	K232-S234 WeakPolarHBondContact CG-OG 3.37Å; K232-S234 PolarHBondContact O-N 3.37Å; S234-Y237 PolarHBondContact O-N 2.82Å; S234-Y238 WeakPolarHBondContact O-CB 3.23Å; S234-Y238 PolarHBondContact O-N 3.46Å
235	F	44.8	Very low	45	Very low	49 Å²	49	91.2 Å²	91.2	22%	0.215	44%	0.443	C	S	.	.	H	α-helix	trans	-69.8	-38.5	178.7	-173.4	-119	0	0	0	112.6	L226 K232 K233 Y237 Y238 I239	L226-F235 HydrophobicContact CD2-CD2 4.26Å; L226-F235 HydrophobicContact CD2-CE1 4.2Å; L226-F235 HydrophobicContact CD2-CE2 3.25Å; L226-F235 HydrophobicContact CD2-CZ 3.19Å; K232-F235 VanDerWaalsContact O-CB 3.25Å; K232-F235 WeakPolarHBondContact O-CB 3.34Å; K232-F235 PolarHBondContact O-N 3.18Å; K233-F235 PolarHBondContact O-N 2.7Å; F235-Y237 VanDerWaalsContact C-N 3.3Å; F235-Y237 PolarHBondContact O-N 3.43Å; F235-Y238 PolarHBondContact O-N 2.7Å; F235-I239 HydrophobicContact CD1-CD1 4.13Å; F235-I239 HydrophobicContact CE1-CD1 3.43Å; F235-I239 VanDerWaalsContact CE1-CD1 3.43Å; F235-I239 HydrophobicContact CE1-CG1 4.19Å; F235-I239 HydrophobicContact CE2-CD1 4.08Å; F235-I239 HydrophobicContact CE2-CG1 4.02Å; F235-I239 HydrophobicContact CZ-CD1 3.4Å; F235-I239 HydrophobicContact CZ-CG1 3.87Å; F235-I239 PolarHBondContact O-N 3.45Å
236	G	43.3	Very low	44.8	Very low	46 Å²	46	88.1 Å²	88.1	47%	0.474	43%	0.433	S	S	.	.	H	α-helix	trans	-61.6	-39.8	171.1	0	0	0	0	0	111.9	K233 N240	K233-G236 PolarHBondContact O-N 3.41Å; G236-N240 VanDerWaalsContact O-CB 3.23Å; G236-N240 WeakPolarHBondContact O-CB 3.48Å; G236-N240 PolarHBondContact O-N 2.8Å
237	Y	42.2	Very low	44.9	Very low	175 Å²	175	90.4 Å²	90.4	69%	0.686	44%	0.44	S	S	*	.	H	α-helix	trans	-69.8	-35.9	173.2	-68.3	-72.3	0	0	0	113	K233 S234 F235 N240 Y241	K233-Y237 VanDerWaalsContact O-CD2 3.25Å; K233-Y237 WeakPolarHBondContact O-CD2 3.32Å; K233-Y237 PolarHBondContact O-N 2.86Å; S234-Y237 PolarHBondContact O-N 2.82Å; F235-Y237 VanDerWaalsContact C-N 3.3Å; F235-Y237 PolarHBondContact O-N 3.43Å; Y237-N240 PolarHBondContact O-N 2.85Å; Y237-Y241 WeakPolarHBondContact O-CB 3.21Å; Y237-Y241 PolarHBondContact O-N 3.06Å
238	Y	44.4	Very low	45	Very low	82 Å²	82	88 Å²	88	32%	0.322	44%	0.435	S	S	.	.	H	α-helix	trans	-69.9	-43.8	177.5	-177.3	-105.3	0	0	0	112.4	S234 F235 Y241 L242	S234-Y238 WeakPolarHBondContact O-CB 3.23Å; S234-Y238 PolarHBondContact O-N 3.46Å; F235-Y238 PolarHBondContact O-N 2.7Å; Y238-Y241 PolarHBondContact O-N 3.38Å; Y238-L242 HydrophobicContact CD1-CD1 3.89Å; Y238-L242 HydrophobicContact CE1-CD1 3.35Å; Y238-L242 HydrophobicContact CE1-CG 4.34Å; Y238-L242 HydrophobicContact CE2-CD1 4.36Å; Y238-L242 WeakPolarHBondContact O-CB 3.33Å; Y238-L242 PolarHBondContact O-N 3.33Å
239	I	45.2	Very low	44.7	Very low	23 Å²	23	85.8 Å²	85.8	12%	0.118	42%	0.424	C	S	.	.	H	α-helix	trans	-61.3	-45.6	170.7	-74.5	-174.8	0	0	0	110.3	F235 Y241 L242 Y243 Y507	F235-I239 HydrophobicContact CD1-CD1 4.13Å; F235-I239 HydrophobicContact CE1-CD1 3.43Å; F235-I239 VanDerWaalsContact CE1-CD1 3.43Å; F235-I239 HydrophobicContact CE1-CG1 4.19Å; F235-I239 HydrophobicContact CE2-CD1 4.08Å; F235-I239 HydrophobicContact CE2-CG1 4.02Å; F235-I239 HydrophobicContact CZ-CD1 3.4Å; F235-I239 HydrophobicContact CZ-CG1 3.87Å; F235-I239 PolarHBondContact O-N 3.45Å; I239-Y241 VanDerWaalsContact C-N 3.31Å; I239-Y241 PolarHBondContact O-N 3.28Å; I239-L242 PolarHBondContact O-N 2.81Å; I239-Y243 WeakPolarHBondContact O-CB 3.49Å; I239-Y243 PolarHBondContact O-N 3.31Å; I239-Y507 HydrophobicContact CD1-CD2 4.22Å; I239-Y507 HydrophobicContact CD1-CE2 4.49Å; I239-Y507 HydrophobicContact CD1-CG 4.4Å; I239-Y507 HydrophobicContact CG1-CD2 4.02Å; I239-Y507 HydrophobicContact CG1-CE2 3.96Å
240	N	45.3	Very low	44.5	Very low	96 Å²	96	87 Å²	87	51%	0.513	43%	0.43	S	S	.	.	H	α-helix	trans	-66.7	-34.7	-179.5	-158.3	37.1	0	0	0	111.7	G236 Y237 Y243 T244	G236-N240 VanDerWaalsContact O-CB 3.23Å; G236-N240 WeakPolarHBondContact O-CB 3.48Å; G236-N240 PolarHBondContact O-N 2.8Å; Y237-N240 PolarHBondContact O-N 2.85Å; N240-Y243 PolarHBondContact O-N 3.42Å; N240-T244 WeakPolarHBondContact O-CG2 3.38Å; N240-T244 PolarHBondContact O-N 3.39Å; N240-T244 PolarHBondContact O-OG1 3.47Å; N240-T244 VanDerWaalsContact O-OG1 3.06Å
241	Y	46.5	Very low	44.1	Very low	92 Å²	92	89.3 Å²	89.3	36%	0.361	43%	0.428	S	S	.	.	H	α-helix	trans	-67.6	-44.8	173.6	175.7	-102.4	0	0	0	112.8	Y237 Y238 I239 Y243 T244 M245	Y237-Y241 WeakPolarHBondContact O-CB 3.21Å; Y237-Y241 PolarHBondContact O-N 3.06Å; Y238-Y241 PolarHBondContact O-N 3.38Å; I239-Y241 VanDerWaalsContact C-N 3.31Å; I239-Y241 PolarHBondContact O-N 3.28Å; Y241-Y243 VanDerWaalsContact C-N 3.32Å; Y241-T244 WeakPolarHBondContact CA-OG1 3.45Å; Y241-T244 PolarHBondContact O-N 2.91Å; Y241-T244 PolarHBondContact O-OG1 2.88Å; Y241-M245 HydrophobicContact CD1-CG 4.44Å; Y241-M245 HydrophobicContact CD2-CG 4.49Å; Y241-M245 HydrophobicContact CE1-CG 4.04Å; Y241-M245 HydrophobicContact CE2-CG 4.09Å; Y241-M245 WeakPolarHBondContact O-CB 3.39Å; Y241-M245 VanDerWaalsContact O-CG 3.28Å; Y241-M245 WeakPolarHBondContact O-CG 3.23Å; Y241-M245 PolarHBondContact O-N 2.83Å
242	L	44.5	Very low	44	Very low	14 Å²	14	86.5 Å²	86.5	7%	0.073	41%	0.413	C	S	.	.	H	α-helix	trans	-63.3	-39.6	172.4	-84.7	170.8	0	0	0	111.3	Y238 I239 M245 V246 Y507	Y238-L242 HydrophobicContact CD1-CD1 3.89Å; Y238-L242 HydrophobicContact CE1-CD1 3.35Å; Y238-L242 HydrophobicContact CE1-CG 4.34Å; Y238-L242 HydrophobicContact CE2-CD1 4.36Å; Y238-L242 WeakPolarHBondContact O-CB 3.33Å; Y238-L242 PolarHBondContact O-N 3.33Å; I239-L242 PolarHBondContact O-N 2.81Å; L242-M245 PolarHBondContact O-N 3.18Å; L242-V246 WeakPolarHBondContact O-CB 3.46Å; L242-V246 VanDerWaalsContact O-CG2 3.27Å; L242-V246 WeakPolarHBondContact O-CG2 3.09Å; L242-V246 PolarHBondContact O-N 2.89Å; L242-Y507 HydrophobicContact CD1-CE2 4Å
243	Y	46	Very low	43.4	Very low	136 Å²	136	87.2 Å²	87.2	53%	0.533	42%	0.422	S	S	.	.	H	α-helix	trans	-65.8	-41.4	176.1	-175.8	-97.3	0	0	0	111.8	I239 N240 Y241 K247	I239-Y243 WeakPolarHBondContact O-CB 3.49Å; I239-Y243 PolarHBondContact O-N 3.31Å; N240-Y243 PolarHBondContact O-N 3.42Å; Y241-Y243 VanDerWaalsContact C-N 3.32Å; Y243-K247 WeakPolarHBondContact O-CB 3.45Å; Y243-K247 PolarHBondContact O-N 3.19Å
244	T	50.7	Low	43.1	Very low	51 Å²	51	85.2 Å²	85.2	31%	0.313	42%	0.415	S	S	.	.	H	α-helix	trans	-66.2	-42.9	172.1	47.1	0	0	0	0	111.9	N240 Y241 V246 K247 E248	N240-T244 WeakPolarHBondContact O-CG2 3.38Å; N240-T244 PolarHBondContact O-N 3.39Å; N240-T244 PolarHBondContact O-OG1 3.47Å; N240-T244 VanDerWaalsContact O-OG1 3.06Å; Y241-T244 WeakPolarHBondContact CA-OG1 3.45Å; Y241-T244 PolarHBondContact O-N 2.91Å; Y241-T244 PolarHBondContact O-OG1 2.88Å; T244-V246 PolarHBondContact O-N 2.67Å; T244-K247 PolarHBondContact O-N 3.36Å; T244-E248 WeakPolarHBondContact O-CB 3.46Å; T244-E248 VanDerWaalsContact O-CG 3.29Å; T244-E248 WeakPolarHBondContact O-CG 3.28Å; T244-E248 PolarHBondContact O-N 2.87Å
245	M	46.4	Very low	42.7	Very low	34 Å²	34	87.3 Å²	87.3	17%	0.167	43%	0.429	C	S	.	.	H	α-helix	trans	-62.5	-41.7	176.6	-76.5	-79.3	-80.4	0	0	112.2	Y241 L242 N249 N301	Y241-M245 HydrophobicContact CD1-CG 4.44Å; Y241-M245 HydrophobicContact CD2-CG 4.49Å; Y241-M245 HydrophobicContact CE1-CG 4.04Å; Y241-M245 HydrophobicContact CE2-CG 4.09Å; Y241-M245 WeakPolarHBondContact O-CB 3.39Å; Y241-M245 VanDerWaalsContact O-CG 3.28Å; Y241-M245 WeakPolarHBondContact O-CG 3.23Å; Y241-M245 PolarHBondContact O-N 2.83Å; L242-M245 PolarHBondContact O-N 3.18Å; M245-N249 WeakPolarHBondContact O-CB 3.35Å; M245-N249 PolarHBondContact O-N 2.87Å; M245-N249 VanDerWaalsContact O-N 3.1Å; M245-N249 PolarHBondContact O-ND2 3.38Å; M245-N301 HydrophobicContact CE-CB 3.98Å
246	V	45.9	Very low	42	Very low	53 Å²	53	95.8 Å²	95.8	32%	0.321	46%	0.461	S	S	.	.	H	α-helix	trans	-69.9	-38.4	175.6	168.6	0	0	0	0	110.9	L242 T244 L250 F298	L242-V246 WeakPolarHBondContact O-CB 3.46Å; L242-V246 VanDerWaalsContact O-CG2 3.27Å; L242-V246 WeakPolarHBondContact O-CG2 3.09Å; L242-V246 PolarHBondContact O-N 2.89Å; T244-V246 PolarHBondContact O-N 2.67Å; V246-L250 HydrophobicContact CG1-CD1 3.69Å; V246-L250 HydrophobicContact CG1-CG 4.49Å; V246-L250 VanDerWaalsContact O-CB 3.3Å; V246-L250 WeakPolarHBondContact O-CB 3.23Å; V246-L250 WeakPolarHBondContact O-CD1 3.37Å; V246-L250 VanDerWaalsContact O-CG 3.23Å; V246-L250 WeakPolarHBondContact O-CG 3.38Å; V246-L250 PolarHBondContact O-N 3.35Å; V246-L250 VanDerWaalsContact O-N 3.09Å; V246-F298 HydrophobicContact CG2-CE2 4.35Å
247	K	45.9	Very low	41.4	Very low	104 Å²	104	100.4 Å²	100.4	45%	0.452	47%	0.474	S	S	.	.	H	α-helix	trans	-66.6	-45.4	176.6	-172.3	-175.8	177.5	-166.5	0	111.8	Y243 T244 L250 Y251	Y243-K247 WeakPolarHBondContact O-CB 3.45Å; Y243-K247 PolarHBondContact O-N 3.19Å; T244-K247 PolarHBondContact O-N 3.36Å; K247-L250 PolarHBondContact O-N 2.8Å; K247-Y251 HydrophobicContact CG-CD2 3.62Å; K247-Y251 HydrophobicContact CG-CE2 3.95Å; K247-Y251 WeakPolarHBondContact O-CB 3.5Å; K247-Y251 WeakPolarHBondContact O-CD2 3.31Å; K247-Y251 PolarHBondContact O-N 3.18Å
248	E	44.5	Very low	40.9	Very low	112 Å²	112	99 Å²	99	52%	0.523	48%	0.479	S	S	.	.	H	α-helix	trans	-61.2	-50.1	177.3	-74.3	167.6	-171.3	0	0	110.4	T244 L250 Y251 D252	T244-E248 WeakPolarHBondContact O-CB 3.46Å; T244-E248 VanDerWaalsContact O-CG 3.29Å; T244-E248 WeakPolarHBondContact O-CG 3.28Å; T244-E248 PolarHBondContact O-N 2.87Å; E248-L250 PolarHBondContact O-N 3.47Å; E248-L250 VanDerWaalsContact O-N 3.12Å; E248-Y251 PolarHBondContact O-N 2.95Å; E248-D252 PolarHBondContact O-N 3.26Å
249	N	42.1	Very low	40.2	Very low	59 Å²	59	102.9 Å²	102.9	32%	0.316	51%	0.505	S	S	.	.	H	α-helix	trans	-67.4	-11.1	176.7	-72.1	-77.5	0	0	0	114.7	M245	M245-N249 WeakPolarHBondContact O-CB 3.35Å; M245-N249 PolarHBondContact O-N 2.87Å; M245-N249 VanDerWaalsContact O-N 3.1Å; M245-N249 PolarHBondContact O-ND2 3.38Å
250	L	39.1	Very low	39.4	Very low	120 Å²	120	107.5 Å²	107.5	63%	0.628	54%	0.535	S	S	*	.	H	α-helix	trans	-102.3	-18.6	174	-76.1	171.1	0	0	0	113.7	V246 K247 E248	V246-L250 HydrophobicContact CG1-CD1 3.69Å; V246-L250 HydrophobicContact CG1-CG 4.49Å; V246-L250 VanDerWaalsContact O-CB 3.3Å; V246-L250 WeakPolarHBondContact O-CB 3.23Å; V246-L250 WeakPolarHBondContact O-CD1 3.37Å; V246-L250 VanDerWaalsContact O-CG 3.23Å; V246-L250 WeakPolarHBondContact O-CG 3.38Å; V246-L250 PolarHBondContact O-N 3.35Å; V246-L250 VanDerWaalsContact O-N 3.09Å; K247-L250 PolarHBondContact O-N 2.8Å; E248-L250 PolarHBondContact O-N 3.47Å; E248-L250 VanDerWaalsContact O-N 3.12Å
251	Y	39.5	Very low	38.7	Very low	139 Å²	139	109.2 Å²	109.2	55%	0.545	55%	0.549	S	S	.	.	H	α-helix	trans	-102.2	-15.2	-179.7	-90.2	-88.9	0	0	0	113.8	K247 E248 D253 H254 C255	K247-Y251 HydrophobicContact CG-CD2 3.62Å; K247-Y251 HydrophobicContact CG-CE2 3.95Å; K247-Y251 WeakPolarHBondContact O-CB 3.5Å; K247-Y251 WeakPolarHBondContact O-CD2 3.31Å; K247-Y251 PolarHBondContact O-N 3.18Å; E248-Y251 PolarHBondContact O-N 2.95Å; Y251-D253 PolarHBondContact O-N 3.36Å; Y251-H254 PolarHBondContact O-N 3.35Å; Y251-C255 PolarHBondContact O-N 2.89Å
252	D	38.3	Very low	37.9	Very low	102 Å²	102	111.6 Å²	111.6	55%	0.545	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-58.2	-28.3	176.2	-86.8	-11.1	0	0	0	113.2	E248 H254	E248-D252 PolarHBondContact O-N 3.26Å; D252-H254 PolarHBondContact O-N 3.49Å
253	D	35.2	Very low	37.5	Very low	114 Å²	114	117 Å²	117	61%	0.61	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-71.5	-8.1	173.8	-81.3	-20.7	0	0	0	113.9	Y251	Y251-D253 PolarHBondContact O-N 3.36Å
254	H	35.4	Very low	36.8	Very low	135 Å²	135	117.5 Å²	117.5	63%	0.625	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-115.5	-3.9	-178.9	-80.7	-52.3	0	0	0	115.1	Y251 D252	Y251-H254 PolarHBondContact O-N 3.35Å; D252-H254 PolarHBondContact O-N 3.49Å
255	C	30.7	Very low	36.1	Very low	98 Å²	98	122.1 Å²	122.1	66%	0.662	64%	0.641	S	S	*	*	S	Bend	trans	-94.8	0.5	-175.8	-89.3	0	0	0	0	115.9	Y251	Y251-C255 PolarHBondContact O-N 2.89Å
256	Y	30.7	Very low	35.4	Very low	227 Å²	227	127 Å²	127	89%	0.89	67%	0.668	S	S	*	*	S	Bend	trans	-90.2	4.5	-175.2	-111.9	-81.3	0	0	0	116.5
257	N	30.3	Very low	34.7	Very low	142 Å²	142	131.4 Å²	131.4	76%	0.759	69%	0.69	S	S	*	*	S	Bend	trans	-123.3	6.2	-170.3	-112.1	8	0	0	0	116.8
258	N	31.2	Very low	34	Very low	147 Å²	147	130.8 Å²	130.8	79%	0.786	70%	0.699	S	S	*	*			trans	-107.5	23.4	-176.6	-77.3	8.7	0	0	0	114.6
259	N	30	Very low	33.4	Very low	163 Å²	163	132.2 Å²	132.2	87%	0.872	71%	0.71	S	S	*	*			trans	-99.5	55.7	176.7	-83.3	-1.6	0	0	0	112.7
260	T	28.5	Very low	32.8	Very low	119 Å²	119	137.1 Å²	137.1	73%	0.73	74%	0.736	S	S	*	*	S	Bend	trans	-147.3	137.1	166.5	25.8	0	0	0	0	112.2
261	T	31.9	Very low	32.4	Very low	132 Å²	132	135.3 Å²	135.3	81%	0.81	75%	0.747	S	S	*	*			trans	63.7	71.2	165.5	56.4	0	0	0	0	118.6
262	T	28.4	Very low	31.8	Very low	143 Å²	143	134.6 Å²	134.6	88%	0.877	76%	0.757	S	S	*	*			trans	-93.4	104.5	145	47.7	0	0	0	0	110.4
263	T	37	Very low	31.3	Very low	127 Å²	127	136.8 Å²	136.8	78%	0.779	77%	0.768	S	S	*	*			trans	-144.3	111	161.6	43.4	0	0	0	0	110.6
264	N	31.3	Very low	31.1	Very low	146 Å²	146	138 Å²	138	78%	0.781	77%	0.774	S	S	*	*			trans	-6.8	136.7	155.7	-52.3	-14	0	0	0	116
265	N	34.9	Very low	30.7	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	78%	0.782	S	S	*	*				-165	164.8	70.5	-106.3	-33.2	0	0	0	114.4
266	N	31.8	Very low	30.9	Very low	136 Å²	136	142 Å²	142	73%	0.727	79%	0.793	S	S	*	*			trans	-68.5	140.4	175.7	-47.4	-52.4	0	0	0	111.9
267	N	32.9	Very low	30.9	Very low	146 Å²	146	142.3 Å²	142.3	78%	0.781	79%	0.793	S	S	*	*				170.1	144.3	108	-89.7	-18.6	0	0	0	114.1
268	S	30.6	Very low	30.8	Very low	91 Å²	91	140.2 Å²	140.2	64%	0.636	79%	0.789	S	S	*	*			trans	43.7	119.9	145.9	66.1	0	0	0	0	121.9
269	N	30.9	Very low	30.6	Very low	142 Å²	142	140.1 Å²	140.1	76%	0.759	79%	0.789	S	S	*	*				74	129	129.5	-58.1	-7.1	0	0	0	120.8
270	N	29.8	Very low	30.7	Very low	162 Å²	162	138.9 Å²	138.9	87%	0.866	79%	0.787	S	S	*	*			trans	53.2	95.2	142.3	-56.2	-8.1	0	0	0	117.8
271	G	30.4	Very low	30.6	Very low	82 Å²	82	141 Å²	141	85%	0.845	79%	0.794	S	S	*	*			trans	-156.1	96.1	169.9	0	0	0	0	0	111.9
272	T	28.7	Very low	30.5	Very low	125 Å²	125	142.4 Å²	142.4	77%	0.767	79%	0.789	S	S	*	*			trans	-77.5	159.4	175.7	47.2	0	0	0	0	113.1
273	L	27.4	Very low	30.4	Very low	148 Å²	148	144.4 Å²	144.4	78%	0.775	79%	0.788	S	S	*	*			trans	82.1	144.5	143.2	-87.7	158	0	0	0	120.6
274	L	29.8	Very low	30	Very low	140 Å²	140	146.8 Å²	146.8	73%	0.733	78%	0.784	S	S	*	*			trans	72.8	108.4	159.1	-63.7	158	0	0	0	115.8
275	N	28.2	Very low	29.8	Very low	150 Å²	150	147.1 Å²	147.1	80%	0.802	79%	0.786	S	S	*	*				57.7	103.4	88.8	-88.8	-9.4	0	0	0	111.8
276	D	34.3	Very low	29.6	Very low	167 Å²	167	146.5 Å²	146.5	89%	0.893	78%	0.778	S	S	*	*			trans	-140.7	148.3	133.7	-131.9	-28.7	0	0	0	113.2
277	R	30.2	Very low	29.6	Very low	232 Å²	232	144.9 Å²	144.9	88%	0.875	78%	0.775	S	S	*	*			trans	-131.9	103.7	-161.3	169.8	-164.6	178.7	177.5	0.3	108.7
278	S	29.2	Very low	29.6	Very low	99 Å²	99	146.3 Å²	146.3	69%	0.692	78%	0.782	S	S	*	*			trans	-174.5	139.8	149.6	41.9	0	0	0	0	114.3
279	N	27.2	Very low	29.9	Very low	144 Å²	144	146.3 Å²	146.3	77%	0.77	78%	0.775	S	S	*	*			trans	34.9	120.8	134.6	-49.5	-19.8	0	0	0	119
280	T	30.7	Very low	30.5	Very low	137 Å²	137	142 Å²	142	84%	0.84	76%	0.756	S	S	*	*				-172.9	148.2	94.9	25.8	0	0	0	0	112.6	K282	T280-K282 PolarHBondContact O-N 3.38Å
281	N	27.5	Very low	31.1	Very low	163 Å²	163	140.7 Å²	140.7	87%	0.872	75%	0.747	S	S	*	*			trans	-64	127.5	176.7	-60.2	-48	0	0	0	111.6
282	K	29.7	Very low	31.4	Very low	162 Å²	162	142.7 Å²	142.7	70%	0.704	73%	0.733	S	S	*	*			trans	-134.4	103.7	152.6	-75.1	-169.3	177	175.3	0	110.6	T280 Y284	T280-K282 PolarHBondContact O-N 3.38Å; K282-Y284 HydrophobicContact CB-CD2 4.12Å; K282-Y284 HydrophobicContact CB-CE2 3.73Å; K282-Y284 HydrophobicContact CD-CE2 4.29Å; K282-Y284 PolarHBondContact O-N 2.87Å
283	Q	25.5	Very low	32.2	Very low	185 Å²	185	142.5 Å²	142.5	86%	0.864	72%	0.723	S	S	*	*			trans	-58.6	123.4	162.2	-76.7	165.8	-74.2	0	0	109
284	Y	28.4	Very low	32.8	Very low	178 Å²	178	139.1 Å²	139.1	70%	0.698	71%	0.711	S	S	*	*			trans	-112.9	107.3	165.9	-83.6	-84.4	0	0	0	109.2	K282 H286	K282-Y284 HydrophobicContact CB-CD2 4.12Å; K282-Y284 HydrophobicContact CB-CE2 3.73Å; K282-Y284 HydrophobicContact CD-CE2 4.29Å; K282-Y284 PolarHBondContact O-N 2.87Å; Y284-H286 PolarHBondContact O-N 2.9Å; Y284-H286 VanDerWaalsContact O-N 3.16Å
285	N	26.7	Very low	33.4	Very low	152 Å²	152	137.5 Å²	137.5	81%	0.813	70%	0.703	S	S	*	*			trans	-71.4	102.3	172.7	-71.8	-27.4	0	0	0	108.9
286	H	32.4	Very low	34.2	Very low	136 Å²	136	138 Å²	138	63%	0.63	70%	0.698	S	S	*	*			trans	-71.9	133.8	167.3	-89.8	-90.4	0	0	0	110.1	Y284 L288	Y284-H286 PolarHBondContact O-N 2.9Å; Y284-H286 VanDerWaalsContact O-N 3.16Å; H286-L288 PolarHBondContact O-N 3.36Å
287	P	31.1	Very low	34.6	Very low	102 Å²	102	136 Å²	136	66%	0.662	68%	0.681	S	S	*	*			trans	-68.6	121	172	28.7	-32.3	0	0	0	109.2	N289	P287-N289 PolarHBondContact O-N 3.48Å
288	L	32.3	Very low	35.3	Very low	175 Å²	175	127.8 Å²	127.8	92%	0.916	65%	0.652	S	S	*	*			trans	-70.2	77.7	173.1	-81.6	159.2	0	0	0	110.2	H286 S290	H286-L288 PolarHBondContact O-N 3.36Å; L288-S290 PolarHBondContact O-N 2.89Å; L288-S290 VanDerWaalsContact O-N 3.07Å
289	N	36.7	Very low	35.9	Very low	92 Å²	92	124.5 Å²	124.5	49%	0.492	63%	0.634	S	S	.	*			trans	-55.4	114.7	163.5	-84.5	-24.8	0	0	0	107.8	P287 I291	P287-N289 PolarHBondContact O-N 3.48Å; N289-I291 PolarHBondContact O-N 3.47Å
290	S	44.6	Very low	36.7	Very low	51 Å²	51	120.6 Å²	120.6	36%	0.357	62%	0.621	S	S	.	*			trans	-61	139.8	-169.7	69	0	0	0	0	111.1	L288 F292 Q293 C294	L288-S290 PolarHBondContact O-N 2.89Å; L288-S290 VanDerWaalsContact O-N 3.07Å; S290-F292 PolarHBondContact O-N 3.37Å; S290-Q293 PolarHBondContact O-N 2.87Å; S290-Q293 PolarHBondContact OG-N 3.25Å; S290-C294 PolarHBondContact O-N 3Å
291	I	42.3	Very low	37.2	Very low	135 Å²	135	117 Å²	117	69%	0.692	60%	0.597	S	S	*	*	H	α-helix	trans	-51.9	-32.9	174.3	-65.2	167.9	0	0	0	110.5	N289 C294 L295	N289-I291 PolarHBondContact O-N 3.47Å; I291-C294 PolarHBondContact O-N 3.33Å; I291-L295 HydrophobicContact CG2-CD1 3.92Å; I291-L295 HydrophobicContact CG2-CG 4.4Å; I291-L295 WeakPolarHBondContact O-CB 3.28Å; I291-L295 VanDerWaalsContact O-CG 3.28Å; I291-L295 WeakPolarHBondContact O-CG 3.47Å; I291-L295 PolarHBondContact O-N 2.75Å
292	F	35.9	Very low	37.7	Very low	123 Å²	123	113 Å²	113	54%	0.539	58%	0.575	S	S	.	*	H	α-helix	trans	-62	-41	172.9	-75.9	-81.1	0	0	0	114.4	S290 L295 F296 M521	S290-F292 PolarHBondContact O-N 3.37Å; F292-L295 PolarHBondContact O-N 2.8Å; F292-F296 WeakPolarHBondContact O-CB 3.31Å; F292-F296 PolarHBondContact O-N 3.37Å; F292-M521 HydrophobicContact CE2-CE 4.4Å; F292-M521 HydrophobicContact CZ-CE 3.75Å
293	Q	46	Very low	38	Very low	121 Å²	121	110.8 Å²	110.8	57%	0.565	58%	0.579	S	S	*	*	H	α-helix	trans	-65.7	-42.2	175.1	-93.2	177.9	-29.4	0	0	111.8	S290 L295 F296 K297	S290-Q293 PolarHBondContact O-N 2.87Å; S290-Q293 PolarHBondContact OG-N 3.25Å; Q293-L295 VanDerWaalsContact C-N 3.35Å; Q293-L295 PolarHBondContact O-N 3.22Å; Q293-F296 PolarHBondContact O-N 2.8Å; Q293-K297 VanDerWaalsContact O-CB 3.28Å; Q293-K297 WeakPolarHBondContact O-CB 3.43Å; Q293-K297 PolarHBondContact O-N 3.49Å
294	C	39.1	Very low	38.5	Very low	78 Å²	78	105.6 Å²	105.6	53%	0.527	56%	0.563	S	S	.	*	H	α-helix	trans	-61.9	-42.7	174.2	-72.6	0	0	0	0	111.7	S290 I291 K297 F298	S290-C294 PolarHBondContact O-N 3Å; I291-C294 PolarHBondContact O-N 3.33Å; C294-K297 PolarHBondContact O-N 3.36Å; C294-F298 VanDerWaalsContact O-CB 3.24Å; C294-F298 WeakPolarHBondContact O-CB 3.27Å; C294-F298 PolarHBondContact O-N 2.89Å
295	L	42.5	Very low	38.9	Very low	105 Å²	105	101.5 Å²	101.5	55%	0.55	55%	0.552	S	S	.	*	H	α-helix	trans	-63.9	-42.8	175.7	-73.6	168.5	0	0	0	112.8	I291 F292 Q293 F298 G299	I291-L295 HydrophobicContact CG2-CD1 3.92Å; I291-L295 HydrophobicContact CG2-CG 4.4Å; I291-L295 WeakPolarHBondContact O-CB 3.28Å; I291-L295 VanDerWaalsContact O-CG 3.28Å; I291-L295 WeakPolarHBondContact O-CG 3.47Å; I291-L295 PolarHBondContact O-N 2.75Å; F292-L295 PolarHBondContact O-N 2.8Å; Q293-L295 VanDerWaalsContact C-N 3.35Å; Q293-L295 PolarHBondContact O-N 3.22Å; L295-F298 PolarHBondContact O-N 3.27Å; L295-G299 PolarHBondContact O-N 2.87Å
296	F	45.5	Very low	39.5	Very low	161 Å²	161	103.4 Å²	103.4	71%	0.706	55%	0.553	S	S	*	*	H	α-helix	trans	-66.3	-41.4	176.1	-100.6	-82.4	0	0	0	112.3	F292 Q293 G299 A300	F292-F296 WeakPolarHBondContact O-CB 3.31Å; F292-F296 PolarHBondContact O-N 3.37Å; Q293-F296 PolarHBondContact O-N 2.8Å; F296-G299 PolarHBondContact O-N 3.21Å; F296-A300 WeakPolarHBondContact O-CB 3.32Å; F296-A300 PolarHBondContact O-N 3.18Å
297	K	43.8	Very low	39.8	Very low	124 Å²	124	105.2 Å²	105.2	54%	0.539	56%	0.56	S	S	.	*	H	α-helix	trans	-66.1	-38.3	177.1	-160.7	-179.3	-175.5	-168.3	0	111.3	Q293 C294 N301	Q293-K297 VanDerWaalsContact O-CB 3.28Å; Q293-K297 WeakPolarHBondContact O-CB 3.43Å; Q293-K297 PolarHBondContact O-N 3.49Å; C294-K297 PolarHBondContact O-N 3.36Å; K297-N301 WeakPolarHBondContact O-CB 3.42Å; K297-N301 PolarHBondContact O-N 3.35Å; K297-N301 PolarHBondContact O-ND2 2.93Å
298	F	44	Very low	40.2	Very low	61 Å²	61	103 Å²	103	27%	0.268	55%	0.546	S	S	.	.	H	α-helix	trans	-65	-45.7	172.7	-174.5	-103.6	0	0	0	112.1	V246 C294 L295 N301 L302	V246-F298 HydrophobicContact CG2-CE2 4.35Å; C294-F298 VanDerWaalsContact O-CB 3.24Å; C294-F298 WeakPolarHBondContact O-CB 3.27Å; C294-F298 PolarHBondContact O-N 2.89Å; L295-F298 PolarHBondContact O-N 3.27Å; F298-N301 PolarHBondContact O-N 3.28Å; F298-L302 HydrophobicContact CD1-CD1 3.85Å; F298-L302 HydrophobicContact CE1-CD1 3.55Å; F298-L302 HydrophobicContact CZ-CD1 4.09Å; F298-L302 PolarHBondContact O-N 3.37Å
299	G	41.4	Very low	40.6	Very low	30 Å²	30	99 Å²	99	31%	0.309	53%	0.531	S	S	.	.	H	α-helix	trans	-61.9	-43.6	174.7	0	0	0	0	0	113.3	L295 F296 N301 L302 C303	L295-G299 PolarHBondContact O-N 2.87Å; F296-G299 PolarHBondContact O-N 3.21Å; G299-N301 VanDerWaalsContact C-N 3.33Å; G299-N301 PolarHBondContact O-N 2.93Å; G299-L302 PolarHBondContact O-N 2.88Å; G299-C303 PolarHBondContact O-N 3.4Å; G299-C303 VanDerWaalsContact O-N 3.07Å; G299-C303 PolarHBondContact O-SG 3.14Å
300	A	44.7	Very low	41	Very low	61 Å²	61	98.4 Å²	98.4	50%	0.504	53%	0.526	S	S	.	.	H	α-helix	trans	-62.7	-38.4	176.4	0	0	0	0	0	112.6	F296 C303 S304	F296-A300 WeakPolarHBondContact O-CB 3.32Å; F296-A300 PolarHBondContact O-N 3.18Å; A300-C303 PolarHBondContact O-N 3.49Å; A300-S304 PolarHBondContact O-N 3.39Å
301	N	40.5	Very low	41	Very low	61 Å²	61	106.2 Å²	106.2	33%	0.326	55%	0.554	S	S	.	*	H	α-helix	trans	-71.4	-26.2	175.5	-77.3	-20	0	0	0	113.4	M245 K297 F298 G299 S304	M245-N301 HydrophobicContact CE-CB 3.98Å; K297-N301 WeakPolarHBondContact O-CB 3.42Å; K297-N301 PolarHBondContact O-N 3.35Å; K297-N301 PolarHBondContact O-ND2 2.93Å; F298-N301 PolarHBondContact O-N 3.28Å; G299-N301 VanDerWaalsContact C-N 3.33Å; G299-N301 PolarHBondContact O-N 2.93Å; N301-S304 PolarHBondContact O-OG 2.91Å; N301-S304 VanDerWaalsContact O-OG 3.13Å
302	L	39.1	Very low	41.3	Very low	79 Å²	79	103.6 Å²	103.6	41%	0.414	55%	0.547	S	S	.	.	H	α-helix	trans	-74	-32.4	170.4	-76.6	165	0	0	0	112.2	F298 G299 S304 I305	F298-L302 HydrophobicContact CD1-CD1 3.85Å; F298-L302 HydrophobicContact CE1-CD1 3.55Å; F298-L302 HydrophobicContact CZ-CD1 4.09Å; F298-L302 PolarHBondContact O-N 3.37Å; G299-L302 PolarHBondContact O-N 2.88Å; L302-S304 VanDerWaalsContact C-N 3.34Å; L302-S304 PolarHBondContact O-N 2.92Å; L302-I305 WeakPolarHBondContact O-CD1 3.28Å; L302-I305 WeakPolarHBondContact O-CG1 3.49Å
303	C	36.4	Very low	41.7	Very low	117 Å²	117	98 Å²	98	79%	0.791	52%	0.524	S	S	*	.	H	α-helix	trans	-78.6	-10	178.8	-70.5	0	0	0	0	114.6	G299 A300	G299-C303 PolarHBondContact O-N 3.4Å; G299-C303 VanDerWaalsContact O-N 3.07Å; G299-C303 PolarHBondContact O-SG 3.14Å; A300-C303 PolarHBondContact O-N 3.49Å
304	S	35.3	Very low	41.7	Very low	75 Å²	75	96.8 Å²	96.8	52%	0.524	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	9.2	-174.6	65.1	0	0	0	0	115.2	A300 N301 L302 K306	A300-S304 PolarHBondContact O-N 3.39Å; N301-S304 PolarHBondContact O-OG 2.91Å; N301-S304 VanDerWaalsContact O-OG 3.13Å; L302-S304 VanDerWaalsContact C-N 3.34Å; L302-S304 PolarHBondContact O-N 2.92Å; S304-K306 PolarHBondContact O-N 3.33Å
305	I	37.6	Very low	41.9	Very low	93 Å²	93	96 Å²	96	48%	0.477	52%	0.516	S	S	.	.			trans	-68.8	92.1	-177.3	-56.9	171.2	0	0	0	111.1	L302 L328	L302-I305 WeakPolarHBondContact O-CD1 3.28Å; L302-I305 WeakPolarHBondContact O-CG1 3.49Å; I305-L328 HydrophobicContact CG2-CD2 4.38Å
306	K	38	Very low	41.9	Very low	191 Å²	191	93 Å²	93	83%	0.83	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-79.6	135.1	170.2	-71	-174.4	177	-178.4	0	111.1	S304	S304-K306 PolarHBondContact O-N 3.33Å
307	K	38.6	Very low	41.9	Very low	175 Å²	175	94.2 Å²	94.2	76%	0.761	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-73.6	123.5	170.3	-66.9	-177.2	176.5	-172.7	0	110.2
308	C	40.2	Very low	42.2	Very low	56 Å²	56	96.2 Å²	96.2	38%	0.378	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-103	132.9	166.7	-80.7	0	0	0	0	110.8
309	P	41.7	Very low	42.1	Very low	91 Å²	91	98 Å²	98	59%	0.591	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-71.5	141	174.3	29.8	-33.7	0	0	0	111.4	K311 S312	P309-K311 PolarHBondContact O-N 3.48Å; P309-S312 PolarHBondContact O-N 3.36Å; P309-S312 PolarHBondContact O-OG 3.27Å
310	I	43.2	Very low	41.9	Very low	78 Å²	78	104 Å²	104	40%	0.4	56%	0.556	S	S	.	*	G	3₁₀ helix	trans	-53.5	-34.1	-174	-66	163.9	0	0	0	113	S312 C313	I310-S312 PolarHBondContact O-N 3.44Å; I310-S312 VanDerWaalsContact O-N 3.14Å; I310-C313 PolarHBondContact O-N 3.34Å
311	K	46.3	Very low	41.5	Very low	215 Å²	215	108.4 Å²	108.4	94%	0.935	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-63.2	-18.2	-175.3	-69	-172.1	176.3	-176.7	0	115	P309	P309-K311 PolarHBondContact O-N 3.48Å
312	S	47	Very low	41.2	Very low	80 Å²	80	113.4 Å²	113.4	56%	0.559	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-106.6	3	-177	58.6	0	0	0	0	115.2	P309 I310 P314	P309-S312 PolarHBondContact O-N 3.36Å; P309-S312 PolarHBondContact O-OG 3.27Å; I310-S312 PolarHBondContact O-N 3.44Å; I310-S312 VanDerWaalsContact O-N 3.14Å; S312-P314 WeakPolarHBondContact O-CD 3.31Å
313	C	44.3	Very low	41.3	Very low	7 Å²	7	117 Å²	117	5%	0.047	60%	0.596	C	S	.	*			trans	-95.4	113.8	-179.8	-171.3	0	0	0	0	112.2	I310 I315 C316 K317	I310-C313 PolarHBondContact O-N 3.34Å; C313-I315 PolarHBondContact O-N 3.2Å; C313-C316 HydrophobicContact CB-CB 4Å; C313-C316 PolarHBondContact O-N 3.26Å; C313-K317 PolarHBondContact O-N 2.83Å
314	P	47	Very low	41.4	Very low	95 Å²	95	117.4 Å²	117.4	62%	0.617	60%	0.6	S	S	*	*	H	α-helix	trans	-63.9	-29.1	-178.6	24.4	-33.3	0	0	0	113.1	S312 K317 Q318	S312-P314 WeakPolarHBondContact O-CD 3.31Å; P314-K317 PolarHBondContact O-N 3.29Å; P314-Q318 PolarHBondContact O-N 3.4Å
315	I	42.7	Very low	41.6	Very low	62 Å²	62	118.1 Å²	118.1	32%	0.318	60%	0.601	S	S	.	*	H	α-helix	trans	-72.5	-36.3	178.6	-60	164.5	0	0	0	111.2	C313 K317 Q318 K331	C313-I315 PolarHBondContact O-N 3.2Å; I315-K317 VanDerWaalsContact C-N 3.29Å; I315-K317 PolarHBondContact O-N 2.86Å; I315-Q318 PolarHBondContact O-N 2.82Å; I315-K331 HydrophobicContact CD1-CB 4.42Å; I315-K331 HydrophobicContact CD1-CD 4.41Å; I315-K331 HydrophobicContact CG2-CD 4.49Å
316	C	42.5	Very low	41.4	Very low	41 Å²	41	122.4 Å²	122.4	28%	0.277	62%	0.619	S	S	.	*	H	α-helix	trans	-67.7	-32.2	174.2	-65.3	0	0	0	0	111.7	C313 Q318 L319	C313-C316 HydrophobicContact CB-CB 4Å; C313-C316 PolarHBondContact O-N 3.26Å; C316-Q318 VanDerWaalsContact C-N 3.34Å; C316-L319 PolarHBondContact O-N 2.81Å
317	K	46.1	Very low	41.4	Very low	187 Å²	187	117.5 Å²	117.5	81%	0.813	60%	0.596	S	S	*	*	H	α-helix	trans	-68.3	-30.8	178.1	-156.5	177.5	-176.9	-175.4	0	112.9	C313 P314 I315 L319	C313-K317 PolarHBondContact O-N 2.83Å; P314-K317 PolarHBondContact O-N 3.29Å; I315-K317 VanDerWaalsContact C-N 3.29Å; I315-K317 PolarHBondContact O-N 2.86Å; K317-L319 VanDerWaalsContact C-N 3.34Å
318	Q	48.8	Very low	41.3	Very low	166 Å²	166	113.4 Å²	113.4	78%	0.776	58%	0.582	S	S	*	*	H	α-helix	trans	-75.2	-16.9	176.8	-75.1	-179.9	-30.5	0	0	114.5	P314 I315 C316	P314-Q318 PolarHBondContact O-N 3.4Å; I315-Q318 PolarHBondContact O-N 2.82Å; C316-Q318 VanDerWaalsContact C-N 3.34Å
319	L	43.2	Very low	41	Very low	98 Å²	98	112.3 Å²	112.3	51%	0.513	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.6	1.8	-171.5	-78.9	166.7	0	0	0	114.7	C316 K317 Y321	C316-L319 PolarHBondContact O-N 2.81Å; K317-L319 VanDerWaalsContact C-N 3.34Å; L319-Y321 HydrophobicContact CB-CD2 3.66Å; L319-Y321 HydrophobicContact CB-CE2 3.72Å; L319-Y321 HydrophobicContact CD1-CE2 4.4Å; L319-Y321 HydrophobicContact CD2-CE2 4.21Å; L319-Y321 HydrophobicContact CG-CE2 4.34Å; L319-Y321 WeakPolarHBondContact O-CD2 3.27Å; L319-Y321 PolarHBondContact O-N 3.17Å
320	N	36.1	Very low	40.9	Very low	155 Å²	155	112.9 Å²	112.9	83%	0.829	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	45.2	35.8	172.6	-150.3	17.1	0	0	0	116.2	N322	N320-N322 PolarHBondContact O-N 3.35Å
321	Y	36.5	Very low	40.6	Very low	154 Å²	154	116.3 Å²	116.3	60%	0.604	58%	0.58	S	S	*	*			trans	-86.5	106.9	179.8	-74	-60.9	0	0	0	111.7	L319 W323	L319-Y321 HydrophobicContact CB-CD2 3.66Å; L319-Y321 HydrophobicContact CB-CE2 3.72Å; L319-Y321 HydrophobicContact CD1-CE2 4.4Å; L319-Y321 HydrophobicContact CD2-CE2 4.21Å; L319-Y321 HydrophobicContact CG-CE2 4.34Å; L319-Y321 WeakPolarHBondContact O-CD2 3.27Å; L319-Y321 PolarHBondContact O-N 3.17Å; Y321-W323 HydrophobicContact CD1-CZ2 4.43Å; Y321-W323 AromaticContact CD1-NE1 3.62Å; Y321-W323 PolarHBondContact O-N 3.34Å
322	N	35.1	Very low	39.8	Very low	166 Å²	166	109.9 Å²	109.9	89%	0.888	56%	0.561	S	S	*	*			trans	-78.6	58.1	178.7	-154.5	10	0	0	0	112	N320	N320-N322 PolarHBondContact O-N 3.35Å
323	W	41.9	Very low	39.2	Very low	155 Å²	155	115 Å²	115	59%	0.587	57%	0.574	S	S	*	*			trans	-105.6	117.2	-169.1	-72	27.4	0	0	0	110.9	Y321 V325 Y327	Y321-W323 HydrophobicContact CD1-CZ2 4.43Å; Y321-W323 AromaticContact CD1-NE1 3.62Å; Y321-W323 PolarHBondContact O-N 3.34Å; W323-V325 VanDerWaalsContact C-N 3.27Å; W323-V325 PolarHBondContact O-N 2.87Å; W323-Y327 HydrophobicContact CE3-CD2 4.35Å; W323-Y327 AromaticContact CE3-CE2 3.58Å; W323-Y327 HydrophobicContact CE3-CE2 3.58Å; W323-Y327 AromaticContact CE3-CZ 3.76Å; W323-Y327 HydrophobicContact CZ3-CE1 4.47Å; W323-Y327 HydrophobicContact CZ3-CE2 4.13Å; W323-Y327 AromaticContact CZ3-CZ 3.81Å
