A0A3Q0KSG7_SCHMA Loading...

Bromodomain containing, putative AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KSG7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,162 aa.

						>A0A3Q0KSG7_SCHMA|A0A3Q0KSG7
MLNEMNSGGLHCVADSDNALKLKISFSGGKCSQDCSVSSESDVLTEVTSRNLYTVLSEIHQNLVRRDPRGIFANPVTDDIAVGYSEVISKPMDLGTIYNRLKSRAYYRSATEYLADVTLMCNNAMVYNPPDTIYYQRARKLLAFCRKQMTVSSLQKACKDIPGGLTVEEIGDLTSVEAEMNQMNRVKPFHRSSKLHTHSQSELSDHKFRFSPKRVDSNRNIPPTVQPLVNHSFQKHRGRPKSHLSTSSRLYHINRKALKSYSHFSSEEHLSRDDLKKKNNNDNTEKCISTVEFKKSFASLTSSKKVQLTHQDTSIRSSVNTPILPIPHRRGRGRPRKIKIDDIQTSSGSSTLNISTQLQDSSLISSNSTPIDGKRHSENLSTLSHDHYSRSICVNNSFENSITGHSNLSLGPTQSEYENSLTESVMKIESNSQYTQEFLNNEPIVLLNIAPSTPSSSPLSGSSCKTFIGKTSFVSKKSQKLSSDIQSNKLSQFKMDRNKEMFNYLDKTNSVNDEDSVYNDSCDENVERSHHQIVDNVPNEILIQAKKAAEESAAKLKRKYEFIASSESNNEYIGPKIMCLNCSNQGEISAVECPKARSSINSQHYPNLSNYNNDNISENEESSKPRPNYNVSYPPFLIDLLTKSKLLNTQKMDDHSLSKQNKILDDLNKLKYNIDEPIAGAIHGPLAIFSAAQLAQLSDVYGGDPSVIEYAISLLKFVQPMGRWARRWAAKRLDAATDGLHSQACYTLSSQPAHTVEPTFDKDKSDLLQNWTDVVDITIDPPTPKVDQSDVEQPEPCLVDLLNQYDTVISCSNDTNSSVLSTSNESAPCVVETTITYIKKDNLNSVNTSSLSGSLDIPVSINSCSVSFCNNDMSNSQLVSDSALNVSNIPQQNSSTREVDDDLDDVIICESVPPPIATHTPNVDVILQQYNVNDAQQSEKLPLIATKLPEDEITITDECASSSVKSVDYVVPSDTPSLNEHELDSVDHINNEQISEISADSSNSLLKTALSGSSFSLNTSHDRITVQNKGTVDGLEDSFGNLSSGSDCSTVMSTHSLFLDSHLITHKELPVSVPHIENQIAVNHCNPISSCSETTDSLTDPVVQNQYGEIYADNRVNIDADSAIFDTAESSHSLILSNSMLLDNTCETNEQLTSNNNISSVS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.7	Very low	33.9	Very low	234 Å²	234	139.5 Å²	139.5	100%	1.153	78%	0.78	S	S	*	*				0	105.1	0	-65.6	163.1	176.7	0	0	104.2
2	L	26.3	Very low	33.7	Very low	157 Å²	157	137.9 Å²	137.9	82%	0.822	78%	0.783	S	S	*	*				62.1	112.3	57.1	-64.6	173.4	0	0	0	111.8
3	N	29.8	Very low	34	Very low	129 Å²	129	135.5 Å²	135.5	69%	0.69	77%	0.772	S	S	*	*			trans	71.1	145.1	161.1	-54.7	34.9	0	0	0	114.4
4	E	36.7	Very low	33.9	Very low	165 Å²	165	132.7 Å²	132.7	77%	0.771	77%	0.774	S	S	*	*			cis	-152.9	161.9	3.2	-132.4	151.7	-128.8	0	0	113.9
5	M	36.6	Very low	34.2	Very low	175 Å²	175	132.7 Å²	132.7	86%	0.862	77%	0.769	S	S	*	*			trans	-59.3	160.4	-179	-55.8	155.1	170.5	0	0	114.9
6	N	36	Very low	35	Very low	135 Å²	135	131.7 Å²	131.7	72%	0.722	77%	0.772	S	S	*	*				-173.1	148.6	92.9	-154.6	3	0	0	0	113.1	H1062	N6-H1062 PolarHBondContact O-CD2 3.25Å
7	S	34.9	Very low	36	Very low	62 Å²	62	131.4 Å²	131.4	43%	0.434	77%	0.767	S	S	.	*			trans	-120.5	124.9	-171.6	-53	0	0	0	0	113.5	G9 S1061	S7-G9 PolarHBondContact O-N 2.83Å; S7-S1061 PolarHBondContact OG-OG 3.25Å
8	G	34.6	Very low	36.2	Very low	78 Å²	78	133.3 Å²	133.3	80%	0.804	77%	0.773	S	S	*	*			trans	-80.1	48.7	179.6	0	0	0	0	0	115.1
9	G	35.1	Very low	36.3	Very low	64 Å²	64	130.6 Å²	130.6	66%	0.66	77%	0.769	S	S	*	*			trans	-75.9	150.5	-178.8	0	0	0	0	0	114.1	S7 H11	S7-G9 PolarHBondContact O-N 2.83Å; G9-H11 PolarHBondContact O-N 3.24Å
10	L	33.2	Very low	36.3	Very low	176 Å²	176	133.1 Å²	133.1	92%	0.921	78%	0.777	S	S	*	*			trans	-69.9	112.7	176.2	-78.6	80.8	0	0	0	111	C12	L10-C12 PolarHBondContact O-N 2.81Å
11	H	33.8	Very low	36.3	Very low	160 Å²	160	135.9 Å²	135.9	74%	0.741	78%	0.78	S	S	*	*			trans	-79.2	110.5	174.1	-172.2	-70.9	0	0	0	111.7	G9 V13	G9-H11 PolarHBondContact O-N 3.24Å; H11-V13 WeakPolarHBondContact ND1-CG2 3.39Å; H11-V13 PolarHBondContact O-N 3.25Å
12	C	31.6	Very low	36.4	Very low	120 Å²	120	133 Å²	133	81%	0.811	77%	0.768	S	S	*	*			trans	-76.6	98.6	169.9	49.1	0	0	0	0	111.2	L10	L10-C12 PolarHBondContact O-N 2.81Å
13	V	37.2	Very low	36.9	Very low	106 Å²	106	134.1 Å²	134.1	64%	0.642	77%	0.767	S	S	*	*			trans	-77.8	125	163.3	-175.7	0	0	0	0	108.4	H11	H11-V13 WeakPolarHBondContact ND1-CG2 3.39Å; H11-V13 PolarHBondContact O-N 3.25Å
14	A	32.9	Very low	37.6	Very low	97 Å²	97	134.4 Å²	134.4	80%	0.802	77%	0.767	S	S	*	*			trans	-94	104.9	165.9	0	0	0	0	0	108.9
15	D	39.3	Very low	37.6	Very low	132 Å²	132	130.4 Å²	130.4	71%	0.706	76%	0.757	S	S	*	*			trans	-64.4	151.8	165.7	-74.5	-36.8	0	0	0	110.1	D17	D15-D17 PolarHBondContact O-N 3.49Å
16	S	46.6	Very low	37.7	Very low	117 Å²	117	131.4 Å²	131.4	82%	0.818	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-10.4	-173	46.5	0	0	0	0	116.1
17	D	51.4	Low	37.8	Very low	126 Å²	126	130.5 Å²	130.5	67%	0.674	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	6.2	-160.6	-66.5	22	0	0	0	112.9	D15 A19	D15-D17 PolarHBondContact O-N 3.49Å; D17-A19 PolarHBondContact O-N 3.37Å
18	N	40.9	Very low	37.8	Very low	166 Å²	166	131.5 Å²	131.5	89%	0.888	78%	0.781	S	S	*	*			trans	57.4	14.6	172.1	-110.4	-5.4	0	0	0	116.1
19	A	37.3	Very low	37.9	Very low	83 Å²	83	131.5 Å²	131.5	69%	0.686	78%	0.781	S	S	*	*			trans	-101.2	84.1	-171.9	0	0	0	0	0	112.9	D17 K21	D17-A19 PolarHBondContact O-N 3.37Å; A19-K21 PolarHBondContact O-N 2.99Å
20	L	36.4	Very low	37.8	Very low	180 Å²	180	138.1 Å²	138.1	94%	0.942	79%	0.792	S	S	*	*			trans	-61.2	108.3	176.7	-69.2	175.8	0	0	0	112.1
21	K	35.3	Very low	37.8	Very low	192 Å²	192	135.9 Å²	135.9	84%	0.835	79%	0.79	S	S	*	*			trans	-128.1	81.6	-177.6	-168.8	177.6	-177.3	177.9	0	111.7	A19 K23	A19-K21 PolarHBondContact O-N 2.99Å; K21-K23 PolarHBondContact O-N 2.84Å
22	L	39.3	Very low	37.9	Very low	173 Å²	173	132.7 Å²	132.7	91%	0.906	79%	0.785	S	S	*	*			trans	-62.1	117.2	178.2	-67.9	172.4	0	0	0	111.5
23	K	36.3	Very low	38.5	Very low	180 Å²	180	134.9 Å²	134.9	78%	0.783	78%	0.784	S	S	*	*			trans	-113.8	78.1	176.2	-171.6	-172.9	173	-174	0	110.5	K21 S25	K21-K23 PolarHBondContact O-N 2.84Å; K23-S25 PolarHBondContact O-N 2.75Å; K23-S25 PolarHBondContact O-OG 2.75Å
24	I	43.8	Very low	38.3	Very low	135 Å²	135	136.2 Å²	136.2	69%	0.692	79%	0.787	S	S	*	*			trans	-62.5	122.6	175.3	-52.6	175.9	0	0	0	108.6	F26	I24-F26 HydrophobicContact CG2-CD2 4.12Å; I24-F26 HydrophobicContact CG2-CE1 4.39Å; I24-F26 HydrophobicContact CG2-CE2 3.58Å; I24-F26 HydrophobicContact CG2-CZ 3.74Å
25	S	36.7	Very low	38.4	Very low	81 Å²	81	138.2 Å²	138.2	57%	0.566	79%	0.794	S	S	*	*			trans	-127.7	103.3	-176.5	-55.7	0	0	0	0	108.7	K23 S27	K23-S25 PolarHBondContact O-N 2.75Å; K23-S25 PolarHBondContact O-OG 2.75Å; S25-S27 PolarHBondContact O-N 3.34Å
26	F	38.4	Very low	38.2	Very low	196 Å²	196	137.7 Å²	137.7	86%	0.86	80%	0.8	S	S	*	*			trans	-81.5	93.5	178.8	-68.6	-75.9	0	0	0	110.4	I24 G28	I24-F26 HydrophobicContact CG2-CD2 4.12Å; I24-F26 HydrophobicContact CG2-CE1 4.39Å; I24-F26 HydrophobicContact CG2-CE2 3.58Å; I24-F26 HydrophobicContact CG2-CZ 3.74Å; F26-G28 PolarHBondContact O-N 2.74Å
27	S	39.9	Very low	38	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	80%	0.801	S	S	*	*			trans	-77.4	105.6	171.1	52.3	0	0	0	0	110.3	S25 G29	S25-S27 PolarHBondContact O-N 3.34Å; S27-G29 PolarHBondContact O-N 3.18Å
28	G	33	Very low	37.3	Very low	82 Å²	82	138.2 Å²	138.2	85%	0.845	81%	0.808	S	S	*	*			trans	-69.8	107.1	176.2	0	0	0	0	0	111.9	F26 K30	F26-G28 PolarHBondContact O-N 2.74Å; G28-K30 PolarHBondContact O-N 3.18Å
29	G	37.2	Very low	37.5	Very low	79 Å²	79	135.4 Å²	135.4	81%	0.814	80%	0.801	S	S	*	*			trans	-78.1	115.7	171.7	0	0	0	0	0	111.1	S27	S27-G29 PolarHBondContact O-N 3.18Å
30	K	33.8	Very low	37.5	Very low	202 Å²	202	141.3 Å²	141.3	88%	0.878	81%	0.814	S	S	*	*			trans	-71.8	137.2	161.5	-74.2	-175.4	174.9	-175.3	0	108.9	G28	G28-K30 PolarHBondContact O-N 3.18Å
31	C	33.6	Very low	37.9	Very low	130 Å²	130	137.8 Å²	137.8	88%	0.878	81%	0.805	S	S	*	*			trans	-124	139.7	156.2	-159.8	0	0	0	0	107.7
32	S	35.9	Very low	38.7	Very low	93 Å²	93	135.6 Å²	135.6	65%	0.65	80%	0.803	S	S	*	*			trans	-147.6	110.5	-178.1	-59.4	0	0	0	0	108.9
33	Q	42.6	Very low	39.4	Very low	166 Å²	166	133.7 Å²	133.7	78%	0.776	80%	0.798	S	S	*	*			trans	-156.8	95	157.4	-147.5	78.4	75.6	0	0	109.5
34	D	34.1	Very low	40.6	Very low	133 Å²	133	130.4 Å²	130.4	71%	0.711	79%	0.788	S	S	*	*			trans	25.9	112.1	136.1	-37.1	-46	0	0	0	118.6
35	C	34.7	Very low	42.2	Very low	139 Å²	139	128.9 Å²	128.9	94%	0.939	79%	0.785	S	S	*	*			trans	-151.4	105.3	150.7	-135.8	0	0	0	0	108.4
36	S	34.5	Very low	44.5	Very low	121 Å²	121	130.9 Å²	130.9	85%	0.846	79%	0.786	S	S	*	*			trans	-108.8	104.6	-166.3	55.8	0	0	0	0	113.1
37	V	41.9	Very low	47.1	Very low	139 Å²	139	123.6 Å²	123.6	84%	0.842	76%	0.757	S	S	*	*			trans	-132.6	134.2	159.1	-176.3	0	0	0	0	108.8
38	S	38	Very low	49.7	Very low	115 Å²	115	118 Å²	118	80%	0.804	72%	0.718	S	S	*	*			trans	-53.8	125.9	-168	50.8	0	0	0	0	117.7
39	S	43.7	Very low	52.6	Low	107 Å²	107	115.6 Å²	115.6	75%	0.748	69%	0.688	S	S	*	*			trans	-155.1	141	135	51.6	0	0	0	0	109.8	S41	S39-S41 PolarHBondContact O-N 3.45Å
40	E	38.5	Very low	55.3	Low	207 Å²	207	121.1 Å²	121.1	97%	0.967	69%	0.685	S	S	*	*			trans	-71.8	116.1	-174.7	-66.8	-175.9	128.9	0	0	110.6
41	S	44	Very low	58.1	Low	107 Å²	107	113.3 Å²	113.3	75%	0.748	65%	0.653	S	S	*	*			trans	-105.5	102.5	177	19	0	0	0	0	109.3	S39 V43	S39-S41 PolarHBondContact O-N 3.45Å; S41-V43 PolarHBondContact O-N 2.66Å
42	D	52.7	Low	61.1	Low	146 Å²	146	107.1 Å²	107.1	78%	0.781	61%	0.611	S	S	*	*			trans	-50	124.8	174.6	-94	-42	0	0	0	110.9	L44	D42-L44 HydrophobicContact CB-CD2 4.2Å; D42-L44 HydrophobicContact CB-CG 4.31Å; D42-L44 PolarHBondContact O-N 3.11Å
43	V	54.8	Low	63.9	Low	133 Å²	133	105.9 Å²	105.9	81%	0.806	59%	0.592	S	S	*	*			trans	-76.4	74.7	173	-174.7	0	0	0	0	108.3	S41 T45	S41-V43 PolarHBondContact O-N 2.66Å; V43-T45 PolarHBondContact O-N 3.43Å; V43-T45 PolarHBondContact O-OG1 2.91Å
44	L	60	Low	66.4	Low	111 Å²	111	101.1 Å²	101.1	58%	0.581	57%	0.574	S	S	*	*			trans	-56.9	98	179.5	-70.5	-178.3	0	0	0	110	D42 A105	D42-L44 HydrophobicContact CB-CD2 4.2Å; D42-L44 HydrophobicContact CB-CG 4.31Å; D42-L44 PolarHBondContact O-N 3.11Å; L44-A105 HydrophobicContact CB-CB 4.03Å; L44-A105 HydrophobicContact CD1-CB 4.41Å; L44-A105 HydrophobicContact CD2-CB 4.26Å; L44-A105 HydrophobicContact CG-CB 4.47Å
45	T	77.3	Confident	69.3	Low	103 Å²	103	94.8 Å²	94.8	63%	0.632	54%	0.541	S	S	*	.			trans	-71.4	131	-177.9	-60	0	0	0	0	109	V43 V47	V43-T45 PolarHBondContact O-N 3.43Å; V43-T45 PolarHBondContact O-OG1 2.91Å; T45-V47 WeakPolarHBondContact O-CG1 3.46Å; T45-V47 PolarHBondContact O-N 3.07Å
46	E	85.9	Confident	72.3	Confident	122 Å²	122	88.2 Å²	88.2	57%	0.57	50%	0.496	S	S	*	.			trans	-67.8	87.5	179.3	-65.3	-164.7	147.2	0	0	111.7	R104	E46-R104 CarbonylContact C-O 3.6Å; E46-R104 WeakPolarHBondContact CA-O 3.33Å; E46-R104 VanDerWaalsContact CD-CZ 3.4Å; E46-R104 IonicContact OE1-CZ 3.35Å; E46-R104 IonicContact OE1-NH1 2.96Å; E46-R104 PolarHBondContact OE1-NH1 2.91Å; E46-R104 IonicContact OE1-NH2 2.68Å; E46-R104 IonicContact OE2-CZ 2.83Å; E46-R104 IonicContact OE2-NH1 3.05Å; E46-R104 PolarHBondContact OE2-NH1 3.34Å; E46-R104 IonicContact OE2-NH2 3.37Å; E46-R104 PolarHBondContact OE2-NH2 3.37Å
47	V	93	Very high	75.2	Confident	43 Å²	43	83.7 Å²	83.7	26%	0.261	47%	0.465	S	S	.	.			trans	-79.3	-26.3	176.7	-49.8	0	0	0	0	112.9	T45 S49 R104 A105 R108	T45-V47 WeakPolarHBondContact O-CG1 3.46Å; T45-V47 PolarHBondContact O-N 3.07Å; V47-S49 PolarHBondContact O-N 2.81Å; V47-R104 PolarHBondContact N-O 3.12Å; V47-A105 VanDerWaalsContact CG2-C 3.43Å; V47-A105 WeakPolarHBondContact CG2-O 3.49Å; V47-R108 HydrophobicContact CB-CG 3.86Å; V47-R108 HydrophobicContact CG2-CG 3.88Å
48	T	94.5	Very high	77.8	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	45%	0.445	C	S	.	.	S	Bend	trans	-81.8	109.9	177.2	-49.8	0	0	0	0	109.6	L52 L101 R104 Y107	T48-L52 HydrophobicContact CG2-CB 4.33Å; T48-L52 HydrophobicContact CG2-CD2 4.2Å; T48-L52 HydrophobicContact CG2-CG 4.21Å; T48-L101 HydrophobicContact CG2-CD1 4.45Å; T48-R104 WeakPolarHBondContact CB-O 3.48Å; T48-R104 PolarHBondContact N-O 3.04Å; T48-R104 VanDerWaalsContact O-CZ 3.31Å; T48-R104 PolarHBondContact O-NE 3.43Å; T48-R104 PolarHBondContact O-NH2 3.34Å; T48-R104 PolarHBondContact OG1-O 3.43Å; T48-Y107 WeakPolarHBondContact CA-O 3.36Å; T48-Y107 WeakPolarHBondContact CB-O 3.42Å; T48-Y107 WeakPolarHBondContact CG2-O 3.42Å; T48-Y107 PolarHBondContact OG1-N 2.83Å; T48-Y107 PolarHBondContact OG1-O 3.14Å
49	S	94	Very high	80.6	Confident	32 Å²	32	76.1 Å²	76.1	22%	0.224	41%	0.407	C	S	.	.			trans	-60	158.6	177.7	94.3	0	0	0	0	112.2	V47 N51 L52 Y53 E169	V47-S49 PolarHBondContact O-N 2.81Å; S49-N51 PolarHBondContact O-N 2.8Å; S49-N51 PolarHBondContact OG-N 2.71Å; S49-L52 PolarHBondContact O-N 2.78Å; S49-L52 PolarHBondContact OG-N 2.91Å; S49-L52 VanDerWaalsContact OG-N 3.09Å; S49-Y53 VanDerWaalsContact O-CB 3.22Å; S49-Y53 WeakPolarHBondContact O-CB 3.34Å; S49-Y53 PolarHBondContact O-N 2.83Å; S49-E169 WeakPolarHBondContact CB-OE1 3.36Å; S49-E169 PolarHBondContact OG-OE1 3.37Å
50	R	93.5	Very high	83.2	Confident	195 Å²	195	71.3 Å²	71.3	74%	0.736	37%	0.373	S	S	*	.	H	α-helix	trans	-61.1	-34.3	178.5	-167.1	178.6	-172.9	117.2	2.5	112.6	T54	R50-T54 WeakPolarHBondContact O-CB 3.33Å; R50-T54 PolarHBondContact O-N 3.28Å; R50-T54 VanDerWaalsContact O-N 3.14Å; R50-T54 PolarHBondContact O-OG1 2.84Å
51	N	93.8	Very high	85.9	Confident	38 Å²	38	65.7 Å²	65.7	20%	0.203	35%	0.347	C	S	.	.	H	α-helix	trans	-75.4	-45.6	-179.7	-69.8	6	0	0	0	110.4	S49 T54 V55 I161 P162 G164 L165	S49-N51 PolarHBondContact O-N 2.8Å; S49-N51 PolarHBondContact OG-N 2.71Å; N51-T54 PolarHBondContact O-N 2.87Å; N51-V55 PolarHBondContact O-N 3.45Å; N51-V55 VanDerWaalsContact O-N 3.07Å; N51-I161 HydrophobicContact CB-CG2 3.98Å; N51-I161 WeakPolarHBondContact OD1-CG2 3.37Å; N51-P162 PolarHBondContact ND2-O 3.38Å; N51-G164 WeakPolarHBondContact CB-O 3.28Å; N51-G164 PolarHBondContact ND2-O 2.51Å; N51-L165 HydrophobicContact CB-CD2 3.99Å
52	L	95.1	Very high	88.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.4	-46.1	175.2	-176.6	62.7	0	0	0	111.4	T48 S49 T54 V55 L56 R108 A110 L165 E169	T48-L52 HydrophobicContact CG2-CB 4.33Å; T48-L52 HydrophobicContact CG2-CD2 4.2Å; T48-L52 HydrophobicContact CG2-CG 4.21Å; S49-L52 PolarHBondContact O-N 2.78Å; S49-L52 PolarHBondContact OG-N 2.91Å; S49-L52 VanDerWaalsContact OG-N 3.09Å; L52-T54 VanDerWaalsContact C-N 3.29Å; L52-T54 PolarHBondContact O-N 3.34Å; L52-V55 PolarHBondContact O-N 3.37Å; L52-L56 HydrophobicContact CD1-CD1 3.77Å; L52-L56 HydrophobicContact CD1-CD2 4.39Å; L52-L56 HydrophobicContact CD1-CG 3.82Å; L52-L56 HydrophobicContact CD2-CD1 4.37Å; L52-L56 HydrophobicContact CG-CD1 3.76Å; L52-L56 HydrophobicContact CG-CG 4.16Å; L52-L56 WeakPolarHBondContact O-CB 3.32Å; L52-L56 WeakPolarHBondContact O-CG 3.35Å; L52-L56 PolarHBondContact O-N 3.38Å; L52-R108 VanDerWaalsContact CD2-C 3.43Å; L52-R108 VanDerWaalsContact CD2-O 3.26Å; L52-R108 WeakPolarHBondContact CD2-O 3.23Å; L52-A110 HydrophobicContact CD1-CB 4.22Å; L52-L165 HydrophobicContact CB-CD2 3.96Å; L52-L165 HydrophobicContact CD1-CD2 4.26Å; L52-E169 HydrophobicContact CB-CG 4.49Å; L52-E169 HydrophobicContact CD1-CB 4.49Å
53	Y	95.8	Very high	90.6	Very high	66 Å²	66	54.6 Å²	54.6	26%	0.259	28%	0.279	S	S	.	.	H	α-helix	trans	-55	-44.3	174.8	175.2	-98.9	0	0	0	112.1	S49 S57 L101 R104	S49-Y53 VanDerWaalsContact O-CB 3.22Å; S49-Y53 WeakPolarHBondContact O-CB 3.34Å; S49-Y53 PolarHBondContact O-N 2.83Å; Y53-S57 WeakPolarHBondContact O-CB 3.3Å; Y53-S57 PolarHBondContact O-N 3.33Å; Y53-S57 PolarHBondContact O-OG 2.68Å; Y53-L101 HydrophobicContact CD2-CD1 3.81Å; Y53-L101 HydrophobicContact CD2-CG 3.98Å; Y53-L101 WeakPolarHBondContact CD2-O 3.41Å; Y53-L101 HydrophobicContact CE2-CD1 4.35Å; Y53-L101 HydrophobicContact CE2-CG 4Å; Y53-L101 WeakPolarHBondContact CE2-O 3.15Å; Y53-R104 HydrophobicContact CD2-CG 3.59Å; Y53-R104 HydrophobicContact CE2-CG 4.12Å; Y53-R104 HydrophobicContact CG-CG 4.1Å
54	T	94.8	Very high	92.7	Very high	66 Å²	66	51 Å²	51	41%	0.405	26%	0.257	S	S	.	.	H	α-helix	trans	-64.7	-47.4	-179.5	-57.7	0	0	0	0	111.4	R50 N51 L52 S57 E58 I161	R50-T54 WeakPolarHBondContact O-CB 3.33Å; R50-T54 PolarHBondContact O-N 3.28Å; R50-T54 VanDerWaalsContact O-N 3.14Å; R50-T54 PolarHBondContact O-OG1 2.84Å; N51-T54 PolarHBondContact O-N 2.87Å; L52-T54 VanDerWaalsContact C-N 3.29Å; L52-T54 PolarHBondContact O-N 3.34Å; T54-S57 PolarHBondContact O-N 3.35Å; T54-E58 PolarHBondContact O-N 3.35Å; T54-E58 VanDerWaalsContact O-N 3.14Å; T54-I161 HydrophobicContact CG2-CD1 3.84Å
55	V	95.3	Very high	94.4	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-68	-45.1	-179.8	175.6	0	0	0	0	111.6	N51 L52 S57 E58 I59 L154 A157 I161 L165	N51-V55 PolarHBondContact O-N 3.45Å; N51-V55 VanDerWaalsContact O-N 3.07Å; L52-V55 PolarHBondContact O-N 3.37Å; V55-S57 VanDerWaalsContact C-N 3.3Å; V55-S57 PolarHBondContact O-N 3.31Å; V55-E58 PolarHBondContact O-N 2.84Å; V55-I59 HydrophobicContact CG1-CD1 4.02Å; V55-I59 WeakPolarHBondContact O-CG1 3.46Å; V55-I59 PolarHBondContact O-N 2.94Å; V55-L154 HydrophobicContact CG1-CD2 3.62Å; V55-A157 HydrophobicContact CG1-CB 3.92Å; V55-A157 HydrophobicContact CG2-CB 4.29Å; V55-I161 HydrophobicContact CG2-CD1 3.54Å; V55-L165 HydrophobicContact CB-CD1 4.31Å; V55-L165 HydrophobicContact CG1-CD1 4.27Å; V55-L165 HydrophobicContact CG2-CD1 4.14Å; V55-L165 HydrophobicContact CG2-CG 4.44Å
56	L	96.7	Very high	95.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66	-32.4	177.5	-67.1	-177.1	0	0	0	112.1	L52 I59 H60 L101 Y107 A110 Y113 M149	L52-L56 HydrophobicContact CD1-CD1 3.77Å; L52-L56 HydrophobicContact CD1-CD2 4.39Å; L52-L56 HydrophobicContact CD1-CG 3.82Å; L52-L56 HydrophobicContact CD2-CD1 4.37Å; L52-L56 HydrophobicContact CG-CD1 3.76Å; L52-L56 HydrophobicContact CG-CG 4.16Å; L52-L56 WeakPolarHBondContact O-CB 3.32Å; L52-L56 WeakPolarHBondContact O-CG 3.35Å; L52-L56 PolarHBondContact O-N 3.38Å; L56-I59 PolarHBondContact O-N 2.79Å; L56-H60 VanDerWaalsContact O-CB 3.25Å; L56-H60 WeakPolarHBondContact O-CB 3.22Å; L56-H60 PolarHBondContact O-N 3.48Å; L56-L101 HydrophobicContact CB-CD1 3.73Å; L56-L101 HydrophobicContact CB-CD2 4.08Å; L56-L101 HydrophobicContact CD1-CD1 4.14Å; L56-Y107 HydrophobicContact CD1-CD2 4.47Å; L56-Y107 HydrophobicContact CD1-CG 4.49Å; L56-A110 HydrophobicContact CD2-CB 4.26Å; L56-Y113 HydrophobicContact CB-CD2 4.24Å; L56-Y113 HydrophobicContact CB-CE2 4.34Å; L56-Y113 HydrophobicContact CD1-CD2 3.94Å; L56-Y113 HydrophobicContact CD1-CG 3.99Å; L56-Y113 HydrophobicContact CD2-CD1 3.88Å; L56-Y113 HydrophobicContact CD2-CD2 4.2Å; L56-Y113 HydrophobicContact CD2-CE1 4.44Å; L56-Y113 HydrophobicContact CD2-CG 3.75Å; L56-Y113 HydrophobicContact CG-CD2 4.36Å; L56-Y113 HydrophobicContact CG-CG 4.34Å; L56-M149 HydrophobicContact CD2-CE 4.3Å; L56-M149 HydrophobicContact CD2-SD 4.21Å
57	S	96.7	Very high	95.9	Very high	26 Å²	26	48 Å²	48	18%	0.182	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-41.3	174	-64.4	0	0	0	0	111.8	Y53 T54 V55 H60 Q61	Y53-S57 WeakPolarHBondContact O-CB 3.3Å; Y53-S57 PolarHBondContact O-N 3.33Å; Y53-S57 PolarHBondContact O-OG 2.68Å; T54-S57 PolarHBondContact O-N 3.35Å; V55-S57 VanDerWaalsContact C-N 3.3Å; V55-S57 PolarHBondContact O-N 3.31Å; S57-H60 PolarHBondContact O-N 3.01Å; S57-Q61 WeakPolarHBondContact O-CB 3.26Å; S57-Q61 WeakPolarHBondContact O-CG 2.99Å; S57-Q61 PolarHBondContact O-N 3.07Å
58	E	95.5	Very high	95.9	Very high	92 Å²	92	50.9 Å²	50.9	43%	0.43	24%	0.242	S	C	.	.	H	α-helix	trans	-64.2	-44.1	174.7	-158.6	-139.6	123.2	0	0	111.1	T54 V55 Q61 N62	T54-E58 PolarHBondContact O-N 3.35Å; T54-E58 VanDerWaalsContact O-N 3.14Å; V55-E58 PolarHBondContact O-N 2.84Å; E58-Q61 PolarHBondContact O-N 3Å; E58-N62 WeakPolarHBondContact O-CB 3.47Å; E58-N62 PolarHBondContact O-N 3.43Å; E58-N62 PolarHBondContact O-ND2 3.25Å; E58-N62 PolarHBondContact OE1-ND2 2.63Å
59	I	96.6	Very high	95.9	Very high	3 Å²	3	59.2 Å²	59.2	2%	0.015	27%	0.273	C	S	.	.	H	α-helix	trans	-63.8	-41.8	176.9	-67.1	174	0	0	0	110.9	V55 L56 N62 L63 Y113 Q148 M149 L154	V55-I59 HydrophobicContact CG1-CD1 4.02Å; V55-I59 WeakPolarHBondContact O-CG1 3.46Å; V55-I59 PolarHBondContact O-N 2.94Å; L56-I59 PolarHBondContact O-N 2.79Å; I59-N62 CarbonylContact O-C 3.57Å; I59-N62 WeakPolarHBondContact O-CA 3.33Å; I59-N62 WeakPolarHBondContact O-CB 3.22Å; I59-N62 PolarHBondContact O-N 2.95Å; I59-N62 VanDerWaalsContact O-N 3.12Å; I59-L63 HydrophobicContact CG2-CD1 4.26Å; I59-L63 WeakPolarHBondContact O-CG 3.35Å; I59-L63 PolarHBondContact O-N 3.23Å; I59-Y113 HydrophobicContact CG2-CE1 4.29Å; I59-Q148 HydrophobicContact CD1-CB 4.41Å; I59-Q148 HydrophobicContact CG1-CB 4.33Å; I59-Q148 HydrophobicContact CG2-CB 4.24Å; I59-M149 HydrophobicContact CD1-CE 4.22Å; I59-M149 HydrophobicContact CD1-SD 3.76Å; I59-M149 HydrophobicContact CG2-CE 3.9Å; I59-L154 HydrophobicContact CD1-CD2 3.72Å
60	H	97.9	Very high	96	Very high	6 Å²	6	59.4 Å²	59.4	3%	0.028	28%	0.281	C	S	.	.	H	α-helix	trans	-58.6	-50.2	175.8	-172.6	74.1	0	0	0	111.7	L56 S57 N62 L63 V64 L94 Y98 L101 Y113	L56-H60 VanDerWaalsContact O-CB 3.25Å; L56-H60 WeakPolarHBondContact O-CB 3.22Å; L56-H60 PolarHBondContact O-N 3.48Å; S57-H60 PolarHBondContact O-N 3.01Å; H60-N62 PolarHBondContact O-N 2.96Å; H60-L63 WeakPolarHBondContact O-CA 3.3Å; H60-L63 WeakPolarHBondContact O-CB 3.48Å; H60-L63 PolarHBondContact O-N 3.38Å; H60-V64 WeakPolarHBondContact NE2-CG2 3.47Å; H60-V64 PolarHBondContact O-N 3.43Å; H60-L94 PolarHBondContact CE1-O 3.31Å; H60-Y98 AromaticContact CD2-CD2 3.74Å; H60-Y98 AromaticContact NE2-CD2 3.82Å; H60-L101 HydrophobicContact CB-CD2 4.3Å; H60-Y113 WeakPolarHBondContact CA-OH 3.38Å; H60-Y113 WeakPolarHBondContact CB-OH 3.45Å; H60-Y113 PolarHBondContact N-OH 3.49Å; H60-Y113 PolarHBondContact ND1-OH 3.42Å
61	Q	97.2	Very high	96.1	Very high	90 Å²	90	51.9 Å²	51.9	42%	0.421	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-32.6	175.8	-72.1	-67.2	-15.4	0	0	112.3	S57 E58 L63 R65	S57-Q61 WeakPolarHBondContact O-CB 3.26Å; S57-Q61 WeakPolarHBondContact O-CG 2.99Å; S57-Q61 PolarHBondContact O-N 3.07Å; E58-Q61 PolarHBondContact O-N 3Å; Q61-L63 VanDerWaalsContact C-N 3.32Å; Q61-R65 VanDerWaalsContact C-NH2 3.33Å; Q61-R65 WeakPolarHBondContact O-CB 3.5Å; Q61-R65 WeakPolarHBondContact O-CG 3.15Å; Q61-R65 VanDerWaalsContact O-CZ 3.27Å; Q61-R65 PolarHBondContact O-N 3.17Å; Q61-R65 VanDerWaalsContact O-N 3.17Å; Q61-R65 PolarHBondContact O-NE 3.16Å; Q61-R65 VanDerWaalsContact O-NE 3.07Å; Q61-R65 PolarHBondContact O-NH2 3.25Å
62	N	96.9	Very high	96.3	Very high	20 Å²	20	50.7 Å²	50.7	11%	0.107	25%	0.248	C	C	.	.	H	α-helix	trans	-72.7	-19.8	173.6	-78.3	-58.1	0	0	0	114.1	E58 I59 H60 R65 R66 F144	E58-N62 WeakPolarHBondContact O-CB 3.47Å; E58-N62 PolarHBondContact O-N 3.43Å; E58-N62 PolarHBondContact O-ND2 3.25Å; E58-N62 PolarHBondContact OE1-ND2 2.63Å; I59-N62 CarbonylContact O-C 3.57Å; I59-N62 WeakPolarHBondContact O-CA 3.33Å; I59-N62 WeakPolarHBondContact O-CB 3.22Å; I59-N62 PolarHBondContact O-N 2.95Å; I59-N62 VanDerWaalsContact O-N 3.12Å; H60-N62 PolarHBondContact O-N 2.96Å; N62-R65 PolarHBondContact OD1-NH1 3.03Å; N62-R65 PolarHBondContact OD1-NH2 3.39Å; N62-R66 PolarHBondContact O-NH1 3.15Å; N62-F144 HydrophobicContact CB-CE1 4.03Å; N62-F144 HydrophobicContact CB-CZ 4.05Å; N62-F144 WeakPolarHBondContact O-CE1 2.98Å
63	L	97.8	Very high	96.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-84.1	-49.6	172.8	-68.7	166.7	0	0	0	111.3	I59 H60 Q61 R65 R66 D67 L94 Y113 V117 L141 F144 C145	I59-L63 HydrophobicContact CG2-CD1 4.26Å; I59-L63 WeakPolarHBondContact O-CG 3.35Å; I59-L63 PolarHBondContact O-N 3.23Å; H60-L63 WeakPolarHBondContact O-CA 3.3Å; H60-L63 WeakPolarHBondContact O-CB 3.48Å; H60-L63 PolarHBondContact O-N 3.38Å; Q61-L63 VanDerWaalsContact C-N 3.32Å; L63-R65 VanDerWaalsContact C-N 3.3Å; L63-R65 PolarHBondContact O-N 2.83Å; L63-R66 WeakPolarHBondContact O-CA 3.34Å; L63-R66 WeakPolarHBondContact O-CB 3.44Å; L63-R66 PolarHBondContact O-N 2.87Å; L63-D67 PolarHBondContact O-N 2.86Å; L63-L94 HydrophobicContact CB-CD2 4.38Å; L63-Y113 HydrophobicContact CD1-CE1 4.27Å; L63-V117 HydrophobicContact CD1-CG1 4.18Å; L63-V117 HydrophobicContact CD1-CG2 4.01Å; L63-L141 HydrophobicContact CB-CD1 4.27Å; L63-L141 HydrophobicContact CD2-CD1 3.62Å; L63-L141 HydrophobicContact CD2-CG 4.05Å; L63-F144 HydrophobicContact CD2-CD1 3.86Å; L63-F144 HydrophobicContact CD2-CE1 4.25Å; L63-C145 HydrophobicContact CD2-CB 3.81Å
64	V	97.6	Very high	96.4	Very high	57 Å²	57	54.9 Å²	54.9	35%	0.345	28%	0.279	S	S	.	.	H	α-helix	trans	-54.7	-46.3	176.1	175.4	0	0	0	0	110.7	H60 R66 D67 L94	H60-V64 WeakPolarHBondContact NE2-CG2 3.47Å; H60-V64 PolarHBondContact O-N 3.43Å; V64-R66 PolarHBondContact O-N 3.23Å; V64-D67 CarbonylContact O-C 3.43Å; V64-D67 PolarHBondContact O-N 3.43Å; V64-L94 HydrophobicContact CG2-CD1 4.17Å
65	R	97.1	Very high	96.5	Very high	146 Å²	146	55.2 Å²	55.2	55%	0.551	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-5.6	174.7	-75.9	-178.9	-83.6	109.2	-2.7	115.3	Q61 N62 L63	Q61-R65 VanDerWaalsContact C-NH2 3.33Å; Q61-R65 WeakPolarHBondContact O-CB 3.5Å; Q61-R65 WeakPolarHBondContact O-CG 3.15Å; Q61-R65 VanDerWaalsContact O-CZ 3.27Å; Q61-R65 PolarHBondContact O-N 3.17Å; Q61-R65 VanDerWaalsContact O-N 3.17Å; Q61-R65 PolarHBondContact O-NE 3.16Å; Q61-R65 VanDerWaalsContact O-NE 3.07Å; Q61-R65 PolarHBondContact O-NH2 3.25Å; N62-R65 PolarHBondContact OD1-NH1 3.03Å; N62-R65 PolarHBondContact OD1-NH2 3.39Å; L63-R65 VanDerWaalsContact C-N 3.3Å; L63-R65 PolarHBondContact O-N 2.83Å
66	R	96.8	Very high	96.5	Very high	116 Å²	116	57.3 Å²	57.3	44%	0.438	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-4.7	172.4	-81.1	-179.9	171.1	70.4	7.6	114.3	N62 L63 V64 P68 L141 F144	N62-R66 PolarHBondContact O-NH1 3.15Å; L63-R66 WeakPolarHBondContact O-CA 3.34Å; L63-R66 WeakPolarHBondContact O-CB 3.44Å; L63-R66 PolarHBondContact O-N 2.87Å; V64-R66 PolarHBondContact O-N 3.23Å; R66-P68 VanDerWaalsContact O-CD 3.26Å; R66-P68 WeakPolarHBondContact O-CD 3.25Å; R66-L141 HydrophobicContact CB-CD1 3.92Å; R66-F144 VanDerWaalsContact CD-CD1 3.48Å
67	D	96.9	Very high	96.4	Very high	10 Å²	10	60.1 Å²	60.1	5%	0.053	31%	0.313	C	S	.	.			trans	-116.3	68.5	169.5	-173.2	22.4	0	0	0	112	L63 V64 R69 G70 I71 F72	L63-D67 PolarHBondContact O-N 2.86Å; V64-D67 CarbonylContact O-C 3.43Å; V64-D67 PolarHBondContact O-N 3.43Å; D67-R69 PolarHBondContact O-N 3.27Å; D67-G70 PolarHBondContact O-N 3.07Å; D67-G70 VanDerWaalsContact O-N 3.07Å; D67-G70 VanDerWaalsContact OD2-C 3.29Å; D67-I71 PolarHBondContact OD1-N 3.24Å; D67-I71 WeakPolarHBondContact OD2-CA 3.34Å; D67-I71 PolarHBondContact OD2-N 3.3Å; D67-F72 HydrophobicContact CB-CD2 4.28Å; D67-F72 WeakPolarHBondContact OD2-CD2 3.34Å; D67-F72 PolarHBondContact OD2-N 2.99Å
68	P	94.5	Very high	96.3	Very high	104 Å²	104	61.8 Å²	61.8	68%	0.675	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	20.7	179.9	34.9	-40	0	0	0	113.6	R66	R66-P68 VanDerWaalsContact O-CD 3.26Å; R66-P68 WeakPolarHBondContact O-CD 3.25Å
69	R	94	Very high	96.3	Very high	175 Å²	175	64.3 Å²	64.3	66%	0.66	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.8	-2.1	172.8	-72.1	-170.7	179.2	-167.3	-0.3	112.7	D67 I71	D67-R69 PolarHBondContact O-N 3.27Å; R69-I71 HydrophobicContact CB-CD1 4.02Å; R69-I71 HydrophobicContact CB-CG1 3.86Å; R69-I71 PolarHBondContact O-N 3.01Å
70	G	95.3	Very high	96.1	Very high	37 Å²	37	70 Å²	70	38%	0.381	37%	0.365	S	S	.	.			trans	61	24.1	-177.3	0	0	0	0	0	114.8	D67 F72 A73	D67-G70 PolarHBondContact O-N 3.07Å; D67-G70 VanDerWaalsContact O-N 3.07Å; D67-G70 VanDerWaalsContact OD2-C 3.29Å; G70-F72 PolarHBondContact O-N 3.43Å; G70-F72 VanDerWaalsContact O-N 3.15Å; G70-A73 WeakPolarHBondContact O-CB 3.34Å; G70-A73 PolarHBondContact O-N 3.14Å
71	I	96	Very high	95.8	Very high	36 Å²	36	70.4 Å²	70.4	19%	0.185	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-30.9	179.3	-68.6	168.5	0	0	0	112	D67 R69 Y134 R137	D67-I71 PolarHBondContact OD1-N 3.24Å; D67-I71 WeakPolarHBondContact OD2-CA 3.34Å; D67-I71 PolarHBondContact OD2-N 3.3Å; R69-I71 HydrophobicContact CB-CD1 4.02Å; R69-I71 HydrophobicContact CB-CG1 3.86Å; R69-I71 PolarHBondContact O-N 3.01Å; I71-Y134 HydrophobicContact CG2-CD1 3.62Å; I71-Y134 HydrophobicContact CG2-CE1 4.09Å; I71-R137 HydrophobicContact CD1-CG 4.04Å
72	F	97.7	Very high	95.8	Very high	13 Å²	13	71.3 Å²	71.3	6%	0.057	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	15	177.1	-46.2	-73.1	0	0	0	112.4	D67 G70 L94 M120 A124 R137 A138 L141	D67-F72 HydrophobicContact CB-CD2 4.28Å; D67-F72 WeakPolarHBondContact OD2-CD2 3.34Å; D67-F72 PolarHBondContact OD2-N 2.99Å; G70-F72 PolarHBondContact O-N 3.43Å; G70-F72 VanDerWaalsContact O-N 3.15Å; F72-L94 HydrophobicContact CB-CD1 4.17Å; F72-L94 HydrophobicContact CB-CG 4.19Å; F72-L94 VanDerWaalsContact O-CB 3.25Å; F72-L94 WeakPolarHBondContact O-CB 3.36Å; F72-L94 WeakPolarHBondContact O-CG 3.44Å; F72-L94 PolarHBondContact O-N 2.95Å; F72-M120 HydrophobicContact CB-CE 4.27Å; F72-M120 HydrophobicContact CB-CG 4.38Å; F72-M120 HydrophobicContact CB-SD 3.77Å; F72-M120 HydrophobicContact CD1-CG 4.33Å; F72-M120 HydrophobicContact CG-CE 4.43Å; F72-M120 HydrophobicContact CG-SD 4.4Å; F72-A124 HydrophobicContact CE1-CB 3.81Å; F72-R137 HydrophobicContact CE2-CB 3.86Å; F72-R137 HydrophobicContact CZ-CB 3.88Å; F72-A138 HydrophobicContact CE1-CB 4.06Å; F72-A138 HydrophobicContact CZ-CB 3.83Å; F72-L141 HydrophobicContact CD2-CD2 3.64Å; F72-L141 HydrophobicContact CE2-CD2 3.96Å; F72-L141 HydrophobicContact CG-CD2 4.35Å
73	A	97.1	Very high	95.7	Very high	34 Å²	34	70.8 Å²	70.8	28%	0.281	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-38	-173.8	0	0	0	0	0	113.2	G70 G95	G70-A73 WeakPolarHBondContact O-CB 3.34Å; G70-A73 PolarHBondContact O-N 3.14Å; A73-G95 WeakPolarHBondContact O-CA 3.44Å; A73-G95 PolarHBondContact O-N 3.4Å
74	N	96.7	Very high	95.6	Very high	121 Å²	121	71.5 Å²	71.5	65%	0.647	38%	0.383	S	S	*	.	S	Bend	trans	-123.7	162.4	-173.6	-62.5	-11.6	0	0	0	110.5	D93	N74-D93 VanDerWaalsContact C-CB 3.49Å; N74-D93 WeakPolarHBondContact O-CB 3.45Å
75	P	96	Very high	95.5	Very high	73 Å²	73	72.4 Å²	72.4	47%	0.474	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-55.5	147.4	169.6	-23.8	33	0	0	0	112.6	D93	P75-D93 WeakPolarHBondContact CG-OD2 3.4Å
76	V	96	Very high	95.5	Very high	44 Å²	44	73.3 Å²	73.3	27%	0.267	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-91.6	124	174.5	179.2	0	0	0	0	109.2	I80 A81 Y84	V76-I80 HydrophobicContact CG1-CB 4.39Å; V76-I80 HydrophobicContact CG1-CG2 4.34Å; V76-A81 HydrophobicContact CG1-CB 3.7Å; V76-Y84 HydrophobicContact CB-CD1 4.08Å; V76-Y84 HydrophobicContact CB-CE1 3.79Å; V76-Y84 HydrophobicContact CB-CE2 4.25Å; V76-Y84 HydrophobicContact CB-CG 4.44Å; V76-Y84 HydrophobicContact CG1-CD1 3.9Å; V76-Y84 HydrophobicContact CG1-CD2 3.85Å; V76-Y84 HydrophobicContact CG1-CE1 4.06Å; V76-Y84 HydrophobicContact CG1-CE2 3.99Å; V76-Y84 HydrophobicContact CG1-CG 3.79Å
77	T	94.4	Very high	95.5	Very high	60 Å²	60	71 Å²	71	37%	0.368	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-96.8	164.1	170.4	71	0	0	0	0	111.2	D79 I80 A81	T77-D79 VanDerWaalsContact CB-OD2 3.22Å; T77-D79 WeakPolarHBondContact CB-OD2 3.43Å; T77-D79 PolarHBondContact O-N 2.78Å; T77-D79 PolarHBondContact OG1-OD2 3.09Å; T77-I80 WeakPolarHBondContact O-CB 3.26Å; T77-I80 PolarHBondContact O-N 3.22Å; T77-I80 VanDerWaalsContact O-N 3.14Å; T77-A81 PolarHBondContact O-N 3.38Å
78	D	94.9	Very high	95.5	Very high	60 Å²	60	71 Å²	71	32%	0.321	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.3	176.9	-69.9	-75.7	0	0	0	113.2	I80 A81 V82 G83 Y84 S85	D78-I80 VanDerWaalsContact C-N 3.35Å; D78-A81 WeakPolarHBondContact CA-O 3.45Å; D78-A81 CarbonylContact O-C 3.55Å; D78-A81 PolarHBondContact O-N 3.21Å; D78-V82 VanDerWaalsContact O-CA 3.23Å; D78-V82 WeakPolarHBondContact O-CA 3.46Å; D78-V82 PolarHBondContact O-N 3.2Å; D78-V82 VanDerWaalsContact O-N 3.07Å; D78-G83 WeakPolarHBondContact OD1-CA 3.37Å; D78-G83 PolarHBondContact OD1-N 3.11Å; D78-Y84 PolarHBondContact OD1-N 3.33Å; D78-S85 PolarHBondContact OD1-N 3.14Å; D78-S85 WeakPolarHBondContact OD2-CB 3.45Å; D78-S85 PolarHBondContact OD2-OG 2.91Å
79	D	94.3	Very high	95.5	Very high	146 Å²	146	71.6 Å²	71.6	78%	0.781	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-37.4	171.9	-30.4	-83.8	0	0	0	111.3	T77	T77-D79 VanDerWaalsContact CB-OD2 3.22Å; T77-D79 WeakPolarHBondContact CB-OD2 3.43Å; T77-D79 PolarHBondContact O-N 2.78Å; T77-D79 PolarHBondContact OG1-OD2 3.09Å
80	I	92.1	Very high	95.6	Very high	122 Å²	122	70.1 Å²	70.1	63%	0.626	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-32.4	175.1	-60.7	171	0	0	0	110.3	V76 T77 D78	V76-I80 HydrophobicContact CG1-CB 4.39Å; V76-I80 HydrophobicContact CG1-CG2 4.34Å; T77-I80 WeakPolarHBondContact O-CB 3.26Å; T77-I80 PolarHBondContact O-N 3.22Å; T77-I80 VanDerWaalsContact O-N 3.14Å; D78-I80 VanDerWaalsContact C-N 3.35Å
81	A	93.3	Very high	95.7	Very high	14 Å²	14	71.9 Å²	71.9	12%	0.116	41%	0.41	C	S	.	.	S	Bend	trans	-148.2	90.9	-174.2	0	0	0	0	0	111.9	V76 T77 D78 G83 Y84 Y127	V76-A81 HydrophobicContact CG1-CB 3.7Å; T77-A81 PolarHBondContact O-N 3.38Å; D78-A81 WeakPolarHBondContact CA-O 3.45Å; D78-A81 CarbonylContact O-C 3.55Å; D78-A81 PolarHBondContact O-N 3.21Å; A81-G83 PolarHBondContact O-N 3.3Å; A81-Y84 HydrophobicContact CB-CD2 4.1Å; A81-Y84 HydrophobicContact CB-CG 4.24Å; A81-Y84 WeakPolarHBondContact O-CB 3.18Å; A81-Y84 PolarHBondContact O-N 3.23Å; A81-Y127 HydrophobicContact CB-CE1 3.8Å
82	V	95.8	Very high	95.8	Very high	110 Å²	110	70.9 Å²	70.9	67%	0.667	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	110.1	-172.8	-176.6	0	0	0	0	113.3	D78 Y127 R191	D78-V82 VanDerWaalsContact O-CA 3.23Å; D78-V82 WeakPolarHBondContact O-CA 3.46Å; D78-V82 PolarHBondContact O-N 3.2Å; D78-V82 VanDerWaalsContact O-N 3.07Å; V82-Y127 PolarHBondContact O-OH 2.68Å; V82-R191 PolarHBondContact O-NH1 3.31Å; V82-R191 PolarHBondContact O-NH2 2.7Å
83	G	95.1	Very high	95.8	Very high	8 Å²	8	70.5 Å²	70.5	8%	0.082	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	35.5	-177.6	0	0	0	0	0	113.2	D78 A81 V87	D78-G83 WeakPolarHBondContact OD1-CA 3.37Å; D78-G83 PolarHBondContact OD1-N 3.11Å; A81-G83 PolarHBondContact O-N 3.3Å; G83-V87 WeakPolarHBondContact O-CG2 3.46Å
84	Y	96.8	Very high	95.9	Very high	16 Å²	16	69.1 Å²	69.1	6%	0.063	39%	0.392	C	S	.	.	S	Bend	trans	-75.7	-43.4	174.1	-176.7	-93.7	0	0	0	111.2	V76 D78 A81 E86 V87 I88 P91 Y127	V76-Y84 HydrophobicContact CB-CD1 4.08Å; V76-Y84 HydrophobicContact CB-CE1 3.79Å; V76-Y84 HydrophobicContact CB-CE2 4.25Å; V76-Y84 HydrophobicContact CB-CG 4.44Å; V76-Y84 HydrophobicContact CG1-CD1 3.9Å; V76-Y84 HydrophobicContact CG1-CD2 3.85Å; V76-Y84 HydrophobicContact CG1-CE1 4.06Å; V76-Y84 HydrophobicContact CG1-CE2 3.99Å; V76-Y84 HydrophobicContact CG1-CG 3.79Å; D78-Y84 PolarHBondContact OD1-N 3.33Å; A81-Y84 HydrophobicContact CB-CD2 4.1Å; A81-Y84 HydrophobicContact CB-CG 4.24Å; A81-Y84 WeakPolarHBondContact O-CB 3.18Å; A81-Y84 PolarHBondContact O-N 3.23Å; Y84-E86 PolarHBondContact O-N 2.69Å; Y84-V87 PolarHBondContact O-N 2.87Å; Y84-I88 HydrophobicContact CD1-CB 4.19Å; Y84-I88 HydrophobicContact CD1-CG1 4.49Å; Y84-I88 HydrophobicContact CD2-CG1 4.06Å; Y84-I88 HydrophobicContact CE1-CB 3.82Å; Y84-I88 HydrophobicContact CE1-CG1 4.17Å; Y84-I88 HydrophobicContact CE1-CG2 3.89Å; Y84-I88 HydrophobicContact CE2-CB 4.31Å; Y84-I88 HydrophobicContact CE2-CG1 3.72Å; Y84-I88 HydrophobicContact CG-CG1 4.44Å; Y84-I88 PolarHBondContact O-N 3.3Å; Y84-P91 HydrophobicContact CE1-CB 4.46Å; Y84-Y127 AromaticContact CD2-CD1 3.93Å; Y84-Y127 HydrophobicContact CD2-CD1 3.93Å; Y84-Y127 AromaticContact CD2-CD2 3.76Å; Y84-Y127 HydrophobicContact CD2-CD2 3.76Å; Y84-Y127 HydrophobicContact CD2-CE1 4.26Å; Y84-Y127 HydrophobicContact CD2-CE2 4.12Å; Y84-Y127 AromaticContact CD2-CG 3.68Å; Y84-Y127 HydrophobicContact CD2-CG 3.68Å; Y84-Y127 HydrophobicContact CE2-CD1 4.41Å; Y84-Y127 HydrophobicContact CE2-CG 4.12Å
85	S	95.4	Very high	96	Very high	76 Å²	76	64.4 Å²	64.4	53%	0.531	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-26.6	179.1	-60.9	0	0	0	0	112.7	D78 V87	D78-S85 PolarHBondContact OD1-N 3.14Å; D78-S85 WeakPolarHBondContact OD2-CB 3.45Å; D78-S85 PolarHBondContact OD2-OG 2.91Å; S85-V87 VanDerWaalsContact C-N 3.32Å
86	E	96.2	Very high	96.1	Very high	164 Å²	164	63.1 Å²	63.1	77%	0.766	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-28.7	172.3	-58.1	-179.1	159.5	0	0	113.1	Y84	Y84-E86 PolarHBondContact O-N 2.69Å
87	V	96.2	Very high	96.2	Very high	69 Å²	69	61 Å²	61	42%	0.418	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-33.3	-171.5	176.5	0	0	0	0	112	G83 Y84 S85 V126 Y127	G83-V87 WeakPolarHBondContact O-CG2 3.46Å; Y84-V87 PolarHBondContact O-N 2.87Å; S85-V87 VanDerWaalsContact C-N 3.32Å; V87-V126 HydrophobicContact CG1-CG1 4.37Å; V87-Y127 HydrophobicContact CB-CD2 4.05Å; V87-Y127 HydrophobicContact CG1-CD2 4.06Å; V87-Y127 HydrophobicContact CG2-CD2 4.39Å
88	I	97	Very high	96.3	Very high	9 Å²	9	62 Å²	62	5%	0.046	35%	0.347	C	S	.	.			trans	-115.4	93.1	-173.4	-58.2	-57.5	0	0	0	110.3	Y84 K90 N123 V126	Y84-I88 HydrophobicContact CD1-CB 4.19Å; Y84-I88 HydrophobicContact CD1-CG1 4.49Å; Y84-I88 HydrophobicContact CD2-CG1 4.06Å; Y84-I88 HydrophobicContact CE1-CB 3.82Å; Y84-I88 HydrophobicContact CE1-CG1 4.17Å; Y84-I88 HydrophobicContact CE1-CG2 3.89Å; Y84-I88 HydrophobicContact CE2-CB 4.31Å; Y84-I88 HydrophobicContact CE2-CG1 3.72Å; Y84-I88 HydrophobicContact CG-CG1 4.44Å; Y84-I88 PolarHBondContact O-N 3.3Å; I88-K90 PolarHBondContact O-N 2.7Å; I88-N123 HydrophobicContact CD1-CB 4.09Å; I88-N123 HydrophobicContact CG1-CB 4.45Å; I88-N123 HydrophobicContact CG2-CB 3.84Å; I88-N123 VanDerWaalsContact CG2-CG 3.44Å; I88-V126 HydrophobicContact CD1-CB 4.15Å; I88-V126 HydrophobicContact CD1-CG1 3.98Å
89	S	95.6	Very high	96.5	Very high	116 Å²	116	63.8 Å²	63.8	81%	0.811	36%	0.357	S	S	*	.	S	Bend	trans	-69.2	-9.8	-178.3	59.1	0	0	0	0	116
90	K	96.6	Very high	96.6	Very high	144 Å²	144	60.2 Å²	60.2	63%	0.626	33%	0.332	S	S	*	.	S	Bend	trans	-142.9	79.9	-179.1	-68.9	-170.2	177.6	-174.9	0	110.4	I88 L119 N123	I88-K90 PolarHBondContact O-N 2.7Å; K90-L119 HydrophobicContact CB-CD1 4.31Å; K90-L119 HydrophobicContact CB-CD2 4.18Å; K90-N123 PolarHBondContact O-ND2 3.02Å
91	P	97	Very high	96.9	Very high	74 Å²	74	54.4 Å²	54.4	48%	0.481	30%	0.302	S	S	.	.			trans	-58.8	148	176	25.3	-34.5	0	0	0	111.4	Y84	Y84-P91 HydrophobicContact CE1-CB 4.46Å
92	M	98.1	Very high	97	Very high	15 Å²	15	59.9 Å²	59.9	7%	0.074	32%	0.324	C	S	.	.			trans	-160.3	143.2	177.5	-170.8	53.5	59.2	0	0	110.1	T96 I97 D116 L119 M120	M92-T96 HydrophobicContact CE-CG2 4.02Å; M92-T96 HydrophobicContact SD-CG2 3.66Å; M92-I97 HydrophobicContact CG-CD1 4Å; M92-I97 HydrophobicContact CG-CG1 4.08Å; M92-I97 HydrophobicContact SD-CD1 4.27Å; M92-I97 HydrophobicContact SD-CG1 3.67Å; M92-D116 HydrophobicContact CG-CB 4.21Å; M92-D116 WeakPolarHBondContact CG-O 3.39Å; M92-D116 HydrophobicContact SD-CB 4.28Å; M92-L119 HydrophobicContact CB-CD2 3.99Å; M92-L119 HydrophobicContact CB-CG 4.05Å; M92-L119 HydrophobicContact CE-CD2 4.49Å; M92-L119 HydrophobicContact CG-CD2 4.45Å; M92-M120 HydrophobicContact CB-CB 4.11Å; M92-M120 HydrophobicContact CG-CB 4.07Å; M92-M120 WeakPolarHBondContact O-CG 3.36Å
93	D	98.3	Very high	97	Very high	5 Å²	5	57 Å²	57	3%	0.027	31%	0.309	C	S	.	.			trans	-152.7	167.4	-172.9	65.6	96	0	0	0	110.8	N74 P75 G95 T96 I97	N74-D93 VanDerWaalsContact C-CB 3.49Å; N74-D93 WeakPolarHBondContact O-CB 3.45Å; P75-D93 WeakPolarHBondContact CG-OD2 3.4Å; D93-G95 PolarHBondContact O-N 3.07Å; D93-G95 VanDerWaalsContact OD1-CA 3.25Å; D93-G95 WeakPolarHBondContact OD1-CA 3.36Å; D93-G95 PolarHBondContact OD1-N 3.17Å; D93-T96 PolarHBondContact O-N 2.6Å; D93-T96 PolarHBondContact OD1-N 3.38Å; D93-T96 WeakPolarHBondContact OD2-CB 3.44Å; D93-T96 PolarHBondContact OD2-OG1 3.36Å; D93-I97 WeakPolarHBondContact O-CB 3.34Å; D93-I97 WeakPolarHBondContact O-CD1 3.48Å; D93-I97 VanDerWaalsContact O-CG1 3.22Å; D93-I97 WeakPolarHBondContact O-CG1 3.26Å; D93-I97 PolarHBondContact O-N 3.41Å
94	L	98.4	Very high	96.9	Very high	6 Å²	6	58.9 Å²	58.9	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-33.5	-178.7	-67.6	174.1	0	0	0	112.7	H60 L63 V64 F72 I97 Y98 M120	H60-L94 PolarHBondContact CE1-O 3.31Å; L63-L94 HydrophobicContact CB-CD2 4.38Å; V64-L94 HydrophobicContact CG2-CD1 4.17Å; F72-L94 HydrophobicContact CB-CD1 4.17Å; F72-L94 HydrophobicContact CB-CG 4.19Å; F72-L94 VanDerWaalsContact O-CB 3.25Å; F72-L94 WeakPolarHBondContact O-CB 3.36Å; F72-L94 WeakPolarHBondContact O-CG 3.44Å; F72-L94 PolarHBondContact O-N 2.95Å; L94-I97 PolarHBondContact O-N 3.2Å; L94-Y98 VanDerWaalsContact O-CB 3.26Å; L94-Y98 WeakPolarHBondContact O-CB 3.41Å; L94-Y98 PolarHBondContact O-N 3Å; L94-M120 HydrophobicContact CD2-CE 3.94Å; L94-M120 HydrophobicContact CD2-SD 3.9Å; L94-M120 HydrophobicContact CG-CE 4.24Å; L94-M120 HydrophobicContact CG-SD 3.78Å
95	G	97.7	Very high	96.8	Very high	22 Å²	22	59 Å²	59	23%	0.227	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-47.9	175.5	0	0	0	0	0	112	A73 D93 I97 Y98 N99	A73-G95 WeakPolarHBondContact O-CA 3.44Å; A73-G95 PolarHBondContact O-N 3.4Å; D93-G95 PolarHBondContact O-N 3.07Å; D93-G95 VanDerWaalsContact OD1-CA 3.25Å; D93-G95 WeakPolarHBondContact OD1-CA 3.36Å; D93-G95 PolarHBondContact OD1-N 3.17Å; G95-I97 PolarHBondContact O-N 3.22Å; G95-Y98 WeakPolarHBondContact O-CB 3.34Å; G95-Y98 PolarHBondContact O-N 2.86Å; G95-N99 WeakPolarHBondContact O-CB 3.19Å; G95-N99 VanDerWaalsContact O-CG 3.31Å; G95-N99 PolarHBondContact O-N 2.93Å; G95-N99 PolarHBondContact O-ND2 3.02Å
96	T	98.1	Very high	96.8	Very high	45 Å²	45	60.9 Å²	60.9	28%	0.276	31%	0.314	S	S	.	.	H	α-helix	trans	-60.3	-44.5	172.7	-63	0	0	0	0	111.5	M92 D93 Y98 N99 R100	M92-T96 HydrophobicContact CE-CG2 4.02Å; M92-T96 HydrophobicContact SD-CG2 3.66Å; D93-T96 PolarHBondContact O-N 2.6Å; D93-T96 PolarHBondContact OD1-N 3.38Å; D93-T96 WeakPolarHBondContact OD2-CB 3.44Å; D93-T96 PolarHBondContact OD2-OG1 3.36Å; T96-Y98 VanDerWaalsContact C-N 3.31Å; T96-Y98 PolarHBondContact O-N 2.87Å; T96-N99 PolarHBondContact O-N 2.77Å; T96-R100 WeakPolarHBondContact O-CG 3.42Å; T96-R100 PolarHBondContact O-N 3.22Å
97	I	98.4	Very high	96.8	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.9	-40.5	176.2	-71.8	167.9	0	0	0	111.4	M92 D93 L94 G95 L101 Y107 Y113 D116 V117 M120	M92-I97 HydrophobicContact CG-CD1 4Å; M92-I97 HydrophobicContact CG-CG1 4.08Å; M92-I97 HydrophobicContact SD-CD1 4.27Å; M92-I97 HydrophobicContact SD-CG1 3.67Å; D93-I97 WeakPolarHBondContact O-CB 3.34Å; D93-I97 WeakPolarHBondContact O-CD1 3.48Å; D93-I97 VanDerWaalsContact O-CG1 3.22Å; D93-I97 WeakPolarHBondContact O-CG1 3.26Å; D93-I97 PolarHBondContact O-N 3.41Å; L94-I97 PolarHBondContact O-N 3.2Å; G95-I97 PolarHBondContact O-N 3.22Å; I97-L101 WeakPolarHBondContact O-CB 3.16Å; I97-L101 PolarHBondContact O-N 2.94Å; I97-Y107 PolarHBondContact O-OH 3.18Å; I97-Y113 HydrophobicContact CG2-CD2 4.13Å; I97-Y113 HydrophobicContact CG2-CE2 3.5Å; I97-D116 HydrophobicContact CD1-CB 4.1Å; I97-D116 HydrophobicContact CG1-CB 3.93Å; I97-V117 HydrophobicContact CD1-CB 4.47Å; I97-V117 HydrophobicContact CD1-CG2 3.85Å; I97-V117 HydrophobicContact CG2-CG2 4.5Å; I97-M120 HydrophobicContact CD1-SD 4.18Å
98	Y	97.9	Very high	96.8	Very high	80 Å²	80	57.2 Å²	57.2	31%	0.314	29%	0.285	S	S	.	.	H	α-helix	trans	-66.8	-44.1	177	-178.4	-114.9	0	0	0	111.9	H60 L94 G95 T96 L101 K102	H60-Y98 AromaticContact CD2-CD2 3.74Å; H60-Y98 AromaticContact NE2-CD2 3.82Å; L94-Y98 VanDerWaalsContact O-CB 3.26Å; L94-Y98 WeakPolarHBondContact O-CB 3.41Å; L94-Y98 PolarHBondContact O-N 3Å; G95-Y98 WeakPolarHBondContact O-CB 3.34Å; G95-Y98 PolarHBondContact O-N 2.86Å; T96-Y98 VanDerWaalsContact C-N 3.31Å; T96-Y98 PolarHBondContact O-N 2.87Å; Y98-L101 WeakPolarHBondContact O-CB 3.36Å; Y98-L101 PolarHBondContact O-N 3.07Å; Y98-L101 VanDerWaalsContact O-N 3.17Å; Y98-K102 HydrophobicContact CE1-CD 4.22Å; Y98-K102 VanDerWaalsContact O-CB 3.26Å; Y98-K102 WeakPolarHBondContact O-CB 3.4Å; Y98-K102 PolarHBondContact O-N 3.28Å
99	N	97.5	Very high	96.7	Very high	98 Å²	98	57.3 Å²	57.3	52%	0.524	29%	0.287	S	S	.	.	H	α-helix	trans	-64.6	-43.1	178.1	-71.7	-23.6	0	0	0	111.6	G95 T96 L101 K102 S103	G95-N99 WeakPolarHBondContact O-CB 3.19Å; G95-N99 VanDerWaalsContact O-CG 3.31Å; G95-N99 PolarHBondContact O-N 2.93Å; G95-N99 PolarHBondContact O-ND2 3.02Å; T96-N99 PolarHBondContact O-N 2.77Å; N99-L101 VanDerWaalsContact C-N 3.31Å; N99-L101 PolarHBondContact O-N 3.37Å; N99-K102 PolarHBondContact O-N 2.97Å; N99-S103 WeakPolarHBondContact O-CB 3.46Å; N99-S103 PolarHBondContact O-N 3.29Å; N99-S103 PolarHBondContact O-OG 3.03Å
100	R	97.4	Very high	96.7	Very high	72 Å²	72	51.8 Å²	51.8	27%	0.272	25%	0.248	S	C	.	.	H	α-helix	trans	-56.1	-44.5	170.1	-75.4	-176.6	174.8	-175.1	0.2	111.8	T96 S103 Y106 Y107 D116	T96-R100 WeakPolarHBondContact O-CG 3.42Å; T96-R100 PolarHBondContact O-N 3.22Å; R100-S103 PolarHBondContact O-OG 2.68Å; R100-Y106 HydrophobicContact CB-CD1 4.49Å; R100-Y106 HydrophobicContact CB-CD2 3.92Å; R100-Y106 HydrophobicContact CB-CG 3.89Å; R100-Y106 HydrophobicContact CG-CD1 3.87Å; R100-Y106 HydrophobicContact CG-CD2 3.88Å; R100-Y106 HydrophobicContact CG-CE1 4.13Å; R100-Y106 HydrophobicContact CG-CE2 4.15Å; R100-Y106 HydrophobicContact CG-CG 3.75Å; R100-Y107 HydrophobicContact CB-CE2 3.73Å; R100-Y107 WeakPolarHBondContact CB-OH 3.36Å; R100-D116 IonicContact CZ-OD2 3.06Å; R100-D116 IonicContact NH1-OD1 2.65Å; R100-D116 PolarHBondContact NH1-OD1 3.15Å; R100-D116 IonicContact NH1-OD2 3.86Å; R100-D116 PolarHBondContact NH1-OD2 3.32Å
101	L	97.3	Very high	96.7	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-67	-47.4	178.8	-177.8	59.4	0	0	0	112.3	T48 Y53 L56 H60 I97 Y98 N99 S103 R104 Y107 Y113	T48-L101 HydrophobicContact CG2-CD1 4.45Å; Y53-L101 HydrophobicContact CD2-CD1 3.81Å; Y53-L101 HydrophobicContact CD2-CG 3.98Å; Y53-L101 WeakPolarHBondContact CD2-O 3.41Å; Y53-L101 HydrophobicContact CE2-CD1 4.35Å; Y53-L101 HydrophobicContact CE2-CG 4Å; Y53-L101 WeakPolarHBondContact CE2-O 3.15Å; L56-L101 HydrophobicContact CB-CD1 3.73Å; L56-L101 HydrophobicContact CB-CD2 4.08Å; L56-L101 HydrophobicContact CD1-CD1 4.14Å; H60-L101 HydrophobicContact CB-CD2 4.3Å; I97-L101 WeakPolarHBondContact O-CB 3.16Å; I97-L101 PolarHBondContact O-N 2.94Å; Y98-L101 WeakPolarHBondContact O-CB 3.36Å; Y98-L101 PolarHBondContact O-N 3.07Å; Y98-L101 VanDerWaalsContact O-N 3.17Å; N99-L101 VanDerWaalsContact C-N 3.31Å; N99-L101 PolarHBondContact O-N 3.37Å; L101-S103 VanDerWaalsContact C-N 3.32Å; L101-S103 PolarHBondContact O-N 3.36Å; L101-R104 PolarHBondContact O-N 3.41Å; L101-R104 VanDerWaalsContact O-N 3.07Å; L101-Y107 HydrophobicContact CB-CD2 4.23Å; L101-Y107 HydrophobicContact CB-CE2 3.86Å; L101-Y107 HydrophobicContact CD1-CD2 4.05Å; L101-Y107 HydrophobicContact CD1-CE2 4.45Å; L101-Y113 HydrophobicContact CD2-CE2 4.21Å
102	K	96.2	Very high	96.7	Very high	129 Å²	129	45.5 Å²	45.5	56%	0.561	22%	0.216	S	C	*	.	H	α-helix	trans	-60.6	-38.2	-179.3	-175.8	-177.4	174.6	-169.9	0	112.2	Y98 N99 R104	Y98-K102 HydrophobicContact CE1-CD 4.22Å; Y98-K102 VanDerWaalsContact O-CB 3.26Å; Y98-K102 WeakPolarHBondContact O-CB 3.4Å; Y98-K102 PolarHBondContact O-N 3.28Å; N99-K102 PolarHBondContact O-N 2.97Å; K102-R104 PolarHBondContact O-N 3.42Å
103	S	95.4	Very high	96.6	Very high	50 Å²	50	44.8 Å²	44.8	35%	0.35	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-20.3	175.9	73.6	0	0	0	0	114.1	N99 R100 L101 A105 Y106	N99-S103 WeakPolarHBondContact O-CB 3.46Å; N99-S103 PolarHBondContact O-N 3.29Å; N99-S103 PolarHBondContact O-OG 3.03Å; R100-S103 PolarHBondContact O-OG 2.68Å; L101-S103 VanDerWaalsContact C-N 3.32Å; L101-S103 PolarHBondContact O-N 3.36Å; S103-A105 PolarHBondContact O-N 3.31Å; S103-A105 PolarHBondContact OG-N 3.31Å; S103-Y106 VanDerWaalsContact OG-CD2 3.3Å; S103-Y106 WeakPolarHBondContact OG-CD2 3.14Å
104	R	94.5	Very high	96.6	Very high	46 Å²	46	44.8 Å²	44.8	17%	0.174	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	15.8	-173.5	-65.6	-179.6	57.7	-133.6	-19.4	115.4	E46 V47 T48 Y53 L101 K102	E46-R104 CarbonylContact C-O 3.6Å; E46-R104 WeakPolarHBondContact CA-O 3.33Å; E46-R104 VanDerWaalsContact CD-CZ 3.4Å; E46-R104 IonicContact OE1-CZ 3.35Å; E46-R104 IonicContact OE1-NH1 2.96Å; E46-R104 PolarHBondContact OE1-NH1 2.91Å; E46-R104 IonicContact OE1-NH2 2.68Å; E46-R104 IonicContact OE2-CZ 2.83Å; E46-R104 IonicContact OE2-NH1 3.05Å; E46-R104 PolarHBondContact OE2-NH1 3.34Å; E46-R104 IonicContact OE2-NH2 3.37Å; E46-R104 PolarHBondContact OE2-NH2 3.37Å; V47-R104 PolarHBondContact N-O 3.12Å; T48-R104 WeakPolarHBondContact CB-O 3.48Å; T48-R104 PolarHBondContact N-O 3.04Å; T48-R104 VanDerWaalsContact O-CZ 3.31Å; T48-R104 PolarHBondContact O-NE 3.43Å; T48-R104 PolarHBondContact O-NH2 3.34Å; T48-R104 PolarHBondContact OG1-O 3.43Å; Y53-R104 HydrophobicContact CD2-CG 3.59Å; Y53-R104 HydrophobicContact CE2-CG 4.12Å; Y53-R104 HydrophobicContact CG-CG 4.1Å; L101-R104 PolarHBondContact O-N 3.41Å; L101-R104 VanDerWaalsContact O-N 3.07Å; K102-R104 PolarHBondContact O-N 3.42Å
105	A	94.4	Very high	96.5	Very high	19 Å²	19	46 Å²	46	16%	0.157	22%	0.223	C	C	.	.	S	Bend	trans	-100.6	-6.9	-176	0	0	0	0	0	114.5	L44 V47 S103	L44-A105 HydrophobicContact CB-CB 4.03Å; L44-A105 HydrophobicContact CD1-CB 4.41Å; L44-A105 HydrophobicContact CD2-CB 4.26Å; L44-A105 HydrophobicContact CG-CB 4.47Å; V47-A105 VanDerWaalsContact CG2-C 3.43Å; V47-A105 WeakPolarHBondContact CG2-O 3.49Å; S103-A105 PolarHBondContact O-N 3.31Å; S103-A105 PolarHBondContact OG-N 3.31Å
106	Y	94.6	Very high	96.5	Very high	116 Å²	116	45.9 Å²	45.9	46%	0.455	22%	0.218	S	C	.	.	S	Bend	trans	-106.6	-58.9	-172.6	-70.4	-97.6	0	0	0	114	R100 S103 R108	R100-Y106 HydrophobicContact CB-CD1 4.49Å; R100-Y106 HydrophobicContact CB-CD2 3.92Å; R100-Y106 HydrophobicContact CB-CG 3.89Å; R100-Y106 HydrophobicContact CG-CD1 3.87Å; R100-Y106 HydrophobicContact CG-CD2 3.88Å; R100-Y106 HydrophobicContact CG-CE1 4.13Å; R100-Y106 HydrophobicContact CG-CE2 4.15Å; R100-Y106 HydrophobicContact CG-CG 3.75Å; S103-Y106 VanDerWaalsContact OG-CD2 3.3Å; S103-Y106 WeakPolarHBondContact OG-CD2 3.14Å; Y106-R108 PolarHBondContact O-N 3.45Å
107	Y	96.5	Very high	96.5	Very high	3 Å²	3	43.7 Å²	43.7	1%	0.012	20%	0.204	C	C	.	.			trans	-86.9	108	-168.9	-50.7	-62.3	0	0	0	111.4	T48 L56 I97 R100 L101 E112 Y113 D116	T48-Y107 WeakPolarHBondContact CA-O 3.36Å; T48-Y107 WeakPolarHBondContact CB-O 3.42Å; T48-Y107 WeakPolarHBondContact CG2-O 3.42Å; T48-Y107 PolarHBondContact OG1-N 2.83Å; T48-Y107 PolarHBondContact OG1-O 3.14Å; L56-Y107 HydrophobicContact CD1-CD2 4.47Å; L56-Y107 HydrophobicContact CD1-CG 4.49Å; I97-Y107 PolarHBondContact O-OH 3.18Å; R100-Y107 HydrophobicContact CB-CE2 3.73Å; R100-Y107 WeakPolarHBondContact CB-OH 3.36Å; L101-Y107 HydrophobicContact CB-CD2 4.23Å; L101-Y107 HydrophobicContact CB-CE2 3.86Å; L101-Y107 HydrophobicContact CD1-CD2 4.05Å; L101-Y107 HydrophobicContact CD1-CE2 4.45Å; Y107-E112 HydrophobicContact CD1-CB 3.94Å; Y107-Y113 HydrophobicContact CD2-CD2 4.11Å; Y107-Y113 HydrophobicContact CE1-CD2 4.4Å; Y107-Y113 AromaticContact CE2-CD2 3.76Å; Y107-Y113 HydrophobicContact CE2-CD2 3.76Å; Y107-Y113 HydrophobicContact CE2-CE2 4.5Å; Y107-Y113 AromaticContact CZ-CD2 3.92Å; Y107-D116 WeakPolarHBondContact CE1-OD2 3.41Å; Y107-D116 PolarHBondContact OH-OD2 3.23Å
108	R	95.5	Very high	96.4	Very high	152 Å²	152	43.8 Å²	43.8	57%	0.574	21%	0.205	S	C	*	.	S	Bend	trans	-77.1	-26.9	166.7	-65.5	174.5	-174.4	84.2	4	111.5	V47 L52 Y106 E112	V47-R108 HydrophobicContact CB-CG 3.86Å; V47-R108 HydrophobicContact CG2-CG 3.88Å; L52-R108 VanDerWaalsContact CD2-C 3.43Å; L52-R108 VanDerWaalsContact CD2-O 3.26Å; L52-R108 WeakPolarHBondContact CD2-O 3.23Å; Y106-R108 PolarHBondContact O-N 3.45Å; R108-E112 WeakPolarHBondContact CA-OE2 3.22Å; R108-E112 WeakPolarHBondContact CB-OE2 3.33Å; R108-E112 PolarHBondContact N-OE2 2.83Å; R108-E112 IonicContact NH1-OE1 3.69Å
109	S	95.9	Very high	96.4	Very high	12 Å²	12	41.4 Å²	41.4	8%	0.084	20%	0.197	C	C	.	.	S	Bend	trans	-144	161.4	-173.7	64.5	0	0	0	0	113.3	T111 E112 E168 E169	S109-T111 PolarHBondContact O-N 3.5Å; S109-T111 PolarHBondContact OG-OG1 2.93Å; S109-E112 PolarHBondContact N-OE2 3.08Å; S109-E112 PolarHBondContact O-N 2.96Å; S109-E112 PolarHBondContact OG-OE2 2.9Å; S109-E112 VanDerWaalsContact OG-OE2 3.07Å; S109-E168 WeakPolarHBondContact CB-O 3.32Å; S109-E169 CarbonylContact C-O 3.49Å; S109-E169 VanDerWaalsContact CA-O 3.3Å; S109-E169 WeakPolarHBondContact CA-O 3.46Å
110	A	96	Very high	96.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.3	-18.9	174.2	0	0	0	0	0	113.2	L52 L56 L114 M149 L154 E169 L173	L52-A110 HydrophobicContact CD1-CB 4.22Å; L56-A110 HydrophobicContact CD2-CB 4.26Å; A110-L114 WeakPolarHBondContact O-CB 3.35Å; A110-L114 PolarHBondContact O-N 2.82Å; A110-M149 HydrophobicContact CB-SD 4.06Å; A110-L154 HydrophobicContact CB-CD1 4.03Å; A110-L154 HydrophobicContact CB-CD2 4.5Å; A110-E169 PolarHBondContact N-O 3.34Å; A110-L173 HydrophobicContact CB-CD2 4.46Å
111	T	95.4	Very high	96.5	Very high	22 Å²	22	33.5 Å²	33.5	14%	0.135	16%	0.16	C	C	.	.	H	α-helix	trans	-71.5	-40.2	177.3	61.5	0	0	0	0	112.4	S109 Y113 L114 A115 D172 L173	S109-T111 PolarHBondContact O-N 3.5Å; S109-T111 PolarHBondContact OG-OG1 2.93Å; T111-Y113 VanDerWaalsContact C-N 3.34Å; T111-L114 PolarHBondContact O-N 2.7Å; T111-A115 WeakPolarHBondContact O-CB 3.3Å; T111-A115 PolarHBondContact O-N 3.07Å; T111-D172 WeakPolarHBondContact CG2-O 3.46Å; T111-L173 HydrophobicContact CG2-CD2 3.98Å; T111-L173 HydrophobicContact CG2-CG 4.04Å
112	E	96.4	Very high	96.5	Very high	63 Å²	63	33.8 Å²	33.8	29%	0.294	16%	0.162	S	C	.	.	H	α-helix	trans	-64.4	-41.6	177.6	-66.9	158.6	135.2	0	0	110.5	Y107 R108 S109 A115 D116	Y107-E112 HydrophobicContact CD1-CB 3.94Å; R108-E112 WeakPolarHBondContact CA-OE2 3.22Å; R108-E112 WeakPolarHBondContact CB-OE2 3.33Å; R108-E112 PolarHBondContact N-OE2 2.83Å; R108-E112 IonicContact NH1-OE1 3.69Å; S109-E112 PolarHBondContact N-OE2 3.08Å; S109-E112 PolarHBondContact O-N 2.96Å; S109-E112 PolarHBondContact OG-OE2 2.9Å; S109-E112 VanDerWaalsContact OG-OE2 3.07Å; E112-A115 WeakPolarHBondContact O-CB 3.49Å; E112-A115 PolarHBondContact O-N 3.01Å; E112-D116 PolarHBondContact O-N 2.81Å; E112-D116 VanDerWaalsContact O-N 3.14Å
113	Y	97.4	Very high	96.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.9	-41.9	172.8	-178.3	-79.5	0	0	0	112.3	L56 I59 H60 L63 I97 L101 Y107 T111 A115 D116 V117 M149	L56-Y113 HydrophobicContact CB-CD2 4.24Å; L56-Y113 HydrophobicContact CB-CE2 4.34Å; L56-Y113 HydrophobicContact CD1-CD2 3.94Å; L56-Y113 HydrophobicContact CD1-CG 3.99Å; L56-Y113 HydrophobicContact CD2-CD1 3.88Å; L56-Y113 HydrophobicContact CD2-CD2 4.2Å; L56-Y113 HydrophobicContact CD2-CE1 4.44Å; L56-Y113 HydrophobicContact CD2-CG 3.75Å; L56-Y113 HydrophobicContact CG-CD2 4.36Å; L56-Y113 HydrophobicContact CG-CG 4.34Å; I59-Y113 HydrophobicContact CG2-CE1 4.29Å; H60-Y113 WeakPolarHBondContact CA-OH 3.38Å; H60-Y113 WeakPolarHBondContact CB-OH 3.45Å; H60-Y113 PolarHBondContact N-OH 3.49Å; H60-Y113 PolarHBondContact ND1-OH 3.42Å; L63-Y113 HydrophobicContact CD1-CE1 4.27Å; I97-Y113 HydrophobicContact CG2-CD2 4.13Å; I97-Y113 HydrophobicContact CG2-CE2 3.5Å; L101-Y113 HydrophobicContact CD2-CE2 4.21Å; Y107-Y113 HydrophobicContact CD2-CD2 4.11Å; Y107-Y113 HydrophobicContact CE1-CD2 4.4Å; Y107-Y113 AromaticContact CE2-CD2 3.76Å; Y107-Y113 HydrophobicContact CE2-CD2 3.76Å; Y107-Y113 HydrophobicContact CE2-CE2 4.5Å; Y107-Y113 AromaticContact CZ-CD2 3.92Å; T111-Y113 VanDerWaalsContact C-N 3.34Å; Y113-A115 VanDerWaalsContact C-N 3.28Å; Y113-A115 PolarHBondContact O-N 3.4Å; Y113-D116 PolarHBondContact O-N 2.99Å; Y113-V117 HydrophobicContact CD1-CG2 4.05Å; Y113-V117 HydrophobicContact CE1-CG2 3.6Å; Y113-V117 WeakPolarHBondContact O-CG2 3.47Å; Y113-V117 PolarHBondContact O-N 2.97Å; Y113-V117 VanDerWaalsContact O-N 3.11Å; Y113-M149 HydrophobicContact CD1-CE 3.46Å; Y113-M149 VanDerWaalsContact CD1-CE 3.46Å; Y113-M149 HydrophobicContact CE1-CE 3.77Å
114	L	97	Very high	96.7	Very high	5 Å²	5	26.3 Å²	26.3	3%	0.026	13%	0.125	C	C	.	.	H	α-helix	trans	-63.8	-34.2	175.5	-178	61.2	0	0	0	112	A110 T111 T118 R146 M149 L173 V176	A110-L114 WeakPolarHBondContact O-CB 3.35Å; A110-L114 PolarHBondContact O-N 2.82Å; T111-L114 PolarHBondContact O-N 2.7Å; L114-T118 WeakPolarHBondContact O-CB 3.44Å; L114-T118 PolarHBondContact O-N 3.05Å; L114-T118 PolarHBondContact O-OG1 3.42Å; L114-R146 HydrophobicContact CD1-CG 4.33Å; L114-M149 HydrophobicContact CB-CG 4.22Å; L114-M149 HydrophobicContact CD1-CB 4.11Å; L114-M149 HydrophobicContact CD1-CG 4.32Å; L114-M149 HydrophobicContact CD2-CB 4.29Å; L114-M149 HydrophobicContact CD2-CG 4.17Å; L114-M149 HydrophobicContact CG-CG 4.47Å; L114-L173 HydrophobicContact CD2-CD2 3.88Å; L114-V176 HydrophobicContact CG-CG1 4.31Å
115	A	97	Very high	96.8	Very high	31 Å²	31	25.5 Å²	25.5	26%	0.256	12%	0.124	S	C	.	.	H	α-helix	trans	-65.5	-47.9	176.4	0	0	0	0	0	111.4	T111 E112 Y113 T118 L119 V176	T111-A115 WeakPolarHBondContact O-CB 3.3Å; T111-A115 PolarHBondContact O-N 3.07Å; E112-A115 WeakPolarHBondContact O-CB 3.49Å; E112-A115 PolarHBondContact O-N 3.01Å; Y113-A115 VanDerWaalsContact C-N 3.28Å; Y113-A115 PolarHBondContact O-N 3.4Å; A115-T118 CarbonylContact O-C 3.5Å; A115-T118 PolarHBondContact O-N 3.43Å; A115-L119 WeakPolarHBondContact O-CB 3.35Å; A115-L119 PolarHBondContact O-N 2.77Å; A115-V176 HydrophobicContact CB-CG1 4.08Å
116	D	97.8	Very high	96.9	Very high	20 Å²	20	28.3 Å²	28.3	11%	0.107	14%	0.139	C	C	.	.	H	α-helix	trans	-63.4	-43.3	176.8	-82.7	-22.6	0	0	0	112.4	M92 I97 R100 Y107 E112 Y113 T118 L119 M120	M92-D116 HydrophobicContact CG-CB 4.21Å; M92-D116 WeakPolarHBondContact CG-O 3.39Å; M92-D116 HydrophobicContact SD-CB 4.28Å; I97-D116 HydrophobicContact CD1-CB 4.1Å; I97-D116 HydrophobicContact CG1-CB 3.93Å; R100-D116 IonicContact CZ-OD2 3.06Å; R100-D116 IonicContact NH1-OD1 2.65Å; R100-D116 PolarHBondContact NH1-OD1 3.15Å; R100-D116 IonicContact NH1-OD2 3.86Å; R100-D116 PolarHBondContact NH1-OD2 3.32Å; Y107-D116 WeakPolarHBondContact CE1-OD2 3.41Å; Y107-D116 PolarHBondContact OH-OD2 3.23Å; E112-D116 PolarHBondContact O-N 2.81Å; E112-D116 VanDerWaalsContact O-N 3.14Å; Y113-D116 PolarHBondContact O-N 2.99Å; D116-T118 VanDerWaalsContact C-N 3.29Å; D116-T118 PolarHBondContact O-N 3.13Å; D116-L119 WeakPolarHBondContact O-CB 3.48Å; D116-L119 PolarHBondContact O-N 3.05Å; D116-M120 PolarHBondContact O-N 3.3Å