324	S	38.5	Very low	38.4	Very low	126 Å²	126	120 Å²	120	88%	0.881	61%	0.606	S	S	*	*			trans	-79.9	8.7	-171.2	54.4	0	0	0	0	116
325	V	38.5	Very low	37.5	Very low	89 Å²	89	122.5 Å²	122.5	54%	0.539	61%	0.614	S	S	.	*	S	Bend	trans	-120.1	141.2	-172.2	-175.4	0	0	0	0	109.7	W323 Y327	W323-V325 VanDerWaalsContact C-N 3.27Å; W323-V325 PolarHBondContact O-N 2.87Å; V325-Y327 HydrophobicContact CB-CE2 4.16Å; V325-Y327 WeakPolarHBondContact O-CD2 3.36Å; V325-Y327 PolarHBondContact O-N 3.21Å
326	E	34.3	Very low	36.9	Very low	183 Å²	183	130.8 Å²	130.8	86%	0.855	64%	0.643	S	S	*	*			trans	-64.6	129	178.6	-59.9	-173.5	154.4	0	0	112.1
327	Y	37.3	Very low	36.2	Very low	88 Å²	88	139.6 Å²	139.6	35%	0.345	67%	0.672	S	S	.	*			trans	-125.5	137.8	175.6	-81	-89.1	0	0	0	110.4	W323 V325 C329	W323-Y327 HydrophobicContact CE3-CD2 4.35Å; W323-Y327 AromaticContact CE3-CE2 3.58Å; W323-Y327 HydrophobicContact CE3-CE2 3.58Å; W323-Y327 AromaticContact CE3-CZ 3.76Å; W323-Y327 HydrophobicContact CZ3-CE1 4.47Å; W323-Y327 HydrophobicContact CZ3-CE2 4.13Å; W323-Y327 AromaticContact CZ3-CZ 3.81Å; V325-Y327 HydrophobicContact CB-CE2 4.16Å; V325-Y327 WeakPolarHBondContact O-CD2 3.36Å; V325-Y327 PolarHBondContact O-N 3.21Å; Y327-C329 PolarHBondContact O-N 3.02Å
328	L	36.9	Very low	35.4	Very low	90 Å²	90	138.3 Å²	138.3	47%	0.471	67%	0.668	S	S	.	*			trans	-71.2	116.5	167	-77.2	88.4	0	0	0	109.4	I305 F330	I305-L328 HydrophobicContact CG2-CD2 4.38Å; L328-F330 HydrophobicContact CB-CD2 4.23Å; L328-F330 HydrophobicContact CB-CE2 3.63Å; L328-F330 HydrophobicContact CB-CZ 3.95Å; L328-F330 HydrophobicContact CD2-CZ 4.08Å; L328-F330 VanDerWaalsContact O-CD2 3.31Å; L328-F330 WeakPolarHBondContact O-CD2 3.26Å
329	C	33.4	Very low	34.4	Very low	33 Å²	33	137.8 Å²	137.8	22%	0.223	67%	0.671	C	S	.	*			trans	-83.6	114.6	168.1	-176.4	0	0	0	0	110.2	Y327	Y327-C329 PolarHBondContact O-N 3.02Å
330	F	39.9	Very low	33.7	Very low	102 Å²	102	139.3 Å²	139.3	45%	0.447	68%	0.68	S	S	.	*			trans	-89.7	7	-178.4	-71.1	-87.4	0	0	0	114.3	L328	L328-F330 HydrophobicContact CB-CD2 4.23Å; L328-F330 HydrophobicContact CB-CE2 3.63Å; L328-F330 HydrophobicContact CB-CZ 3.95Å; L328-F330 HydrophobicContact CD2-CZ 4.08Å; L328-F330 VanDerWaalsContact O-CD2 3.31Å; L328-F330 WeakPolarHBondContact O-CD2 3.26Å
331	K	37	Very low	33.4	Very low	150 Å²	150	137.3 Å²	137.3	65%	0.652	67%	0.673	S	S	*	*			trans	-111.6	23.3	-164.6	-138.2	-176.6	-177.1	-169.1	0	115.8	I315 K333	I315-K331 HydrophobicContact CD1-CB 4.42Å; I315-K331 HydrophobicContact CD1-CD 4.41Å; I315-K331 HydrophobicContact CG2-CD 4.49Å; K331-K333 PolarHBondContact O-N 3.17Å
332	C	30	Very low	33.1	Very low	80 Å²	80	137.5 Å²	137.5	54%	0.541	69%	0.685	S	S	.	*			trans	-93.4	74	177.6	-69.7	0	0	0	0	112.7
333	K	33.6	Very low	32.9	Very low	189 Å²	189	138.1 Å²	138.1	82%	0.822	69%	0.687	S	S	*	*			trans	-137.7	126.9	156.4	-150.2	178.6	-175	-172.6	0	107.5	K331	K331-K333 PolarHBondContact O-N 3.17Å
334	P	28.3	Very low	32.3	Very low	112 Å²	112	137.8 Å²	137.8	73%	0.727	70%	0.696	S	S	*	*			trans	-71.4	163.7	-178.2	31	-35.1	0	0	0	110.9
335	N	28.1	Very low	32	Very low	147 Å²	147	138.9 Å²	138.9	79%	0.786	69%	0.692	S	S	*	*			trans	73	85.9	179.8	-52.2	-12.1	0	0	0	115.4
336	Y	28.9	Very low	31.7	Very low	235 Å²	235	143.2 Å²	143.2	92%	0.922	71%	0.706	S	S	*	*			trans	-155.3	110	133.4	-114.1	-73.4	0	0	0	110.3
337	Y	28.5	Very low	31.7	Very low	227 Å²	227	143.3 Å²	143.3	89%	0.89	71%	0.706	S	S	*	*			trans	-69.5	140.8	168.7	-100	-99.8	0	0	0	109.8
338	H	28.5	Very low	31.6	Very low	159 Å²	159	146.2 Å²	146.2	74%	0.736	73%	0.726	S	S	*	*			trans	-79.1	121	176.3	-138.8	-59.4	0	0	0	108.8	N340	H338-N340 PolarHBondContact CE1-OD1 2.92Å; H338-N340 PolarHBondContact ND1-OD1 3.41Å
339	N	28.9	Very low	31.5	Very low	155 Å²	155	149 Å²	149	83%	0.829	74%	0.74	S	S	*	*			trans	-121.8	108.9	167.6	-127.6	-0.1	0	0	0	109.5
340	N	26.7	Very low	31.5	Very low	131 Å²	131	156.5 Å²	156.5	70%	0.701	77%	0.772	S	S	*	*			trans	-94.5	99.3	-174.9	-79.4	-20	0	0	0	110.8	H338	H338-N340 PolarHBondContact CE1-OD1 2.92Å; H338-N340 PolarHBondContact ND1-OD1 3.41Å
341	T	30.4	Very low	31.1	Very low	112 Å²	112	161 Å²	161	69%	0.687	79%	0.791	S	S	*	*			trans	-146.2	-25.6	170.8	39.5	0	0	0	0	116.4
342	N	31.3	Very low	30.8	Very low	159 Å²	159	161.6 Å²	161.6	85%	0.85	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	24.4	-162.4	-70.5	-14.6	0	0	0	117.1
343	L	29.8	Very low	30.9	Very low	179 Å²	179	167.5 Å²	167.5	94%	0.937	82%	0.821	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-2.9	-177.8	-142.9	81.4	0	0	0	115.5
344	L	29.4	Very low	30.7	Very low	148 Å²	148	167.6 Å²	167.6	78%	0.775	82%	0.821	S	S	*	*	S	Bend	trans	-92	-24.8	-168.4	-141	76.3	0	0	0	115.6	H346	L344-H346 PolarHBondContact O-N 3.25Å
345	N	31.6	Very low	30.7	Very low	148 Å²	148	168.7 Å²	168.7	79%	0.791	82%	0.821	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	5.5	-162.2	-81.1	-1.9	0	0	0	117.3
346	H	32.9	Very low	30.9	Very low	180 Å²	180	169 Å²	169	83%	0.833	82%	0.823	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	8	-171.2	-128.6	-55.7	0	0	0	116.3	L344	L344-H346 PolarHBondContact O-N 3.25Å
347	Q	34.9	Very low	31	Very low	185 Å²	185	162.8 Å²	162.8	86%	0.864	81%	0.812	S	S	*	*	S	Bend	trans	-94.6	-6	-172.8	-70.9	-169.5	-11.6	0	0	116.3
348	I	34.8	Very low	31.1	Very low	149 Å²	149	159.5 Å²	159.5	76%	0.764	81%	0.808	S	S	*	*	S	Bend	trans	-93.8	-16.2	-163.2	-65.1	176.2	0	0	0	114.8
349	I	35	Very low	31.1	Very low	149 Å²	149	160.7 Å²	160.7	76%	0.764	81%	0.807	S	S	*	*	S	Bend	trans	-95.2	-3.1	-161.8	-63.4	174.8	0	0	0	115.6
350	Q	34.1	Very low	31.3	Very low	191 Å²	191	159.7 Å²	159.7	89%	0.893	80%	0.801	S	S	*	*			trans	-105.5	21.7	-171.4	-76.1	-169.5	-13.1	0	0	117.4
351	K	29.8	Very low	31.4	Very low	197 Å²	197	157 Å²	157	86%	0.857	79%	0.792	S	S	*	*			trans	-99.3	84.4	164.2	-77.9	-175.5	177	178.9	0	110.2
352	N	31.6	Very low	31.8	Very low	161 Å²	161	154.9 Å²	154.9	86%	0.861	78%	0.782	S	S	*	*			trans	171.5	84.1	152.1	-90.3	-18.4	0	0	0	112
353	Q	32.7	Very low	32	Very low	204 Å²	204	151.8 Å²	151.8	95%	0.953	77%	0.765	S	S	*	*			trans	-164.4	103.7	148	-111.7	165.2	21.5	0	0	109.5
354	K	28.1	Very low	32.3	Very low	191 Å²	191	148.4 Å²	148.4	83%	0.83	75%	0.747	S	S	*	*			trans	-93.6	137.9	-177.7	-132.1	177.4	-177.3	179.8	0	109.1
355	N	28.6	Very low	32.6	Very low	136 Å²	136	146.3 Å²	146.3	73%	0.727	74%	0.736	S	S	*	*			trans	41.2	104.4	151.9	-56.9	-1.8	0	0	0	118.8
356	N	32	Very low	32.8	Very low	152 Å²	152	144.9 Å²	144.9	81%	0.813	73%	0.726	S	S	*	*			trans	-153.2	117.5	143.2	-102.3	-28.9	0	0	0	110.2	I358	N356-I358 PolarHBondContact O-N 3Å
357	P	30.8	Very low	33.1	Very low	106 Å²	106	143.2 Å²	143.2	69%	0.688	72%	0.716	S	S	*	*			trans	-77.5	109.1	175.5	30.7	-31.4	0	0	0	109.8	Y359	P357-Y359 PolarHBondContact O-N 3.28Å
358	I	31.3	Very low	33.3	Very low	158 Å²	158	142 Å²	142	81%	0.81	71%	0.708	S	S	*	*			trans	-76.4	122.8	178.5	-61.8	177.1	0	0	0	109.3	N356	N356-I358 PolarHBondContact O-N 3Å
359	Y	28.8	Very low	33.9	Very low	183 Å²	183	139.5 Å²	139.5	72%	0.718	70%	0.696	S	S	*	*			trans	-66.1	145.3	-165.6	-80.1	-106.2	0	0	0	115.1	P357 S361 S362	P357-Y359 PolarHBondContact O-N 3.28Å; Y359-S361 PolarHBondContact O-N 2.84Å; Y359-S362 PolarHBondContact O-N 2.83Å; Y359-S362 PolarHBondContact O-OG 3.09Å
360	L	32.6	Very low	34.5	Very low	135 Å²	135	135.9 Å²	135.9	71%	0.707	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-15.4	175.1	-157.6	74.3	0	0	0	114.1	S362 I363	L360-S362 VanDerWaalsContact C-N 3.29Å; L360-S362 PolarHBondContact O-N 3.49Å; L360-I363 HydrophobicContact CD1-CD1 4.2Å; L360-I363 PolarHBondContact O-N 3.49Å
361	S	29.3	Very low	35	Very low	74 Å²	74	135.2 Å²	135.2	52%	0.517	67%	0.668	S	S	.	*	H	α-helix	trans	-62.2	-30.9	-179.3	54.2	0	0	0	0	113.8	Y359 I363 I364 N365	Y359-S361 PolarHBondContact O-N 2.84Å; S361-I363 VanDerWaalsContact C-N 3.28Å; S361-I363 PolarHBondContact O-N 3.29Å; S361-I364 PolarHBondContact O-N 3.15Å; S361-N365 PolarHBondContact O-N 2.95Å
362	S	37.5	Very low	35.8	Very low	68 Å²	68	132.1 Å²	132.1	48%	0.476	66%	0.655	S	S	.	*	H	α-helix	trans	-61.7	-33.8	177.5	58.4	0	0	0	0	113.2	Y359 L360	Y359-S362 PolarHBondContact O-N 2.83Å; Y359-S362 PolarHBondContact O-OG 3.09Å; L360-S362 VanDerWaalsContact C-N 3.29Å; L360-S362 PolarHBondContact O-N 3.49Å
363	I	36.2	Very low	36.8	Very low	93 Å²	93	128.3 Å²	128.3	48%	0.477	64%	0.637	S	S	.	*	H	α-helix	trans	-73.7	-31.6	-178.7	-59.5	176.5	0	0	0	111.2	L360 S361	L360-I363 HydrophobicContact CD1-CD1 4.2Å; L360-I363 PolarHBondContact O-N 3.49Å; S361-I363 VanDerWaalsContact C-N 3.28Å; S361-I363 PolarHBondContact O-N 3.29Å
364	I	36.9	Very low	37.8	Very low	109 Å²	109	123.2 Å²	123.2	56%	0.559	62%	0.616	S	S	*	*	H	α-helix	trans	-72.7	-39.2	-179.3	-60.8	176	0	0	0	110.8	S361 M366 K367	S361-I364 PolarHBondContact O-N 3.15Å; I364-M366 PolarHBondContact O-N 3.34Å; I364-K367 PolarHBondContact O-N 3.39Å
365	N	35.9	Very low	38.8	Very low	103 Å²	103	115.8 Å²	115.8	55%	0.551	59%	0.593	S	S	*	*	H	α-helix	trans	-67.9	-33.8	177.7	-85.5	-16.6	0	0	0	113.3	S361 K367 K368 I369	S361-N365 PolarHBondContact O-N 2.95Å; N365-K367 VanDerWaalsContact C-N 3.29Å; N365-K367 PolarHBondContact O-N 2.85Å; N365-K368 PolarHBondContact O-N 2.82Å; N365-I369 PolarHBondContact O-N 2.91Å
366	M	35.1	Very low	40.3	Very low	119 Å²	119	115.2 Å²	115.2	59%	0.586	58%	0.582	S	S	*	*	H	α-helix	trans	-62.2	-32.8	175.9	-81.1	-71.4	177.6	0	0	113.4	I364 K368 I369 N370	I364-M366 PolarHBondContact O-N 3.34Å; M366-K368 VanDerWaalsContact C-N 3.35Å; M366-K368 PolarHBondContact O-N 2.91Å; M366-I369 PolarHBondContact O-N 3.45Å; M366-I369 HydrophobicContact SD-CD1 4.46Å; M366-N370 PolarHBondContact O-N 2.88Å
367	K	38.6	Very low	41.3	Very low	144 Å²	144	110.9 Å²	110.9	63%	0.626	56%	0.558	S	S	*	*	H	α-helix	trans	-62.8	-39.3	175.1	-75.9	-174.2	176.2	-179.5	0	112.2	I364 N365 I369 Y371	I364-K367 PolarHBondContact O-N 3.39Å; N365-K367 VanDerWaalsContact C-N 3.29Å; N365-K367 PolarHBondContact O-N 2.85Å; K367-I369 VanDerWaalsContact C-N 3.33Å; K367-I369 PolarHBondContact O-N 3.39Å; K367-Y371 WeakPolarHBondContact O-CD2 3.42Å
368	K	39.3	Very low	42.9	Very low	160 Å²	160	110.5 Å²	110.5	70%	0.696	55%	0.55	S	S	*	.	H	α-helix	trans	-66.5	-31.5	179	-75.4	-175.2	174	-179.8	0	113.1	N365 M366	N365-K368 PolarHBondContact O-N 2.82Å; M366-K368 VanDerWaalsContact C-N 3.35Å; M366-K368 PolarHBondContact O-N 2.91Å
369	I	46.6	Very low	44.4	Very low	97 Å²	97	108 Å²	108	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-71.6	-41.3	-178.6	-62.7	170.5	0	0	0	111.3	N365 M366 K367 Y371 K372 T373	N365-I369 PolarHBondContact O-N 2.91Å; M366-I369 PolarHBondContact O-N 3.45Å; M366-I369 HydrophobicContact SD-CD1 4.46Å; K367-I369 VanDerWaalsContact C-N 3.33Å; K367-I369 PolarHBondContact O-N 3.39Å; I369-Y371 PolarHBondContact O-N 2.87Å; I369-K372 WeakPolarHBondContact O-CB 3.37Å; I369-K372 PolarHBondContact O-N 3.05Å; I369-K372 VanDerWaalsContact O-N 3.15Å; I369-T373 PolarHBondContact O-N 2.87Å; I369-T373 PolarHBondContact O-OG1 3.14Å
370	N	48	Very low	46.1	Very low	72 Å²	72	104 Å²	104	39%	0.385	53%	0.527	S	S	.	.	H	α-helix	trans	-66.9	-36.5	-174.9	-76.2	-28.8	0	0	0	114.4	M366 K372 T373 I374	M366-N370 PolarHBondContact O-N 2.88Å; N370-K372 VanDerWaalsContact C-N 3.28Å; N370-K372 PolarHBondContact O-N 3.28Å; N370-T373 PolarHBondContact O-OG1 2.95Å; N370-I374 VanDerWaalsContact O-CG1 3.32Å; N370-I374 WeakPolarHBondContact O-CG1 3.43Å; N370-I374 PolarHBondContact O-N 2.93Å
371	Y	44.4	Very low	47.3	Very low	178 Å²	178	100.3 Å²	100.3	70%	0.698	51%	0.507	S	S	*	.	H	α-helix	trans	-68.2	-30.9	174.3	-64.4	-69.4	0	0	0	112	K367 I369 G375	K367-Y371 WeakPolarHBondContact O-CD2 3.42Å; I369-Y371 PolarHBondContact O-N 2.87Å; Y371-G375 PolarHBondContact O-N 3.23Å
372	K	47.9	Very low	48.8	Very low	132 Å²	132	99.6 Å²	99.6	57%	0.574	50%	0.502	S	S	*	.	H	α-helix	trans	-69.4	-46.4	179.8	-143.4	-173.8	-177.5	-172	0	111.4	I369 N370 G375 Y376	I369-K372 WeakPolarHBondContact O-CB 3.37Å; I369-K372 PolarHBondContact O-N 3.05Å; I369-K372 VanDerWaalsContact O-N 3.15Å; N370-K372 VanDerWaalsContact C-N 3.28Å; N370-K372 PolarHBondContact O-N 3.28Å; K372-G375 PolarHBondContact O-N 2.98Å; K372-Y376 HydrophobicContact CD-CE2 3.95Å; K372-Y376 WeakPolarHBondContact CE-OH 3.3Å; K372-Y376 HydrophobicContact CG-CD2 4.28Å; K372-Y376 HydrophobicContact CG-CE2 3.69Å; K372-Y376 WeakPolarHBondContact O-CD2 3.31Å; K372-Y376 PolarHBondContact O-N 3.4Å
373	T	51.6	Low	50.1	Low	81 Å²	81	100.7 Å²	100.7	50%	0.497	50%	0.503	S	S	.	.	H	α-helix	trans	-69	-39.4	178.3	42.3	0	0	0	0	113.3	I369 N370 Y376 L377	I369-T373 PolarHBondContact O-N 2.87Å; I369-T373 PolarHBondContact O-OG1 3.14Å; N370-T373 PolarHBondContact O-OG1 2.95Å; T373-Y376 PolarHBondContact O-N 2.91Å; T373-L377 PolarHBondContact O-N 2.89Å
374	I	53.4	Low	51.2	Low	97 Å²	97	100.9 Å²	100.9	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-65.8	-41.8	173.3	-65.7	169.4	0	0	0	110.4	N370 L377 I378	N370-I374 VanDerWaalsContact O-CG1 3.32Å; N370-I374 WeakPolarHBondContact O-CG1 3.43Å; N370-I374 PolarHBondContact O-N 2.93Å; I374-L377 PolarHBondContact O-N 3.46Å; I374-I378 HydrophobicContact CG2-CD1 3.9Å; I374-I378 WeakPolarHBondContact O-CG1 3.24Å; I374-I378 PolarHBondContact O-N 3.29Å
375	G	49.8	Very low	52.5	Low	35 Å²	35	99 Å²	99	36%	0.361	49%	0.494	S	S	.	.	H	α-helix	trans	-59.1	-46	174.1	0	0	0	0	0	112.9	Y371 K372 L377 I378 L379	Y371-G375 PolarHBondContact O-N 3.23Å; K372-G375 PolarHBondContact O-N 2.98Å; G375-L377 PolarHBondContact O-N 2.92Å; G375-I378 PolarHBondContact O-N 3.24Å; G375-L379 VanDerWaalsContact O-CB 3.29Å; G375-L379 WeakPolarHBondContact O-CB 3.44Å; G375-L379 PolarHBondContact O-N 2.85Å
376	Y	60.5	Low	53.8	Low	123 Å²	123	97.7 Å²	97.7	48%	0.482	49%	0.49	S	S	.	.	H	α-helix	trans	-61.6	-40.1	174.4	-75.1	-56.6	0	0	0	112.7	K372 T373 L379 I380	K372-Y376 HydrophobicContact CD-CE2 3.95Å; K372-Y376 WeakPolarHBondContact CE-OH 3.3Å; K372-Y376 HydrophobicContact CG-CD2 4.28Å; K372-Y376 HydrophobicContact CG-CE2 3.69Å; K372-Y376 WeakPolarHBondContact O-CD2 3.31Å; K372-Y376 PolarHBondContact O-N 3.4Å; T373-Y376 PolarHBondContact O-N 2.91Å; Y376-L379 PolarHBondContact O-N 2.78Å; Y376-I380 WeakPolarHBondContact O-CB 3.31Å; Y376-I380 WeakPolarHBondContact O-CD1 3.32Å; Y376-I380 VanDerWaalsContact O-CG1 3.22Å; Y376-I380 WeakPolarHBondContact O-CG1 3.28Å; Y376-I380 PolarHBondContact O-N 3.24Å
377	L	52.8	Low	55	Low	61 Å²	61	94.9 Å²	94.9	32%	0.319	48%	0.482	S	S	.	.	H	α-helix	trans	-65.5	-43.6	178	-164.7	106.7	0	0	0	111.6	T373 I374 G375 I380 I381 L471	T373-L377 PolarHBondContact O-N 2.89Å; I374-L377 PolarHBondContact O-N 3.46Å; G375-L377 PolarHBondContact O-N 2.92Å; L377-I380 PolarHBondContact O-N 2.84Å; L377-I381 HydrophobicContact CD2-CD1 3.81Å; L377-I381 HydrophobicContact CG-CD1 4.09Å; L377-I381 WeakPolarHBondContact O-CB 3.43Å; L377-I381 VanDerWaalsContact O-CG1 3.27Å; L377-I381 WeakPolarHBondContact O-CG1 3.25Å; L377-I381 PolarHBondContact O-N 3.09Å; L377-L471 HydrophobicContact CD1-CD2 4.11Å; L377-L471 HydrophobicContact CD2-CD1 4.24Å; L377-L471 HydrophobicContact CD2-CD2 3.93Å
378	I	65.2	Low	56	Low	99 Å²	99	90.6 Å²	90.6	51%	0.508	47%	0.465	S	S	.	.	H	α-helix	trans	-62	-44.7	174.3	-67.2	168.1	0	0	0	110.1	I374 G375 I380 I381 S382	I374-I378 HydrophobicContact CG2-CD1 3.9Å; I374-I378 WeakPolarHBondContact O-CG1 3.24Å; I374-I378 PolarHBondContact O-N 3.29Å; G375-I378 PolarHBondContact O-N 3.24Å; I378-I380 PolarHBondContact O-N 3.34Å; I378-I381 PolarHBondContact O-N 2.81Å; I378-S382 WeakPolarHBondContact O-CB 3.38Å; I378-S382 PolarHBondContact O-N 3.29Å; I378-S382 PolarHBondContact O-OG 2.91Å; I378-S382 VanDerWaalsContact O-OG 3.05Å
379	L	61.8	Low	56.8	Low	105 Å²	105	87.5 Å²	87.5	55%	0.55	46%	0.456	S	S	.	.	H	α-helix	trans	-63.4	-41.4	179.4	-159.7	161.8	0	0	0	111.5	G375 Y376 S382 L383	G375-L379 VanDerWaalsContact O-CB 3.29Å; G375-L379 WeakPolarHBondContact O-CB 3.44Å; G375-L379 PolarHBondContact O-N 2.85Å; Y376-L379 PolarHBondContact O-N 2.78Å; L379-S382 PolarHBondContact O-N 3.45Å; L379-L383 WeakPolarHBondContact O-CB 3.46Å; L379-L383 PolarHBondContact O-N 3.27Å
380	I	65	Low	57.3	Low	99 Å²	99	89.1 Å²	89.1	51%	0.508	47%	0.465	S	S	.	.	H	α-helix	trans	-64.9	-43.4	174.9	-69.8	163	0	0	0	111.4	Y376 L377 I378 L383 L384	Y376-I380 WeakPolarHBondContact O-CB 3.31Å; Y376-I380 WeakPolarHBondContact O-CD1 3.32Å; Y376-I380 VanDerWaalsContact O-CG1 3.22Å; Y376-I380 WeakPolarHBondContact O-CG1 3.28Å; Y376-I380 PolarHBondContact O-N 3.24Å; L377-I380 PolarHBondContact O-N 2.84Å; I378-I380 PolarHBondContact O-N 3.34Å; I380-L383 PolarHBondContact O-N 3.06Å; I380-L384 HydrophobicContact CG2-CD1 4Å; I380-L384 WeakPolarHBondContact O-CB 3.18Å; I380-L384 WeakPolarHBondContact O-CG 3.47Å; I380-L384 PolarHBondContact O-N 2.92Å
381	I	57.4	Low	57.8	Low	57 Å²	57	90.3 Å²	90.3	29%	0.292	47%	0.47	S	S	.	.	H	α-helix	trans	-64.9	-46.3	176.9	-70.1	165.8	0	0	0	110.5	L377 I378 L383 L384 I385	L377-I381 HydrophobicContact CD2-CD1 3.81Å; L377-I381 HydrophobicContact CG-CD1 4.09Å; L377-I381 WeakPolarHBondContact O-CB 3.43Å; L377-I381 VanDerWaalsContact O-CG1 3.27Å; L377-I381 WeakPolarHBondContact O-CG1 3.25Å; L377-I381 PolarHBondContact O-N 3.09Å; I378-I381 PolarHBondContact O-N 2.81Å; I381-L383 VanDerWaalsContact C-N 3.34Å; I381-L383 PolarHBondContact O-N 3.45Å; I381-L384 PolarHBondContact O-N 2.67Å; I381-I385 HydrophobicContact CG2-CD1 3.74Å; I381-I385 HydrophobicContact CG2-CG1 4.48Å; I381-I385 WeakPolarHBondContact O-CB 3.32Å; I381-I385 VanDerWaalsContact O-CG1 3.28Å; I381-I385 WeakPolarHBondContact O-CG1 3.36Å; I381-I385 PolarHBondContact O-N 3.06Å
382	S	60.8	Low	58.2	Low	59 Å²	59	83 Å²	83	41%	0.413	45%	0.445	S	S	.	.	H	α-helix	trans	-59.7	-44	174.7	-66.1	0	0	0	0	111.2	I378 L379 I385 T386	I378-S382 WeakPolarHBondContact O-CB 3.38Å; I378-S382 PolarHBondContact O-N 3.29Å; I378-S382 PolarHBondContact O-OG 2.91Å; I378-S382 VanDerWaalsContact O-OG 3.05Å; L379-S382 PolarHBondContact O-N 3.45Å; S382-I385 PolarHBondContact O-N 3.5Å; S382-T386 WeakPolarHBondContact O-CB 3.38Å; S382-T386 WeakPolarHBondContact O-CG2 3.4Å; S382-T386 PolarHBondContact O-N 3.12Å; S382-T386 PolarHBondContact O-OG1 3.28Å
383	L	64.1	Low	58.4	Low	92 Å²	92	81.6 Å²	81.6	48%	0.482	44%	0.443	S	S	.	.	H	α-helix	trans	-63.6	-43.6	178.4	-173.4	143.5	0	0	0	111.6	L379 I380 I381 T386 C387	L379-L383 WeakPolarHBondContact O-CB 3.46Å; L379-L383 PolarHBondContact O-N 3.27Å; I380-L383 PolarHBondContact O-N 3.06Å; I381-L383 VanDerWaalsContact C-N 3.34Å; I381-L383 PolarHBondContact O-N 3.45Å; L383-T386 VanDerWaalsContact CA-OG1 3.28Å; L383-T386 WeakPolarHBondContact CA-OG1 3.48Å; L383-T386 PolarHBondContact O-N 3.2Å; L383-T386 PolarHBondContact O-OG1 3.29Å; L383-C387 WeakPolarHBondContact O-CB 3.26Å; L383-C387 PolarHBondContact O-N 3.15Å; L383-C387 PolarHBondContact O-SG 3.38Å
384	L	60.3	Low	58.3	Low	97 Å²	97	81.9 Å²	81.9	51%	0.508	45%	0.447	S	S	.	.	H	α-helix	trans	-61.7	-46	173.8	-78.2	165.3	0	0	0	111.9	I380 I381 C387 L388	I380-L384 HydrophobicContact CG2-CD1 4Å; I380-L384 WeakPolarHBondContact O-CB 3.18Å; I380-L384 WeakPolarHBondContact O-CG 3.47Å; I380-L384 PolarHBondContact O-N 2.92Å; I381-L384 PolarHBondContact O-N 2.67Å; L384-C387 PolarHBondContact O-N 3.14Å; L384-L388 WeakPolarHBondContact O-CB 3.4Å; L384-L388 WeakPolarHBondContact O-CD1 3.13Å; L384-L388 VanDerWaalsContact O-CG 3.26Å; L384-L388 WeakPolarHBondContact O-CG 3.48Å; L384-L388 PolarHBondContact O-N 3.31Å
385	I	63	Low	58	Low	68 Å²	68	80 Å²	80	35%	0.349	44%	0.435	S	S	.	.	H	α-helix	trans	-62.6	-44	176.1	-68.7	167.5	0	0	0	110.5	I381 S382 L388 L389 F603	I381-I385 HydrophobicContact CG2-CD1 3.74Å; I381-I385 HydrophobicContact CG2-CG1 4.48Å; I381-I385 WeakPolarHBondContact O-CB 3.32Å; I381-I385 VanDerWaalsContact O-CG1 3.28Å; I381-I385 WeakPolarHBondContact O-CG1 3.36Å; I381-I385 PolarHBondContact O-N 3.06Å; S382-I385 PolarHBondContact O-N 3.5Å; I385-L388 PolarHBondContact O-N 3.46Å; I385-L389 HydrophobicContact CG2-CD1 3.88Å; I385-L389 HydrophobicContact CG2-CG 4.41Å; I385-L389 WeakPolarHBondContact O-CB 3.25Å; I385-L389 VanDerWaalsContact O-CG 3.31Å; I385-L389 WeakPolarHBondContact O-CG 3.1Å; I385-L389 PolarHBondContact O-N 2.9Å; I385-F603 HydrophobicContact CD1-CZ 4.17Å
386	T	63.2	Low	58.2	Low	76 Å²	76	83.3 Å²	83.3	47%	0.466	44%	0.444	S	S	.	.	H	α-helix	trans	-66.1	-40.6	176.9	51.2	0	0	0	0	111.8	S382 L383 L388 L389 L390	S382-T386 WeakPolarHBondContact O-CB 3.38Å; S382-T386 WeakPolarHBondContact O-CG2 3.4Å; S382-T386 PolarHBondContact O-N 3.12Å; S382-T386 PolarHBondContact O-OG1 3.28Å; L383-T386 VanDerWaalsContact CA-OG1 3.28Å; L383-T386 WeakPolarHBondContact CA-OG1 3.48Å; L383-T386 PolarHBondContact O-N 3.2Å; L383-T386 PolarHBondContact O-OG1 3.29Å; T386-L388 PolarHBondContact O-N 3.5Å; T386-L389 CarbonylContact O-C 3.59Å; T386-L389 PolarHBondContact O-N 3.22Å; T386-L390 VanDerWaalsContact O-CB 3.27Å; T386-L390 WeakPolarHBondContact O-CB 3.28Å; T386-L390 PolarHBondContact O-N 3.38Å
387	C	61.7	Low	57.8	Low	60 Å²	60	88.3 Å²	88.3	41%	0.405	46%	0.462	S	S	.	.	H	α-helix	trans	-63	-42.2	175.5	-74.5	0	0	0	0	111.5	L383 L384 L390 I391	L383-C387 WeakPolarHBondContact O-CB 3.26Å; L383-C387 PolarHBondContact O-N 3.15Å; L383-C387 PolarHBondContact O-SG 3.38Å; L384-C387 PolarHBondContact O-N 3.14Å; C387-L390 PolarHBondContact O-N 2.97Å; C387-I391 WeakPolarHBondContact O-CD1 3.18Å; C387-I391 VanDerWaalsContact O-CG1 3.23Å; C387-I391 WeakPolarHBondContact O-CG1 3.43Å; C387-I391 PolarHBondContact O-N 3.37Å
388	L	58.5	Low	57.7	Low	54 Å²	54	86.7 Å²	86.7	28%	0.283	46%	0.456	S	S	.	.	H	α-helix	trans	-61.3	-45.6	173.6	-72.5	163.4	0	0	0	111.4	L384 I385 T386 I391 C392 I460	L384-L388 WeakPolarHBondContact O-CB 3.4Å; L384-L388 WeakPolarHBondContact O-CD1 3.13Å; L384-L388 VanDerWaalsContact O-CG 3.26Å; L384-L388 WeakPolarHBondContact O-CG 3.48Å; L384-L388 PolarHBondContact O-N 3.31Å; I385-L388 PolarHBondContact O-N 3.46Å; T386-L388 PolarHBondContact O-N 3.5Å; L388-I391 PolarHBondContact O-N 2.98Å; L388-C392 WeakPolarHBondContact O-CB 3.5Å; L388-C392 PolarHBondContact O-N 3.21Å; L388-C392 PolarHBondContact O-SG 3.1Å; L388-I460 HydrophobicContact CD1-CD1 3.87Å; L388-I460 HydrophobicContact CD1-CG1 3.86Å; L388-I460 HydrophobicContact CD2-CD1 4.29Å; L388-I460 HydrophobicContact CD2-CG1 4.34Å
389	L	56.4	Low	56.9	Low	96 Å²	96	84.5 Å²	84.5	50%	0.503	44%	0.442	S	S	.	.	H	α-helix	trans	-64.8	-37.7	175.4	-72.3	170.8	0	0	0	112.7	I385 T386 I391 C392 L393	I385-L389 HydrophobicContact CG2-CD1 3.88Å; I385-L389 HydrophobicContact CG2-CG 4.41Å; I385-L389 WeakPolarHBondContact O-CB 3.25Å; I385-L389 VanDerWaalsContact O-CG 3.31Å; I385-L389 WeakPolarHBondContact O-CG 3.1Å; I385-L389 PolarHBondContact O-N 2.9Å; T386-L389 CarbonylContact O-C 3.59Å; T386-L389 PolarHBondContact O-N 3.22Å; L389-I391 VanDerWaalsContact C-N 3.32Å; L389-C392 PolarHBondContact O-N 2.98Å; L389-L393 HydrophobicContact CB-CD1 4.49Å; L389-L393 VanDerWaalsContact O-CB 3.31Å; L389-L393 WeakPolarHBondContact O-CB 3.27Å; L389-L393 VanDerWaalsContact O-CG 3.31Å; L389-L393 WeakPolarHBondContact O-CG 3.33Å; L389-L393 PolarHBondContact O-N 3.27Å
390	L	57.9	Low	56.3	Low	131 Å²	131	84 Å²	84	69%	0.686	44%	0.436	S	S	*	.	H	α-helix	trans	-71.2	-28.3	179.8	-141.4	113.3	0	0	0	112.2	T386 C387 P394	T386-L390 VanDerWaalsContact O-CB 3.27Å; T386-L390 WeakPolarHBondContact O-CB 3.28Å; T386-L390 PolarHBondContact O-N 3.38Å; C387-L390 PolarHBondContact O-N 2.97Å; L390-P394 WeakPolarHBondContact O-CD 3.35Å; L390-P394 WeakPolarHBondContact O-CG 3.28Å
391	I	58.2	Low	55.2	Low	96 Å²	96	84 Å²	84	49%	0.492	44%	0.437	S	S	.	.	H	α-helix	trans	-73.6	-39	170.1	-67.7	162.9	0	0	0	110.3	C387 L388 L389 Q395	C387-I391 WeakPolarHBondContact O-CD1 3.18Å; C387-I391 VanDerWaalsContact O-CG1 3.23Å; C387-I391 WeakPolarHBondContact O-CG1 3.43Å; C387-I391 PolarHBondContact O-N 3.37Å; L388-I391 PolarHBondContact O-N 2.98Å; L389-I391 VanDerWaalsContact C-N 3.32Å; I391-Q395 VanDerWaalsContact O-CD 3.24Å; I391-Q395 WeakPolarHBondContact O-CG 3.25Å; I391-Q395 PolarHBondContact O-NE2 2.93Å
392	C	53.4	Low	54.8	Low	25 Å²	25	84 Å²	84	17%	0.169	44%	0.437	C	S	.	.	H	α-helix	trans	-78.1	-35.8	-178.3	-68.8	0	0	0	0	114.7	L388 L389 Q395 I396	L388-C392 WeakPolarHBondContact O-CB 3.5Å; L388-C392 PolarHBondContact O-N 3.21Å; L388-C392 PolarHBondContact O-SG 3.1Å; L389-C392 PolarHBondContact O-N 2.98Å; C392-Q395 CarbonylContact O-C 3.59Å; C392-Q395 WeakPolarHBondContact O-CA 3.47Å; C392-Q395 WeakPolarHBondContact O-CB 3.36Å; C392-Q395 PolarHBondContact O-N 3.04Å; C392-Q395 VanDerWaalsContact O-N 3.1Å; C392-I396 PolarHBondContact O-N 2.99Å; C392-I396 VanDerWaalsContact O-N 3.14Å
393	L	51.3	Low	53.7	Low	103 Å²	103	83.4 Å²	83.4	54%	0.539	44%	0.44	S	S	.	.	H	α-helix	trans	-62.2	-48.5	-172.5	-86.3	162.3	0	0	0	113.8	L389 Q395 I396	L389-L393 HydrophobicContact CB-CD1 4.49Å; L389-L393 VanDerWaalsContact O-CB 3.31Å; L389-L393 WeakPolarHBondContact O-CB 3.27Å; L389-L393 VanDerWaalsContact O-CG 3.31Å; L389-L393 WeakPolarHBondContact O-CG 3.33Å; L389-L393 PolarHBondContact O-N 3.27Å; L393-Q395 PolarHBondContact O-N 3.49Å; L393-I396 PolarHBondContact O-N 3.47Å; L393-I396 VanDerWaalsContact O-N 3.15Å
394	P	49.4	Very low	52.8	Low	87 Å²	87	83.2 Å²	83.2	57%	0.565	44%	0.438	S	S	*	.	H	α-helix	trans	-61.7	-25.3	173.8	-22.2	34.2	0	0	0	113.1	L390 W397	L390-P394 WeakPolarHBondContact O-CD 3.35Å; L390-P394 WeakPolarHBondContact O-CG 3.28Å; P394-W397 PolarHBondContact O-N 3.17Å
395	Q	48.4	Very low	52	Low	57 Å²	57	84.2 Å²	84.2	27%	0.266	44%	0.444	S	S	.	.	H	α-helix	trans	-85.2	-9.9	-179.8	-59.9	179.5	0.5	0	0	113.4	I391 C392 L393 S398 Y399	I391-Q395 VanDerWaalsContact O-CD 3.24Å; I391-Q395 WeakPolarHBondContact O-CG 3.25Å; I391-Q395 PolarHBondContact O-NE2 2.93Å; C392-Q395 CarbonylContact O-C 3.59Å; C392-Q395 WeakPolarHBondContact O-CA 3.47Å; C392-Q395 WeakPolarHBondContact O-CB 3.36Å; C392-Q395 PolarHBondContact O-N 3.04Å; C392-Q395 VanDerWaalsContact O-N 3.1Å; L393-Q395 PolarHBondContact O-N 3.49Å; Q395-S398 PolarHBondContact O-OG 3.4Å; Q395-S398 VanDerWaalsContact O-OG 3.05Å; Q395-Y399 WeakPolarHBondContact O-CD2 3.25Å; Q395-Y399 WeakPolarHBondContact O-CE2 3.49Å
396	I	52.1	Low	50.9	Low	105 Å²	105	84.6 Å²	84.6	54%	0.538	45%	0.446	S	S	.	.	H	α-helix	trans	-83.3	-33.6	167.4	-66.5	165.6	0	0	0	109.9	C392 L393 S398 Y399	C392-I396 PolarHBondContact O-N 2.99Å; C392-I396 VanDerWaalsContact O-N 3.14Å; L393-I396 PolarHBondContact O-N 3.47Å; L393-I396 VanDerWaalsContact O-N 3.15Å; I396-S398 VanDerWaalsContact C-N 3.25Å; I396-S398 PolarHBondContact O-N 3.45Å; I396-Y399 PolarHBondContact O-N 2.92Å
397	W	52.4	Low	50.1	Low	228 Å²	228	85.4 Å²	85.4	86%	0.864	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-15.6	177.6	-96.2	49.2	0	0	0	115	P394 Y399	P394-W397 PolarHBondContact O-N 3.17Å; W397-Y399 PolarHBondContact O-N 3.05Å
398	S	50.4	Low	49.2	Very low	27 Å²	27	86 Å²	86	19%	0.189	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-5.7	175	60.8	0	0	0	0	114	Q395 I396 K443	Q395-S398 PolarHBondContact O-OG 3.4Å; Q395-S398 VanDerWaalsContact O-OG 3.05Å; I396-S398 VanDerWaalsContact C-N 3.25Å; I396-S398 PolarHBondContact O-N 3.45Å; S398-K443 WeakPolarHBondContact O-CB 3.24Å; S398-K443 WeakPolarHBondContact O-CG 3.13Å; S398-K443 PolarHBondContact O-N 3.23Å
399	Y	49.3	Very low	48.3	Very low	53 Å²	53	89.1 Å²	89.1	21%	0.208	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	126	179.9	-72.8	-71.6	0	0	0	112.9	Q395 I396 W397 L440 L441 N442 Y449	Q395-Y399 WeakPolarHBondContact O-CD2 3.25Å; Q395-Y399 WeakPolarHBondContact O-CE2 3.49Å; I396-Y399 PolarHBondContact O-N 2.92Å; W397-Y399 PolarHBondContact O-N 3.05Å; Y399-L440 HydrophobicContact CD1-CD2 3.19Å; Y399-L440 HydrophobicContact CD1-CG 3.52Å; Y399-L440 HydrophobicContact CD2-CD2 4.39Å; Y399-L440 HydrophobicContact CE1-CD2 3.64Å; Y399-L440 HydrophobicContact CE1-CG 4.33Å; Y399-L440 HydrophobicContact CG-CD2 3.6Å; Y399-L440 HydrophobicContact CG-CG 3.97Å; Y399-L441 WeakPolarHBondContact CA-O 3.26Å; Y399-N442 HydrophobicContact CD1-CB 4.28Å; Y399-N442 HydrophobicContact CE1-CB 3.78Å; Y399-Y449 HydrophobicContact CE2-CD2 4.08Å; Y399-Y449 HydrophobicContact CE2-CE1 4.42Å; Y399-Y449 AromaticContact CE2-CE2 3.49Å; Y399-Y449 HydrophobicContact CE2-CE2 3.49Å; Y399-Y449 VanDerWaalsContact CE2-CE2 3.49Å; Y399-Y449 AromaticContact CE2-CZ 3.66Å; Y399-Y449 AromaticContact CZ-CE2 3.85Å; Y399-Y449 AromaticContact CZ-CZ 3.76Å; Y399-Y449 WeakPolarHBondContact OH-CD1 3.3Å; Y399-Y449 WeakPolarHBondContact OH-CD2 3.45Å; Y399-Y449 WeakPolarHBondContact OH-CE1 3.23Å; Y399-Y449 VanDerWaalsContact OH-CE2 3.31Å; Y399-Y449 WeakPolarHBondContact OH-CE2 3.29Å; Y399-Y449 VanDerWaalsContact OH-CG 3.25Å
400	Q	48.5	Very low	47.5	Very low	94 Å²	94	89.6 Å²	89.6	44%	0.439	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	125	172.8	-170.5	167	-18.6	0	0	109.8	I402 L441 K443	Q400-I402 HydrophobicContact CG-CG1 4Å; Q400-L441 PolarHBondContact N-O 3.27Å; Q400-L441 PolarHBondContact O-N 2.96Å; Q400-K443 VanDerWaalsContact OE1-CE 3.3Å
401	L	41.6	Very low	46.7	Very low	100 Å²	100	89.8 Å²	89.8	52%	0.524	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	118.9	164.5	-118.9	87.2	0	0	0	108.1	W438 L440	L401-W438 HydrophobicContact CB-CE3 4.25Å; L401-W438 HydrophobicContact CD2-CB 4.21Å; L401-W438 HydrophobicContact CD2-CD2 3.9Å; L401-W438 HydrophobicContact CD2-CE3 3.69Å; L401-W438 HydrophobicContact CD2-CG 4.15Å; L401-W438 HydrophobicContact CD2-CZ3 4.3Å; L401-W438 HydrophobicContact CG-CB 4.47Å; L401-W438 HydrophobicContact CG-CE3 4.21Å; L401-L440 HydrophobicContact CD1-CD1 3.57Å
402	I	49.4	Very low	45.7	Very low	56 Å²	56	91.7 Å²	91.7	29%	0.287	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	120.8	174.8	-60	-179.3	0	0	0	108.3	Q400 M404 W438 R439 L441	Q400-I402 HydrophobicContact CG-CG1 4Å; I402-M404 HydrophobicContact CG2-CG 4.32Å; I402-W438 CarbonylContact O-C 3.59Å; I402-W438 WeakPolarHBondContact O-CA 3.32Å; I402-R439 PolarHBondContact N-O 3.23Å; I402-R439 PolarHBondContact O-N 2.7Å; I402-L441 HydrophobicContact CD1-CB 3.89Å; I402-L441 HydrophobicContact CD1-CD1 4.29Å; I402-L441 HydrophobicContact CD1-CD2 4.04Å; I402-L441 HydrophobicContact CD1-CG 4.29Å
403	G	37.6	Very low	45.1	Very low	47 Å²	47	97.8 Å²	97.8	49%	0.485	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	133.9	171.4	0	0	0	0	0	110.8
404	M	46.6	Very low	44.3	Very low	87 Å²	87	103.7 Å²	103.7	43%	0.429	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	126.6	179.3	-62	-170.1	73.1	0	0	109.7	I402 L406 A437 R439	I402-M404 HydrophobicContact CG2-CG 4.32Å; M404-L406 PolarHBondContact O-N 2.93Å; M404-A437 PolarHBondContact N-O 2.87Å; M404-A437 PolarHBondContact O-N 3.31Å; M404-R439 HydrophobicContact CG-CB 4.32Å; M404-R439 HydrophobicContact SD-CB 3.68Å; M404-R439 HydrophobicContact SD-CG 4.26Å