117	V	97.9	Very high	97.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.2	-37.1	174.8	177	0	0	0	0	111.3	L63 I97 Y113 M120 C121 C145	L63-V117 HydrophobicContact CD1-CG1 4.18Å; L63-V117 HydrophobicContact CD1-CG2 4.01Å; I97-V117 HydrophobicContact CD1-CB 4.47Å; I97-V117 HydrophobicContact CD1-CG2 3.85Å; I97-V117 HydrophobicContact CG2-CG2 4.5Å; Y113-V117 HydrophobicContact CD1-CG2 4.05Å; Y113-V117 HydrophobicContact CE1-CG2 3.6Å; Y113-V117 WeakPolarHBondContact O-CG2 3.47Å; Y113-V117 PolarHBondContact O-N 2.97Å; Y113-V117 VanDerWaalsContact O-N 3.11Å; V117-M120 HydrophobicContact CG1-CE 4.17Å; V117-C121 WeakPolarHBondContact O-CB 3.48Å; V117-C121 PolarHBondContact O-N 3.4Å; V117-C121 VanDerWaalsContact O-N 3.13Å; V117-C121 PolarHBondContact O-SG 3.39Å; V117-C121 VanDerWaalsContact O-SG 3.39Å; V117-C145 HydrophobicContact CG1-CB 3.97Å
118	T	97.5	Very high	97.1	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	13%	0.133	C	C	.	.	H	α-helix	trans	-73.1	-31.9	177	-56.4	0	0	0	0	111.9	L114 A115 D116 C121 N122 L142 M180	L114-T118 WeakPolarHBondContact O-CB 3.44Å; L114-T118 PolarHBondContact O-N 3.05Å; L114-T118 PolarHBondContact O-OG1 3.42Å; A115-T118 CarbonylContact O-C 3.5Å; A115-T118 PolarHBondContact O-N 3.43Å; D116-T118 VanDerWaalsContact C-N 3.29Å; D116-T118 PolarHBondContact O-N 3.13Å; T118-C121 PolarHBondContact O-N 3Å; T118-N122 VanDerWaalsContact O-CB 3.23Å; T118-N122 WeakPolarHBondContact O-CB 3.45Å; T118-N122 VanDerWaalsContact O-CG 3.3Å; T118-N122 PolarHBondContact O-N 3.27Å; T118-L142 HydrophobicContact CG2-CD1 3.92Å; T118-L142 HydrophobicContact CG2-CD2 4.22Å; T118-L142 WeakPolarHBondContact OG1-CD1 3.42Å; T118-M180 VanDerWaalsContact CB-SD 3.55Å; T118-M180 HydrophobicContact CG2-CB 4.14Å; T118-M180 HydrophobicContact CG2-CE 3.8Å; T118-M180 HydrophobicContact CG2-CG 4.43Å; T118-M180 HydrophobicContact CG2-SD 3.43Å; T118-M180 WeakPolarHBondContact CG2-SD 3.3Å
119	L	97.9	Very high	97.1	Very high	30 Å²	30	22.6 Å²	22.6	16%	0.157	13%	0.128	C	C	.	.	H	α-helix	trans	-63.9	-53.7	173.9	173.7	62.3	0	0	0	110.3	K90 M92 A115 D116 C121 N122 N123 M180	K90-L119 HydrophobicContact CB-CD1 4.31Å; K90-L119 HydrophobicContact CB-CD2 4.18Å; M92-L119 HydrophobicContact CB-CD2 3.99Å; M92-L119 HydrophobicContact CB-CG 4.05Å; M92-L119 HydrophobicContact CE-CD2 4.49Å; M92-L119 HydrophobicContact CG-CD2 4.45Å; A115-L119 WeakPolarHBondContact O-CB 3.35Å; A115-L119 PolarHBondContact O-N 2.77Å; D116-L119 WeakPolarHBondContact O-CB 3.48Å; D116-L119 PolarHBondContact O-N 3.05Å; L119-C121 VanDerWaalsContact C-N 3.31Å; L119-C121 PolarHBondContact O-N 2.94Å; L119-N122 PolarHBondContact O-N 3.13Å; L119-N122 VanDerWaalsContact O-N 3.15Å; L119-N123 WeakPolarHBondContact CD1-OD1 3.22Å; L119-N123 WeakPolarHBondContact O-CB 3.18Å; L119-N123 PolarHBondContact O-N 2.82Å; L119-N123 PolarHBondContact O-ND2 2.97Å; L119-N123 PolarHBondContact O-OD1 2.98Å; L119-M180 HydrophobicContact CB-CE 4.05Å
120	M	98.1	Very high	97.1	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.02	15%	0.149	C	C	.	.	H	α-helix	trans	-49.9	-50.1	173.3	174.9	-169.7	80.3	0	0	111.9	F72 M92 L94 I97 D116 V117 A124 L141	F72-M120 HydrophobicContact CB-CE 4.27Å; F72-M120 HydrophobicContact CB-CG 4.38Å; F72-M120 HydrophobicContact CB-SD 3.77Å; F72-M120 HydrophobicContact CD1-CG 4.33Å; F72-M120 HydrophobicContact CG-CE 4.43Å; F72-M120 HydrophobicContact CG-SD 4.4Å; M92-M120 HydrophobicContact CB-CB 4.11Å; M92-M120 HydrophobicContact CG-CB 4.07Å; M92-M120 WeakPolarHBondContact O-CG 3.36Å; L94-M120 HydrophobicContact CD2-CE 3.94Å; L94-M120 HydrophobicContact CD2-SD 3.9Å; L94-M120 HydrophobicContact CG-CE 4.24Å; L94-M120 HydrophobicContact CG-SD 3.78Å; I97-M120 HydrophobicContact CD1-SD 4.18Å; D116-M120 PolarHBondContact O-N 3.3Å; V117-M120 HydrophobicContact CG1-CE 4.17Å; M120-A124 PolarHBondContact O-N 3.46Å; M120-L141 HydrophobicContact CE-CD2 3.76Å
121	C	97.9	Very high	97.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-67.3	-40	178.9	-73.6	0	0	0	0	113.3	V117 T118 L119 M125 A138 L142	V117-C121 WeakPolarHBondContact O-CB 3.48Å; V117-C121 PolarHBondContact O-N 3.4Å; V117-C121 VanDerWaalsContact O-N 3.13Å; V117-C121 PolarHBondContact O-SG 3.39Å; V117-C121 VanDerWaalsContact O-SG 3.39Å; T118-C121 PolarHBondContact O-N 3Å; L119-C121 VanDerWaalsContact C-N 3.31Å; L119-C121 PolarHBondContact O-N 2.94Å; C121-M125 WeakPolarHBondContact O-CE 3.49Å; C121-M125 WeakPolarHBondContact O-CG 3.18Å; C121-M125 PolarHBondContact O-N 3.24Å; C121-M125 VanDerWaalsContact O-N 3.13Å; C121-A138 HydrophobicContact CB-CB 4.34Å; C121-L142 HydrophobicContact CB-CB 3.86Å; C121-L142 HydrophobicContact CB-CD1 4.41Å; C121-L142 HydrophobicContact CB-CD2 4.08Å; C121-L142 HydrophobicContact CB-CG 4.34Å
122	N	97.3	Very high	97.1	Very high	6 Å²	6	31.6 Å²	31.6	3%	0.032	18%	0.18	C	C	.	.	H	α-helix	trans	-67.8	-42.9	177.5	-81.9	-5.8	0	0	0	111.4	T118 L119 A124 M125 V126 N184	T118-N122 VanDerWaalsContact O-CB 3.23Å; T118-N122 WeakPolarHBondContact O-CB 3.45Å; T118-N122 VanDerWaalsContact O-CG 3.3Å; T118-N122 PolarHBondContact O-N 3.27Å; L119-N122 PolarHBondContact O-N 3.13Å; L119-N122 VanDerWaalsContact O-N 3.15Å; N122-A124 VanDerWaalsContact C-N 3.32Å; N122-A124 PolarHBondContact O-N 3.46Å; N122-M125 CarbonylContact O-C 3.23Å; N122-M125 WeakPolarHBondContact O-CA 3.25Å; N122-M125 PolarHBondContact O-N 3.49Å; N122-M125 WeakPolarHBondContact OD1-CE 3.15Å; N122-V126 WeakPolarHBondContact O-CG2 3.34Å; N122-V126 PolarHBondContact O-N 3.4Å; N122-N184 PolarHBondContact OD1-ND2 3.43Å
123	N	97.6	Very high	97.1	Very high	15 Å²	15	31.8 Å²	31.8	8%	0.08	18%	0.183	C	C	.	.	H	α-helix	trans	-54.3	-49.3	175.8	-69.9	-14.4	0	0	0	111.1	I88 K90 L119 M125 V126 Y127	I88-N123 HydrophobicContact CD1-CB 4.09Å; I88-N123 HydrophobicContact CG1-CB 4.45Å; I88-N123 HydrophobicContact CG2-CB 3.84Å; I88-N123 VanDerWaalsContact CG2-CG 3.44Å; K90-N123 PolarHBondContact O-ND2 3.02Å; L119-N123 WeakPolarHBondContact CD1-OD1 3.22Å; L119-N123 WeakPolarHBondContact O-CB 3.18Å; L119-N123 PolarHBondContact O-N 2.82Å; L119-N123 PolarHBondContact O-ND2 2.97Å; L119-N123 PolarHBondContact O-OD1 2.98Å; N123-M125 VanDerWaalsContact C-N 3.25Å; N123-M125 PolarHBondContact O-N 2.8Å; N123-V126 PolarHBondContact O-N 3.14Å; N123-Y127 PolarHBondContact O-N 2.99Å
124	A	97.6	Very high	97.1	Very high	8 Å²	8	37.2 Å²	37.2	7%	0.066	20%	0.204	C	C	.	.	H	α-helix	trans	-61.9	-31	175.7	0	0	0	0	0	113.1	F72 M120 N122 N128 A138	F72-A124 HydrophobicContact CE1-CB 3.81Å; M120-A124 PolarHBondContact O-N 3.46Å; N122-A124 VanDerWaalsContact C-N 3.32Å; N122-A124 PolarHBondContact O-N 3.46Å; A124-N128 VanDerWaalsContact O-CB 3.28Å; A124-N128 WeakPolarHBondContact O-CB 3.25Å; A124-N128 PolarHBondContact O-N 3.41Å; A124-N128 PolarHBondContact O-ND2 3.43Å; A124-A138 HydrophobicContact CB-CB 3.82Å
125	M	97.5	Very high	97.1	Very high	28 Å²	28	39.7 Å²	39.7	14%	0.138	21%	0.213	C	C	.	.	H	α-helix	trans	-84.4	-17.4	176.2	-70.5	-173.7	-58.7	0	0	114.7	C121 N122 N123 Y135 A138 R139 L142	C121-M125 WeakPolarHBondContact O-CE 3.49Å; C121-M125 WeakPolarHBondContact O-CG 3.18Å; C121-M125 PolarHBondContact O-N 3.24Å; C121-M125 VanDerWaalsContact O-N 3.13Å; N122-M125 CarbonylContact O-C 3.23Å; N122-M125 WeakPolarHBondContact O-CA 3.25Å; N122-M125 PolarHBondContact O-N 3.49Å; N122-M125 WeakPolarHBondContact OD1-CE 3.15Å; N123-M125 VanDerWaalsContact C-N 3.25Å; N123-M125 PolarHBondContact O-N 2.8Å; M125-Y135 VanDerWaalsContact CA-CD2 3.46Å; M125-Y135 HydrophobicContact CB-CD2 3.63Å; M125-Y135 HydrophobicContact CB-CE2 3.58Å; M125-Y135 HydrophobicContact CB-CG 4.38Å; M125-Y135 HydrophobicContact CG-CD1 4.32Å; M125-Y135 HydrophobicContact CG-CD2 3.67Å; M125-Y135 HydrophobicContact CG-CE1 4.43Å; M125-Y135 HydrophobicContact CG-CE2 3.8Å; M125-Y135 HydrophobicContact CG-CG 3.92Å; M125-Y135 WeakPolarHBondContact O-CD2 3.35Å; M125-Y135 WeakPolarHBondContact O-CE2 3.5Å; M125-Y135 HydrophobicContact SD-CE1 4.35Å; M125-Y135 HydrophobicContact SD-CE2 4.38Å; M125-A138 HydrophobicContact CG-CB 3.93Å; M125-R139 HydrophobicContact SD-CB 3.85Å; M125-R139 HydrophobicContact SD-CG 4.41Å; M125-L142 HydrophobicContact CE-CD2 3.94Å
126	V	96.9	Very high	97.1	Very high	79 Å²	79	41.7 Å²	41.7	48%	0.479	22%	0.217	S	C	.	.	H	α-helix	trans	-86	-44.8	174.9	166.7	0	0	0	0	110.6	V87 I88 N122 N123	V87-V126 HydrophobicContact CG1-CG1 4.37Å; I88-V126 HydrophobicContact CD1-CB 4.15Å; I88-V126 HydrophobicContact CD1-CG1 3.98Å; N122-V126 WeakPolarHBondContact O-CG2 3.34Å; N122-V126 PolarHBondContact O-N 3.4Å; N123-V126 PolarHBondContact O-N 3.14Å
127	Y	97.6	Very high	97.1	Very high	49 Å²	49	44.6 Å²	44.6	19%	0.192	23%	0.227	C	C	.	.	H	α-helix	trans	-73.4	-41.2	179.8	-175.7	-98	0	0	0	112.8	A81 V82 Y84 V87 N123	A81-Y127 HydrophobicContact CB-CE1 3.8Å; V82-Y127 PolarHBondContact O-OH 2.68Å; Y84-Y127 AromaticContact CD2-CD1 3.93Å; Y84-Y127 HydrophobicContact CD2-CD1 3.93Å; Y84-Y127 AromaticContact CD2-CD2 3.76Å; Y84-Y127 HydrophobicContact CD2-CD2 3.76Å; Y84-Y127 HydrophobicContact CD2-CE1 4.26Å; Y84-Y127 HydrophobicContact CD2-CE2 4.12Å; Y84-Y127 AromaticContact CD2-CG 3.68Å; Y84-Y127 HydrophobicContact CD2-CG 3.68Å; Y84-Y127 HydrophobicContact CE2-CD1 4.41Å; Y84-Y127 HydrophobicContact CE2-CG 4.12Å; V87-Y127 HydrophobicContact CB-CD2 4.05Å; V87-Y127 HydrophobicContact CG1-CD2 4.06Å; V87-Y127 HydrophobicContact CG2-CD2 4.39Å; N123-Y127 PolarHBondContact O-N 2.99Å
128	N	97.2	Very high	97.1	Very high	29 Å²	29	44.6 Å²	44.6	16%	0.155	23%	0.227	C	C	.	.	S	Bend	trans	-99.3	136.7	-173.5	-58.5	-89.2	0	0	0	112.7	A124 T132 Y134 Y135	A124-N128 VanDerWaalsContact O-CB 3.28Å; A124-N128 WeakPolarHBondContact O-CB 3.25Å; A124-N128 PolarHBondContact O-N 3.41Å; A124-N128 PolarHBondContact O-ND2 3.43Å; N128-T132 HydrophobicContact CB-CG2 4.16Å; N128-T132 WeakPolarHBondContact CB-OG1 3.4Å; N128-Y134 WeakPolarHBondContact OD1-CD2 3.48Å; N128-Y135 WeakPolarHBondContact O-CD2 3.41Å
129	P	96.1	Very high	97.1	Very high	72 Å²	72	50.2 Å²	50.2	47%	0.468	25%	0.248	S	C	.	.			trans	-55.5	152.4	170.4	-29.1	36.7	0	0	0	114.7	D131 T132 Y135	P129-D131 WeakPolarHBondContact CB-OD1 3.4Å; P129-D131 PolarHBondContact O-N 3.49Å; P129-T132 HydrophobicContact CB-CG2 4.14Å; P129-T132 HydrophobicContact CG-CG2 4.4Å; P129-T132 WeakPolarHBondContact O-CB 3.26Å; P129-T132 WeakPolarHBondContact O-CG2 3.48Å; P129-T132 PolarHBondContact O-N 2.57Å; P129-T132 PolarHBondContact O-OG1 3.32Å; P129-Y135 VanDerWaalsContact O-CB 3.3Å; P129-Y135 WeakPolarHBondContact O-CB 3.36Å
130	P	96	Very high	97.1	Very high	79 Å²	79	55.2 Å²	55.2	51%	0.513	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-17.2	-168.5	28	-36.4	0	0	0	115.8	Y135	P130-Y135 VanDerWaalsContact CA-CG 3.49Å; P130-Y135 HydrophobicContact CB-CD1 4.11Å; P130-Y135 HydrophobicContact CB-CD2 4.27Å; P130-Y135 HydrophobicContact CB-CE1 3.92Å; P130-Y135 HydrophobicContact CB-CE2 4.09Å; P130-Y135 HydrophobicContact CB-CG 4.32Å
131	D	94.1	Very high	97.1	Very high	115 Å²	115	55.4 Å²	55.4	62%	0.615	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-25.1	173.8	52.7	-67.3	0	0	0	112.9	P129 Q136	P129-D131 WeakPolarHBondContact CB-OD1 3.4Å; P129-D131 PolarHBondContact O-N 3.49Å; D131-Q136 PolarHBondContact O-NE2 3.22Å
132	T	96.2	Very high	97	Very high	30 Å²	30	56 Å²	56	18%	0.184	27%	0.272	C	S	.	.	S	Bend	trans	-61.8	153.4	-177.9	65.1	0	0	0	0	113.6	N128 P129 Y134 Y135 Q136	N128-T132 HydrophobicContact CB-CG2 4.16Å; N128-T132 WeakPolarHBondContact CB-OG1 3.4Å; P129-T132 HydrophobicContact CB-CG2 4.14Å; P129-T132 HydrophobicContact CG-CG2 4.4Å; P129-T132 WeakPolarHBondContact O-CB 3.26Å; P129-T132 WeakPolarHBondContact O-CG2 3.48Å; P129-T132 PolarHBondContact O-N 2.57Å; P129-T132 PolarHBondContact O-OG1 3.32Å; T132-Y134 PolarHBondContact O-N 3.42Å; T132-Y135 WeakPolarHBondContact OG1-CB 3.35Å; T132-Y135 PolarHBondContact OG1-N 2.78Å; T132-Y135 VanDerWaalsContact OG1-N 3.14Å; T132-Q136 WeakPolarHBondContact O-CB 3Å; T132-Q136 VanDerWaalsContact O-CG 3.28Å; T132-Q136 WeakPolarHBondContact O-CG 3.41Å; T132-Q136 PolarHBondContact O-N 2.83Å
133	I	96.4	Very high	97	Very high	66 Å²	66	58.7 Å²	58.7	34%	0.338	30%	0.295	S	S	.	.	H	α-helix	trans	-60.7	-35.3	172.4	-168.1	168.5	0	0	0	112	Q136 R137	I133-Q136 PolarHBondContact O-N 3.38Å; I133-R137 HydrophobicContact CG1-CG 3.99Å; I133-R137 VanDerWaalsContact O-CB 3.22Å; I133-R137 WeakPolarHBondContact O-CB 3.06Å; I133-R137 WeakPolarHBondContact O-CG 3.21Å; I133-R137 PolarHBondContact O-N 3.05Å
134	Y	96.9	Very high	97	Very high	114 Å²	114	59.4 Å²	59.4	45%	0.447	30%	0.298	S	S	.	.	H	α-helix	trans	-61.9	-55.3	179.9	-55.3	-76.5	0	0	0	111.7	I71 N128 T132 Q136 R137 A138	I71-Y134 HydrophobicContact CG2-CD1 3.62Å; I71-Y134 HydrophobicContact CG2-CE1 4.09Å; N128-Y134 WeakPolarHBondContact OD1-CD2 3.48Å; T132-Y134 PolarHBondContact O-N 3.42Å; Y134-Q136 PolarHBondContact O-N 2.9Å; Y134-R137 PolarHBondContact O-N 2.93Å; Y134-A138 WeakPolarHBondContact O-CB 3.49Å; Y134-A138 PolarHBondContact O-N 2.97Å
135	Y	97.8	Very high	96.9	Very high	57 Å²	57	59 Å²	59	22%	0.224	30%	0.295	C	S	.	.	H	α-helix	trans	-59	-46.5	175.6	-174.3	-73.5	0	0	0	111.3	M125 N128 P129 P130 T132 R137 A138 R139	M125-Y135 VanDerWaalsContact CA-CD2 3.46Å; M125-Y135 HydrophobicContact CB-CD2 3.63Å; M125-Y135 HydrophobicContact CB-CE2 3.58Å; M125-Y135 HydrophobicContact CB-CG 4.38Å; M125-Y135 HydrophobicContact CG-CD1 4.32Å; M125-Y135 HydrophobicContact CG-CD2 3.67Å; M125-Y135 HydrophobicContact CG-CE1 4.43Å; M125-Y135 HydrophobicContact CG-CE2 3.8Å; M125-Y135 HydrophobicContact CG-CG 3.92Å; M125-Y135 WeakPolarHBondContact O-CD2 3.35Å; M125-Y135 WeakPolarHBondContact O-CE2 3.5Å; M125-Y135 HydrophobicContact SD-CE1 4.35Å; M125-Y135 HydrophobicContact SD-CE2 4.38Å; N128-Y135 WeakPolarHBondContact O-CD2 3.41Å; P129-Y135 VanDerWaalsContact O-CB 3.3Å; P129-Y135 WeakPolarHBondContact O-CB 3.36Å; P130-Y135 VanDerWaalsContact CA-CG 3.49Å; P130-Y135 HydrophobicContact CB-CD1 4.11Å; P130-Y135 HydrophobicContact CB-CD2 4.27Å; P130-Y135 HydrophobicContact CB-CE1 3.92Å; P130-Y135 HydrophobicContact CB-CE2 4.09Å; P130-Y135 HydrophobicContact CB-CG 4.32Å; T132-Y135 WeakPolarHBondContact OG1-CB 3.35Å; T132-Y135 PolarHBondContact OG1-N 2.78Å; T132-Y135 VanDerWaalsContact OG1-N 3.14Å; Y135-R137 VanDerWaalsContact C-N 3.3Å; Y135-R137 PolarHBondContact O-N 3.24Å; Y135-A138 PolarHBondContact O-N 2.81Å; Y135-R139 WeakPolarHBondContact O-CB 3.32Å; Y135-R139 PolarHBondContact O-N 2.91Å
136	Q	97.1	Very high	96.8	Very high	73 Å²	73	60.2 Å²	60.2	34%	0.341	30%	0.298	S	S	.	.	H	α-helix	trans	-63.3	-34.5	-179.7	-72.8	-168.8	54.6	0	0	113.2	D131 T132 I133 Y134 K140	D131-Q136 PolarHBondContact O-NE2 3.22Å; T132-Q136 WeakPolarHBondContact O-CB 3Å; T132-Q136 VanDerWaalsContact O-CG 3.28Å; T132-Q136 WeakPolarHBondContact O-CG 3.41Å; T132-Q136 PolarHBondContact O-N 2.83Å; I133-Q136 PolarHBondContact O-N 3.38Å; Y134-Q136 PolarHBondContact O-N 2.9Å; Q136-K140 WeakPolarHBondContact O-CD 3.47Å; Q136-K140 VanDerWaalsContact O-CG 3.24Å; Q136-K140 WeakPolarHBondContact O-CG 3.47Å; Q136-K140 PolarHBondContact O-N 3.4Å
137	R	97.3	Very high	96.7	Very high	81 Å²	81	63.4 Å²	63.4	31%	0.306	31%	0.305	S	S	.	.	H	α-helix	trans	-72.4	-48.1	174.7	-75.8	-81.9	173.5	173.4	-1.2	110.9	I71 F72 I133 Y134 Y135 R139 K140 L141	I71-R137 HydrophobicContact CD1-CG 4.04Å; F72-R137 HydrophobicContact CE2-CB 3.86Å; F72-R137 HydrophobicContact CZ-CB 3.88Å; I133-R137 HydrophobicContact CG1-CG 3.99Å; I133-R137 VanDerWaalsContact O-CB 3.22Å; I133-R137 WeakPolarHBondContact O-CB 3.06Å; I133-R137 WeakPolarHBondContact O-CG 3.21Å; I133-R137 PolarHBondContact O-N 3.05Å; Y134-R137 PolarHBondContact O-N 2.93Å; Y135-R137 VanDerWaalsContact C-N 3.3Å; Y135-R137 PolarHBondContact O-N 3.24Å; R137-R139 PolarHBondContact O-N 2.94Å; R137-K140 PolarHBondContact O-N 2.99Å; R137-K140 VanDerWaalsContact O-N 3.11Å; R137-L141 WeakPolarHBondContact O-CB 3.46Å; R137-L141 PolarHBondContact O-N 3.09Å
138	A	98.1	Very high	96.5	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-57.3	-48.6	179	0	0	0	0	0	111.6	F72 C121 A124 M125 Y134 Y135 K140 L141 L142	F72-A138 HydrophobicContact CE1-CB 4.06Å; F72-A138 HydrophobicContact CZ-CB 3.83Å; C121-A138 HydrophobicContact CB-CB 4.34Å; A124-A138 HydrophobicContact CB-CB 3.82Å; M125-A138 HydrophobicContact CG-CB 3.93Å; Y134-A138 WeakPolarHBondContact O-CB 3.49Å; Y134-A138 PolarHBondContact O-N 2.97Å; Y135-A138 PolarHBondContact O-N 2.81Å; A138-K140 VanDerWaalsContact C-N 3.31Å; A138-K140 PolarHBondContact O-N 2.74Å; A138-L141 PolarHBondContact O-N 2.88Å; A138-L142 WeakPolarHBondContact O-CB 3.43Å; A138-L142 PolarHBondContact O-N 3.19Å
139	R	97.5	Very high	96.3	Very high	120 Å²	120	62.2 Å²	62.2	45%	0.453	30%	0.3	S	S	.	.	H	α-helix	trans	-58.8	-38.6	175.9	-171.4	179.5	65.3	-155.6	-5.8	112.9	M125 Y135 R137 A143	M125-R139 HydrophobicContact SD-CB 3.85Å; M125-R139 HydrophobicContact SD-CG 4.41Å; Y135-R139 WeakPolarHBondContact O-CB 3.32Å; Y135-R139 PolarHBondContact O-N 2.91Å; R137-R139 PolarHBondContact O-N 2.94Å; R139-A143 WeakPolarHBondContact O-CB 3.35Å; R139-A143 PolarHBondContact O-N 3.21Å
140	K	97.5	Very high	96.1	Very high	135 Å²	135	61.7 Å²	61.7	59%	0.587	30%	0.296	S	S	*	.	H	α-helix	trans	-72.1	-40.2	177.2	-76.3	172.1	-179.2	174	0	112	Q136 R137 A138 F144	Q136-K140 WeakPolarHBondContact O-CD 3.47Å; Q136-K140 VanDerWaalsContact O-CG 3.24Å; Q136-K140 WeakPolarHBondContact O-CG 3.47Å; Q136-K140 PolarHBondContact O-N 3.4Å; R137-K140 PolarHBondContact O-N 2.99Å; R137-K140 VanDerWaalsContact O-N 3.11Å; A138-K140 VanDerWaalsContact C-N 3.31Å; A138-K140 PolarHBondContact O-N 2.74Å; K140-F144 PolarHBondContact O-N 2.89Å; K140-F144 VanDerWaalsContact O-N 3.15Å
141	L	98	Very high	95.9	Very high	7 Å²	7	61 Å²	61	4%	0.037	29%	0.29	C	S	.	.	H	α-helix	trans	-68.4	-44.6	179.9	-170.8	63.3	0	0	0	111.2	L63 R66 F72 M120 R137 A138 F144 C145	L63-L141 HydrophobicContact CB-CD1 4.27Å; L63-L141 HydrophobicContact CD2-CD1 3.62Å; L63-L141 HydrophobicContact CD2-CG 4.05Å; R66-L141 HydrophobicContact CB-CD1 3.92Å; F72-L141 HydrophobicContact CD2-CD2 3.64Å; F72-L141 HydrophobicContact CE2-CD2 3.96Å; F72-L141 HydrophobicContact CG-CD2 4.35Å; M120-L141 HydrophobicContact CE-CD2 3.76Å; R137-L141 WeakPolarHBondContact O-CB 3.46Å; R137-L141 PolarHBondContact O-N 3.09Å; A138-L141 PolarHBondContact O-N 2.88Å; L141-F144 PolarHBondContact O-N 2.98Å; L141-C145 PolarHBondContact O-N 3.44Å
142	L	97.3	Very high	95.7	Very high	13 Å²	13	58.6 Å²	58.6	7%	0.068	28%	0.283	C	S	.	.	H	α-helix	trans	-60.6	-46.1	175.7	-178.1	54.2	0	0	0	112.5	T118 C121 M125 A138 F144 C145 R146	T118-L142 HydrophobicContact CG2-CD1 3.92Å; T118-L142 HydrophobicContact CG2-CD2 4.22Å; T118-L142 WeakPolarHBondContact OG1-CD1 3.42Å; C121-L142 HydrophobicContact CB-CB 3.86Å; C121-L142 HydrophobicContact CB-CD1 4.41Å; C121-L142 HydrophobicContact CB-CD2 4.08Å; C121-L142 HydrophobicContact CB-CG 4.34Å; M125-L142 HydrophobicContact CE-CD2 3.94Å; A138-L142 WeakPolarHBondContact O-CB 3.43Å; A138-L142 PolarHBondContact O-N 3.19Å; L142-F144 VanDerWaalsContact C-N 3.25Å; L142-F144 PolarHBondContact O-N 2.79Å; L142-C145 PolarHBondContact O-N 3.19Å; L142-R146 HydrophobicContact CD1-CG 4.27Å; L142-R146 WeakPolarHBondContact O-CG 3.44Å; L142-R146 PolarHBondContact O-N 2.85Å
143	A	96.7	Very high	95.5	Very high	62 Å²	62	58.5 Å²	58.5	51%	0.512	28%	0.283	S	S	.	.	H	α-helix	trans	-62.9	-32.1	176.7	0	0	0	0	0	112.6	R139 K147	R139-A143 WeakPolarHBondContact O-CB 3.35Å; R139-A143 PolarHBondContact O-N 3.21Å; A143-K147 PolarHBondContact O-N 3.09Å
144	F	96.9	Very high	95.3	Very high	30 Å²	30	55.3 Å²	55.3	13%	0.132	27%	0.267	C	S	.	.	H	α-helix	trans	-72.6	-44.9	171.1	173.3	-100.7	0	0	0	112.3	N62 L63 R66 K140 L141 L142 R146 K147 Q148	N62-F144 HydrophobicContact CB-CE1 4.03Å; N62-F144 HydrophobicContact CB-CZ 4.05Å; N62-F144 WeakPolarHBondContact O-CE1 2.98Å; L63-F144 HydrophobicContact CD2-CD1 3.86Å; L63-F144 HydrophobicContact CD2-CE1 4.25Å; R66-F144 VanDerWaalsContact CD-CD1 3.48Å; K140-F144 PolarHBondContact O-N 2.89Å; K140-F144 VanDerWaalsContact O-N 3.15Å; L141-F144 PolarHBondContact O-N 2.98Å; L142-F144 VanDerWaalsContact C-N 3.25Å; L142-F144 PolarHBondContact O-N 2.79Å; F144-R146 PolarHBondContact O-N 3.35Å; F144-K147 WeakPolarHBondContact O-CB 3.43Å; F144-K147 PolarHBondContact O-N 3.21Å; F144-K147 VanDerWaalsContact O-N 3.13Å; F144-Q148 HydrophobicContact CD1-CG 4.32Å; F144-Q148 HydrophobicContact CD2-CG 4.41Å; F144-Q148 HydrophobicContact CE1-CG 3.65Å; F144-Q148 HydrophobicContact CE2-CG 3.74Å; F144-Q148 HydrophobicContact CZ-CG 3.31Å; F144-Q148 PolarHBondContact O-N 3.49Å; F144-Q148 VanDerWaalsContact O-N 3.09Å
145	C	96.7	Very high	94.8	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-55.2	-51.9	177.9	-173.5	0	0	0	0	111.3	L63 V117 L141 L142 K147 Q148 M149	L63-C145 HydrophobicContact CD2-CB 3.81Å; V117-C145 HydrophobicContact CG1-CB 3.97Å; L141-C145 PolarHBondContact O-N 3.44Å; L142-C145 PolarHBondContact O-N 3.19Å; C145-K147 PolarHBondContact O-N 3.13Å; C145-Q148 CarbonylContact O-C 3.57Å; C145-Q148 WeakPolarHBondContact O-CA 3.44Å; C145-Q148 WeakPolarHBondContact O-CB 3.16Å; C145-Q148 PolarHBondContact O-N 3.44Å; C145-M149 WeakPolarHBondContact O-CB 3.38Å; C145-M149 PolarHBondContact O-N 3Å
146	R	94.8	Very high	94.3	Very high	54 Å²	54	58.2 Å²	58.2	20%	0.204	28%	0.284	C	S	.	.	H	α-helix	trans	-57.5	-34.2	178	-70.9	166	176	-147.5	8.5	113	L114 L142 F144 M149 T150 E177	L114-R146 HydrophobicContact CD1-CG 4.33Å; L142-R146 HydrophobicContact CD1-CG 4.27Å; L142-R146 WeakPolarHBondContact O-CG 3.44Å; L142-R146 PolarHBondContact O-N 2.85Å; F144-R146 PolarHBondContact O-N 3.35Å; R146-M149 PolarHBondContact O-N 2.96Å; R146-T150 WeakPolarHBondContact O-CG2 3.41Å; R146-T150 PolarHBondContact O-N 2.97Å; R146-E177 WeakPolarHBondContact CD-OE1 3.35Å; R146-E177 IonicContact CZ-OE1 3.89Å; R146-E177 IonicContact NE-OE1 3.34Å; R146-E177 PolarHBondContact NE-OE1 3.14Å; R146-E177 IonicContact NH1-OE1 3.22Å; R146-E177 PolarHBondContact NH1-OE1 3.26Å
147	K	94.8	Very high	93.8	Very high	146 Å²	146	56 Å²	56	64%	0.635	28%	0.278	S	S	*	.	H	α-helix	trans	-69	-36.5	174.1	-173	-177.3	177.2	-175.1	0	112.8	A143 F144 C145 S153	A143-K147 PolarHBondContact O-N 3.09Å; F144-K147 WeakPolarHBondContact O-CB 3.43Å; F144-K147 PolarHBondContact O-N 3.21Å; F144-K147 VanDerWaalsContact O-N 3.13Å; C145-K147 PolarHBondContact O-N 3.13Å; K147-S153 WeakPolarHBondContact O-CB 3.42Å; K147-S153 PolarHBondContact O-OG 3.03Å
148	Q	94	Very high	93.3	Very high	48 Å²	48	52.8 Å²	52.8	22%	0.224	27%	0.268	C	S	.	.	H	α-helix	trans	-73.5	-32.4	173.1	-63.6	-60.7	104.9	0	0	112	I59 F144 C145 T150 S153	I59-Q148 HydrophobicContact CD1-CB 4.41Å; I59-Q148 HydrophobicContact CG1-CB 4.33Å; I59-Q148 HydrophobicContact CG2-CB 4.24Å; F144-Q148 HydrophobicContact CD1-CG 4.32Å; F144-Q148 HydrophobicContact CD2-CG 4.41Å; F144-Q148 HydrophobicContact CE1-CG 3.65Å; F144-Q148 HydrophobicContact CE2-CG 3.74Å; F144-Q148 HydrophobicContact CZ-CG 3.31Å; F144-Q148 PolarHBondContact O-N 3.49Å; F144-Q148 VanDerWaalsContact O-N 3.09Å; C145-Q148 CarbonylContact O-C 3.57Å; C145-Q148 WeakPolarHBondContact O-CA 3.44Å; C145-Q148 WeakPolarHBondContact O-CB 3.16Å; C145-Q148 PolarHBondContact O-N 3.44Å; Q148-T150 VanDerWaalsContact C-N 3.35Å; Q148-T150 PolarHBondContact O-N 3.31Å; Q148-S153 WeakPolarHBondContact O-CB 3.47Å
149	M	92.8	Very high	92.3	Very high	4 Å²	4	60.4 Å²	60.4	2%	0.02	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	22.2	-176.5	-141.5	73.2	72.8	0	0	114.5	L56 I59 A110 Y113 L114 C145 R146 L154 L173	L56-M149 HydrophobicContact CD2-CE 4.3Å; L56-M149 HydrophobicContact CD2-SD 4.21Å; I59-M149 HydrophobicContact CD1-CE 4.22Å; I59-M149 HydrophobicContact CD1-SD 3.76Å; I59-M149 HydrophobicContact CG2-CE 3.9Å; A110-M149 HydrophobicContact CB-SD 4.06Å; Y113-M149 HydrophobicContact CD1-CE 3.46Å; Y113-M149 VanDerWaalsContact CD1-CE 3.46Å; Y113-M149 HydrophobicContact CE1-CE 3.77Å; L114-M149 HydrophobicContact CB-CG 4.22Å; L114-M149 HydrophobicContact CD1-CB 4.11Å; L114-M149 HydrophobicContact CD1-CG 4.32Å; L114-M149 HydrophobicContact CD2-CB 4.29Å; L114-M149 HydrophobicContact CD2-CG 4.17Å; L114-M149 HydrophobicContact CG-CG 4.47Å; C145-M149 WeakPolarHBondContact O-CB 3.38Å; C145-M149 PolarHBondContact O-N 3Å; R146-M149 PolarHBondContact O-N 2.96Å; M149-L154 HydrophobicContact CG-CD1 4.45Å; M149-L154 HydrophobicContact SD-CD1 4.44Å; M149-L154 HydrophobicContact SD-CD2 3.88Å; M149-L154 HydrophobicContact SD-CG 4.49Å; M149-L173 HydrophobicContact CB-CD2 4.44Å; M149-L173 HydrophobicContact CG-CD2 3.58Å; M149-L173 WeakPolarHBondContact O-CD1 3.45Å
150	T	92.2	Very high	91.5	Very high	62 Å²	62	59.9 Å²	59.9	38%	0.38	31%	0.308	S	S	.	.	S	Bend	trans	-78.2	149.6	166.8	78	0	0	0	0	109.9	R146 Q148 S152 S153 L154	R146-T150 WeakPolarHBondContact O-CG2 3.41Å; R146-T150 PolarHBondContact O-N 2.97Å; Q148-T150 VanDerWaalsContact C-N 3.35Å; Q148-T150 PolarHBondContact O-N 3.31Å; T150-S152 PolarHBondContact O-N 3.24Å; T150-S153 WeakPolarHBondContact O-CA 3.38Å; T150-S153 WeakPolarHBondContact O-CB 3.45Å; T150-S153 PolarHBondContact O-N 2.98Å; T150-S153 WeakPolarHBondContact OG1-CB 3.47Å; T150-S153 PolarHBondContact OG1-N 2.8Å; T150-S153 VanDerWaalsContact OG1-N 3.14Å; T150-S153 PolarHBondContact OG1-OG 3.18Å; T150-L154 PolarHBondContact O-N 2.95Å
151	V	90.2	Very high	90.8	Very high	63 Å²	63	54.9 Å²	54.9	38%	0.382	29%	0.287	S	S	.	.	H	α-helix	trans	-49.2	-45.6	174.8	-178.6	0	0	0	0	111.2	S153 L154 Q155 I170 L173	V151-S153 VanDerWaalsContact C-N 3.27Å; V151-S153 PolarHBondContact O-N 2.76Å; V151-L154 PolarHBondContact O-N 3.13Å; V151-Q155 HydrophobicContact CG1-CG 4.45Å; V151-Q155 WeakPolarHBondContact O-CB 3.48Å; V151-Q155 VanDerWaalsContact O-CG 3.26Å; V151-Q155 WeakPolarHBondContact O-CG 3.41Å; V151-Q155 PolarHBondContact O-N 3.37Å; V151-I170 HydrophobicContact CG2-CG2 4.09Å; V151-L173 HydrophobicContact CG2-CD1 3.89Å
152	S	90.6	Very high	89.9	Confident	66 Å²	66	60 Å²	60	46%	0.462	32%	0.32	S	S	.	.	H	α-helix	trans	-73	-9.9	178.2	-51.7	0	0	0	0	115.1	T150 K156	T150-S152 PolarHBondContact O-N 3.24Å; S152-K156 WeakPolarHBondContact O-CD 3.22Å; S152-K156 WeakPolarHBondContact O-CE 3.37Å; S152-K156 WeakPolarHBondContact O-CG 3.23Å; S152-K156 PolarHBondContact O-NZ 2.94Å; S152-K156 VanDerWaalsContact O-NZ 3.09Å
153	S	91.9	Very high	89	Confident	27 Å²	27	63.5 Å²	63.5	19%	0.189	36%	0.36	C	S	.	.	H	α-helix	trans	-93.6	-44.5	171.6	-68.4	0	0	0	0	110.4	K147 Q148 T150 V151 Q155 K156 A157	K147-S153 WeakPolarHBondContact O-CB 3.42Å; K147-S153 PolarHBondContact O-OG 3.03Å; Q148-S153 WeakPolarHBondContact O-CB 3.47Å; T150-S153 WeakPolarHBondContact O-CA 3.38Å; T150-S153 WeakPolarHBondContact O-CB 3.45Å; T150-S153 PolarHBondContact O-N 2.98Å; T150-S153 WeakPolarHBondContact OG1-CB 3.47Å; T150-S153 PolarHBondContact OG1-N 2.8Å; T150-S153 VanDerWaalsContact OG1-N 3.14Å; T150-S153 PolarHBondContact OG1-OG 3.18Å; V151-S153 VanDerWaalsContact C-N 3.27Å; V151-S153 PolarHBondContact O-N 2.76Å; S153-Q155 PolarHBondContact O-N 3.28Å; S153-K156 WeakPolarHBondContact O-CA 3.49Å; S153-K156 WeakPolarHBondContact O-CB 3.25Å; S153-K156 PolarHBondContact O-N 3.1Å; S153-A157 PolarHBondContact O-N 2.79Å; S153-A157 VanDerWaalsContact O-N 3.08Å
154	L	92.1	Very high	88.6	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-56.2	-51.1	172.5	-70.8	168.6	0	0	0	111.1	V55 I59 A110 M149 T150 V151 K156 A157 C158 L165 I170 L173	V55-L154 HydrophobicContact CG1-CD2 3.62Å; I59-L154 HydrophobicContact CD1-CD2 3.72Å; A110-L154 HydrophobicContact CB-CD1 4.03Å; A110-L154 HydrophobicContact CB-CD2 4.5Å; M149-L154 HydrophobicContact CG-CD1 4.45Å; M149-L154 HydrophobicContact SD-CD1 4.44Å; M149-L154 HydrophobicContact SD-CD2 3.88Å; M149-L154 HydrophobicContact SD-CG 4.49Å; T150-L154 PolarHBondContact O-N 2.95Å; V151-L154 PolarHBondContact O-N 3.13Å; L154-K156 PolarHBondContact O-N 2.75Å; L154-K156 VanDerWaalsContact O-N 3.07Å; L154-A157 PolarHBondContact O-N 3.01Å; L154-C158 PolarHBondContact O-N 2.96Å; L154-C158 PolarHBondContact O-SG 3.12Å; L154-L165 HydrophobicContact CB-CD1 4.4Å; L154-L165 HydrophobicContact CD2-CD1 4.43Å; L154-I170 HydrophobicContact CD1-CG1 4.47Å; L154-I170 HydrophobicContact CD1-CG2 4.16Å; L154-L173 HydrophobicContact CD1-CD1 3.85Å