405	N	42.5	Very low	43.9	Very low	118 Å²	118	105 Å²	105	63%	0.631	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	102	174.4	-71.5	-26.3	0	0	0	109.9	K407 Y434 Y435	N405-K407 PolarHBondContact O-N 2.77Å; N405-Y434 HydrophobicContact CB-CD1 4.08Å; N405-Y435 CarbonylContact C-O 3.56Å
406	L	40.9	Very low	43.2	Very low	77 Å²	77	109.1 Å²	109.1	40%	0.403	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	112	-179.8	-130.5	146.3	0	0	0	109.4	M404 I408 Y434 Y435 A437	M404-L406 PolarHBondContact O-N 2.93Å; L406-I408 HydrophobicContact CD2-CG1 4.43Å; L406-Y434 WeakPolarHBondContact O-CA 3.3Å; L406-Y435 WeakPolarHBondContact CB-O 3.47Å; L406-Y435 PolarHBondContact N-O 2.77Å; L406-Y435 PolarHBondContact O-N 3.43Å; L406-A437 HydrophobicContact CB-CB 4.47Å; L406-A437 HydrophobicContact CD1-CB 3.78Å
407	K	45.1	Very low	42.6	Very low	93 Å²	93	110.1 Å²	110.1	40%	0.404	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.1	109.1	-175.7	-178.1	173.8	-177.2	153.8	0	110.4	N405 E432 Y434	N405-K407 PolarHBondContact O-N 2.77Å; K407-E432 WeakPolarHBondContact CE-OE1 3.24Å; K407-E432 WeakPolarHBondContact CE-OE2 3.49Å; K407-E432 IonicContact NZ-OE1 3.83Å; K407-E432 PolarHBondContact NZ-OE1 2.9Å; K407-E432 IonicContact NZ-OE2 3.62Å; K407-E432 PolarHBondContact NZ-OE2 3.48Å; K407-Y434 HydrophobicContact CB-CD1 4.02Å; K407-Y434 HydrophobicContact CB-CE1 3.87Å; K407-Y434 HydrophobicContact CD-CE1 3.82Å; K407-Y434 HydrophobicContact CG-CD1 4.33Å; K407-Y434 HydrophobicContact CG-CE1 3.91Å; K407-Y434 PolarHBondContact NZ-OH 3.36Å
408	I	44	Very low	42.1	Very low	73 Å²	73	105.6 Å²	105.6	37%	0.374	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	123.3	177.4	-54.9	-177	0	0	0	109.1	L406 L410 K433 Y435	L406-I408 HydrophobicContact CD2-CG1 4.43Å; I408-L410 HydrophobicContact CG2-CD1 4.14Å; I408-K433 PolarHBondContact N-O 2.78Å; I408-K433 PolarHBondContact O-N 3.35Å; I408-K433 VanDerWaalsContact O-N 3.09Å; I408-Y435 HydrophobicContact CB-CD2 4.48Å; I408-Y435 HydrophobicContact CB-CE2 4.37Å; I408-Y435 HydrophobicContact CD1-CD2 3.74Å; I408-Y435 HydrophobicContact CD1-CE2 3.89Å; I408-Y435 HydrophobicContact CG1-CD2 4.07Å; I408-Y435 HydrophobicContact CG1-CE2 4.34Å
409	K	40	Very low	41.5	Very low	118 Å²	118	111.9 Å²	111.9	51%	0.513	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.9	116.4	167.4	-75.6	-172.9	168	-170.9	0	108.6	E432	K409-E432 WeakPolarHBondContact CE-OE1 3.28Å; K409-E432 HydrophobicContact CG-CG 4.25Å; K409-E432 IonicContact NZ-OE1 3.02Å
410	L	39.5	Very low	41.1	Very low	106 Å²	106	116.1 Å²	116.1	56%	0.555	61%	0.612	S	S	*	*			trans	-82.5	119.8	164.3	-101.6	76.7	0	0	0	108.7	I408	I408-L410 HydrophobicContact CG2-CD1 4.14Å
411	F	39.6	Very low	40.6	Very low	135 Å²	135	119.7 Å²	119.7	59%	0.592	63%	0.629	S	S	*	*			trans	-92.7	104.3	164.7	-105.8	-88.6	0	0	0	109
412	N	38.1	Very low	40.3	Very low	136 Å²	136	123 Å²	123	73%	0.727	64%	0.642	S	S	*	*			trans	-89.2	101.2	167.7	-79.8	-1.3	0	0	0	108.6
413	Q	39.5	Very low	39.5	Very low	154 Å²	154	128.2 Å²	128.2	72%	0.72	67%	0.667	S	S	*	*			trans	-112.4	70.7	177.2	-136	176.4	11.5	0	0	111
414	Y	35.6	Very low	39.3	Very low	227 Å²	227	130.6 Å²	130.6	89%	0.89	68%	0.676	S	S	*	*			trans	-109.5	88.1	165.7	-77.2	-78.6	0	0	0	109.2
415	T	39.8	Very low	38.8	Very low	114 Å²	114	131.8 Å²	131.8	70%	0.699	69%	0.693	S	S	*	*			trans	-136.6	95.4	168	47.7	0	0	0	0	109.4	T417	T415-T417 PolarHBondContact O-N 3.46Å
416	T	33.9	Very low	38.8	Very low	143 Å²	143	134.1 Å²	134.1	88%	0.877	70%	0.704	S	S	*	*			trans	-69.5	111.3	166.1	44.6	0	0	0	0	109.4
417	T	40.7	Very low	38.6	Very low	126 Å²	126	136 Å²	136	77%	0.773	72%	0.724	S	S	*	*			trans	-110.2	94.1	172.6	52.7	0	0	0	0	110.1	T415	T415-T417 PolarHBondContact O-N 3.46Å
418	T	42.5	Very low	38.4	Very low	133 Å²	133	136.6 Å²	136.6	82%	0.816	74%	0.739	S	S	*	*			trans	-67.4	141	156	43.8	0	0	0	0	109.2	T420	T418-T420 PolarHBondContact O-N 3.19Å
419	N	37.7	Very low	38.3	Very low	159 Å²	159	137.5 Å²	137.5	85%	0.85	75%	0.752	S	S	*	*	S	Bend	trans	-48.6	121.2	-178.2	-48.7	-25	0	0	0	113.3
420	T	40.3	Very low	38.3	Very low	142 Å²	142	136.2 Å²	136.2	87%	0.871	75%	0.751	S	S	*	*				-163.7	157.6	123.8	21.9	0	0	0	0	109.4	T418	T418-T420 PolarHBondContact O-N 3.19Å
421	E	37	Very low	38.4	Very low	169 Å²	169	138.1 Å²	138.1	79%	0.79	76%	0.756	S	S	*	*			trans	-79.2	170.9	-167.3	-62.5	152.8	141.4	0	0	113.3
422	H	36.4	Very low	38.6	Very low	171 Å²	171	135.2 Å²	135.2	79%	0.792	75%	0.745	S	S	*	*			trans	84.8	134.2	165.1	-74.4	-86.3	0	0	0	121.4
423	M	32.6	Very low	38.7	Very low	164 Å²	164	134.9 Å²	134.9	81%	0.808	74%	0.737	S	S	*	*			trans	75.6	83	153.5	-67.8	171.6	76.6	0	0	119.5
424	S	33.8	Very low	39.1	Very low	97 Å²	97	133.7 Å²	133.7	68%	0.678	73%	0.727	S	S	*	*				47.6	133.9	114	61.1	0	0	0	0	121.3
425	S	36.1	Very low	39.3	Very low	113 Å²	113	128.4 Å²	128.4	79%	0.79	71%	0.706	S	S	*	*			trans	66.7	85	157.7	61.8	0	0	0	0	118.6
426	I	41.3	Very low	39.3	Very low	167 Å²	167	127.9 Å²	127.9	86%	0.856	71%	0.705	S	S	*	*			trans	-131.3	121.7	145.3	-59.6	-178.1	0	0	0	108.6	S428	I426-S428 PolarHBondContact O-N 3.39Å
427	S	36.8	Very low	39.6	Very low	117 Å²	117	122.5 Å²	122.5	82%	0.818	68%	0.675	S	S	*	*			trans	-78.6	103.7	178.8	35.5	0	0	0	0	111.4	S429	S427-S429 PolarHBondContact O-N 2.95Å
428	S	40.6	Very low	39.5	Very low	105 Å²	105	124 Å²	124	73%	0.734	67%	0.666	S	S	*	*			trans	-76.2	111.1	172.3	51	0	0	0	0	111.2	I426 N430	I426-S428 PolarHBondContact O-N 3.39Å; S428-N430 PolarHBondContact O-N 2.82Å
429	S	41.6	Very low	39.5	Very low	91 Å²	91	123 Å²	123	64%	0.636	65%	0.648	S	S	*	*			trans	-71.6	111.1	179.7	46.5	0	0	0	0	111.8	S427 H431	S427-S429 PolarHBondContact O-N 2.95Å; S429-H431 PolarHBondContact O-N 3.46Å
430	N	41.4	Very low	39.8	Very low	91 Å²	91	118.2 Å²	118.2	49%	0.487	62%	0.621	S	S	.	*			trans	-66.9	98.8	171.4	-74.1	-51	0	0	0	110.6	S428 E432	S428-N430 PolarHBondContact O-N 2.82Å; N430-E432 PolarHBondContact O-N 3.27Å; N430-E432 VanDerWaalsContact O-N 3.16Å
431	H	40.5	Very low	40	Very low	147 Å²	147	115.1 Å²	115.1	68%	0.681	60%	0.599	S	S	*	*			trans	-74.7	103.2	173.6	-80.9	-70.5	0	0	0	111.3	S429	S429-H431 PolarHBondContact O-N 3.46Å
432	E	43.5	Very low	40.7	Very low	73 Å²	73	109.3 Å²	109.3	34%	0.341	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.7	124.8	173.9	-50.1	-173.4	125.9	0	0	109.9	K407 K409 N430	K407-E432 WeakPolarHBondContact CE-OE1 3.24Å; K407-E432 WeakPolarHBondContact CE-OE2 3.49Å; K407-E432 IonicContact NZ-OE1 3.83Å; K407-E432 PolarHBondContact NZ-OE1 2.9Å; K407-E432 IonicContact NZ-OE2 3.62Å; K407-E432 PolarHBondContact NZ-OE2 3.48Å; K409-E432 WeakPolarHBondContact CE-OE1 3.28Å; K409-E432 HydrophobicContact CG-CG 4.25Å; K409-E432 IonicContact NZ-OE1 3.02Å; N430-E432 PolarHBondContact O-N 3.27Å; N430-E432 VanDerWaalsContact O-N 3.16Å
433	K	41.8	Very low	41.5	Very low	129 Å²	129	107.8 Å²	107.8	56%	0.561	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109	134.1	172.3	-78.8	-175.6	176.2	178.2	0	110.5	I408 Y435	I408-K433 PolarHBondContact N-O 2.78Å; I408-K433 PolarHBondContact O-N 3.35Å; I408-K433 VanDerWaalsContact O-N 3.09Å; K433-Y435 HydrophobicContact CB-CE2 3.87Å
434	Y	46.3	Very low	42.4	Very low	130 Å²	130	104.3 Å²	104.3	51%	0.51	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.9	129.1	176.5	-69.5	-96	0	0	0	109.5	N405 L406 K407	N405-Y434 HydrophobicContact CB-CD1 4.08Å; L406-Y434 WeakPolarHBondContact O-CA 3.3Å; K407-Y434 HydrophobicContact CB-CD1 4.02Å; K407-Y434 HydrophobicContact CB-CE1 3.87Å; K407-Y434 HydrophobicContact CD-CE1 3.82Å; K407-Y434 HydrophobicContact CG-CD1 4.33Å; K407-Y434 HydrophobicContact CG-CE1 3.91Å; K407-Y434 PolarHBondContact NZ-OH 3.36Å
435	Y	41.4	Very low	43.1	Very low	115 Å²	115	103 Å²	103	45%	0.451	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.7	128.2	176.8	-68	-88.9	0	0	0	110	N405 L406 I408 K433 A437	N405-Y435 CarbonylContact C-O 3.56Å; L406-Y435 WeakPolarHBondContact CB-O 3.47Å; L406-Y435 PolarHBondContact N-O 2.77Å; L406-Y435 PolarHBondContact O-N 3.43Å; I408-Y435 HydrophobicContact CB-CD2 4.48Å; I408-Y435 HydrophobicContact CB-CE2 4.37Å; I408-Y435 HydrophobicContact CD1-CD2 3.74Å; I408-Y435 HydrophobicContact CD1-CE2 3.89Å; I408-Y435 HydrophobicContact CG1-CD2 4.07Å; I408-Y435 HydrophobicContact CG1-CE2 4.34Å; K433-Y435 HydrophobicContact CB-CE2 3.87Å; Y435-A437 PolarHBondContact O-N 3.5Å
436	P	38.4	Very low	43.7	Very low	104 Å²	104	103.3 Å²	103.3	68%	0.675	54%	0.543	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	125.5	174.6	28.7	-33.1	0	0	0	110.4
437	A	40.3	Very low	44.3	Very low	30 Å²	30	98.1 Å²	98.1	25%	0.248	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	163.5	173.2	0	0	0	0	0	109.8	M404 L406 Y435	M404-A437 PolarHBondContact N-O 2.87Å; M404-A437 PolarHBondContact O-N 3.31Å; L406-A437 HydrophobicContact CB-CB 4.47Å; L406-A437 HydrophobicContact CD1-CB 3.78Å; Y435-A437 PolarHBondContact O-N 3.5Å
438	W	39.8	Very low	45.1	Very low	158 Å²	158	97.1 Å²	97.1	60%	0.598	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124	128.1	178.7	-61.9	91.9	0	0	0	110.5	L401 I402	L401-W438 HydrophobicContact CB-CE3 4.25Å; L401-W438 HydrophobicContact CD2-CB 4.21Å; L401-W438 HydrophobicContact CD2-CD2 3.9Å; L401-W438 HydrophobicContact CD2-CE3 3.69Å; L401-W438 HydrophobicContact CD2-CG 4.15Å; L401-W438 HydrophobicContact CD2-CZ3 4.3Å; L401-W438 HydrophobicContact CG-CB 4.47Å; L401-W438 HydrophobicContact CG-CE3 4.21Å; I402-W438 CarbonylContact O-C 3.59Å; I402-W438 WeakPolarHBondContact O-CA 3.32Å
439	R	41	Very low	45.5	Very low	112 Å²	112	93.9 Å²	93.9	42%	0.423	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.3	175.2	-170.9	179.1	-162.7	158.9	18.7	109.3	I402 M404 L441 D582	I402-R439 PolarHBondContact N-O 3.23Å; I402-R439 PolarHBondContact O-N 2.7Å; M404-R439 HydrophobicContact CG-CB 4.32Å; M404-R439 HydrophobicContact SD-CB 3.68Å; M404-R439 HydrophobicContact SD-CG 4.26Å; R439-L441 HydrophobicContact CG-CD1 4.43Å; R439-D582 IonicContact NH2-OD2 3.18Å; R439-D582 PolarHBondContact NH2-OD2 3.18Å; R439-D582 VanDerWaalsContact NH2-OD2 3.11Å
440	L	44.7	Very low	46.1	Very low	57 Å²	57	91.3 Å²	91.3	30%	0.298	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	120.3	165.9	-146.8	75.8	0	0	0	108.8	Y399 L401 Q589	Y399-L440 HydrophobicContact CD1-CD2 3.19Å; Y399-L440 HydrophobicContact CD1-CG 3.52Å; Y399-L440 HydrophobicContact CD2-CD2 4.39Å; Y399-L440 HydrophobicContact CE1-CD2 3.64Å; Y399-L440 HydrophobicContact CE1-CG 4.33Å; Y399-L440 HydrophobicContact CG-CD2 3.6Å; Y399-L440 HydrophobicContact CG-CG 3.97Å; L401-L440 HydrophobicContact CD1-CD1 3.57Å; L440-Q589 HydrophobicContact CB-CG 3.82Å; L440-Q589 HydrophobicContact CD1-CG 4.24Å; L440-Q589 HydrophobicContact CD2-CG 3.82Å; L440-Q589 HydrophobicContact CG-CG 4.18Å
441	L	45.6	Very low	46.7	Very low	78 Å²	78	91.7 Å²	91.7	41%	0.408	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.5	168.2	-132.3	82.4	0	0	0	109.5	Y399 Q400 I402 R439	Y399-L441 WeakPolarHBondContact CA-O 3.26Å; Q400-L441 PolarHBondContact N-O 3.27Å; Q400-L441 PolarHBondContact O-N 2.96Å; I402-L441 HydrophobicContact CD1-CB 3.89Å; I402-L441 HydrophobicContact CD1-CD1 4.29Å; I402-L441 HydrophobicContact CD1-CD2 4.04Å; I402-L441 HydrophobicContact CD1-CG 4.29Å; R439-L441 HydrophobicContact CG-CD1 4.43Å
442	N	51.7	Low	47.5	Very low	46 Å²	46	86.7 Å²	86.7	25%	0.246	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	118.4	166.7	178	1.3	0	0	0	108.1	Y399 T444	Y399-N442 HydrophobicContact CD1-CB 4.28Å; Y399-N442 HydrophobicContact CE1-CB 3.78Å; N442-T444 PolarHBondContact O-N 3.29Å; N442-T444 PolarHBondContact OD1-N 3Å; N442-T444 VanDerWaalsContact OD1-N 3.08Å; N442-T444 PolarHBondContact OD1-OG1 3.49Å
443	K	52.5	Low	48.2	Very low	140 Å²	140	84.3 Å²	84.3	61%	0.609	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-22.6	-178.8	-75.3	-176.4	175.2	-177.4	0	114.7	S398 Q400	S398-K443 WeakPolarHBondContact O-CB 3.24Å; S398-K443 WeakPolarHBondContact O-CG 3.13Å; S398-K443 PolarHBondContact O-N 3.23Å; Q400-K443 VanDerWaalsContact OE1-CE 3.3Å
444	T	51.5	Low	48.9	Very low	91 Å²	91	78.3 Å²	78.3	56%	0.558	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-4.1	-169.3	61.4	0	0	0	0	115.3	N442 Q446	N442-T444 PolarHBondContact O-N 3.29Å; N442-T444 PolarHBondContact OD1-N 3Å; N442-T444 VanDerWaalsContact OD1-N 3.08Å; N442-T444 PolarHBondContact OD1-OG1 3.49Å; T444-Q446 PolarHBondContact O-N 3.28Å
445	G	48.1	Very low	49.6	Very low	68 Å²	68	76.3 Å²	76.3	70%	0.701	39%	0.394	S	S	*	.			trans	63.9	-9.4	172.7	0	0	0	0	0	117.5
446	Q	49	Very low	50.6	Low	121 Å²	121	72.3 Å²	72.3	57%	0.565	38%	0.38	S	S	*	.			trans	-86.3	135.6	-172.2	-73.3	177.3	-7.1	0	0	113.2	T444 I448	T444-Q446 PolarHBondContact O-N 3.28Å; Q446-I448 HydrophobicContact CB-CD1 4.23Å; Q446-I448 HydrophobicContact CB-CG1 4.26Å; Q446-I448 PolarHBondContact O-N 3.03Å; Q446-I448 VanDerWaalsContact O-N 3.16Å
447	T	53.4	Low	51.6	Low	57 Å²	57	68.4 Å²	68.4	35%	0.35	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-8.8	-179	48.2	0	0	0	0	114.8	Y449 E450 Y451 N549	T447-Y449 PolarHBondContact O-N 3Å; T447-Y449 VanDerWaalsContact O-N 3.11Å; T447-E450 PolarHBondContact O-N 3.19Å; T447-E450 VanDerWaalsContact O-N 3.07Å; T447-Y451 PolarHBondContact O-N 2.78Å; T447-N549 WeakPolarHBondContact CG2-ND2 3.17Å
448	I	54.3	Low	52.6	Low	97 Å²	97	70.3 Å²	70.3	50%	0.497	36%	0.356	S	S	.	.	H	α-helix	trans	-50.4	-37.8	179.6	-58.7	172.6	0	0	0	111.4	Q446 E450 Y451 C452	Q446-I448 HydrophobicContact CB-CD1 4.23Å; Q446-I448 HydrophobicContact CB-CG1 4.26Å; Q446-I448 PolarHBondContact O-N 3.03Å; Q446-I448 VanDerWaalsContact O-N 3.16Å; I448-E450 PolarHBondContact O-N 3.13Å; I448-Y451 PolarHBondContact O-N 3.3Å; I448-C452 PolarHBondContact O-N 3.44Å; I448-C452 PolarHBondContact O-SG 3.35Å
449	Y	49.5	Very low	53.8	Low	36 Å²	36	65.6 Å²	65.6	14%	0.141	35%	0.345	C	S	.	.	H	α-helix	trans	-54.7	-47.4	178.1	178.8	-94.4	0	0	0	113.5	Y399 T447 C452 F453 L592	Y399-Y449 HydrophobicContact CE2-CD2 4.08Å; Y399-Y449 HydrophobicContact CE2-CE1 4.42Å; Y399-Y449 AromaticContact CE2-CE2 3.49Å; Y399-Y449 HydrophobicContact CE2-CE2 3.49Å; Y399-Y449 VanDerWaalsContact CE2-CE2 3.49Å; Y399-Y449 AromaticContact CE2-CZ 3.66Å; Y399-Y449 AromaticContact CZ-CE2 3.85Å; Y399-Y449 AromaticContact CZ-CZ 3.76Å; Y399-Y449 WeakPolarHBondContact OH-CD1 3.3Å; Y399-Y449 WeakPolarHBondContact OH-CD2 3.45Å; Y399-Y449 WeakPolarHBondContact OH-CE1 3.23Å; Y399-Y449 VanDerWaalsContact OH-CE2 3.31Å; Y399-Y449 WeakPolarHBondContact OH-CE2 3.29Å; Y399-Y449 VanDerWaalsContact OH-CG 3.25Å; T447-Y449 PolarHBondContact O-N 3Å; T447-Y449 VanDerWaalsContact O-N 3.11Å; Y449-C452 PolarHBondContact O-N 3.49Å; Y449-F453 HydrophobicContact CD1-CD2 4.26Å; Y449-F453 HydrophobicContact CD2-CD2 4.23Å; Y449-F453 HydrophobicContact CD2-CE2 4.24Å; Y449-F453 AromaticContact CE1-CD2 3.81Å; Y449-F453 HydrophobicContact CE1-CD2 3.81Å; Y449-F453 HydrophobicContact CE1-CE2 4.03Å; Y449-F453 AromaticContact CE2-CD2 3.77Å; Y449-F453 HydrophobicContact CE2-CD2 3.77Å; Y449-F453 AromaticContact CE2-CE2 3.42Å; Y449-F453 HydrophobicContact CE2-CE2 3.42Å; Y449-F453 VanDerWaalsContact CE2-CE2 3.42Å; Y449-F453 HydrophobicContact CE2-CZ 4.45Å; Y449-F453 HydrophobicContact CG-CD2 4.47Å; Y449-F453 AromaticContact CZ-CD2 3.57Å; Y449-F453 AromaticContact CZ-CE2 3.31Å; Y449-F453 PolarHBondContact O-N 3.06Å; Y449-F453 VanDerWaalsContact OH-CE2 3.32Å; Y449-F453 WeakPolarHBondContact OH-CE2 3.34Å; Y449-L592 HydrophobicContact CE1-CD1 3.73Å; Y449-L592 WeakPolarHBondContact OH-CD1 3.43Å
450	E	53.7	Low	54.8	Low	38 Å²	38	62.6 Å²	62.6	18%	0.178	34%	0.336	C	S	.	.	H	α-helix	trans	-76.7	-28.3	-173.8	-57.9	176.4	135.3	0	0	111.2	T447 I448 A454 L545 R588	T447-E450 PolarHBondContact O-N 3.19Å; T447-E450 VanDerWaalsContact O-N 3.07Å; I448-E450 PolarHBondContact O-N 3.13Å; E450-A454 WeakPolarHBondContact O-CB 3.4Å; E450-A454 PolarHBondContact O-N 2.98Å; E450-L545 HydrophobicContact CB-CD1 3.48Å; E450-L545 VanDerWaalsContact CB-CD1 3.48Å; E450-L545 HydrophobicContact CG-CD1 4.29Å; E450-L545 VanDerWaalsContact OE2-CD2 3.32Å; E450-L545 WeakPolarHBondContact OE2-CD2 3.43Å; E450-R588 IonicContact OE1-CZ 2.7Å; E450-R588 IonicContact OE1-NH1 3.01Å; E450-R588 PolarHBondContact OE1-NH1 3.49Å; E450-R588 IonicContact OE2-NH1 2.7Å
451	Y	54.1	Low	55.5	Low	98 Å²	98	60.6 Å²	60.6	38%	0.384	33%	0.327	S	S	.	.	H	α-helix	trans	-65.6	-48.3	167.6	-84.2	-103.7	0	0	0	111.6	T447 I448 F453 A454 V455 L542	T447-Y451 PolarHBondContact O-N 2.78Å; I448-Y451 PolarHBondContact O-N 3.3Å; Y451-F453 VanDerWaalsContact C-N 3.35Å; Y451-F453 PolarHBondContact O-N 3.34Å; Y451-A454 PolarHBondContact O-N 3.46Å; Y451-V455 WeakPolarHBondContact O-CG2 3.42Å; Y451-V455 PolarHBondContact O-N 3.43Å; Y451-L542 HydrophobicContact CD1-CD2 3.52Å; Y451-L542 HydrophobicContact CD2-CD2 4.31Å; Y451-L542 HydrophobicContact CE1-CD2 3.26Å; Y451-L542 HydrophobicContact CE2-CD2 4.1Å; Y451-L542 HydrophobicContact CG-CD2 4.05Å
452	C	56.4	Low	56.2	Low	42 Å²	42	57.6 Å²	57.6	28%	0.284	31%	0.312	S	S	.	.	H	α-helix	trans	-59.6	-43.7	176.9	-73	0	0	0	0	111.7	I448 Y449 V455 I456	I448-C452 PolarHBondContact O-N 3.44Å; I448-C452 PolarHBondContact O-SG 3.35Å; Y449-C452 PolarHBondContact O-N 3.49Å; C452-V455 PolarHBondContact O-N 3.38Å; C452-I456 WeakPolarHBondContact O-CB 3.48Å; C452-I456 WeakPolarHBondContact O-CD1 3.38Å; C452-I456 VanDerWaalsContact O-CG1 3.23Å; C452-I456 WeakPolarHBondContact O-CG1 3.46Å; C452-I456 PolarHBondContact O-N 2.91Å
453	F	58.8	Low	56.8	Low	23 Å²	23	58.5 Å²	58.5	10%	0.101	32%	0.321	C	S	.	.	H	α-helix	trans	-63.2	-40.5	175.2	-99.5	-94.1	0	0	0	113.2	Y449 Y451 V455 I456 H457 L592 M596	Y449-F453 HydrophobicContact CD1-CD2 4.26Å; Y449-F453 HydrophobicContact CD2-CD2 4.23Å; Y449-F453 HydrophobicContact CD2-CE2 4.24Å; Y449-F453 AromaticContact CE1-CD2 3.81Å; Y449-F453 HydrophobicContact CE1-CD2 3.81Å; Y449-F453 HydrophobicContact CE1-CE2 4.03Å; Y449-F453 AromaticContact CE2-CD2 3.77Å; Y449-F453 HydrophobicContact CE2-CD2 3.77Å; Y449-F453 AromaticContact CE2-CE2 3.42Å; Y449-F453 HydrophobicContact CE2-CE2 3.42Å; Y449-F453 VanDerWaalsContact CE2-CE2 3.42Å; Y449-F453 HydrophobicContact CE2-CZ 4.45Å; Y449-F453 HydrophobicContact CG-CD2 4.47Å; Y449-F453 AromaticContact CZ-CD2 3.57Å; Y449-F453 AromaticContact CZ-CE2 3.31Å; Y449-F453 PolarHBondContact O-N 3.06Å; Y449-F453 VanDerWaalsContact OH-CE2 3.32Å; Y449-F453 WeakPolarHBondContact OH-CE2 3.34Å; Y451-F453 VanDerWaalsContact C-N 3.35Å; Y451-F453 PolarHBondContact O-N 3.34Å; F453-V455 VanDerWaalsContact C-N 3.35Å; F453-V455 PolarHBondContact O-N 2.81Å; F453-I456 PolarHBondContact O-N 2.92Å; F453-H457 VanDerWaalsContact O-CB 3.32Å; F453-H457 WeakPolarHBondContact O-CB 3.34Å; F453-H457 PolarHBondContact O-N 2.92Å; F453-L592 HydrophobicContact CD1-CD1 4.35Å; F453-L592 HydrophobicContact CE1-CD1 4.28Å; F453-L592 HydrophobicContact CE1-CD2 4.19Å; F453-L592 HydrophobicContact CE1-CG 4.34Å; F453-L592 HydrophobicContact CZ-CD2 4.39Å; F453-M596 HydrophobicContact CE1-CE 4.37Å; F453-M596 HydrophobicContact CE1-CG 4.3Å; F453-M596 HydrophobicContact CE1-SD 3.76Å
454	A	57.1	Low	57.1	Low	4 Å²	4	53.2 Å²	53.2	3%	0.033	30%	0.301	C	S	.	.	H	α-helix	trans	-63.7	-39.1	175.2	0	0	0	0	0	112.4	E450 Y451 F458	E450-A454 WeakPolarHBondContact O-CB 3.4Å; E450-A454 PolarHBondContact O-N 2.98Å; Y451-A454 PolarHBondContact O-N 3.46Å; A454-F458 PolarHBondContact O-N 3.47Å
455	V	61.1	Low	57.5	Low	87 Å²	87	50.3 Å²	50.3	53%	0.527	28%	0.281	S	S	.	.	H	α-helix	trans	-67.8	-46.1	175.3	172.1	0	0	0	0	111.1	Y451 C452 F453 H457 F458 V459	Y451-V455 WeakPolarHBondContact O-CG2 3.42Å; Y451-V455 PolarHBondContact O-N 3.43Å; C452-V455 PolarHBondContact O-N 3.38Å; F453-V455 VanDerWaalsContact C-N 3.35Å; F453-V455 PolarHBondContact O-N 2.81Å; V455-H457 VanDerWaalsContact C-N 3.32Å; V455-H457 PolarHBondContact O-N 3.38Å; V455-F458 PolarHBondContact O-N 2.92Å; V455-V459 HydrophobicContact CG1-CG2 3.87Å; V455-V459 WeakPolarHBondContact O-CB 3.41Å; V455-V459 VanDerWaalsContact O-CG2 3.3Å; V455-V459 WeakPolarHBondContact O-CG2 3.38Å; V455-V459 PolarHBondContact O-N 3.24Å
456	I	61	Low	58.3	Low	31 Å²	31	51.4 Å²	51.4	16%	0.159	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-42.7	177.9	-70.9	165.5	0	0	0	111.1	C452 F453 F458 V459 I460	C452-I456 WeakPolarHBondContact O-CB 3.48Å; C452-I456 WeakPolarHBondContact O-CD1 3.38Å; C452-I456 VanDerWaalsContact O-CG1 3.23Å; C452-I456 WeakPolarHBondContact O-CG1 3.46Å; C452-I456 PolarHBondContact O-N 2.91Å; F453-I456 PolarHBondContact O-N 2.92Å; I456-F458 PolarHBondContact O-N 3.37Å; I456-V459 PolarHBondContact O-N 3.46Å; I456-I460 HydrophobicContact CG2-CD1 3.56Å; I456-I460 HydrophobicContact CG2-CG1 4.17Å; I456-I460 PolarHBondContact O-N 2.86Å
457	H	59.3	Low	58.8	Low	22 Å²	22	48 Å²	48	10%	0.102	26%	0.257	C	S	.	.	H	α-helix	trans	-62	-27.8	175.8	-172.9	-52.7	0	0	0	113	F453 V455 P461 L599	F453-H457 VanDerWaalsContact O-CB 3.32Å; F453-H457 WeakPolarHBondContact O-CB 3.34Å; F453-H457 PolarHBondContact O-N 2.92Å; V455-H457 VanDerWaalsContact C-N 3.32Å; V455-H457 PolarHBondContact O-N 3.38Å; H457-P461 WeakPolarHBondContact O-CD 3.45Å; H457-P461 WeakPolarHBondContact O-CG 3.45Å; H457-L599 HydrophobicContact CB-CD1 4.19Å
458	F	62.4	Low	59	Low	70 Å²	70	46.9 Å²	46.9	31%	0.307	25%	0.251	S	S	.	.	H	α-helix	trans	-85.9	-43.8	174.3	179.1	-97.8	0	0	0	112.4	A454 V455 I456 C462 I531 L534 M535	A454-F458 PolarHBondContact O-N 3.47Å; V455-F458 PolarHBondContact O-N 2.92Å; I456-F458 PolarHBondContact O-N 3.37Å; F458-C462 WeakPolarHBondContact O-CB 3.49Å; F458-C462 PolarHBondContact O-N 3.1Å; F458-C462 PolarHBondContact O-SG 2.65Å; F458-I531 HydrophobicContact CE2-CG2 4.47Å; F458-L534 HydrophobicContact CD2-CB 4.03Å; F458-L534 HydrophobicContact CE2-CB 4.46Å; F458-M535 HydrophobicContact CE2-CB 4.47Å
459	V	64.5	Low	59.3	Low	60 Å²	60	43.5 Å²	43.5	36%	0.364	23%	0.234	S	C	.	.	H	α-helix	trans	-71.4	-45.7	-171.6	171.9	0	0	0	0	111.8	V455 I456 C462 C463	V455-V459 HydrophobicContact CG1-CG2 3.87Å; V455-V459 WeakPolarHBondContact O-CB 3.41Å; V455-V459 VanDerWaalsContact O-CG2 3.3Å; V455-V459 WeakPolarHBondContact O-CG2 3.38Å; V455-V459 PolarHBondContact O-N 3.24Å; I456-V459 PolarHBondContact O-N 3.46Å; V459-C462 PolarHBondContact O-N 2.88Å; V459-C463 WeakPolarHBondContact O-CB 3.41Å; V459-C463 PolarHBondContact O-N 2.92Å; V459-C463 PolarHBondContact O-SG 2.91Å; V459-C463 VanDerWaalsContact O-SG 3.34Å
460	I	62.1	Low	60	Low	49 Å²	49	46.1 Å²	46.1	25%	0.251	25%	0.25	S	S	.	.	H	α-helix	trans	-59.4	-53.4	-176.5	-66.6	177.9	0	0	0	111.7	L388 I456 C462 C463 T464 F603	L388-I460 HydrophobicContact CD1-CD1 3.87Å; L388-I460 HydrophobicContact CD1-CG1 3.86Å; L388-I460 HydrophobicContact CD2-CD1 4.29Å; L388-I460 HydrophobicContact CD2-CG1 4.34Å; I456-I460 HydrophobicContact CG2-CD1 3.56Å; I456-I460 HydrophobicContact CG2-CG1 4.17Å; I456-I460 PolarHBondContact O-N 2.86Å; I460-C462 VanDerWaalsContact C-N 3.33Å; I460-C462 PolarHBondContact O-N 3.31Å; I460-C463 PolarHBondContact O-N 2.76Å; I460-T464 PolarHBondContact O-N 2.92Å; I460-T464 PolarHBondContact O-OG1 3.06Å; I460-F603 HydrophobicContact CG2-CD2 4.38Å
461	P	59.4	Low	60.3	Low	15 Å²	15	45.4 Å²	45.4	10%	0.097	25%	0.248	C	C	.	.	H	α-helix	trans	-65.9	-31.9	-179.9	-22.1	35.5	0	0	0	113.6	H457 T464 M465 L534 L599	H457-P461 WeakPolarHBondContact O-CD 3.45Å; H457-P461 WeakPolarHBondContact O-CG 3.45Å; P461-T464 WeakPolarHBondContact CA-OG1 3.23Å; P461-T464 PolarHBondContact O-OG1 3.19Å; P461-T464 VanDerWaalsContact O-OG1 3.06Å; P461-M465 WeakPolarHBondContact O-CB 3.35Å; P461-M465 WeakPolarHBondContact O-CG 2.99Å; P461-M465 PolarHBondContact O-N 3.12Å; P461-M465 VanDerWaalsContact O-N 3.12Å; P461-L534 HydrophobicContact CB-CD1 3.93Å; P461-L534 HydrophobicContact CG-CD2 4.43Å; P461-L599 HydrophobicContact CG-CD2 4.13Å
462	C	61.1	Low	60.5	Low	15 Å²	15	42.8 Å²	42.8	10%	0.101	24%	0.24	C	C	.	.	H	α-helix	trans	-67.8	-44.4	174.7	-72.9	0	0	0	0	111.3	F458 V459 I460 M465 I466	F458-C462 WeakPolarHBondContact O-CB 3.49Å; F458-C462 PolarHBondContact O-N 3.1Å; F458-C462 PolarHBondContact O-SG 2.65Å; V459-C462 PolarHBondContact O-N 2.88Å; I460-C462 VanDerWaalsContact C-N 3.33Å; I460-C462 PolarHBondContact O-N 3.31Å; C462-M465 PolarHBondContact O-N 2.99Å; C462-I466 WeakPolarHBondContact O-CD1 3.32Å; C462-I466 VanDerWaalsContact O-CG1 3.28Å; C462-I466 WeakPolarHBondContact O-CG1 3.46Å; C462-I466 PolarHBondContact O-N 3.36Å
463	C	62.9	Low	60.9	Low	65 Å²	65	43.9 Å²	43.9	44%	0.439	24%	0.242	S	C	.	.	H	α-helix	trans	-64.1	-43.8	177.2	-72.9	0	0	0	0	112.3	V459 I460 M465 I466 V467	V459-C463 WeakPolarHBondContact O-CB 3.41Å; V459-C463 PolarHBondContact O-N 2.92Å; V459-C463 PolarHBondContact O-SG 2.91Å; V459-C463 VanDerWaalsContact O-SG 3.34Å; I460-C463 PolarHBondContact O-N 2.76Å; C463-M465 PolarHBondContact O-N 3.42Å; C463-I466 PolarHBondContact O-N 2.83Å; C463-V467 VanDerWaalsContact O-CG2 3.32Å; C463-V467 WeakPolarHBondContact O-CG2 3.47Å; C463-V467 PolarHBondContact O-N 3.4Å
464	T	58.8	Low	61.2	Low	29 Å²	29	47.5 Å²	47.5	18%	0.178	26%	0.262	C	S	.	.	H	α-helix	trans	-63.2	-42.7	177	54	0	0	0	0	111.8	I460 P461 V467 T468 F603 Q606	I460-T464 PolarHBondContact O-N 2.92Å; I460-T464 PolarHBondContact O-OG1 3.06Å; P461-T464 WeakPolarHBondContact CA-OG1 3.23Å; P461-T464 PolarHBondContact O-OG1 3.19Å; P461-T464 VanDerWaalsContact O-OG1 3.06Å; T464-V467 PolarHBondContact O-N 3.27Å; T464-T468 WeakPolarHBondContact O-CG2 3.49Å; T464-T468 PolarHBondContact O-N 2.89Å; T464-F603 HydrophobicContact CG2-CD2 3.87Å; T464-F603 HydrophobicContact CG2-CE2 3.84Å; T464-Q606 PolarHBondContact OG1-OE1 3.44Å
465	M	61	Low	61.3	Low	30 Å²	30	50.2 Å²	50.2	15%	0.148	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-41.4	176.5	-69.2	-75.6	-157.9	0	0	112.6	P461 C462 C463 V467 T468 V469 Q526 L527 T530	P461-M465 WeakPolarHBondContact O-CB 3.35Å; P461-M465 WeakPolarHBondContact O-CG 2.99Å; P461-M465 PolarHBondContact O-N 3.12Å; P461-M465 VanDerWaalsContact O-N 3.12Å; C462-M465 PolarHBondContact O-N 2.99Å; C463-M465 PolarHBondContact O-N 3.42Å; M465-V467 VanDerWaalsContact C-N 3.33Å; M465-V467 PolarHBondContact O-N 3.05Å; M465-T468 PolarHBondContact O-N 3.05Å; M465-T468 PolarHBondContact O-OG1 2.88Å; M465-V469 WeakPolarHBondContact O-CG2 3.45Å; M465-V469 PolarHBondContact O-N 3.32Å; M465-Q526 HydrophobicContact CE-CG 4.4Å; M465-L527 HydrophobicContact CB-CD1 3.58Å; M465-L527 HydrophobicContact CG-CD1 4.24Å; M465-T530 HydrophobicContact CE-CG2 4.37Å
466	I	64	Low	61.3	Low	91 Å²	91	47.9 Å²	47.9	47%	0.467	26%	0.255	S	S	.	.	H	α-helix	trans	-61.9	-42.6	174.6	-69.5	164.3	0	0	0	110.6	C462 C463 V469 L470	C462-I466 WeakPolarHBondContact O-CD1 3.32Å; C462-I466 VanDerWaalsContact O-CG1 3.28Å; C462-I466 WeakPolarHBondContact O-CG1 3.46Å; C462-I466 PolarHBondContact O-N 3.36Å; C463-I466 PolarHBondContact O-N 2.83Å; I466-V469 PolarHBondContact O-N 3.38Å; I466-L470 HydrophobicContact CG2-CD1 3.92Å; I466-L470 HydrophobicContact CG2-CG 4.42Å; I466-L470 WeakPolarHBondContact O-CB 3.2Å; I466-L470 WeakPolarHBondContact O-CG 3.43Å; I466-L470 PolarHBondContact O-N 3.34Å
467	V	60.5	Low	61.6	Low	48 Å²	48	50.3 Å²	50.3	29%	0.291	27%	0.268	S	S	.	.	H	α-helix	trans	-63.6	-40.7	176.6	170.2	0	0	0	0	111.8	C463 T464 M465 L470 L471	C463-V467 VanDerWaalsContact O-CG2 3.32Å; C463-V467 WeakPolarHBondContact O-CG2 3.47Å; C463-V467 PolarHBondContact O-N 3.4Å; T464-V467 PolarHBondContact O-N 3.27Å; M465-V467 VanDerWaalsContact C-N 3.33Å; M465-V467 PolarHBondContact O-N 3.05Å; V467-L470 PolarHBondContact O-N 2.97Å; V467-L471 HydrophobicContact CG1-CD1 3.8Å; V467-L471 HydrophobicContact CG1-CG 4.31Å; V467-L471 WeakPolarHBondContact O-CB 3.48Å; V467-L471 VanDerWaalsContact O-CG 3.27Å; V467-L471 WeakPolarHBondContact O-CG 3.13Å; V467-L471 PolarHBondContact O-N 3.19Å
468	T	58.1	Low	61.7	Low	35 Å²	35	52.5 Å²	52.5	22%	0.215	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-40.1	176.9	61.3	0	0	0	0	112.2	T464 M465 L471 L472 L610	T464-T468 WeakPolarHBondContact O-CG2 3.49Å; T464-T468 PolarHBondContact O-N 2.89Å; M465-T468 PolarHBondContact O-N 3.05Å; M465-T468 PolarHBondContact O-OG1 2.88Å; T468-L471 PolarHBondContact O-N 3.3Å; T468-L472 WeakPolarHBondContact O-CG 3.49Å; T468-L472 PolarHBondContact O-N 3.27Å; T468-L610 HydrophobicContact CG2-CD1 4.37Å; T468-L610 HydrophobicContact CG2-CD2 4.49Å
469	V	59.2	Low	61.6	Low	25 Å²	25	51 Å²	51	15%	0.152	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-45.1	174	172.2	0	0	0	0	111.3	M465 I466 L471 L472 I473 L520	M465-V469 WeakPolarHBondContact O-CG2 3.45Å; M465-V469 PolarHBondContact O-N 3.32Å; I466-V469 PolarHBondContact O-N 3.38Å; V469-L471 PolarHBondContact O-N 3.2Å; V469-L472 WeakPolarHBondContact O-CB 3.38Å; V469-L472 PolarHBondContact O-N 3.05Å; V469-I473 HydrophobicContact CG1-CD1 4.02Å; V469-I473 WeakPolarHBondContact O-CG1 3.24Å; V469-I473 PolarHBondContact O-N 3.22Å; V469-L520 HydrophobicContact CG1-CD1 4.04Å
470	L	63.8	Low	61.3	Low	91 Å²	91	55.2 Å²	55.2	48%	0.476	29%	0.285	S	S	.	.	H	α-helix	trans	-62.6	-40.7	175.9	-72.9	171.2	0	0	0	112.3	I466 V467 I473 I474	I466-L470 HydrophobicContact CG2-CD1 3.92Å; I466-L470 HydrophobicContact CG2-CG 4.42Å; I466-L470 WeakPolarHBondContact O-CB 3.2Å; I466-L470 WeakPolarHBondContact O-CG 3.43Å; I466-L470 PolarHBondContact O-N 3.34Å; V467-L470 PolarHBondContact O-N 2.97Å; L470-I473 PolarHBondContact O-N 2.95Å; L470-I474 VanDerWaalsContact O-CG1 3.3Å; L470-I474 WeakPolarHBondContact O-CG1 3.32Å; L470-I474 PolarHBondContact O-N 3.49Å
471	L	60.6	Low	61.4	Low	24 Å²	24	60.6 Å²	60.6	13%	0.126	30%	0.304	C	S	.	.	H	α-helix	trans	-66.7	-35	176	-71.9	171	0	0	0	112.4	L377 V467 T468 V469 I474 R475 L610	L377-L471 HydrophobicContact CD1-CD2 4.11Å; L377-L471 HydrophobicContact CD2-CD1 4.24Å; L377-L471 HydrophobicContact CD2-CD2 3.93Å; V467-L471 HydrophobicContact CG1-CD1 3.8Å; V467-L471 HydrophobicContact CG1-CG 4.31Å; V467-L471 WeakPolarHBondContact O-CB 3.48Å; V467-L471 VanDerWaalsContact O-CG 3.27Å; V467-L471 WeakPolarHBondContact O-CG 3.13Å; V467-L471 PolarHBondContact O-N 3.19Å; T468-L471 PolarHBondContact O-N 3.3Å; V469-L471 PolarHBondContact O-N 3.2Å; L471-I474 PolarHBondContact O-N 3.49Å; L471-R475 VanDerWaalsContact O-CB 3.24Å; L471-R475 WeakPolarHBondContact O-CB 3.15Å; L471-R475 PolarHBondContact O-N 2.92Å; L471-L610 HydrophobicContact CD1-CD1 3.82Å; L471-L610 HydrophobicContact CD1-CD2 3.96Å; L471-L610 HydrophobicContact CD1-CG 4.46Å
472	L	59.5	Low	61.5	Low	42 Å²	42	63 Å²	63	22%	0.22	31%	0.314	C	S	.	.	H	α-helix	trans	-64.3	-41.4	170.9	-74.1	169.5	0	0	0	111.9	T468 V469 R475 L476 I519 L520	T468-L472 WeakPolarHBondContact O-CG 3.49Å; T468-L472 PolarHBondContact O-N 3.27Å; V469-L472 WeakPolarHBondContact O-CB 3.38Å; V469-L472 PolarHBondContact O-N 3.05Å; L472-R475 PolarHBondContact O-N 3.48Å; L472-L476 WeakPolarHBondContact O-CB 3.39Å; L472-L476 PolarHBondContact O-N 2.79Å; L472-I519 HydrophobicContact CD1-CG2 4.25Å; L472-I519 HydrophobicContact CD2-CG2 4.13Å; L472-L520 HydrophobicContact CB-CD1 4.29Å
473	I	63.8	Low	61.1	Low	65 Å²	65	64.5 Å²	64.5	33%	0.333	32%	0.32	S	S	.	.	H	α-helix	trans	-64.8	-45.2	175.3	-66.7	164.2	0	0	0	111	V469 L470 R475 L476 I477 L520	V469-I473 HydrophobicContact CG1-CD1 4.02Å; V469-I473 WeakPolarHBondContact O-CG1 3.24Å; V469-I473 PolarHBondContact O-N 3.22Å; L470-I473 PolarHBondContact O-N 2.95Å; I473-R475 VanDerWaalsContact C-N 3.3Å; I473-R475 PolarHBondContact O-N 3.48Å; I473-L476 WeakPolarHBondContact O-CB 3.27Å; I473-L476 PolarHBondContact O-N 2.92Å; I473-I477 HydrophobicContact CG2-CD1 3.9Å; I473-I477 VanDerWaalsContact O-CG1 3.28Å; I473-I477 WeakPolarHBondContact O-CG1 3.43Å; I473-I477 PolarHBondContact O-N 2.88Å; I473-L520 HydrophobicContact CG1-CD1 4.1Å
474	I	65.5	Low	60.9	Low	99 Å²	99	68.7 Å²	68.7	51%	0.508	33%	0.331	S	S	.	.	H	α-helix	trans	-62.4	-38.6	175.9	-68.3	164.6	0	0	0	110.7	L470 L471 I477 K478	L470-I474 VanDerWaalsContact O-CG1 3.3Å; L470-I474 WeakPolarHBondContact O-CG1 3.32Å; L470-I474 PolarHBondContact O-N 3.49Å; L471-I474 PolarHBondContact O-N 3.49Å; I474-I477 PolarHBondContact O-N 3.42Å; I474-K478 WeakPolarHBondContact O-CB 3.43Å; I474-K478 PolarHBondContact O-N 3Å
475	R	59.8	Low	60.9	Low	62 Å²	62	70.9 Å²	70.9	23%	0.234	35%	0.348	C	S	.	.	H	α-helix	trans	-65.4	-44.2	175.5	-174.7	-177.8	-172.4	179.9	6.5	112.3	L471 L472 I473 I477 K478 I479 N613 T617	L471-R475 VanDerWaalsContact O-CB 3.24Å; L471-R475 WeakPolarHBondContact O-CB 3.15Å; L471-R475 PolarHBondContact O-N 2.92Å; L472-R475 PolarHBondContact O-N 3.48Å; I473-R475 VanDerWaalsContact C-N 3.3Å; I473-R475 PolarHBondContact O-N 3.48Å; R475-I477 VanDerWaalsContact C-N 3.31Å; R475-I477 PolarHBondContact O-N 2.98Å; R475-K478 PolarHBondContact O-N 3.06Å; R475-I479 HydrophobicContact CG-CD1 4.02Å; R475-I479 WeakPolarHBondContact O-CB 3.34Å; R475-I479 VanDerWaalsContact O-CG1 3.28Å; R475-I479 WeakPolarHBondContact O-CG1 3.29Å; R475-I479 PolarHBondContact O-N 3.43Å; R475-N613 PolarHBondContact NH1-O 3.38Å; R475-N613 PolarHBondContact NH2-O 2.85Å; R475-T617 PolarHBondContact NH2-OG1 3.31Å
476	L	60.8	Low	60.6	Low	37 Å²	37	71.6 Å²	71.6	19%	0.194	35%	0.352	C	S	.	.	H	α-helix	trans	-54.1	-47.7	171.8	-92.8	160.9	0	0	0	111.4	L472 I473 K480 S516 L520	L472-L476 WeakPolarHBondContact O-CB 3.39Å; L472-L476 PolarHBondContact O-N 2.79Å; I473-L476 WeakPolarHBondContact O-CB 3.27Å; I473-L476 PolarHBondContact O-N 2.92Å; L476-K480 PolarHBondContact O-N 3.43Å; L476-K480 VanDerWaalsContact O-N 3.11Å; L476-S516 WeakPolarHBondContact CD2-OG 3.36Å; L476-L520 HydrophobicContact CD1-CD2 4.32Å
477	I	66.1	Low	60.1	Low	82 Å²	82	69.8 Å²	69.8	42%	0.421	34%	0.342	S	S	.	.	H	α-helix	trans	-64.6	-45.9	177.6	-68.3	167	0	0	0	110.9	I473 I474 R475 I479 K480 Y481	I473-I477 HydrophobicContact CG2-CD1 3.9Å; I473-I477 VanDerWaalsContact O-CG1 3.28Å; I473-I477 WeakPolarHBondContact O-CG1 3.43Å; I473-I477 PolarHBondContact O-N 2.88Å; I474-I477 PolarHBondContact O-N 3.42Å; R475-I477 VanDerWaalsContact C-N 3.31Å; R475-I477 PolarHBondContact O-N 2.98Å; I477-I479 PolarHBondContact O-N 2.81Å; I477-K480 WeakPolarHBondContact O-CB 3.4Å; I477-K480 PolarHBondContact O-N 3.31Å; I477-Y481 HydrophobicContact CG2-CD2 3.65Å; I477-Y481 HydrophobicContact CG2-CE2 3.39Å; I477-Y481 WeakPolarHBondContact O-CD2 3.27Å; I477-Y481 PolarHBondContact O-N 2.92Å
478	K	63.1	Low	59.8	Low	68 Å²	68	73.5 Å²	73.5	30%	0.296	36%	0.36	S	S	.	.	H	α-helix	trans	-58.3	-48.8	177.3	-178.7	-177.6	171.6	-178.6	0	111.7	I474 R475 K480 Y481 E482 N618	I474-K478 WeakPolarHBondContact O-CB 3.43Å; I474-K478 PolarHBondContact O-N 3Å; R475-K478 PolarHBondContact O-N 3.06Å; K478-K480 VanDerWaalsContact C-N 3.31Å; K478-K480 PolarHBondContact O-N 2.92Å; K478-Y481 PolarHBondContact O-N 3.49Å; K478-Y481 VanDerWaalsContact O-N 3.12Å; K478-E482 WeakPolarHBondContact CE-OE1 3.35Å; K478-E482 WeakPolarHBondContact CE-OE2 3.47Å; K478-E482 HydrophobicContact CG-CG 4.37Å; K478-E482 IonicContact NZ-OE1 3.06Å; K478-E482 PolarHBondContact NZ-OE1 2.9Å; K478-E482 PolarHBondContact O-N 3.16Å; K478-N618 PolarHBondContact NZ-OD1 3.48Å
479	I	59.7	Low	59.6	Low	38 Å²	38	77.9 Å²	77.9	20%	0.195	38%	0.377	C	S	.	.	H	α-helix	trans	-55.4	-48.8	176.7	-72.7	163.8	0	0	0	109.8	R475 I477 Y481 E482 L483 L512	R475-I479 HydrophobicContact CG-CD1 4.02Å; R475-I479 WeakPolarHBondContact O-CB 3.34Å; R475-I479 VanDerWaalsContact O-CG1 3.28Å; R475-I479 WeakPolarHBondContact O-CG1 3.29Å; R475-I479 PolarHBondContact O-N 3.43Å; I477-I479 PolarHBondContact O-N 2.81Å; I479-Y481 VanDerWaalsContact C-N 3.29Å; I479-Y481 PolarHBondContact O-N 3.31Å; I479-E482 PolarHBondContact O-N 2.79Å; I479-L483 WeakPolarHBondContact O-CB 3.24Å; I479-L483 PolarHBondContact O-N 2.95Å; I479-L512 HydrophobicContact CD1-CD2 4.18Å; I479-L512 HydrophobicContact CG2-CD2 3.52Å
480	K	58.8	Low	59.2	Low	149 Å²	149	78.6 Å²	78.6	65%	0.648	38%	0.38	S	S	*	.	H	α-helix	trans	-57.5	-38.2	178.1	-174.1	179.1	179.6	179	0	112.8	L476 I477 K478 K484	L476-K480 PolarHBondContact O-N 3.43Å; L476-K480 VanDerWaalsContact O-N 3.11Å; I477-K480 WeakPolarHBondContact O-CB 3.4Å; I477-K480 PolarHBondContact O-N 3.31Å; K478-K480 VanDerWaalsContact C-N 3.31Å; K478-K480 PolarHBondContact O-N 2.92Å; K480-K484 WeakPolarHBondContact O-CB 3.42Å; K480-K484 PolarHBondContact O-N 2.94Å; K480-K484 VanDerWaalsContact O-N 3.12Å
481	Y	64.1	Low	58.6	Low	163 Å²	163	79.8 Å²	79.8	64%	0.639	39%	0.386	S	S	*	.	H	α-helix	trans	-76.1	-48.2	178.4	-76.8	-62.8	0	0	0	113.8	I477 K478 I479 L483 K484 S485	I477-Y481 HydrophobicContact CG2-CD2 3.65Å; I477-Y481 HydrophobicContact CG2-CE2 3.39Å; I477-Y481 WeakPolarHBondContact O-CD2 3.27Å; I477-Y481 PolarHBondContact O-N 2.92Å; K478-Y481 PolarHBondContact O-N 3.49Å; K478-Y481 VanDerWaalsContact O-N 3.12Å; I479-Y481 VanDerWaalsContact C-N 3.29Å; I479-Y481 PolarHBondContact O-N 3.31Å; Y481-L483 VanDerWaalsContact C-N 3.28Å; Y481-L483 PolarHBondContact O-N 3.45Å; Y481-K484 PolarHBondContact O-N 2.98Å; Y481-S485 PolarHBondContact O-N 3.26Å
482	E	60.5	Low	58	Low	66 Å²	66	86.1 Å²	86.1	31%	0.308	42%	0.42	S	S	.	.	H	α-helix	trans	-61.7	-40.3	178.2	-72.1	-175.4	161.4	0	0	111	K478 I479 S485 I486	K478-E482 WeakPolarHBondContact CE-OE1 3.35Å; K478-E482 WeakPolarHBondContact CE-OE2 3.47Å; K478-E482 HydrophobicContact CG-CG 4.37Å; K478-E482 IonicContact NZ-OE1 3.06Å; K478-E482 PolarHBondContact NZ-OE1 2.9Å; K478-E482 PolarHBondContact O-N 3.16Å; I479-E482 PolarHBondContact O-N 2.79Å; E482-S485 VanDerWaalsContact O-CB 3.3Å; E482-S485 WeakPolarHBondContact O-CB 3.21Å; E482-S485 PolarHBondContact O-N 3.06Å; E482-I486 WeakPolarHBondContact O-CG1 3.29Å; E482-I486 PolarHBondContact O-N 3.17Å
483	L	52.3	Low	57.4	Low	45 Å²	45	89.7 Å²	89.7	24%	0.236	44%	0.437	C	S	.	.	H	α-helix	trans	-62.8	-44.5	174	-177.2	79.1	0	0	0	113	I479 Y481 S485 I486 I487 I509	I479-L483 WeakPolarHBondContact O-CB 3.24Å; I479-L483 PolarHBondContact O-N 2.95Å; Y481-L483 VanDerWaalsContact C-N 3.28Å; Y481-L483 PolarHBondContact O-N 3.45Å; L483-S485 PolarHBondContact O-N 3.29Å; L483-I486 PolarHBondContact O-N 3.46Å; L483-I487 HydrophobicContact CG-CD1 4.1Å; L483-I487 VanDerWaalsContact O-CG1 3.31Å; L483-I487 WeakPolarHBondContact O-CG1 3.36Å; L483-I487 PolarHBondContact O-N 3.44Å; L483-I509 HydrophobicContact CD1-CD1 3.75Å; L483-I509 HydrophobicContact CD1-CG1 3.59Å; L483-I509 HydrophobicContact CD2-CB 4.18Å; L483-I509 HydrophobicContact CD2-CD1 3.6Å; L483-I509 HydrophobicContact CD2-CG1 3.47Å; L483-I509 VanDerWaalsContact CD2-CG1 3.47Å; L483-I509 HydrophobicContact CD2-CG2 3.62Å; L483-I509 HydrophobicContact CG-CD1 3.87Å; L483-I509 HydrophobicContact CG-CG1 3.98Å
484	K	59.5	Low	56.5	Low	153 Å²	153	92.9 Å²	92.9	67%	0.665	46%	0.455	S	S	*	.	H	α-helix	trans	-59.6	-35.3	174.6	-175.8	176	179.2	-178	0	111.2	K480 Y481 L488	K480-K484 WeakPolarHBondContact O-CB 3.42Å; K480-K484 PolarHBondContact O-N 2.94Å; K480-K484 VanDerWaalsContact O-N 3.12Å; Y481-K484 PolarHBondContact O-N 2.98Å; K484-L488 WeakPolarHBondContact O-CB 3.18Å; K484-L488 PolarHBondContact O-N 3.34Å; K484-L488 VanDerWaalsContact O-N 3.15Å
485	S	57.6	Low	55.9	Low	76 Å²	76	97.2 Å²	97.2	53%	0.531	47%	0.47	S	S	.	.	H	α-helix	trans	-67.6	-46.5	174	-170.3	0	0	0	0	112.5	Y481 E482 L483 I487 L488 H489	Y481-S485 PolarHBondContact O-N 3.26Å; E482-S485 VanDerWaalsContact O-CB 3.3Å; E482-S485 WeakPolarHBondContact O-CB 3.21Å; E482-S485 PolarHBondContact O-N 3.06Å; L483-S485 PolarHBondContact O-N 3.29Å; S485-I487 VanDerWaalsContact C-N 3.33Å; S485-I487 PolarHBondContact O-N 3.07Å; S485-L488 PolarHBondContact O-N 3.31Å; S485-L488 VanDerWaalsContact O-N 3.16Å; S485-H489 WeakPolarHBondContact O-CB 3.36Å; S485-H489 PolarHBondContact O-N 3.38Å
486	I	55.6	Low	55.4	Low	45 Å²	45	103.4 Å²	103.4	23%	0.231	50%	0.499	C	S	.	.	H	α-helix	trans	-63.3	-38	178.2	-67.3	163.4	0	0	0	111.9	E482 L483 H489 N490 L621 Y625	E482-I486 WeakPolarHBondContact O-CG1 3.29Å; E482-I486 PolarHBondContact O-N 3.17Å; L483-I486 PolarHBondContact O-N 3.46Å; I486-H489 PolarHBondContact O-N 2.83Å; I486-N490 PolarHBondContact O-N 2.86Å; I486-N490 PolarHBondContact O-ND2 3.36Å; I486-L621 HydrophobicContact CD1-CD2 4.21Å; I486-Y625 HydrophobicContact CG1-CE2 4.26Å
487	I	53.7	Low	54.7	Low	52 Å²	52	107.2 Å²	107.2	27%	0.267	52%	0.519	S	S	.	.	H	α-helix	trans	-63.9	-43.7	174.3	-69.6	165.6	0	0	0	110.5	L483 S485 H489 M502 I505 I509	L483-I487 HydrophobicContact CG-CD1 4.1Å; L483-I487 VanDerWaalsContact O-CG1 3.31Å; L483-I487 WeakPolarHBondContact O-CG1 3.36Å; L483-I487 PolarHBondContact O-N 3.44Å; S485-I487 VanDerWaalsContact C-N 3.33Å; S485-I487 PolarHBondContact O-N 3.07Å; I487-H489 VanDerWaalsContact C-N 3.33Å; I487-H489 PolarHBondContact O-N 2.77Å; I487-M502 HydrophobicContact CG2-CE 3.96Å; I487-M502 HydrophobicContact CG2-SD 4.45Å; I487-I505 HydrophobicContact CG1-CG2 4.42Å; I487-I509 HydrophobicContact CD1-CD1 3.9Å
488	L	53	Low	53.9	Low	127 Å²	127	105.8 Å²	105.8	67%	0.665	51%	0.512	S	S	*	.	H	α-helix	trans	-65.8	-35.7	179.1	-155.3	76.7	0	0	0	112.2	K484 S485 I491	K484-L488 WeakPolarHBondContact O-CB 3.18Å; K484-L488 PolarHBondContact O-N 3.34Å; K484-L488 VanDerWaalsContact O-N 3.15Å; S485-L488 PolarHBondContact O-N 3.31Å; S485-L488 VanDerWaalsContact O-N 3.16Å; L488-I491 HydrophobicContact CD1-CD1 4.25Å; L488-I491 WeakPolarHBondContact O-CD1 3.44Å; L488-I491 WeakPolarHBondContact O-CG1 3.36Å
489	H	54	Low	53.5	Low	126 Å²	126	110 Å²	110	58%	0.583	53%	0.53	S	S	*	.	H	α-helix	trans	-77.4	-22.8	-176.8	-158.5	-48.1	0	0	0	113.9	S485 I486 I487	S485-H489 WeakPolarHBondContact O-CB 3.36Å; S485-H489 PolarHBondContact O-N 3.38Å; I486-H489 PolarHBondContact O-N 2.83Å; I487-H489 VanDerWaalsContact C-N 3.33Å; I487-H489 PolarHBondContact O-N 2.77Å
490	N	51.8	Low	53	Low	40 Å²	40	114 Å²	114	21%	0.214	55%	0.551	C	S	.	*	T	Hydrogen-bonded Turn	trans	-90.1	7.4	-178.1	-86.3	-59.7	0	0	0	114.8	I486 N492	I486-N490 PolarHBondContact O-N 2.86Å; I486-N490 PolarHBondContact O-ND2 3.36Å; N490-N492 PolarHBondContact O-N 2.9Å; N490-N492 VanDerWaalsContact O-N 3.12Å
491	I	50.6	Low	52.4	Low	117 Å²	117	110.9 Å²	110.9	60%	0.6	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.2	-177.9	-65.9	175.2	0	0	0	112.8	L488 M493	L488-I491 HydrophobicContact CD1-CD1 4.25Å; L488-I491 WeakPolarHBondContact O-CD1 3.44Å; L488-I491 WeakPolarHBondContact O-CG1 3.36Å; I491-M493 PolarHBondContact O-N 3.46Å
492	N	49.2	Very low	51.8	Low	156 Å²	156	105.8 Å²	105.8	83%	0.834	52%	0.519	S	S	*	.	S	Bend	trans	-94.3	38.3	-171.2	-149.4	21.1	0	0	0	114.9	N490	N490-N492 PolarHBondContact O-N 2.9Å; N490-N492 VanDerWaalsContact O-N 3.12Å
493	M	46.9	Very low	51.5	Low	117 Å²	117	106.1 Å²	106.1	58%	0.576	52%	0.523	S	S	*	.	S	Bend	trans	-123.5	176	-179.3	-70.3	-72.6	167.2	0	0	111.6	I491 I498	I491-M493 PolarHBondContact O-N 3.46Å; M493-I498 HydrophobicContact CB-CD1 4.36Å; M493-I498 HydrophobicContact CB-CG1 4.36Å; M493-I498 WeakPolarHBondContact O-CD1 3.45Å
494	N	44.6	Very low	51.4	Low	132 Å²	132	107.2 Å²	107.2	71%	0.706	53%	0.528	S	S	*	.			trans	-69.1	136.7	-170.5	-97	-23.9	0	0	0	114.7	K496 D497 I498	N494-K496 VanDerWaalsContact C-N 3.33Å; N494-K496 PolarHBondContact O-N 3.06Å; N494-K496 VanDerWaalsContact O-N 3.12Å; N494-D497 PolarHBondContact O-N 2.79Å; N494-I498 WeakPolarHBondContact O-CG1 3.28Å; N494-I498 PolarHBondContact O-N 2.91Å
495	K	52.1	Low	51	Low	191 Å²	191	101.5 Å²	101.5	83%	0.83	50%	0.504	S	S	*	.	H	α-helix	trans	-56.7	-30.4	-167.7	-76.5	-178.5	174.8	177.1	0	116.6
496	K	48.9	Very low	50.8	Low	192 Å²	192	102.1 Å²	102.1	84%	0.835	50%	0.499	S	S	*	.	H	α-helix	trans	-81.4	-43.9	-175.9	-73.7	-177.2	177.2	176.8	0	112.1	N494 K499	N494-K496 VanDerWaalsContact C-N 3.33Å; N494-K496 PolarHBondContact O-N 3.06Å; N494-K496 VanDerWaalsContact O-N 3.12Å; K496-K499 PolarHBondContact O-N 3.41Å
497	D	47.7	Very low	50.7	Low	116 Å²	116	101.4 Å²	101.4	62%	0.62	49%	0.494	S	S	*	.	H	α-helix	trans	-74.3	-29.6	-178.8	-54.3	-47.6	0	0	0	112.2	N494 K499 L500 Y501	N494-D497 PolarHBondContact O-N 2.79Å; D497-K499 VanDerWaalsContact C-N 3.25Å; D497-K499 PolarHBondContact O-N 2.82Å; D497-L500 PolarHBondContact O-N 3.46Å; D497-Y501 VanDerWaalsContact O-CB 3.23Å; D497-Y501 WeakPolarHBondContact O-CB 3.19Å; D497-Y501 PolarHBondContact O-N 3.22Å
498	I	49.5	Very low	50.6	Low	52 Å²	52	102.5 Å²	102.5	27%	0.267	51%	0.505	S	S	.	.	H	α-helix	trans	-50.5	-43.7	173.6	-78	174.9	0	0	0	111.7	M493 N494 L500 Y501 M502	M493-I498 HydrophobicContact CB-CD1 4.36Å; M493-I498 HydrophobicContact CB-CG1 4.36Å; M493-I498 WeakPolarHBondContact O-CD1 3.45Å; N494-I498 WeakPolarHBondContact O-CG1 3.28Å; N494-I498 PolarHBondContact O-N 2.91Å; I498-L500 PolarHBondContact O-N 3.45Å; I498-Y501 PolarHBondContact O-N 2.92Å; I498-M502 HydrophobicContact CG2-CG 3.83Å; I498-M502 WeakPolarHBondContact O-CB 3.26Å; I498-M502 WeakPolarHBondContact O-CG 3.42Å; I498-M502 PolarHBondContact O-N 3.43Å
499	K	52.6	Low	50.6	Low	157 Å²	157	97.7 Å²	97.7	68%	0.683	48%	0.479	S	S	*	.	H	α-helix	trans	-70.9	-35.9	-173.4	-160.9	171.7	-175	177.2	0	112.4	K496 D497 N503	K496-K499 PolarHBondContact O-N 3.41Å; D497-K499 VanDerWaalsContact C-N 3.25Å; D497-K499 PolarHBondContact O-N 2.82Å; K499-N503 WeakPolarHBondContact O-CB 3.3Å; K499-N503 PolarHBondContact O-N 2.94Å; K499-N503 PolarHBondContact O-OD1 3.04Å
500	L	49.8	Very low	50.8	Low	121 Å²	121	95.6 Å²	95.6	63%	0.634	47%	0.472	S	S	*	.	H	α-helix	trans	-72	-46	174.1	-159.7	90.2	0	0	0	110.8	D497 I498 N503 I504	D497-L500 PolarHBondContact O-N 3.46Å; I498-L500 PolarHBondContact O-N 3.45Å; L500-N503 PolarHBondContact O-N 2.8Å; L500-I504 HydrophobicContact CD2-CD1 4.06Å; L500-I504 HydrophobicContact CG-CD1 4.1Å; L500-I504 VanDerWaalsContact O-CG1 3.32Å; L500-I504 WeakPolarHBondContact O-CG1 3.32Å; L500-I504 PolarHBondContact O-N 2.83Å
501	Y	47	Very low	51.1	Low	85 Å²	85	97.2 Å²	97.2	33%	0.333	48%	0.475	S	S	.	.	H	α-helix	trans	-64.1	-41.4	-179.3	-171.4	-110	0	0	0	112.4	D497 I498 I504 I505	D497-Y501 VanDerWaalsContact O-CB 3.23Å; D497-Y501 WeakPolarHBondContact O-CB 3.19Å; D497-Y501 PolarHBondContact O-N 3.22Å; I498-Y501 PolarHBondContact O-N 2.92Å; Y501-I504 PolarHBondContact O-N 3.48Å; Y501-I505 HydrophobicContact CD1-CD1 3.68Å; Y501-I505 HydrophobicContact CE1-CD1 3.26Å; Y501-I505 HydrophobicContact CE1-CG1 4.39Å; Y501-I505 HydrophobicContact CE2-CD1 4.34Å; Y501-I505 HydrophobicContact CG-CD1 4.36Å; Y501-I505 WeakPolarHBondContact O-CB 3.38Å; Y501-I505 WeakPolarHBondContact O-CG1 3.12Å; Y501-I505 PolarHBondContact O-N 3.31Å
502	M	50.9	Low	51.2	Low	56 Å²	56	95.9 Å²	95.9	28%	0.276	47%	0.469	S	S	.	.	H	α-helix	trans	-66.7	-37.1	174.3	-71.8	-74.6	-79.4	0	0	112.1	I487 I498 I505 Q506	I487-M502 HydrophobicContact CG2-CE 3.96Å; I487-M502 HydrophobicContact CG2-SD 4.45Å; I498-M502 HydrophobicContact CG2-CG 3.83Å; I498-M502 WeakPolarHBondContact O-CB 3.26Å; I498-M502 WeakPolarHBondContact O-CG 3.42Å; I498-M502 PolarHBondContact O-N 3.43Å; M502-I505 PolarHBondContact O-N 2.91Å; M502-Q506 VanDerWaalsContact O-CB 3.29Å; M502-Q506 WeakPolarHBondContact O-CB 3.39Å; M502-Q506 VanDerWaalsContact O-CG 3.25Å; M502-Q506 WeakPolarHBondContact O-CG 3.38Å; M502-Q506 PolarHBondContact O-N 3.04Å
503	N	53.4	Low	51.6	Low	73 Å²	73	92 Å²	92	39%	0.39	45%	0.447	S	S	.	.	H	α-helix	trans	-67.6	-40.6	174.1	-75	6.2	0	0	0	111.8	K499 L500 Q506 Y507	K499-N503 WeakPolarHBondContact O-CB 3.3Å; K499-N503 PolarHBondContact O-N 2.94Å; K499-N503 PolarHBondContact O-OD1 3.04Å; L500-N503 PolarHBondContact O-N 2.8Å; N503-Q506 PolarHBondContact O-N 3.1Å; N503-Y507 VanDerWaalsContact O-CB 3.29Å; N503-Y507 WeakPolarHBondContact O-CB 3.45Å; N503-Y507 PolarHBondContact O-N 3.47Å
504	I	52.1	Low	52	Low	68 Å²	68	90.3 Å²	90.3	35%	0.349	44%	0.438	S	S	.	.	H	α-helix	trans	-65.5	-43.2	175	-68.4	163.9	0	0	0	110.5	L500 Y501 Y507 C508	L500-I504 HydrophobicContact CD2-CD1 4.06Å; L500-I504 HydrophobicContact CG-CD1 4.1Å; L500-I504 VanDerWaalsContact O-CG1 3.32Å; L500-I504 WeakPolarHBondContact O-CG1 3.32Å; L500-I504 PolarHBondContact O-N 2.83Å; Y501-I504 PolarHBondContact O-N 3.48Å; I504-Y507 WeakPolarHBondContact O-CB 3.5Å; I504-Y507 PolarHBondContact O-N 3.47Å; I504-C508 WeakPolarHBondContact O-CB 3.39Å; I504-C508 PolarHBondContact O-N 2.87Å; I504-C508 PolarHBondContact O-SG 2.96Å; I504-C508 VanDerWaalsContact O-SG 3.37Å
505	I	51.1	Low	52.3	Low	33 Å²	33	86.5 Å²	86.5	17%	0.169	42%	0.418	C	S	.	.	H	α-helix	trans	-61.5	-49.9	174.1	-79	177.8	0	0	0	110.4	I487 Y501 M502 Y507 C508 I509	I487-I505 HydrophobicContact CG1-CG2 4.42Å; Y501-I505 HydrophobicContact CD1-CD1 3.68Å; Y501-I505 HydrophobicContact CE1-CD1 3.26Å; Y501-I505 HydrophobicContact CE1-CG1 4.39Å; Y501-I505 HydrophobicContact CE2-CD1 4.34Å; Y501-I505 HydrophobicContact CG-CD1 4.36Å; Y501-I505 WeakPolarHBondContact O-CB 3.38Å; Y501-I505 WeakPolarHBondContact O-CG1 3.12Å; Y501-I505 PolarHBondContact O-N 3.31Å; M502-I505 PolarHBondContact O-N 2.91Å; I505-Y507 VanDerWaalsContact C-N 3.29Å; I505-Y507 PolarHBondContact O-N 3.28Å; I505-C508 PolarHBondContact O-N 3.49Å; I505-I509 HydrophobicContact CG2-CD1 3.4Å; I505-I509 VanDerWaalsContact CG2-CD1 3.4Å; I505-I509 HydrophobicContact CG2-CG1 4.21Å; I505-I509 WeakPolarHBondContact O-CB 3.28Å; I505-I509 VanDerWaalsContact O-CD1 3.32Å; I505-I509 WeakPolarHBondContact O-CD1 3.5Å; I505-I509 WeakPolarHBondContact O-CG1 3.44Å; I505-I509 PolarHBondContact O-N 2.72Å
506	Q	53.5	Low	52.4	Low	89 Å²	89	78.5 Å²	78.5	42%	0.416	39%	0.386	S	S	.	.	H	α-helix	trans	-58.4	-39.9	176.5	-77.5	177.5	-6.8	0	0	112.5	M502 N503 I509 I510	M502-Q506 VanDerWaalsContact O-CB 3.29Å; M502-Q506 WeakPolarHBondContact O-CB 3.39Å; M502-Q506 VanDerWaalsContact O-CG 3.25Å; M502-Q506 WeakPolarHBondContact O-CG 3.38Å; M502-Q506 PolarHBondContact O-N 3.04Å; N503-Q506 PolarHBondContact O-N 3.1Å; Q506-I509 PolarHBondContact O-N 2.67Å; Q506-I510 WeakPolarHBondContact O-CD1 3.41Å; Q506-I510 VanDerWaalsContact O-CG1 3.27Å; Q506-I510 WeakPolarHBondContact O-CG1 3.31Å; Q506-I510 PolarHBondContact O-N 3Å
507	Y	52.1	Low	52.8	Low	30 Å²	30	72.5 Å²	72.5	12%	0.118	37%	0.365	C	S	.	.	H	α-helix	trans	-59	-59.1	172	-172.8	-90.4	0	0	0	110.2	I239 L242 N503 I504 I505 I509 I510 Y511	I239-Y507 HydrophobicContact CD1-CD2 4.22Å; I239-Y507 HydrophobicContact CD1-CE2 4.49Å; I239-Y507 HydrophobicContact CD1-CG 4.4Å; I239-Y507 HydrophobicContact CG1-CD2 4.02Å; I239-Y507 HydrophobicContact CG1-CE2 3.96Å; L242-Y507 HydrophobicContact CD1-CE2 4Å; N503-Y507 VanDerWaalsContact O-CB 3.29Å; N503-Y507 WeakPolarHBondContact O-CB 3.45Å; N503-Y507 PolarHBondContact O-N 3.47Å; I504-Y507 WeakPolarHBondContact O-CB 3.5Å; I504-Y507 PolarHBondContact O-N 3.47Å; I505-Y507 VanDerWaalsContact C-N 3.29Å; I505-Y507 PolarHBondContact O-N 3.28Å; Y507-I509 PolarHBondContact O-N 3.46Å; Y507-I509 VanDerWaalsContact O-N 3.14Å; Y507-I510 PolarHBondContact O-N 3.45Å; Y507-Y511 AromaticContact CD1-CD2 3.7Å; Y507-Y511 HydrophobicContact CD1-CD2 3.7Å; Y507-Y511 AromaticContact CD1-CE2 3.75Å; Y507-Y511 HydrophobicContact CD1-CE2 3.75Å; Y507-Y511 HydrophobicContact CD2-CD2 4.42Å; Y507-Y511 AromaticContact CD2-CE2 3.8Å; Y507-Y511 HydrophobicContact CD2-CE2 3.8Å; Y507-Y511 AromaticContact CE1-CD2 3.61Å; Y507-Y511 HydrophobicContact CE1-CD2 3.61Å; Y507-Y511 AromaticContact CE1-CE2 3.37Å; Y507-Y511 HydrophobicContact CE1-CE2 3.37Å; Y507-Y511 HydrophobicContact CE2-CD2 4.36Å; Y507-Y511 AromaticContact CE2-CE2 3.44Å; Y507-Y511 HydrophobicContact CE2-CE2 3.44Å; Y507-Y511 VanDerWaalsContact CE2-CE2 3.44Å; Y507-Y511 HydrophobicContact CG-CD2 4.11Å; Y507-Y511 AromaticContact CG-CE2 3.95Å; Y507-Y511 HydrophobicContact CG-CE2 3.95Å; Y507-Y511 AromaticContact CZ-CD2 3.96Å; Y507-Y511 AromaticContact CZ-CE2 3.19Å; Y507-Y511 AromaticContact CZ-CZ 3.76Å; Y507-Y511 VanDerWaalsContact O-CD2 3.25Å; Y507-Y511 WeakPolarHBondContact O-CD2 3.44Å; Y507-Y511 PolarHBondContact O-N 2.89Å; Y507-Y511 PolarHBondContact OH-OH 3.38Å
508	C	51.2	Low	53.1	Low	74 Å²	74	69.7 Å²	69.7	50%	0.5	35%	0.35	S	S	.	.	H	α-helix	trans	-55.5	-34.1	178	-69.6	0	0	0	0	113.6	I504 I505 L512	I504-C508 WeakPolarHBondContact O-CB 3.39Å; I504-C508 PolarHBondContact O-N 2.87Å; I504-C508 PolarHBondContact O-SG 2.96Å; I504-C508 VanDerWaalsContact O-SG 3.37Å; I505-C508 PolarHBondContact O-N 3.49Å; C508-L512 WeakPolarHBondContact O-CB 3.47Å; C508-L512 PolarHBondContact O-N 3.39Å
509	I	53.5	Low	53.4	Low	26 Å²	26	71.7 Å²	71.7	13%	0.133	36%	0.36	C	S	.	.	H	α-helix	trans	-66.1	-47.3	174.7	-68.8	161.9	0	0	0	111.3	L483 I487 I505 Q506 Y507 Y511 L512 I513	L483-I509 HydrophobicContact CD1-CD1 3.75Å; L483-I509 HydrophobicContact CD1-CG1 3.59Å; L483-I509 HydrophobicContact CD2-CB 4.18Å; L483-I509 HydrophobicContact CD2-CD1 3.6Å; L483-I509 HydrophobicContact CD2-CG1 3.47Å; L483-I509 VanDerWaalsContact CD2-CG1 3.47Å; L483-I509 HydrophobicContact CD2-CG2 3.62Å; L483-I509 HydrophobicContact CG-CD1 3.87Å; L483-I509 HydrophobicContact CG-CG1 3.98Å; I487-I509 HydrophobicContact CD1-CD1 3.9Å; I505-I509 HydrophobicContact CG2-CD1 3.4Å; I505-I509 VanDerWaalsContact CG2-CD1 3.4Å; I505-I509 HydrophobicContact CG2-CG1 4.21Å; I505-I509 WeakPolarHBondContact O-CB 3.28Å; I505-I509 VanDerWaalsContact O-CD1 3.32Å; I505-I509 WeakPolarHBondContact O-CD1 3.5Å; I505-I509 WeakPolarHBondContact O-CG1 3.44Å; I505-I509 PolarHBondContact O-N 2.72Å; Q506-I509 PolarHBondContact O-N 2.67Å; Y507-I509 PolarHBondContact O-N 3.46Å; Y507-I509 VanDerWaalsContact O-N 3.14Å; I509-Y511 VanDerWaalsContact C-N 3.32Å; I509-Y511 PolarHBondContact O-N 2.98Å; I509-L512 PolarHBondContact O-N 3.16Å; I509-I513 HydrophobicContact CG2-CD1 3.66Å; I509-I513 HydrophobicContact CG2-CG1 4.37Å; I509-I513 WeakPolarHBondContact O-CB 3.49Å; I509-I513 VanDerWaalsContact O-CG1 3.28Å; I509-I513 WeakPolarHBondContact O-CG1 3.42Å; I509-I513 PolarHBondContact O-N 3.23Å
510	I	58.1	Low	53.6	Low	82 Å²	82	65.6 Å²	65.6	42%	0.421	34%	0.335	S	S	.	.	H	α-helix	trans	-60.3	-45	178.7	-71	163.1	0	0	0	109.8	Q506 Y507 I513 Q514	Q506-I510 WeakPolarHBondContact O-CD1 3.41Å; Q506-I510 VanDerWaalsContact O-CG1 3.27Å; Q506-I510 WeakPolarHBondContact O-CG1 3.31Å; Q506-I510 PolarHBondContact O-N 3Å; Y507-I510 PolarHBondContact O-N 3.45Å; I510-I513 PolarHBondContact O-N 3.18Å; I510-Q514 HydrophobicContact CG2-CG 4.49Å; I510-Q514 WeakPolarHBondContact O-CB 3.23Å; I510-Q514 VanDerWaalsContact O-CG 3.23Å; I510-Q514 WeakPolarHBondContact O-CG 3.43Å; I510-Q514 PolarHBondContact O-N 2.88Å
511	Y	58.1	Low	53.9	Low	75 Å²	75	62.9 Å²	62.9	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-65.4	-43	175.5	-76	-82.4	0	0	0	112.5	Y507 I509 I513 Q514 D515	Y507-Y511 AromaticContact CD1-CD2 3.7Å; Y507-Y511 HydrophobicContact CD1-CD2 3.7Å; Y507-Y511 AromaticContact CD1-CE2 3.75Å; Y507-Y511 HydrophobicContact CD1-CE2 3.75Å; Y507-Y511 HydrophobicContact CD2-CD2 4.42Å; Y507-Y511 AromaticContact CD2-CE2 3.8Å; Y507-Y511 HydrophobicContact CD2-CE2 3.8Å; Y507-Y511 AromaticContact CE1-CD2 3.61Å; Y507-Y511 HydrophobicContact CE1-CD2 3.61Å; Y507-Y511 AromaticContact CE1-CE2 3.37Å; Y507-Y511 HydrophobicContact CE1-CE2 3.37Å; Y507-Y511 HydrophobicContact CE2-CD2 4.36Å; Y507-Y511 AromaticContact CE2-CE2 3.44Å; Y507-Y511 HydrophobicContact CE2-CE2 3.44Å; Y507-Y511 VanDerWaalsContact CE2-CE2 3.44Å; Y507-Y511 HydrophobicContact CG-CD2 4.11Å; Y507-Y511 AromaticContact CG-CE2 3.95Å; Y507-Y511 HydrophobicContact CG-CE2 3.95Å; Y507-Y511 AromaticContact CZ-CD2 3.96Å; Y507-Y511 AromaticContact CZ-CE2 3.19Å; Y507-Y511 AromaticContact CZ-CZ 3.76Å; Y507-Y511 VanDerWaalsContact O-CD2 3.25Å; Y507-Y511 WeakPolarHBondContact O-CD2 3.44Å; Y507-Y511 PolarHBondContact O-N 2.89Å; Y507-Y511 PolarHBondContact OH-OH 3.38Å; I509-Y511 VanDerWaalsContact C-N 3.32Å; I509-Y511 PolarHBondContact O-N 2.98Å; Y511-I513 VanDerWaalsContact C-N 3.31Å; Y511-I513 PolarHBondContact O-N 3.32Å; Y511-Q514 PolarHBondContact O-N 3.04Å; Y511-D515 WeakPolarHBondContact O-CB 3.34Å; Y511-D515 PolarHBondContact O-N 3.42Å; Y511-D515 VanDerWaalsContact O-OD1 3.05Å
512	L	52.9	Low	54.3	Low	88 Å²	88	60.8 Å²	60.8	46%	0.461	31%	0.313	S	S	.	.	H	α-helix	trans	-68.6	-29.7	-179.7	-166.5	130.4	0	0	0	112.9	I479 C508 I509 S516	I479-L512 HydrophobicContact CD1-CD2 4.18Å; I479-L512 HydrophobicContact CG2-CD2 3.52Å; C508-L512 WeakPolarHBondContact O-CB 3.47Å; C508-L512 PolarHBondContact O-N 3.39Å; I509-L512 PolarHBondContact O-N 3.16Å; L512-S516 PolarHBondContact O-N 3.07Å; L512-S516 PolarHBondContact O-OG 3.34Å
513	I	56.8	Low	54.4	Low	75 Å²	75	59.3 Å²	59.3	39%	0.385	31%	0.312	S	S	.	.	H	α-helix	trans	-71.8	-44.8	169	-68.6	170.8	0	0	0	110.7	I509 I510 Y511 D515 S516 V517	I509-I513 HydrophobicContact CG2-CD1 3.66Å; I509-I513 HydrophobicContact CG2-CG1 4.37Å; I509-I513 WeakPolarHBondContact O-CB 3.49Å; I509-I513 VanDerWaalsContact O-CG1 3.28Å; I509-I513 WeakPolarHBondContact O-CG1 3.42Å; I509-I513 PolarHBondContact O-N 3.23Å; I510-I513 PolarHBondContact O-N 3.18Å; Y511-I513 VanDerWaalsContact C-N 3.31Å; Y511-I513 PolarHBondContact O-N 3.32Å; I513-D515 VanDerWaalsContact C-N 3.27Å; I513-D515 PolarHBondContact O-N 3.31Å; I513-S516 WeakPolarHBondContact CA-OG 3.48Å; I513-S516 PolarHBondContact O-N 3.39Å; I513-S516 PolarHBondContact O-OG 2.98Å; I513-V517 HydrophobicContact CG2-CG2 4.33Å; I513-V517 WeakPolarHBondContact O-CB 3.31Å; I513-V517 VanDerWaalsContact O-CG2 3.28Å; I513-V517 WeakPolarHBondContact O-CG2 3.47Å; I513-V517 PolarHBondContact O-N 3.29Å
514	Q	56	Low	54.6	Low	82 Å²	82	58.7 Å²	58.7	38%	0.383	31%	0.308	S	S	.	.	H	α-helix	trans	-59.5	-38.4	175.1	-76.7	172.9	-4.6	0	0	111.9	I510 Y511 L518	I510-Q514 HydrophobicContact CG2-CG 4.49Å; I510-Q514 WeakPolarHBondContact O-CB 3.23Å; I510-Q514 VanDerWaalsContact O-CG 3.23Å; I510-Q514 WeakPolarHBondContact O-CG 3.43Å; I510-Q514 PolarHBondContact O-N 2.88Å; Y511-Q514 PolarHBondContact O-N 3.04Å; Q514-L518 VanDerWaalsContact O-CB 3.28Å; Q514-L518 WeakPolarHBondContact O-CB 3.26Å; Q514-L518 PolarHBondContact O-N 3.3Å
515	D	52.2	Low	54.9	Low	52 Å²	52	58.2 Å²	58.2	28%	0.278	31%	0.306	S	S	.	.	H	α-helix	trans	-66.9	-44.6	178.8	-74.9	9.4	0	0	0	112.1	R219 Y511 I513 L518 I519	R219-D515 IonicContact CZ-OD1 3.54Å; R219-D515 IonicContact NH1-OD1 3.11Å; R219-D515 PolarHBondContact NH1-OD1 2.85Å; R219-D515 IonicContact NH1-OD2 2.67Å; R219-D515 PolarHBondContact NH1-OD2 3.44Å; R219-D515 IonicContact NH2-OD1 3.57Å; R219-D515 PolarHBondContact NH2-OD1 3.19Å; Y511-D515 WeakPolarHBondContact O-CB 3.34Å; Y511-D515 PolarHBondContact O-N 3.42Å; Y511-D515 VanDerWaalsContact O-OD1 3.05Å; I513-D515 VanDerWaalsContact C-N 3.27Å; I513-D515 PolarHBondContact O-N 3.31Å; D515-L518 PolarHBondContact O-N 2.96Å; D515-I519 WeakPolarHBondContact O-CD1 3.29Å; D515-I519 VanDerWaalsContact O-CG1 3.24Å; D515-I519 WeakPolarHBondContact O-CG1 3.33Å; D515-I519 PolarHBondContact O-N 3.43Å
516	S	53.2	Low	55.2	Low	22 Å²	22	59.9 Å²	59.9	15%	0.154	31%	0.313	C	S	.	.	H	α-helix	trans	-74	-30.2	178.3	44	0	0	0	0	112.6	L476 L512 I513 L520	L476-S516 WeakPolarHBondContact CD2-OG 3.36Å; L512-S516 PolarHBondContact O-N 3.07Å; L512-S516 PolarHBondContact O-OG 3.34Å; I513-S516 WeakPolarHBondContact CA-OG 3.48Å; I513-S516 PolarHBondContact O-N 3.39Å; I513-S516 PolarHBondContact O-OG 2.98Å; S516-L520 VanDerWaalsContact O-CB 3.32Å; S516-L520 WeakPolarHBondContact O-CB 3.45Å; S516-L520 PolarHBondContact O-N 3.28Å
517	V	56.4	Low	55.5	Low	66 Å²	66	57.2 Å²	57.2	40%	0.4	30%	0.302	S	S	.	.	H	α-helix	trans	-68.3	-41	167	170.7	0	0	0	0	111.3	I513 L520 M521	I513-V517 HydrophobicContact CG2-CG2 4.33Å; I513-V517 WeakPolarHBondContact O-CB 3.31Å; I513-V517 VanDerWaalsContact O-CG2 3.28Å; I513-V517 WeakPolarHBondContact O-CG2 3.47Å; I513-V517 PolarHBondContact O-N 3.29Å; V517-L520 WeakPolarHBondContact O-CB 3.35Å; V517-L520 PolarHBondContact O-N 2.87Å; V517-M521 HydrophobicContact CG1-CG 4.36Å; V517-M521 WeakPolarHBondContact O-CB 3.17Å; V517-M521 VanDerWaalsContact O-CG 3.3Å; V517-M521 WeakPolarHBondContact O-CG 3.2Å; V517-M521 PolarHBondContact O-N 3.5Å
518	L	55.4	Low	55.9	Low	57 Å²	57	59.5 Å²	59.5	30%	0.298	32%	0.321	S	S	.	.	H	α-helix	trans	-61.6	-46.4	175.3	-174.1	79	0	0	0	110.9	L215 Q514 D515 L520 M521 M522	L215-L518 HydrophobicContact CD1-CD1 4.39Å; L215-L518 HydrophobicContact CD1-CD2 4.16Å; Q514-L518 VanDerWaalsContact O-CB 3.28Å; Q514-L518 WeakPolarHBondContact O-CB 3.26Å; Q514-L518 PolarHBondContact O-N 3.3Å; D515-L518 PolarHBondContact O-N 2.96Å; L518-L520 VanDerWaalsContact C-N 3.33Å; L518-L520 PolarHBondContact O-N 3.07Å; L518-M521 PolarHBondContact O-N 3.05Å; L518-M522 WeakPolarHBondContact O-CG 3.48Å; L518-M522 PolarHBondContact O-N 3.23Å
519	I	55.1	Low	56.3	Low	94 Å²	94	57.5 Å²	57.5	48%	0.482	31%	0.307	S	S	.	.	H	α-helix	trans	-60.8	-42.6	175.9	-69.7	162.9	0	0	0	110.9	L472 D515 M522 G523	L472-I519 HydrophobicContact CD1-CG2 4.25Å; L472-I519 HydrophobicContact CD2-CG2 4.13Å; D515-I519 WeakPolarHBondContact O-CD1 3.29Å; D515-I519 VanDerWaalsContact O-CG1 3.24Å; D515-I519 WeakPolarHBondContact O-CG1 3.33Å; D515-I519 PolarHBondContact O-N 3.43Å; I519-M522 PolarHBondContact O-N 3.44Å; I519-G523 PolarHBondContact O-N 3.06Å