155	Q	86.6	Confident	88.3	Confident	110 Å²	110	61 Å²	61	51%	0.514	34%	0.343	S	S	.	.	H	α-helix	trans	-59.3	-20.2	174.4	-71.9	173.4	-11.6	0	0	114	V151 S153	V151-Q155 HydrophobicContact CG1-CG 4.45Å; V151-Q155 WeakPolarHBondContact O-CB 3.48Å; V151-Q155 VanDerWaalsContact O-CG 3.26Å; V151-Q155 WeakPolarHBondContact O-CG 3.41Å; V151-Q155 PolarHBondContact O-N 3.37Å; S153-Q155 PolarHBondContact O-N 3.28Å
156	K	87.9	Confident	88	Confident	121 Å²	121	64.3 Å²	64.3	53%	0.526	36%	0.363	S	S	.	.	H	α-helix	trans	-83.7	-36.4	173.9	-72.6	167.3	-166.5	147.2	0	112.4	S152 S153 L154 C158 K159	S152-K156 WeakPolarHBondContact O-CD 3.22Å; S152-K156 WeakPolarHBondContact O-CE 3.37Å; S152-K156 WeakPolarHBondContact O-CG 3.23Å; S152-K156 PolarHBondContact O-NZ 2.94Å; S152-K156 VanDerWaalsContact O-NZ 3.09Å; S153-K156 WeakPolarHBondContact O-CA 3.49Å; S153-K156 WeakPolarHBondContact O-CB 3.25Å; S153-K156 PolarHBondContact O-N 3.1Å; L154-K156 PolarHBondContact O-N 2.75Å; L154-K156 VanDerWaalsContact O-N 3.07Å; K156-C158 VanDerWaalsContact C-N 3.29Å; K156-K159 WeakPolarHBondContact O-CB 3.37Å; K156-K159 WeakPolarHBondContact O-CD 3.41Å; K156-K159 VanDerWaalsContact O-CG 3.3Å; K156-K159 WeakPolarHBondContact O-CG 3.37Å; K156-K159 PolarHBondContact O-N 2.95Å
157	A	86.5	Confident	87.7	Confident	26 Å²	26	68 Å²	68	22%	0.215	39%	0.391	C	S	.	.	H	α-helix	trans	-64.2	-36.9	170.9	0	0	0	0	0	111.1	V55 S153 L154 K159	V55-A157 HydrophobicContact CG1-CB 3.92Å; V55-A157 HydrophobicContact CG2-CB 4.29Å; S153-A157 PolarHBondContact O-N 2.79Å; S153-A157 VanDerWaalsContact O-N 3.08Å; L154-A157 PolarHBondContact O-N 3.01Å; A157-K159 PolarHBondContact O-N 3.26Å
158	C	85.6	Confident	87.6	Confident	14 Å²	14	69 Å²	69	10%	0.095	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-62.4	-10.3	177.5	-64	0	0	0	0	116	L154 K156 D160 I161 L165	L154-C158 PolarHBondContact O-N 2.96Å; L154-C158 PolarHBondContact O-SG 3.12Å; K156-C158 VanDerWaalsContact C-N 3.29Å; C158-D160 PolarHBondContact O-N 2.99Å; C158-D160 VanDerWaalsContact O-N 3.13Å; C158-I161 PolarHBondContact O-N 3.05Å; C158-L165 VanDerWaalsContact SG-CG 3.5Å
159	K	78.9	Confident	87.5	Confident	160 Å²	160	68.1 Å²	68.1	70%	0.696	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-61.1	-27.1	-168	-77.9	176.1	175.8	179.8	0	115.3	K156 A157	K156-K159 WeakPolarHBondContact O-CB 3.37Å; K156-K159 WeakPolarHBondContact O-CD 3.41Å; K156-K159 VanDerWaalsContact O-CG 3.3Å; K156-K159 WeakPolarHBondContact O-CG 3.37Å; K156-K159 PolarHBondContact O-N 2.95Å; A157-K159 PolarHBondContact O-N 3.26Å
160	D	79.4	Confident	87.5	Confident	109 Å²	109	68.7 Å²	68.7	58%	0.583	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-96.9	-3.2	178.1	-90.9	18.5	0	0	0	112.8	C158 R334	C158-D160 PolarHBondContact O-N 2.99Å; C158-D160 VanDerWaalsContact O-N 3.13Å; D160-R334 IonicContact OD1-CZ 2.83Å; D160-R334 IonicContact OD1-NH1 2.71Å; D160-R334 PolarHBondContact OD1-NH1 3.42Å; D160-R334 IonicContact OD1-NH2 3.83Å; D160-R334 IonicContact OD2-CZ 3.86Å; D160-R334 IonicContact OD2-NH1 2.8Å; D160-R334 PolarHBondContact OD2-NH1 2.86Å; D160-R334 IonicContact OD2-NH2 2.83Å; D160-R334 PolarHBondContact OD2-NH2 2.62Å
161	I	82	Confident	87.4	Confident	30 Å²	30	67 Å²	67	15%	0.154	39%	0.392	C	S	.	.	S	Bend	trans	-102.6	119.5	-170.7	-54.3	-178.2	0	0	0	110.1	N51 T54 V55 C158 G163 G164	N51-I161 HydrophobicContact CB-CG2 3.98Å; N51-I161 WeakPolarHBondContact OD1-CG2 3.37Å; T54-I161 HydrophobicContact CG2-CD1 3.84Å; V55-I161 HydrophobicContact CG2-CD1 3.54Å; C158-I161 PolarHBondContact O-N 3.05Å; I161-G163 PolarHBondContact O-N 3.33Å; I161-G164 PolarHBondContact O-N 3.04Å
162	P	79.8	Confident	87.3	Confident	114 Å²	114	68.3 Å²	68.3	74%	0.74	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	130.3	174.5	-24.4	34.8	0	0	0	112.2	N51 G164	N51-P162 PolarHBondContact ND2-O 3.38Å; P162-G164 VanDerWaalsContact C-N 3.28Å; P162-G164 PolarHBondContact O-N 3.07Å
163	G	79.5	Confident	87	Confident	87 Å²	87	66.1 Å²	66.1	90%	0.897	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	-20.9	-178.6	0	0	0	0	0	115.4	I161	I161-G163 PolarHBondContact O-N 3.33Å
164	G	87.8	Confident	86.4	Confident	16 Å²	16	69.5 Å²	69.5	17%	0.165	40%	0.4	C	S	.	.			trans	68.4	-149.5	-176.4	0	0	0	0	0	113.2	N51 I161 P162	N51-G164 WeakPolarHBondContact CB-O 3.28Å; N51-G164 PolarHBondContact ND2-O 2.51Å; I161-G164 PolarHBondContact O-N 3.04Å; P162-G164 VanDerWaalsContact C-N 3.28Å; P162-G164 PolarHBondContact O-N 3.07Å
165	L	89.9	Confident	85.7	Confident	24 Å²	24	71.6 Å²	71.6	13%	0.126	41%	0.414	C	S	.	.			trans	-111.2	144.8	168.2	-68.7	171.2	0	0	0	110.2	N51 L52 V55 L154 C158 E169 I170	N51-L165 HydrophobicContact CB-CD2 3.99Å; L52-L165 HydrophobicContact CB-CD2 3.96Å; L52-L165 HydrophobicContact CD1-CD2 4.26Å; V55-L165 HydrophobicContact CB-CD1 4.31Å; V55-L165 HydrophobicContact CG1-CD1 4.27Å; V55-L165 HydrophobicContact CG2-CD1 4.14Å; V55-L165 HydrophobicContact CG2-CG 4.44Å; L154-L165 HydrophobicContact CB-CD1 4.4Å; L154-L165 HydrophobicContact CD2-CD1 4.43Å; C158-L165 VanDerWaalsContact SG-CG 3.5Å; L165-E169 WeakPolarHBondContact CA-OE2 3.32Å; L165-E169 HydrophobicContact CB-CB 4.31Å; L165-E169 HydrophobicContact CD2-CB 4.14Å; L165-E169 WeakPolarHBondContact CD2-OE2 3.46Å; L165-I170 HydrophobicContact CB-CD1 4.2Å; L165-I170 HydrophobicContact CB-CG1 3.92Å; L165-I170 HydrophobicContact CD1-CG1 4.29Å
166	T	91	Very high	85	Confident	69 Å²	69	67.1 Å²	67.1	42%	0.423	39%	0.394	S	S	.	.			trans	-73.5	166.8	172.1	78.6	0	0	0	0	111.3	E168 E169 I170	T166-E168 PolarHBondContact O-N 2.65Å; T166-E168 PolarHBondContact OG1-N 2.93Å; T166-E169 HydrophobicContact CG2-CG 4.45Å; T166-E169 PolarHBondContact N-OE2 3.14Å; T166-E169 PolarHBondContact O-N 3.43Å; T166-E169 WeakPolarHBondContact OG1-CG 3.43Å; T166-E169 PolarHBondContact OG1-N 3.36Å; T166-I170 WeakPolarHBondContact O-CG1 3.37Å; T166-I170 PolarHBondContact O-N 3.33Å; T166-I170 VanDerWaalsContact O-N 3.12Å
167	V	89.3	Confident	84	Confident	131 Å²	131	64.9 Å²	64.9	79%	0.794	39%	0.386	S	S	*	.	H	α-helix	trans	-64.7	-33.7	174.7	-177.7	0	0	0	0	111.1	I170 G171	V167-I170 PolarHBondContact O-N 3.3Å; V167-G171 PolarHBondContact O-N 3.02Å
168	E	91.6	Very high	83.2	Confident	168 Å²	168	66.2 Å²	66.2	79%	0.785	40%	0.397	S	S	*	.	H	α-helix	trans	-69.5	-42.7	177.3	-62.3	169.7	-178.9	0	0	111.6	S109 T166 I170 G171	S109-E168 WeakPolarHBondContact CB-O 3.32Å; T166-E168 PolarHBondContact O-N 2.65Å; T166-E168 PolarHBondContact OG1-N 2.93Å; E168-I170 VanDerWaalsContact C-N 3.26Å; E168-I170 PolarHBondContact O-N 2.94Å; E168-G171 PolarHBondContact O-N 3.11Å
169	E	93	Very high	82.3	Confident	29 Å²	29	70.8 Å²	70.8	14%	0.136	42%	0.417	C	S	.	.	H	α-helix	trans	-66.2	-27	175.3	-70.9	171	158.7	0	0	112.8	S49 L52 S109 A110 L165 T166	S49-E169 WeakPolarHBondContact CB-OE1 3.36Å; S49-E169 PolarHBondContact OG-OE1 3.37Å; L52-E169 HydrophobicContact CB-CG 4.49Å; L52-E169 HydrophobicContact CD1-CB 4.49Å; S109-E169 CarbonylContact C-O 3.49Å; S109-E169 VanDerWaalsContact CA-O 3.3Å; S109-E169 WeakPolarHBondContact CA-O 3.46Å; A110-E169 PolarHBondContact N-O 3.34Å; L165-E169 WeakPolarHBondContact CA-OE2 3.32Å; L165-E169 HydrophobicContact CB-CB 4.31Å; L165-E169 HydrophobicContact CD2-CB 4.14Å; L165-E169 WeakPolarHBondContact CD2-OE2 3.46Å; T166-E169 HydrophobicContact CG2-CG 4.45Å; T166-E169 PolarHBondContact N-OE2 3.14Å; T166-E169 PolarHBondContact O-N 3.43Å; T166-E169 WeakPolarHBondContact OG1-CG 3.43Å; T166-E169 PolarHBondContact OG1-N 3.36Å
170	I	92.4	Very high	81.5	Confident	16 Å²	16	63.9 Å²	63.9	8%	0.082	39%	0.387	C	S	.	.	H	α-helix	trans	-79.1	-46.2	173.4	-68.1	169.5	0	0	0	110.5	V151 L154 L165 T166 V167 E168 L173	V151-I170 HydrophobicContact CG2-CG2 4.09Å; L154-I170 HydrophobicContact CD1-CG1 4.47Å; L154-I170 HydrophobicContact CD1-CG2 4.16Å; L165-I170 HydrophobicContact CB-CD1 4.2Å; L165-I170 HydrophobicContact CB-CG1 3.92Å; L165-I170 HydrophobicContact CD1-CG1 4.29Å; T166-I170 WeakPolarHBondContact O-CG1 3.37Å; T166-I170 PolarHBondContact O-N 3.33Å; T166-I170 VanDerWaalsContact O-N 3.12Å; V167-I170 PolarHBondContact O-N 3.3Å; E168-I170 VanDerWaalsContact C-N 3.26Å; E168-I170 PolarHBondContact O-N 2.94Å; I170-L173 HydrophobicContact CG2-CD1 3.67Å
171	G	89.6	Confident	80.6	Confident	26 Å²	26	62.4 Å²	62.4	27%	0.268	38%	0.38	S	S	.	.			trans	67.5	178.1	-179.9	0	0	0	0	0	115	V167 E168 L173	V167-G171 PolarHBondContact O-N 3.02Å; E168-G171 PolarHBondContact O-N 3.11Å; G171-L173 PolarHBondContact O-N 3.26Å; G171-L173 VanDerWaalsContact O-N 3.11Å
172	D	89.1	Confident	79.5	Confident	92 Å²	92	67.2 Å²	67.2	49%	0.492	40%	0.401	S	S	.	.			trans	-79.5	90.6	172.2	-177.4	12.5	0	0	0	112	T111 T174	T111-D172 WeakPolarHBondContact CG2-O 3.46Å; D172-T174 PolarHBondContact O-N 3.31Å; D172-T174 VanDerWaalsContact O-N 3.15Å; D172-T174 WeakPolarHBondContact OD1-CA 3.38Å; D172-T174 WeakPolarHBondContact OD1-CB 3.4Å; D172-T174 PolarHBondContact OD1-N 3.15Å; D172-T174 PolarHBondContact OD1-OG1 3.28Å; D172-T174 PolarHBondContact OD2-OG1 3.19Å
173	L	83.9	Confident	78.4	Confident	20 Å²	20	67.1 Å²	67.1	11%	0.105	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-8.8	176	-66.4	155.6	0	0	0	113.8	A110 T111 L114 M149 V151 L154 I170 G171	A110-L173 HydrophobicContact CB-CD2 4.46Å; T111-L173 HydrophobicContact CG2-CD2 3.98Å; T111-L173 HydrophobicContact CG2-CG 4.04Å; L114-L173 HydrophobicContact CD2-CD2 3.88Å; M149-L173 HydrophobicContact CB-CD2 4.44Å; M149-L173 HydrophobicContact CG-CD2 3.58Å; M149-L173 WeakPolarHBondContact O-CD1 3.45Å; V151-L173 HydrophobicContact CG2-CD1 3.89Å; L154-L173 HydrophobicContact CD1-CD1 3.85Å; I170-L173 HydrophobicContact CG2-CD1 3.67Å; G171-L173 PolarHBondContact O-N 3.26Å; G171-L173 VanDerWaalsContact O-N 3.11Å
174	T	78.7	Confident	77.2	Confident	98 Å²	98	66.5 Å²	66.5	60%	0.601	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-34.2	-178.6	73.7	0	0	0	0	113.4	D172 V176 E177 A178	D172-T174 PolarHBondContact O-N 3.31Å; D172-T174 VanDerWaalsContact O-N 3.15Å; D172-T174 WeakPolarHBondContact OD1-CA 3.38Å; D172-T174 WeakPolarHBondContact OD1-CB 3.4Å; D172-T174 PolarHBondContact OD1-N 3.15Å; D172-T174 PolarHBondContact OD1-OG1 3.28Å; D172-T174 PolarHBondContact OD2-OG1 3.19Å; T174-V176 VanDerWaalsContact C-N 3.32Å; T174-V176 PolarHBondContact O-N 2.74Å; T174-E177 PolarHBondContact O-N 2.87Å; T174-A178 PolarHBondContact O-N 3.43Å
175	S	76.9	Confident	75.3	Confident	43 Å²	43	75.9 Å²	75.9	30%	0.301	40%	0.399	S	S	.	.	H	α-helix	trans	-61.1	-40	177.4	-157.8	0	0	0	0	112.3	E177 A178 E179	S175-E177 VanDerWaalsContact C-N 3.26Å; S175-E177 PolarHBondContact O-N 2.88Å; S175-A178 WeakPolarHBondContact O-CA 3.36Å; S175-A178 PolarHBondContact O-N 3.22Å; S175-E179 PolarHBondContact O-N 2.85Å; S175-E179 PolarHBondContact OG-OE1 2.78Å
176	V	73.2	Confident	73.3	Confident	16 Å²	16	80.1 Å²	80.1	10%	0.097	43%	0.426	C	S	.	.	H	α-helix	trans	-56.5	-39	178.5	-174.5	0	0	0	0	111.8	L114 A115 T174 M180	L114-V176 HydrophobicContact CG-CG1 4.31Å; A115-V176 HydrophobicContact CB-CG1 4.08Å; T174-V176 VanDerWaalsContact C-N 3.32Å; T174-V176 PolarHBondContact O-N 2.74Å; V176-M180 HydrophobicContact CG1-CG 4.48Å; V176-M180 HydrophobicContact CG1-SD 3.74Å; V176-M180 WeakPolarHBondContact O-CB 3.18Å; V176-M180 VanDerWaalsContact O-CG 3.25Å; V176-M180 WeakPolarHBondContact O-CG 3.17Å; V176-M180 PolarHBondContact O-N 3.32Å
177	E	66	Low	71	Confident	74 Å²	74	85.5 Å²	85.5	35%	0.346	44%	0.443	S	S	.	.	H	α-helix	trans	-70.3	-41	174.3	-63.5	-154.9	134.7	0	0	112	R146 T174 S175 N181	R146-E177 WeakPolarHBondContact CD-OE1 3.35Å; R146-E177 IonicContact CZ-OE1 3.89Å; R146-E177 IonicContact NE-OE1 3.34Å; R146-E177 PolarHBondContact NE-OE1 3.14Å; R146-E177 IonicContact NH1-OE1 3.22Å; R146-E177 PolarHBondContact NH1-OE1 3.26Å; T174-E177 PolarHBondContact O-N 2.87Å; S175-E177 VanDerWaalsContact C-N 3.26Å; S175-E177 PolarHBondContact O-N 2.88Å; E177-N181 WeakPolarHBondContact O-CB 3.28Å; E177-N181 PolarHBondContact O-N 2.95Å; E177-N181 PolarHBondContact O-ND2 3.47Å
178	A	70.3	Confident	69	Low	55 Å²	55	83.6 Å²	83.6	46%	0.455	43%	0.433	S	S	.	.	H	α-helix	trans	-66.6	-38.7	-178.5	0	0	0	0	0	113.1	T174 S175 Q182	T174-A178 PolarHBondContact O-N 3.43Å; S175-A178 WeakPolarHBondContact O-CA 3.36Å; S175-A178 PolarHBondContact O-N 3.22Å; A178-Q182 WeakPolarHBondContact O-CG 3.24Å; A178-Q182 PolarHBondContact O-NE2 2.88Å
179	E	66.4	Low	66.9	Low	109 Å²	109	85.2 Å²	85.2	51%	0.509	44%	0.438	S	S	.	.	H	α-helix	trans	-71.6	-50.9	176.6	-70.4	168.5	-137.8	0	0	111.3	S175 N181 Q182	S175-E179 PolarHBondContact O-N 2.85Å; S175-E179 PolarHBondContact OG-OE1 2.78Å; E179-N181 VanDerWaalsContact C-N 3.34Å; E179-N181 PolarHBondContact O-N 3.23Å; E179-Q182 WeakPolarHBondContact O-CB 3.41Å; E179-Q182 PolarHBondContact O-N 2.79Å
180	M	62.8	Low	64.6	Low	15 Å²	15	91.5 Å²	91.5	7%	0.074	47%	0.467	C	S	.	.	H	α-helix	trans	-75.8	-22.7	-172.8	-58.8	-174.6	89.9	0	0	113.1	T118 L119 V176 Q182 M183	T118-M180 VanDerWaalsContact CB-SD 3.55Å; T118-M180 HydrophobicContact CG2-CB 4.14Å; T118-M180 HydrophobicContact CG2-CE 3.8Å; T118-M180 HydrophobicContact CG2-CG 4.43Å; T118-M180 HydrophobicContact CG2-SD 3.43Å; T118-M180 WeakPolarHBondContact CG2-SD 3.3Å; L119-M180 HydrophobicContact CB-CE 4.05Å; V176-M180 HydrophobicContact CG1-CG 4.48Å; V176-M180 HydrophobicContact CG1-SD 3.74Å; V176-M180 WeakPolarHBondContact O-CB 3.18Å; V176-M180 VanDerWaalsContact O-CG 3.25Å; V176-M180 WeakPolarHBondContact O-CG 3.17Å; V176-M180 PolarHBondContact O-N 3.32Å; M180-Q182 PolarHBondContact O-N 2.97Å; M180-M183 PolarHBondContact O-N 3.35Å
181	N	60.2	Low	62.2	Low	79 Å²	79	98.4 Å²	98.4	42%	0.422	49%	0.492	S	S	.	.	H	α-helix	trans	-68.4	-16.1	168.4	-73.5	-27.5	0	0	0	113.3	E177 E179	E177-N181 WeakPolarHBondContact O-CB 3.28Å; E177-N181 PolarHBondContact O-N 2.95Å; E177-N181 PolarHBondContact O-ND2 3.47Å; E179-N181 VanDerWaalsContact C-N 3.34Å; E179-N181 PolarHBondContact O-N 3.23Å
182	Q	59.3	Low	59.8	Low	131 Å²	131	102.1 Å²	102.1	61%	0.612	51%	0.514	S	S	*	.	H	α-helix	trans	-79.5	-37	174	-67.3	171.6	74.3	0	0	112	A178 E179 M180 N184 R185	A178-Q182 WeakPolarHBondContact O-CG 3.24Å; A178-Q182 PolarHBondContact O-NE2 2.88Å; E179-Q182 WeakPolarHBondContact O-CB 3.41Å; E179-Q182 PolarHBondContact O-N 2.79Å; M180-Q182 PolarHBondContact O-N 2.97Å; Q182-N184 VanDerWaalsContact C-N 3.26Å; Q182-N184 PolarHBondContact O-N 3.17Å; Q182-R185 WeakPolarHBondContact O-CB 3.4Å; Q182-R185 PolarHBondContact O-N 3.07Å; Q182-R185 VanDerWaalsContact O-N 3.07Å
183	M	55.2	Low	57.5	Low	112 Å²	112	103.5 Å²	103.5	55%	0.552	53%	0.531	S	S	*	.	H	α-helix	trans	-59.8	-39.2	172.8	-64.7	-176.8	-146.6	0	0	111.6	M180 R185 V186	M180-M183 PolarHBondContact O-N 3.35Å; M183-R185 PolarHBondContact O-N 3.06Å; M183-V186 WeakPolarHBondContact O-CB 3.12Å; M183-V186 WeakPolarHBondContact O-CG2 3.22Å; M183-V186 PolarHBondContact O-N 3.15Å
184	N	53.7	Low	55.1	Low	73 Å²	73	110.7 Å²	110.7	39%	0.39	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.8	5.6	176.1	-71.1	-27.5	0	0	0	114.6	N122 Q182	N122-N184 PolarHBondContact OD1-ND2 3.43Å; Q182-N184 VanDerWaalsContact C-N 3.26Å; Q182-N184 PolarHBondContact O-N 3.17Å
185	R	48.1	Very low	52.9	Low	214 Å²	214	114.4 Å²	114.4	81%	0.808	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-9.5	166.6	-70.8	-175.8	165.7	-176	-3.1	114.2	Q182 M183 K187	Q182-R185 WeakPolarHBondContact O-CB 3.4Å; Q182-R185 PolarHBondContact O-N 3.07Å; Q182-R185 VanDerWaalsContact O-N 3.07Å; M183-R185 PolarHBondContact O-N 3.06Å; R185-K187 PolarHBondContact O-N 2.84Å
186	V	49.3	Very low	50.9	Low	113 Å²	113	119.5 Å²	119.5	69%	0.685	60%	0.595	S	S	*	*	S	Bend	trans	-63	123.5	165.6	-179.1	0	0	0	0	107.1	M183	M183-V186 WeakPolarHBondContact O-CB 3.12Å; M183-V186 WeakPolarHBondContact O-CG2 3.22Å; M183-V186 PolarHBondContact O-N 3.15Å
187	K	42.5	Very low	48.7	Very low	181 Å²	181	125.7 Å²	125.7	79%	0.787	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-62.5	138.8	-178.8	-65.6	175.6	-177.5	172.5	0	108.9	R185 F189	R185-K187 PolarHBondContact O-N 2.84Å; K187-F189 PolarHBondContact O-N 3.23Å
188	P	46.2	Very low	47.1	Very low	92 Å²	92	128.8 Å²	128.8	60%	0.597	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-57.2	127.5	174.3	25	-33.7	0	0	0	109.2	H190	P188-H190 VanDerWaalsContact C-N 3.34Å; P188-H190 PolarHBondContact O-N 3.07Å
189	F	48	Very low	45	Very low	201 Å²	201	131.5 Å²	131.5	88%	0.882	66%	0.664	S	S	*	*			trans	-68.8	96.5	171.4	-113.4	-90	0	0	0	107.6	K187 R191	K187-F189 PolarHBondContact O-N 3.23Å; F189-R191 PolarHBondContact O-N 2.84Å
190	H	44.3	Very low	43.6	Very low	162 Å²	162	132.9 Å²	132.9	75%	0.75	67%	0.67	S	S	*	*			trans	-61.7	100.3	171	-71.2	-76.3	0	0	0	108.3	P188 S192	P188-H190 VanDerWaalsContact C-N 3.34Å; P188-H190 PolarHBondContact O-N 3.07Å; H190-S192 PolarHBondContact O-N 3.17Å
191	R	42.8	Very low	42	Very low	161 Å²	161	137.6 Å²	137.6	61%	0.608	71%	0.705	S	S	*	*			trans	-50.4	111.9	164.3	-95.7	-170.2	172.6	171.4	2	106.4	V82 F189 S193	V82-R191 PolarHBondContact O-NH1 3.31Å; V82-R191 PolarHBondContact O-NH2 2.7Å; F189-R191 PolarHBondContact O-N 2.84Å; R191-S193 PolarHBondContact O-N 3.07Å
192	S	39	Very low	40.7	Very low	103 Å²	103	141.9 Å²	141.9	72%	0.72	72%	0.722	S	S	*	*			trans	-66	126.7	-173.3	-72.1	0	0	0	0	108.5	H190 K194	H190-S192 PolarHBondContact O-N 3.17Å; S192-K194 PolarHBondContact O-N 3.03Å
193	S	40.4	Very low	39.3	Very low	122 Å²	122	142.4 Å²	142.4	85%	0.853	73%	0.728	S	S	*	*	S	Bend	trans	-73.7	56.1	-177.6	40.9	0	0	0	0	112.4	R191	R191-S193 PolarHBondContact O-N 3.07Å
194	K	33.3	Very low	38.2	Very low	170 Å²	170	142 Å²	142	74%	0.739	74%	0.736	S	S	*	*			trans	-127.1	46	-178.4	-73.5	-167.6	173.5	-171.1	0	112.1	S192	S192-K194 PolarHBondContact O-N 3.03Å
195	L	34	Very low	37.2	Very low	177 Å²	177	144.6 Å²	144.6	93%	0.927	75%	0.751	S	S	*	*			trans	-96.7	92.7	146.4	-71.5	177.8	0	0	0	106.3
196	H	33.3	Very low	36.6	Very low	149 Å²	149	140.6 Å²	140.6	69%	0.69	74%	0.741	S	S	*	*			trans	-72.4	147.4	174	-80.1	17.8	0	0	0	109.9	H198	H196-H198 PolarHBondContact O-N 3.34Å
197	T	27	Very low	35.9	Very low	147 Å²	147	143 Å²	143	90%	0.902	74%	0.742	S	S	*	*			trans	-56.7	105.1	152.7	47.6	0	0	0	0	108.8
198	H	32.9	Very low	35.3	Very low	138 Å²	138	143.3 Å²	143.3	64%	0.639	74%	0.744	S	S	*	*			trans	-123.5	95.5	167.2	-152	-21.6	0	0	0	109.4	H196 Q200	H196-H198 PolarHBondContact O-N 3.34Å; H198-Q200 VanDerWaalsContact CE1-CG 3.49Å; H198-Q200 WeakPolarHBondContact CE1-CG 3.38Å; H198-Q200 PolarHBondContact CE1-NE2 3.46Å; H198-Q200 VanDerWaalsContact CE1-NE2 3.33Å; H198-Q200 WeakPolarHBondContact ND1-CG 3.49Å; H198-Q200 PolarHBondContact NE2-NE2 2.82Å; H198-Q200 PolarHBondContact O-N 2.84Å
199	S	27.2	Very low	34.4	Very low	113 Å²	113	147.8 Å²	147.8	79%	0.79	75%	0.748	S	S	*	*			trans	-61.3	122.4	155	43.7	0	0	0	0	108.1
200	Q	36.6	Very low	33.7	Very low	137 Å²	137	146.9 Å²	146.9	64%	0.64	74%	0.744	S	S	*	*			trans	-126.8	105.2	162.7	-70.3	-163.8	-10.5	0	0	108.1	H198 E202	H198-Q200 VanDerWaalsContact CE1-CG 3.49Å; H198-Q200 WeakPolarHBondContact CE1-CG 3.38Å; H198-Q200 PolarHBondContact CE1-NE2 3.46Å; H198-Q200 VanDerWaalsContact CE1-NE2 3.33Å; H198-Q200 WeakPolarHBondContact ND1-CG 3.49Å; H198-Q200 PolarHBondContact NE2-NE2 2.82Å; H198-Q200 PolarHBondContact O-N 2.84Å; Q200-E202 PolarHBondContact O-N 3.09Å
201	S	27.8	Very low	33.2	Very low	115 Å²	115	144.2 Å²	144.2	80%	0.804	74%	0.744	S	S	*	*			trans	-91.1	87.7	170.9	54.1	0	0	0	0	108.5
202	E	33.2	Very low	33	Very low	168 Å²	168	142.5 Å²	142.5	79%	0.785	75%	0.754	S	S	*	*			trans	-137.7	146.3	172.4	-74.3	-166.5	-169	0	0	110.1	Q200	Q200-E202 PolarHBondContact O-N 3.09Å
203	L	30.5	Very low	32.9	Very low	142 Å²	142	146.5 Å²	146.5	74%	0.743	76%	0.758	S	S	*	*			cis	-165.3	164.2	-32.1	-150.7	77.4	0	0	0	106.6
204	S	31.5	Very low	32.7	Very low	104 Å²	104	150.8 Å²	150.8	73%	0.727	76%	0.756	S	S	*	*			trans	71.3	151.1	161.3	93.9	0	0	0	0	115.1
205	D	33.1	Very low	33.1	Very low	128 Å²	128	148.1 Å²	148.1	68%	0.684	75%	0.754	S	S	*	*			cis	-161.4	173.4	-11.9	-143	-59.8	0	0	0	112.4
206	H	35	Very low	33.3	Very low	130 Å²	130	145.9 Å²	145.9	60%	0.602	74%	0.743	S	S	*	*			trans	101.7	103.3	149.1	-65	-12.2	0	0	0	120.7
207	K	34.5	Very low	33.7	Very low	163 Å²	163	143.8 Å²	143.8	71%	0.709	75%	0.745	S	S	*	*			trans	66	117.6	138.2	-58.4	156.3	-171	147	0	114.9
208	F	30.9	Very low	34.2	Very low	188 Å²	188	143.6 Å²	143.6	83%	0.825	74%	0.738	S	S	*	*				-137.3	142.5	64.8	-94.9	-91.4	0	0	0	115.9
209	R	28	Very low	34.4	Very low	185 Å²	185	148.2 Å²	148.2	70%	0.698	75%	0.75	S	S	*	*			trans	0.7	143	155.3	-61.3	175.7	172	160.6	-2.8	118.4
210	F	33.4	Very low	34.9	Very low	182 Å²	182	150 Å²	150	80%	0.798	75%	0.751	S	S	*	*			cis	-146.3	126	42.4	-79.7	-92	0	0	0	116.9
211	S	32.3	Very low	35.1	Very low	106 Å²	106	151.1 Å²	151.1	74%	0.741	76%	0.76	S	S	*	*			trans	45.1	110.1	134.2	-54.6	0	0	0	0	122.9
212	P	40.1	Very low	35.4	Very low	126 Å²	126	149.1 Å²	149.1	82%	0.818	74%	0.744	S	S	*	*			trans	-105.9	162.6	173.5	39.8	-34.5	0	0	0	115.8
213	K	36.4	Very low	35.9	Very low	187 Å²	187	144.8 Å²	144.8	81%	0.813	73%	0.73	S	S	*	*			trans	-158.4	150.7	166	-67.8	-173.7	-174.4	166.8	0	109.1
214	R	36.5	Very low	36	Very low	211 Å²	211	144 Å²	144	80%	0.796	73%	0.731	S	S	*	*			cis	-176	158.1	-10.1	-110.9	-178.6	-174.5	-177.7	-1.9	109.4
215	V	40.2	Very low	36.3	Very low	115 Å²	115	145.4 Å²	145.4	70%	0.697	74%	0.735	S	S	*	*			trans	70.1	141.4	144.3	165.5	0	0	0	0	118.9
216	D	38.8	Very low	36.5	Very low	130 Å²	130	147.9 Å²	147.9	70%	0.695	74%	0.743	S	S	*	*			cis	-170.1	152.7	-21.9	-92.3	-20.1	0	0	0	110.5
217	S	41.2	Very low	36.7	Very low	104 Å²	104	146.5 Å²	146.5	73%	0.727	75%	0.745	S	S	*	*			trans	66.4	165.6	145.3	75.5	0	0	0	0	121.7
218	N	37.4	Very low	36.7	Very low	144 Å²	144	146 Å²	146	77%	0.77	75%	0.75	S	S	*	*			cis	-173.3	167.4	-44.4	-95.7	-15.1	0	0	0	110.2
219	R	38.5	Very low	36.9	Very low	234 Å²	234	142.6 Å²	142.6	88%	0.883	74%	0.744	S	S	*	*			trans	89.5	131.4	172.1	-51.8	160.7	-178.3	177.2	0.5	114.4
220	N	37.2	Very low	37.2	Very low	151 Å²	151	140.1 Å²	140.1	81%	0.807	74%	0.744	S	S	*	*			cis	115.2	138.5	9.2	-71.4	25	0	0	0	113.3
221	I	40.6	Very low	37.3	Very low	161 Å²	161	138.3 Å²	138.3	83%	0.826	74%	0.738	S	S	*	*			trans	108.9	111.6	161	-57.5	161.7	0	0	0	117.3
222	P	35.1	Very low	37.4	Very low	73 Å²	73	137.4 Å²	137.4	47%	0.474	73%	0.732	S	S	.	*			trans	-108.9	-155.6	162.7	45.5	-35.5	0	0	0	110.2	E958	P222-E958 HydrophobicContact CG-CB 3.82Å; P222-E958 WeakPolarHBondContact CG-OE2 3.43Å
223	P	43.6	Very low	37.1	Very low	76 Å²	76	139.9 Å²	139.9	49%	0.494	73%	0.73	S	S	.	*			cis	-135	-160.9	-15.9	42	-24.2	0	0	0	115.1	E958	P223-E958 VanDerWaalsContact CB-CD 3.48Å; P223-E958 WeakPolarHBondContact CB-OE1 3.26Å; P223-E958 WeakPolarHBondContact CB-OE2 3.42Å; P223-E958 WeakPolarHBondContact CG-OE2 3.23Å
224	T	32	Very low	37.2	Very low	125 Å²	125	136.8 Å²	136.8	77%	0.767	72%	0.719	S	S	*	*			trans	88.8	117.1	159.2	-52.3	0	0	0	0	120
225	V	36.9	Very low	37.2	Very low	134 Å²	134	134.7 Å²	134.7	81%	0.812	72%	0.715	S	S	*	*				-177	139.5	125.8	146.5	0	0	0	0	109.5
226	Q	37.4	Very low	37	Very low	180 Å²	180	134.4 Å²	134.4	84%	0.841	71%	0.706	S	S	*	*			trans	-120.1	-165.9	172.4	-47.9	-177.4	-3.8	0	0	109
227	P	39.8	Very low	36.7	Very low	101 Å²	101	137.3 Å²	137.3	66%	0.656	71%	0.707	S	S	*	*			cis	-132.9	-170.7	-16.1	41.1	-24.5	0	0	0	113.2
228	L	34.1	Very low	36.2	Very low	154 Å²	154	136.5 Å²	136.5	81%	0.806	72%	0.715	S	S	*	*				-165.9	124.6	128.6	-125.6	75	0	0	0	112.1
229	V	36.4	Very low	36	Very low	115 Å²	115	141.2 Å²	141.2	70%	0.697	72%	0.722	S	S	*	*				50	121.8	127.3	171.7	0	0	0	0	118
230	N	33.3	Very low	35.8	Very low	133 Å²	133	134.2 Å²	134.2	71%	0.711	71%	0.707	S	S	*	*			cis	-170.5	177.5	9.2	-126.3	0.7	0	0	0	110.9
231	H	36	Very low	35.5	Very low	145 Å²	145	135.7 Å²	135.7	67%	0.671	71%	0.706	S	S	*	*			cis	-146.4	-76.2	-7.4	-162.9	52.6	0	0	0	114.6
232	S	34.2	Very low	35	Very low	87 Å²	87	131.5 Å²	131.5	61%	0.608	69%	0.691	S	S	*	*			trans	-147.3	148.1	-160.7	58	0	0	0	0	114
233	F	33.7	Very low	34.8	Very low	178 Å²	178	136.3 Å²	136.3	78%	0.781	71%	0.707	S	S	*	*			cis	74.9	148	37.5	-63.9	-56.8	0	0	0	113.4
234	Q	38.6	Very low	34.2	Very low	122 Å²	122	140.9 Å²	140.9	57%	0.57	73%	0.727	S	S	*	*			cis	-165.2	146.6	17.5	-138.2	167.8	96	0	0	115.5
235	K	37.3	Very low	34.1	Very low	167 Å²	167	140.3 Å²	140.3	73%	0.726	73%	0.728	S	S	*	*			trans	56.3	175.3	147.6	-72.6	166.7	-159.3	158.8	0	117.7
236	H	35.2	Very low	33.8	Very low	109 Å²	109	140.7 Å²	140.7	51%	0.505	73%	0.73	S	S	.	*			cis	-139.6	145.1	29.5	-87.8	-128.6	0	0	0	117
237	R	33.3	Very low	33.4	Very low	190 Å²	190	136.5 Å²	136.5	72%	0.717	72%	0.721	S	S	*	*			trans	36.8	114.5	145.4	-58.5	177	179.4	158.7	0.3	121.3	D515	R237-D515 IonicContact NH1-OD1 2.63Å; R237-D515 PolarHBondContact NH1-OD1 2.95Å; R237-D515 IonicContact NH1-OD2 2.82Å
238	G	30.5	Very low	33	Very low	87 Å²	87	136.7 Å²	136.7	90%	0.897	73%	0.725	S	S	*	*			trans	-170.8	113.6	160	0	0	0	0	0	115
239	R	33.2	Very low	32.7	Very low	243 Å²	243	140.4 Å²	140.4	92%	0.917	73%	0.728	S	S	*	*			trans	-139.3	165.2	178	-139.9	-160.4	170.1	-171.8	-1.1	106.7
240	P	34.6	Very low	32.3	Very low	88 Å²	88	142.6 Å²	142.6	57%	0.571	74%	0.735	S	S	*	*			cis	-134.6	-158.5	-3	37.1	-14.5	0	0	0	113.5
241	K	31.1	Very low	32.3	Very low	181 Å²	181	146.2 Å²	146.2	79%	0.787	74%	0.74	S	S	*	*			trans	73.5	117.4	166.8	-61	160.8	-175.7	177.2	0	114.6
242	S	29.9	Very low	32	Very low	73 Å²	73	147.6 Å²	147.6	51%	0.51	75%	0.747	S	S	.	*				82.3	127.2	53.3	76.7	0	0	0	0	114.7
243	H	30.2	Very low	32	Very low	175 Å²	175	150.1 Å²	150.1	81%	0.81	75%	0.752	S	S	*	*			trans	49.6	90.9	166.5	46.3	-116.1	0	0	0	119.1
244	L	31.4	Very low	31.9	Very low	171 Å²	171	147.9 Å²	147.9	90%	0.895	75%	0.748	S	S	*	*			trans	-126.5	140.2	148.7	-82.3	91.8	0	0	0	110.4
245	S	28.4	Very low	31.5	Very low	113 Å²	113	153.9 Å²	153.9	79%	0.79	77%	0.765	S	S	*	*			trans	-99.7	128.2	174.4	-58.6	0	0	0	0	111	S247	S245-S247 WeakPolarHBondContact O-CB 3.22Å
246	T	30.8	Very low	31.3	Very low	142 Å²	142	154.7 Å²	154.7	87%	0.871	77%	0.769	S	S	*	*			trans	-115.9	81.3	169.1	-45.7	0	0	0	0	107
247	S	29.4	Very low	31	Very low	92 Å²	92	152.9 Å²	152.9	64%	0.643	77%	0.773	S	S	*	*				59.4	89.8	53.2	-157.4	0	0	0	0	112.8	S245	S245-S247 WeakPolarHBondContact O-CB 3.22Å
248	S	32.6	Very low	30.9	Very low	106 Å²	106	151.9 Å²	151.9	74%	0.741	78%	0.781	S	S	*	*			trans	30.3	97.3	151	-58.2	0	0	0	0	119.8
249	R	27.3	Very low	30.9	Very low	232 Å²	232	156.3 Å²	156.3	88%	0.875	78%	0.776	S	S	*	*			trans	-171.9	168.7	132.6	-93.9	138.2	-156.1	-155.7	6.4	109.3
250	L	27.8	Very low	30.8	Very low	161 Å²	161	149.4 Å²	149.4	84%	0.843	76%	0.764	S	S	*	*			trans	68.3	113.6	-161.1	-46.7	170.7	0	0	0	110.4
251	Y	32.8	Very low	30.4	Very low	208 Å²	208	156.4 Å²	156.4	82%	0.816	78%	0.781	S	S	*	*			cis	-92.7	110.4	13.4	-68.5	-103.2	0	0	0	113.6	I253	Y251-I253 HydrophobicContact CD1-CD1 3.68Å; Y251-I253 HydrophobicContact CD1-CG1 4.07Å; Y251-I253 HydrophobicContact CE1-CD1 4.09Å
252	H	30.4	Very low	30.2	Very low	175 Å²	175	152.1 Å²	152.1	81%	0.81	77%	0.774	S	S	*	*			trans	-120.6	60.1	158	-103.5	21.4	0	0	0	108.4	N254	H252-N254 PolarHBondContact O-N 3.33Å
253	I	33.6	Very low	30.1	Very low	140 Å²	140	157.1 Å²	157.1	72%	0.718	79%	0.789	S	S	*	*			trans	-74.9	84	173.8	-57.7	-174.8	0	0	0	108.8	Y251 R255	Y251-I253 HydrophobicContact CD1-CD1 3.68Å; Y251-I253 HydrophobicContact CD1-CG1 4.07Å; Y251-I253 HydrophobicContact CE1-CD1 4.09Å; I253-R255 PolarHBondContact O-N 3.04Å
254	N	31.9	Very low	30	Very low	130 Å²	130	159 Å²	159	70%	0.695	80%	0.795	S	S	*	*			trans	37.4	44.4	150.2	-112.8	-21.3	0	0	0	120.3	H252 K256	H252-N254 PolarHBondContact O-N 3.33Å; N254-K256 PolarHBondContact O-N 3.37Å
255	R	30.9	Very low	29.8	Very low	248 Å²	248	156.3 Å²	156.3	94%	0.936	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	33.3	165.7	-125.3	-177.1	-161.5	-167.2	6.5	114	I253	I253-R255 PolarHBondContact O-N 3.04Å
256	K	31.9	Very low	29.7	Very low	185 Å²	185	155.8 Å²	155.8	80%	0.804	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.9	-6.2	178.4	-75.7	-170.1	175.2	-176.3	0	114.3	N254	N254-K256 PolarHBondContact O-N 3.37Å
257	A	30	Very low	29.6	Very low	70 Å²	70	157.9 Å²	157.9	58%	0.579	79%	0.787	S	S	*	*	S	Bend	trans	-87.4	-4.3	176	0	0	0	0	0	114.4
258	L	30.9	Very low	29.6	Very low	170 Å²	170	162.5 Å²	162.5	89%	0.89	80%	0.798	S	S	*	*	S	Bend	trans	-118.8	58.9	175.8	-70.8	172.6	0	0	0	110.7
259	K	30.5	Very low	29.4	Very low	180 Å²	180	165.5 Å²	165.5	78%	0.783	80%	0.8	S	S	*	*			trans	-139.8	28.2	169.9	-81.2	-155.9	170.6	-165.2	0	112.8
260	S	29.7	Very low	29.5	Very low	97 Å²	97	162.4 Å²	162.4	68%	0.678	80%	0.8	S	S	*	*	S	Bend	trans	-122.1	31.3	-179.4	58.4	0	0	0	0	113
261	Y	28	Very low	29.4	Very low	235 Å²	235	159.9 Å²	159.9	92%	0.922	80%	0.796	S	S	*	*			trans	-143.2	75.2	166.8	-99.3	-76.4	0	0	0	109.3
262	S	25.5	Very low	29.4	Very low	91 Å²	91	159.7 Å²	159.7	64%	0.636	79%	0.794	S	S	*	*			trans	-154.7	67.7	177.5	62.4	0	0	0	0	111.2
263	H	28.5	Very low	29.7	Very low	179 Å²	179	157.1 Å²	157.1	83%	0.829	79%	0.786	S	S	*	*			trans	-163.8	70.4	166.7	-98.6	-63.4	0	0	0	111.5
264	F	27.1	Very low	29.7	Very low	213 Å²	213	155.9 Å²	155.9	93%	0.934	78%	0.781	S	S	*	*			trans	-167	128.6	154.8	-85.3	-66	0	0	0	105.3
265	S	27.2	Very low	29.8	Very low	116 Å²	116	155.9 Å²	155.9	81%	0.811	78%	0.78	S	S	*	*			cis	-132.7	148.2	5.9	-61.3	0	0	0	0	111.7
266	S	27.3	Very low	30	Very low	102 Å²	102	152.4 Å²	152.4	71%	0.713	77%	0.772	S	S	*	*			trans	-146.7	139.8	167.2	53.8	0	0	0	0	108.5
267	E	27.6	Very low	29.9	Very low	185 Å²	185	152.6 Å²	152.6	86%	0.864	77%	0.773	S	S	*	*			trans	66.4	98.8	175.3	-52.3	-172.7	155.9	0	0	116.8
268	E	29.2	Very low	30.1	Very low	190 Å²	190	157.8 Å²	157.8	89%	0.888	78%	0.782	S	S	*	*			trans	-131.4	127.1	130.7	-83	-152.6	141	0	0	111.3
269	H	28.4	Very low	30.1	Very low	168 Å²	168	155.9 Å²	155.9	78%	0.778	77%	0.773	S	S	*	*			trans	-21.8	147.8	165.9	-54.5	-77.7	0	0	0	120.2
270	L	30.7	Very low	30.3	Very low	168 Å²	168	152.9 Å²	152.9	88%	0.88	77%	0.765	S	S	*	*				-160.4	118	123.2	-109.2	169.4	0	0	0	111.3
271	S	26.1	Very low	30.5	Very low	108 Å²	108	153.8 Å²	153.8	76%	0.755	76%	0.763	S	S	*	*			trans	-136.6	123	177.7	59.7	0	0	0	0	111.4
272	R	33.2	Very low	30.8	Very low	203 Å²	203	148.2 Å²	148.2	77%	0.766	75%	0.749	S	S	*	*			trans	-160.8	149.2	-178	-69.5	-163.9	67.2	153.2	2	108.5
273	D	34.8	Very low	31.2	Very low	122 Å²	122	150.4 Å²	150.4	65%	0.652	75%	0.754	S	S	*	*			cis	-135.7	-169.9	-20.9	-73.5	-33.6	0	0	0	104.6
274	D	35.2	Very low	31.4	Very low	114 Å²	114	147.4 Å²	147.4	61%	0.61	75%	0.748	S	S	*	*			cis	-148.1	149.9	14	-178.9	52.5	0	0	0	112.8	K276	D274-K276 IonicContact OD2-NZ 2.75Å; D274-K276 PolarHBondContact OD2-NZ 3.48Å
275	L	32.5	Very low	31.7	Very low	130 Å²	130	143.6 Å²	143.6	68%	0.681	73%	0.733	S	S	*	*			trans	-10.9	124.5	157.1	-57.3	165.6	0	0	0	121
276	K	35.3	Very low	31.9	Very low	175 Å²	175	145.6 Å²	145.6	76%	0.761	73%	0.727	S	S	*	*				163.3	164	108	-83.6	142.2	-151.9	127	0	112.2	D274	D274-K276 IonicContact OD2-NZ 2.75Å; D274-K276 PolarHBondContact OD2-NZ 3.48Å
277	K	30.8	Very low	31.9	Very low	188 Å²	188	144.9 Å²	144.9	82%	0.817	72%	0.721	S	S	*	*			cis	172.1	151.1	-34.1	-171.4	168.4	-174	173.5	0	106.2
278	K	33.8	Very low	32	Very low	180 Å²	180	143.4 Å²	143.4	78%	0.783	72%	0.718	S	S	*	*			trans	80.3	120.1	-177.9	-76.3	-173	173.4	-174.5	0	114.3
279	N	31.7	Very low	32.1	Very low	130 Å²	130	138.7 Å²	138.7	70%	0.695	71%	0.706	S	S	*	*				78.6	139.3	69.1	-71.5	48	0	0	0	110.6
280	N	33.7	Very low	32.1	Very low	116 Å²	116	136.2 Å²	136.2	62%	0.62	70%	0.703	S	S	*	*			cis	-162.4	157.4	14.2	-124.9	23.9	0	0	0	111.1
281	N	34.3	Very low	32.2	Very low	117 Å²	117	134.4 Å²	134.4	63%	0.626	70%	0.698	S	S	*	*			trans	65.4	158.4	142.6	-70.8	39	0	0	0	119.1
282	D	35	Very low	32.3	Very low	117 Å²	117	134.9 Å²	134.9	63%	0.626	69%	0.688	S	S	*	*			cis	-151.9	172.1	-1.4	-122.2	-27.6	0	0	0	111.7
283	N	33.8	Very low	32.2	Very low	138 Å²	138	133.6 Å²	133.6	74%	0.738	69%	0.689	S	S	*	*			trans	68.6	149.3	164	-59.7	-33.3	0	0	0	116.9
284	T	31.8	Very low	31.9	Very low	116 Å²	116	134.4 Å²	134.4	71%	0.712	69%	0.686	S	S	*	*			cis	-163.4	143.7	-11.5	29.8	0	0	0	0	105.7
285	E	33.8	Very low	31.7	Very low	133 Å²	133	138.3 Å²	138.3	62%	0.621	70%	0.698	S	S	*	*			cis	-160.7	148.4	-1.7	-94.4	-102	96.8	0	0	109.1
286	K	31.3	Very low	31.5	Very low	158 Å²	158	136.3 Å²	136.3	69%	0.687	70%	0.695	S	S	*	*			trans	46.9	146.9	137.6	-62.3	-162.9	176.1	92.9	0	122.6
287	C	27.7	Very low	31.1	Very low	86 Å²	86	137.7 Å²	137.7	58%	0.581	70%	0.701	S	S	*	*			cis	-172.2	150.2	-7.3	-112.8	0	0	0	0	112.3
288	I	29.7	Very low	31	Very low	155 Å²	155	131.9 Å²	131.9	80%	0.795	69%	0.688	S	S	*	*			trans	64.3	145.6	136.3	-64.2	167.6	0	0	0	117.5
289	S	31.3	Very low	30.7	Very low	91 Å²	91	128.1 Å²	128.1	64%	0.636	68%	0.684	S	S	*	*			cis	-126.9	145.9	5.2	51.4	0	0	0	0	110.4
290	T	28.4	Very low	30.8	Very low	116 Å²	116	129.1 Å²	129.1	71%	0.712	69%	0.689	S	S	*	*				40.8	133.6	79.7	43.1	0	0	0	0	114.1
291	V	31.6	Very low	30.6	Very low	130 Å²	130	129 Å²	129	79%	0.788	69%	0.693	S	S	*	*				-143.9	147	62.6	157.3	0	0	0	0	113.5
292	E	27.8	Very low	30.7	Very low	118 Å²	118	129 Å²	129	55%	0.551	70%	0.702	S	S	*	*			trans	-70	170.4	174.4	-44.1	180	88.4	0	0	113.8	K294	E292-K294 WeakPolarHBondContact OE1-CE 3.33Å; E292-K294 IonicContact OE1-NZ 3.77Å; E292-K294 PolarHBondContact OE1-NZ 3.4Å; E292-K294 IonicContact OE2-NZ 3.37Å; E292-K294 PolarHBondContact OE2-NZ 3.49Å
293	F	30.9	Very low	30.5	Very low	176 Å²	176	128.6 Å²	128.6	77%	0.772	71%	0.708	S	S	*	*				174.7	101.6	121.4	-101.5	-76.8	0	0	0	108.3
294	K	28.7	Very low	30.7	Very low	139 Å²	139	132.1 Å²	132.1	60%	0.604	72%	0.717	S	S	*	*				47.1	102.5	85.8	-72.9	174.5	176.8	135.1	0	114.6	E292	E292-K294 WeakPolarHBondContact OE1-CE 3.33Å; E292-K294 IonicContact OE1-NZ 3.77Å; E292-K294 PolarHBondContact OE1-NZ 3.4Å; E292-K294 IonicContact OE2-NZ 3.37Å; E292-K294 PolarHBondContact OE2-NZ 3.49Å
295	K	31.3	Very low	30.5	Very low	196 Å²	196	134.8 Å²	134.8	85%	0.852	72%	0.719	S	S	*	*				170.7	129.9	128.2	-90.8	176.3	178	-178.5	0	108.3
296	S	28.4	Very low	30.4	Very low	87 Å²	87	135.2 Å²	135.2	61%	0.608	73%	0.73	S	S	*	*			cis	105.4	150.5	21.5	72.6	0	0	0	0	113.6
297	F	27.3	Very low	30.2	Very low	204 Å²	204	133.7 Å²	133.7	90%	0.895	73%	0.725	S	S	*	*			trans	77.7	152.7	177.2	-74.5	-112.2	0	0	0	117.1
298	A	29	Very low	30.1	Very low	67 Å²	67	136.7 Å²	136.7	55%	0.554	74%	0.735	S	S	*	*			cis	-177.9	149.4	-31.1	0	0	0	0	0	111.2
299	S	28.1	Very low	30	Very low	100 Å²	100	134.3 Å²	134.3	70%	0.699	73%	0.728	S	S	*	*			trans	60.5	172.2	158.8	66.6	0	0	0	0	116.7
300	L	33.3	Very low	30	Very low	151 Å²	151	137.3 Å²	137.3	79%	0.791	73%	0.731	S	S	*	*			cis	-121.9	145.5	1	-73	85.8	0	0	0	108.3
301	T	29.7	Very low	30.1	Very low	114 Å²	114	139.2 Å²	139.2	70%	0.699	73%	0.732	S	S	*	*			cis	78	86.3	40.3	70.9	0	0	0	0	117.1
302	S	35.6	Very low	30.1	Very low	117 Å²	117	139.3 Å²	139.3	82%	0.818	73%	0.728	S	S	*	*			trans	-172.5	158.4	139.9	65	0	0	0	0	111.9
303	S	31.1	Very low	30.4	Very low	108 Å²	108	139 Å²	139	76%	0.755	74%	0.735	S	S	*	*			cis	165.7	117.5	-49.2	-90.6	0	0	0	0	110.1
304	K	37.4	Very low	30.4	Very low	212 Å²	212	135.6 Å²	135.6	92%	0.922	73%	0.733	S	S	*	*			trans	145.6	121	166	-87.1	158.7	-177	-178.8	0	107.9
305	K	27.2	Very low	30.6	Very low	173 Å²	173	137 Å²	137	75%	0.752	75%	0.745	S	S	*	*			cis	85	82.4	11.6	-159.1	-172.6	174.3	-179.4	0	118.1
306	V	31.9	Very low	30.5	Very low	141 Å²	141	137.4 Å²	137.4	86%	0.855	74%	0.741	S	S	*	*			trans	-156.4	127.7	148.7	179.9	0	0	0	0	105.2
307	Q	27.5	Very low	30.8	Very low	126 Å²	126	139.1 Å²	139.1	59%	0.589	75%	0.753	S	S	*	*			cis	94.6	128	1.3	-151.6	-174.8	-29.9	0	0	117.6
308	L	26.6	Very low	30.9	Very low	149 Å²	149	132.8 Å²	132.8	78%	0.78	73%	0.734	S	S	*	*			trans	78.7	143.5	-178	-53.2	146.7	0	0	0	113.7
309	T	26.4	Very low	31.1	Very low	106 Å²	106	135.9 Å²	135.9	65%	0.65	75%	0.746	S	S	*	*			cis	-163.3	157.8	-6.2	12.6	0	0	0	0	112.9
310	H	32.3	Very low	31.1	Very low	153 Å²	153	138.6 Å²	138.6	71%	0.708	75%	0.753	S	S	*	*			trans	43	124.7	150.2	-66.8	-70.5	0	0	0	122.9
311	Q	29.2	Very low	31	Very low	157 Å²	157	137.4 Å²	137.4	73%	0.734	75%	0.752	S	S	*	*				56.3	141.2	129.6	-73.8	155.2	-49.3	0	0	119.3
312	D	33.4	Very low	30.9	Very low	132 Å²	132	137.3 Å²	137.3	71%	0.706	75%	0.753	S	S	*	*				-152.9	159.3	56.1	-130	-44	0	0	0	118.1
313	T	33.3	Very low	30.5	Very low	112 Å²	112	139.8 Å²	139.8	69%	0.687	76%	0.755	S	S	*	*			trans	13	127.1	156	36.1	0	0	0	0	122
314	S	30.1	Very low	30.5	Very low	104 Å²	104	141.4 Å²	141.4	73%	0.727	76%	0.755	S	S	*	*				86.8	134.3	84.2	-156.9	0	0	0	0	112.3
315	I	34.9	Very low	30	Very low	167 Å²	167	136.7 Å²	136.7	86%	0.856	75%	0.746	S	S	*	*				-132.5	157.5	56.2	-75.7	169.3	0	0	0	113.6
316	R	28.5	Very low	30.2	Very low	205 Å²	205	135.9 Å²	135.9	77%	0.774	75%	0.748	S	S	*	*			trans	-121.9	136.7	-175.5	163.3	-169.2	170.2	-161.1	0.9	111.1	S318	R316-S318 PolarHBondContact NE-OG 3.34Å
317	S	33.3	Very low	30	Very low	123 Å²	123	133.9 Å²	133.9	86%	0.86	74%	0.738	S	S	*	*			trans	-131.2	153.3	144.7	69.2	0	0	0	0	108.4
318	S	31	Very low	30.2	Very low	71 Å²	71	137.2 Å²	137.2	50%	0.497	75%	0.753	S	S	.	*			trans	-155.3	126.8	-166.7	56.9	0	0	0	0	112.4	R316	R316-S318 PolarHBondContact NE-OG 3.34Å
319	V	32.4	Very low	30.5	Very low	133 Å²	133	141.5 Å²	141.5	81%	0.806	76%	0.759	S	S	*	*			trans	-126.8	106.7	165.3	-178.8	0	0	0	0	108.2
320	N	28.7	Very low	30.8	Very low	157 Å²	157	147.5 Å²	147.5	84%	0.84	77%	0.77	S	S	*	*			trans	-85.7	134.5	166.7	-68	-11.3	0	0	0	108.5
321	T	30.5	Very low	30.9	Very low	126 Å²	126	143.7 Å²	143.7	77%	0.773	77%	0.772	S	S	*	*			trans	-132	149.9	158.5	28.4	0	0	0	0	109.8
322	P	28.1	Very low	31.1	Very low	111 Å²	111	148.3 Å²	148.3	72%	0.721	78%	0.783	S	S	*	*			trans	-85.8	154.2	-156.3	32.8	-36.8	0	0	0	114.4	L324	P322-L324 PolarHBondContact O-N 3.5Å
323	I	27.4	Very low	31.1	Very low	170 Å²	170	145.2 Å²	145.2	87%	0.872	78%	0.782	S	S	*	*			trans	-63.7	112.5	167.6	-60.8	168.1	0	0	0	108.8
324	L	29.9	Very low	31.5	Very low	142 Å²	142	148.6 Å²	148.6	74%	0.743	78%	0.782	S	S	*	*			trans	-94.2	128.7	165.7	-83.7	168.5	0	0	0	109.6	P322 I326	P322-L324 PolarHBondContact O-N 3.5Å; L324-I326 PolarHBondContact O-N 2.7Å
325	P	27.3	Very low	31.7	Very low	113 Å²	113	149.4 Å²	149.4	73%	0.734	79%	0.785	S	S	*	*			trans	-73.8	98.9	175.3	29.9	-32.9	0	0	0	109.7	P327	P325-P327 VanDerWaalsContact O-CD 3.3Å; P325-P327 WeakPolarHBondContact O-CD 3.38Å
326	I	31.7	Very low	31.7	Very low	155 Å²	155	152.6 Å²	152.6	80%	0.795	79%	0.786	S	S	*	*			trans	-68.5	116.3	172.9	-58.7	178.4	0	0	0	108	L324	L324-I326 PolarHBondContact O-N 2.7Å
327	P	28.4	Very low	32.1	Very low	100 Å²	100	152.8 Å²	152.8	65%	0.649	79%	0.793	S	S	*	*			trans	-72.2	142.5	-177.8	29.7	-34.6	0	0	0	110.7	P325 R329	P325-P327 VanDerWaalsContact O-CD 3.3Å; P325-P327 WeakPolarHBondContact O-CD 3.38Å; P327-R329 PolarHBondContact O-N 3.34Å
328	H	31.8	Very low	32.2	Very low	195 Å²	195	153.4 Å²	153.4	90%	0.903	79%	0.785	S	S	*	*			trans	-54.6	98.9	173.7	-78.5	-71.5	0	0	0	111.4	R330	H328-R330 VanDerWaalsContact C-N 3.35Å; H328-R330 PolarHBondContact O-N 3.15Å
329	R	32.8	Very low	32.3	Very low	239 Å²	239	159.8 Å²	159.8	90%	0.902	80%	0.803	S	S	*	*			trans	-72.5	90.5	170.2	-79.8	-165.8	169.3	-154.1	-0.5	109.6	P327 G331	P327-R329 PolarHBondContact O-N 3.34Å; R329-G331 PolarHBondContact O-N 3.4Å
330	R	31.8	Very low	32.3	Very low	232 Å²	232	159.5 Å²	159.5	88%	0.875	80%	0.796	S	S	*	*			trans	-53.1	132.7	164.9	-69.5	178	172.8	162.2	-1.3	109.5	H328	H328-R330 VanDerWaalsContact C-N 3.35Å; H328-R330 PolarHBondContact O-N 3.15Å
331	G	34.7	Very low	32.5	Very low	73 Å²	73	159 Å²	159	75%	0.753	79%	0.793	S	S	*	*			trans	-52.6	146.1	166.5	0	0	0	0	0	111	R329 G333	R329-G331 PolarHBondContact O-N 3.4Å; G331-G333 VanDerWaalsContact C-N 3.34Å; G331-G333 PolarHBondContact O-N 2.83Å
332	R	34.3	Very low	32.5	Very low	255 Å²	255	160.2 Å²	160.2	96%	0.962	80%	0.795	S	S	*	*			trans	-73.9	79.3	-166.5	-74.1	-177.7	170	-179.1	-3.4	113.2
333	G	32.2	Very low	32.6	Very low	67 Å²	67	161.4 Å²	161.4	69%	0.691	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-62.3	143.3	161.1	0	0	0	0	0	111.7	G331	G331-G333 VanDerWaalsContact C-N 3.34Å; G331-G333 PolarHBondContact O-N 2.83Å
334	R	41.1	Very low	32.8	Very low	182 Å²	182	161.9 Å²	161.9	69%	0.687	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-49.4	142.2	176.5	-167.8	-175.2	-167.8	174.1	6.3	111.7	D160 R336	D160-R334 IonicContact OD1-CZ 2.83Å; D160-R334 IonicContact OD1-NH1 2.71Å; D160-R334 PolarHBondContact OD1-NH1 3.42Å; D160-R334 IonicContact OD1-NH2 3.83Å; D160-R334 IonicContact OD2-CZ 3.86Å; D160-R334 IonicContact OD2-NH1 2.8Å; D160-R334 PolarHBondContact OD2-NH1 2.86Å; D160-R334 IonicContact OD2-NH2 2.83Å; D160-R334 PolarHBondContact OD2-NH2 2.62Å; R334-R336 PolarHBondContact O-N 3.08Å; R334-R336 VanDerWaalsContact O-N 3.1Å
335	P	35.2	Very low	32.7	Very low	121 Å²	121	162.2 Å²	162.2	79%	0.786	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-60.8	116.3	-176.7	-23.1	33.4	0	0	0	112.2	K337	P335-K337 PolarHBondContact O-N 3.17Å
336	R	33.9	Very low	33	Very low	235 Å²	235	162.8 Å²	162.8	89%	0.887	81%	0.807	S	S	*	*			trans	-72.8	112.5	166.8	-64.1	-175.8	-171.6	173.9	2.9	107.8	R334 I338	R334-R336 PolarHBondContact O-N 3.08Å; R334-R336 VanDerWaalsContact O-N 3.1Å; R336-I338 PolarHBondContact O-N 3.25Å
337	K	37.8	Very low	32.9	Very low	209 Å²	209	161.5 Å²	161.5	91%	0.909	81%	0.812	S	S	*	*			trans	-64.7	101.9	165.1	-79.4	-171.9	174.9	-176.9	0	108.3	P335	P335-K337 PolarHBondContact O-N 3.17Å
338	I	34.4	Very low	33	Very low	135 Å²	135	160.3 Å²	160.3	69%	0.692	82%	0.818	S	S	*	*			trans	-73	121.9	164.9	-65.2	172.9	0	0	0	106.4	R336 I340	R336-I338 PolarHBondContact O-N 3.25Å; I338-I340 HydrophobicContact CG2-CB 4.2Å; I338-I340 HydrophobicContact CG2-CD1 3.58Å; I338-I340 HydrophobicContact CG2-CG1 3.65Å
339	K	33.8	Very low	32.8	Very low	205 Å²	205	156.6 Å²	156.6	89%	0.891	81%	0.814	S	S	*	*			trans	-89.1	106.4	166.7	-95.5	-167.4	168.3	-165.4	0	107.9
340	I	33.3	Very low	32.8	Very low	128 Å²	128	150.2 Å²	150.2	66%	0.656	81%	0.806	S	S	*	*			trans	-149.6	127.8	171.2	-72.8	178.3	0	0	0	103.4	I338	I338-I340 HydrophobicContact CG2-CB 4.2Å; I338-I340 HydrophobicContact CG2-CD1 3.58Å; I338-I340 HydrophobicContact CG2-CG1 3.65Å
341	D	32.4	Very low	32.5	Very low	146 Å²	146	145 Å²	145	78%	0.781	80%	0.8	S	S	*	*			cis	-142.1	177.9	-11.3	-93	-23.6	0	0	0	108.1
342	D	30.8	Very low	32.3	Very low	151 Å²	151	149.6 Å²	149.6	81%	0.807	81%	0.806	S	S	*	*			trans	-74.1	141.3	173.4	-89.5	-55.6	0	0	0	113.3
343	I	30.6	Very low	31.9	Very low	136 Å²	136	144.2 Å²	144.2	70%	0.697	80%	0.797	S	S	*	*	S	Bend	trans	78.2	123.7	150.2	-65	165	0	0	0	119.3
344	Q	30.6	Very low	31.9	Very low	181 Å²	181	149 Å²	149	85%	0.846	80%	0.804	S	S	*	*			trans	67.5	103.2	156.8	-73.2	165.9	20.6	0	0	121.1
345	T	28.6	Very low	31.1	Very low	149 Å²	149	145.2 Å²	145.2	91%	0.914	81%	0.806	S	S	*	*			trans	-127.2	118.4	142.4	54.1	0	0	0	0	109.7
346	S	33.1	Very low	31	Very low	124 Å²	124	145.7 Å²	145.7	87%	0.867	81%	0.807	S	S	*	*			trans	-101.1	141.8	178.8	56.5	0	0	0	0	112.4
347	S	29.1	Very low	30.7	Very low	129 Å²	129	142.8 Å²	142.8	90%	0.902	80%	0.804	S	S	*	*			trans	-78.8	144.2	-176.9	54.1	0	0	0	0	115
348	G	31.8	Very low	30.4	Very low	74 Å²	74	139.9 Å²	139.9	76%	0.763	80%	0.797	S	S	*	*			trans	173.9	100.3	165.3	0	0	0	0	0	109.4
349	S	27.5	Very low	30	Very low	118 Å²	118	141.1 Å²	141.1	83%	0.825	80%	0.8	S	S	*	*				80.5	81.6	52.3	-170.2	0	0	0	0	114.5
350	S	31.5	Very low	29.7	Very low	104 Å²	104	138 Å²	138	73%	0.727	79%	0.793	S	S	*	*			trans	-157.1	96.3	152.5	58.4	0	0	0	0	108.5
351	T	26.1	Very low	29.6	Very low	124 Å²	124	136.9 Å²	136.9	76%	0.761	80%	0.797	S	S	*	*				50.2	108.8	93.5	63.9	0	0	0	0	114.7
352	L	31	Very low	29.4	Very low	168 Å²	168	134.8 Å²	134.8	88%	0.88	79%	0.794	S	S	*	*			trans	-157.5	114.2	136.1	-109.2	173.9	0	0	0	109.2
353	N	25.4	Very low	29.2	Very low	143 Å²	143	134.5 Å²	134.5	77%	0.765	79%	0.791	S	S	*	*			trans	-83.6	156.7	170	-65	-27.2	0	0	0	109.8
354	I	31.4	Very low	29	Very low	166 Å²	166	134.5 Å²	134.5	85%	0.851	79%	0.791	S	S	*	*			trans	-155.7	136.6	137.5	-99.3	144.5	0	0	0	107.5
355	S	25.1	Very low	28.7	Very low	104 Å²	104	130.9 Å²	130.9	73%	0.727	79%	0.786	S	S	*	*			trans	-128.3	133	-173.3	-52.5	0	0	0	0	111.5
356	T	33	Very low	28.6	Very low	131 Å²	131	127.4 Å²	127.4	80%	0.804	77%	0.768	S	S	*	*			trans	-156.1	115.1	156.7	44.2	0	0	0	0	106.2
357	Q	27.2	Very low	28.2	Very low	174 Å²	174	128.9 Å²	128.9	81%	0.813	77%	0.766	S	S	*	*				72.1	155.2	59.8	-73	-157.2	-7.6	0	0	115.3
358	L	31.3	Very low	28.2	Very low	148 Å²	148	127.9 Å²	127.9	78%	0.775	76%	0.759	S	S	*	*			trans	76.7	113.6	-167.9	-48.2	179.6	0	0	0	112
359	Q	27.1	Very low	28.2	Very low	161 Å²	161	130 Å²	130	75%	0.752	76%	0.757	S	S	*	*			cis	59.3	120.6	41.7	-54	-174.5	-88.8	0	0	110.8
360	D	27.6	Very low	28.5	Very low	139 Å²	139	129.5 Å²	129.5	74%	0.743	75%	0.751	S	S	*	*				-170.6	179.3	56.6	-90.7	-45.9	0	0	0	111.5
361	S	31.2	Very low	28.3	Very low	105 Å²	105	131.7 Å²	131.7	73%	0.734	75%	0.753	S	S	*	*			trans	66.9	119.8	167.1	-49.9	0	0	0	0	116.3
362	S	26.4	Very low	28.3	Very low	102 Å²	102	133.5 Å²	133.5	71%	0.713	76%	0.758	S	S	*	*			cis	73.4	148.5	20	107	0	0	0	0	116.2
363	L	27.2	Very low	28.1	Very low	144 Å²	144	128.8 Å²	128.8	75%	0.754	75%	0.75	S	S	*	*			trans	93.8	120.9	171.9	-54.1	-174.5	0	0	0	120.6
364	I	26.2	Very low	28.2	Very low	137 Å²	137	130.7 Å²	130.7	70%	0.703	75%	0.752	S	S	*	*				72.4	112.5	127.9	-63.9	173.4	0	0	0	119.3
365	S	25.1	Very low	28	Very low	104 Å²	104	132.2 Å²	132.2	73%	0.727	75%	0.747	S	S	*	*				45.2	153.7	109.7	-140.5	0	0	0	0	119.6
366	S	26.3	Very low	28.3	Very low	77 Å²	77	134.3 Å²	134.3	54%	0.538	75%	0.745	S	S	.	*			cis	-168.8	164.9	19.3	-22	0	0	0	0	110
367	N	25.6	Very low	27.9	Very low	155 Å²	155	132.4 Å²	132.4	83%	0.829	74%	0.737	S	S	*	*			trans	64.9	162	145.3	-60.5	-8	0	0	0	117.7
368	S	28	Very low	28.1	Very low	107 Å²	107	131.7 Å²	131.7	75%	0.748	73%	0.734	S	S	*	*			cis	-160	161.4	-15	38.8	0	0	0	0	111.2
369	T	32.9	Very low	27.9	Very low	120 Å²	120	131.1 Å²	131.1	74%	0.736	73%	0.731	S	S	*	*			trans	-47.6	161.2	155.4	46.6	0	0	0	0	112.9
370	P	32.9	Very low	27.9	Very low	106 Å²	106	130.9 Å²	130.9	69%	0.688	73%	0.734	S	S	*	*				-161.4	158.6	53.6	45.7	-23.3	0	0	0	122.4
371	I	26.7	Very low	27.8	Very low	150 Å²	150	128.6 Å²	128.6	77%	0.769	73%	0.729	S	S	*	*				60.2	144.3	124.8	-58.7	170.3	0	0	0	123.4
372	D	26.5	Very low	27.8	Very low	162 Å²	162	130 Å²	130	87%	0.866	73%	0.734	S	S	*	*			trans	77.6	147.5	159.1	-89.1	-35.6	0	0	0	121.9
373	G	27.5	Very low	27.8	Very low	70 Å²	70	133 Å²	133	72%	0.722	74%	0.741	S	S	*	*			trans	-168.1	-48.9	-178.7	0	0	0	0	0	121.1
374	K	28.1	Very low	27.9	Very low	183 Å²	183	131.2 Å²	131.2	80%	0.796	74%	0.74	S	S	*	*			trans	69.3	116.4	-179.1	-70.4	175.4	178.4	162.8	0	121.2
375	R	25.6	Very low	28	Very low	197 Å²	197	133.9 Å²	133.9	74%	0.743	75%	0.749	S	S	*	*				81.1	153.9	122.2	-67.3	-179.1	175.6	-165.2	-1.6	123.7
376	H	31.3	Very low	28	Very low	149 Å²	149	135.1 Å²	135.1	69%	0.69	75%	0.748	S	S	*	*			trans	73.7	116.3	167.8	-59.6	-64.3	0	0	0	115.3
377	S	26.3	Very low	28.1	Very low	90 Å²	90	138.1 Å²	138.1	63%	0.629	75%	0.753	S	S	*	*				67.7	126.3	55.1	80.5	0	0	0	0	111.5
378	E	30.9	Very low	28.1	Very low	160 Å²	160	138.6 Å²	138.6	75%	0.748	74%	0.744	S	S	*	*			cis	-154.1	147.4	41.6	-73.9	173.9	-165.6	0	0	115.5
379	N	26.5	Very low	28.2	Very low	136 Å²	136	138.2 Å²	138.2	73%	0.727	74%	0.742	S	S	*	*			trans	54.7	160	131.4	-54.9	-29.7	0	0	0	125.2
380	L	27.4	Very low	27.8	Very low	156 Å²	156	142 Å²	142	82%	0.817	74%	0.742	S	S	*	*			trans	88.4	79.7	155.5	-69.3	142	0	0	0	121.7
381	S	25.5	Very low	27.5	Very low	91 Å²	91	141.8 Å²	141.8	64%	0.636	74%	0.743	S	S	*	*				57.8	114.7	117.7	64.1	0	0	0	0	123.5
382	T	30.1	Very low	27.4	Very low	135 Å²	135	142 Å²	142	83%	0.828	75%	0.745	S	S	*	*				174.7	113.5	128.7	22.2	0	0	0	0	106.9
383	L	27.4	Very low	27.4	Very low	165 Å²	165	140.2 Å²	140.2	86%	0.864	74%	0.743	S	S	*	*				45	130.7	76.1	-76.9	89	0	0	0	114.4
384	S	28.1	Very low	27.3	Very low	106 Å²	106	142 Å²	142	74%	0.741	74%	0.74	S	S	*	*			cis	-141.7	145.5	21.1	58.2	0	0	0	0	116.6
385	H	30.1	Very low	27.4	Very low	193 Å²	193	137 Å²	137	89%	0.894	72%	0.722	S	S	*	*			trans	53.6	89.1	162.1	-85.1	-44.8	0	0	0	120
386	D	24.7	Very low	27.4	Very low	130 Å²	130	134.2 Å²	134.2	70%	0.695	72%	0.722	S	S	*	*			trans	-129.6	146.8	155.3	-153.7	-8.2	0	0	0	108.5
387	H	28.6	Very low	27	Very low	139 Å²	139	132.1 Å²	132.1	64%	0.644	72%	0.724	S	S	*	*			trans	52.9	-177.6	172.9	-56.2	-46.4	0	0	0	116.6
388	Y	24.6	Very low	27	Very low	166 Å²	166	137.4 Å²	137.4	65%	0.651	74%	0.736	S	S	*	*			cis	-139.7	145.1	9.9	-111.5	-94	0	0	0	107.1
389	S	30.8	Very low	26.7	Very low	99 Å²	99	137.2 Å²	137.2	69%	0.692	74%	0.735	S	S	*	*				63.9	134.3	51.4	-76.8	0	0	0	0	115.6
390	R	24.2	Very low	26.6	Very low	198 Å²	198	137.1 Å²	137.1	75%	0.747	74%	0.735	S	S	*	*			trans	100.8	115.6	-177.8	-62.6	174.2	171.1	125.6	0.8	113.8
391	S	27	Very low	26.5	Very low	102 Å²	102	134.6 Å²	134.6	71%	0.713	73%	0.73	S	S	*	*			cis	68.9	93.7	45.9	88.2	0	0	0	0	113.7
392	I	24.1	Very low	26.5	Very low	155 Å²	155	137.6 Å²	137.6	80%	0.795	74%	0.737	S	S	*	*			trans	-128.6	110.5	153	-53.3	-178.2	0	0	0	106.7	V394	I392-V394 HydrophobicContact CG2-CG2 3.7Å
393	C	26	Very low	26.3	Very low	124 Å²	124	136.7 Å²	136.7	84%	0.838	73%	0.732	S	S	*	*			trans	-84.1	118.2	165.2	-57	0	0	0	0	107.5
394	V	26.8	Very low	26.4	Very low	108 Å²	108	132.8 Å²	132.8	66%	0.655	73%	0.731	S	S	*	*			trans	-116.9	97.5	164.8	-173.4	0	0	0	0	107.8	I392 N396	I392-V394 HydrophobicContact CG2-CG2 3.7Å; V394-N396 HydrophobicContact CG1-CB 4.39Å; V394-N396 PolarHBondContact O-N 2.83Å
395	N	29.1	Very low	26.4	Very low	78 Å²	78	135 Å²	135	42%	0.417	73%	0.73	S	S	.	*			trans	-75.3	118.7	157.6	-76.6	-48	0	0	0	107.3	I838	N395-I838 HydrophobicContact CB-CD1 3.87Å; N395-I838 HydrophobicContact CB-CG1 4.42Å
396	N	25.7	Very low	26.4	Very low	138 Å²	138	131 Å²	131	74%	0.738	72%	0.723	S	S	*	*			trans	-150	113.6	159.7	-98.5	-24.3	0	0	0	108.5	V394	V394-N396 HydrophobicContact CG1-CB 4.39Å; V394-N396 PolarHBondContact O-N 2.83Å
397	S	24.1	Very low	26.6	Very low	105 Å²	105	131.2 Å²	131.2	73%	0.734	72%	0.724	S	S	*	*			trans	-63.1	134.3	168.4	48.6	0	0	0	0	110.9
398	F	26.3	Very low	26.5	Very low	201 Å²	201	131.6 Å²	131.6	88%	0.882	73%	0.73	S	S	*	*			trans	-143.4	88.6	159.2	-109.1	-78	0	0	0	109.4
399	E	23.1	Very low	26.5	Very low	156 Å²	156	128.1 Å²	128.1	73%	0.729	73%	0.73	S	S	*	*			trans	-73.6	156.5	158.8	-64	-174.5	120.5	0	0	110
400	N	25.6	Very low	26.4	Very low	135 Å²	135	130 Å²	130	72%	0.722	73%	0.732	S	S	*	*			trans	58	121.8	160.1	-58.6	-46	0	0	0	116.3
401	S	25.2	Very low	26.5	Very low	103 Å²	103	122.7 Å²	122.7	72%	0.72	72%	0.718	S	S	*	*				-173.9	167.7	70.6	-64.5	0	0	0	0	113.8
402	I	25.8	Very low	26.8	Very low	153 Å²	153	120.2 Å²	120.2	79%	0.785	70%	0.699	S	S	*	*			trans	85	76.7	155.5	-64.8	148.6	0	0	0	117.8
403	T	25.1	Very low	26.9	Very low	117 Å²	117	117 Å²	117	72%	0.718	69%	0.688	S	S	*	*				47.3	127.7	124.8	60.3	0	0	0	0	122.2
404	G	28.5	Very low	26.9	Very low	82 Å²	82	120.4 Å²	120.4	85%	0.845	69%	0.691	S	S	*	*			trans	-160	53.9	170.6	0	0	0	0	0	115.2
405	H	29.5	Very low	26.9	Very low	154 Å²	154	120.1 Å²	120.1	71%	0.713	69%	0.694	S	S	*	*			trans	-31.4	124.2	-172.2	-59.6	-90	0	0	0	120.5
406	S	30.5	Very low	26.7	Very low	108 Å²	108	124.3 Å²	124.3	76%	0.755	71%	0.711	S	S	*	*				-176.8	112.6	116.9	26.6	0	0	0	0	109.7
407	N	27.5	Very low	26.7	Very low	134 Å²	134	128.5 Å²	128.5	72%	0.717	72%	0.718	S	S	*	*				71.1	119.8	73.7	-70.8	3.7	0	0	0	112.3
408	L	26.8	Very low	26.8	Very low	147 Å²	147	131.5 Å²	131.5	77%	0.77	72%	0.72	S	S	*	*			cis	-145.9	144.2	9.1	-79.4	126.8	0	0	0	109.5
409	S	25.7	Very low	26.9	Very low	93 Å²	93	128.9 Å²	128.9	65%	0.65	72%	0.715	S	S	*	*				65.5	135.5	85.4	129.8	0	0	0	0	114.4
410	L	28.3	Very low	27.2	Very low	140 Å²	140	125.9 Å²	125.9	73%	0.733	71%	0.712	S	S	*	*			cis	-159.2	167.8	9.8	-137.2	68.9	0	0	0	110	A827	L410-A827 HydrophobicContact CB-CB 4.44Å; L410-A827 HydrophobicContact CD2-CB 3.4Å; L410-A827 VanDerWaalsContact CD2-CB 3.4Å; L410-A827 HydrophobicContact CG-CB 3.67Å
411	G	25.5	Very low	27.3	Very low	44 Å²	44	128 Å²	128	45%	0.454	72%	0.722	S	S	.	*			trans	-107.1	-151.1	-179.4	0	0	0	0	0	116	A827 P828	G411-A827 VanDerWaalsContact O-CA 3.31Å; G411-A827 WeakPolarHBondContact O-CA 3.39Å; G411-P828 VanDerWaalsContact CA-CD 3.45Å
412	P	32.8	Very low	27.4	Very low	49 Å²	49	127.9 Å²	127.9	32%	0.318	72%	0.717	S	S	.	*			cis	-144.4	-124.3	12	45.8	-22.3	0	0	0	115	S826 A827 P828	P412-S826 WeakPolarHBondContact CG-O 3.42Å; P412-A827 VanDerWaalsContact CG-CA 3.47Å; P412-P828 HydrophobicContact CB-CB 3.67Å; P412-P828 HydrophobicContact CB-CG 3.61Å
413	T	27.1	Very low	27.5	Very low	89 Å²	89	128.8 Å²	128.8	55%	0.546	72%	0.718	S	S	.	*			trans	72.3	136.7	-175.6	68.3	0	0	0	0	112.7
414	Q	26.5	Very low	27.7	Very low	194 Å²	194	127.6 Å²	127.6	91%	0.907	72%	0.715	S	S	*	*			cis	76.3	60.1	18.1	-147.5	179	31.7	0	0	115.5
415	S	25.3	Very low	27.7	Very low	102 Å²	102	131 Å²	131	71%	0.713	72%	0.719	S	S	*	*			trans	-154.3	162.4	158.9	-52.8	0	0	0	0	109.9
416	E	24.9	Very low	27.6	Very low	167 Å²	167	131.1 Å²	131.1	78%	0.78	72%	0.721	S	S	*	*			trans	-72.5	154.5	-176.8	-53.5	96.1	151.4	0	0	114.4
417	Y	26.4	Very low	27.6	Very low	225 Å²	225	135.4 Å²	135.4	88%	0.882	73%	0.727	S	S	*	*			trans	-148.6	87.3	156.2	-99.8	-75.8	0	0	0	111
418	E	27.3	Very low	27.5	Very low	168 Å²	168	136 Å²	136	79%	0.785	73%	0.728	S	S	*	*			trans	-77.1	165.2	139.9	-72.1	-164.5	136.7	0	0	108.8
419	N	27.1	Very low	27.6	Very low	146 Å²	146	138.1 Å²	138.1	78%	0.781	73%	0.734	S	S	*	*			trans	60.1	85.1	171.3	-56	-45.8	0	0	0	117
420	S	29	Very low	27.8	Very low	94 Å²	94	138.5 Å²	138.5	66%	0.657	74%	0.737	S	S	*	*				-171.1	133.3	106.4	-173.5	0	0	0	0	113	T422	S420-T422 PolarHBondContact OG-N 3.37Å; S420-T422 PolarHBondContact OG-OG1 2.83Å
421	L	27.8	Very low	27.7	Very low	178 Å²	178	138.9 Å²	138.9	93%	0.932	74%	0.74	S	S	*	*			trans	-145.5	54.2	141.1	-130.4	174.2	0	0	0	109.2
422	T	27.9	Very low	27.8	Very low	102 Å²	102	141.9 Å²	141.9	63%	0.626	75%	0.754	S	S	*	*			trans	-75.7	140.8	169.6	37.3	0	0	0	0	111.3	S420	S420-T422 PolarHBondContact OG-N 3.37Å; S420-T422 PolarHBondContact OG-OG1 2.83Å
423	E	28.3	Very low	27.5	Very low	171 Å²	171	146.4 Å²	146.4	80%	0.799	77%	0.77	S	S	*	*			trans	45.2	132.1	144.5	-60.6	-171.2	104.2	0	0	122.8
424	S	28.4	Very low	27.5	Very low	93 Å²	93	151.2 Å²	151.2	65%	0.65	78%	0.78	S	S	*	*			trans	76.3	115	140.3	78.1	0	0	0	0	119.5
425	V	28.8	Very low	27.5	Very low	153 Å²	153	146.9 Å²	146.9	93%	0.927	77%	0.767	S	S	*	*			trans	-94.6	91.2	135.9	176.7	0	0	0	0	106.6
426	M	27.5	Very low	27.5	Very low	156 Å²	156	149.4 Å²	149.4	77%	0.768	77%	0.767	S	S	*	*			trans	-75.5	145.1	166.3	-76.5	-134.1	-69.7	0	0	111
427	K	30.1	Very low	27.7	Very low	198 Å²	198	147.5 Å²	147.5	86%	0.861	76%	0.758	S	S	*	*			trans	173.8	131.8	155.7	-99.5	165	-177.5	178.4	0	107.4
428	I	26.9	Very low	27.8	Very low	147 Å²	147	144.2 Å²	144.2	75%	0.754	75%	0.749	S	S	*	*	S	Bend	cis	-143.8	139	0.9	-41.2	177.2	0	0	0	107.1
429	E	28.7	Very low	27.9	Very low	192 Å²	192	142.1 Å²	142.1	90%	0.897	74%	0.742	S	S	*	*				173.8	128.4	124.6	-95.8	176.1	-175.1	0	0	110.6
430	S	28.4	Very low	28	Very low	101 Å²	101	141.2 Å²	141.2	71%	0.706	74%	0.738	S	S	*	*			trans	-122.9	138.3	-169.9	-50.9	0	0	0	0	111.4
431	N	27.7	Very low	28.1	Very low	148 Å²	148	144.6 Å²	144.6	79%	0.791	75%	0.748	S	S	*	*			trans	74.8	129	152.1	-55.7	-18.7	0	0	0	120
432	S	26.4	Very low	28.1	Very low	106 Å²	106	144.8 Å²	144.8	74%	0.741	75%	0.745	S	S	*	*			trans	78.7	149.8	142.1	80	0	0	0	0	117.5
433	Q	27.6	Very low	28.3	Very low	144 Å²	144	144.3 Å²	144.3	67%	0.673	74%	0.743	S	S	*	*			cis	-161.2	154.5	11.4	-142.4	167.9	23	0	0	112.2
434	Y	26.2	Very low	28.2	Very low	191 Å²	191	144.2 Å²	144.2	75%	0.749	75%	0.747	S	S	*	*			trans	65.1	154.1	164	-63.6	-60	0	0	0	117.8
435	T	26.4	Very low	28.1	Very low	103 Å²	103	145.7 Å²	145.7	63%	0.632	75%	0.751	S	S	*	*			cis	-152.6	160.8	2.6	-7.4	0	0	0	0	111.6
436	Q	26.5	Very low	28	Very low	154 Å²	154	146 Å²	146	72%	0.72	75%	0.747	S	S	*	*			trans	22.8	131.5	135.7	-80.7	165.5	-99.8	0	0	118.7
437	E	28.7	Very low	27.9	Very low	127 Å²	127	145.2 Å²	145.2	59%	0.593	75%	0.745	S	S	*	*			cis	178.7	172.6	41.5	-101.2	160.8	-157.1	0	0	108.2
438	F	29.1	Very low	27.6	Very low	156 Å²	156	142 Å²	142	68%	0.684	74%	0.737	S	S	*	*			cis	-159.8	148.7	-6.1	-115.1	-36.4	0	0	0	110.1
439	L	29	Very low	27.7	Very low	124 Å²	124	142.1 Å²	142.1	65%	0.649	74%	0.738	S	S	*	*			trans	53.9	112.1	144.8	-62.9	163.4	0	0	0	123.1
440	N	27.9	Very low	27.6	Very low	128 Å²	128	137 Å²	137	68%	0.684	73%	0.729	S	S	*	*				59.1	123.6	123	-54.9	8.8	0	0	0	122
441	N	31.2	Very low	27.9	Very low	164 Å²	164	137.8 Å²	137.8	88%	0.877	73%	0.731	S	S	*	*				-169.5	149.9	88.8	-89.7	-50.2	0	0	0	112.7
442	E	28.8	Very low	28	Very low	183 Å²	183	136.4 Å²	136.4	86%	0.855	73%	0.733	S	S	*	*			trans	-90.5	167.7	-176.7	-96.1	-92.7	109.4	0	0	113.2
443	P	31.8	Very low	28.1	Very low	92 Å²	92	137.8 Å²	137.8	60%	0.597	74%	0.737	S	S	*	*			trans	-98.2	171.6	-164.4	39.1	-36.4	0	0	0	114.9
444	I	26.9	Very low	28.4	Very low	169 Å²	169	136.1 Å²	136.1	87%	0.867	74%	0.739	S	S	*	*			trans	-130.3	120.5	160.6	-61.9	-179.3	0	0	0	109.4
445	V	25.1	Very low	28.5	Very low	124 Å²	124	131.9 Å²	131.9	75%	0.752	74%	0.737	S	S	*	*			trans	-90.5	141.4	164.5	172.8	0	0	0	0	108.3
446	L	27	Very low	28.9	Very low	158 Å²	158	133 Å²	133	83%	0.827	75%	0.749	S	S	*	*			trans	-153	151.5	146.1	-112.6	179	0	0	0	112.7
447	L	24.6	Very low	29.2	Very low	141 Å²	141	130.9 Å²	130.9	74%	0.738	75%	0.752	S	S	*	*			trans	-77.5	179.2	176.1	-59.4	141	0	0	0	109.1