520	L	56.4	Low	56.5	Low	29 Å²	29	57 Å²	57	15%	0.152	31%	0.306	C	S	.	.	H	α-helix	trans	-60.4	-46.4	174.7	-174.9	72.2	0	0	0	111.5	V469 L472 I473 L476 S516 V517 L518 G523 I524	V469-L520 HydrophobicContact CG1-CD1 4.04Å; L472-L520 HydrophobicContact CB-CD1 4.29Å; I473-L520 HydrophobicContact CG1-CD1 4.1Å; L476-L520 HydrophobicContact CD1-CD2 4.32Å; S516-L520 VanDerWaalsContact O-CB 3.32Å; S516-L520 WeakPolarHBondContact O-CB 3.45Å; S516-L520 PolarHBondContact O-N 3.28Å; V517-L520 WeakPolarHBondContact O-CB 3.35Å; V517-L520 PolarHBondContact O-N 2.87Å; L518-L520 VanDerWaalsContact C-N 3.33Å; L518-L520 PolarHBondContact O-N 3.07Å; L520-G523 PolarHBondContact O-N 3.42Å; L520-I524 HydrophobicContact CG-CD1 4Å; L520-I524 VanDerWaalsContact O-CG1 3.3Å; L520-I524 WeakPolarHBondContact O-CG1 3.46Å; L520-I524 PolarHBondContact O-N 3.11Å
521	M	57.4	Low	56.6	Low	65 Å²	65	55.9 Å²	55.9	32%	0.32	30%	0.3	S	S	.	.	H	α-helix	trans	-63.6	-40.7	178	-71.3	-59.2	-63.5	0	0	112.2	F292 V517 L518 I524 I525	F292-M521 HydrophobicContact CE2-CE 4.4Å; F292-M521 HydrophobicContact CZ-CE 3.75Å; V517-M521 HydrophobicContact CG1-CG 4.36Å; V517-M521 WeakPolarHBondContact O-CB 3.17Å; V517-M521 VanDerWaalsContact O-CG 3.3Å; V517-M521 WeakPolarHBondContact O-CG 3.2Å; V517-M521 PolarHBondContact O-N 3.5Å; L518-M521 PolarHBondContact O-N 3.05Å; M521-I524 PolarHBondContact O-N 2.82Å; M521-I524 HydrophobicContact SD-CD1 4.42Å; M521-I525 VanDerWaalsContact O-CG1 3.26Å; M521-I525 WeakPolarHBondContact O-CG1 3.4Å; M521-I525 PolarHBondContact O-N 3.2Å
522	M	55.3	Low	56.7	Low	41 Å²	41	55.3 Å²	55.3	20%	0.202	31%	0.305	C	S	.	.	H	α-helix	trans	-67.7	-35.7	175.1	-63.3	-54.4	-98.3	0	0	111.9	L208 I212 L518 I519 I525 Q526	L208-M522 HydrophobicContact CD2-CE 4.01Å; I212-M522 HydrophobicContact CD1-CE 3.84Å; I212-M522 HydrophobicContact CG1-CE 3.43Å; I212-M522 VanDerWaalsContact CG1-CE 3.43Å; L518-M522 WeakPolarHBondContact O-CG 3.48Å; L518-M522 PolarHBondContact O-N 3.23Å; I519-M522 PolarHBondContact O-N 3.44Å; M522-I525 PolarHBondContact O-N 3.08Å; M522-I525 HydrophobicContact SD-CD1 4.06Å; M522-Q526 WeakPolarHBondContact O-CB 3.24Å; M522-Q526 PolarHBondContact O-N 3.24Å
523	G	52.8	Low	57	Low	25 Å²	25	52.9 Å²	52.9	26%	0.258	29%	0.29	S	S	.	.	H	α-helix	trans	-63	-41.4	171.1	0	0	0	0	0	112.9	I519 L520 Q526 L527	I519-G523 PolarHBondContact O-N 3.06Å; L520-G523 PolarHBondContact O-N 3.42Å; G523-Q526 PolarHBondContact O-N 3.36Å; G523-L527 WeakPolarHBondContact O-CB 3.48Å; G523-L527 PolarHBondContact O-N 3.37Å
524	I	58.2	Low	57.2	Low	59 Å²	59	50.1 Å²	50.1	30%	0.303	28%	0.276	S	S	.	.	H	α-helix	trans	-67	-43.5	175.2	-67.9	163.6	0	0	0	111.2	L520 M521 Q526 L527 C528	L520-I524 HydrophobicContact CG-CD1 4Å; L520-I524 VanDerWaalsContact O-CG1 3.3Å; L520-I524 WeakPolarHBondContact O-CG1 3.46Å; L520-I524 PolarHBondContact O-N 3.11Å; M521-I524 PolarHBondContact O-N 2.82Å; M521-I524 HydrophobicContact SD-CD1 4.42Å; I524-Q526 VanDerWaalsContact C-N 3.34Å; I524-Q526 PolarHBondContact O-N 3.05Å; I524-L527 WeakPolarHBondContact O-CB 3.35Å; I524-L527 PolarHBondContact O-N 2.91Å; I524-C528 WeakPolarHBondContact O-CB 3.49Å; I524-C528 PolarHBondContact O-N 3.09Å; I524-C528 PolarHBondContact O-SG 2.89Å
525	I	58.2	Low	57.3	Low	59 Å²	59	51 Å²	51	30%	0.303	28%	0.282	S	S	.	.	H	α-helix	trans	-61.1	-45.7	175.9	-69.7	162.8	0	0	0	110	L208 M521 M522 L527 C528 C529	L208-I525 HydrophobicContact CD1-CG2 3.76Å; L208-I525 HydrophobicContact CD2-CG2 4.11Å; M521-I525 VanDerWaalsContact O-CG1 3.26Å; M521-I525 WeakPolarHBondContact O-CG1 3.4Å; M521-I525 PolarHBondContact O-N 3.2Å; M522-I525 PolarHBondContact O-N 3.08Å; M522-I525 HydrophobicContact SD-CD1 4.06Å; I525-L527 PolarHBondContact O-N 3.33Å; I525-C528 PolarHBondContact O-N 2.91Å; I525-C529 WeakPolarHBondContact O-CB 3.34Å; I525-C529 PolarHBondContact O-N 3.29Å; I525-C529 PolarHBondContact O-SG 3.16Å
526	Q	57.1	Low	57.6	Low	68 Å²	68	51.1 Å²	51.1	32%	0.318	28%	0.282	S	S	.	.	H	α-helix	trans	-59.4	-46.4	175.7	-176.6	66.1	4.1	0	0	111.4	M465 M522 G523 I524 C528 C529 T530	M465-Q526 HydrophobicContact CE-CG 4.4Å; M522-Q526 WeakPolarHBondContact O-CB 3.24Å; M522-Q526 PolarHBondContact O-N 3.24Å; G523-Q526 PolarHBondContact O-N 3.36Å; I524-Q526 VanDerWaalsContact C-N 3.34Å; I524-Q526 PolarHBondContact O-N 3.05Å; Q526-C528 PolarHBondContact O-N 3.26Å; Q526-C529 CarbonylContact O-C 3.52Å; Q526-C529 PolarHBondContact O-N 3.43Å; Q526-C529 VanDerWaalsContact O-N 3.1Å; Q526-T530 HydrophobicContact CG-CG2 4.3Å; Q526-T530 WeakPolarHBondContact O-CG2 3.42Å; Q526-T530 PolarHBondContact O-N 3.45Å; Q526-T530 PolarHBondContact O-OG1 3.17Å
527	L	58.6	Low	57.8	Low	33 Å²	33	52 Å²	52	17%	0.173	29%	0.285	C	S	.	.	H	α-helix	trans	-55.2	-50.4	174.9	179.3	76.6	0	0	0	111.7	M465 G523 I524 I525 C529 T530 I531	M465-L527 HydrophobicContact CB-CD1 3.58Å; M465-L527 HydrophobicContact CG-CD1 4.24Å; G523-L527 WeakPolarHBondContact O-CB 3.48Å; G523-L527 PolarHBondContact O-N 3.37Å; I524-L527 WeakPolarHBondContact O-CB 3.35Å; I524-L527 PolarHBondContact O-N 2.91Å; I525-L527 PolarHBondContact O-N 3.33Å; L527-C529 PolarHBondContact O-N 2.87Å; L527-T530 WeakPolarHBondContact CA-OG1 3.43Å; L527-T530 PolarHBondContact O-N 2.94Å; L527-T530 PolarHBondContact O-OG1 3.41Å; L527-I531 HydrophobicContact CD1-CD1 3.77Å; L527-I531 HydrophobicContact CD1-CG1 4.16Å; L527-I531 HydrophobicContact CD2-CD1 4.43Å; L527-I531 HydrophobicContact CG-CD1 3.75Å; L527-I531 HydrophobicContact CG-CG1 4.4Å; L527-I531 WeakPolarHBondContact O-CG1 3.3Å; L527-I531 PolarHBondContact O-N 3.24Å
528	C	60.2	Low	57.9	Low	78 Å²	78	49.9 Å²	49.9	53%	0.527	27%	0.272	S	S	.	.	H	α-helix	trans	-62.5	-28.4	177.3	-69.8	0	0	0	0	112.9	I524 I525 Q526 P532	I524-C528 WeakPolarHBondContact O-CB 3.49Å; I524-C528 PolarHBondContact O-N 3.09Å; I524-C528 PolarHBondContact O-SG 2.89Å; I525-C528 PolarHBondContact O-N 2.91Å; Q526-C528 PolarHBondContact O-N 3.26Å; C528-P532 WeakPolarHBondContact O-CD 3.45Å; C528-P532 VanDerWaalsContact O-CG 3.32Å; C528-P532 WeakPolarHBondContact O-CG 3.41Å
529	C	59.6	Low	57.9	Low	31 Å²	31	51 Å²	51	21%	0.209	28%	0.278	C	S	.	.	H	α-helix	trans	-86	-23.7	174.9	-68.8	0	0	0	0	113.8	Q201 I525 Q526 L527	Q201-C529 PolarHBondContact NE2-O 3.36Å; I525-C529 WeakPolarHBondContact O-CB 3.34Å; I525-C529 PolarHBondContact O-N 3.29Å; I525-C529 PolarHBondContact O-SG 3.16Å; Q526-C529 CarbonylContact O-C 3.52Å; Q526-C529 PolarHBondContact O-N 3.43Å; Q526-C529 VanDerWaalsContact O-N 3.1Å; L527-C529 PolarHBondContact O-N 2.87Å
530	T	59.5	Low	57.9	Low	16 Å²	16	48.8 Å²	48.8	10%	0.098	27%	0.266	C	S	.	.	H	α-helix	trans	-89.2	-36.3	179.4	50.9	0	0	0	0	113.6	M465 Q526 L527 Y533 L534	M465-T530 HydrophobicContact CE-CG2 4.37Å; Q526-T530 HydrophobicContact CG-CG2 4.3Å; Q526-T530 WeakPolarHBondContact O-CG2 3.42Å; Q526-T530 PolarHBondContact O-N 3.45Å; Q526-T530 PolarHBondContact O-OG1 3.17Å; L527-T530 WeakPolarHBondContact CA-OG1 3.43Å; L527-T530 PolarHBondContact O-N 2.94Å; L527-T530 PolarHBondContact O-OG1 3.41Å; T530-Y533 PolarHBondContact O-N 3.48Å; T530-L534 WeakPolarHBondContact O-CG 3.46Å; T530-L534 PolarHBondContact O-N 3.25Å
531	I	59.1	Low	57.9	Low	59 Å²	59	49.9 Å²	49.9	30%	0.303	27%	0.268	S	S	.	.	H	α-helix	trans	-57.9	-48.9	-179.4	-70.8	170.3	0	0	0	112.2	F458 L527 Y533 L534 M535	F458-I531 HydrophobicContact CE2-CG2 4.47Å; L527-I531 HydrophobicContact CD1-CD1 3.77Å; L527-I531 HydrophobicContact CD1-CG1 4.16Å; L527-I531 HydrophobicContact CD2-CD1 4.43Å; L527-I531 HydrophobicContact CG-CD1 3.75Å; L527-I531 HydrophobicContact CG-CG1 4.4Å; L527-I531 WeakPolarHBondContact O-CG1 3.3Å; L527-I531 PolarHBondContact O-N 3.24Å; I531-Y533 VanDerWaalsContact C-N 3.26Å; I531-Y533 PolarHBondContact O-N 3.12Å; I531-L534 PolarHBondContact O-N 3.03Å; I531-M535 WeakPolarHBondContact O-CB 3.39Å; I531-M535 PolarHBondContact O-N 3.31Å
532	P	59.9	Low	57.8	Low	62 Å²	62	48.9 Å²	48.9	40%	0.403	26%	0.263	S	S	.	.	H	α-helix	trans	-63	-32.6	179.7	-23.6	35.2	0	0	0	113	C528 M535 I536	C528-P532 WeakPolarHBondContact O-CD 3.45Å; C528-P532 VanDerWaalsContact O-CG 3.32Å; C528-P532 WeakPolarHBondContact O-CG 3.41Å; P532-M535 PolarHBondContact O-N 3.1Å; P532-I536 WeakPolarHBondContact O-CB 3.42Å; P532-I536 WeakPolarHBondContact O-CD1 3.43Å; P532-I536 WeakPolarHBondContact O-CG1 3.49Å; P532-I536 PolarHBondContact O-N 3.41Å
533	Y	60.3	Low	57.6	Low	37 Å²	37	50.4 Å²	50.4	15%	0.145	27%	0.27	C	S	.	.	H	α-helix	trans	-70.5	-44.7	177.1	169.7	-96.4	0	0	0	112.3	L198 T530 I531 M535 I536 N537	L198-Y533 HydrophobicContact CD2-CD2 4.01Å; L198-Y533 HydrophobicContact CD2-CE2 3.58Å; T530-Y533 PolarHBondContact O-N 3.48Å; I531-Y533 VanDerWaalsContact C-N 3.26Å; I531-Y533 PolarHBondContact O-N 3.12Å; Y533-M535 VanDerWaalsContact C-N 3.28Å; Y533-M535 PolarHBondContact O-N 2.96Å; Y533-I536 PolarHBondContact O-N 3.27Å; Y533-N537 WeakPolarHBondContact CE1-ND2 3.46Å; Y533-N537 WeakPolarHBondContact O-CB 3.47Å; Y533-N537 PolarHBondContact O-N 3.48Å; Y533-N537 PolarHBondContact OH-ND2 2.84Å
534	L	59.7	Low	57.5	Low	17 Å²	17	52 Å²	52	9%	0.089	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-39.6	173.2	-71	164.2	0	0	0	111.2	F458 P461 T530 I531 S538	F458-L534 HydrophobicContact CD2-CB 4.03Å; F458-L534 HydrophobicContact CE2-CB 4.46Å; P461-L534 HydrophobicContact CB-CD1 3.93Å; P461-L534 HydrophobicContact CG-CD2 4.43Å; T530-L534 WeakPolarHBondContact O-CG 3.46Å; T530-L534 PolarHBondContact O-N 3.25Å; I531-L534 PolarHBondContact O-N 3.03Å; L534-S538 WeakPolarHBondContact O-CB 3.28Å; L534-S538 PolarHBondContact O-N 3.11Å; L534-S538 PolarHBondContact O-OG 3.33Å
535	M	58.6	Low	57.1	Low	102 Å²	102	50.4 Å²	50.4	50%	0.502	27%	0.269	S	S	.	.	H	α-helix	trans	-66.5	-46.3	176.3	-173.9	176.8	-179.6	0	0	112.6	F458 I531 P532 Y533 S538 I539	F458-M535 HydrophobicContact CE2-CB 4.47Å; I531-M535 WeakPolarHBondContact O-CB 3.39Å; I531-M535 PolarHBondContact O-N 3.31Å; P532-M535 PolarHBondContact O-N 3.1Å; Y533-M535 VanDerWaalsContact C-N 3.28Å; Y533-M535 PolarHBondContact O-N 2.96Å; M535-S538 PolarHBondContact O-N 3.49Å; M535-S538 PolarHBondContact O-OG 3Å; M535-I539 HydrophobicContact CE-CD1 3.95Å; M535-I539 HydrophobicContact CG-CD1 3.76Å; M535-I539 WeakPolarHBondContact O-CB 3.34Å; M535-I539 WeakPolarHBondContact O-CD1 3.49Å; M535-I539 WeakPolarHBondContact O-CG1 3.32Å; M535-I539 PolarHBondContact O-N 2.95Å
536	I	58.5	Low	56.5	Low	54 Å²	54	52 Å²	52	28%	0.277	28%	0.278	S	S	.	.	H	α-helix	trans	-64.3	-43.2	177.7	-70.9	164	0	0	0	110.7	L194 P532 Y533 S538 I539 H540	L194-I536 HydrophobicContact CD1-CG2 3.88Å; P532-I536 WeakPolarHBondContact O-CB 3.42Å; P532-I536 WeakPolarHBondContact O-CD1 3.43Å; P532-I536 WeakPolarHBondContact O-CG1 3.49Å; P532-I536 PolarHBondContact O-N 3.41Å; Y533-I536 PolarHBondContact O-N 3.27Å; I536-S538 PolarHBondContact O-N 3.36Å; I536-I539 PolarHBondContact O-N 2.95Å; I536-H540 VanDerWaalsContact O-CB 3.32Å; I536-H540 WeakPolarHBondContact O-CB 3.39Å; I536-H540 PolarHBondContact O-N 2.96Å
537	N	57.5	Low	56	Low	41 Å²	41	53.3 Å²	53.3	22%	0.219	29%	0.285	C	S	.	.	H	α-helix	trans	-64	-39.6	176.6	-78.7	-5.9	0	0	0	112.4	Y533 R541	Y533-N537 WeakPolarHBondContact CE1-ND2 3.46Å; Y533-N537 WeakPolarHBondContact O-CB 3.47Å; Y533-N537 PolarHBondContact O-N 3.48Å; Y533-N537 PolarHBondContact OH-ND2 2.84Å; N537-R541 WeakPolarHBondContact O-CB 3.05Å; N537-R541 PolarHBondContact O-N 3.3Å
538	S	58.3	Low	55.1	Low	20 Å²	20	56 Å²	56	14%	0.14	30%	0.3	C	S	.	.	H	α-helix	trans	-69.3	-40.1	177.3	69.1	0	0	0	0	112	L534 M535 I536 R541 L542	L534-S538 WeakPolarHBondContact O-CB 3.28Å; L534-S538 PolarHBondContact O-N 3.11Å; L534-S538 PolarHBondContact O-OG 3.33Å; M535-S538 PolarHBondContact O-N 3.49Å; M535-S538 PolarHBondContact O-OG 3Å; I536-S538 PolarHBondContact O-N 3.36Å; S538-R541 PolarHBondContact O-N 2.85Å; S538-L542 WeakPolarHBondContact O-CD1 3.44Å; S538-L542 WeakPolarHBondContact O-CG 3.3Å; S538-L542 PolarHBondContact O-N 2.97Å
539	I	55.5	Low	54.1	Low	82 Å²	82	55.9 Å²	55.9	42%	0.421	29%	0.294	S	S	.	.	H	α-helix	trans	-64	-47.2	174.7	-68.9	167.3	0	0	0	111	M535 I536 R541 L542 E543	M535-I539 HydrophobicContact CE-CD1 3.95Å; M535-I539 HydrophobicContact CG-CD1 3.76Å; M535-I539 WeakPolarHBondContact O-CB 3.34Å; M535-I539 WeakPolarHBondContact O-CD1 3.49Å; M535-I539 WeakPolarHBondContact O-CG1 3.32Å; M535-I539 PolarHBondContact O-N 2.95Å; I536-I539 PolarHBondContact O-N 2.95Å; I539-R541 VanDerWaalsContact C-N 3.28Å; I539-R541 PolarHBondContact O-N 3.44Å; I539-L542 WeakPolarHBondContact O-CB 3.37Å; I539-L542 PolarHBondContact O-N 2.91Å; I539-L542 VanDerWaalsContact O-N 3.15Å; I539-E543 WeakPolarHBondContact O-CB 3.44Å; I539-E543 PolarHBondContact O-N 3.25Å
540	H	55	Low	52.9	Low	47 Å²	47	61.9 Å²	61.9	22%	0.218	32%	0.319	C	S	.	.	H	α-helix	trans	-62.8	-35.7	177.4	-172.7	-54.4	0	0	0	111.7	I536 C544	I536-H540 VanDerWaalsContact O-CB 3.32Å; I536-H540 WeakPolarHBondContact O-CB 3.39Å; I536-H540 PolarHBondContact O-N 2.96Å; H540-C544 PolarHBondContact CE1-SG 3.41Å; H540-C544 PolarHBondContact ND1-SG 2.93Å; H540-C544 VanDerWaalsContact ND1-SG 3.37Å; H540-C544 PolarHBondContact O-N 3.29Å; H540-C544 PolarHBondContact O-SG 2.94Å
541	R	57	Low	51.8	Low	51 Å²	51	64.5 Å²	64.5	19%	0.192	34%	0.338	C	S	.	.	H	α-helix	trans	-64.1	-46.6	172.9	-171.1	-176.9	-168.8	131.3	13.7	111.1	N537 S538 I539 E543 C544 L545 E595	N537-R541 WeakPolarHBondContact O-CB 3.05Å; N537-R541 PolarHBondContact O-N 3.3Å; S538-R541 PolarHBondContact O-N 2.85Å; I539-R541 VanDerWaalsContact C-N 3.28Å; I539-R541 PolarHBondContact O-N 3.44Å; R541-E543 PolarHBondContact O-N 3.3Å; R541-C544 PolarHBondContact O-N 2.71Å; R541-L545 HydrophobicContact CG-CD1 4.18Å; R541-L545 WeakPolarHBondContact O-CD1 3.29Å; R541-L545 WeakPolarHBondContact O-CG 3.37Å; R541-L545 PolarHBondContact O-N 3.16Å; R541-E595 IonicContact CZ-OE2 3.8Å; R541-E595 IonicContact NH1-OE1 2.63Å; R541-E595 IonicContact NH1-OE2 2.71Å; R541-E595 PolarHBondContact NH1-OE2 3.21Å; R541-E595 IonicContact NH2-OE2 3.4Å; R541-E595 PolarHBondContact NH2-OE2 3.48Å
542	L	55.4	Low	50.6	Low	44 Å²	44	71.6 Å²	71.6	23%	0.23	36%	0.361	C	S	.	.	H	α-helix	trans	-59.4	-44.2	175.5	-77.3	158.6	0	0	0	112	Y451 S538 I539 L545 L546	Y451-L542 HydrophobicContact CD1-CD2 3.52Å; Y451-L542 HydrophobicContact CD2-CD2 4.31Å; Y451-L542 HydrophobicContact CE1-CD2 3.26Å; Y451-L542 HydrophobicContact CE2-CD2 4.1Å; Y451-L542 HydrophobicContact CG-CD2 4.05Å; S538-L542 WeakPolarHBondContact O-CD1 3.44Å; S538-L542 WeakPolarHBondContact O-CG 3.3Å; S538-L542 PolarHBondContact O-N 2.97Å; I539-L542 WeakPolarHBondContact O-CB 3.37Å; I539-L542 PolarHBondContact O-N 2.91Å; I539-L542 VanDerWaalsContact O-N 3.15Å; L542-L545 PolarHBondContact O-N 2.82Å; L542-L546 WeakPolarHBondContact O-CB 3.11Å; L542-L546 PolarHBondContact O-N 3.45Å
543	E	51.1	Low	49.4	Very low	73 Å²	73	75.6 Å²	75.6	34%	0.341	38%	0.379	S	S	.	.	H	α-helix	trans	-63.6	-46.9	179.5	-170.1	175.3	-177.1	0	0	111.9	I539 R541 L545 L546 I547	I539-E543 WeakPolarHBondContact O-CB 3.44Å; I539-E543 PolarHBondContact O-N 3.25Å; R541-E543 PolarHBondContact O-N 3.3Å; E543-L545 PolarHBondContact O-N 3.46Å; E543-L546 PolarHBondContact O-N 2.97Å; E543-I547 HydrophobicContact CG-CD1 3.89Å; E543-I547 VanDerWaalsContact O-CG1 3.32Å; E543-I547 WeakPolarHBondContact O-CG1 3.4Å; E543-I547 PolarHBondContact O-N 3.43Å
544	C	50.9	Low	48	Very low	60 Å²	60	76.9 Å²	76.9	41%	0.405	40%	0.403	S	S	.	.	H	α-helix	trans	-59.5	-31	175.1	-71.8	0	0	0	0	113.5	H540 R541 N548	H540-C544 PolarHBondContact CE1-SG 3.41Å; H540-C544 PolarHBondContact ND1-SG 2.93Å; H540-C544 VanDerWaalsContact ND1-SG 3.37Å; H540-C544 PolarHBondContact O-N 3.29Å; H540-C544 PolarHBondContact O-SG 2.94Å; R541-C544 PolarHBondContact O-N 2.71Å; C544-N548 PolarHBondContact O-N 2.98Å
545	L	50	Low	46.5	Very low	24 Å²	24	85.3 Å²	85.3	13%	0.126	44%	0.44	C	S	.	.	H	α-helix	trans	-83.4	-34.3	-180	-65.5	172	0	0	0	112.6	E450 R541 L542 E543 N549	E450-L545 HydrophobicContact CB-CD1 3.48Å; E450-L545 VanDerWaalsContact CB-CD1 3.48Å; E450-L545 HydrophobicContact CG-CD1 4.29Å; E450-L545 VanDerWaalsContact OE2-CD2 3.32Å; E450-L545 WeakPolarHBondContact OE2-CD2 3.43Å; R541-L545 HydrophobicContact CG-CD1 4.18Å; R541-L545 WeakPolarHBondContact O-CD1 3.29Å; R541-L545 WeakPolarHBondContact O-CG 3.37Å; R541-L545 PolarHBondContact O-N 3.16Å; L542-L545 PolarHBondContact O-N 2.82Å; E543-L545 PolarHBondContact O-N 3.46Å; L545-N549 PolarHBondContact O-N 3.07Å; L545-N549 PolarHBondContact O-ND2 2.69Å
546	L	45.7	Very low	45	Very low	94 Å²	94	88.4 Å²	88.4	49%	0.492	46%	0.455	S	S	.	.	H	α-helix	trans	-65.1	-46.5	172.2	-82.6	158	0	0	0	111.5	L542 E543 N548 N549 Q550	L542-L546 WeakPolarHBondContact O-CB 3.11Å; L542-L546 PolarHBondContact O-N 3.45Å; E543-L546 PolarHBondContact O-N 2.97Å; L546-N548 PolarHBondContact O-N 3.16Å; L546-N549 PolarHBondContact O-N 2.63Å; L546-Q550 PolarHBondContact O-N 2.94Å
547	I	45.1	Very low	43.6	Very low	94 Å²	94	91.7 Å²	91.7	48%	0.482	48%	0.48	S	S	.	.	H	α-helix	trans	-62.3	-41.8	-180	-67.7	168.3	0	0	0	111.5	E543 N549 Q550 S551	E543-I547 HydrophobicContact CG-CD1 3.89Å; E543-I547 VanDerWaalsContact O-CG1 3.32Å; E543-I547 WeakPolarHBondContact O-CG1 3.4Å; E543-I547 PolarHBondContact O-N 3.43Å; I547-N549 VanDerWaalsContact C-N 3.27Å; I547-N549 PolarHBondContact O-N 3.02Å; I547-Q550 PolarHBondContact O-N 3.45Å; I547-S551 PolarHBondContact O-N 3Å
548	N	41.5	Very low	42.2	Very low	91 Å²	91	96.2 Å²	96.2	49%	0.487	51%	0.509	S	S	.	.	H	α-helix	trans	-66.9	-24.8	-179.4	-117.1	-19.4	0	0	0	113.9	C544 L546 S551	C544-N548 PolarHBondContact O-N 2.98Å; L546-N548 PolarHBondContact O-N 3.16Å; N548-S551 PolarHBondContact O-OG 3.31Å
549	N	37.5	Very low	40.8	Very low	75 Å²	75	99.7 Å²	99.7	40%	0.401	53%	0.533	S	S	.	.	H	α-helix	trans	-81.4	-28.3	174.7	-73.9	-56.2	0	0	0	112.4	T447 L545 L546 I547	T447-N549 WeakPolarHBondContact CG2-ND2 3.17Å; L545-N549 PolarHBondContact O-N 3.07Å; L545-N549 PolarHBondContact O-ND2 2.69Å; L546-N549 PolarHBondContact O-N 2.63Å; I547-N549 VanDerWaalsContact C-N 3.27Å; I547-N549 PolarHBondContact O-N 3.02Å
550	Q	36.1	Very low	39.7	Very low	156 Å²	156	101.8 Å²	101.8	73%	0.729	55%	0.552	S	S	*	*	H	α-helix	trans	-68.9	-36.3	173.9	-78.6	-174.1	-38.3	0	0	112.8	L546 I547 R552 N553	L546-Q550 PolarHBondContact O-N 2.94Å; I547-Q550 PolarHBondContact O-N 3.45Å; Q550-R552 VanDerWaalsContact C-N 3.29Å; Q550-R552 PolarHBondContact O-N 3.46Å; Q550-N553 PolarHBondContact O-N 3.29Å
551	S	35.1	Very low	38.7	Very low	71 Å²	71	105.8 Å²	105.8	50%	0.497	58%	0.58	S	S	.	*	H	α-helix	trans	-64.5	-32.7	178.2	64.7	0	0	0	0	113	I547 N548 N553 G554	I547-S551 PolarHBondContact O-N 3Å; N548-S551 PolarHBondContact O-OG 3.31Å; S551-N553 VanDerWaalsContact C-N 3.33Å; S551-N553 PolarHBondContact O-N 2.95Å; S551-G554 PolarHBondContact O-N 2.84Å
552	R	34.8	Very low	37.5	Very low	209 Å²	209	107.7 Å²	107.7	79%	0.789	61%	0.607	S	S	*	*	H	α-helix	trans	-75.5	-18.5	-175.1	-151	173.6	-172.6	-170.1	-0.2	114.4	Q550	Q550-R552 VanDerWaalsContact C-N 3.29Å; Q550-R552 PolarHBondContact O-N 3.46Å
553	N	33.5	Very low	36.2	Very low	145 Å²	145	113 Å²	113	78%	0.775	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-2.3	177.8	-68.4	0.2	0	0	0	113.2	Q550 S551	Q550-N553 PolarHBondContact O-N 3.29Å; S551-N553 VanDerWaalsContact C-N 3.33Å; S551-N553 PolarHBondContact O-N 2.95Å
554	G	32.2	Very low	35.2	Very low	64 Å²	64	112.9 Å²	112.9	66%	0.66	66%	0.659	S	S	*	*	S	Bend	trans	-94.9	-5.1	-180	0	0	0	0	0	115.5	S551	S551-G554 PolarHBondContact O-N 2.84Å
555	F	27.8	Very low	34.2	Very low	195 Å²	195	114 Å²	114	86%	0.855	67%	0.673	S	S	*	*			trans	-118.7	65.1	-175.5	-107	-88.2	0	0	0	111.7
556	M	26	Very low	33.2	Very low	166 Å²	166	119.2 Å²	119.2	82%	0.818	71%	0.705	S	S	*	*			trans	-97	113.7	157.1	-74.6	-156.5	100.1	0	0	109.3	T558	M556-T558 PolarHBondContact O-N 3.09Å; M556-T558 VanDerWaalsContact O-N 3.07Å
557	P	30.2	Very low	32.5	Very low	124 Å²	124	121.9 Å²	121.9	81%	0.805	73%	0.726	S	S	*	*			trans	-71.5	100.5	167.8	29.1	-31.5	0	0	0	108.9	S559	P557-S559 PolarHBondContact O-N 3.19Å
558	T	27.6	Very low	31.7	Very low	136 Å²	136	121.8 Å²	121.8	83%	0.834	74%	0.739	S	S	*	*			trans	-73.7	92	178.1	50.5	0	0	0	0	111.4	M556	M556-T558 PolarHBondContact O-N 3.09Å; M556-T558 VanDerWaalsContact O-N 3.07Å
559	S	30	Very low	31	Very low	92 Å²	92	122.6 Å²	122.6	64%	0.643	76%	0.758	S	S	*	*			trans	-166.1	106.9	154.6	-173.2	0	0	0	0	111.7	P557	P557-S559 PolarHBondContact O-N 3.19Å
560	P	32	Very low	30.5	Very low	126 Å²	126	122.7 Å²	122.7	82%	0.818	78%	0.777	S	S	*	*			trans	-85.2	108.9	165.3	32.1	-27.6	0	0	0	109.4	A562	P560-A562 PolarHBondContact O-N 3.4Å
561	V	34.3	Very low	30.1	Very low	132 Å²	132	119.7 Å²	119.7	80%	0.8	78%	0.779	S	S	*	*			trans	-72.2	113.8	169.8	176.4	0	0	0	0	108.5
562	A	31.2	Very low	29.8	Very low	91 Å²	91	122.6 Å²	122.6	75%	0.752	79%	0.793	S	S	*	*			trans	-68.8	138	175.8	0	0	0	0	0	111.2	P560	P560-A562 PolarHBondContact O-N 3.4Å
563	V	28.9	Very low	29.4	Very low	154 Å²	154	117.2 Å²	117.2	93%	0.933	79%	0.794	S	S	*	*			trans	-70.4	129.2	176.1	176.8	0	0	0	0	109.8
564	G	28.5	Very low	29.1	Very low	71 Å²	71	115.6 Å²	115.6	73%	0.732	80%	0.8	S	S	*	*			trans	-162.8	91.5	-178.5	0	0	0	0	0	114.7
565	A	30.8	Very low	28.9	Very low	85 Å²	85	116.3 Å²	116.3	70%	0.702	80%	0.8	S	S	*	*			trans	55.3	117.3	153	0	0	0	0	0	121.1
566	T	28.7	Very low	28.8	Very low	132 Å²	132	111.1 Å²	111.1	81%	0.81	79%	0.794	S	S	*	*			trans	50.9	107.5	135.4	60.9	0	0	0	0	120.1
567	V	31.4	Very low	29	Very low	151 Å²	151	110 Å²	110	92%	0.915	80%	0.795	S	S	*	*				-158.9	147.7	115.2	165.1	0	0	0	0	107.3
568	A	27.4	Very low	29	Very low	92 Å²	92	109.3 Å²	109.3	76%	0.76	79%	0.789	S	S	*	*			trans	-93.7	169.7	-175.2	0	0	0	0	0	114.1
569	A	28.3	Very low	29.2	Very low	108 Å²	108	107.9 Å²	107.9	89%	0.893	79%	0.785	S	S	*	*			trans	75.7	105.4	165.9	0	0	0	0	0	118.5
570	G	25.3	Very low	29.3	Very low	77 Å²	77	112.3 Å²	112.3	79%	0.794	79%	0.792	S	S	*	*			trans	114	137.5	151.6	0	0	0	0	0	116.6
571	A	28.1	Very low	29.2	Very low	93 Å²	93	113 Å²	113	77%	0.769	79%	0.79	S	S	*	*			trans	73.1	116.2	161.6	0	0	0	0	0	120.4
572	T	29.2	Very low	29.2	Very low	131 Å²	131	113 Å²	113	80%	0.804	79%	0.785	S	S	*	*			trans	59.2	101.5	133.8	57.9	0	0	0	0	121.3	A574	T572-A574 PolarHBondContact O-N 3.24Å
573	A	27	Very low	29.4	Very low	96 Å²	96	114.8 Å²	114.8	79%	0.793	78%	0.781	S	S	*	*				45	76.2	123.9	0	0	0	0	0	118.8	A575	A573-A575 PolarHBondContact O-N 2.75Å
574	A	26.4	Very low	29.6	Very low	111 Å²	111	114.3 Å²	114.3	92%	0.917	77%	0.772	S	S	*	*			trans	-70	83	154.6	0	0	0	0	0	110	T572 A576	T572-A574 PolarHBondContact O-N 3.24Å; A574-A576 PolarHBondContact O-N 2.92Å
575	A	27.9	Very low	30	Very low	80 Å²	80	119.9 Å²	119.9	66%	0.661	77%	0.771	S	S	*	*			trans	-68.8	116.6	177.8	0	0	0	0	0	110.6	A573 V577	A573-A575 PolarHBondContact O-N 2.75Å; A575-V577 PolarHBondContact O-N 3.31Å
576	A	26.7	Very low	30.6	Very low	86 Å²	86	119.2 Å²	119.2	71%	0.711	76%	0.76	S	S	*	*			trans	-61.7	106.5	168.3	0	0	0	0	0	109.4	A574 T578	A574-A576 PolarHBondContact O-N 2.92Å; A576-T578 PolarHBondContact O-N 3.34Å; A576-T578 PolarHBondContact O-OG1 2.98Å
577	V	28.4	Very low	31.5	Very low	141 Å²	141	115.8 Å²	115.8	86%	0.855	74%	0.738	S	S	*	*			trans	-69.8	80.3	-180	-176.3	0	0	0	0	109.4	A575 S579	A575-V577 PolarHBondContact O-N 3.31Å; V577-S579 PolarHBondContact O-N 3.37Å
578	T	30.1	Very low	32.3	Very low	111 Å²	111	116.2 Å²	116.2	68%	0.681	72%	0.723	S	S	*	*			trans	-78.3	101.5	165.4	38.7	0	0	0	0	107.2	A576 K580	A576-T578 PolarHBondContact O-N 3.34Å; A576-T578 PolarHBondContact O-OG1 2.98Å; T578-K580 PolarHBondContact O-N 3.24Å; T578-K580 VanDerWaalsContact O-N 3.1Å
579	S	32.6	Very low	33.2	Very low	105 Å²	105	114.3 Å²	114.3	73%	0.734	70%	0.699	S	S	*	*			trans	-54.8	115.5	177.5	44.2	0	0	0	0	109.7	V577 D581	V577-S579 PolarHBondContact O-N 3.37Å; S579-D581 PolarHBondContact O-N 2.99Å
580	K	31.1	Very low	34.1	Very low	185 Å²	185	113.5 Å²	113.5	80%	0.804	68%	0.68	S	S	*	*			trans	-104.3	29.5	-159.3	-147	172.3	-173.6	171.7	0	112.5	T578	T578-K580 PolarHBondContact O-N 3.24Å; T578-K580 VanDerWaalsContact O-N 3.1Å
581	D	31.1	Very low	35.4	Very low	142 Å²	142	112.3 Å²	112.3	76%	0.759	65%	0.651	S	S	*	*			trans	-113.4	38.1	-163.5	-54.9	-42.4	0	0	0	112.4	S579 L583	S579-D581 PolarHBondContact O-N 2.99Å; D581-L583 PolarHBondContact O-N 3.06Å
582	D	35	Very low	36.5	Very low	130 Å²	130	109.9 Å²	109.9	70%	0.695	63%	0.625	S	S	*	*			trans	-69	75.5	164.3	-97.4	-7.1	0	0	0	108.3	R439 I584	R439-D582 IonicContact NH2-OD2 3.18Å; R439-D582 PolarHBondContact NH2-OD2 3.18Å; R439-D582 VanDerWaalsContact NH2-OD2 3.11Å; D582-I584 PolarHBondContact O-N 3.4Å
583	L	34.4	Very low	37.5	Very low	130 Å²	130	110.4 Å²	110.4	68%	0.681	62%	0.616	S	S	*	*			trans	-55.2	125	179.3	-163.2	84.1	0	0	0	109.7	D581 W585	D581-L583 PolarHBondContact O-N 3.06Å; L583-W585 VanDerWaalsContact C-N 3.28Å; L583-W585 PolarHBondContact O-N 3.41Å
584	I	32.6	Very low	38.8	Very low	144 Å²	144	109.1 Å²	109.1	74%	0.738	60%	0.595	S	S	*	*			trans	-70.1	81.8	-171	-55.4	170.2	0	0	0	110.6	D582	D582-I584 PolarHBondContact O-N 3.4Å
585	W	37.5	Very low	40.1	Very low	187 Å²	187	105.1 Å²	105.1	71%	0.708	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-64.9	152.7	156	-89.2	69.3	0	0	0	109.4	L583 T587	L583-W585 VanDerWaalsContact C-N 3.28Å; L583-W585 PolarHBondContact O-N 3.41Å; W585-T587 PolarHBondContact O-N 3.37Å; W585-T587 VanDerWaalsContact O-N 3.1Å
586	P	42.8	Very low	41.3	Very low	72 Å²	72	105.5 Å²	105.5	47%	0.468	55%	0.547	S	S	.	.	S	Bend	trans	-52.4	124.1	164	-17.7	29.1	0	0	0	107.6	R588	P586-R588 PolarHBondContact O-N 3.3Å
587	T	47.3	Very low	42.6	Very low	59 Å²	59	105.5 Å²	105.5	36%	0.362	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-51.3	143.9	-170.6	54.2	0	0	0	0	110.4	W585 Q589 N590 W591	W585-T587 PolarHBondContact O-N 3.37Å; W585-T587 VanDerWaalsContact O-N 3.1Å; T587-Q589 CarbonylContact O-C 3.56Å; T587-Q589 PolarHBondContact O-N 3.36Å; T587-Q589 PolarHBondContact OG1-OE1 2.87Å; T587-N590 PolarHBondContact O-N 3.42Å; T587-W591 PolarHBondContact O-N 3.29Å
588	R	48.7	Very low	43.9	Very low	160 Å²	160	101.2 Å²	101.2	60%	0.604	50%	0.504	S	S	*	.	H	α-helix	trans	-51.5	-28.9	-179.5	-69.9	-168.6	-175	-167.2	7.2	112.1	E450 P586 L592	E450-R588 IonicContact OE1-CZ 2.7Å; E450-R588 IonicContact OE1-NH1 3.01Å; E450-R588 PolarHBondContact OE1-NH1 3.49Å; E450-R588 IonicContact OE2-NH1 2.7Å; P586-R588 PolarHBondContact O-N 3.3Å; R588-L592 WeakPolarHBondContact O-CB 3.47Å; R588-L592 PolarHBondContact O-N 3.03Å
589	Q	46.2	Very low	45.1	Very low	52 Å²	52	97.4 Å²	97.4	24%	0.243	48%	0.479	C	S	.	.	H	α-helix	trans	-53.6	-53.7	168.5	-68.2	154.7	-65.2	0	0	113.5	L440 T587 W591 L592 F593	L440-Q589 HydrophobicContact CB-CG 3.82Å; L440-Q589 HydrophobicContact CD1-CG 4.24Å; L440-Q589 HydrophobicContact CD2-CG 3.82Å; L440-Q589 HydrophobicContact CG-CG 4.18Å; T587-Q589 CarbonylContact O-C 3.56Å; T587-Q589 PolarHBondContact O-N 3.36Å; T587-Q589 PolarHBondContact OG1-OE1 2.87Å; Q589-W591 VanDerWaalsContact C-N 3.33Å; Q589-W591 PolarHBondContact O-N 2.93Å; Q589-L592 PolarHBondContact O-N 3.36Å; Q589-F593 WeakPolarHBondContact O-CB 3.21Å; Q589-F593 PolarHBondContact O-N 3.23Å
590	N	47.6	Very low	46.1	Very low	92 Å²	92	98.3 Å²	98.3	49%	0.492	47%	0.47	S	S	.	.	H	α-helix	trans	-63.8	-40.4	-175.7	-73.7	0.5	0	0	0	111.2	T587 F593 I594	T587-N590 PolarHBondContact O-N 3.42Å; N590-F593 PolarHBondContact O-N 3.24Å; N590-I594 WeakPolarHBondContact O-CB 3.43Å; N590-I594 WeakPolarHBondContact O-CD1 3.48Å; N590-I594 VanDerWaalsContact O-CG1 3.24Å; N590-I594 WeakPolarHBondContact O-CG1 3.5Å; N590-I594 PolarHBondContact O-N 3.15Å
591	W	53.2	Low	47.1	Very low	51 Å²	51	90.6 Å²	90.6	19%	0.193	44%	0.443	C	S	.	.	H	α-helix	trans	-63.2	-45.5	173.5	-83.3	108.3	0	0	0	112.5	R148 T587 Q589 F593 I594 E595	R148-W591 HydrophobicContact CB-CH2 4.28Å; R148-W591 HydrophobicContact CG-CH2 4.11Å; T587-W591 PolarHBondContact O-N 3.29Å; Q589-W591 VanDerWaalsContact C-N 3.33Å; Q589-W591 PolarHBondContact O-N 2.93Å; W591-F593 VanDerWaalsContact C-N 3.3Å; W591-F593 PolarHBondContact O-N 3.23Å; W591-I594 PolarHBondContact O-N 3.36Å; W591-E595 WeakPolarHBondContact O-CB 2.95Å; W591-E595 WeakPolarHBondContact O-CG 3.28Å; W591-E595 PolarHBondContact O-N 3.46Å
592	L	50.4	Low	48.3	Very low	43 Å²	43	86.2 Å²	86.2	23%	0.225	42%	0.42	C	S	.	.	H	α-helix	trans	-65.3	-34.7	177.4	-165.5	141.2	0	0	0	111.9	Y449 F453 R588 Q589 M596	Y449-L592 HydrophobicContact CE1-CD1 3.73Å; Y449-L592 WeakPolarHBondContact OH-CD1 3.43Å; F453-L592 HydrophobicContact CD1-CD1 4.35Å; F453-L592 HydrophobicContact CE1-CD1 4.28Å; F453-L592 HydrophobicContact CE1-CD2 4.19Å; F453-L592 HydrophobicContact CE1-CG 4.34Å; F453-L592 HydrophobicContact CZ-CD2 4.39Å; R588-L592 WeakPolarHBondContact O-CB 3.47Å; R588-L592 PolarHBondContact O-N 3.03Å; Q589-L592 PolarHBondContact O-N 3.36Å; L592-M596 HydrophobicContact CD2-CG 4.05Å; L592-M596 VanDerWaalsContact O-CB 3.29Å; L592-M596 WeakPolarHBondContact O-CB 3.36Å; L592-M596 WeakPolarHBondContact O-CG 3.22Å; L592-M596 PolarHBondContact O-N 2.88Å
593	F	49.6	Very low	49.1	Very low	141 Å²	141	82.6 Å²	82.6	62%	0.618	40%	0.398	S	S	*	.	H	α-helix	trans	-69.2	-42.2	175.5	-156.6	-98.4	0	0	0	111.9	Q589 N590 W591 M596 N597	Q589-F593 WeakPolarHBondContact O-CB 3.21Å; Q589-F593 PolarHBondContact O-N 3.23Å; N590-F593 PolarHBondContact O-N 3.24Å; W591-F593 VanDerWaalsContact C-N 3.3Å; W591-F593 PolarHBondContact O-N 3.23Å; F593-M596 PolarHBondContact O-N 3.5Å; F593-N597 WeakPolarHBondContact CD1-ND2 3.34Å; F593-N597 WeakPolarHBondContact CE1-ND2 3.36Å; F593-N597 PolarHBondContact O-N 2.83Å; F593-N597 PolarHBondContact O-ND2 3.38Å
594	I	54	Low	49.9	Very low	69 Å²	69	79.5 Å²	79.5	35%	0.354	38%	0.382	S	S	.	.	H	α-helix	trans	-63.8	-45.2	175.1	-69.5	163.7	0	0	0	110.7	I144 N590 W591 N597 Y598	I144-I594 HydrophobicContact CD1-CG2 4.05Å; I144-I594 HydrophobicContact CG1-CG2 4.45Å; I144-I594 HydrophobicContact CG2-CG2 3.97Å; N590-I594 WeakPolarHBondContact O-CB 3.43Å; N590-I594 WeakPolarHBondContact O-CD1 3.48Å; N590-I594 VanDerWaalsContact O-CG1 3.24Å; N590-I594 WeakPolarHBondContact O-CG1 3.5Å; N590-I594 PolarHBondContact O-N 3.15Å; W591-I594 PolarHBondContact O-N 3.36Å; I594-N597 PolarHBondContact O-N 3.01Å; I594-Y598 WeakPolarHBondContact O-CB 3.39Å; I594-Y598 PolarHBondContact O-N 3.44Å
595	E	53.7	Low	51	Low	28 Å²	28	73.9 Å²	73.9	13%	0.131	35%	0.353	C	S	.	.	H	α-helix	trans	-67.2	-35.6	177.9	-72.1	-179.7	156.4	0	0	112.9	R148 R541 W591 Y598 L599	R148-E595 IonicContact NH2-OE1 3.68Å; R541-E595 IonicContact CZ-OE2 3.8Å; R541-E595 IonicContact NH1-OE1 2.63Å; R541-E595 IonicContact NH1-OE2 2.71Å; R541-E595 PolarHBondContact NH1-OE2 3.21Å; R541-E595 IonicContact NH2-OE2 3.4Å; R541-E595 PolarHBondContact NH2-OE2 3.48Å; W591-E595 WeakPolarHBondContact O-CB 2.95Å; W591-E595 WeakPolarHBondContact O-CG 3.28Å; W591-E595 PolarHBondContact O-N 3.46Å; E595-Y598 PolarHBondContact O-N 2.89Å; E595-L599 PolarHBondContact O-N 3.33Å