448	N	25.3	Very low	29.6	Very low	130 Å²	130	129.8 Å²	129.8	70%	0.695	76%	0.755	S	S	*	*			cis	-168.2	-178	23.7	-149.6	-12.3	0	0	0	112.4
449	I	28.1	Very low	29.8	Very low	149 Å²	149	130.1 Å²	130.1	76%	0.764	76%	0.764	S	S	*	*			trans	74.6	114.3	151.5	-66.2	156.8	0	0	0	118.8
450	A	26.3	Very low	30	Very low	85 Å²	85	130.1 Å²	130.1	70%	0.702	77%	0.774	S	S	*	*			trans	-104.8	-176.8	148	0	0	0	0	0	107.8
451	P	34.3	Very low	30.3	Very low	118 Å²	118	126.9 Å²	126.9	77%	0.766	77%	0.771	S	S	*	*			cis	-140.5	-176	7.2	44.1	-26.2	0	0	0	115.3
452	S	31.6	Very low	30.6	Very low	119 Å²	119	124.9 Å²	124.9	83%	0.832	77%	0.77	S	S	*	*				174.7	153.5	126.6	42.1	0	0	0	0	114
453	T	26.7	Very low	30.9	Very low	134 Å²	134	120.6 Å²	120.6	82%	0.822	76%	0.76	S	S	*	*			trans	-94.3	174.4	166	47.7	0	0	0	0	108.8
454	P	34.6	Very low	30.9	Very low	110 Å²	110	121.7 Å²	121.7	71%	0.714	77%	0.768	S	S	*	*			cis	-150	-176.8	27.3	41.4	-18	0	0	0	119.1
455	S	28.7	Very low	31.3	Very low	101 Å²	101	122 Å²	122	71%	0.706	76%	0.763	S	S	*	*			trans	50.9	116.1	147.4	63.6	0	0	0	0	121.2
456	S	33.6	Very low	31.7	Very low	127 Å²	127	121.1 Å²	121.1	89%	0.888	76%	0.759	S	S	*	*				-177.9	173.4	101.3	43	0	0	0	0	112
457	S	32.8	Very low	32	Very low	110 Å²	110	123.2 Å²	123.2	77%	0.769	76%	0.761	S	S	*	*			trans	-140.1	-172.9	-174.2	66.8	0	0	0	0	108.9
458	P	37.8	Very low	32.3	Very low	103 Å²	103	122.2 Å²	122.2	67%	0.669	76%	0.756	S	S	*	*			cis	-133.9	-141.9	-4.1	39.9	-18.4	0	0	0	112.5
459	L	33.1	Very low	32.6	Very low	164 Å²	164	119.3 Å²	119.3	86%	0.859	76%	0.756	S	S	*	*			trans	80.5	136	175.5	-48.5	168.3	0	0	0	114.1
460	S	34.4	Very low	32.9	Very low	124 Å²	124	121 Å²	121	87%	0.867	76%	0.758	S	S	*	*			cis	-160	168.5	-7.5	-159.4	0	0	0	0	107.5
461	G	33.1	Very low	33.3	Very low	60 Å²	60	122.7 Å²	122.7	62%	0.619	76%	0.76	S	S	*	*			cis	-176.7	-150	8	0	0	0	0	0	110.9
462	S	37.2	Very low	33	Very low	122 Å²	122	121.3 Å²	121.3	85%	0.853	75%	0.753	S	S	*	*			trans	58.2	97.1	177.2	-59.1	0	0	0	0	116
463	S	35.1	Very low	33	Very low	92 Å²	92	124.8 Å²	124.8	64%	0.643	75%	0.754	S	S	*	*				65.1	127.7	70.9	-143.6	0	0	0	0	113.2
464	C	31.8	Very low	33.2	Very low	115 Å²	115	124.3 Å²	124.3	78%	0.777	75%	0.75	S	S	*	*			cis	-115.1	155.4	30.2	-68	0	0	0	0	113.4
465	K	36.9	Very low	33	Very low	175 Å²	175	124 Å²	124	76%	0.761	75%	0.751	S	S	*	*				62	131.4	53.6	-61.7	-179.5	179.4	176.2	0	113.1
466	T	33.1	Very low	33.1	Very low	107 Å²	107	129.3 Å²	129.3	66%	0.656	76%	0.761	S	S	*	*			cis	-160.8	148.7	-4.8	7.2	0	0	0	0	108
467	F	32.2	Very low	32.9	Very low	201 Å²	201	133.3 Å²	133.3	88%	0.882	76%	0.762	S	S	*	*				-158.2	164.8	88.1	-130.7	-95.3	0	0	0	112.9
468	I	31.7	Very low	32.8	Very low	121 Å²	121	132.9 Å²	132.9	62%	0.621	76%	0.759	S	S	*	*			trans	-138.6	136.5	-163.6	-66.8	174.3	0	0	0	113.2	K470	I468-K470 HydrophobicContact CG2-CD 3.77Å; I468-K470 HydrophobicContact CG2-CG 3.8Å
469	G	32.3	Very low	32.6	Very low	69 Å²	69	136.4 Å²	136.4	71%	0.711	77%	0.767	S	S	*	*			trans	-169.8	119.3	156.9	0	0	0	0	0	108.1
470	K	34	Very low	32.3	Very low	183 Å²	183	136.7 Å²	136.7	80%	0.796	76%	0.761	S	S	*	*			cis	58.2	127.5	37.9	-54.3	-176.2	175	-177.8	0	111.3	I468	I468-K470 HydrophobicContact CG2-CD 3.77Å; I468-K470 HydrophobicContact CG2-CG 3.8Å
471	T	33.8	Very low	32	Very low	121 Å²	121	137.6 Å²	137.6	74%	0.742	76%	0.756	S	S	*	*			cis	-138.9	135.6	10.4	41.2	0	0	0	0	109.1
472	S	29.5	Very low	31.8	Very low	89 Å²	89	139.8 Å²	139.8	62%	0.622	76%	0.761	S	S	*	*				49.6	129.7	80.6	76.6	0	0	0	0	117.2
473	F	30.6	Very low	31.4	Very low	193 Å²	193	138 Å²	138	85%	0.846	75%	0.749	S	S	*	*			trans	85.2	134.5	157.1	-70.7	-64.9	0	0	0	122.9
474	V	30.7	Very low	31.1	Very low	124 Å²	124	140.2 Å²	140.2	75%	0.752	75%	0.754	S	S	*	*			trans	72.2	110.4	143	174.4	0	0	0	0	120.1
475	S	30.2	Very low	31.2	Very low	104 Å²	104	141.9 Å²	141.9	73%	0.727	75%	0.753	S	S	*	*			trans	-6.8	130.9	141.7	-42.3	0	0	0	0	118.9
476	K	32.7	Very low	31	Very low	212 Å²	212	141.5 Å²	141.5	92%	0.922	75%	0.754	S	S	*	*				-164.1	165.8	110.3	-106.3	161	-174.8	176.3	0	113.6
477	K	28	Very low	30.8	Very low	211 Å²	211	141 Å²	141	92%	0.917	76%	0.755	S	S	*	*			trans	-108.9	106.6	-166.4	177.5	-176	-179.5	-179.1	0	110.4
478	S	32	Very low	30.6	Very low	100 Å²	100	138.4 Å²	138.4	70%	0.699	75%	0.75	S	S	*	*			trans	-153.9	129.2	169.4	47.2	0	0	0	0	107.8
479	Q	32.3	Very low	30.7	Very low	178 Å²	178	142.2 Å²	142.2	83%	0.832	76%	0.762	S	S	*	*				57.8	128.2	69.5	-69.6	-164.7	15.4	0	0	112.2
480	K	27.8	Very low	30.4	Very low	169 Å²	169	147 Å²	147	74%	0.735	77%	0.77	S	S	*	*			cis	-170.6	164	-3.8	-147.8	-178.2	166.6	-175.2	0	109.5
481	L	26.6	Very low	30.3	Very low	144 Å²	144	143 Å²	143	75%	0.754	77%	0.765	S	S	*	*			trans	68.6	163.1	151.8	-83.1	160.8	0	0	0	121.2
482	S	29.8	Very low	30	Very low	105 Å²	105	145.3 Å²	145.3	73%	0.734	77%	0.768	S	S	*	*			trans	52.6	108.2	173.1	-86.7	0	0	0	0	117.3
483	S	28.7	Very low	30	Very low	86 Å²	86	150.3 Å²	150.3	60%	0.601	78%	0.779	S	S	*	*			cis	78	130.3	22.8	107.9	0	0	0	0	116.9
484	D	28.2	Very low	29.9	Very low	138 Å²	138	149.9 Å²	149.9	74%	0.738	78%	0.777	S	S	*	*			trans	65.7	110.8	154.2	-46.6	-51.7	0	0	0	121.9
485	I	34	Very low	29.9	Very low	150 Å²	150	150.6 Å²	150.6	77%	0.769	77%	0.774	S	S	*	*			trans	-165.1	110.8	136.4	-99.3	150.4	0	0	0	105.4
486	Q	32.4	Very low	30.1	Very low	167 Å²	167	151.8 Å²	151.8	78%	0.78	77%	0.772	S	S	*	*				60.2	136.8	85.9	-65.3	178.1	22.4	0	0	113.9
487	S	29.4	Very low	29.8	Very low	96 Å²	96	151.6 Å²	151.6	67%	0.671	77%	0.765	S	S	*	*			cis	-170.8	164.6	-8.6	56.2	0	0	0	0	112
488	N	28.1	Very low	29.8	Very low	146 Å²	146	148.6 Å²	148.6	78%	0.781	76%	0.759	S	S	*	*			trans	20.9	114.4	147.3	-59.6	-17.7	0	0	0	121.2
489	K	34.3	Very low	29.7	Very low	201 Å²	201	152.3 Å²	152.3	87%	0.874	76%	0.763	S	S	*	*			trans	-175.3	134.1	132	-96.7	147.4	-174.8	176.2	0	108
490	L	25.1	Very low	29.8	Very low	169 Å²	169	150.2 Å²	150.2	89%	0.885	75%	0.753	S	S	*	*			cis	75.7	69.6	17.2	-158.9	69.9	0	0	0	117
491	S	31.5	Very low	29.8	Very low	99 Å²	99	149.1 Å²	149.1	69%	0.692	75%	0.752	S	S	*	*			trans	-158.3	115.7	148.8	50.5	0	0	0	0	106.5
492	Q	28.1	Very low	29.9	Very low	170 Å²	170	150.2 Å²	150.2	79%	0.794	75%	0.751	S	S	*	*				70.3	151.2	76.6	-69.5	-168.5	-1.4	0	0	114.1
493	F	30	Very low	30	Very low	195 Å²	195	151.8 Å²	151.8	86%	0.855	75%	0.751	S	S	*	*			trans	73.4	102.7	-159.9	-53.3	-72.7	0	0	0	113.1
494	K	27.3	Very low	30.2	Very low	183 Å²	183	156.7 Å²	156.7	80%	0.796	76%	0.758	S	S	*	*			cis	74.7	142.8	14.5	-135.9	-173.9	-172.6	-172.9	0	114.2
495	M	31.8	Very low	30.3	Very low	140 Å²	140	156.5 Å²	156.5	69%	0.69	76%	0.756	S	S	*	*			trans	75.7	138.2	-171.9	-37.6	-81.9	62.5	0	0	112.9
496	D	33.3	Very low	30.1	Very low	129 Å²	129	155.5 Å²	155.5	69%	0.69	75%	0.752	S	S	*	*			cis	-153.6	177.9	-18.3	-129.2	-34.7	0	0	0	115.2
497	R	27.9	Very low	30.3	Very low	208 Å²	208	156.4 Å²	156.4	79%	0.785	75%	0.754	S	S	*	*			trans	-88.3	147.5	-173.8	-60.2	163.2	164.7	179.4	-6.1	115
498	N	27.1	Very low	30.4	Very low	148 Å²	148	157 Å²	157	79%	0.791	75%	0.754	S	S	*	*			trans	62.9	154.7	142	-58.7	-1.7	0	0	0	120.9
499	K	30	Very low	30.6	Very low	178 Å²	178	157.5 Å²	157.5	77%	0.774	76%	0.756	S	S	*	*			trans	72.1	154.9	177.2	-44.7	169.2	89.3	-126.5	0	113.3
500	E	33.7	Very low	30.5	Very low	134 Å²	134	152.8 Å²	152.8	63%	0.626	75%	0.749	S	S	*	*			cis	-114.2	159.1	-12.9	-94.2	96.5	-147.6	0	0	108.7
501	M	28.8	Very low	30.9	Very low	146 Å²	146	149.7 Å²	149.7	72%	0.719	74%	0.737	S	S	*	*			cis	83.9	114.3	28.6	-161.2	-169.7	71.8	0	0	115.6
502	F	27.8	Very low	31.3	Very low	167 Å²	167	152.8 Å²	152.8	73%	0.732	75%	0.746	S	S	*	*			trans	62.3	112.5	166.4	-83.4	-61.1	0	0	0	119.6
503	N	33.1	Very low	31.6	Very low	137 Å²	137	150.6 Å²	150.6	73%	0.733	74%	0.739	S	S	*	*				173	127.1	100.5	-88	-28.8	0	0	0	117
504	Y	31.3	Very low	32	Very low	189 Å²	189	147.7 Å²	147.7	74%	0.741	73%	0.728	S	S	*	*			trans	50.9	111	134.6	-76.4	-102.7	0	0	0	124.7
505	L	32	Very low	32.5	Very low	134 Å²	134	143.8 Å²	143.8	70%	0.702	72%	0.716	S	S	*	*				71.5	126.1	104.7	-152	73.4	0	0	0	122.4
506	D	29.2	Very low	32.8	Very low	129 Å²	129	142.4 Å²	142.4	69%	0.69	72%	0.72	S	S	*	*			trans	36.1	123.6	153.7	-57.2	-15.1	0	0	0	122.9
507	K	35.7	Very low	33.1	Very low	187 Å²	187	142.4 Å²	142.4	81%	0.813	73%	0.725	S	S	*	*				-179.5	119.5	105.7	-99.6	156.2	-172.4	166.5	0	117.4
508	T	31.4	Very low	33.4	Very low	108 Å²	108	142.2 Å²	142.2	66%	0.663	73%	0.725	S	S	*	*				43.5	139.1	129.8	63.7	0	0	0	0	123.5
509	N	32.9	Very low	33.8	Very low	156 Å²	156	141.5 Å²	141.5	83%	0.834	72%	0.722	S	S	*	*			trans	74.8	152.4	149.9	-59.3	-10.2	0	0	0	118.1
510	S	32.5	Very low	33.9	Very low	103 Å²	103	140.5 Å²	140.5	72%	0.72	73%	0.725	S	S	*	*			cis	-166.6	144.7	-20.6	174.2	0	0	0	0	111
511	V	34.6	Very low	33.9	Very low	104 Å²	104	139.5 Å²	139.5	63%	0.63	73%	0.733	S	S	*	*			trans	4.5	134.2	154	-175.1	0	0	0	0	120
512	N	38.3	Very low	33.9	Very low	164 Å²	164	137.4 Å²	137.4	88%	0.877	73%	0.731	S	S	*	*			trans	-165.7	148.2	133.2	-92.1	-35.7	0	0	0	111.2
513	D	36	Very low	34.1	Very low	124 Å²	124	136.7 Å²	136.7	66%	0.663	74%	0.735	S	S	*	*			trans	-110.2	151.2	-167.7	-52.3	-85.2	0	0	0	113.9
514	E	37.7	Very low	34.1	Very low	133 Å²	133	137.6 Å²	137.6	62%	0.621	74%	0.735	S	S	*	*				166.4	156.9	107.7	-93.9	-63.4	-170.7	0	0	115.9
515	D	37.7	Very low	34	Very low	102 Å²	102	134.6 Å²	134.6	55%	0.545	73%	0.731	S	S	.	*			trans	8.4	122.8	162.4	-83.9	-28.6	0	0	0	121.5	R237	R237-D515 IonicContact NH1-OD1 2.63Å; R237-D515 PolarHBondContact NH1-OD1 2.95Å; R237-D515 IonicContact NH1-OD2 2.82Å
516	S	38.4	Very low	34.1	Very low	110 Å²	110	133.6 Å²	133.6	77%	0.769	73%	0.731	S	S	*	*				152	129.3	99.7	59	0	0	0	0	118.5
517	V	39.3	Very low	34.1	Very low	130 Å²	130	133.7 Å²	133.7	79%	0.788	73%	0.727	S	S	*	*			trans	71.5	112.8	132.4	174.8	0	0	0	0	122.7
518	Y	33.4	Very low	33.8	Very low	203 Å²	203	134.2 Å²	134.2	80%	0.796	72%	0.724	S	S	*	*			trans	85	143.9	145.4	-108.5	-114.1	0	0	0	123.3
519	N	35.2	Very low	33.8	Very low	134 Å²	134	135 Å²	135	72%	0.717	73%	0.734	S	S	*	*			trans	61.8	127.1	176.9	-53.2	-38	0	0	0	115.8
520	D	32.8	Very low	33.6	Very low	156 Å²	156	135.5 Å²	135.5	83%	0.834	73%	0.731	S	S	*	*			cis	82.5	81.8	35.2	-164.1	31.5	0	0	0	114.8
521	S	34.7	Very low	33.5	Very low	114 Å²	114	138.7 Å²	138.7	80%	0.797	73%	0.734	S	S	*	*			trans	-158.5	164.1	142.1	68.9	0	0	0	0	110.8
522	C	27.9	Very low	33.2	Very low	102 Å²	102	141.2 Å²	141.2	69%	0.689	74%	0.739	S	S	*	*			trans	-78	172.2	-174.2	-53.6	0	0	0	0	115.2
523	D	32.7	Very low	33.1	Very low	152 Å²	152	141.4 Å²	141.4	81%	0.813	74%	0.738	S	S	*	*			trans	94	141.9	136.7	-73.8	-40.3	0	0	0	122.5
524	E	31.8	Very low	33	Very low	156 Å²	156	140.8 Å²	140.8	73%	0.729	74%	0.739	S	S	*	*			trans	62.3	114.2	155.4	-72.2	-155.3	-173.4	0	0	122.2
525	N	30.6	Very low	32.7	Very low	125 Å²	125	141 Å²	141	67%	0.668	74%	0.744	S	S	*	*				72.9	144.2	122.8	-65.6	-28.1	0	0	0	120.8
526	V	32.5	Very low	32.8	Very low	114 Å²	114	142.7 Å²	142.7	69%	0.691	75%	0.753	S	S	*	*			cis	-161.6	154.9	-26.4	86.5	0	0	0	0	109.4
527	E	30.8	Very low	33.4	Very low	131 Å²	131	143.2 Å²	143.2	61%	0.612	75%	0.752	S	S	*	*			trans	69.4	145	160	-80.6	-170.7	152.6	0	0	123.5
528	R	29.1	Very low	33.8	Very low	197 Å²	197	140.3 Å²	140.3	74%	0.743	74%	0.735	S	S	*	*			trans	73.3	88.1	140.4	-75.1	167.3	171.2	143.5	-1.6	120.9
529	S	31.5	Very low	34.9	Very low	124 Å²	124	135.5 Å²	135.5	87%	0.867	72%	0.723	S	S	*	*				-142	111	118.8	61.4	0	0	0	0	110.9
530	H	28.1	Very low	36.4	Very low	167 Å²	167	134.9 Å²	134.9	77%	0.773	72%	0.716	S	S	*	*			trans	-77.5	138.6	168	-82.8	-105.8	0	0	0	109.6
531	H	30.5	Very low	37.7	Very low	170 Å²	170	133.2 Å²	133.2	79%	0.787	71%	0.706	S	S	*	*			trans	-166	98.7	135.2	-94.5	-64.7	0	0	0	112
532	Q	28.8	Very low	38.7	Very low	157 Å²	157	131 Å²	131	73%	0.734	69%	0.685	S	S	*	*				64.8	78.2	117.2	-156.1	162.1	1.9	0	0	120.3
533	I	35.1	Very low	40.6	Very low	168 Å²	168	131.5 Å²	131.5	86%	0.862	68%	0.68	S	S	*	*			trans	-132.5	83.9	147.8	-54.9	178.6	0	0	0	106
534	V	34	Very low	42.3	Very low	112 Å²	112	129.8 Å²	129.8	68%	0.679	67%	0.667	S	S	*	*				70.3	113.3	94.8	177	0	0	0	0	112.8
535	D	32.6	Very low	43.7	Very low	137 Å²	137	125.1 Å²	125.1	73%	0.733	65%	0.654	S	S	*	*			trans	-69.9	138	-173.5	-53.7	-108.3	0	0	0	113.9
536	N	38.3	Very low	45.3	Very low	138 Å²	138	123.8 Å²	123.8	74%	0.738	64%	0.643	S	S	*	*			trans	-146.2	15.4	170.1	-111.9	-32.1	0	0	0	114.8
537	V	51.3	Low	47.2	Very low	121 Å²	121	124 Å²	124	73%	0.733	64%	0.635	S	S	*	*			trans	-107.5	43.2	-177.2	-154.3	0	0	0	0	116.1
538	P	47.9	Very low	48.9	Very low	69 Å²	69	120.2 Å²	120.2	45%	0.448	63%	0.626	S	S	.	*	S	Bend	trans	-93.6	-34.8	162.4	-5.4	24.3	0	0	0	114	E540 I541	P538-E540 PolarHBondContact O-N 3.42Å; P538-I541 PolarHBondContact O-N 3.09Å
539	N	56.2	Low	50.4	Low	101 Å²	101	113.1 Å²	113.1	54%	0.54	61%	0.609	S	S	.	*	H	α-helix	trans	-67.3	-32.2	-161.7	-71.4	-8.2	0	0	0	114	I541 L542 I543	N539-I541 VanDerWaalsContact C-N 3.29Å; N539-I541 PolarHBondContact O-N 3.13Å; N539-L542 PolarHBondContact O-N 3.05Å; N539-I543 WeakPolarHBondContact O-CG1 3.16Å; N539-I543 PolarHBondContact O-N 2.68Å
540	E	67.1	Low	52.2	Low	121 Å²	121	113.5 Å²	113.5	57%	0.565	60%	0.597	S	S	*	*	H	α-helix	trans	-65.8	-32.8	-179.1	-161.4	178.2	160.8	0	0	112.3	P538 I543 Q544	P538-E540 PolarHBondContact O-N 3.42Å; E540-I543 PolarHBondContact O-N 3.13Å; E540-Q544 WeakPolarHBondContact O-CB 3.31Å; E540-Q544 VanDerWaalsContact O-CG 3.29Å; E540-Q544 WeakPolarHBondContact O-CG 3.37Å; E540-Q544 PolarHBondContact O-N 3.14Å; E540-Q544 PolarHBondContact OE1-NE2 3.33Å
541	I	59.6	Low	54.2	Low	122 Å²	122	111.1 Å²	111.1	63%	0.626	59%	0.586	S	S	*	*	H	α-helix	trans	-66.9	-40.5	175.1	-57.9	176.1	0	0	0	110.4	P538 N539 Q544 A545	P538-I541 PolarHBondContact O-N 3.09Å; N539-I541 VanDerWaalsContact C-N 3.29Å; N539-I541 PolarHBondContact O-N 3.13Å; I541-Q544 PolarHBondContact O-N 3.45Å; I541-A545 VanDerWaalsContact O-CB 3.3Å; I541-A545 WeakPolarHBondContact O-CB 3.16Å; I541-A545 PolarHBondContact O-N 3.49Å
542	L	57	Low	55.6	Low	66 Å²	66	106.4 Å²	106.4	35%	0.346	57%	0.572	S	S	.	*	H	α-helix	trans	-65.6	-39.6	175.2	-78.8	164.9	0	0	0	112.2	N539 A545 K546 L670	N539-L542 PolarHBondContact O-N 3.05Å; L542-A545 PolarHBondContact O-N 3.37Å; L542-K546 PolarHBondContact O-N 2.83Å; L542-L670 HydrophobicContact CD2-CD2 3.83Å
543	I	67.7	Low	57.1	Low	114 Å²	114	100.9 Å²	100.9	59%	0.585	55%	0.554	S	S	*	*	H	α-helix	trans	-64.8	-46	176	-68.1	164.1	0	0	0	110.6	N539 E540 A545 K546 K547	N539-I543 WeakPolarHBondContact O-CG1 3.16Å; N539-I543 PolarHBondContact O-N 2.68Å; E540-I543 PolarHBondContact O-N 3.13Å; I543-A545 PolarHBondContact O-N 3.21Å; I543-K546 PolarHBondContact O-N 3.07Å; I543-K547 WeakPolarHBondContact O-CB 3.14Å; I543-K547 PolarHBondContact O-N 2.95Å
544	Q	67.9	Low	58.7	Low	116 Å²	116	94.8 Å²	94.8	54%	0.542	53%	0.528	S	S	.	.	H	α-helix	trans	-63.3	-39.8	176.2	-70.7	176.5	19	0	0	111.9	E540 I541 A548	E540-Q544 WeakPolarHBondContact O-CB 3.31Å; E540-Q544 VanDerWaalsContact O-CG 3.29Å; E540-Q544 WeakPolarHBondContact O-CG 3.37Å; E540-Q544 PolarHBondContact O-N 3.14Å; E540-Q544 PolarHBondContact OE1-NE2 3.33Å; I541-Q544 PolarHBondContact O-N 3.45Å; Q544-A548 WeakPolarHBondContact O-CB 3.4Å; Q544-A548 PolarHBondContact O-N 3.3Å
545	A	60.8	Low	60.5	Low	57 Å²	57	97 Å²	97	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-65	-44.9	176.9	0	0	0	0	0	112.8	I541 L542 I543 A548 A549	I541-A545 VanDerWaalsContact O-CB 3.3Å; I541-A545 WeakPolarHBondContact O-CB 3.16Å; I541-A545 PolarHBondContact O-N 3.49Å; L542-A545 PolarHBondContact O-N 3.37Å; I543-A545 PolarHBondContact O-N 3.21Å; A545-A548 PolarHBondContact O-N 2.96Å; A545-A549 PolarHBondContact O-N 2.65Å; A545-A549 VanDerWaalsContact O-N 3.09Å
546	K	63.9	Low	61.9	Low	97 Å²	97	94.7 Å²	94.7	42%	0.422	52%	0.516	S	S	.	.	H	α-helix	trans	-59.4	-50.1	174.8	-80.7	177	169.4	-78.9	0	111.4	L542 I543 A548 A549 E550 E676	L542-K546 PolarHBondContact O-N 2.83Å; I543-K546 PolarHBondContact O-N 3.07Å; K546-A548 VanDerWaalsContact C-N 3.34Å; K546-A548 PolarHBondContact O-N 3.48Å; K546-A549 WeakPolarHBondContact O-CB 3.22Å; K546-A549 PolarHBondContact O-N 3.06Å; K546-A549 VanDerWaalsContact O-N 3.1Å; K546-E550 PolarHBondContact O-N 2.82Å; K546-E676 IonicContact NZ-OE1 2.68Å; K546-E676 PolarHBondContact NZ-OE1 2.69Å; K546-E676 IonicContact NZ-OE2 3.2Å; K546-E676 PolarHBondContact NZ-OE2 3.12Å
547	K	73	Confident	63.3	Low	120 Å²	120	94.7 Å²	94.7	52%	0.522	51%	0.509	S	S	.	.	H	α-helix	trans	-58.7	-41.9	177.7	-178.6	172	173.3	175.1	0	112.8	I543 A549 E550 E551	I543-K547 WeakPolarHBondContact O-CB 3.14Å; I543-K547 PolarHBondContact O-N 2.95Å; K547-A549 VanDerWaalsContact C-N 3.31Å; K547-A549 PolarHBondContact O-N 3.24Å; K547-E550 PolarHBondContact O-N 2.95Å; K547-E551 WeakPolarHBondContact CE-OE1 3.38Å; K547-E551 IonicContact NZ-OE1 2.73Å; K547-E551 WeakPolarHBondContact O-CG 3.38Å; K547-E551 PolarHBondContact O-N 3.38Å
548	A	66.2	Low	64.2	Low	51 Å²	51	97.5 Å²	97.5	42%	0.421	51%	0.507	S	S	.	.	H	α-helix	trans	-65.5	-32.8	177.3	0	0	0	0	0	113	Q544 A545 K546 S552	Q544-A548 WeakPolarHBondContact O-CB 3.4Å; Q544-A548 PolarHBondContact O-N 3.3Å; A545-A548 PolarHBondContact O-N 2.96Å; K546-A548 VanDerWaalsContact C-N 3.34Å; K546-A548 PolarHBondContact O-N 3.48Å; A548-S552 WeakPolarHBondContact O-CB 3.3Å; A548-S552 PolarHBondContact O-N 2.98Å; A548-S552 VanDerWaalsContact O-N 3.16Å; A548-S552 PolarHBondContact O-OG 3.26Å
549	A	61.3	Low	65.2	Low	48 Å²	48	100.7 Å²	100.7	40%	0.397	51%	0.514	S	S	.	.	H	α-helix	trans	-69.6	-43.8	173.5	0	0	0	0	0	111.8	A545 K546 K547 S552 A553	A545-A549 PolarHBondContact O-N 2.65Å; A545-A549 VanDerWaalsContact O-N 3.09Å; K546-A549 WeakPolarHBondContact O-CB 3.22Å; K546-A549 PolarHBondContact O-N 3.06Å; K546-A549 VanDerWaalsContact O-N 3.1Å; K547-A549 VanDerWaalsContact C-N 3.31Å; K547-A549 PolarHBondContact O-N 3.24Å; A549-S552 PolarHBondContact O-N 2.98Å; A549-A553 WeakPolarHBondContact O-CB 3.45Å; A549-A553 PolarHBondContact O-N 3.28Å
550	E	68.2	Low	65.2	Low	132 Å²	132	99.5 Å²	99.5	62%	0.617	50%	0.502	S	S	*	.	H	α-helix	trans	-60.4	-48.5	175.7	-70.4	174.8	167.7	0	0	112.3	K546 K547 S552 A553 A554	K546-E550 PolarHBondContact O-N 2.82Å; K547-E550 PolarHBondContact O-N 2.95Å; E550-S552 VanDerWaalsContact C-N 3.28Å; E550-S552 PolarHBondContact O-N 2.81Å; E550-A553 PolarHBondContact O-N 3.08Å; E550-A554 WeakPolarHBondContact O-CB 3.35Å; E550-A554 PolarHBondContact O-N 3.06Å
551	E	71.2	Confident	64.7	Low	117 Å²	117	99.5 Å²	99.5	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-60.3	-38.1	176.3	-74	-179.5	-170.6	0	0	111.9	K547 K555	K547-E551 WeakPolarHBondContact CE-OE1 3.38Å; K547-E551 IonicContact NZ-OE1 2.73Å; K547-E551 WeakPolarHBondContact O-CG 3.38Å; K547-E551 PolarHBondContact O-N 3.38Å; E551-K555 VanDerWaalsContact O-CB 3.25Å; E551-K555 WeakPolarHBondContact O-CB 3.38Å; E551-K555 PolarHBondContact O-N 2.62Å
552	S	58.8	Low	64.2	Low	71 Å²	71	102 Å²	102	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-68	-42.2	176.7	-61.3	0	0	0	0	112.3	A548 A549 E550 K555 L556	A548-S552 WeakPolarHBondContact O-CB 3.3Å; A548-S552 PolarHBondContact O-N 2.98Å; A548-S552 VanDerWaalsContact O-N 3.16Å; A548-S552 PolarHBondContact O-OG 3.26Å; A549-S552 PolarHBondContact O-N 2.98Å; E550-S552 VanDerWaalsContact C-N 3.28Å; E550-S552 PolarHBondContact O-N 2.81Å; S552-K555 PolarHBondContact O-N 2.85Å; S552-L556 PolarHBondContact O-N 3.35Å
553	A	61.9	Low	64.1	Low	41 Å²	41	102.7 Å²	102.7	34%	0.339	51%	0.512	S	S	.	.	H	α-helix	trans	-66.9	-43.1	176.8	0	0	0	0	0	112	A549 E550 K555 L556 K557	A549-A553 WeakPolarHBondContact O-CB 3.45Å; A549-A553 PolarHBondContact O-N 3.28Å; E550-A553 PolarHBondContact O-N 3.08Å; A553-K555 VanDerWaalsContact C-N 3.31Å; A553-K555 PolarHBondContact O-N 2.93Å; A553-L556 PolarHBondContact O-N 2.97Å; A553-K557 PolarHBondContact O-N 3.33Å
554	A	68	Low	63	Low	39 Å²	39	99.3 Å²	99.3	32%	0.322	50%	0.501	S	S	.	.	H	α-helix	trans	-62.9	-38.1	175.3	0	0	0	0	0	112	E550 K557 R558	E550-A554 WeakPolarHBondContact O-CB 3.35Å; E550-A554 PolarHBondContact O-N 3.06Å; A554-K557 PolarHBondContact O-N 3.34Å; A554-R558 WeakPolarHBondContact O-CG 3.42Å; A554-R558 PolarHBondContact O-N 3.21Å; A554-R558 VanDerWaalsContact O-N 3.1Å
555	K	71.9	Confident	61.8	Low	159 Å²	159	98.4 Å²	98.4	69%	0.691	51%	0.507	S	S	*	.	H	α-helix	trans	-67.5	-35.6	174.8	-174	176.9	-178.2	179.7	0	112.7	E551 S552 A553 K559	E551-K555 VanDerWaalsContact O-CB 3.25Å; E551-K555 WeakPolarHBondContact O-CB 3.38Å; E551-K555 PolarHBondContact O-N 2.62Å; S552-K555 PolarHBondContact O-N 2.85Å; A553-K555 VanDerWaalsContact C-N 3.31Å; A553-K555 PolarHBondContact O-N 2.93Å; K555-K559 WeakPolarHBondContact O-CB 3.49Å; K555-K559 PolarHBondContact O-N 2.9Å
556	L	62.4	Low	60.7	Low	88 Å²	88	99.5 Å²	99.5	46%	0.461	51%	0.511	S	S	.	.	H	α-helix	trans	-66.4	-48	172	-80.2	168.7	0	0	0	111.4	S552 A553 R558 K559 Y560	S552-L556 PolarHBondContact O-N 3.35Å; A553-L556 PolarHBondContact O-N 2.97Å; L556-R558 PolarHBondContact O-N 3.25Å; L556-K559 PolarHBondContact O-N 3.49Å; L556-K559 VanDerWaalsContact O-N 3.1Å; L556-Y560 HydrophobicContact CD2-CD2 4.41Å; L556-Y560 HydrophobicContact CD2-CE2 3.98Å; L556-Y560 WeakPolarHBondContact O-CD2 3.27Å; L556-Y560 PolarHBondContact O-N 2.87Å
557	K	67.1	Low	59.6	Low	138 Å²	138	103.7 Å²	103.7	60%	0.6	53%	0.532	S	S	*	.	H	α-helix	trans	-53.5	-54.6	176.9	-73.7	-169.9	174.2	-168.4	0	111.8	A553 A554 K559 Y560 E561	A553-K557 PolarHBondContact O-N 3.33Å; A554-K557 PolarHBondContact O-N 3.34Å; K557-K559 PolarHBondContact O-N 3.48Å; K557-K559 VanDerWaalsContact O-N 3.14Å; K557-Y560 PolarHBondContact O-N 3.37Å; K557-E561 WeakPolarHBondContact O-CB 3.35Å; K557-E561 PolarHBondContact O-N 2.88Å
558	R	70.5	Confident	57.9	Low	181 Å²	181	103.6 Å²	103.6	68%	0.683	55%	0.547	S	S	*	.	H	α-helix	trans	-57.6	-29.3	177.6	-70.5	178.1	-176.8	141.5	-0.1	114.8	A554 L556 E561	A554-R558 WeakPolarHBondContact O-CG 3.42Å; A554-R558 PolarHBondContact O-N 3.21Å; A554-R558 VanDerWaalsContact O-N 3.1Å; L556-R558 PolarHBondContact O-N 3.25Å; R558-E561 WeakPolarHBondContact CA-OE2 3.36Å
559	K	69.3	Low	56.6	Low	136 Å²	136	108.2 Å²	108.2	59%	0.591	57%	0.565	S	S	*	*	H	α-helix	trans	-76.6	-28.5	179.4	-168.8	-170.9	171.2	-150	0	112.6	K555 L556 K557	K555-K559 WeakPolarHBondContact O-CB 3.49Å; K555-K559 PolarHBondContact O-N 2.9Å; L556-K559 PolarHBondContact O-N 3.49Å; L556-K559 VanDerWaalsContact O-N 3.1Å; K557-K559 PolarHBondContact O-N 3.48Å; K557-K559 VanDerWaalsContact O-N 3.14Å
560	Y	55.3	Low	55.7	Low	76 Å²	76	114.9 Å²	114.9	30%	0.298	59%	0.594	S	S	.	*	H	α-helix	trans	-112.4	-7.2	-174.6	-67.6	-78.3	0	0	0	114	L556 K557 F562 I563 P575	L556-Y560 HydrophobicContact CD2-CD2 4.41Å; L556-Y560 HydrophobicContact CD2-CE2 3.98Å; L556-Y560 WeakPolarHBondContact O-CD2 3.27Å; L556-Y560 PolarHBondContact O-N 2.87Å; K557-Y560 PolarHBondContact O-N 3.37Å; Y560-F562 VanDerWaalsContact C-N 3.29Å; Y560-F562 PolarHBondContact O-N 2.81Å; Y560-I563 HydrophobicContact CD1-CD1 3.8Å; Y560-I563 HydrophobicContact CE1-CD1 4.25Å; Y560-I563 PolarHBondContact O-N 3.36Å; Y560-P575 HydrophobicContact CE2-CG 4.41Å
561	E	56	Low	54.6	Low	121 Å²	121	116.4 Å²	116.4	57%	0.565	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-51.1	-42.8	176.7	-105	164.3	167.1	0	0	113.4	K557 R558 I563	K557-E561 WeakPolarHBondContact O-CB 3.35Å; K557-E561 PolarHBondContact O-N 2.88Å; R558-E561 WeakPolarHBondContact CA-OE2 3.36Å; E561-I563 VanDerWaalsContact C-N 3.31Å; E561-I563 PolarHBondContact O-N 2.91Å
562	F	50.3	Low	53.2	Low	174 Å²	174	114.9 Å²	114.9	76%	0.763	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-77.8	-7.4	-179.7	-72.6	-86.8	0	0	0	115.2	Y560 S565	Y560-F562 VanDerWaalsContact C-N 3.29Å; Y560-F562 PolarHBondContact O-N 2.81Å; F562-S565 PolarHBondContact O-OG 2.94Å
563	I	53.5	Low	52.5	Low	81 Å²	81	118 Å²	118	42%	0.415	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-93.3	-15.2	179.3	-66.4	165.1	0	0	0	110.8	Y560 E561 I573	Y560-I563 HydrophobicContact CD1-CD1 3.8Å; Y560-I563 HydrophobicContact CE1-CD1 4.25Å; Y560-I563 PolarHBondContact O-N 3.36Å; E561-I563 VanDerWaalsContact C-N 3.31Å; E561-I563 PolarHBondContact O-N 2.91Å; I563-I573 HydrophobicContact CG2-CG2 4.46Å
564	A	44.9	Very low	52	Low	43 Å²	43	117.6 Å²	117.6	36%	0.355	60%	0.6	S	S	.	*	S	Bend	trans	-89.1	-1	-179.6	0	0	0	0	0	114.5
565	S	42.5	Very low	51.2	Low	97 Å²	97	119.1 Å²	119.1	68%	0.678	61%	0.607	S	S	*	*	S	Bend	trans	-98.8	3.9	-172.7	51.4	0	0	0	0	115.2	F562	F562-S565 PolarHBondContact O-OG 2.94Å
566	S	38.7	Very low	50.4	Low	79 Å²	79	117.8 Å²	117.8	55%	0.552	60%	0.601	S	S	*	*	S	Bend	trans	-121.7	133.1	-178.1	54.6	0	0	0	0	112.3
567	E	41.4	Very low	50.3	Low	185 Å²	185	117 Å²	117	86%	0.864	60%	0.597	S	S	*	*			trans	72.7	131.3	171	-55.9	-170.6	164.3	0	0	118.1	N569	E567-N569 PolarHBondContact O-N 3.02Å; E567-N569 VanDerWaalsContact O-N 3.13Å
568	S	36.3	Very low	50.3	Low	119 Å²	119	114.2 Å²	114.2	83%	0.832	59%	0.587	S	S	*	*	S	Bend	trans	-87.1	74.3	-174.8	57.6	0	0	0	0	112.4
569	N	40.1	Very low	49.9	Very low	148 Å²	148	107.2 Å²	107.2	79%	0.791	57%	0.565	S	S	*	*			trans	-143.9	137.6	162.5	-90	-54.6	0	0	0	110.5	E567 E571	E567-N569 PolarHBondContact O-N 3.02Å; E567-N569 VanDerWaalsContact O-N 3.13Å; N569-E571 PolarHBondContact O-N 3.25Å
570	N	41	Very low	50.1	Low	188 Å²	188	104.3 Å²	104.3	100%	1.005	56%	0.555	S	S	*	*			trans	-77.4	39.2	-173.9	-78	-26.8	0	0	0	113.9
571	E	44.8	Very low	50.8	Low	163 Å²	163	102.9 Å²	102.9	76%	0.762	55%	0.553	S	S	*	*			trans	-114.7	118.9	-177.9	-168	136.7	-123.7	0	0	111.3	N569 I573	N569-E571 PolarHBondContact O-N 3.25Å; E571-I573 PolarHBondContact O-N 3.36Å; E571-I573 VanDerWaalsContact O-N 3.14Å
572	Y	43.5	Very low	51.6	Low	86 Å²	86	98.8 Å²	98.8	34%	0.337	54%	0.538	S	S	.	.			trans	-74.4	103.6	-168	173.1	-100	0	0	0	112.7	G574 P575 K576	Y572-G574 VanDerWaalsContact C-N 3.34Å; Y572-G574 WeakPolarHBondContact CE1-O 3.48Å; Y572-G574 PolarHBondContact O-N 3.33Å; Y572-G574 VanDerWaalsContact O-N 3.07Å; Y572-P575 PolarHBondContact OH-O 2.92Å; Y572-K576 HydrophobicContact CD1-CD 4.39Å; Y572-K576 HydrophobicContact CD1-CG 3.55Å; Y572-K576 HydrophobicContact CE1-CB 4.34Å; Y572-K576 HydrophobicContact CE1-CG 3.56Å
573	I	43.8	Very low	52.7	Low	136 Å²	136	94.8 Å²	94.8	70%	0.697	53%	0.531	S	S	*	.			trans	-80.5	77.4	173.2	-52.2	-179.6	0	0	0	109.6	I563 E571	I563-I573 HydrophobicContact CG2-CG2 4.46Å; E571-I573 PolarHBondContact O-N 3.36Å; E571-I573 VanDerWaalsContact O-N 3.14Å
574	G	49.7	Very low	53.4	Low	33 Å²	33	94.8 Å²	94.8	34%	0.34	53%	0.532	S	S	.	.	S	Bend	trans	-174.5	174.9	179.1	0	0	0	0	0	115.3	Y572 K576	Y572-G574 VanDerWaalsContact C-N 3.34Å; Y572-G574 WeakPolarHBondContact CE1-O 3.48Å; Y572-G574 PolarHBondContact O-N 3.33Å; Y572-G574 VanDerWaalsContact O-N 3.07Å; G574-K576 PolarHBondContact O-N 3.04Å
575	P	51.3	Low	54.4	Low	71 Å²	71	100.4 Å²	100.4	46%	0.461	55%	0.551	S	S	.	*			trans	-76.1	114.7	175	30.3	-32.1	0	0	0	110.5	Y560 Y572	Y560-P575 HydrophobicContact CE2-CG 4.41Å; Y572-P575 PolarHBondContact OH-O 2.92Å
576	K	56.6	Low	55.7	Low	131 Å²	131	97.7 Å²	97.7	57%	0.57	54%	0.539	S	S	*	.			trans	-74.6	126.2	-179	-66.9	179.1	-178.3	177.3	0	110.4	Y572 G574	Y572-K576 HydrophobicContact CD1-CD 4.39Å; Y572-K576 HydrophobicContact CD1-CG 3.55Å; Y572-K576 HydrophobicContact CE1-CB 4.34Å; Y572-K576 HydrophobicContact CE1-CG 3.56Å; G574-K576 PolarHBondContact O-N 3.04Å
577	I	58.9	Low	57.1	Low	72 Å²	72	97.4 Å²	97.4	37%	0.369	53%	0.528	S	S	.	.			trans	-86.9	130.8	175.4	-54.9	-174.5	0	0	0	109.1	C593 A596	I577-C593 HydrophobicContact CB-CB 4.05Å; I577-C593 HydrophobicContact CG2-CB 3.89Å; I577-C593 WeakPolarHBondContact O-CB 3.5Å; I577-C593 PolarHBondContact O-N 3.29Å; I577-A596 HydrophobicContact CB-CB 3.57Å; I577-A596 HydrophobicContact CD1-CB 3.74Å; I577-A596 HydrophobicContact CG1-CB 3.8Å; I577-A596 HydrophobicContact CG2-CB 4.41Å
578	M	68.7	Low	58.5	Low	78 Å²	78	88.8 Å²	88.8	38%	0.384	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	139.4	180	-59.4	-62.1	-67.4	0	0	110.3	A590 E592 Y629	M578-A590 HydrophobicContact CE-CB 4.12Å; M578-E592 HydrophobicContact SD-CB 4.13Å; M578-E592 HydrophobicContact SD-CG 4.45Å; M578-Y629 HydrophobicContact CE-CD2 3.51Å; M578-Y629 HydrophobicContact CE-CE2 3.59Å
579	C	61	Low	60.3	Low	34 Å²	34	83.3 Å²	83.3	23%	0.23	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	146.9	174.6	-67.4	0	0	0	0	110.6	A590 V591 C593	C579-A590 WeakPolarHBondContact O-CA 3.06Å; C579-V591 PolarHBondContact N-O 2.9Å; C579-V591 PolarHBondContact O-N 3.34Å; C579-C593 VanDerWaalsContact SG-CB 3.53Å; C579-C593 VanDerWaalsContact SG-SG 3.65Å
580	L	74.6	Confident	61.7	Low	75 Å²	75	76.9 Å²	76.9	39%	0.393	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	113.6	172.4	-64.3	173.6	0	0	0	110.6	I588 A590 V631 Y633	L580-I588 HydrophobicContact CB-CG2 4.35Å; L580-I588 HydrophobicContact CD2-CG2 4.05Å; L580-A590 HydrophobicContact CD2-CB 4.45Å; L580-V631 HydrophobicContact CD2-CG2 4.01Å; L580-Y633 VanDerWaalsContact CD1-OH 3.27Å; L580-Y633 WeakPolarHBondContact CD1-OH 2.9Å
581	N	69.5	Low	63.1	Low	46 Å²	46	69.5 Å²	69.5	25%	0.246	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	108.3	171.1	172.5	26.1	0	0	0	109.9	S583 S589 V591	N581-S583 VanDerWaalsContact OD1-CB 3.23Å; N581-S583 WeakPolarHBondContact OD1-CB 3.42Å; N581-S583 PolarHBondContact OD1-N 3.05Å; N581-S583 VanDerWaalsContact OD1-N 3.13Å; N581-S583 PolarHBondContact OD1-OG 3.37Å; N581-S589 WeakPolarHBondContact CA-O 3.44Å; N581-S589 WeakPolarHBondContact CB-O 3.32Å; N581-S589 PolarHBondContact N-O 3.2Å; N581-S589 PolarHBondContact ND2-OG 3.43Å; N581-S589 PolarHBondContact O-N 3.27Å; N581-S589 VanDerWaalsContact O-N 3.08Å; N581-V591 HydrophobicContact CB-CG2 3.78Å
582	C	73	Confident	64.1	Low	36 Å²	36	64.3 Å²	64.3	24%	0.243	35%	0.354	C	S	.	.			trans	-109.3	29.5	176.8	-53.7	0	0	0	0	112.1	N584 T642	C582-N584 VanDerWaalsContact C-N 3.31Å; C582-T642 HydrophobicContact CB-CG2 4.35Å
583	S	72.8	Confident	65	Low	89 Å²	89	60.6 Å²	60.6	62%	0.622	34%	0.341	S	S	*	.			trans	-72.3	-25.1	-177.2	-53.2	0	0	0	0	113.2	N581	N581-S583 VanDerWaalsContact OD1-CB 3.23Å; N581-S583 WeakPolarHBondContact OD1-CB 3.42Å; N581-S583 PolarHBondContact OD1-N 3.05Å; N581-S583 VanDerWaalsContact OD1-N 3.13Å; N581-S583 PolarHBondContact OD1-OG 3.37Å
584	N	67.9	Low	65.7	Low	81 Å²	81	58 Å²	58	43%	0.433	33%	0.333	S	S	.	.	S	Bend	trans	-90.9	132.6	179.2	-68.2	-1.2	0	0	0	109.8	C582 G586 E587 T642	C582-N584 VanDerWaalsContact C-N 3.31Å; N584-G586 PolarHBondContact O-N 3.18Å; N584-E587 HydrophobicContact CB-CB 3.94Å; N584-E587 PolarHBondContact ND2-OE2 2.87Å; N584-E587 PolarHBondContact O-N 3.06Å; N584-E587 VanDerWaalsContact O-O 3.14Å; N584-T642 WeakPolarHBondContact O-CB 3.34Å; N584-T642 WeakPolarHBondContact O-CG2 3.48Å
585	Q	66.4	Low	65.7	Low	161 Å²	161	61.8 Å²	61.8	75%	0.752	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	126.6	172.7	-67.2	-175	8.2	0	0	109.8
586	G	69.2	Low	65.5	Low	41 Å²	41	59.6 Å²	59.6	42%	0.423	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	3.4	-177.7	0	0	0	0	0	115.9	N584 I638 T642	N584-G586 PolarHBondContact O-N 3.18Å; G586-I638 VanDerWaalsContact C-CG2 3.43Å; G586-I638 WeakPolarHBondContact O-CG2 3.43Å; G586-T642 PolarHBondContact N-OG1 2.91Å
587	E	68.1	Low	65	Low	73 Å²	73	60 Å²	60	34%	0.341	33%	0.326	S	S	.	.			trans	-139.1	138.8	-178.3	-179.4	178.5	-134.8	0	0	112.6	N584 N630 T642	N584-E587 HydrophobicContact CB-CB 3.94Å; N584-E587 PolarHBondContact ND2-OE2 2.87Å; N584-E587 PolarHBondContact O-N 3.06Å; N584-E587 VanDerWaalsContact O-O 3.14Å; E587-N630 PolarHBondContact OE1-ND2 2.91Å; E587-T642 WeakPolarHBondContact O-CG2 3.45Å
588	I	70.9	Confident	64	Low	4 Å²	4	60.2 Å²	60.2	2%	0.021	33%	0.334	C	S	.	.			trans	-125.5	123.4	174.1	-57	169.7	0	0	0	108.3	L580 V631 Y633 I638 L641 T642	L580-I588 HydrophobicContact CB-CG2 4.35Å; L580-I588 HydrophobicContact CD2-CG2 4.05Å; I588-V631 HydrophobicContact CG2-CB 4.39Å; I588-V631 PolarHBondContact O-N 3.25Å; I588-Y633 HydrophobicContact CB-CD2 4.23Å; I588-Y633 HydrophobicContact CB-CE2 4.41Å; I588-Y633 HydrophobicContact CD1-CD2 3.57Å; I588-Y633 HydrophobicContact CD1-CE2 4.04Å; I588-Y633 HydrophobicContact CD1-CG 4.14Å; I588-Y633 HydrophobicContact CG1-CD2 4.49Å; I588-Y633 HydrophobicContact CG2-CD2 4.24Å; I588-Y633 HydrophobicContact CG2-CE2 3.91Å; I588-I638 HydrophobicContact CD1-CG1 4.29Å; I588-L641 HydrophobicContact CD1-CB 3.9Å; I588-L641 HydrophobicContact CD1-CD1 3.67Å; I588-L641 HydrophobicContact CD1-CG 4.44Å; I588-T642 HydrophobicContact CD1-CG2 4.43Å; I588-T642 HydrophobicContact CG1-CG2 3.79Å
589	S	74.2	Confident	62.7	Low	4 Å²	4	60.7 Å²	60.7	3%	0.028	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	147	176.6	51.9	0	0	0	0	110.5	N581 Y629	N581-S589 WeakPolarHBondContact CA-O 3.44Å; N581-S589 WeakPolarHBondContact CB-O 3.32Å; N581-S589 PolarHBondContact N-O 3.2Å; N581-S589 PolarHBondContact ND2-OG 3.43Å; N581-S589 PolarHBondContact O-N 3.27Å; N581-S589 VanDerWaalsContact O-N 3.08Å; S589-Y629 CarbonylContact C-O 3.58Å; S589-Y629 WeakPolarHBondContact CA-O 3.37Å
590	A	70.8	Confident	61.4	Low	13 Å²	13	65.4 Å²	65.4	11%	0.107	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.6	169.8	0	0	0	0	0	110.1	M578 C579 L580 Y629 V631	M578-A590 HydrophobicContact CE-CB 4.12Å; C579-A590 WeakPolarHBondContact O-CA 3.06Å; L580-A590 HydrophobicContact CD2-CB 4.45Å; A590-Y629 PolarHBondContact N-O 3.12Å; A590-Y629 PolarHBondContact O-N 3.25Å; A590-Y629 VanDerWaalsContact O-N 3.17Å; A590-V631 HydrophobicContact CB-CG2 3.84Å
591	V	68.7	Low	59.4	Low	32 Å²	32	69.2 Å²	69.2	19%	0.194	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	141.2	-176	-177.7	0	0	0	0	108.9	C579 N581 C593	C579-V591 PolarHBondContact N-O 2.9Å; C579-V591 PolarHBondContact O-N 3.34Å; N581-V591 HydrophobicContact CB-CG2 3.78Å; V591-C593 PolarHBondContact O-N 3.32Å
592	E	67	Low	57.6	Low	54 Å²	54	72.4 Å²	72.4	25%	0.252	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	132.4	-180	-165.4	-168.5	151	0	0	112	M578 P594 R597	M578-E592 HydrophobicContact SD-CB 4.13Å; M578-E592 HydrophobicContact SD-CG 4.45Å; E592-P594 VanDerWaalsContact O-CD 3.3Å; E592-P594 WeakPolarHBondContact O-CD 3.48Å; E592-R597 VanDerWaalsContact CD-NH2 3.28Å; E592-R597 IonicContact OE1-CZ 2.76Å; E592-R597 IonicContact OE1-NE 2.86Å; E592-R597 PolarHBondContact OE1-NE 2.92Å; E592-R597 IonicContact OE1-NH2 3.63Å; E592-R597 PolarHBondContact OE1-NH2 2.84Å; E592-R597 IonicContact OE2-CZ 3.79Å; E592-R597 IonicContact OE2-NE 3.2Å; E592-R597 IonicContact OE2-NH2 2.62Å; E592-R597 PolarHBondContact OE2-NH2 3.12Å
593	C	61	Low	55.6	Low	8 Å²	8	79.2 Å²	79.2	5%	0.054	44%	0.442	C	S	.	.			trans	-70.5	115.9	-177.6	-176.8	0	0	0	0	111.4	I577 C579 V591 K595 A596	I577-C593 HydrophobicContact CB-CB 4.05Å; I577-C593 HydrophobicContact CG2-CB 3.89Å; I577-C593 WeakPolarHBondContact O-CB 3.5Å; I577-C593 PolarHBondContact O-N 3.29Å; C579-C593 VanDerWaalsContact SG-CB 3.53Å; C579-C593 VanDerWaalsContact SG-SG 3.65Å; V591-C593 PolarHBondContact O-N 3.32Å; C593-K595 VanDerWaalsContact C-N 3.3Å; C593-K595 PolarHBondContact O-N 2.95Å; C593-A596 HydrophobicContact CB-CB 3.81Å; C593-A596 WeakPolarHBondContact O-CB 3.04Å; C593-A596 PolarHBondContact O-N 3.31Å; C593-A596 VanDerWaalsContact O-N 3.14Å
594	P	59	Low	53.6	Low	81 Å²	81	82.8 Å²	82.8	53%	0.526	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-60.6	-38.5	-176.7	-24.5	35.1	0	0	0	113.1	E592 A596 R597	E592-P594 VanDerWaalsContact O-CD 3.3Å; E592-P594 WeakPolarHBondContact O-CD 3.48Å; P594-A596 VanDerWaalsContact C-N 3.26Å; P594-A596 PolarHBondContact O-N 2.94Å; P594-R597 PolarHBondContact O-N 3.37Å
595	K	49.9	Very low	51.7	Low	113 Å²	113	89.4 Å²	89.4	49%	0.491	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-75.2	-9.2	-178.9	-64.9	-172.3	177.7	-177.4	0	114.8	C593 D675	C593-K595 VanDerWaalsContact C-N 3.3Å; C593-K595 PolarHBondContact O-N 2.95Å; K595-D675 WeakPolarHBondContact CD-O 3.25Å; K595-D675 WeakPolarHBondContact CE-O 3.49Å; K595-D675 VanDerWaalsContact CE-OD1 3.3Å; K595-D675 WeakPolarHBondContact CE-OD1 3.14Å; K595-D675 WeakPolarHBondContact CE-OD2 3.37Å; K595-D675 VanDerWaalsContact NZ-CB 3.33Å; K595-D675 PolarHBondContact NZ-O 3.39Å; K595-D675 IonicContact NZ-OD1 3.65Å; K595-D675 IonicContact NZ-OD2 3.31Å; K595-D675 PolarHBondContact NZ-OD2 3Å
596	A	47.4	Very low	50	Low	26 Å²	26	87 Å²	87	22%	0.215	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-86.6	-15.9	176.6	0	0	0	0	0	113	I577 C593 P594 S598	I577-A596 HydrophobicContact CB-CB 3.57Å; I577-A596 HydrophobicContact CD1-CB 3.74Å; I577-A596 HydrophobicContact CG1-CB 3.8Å; I577-A596 HydrophobicContact CG2-CB 4.41Å; C593-A596 HydrophobicContact CB-CB 3.81Å; C593-A596 WeakPolarHBondContact O-CB 3.04Å; C593-A596 PolarHBondContact O-N 3.31Å; C593-A596 VanDerWaalsContact O-N 3.14Å; P594-A596 VanDerWaalsContact C-N 3.26Å; P594-A596 PolarHBondContact O-N 2.94Å; A596-S598 PolarHBondContact O-N 3.24Å
597	R	46	Very low	48	Very low	138 Å²	138	92.7 Å²	92.7	52%	0.521	49%	0.488	S	S	.	.	S	Bend	trans	-68.7	120.9	173.3	-67.4	-176.3	169.7	-163.5	-4.4	109.4	E592 P594 S599	E592-R597 VanDerWaalsContact CD-NH2 3.28Å; E592-R597 IonicContact OE1-CZ 2.76Å; E592-R597 IonicContact OE1-NE 2.86Å; E592-R597 PolarHBondContact OE1-NE 2.92Å; E592-R597 IonicContact OE1-NH2 3.63Å; E592-R597 PolarHBondContact OE1-NH2 2.84Å; E592-R597 IonicContact OE2-CZ 3.79Å; E592-R597 IonicContact OE2-NE 3.2Å; E592-R597 IonicContact OE2-NH2 2.62Å; E592-R597 PolarHBondContact OE2-NH2 3.12Å; P594-R597 PolarHBondContact O-N 3.37Å; R597-S599 PolarHBondContact O-N 3.32Å
598	S	38.3	Very low	46.3	Very low	77 Å²	77	97.5 Å²	97.5	54%	0.538	52%	0.515	S	S	.	.			trans	-73.8	71.3	168.7	51.3	0	0	0	0	109.9	A596 I600	A596-S598 PolarHBondContact O-N 3.24Å; S598-I600 PolarHBondContact O-N 2.95Å
599	S	40.4	Very low	44.2	Very low	88 Å²	88	101.9 Å²	101.9	62%	0.615	55%	0.546	S	S	*	.			trans	-71	108.8	178.5	54.7	0	0	0	0	110.8	R597 N601	R597-S599 PolarHBondContact O-N 3.32Å; S599-N601 PolarHBondContact O-N 3.44Å
600	I	35.1	Very low	42	Very low	134 Å²	134	108.6 Å²	108.6	69%	0.687	58%	0.581	S	S	*	*	S	Bend	trans	-69.9	76	162	-56.4	172.5	0	0	0	107.4	S598	S598-I600 PolarHBondContact O-N 2.95Å
601	N	31.9	Very low	40.1	Very low	154 Å²	154	118.8 Å²	118.8	82%	0.824	62%	0.619	S	S	*	*			trans	-174.3	81.8	169.7	-99.4	-21.3	0	0	0	109.3	S599	S599-N601 PolarHBondContact O-N 3.44Å
602	S	31.8	Very low	38.2	Very low	113 Å²	113	124 Å²	124	79%	0.79	65%	0.646	S	S	*	*			trans	-155.9	49.9	171.4	-161	0	0	0	0	111.3
603	Q	30.9	Very low	36.5	Very low	179 Å²	179	128.9 Å²	128.9	84%	0.836	67%	0.673	S	S	*	*			trans	-129.4	136.7	166.1	-69.8	-173.2	-8.4	0	0	107.9
604	H	30	Very low	35	Very low	165 Å²	165	134.9 Å²	134.9	76%	0.764	71%	0.705	S	S	*	*			trans	62.8	131.2	-153.1	-47.4	-81.8	0	0	0	111.4
605	Y	29.4	Very low	33.6	Very low	219 Å²	219	138 Å²	138	86%	0.859	72%	0.717	S	S	*	*			cis	-127.3	152.6	30.7	-75	-99.2	0	0	0	114.2
606	P	29.4	Very low	32.6	Very low	110 Å²	110	140.6 Å²	140.6	71%	0.714	74%	0.735	S	S	*	*			trans	-80.5	163.6	167.2	35.4	-35	0	0	0	112.5
607	N	26.9	Very low	31.8	Very low	161 Å²	161	144 Å²	144	86%	0.861	76%	0.757	S	S	*	*			trans	-41.7	129.5	-179.5	-57.1	-37.5	0	0	0	115.4
608	L	32.9	Very low	31	Very low	174 Å²	174	146.3 Å²	146.3	91%	0.911	77%	0.774	S	S	*	*			trans	-145.4	112.3	146	-147.9	73.9	0	0	0	111.2
609	S	27.1	Very low	30.5	Very low	97 Å²	97	149.6 Å²	149.6	68%	0.678	79%	0.785	S	S	*	*			trans	-84.1	154.7	171.7	53.2	0	0	0	0	111.3
610	N	28.3	Very low	30.1	Very low	144 Å²	144	153.9 Å²	153.9	77%	0.77	80%	0.795	S	S	*	*			trans	68.5	108.8	177.9	-52.4	-23.5	0	0	0	114.9
611	Y	31.6	Very low	29.8	Very low	228 Å²	228	157 Å²	157	89%	0.894	81%	0.807	S	S	*	*				-160.5	134.5	103.4	-108.7	-76.9	0	0	0	109.8
612	N	28.1	Very low	29.7	Very low	142 Å²	142	155 Å²	155	76%	0.759	81%	0.806	S	S	*	*			trans	-77.2	140.4	163	-64.8	-21.5	0	0	0	108.5
613	N	30.2	Very low	29.5	Very low	156 Å²	156	155.3 Å²	155.3	83%	0.834	81%	0.807	S	S	*	*				179.9	159.4	124.4	-88.2	-12.6	0	0	0	111.5
614	D	29.7	Very low	29.6	Very low	134 Å²	134	156.1 Å²	156.1	72%	0.717	81%	0.808	S	S	*	*			trans	-74	155.2	-166.8	-47.1	-78.5	0	0	0	115.2
615	N	29.5	Very low	29.9	Very low	147 Å²	147	154.4 Å²	154.4	79%	0.786	81%	0.812	S	S	*	*			trans	68	121.1	164.4	-45.9	-72.3	0	0	0	117.5
616	I	30.4	Very low	30.6	Very low	167 Å²	167	152.8 Å²	152.8	86%	0.856	80%	0.804	S	S	*	*				-171	143.5	113	-95.4	154.9	0	0	0	110.1
617	S	30.3	Very low	31.4	Very low	98 Å²	98	151.1 Å²	151.1	69%	0.685	79%	0.794	S	S	*	*			trans	-19.1	126.9	-177.6	55.8	0	0	0	0	120
618	E	28.6	Very low	32.7	Very low	185 Å²	185	148.1 Å²	148.1	86%	0.864	78%	0.777	S	S	*	*			trans	-58.3	149.5	146.2	-53.4	173.1	138.2	0	0	110.7
619	N	28.5	Very low	33.8	Very low	147 Å²	147	146.2 Å²	146.2	79%	0.786	76%	0.759	S	S	*	*			trans	-165.1	147.5	155	-111.4	-23.5	0	0	0	114.3
620	E	31.1	Very low	35.3	Very low	177 Å²	177	147.2 Å²	147.2	83%	0.827	76%	0.757	S	S	*	*	S	Bend	trans	61.4	59.4	155.8	-59.5	-168.6	-176.4	0	0	121.1
621	E	30.2	Very low	36.7	Very low	199 Å²	199	142.4 Å²	142.4	93%	0.93	73%	0.733	S	S	*	*			trans	-144.4	49.1	144	-150.7	178.8	-158.4	0	0	113.9
622	S	28.7	Very low	38.3	Very low	114 Å²	114	137.4 Å²	137.4	80%	0.797	73%	0.731	S	S	*	*			trans	-133.8	77.8	-173.1	63.8	0	0	0	0	114.3
623	S	28.6	Very low	40	Very low	118 Å²	118	132.1 Å²	132.1	83%	0.825	70%	0.7	S	S	*	*			trans	-145.5	20.8	-178.8	62.5	0	0	0	0	117
624	K	32.3	Very low	42	Very low	196 Å²	196	127.6 Å²	127.6	85%	0.852	68%	0.68	S	S	*	*	S	Bend	trans	-129.2	128.4	162.8	-73.9	-175.8	178.9	176.5	0	110.7	R626	K624-R626 PolarHBondContact O-N 3.36Å
625	P	35.9	Very low	43.7	Very low	129 Å²	129	125.7 Å²	125.7	84%	0.838	68%	0.675	S	S	*	*			trans	-67.9	130.2	177.2	28.3	-33.4	0	0	0	110.1
626	R	44.3	Very low	45.4	Very low	185 Å²	185	125.6 Å²	125.6	70%	0.698	67%	0.668	S	S	*	*			trans	-69.1	136.2	168.5	-62.8	-175.4	-175.3	-173.8	3	108.3	K624 N628	K624-R626 PolarHBondContact O-N 3.36Å; R626-N628 PolarHBondContact O-N 2.98Å
627	P	47	Very low	46.8	Very low	76 Å²	76	120.3 Å²	120.3	49%	0.494	64%	0.641	S	S	.	*			trans	-71.5	102.3	176.6	29.1	-33.4	0	0	0	109.7	Y629	P627-Y629 HydrophobicContact CB-CD2 4.43Å; P627-Y629 HydrophobicContact CB-CE1 4.5Å; P627-Y629 HydrophobicContact CB-CE2 3.73Å; P627-Y629 HydrophobicContact CG-CE2 3.83Å; P627-Y629 VanDerWaalsContact O-CD2 3.25Å; P627-Y629 WeakPolarHBondContact O-CD2 3.49Å; P627-Y629 VanDerWaalsContact O-CE2 3.3Å; P627-Y629 WeakPolarHBondContact O-CE2 3.39Å
628	N	53	Low	48.6	Very low	98 Å²	98	117.3 Å²	117.3	52%	0.524	62%	0.616	S	S	.	*			trans	-75.6	121.7	161.5	-77.4	-0.6	0	0	0	107.8	R626	R626-N628 PolarHBondContact O-N 2.98Å
629	Y	55.6	Low	50.4	Low	133 Å²	133	111.9 Å²	111.9	52%	0.522	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100	114.8	173.6	-55.7	-96.5	0	0	0	108.5	M578 S589 A590 P627 V631	M578-Y629 HydrophobicContact CE-CD2 3.51Å; M578-Y629 HydrophobicContact CE-CE2 3.59Å; S589-Y629 CarbonylContact C-O 3.58Å; S589-Y629 WeakPolarHBondContact CA-O 3.37Å; A590-Y629 PolarHBondContact N-O 3.12Å; A590-Y629 PolarHBondContact O-N 3.25Å; A590-Y629 VanDerWaalsContact O-N 3.17Å; P627-Y629 HydrophobicContact CB-CD2 4.43Å; P627-Y629 HydrophobicContact CB-CE1 4.5Å; P627-Y629 HydrophobicContact CB-CE2 3.73Å; P627-Y629 HydrophobicContact CG-CE2 3.83Å; P627-Y629 VanDerWaalsContact O-CD2 3.25Å; P627-Y629 WeakPolarHBondContact O-CD2 3.49Å; P627-Y629 VanDerWaalsContact O-CE2 3.3Å; P627-Y629 WeakPolarHBondContact O-CE2 3.39Å; Y629-V631 PolarHBondContact O-N 3.47Å
630	N	59	Low	52	Low	118 Å²	118	106.4 Å²	106.4	63%	0.631	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.9	127.7	178.6	-76.4	26.6	0	0	0	110	E587	E587-N630 PolarHBondContact OE1-ND2 2.91Å
631	V	58.9	Low	53.4	Low	44 Å²	44	100.6 Å²	100.6	27%	0.267	54%	0.538	S	S	.	.			trans	-106.8	112.1	-175.9	-165.5	0	0	0	0	109.4	L580 I588 A590 Y629 Y633	L580-V631 HydrophobicContact CD2-CG2 4.01Å; I588-V631 HydrophobicContact CG2-CB 4.39Å; I588-V631 PolarHBondContact O-N 3.25Å; A590-V631 HydrophobicContact CB-CG2 3.84Å; Y629-V631 PolarHBondContact O-N 3.47Å; V631-Y633 HydrophobicContact CB-CD2 4.18Å; V631-Y633 HydrophobicContact CB-CE2 3.85Å; V631-Y633 HydrophobicContact CG1-CD2 3.84Å; V631-Y633 HydrophobicContact CG1-CE2 3.32Å; V631-Y633 PolarHBondContact O-N 3.03Å
632	S	64.6	Low	55.1	Low	122 Å²	122	91.5 Å²	91.5	85%	0.853	50%	0.497	S	S	*	.			trans	-73.2	118.6	176.8	-168.8	0	0	0	0	110.3
633	Y	64.6	Low	56.6	Low	31 Å²	31	93.7 Å²	93.7	12%	0.122	49%	0.492	C	S	.	.			trans	-119.7	152.8	169.9	-78.2	-87.1	0	0	0	109.4	L580 I588 V631 L637 I638 H683	L580-Y633 VanDerWaalsContact CD1-OH 3.27Å; L580-Y633 WeakPolarHBondContact CD1-OH 2.9Å; I588-Y633 HydrophobicContact CB-CD2 4.23Å; I588-Y633 HydrophobicContact CB-CE2 4.41Å; I588-Y633 HydrophobicContact CD1-CD2 3.57Å; I588-Y633 HydrophobicContact CD1-CE2 4.04Å; I588-Y633 HydrophobicContact CD1-CG 4.14Å; I588-Y633 HydrophobicContact CG1-CD2 4.49Å; I588-Y633 HydrophobicContact CG2-CD2 4.24Å; I588-Y633 HydrophobicContact CG2-CE2 3.91Å; V631-Y633 HydrophobicContact CB-CD2 4.18Å; V631-Y633 HydrophobicContact CB-CE2 3.85Å; V631-Y633 HydrophobicContact CG1-CD2 3.84Å; V631-Y633 HydrophobicContact CG1-CE2 3.32Å; V631-Y633 PolarHBondContact O-N 3.03Å; Y633-L637 HydrophobicContact CD1-CB 4.37Å; Y633-L637 HydrophobicContact CD1-CD1 4.12Å; Y633-I638 WeakPolarHBondContact O-CD1 3.47Å; Y633-H683 AromaticContact CE1-CE1 3.83Å; Y633-H683 AromaticContact CE1-NE2 3.84Å; Y633-H683 AromaticContact CZ-NE2 3.83Å; Y633-H683 PolarHBondContact OH-CD2 2.96Å; Y633-H683 VanDerWaalsContact OH-CD2 3.31Å; Y633-H683 PolarHBondContact OH-NE2 3.23Å
634	P	71.9	Confident	57.5	Low	61 Å²	61	88.8 Å²	88.8	40%	0.396	46%	0.457	S	S	.	.			trans	-51.1	141.2	167.4	-27.2	34.8	0	0	0	111.4	F636 L637 I638	P634-F636 VanDerWaalsContact C-N 3.25Å; P634-F636 HydrophobicContact CB-CD1 3.66Å; P634-F636 HydrophobicContact CB-CE1 3.39Å; P634-F636 HydrophobicContact CB-CZ 4.21Å; P634-F636 HydrophobicContact CG-CE1 4.13Å; P634-F636 PolarHBondContact O-N 3.28Å; P634-F636 VanDerWaalsContact O-N 3.09Å; P634-L637 HydrophobicContact CG-CD1 4.48Å; P634-L637 WeakPolarHBondContact O-CA 3.47Å; P634-L637 WeakPolarHBondContact O-CB 3.01Å; P634-L637 PolarHBondContact O-N 3.14Å; P634-I638 PolarHBondContact O-N 3.31Å; P634-I638 VanDerWaalsContact O-N 3.12Å
635	P	64.6	Low	58.3	Low	95 Å²	95	88.7 Å²	88.7	62%	0.617	46%	0.457	S	S	*	.	H	α-helix	trans	-52.3	-39.3	-174.1	-31	36.1	0	0	0	114.3	L637 I638 D639	P635-L637 VanDerWaalsContact C-N 3.27Å; P635-L637 PolarHBondContact O-N 3.36Å; P635-I638 PolarHBondContact O-N 3.08Å; P635-I638 VanDerWaalsContact O-N 3.1Å; P635-D639 PolarHBondContact O-N 3.25Å
636	F	65.4	Low	58.6	Low	145 Å²	145	89.7 Å²	89.7	64%	0.636	46%	0.455	S	S	*	.	H	α-helix	trans	-64.3	-26.9	177.5	76.1	-91.1	0	0	0	114.1	P634 L640	P634-F636 VanDerWaalsContact C-N 3.25Å; P634-F636 HydrophobicContact CB-CD1 3.66Å; P634-F636 HydrophobicContact CB-CE1 3.39Å; P634-F636 HydrophobicContact CB-CZ 4.21Å; P634-F636 HydrophobicContact CG-CE1 4.13Å; P634-F636 PolarHBondContact O-N 3.28Å; P634-F636 VanDerWaalsContact O-N 3.09Å; F636-L640 VanDerWaalsContact O-CB 3.23Å; F636-L640 WeakPolarHBondContact O-CB 3.38Å; F636-L640 PolarHBondContact O-N 3.18Å
637	L	60.4	Low	58.2	Low	56 Å²	56	87.8 Å²	87.8	29%	0.293	46%	0.457	S	S	.	.	H	α-helix	trans	-81.5	-34.7	171.7	-76.7	178.9	0	0	0	111.6	Y633 P634 P635 L640 L641	Y633-L637 HydrophobicContact CD1-CB 4.37Å; Y633-L637 HydrophobicContact CD1-CD1 4.12Å; P634-L637 HydrophobicContact CG-CD1 4.48Å; P634-L637 WeakPolarHBondContact O-CA 3.47Å; P634-L637 WeakPolarHBondContact O-CB 3.01Å; P634-L637 PolarHBondContact O-N 3.14Å; P635-L637 VanDerWaalsContact C-N 3.27Å; P635-L637 PolarHBondContact O-N 3.36Å; L637-L640 HydrophobicContact CD2-CD2 4.39Å; L637-L641 WeakPolarHBondContact O-CB 3.47Å; L637-L641 WeakPolarHBondContact O-CD1 3.46Å; L637-L641 WeakPolarHBondContact O-CG 3.43Å; L637-L641 PolarHBondContact O-N 3.2Å
638	I	67.8	Low	57.7	Low	34 Å²	34	90.8 Å²	90.8	17%	0.174	47%	0.469	C	S	.	.	H	α-helix	trans	-61.1	-50.6	171.4	-63	170.9	0	0	0	109.7	G586 I588 Y633 P634 P635 L640 L641 T642	G586-I638 VanDerWaalsContact C-CG2 3.43Å; G586-I638 WeakPolarHBondContact O-CG2 3.43Å; I588-I638 HydrophobicContact CD1-CG1 4.29Å; Y633-I638 WeakPolarHBondContact O-CD1 3.47Å; P634-I638 PolarHBondContact O-N 3.31Å; P634-I638 VanDerWaalsContact O-N 3.12Å; P635-I638 PolarHBondContact O-N 3.08Å; P635-I638 VanDerWaalsContact O-N 3.1Å; I638-L640 VanDerWaalsContact C-N 3.33Å; I638-L640 PolarHBondContact O-N 3.26Å; I638-L641 PolarHBondContact O-N 3.37Å; I638-T642 HydrophobicContact CG2-CG2 4.23Å; I638-T642 WeakPolarHBondContact O-CB 3.17Å; I638-T642 WeakPolarHBondContact O-CG2 3.25Å; I638-T642 PolarHBondContact O-N 3.37Å; I638-T642 PolarHBondContact O-OG1 3.14Å
639	D	65.6	Low	56.7	Low	71 Å²	71	92.5 Å²	92.5	38%	0.38	48%	0.484	S	S	.	.	H	α-helix	trans	-61.5	-39.5	-179.8	-74.2	-32.7	0	0	0	112.5	P635 K643 S644	P635-D639 PolarHBondContact O-N 3.25Å; D639-K643 CarbonylContact O-C 3.42Å; D639-K643 WeakPolarHBondContact O-CA 3.45Å; D639-K643 PolarHBondContact O-N 3.47Å; D639-S644 WeakPolarHBondContact CA-OG 3.32Å; D639-S644 WeakPolarHBondContact CB-O 3.3Å; D639-S644 PolarHBondContact O-N 3.4Å; D639-S644 VanDerWaalsContact O-N 3.13Å; D639-S644 VanDerWaalsContact OD1-CB 3.26Å; D639-S644 WeakPolarHBondContact OD1-CB 3.36Å; D639-S644 PolarHBondContact OD1-OG 2.74Å
640	L	62	Low	55.8	Low	33 Å²	33	94.1 Å²	94.1	17%	0.173	50%	0.496	C	S	.	.	H	α-helix	trans	-69	-44.9	175.5	-174.8	66	0	0	0	112.7	F636 L637 I638 L664	F636-L640 VanDerWaalsContact O-CB 3.23Å; F636-L640 WeakPolarHBondContact O-CB 3.38Å; F636-L640 PolarHBondContact O-N 3.18Å; L637-L640 HydrophobicContact CD2-CD2 4.39Å; I638-L640 VanDerWaalsContact C-N 3.33Å; I638-L640 PolarHBondContact O-N 3.26Å; L640-L664 HydrophobicContact CD1-CD2 3.76Å; L640-L664 HydrophobicContact CD1-CG 4.13Å; L640-L664 HydrophobicContact CD2-CD1 3.81Å; L640-L664 HydrophobicContact CD2-CD2 3.95Å; L640-L664 HydrophobicContact CD2-CG 3.85Å
641	L	60.4	Low	54.6	Low	54 Å²	54	98.2 Å²	98.2	28%	0.283	51%	0.508	S	S	.	.	H	α-helix	trans	-77.9	-27.3	-176.6	-68.7	170.2	0	0	0	113.1	I588 L637 I638 K671	I588-L641 HydrophobicContact CD1-CB 3.9Å; I588-L641 HydrophobicContact CD1-CD1 3.67Å; I588-L641 HydrophobicContact CD1-CG 4.44Å; L637-L641 WeakPolarHBondContact O-CB 3.47Å; L637-L641 WeakPolarHBondContact O-CD1 3.46Å; L637-L641 WeakPolarHBondContact O-CG 3.43Å; L637-L641 PolarHBondContact O-N 3.2Å; I638-L641 PolarHBondContact O-N 3.37Å; L641-K671 PolarHBondContact O-NZ 3.42Å
642	T	66.5	Low	53.3	Low	9 Å²	9	102.9 Å²	102.9	6%	0.055	53%	0.529	C	S	.	.	H	α-helix	trans	-106.3	-0.5	179.8	71.1	0	0	0	0	113.6	C582 N584 G586 E587 I588 I638 S644	C582-T642 HydrophobicContact CB-CG2 4.35Å; N584-T642 WeakPolarHBondContact O-CB 3.34Å; N584-T642 WeakPolarHBondContact O-CG2 3.48Å; G586-T642 PolarHBondContact N-OG1 2.91Å; E587-T642 WeakPolarHBondContact O-CG2 3.45Å; I588-T642 HydrophobicContact CD1-CG2 4.43Å; I588-T642 HydrophobicContact CG1-CG2 3.79Å; I638-T642 HydrophobicContact CG2-CG2 4.23Å; I638-T642 WeakPolarHBondContact O-CB 3.17Å; I638-T642 WeakPolarHBondContact O-CG2 3.25Å; I638-T642 PolarHBondContact O-N 3.37Å; I638-T642 PolarHBondContact O-OG1 3.14Å; T642-S644 VanDerWaalsContact C-N 3.31Å; T642-S644 PolarHBondContact O-N 2.93Å; T642-S644 PolarHBondContact OG1-OG 2.91Å
643	K	59.6	Low	52.1	Low	160 Å²	160	103.3 Å²	103.3	70%	0.696	52%	0.521	S	S	*	.			trans	63.6	21.3	-179.2	-58.2	-175	174.4	-176.5	0	115.4	D639 K645	D639-K643 CarbonylContact O-C 3.42Å; D639-K643 WeakPolarHBondContact O-CA 3.45Å; D639-K643 PolarHBondContact O-N 3.47Å; K643-K645 PolarHBondContact O-N 3.47Å
644	S	49.1	Very low	51.1	Low	15 Å²	15	108.5 Å²	108.5	11%	0.105	55%	0.551	C	S	.	*			trans	-71.9	116	176.1	32	0	0	0	0	112.3	D639 T642 L646	D639-S644 WeakPolarHBondContact CA-OG 3.32Å; D639-S644 WeakPolarHBondContact CB-O 3.3Å; D639-S644 PolarHBondContact O-N 3.4Å; D639-S644 VanDerWaalsContact O-N 3.13Å; D639-S644 VanDerWaalsContact OD1-CB 3.26Å; D639-S644 WeakPolarHBondContact OD1-CB 3.36Å; D639-S644 PolarHBondContact OD1-OG 2.74Å; T642-S644 VanDerWaalsContact C-N 3.31Å; T642-S644 PolarHBondContact O-N 2.93Å; T642-S644 PolarHBondContact OG1-OG 2.91Å; S644-L646 PolarHBondContact O-N 3.02Å
645	K	47.4	Very low	49.9	Very low	194 Å²	194	113.3 Å²	113.3	84%	0.843	57%	0.568	S	S	*	*			trans	49.7	54.2	159.4	-61.7	-177.1	-179.9	174.9	0	117.7	K643 L647	K643-K645 PolarHBondContact O-N 3.47Å; K645-L647 PolarHBondContact O-N 3.47Å
646	L	43.5	Very low	48.9	Very low	150 Å²	150	111.9 Å²	111.9	79%	0.785	56%	0.56	S	S	*	*			trans	-76.8	41.2	162.3	-132.1	169.8	0	0	0	112.5	S644	S644-L646 PolarHBondContact O-N 3.02Å
647	L	36.4	Very low	47.9	Very low	145 Å²	145	107.8 Å²	107.8	76%	0.759	55%	0.545	S	S	*	.			trans	-120.7	134	-179.1	-126.5	75.9	0	0	0	109.9	K645	K645-L647 PolarHBondContact O-N 3.47Å
648	N	35.6	Very low	47.6	Very low	139 Å²	139	108.2 Å²	108.2	74%	0.743	55%	0.552	S	S	*	*	S	Bend	trans	77.7	99.9	-179.3	-58.1	-25.7	0	0	0	118.1
649	T	31	Very low	46.9	Very low	134 Å²	134	113.8 Å²	113.8	82%	0.822	58%	0.575	S	S	*	*			trans	68	153.3	144.7	65.9	0	0	0	0	117.5
650	Q	38.4	Very low	46	Very low	166 Å²	166	115.6 Å²	115.6	78%	0.776	58%	0.582	S	S	*	*			cis	-155.5	134.9	20.9	-156	169.5	10.8	0	0	111.4
651	K	32.4	Very low	45.5	Very low	204 Å²	204	117.4 Å²	117.4	89%	0.887	59%	0.591	S	S	*	*			trans	21	96.7	164.6	-63.9	-176.7	177.6	-177.4	0	118.4
652	M	33.1	Very low	45.4	Very low	143 Å²	143	120.6 Å²	120.6	70%	0.704	60%	0.603	S	S	*	*			trans	-139	153.3	161.2	-81.6	-75.1	-79	0	0	109	D654 L657	M652-D654 PolarHBondContact O-N 3.32Å; M652-L657 HydrophobicContact CB-CD1 3.67Å
653	D	38.9	Very low	44.8	Very low	131 Å²	131	125.2 Å²	125.2	70%	0.701	63%	0.626	S	S	*	*			trans	-65.4	118	-161.6	-63.3	-50.7	0	0	0	115.4	H655 S656 L657	D653-H655 PolarHBondContact O-N 3.18Å; D653-S656 PolarHBondContact O-N 3.05Å; D653-L657 PolarHBondContact O-N 3.08Å; D653-L657 VanDerWaalsContact O-N 3.12Å
654	D	44	Very low	44	Very low	139 Å²	139	120.4 Å²	120.4	74%	0.743	61%	0.608	S	S	*	*	H	α-helix	trans	-55.2	-30.2	-173.4	-57.5	-59.8	0	0	0	114.2	M652 S658	M652-D654 PolarHBondContact O-N 3.32Å; D654-S658 WeakPolarHBondContact O-CB 3.29Å; D654-S658 PolarHBondContact O-N 3.35Å; D654-S658 PolarHBondContact O-OG 2.91Å
655	H	46.6	Very low	44.3	Very low	162 Å²	162	123.8 Å²	123.8	75%	0.75	63%	0.625	S	S	*	*	H	α-helix	trans	-79.5	-17.9	-176.7	-148.1	-36.4	0	0	0	113.5	D653	D653-H655 PolarHBondContact O-N 3.18Å
656	S	41.9	Very low	44.6	Very low	65 Å²	65	117.8 Å²	117.8	46%	0.455	60%	0.602	S	S	.	*	H	α-helix	trans	-88.5	-45.3	165.7	-164.5	0	0	0	0	110.4	D653 S658 K659 Q660	D653-S656 PolarHBondContact O-N 3.05Å; S656-S658 VanDerWaalsContact C-N 3.34Å; S656-S658 PolarHBondContact O-N 3Å; S656-K659 PolarHBondContact O-N 2.94Å; S656-K659 VanDerWaalsContact O-N 3.15Å; S656-Q660 PolarHBondContact O-N 3Å; S656-Q660 PolarHBondContact O-OE1 2.66Å; S656-Q660 PolarHBondContact OG-OE1 3.45Å
657	L	46.4	Very low	44.7	Very low	60 Å²	60	114.6 Å²	114.6	31%	0.314	59%	0.585	S	S	.	*	H	α-helix	trans	-57.4	-42.3	178.4	-95.6	92.3	0	0	0	112.3	M652 D653 K659 Q660 N661	M652-L657 HydrophobicContact CB-CD1 3.67Å; D653-L657 PolarHBondContact O-N 3.08Å; D653-L657 VanDerWaalsContact O-N 3.12Å; L657-K659 VanDerWaalsContact C-N 3.27Å; L657-K659 PolarHBondContact O-N 3.47Å; L657-Q660 PolarHBondContact O-N 3.2Å; L657-Q660 VanDerWaalsContact O-N 3.15Å; L657-N661 WeakPolarHBondContact O-CA 3.46Å; L657-N661 WeakPolarHBondContact O-CB 3.3Å; L657-N661 PolarHBondContact O-N 3.49Å; L657-N661 PolarHBondContact O-OD1 3.42Å
658	S	53.2	Low	45	Very low	64 Å²	64	110.6 Å²	110.6	45%	0.448	56%	0.564	S	S	.	*	H	α-helix	trans	-58.7	-33.6	178.7	50.1	0	0	0	0	114.2	D654 S656 K662	D654-S658 WeakPolarHBondContact O-CB 3.29Å; D654-S658 PolarHBondContact O-N 3.35Å; D654-S658 PolarHBondContact O-OG 2.91Å; S656-S658 VanDerWaalsContact C-N 3.34Å; S656-S658 PolarHBondContact O-N 3Å; S658-K662 VanDerWaalsContact O-CB 3.29Å; S658-K662 WeakPolarHBondContact O-CB 3.34Å; S658-K662 PolarHBondContact O-N 2.92Å; S658-K662 VanDerWaalsContact O-N 3.08Å
659	K	53.7	Low	45.8	Very low	152 Å²	152	110.4 Å²	110.4	66%	0.661	56%	0.557	S	S	*	*	H	α-helix	trans	-77.1	-42.8	172.8	-91.9	-177	175.2	175.1	0	112.5	S656 L657 K662 I663	S656-K659 PolarHBondContact O-N 2.94Å; S656-K659 VanDerWaalsContact O-N 3.15Å; L657-K659 VanDerWaalsContact C-N 3.27Å; L657-K659 PolarHBondContact O-N 3.47Å; K659-K662 PolarHBondContact O-N 2.75Å; K659-I663 WeakPolarHBondContact O-CG1 3.49Å; K659-I663 PolarHBondContact O-N 3Å; K659-I663 VanDerWaalsContact O-N 3.12Å
660	Q	45.8	Very low	46.2	Very low	109 Å²	109	107.7 Å²	107.7	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-66.2	-45.2	179.5	-68.5	172.9	-89.2	0	0	110.5	S656 L657 I663 L664	S656-Q660 PolarHBondContact O-N 3Å; S656-Q660 PolarHBondContact O-OE1 2.66Å; S656-Q660 PolarHBondContact OG-OE1 3.45Å; L657-Q660 PolarHBondContact O-N 3.2Å; L657-Q660 VanDerWaalsContact O-N 3.15Å; Q660-I663 CarbonylContact O-C 3.09Å; Q660-I663 WeakPolarHBondContact O-CB 3.33Å; Q660-I663 PolarHBondContact O-N 2.9Å; Q660-L664 WeakPolarHBondContact O-CB 3.47Å; Q660-L664 PolarHBondContact O-N 3.16Å
661	N	50.7	Low	46.1	Very low	71 Å²	71	103.9 Å²	103.9	38%	0.38	52%	0.518	S	S	.	.	H	α-helix	trans	-62.6	-42.6	173.7	-64.8	2.7	0	0	0	112	L657 I663 L664 D665	L657-N661 WeakPolarHBondContact O-CA 3.46Å; L657-N661 WeakPolarHBondContact O-CB 3.3Å; L657-N661 PolarHBondContact O-N 3.49Å; L657-N661 PolarHBondContact O-OD1 3.42Å; N661-I663 VanDerWaalsContact C-N 3.29Å; N661-I663 PolarHBondContact O-N 3.28Å; N661-L664 CarbonylContact O-C 3.56Å; N661-L664 WeakPolarHBondContact O-CA 3.37Å; N661-L664 WeakPolarHBondContact O-CB 3.5Å; N661-L664 PolarHBondContact O-N 2.72Å; N661-D665 WeakPolarHBondContact O-CB 3.33Å; N661-D665 VanDerWaalsContact O-CG 3.25Å; N661-D665 PolarHBondContact O-N 2.97Å