596	M	53.3	Low	52	Low	88 Å²	88	66.5 Å²	66.5	43%	0.433	33%	0.327	S	S	.	.	H	α-helix	trans	-67.9	-40.6	174	-76.8	-70.4	-86.7	0	0	112.1	F453 L592 F593 Y598 L599 F600	F453-M596 HydrophobicContact CE1-CE 4.37Å; F453-M596 HydrophobicContact CE1-CG 4.3Å; F453-M596 HydrophobicContact CE1-SD 3.76Å; L592-M596 HydrophobicContact CD2-CG 4.05Å; L592-M596 VanDerWaalsContact O-CB 3.29Å; L592-M596 WeakPolarHBondContact O-CB 3.36Å; L592-M596 WeakPolarHBondContact O-CG 3.22Å; L592-M596 PolarHBondContact O-N 2.88Å; F593-M596 PolarHBondContact O-N 3.5Å; M596-Y598 VanDerWaalsContact C-N 3.32Å; M596-L599 PolarHBondContact O-N 2.92Å; M596-F600 VanDerWaalsContact O-CB 3.24Å; M596-F600 WeakPolarHBondContact O-CB 3.47Å; M596-F600 PolarHBondContact O-N 3.37Å
597	N	54	Low	52.4	Low	86 Å²	86	67 Å²	67	46%	0.46	33%	0.325	S	S	.	.	H	α-helix	trans	-65.1	-36.8	172.8	-79.4	-74.4	0	0	0	111.9	F593 I594 G601	F593-N597 WeakPolarHBondContact CD1-ND2 3.34Å; F593-N597 WeakPolarHBondContact CE1-ND2 3.36Å; F593-N597 PolarHBondContact O-N 2.83Å; F593-N597 PolarHBondContact O-ND2 3.38Å; I594-N597 PolarHBondContact O-N 3.01Å; N597-G601 PolarHBondContact O-N 3.23Å
598	Y	57.2	Low	52.7	Low	51 Å²	51	67.9 Å²	67.9	20%	0.2	33%	0.326	C	S	.	.	H	α-helix	trans	-63.2	-50	174.2	176.9	-92	0	0	0	112	I141 I594 E595 M596 F600 G601 D602	I141-Y598 HydrophobicContact CD1-CE2 4.08Å; I141-Y598 HydrophobicContact CG1-CE2 3.7Å; I594-Y598 WeakPolarHBondContact O-CB 3.39Å; I594-Y598 PolarHBondContact O-N 3.44Å; E595-Y598 PolarHBondContact O-N 2.89Å; M596-Y598 VanDerWaalsContact C-N 3.32Å; Y598-F600 VanDerWaalsContact C-N 3.35Å; Y598-F600 PolarHBondContact O-N 2.86Å; Y598-G601 PolarHBondContact O-N 3.45Å; Y598-D602 WeakPolarHBondContact CE1-OD2 3.21Å; Y598-D602 PolarHBondContact O-N 3.47Å; Y598-D602 PolarHBondContact OH-OD2 3.24Å
599	L	54.8	Low	53	Low	30 Å²	30	63.3 Å²	63.3	16%	0.157	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-42.6	175.9	-81.2	169.2	0	0	0	112.4	H457 P461 E595 M596 G601 F603	H457-L599 HydrophobicContact CB-CD1 4.19Å; P461-L599 HydrophobicContact CG-CD2 4.13Å; E595-L599 PolarHBondContact O-N 3.33Å; M596-L599 PolarHBondContact O-N 2.92Å; L599-G601 VanDerWaalsContact C-N 3.34Å; L599-F603 VanDerWaalsContact O-CB 3.26Å; L599-F603 WeakPolarHBondContact O-CB 3.39Å; L599-F603 PolarHBondContact O-N 2.77Å
600	F	53.5	Low	53.2	Low	124 Å²	124	62.5 Å²	62.5	54%	0.544	31%	0.311	S	S	.	.	H	α-helix	trans	-66.2	-37.3	177.4	-171.2	-112.5	0	0	0	111.7	M596 Y598 L604	M596-F600 VanDerWaalsContact O-CB 3.24Å; M596-F600 WeakPolarHBondContact O-CB 3.47Å; M596-F600 PolarHBondContact O-N 3.37Å; Y598-F600 VanDerWaalsContact C-N 3.35Å; Y598-F600 PolarHBondContact O-N 2.86Å; F600-L604 HydrophobicContact CD1-CD1 3.75Å; F600-L604 HydrophobicContact CD1-CG 4.4Å; F600-L604 HydrophobicContact CE1-CD1 3.42Å; F600-L604 VanDerWaalsContact CE1-CD1 3.42Å; F600-L604 HydrophobicContact CE1-CG 4.17Å; F600-L604 HydrophobicContact CG-CD1 4.48Å; F600-L604 HydrophobicContact CZ-CD1 3.89Å; F600-L604 HydrophobicContact CZ-CD2 4.48Å; F600-L604 HydrophobicContact CZ-CG 4.24Å; F600-L604 WeakPolarHBondContact O-CB 3.41Å; F600-L604 WeakPolarHBondContact O-CG 3.02Å; F600-L604 PolarHBondContact O-N 3.19Å
601	G	51.9	Low	53.2	Low	24 Å²	24	60.7 Å²	60.7	25%	0.247	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-58	171.4	0	0	0	0	0	112.3	N597 Y598 L599 F603 L604 I605	N597-G601 PolarHBondContact O-N 3.23Å; Y598-G601 PolarHBondContact O-N 3.45Å; L599-G601 VanDerWaalsContact C-N 3.34Å; G601-F603 VanDerWaalsContact C-N 3.26Å; G601-F603 PolarHBondContact O-N 2.97Å; G601-L604 PolarHBondContact O-N 3.14Å; G601-L604 VanDerWaalsContact O-N 3.14Å; G601-I605 WeakPolarHBondContact O-CB 3.32Å; G601-I605 VanDerWaalsContact O-CD1 3.28Å; G601-I605 WeakPolarHBondContact O-CD1 3.36Å; G601-I605 VanDerWaalsContact O-CG1 3.25Å; G601-I605 WeakPolarHBondContact O-CG1 3.44Å; G601-I605 PolarHBondContact O-N 3.36Å
602	D	55.9	Low	53.1	Low	50 Å²	50	61.6 Å²	61.6	27%	0.267	31%	0.313	S	S	.	.	H	α-helix	trans	-57	-39.3	178.7	-96.3	-7.5	0	0	0	111.8	Y598 Q606	Y598-D602 WeakPolarHBondContact CE1-OD2 3.21Å; Y598-D602 PolarHBondContact O-N 3.47Å; Y598-D602 PolarHBondContact OH-OD2 3.24Å; D602-Q606 WeakPolarHBondContact O-CB 3.41Å; D602-Q606 VanDerWaalsContact O-CG 3.25Å; D602-Q606 WeakPolarHBondContact O-CG 3.45Å; D602-Q606 PolarHBondContact O-N 2.8Å
603	F	52.3	Low	53.1	Low	54 Å²	54	62.8 Å²	62.8	24%	0.237	32%	0.32	C	S	.	.	H	α-helix	trans	-63.6	-50.1	174	178.8	-96.2	0	0	0	112.4	I385 I460 T464 L599 G601 I605 Q606 L607	I385-F603 HydrophobicContact CD1-CZ 4.17Å; I460-F603 HydrophobicContact CG2-CD2 4.38Å; T464-F603 HydrophobicContact CG2-CD2 3.87Å; T464-F603 HydrophobicContact CG2-CE2 3.84Å; L599-F603 VanDerWaalsContact O-CB 3.26Å; L599-F603 WeakPolarHBondContact O-CB 3.39Å; L599-F603 PolarHBondContact O-N 2.77Å; G601-F603 VanDerWaalsContact C-N 3.26Å; G601-F603 PolarHBondContact O-N 2.97Å; F603-I605 VanDerWaalsContact C-N 3.32Å; F603-I605 PolarHBondContact O-N 2.85Å; F603-Q606 PolarHBondContact O-N 2.85Å; F603-L607 HydrophobicContact CE1-CD1 4.42Å; F603-L607 HydrophobicContact CZ-CD1 4.27Å; F603-L607 WeakPolarHBondContact O-CB 3.49Å; F603-L607 PolarHBondContact O-N 3.14Å
604	L	51.4	Low	53	Low	64 Å²	64	59.7 Å²	59.7	34%	0.335	31%	0.309	S	S	.	.	H	α-helix	trans	-61	-40.2	177.9	-80.8	177	0	0	0	111.9	F600 G601 L607 I608	F600-L604 HydrophobicContact CD1-CD1 3.75Å; F600-L604 HydrophobicContact CD1-CG 4.4Å; F600-L604 HydrophobicContact CE1-CD1 3.42Å; F600-L604 VanDerWaalsContact CE1-CD1 3.42Å; F600-L604 HydrophobicContact CE1-CG 4.17Å; F600-L604 HydrophobicContact CG-CD1 4.48Å; F600-L604 HydrophobicContact CZ-CD1 3.89Å; F600-L604 HydrophobicContact CZ-CD2 4.48Å; F600-L604 HydrophobicContact CZ-CG 4.24Å; F600-L604 WeakPolarHBondContact O-CB 3.41Å; F600-L604 WeakPolarHBondContact O-CG 3.02Å; F600-L604 PolarHBondContact O-N 3.19Å; G601-L604 PolarHBondContact O-N 3.14Å; G601-L604 VanDerWaalsContact O-N 3.14Å; L604-L607 WeakPolarHBondContact O-CB 3.21Å; L604-L607 PolarHBondContact O-N 3.09Å; L604-I608 WeakPolarHBondContact O-CB 3.41Å; L604-I608 WeakPolarHBondContact O-CD1 3.28Å; L604-I608 WeakPolarHBondContact O-CG1 3.49Å; L604-I608 PolarHBondContact O-N 3.32Å
605	I	56.2	Low	52.4	Low	27 Å²	27	60.7 Å²	60.7	14%	0.138	32%	0.321	C	S	.	.	H	α-helix	trans	-64.7	-44.9	178.2	-68.1	154.3	0	0	0	110.5	L133 N137 G601 F603 L607 I608 I609	L133-I605 HydrophobicContact CD2-CG1 4.06Å; N137-I605 WeakPolarHBondContact ND2-CD1 3.32Å; G601-I605 WeakPolarHBondContact O-CB 3.32Å; G601-I605 VanDerWaalsContact O-CD1 3.28Å; G601-I605 WeakPolarHBondContact O-CD1 3.36Å; G601-I605 VanDerWaalsContact O-CG1 3.25Å; G601-I605 WeakPolarHBondContact O-CG1 3.44Å; G601-I605 PolarHBondContact O-N 3.36Å; F603-I605 VanDerWaalsContact C-N 3.32Å; F603-I605 PolarHBondContact O-N 2.85Å; I605-L607 VanDerWaalsContact C-N 3.33Å; I605-L607 PolarHBondContact O-N 3.26Å; I605-I608 PolarHBondContact O-N 3.38Å; I605-I609 HydrophobicContact CG2-CD1 3.75Å; I605-I609 HydrophobicContact CG2-CG1 4.48Å; I605-I609 WeakPolarHBondContact O-CB 3.35Å; I605-I609 WeakPolarHBondContact O-CD1 3.06Å; I605-I609 VanDerWaalsContact O-CG1 3.23Å; I605-I609 WeakPolarHBondContact O-CG1 3.47Å; I605-I609 PolarHBondContact O-N 3.1Å
606	Q	57.1	Low	52.2	Low	32 Å²	32	62.3 Å²	62.3	15%	0.15	33%	0.331	C	S	.	.	H	α-helix	trans	-62.6	-40	174.4	-70.9	173	30.6	0	0	111.7	T464 D602 F603 L610	T464-Q606 PolarHBondContact OG1-OE1 3.44Å; D602-Q606 WeakPolarHBondContact O-CB 3.41Å; D602-Q606 VanDerWaalsContact O-CG 3.25Å; D602-Q606 WeakPolarHBondContact O-CG 3.45Å; D602-Q606 PolarHBondContact O-N 2.8Å; F603-Q606 PolarHBondContact O-N 2.85Å; Q606-L610 VanDerWaalsContact O-CB 3.23Å; Q606-L610 WeakPolarHBondContact O-CB 2.81Å; Q606-L610 PolarHBondContact O-N 3.19Å
607	L	51.1	Low	51.9	Low	81 Å²	81	60.7 Å²	60.7	42%	0.424	33%	0.326	S	S	.	.	H	α-helix	trans	-64.7	-40.7	175.9	-163.1	90.8	0	0	0	112.2	F603 L604 I605 L610 S611	F603-L607 HydrophobicContact CE1-CD1 4.42Å; F603-L607 HydrophobicContact CZ-CD1 4.27Å; F603-L607 WeakPolarHBondContact O-CB 3.49Å; F603-L607 PolarHBondContact O-N 3.14Å; L604-L607 WeakPolarHBondContact O-CB 3.21Å; L604-L607 PolarHBondContact O-N 3.09Å; I605-L607 VanDerWaalsContact C-N 3.33Å; I605-L607 PolarHBondContact O-N 3.26Å; L607-L610 PolarHBondContact O-N 3.46Å; L607-S611 WeakPolarHBondContact O-CB 3.45Å; L607-S611 PolarHBondContact O-N 2.9Å; L607-S611 PolarHBondContact O-OG 3.46Å
608	I	53.7	Low	51.2	Low	78 Å²	78	59.8 Å²	59.8	40%	0.4	32%	0.321	S	S	.	.	H	α-helix	trans	-68.5	-45.1	177.2	-71.6	163.4	0	0	0	110.7	L604 I605 L610 S611 I612	L604-I608 WeakPolarHBondContact O-CB 3.41Å; L604-I608 WeakPolarHBondContact O-CD1 3.28Å; L604-I608 WeakPolarHBondContact O-CG1 3.49Å; L604-I608 PolarHBondContact O-N 3.32Å; I605-I608 PolarHBondContact O-N 3.38Å; I608-L610 VanDerWaalsContact C-N 3.26Å; I608-L610 PolarHBondContact O-N 3.01Å; I608-S611 PolarHBondContact O-N 3.31Å; I608-S611 PolarHBondContact O-OG 3.26Å; I608-I612 HydrophobicContact CG2-CD1 3.71Å; I608-I612 HydrophobicContact CG2-CG1 4.41Å; I608-I612 WeakPolarHBondContact O-CB 3.38Å; I608-I612 VanDerWaalsContact O-CG1 3.28Å; I608-I612 WeakPolarHBondContact O-CG1 3.45Å; I608-I612 PolarHBondContact O-N 3.43Å
609	I	54.8	Low	50.3	Low	64 Å²	64	63.1 Å²	63.1	33%	0.328	34%	0.338	S	S	.	.	H	α-helix	trans	-59.8	-40.6	174.1	-69	164.3	0	0	0	110.2	F130 I605 N613	F130-I609 HydrophobicContact CD2-CD1 4.47Å; F130-I609 HydrophobicContact CE2-CD1 3.9Å; F130-I609 HydrophobicContact CE2-CG1 4.41Å; I605-I609 HydrophobicContact CG2-CD1 3.75Å; I605-I609 HydrophobicContact CG2-CG1 4.48Å; I605-I609 WeakPolarHBondContact O-CB 3.35Å; I605-I609 WeakPolarHBondContact O-CD1 3.06Å; I605-I609 VanDerWaalsContact O-CG1 3.23Å; I605-I609 WeakPolarHBondContact O-CG1 3.47Å; I605-I609 PolarHBondContact O-N 3.1Å; I609-N613 VanDerWaalsContact O-CB 3.27Å; I609-N613 WeakPolarHBondContact O-CB 3.3Å; I609-N613 PolarHBondContact O-N 2.9Å; I609-N613 VanDerWaalsContact O-N 3.15Å; I609-N613 PolarHBondContact O-ND2 3.31Å
610	L	50.3	Low	49.6	Very low	36 Å²	36	64.6 Å²	64.6	19%	0.188	35%	0.346	C	S	.	.	H	α-helix	trans	-67.2	-43.4	176.9	-177.3	61.8	0	0	0	112.1	T468 L471 Q606 L607 I608 N613 L614	T468-L610 HydrophobicContact CG2-CD1 4.37Å; T468-L610 HydrophobicContact CG2-CD2 4.49Å; L471-L610 HydrophobicContact CD1-CD1 3.82Å; L471-L610 HydrophobicContact CD1-CD2 3.96Å; L471-L610 HydrophobicContact CD1-CG 4.46Å; Q606-L610 VanDerWaalsContact O-CB 3.23Å; Q606-L610 WeakPolarHBondContact O-CB 2.81Å; Q606-L610 PolarHBondContact O-N 3.19Å; L607-L610 PolarHBondContact O-N 3.46Å; I608-L610 VanDerWaalsContact C-N 3.26Å; I608-L610 PolarHBondContact O-N 3.01Å; L610-N613 PolarHBondContact O-N 3Å; L610-L614 HydrophobicContact CD1-CD1 3.87Å; L610-L614 HydrophobicContact CD1-CG 4.12Å; L610-L614 HydrophobicContact CD2-CD1 4.45Å; L610-L614 HydrophobicContact CG-CD1 3.77Å; L610-L614 HydrophobicContact CG-CG 4.41Å; L610-L614 WeakPolarHBondContact O-CB 2.9Å; L610-L614 VanDerWaalsContact O-CG 3.29Å; L610-L614 WeakPolarHBondContact O-CG 3.48Å; L610-L614 PolarHBondContact O-N 3.32Å
611	S	47.8	Very low	49.1	Very low	53 Å²	53	62.3 Å²	62.3	37%	0.371	34%	0.339	S	S	.	.	H	α-helix	trans	-67.7	-44.7	-178.7	70.3	0	0	0	0	112.2	L607 I608 N613 L614 C615	L607-S611 WeakPolarHBondContact O-CB 3.45Å; L607-S611 PolarHBondContact O-N 2.9Å; L607-S611 PolarHBondContact O-OG 3.46Å; I608-S611 PolarHBondContact O-N 3.31Å; I608-S611 PolarHBondContact O-OG 3.26Å; S611-N613 VanDerWaalsContact C-N 3.3Å; S611-N613 PolarHBondContact O-N 3.5Å; S611-L614 PolarHBondContact O-N 3.43Å; S611-C615 WeakPolarHBondContact O-CB 3.29Å; S611-C615 PolarHBondContact O-N 2.87Å; S611-C615 PolarHBondContact O-SG 2.9Å
612	I	51.4	Low	48.6	Very low	70 Å²	70	67.2 Å²	67.2	36%	0.359	36%	0.358	S	S	.	.	H	α-helix	trans	-57.9	-45.7	173.6	-66.5	168.4	0	0	0	110	I608 L614	I608-I612 HydrophobicContact CG2-CD1 3.71Å; I608-I612 HydrophobicContact CG2-CG1 4.41Å; I608-I612 WeakPolarHBondContact O-CB 3.38Å; I608-I612 VanDerWaalsContact O-CG1 3.28Å; I608-I612 WeakPolarHBondContact O-CG1 3.45Å; I608-I612 PolarHBondContact O-N 3.43Å; I612-L614 PolarHBondContact O-N 3.34Å
613	N	50.4	Low	47.7	Very low	69 Å²	69	72 Å²	72	37%	0.369	37%	0.373	S	S	.	.	H	α-helix	trans	-68.1	-31.2	179.2	-85.7	-60.4	0	0	0	114.3	R475 I609 L610 S611	R475-N613 PolarHBondContact NH1-O 3.38Å; R475-N613 PolarHBondContact NH2-O 2.85Å; I609-N613 VanDerWaalsContact O-CB 3.27Å; I609-N613 WeakPolarHBondContact O-CB 3.3Å; I609-N613 PolarHBondContact O-N 2.9Å; I609-N613 VanDerWaalsContact O-N 3.15Å; I609-N613 PolarHBondContact O-ND2 3.31Å; L610-N613 PolarHBondContact O-N 3Å; S611-N613 VanDerWaalsContact C-N 3.3Å; S611-N613 PolarHBondContact O-N 3.5Å
614	L	47	Very low	47.4	Very low	76 Å²	76	73.7 Å²	73.7	40%	0.398	38%	0.384	S	S	.	.	H	α-helix	trans	-81.1	-38.9	179.3	-78	170.7	0	0	0	113.1	L610 S611 I612 N618	L610-L614 HydrophobicContact CD1-CD1 3.87Å; L610-L614 HydrophobicContact CD1-CG 4.12Å; L610-L614 HydrophobicContact CD2-CD1 4.45Å; L610-L614 HydrophobicContact CG-CD1 3.77Å; L610-L614 HydrophobicContact CG-CG 4.41Å; L610-L614 WeakPolarHBondContact O-CB 2.9Å; L610-L614 VanDerWaalsContact O-CG 3.29Å; L610-L614 WeakPolarHBondContact O-CG 3.48Å; L610-L614 PolarHBondContact O-N 3.32Å; S611-L614 PolarHBondContact O-N 3.43Å; I612-L614 PolarHBondContact O-N 3.34Å; L614-N618 PolarHBondContact O-ND2 3Å
615	C	42.6	Very low	46.9	Very low	90 Å²	90	75 Å²	75	61%	0.608	39%	0.385	S	S	*	.	H	α-helix	trans	-72.3	-45	-173.3	-75.5	0	0	0	0	113.1	S611	S611-C615 WeakPolarHBondContact O-CB 3.29Å; S611-C615 PolarHBondContact O-N 2.87Å; S611-C615 PolarHBondContact O-SG 2.9Å
616	D	49	Very low	46.2	Very low	61 Å²	61	76.9 Å²	76.9	33%	0.326	40%	0.4	S	S	.	.	H	α-helix	trans	-73.4	-38.5	-164.3	-117.6	-12.7	0	0	0	114	N618 H619 L620	D616-N618 PolarHBondContact O-N 2.82Å; D616-H619 PolarHBondContact O-N 3.45Å; D616-L620 WeakPolarHBondContact O-CB 3.28Å; D616-L620 PolarHBondContact O-N 3.43Å; D616-L620 VanDerWaalsContact O-N 3.08Å
617	T	47.7	Very low	45.5	Very low	55 Å²	55	79.2 Å²	79.2	34%	0.337	41%	0.413	S	S	.	.	H	α-helix	trans	-69.4	-32.4	-177.4	35.6	0	0	0	0	114.5	R475 L621	R475-T617 PolarHBondContact NH2-OG1 3.31Å; T617-L621 WeakPolarHBondContact O-CB 3.39Å; T617-L621 PolarHBondContact O-N 3.18Å; T617-L621 VanDerWaalsContact O-N 3.13Å
618	N	39.5	Very low	45.4	Very low	67 Å²	67	80 Å²	80	36%	0.358	41%	0.414	S	S	.	.	H	α-helix	trans	-69.9	-38.5	178.8	-69.7	-51.7	0	0	0	110.9	K478 L614 D616 I622	K478-N618 PolarHBondContact NZ-OD1 3.48Å; L614-N618 PolarHBondContact O-ND2 3Å; D616-N618 PolarHBondContact O-N 2.82Å; N618-I622 WeakPolarHBondContact O-CD1 3.19Å; N618-I622 VanDerWaalsContact O-CG1 3.27Å; N618-I622 WeakPolarHBondContact O-CG1 3.32Å; N618-I622 PolarHBondContact O-N 3.24Å
619	H	38.7	Very low	45	Very low	121 Å²	121	79.1 Å²	79.1	56%	0.56	41%	0.411	S	S	*	.	H	α-helix	trans	-73.2	-37.2	179.5	-165.6	-77.6	0	0	0	112.3	D616 R623	D616-H619 PolarHBondContact O-N 3.45Å; H619-R623 WeakPolarHBondContact O-CB 3.5Å; H619-R623 PolarHBondContact O-N 2.96Å
620	L	40	Very low	44.2	Very low	61 Å²	61	83.7 Å²	83.7	32%	0.319	43%	0.428	S	S	.	.	H	α-helix	trans	-69.8	-41.8	177.5	-98.8	151.3	0	0	0	113.4	Y119 D616 R623 N624	Y119-L620 HydrophobicContact CD2-CD1 4.37Å; Y119-L620 HydrophobicContact CE2-CD1 4.36Å; D616-L620 WeakPolarHBondContact O-CB 3.28Å; D616-L620 PolarHBondContact O-N 3.43Å; D616-L620 VanDerWaalsContact O-N 3.08Å; L620-R623 PolarHBondContact O-N 3.36Å; L620-N624 VanDerWaalsContact O-CB 3.32Å; L620-N624 WeakPolarHBondContact O-CB 3.42Å; L620-N624 PolarHBondContact O-N 3.12Å
621	L	41.8	Very low	44	Very low	76 Å²	76	87.4 Å²	87.4	40%	0.398	45%	0.445	S	S	.	.	H	α-helix	trans	-63.1	-45.6	176.4	-111.6	151.3	0	0	0	111.5	I486 T617 Y625	I486-L621 HydrophobicContact CD1-CD2 4.21Å; T617-L621 WeakPolarHBondContact O-CB 3.39Å; T617-L621 PolarHBondContact O-N 3.18Å; T617-L621 VanDerWaalsContact O-N 3.13Å; L621-Y625 WeakPolarHBondContact O-CB 3.44Å; L621-Y625 PolarHBondContact O-N 3.49Å
622	I	40.9	Very low	44.2	Very low	126 Å²	126	88.8 Å²	88.8	65%	0.646	44%	0.444	S	S	*	.	H	α-helix	trans	-65.6	-42.6	178.9	-66.6	170.7	0	0	0	111.2	N618 S626	N618-I622 WeakPolarHBondContact O-CD1 3.19Å; N618-I622 VanDerWaalsContact O-CG1 3.27Å; N618-I622 WeakPolarHBondContact O-CG1 3.32Å; N618-I622 PolarHBondContact O-N 3.24Å; I622-S626 PolarHBondContact O-N 3.46Å
623	R	38.9	Very low	44.1	Very low	152 Å²	152	90.2 Å²	90.2	57%	0.574	45%	0.451	S	S	*	.	H	α-helix	trans	-73.6	-38.5	-177.7	-169.4	173.5	-174.5	168.3	4.3	113.1	H619 L620 S626 I627	H619-R623 WeakPolarHBondContact O-CB 3.5Å; H619-R623 PolarHBondContact O-N 2.96Å; L620-R623 PolarHBondContact O-N 3.36Å; R623-S626 PolarHBondContact O-OG 3.34Å; R623-S626 VanDerWaalsContact O-OG 3.1Å; R623-I627 HydrophobicContact CG-CD1 3.9Å; R623-I627 WeakPolarHBondContact O-CB 3.49Å; R623-I627 WeakPolarHBondContact O-CD1 3.37Å; R623-I627 WeakPolarHBondContact O-CG1 3.43Å; R623-I627 PolarHBondContact O-N 2.99Å
624	N	44	Very low	43.7	Very low	89 Å²	89	93.4 Å²	93.4	48%	0.476	46%	0.459	S	S	.	.	H	α-helix	trans	-71.4	-38.1	176	-70.4	-3.8	0	0	0	111.2	L620 S626 I627 E628	L620-N624 VanDerWaalsContact O-CB 3.32Å; L620-N624 WeakPolarHBondContact O-CB 3.42Å; L620-N624 PolarHBondContact O-N 3.12Å; N624-S626 VanDerWaalsContact C-N 3.34Å; N624-S626 PolarHBondContact O-N 2.81Å; N624-I627 PolarHBondContact O-N 2.88Å; N624-E628 PolarHBondContact O-N 2.96Å
625	Y	41.5	Very low	43.9	Very low	92 Å²	92	93.9 Å²	93.9	36%	0.361	46%	0.462	S	S	.	.	H	α-helix	trans	-67.9	-32.2	175.7	-163.1	-97.4	0	0	0	112.7	I486 L621 N629	I486-Y625 HydrophobicContact CG1-CE2 4.26Å; L621-Y625 WeakPolarHBondContact O-CB 3.44Å; L621-Y625 PolarHBondContact O-N 3.49Å; Y625-N629 VanDerWaalsContact CD1-ND2 3.35Å; Y625-N629 WeakPolarHBondContact CD1-ND2 3.29Å; Y625-N629 WeakPolarHBondContact CE1-ND2 3.5Å; Y625-N629 WeakPolarHBondContact O-CB 3.34Å; Y625-N629 PolarHBondContact O-N 2.9Å; Y625-N629 PolarHBondContact O-ND2 3.28Å
626	S	41.8	Very low	44.5	Very low	65 Å²	65	92.1 Å²	92.1	46%	0.455	45%	0.45	S	S	.	.	H	α-helix	trans	-70.8	-43.2	171.3	79.1	0	0	0	0	111.6	I622 R623 N624 N629 F630	I622-S626 PolarHBondContact O-N 3.46Å; R623-S626 PolarHBondContact O-OG 3.34Å; R623-S626 VanDerWaalsContact O-OG 3.1Å; N624-S626 VanDerWaalsContact C-N 3.34Å; N624-S626 PolarHBondContact O-N 2.81Å; S626-N629 PolarHBondContact O-N 2.94Å; S626-F630 WeakPolarHBondContact O-CB 3.45Å; S626-F630 PolarHBondContact O-N 3.03Å
627	I	43.1	Very low	44.4	Very low	81 Å²	81	92.8 Å²	92.8	42%	0.415	45%	0.454	S	S	.	.	H	α-helix	trans	-66.7	-45.2	-179.2	-68.8	167.2	0	0	0	112	R623 N624 N629 F630 Q631	R623-I627 HydrophobicContact CG-CD1 3.9Å; R623-I627 WeakPolarHBondContact O-CB 3.49Å; R623-I627 WeakPolarHBondContact O-CD1 3.37Å; R623-I627 WeakPolarHBondContact O-CG1 3.43Å; R623-I627 PolarHBondContact O-N 2.99Å; N624-I627 PolarHBondContact O-N 2.88Å; I627-N629 PolarHBondContact O-N 3.48Å; I627-F630 PolarHBondContact O-N 2.99Å; I627-Q631 VanDerWaalsContact O-CB 3.23Å; I627-Q631 WeakPolarHBondContact O-CB 3.32Å; I627-Q631 PolarHBondContact O-N 2.77Å
628	E	48.7	Very low	44.9	Very low	97 Å²	97	93.3 Å²	93.3	45%	0.453	45%	0.454	S	S	.	.	H	α-helix	trans	-65.1	-37.6	177.7	-79.3	-162.3	161.8	0	0	112.6	N624 Q631 K632	N624-E628 PolarHBondContact O-N 2.96Å; E628-Q631 PolarHBondContact O-N 3.21Å; E628-K632 WeakPolarHBondContact O-CB 3.15Å; E628-K632 WeakPolarHBondContact O-CG 3.41Å; E628-K632 PolarHBondContact O-N 3.5Å
629	N	45.7	Very low	45.6	Very low	61 Å²	61	94.2 Å²	94.2	33%	0.326	46%	0.459	S	S	.	.	H	α-helix	trans	-68.5	-41.7	174.1	-78.6	-46.7	0	0	0	111.4	Y625 S626 I627 Q631 K632 I633	Y625-N629 VanDerWaalsContact CD1-ND2 3.35Å; Y625-N629 WeakPolarHBondContact CD1-ND2 3.29Å; Y625-N629 WeakPolarHBondContact CE1-ND2 3.5Å; Y625-N629 WeakPolarHBondContact O-CB 3.34Å; Y625-N629 PolarHBondContact O-N 2.9Å; Y625-N629 PolarHBondContact O-ND2 3.28Å; S626-N629 PolarHBondContact O-N 2.94Å; I627-N629 PolarHBondContact O-N 3.48Å; N629-Q631 VanDerWaalsContact C-N 3.31Å; N629-Q631 PolarHBondContact O-N 3.42Å; N629-K632 PolarHBondContact O-N 3.36Å; N629-I633 WeakPolarHBondContact O-CB 3.28Å; N629-I633 WeakPolarHBondContact O-CD1 3.47Å; N629-I633 WeakPolarHBondContact O-CG1 3.42Å; N629-I633 PolarHBondContact O-N 3.25Å
630	F	37.3	Very low	46.5	Very low	159 Å²	159	96.2 Å²	96.2	70%	0.697	46%	0.461	S	S	*	.	H	α-helix	trans	-61.3	-42.2	174.4	-137.9	-88.1	0	0	0	111.1	S626 I627 I633 Y634	S626-F630 WeakPolarHBondContact O-CB 3.45Å; S626-F630 PolarHBondContact O-N 3.03Å; I627-F630 PolarHBondContact O-N 2.99Å; F630-I633 PolarHBondContact O-N 2.93Å; F630-Y634 WeakPolarHBondContact O-CB 3.32Å; F630-Y634 PolarHBondContact O-N 2.73Å
631	Q	46.5	Very low	47.2	Very low	115 Å²	115	98.4 Å²	98.4	54%	0.537	47%	0.473	S	S	.	.	H	α-helix	trans	-70.6	-39	-179.8	-165.5	168.6	12	0	0	111.8	I627 E628 N629 Y634 L635	I627-Q631 VanDerWaalsContact O-CB 3.23Å; I627-Q631 WeakPolarHBondContact O-CB 3.32Å; I627-Q631 PolarHBondContact O-N 2.77Å; E628-Q631 PolarHBondContact O-N 3.21Å; N629-Q631 VanDerWaalsContact C-N 3.31Å; N629-Q631 PolarHBondContact O-N 3.42Å; Q631-Y634 PolarHBondContact O-N 3.43Å; Q631-L635 HydrophobicContact CG-CD1 3.85Å; Q631-L635 WeakPolarHBondContact O-CB 3.4Å; Q631-L635 WeakPolarHBondContact O-CD1 3.5Å; Q631-L635 PolarHBondContact O-N 3.2Å
632	K	52.6	Low	48.1	Very low	82 Å²	82	101.8 Å²	101.8	36%	0.357	49%	0.485	S	S	.	.	H	α-helix	trans	-66.2	-41.6	171.8	-80.1	174.7	176.8	164.4	0	112.6	E628 N629 S636	E628-K632 WeakPolarHBondContact O-CB 3.15Å; E628-K632 WeakPolarHBondContact O-CG 3.41Å; E628-K632 PolarHBondContact O-N 3.5Å; N629-K632 PolarHBondContact O-N 3.36Å; K632-S636 VanDerWaalsContact O-CB 3.28Å; K632-S636 WeakPolarHBondContact O-CB 3.4Å; K632-S636 PolarHBondContact O-N 3.38Å; K632-S636 PolarHBondContact O-OG 2.97Å
633	I	48.9	Very low	49.1	Very low	99 Å²	99	102.6 Å²	102.6	51%	0.508	49%	0.486	S	S	.	.	H	α-helix	trans	-65.8	-42.9	175.3	-69.2	164.9	0	0	0	110.3	N629 F630 S636 N637	N629-I633 WeakPolarHBondContact O-CB 3.28Å; N629-I633 WeakPolarHBondContact O-CD1 3.47Å; N629-I633 WeakPolarHBondContact O-CG1 3.42Å; N629-I633 PolarHBondContact O-N 3.25Å; F630-I633 PolarHBondContact O-N 2.93Å; I633-S636 PolarHBondContact O-N 3.43Å; I633-S636 PolarHBondContact O-OG 3.48Å; I633-S636 VanDerWaalsContact O-OG 3.05Å; I633-N637 WeakPolarHBondContact O-CB 3.21Å; I633-N637 VanDerWaalsContact O-CG 3.29Å; I633-N637 PolarHBondContact O-N 3.5Å
634	Y	40.8	Very low	50.3	Low	137 Å²	137	99.7 Å²	99.7	54%	0.537	48%	0.482	S	S	.	.	H	α-helix	trans	-67	-43.6	178.9	-170.6	-107	0	0	0	112.2	F630 Q631 N637 I638	F630-Y634 WeakPolarHBondContact O-CB 3.32Å; F630-Y634 PolarHBondContact O-N 2.73Å; Q631-Y634 PolarHBondContact O-N 3.43Å; Y634-N637 PolarHBondContact O-N 3.31Å; Y634-I638 HydrophobicContact CD1-CD1 3.69Å; Y634-I638 HydrophobicContact CE1-CD1 3.3Å; Y634-I638 HydrophobicContact CE1-CG1 4.42Å; Y634-I638 HydrophobicContact CE2-CD1 4.44Å; Y634-I638 HydrophobicContact CG-CD1 4.41Å; Y634-I638 WeakPolarHBondContact O-CB 3.43Å; Y634-I638 WeakPolarHBondContact O-CG1 3.15Å; Y634-I638 PolarHBondContact O-N 2.89Å
635	L	51	Low	50.9	Low	86 Å²	86	103.4 Å²	103.4	45%	0.45	49%	0.49	S	S	.	.	H	α-helix	trans	-68.4	-35.5	173.6	-93.9	130.2	0	0	0	113.1	Q631 I638 N639	Q631-L635 HydrophobicContact CG-CD1 3.85Å; Q631-L635 WeakPolarHBondContact O-CB 3.4Å; Q631-L635 WeakPolarHBondContact O-CD1 3.5Å; Q631-L635 PolarHBondContact O-N 3.2Å; L635-I638 PolarHBondContact O-N 2.97Å; L635-N639 WeakPolarHBondContact O-CB 3.26Å; L635-N639 PolarHBondContact O-N 3.48Å
636	S	55.7	Low	52.2	Low	52 Å²	52	105 Å²	105	36%	0.364	50%	0.501	S	S	.	.	H	α-helix	trans	-68.9	-37.6	175.6	76.1	0	0	0	0	111.6	K632 I633 N639 R640	K632-S636 VanDerWaalsContact O-CB 3.28Å; K632-S636 WeakPolarHBondContact O-CB 3.4Å; K632-S636 PolarHBondContact O-N 3.38Å; K632-S636 PolarHBondContact O-OG 2.97Å; I633-S636 PolarHBondContact O-N 3.43Å; I633-S636 PolarHBondContact O-OG 3.48Å; I633-S636 VanDerWaalsContact O-OG 3.05Å; S636-N639 PolarHBondContact O-N 3.28Å; S636-R640 WeakPolarHBondContact O-CB 3.46Å; S636-R640 WeakPolarHBondContact O-CG 3.4Å; S636-R640 PolarHBondContact O-N 2.77Å
637	N	47.9	Very low	53.4	Low	76 Å²	76	110.4 Å²	110.4	41%	0.406	51%	0.511	S	S	.	.	H	α-helix	trans	-69.2	-39.3	172.6	-73.4	-12.8	0	0	0	112.1	I633 Y634 N641	I633-N637 WeakPolarHBondContact O-CB 3.21Å; I633-N637 VanDerWaalsContact O-CG 3.29Å; I633-N637 PolarHBondContact O-N 3.5Å; Y634-N637 PolarHBondContact O-N 3.31Å; N637-N641 WeakPolarHBondContact O-CB 3.37Å; N637-N641 PolarHBondContact O-N 3.46Å; N637-N641 PolarHBondContact O-OD1 3.15Å
638	I	57.7	Low	54.5	Low	65 Å²	65	110.9 Å²	110.9	33%	0.333	51%	0.514	S	S	.	.	H	α-helix	trans	-64.1	-40.9	172.7	-76.3	174.2	0	0	0	111.4	Y634 L635 N641 K642	Y634-I638 HydrophobicContact CD1-CD1 3.69Å; Y634-I638 HydrophobicContact CE1-CD1 3.3Å; Y634-I638 HydrophobicContact CE1-CG1 4.42Å; Y634-I638 HydrophobicContact CE2-CD1 4.44Å; Y634-I638 HydrophobicContact CG-CD1 4.41Å; Y634-I638 WeakPolarHBondContact O-CB 3.43Å; Y634-I638 WeakPolarHBondContact O-CG1 3.15Å; Y634-I638 PolarHBondContact O-N 2.89Å; L635-I638 PolarHBondContact O-N 2.97Å; I638-N641 PolarHBondContact O-N 3.11Å; I638-K642 WeakPolarHBondContact O-CB 3.34Å; I638-K642 PolarHBondContact O-N 2.99Å
639	N	54.8	Low	55.4	Low	87 Å²	87	111.1 Å²	111.1	47%	0.465	52%	0.515	S	S	.	.	H	α-helix	trans	-72.1	-38.7	179.1	-75.9	-10.2	0	0	0	112.3	L635 S636 K642 Q643	L635-N639 WeakPolarHBondContact O-CB 3.26Å; L635-N639 PolarHBondContact O-N 3.48Å; S636-N639 PolarHBondContact O-N 3.28Å; N639-K642 PolarHBondContact O-N 3.34Å; N639-Q643 WeakPolarHBondContact O-CB 3.42Å; N639-Q643 WeakPolarHBondContact O-CG 3.23Å; N639-Q643 PolarHBondContact O-N 2.71Å
640	R	56.3	Low	56.6	Low	162 Å²	162	110.8 Å²	110.8	61%	0.611	52%	0.517	S	S	*	.	H	α-helix	trans	-61.9	-44.3	169.6	-78.5	178.4	175.2	176.3	-2.5	111.6	S636 Q643 N644	S636-R640 WeakPolarHBondContact O-CB 3.46Å; S636-R640 WeakPolarHBondContact O-CG 3.4Å; S636-R640 PolarHBondContact O-N 2.77Å; R640-Q643 PolarHBondContact O-N 3.49Å; R640-N644 WeakPolarHBondContact O-CB 3.48Å; R640-N644 PolarHBondContact O-N 2.78Å
641	N	55.8	Low	58.1	Low	107 Å²	107	108.5 Å²	108.5	57%	0.572	51%	0.509	S	S	*	.	H	α-helix	trans	-67	-36.9	177.2	-72.4	-0.5	0	0	0	111.7	N637 I638 Y645	N637-N641 WeakPolarHBondContact O-CB 3.37Å; N637-N641 PolarHBondContact O-N 3.46Å; N637-N641 PolarHBondContact O-OD1 3.15Å; I638-N641 PolarHBondContact O-N 3.11Å; N641-Y645 WeakPolarHBondContact O-CB 3.4Å; N641-Y645 PolarHBondContact O-N 3.01Å
642	K	61.2	Low	59	Low	147 Å²	147	108.9 Å²	108.9	64%	0.639	51%	0.512	S	S	*	.	H	α-helix	trans	-66.3	-41.4	172.3	-89.2	-168.7	169.1	-168.8	0	112.7	I638 N639 Y645 H646	I638-K642 WeakPolarHBondContact O-CB 3.34Å; I638-K642 PolarHBondContact O-N 2.99Å; N639-K642 PolarHBondContact O-N 3.34Å; K642-Y645 PolarHBondContact O-N 3.39Å; K642-H646 VanDerWaalsContact O-CB 3.3Å; K642-H646 WeakPolarHBondContact O-CB 3.41Å; K642-H646 PolarHBondContact O-N 3.44Å
643	Q	61.4	Low	60	Low	143 Å²	143	109.1 Å²	109.1	67%	0.668	52%	0.517	S	S	*	.	H	α-helix	trans	-65.8	-42.4	175.4	-77	-178.4	-37.9	0	0	111.3	N639 R640 R647	N639-Q643 WeakPolarHBondContact O-CB 3.42Å; N639-Q643 WeakPolarHBondContact O-CG 3.23Å; N639-Q643 PolarHBondContact O-N 2.71Å; R640-Q643 PolarHBondContact O-N 3.49Å; Q643-R647 VanDerWaalsContact O-CB 3.28Å; Q643-R647 WeakPolarHBondContact O-CB 3.44Å; Q643-R647 PolarHBondContact O-N 2.83Å
644	N	63.4	Low	61.1	Low	91 Å²	91	108.6 Å²	108.6	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-64.9	-42.7	173.7	-74.7	-4.6	0	0	0	111.7	R640 R647 I648	R640-N644 WeakPolarHBondContact O-CB 3.48Å; R640-N644 PolarHBondContact O-N 2.78Å; N644-R647 PolarHBondContact O-N 3.45Å; N644-I648 WeakPolarHBondContact O-CB 3.28Å; N644-I648 WeakPolarHBondContact O-CD1 3.4Å; N644-I648 WeakPolarHBondContact O-CG1 3.46Å; N644-I648 PolarHBondContact O-N 3.27Å
645	Y	57.8	Low	62.6	Low	167 Å²	167	106.3 Å²	106.3	66%	0.655	52%	0.515	S	S	*	.	H	α-helix	trans	-65.4	-41.7	178.3	-154.5	-85.5	0	0	0	111.5	N641 K642 R647 I648 Q649	N641-Y645 WeakPolarHBondContact O-CB 3.4Å; N641-Y645 PolarHBondContact O-N 3.01Å; K642-Y645 PolarHBondContact O-N 3.39Å; Y645-R647 VanDerWaalsContact C-N 3.35Å; Y645-I648 PolarHBondContact O-N 3.31Å; Y645-Q649 WeakPolarHBondContact O-CB 3.41Å; Y645-Q649 PolarHBondContact O-N 2.82Å
646	H	67.2	Low	63.4	Low	127 Å²	127	107.4 Å²	107.4	59%	0.588	52%	0.519	S	S	*	.	H	α-helix	trans	-67.9	-34.5	175.4	-161.4	-42.4	0	0	0	111.9	K642 C650	K642-H646 VanDerWaalsContact O-CB 3.3Å; K642-H646 WeakPolarHBondContact O-CB 3.41Å; K642-H646 PolarHBondContact O-N 3.44Å; H646-C650 PolarHBondContact ND1-SG 2.73Å; H646-C650 VanDerWaalsContact ND1-SG 3.4Å; H646-C650 WeakPolarHBondContact O-CB 3.27Å; H646-C650 PolarHBondContact O-N 3.11Å; H646-C650 PolarHBondContact O-SG 2.8Å
647	R	68	Low	64.3	Low	177 Å²	177	111.2 Å²	111.2	67%	0.668	53%	0.529	S	S	*	.	H	α-helix	trans	-69.4	-43.8	175.1	-164.1	177.1	-167.1	-175.4	2.5	111.7	Q643 N644 Y645 Q649 C650 Q651	Q643-R647 VanDerWaalsContact O-CB 3.28Å; Q643-R647 WeakPolarHBondContact O-CB 3.44Å; Q643-R647 PolarHBondContact O-N 2.83Å; N644-R647 PolarHBondContact O-N 3.45Å; Y645-R647 VanDerWaalsContact C-N 3.35Å; R647-Q649 VanDerWaalsContact C-N 3.34Å; R647-C650 PolarHBondContact O-N 3.01Å; R647-Q651 WeakPolarHBondContact O-CB 3.17Å; R647-Q651 VanDerWaalsContact O-CG 3.3Å; R647-Q651 WeakPolarHBondContact O-CG 3.27Å; R647-Q651 PolarHBondContact O-N 2.93Å
648	I	65.6	Low	65.3	Low	91 Å²	91	114.4 Å²	114.4	47%	0.467	54%	0.54	S	S	.	.	H	α-helix	trans	-64.5	-38.7	173.9	-68	163.5	0	0	0	110.5	N644 Y645 Q651 M652	N644-I648 WeakPolarHBondContact O-CB 3.28Å; N644-I648 WeakPolarHBondContact O-CD1 3.4Å; N644-I648 WeakPolarHBondContact O-CG1 3.46Å; N644-I648 PolarHBondContact O-N 3.27Å; Y645-I648 PolarHBondContact O-N 3.31Å; I648-Q651 PolarHBondContact O-N 2.77Å; I648-M652 HydrophobicContact CG2-CG 4.39Å; I648-M652 HydrophobicContact CG2-SD 4.31Å; I648-M652 WeakPolarHBondContact O-CB 3.1Å; I648-M652 WeakPolarHBondContact O-CG 3.28Å; I648-M652 PolarHBondContact O-N 3.29Å
649	Q	68.4	Low	65.6	Low	102 Å²	102	116.6 Å²	116.6	48%	0.477	55%	0.549	S	S	.	.	H	α-helix	trans	-71	-36.6	178.3	-171.7	172.5	2.5	0	0	112.4	Y645 R647 N653	Y645-Q649 WeakPolarHBondContact O-CB 3.41Å; Y645-Q649 PolarHBondContact O-N 2.82Å; R647-Q649 VanDerWaalsContact C-N 3.34Å; Q649-N653 WeakPolarHBondContact O-CB 3.25Å; Q649-N653 PolarHBondContact O-N 3.3Å
650	C	70.4	Confident	66.2	Low	55 Å²	55	118 Å²	118	37%	0.372	55%	0.553	S	S	.	*	H	α-helix	trans	-61.7	-50.4	167.5	-71.5	0	0	0	0	110.5	H646 R647 M652 N653 D654	H646-C650 PolarHBondContact ND1-SG 2.73Å; H646-C650 VanDerWaalsContact ND1-SG 3.4Å; H646-C650 WeakPolarHBondContact O-CB 3.27Å; H646-C650 PolarHBondContact O-N 3.11Å; H646-C650 PolarHBondContact O-SG 2.8Å; R647-C650 PolarHBondContact O-N 3.01Å; C650-M652 VanDerWaalsContact C-N 3.32Å; C650-M652 PolarHBondContact O-N 2.84Å; C650-N653 PolarHBondContact O-N 3.11Å; C650-N653 VanDerWaalsContact O-N 3.08Å; C650-D654 PolarHBondContact O-N 2.9Å
651	Q	69	Low	66.8	Low	111 Å²	111	115 Å²	115	52%	0.519	55%	0.547	S	S	.	.	H	α-helix	trans	-60.2	-36.8	178.2	-72.4	177.6	-56.8	0	0	113.2	R647 I648 V655	R647-Q651 WeakPolarHBondContact O-CB 3.17Å; R647-Q651 VanDerWaalsContact O-CG 3.3Å; R647-Q651 WeakPolarHBondContact O-CG 3.27Å; R647-Q651 PolarHBondContact O-N 2.93Å; I648-Q651 PolarHBondContact O-N 2.77Å; Q651-V655 WeakPolarHBondContact O-CB 3.46Å; Q651-V655 VanDerWaalsContact O-CG2 3.25Å; Q651-V655 WeakPolarHBondContact O-CG2 3.49Å; Q651-V655 PolarHBondContact O-N 3.46Å
652	M	66.1	Low	67.4	Low	123 Å²	123	115.9 Å²	115.9	61%	0.606	55%	0.547	S	S	*	.	H	α-helix	trans	-70.7	-37.2	173.6	-75	-173.3	95.1	0	0	112.5	I648 C650 V655 M656	I648-M652 HydrophobicContact CG2-CG 4.39Å; I648-M652 HydrophobicContact CG2-SD 4.31Å; I648-M652 WeakPolarHBondContact O-CB 3.1Å; I648-M652 WeakPolarHBondContact O-CG 3.28Å; I648-M652 PolarHBondContact O-N 3.29Å; C650-M652 VanDerWaalsContact C-N 3.32Å; C650-M652 PolarHBondContact O-N 2.84Å; M652-V655 PolarHBondContact O-N 3.04Å; M652-M656 WeakPolarHBondContact O-CB 3.36Å; M652-M656 WeakPolarHBondContact O-CG 3.26Å; M652-M656 PolarHBondContact O-N 2.87Å
653	N	71.8	Confident	67.6	Low	86 Å²	86	113.6 Å²	113.6	46%	0.46	54%	0.542	S	S	.	.	H	α-helix	trans	-66.7	-38.5	173.6	-84.5	18.1	0	0	0	111.7	Q649 C650 K657	Q649-N653 WeakPolarHBondContact O-CB 3.25Å; Q649-N653 PolarHBondContact O-N 3.3Å; C650-N653 PolarHBondContact O-N 3.11Å; C650-N653 VanDerWaalsContact O-N 3.08Å; N653-K657 WeakPolarHBondContact O-CG 3.34Å; N653-K657 PolarHBondContact O-N 3.27Å
654	D	73.9	Confident	67.7	Low	88 Å²	88	112.9 Å²	112.9	47%	0.471	54%	0.539	S	S	.	.	H	α-helix	trans	-66.6	-44.3	176.1	-61	-29.1	0	0	0	110.2	C650 K657 F658	C650-D654 PolarHBondContact O-N 2.9Å; D654-K657 PolarHBondContact O-N 3.49Å; D654-F658 VanDerWaalsContact O-CD2 3.28Å; D654-F658 WeakPolarHBondContact O-CD2 3.11Å; D654-F658 PolarHBondContact O-N 2.99Å
655	V	70.9	Confident	67.5	Low	89 Å²	89	114.5 Å²	114.5	54%	0.539	54%	0.543	S	S	.	.	H	α-helix	trans	-63.5	-42.2	174.7	168.9	0	0	0	0	112.2	Q651 M652 K657 F658 Q659	Q651-V655 WeakPolarHBondContact O-CB 3.46Å; Q651-V655 VanDerWaalsContact O-CG2 3.25Å; Q651-V655 WeakPolarHBondContact O-CG2 3.49Å; Q651-V655 PolarHBondContact O-N 3.46Å; M652-V655 PolarHBondContact O-N 3.04Å; V655-K657 VanDerWaalsContact C-N 3.33Å; V655-K657 PolarHBondContact O-N 2.81Å; V655-F658 PolarHBondContact O-N 3.49Å; V655-Q659 WeakPolarHBondContact O-CB 3.49Å; V655-Q659 PolarHBondContact O-N 3.39Å
656	M	68.7	Low	67.4	Low	109 Å²	109	110.3 Å²	110.3	54%	0.537	53%	0.532	S	S	.	.	H	α-helix	trans	-65.4	-36.1	175.4	-72.5	-156.6	-47.6	0	0	112	M652 Q659 E660	M652-M656 WeakPolarHBondContact O-CB 3.36Å; M652-M656 WeakPolarHBondContact O-CG 3.26Å; M652-M656 PolarHBondContact O-N 2.87Å; M656-Q659 PolarHBondContact O-N 2.84Å; M656-E660 WeakPolarHBondContact O-CB 3.12Å; M656-E660 WeakPolarHBondContact O-CG 3.4Å; M656-E660 PolarHBondContact O-N 3.05Å
657	K	73.3	Confident	66.8	Low	133 Å²	133	106.4 Å²	106.4	58%	0.578	52%	0.522	S	S	*	.	H	α-helix	trans	-63.8	-41.8	172.1	-80.8	-175.2	170.4	-165.3	0	112.7	N653 D654 V655 Q659 E660 M661	N653-K657 WeakPolarHBondContact O-CG 3.34Å; N653-K657 PolarHBondContact O-N 3.27Å; D654-K657 PolarHBondContact O-N 3.49Å; V655-K657 VanDerWaalsContact C-N 3.33Å; V655-K657 PolarHBondContact O-N 2.81Å; K657-Q659 VanDerWaalsContact C-N 3.31Å; K657-E660 PolarHBondContact O-N 3.07Å; K657-M661 WeakPolarHBondContact O-CG 3.45Å; K657-M661 PolarHBondContact O-N 3.26Å
658	F	69	Low	66.2	Low	143 Å²	143	104.6 Å²	104.6	63%	0.627	52%	0.521	S	S	*	.	H	α-helix	trans	-61	-42.9	173.1	-87.5	-72.1	0	0	0	111.3	D654 V655 M661 E662	D654-F658 VanDerWaalsContact O-CD2 3.28Å; D654-F658 WeakPolarHBondContact O-CD2 3.11Å; D654-F658 PolarHBondContact O-N 2.99Å; V655-F658 PolarHBondContact O-N 3.49Å; F658-M661 HydrophobicContact CD1-CE 3.77Å; F658-M661 HydrophobicContact CE1-CE 4.01Å; F658-M661 HydrophobicContact CG-CE 4.18Å; F658-M661 PolarHBondContact O-N 3.28Å; F658-E662 WeakPolarHBondContact O-CB 3.33Å; F658-E662 PolarHBondContact O-N 3.24Å
659	Q	63.9	Low	65.7	Low	110 Å²	110	106.7 Å²	106.7	51%	0.514	53%	0.529	S	S	.	.	H	α-helix	trans	-71.8	-29.2	179.4	-158.1	165	14.8	0	0	113	V655 M656 K657 N663	V655-Q659 WeakPolarHBondContact O-CB 3.49Å; V655-Q659 PolarHBondContact O-N 3.39Å; M656-Q659 PolarHBondContact O-N 2.84Å; K657-Q659 VanDerWaalsContact C-N 3.31Å; Q659-N663 WeakPolarHBondContact O-CB 3.24Å; Q659-N663 VanDerWaalsContact O-CG 3.3Å; Q659-N663 PolarHBondContact O-N 2.92Å; Q659-N663 VanDerWaalsContact O-N 3.08Å; Q659-N663 PolarHBondContact O-ND2 3.49Å
660	E	67.4	Low	65	Low	118 Å²	118	110.4 Å²	110.4	55%	0.551	54%	0.538	S	S	*	.	H	α-helix	trans	-69.1	-40.8	168.8	-77.8	175.3	164	0	0	111.6	M656 K657 H664	M656-E660 WeakPolarHBondContact O-CB 3.12Å; M656-E660 WeakPolarHBondContact O-CG 3.4Å; M656-E660 PolarHBondContact O-N 3.05Å; K657-E660 PolarHBondContact O-N 3.07Å; E660-H664 WeakPolarHBondContact O-CB 3.18Å; E660-H664 PolarHBondContact O-CD2 3.39Å; E660-H664 VanDerWaalsContact O-CD2 3.22Å; E660-H664 PolarHBondContact O-N 2.92Å
661	M	69.9	Low	64.3	Low	98 Å²	98	114.6 Å²	114.6	48%	0.483	56%	0.557	S	S	.	*	H	α-helix	trans	-67.3	-41.2	175.5	-70.8	-176	-58.8	0	0	112.4	K657 F658 H664 Q665	K657-M661 WeakPolarHBondContact O-CG 3.45Å; K657-M661 PolarHBondContact O-N 3.26Å; F658-M661 HydrophobicContact CD1-CE 3.77Å; F658-M661 HydrophobicContact CE1-CE 4.01Å; F658-M661 HydrophobicContact CG-CE 4.18Å; F658-M661 PolarHBondContact O-N 3.28Å; M661-H664 PolarHBondContact O-N 3.22Å; M661-H664 VanDerWaalsContact O-N 3.16Å; M661-Q665 PolarHBondContact O-N 3.48Å
662	E	68.6	Low	63.8	Low	125 Å²	125	115.6 Å²	115.6	58%	0.584	57%	0.566	S	S	*	*	H	α-helix	trans	-63.8	-44.4	176.8	-166	170.4	-147	0	0	110.8	F658 H664 Q665 D666	F658-E662 WeakPolarHBondContact O-CB 3.33Å; F658-E662 PolarHBondContact O-N 3.24Å; E662-H664 VanDerWaalsContact C-N 3.29Å; E662-H664 PolarHBondContact O-N 3.39Å; E662-Q665 PolarHBondContact O-N 2.87Å; E662-D666 WeakPolarHBondContact O-CB 3.39Å; E662-D666 PolarHBondContact O-N 3.08Å
663	N	65	Low	63.3	Low	100 Å²	100	116.2 Å²	116.2	54%	0.535	57%	0.572	S	S	.	*	H	α-helix	trans	-65	-28.7	172.3	-75.9	-54.3	0	0	0	113.5	Q659 A667	Q659-N663 WeakPolarHBondContact O-CB 3.24Å; Q659-N663 VanDerWaalsContact O-CG 3.3Å; Q659-N663 PolarHBondContact O-N 2.92Å; Q659-N663 VanDerWaalsContact O-N 3.08Å; Q659-N663 PolarHBondContact O-ND2 3.49Å; N663-A667 VanDerWaalsContact O-CB 3.3Å; N663-A667 WeakPolarHBondContact O-CB 3.41Å; N663-A667 PolarHBondContact O-N 2.93Å; N663-A667 VanDerWaalsContact O-N 3.08Å
664	H	62.9	Low	62.6	Low	128 Å²	128	119.7 Å²	119.7	59%	0.593	59%	0.591	S	S	*	*	H	α-helix	trans	-77	-34.5	174.7	-88.1	-59.3	0	0	0	112.7	E660 M661 E662 A667 Q668	E660-H664 WeakPolarHBondContact O-CB 3.18Å; E660-H664 PolarHBondContact O-CD2 3.39Å; E660-H664 VanDerWaalsContact O-CD2 3.22Å; E660-H664 PolarHBondContact O-N 2.92Å; M661-H664 PolarHBondContact O-N 3.22Å; M661-H664 VanDerWaalsContact O-N 3.16Å; E662-H664 VanDerWaalsContact C-N 3.29Å; E662-H664 PolarHBondContact O-N 3.39Å; H664-A667 PolarHBondContact O-N 2.98Å; H664-Q668 WeakPolarHBondContact O-CB 3.45Å; H664-Q668 WeakPolarHBondContact O-CG 3.08Å; H664-Q668 PolarHBondContact O-N 2.86Å
665	Q	59	Low	61.8	Low	125 Å²	125	123.4 Å²	123.4	58%	0.584	61%	0.61	S	S	*	*	H	α-helix	trans	-67.8	-45.8	169.7	-72.1	-174.2	-79.2	0	0	110.8	M661 E662 A667 Q668 Q669	M661-Q665 PolarHBondContact O-N 3.48Å; E662-Q665 PolarHBondContact O-N 2.87Å; Q665-A667 PolarHBondContact O-N 3.39Å; Q665-A667 VanDerWaalsContact O-N 3.16Å; Q665-Q668 PolarHBondContact O-N 2.82Å; Q665-Q669 WeakPolarHBondContact O-CB 3.29Å; Q665-Q669 PolarHBondContact O-N 3.27Å
666	D	57.5	Low	61	Low	78 Å²	78	126.3 Å²	126.3	42%	0.417	62%	0.623	S	S	.	*	H	α-helix	trans	-62.8	-19.9	174.7	-91.9	14.4	0	0	0	113.9	E662 R670	E662-D666 WeakPolarHBondContact O-CB 3.39Å; E662-D666 PolarHBondContact O-N 3.08Å; D666-R670 VanDerWaalsContact O-CD 3.23Å; D666-R670 WeakPolarHBondContact O-CD 3.14Å; D666-R670 WeakPolarHBondContact O-CG 3.27Å; D666-R670 PolarHBondContact O-NE 3.48Å; D666-R670 VanDerWaalsContact O-NE 3.11Å
667	A	54.4	Low	60.4	Low	46 Å²	46	127.7 Å²	127.7	38%	0.38	63%	0.633	S	S	.	*	H	α-helix	trans	-85.2	-47.8	171.4	0	0	0	0	0	111.6	N663 H664 Q665 Q669 R670	N663-A667 VanDerWaalsContact O-CB 3.3Å; N663-A667 WeakPolarHBondContact O-CB 3.41Å; N663-A667 PolarHBondContact O-N 2.93Å; N663-A667 VanDerWaalsContact O-N 3.08Å; H664-A667 PolarHBondContact O-N 2.98Å; Q665-A667 PolarHBondContact O-N 3.39Å; Q665-A667 VanDerWaalsContact O-N 3.16Å; A667-Q669 PolarHBondContact O-N 3.08Å; A667-R670 PolarHBondContact O-N 3.38Å
668	Q	55.5	Low	59.6	Low	138 Å²	138	128.6 Å²	128.6	65%	0.645	64%	0.644	S	S	*	*	H	α-helix	trans	-68.7	-19.9	177.9	-71.8	-174.6	-46.9	0	0	113.5	H664 Q665 N672	H664-Q668 WeakPolarHBondContact O-CB 3.45Å; H664-Q668 WeakPolarHBondContact O-CG 3.08Å; H664-Q668 PolarHBondContact O-N 2.86Å; Q665-Q668 PolarHBondContact O-N 2.82Å; Q668-N672 PolarHBondContact O-ND2 3.18Å
669	Q	54.9	Low	58.7	Low	135 Å²	135	125 Å²	125	63%	0.631	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	1.1	178.2	-160.4	157.6	0.9	0	0	113.2	Q665 A667	Q665-Q669 WeakPolarHBondContact O-CB 3.29Å; Q665-Q669 PolarHBondContact O-N 3.27Å; A667-Q669 PolarHBondContact O-N 3.08Å
670	R	53.8	Low	58.3	Low	180 Å²	180	124.9 Å²	124.9	68%	0.679	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-20.1	168.6	-74.4	175.1	-157.6	-126.2	0.6	113.9	D666 A667 N672	D666-R670 VanDerWaalsContact O-CD 3.23Å; D666-R670 WeakPolarHBondContact O-CD 3.14Å; D666-R670 WeakPolarHBondContact O-CG 3.27Å; D666-R670 PolarHBondContact O-NE 3.48Å; D666-R670 VanDerWaalsContact O-NE 3.11Å; A667-R670 PolarHBondContact O-N 3.38Å; R670-N672 VanDerWaalsContact C-N 3.27Å; R670-N672 PolarHBondContact O-N 3.32Å
671	D	55.7	Low	57.6	Low	143 Å²	143	126.6 Å²	126.6	77%	0.765	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	15.2	179.8	-68.1	-14.7	0	0	0	112.8
672	N	57.5	Low	56.9	Low	132 Å²	132	129.6 Å²	129.6	71%	0.706	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	6.9	-176.8	-74.6	-62.6	0	0	0	114.8	Q668 R670	Q668-N672 PolarHBondContact O-ND2 3.18Å; R670-N672 VanDerWaalsContact C-N 3.27Å; R670-N672 PolarHBondContact O-N 3.32Å
673	D	56.6	Low	56.1	Low	137 Å²	137	131.2 Å²	131.2	73%	0.733	70%	0.702	S	S	*	*	S	Bend	trans	-100.3	6.3	-177.3	-80.3	-13.4	0	0	0	113.9
674	D	57	Low	55.3	Low	159 Å²	159	130.1 Å²	130.1	85%	0.85	71%	0.714	S	S	*	*			trans	-111.7	66.2	177.8	-79.2	-29.7	0	0	0	111.6
675	D	56.1	Low	54.4	Low	166 Å²	166	127.9 Å²	127.9	89%	0.888	73%	0.725	S	S	*	*			trans	-149.9	97.1	156.1	-107.2	-28.4	0	0	0	110.2
676	D	55.4	Low	53.9	Low	150 Å²	150	130.5 Å²	130.5	80%	0.802	74%	0.737	S	S	*	*			trans	-73	150.2	174.6	-83.1	-47.8	0	0	0	112.2
677	N	54.8	Low	53.5	Low	138 Å²	138	133.3 Å²	133.3	74%	0.738	75%	0.752	S	S	*	*			trans	91.2	137.4	154.7	-62.7	-50.1	0	0	0	121.5
678	D	56	Low	53.3	Low	152 Å²	152	137 Å²	137	81%	0.813	77%	0.766	S	S	*	*			trans	73.6	77.8	145.6	-58.7	-15.4	0	0	0	120.4
679	G	50.2	Low	53.2	Low	67 Å²	67	137 Å²	137	69%	0.691	77%	0.765	S	S	*	*				104.3	147.1	93.3	0	0	0	0	0	119.5
680	S	55.3	Low	53.1	Low	107 Å²	107	138.9 Å²	138.9	75%	0.748	77%	0.774	S	S	*	*			trans	60.5	110.1	171.5	36.6	0	0	0	0	116.2
681	D	54	Low	52.9	Low	155 Å²	155	138 Å²	138	83%	0.829	78%	0.777	S	S	*	*				63.2	101.5	80.3	-59.9	-34.7	0	0	0	112
682	D	54	Low	52.6	Low	161 Å²	161	139.1 Å²	139.1	86%	0.861	78%	0.778	S	S	*	*				-172.6	168.9	102.8	-126.5	-28.6	0	0	0	114.2
683	D	53.1	Low	51.9	Low	159 Å²	159	139.5 Å²	139.5	85%	0.85	78%	0.78	S	S	*	*			trans	-58.8	151.8	-173.3	-84.9	-41.7	0	0	0	118.4
684	G	48.7	Very low	51.7	Low	77 Å²	77	139.5 Å²	139.5	79%	0.794	78%	0.778	S	S	*	*				119.3	139.1	119.3	0	0	0	0	0	119.9
685	G	42.8	Very low	51.1	Low	80 Å²	80	139.5 Å²	139.5	83%	0.825	78%	0.778	S	S	*	*			trans	111.4	89.8	140.4	0	0	0	0	0	118.5
686	E	48.1	Very low	51	Low	180 Å²	180	140.4 Å²	140.4	84%	0.841	78%	0.777	S	S	*	*			trans	-23.8	166.2	148.5	-70.5	170.1	147.1	0	0	120.3
687	D	50	Low	50.5	Low	137 Å²	137	140.3 Å²	140.3	73%	0.733	78%	0.776	S	S	*	*			trans	96.2	101.3	147.4	-68.1	-10.6	0	0	0	123.3
688	D	50.6	Low	50.3	Low	123 Å²	123	140.3 Å²	140.3	66%	0.658	78%	0.777	S	S	*	*				90.5	141.9	112.7	-109	-25.2	0	0	0	125.7
689	H	53.5	Low	50.1	Low	138 Å²	138	139.9 Å²	139.9	64%	0.639	77%	0.774	S	S	*	*			trans	61.2	137.5	159	-49.3	-17	0	0	0	119.2
690	H	52.5	Low	49.9	Very low	176 Å²	176	144.1 Å²	144.1	82%	0.815	78%	0.781	S	S	*	*				-167.6	159.6	50.5	-104.7	-67	0	0	0	113.4
691	H	48.6	Very low	49.4	Very low	160 Å²	160	145.8 Å²	145.8	74%	0.741	78%	0.781	S	S	*	*			trans	-68.2	151.2	166.1	-97.6	-92.6	0	0	0	113.5
692	H	50.5	Low	48.9	Very low	168 Å²	168	144.7 Å²	144.7	78%	0.778	78%	0.776	S	S	*	*			trans	-156.9	120.8	138	-124.2	-65.1	0	0	0	113.1
693	D	43	Very low	48.3	Very low	140 Å²	140	143.1 Å²	143.1	75%	0.749	77%	0.767	S	S	*	*			trans	-94.2	140.4	159.9	-60	-60.8	0	0	0	108.4
694	I	51.1	Low	47.7	Very low	136 Å²	136	142.1 Å²	142.1	70%	0.697	76%	0.762	S	S	*	*			trans	-147.6	123.1	162.4	-59.9	-174.8	0	0	0	108.2	E696	I694-E696 HydrophobicContact CG2-CG 4.21Å
695	D	44.2	Very low	47.3	Very low	159 Å²	159	144.7 Å²	144.7	85%	0.85	76%	0.757	S	S	*	*			trans	-87.2	139.4	163.2	-63.9	-60.2	0	0	0	109.3
696	E	55.2	Low	47.4	Very low	185 Å²	185	148 Å²	148	86%	0.864	75%	0.751	S	S	*	*			trans	-137.7	137	158.7	-73	-165.4	159.9	0	0	110.7	I694	I694-E696 HydrophobicContact CG2-CG 4.21Å
697	D	45	Very low	47.1	Very low	148 Å²	148	145.9 Å²	145.9	79%	0.791	75%	0.745	S	S	*	*			trans	-91.1	-168.6	-177.5	-78.5	-61.3	0	0	0	112.1
698	D	49.7	Very low	46.6	Very low	139 Å²	139	145.7 Å²	145.7	74%	0.743	74%	0.744	S	S	*	*			trans	90.9	108.7	152.3	-59.9	-21.4	0	0	0	121
699	D	52.4	Low	46.2	Very low	143 Å²	143	148.8 Å²	148.8	77%	0.765	76%	0.757	S	S	*	*				90.3	136.7	121.8	-71.6	-16.8	0	0	0	125.6
700	D	46.1	Very low	45.4	Very low	155 Å²	155	149.3 Å²	149.3	83%	0.829	76%	0.764	S	S	*	*			trans	103	125.2	138.5	-97.6	-19.1	0	0	0	123.4
701	D	43.7	Very low	44.8	Very low	142 Å²	142	149.2 Å²	149.2	76%	0.759	77%	0.768	S	S	*	*			trans	-74.3	143.1	171.6	-77.6	-53.8	0	0	0	111
702	N	43.5	Very low	44.1	Very low	133 Å²	133	149.3 Å²	149.3	71%	0.711	77%	0.769	S	S	*	*				171.2	126.5	113.8	-97.8	-77.6	0	0	0	115.5
703	N	42.2	Very low	43.4	Very low	128 Å²	128	148 Å²	148	68%	0.684	77%	0.767	S	S	*	*				42.7	129.3	129.2	-74.5	-43.7	0	0	0	123.4
704	N	39.5	Very low	42.9	Very low	138 Å²	138	144.5 Å²	144.5	74%	0.738	76%	0.764	S	S	*	*				102.5	131	129.1	-79.1	-23.5	0	0	0	122.9
705	L	41.5	Very low	42.2	Very low	131 Å²	131	144 Å²	144	69%	0.686	77%	0.767	S	S	*	*			trans	90.2	129.6	137.6	-104.8	61.8	0	0	0	122.1
706	H	43.9	Very low	41.6	Very low	150 Å²	150	147 Å²	147	69%	0.694	77%	0.767	S	S	*	*			trans	66.7	149.8	152.4	-69.5	-58.9	0	0	0	118.9
707	D	41.9	Very low	40.7	Very low	134 Å²	134	147.6 Å²	147.6	72%	0.717	77%	0.766	S	S	*	*			cis	-151	174.6	2.1	-120	-23.2	0	0	0	114.2
708	D	40.5	Very low	40.3	Very low	134 Å²	134	149.5 Å²	149.5	72%	0.717	77%	0.768	S	S	*	*			trans	-67	155.4	-174.5	-72.6	-52.4	0	0	0	117
709	M	41.2	Very low	39.3	Very low	188 Å²	188	151.5 Å²	151.5	93%	0.926	77%	0.77	S	S	*	*			trans	-153.2	119.1	131.8	-91.9	-144.1	-77.2	0	0	112.8
710	N	36.3	Very low	38.3	Very low	148 Å²	148	155.5 Å²	155.5	79%	0.791	78%	0.776	S	S	*	*			trans	-85.4	146.3	169.1	-75.3	-67.2	0	0	0	111.2
711	I	40.3	Very low	37.7	Very low	175 Å²	175	153.2 Å²	153.2	90%	0.897	77%	0.768	S	S	*	*			trans	-143.1	140.2	145.4	-96	151.5	0	0	0	108.8
712	E	34.3	Very low	37	Very low	162 Å²	162	157.4 Å²	157.4	76%	0.757	78%	0.775	S	S	*	*			trans	-106.1	170.9	-162.2	-157.4	-170.2	-159.4	0	0	112.8
713	N	36.9	Very low	36.4	Very low	140 Å²	140	161.9 Å²	161.9	75%	0.749	78%	0.781	S	S	*	*			trans	77.7	112.1	158.5	-63.2	-54.7	0	0	0	120.4
714	G	32.2	Very low	35.9	Very low	66 Å²	66	164 Å²	164	68%	0.68	79%	0.789	S	S	*	*				135	107.1	111.3	0	0	0	0	0	120.4
715	V	35	Very low	35.7	Very low	125 Å²	125	167 Å²	167	76%	0.758	80%	0.796	S	S	*	*				74	121.8	129.9	-177.9	0	0	0	0	120.4
716	R	32.4	Very low	35.6	Very low	224 Å²	224	166.2 Å²	166.2	85%	0.845	80%	0.797	S	S	*	*			trans	68.2	111.3	157.2	-68.1	162.4	-164.2	-167.1	3.5	120.4
717	K	37.2	Very low	35.2	Very low	196 Å²	196	165 Å²	165	85%	0.852	80%	0.802	S	S	*	*				-175.9	109	115.9	-93.7	149.7	-173.4	175.9	0	108.7
718	K	35.7	Very low	34.9	Very low	189 Å²	189	165.5 Å²	165.5	82%	0.822	81%	0.81	S	S	*	*				73.8	110.9	92.5	-78.9	-172.4	175.9	-178	0	114.8
719	F	29.3	Very low	34.7	Very low	181 Å²	181	166.1 Å²	166.1	79%	0.794	81%	0.813	S	S	*	*			trans	-7.6	133.8	159.6	-69.1	-95.8	0	0	0	119.4
720	Y	31.7	Very low	34.4	Very low	227 Å²	227	162.8 Å²	162.8	89%	0.89	81%	0.809	S	S	*	*			trans	-128.1	85.7	138.1	-80.4	-73.2	0	0	0	111.2	Y722	Y720-Y722 PolarHBondContact O-N 3.41Å
721	T	32.3	Very low	34.4	Very low	107 Å²	107	159.2 Å²	159.2	66%	0.656	81%	0.807	S	S	*	*			trans	-71.4	119.8	159.3	-34.7	0	0	0	0	107.5	R723	T721-R723 PolarHBondContact O-N 2.82Å
722	Y	29.9	Very low	34.2	Very low	230 Å²	230	159.6 Å²	159.6	90%	0.902	81%	0.805	S	S	*	*			trans	-68.3	84.4	171.6	-99.9	-93.3	0	0	0	110.1	Y720	Y720-Y722 PolarHBondContact O-N 3.41Å
723	R	29.9	Very low	34.2	Very low	226 Å²	226	158 Å²	158	85%	0.853	81%	0.807	S	S	*	*			trans	-86.8	109.2	167.7	-165.4	179.2	-165.2	179.1	4.3	106.9	T721 K725	T721-R723 PolarHBondContact O-N 2.82Å; R723-K725 PolarHBondContact O-N 3.09Å; R723-K725 VanDerWaalsContact O-N 3.11Å
724	M	32.6	Very low	34.2	Very low	172 Å²	172	156.2 Å²	156.2	85%	0.847	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-54.5	120.1	169.6	-80.5	-177.9	166.6	0	0	108.6	T726	M724-T726 PolarHBondContact O-N 2.85Å
725	K	34.9	Very low	34.5	Very low	202 Å²	202	162 Å²	162	88%	0.878	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-68.5	118.7	167.9	-79.6	-177.8	173.3	-179.1	0	107.6	R723	R723-K725 PolarHBondContact O-N 3.09Å; R723-K725 VanDerWaalsContact O-N 3.11Å
726	T	38.4	Very low	34.5	Very low	115 Å²	115	162.4 Å²	162.4	71%	0.706	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-58.3	141.6	157	41.3	0	0	0	0	109	M724 T728	M724-T726 PolarHBondContact O-N 2.85Å; T726-T728 PolarHBondContact O-N 2.69Å
727	P	36.7	Very low	34.7	Very low	125 Å²	125	159 Å²	159	81%	0.812	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-63	121.8	171.3	27.5	-32.6	0	0	0	108.6	D729	P727-D729 PolarHBondContact O-N 3.26Å
728	T	34.9	Very low	34.5	Very low	144 Å²	144	155 Å²	155	88%	0.883	80%	0.803	S	S	*	*			trans	-81.1	101.9	161.8	36.5	0	0	0	0	107.2	T726	T726-T728 PolarHBondContact O-N 2.69Å
729	D	37.1	Very low	34.6	Very low	146 Å²	146	151.2 Å²	151.2	78%	0.781	80%	0.798	S	S	*	*			trans	-103.4	142.2	162.6	-157	-9.6	0	0	0	109	P727	P727-D729 PolarHBondContact O-N 3.26Å
730	S	34.3	Very low	34.8	Very low	118 Å²	118	149.7 Å²	149.7	83%	0.825	80%	0.797	S	S	*	*			trans	-78.2	118.7	-172.9	42	0	0	0	0	111.3
731	G	36.8	Very low	34.9	Very low	74 Å²	74	144.4 Å²	144.4	76%	0.763	79%	0.791	S	S	*	*			trans	-149	109.7	179.6	0	0	0	0	0	112.2
732	Q	35.8	Very low	35.1	Very low	182 Å²	182	147 Å²	147	85%	0.85	80%	0.799	S	S	*	*			trans	-59.5	151.1	-177.2	-70.6	166.4	-36.6	0	0	114.4
733	T	33.3	Very low	35.3	Very low	129 Å²	129	141.2 Å²	141.2	79%	0.791	79%	0.792	S	S	*	*			trans	47.7	123	147.2	58.7	0	0	0	0	118.6
734	S	38.6	Very low	35.3	Very low	102 Å²	102	138.9 Å²	138.9	71%	0.713	79%	0.79	S	S	*	*				176.7	145.3	52.2	51.6	0	0	0	0	112.7
735	K	36.8	Very low	35.3	Very low	187 Å²	187	136.8 Å²	136.8	81%	0.813	79%	0.788	S	S	*	*			trans	50.9	121.6	138.7	-67.9	-179.2	178.5	177.6	0	121.4
736	N	36.7	Very low	35.2	Very low	134 Å²	134	134.6 Å²	134.6	72%	0.717	78%	0.784	S	S	*	*				103.3	119.2	124.2	-75.8	9	0	0	0	122.1
737	I	36.7	Very low	34.9	Very low	154 Å²	154	134.8 Å²	134.8	79%	0.79	79%	0.79	S	S	*	*			trans	83.7	100.1	141.6	-57.2	159.3	0	0	0	118.5
738	S	31.7	Very low	34.6	Very low	111 Å²	111	136.8 Å²	136.8	78%	0.776	79%	0.794	S	S	*	*			trans	-96.1	172.8	132.7	-29.2	0	0	0	0	107.7
739	P	38.6	Very low	34.5	Very low	110 Å²	110	136.2 Å²	136.2	71%	0.714	79%	0.79	S	S	*	*			cis	-134.1	-171.3	27.2	30.8	-4	0	0	0	112.8
740	L	32.5	Very low	34.3	Very low	148 Å²	148	136.2 Å²	136.2	78%	0.775	79%	0.789	S	S	*	*				179	150.4	67.4	-114.1	138.7	0	0	0	110.7
741	P	34.6	Very low	34.1	Very low	117 Å²	117	138.2 Å²	138.2	76%	0.76	79%	0.79	S	S	*	*			trans	-112.1	144.9	173.3	37.9	-29.6	0	0	0	114.9
742	I	35.9	Very low	33.7	Very low	162 Å²	162	140.1 Å²	140.1	83%	0.831	79%	0.791	S	S	*	*			trans	-152	143.2	176.7	-62.2	-176.1	0	0	0	106.1
743	S	35.2	Very low	33.7	Very low	108 Å²	108	137.2 Å²	137.2	76%	0.755	79%	0.788	S	S	*	*			cis	-138.4	-168.5	3.5	51.3	0	0	0	0	112
744	H	30	Very low	33.6	Very low	176 Å²	176	140.3 Å²	140.3	82%	0.815	79%	0.791	S	S	*	*			trans	-104.3	161.7	178.3	-57.8	-109.7	0	0	0	113.3
745	T	32.7	Very low	33.4	Very low	129 Å²	129	145.3 Å²	145.3	79%	0.791	80%	0.8	S	S	*	*				-162.2	108.2	126.1	28.5	0	0	0	0	114
746	I	31	Very low	33.2	Very low	155 Å²	155	148 Å²	148	80%	0.795	81%	0.805	S	S	*	*			trans	52.1	107	132.8	-52	165	0	0	0	119.6
747	S	32.9	Very low	33	Very low	119 Å²	119	147.8 Å²	147.8	83%	0.832	81%	0.808	S	S	*	*				179.5	66	120.3	37.3	0	0	0	0	113.6
748	D	30.6	Very low	32.7	Very low	167 Å²	167	149.9 Å²	149.9	89%	0.893	81%	0.812	S	S	*	*			trans	-100.3	103.3	166.4	-91.8	-40.2	0	0	0	110.4
749	V	32.3	Very low	32.8	Very low	133 Å²	133	153.2 Å²	153.2	81%	0.806	82%	0.815	S	S	*	*			trans	-150.1	149.2	156.8	-160.3	0	0	0	0	109.5
750	L	32.4	Very low	32.5	Very low	145 Å²	145	153.7 Å²	153.7	76%	0.759	82%	0.816	S	S	*	*	S	Bend	trans	86.8	72.1	172.2	-51.6	-178.9	0	0	0	117.8
751	L	31.8	Very low	32.3	Very low	161 Å²	161	154 Å²	154	84%	0.843	82%	0.817	S	S	*	*				65.4	109.1	123.8	-65	161.3	0	0	0	119.2
752	S	27.4	Very low	32	Very low	114 Å²	114	159 Å²	159	80%	0.797	82%	0.823	S	S	*	*			trans	-128.8	119.2	153.6	52.4	0	0	0	0	110.8
753	P	36.7	Very low	31.7	Very low	120 Å²	120	162.7 Å²	162.7	78%	0.779	83%	0.826	S	S	*	*			trans	-75.4	128.7	172.3	-15.3	30.5	0	0	0	111.1
754	K	30	Very low	31.5	Very low	195 Å²	195	163.7 Å²	163.7	85%	0.848	82%	0.822	S	S	*	*			trans	-74	132.2	167.4	-62	165.2	-179.3	167	0	109
755	F	35.4	Very low	31.3	Very low	207 Å²	207	163.2 Å²	163.2	91%	0.908	83%	0.826	S	S	*	*			trans	-137.9	153.7	150.3	-97.1	-75.3	0	0	0	112.5
756	R	33.3	Very low	31.3	Very low	243 Å²	243	164.6 Å²	164.6	92%	0.917	82%	0.823	S	S	*	*			trans	-91.5	169.3	-162.3	-76.2	174.6	166.9	167.1	-5.3	113.2
757	T	30.7	Very low	31.3	Very low	129 Å²	129	165.8 Å²	165.8	79%	0.791	83%	0.825	S	S	*	*			trans	-80.8	162.1	-178.9	45.2	0	0	0	0	114.6
758	K	30.5	Very low	31	Very low	198 Å²	198	167.9 Å²	167.9	86%	0.861	83%	0.827	S	S	*	*			trans	93.1	108.5	164	-60.7	-173	174.1	-171.8	0	118.3
759	Q	33.8	Very low	31	Very low	181 Å²	181	171.5 Å²	171.5	85%	0.846	83%	0.828	S	S	*	*			trans	-167.2	109.8	136.2	-100.6	161.7	-3.4	0	0	105.8
760	T	32.4	Very low	30.7	Very low	120 Å²	120	172 Å²	172	74%	0.736	83%	0.825	S	S	*	*				50.8	100.5	88	54.7	0	0	0	0	115.1
761	I	29.5	Very low	30.6	Very low	155 Å²	155	174 Å²	174	80%	0.795	83%	0.83	S	S	*	*			trans	24.1	110.4	140.3	-49.6	174.6	0	0	0	116.5
762	Y	28.3	Very low	30.4	Very low	223 Å²	223	177.1 Å²	177.1	88%	0.875	83%	0.831	S	S	*	*			trans	-131	121	138.7	-96.9	-88.1	0	0	0	109.1
763	R	28.5	Very low	30.7	Very low	238 Å²	238	177.3 Å²	177.3	90%	0.898	83%	0.832	S	S	*	*			trans	-72.9	135.3	159.6	-81.1	176.4	167.1	164.4	-5.1	107.1
764	L	30.7	Very low	30.3	Very low	129 Å²	129	179 Å²	179	68%	0.675	83%	0.832	S	S	*	*			trans	-133.8	108.7	161.3	-130.1	110.2	0	0	0	109.9	Q766	L764-Q766 HydrophobicContact CD2-CG 3.95Å; L764-Q766 PolarHBondContact O-N 3.47Å
765	N	26.3	Very low	30.2	Very low	167 Å²	167	174.7 Å²	174.7	89%	0.893	83%	0.825	S	S	*	*			trans	-80.5	105.6	164.2	-102.2	-14.3	0	0	0	107.8
766	Q	33.9	Very low	29.9	Very low	158 Å²	158	170.6 Å²	170.6	74%	0.738	82%	0.822	S	S	*	*			trans	-136.2	98.2	158.9	-78.7	-179.6	-7.2	0	0	106.3	L764	L764-Q766 HydrophobicContact CD2-CG 3.95Å; L764-Q766 PolarHBondContact O-N 3.47Å
767	Q	31	Very low	29.6	Very low	179 Å²	179	164.9 Å²	164.9	84%	0.836	81%	0.814	S	S	*	*				55.7	109.9	88.7	-74	-168.3	-15.7	0	0	113.5	R769	Q767-R769 PolarHBondContact O-N 3.47Å
768	N	26.7	Very low	29.5	Very low	163 Å²	163	166.3 Å²	166.3	87%	0.872	82%	0.816	S	S	*	*			trans	-4.1	112.7	155	-65.3	-23	0	0	0	116.5
769	R	29.6	Very low	29.4	Very low	243 Å²	243	162.4 Å²	162.4	92%	0.917	81%	0.811	S	S	*	*			trans	-147	124.6	133.8	-112.6	164.5	-163.7	-166.2	3.7	112.2	Q767	Q767-R769 PolarHBondContact O-N 3.47Å
770	I	26.9	Very low	29.3	Very low	144 Å²	144	158.8 Å²	158.8	74%	0.738	81%	0.806	S	S	*	*			trans	-63.5	125.6	176.7	-64.2	151.3	0	0	0	108.8	R772	I770-R772 HydrophobicContact CG2-CG 4.29Å
771	H	30.2	Very low	29.2	Very low	188 Å²	188	158.6 Å²	158.6	87%	0.87	81%	0.806	S	S	*	*			trans	-132.3	128.3	149.9	-96.2	-82.8	0	0	0	110.3
772	R	26.6	Very low	29.2	Very low	226 Å²	226	159.3 Å²	159.3	85%	0.853	81%	0.811	S	S	*	*			trans	-83.9	136.4	-173.3	-61.9	169.3	172.6	178.5	-4	110	I770	I770-R772 HydrophobicContact CG2-CG 4.29Å
773	S	32.9	Very low	29.3	Very low	117 Å²	117	157 Å²	157	82%	0.818	81%	0.813	S	S	*	*			trans	-121.6	128.5	149.1	57.6	0	0	0	0	108.2
774	I	29.7	Very low	29.5	Very low	155 Å²	155	154.7 Å²	154.7	80%	0.795	81%	0.812	S	S	*	*			trans	-72.8	136.5	-158	-66.4	149	0	0	0	112.2
775	P	27	Very low	29.5	Very low	105 Å²	105	159.9 Å²	159.9	68%	0.682	82%	0.823	S	S	*	*			trans	-76.4	121.2	164.3	31.4	-30.5	0	0	0	109.3	T777	P775-T777 PolarHBondContact O-N 3.39Å
776	S	29.1	Very low	29.9	Very low	121 Å²	121	159.3 Å²	159.3	85%	0.846	82%	0.818	S	S	*	*			trans	-68.2	104	175.6	55	0	0	0	0	110.7
777	T	27	Very low	29.9	Very low	124 Å²	124	157 Å²	157	76%	0.761	82%	0.817	S	S	*	*			trans	-75.3	117.9	173.8	46.4	0	0	0	0	111.1	P775	P775-T777 PolarHBondContact O-N 3.39Å
778	L	29.3	Very low	29.8	Very low	158 Å²	158	156.7 Å²	156.7	83%	0.827	82%	0.815	S	S	*	*			trans	-154	93.1	163.5	-108.3	164.7	0	0	0	110.1
779	P	29	Very low	30.1	Very low	117 Å²	117	157.3 Å²	157.3	76%	0.76	82%	0.815	S	S	*	*			trans	-84.6	143	160.9	34.2	-29.7	0	0	0	109.3
780	S	30.4	Very low	30.1	Very low	105 Å²	105	152.3 Å²	152.3	73%	0.734	81%	0.805	S	S	*	*			trans	-154.8	148.9	174.3	-83.8	0	0	0	0	111.4
781	P	31.7	Very low	30.4	Very low	115 Å²	115	152.9 Å²	152.9	75%	0.747	81%	0.81	S	S	*	*				-130.7	154.3	-120.4	39	-26.1	0	0	0	114.7
782	L	27.9	Very low	30.3	Very low	171 Å²	171	153.7 Å²	153.7	90%	0.895	81%	0.806	S	S	*	*			trans	-173.3	73.8	155.8	-110.6	164.2	0	0	0	112.3
783	L	31.7	Very low	30.7	Very low	174 Å²	174	150 Å²	150	91%	0.911	80%	0.804	S	S	*	*			trans	-173.4	77	148.2	-130.2	78	0	0	0	112.2
784	Q	31.5	Very low	30.6	Very low	190 Å²	190	149.3 Å²	149.3	89%	0.888	80%	0.795	S	S	*	*			trans	-153.7	108.6	159	-146.4	163.5	-3.5	0	0	114.2
785	R	32.3	Very low	30.5	Very low	238 Å²	238	146.5 Å²	146.5	90%	0.898	79%	0.789	S	S	*	*			trans	-150.5	120.1	156.9	-87.7	-169.7	-175.4	-175.3	3.7	101.4
786	I	33.6	Very low	30.7	Very low	154 Å²	154	148.7 Å²	148.7	79%	0.79	79%	0.79	S	S	*	*	S	Bend	cis	-152.5	162.9	37.2	-85.9	132.9	0	0	0	108.5
787	P	33.7	Very low	30.8	Very low	110 Å²	110	149.3 Å²	149.3	71%	0.714	78%	0.779	S	S	*	*			trans	-108.1	-179	-149.6	40.9	-34.3	0	0	0	118.2
788	E	29.3	Very low	31.1	Very low	172 Å²	172	150.4 Å²	150.4	80%	0.804	78%	0.775	S	S	*	*			trans	-38.2	154.9	179	-57.9	164.2	140.7	0	0	120.8
789	M	32.2	Very low	31.1	Very low	177 Å²	177	148.3 Å²	148.3	87%	0.872	77%	0.765	S	S	*	*			trans	-157.9	105.4	132.4	-98.7	-175.1	-74.5	0	0	107.5
790	I	30.4	Very low	31.1	Very low	138 Å²	138	151.4 Å²	151.4	71%	0.708	76%	0.763	S	S	*	*				66.1	103.8	89	-61.3	167.3	0	0	0	114
791	N	33.4	Very low	31.1	Very low	156 Å²	156	152.7 Å²	152.7	83%	0.834	76%	0.757	S	S	*	*				-167.5	151.6	110.6	-116.2	-14.4	0	0	0	114.1
792	Y	28.4	Very low	31	Very low	204 Å²	204	154.1 Å²	154.1	80%	0.8	75%	0.753	S	S	*	*			trans	-94	149	176.1	-89.1	-112.5	0	0	0	111.2
793	D	34.4	Very low	31.1	Very low	150 Å²	150	152 Å²	152	80%	0.802	74%	0.739	S	S	*	*				-177.1	121.5	108.8	-99.1	-36.3	0	0	0	110.6
794	T	29.6	Very low	31	Very low	101 Å²	101	150 Å²	150	62%	0.62	72%	0.724	S	S	*	*				77.5	104.8	65.8	-25.7	0	0	0	0	115.7
795	S	29.3	Very low	30.9	Very low	96 Å²	96	147.9 Å²	147.9	67%	0.671	72%	0.715	S	S	*	*			trans	111.5	139.8	135.4	85.7	0	0	0	0	122.4
796	H	30.8	Very low	30.9	Very low	151 Å²	151	142.8 Å²	142.8	70%	0.699	70%	0.701	S	S	*	*			trans	82.5	112.2	144.1	-69.4	-50.7	0	0	0	125.1
797	H	30.9	Very low	30.8	Very low	135 Å²	135	141.8 Å²	141.8	63%	0.625	69%	0.693	S	S	*	*			trans	73.4	126.4	130.5	-73.9	-60.9	0	0	0	123.4
798	H	32.9	Very low	30.6	Very low	147 Å²	147	145.5 Å²	145.5	68%	0.681	69%	0.693	S	S	*	*			trans	58.8	152.8	135.8	-67.9	-46.7	0	0	0	119.4
799	N	28.9	Very low	30.8	Very low	114 Å²	114	143.2 Å²	143.2	61%	0.61	69%	0.686	S	S	*	*			cis	-160.1	153.5	-19.4	-120.9	0.8	0	0	0	107.5
800	Y	29.7	Very low	30.8	Very low	182 Å²	182	140.8 Å²	140.8	71%	0.714	68%	0.677	S	S	*	*			trans	60.6	143.1	148.1	-82.3	-66.1	0	0	0	124.4
801	H	31.2	Very low	30.8	Very low	131 Å²	131	141.1 Å²	141.1	61%	0.606	68%	0.68	S	S	*	*			trans	70.7	119.6	145.3	-80.5	-55.5	0	0	0	118.9
802	H	29.8	Very low	30.6	Very low	146 Å²	146	139.1 Å²	139.1	68%	0.676	68%	0.677	S	S	*	*				74.1	143.4	100.2	-79.3	-0.8	0	0	0	113.1
803	Q	29.1	Very low	30.6	Very low	126 Å²	126	136.3 Å²	136.3	59%	0.589	68%	0.676	S	S	*	*			cis	-157.7	166.7	-0.3	-121.4	172.5	20	0	0	108.5
804	Q	29.6	Very low	30.3	Very low	131 Å²	131	134.3 Å²	134.3	61%	0.612	67%	0.674	S	S	*	*			trans	41.1	122.6	143.1	-66.5	176.3	25.2	0	0	120.1
805	Q	29.8	Very low	30.1	Very low	146 Å²	146	138.1 Å²	138.1	68%	0.682	68%	0.682	S	S	*	*				74.7	149.4	113.8	-63.9	-175.7	21.6	0	0	114.8
806	Q	31.1	Very low	30	Very low	132 Å²	132	138.3 Å²	138.3	62%	0.617	68%	0.679	S	S	*	*			cis	-171	161.2	29.4	-138.1	172.2	65	0	0	108
807	Q	31.4	Very low	29.9	Very low	132 Å²	132	136.5 Å²	136.5	62%	0.617	68%	0.679	S	S	*	*			trans	65.8	153.6	154.4	-60.2	-170.6	57	0	0	118.5
808	R	29.5	Very low	29.8	Very low	189 Å²	189	138.2 Å²	138.2	71%	0.713	68%	0.684	S	S	*	*			cis	-168	155.7	-20.1	-116.3	-179.9	174.7	155	-13.5	108.5
809	N	34.1	Very low	29.7	Very low	123 Å²	123	141.2 Å²	141.2	66%	0.658	69%	0.691	S	S	*	*			trans	62.5	162	150.2	-61.2	-3.1	0	0	0	118.3
810	N	32.4	Very low	30.1	Very low	126 Å²	126	141.4 Å²	141.4	67%	0.674	70%	0.698	S	S	*	*			cis	-165.1	158.5	-39	-98.9	-16	0	0	0	106.3
811	N	30.4	Very low	30	Very low	145 Å²	145	138.2 Å²	138.2	78%	0.775	70%	0.698	S	S	*	*			trans	30	128.2	151.9	-57.3	-10.6	0	0	0	118.6
812	C	28.8	Very low	30.2	Very low	114 Å²	114	140 Å²	140	77%	0.77	71%	0.712	S	S	*	*				-173.5	160.6	66.2	-130.8	0	0	0	0	113.5
813	N	28.9	Very low	30	Very low	145 Å²	145	138 Å²	138	78%	0.775	71%	0.714	S	S	*	*			trans	-33.8	142.9	165.1	-51.4	-36.5	0	0	0	115.6
814	S	27.3	Very low	30	Very low	109 Å²	109	142.7 Å²	142.7	76%	0.762	73%	0.728	S	S	*	*				169.1	152.5	102	53.4	0	0	0	0	114.8
815	F	26.9	Very low	30.1	Very low	180 Å²	180	142 Å²	142	79%	0.789	73%	0.733	S	S	*	*			trans	60.1	100.4	143.1	-90.5	-112.5	0	0	0	122.2
816	T	25.9	Very low	29.8	Very low	101 Å²	101	141.7 Å²	141.7	62%	0.62	73%	0.731	S	S	*	*				65.1	141	118.4	59.8	0	0	0	0	123.7
817	T	28.5	Very low	29.7	Very low	112 Å²	112	140.7 Å²	140.7	69%	0.687	74%	0.736	S	S	*	*			trans	91.1	121.8	137.9	39.8	0	0	0	0	123
818	K	30.6	Very low	29.4	Very low	171 Å²	171	142.4 Å²	142.4	74%	0.743	74%	0.742	S	S	*	*			trans	88.1	98.8	135.4	-70.6	164.9	-179.9	-179.8	0	120.2
819	Y	29.1	Very low	29.5	Very low	211 Å²	211	139.3 Å²	139.3	83%	0.827	74%	0.744	S	S	*	*				57.6	166.2	112.4	-72.4	-61.8	0	0	0	120.1
820	P	37.6	Very low	29	Very low	117 Å²	117	141.3 Å²	141.3	76%	0.76	76%	0.755	S	S	*	*			cis	-127.6	168.5	9.1	27	-3.5	0	0	0	117.9
821	T	29.1	Very low	28.8	Very low	115 Å²	115	144 Å²	144	71%	0.706	77%	0.766	S	S	*	*			trans	-60.7	153.8	164.8	48	0	0	0	0	114
822	N	34.4	Very low	28.5	Very low	169 Å²	169	141.9 Å²	141.9	90%	0.904	77%	0.768	S	S	*	*			trans	-142	143.1	141.2	-116.7	-13	0	0	0	111.4
823	S	26	Very low	28.5	Very low	103 Å²	103	142 Å²	142	72%	0.72	77%	0.771	S	S	*	*			trans	-102.6	146.2	-164.8	46	0	0	0	0	112.9
824	Y	29.3	Very low	28.3	Very low	225 Å²	225	141.7 Å²	141.7	88%	0.882	77%	0.768	S	S	*	*			trans	-153	103	151.7	-132.7	-91.1	0	0	0	113.4
825	V	30.5	Very low	28.2	Very low	118 Å²	118	143.4 Å²	143.4	72%	0.715	77%	0.774	S	S	*	*			trans	36.5	123.3	142.6	-165.2	0	0	0	0	120.7
826	E	25.5	Very low	28.1	Very low	138 Å²	138	143.4 Å²	143.4	65%	0.645	77%	0.77	S	S	*	*			trans	-55.6	154.6	167.9	-73	-176.3	123.6	0	0	114.5	K828	E826-K828 VanDerWaalsContact OE2-CE 3.23Å; E826-K828 WeakPolarHBondContact OE2-CE 3.23Å; E826-K828 IonicContact OE2-NZ 2.72Å
827	P	27.9	Very low	28.1	Very low	111 Å²	111	142.7 Å²	142.7	72%	0.721	77%	0.769	S	S	*	*			trans	-113.4	112.1	130.5	32.9	-28.1	0	0	0	111.1	T829	P827-T829 PolarHBondContact O-N 3.44Å; P827-T829 VanDerWaalsContact O-N 3.12Å
828	K	25.3	Very low	28.2	Very low	169 Å²	169	143.5 Å²	143.5	74%	0.735	78%	0.776	S	S	*	*			trans	-61.9	110	163.7	-75.1	172.1	176.7	157.7	0	109.6	E826	E826-K828 VanDerWaalsContact OE2-CE 3.23Å; E826-K828 WeakPolarHBondContact OE2-CE 3.23Å; E826-K828 IonicContact OE2-NZ 2.72Å
829	T	30.5	Very low	28	Very low	124 Å²	124	145.6 Å²	145.6	76%	0.761	78%	0.78	S	S	*	*			trans	-122.2	104.2	167.9	46.5	0	0	0	0	110.7	P827 M831	P827-T829 PolarHBondContact O-N 3.44Å; P827-T829 VanDerWaalsContact O-N 3.12Å; T829-M831 PolarHBondContact O-N 3.14Å
830	N	24.9	Very low	28.1	Very low	164 Å²	164	140.4 Å²	140.4	88%	0.877	77%	0.774	S	S	*	*			trans	-63.2	118.1	169.3	-69.7	-44.6	0	0	0	109.7
831	M	27.2	Very low	27.9	Very low	183 Å²	183	145.7 Å²	145.7	90%	0.901	78%	0.779	S	S	*	*			trans	-124.6	92.1	152	-77.9	-149.3	-161	0	0	109.8	T829	T829-M831 PolarHBondContact O-N 3.14Å
832	A	25.4	Very low	28	Very low	100 Å²	100	148.6 Å²	148.6	83%	0.826	78%	0.784	S	S	*	*			trans	-71.7	125.8	166.7	0	0	0	0	0	109.8
833	S	27.2	Very low	28.2	Very low	118 Å²	118	146.2 Å²	146.2	83%	0.825	78%	0.778	S	S	*	*			trans	-116.9	64.4	169.8	52.2	0	0	0	0	111.8
834	L	26	Very low	28.3	Very low	138 Å²	138	147.7 Å²	147.7	72%	0.723	79%	0.787	S	S	*	*			trans	46.5	76.5	144.3	-69.8	160.9	0	0	0	117.4	Y836	L834-Y836 VanDerWaalsContact C-N 3.35Å; L834-Y836 HydrophobicContact CD2-CD2 4.47Å; L834-Y836 PolarHBondContact O-N 3.38Å
835	T	24.9	Very low	28.4	Very low	145 Å²	145	148.2 Å²	148.2	89%	0.89	79%	0.787	S	S	*	*			trans	-61.1	96.8	146.7	40	0	0	0	0	109.5	S837	T835-S837 PolarHBondContact O-N 3.12Å
836	Y	24.7	Very low	28.4	Very low	179 Å²	179	150.2 Å²	150.2	70%	0.702	79%	0.793	S	S	*	*			trans	-75.3	87.9	-178.8	-132.5	-81.1	0	0	0	111.2	L834	L834-Y836 VanDerWaalsContact C-N 3.35Å; L834-Y836 HydrophobicContact CD2-CD2 4.47Å; L834-Y836 PolarHBondContact O-N 3.38Å
837	S	24.8	Very low	28.5	Very low	87 Å²	87	152.2 Å²	152.2	61%	0.608	80%	0.803	S	S	*	*			trans	-70.4	126.1	164.2	177.7	0	0	0	0	109.4	T835 R839	T835-S837 PolarHBondContact O-N 3.12Å; S837-R839 PolarHBondContact O-N 3.17Å
838	P	30.8	Very low	28.8	Very low	128 Å²	128	155.3 Å²	155.3	83%	0.831	81%	0.813	S	S	*	*			trans	-76.9	67.2	174	32.6	-34.3	0	0	0	110.4	S840	P838-S840 PolarHBondContact O-N 3.44Å
839	R	28.1	Very low	29	Very low	215 Å²	215	155.4 Å²	155.4	81%	0.811	81%	0.813	S	S	*	*			trans	-79.7	113	173.9	-143	177.4	-169.8	-175.7	3.3	109.4	S837	S837-R839 PolarHBondContact O-N 3.17Å
840	S	30.1	Very low	29.3	Very low	103 Å²	103	157.6 Å²	157.6	72%	0.72	82%	0.819	S	S	*	*			trans	-1.6	115.4	161.7	56.4	0	0	0	0	117.1	P838	P838-S840 PolarHBondContact O-N 3.44Å
841	R	33.4	Very low	29.5	Very low	227 Å²	227	155.5 Å²	155.5	86%	0.857	81%	0.807	S	S	*	*			trans	-108.1	92.2	167.1	-73.1	-169.7	176.4	-152.5	0.5	111.7
842	H	30.4	Very low	29.7	Very low	177 Å²	177	154.6 Å²	154.6	82%	0.819	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-77.4	141.6	151.8	-84.9	-88	0	0	0	109.2
843	P	39.8	Very low	30	Very low	119 Å²	119	157 Å²	157	77%	0.773	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-85.2	128.9	167.5	32.5	-30.1	0	0	0	110.7
844	C	27.3	Very low	30.2	Very low	133 Å²	133	157.4 Å²	157.4	90%	0.899	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66.5	147.2	171.7	-56	0	0	0	0	111.3
845	R	31.8	Very low	30.4	Very low	236 Å²	236	155 Å²	155	89%	0.891	79%	0.786	S	S	*	*			trans	-138.1	116	157.5	-161.1	170.2	-174.7	155.7	1.3	111.1
846	L	31.3	Very low	30.5	Very low	161 Å²	161	153.3 Å²	153.3	84%	0.843	78%	0.78	S	S	*	*			trans	22.4	130.4	160.4	-75.5	139.9	0	0	0	120.7
847	Q	27	Very low	30.8	Very low	180 Å²	180	154.7 Å²	154.7	84%	0.841	79%	0.79	S	S	*	*			trans	-53.2	145.3	165.6	-63.3	164.2	-21.7	0	0	112.3
848	N	34.6	Very low	30.8	Very low	175 Å²	175	156.4 Å²	156.4	94%	0.936	80%	0.797	S	S	*	*			trans	-135.6	140.4	133.3	-123.5	-8.4	0	0	0	108.9
849	K	28.3	Very low	30.7	Very low	171 Å²	171	157 Å²	157	74%	0.743	79%	0.792	S	S	*	*			trans	-119.1	106.1	-155.6	-179.6	-171	-176.4	-174.2	0	110	L851	K849-L851 HydrophobicContact CG-CD1 4.35Å
850	I	37.1	Very low	30.8	Very low	171 Å²	171	152.8 Å²	152.8	88%	0.877	79%	0.785	S	S	*	*			trans	-131.9	122.8	162.7	-60.4	-177.1	0	0	0	107.9
851	L	29.1	Very low	30.7	Very low	119 Å²	119	153.2 Å²	153.2	62%	0.623	78%	0.78	S	S	*	*			trans	-74.7	146.6	175.1	-77.6	65.6	0	0	0	109.5	K849	K849-L851 HydrophobicContact CG-CD1 4.35Å
852	L	32.3	Very low	30.6	Very low	164 Å²	164	148.5 Å²	148.5	86%	0.859	77%	0.771	S	S	*	*				-162.8	149	100	-125.8	82.6	0	0	0	113.2
853	H	30.4	Very low	30.8	Very low	152 Å²	152	146 Å²	146	70%	0.704	76%	0.764	S	S	*	*			trans	-56.5	166.5	161.4	-85.8	-120.6	0	0	0	111.8
854	D	31.8	Very low	30.4	Very low	125 Å²	125	146.9 Å²	146.9	67%	0.668	76%	0.762	S	S	*	*			cis	-155	170.3	12.3	-135.9	-44.1	0	0	0	114.3
855	S	30.6	Very low	30.6	Very low	88 Å²	88	145.2 Å²	145.2	62%	0.615	75%	0.752	S	S	*	*			trans	-19.4	125.5	162.1	44.7	0	0	0	0	120.8
856	S	26.4	Very low	30.6	Very low	110 Å²	110	140.1 Å²	140.1	77%	0.769	75%	0.747	S	S	*	*			trans	23.1	115.9	134	61.5	0	0	0	0	120.4
857	K	30.8	Very low	30.5	Very low	208 Å²	208	136.7 Å²	136.7	90%	0.904	74%	0.737	S	S	*	*			trans	-150.4	146.8	135.7	-116.1	166.7	-172.9	174.4	0	112.3
858	T	25.5	Very low	30.6	Very low	122 Å²	122	135.2 Å²	135.2	75%	0.748	73%	0.733	S	S	*	*			trans	-83.3	175.9	-176.5	45	0	0	0	0	112.4
859	I	28.1	Very low	30.4	Very low	141 Å²	141	134 Å²	134	72%	0.723	72%	0.721	S	S	*	*			trans	110.2	115.5	151.5	-62.2	155.7	0	0	0	117.6
860	N	29.8	Very low	30.4	Very low	127 Å²	127	133 Å²	133	68%	0.679	72%	0.722	S	S	*	*			trans	78.6	121	144.6	-78.2	1	0	0	0	124.9
861	N	29.7	Very low	30.3	Very low	112 Å²	112	130.9 Å²	130.9	60%	0.599	72%	0.721	S	S	*	*				83.2	105.8	115.8	-66.5	-1.1	0	0	0	122.2
862	N	30.7	Very low	30.4	Very low	128 Å²	128	132.6 Å²	132.6	68%	0.684	73%	0.731	S	S	*	*				84	151.4	108.4	-66.9	-3.9	0	0	0	121.6
863	N	33.4	Very low	30.5	Very low	124 Å²	124	129.7 Å²	129.7	66%	0.663	72%	0.722	S	S	*	*			trans	79.7	104.3	157.8	-61.1	-18.2	0	0	0	115.1
864	N	31.5	Very low	30.5	Very low	138 Å²	138	127 Å²	127	74%	0.738	72%	0.72	S	S	*	*				86.1	140.1	89.6	-62.8	-15.6	0	0	0	109.2
865	S	32.8	Very low	30.4	Very low	98 Å²	98	125.8 Å²	125.8	69%	0.685	72%	0.722	S	S	*	*			cis	-158.8	152.5	26.8	-27.2	0	0	0	0	110.6
866	T	30.8	Very low	30.2	Very low	128 Å²	128	128.6 Å²	128.6	79%	0.785	73%	0.729	S	S	*	*				23.1	141.6	126.2	62.6	0	0	0	0	119.1
867	S	30	Very low	30.4	Very low	90 Å²	90	129.5 Å²	129.5	63%	0.629	72%	0.724	S	S	*	*			cis	172.3	161.9	13.5	41.5	0	0	0	0	113.4
868	I	29.1	Very low	30.3	Very low	148 Å²	148	127.5 Å²	127.5	76%	0.759	72%	0.718	S	S	*	*			trans	78.2	131.3	138.1	-77.4	161.1	0	0	0	121.5
869	H	30.5	Very low	30.5	Very low	149 Å²	149	127.1 Å²	127.1	69%	0.69	72%	0.72	S	S	*	*			trans	59.1	119.7	157.2	-86	-129.8	0	0	0	120.1
870	M	27.9	Very low	30.8	Very low	152 Å²	152	126.2 Å²	126.2	75%	0.749	72%	0.721	S	S	*	*				71.6	99.1	69.1	-71.8	-128.5	-78.4	0	0	115
871	S	34.8	Very low	30.9	Very low	125 Å²	125	128.2 Å²	128.2	87%	0.874	72%	0.724	S	S	*	*				-173.2	135.4	123.1	33.6	0	0	0	0	113
872	N	30.4	Very low	31	Very low	155 Å²	155	130.8 Å²	130.8	83%	0.829	74%	0.737	S	S	*	*			trans	-66.7	178.5	166.5	-93.9	-13.1	0	0	0	112.1
873	P	36.1	Very low	31	Very low	103 Å²	103	130.5 Å²	130.5	67%	0.669	73%	0.734	S	S	*	*			cis	-138.8	-158.4	-37.4	38.8	-19.8	0	0	0	111.6
874	S	29.1	Very low	31.1	Very low	95 Å²	95	131 Å²	131	66%	0.664	74%	0.742	S	S	*	*			trans	71.2	115.3	150.8	55.4	0	0	0	0	121.4
875	S	29.9	Very low	31.1	Very low	101 Å²	101	130.6 Å²	130.6	71%	0.706	75%	0.745	S	S	*	*				90.9	141.2	129.7	81.1	0	0	0	0	121.6
876	L	27.9	Very low	31.1	Very low	147 Å²	147	131.7 Å²	131.7	77%	0.77	75%	0.75	S	S	*	*			trans	66.8	118.5	147.5	-94.9	65	0	0	0	121.2
877	I	29.7	Very low	31.1	Very low	129 Å²	129	131.8 Å²	131.8	66%	0.662	75%	0.745	S	S	*	*				85.9	110.2	125	-74.4	174.3	0	0	0	121
878	Q	28.3	Very low	31.2	Very low	166 Å²	166	136.6 Å²	136.6	78%	0.776	76%	0.76	S	S	*	*			trans	60.8	136.4	132.1	-62.2	177.7	-20.3	0	0	123.7
879	S	29.5	Very low	31.3	Very low	113 Å²	113	135.9 Å²	135.9	79%	0.79	76%	0.758	S	S	*	*			trans	72.4	147.1	152.7	80.5	0	0	0	0	115.7
880	T	34.2	Very low	31.2	Very low	122 Å²	122	136.1 Å²	136.1	75%	0.748	76%	0.763	S	S	*	*			cis	-141.5	139.3	23.7	34.2	0	0	0	0	110.8
881	K	32.4	Very low	31.5	Very low	170 Å²	170	135.4 Å²	135.4	74%	0.739	77%	0.768	S	S	*	*				92.2	106.9	60.9	-152	-171.9	-161.4	-176.3	0	113.7	I883	K881-I883 HydrophobicContact CG-CD1 4.01Å; K881-I883 HydrophobicContact CG-CG1 4.49Å
882	L	32.9	Very low	31.4	Very low	166 Å²	166	140.1 Å²	140.1	87%	0.869	77%	0.766	S	S	*	*			trans	175.1	97.2	155.1	-97.6	151.5	0	0	0	106.3
883	I	30.4	Very low	31.7	Very low	121 Å²	121	140.6 Å²	140.6	62%	0.621	77%	0.767	S	S	*	*				57	107.1	63	-46.5	176.6	0	0	0	109.4	K881	K881-I883 HydrophobicContact CG-CD1 4.01Å; K881-I883 HydrophobicContact CG-CG1 4.49Å
884	T	34.8	Very low	31.6	Very low	134 Å²	134	143.7 Å²	143.7	82%	0.822	77%	0.772	S	S	*	*				-149.6	154.1	67.2	40	0	0	0	0	115.5
885	T	30.9	Very low	32	Very low	131 Å²	131	146.9 Å²	146.9	80%	0.804	78%	0.777	S	S	*	*			trans	-110.6	159.1	163.9	51.4	0	0	0	0	109.5
886	P	33.6	Very low	32.3	Very low	121 Å²	121	149.9 Å²	149.9	79%	0.786	79%	0.785	S	S	*	*				-150.8	133.9	88.5	36.1	-16.3	0	0	0	117.3
887	N	29.7	Very low	32.6	Very low	129 Å²	129	153.9 Å²	153.9	69%	0.69	79%	0.79	S	S	*	*				19.7	111.3	129.2	-162.5	6.6	0	0	0	119.5	N889	N887-N889 PolarHBondContact OD1-N 3.13Å
888	M	32.9	Very low	32.8	Very low	192 Å²	192	156.2 Å²	156.2	95%	0.946	80%	0.798	S	S	*	*			trans	-129.8	108.9	141.5	-82.3	-141.6	-73.3	0	0	110.6
889	N	30.8	Very low	33.3	Very low	133 Å²	133	155.8 Å²	155.8	71%	0.711	80%	0.8	S	S	*	*			trans	-66.7	177.6	166.3	-106.7	-39.9	0	0	0	111.8	N887	N887-N889 PolarHBondContact OD1-N 3.13Å
890	L	28.8	Very low	33.3	Very low	154 Å²	154	161.2 Å²	161.2	81%	0.806	80%	0.803	S	S	*	*			trans	72.1	106.1	172	-101.8	63.8	0	0	0	116.5
891	T	33.6	Very low	33.3	Very low	137 Å²	137	162.6 Å²	162.6	84%	0.84	81%	0.806	S	S	*	*	S	Bend		167.6	-16.8	127.5	38.5	0	0	0	0	113.7	I893	T891-I893 VanDerWaalsContact C-N 3.33Å; T891-I893 PolarHBondContact O-N 2.82Å
892	R	33.3	Very low	33.3	Very low	224 Å²	224	161.9 Å²	161.9	85%	0.845	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	13.9	-172.5	-119.4	177.9	-170	168.1	5.4	117.5
893	I	37	Very low	33.5	Very low	164 Å²	164	159 Å²	159	84%	0.841	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-12.6	-179	-71.6	174.7	0	0	0	113.2	T891	T891-I893 VanDerWaalsContact C-N 3.33Å; T891-I893 PolarHBondContact O-N 2.82Å
894	Q	34.6	Very low	34.1	Very low	168 Å²	168	158.7 Å²	158.7	79%	0.785	81%	0.809	S	S	*	*	S	Bend	trans	-100.1	-11.2	-171.8	-79.2	-176.9	-23.8	0	0	117.3
895	Q	36.6	Very low	34.4	Very low	163 Å²	163	157.7 Å²	157.7	76%	0.762	81%	0.805	S	S	*	*	G	3₁₀ helix	trans	-85.1	-10.5	-177.6	-75.4	-177.4	-27	0	0	115.3	R897	Q895-R897 VanDerWaalsContact C-N 3.32Å; Q895-R897 PolarHBondContact O-N 2.94Å
896	N	37.5	Very low	35.2	Very low	163 Å²	163	157.3 Å²	157.3	87%	0.872	81%	0.805	S	S	*	*	G	3₁₀ helix	trans	-88.3	20.8	178.3	-82.7	-14.5	0	0	0	114.7
897	R	34	Very low	35.6	Very low	231 Å²	231	159.3 Å²	159.3	87%	0.872	81%	0.808	S	S	*	*	G	3₁₀ helix	trans	-122.9	6.2	-177.8	-88.5	-172.8	174.1	-175.4	-0.8	116.5	Q895	Q895-R897 VanDerWaalsContact C-N 3.32Å; Q895-R897 PolarHBondContact O-N 2.94Å
898	Q	33.8	Very low	36.1	Very low	179 Å²	179	158.4 Å²	158.4	84%	0.836	81%	0.809	S	S	*	*	S	Bend	trans	-117.7	12	-172	-106.9	178.9	-12.1	0	0	117.1
899	I	37.2	Very low	36.8	Very low	157 Å²	157	154.4 Å²	154.4	81%	0.805	80%	0.798	S	S	*	*			trans	-124.8	56.7	170.3	-42.3	-179.9	0	0	0	110.3
900	R	29.6	Very low	37.3	Very low	227 Å²	227	153 Å²	153	86%	0.857	80%	0.795	S	S	*	*			trans	-92.3	145.7	153.5	-88.3	-174	171.7	-170	-2.8	107.8
901	N	34.1	Very low	37.8	Very low	151 Å²	151	149.9 Å²	149.9	81%	0.807	79%	0.785	S	S	*	*			trans	72.6	89.6	-175.4	-45.7	-13.5	0	0	0	113.2
902	N	32.8	Very low	38	Very low	154 Å²	154	151.1 Å²	151.1	82%	0.824	78%	0.779	S	S	*	*			trans	-163.6	107.9	148.6	-92.5	-34.5	0	0	0	108.4
903	S	38.2	Very low	38.5	Very low	106 Å²	106	146.9 Å²	146.9	74%	0.741	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-63.8	149.7	169.6	34.9	0	0	0	0	110.4
904	P	42.5	Very low	38.4	Very low	115 Å²	115	144.9 Å²	144.9	75%	0.747	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-60.5	142.4	172.2	26.8	-33.9	0	0	0	109.7
905	P	42.1	Very low	38.6	Very low	113 Å²	113	143.2 Å²	143.2	73%	0.734	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-63.5	145.3	-178.5	26.9	-34.7	0	0	0	110.6
906	P	45.9	Very low	38.5	Very low	123 Å²	123	142.7 Å²	142.7	80%	0.799	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-62.2	140.5	175	27	-33.8	0	0	0	110.2
907	L	42	Very low	38.4	Very low	162 Å²	162	143.2 Å²	143.2	85%	0.848	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-57.2	141.3	171.8	-80.2	148.3	0	0	0	109.9
908	P	41.4	Very low	38.5	Very low	110 Å²	110	138.1 Å²	138.1	71%	0.714	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-61.2	143.1	178	26.3	-34.2	0	0	0	110.3
909	P	46.6	Very low	38.4	Very low	109 Å²	109	133.4 Å²	133.4	71%	0.708	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-61.9	148.7	177.6	26.9	-34.6	0	0	0	110.6
910	P	42.1	Very low	38	Very low	102 Å²	102	129.1 Å²	129.1	66%	0.662	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-58.3	148.8	177.6	24.2	-33.5	0	0	0	111.3	K912	P910-K912 PolarHBondContact O-N 3.38Å
911	P	38.4	Very low	38.1	Very low	90 Å²	90	125.8 Å²	125.8	58%	0.584	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-57.1	125.5	-174.5	-25.4	34.3	0	0	0	112.6	H913 L914	P911-H913 PolarHBondContact O-N 3.3Å; P911-L914 PolarHBondContact O-N 3.42Å; P911-L914 VanDerWaalsContact O-N 3.14Å
912	K	39.4	Very low	37.9	Very low	163 Å²	163	123.9 Å²	123.9	71%	0.709	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-56.5	-19.1	-175.3	-66	-177	177	-178.3	0	114.3	P910 L914 I915	P910-K912 PolarHBondContact O-N 3.38Å; K912-L914 VanDerWaalsContact C-N 3.29Å; K912-L914 PolarHBondContact O-N 3.07Å; K912-I915 PolarHBondContact O-N 3.24Å
913	H	42.1	Very low	37.7	Very low	135 Å²	135	122 Å²	122	63%	0.625	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-69.5	-20.1	-179.5	-45.2	-60.5	0	0	0	114	P911 Q916	P911-H913 PolarHBondContact O-N 3.3Å; H913-Q916 PolarHBondContact O-N 2.93Å
914	L	35.9	Very low	37.4	Very low	121 Å²	121	124.1 Å²	124.1	63%	0.634	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-77.2	-30.1	178.9	-134.1	156.5	0	0	0	111.9	P911 K912 Q916 L918	P911-L914 PolarHBondContact O-N 3.42Å; P911-L914 VanDerWaalsContact O-N 3.14Å; K912-L914 VanDerWaalsContact C-N 3.29Å; K912-L914 PolarHBondContact O-N 3.07Å; L914-Q916 VanDerWaalsContact C-N 3.27Å; L914-Q916 PolarHBondContact O-N 2.94Å; L914-L918 HydrophobicContact CD2-CD1 4.23Å; L914-L918 WeakPolarHBondContact O-CD1 3.39Å
915	I	38.2	Very low	36.8	Very low	134 Å²	134	128.6 Å²	128.6	69%	0.687	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-21.6	174.8	-64.6	167.9	0	0	0	111.4	K912	K912-I915 PolarHBondContact O-N 3.24Å
916	Q	34.1	Very low	36.2	Very low	152 Å²	152	128.2 Å²	128.2	71%	0.71	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-8.1	179.3	-70.3	177.4	-33.8	0	0	114.3	H913 L914	H913-Q916 PolarHBondContact O-N 2.93Å; L914-Q916 VanDerWaalsContact C-N 3.27Å; L914-Q916 PolarHBondContact O-N 2.94Å
917	M	35.8	Very low	35.5	Very low	174 Å²	174	128.9 Å²	128.9	86%	0.857	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-17.8	171.6	-70	-168.7	74.5	0	0	113.6	G919	M917-G919 PolarHBondContact O-N 3.36Å
918	L	37	Very low	35	Very low	124 Å²	124	126 Å²	126	65%	0.649	73%	0.728	S	S	*	*	S	Bend	trans	-84.6	97.8	160.9	-75.7	96.3	0	0	0	107.6	L914 G920	L914-L918 HydrophobicContact CD2-CD1 4.23Å; L914-L918 WeakPolarHBondContact O-CD1 3.39Å; L918-G920 PolarHBondContact O-N 3.22Å
919	G	31.2	Very low	34.4	Very low	79 Å²	79	129.9 Å²	129.9	81%	0.814	74%	0.736	S	S	*	*			trans	-56	108.6	-179.5	0	0	0	0	0	111.7	M917	M917-G919 PolarHBondContact O-N 3.36Å
920	G	28.8	Very low	33.5	Very low	67 Å²	67	128 Å²	128	69%	0.691	74%	0.737	S	S	*	*			trans	-85.7	124.3	165.4	0	0	0	0	0	109.6	L918	L918-G920 PolarHBondContact O-N 3.22Å
921	D	31.5	Very low	32.7	Very low	158 Å²	158	128.6 Å²	128.6	85%	0.845	74%	0.743	S	S	*	*			trans	-166.3	154.8	148.8	-99.9	-25.7	0	0	0	109.2
922	S	30.5	Very low	32.5	Very low	111 Å²	111	130.5 Å²	130.5	78%	0.776	76%	0.756	S	S	*	*			trans	63.1	92.6	-174.8	61.1	0	0	0	0	115.7
923	S	27.1	Very low	32.1	Very low	114 Å²	114	130.7 Å²	130.7	80%	0.797	76%	0.759	S	S	*	*			cis	80.2	76.3	35.3	94.3	0	0	0	0	115.7
924	I	32.8	Very low	31.7	Very low	150 Å²	150	134 Å²	134	77%	0.769	78%	0.775	S	S	*	*			trans	-139.4	101.5	160.6	-64.6	-172.7	0	0	0	108.1
925	Y	29.5	Very low	31.3	Very low	210 Å²	210	133.3 Å²	133.3	82%	0.824	78%	0.775	S	S	*	*			trans	47.8	119	170.7	-56	-77.7	0	0	0	118.4
926	S	29.9	Very low	31.1	Very low	104 Å²	104	133.9 Å²	133.9	73%	0.727	78%	0.78	S	S	*	*			cis	60.6	80.1	19.9	-49.4	0	0	0	0	115.8
927	T	30.5	Very low	31.1	Very low	138 Å²	138	131.8 Å²	131.8	85%	0.847	78%	0.778	S	S	*	*				169	158.5	113.9	39	0	0	0	0	112.1
928	P	31.9	Very low	30.8	Very low	102 Å²	102	131.6 Å²	131.6	66%	0.662	77%	0.774	S	S	*	*			trans	-89	-175.8	178.7	37.7	-36.6	0	0	0	113.1
929	H	29	Very low	30.7	Very low	190 Å²	190	134.8 Å²	134.8	88%	0.88	78%	0.783	S	S	*	*			trans	100.9	146	173	-62.1	-80	0	0	0	117.5
930	G	26.8	Very low	30.7	Very low	71 Å²	71	137.4 Å²	137.4	73%	0.732	78%	0.777	S	S	*	*			trans	97.1	100.1	140.1	0	0	0	0	0	117.1
931	S	27.2	Very low	30.8	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-60.6	134.4	157	44.4	0	0	0	0	111	Q933	S931-Q933 PolarHBondContact O-N 3.46Å
932	P	34	Very low	30.9	Very low	130 Å²	130	140.1 Å²	140.1	84%	0.844	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-76.4	122.3	171.1	-5.6	22.2	0	0	0	110.6
933	Q	29.3	Very low	31.1	Very low	168 Å²	168	141.4 Å²	141.4	79%	0.785	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-67.3	138.8	158.7	-68.8	173.7	-34.9	0	0	109.3	S931 V935	S931-Q933 PolarHBondContact O-N 3.46Å; Q933-V935 HydrophobicContact CB-CG2 4.26Å
934	Q	33.7	Very low	31.4	Very low	203 Å²	203	141.9 Å²	141.9	95%	0.949	76%	0.763	S	S	*	*			trans	-104.5	109.9	147	-89.5	-169.3	-19.2	0	0	108.6
935	V	29.4	Very low	31.3	Very low	107 Å²	107	142 Å²	142	65%	0.648	77%	0.765	S	S	*	*			trans	-86.2	122.1	172.5	171.4	0	0	0	0	108.4	Q933	Q933-V935 HydrophobicContact CB-CG2 4.26Å
936	N	34.1	Very low	31.5	Very low	147 Å²	147	137.2 Å²	137.2	79%	0.786	76%	0.763	S	S	*	*			trans	-176.2	135.7	155	-101.2	-20.7	0	0	0	109.1
937	T	33.5	Very low	31.6	Very low	107 Å²	107	139.6 Å²	139.6	66%	0.656	77%	0.767	S	S	*	*			cis	-161.6	142.4	-24.1	-8.9	0	0	0	0	107.8
938	H	29.6	Very low	31.7	Very low	171 Å²	171	138.2 Å²	138.2	79%	0.792	76%	0.763	S	S	*	*			trans	8.8	109.5	159.8	-88.2	-104.5	0	0	0	120.9
939	K	33.8	Very low	31.7	Very low	191 Å²	191	140.3 Å²	140.3	83%	0.83	77%	0.769	S	S	*	*				173.4	115.7	109.8	-96.1	179.2	171.2	179.2	0	109.6
940	L	31.8	Very low	31.8	Very low	133 Å²	133	137.9 Å²	137.9	70%	0.696	77%	0.767	S	S	*	*				80.4	120.7	80	-124.2	87.8	0	0	0	114.7
941	M	31.1	Very low	31.8	Very low	146 Å²	146	140.6 Å²	140.6	72%	0.719	77%	0.772	S	S	*	*			trans	84.8	112.6	148.3	-72.3	-175.7	171.6	0	0	122.3
942	I	34.2	Very low	31.9	Very low	136 Å²	136	142.9 Å²	142.9	70%	0.697	78%	0.775	S	S	*	*				67.2	117.8	118.9	-61	167.9	0	0	0	115.9
943	L	33.8	Very low	31.8	Very low	139 Å²	139	143.4 Å²	143.4	73%	0.728	77%	0.771	S	S	*	*				-171.9	148.9	69.3	-163.7	73.1	0	0	0	111.5
944	N	33.7	Very low	31.9	Very low	124 Å²	124	141.3 Å²	141.3	66%	0.663	77%	0.765	S	S	*	*			trans	20.9	127.9	151	-54.8	-6.7	0	0	0	119.4
945	N	30.7	Very low	31.9	Very low	152 Å²	152	139.6 Å²	139.6	81%	0.813	76%	0.761	S	S	*	*			cis	50.1	83.4	45.8	-156.1	21.3	0	0	0	115.7
946	S	34.5	Very low	32	Very low	110 Å²	110	139.1 Å²	139.1	77%	0.769	76%	0.762	S	S	*	*			trans	-155.6	121.7	158.9	-76.5	0	0	0	0	110.4
947	N	31	Very low	31.9	Very low	153 Å²	153	138 Å²	138	82%	0.818	76%	0.761	S	S	*	*			trans	-41.2	132.4	-178.1	-59.3	-33.1	0	0	0	115.5
948	S	33.1	Very low	31.8	Very low	109 Å²	109	140.6 Å²	140.6	76%	0.762	77%	0.77	S	S	*	*				-178.1	129.4	106	39.3	0	0	0	0	113
949	N	31.7	Very low	31.8	Very low	147 Å²	147	142.7 Å²	142.7	79%	0.786	77%	0.773	S	S	*	*			trans	43.3	114.4	151	-57.4	-10.5	0	0	0	120.4
950	T	30.2	Very low	31.7	Very low	138 Å²	138	139.2 Å²	139.2	85%	0.847	77%	0.772	S	S	*	*			trans	62.6	84.8	151.7	55.5	0	0	0	0	118.8
951	P	28.3	Very low	32.1	Very low	128 Å²	128	139.1 Å²	139.1	83%	0.831	78%	0.78	S	S	*	*			trans	-101.6	119.5	157.7	34.4	-24.1	0	0	0	110.7
952	N	28.4	Very low	32.2	Very low	161 Å²	161	139.8 Å²	139.8	86%	0.861	79%	0.786	S	S	*	*			trans	-138.5	85	164.4	-141	16.7	0	0	0	107.3
953	N	32.5	Very low	32.2	Very low	141 Å²	141	141.6 Å²	141.6	75%	0.754	80%	0.797	S	S	*	*			trans	179.6	131.2	161.7	-97.4	-20.6	0	0	0	114.3
954	N	31.5	Very low	32.1	Very low	125 Å²	125	142.2 Å²	142.2	67%	0.668	80%	0.8	S	S	*	*			trans	76.5	145	132.7	-64.8	-15.6	0	0	0	124
955	I	33.4	Very low	32.1	Very low	167 Å²	167	144.6 Å²	144.6	86%	0.856	81%	0.807	S	S	*	*			trans	77.7	130.3	160.7	-60.3	140	0	0	0	113.7
956	S	31.6	Very low	32.1	Very low	96 Å²	96	143 Å²	143	67%	0.671	80%	0.802	S	S	*	*			cis	-148.2	141.1	24.8	51.6	0	0	0	0	116.1
957	V	31.2	Very low	32	Very low	124 Å²	124	142.2 Å²	142.2	75%	0.752	80%	0.796	S	S	*	*			trans	61.7	106.5	138.5	-176.8	0	0	0	0	119.7
958	D	32.6	Very low	31.8	Very low	161 Å²	161	139.8 Å²	139.8	86%	0.861	79%	0.791	S	S	*	*			trans	-153.2	157.8	132.2	-117	-29.4	0	0	0	110.7
959	Y	28.5	Very low	31.8	Very low	216 Å²	216	141.8 Å²	141.8	85%	0.847	79%	0.792	S	S	*	*			trans	-82.1	127.6	-163.8	-88.5	-108.1	0	0	0	115.9
960	S	32.6	Very low	31.6	Very low	117 Å²	117	139.3 Å²	139.3	82%	0.818	79%	0.786	S	S	*	*			trans	-166.1	138.8	150.4	-82.9	0	0	0	0	111.1
961	P	39.7	Very low	31.6	Very low	131 Å²	131	141 Å²	141	85%	0.851	78%	0.782	S	S	*	*			trans	-99.3	115.8	-179.9	34.7	-28.3	0	0	0	112.6
962	D	32.7	Very low	31.7	Very low	160 Å²	160	141.5 Å²	141.5	86%	0.856	77%	0.773	S	S	*	*			trans	-115.9	136	159.6	-123.7	-18.5	0	0	0	108.2
963	L	34.4	Very low	31.9	Very low	175 Å²	175	141.4 Å²	141.4	92%	0.916	77%	0.767	S	S	*	*			trans	-124.9	87.5	179.8	-96.3	168.1	0	0	0	110.5
964	L	31.1	Very low	31.8	Very low	152 Å²	152	139.7 Å²	139.7	80%	0.796	77%	0.766	S	S	*	*			trans	-84.3	142	156.1	-77.1	164.6	0	0	0	109.2
965	H	35.4	Very low	31.9	Very low	174 Å²	174	138.4 Å²	138.4	81%	0.806	77%	0.767	S	S	*	*			trans	176.5	131.5	133.4	-105.7	-82.2	0	0	0	112.2
966	V	29.2	Very low	32	Very low	118 Å²	118	136.5 Å²	136.5	72%	0.715	76%	0.763	S	S	*	*			trans	47.5	128	132.7	176.2	0	0	0	0	118
967	S	32.6	Very low	32.1	Very low	93 Å²	93	138.4 Å²	138.4	65%	0.65	77%	0.771	S	S	*	*			cis	-163.8	141	47.8	-5	0	0	0	0	108.6
968	S	28	Very low	32.2	Very low	102 Å²	102	136.7 Å²	136.7	71%	0.713	78%	0.779	S	S	*	*				47.1	147.9	92	72.9	0	0	0	0	117.9
969	I	32.4	Very low	32.1	Very low	152 Å²	152	134 Å²	134	78%	0.779	77%	0.773	S	S	*	*			trans	77.3	89.9	172.8	-50.5	166	0	0	0	113.5
970	S	28.2	Very low	32.1	Very low	95 Å²	95	133.1 Å²	133.1	66%	0.664	77%	0.773	S	S	*	*				81.7	135.6	71.4	88.3	0	0	0	0	116.5
971	K	29.3	Very low	32.1	Very low	172 Å²	172	137.2 Å²	137.2	75%	0.748	77%	0.771	S	S	*	*			trans	84.1	136.6	148.1	-82.1	-179.9	171.2	-168.9	0	121.8
972	H	30.9	Very low	31.6	Very low	140 Å²	140	137.7 Å²	137.7	65%	0.648	76%	0.762	S	S	*	*			trans	62.8	143.7	150.6	-65	-61.9	0	0	0	117.5
973	E	32.1	Very low	31.6	Very low	159 Å²	159	136.1 Å²	136.1	74%	0.743	76%	0.758	S	S	*	*			cis	-159.2	173.4	-12.4	-143.2	148.5	-140	0	0	111
974	S	30.3	Very low	31.5	Very low	105 Å²	105	134.2 Å²	134.2	73%	0.734	75%	0.749	S	S	*	*			trans	-68.8	178.8	167.9	64	0	0	0	0	112.3
975	S	33.8	Very low	31.5	Very low	98 Å²	98	132.3 Å²	132.3	69%	0.685	75%	0.748	S	S	*	*			cis	-169.4	166.5	25.6	57.7	0	0	0	0	111
976	T	35.1	Very low	31.4	Very low	126 Å²	126	128 Å²	128	77%	0.773	75%	0.75	S	S	*	*			trans	-178	104	143.6	17.9	0	0	0	0	110.1
977	T	34.9	Very low	31.4	Very low	137 Å²	137	128.7 Å²	128.7	84%	0.84	76%	0.755	S	S	*	*				78.9	121.4	100.6	56.1	0	0	0	0	116.9
978	G	33.5	Very low	31.5	Very low	88 Å²	88	129.9 Å²	129.9	91%	0.907	76%	0.759	S	S	*	*			trans	174.5	65.1	173.9	0	0	0	0	0	113.4
979	S	28.9	Very low	31.8	Very low	105 Å²	105	131.5 Å²	131.5	73%	0.734	76%	0.759	S	S	*	*			trans	-99.9	135.5	-178.6	176.2	0	0	0	0	112.2
980	F	30.1	Very low	31.7	Very low	196 Å²	196	133.1 Å²	133.1	86%	0.86	77%	0.766	S	S	*	*			trans	-168.2	112.7	150.6	-109.6	-81.9	0	0	0	105.9
981	R	31.8	Very low	31.9	Very low	203 Å²	203	132.6 Å²	132.6	77%	0.766	78%	0.775	S	S	*	*				39.6	139.8	81.3	-73.6	-165.6	180	-156.6	1.2	113.3
982	Q	28.6	Very low	31.9	Very low	141 Å²	141	128.5 Å²	128.5	66%	0.659	78%	0.781	S	S	*	*			cis	164.9	122	-5.3	161.3	-174	-7.1	0	0	102.2
983	T	33.7	Very low	32	Very low	128 Å²	128	127 Å²	127	79%	0.785	79%	0.787	S	S	*	*			trans	174.4	146.4	163.9	36.3	0	0	0	0	106.3
984	D	31.4	Very low	31.8	Very low	134 Å²	134	126.2 Å²	126.2	72%	0.717	79%	0.787	S	S	*	*			cis	-178.5	164	-26.6	-104.2	-32.7	0	0	0	104.8
985	S	30.5	Very low	32.1	Very low	113 Å²	113	129.1 Å²	129.1	79%	0.79	79%	0.792	S	S	*	*			trans	-62	137.5	-178.2	50.4	0	0	0	0	114.5
986	G	34.6	Very low	32	Very low	82 Å²	82	130.8 Å²	130.8	85%	0.845	79%	0.794	S	S	*	*			trans	-128.9	93.7	169.4	0	0	0	0	0	112.1
987	V	28.5	Very low	31.9	Very low	134 Å²	134	129.7 Å²	129.7	81%	0.812	79%	0.791	S	S	*	*			trans	-89.6	129.8	174.7	172.8	0	0	0	0	109.8
988	T	35.2	Very low	31.9	Very low	118 Å²	118	131.2 Å²	131.2	72%	0.724	79%	0.789	S	S	*	*			trans	-157.7	123.8	154.4	44.1	0	0	0	0	113.6
989	N	33.6	Very low	31.8	Very low	135 Å²	135	135.1 Å²	135.1	72%	0.722	78%	0.784	S	S	*	*			trans	65.3	118.2	138.6	-54.5	-9.2	0	0	0	119.4
990	M	30.1	Very low	31.9	Very low	187 Å²	187	141.3 Å²	141.3	92%	0.921	79%	0.793	S	S	*	*				87	131.2	55.6	-76	-154.7	-158.5	0	0	114.8
991	G	33	Very low	31.9	Very low	83 Å²	83	140.4 Å²	140.4	86%	0.856	79%	0.791	S	S	*	*			trans	93.1	124.1	178.2	0	0	0	0	0	112.6
992	G	29	Very low	32.1	Very low	86 Å²	86	135.4 Å²	135.4	89%	0.887	79%	0.785	S	S	*	*			cis	104.5	118.3	37.5	0	0	0	0	0	106.9
993	S	32.9	Very low	32.4	Very low	110 Å²	110	136 Å²	136	77%	0.769	79%	0.792	S	S	*	*				-160.4	142.2	52.7	-169.8	0	0	0	0	107.5
994	L	29.2	Very low	32.3	Very low	141 Å²	141	135.7 Å²	135.7	74%	0.738	79%	0.791	S	S	*	*				51.3	104.9	73	-118.7	160	0	0	0	113.9
995	I	36.7	Very low	32.6	Very low	166 Å²	166	136.9 Å²	136.9	85%	0.851	80%	0.795	S	S	*	*			trans	-166.8	135.2	141.6	-93.6	150.6	0	0	0	107.4
996	D	31.2	Very low	32.7	Very low	133 Å²	133	137.6 Å²	137.6	71%	0.711	80%	0.795	S	S	*	*			trans	-81.8	-167	-175.4	-63.4	-76.9	0	0	0	114.4
997	S	33.2	Very low	33	Very low	103 Å²	103	143.3 Å²	143.3	72%	0.72	81%	0.813	S	S	*	*			trans	86.7	130.6	169.3	-55.2	0	0	0	0	115.9
998	E	35.4	Very low	33.2	Very low	170 Å²	170	143.8 Å²	143.8	79%	0.794	81%	0.813	S	S	*	*			cis	-156.9	168.3	2.9	-126.5	160	-144	0	0	111.7
999	Q	31.5	Very low	33.1	Very low	170 Å²	170	145.1 Å²	145.1	79%	0.794	82%	0.818	S	S	*	*			trans	-69.3	154.7	-178.9	-62.5	132.7	-43.3	0	0	112.8
1000	Y	30.2	Very low	33.1	Very low	235 Å²	235	145.7 Å²	145.7	92%	0.922	82%	0.823	S	S	*	*				-178.6	99.2	126.8	-106.1	-72.4	0	0	0	112.3
1001	E	30.4	Very low	33.2	Very low	176 Å²	176	143.2 Å²	143.2	82%	0.822	82%	0.818	S	S	*	*			trans	-104	172.2	141.9	-107.7	-168	-179.2	0	0	107
1002	P	35.1	Very low	33.3	Very low	98 Å²	98	147 Å²	147	64%	0.636	82%	0.815	S	S	*	*			cis	-123.8	-177.9	-18.7	36.1	-19.9	0	0	0	111.1
1003	N	35.4	Very low	33.5	Very low	154 Å²	154	151.1 Å²	151.1	82%	0.824	81%	0.81	S	S	*	*			trans	-169	109.8	137.4	-101.2	-29.2	0	0	0	112.9
1004	T	32.1	Very low	33.6	Very low	122 Å²	122	154 Å²	154	75%	0.748	81%	0.813	S	S	*	*			trans	-51.7	133.7	155.8	31.6	0	0	0	0	112.5
1005	I	37.7	Very low	33.9	Very low	159 Å²	159	155 Å²	155	82%	0.815	82%	0.819	S	S	*	*			trans	-128.8	127.6	142.2	-63	-177	0	0	0	107.4
1006	V	31.4	Very low	33.7	Very low	128 Å²	128	154.1 Å²	154.1	78%	0.776	82%	0.816	S	S	*	*			trans	-97.3	127.7	173.9	171.7	0	0	0	0	108.8
1007	T	40.9	Very low	33.9	Very low	201 Å²	201	156 Å²	156	100%	1.233	83%	0.826	S	S	*	*			trans	-148.7	0	150.6	51.3	0	0	0	0	108.4

Retrieved 1,007 of 1,007 residues in 129.2 ms (Link to these results)

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