662	K	59.1	Low	46.4	Very low	121 Å²	121	102.7 Å²	102.7	53%	0.526	51%	0.509	S	S	.	.	H	α-helix	trans	-61.3	-39.6	175.1	-173.1	166.6	-177.5	171.9	0	111.7	S658 K659 D665 D666	S658-K662 VanDerWaalsContact O-CB 3.29Å; S658-K662 WeakPolarHBondContact O-CB 3.34Å; S658-K662 PolarHBondContact O-N 2.92Å; S658-K662 VanDerWaalsContact O-N 3.08Å; K659-K662 PolarHBondContact O-N 2.75Å; K662-D665 PolarHBondContact O-N 3.33Å; K662-D666 WeakPolarHBondContact O-CB 3.38Å; K662-D666 VanDerWaalsContact O-CG 3.22Å; K662-D666 PolarHBondContact O-N 3.43Å
663	I	53.4	Low	46.8	Very low	106 Å²	106	100.7 Å²	100.7	54%	0.544	50%	0.501	S	S	.	.	H	α-helix	trans	-66.4	-37.1	171.4	-65.8	165.8	0	0	0	111	K659 Q660 N661 D666 L667	K659-I663 WeakPolarHBondContact O-CG1 3.49Å; K659-I663 PolarHBondContact O-N 3Å; K659-I663 VanDerWaalsContact O-N 3.12Å; Q660-I663 CarbonylContact O-C 3.09Å; Q660-I663 WeakPolarHBondContact O-CB 3.33Å; Q660-I663 PolarHBondContact O-N 2.9Å; N661-I663 VanDerWaalsContact C-N 3.29Å; N661-I663 PolarHBondContact O-N 3.28Å; I663-D666 PolarHBondContact O-N 3.1Å; I663-L667 HydrophobicContact CG2-CD1 4.08Å; I663-L667 HydrophobicContact CG2-CG 4.48Å; I663-L667 WeakPolarHBondContact O-CB 3.43Å; I663-L667 WeakPolarHBondContact O-CG 3.25Å; I663-L667 PolarHBondContact O-N 3.01Å
664	L	44.1	Very low	47.1	Very low	58 Å²	58	101 Å²	101	30%	0.304	50%	0.501	S	S	.	.	H	α-helix	trans	-68.8	-33.8	177.3	-135.6	69.9	0	0	0	112.9	L640 Q660 N661 N668	L640-L664 HydrophobicContact CD1-CD2 3.76Å; L640-L664 HydrophobicContact CD1-CG 4.13Å; L640-L664 HydrophobicContact CD2-CD1 3.81Å; L640-L664 HydrophobicContact CD2-CD2 3.95Å; L640-L664 HydrophobicContact CD2-CG 3.85Å; Q660-L664 WeakPolarHBondContact O-CB 3.47Å; Q660-L664 PolarHBondContact O-N 3.16Å; N661-L664 CarbonylContact O-C 3.56Å; N661-L664 WeakPolarHBondContact O-CA 3.37Å; N661-L664 WeakPolarHBondContact O-CB 3.5Å; N661-L664 PolarHBondContact O-N 2.72Å; L664-N668 WeakPolarHBondContact O-CB 3.23Å; L664-N668 PolarHBondContact O-N 2.93Å; L664-N668 PolarHBondContact O-ND2 3.35Å
665	D	54.8	Low	47.1	Very low	87 Å²	87	98.8 Å²	98.8	47%	0.465	49%	0.489	S	S	.	.	H	α-helix	trans	-73.1	-41.9	173.9	-70.1	-29.3	0	0	0	110.3	N661 K662 L667 N668 K669	N661-D665 WeakPolarHBondContact O-CB 3.33Å; N661-D665 VanDerWaalsContact O-CG 3.25Å; N661-D665 PolarHBondContact O-N 2.97Å; K662-D665 PolarHBondContact O-N 3.33Å; D665-L667 VanDerWaalsContact C-N 3.29Å; D665-L667 PolarHBondContact O-N 3.37Å; D665-N668 PolarHBondContact O-N 2.68Å; D665-K669 VanDerWaalsContact O-CG 3.27Å; D665-K669 WeakPolarHBondContact O-CG 3.34Å; D665-K669 PolarHBondContact O-N 2.91Å
666	D	54.3	Low	47.1	Very low	68 Å²	68	94.1 Å²	94.1	36%	0.364	47%	0.468	S	S	.	.	H	α-helix	trans	-66.2	-31.1	172.9	-68.7	-25.9	0	0	0	111.9	K662 I663 K669	K662-D666 WeakPolarHBondContact O-CB 3.38Å; K662-D666 VanDerWaalsContact O-CG 3.22Å; K662-D666 PolarHBondContact O-N 3.43Å; I663-D666 PolarHBondContact O-N 3.1Å; D666-K669 IonicContact OD1-NZ 2.68Å; D666-K669 PolarHBondContact OD1-NZ 2.89Å
667	L	44.7	Very low	46.9	Very low	82 Å²	82	94.7 Å²	94.7	43%	0.429	47%	0.47	S	S	.	.	H	α-helix	trans	-73.2	-37.9	168.4	-72.9	168.7	0	0	0	112.6	I663 D665 K669 L670 I682	I663-L667 HydrophobicContact CG2-CD1 4.08Å; I663-L667 HydrophobicContact CG2-CG 4.48Å; I663-L667 WeakPolarHBondContact O-CB 3.43Å; I663-L667 WeakPolarHBondContact O-CG 3.25Å; I663-L667 PolarHBondContact O-N 3.01Å; D665-L667 VanDerWaalsContact C-N 3.29Å; D665-L667 PolarHBondContact O-N 3.37Å; L667-K669 VanDerWaalsContact C-N 3.3Å; L667-K669 PolarHBondContact O-N 3Å; L667-L670 HydrophobicContact CD2-CD1 4.05Å; L667-L670 WeakPolarHBondContact O-CB 3.44Å; L667-L670 PolarHBondContact O-N 3.25Å; L667-L670 VanDerWaalsContact O-N 3.15Å; L667-I682 HydrophobicContact CD2-CD1 4.49Å
668	N	42.8	Very low	46.4	Very low	61 Å²	61	96.3 Å²	96.3	33%	0.326	48%	0.478	S	S	.	.	H	α-helix	trans	-66	-31	173.6	-94.9	-52.4	0	0	0	112.2	L664 D665 L670 K671	L664-N668 WeakPolarHBondContact O-CB 3.23Å; L664-N668 PolarHBondContact O-N 2.93Å; L664-N668 PolarHBondContact O-ND2 3.35Å; D665-N668 PolarHBondContact O-N 2.68Å; N668-L670 PolarHBondContact O-N 3.36Å; N668-K671 WeakPolarHBondContact O-CB 3.46Å; N668-K671 PolarHBondContact O-N 3Å
669	K	51.5	Low	45.3	Very low	136 Å²	136	95 Å²	95	59%	0.591	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-19.6	172.3	-72.3	166.5	-153.4	165.2	0	113.6	D665 D666 L667 K671	D665-K669 VanDerWaalsContact O-CG 3.27Å; D665-K669 WeakPolarHBondContact O-CG 3.34Å; D665-K669 PolarHBondContact O-N 2.91Å; D666-K669 IonicContact OD1-NZ 2.68Å; D666-K669 PolarHBondContact OD1-NZ 2.89Å; L667-K669 VanDerWaalsContact C-N 3.3Å; L667-K669 PolarHBondContact O-N 3Å; K669-K671 PolarHBondContact O-N 3Å
670	L	40.7	Very low	44.3	Very low	76 Å²	76	91.6 Å²	91.6	40%	0.398	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-7.3	171.7	-62	172.5	0	0	0	112.9	L542 L667 N668 Y672 I678	L542-L670 HydrophobicContact CD2-CD2 3.83Å; L667-L670 HydrophobicContact CD2-CD1 4.05Å; L667-L670 WeakPolarHBondContact O-CB 3.44Å; L667-L670 PolarHBondContact O-N 3.25Å; L667-L670 VanDerWaalsContact O-N 3.15Å; N668-L670 PolarHBondContact O-N 3.36Å; L670-Y672 PolarHBondContact O-N 2.92Å; L670-I678 VanDerWaalsContact O-CD1 3.27Å; L670-I678 WeakPolarHBondContact O-CD1 3.29Å
671	K	35.2	Very low	43.9	Very low	86 Å²	86	91.1 Å²	91.1	37%	0.374	49%	0.494	S	S	.	.			trans	-86.2	87.5	-175	-167	-178.4	-165.9	173.3	0	112.1	L641 N668 K669	L641-K671 PolarHBondContact O-NZ 3.42Å; N668-K671 WeakPolarHBondContact O-CB 3.46Å; N668-K671 PolarHBondContact O-N 3Å; K669-K671 PolarHBondContact O-N 3Å
672	Y	38.5	Very low	43.3	Very low	180 Å²	180	92.6 Å²	92.6	71%	0.706	50%	0.501	S	S	*	.			trans	-145.6	148.2	162.3	-121.2	-83.3	0	0	0	114.2	L670	L670-Y672 PolarHBondContact O-N 2.92Å
673	N	42.1	Very low	42.5	Very low	101 Å²	101	90.5 Å²	90.5	54%	0.54	49%	0.493	S	S	.	.			trans	59.7	125.9	169.9	-78.9	-11.6	0	0	0	119.6	D675 E676	N673-D675 HydrophobicContact CB-CB 4.02Å; N673-D675 PolarHBondContact O-N 3.1Å; N673-E676 HydrophobicContact CB-CB 4.48Å; N673-E676 PolarHBondContact O-N 3.44Å
674	I	45.5	Very low	42.5	Very low	137 Å²	137	86.6 Å²	86.6	70%	0.703	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-17.9	161.4	-68.7	162.7	0	0	0	112.2
675	D	43.6	Very low	43.2	Very low	92 Å²	92	88 Å²	88	49%	0.492	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-1.6	-169.1	-109.6	31.3	0	0	0	114.7	K595 N673	K595-D675 WeakPolarHBondContact CD-O 3.25Å; K595-D675 WeakPolarHBondContact CE-O 3.49Å; K595-D675 VanDerWaalsContact CE-OD1 3.3Å; K595-D675 WeakPolarHBondContact CE-OD1 3.14Å; K595-D675 WeakPolarHBondContact CE-OD2 3.37Å; K595-D675 VanDerWaalsContact NZ-CB 3.33Å; K595-D675 PolarHBondContact NZ-O 3.39Å; K595-D675 IonicContact NZ-OD1 3.65Å; K595-D675 IonicContact NZ-OD2 3.31Å; K595-D675 PolarHBondContact NZ-OD2 3Å; N673-D675 HydrophobicContact CB-CB 4.02Å; N673-D675 PolarHBondContact O-N 3.1Å
676	E	46.8	Very low	43.9	Very low	64 Å²	64	84.6 Å²	84.6	30%	0.299	47%	0.473	S	S	.	.	S	Bend	trans	-132.7	115.4	-173	-165.8	166.4	-171.1	0	0	110.8	K546 N673 I678	K546-E676 IonicContact NZ-OE1 2.68Å; K546-E676 PolarHBondContact NZ-OE1 2.69Å; K546-E676 IonicContact NZ-OE2 3.2Å; K546-E676 PolarHBondContact NZ-OE2 3.12Å; N673-E676 HydrophobicContact CB-CB 4.48Å; N673-E676 PolarHBondContact O-N 3.44Å; E676-I678 PolarHBondContact O-N 3.45Å
677	P	38.4	Very low	44.4	Very low	78 Å²	78	84.4 Å²	84.4	51%	0.506	48%	0.481	S	S	.	.			trans	-79.1	86.4	-169.4	31.2	-35.5	0	0	0	112.9
678	I	34.6	Very low	45.9	Very low	94 Å²	94	85 Å²	85	48%	0.482	48%	0.484	S	S	.	.			trans	-76.3	146.5	178.8	-66.9	155.8	0	0	0	111.9	L670 E676	L670-I678 VanDerWaalsContact O-CD1 3.27Å; L670-I678 WeakPolarHBondContact O-CD1 3.29Å; E676-I678 PolarHBondContact O-N 3.45Å
679	A	31.5	Very low	47.4	Very low	36 Å²	36	82.9 Å²	82.9	30%	0.298	47%	0.471	S	S	.	.			trans	75.1	45.1	160	0	0	0	0	0	120.7	A681 I682	A679-A681 PolarHBondContact O-N 3.45Å; A679-A681 VanDerWaalsContact O-N 3.14Å; A679-I682 HydrophobicContact CB-CB 4.1Å; A679-I682 HydrophobicContact CB-CG1 4.5Å
680	G	32.5	Very low	48.6	Very low	80 Å²	80	78.5 Å²	78.5	83%	0.825	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-6.8	150.9	0	0	0	0	0	114.7
681	A	37.5	Very low	50.2	Low	99 Å²	99	79.1 Å²	79.1	82%	0.818	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.3	-1	-174.1	0	0	0	0	0	115.1	A679	A679-A681 PolarHBondContact O-N 3.45Å; A679-A681 VanDerWaalsContact O-N 3.14Å
682	I	38.3	Very low	52	Low	103 Å²	103	77.3 Å²	77.3	53%	0.528	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-26.3	177.5	-58.1	179	0	0	0	111	L667 A679	L667-I682 HydrophobicContact CD2-CD1 4.49Å; A679-I682 HydrophobicContact CB-CB 4.1Å; A679-I682 HydrophobicContact CB-CG1 4.5Å
683	H	42.1	Very low	53.9	Low	77 Å²	77	69.2 Å²	69.2	36%	0.356	44%	0.444	S	S	.	.	S	Bend	trans	-127.5	72.1	173.9	-58.7	-37.8	0	0	0	110.6	Y633 A687	Y633-H683 AromaticContact CE1-CE1 3.83Å; Y633-H683 AromaticContact CE1-NE2 3.84Å; Y633-H683 AromaticContact CZ-NE2 3.83Å; Y633-H683 PolarHBondContact OH-CD2 2.96Å; Y633-H683 VanDerWaalsContact OH-CD2 3.31Å; Y633-H683 PolarHBondContact OH-NE2 3.23Å; H683-A687 HydrophobicContact CB-CB 4.25Å
684	G	52.7	Low	55.7	Low	24 Å²	24	67.2 Å²	67.2	25%	0.247	43%	0.432	C	S	.	.			trans	-68.7	173.2	167.4	0	0	0	0	0	111.8	L686 A687	G684-L686 PolarHBondContact O-N 3.23Å; G684-A687 WeakPolarHBondContact O-CB 3.36Å; G684-A687 PolarHBondContact O-N 3.37Å
685	P	59.4	Low	57.4	Low	86 Å²	86	62.8 Å²	62.8	56%	0.558	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-50.2	-20.9	175.8	-29	34.4	0	0	0	115.4	A687 E709	P685-A687 VanDerWaalsContact C-N 3.3Å; P685-A687 PolarHBondContact O-N 3.17Å; P685-E709 HydrophobicContact CB-CG 4.35Å; P685-E709 WeakPolarHBondContact CD-OE1 3.06Å; P685-E709 HydrophobicContact CG-CG 4.4Å
686	L	69.2	Low	59.3	Low	16 Å²	16	62 Å²	62	8%	0.084	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-76.7	-7.3	176.5	-52.9	-173.7	0	0	0	115.1	G684 I688 F689 L694 P705 I708 E709 I712	G684-L686 PolarHBondContact O-N 3.23Å; L686-I688 PolarHBondContact O-N 3.1Å; L686-I688 VanDerWaalsContact O-N 3.14Å; L686-F689 HydrophobicContact CB-CD2 4.23Å; L686-F689 HydrophobicContact CD2-CD2 4.21Å; L686-F689 HydrophobicContact CD2-CE2 3.87Å; L686-F689 WeakPolarHBondContact O-CD2 3.41Å; L686-F689 PolarHBondContact O-N 2.96Å; L686-L694 HydrophobicContact CB-CD2 4.27Å; L686-L694 HydrophobicContact CD1-CD2 4.12Å; L686-P705 HydrophobicContact CD1-CB 3.84Å; L686-I708 HydrophobicContact CD1-CB 4.14Å; L686-I708 HydrophobicContact CD1-CD1 4.43Å; L686-I708 HydrophobicContact CD1-CG2 4.27Å; L686-I708 HydrophobicContact CD2-CB 4.13Å; L686-I708 HydrophobicContact CD2-CG2 3.58Å; L686-E709 HydrophobicContact CD1-CG 4.13Å; L686-E709 HydrophobicContact CD2-CG 3.74Å; L686-E709 HydrophobicContact CG-CG 3.67Å; L686-I712 HydrophobicContact CD2-CD1 3.69Å
687	A	65.6	Low	61.1	Low	65 Å²	65	59 Å²	59	54%	0.537	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-66.8	-11.5	-178.8	0	0	0	0	0	114.2	H683 G684 P685 F689	H683-A687 HydrophobicContact CB-CB 4.25Å; G684-A687 WeakPolarHBondContact O-CB 3.36Å; G684-A687 PolarHBondContact O-N 3.37Å; P685-A687 VanDerWaalsContact C-N 3.3Å; P685-A687 PolarHBondContact O-N 3.17Å; A687-F689 VanDerWaalsContact C-N 3.32Å
688	I	74.4	Confident	63.3	Low	95 Å²	95	57.2 Å²	57.2	49%	0.487	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-79	-11.1	176.3	66.8	-178.4	0	0	0	113.8	L686 V774 V775	L686-I688 PolarHBondContact O-N 3.1Å; L686-I688 VanDerWaalsContact O-N 3.14Å; I688-V774 HydrophobicContact CB-CG1 4.29Å; I688-V774 HydrophobicContact CD1-CG1 4.16Å; I688-V774 HydrophobicContact CG1-CG1 4.05Å; I688-V775 HydrophobicContact CD1-CG2 4.26Å
689	F	75.8	Confident	65.8	Low	16 Å²	16	58.6 Å²	58.6	7%	0.07	39%	0.393	C	S	.	.	S	Bend	trans	-97.1	141.2	-174.4	-62.7	-68.4	0	0	0	112.8	L686 A687 Q693 L694 L697 I712 W771 V774 V775	L686-F689 HydrophobicContact CB-CD2 4.23Å; L686-F689 HydrophobicContact CD2-CD2 4.21Å; L686-F689 HydrophobicContact CD2-CE2 3.87Å; L686-F689 WeakPolarHBondContact O-CD2 3.41Å; L686-F689 PolarHBondContact O-N 2.96Å; A687-F689 VanDerWaalsContact C-N 3.32Å; F689-Q693 HydrophobicContact CB-CB 4.03Å; F689-Q693 HydrophobicContact CD1-CB 4.07Å; F689-Q693 HydrophobicContact CG-CB 4.45Å; F689-L694 HydrophobicContact CB-CD1 4.2Å; F689-L694 HydrophobicContact CB-CG 3.87Å; F689-L697 HydrophobicContact CD1-CD1 3.92Å; F689-L697 HydrophobicContact CD2-CD1 3.86Å; F689-L697 HydrophobicContact CE1-CD1 3.81Å; F689-L697 HydrophobicContact CE2-CD1 3.8Å; F689-L697 HydrophobicContact CG-CD1 3.94Å; F689-L697 HydrophobicContact CZ-CD1 3.76Å; F689-I712 HydrophobicContact CE2-CD1 3.47Å; F689-I712 VanDerWaalsContact CE2-CD1 3.47Å; F689-I712 HydrophobicContact CZ-CD1 3.51Å; F689-I712 HydrophobicContact CZ-CG1 4.44Å; F689-W771 HydrophobicContact CD1-CB 4.17Å; F689-W771 HydrophobicContact CE1-CB 3.98Å; F689-V774 HydrophobicContact CD1-CG1 4.18Å; F689-V774 HydrophobicContact CE1-CG1 4.22Å; F689-V775 HydrophobicContact CE1-CG2 3.31Å; F689-V775 HydrophobicContact CZ-CG2 3.31Å
690	S	76.8	Confident	68.5	Low	44 Å²	44	57.7 Å²	57.7	31%	0.308	38%	0.384	S	S	.	.			trans	-66	158	166.3	79.7	0	0	0	0	111.1	A692 Q693 L694	S690-A692 PolarHBondContact O-N 2.73Å; S690-A692 VanDerWaalsContact O-N 3.12Å; S690-Q693 PolarHBondContact O-N 3.49Å; S690-Q693 WeakPolarHBondContact OG-CG 3.45Å; S690-Q693 PolarHBondContact OG-N 3.34Å; S690-L694 PolarHBondContact O-N 2.71Å
691	A	73.1	Confident	71.1	Confident	89 Å²	89	54.9 Å²	54.9	74%	0.736	35%	0.349	S	S	*	.	H	α-helix	trans	-57.8	-28.6	177.6	0	0	0	0	0	113.1	A695	A691-A695 WeakPolarHBondContact O-CB 3.4Å; A691-A695 PolarHBondContact O-N 2.8Å
692	A	73.3	Confident	73.4	Confident	48 Å²	48	51.7 Å²	51.7	40%	0.397	33%	0.326	S	S	.	.	H	α-helix	trans	-74.1	-39.9	174.9	0	0	0	0	0	112.5	S690 A695 Q696	S690-A692 PolarHBondContact O-N 2.73Å; S690-A692 VanDerWaalsContact O-N 3.12Å; A692-A695 WeakPolarHBondContact O-CB 3.49Å; A692-A695 PolarHBondContact O-N 2.86Å; A692-Q696 WeakPolarHBondContact O-CG 3.29Å; A692-Q696 PolarHBondContact O-N 3.43Å; A692-Q696 VanDerWaalsContact O-N 3.08Å
693	Q	79.3	Confident	75.4	Confident	10 Å²	10	50.2 Å²	50.2	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-67	-39.7	174.2	-70	162.5	-8.6	0	0	111.2	F689 S690 A695 Q696 L697 Q769 W771	F689-Q693 HydrophobicContact CB-CB 4.03Å; F689-Q693 HydrophobicContact CD1-CB 4.07Å; F689-Q693 HydrophobicContact CG-CB 4.45Å; S690-Q693 PolarHBondContact O-N 3.49Å; S690-Q693 WeakPolarHBondContact OG-CG 3.45Å; S690-Q693 PolarHBondContact OG-N 3.34Å; Q693-A695 VanDerWaalsContact C-N 3.35Å; Q693-A695 PolarHBondContact O-N 3.06Å; Q693-Q696 PolarHBondContact O-N 3.08Å; Q693-L697 WeakPolarHBondContact O-CB 3.48Å; Q693-L697 WeakPolarHBondContact O-CG 3.47Å; Q693-L697 PolarHBondContact O-N 3.4Å; Q693-Q769 PolarHBondContact NE2-O 2.83Å; Q693-W771 HydrophobicContact CB-CB 4.11Å; Q693-W771 HydrophobicContact CG-CB 4.12Å
694	L	79.7	Confident	77.2	Confident	58 Å²	58	50.6 Å²	50.6	30%	0.304	34%	0.341	S	S	.	.	H	α-helix	trans	-63.5	-37.2	172.7	-95.4	162.3	0	0	0	112.9	L686 F689 S690 L697 S698	L686-L694 HydrophobicContact CB-CD2 4.27Å; L686-L694 HydrophobicContact CD1-CD2 4.12Å; F689-L694 HydrophobicContact CB-CD1 4.2Å; F689-L694 HydrophobicContact CB-CG 3.87Å; S690-L694 PolarHBondContact O-N 2.71Å; L694-L697 PolarHBondContact O-N 2.83Å; L694-S698 WeakPolarHBondContact O-CB 3.5Å; L694-S698 PolarHBondContact O-N 3.47Å; L694-S698 PolarHBondContact O-OG 2.98Å
695	A	80.6	Confident	78.5	Confident	44 Å²	44	52.9 Å²	52.9	36%	0.364	35%	0.351	S	S	.	.	H	α-helix	trans	-60.7	-51.6	171.9	0	0	0	0	0	111.1	A691 A692 Q693 L697 S698 D699	A691-A695 WeakPolarHBondContact O-CB 3.4Å; A691-A695 PolarHBondContact O-N 2.8Å; A692-A695 WeakPolarHBondContact O-CB 3.49Å; A692-A695 PolarHBondContact O-N 2.86Å; Q693-A695 VanDerWaalsContact C-N 3.35Å; Q693-A695 PolarHBondContact O-N 3.06Å; A695-L697 VanDerWaalsContact C-N 3.34Å; A695-L697 PolarHBondContact O-N 3.21Å; A695-S698 CarbonylContact O-C 3.53Å; A695-S698 WeakPolarHBondContact O-CA 3.35Å; A695-S698 PolarHBondContact O-N 3.3Å; A695-S698 PolarHBondContact O-OG 3.19Å; A695-D699 PolarHBondContact O-N 3.05Å
696	Q	82.7	Confident	79.5	Confident	76 Å²	76	51.7 Å²	51.7	36%	0.355	35%	0.345	S	S	.	.	H	α-helix	trans	-56.8	-43.7	176.6	-67.4	172.5	22.3	0	0	112.6	A692 Q693 S698 D699 V700	A692-Q696 WeakPolarHBondContact O-CG 3.29Å; A692-Q696 PolarHBondContact O-N 3.43Å; A692-Q696 VanDerWaalsContact O-N 3.08Å; Q693-Q696 PolarHBondContact O-N 3.08Å; Q696-S698 VanDerWaalsContact C-N 3.32Å; Q696-S698 PolarHBondContact O-N 3.27Å; Q696-D699 PolarHBondContact O-N 3.5Å; Q696-V700 WeakPolarHBondContact O-CG2 3.23Å; Q696-V700 PolarHBondContact O-N 3.35Å
697	L	85.1	Confident	80.2	Confident	0 Å²	0	54 Å²	54	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-64.1	-36.9	175.6	-72.4	168.6	0	0	0	112	F689 Q693 L694 A695 V700 Y701 I708 I712 W771	F689-L697 HydrophobicContact CD1-CD1 3.92Å; F689-L697 HydrophobicContact CD2-CD1 3.86Å; F689-L697 HydrophobicContact CE1-CD1 3.81Å; F689-L697 HydrophobicContact CE2-CD1 3.8Å; F689-L697 HydrophobicContact CG-CD1 3.94Å; F689-L697 HydrophobicContact CZ-CD1 3.76Å; Q693-L697 WeakPolarHBondContact O-CB 3.48Å; Q693-L697 WeakPolarHBondContact O-CG 3.47Å; Q693-L697 PolarHBondContact O-N 3.4Å; L694-L697 PolarHBondContact O-N 2.83Å; A695-L697 VanDerWaalsContact C-N 3.34Å; A695-L697 PolarHBondContact O-N 3.21Å; L697-V700 PolarHBondContact O-N 2.89Å; L697-Y701 HydrophobicContact CD2-CD2 4.03Å; L697-Y701 HydrophobicContact CD2-CE2 3.71Å; L697-Y701 WeakPolarHBondContact O-CD2 3.41Å; L697-Y701 PolarHBondContact O-N 3.04Å; L697-I708 HydrophobicContact CB-CD1 4.28Å; L697-I708 HydrophobicContact CB-CG2 3.87Å; L697-I708 HydrophobicContact CD1-CG2 3.96Å; L697-I708 HydrophobicContact CD2-CG2 4.3Å; L697-I708 HydrophobicContact CG-CG2 4.27Å; L697-I712 HydrophobicContact CD1-CD1 4.43Å; L697-W771 HydrophobicContact CD2-CD2 3.75Å; L697-W771 HydrophobicContact CD2-CE3 3.91Å; L697-W771 HydrophobicContact CD2-CG 4.17Å; L697-W771 HydrophobicContact CD2-CZ2 4.4Å; L697-W771 HydrophobicContact CD2-CZ3 4.32Å; L697-W771 HydrophobicContact CG-CD2 4.44Å; L697-W771 HydrophobicContact CG-CG 4.34Å
698	S	85.7	Confident	81.2	Confident	41 Å²	41	51 Å²	51	29%	0.287	34%	0.335	S	S	.	.	H	α-helix	trans	-72.8	-26.6	176.9	77.6	0	0	0	0	114	L694 A695 Q696 G702	L694-S698 WeakPolarHBondContact O-CB 3.5Å; L694-S698 PolarHBondContact O-N 3.47Å; L694-S698 PolarHBondContact O-OG 2.98Å; A695-S698 CarbonylContact O-C 3.53Å; A695-S698 WeakPolarHBondContact O-CA 3.35Å; A695-S698 PolarHBondContact O-N 3.3Å; A695-S698 PolarHBondContact O-OG 3.19Å; Q696-S698 VanDerWaalsContact C-N 3.32Å; Q696-S698 PolarHBondContact O-N 3.27Å; S698-G702 CarbonylContact O-C 3.56Å; S698-G702 VanDerWaalsContact O-C 3.23Å; S698-G702 WeakPolarHBondContact O-CA 3.49Å; S698-G702 PolarHBondContact O-N 3.28Å
699	D	86.9	Confident	81.7	Confident	123 Å²	123	49 Å²	49	66%	0.658	32%	0.323	S	S	*	.	H	α-helix	trans	-73	-29.2	172.4	-70.9	-33.7	0	0	0	111.9	A695 Q696	A695-D699 PolarHBondContact O-N 3.05Å; Q696-D699 PolarHBondContact O-N 3.5Å
700	V	86.9	Confident	82.3	Confident	17 Å²	17	56.8 Å²	56.8	10%	0.103	35%	0.353	C	S	.	.	H	α-helix	trans	-89.7	-47.1	-178.3	176	0	0	0	0	112.9	Q696 L697 T737 L740 H741 A744	Q696-V700 WeakPolarHBondContact O-CG2 3.23Å; Q696-V700 PolarHBondContact O-N 3.35Å; L697-V700 PolarHBondContact O-N 2.89Å; V700-T737 WeakPolarHBondContact O-CG2 3.37Å; V700-L740 HydrophobicContact CG1-CB 4.5Å; V700-H741 HydrophobicContact CG1-CB 4.39Å; V700-A744 HydrophobicContact CG2-CB 3.49Å; V700-A744 VanDerWaalsContact CG2-CB 3.49Å
701	Y	88.3	Confident	82.9	Confident	21 Å²	21	55 Å²	55	8%	0.082	34%	0.341	C	S	.	.	H	α-helix	trans	-106.9	-2.8	-173.9	-55.5	-63.9	0	0	0	113.5	L697 V707 A711 L733 T737 H741	L697-Y701 HydrophobicContact CD2-CD2 4.03Å; L697-Y701 HydrophobicContact CD2-CE2 3.71Å; L697-Y701 WeakPolarHBondContact O-CD2 3.41Å; L697-Y701 PolarHBondContact O-N 3.04Å; Y701-V707 WeakPolarHBondContact O-CG1 3.17Å; Y701-A711 HydrophobicContact CD1-CB 3.73Å; Y701-A711 HydrophobicContact CD2-CB 4.19Å; Y701-A711 HydrophobicContact CE1-CB 3.59Å; Y701-A711 HydrophobicContact CE2-CB 4.05Å; Y701-A711 HydrophobicContact CG-CB 4.04Å; Y701-L733 HydrophobicContact CE1-CD2 4.17Å; Y701-T737 HydrophobicContact CD1-CG2 3.9Å; Y701-T737 HydrophobicContact CE1-CG2 4.25Å; Y701-H741 AromaticContact CZ-ND1 3.88Å; Y701-H741 PolarHBondContact OH-ND1 3.08Å
702	G	85.2	Confident	83.5	Confident	32 Å²	32	51.3 Å²	51.3	33%	0.33	31%	0.309	S	S	.	.			trans	86.7	157.4	-173.2	0	0	0	0	0	113	S698 D704	S698-G702 CarbonylContact O-C 3.56Å; S698-G702 VanDerWaalsContact O-C 3.23Å; S698-G702 WeakPolarHBondContact O-CA 3.49Å; S698-G702 PolarHBondContact O-N 3.28Å; G702-D704 PolarHBondContact O-N 3.03Å
703	G	79.5	Confident	84.2	Confident	73 Å²	73	52.2 Å²	52.2	75%	0.753	31%	0.312	S	S	*	.	S	Bend	trans	-74.9	37.3	179.7	0	0	0	0	0	115.6
704	D	80.7	Confident	84.7	Confident	84 Å²	84	54.1 Å²	54.1	45%	0.449	32%	0.323	S	S	.	.			trans	-110.4	110.6	172	-174.2	-23.2	0	0	0	109	G702 S706 V707 I708	G702-D704 PolarHBondContact O-N 3.03Å; D704-S706 PolarHBondContact O-N 3.09Å; D704-S706 PolarHBondContact OD1-N 3.39Å; D704-V707 HydrophobicContact CB-CB 4.28Å; D704-V707 HydrophobicContact CB-CG2 3.83Å; D704-V707 PolarHBondContact O-N 3.14Å; D704-I708 PolarHBondContact O-N 2.91Å
705	P	79.6	Confident	85.1	Confident	73 Å²	73	51.9 Å²	51.9	47%	0.474	31%	0.311	S	S	.	.	H	α-helix	trans	-50.8	-40.3	-179.4	-30	36.9	0	0	0	113.8	L686 V707 I708 E709	L686-P705 HydrophobicContact CD1-CB 3.84Å; P705-V707 VanDerWaalsContact C-N 3.31Å; P705-V707 PolarHBondContact O-N 3.47Å; P705-I708 PolarHBondContact O-N 3.14Å; P705-E709 WeakPolarHBondContact O-CG 3.36Å; P705-E709 PolarHBondContact O-N 2.97Å
706	S	80.8	Confident	85.4	Confident	61 Å²	61	54.7 Å²	54.7	43%	0.427	32%	0.315	S	S	.	.	H	α-helix	trans	-67.4	-32	-177.9	-64.7	0	0	0	0	112.3	D704 Y710	D704-S706 PolarHBondContact O-N 3.09Å; D704-S706 PolarHBondContact OD1-N 3.39Å; S706-Y710 WeakPolarHBondContact O-CD2 3.33Å; S706-Y710 PolarHBondContact O-N 3.43Å
707	V	84.3	Confident	85.6	Confident	63 Å²	63	57.9 Å²	57.9	38%	0.382	33%	0.328	S	S	.	.	H	α-helix	trans	-70.7	-40.2	176.7	-176.6	0	0	0	0	110.7	Y701 D704 P705 Y710 A711	Y701-V707 WeakPolarHBondContact O-CG1 3.17Å; D704-V707 HydrophobicContact CB-CB 4.28Å; D704-V707 HydrophobicContact CB-CG2 3.83Å; D704-V707 PolarHBondContact O-N 3.14Å; P705-V707 VanDerWaalsContact C-N 3.31Å; P705-V707 PolarHBondContact O-N 3.47Å; V707-Y710 PolarHBondContact O-N 3.29Å; V707-A711 PolarHBondContact O-N 3.49Å
708	I	86.7	Confident	85.8	Confident	4 Å²	4	58 Å²	58	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-63.1	-44.9	174.7	-56.2	169.6	0	0	0	110.1	L686 L697 D704 P705 A711 I712	L686-I708 HydrophobicContact CD1-CB 4.14Å; L686-I708 HydrophobicContact CD1-CD1 4.43Å; L686-I708 HydrophobicContact CD1-CG2 4.27Å; L686-I708 HydrophobicContact CD2-CB 4.13Å; L686-I708 HydrophobicContact CD2-CG2 3.58Å; L697-I708 HydrophobicContact CB-CD1 4.28Å; L697-I708 HydrophobicContact CB-CG2 3.87Å; L697-I708 HydrophobicContact CD1-CG2 3.96Å; L697-I708 HydrophobicContact CD2-CG2 4.3Å; L697-I708 HydrophobicContact CG-CG2 4.27Å; D704-I708 PolarHBondContact O-N 2.91Å; P705-I708 PolarHBondContact O-N 3.14Å; I708-A711 PolarHBondContact O-N 2.99Å; I708-I712 HydrophobicContact CG2-CD1 3.78Å; I708-I712 WeakPolarHBondContact O-CD1 3.16Å; I708-I712 WeakPolarHBondContact O-CG1 3.13Å; I708-I712 PolarHBondContact O-N 3.12Å
709	E	85.4	Confident	85.7	Confident	52 Å²	52	58.3 Å²	58.3	24%	0.243	33%	0.326	C	S	.	.	H	α-helix	trans	-61.1	-42.6	175.9	-72.5	173.2	178.9	0	0	112.6	P685 L686 P705 S713	P685-E709 HydrophobicContact CB-CG 4.35Å; P685-E709 WeakPolarHBondContact CD-OE1 3.06Å; P685-E709 HydrophobicContact CG-CG 4.4Å; L686-E709 HydrophobicContact CD1-CG 4.13Å; L686-E709 HydrophobicContact CD2-CG 3.74Å; L686-E709 HydrophobicContact CG-CG 3.67Å; P705-E709 WeakPolarHBondContact O-CG 3.36Å; P705-E709 PolarHBondContact O-N 2.97Å; E709-S713 VanDerWaalsContact O-CB 3.25Å; E709-S713 WeakPolarHBondContact O-CB 3.44Å; E709-S713 PolarHBondContact O-N 3.23Å; E709-S713 PolarHBondContact O-OG 3.29Å
710	Y	88.2	Confident	85.7	Confident	180 Å²	180	57.9 Å²	57.9	71%	0.706	33%	0.329	S	S	*	.	H	α-helix	trans	-63.6	-42.9	174.7	-80	-56.6	0	0	0	112.4	S706 V707 S713 L714	S706-Y710 WeakPolarHBondContact O-CD2 3.33Å; S706-Y710 PolarHBondContact O-N 3.43Å; V707-Y710 PolarHBondContact O-N 3.29Å; Y710-S713 PolarHBondContact O-N 2.89Å; Y710-L714 WeakPolarHBondContact O-CB 3.36Å; Y710-L714 PolarHBondContact O-N 3.19Å
711	A	87.8	Confident	85.6	Confident	5 Å²	5	61 Å²	61	4%	0.041	34%	0.344	C	S	.	.	H	α-helix	trans	-63.9	-44.2	179.1	0	0	0	0	0	112.1	Y701 V707 I708 L715 L733	Y701-A711 HydrophobicContact CD1-CB 3.73Å; Y701-A711 HydrophobicContact CD2-CB 4.19Å; Y701-A711 HydrophobicContact CE1-CB 3.59Å; Y701-A711 HydrophobicContact CE2-CB 4.05Å; Y701-A711 HydrophobicContact CG-CB 4.04Å; V707-A711 PolarHBondContact O-N 3.49Å; I708-A711 PolarHBondContact O-N 2.99Å; A711-L715 WeakPolarHBondContact O-CG 3.47Å; A711-L715 PolarHBondContact O-N 3.11Å; A711-L715 VanDerWaalsContact O-N 3.12Å; A711-L733 HydrophobicContact CB-CD2 4Å
712	I	87.2	Confident	85.4	Confident	12 Å²	12	61.5 Å²	61.5	6%	0.062	36%	0.356	C	S	.	.	H	α-helix	trans	-63.6	-44.7	174.9	-69.3	162	0	0	0	111	L686 F689 L697 I708 L714 L715 K716 V775	L686-I712 HydrophobicContact CD2-CD1 3.69Å; F689-I712 HydrophobicContact CE2-CD1 3.47Å; F689-I712 VanDerWaalsContact CE2-CD1 3.47Å; F689-I712 HydrophobicContact CZ-CD1 3.51Å; F689-I712 HydrophobicContact CZ-CG1 4.44Å; L697-I712 HydrophobicContact CD1-CD1 4.43Å; I708-I712 HydrophobicContact CG2-CD1 3.78Å; I708-I712 WeakPolarHBondContact O-CD1 3.16Å; I708-I712 WeakPolarHBondContact O-CG1 3.13Å; I708-I712 PolarHBondContact O-N 3.12Å; I712-L714 VanDerWaalsContact C-N 3.33Å; I712-L714 PolarHBondContact O-N 3.02Å; I712-L715 PolarHBondContact O-N 3.4Å; I712-K716 HydrophobicContact CG2-CG 4.5Å; I712-K716 PolarHBondContact O-N 3.16Å; I712-V775 HydrophobicContact CG2-CG1 3.78Å
713	S	88	Confident	85.4	Confident	67 Å²	67	67.5 Å²	67.5	47%	0.469	37%	0.368	S	S	.	.	H	α-helix	trans	-62.2	-41.4	-179.6	-60.4	0	0	0	0	111.8	E709 Y710 F717	E709-S713 VanDerWaalsContact O-CB 3.25Å; E709-S713 WeakPolarHBondContact O-CB 3.44Å; E709-S713 PolarHBondContact O-N 3.23Å; E709-S713 PolarHBondContact O-OG 3.29Å; Y710-S713 PolarHBondContact O-N 2.89Å; S713-F717 WeakPolarHBondContact O-CB 3.37Å; S713-F717 PolarHBondContact O-N 3.39Å
714	L	89	Confident	85.7	Confident	51 Å²	51	70.7 Å²	70.7	27%	0.267	36%	0.357	S	S	.	.	H	α-helix	trans	-61.3	-47.4	174.6	177.6	62.1	0	0	0	111.4	Y710 I712 F717 V718 W728 A729 L733	Y710-L714 WeakPolarHBondContact O-CB 3.36Å; Y710-L714 PolarHBondContact O-N 3.19Å; I712-L714 VanDerWaalsContact C-N 3.33Å; I712-L714 PolarHBondContact O-N 3.02Å; L714-F717 PolarHBondContact O-N 3.18Å; L714-V718 WeakPolarHBondContact O-CG2 3.5Å; L714-V718 PolarHBondContact O-N 2.86Å; L714-V718 VanDerWaalsContact O-N 3.12Å; L714-W728 HydrophobicContact CD1-CZ3 4.38Å; L714-A729 HydrophobicContact CD2-CB 4.31Å; L714-A729 HydrophobicContact CG-CB 4.14Å; L714-L733 HydrophobicContact CD2-CD2 4.27Å; L714-L733 HydrophobicContact CD2-CG 4.26Å
715	L	88	Confident	86.1	Confident	11 Å²	11	66.8 Å²	66.8	6%	0.058	34%	0.337	C	S	.	.	H	α-helix	trans	-63.7	-41.8	-180	-71.7	166.9	0	0	0	112.2	A711 I712 V718 Q719 L733 I777	A711-L715 WeakPolarHBondContact O-CG 3.47Å; A711-L715 PolarHBondContact O-N 3.11Å; A711-L715 VanDerWaalsContact O-N 3.12Å; I712-L715 PolarHBondContact O-N 3.4Å; L715-V718 WeakPolarHBondContact O-CG2 3.38Å; L715-Q719 PolarHBondContact O-N 3.46Å; L715-L733 HydrophobicContact CD1-CD1 3.89Å; L715-L733 HydrophobicContact CD2-CD1 3.82Å; L715-L733 HydrophobicContact CG-CD1 3.77Å; L715-I777 HydrophobicContact CB-CD1 3.54Å; L715-I777 HydrophobicContact CB-CG1 4.08Å; L715-I777 HydrophobicContact CB-CG2 4.15Å; L715-I777 HydrophobicContact CD1-CD1 3.99Å; L715-I777 HydrophobicContact CD2-CG2 4.4Å; L715-I777 HydrophobicContact CG-CD1 4.38Å
716	K	86.6	Confident	86.5	Confident	103 Å²	103	64.6 Å²	64.6	45%	0.448	32%	0.319	S	S	.	.	H	α-helix	trans	-64.9	-38.1	173.6	-72.1	-153.8	179.6	-143	0	112.8	I712 Q719 P720 V775	I712-K716 HydrophobicContact CG2-CG 4.5Å; I712-K716 PolarHBondContact O-N 3.16Å; K716-Q719 WeakPolarHBondContact O-CB 3.4Å; K716-Q719 PolarHBondContact O-N 3.41Å; K716-P720 WeakPolarHBondContact O-CD 3.21Å; K716-V775 HydrophobicContact CD-CG1 4.39Å; K716-V775 WeakPolarHBondContact CE-O 3.38Å; K716-V775 HydrophobicContact CG-CG1 4.24Å; K716-V775 PolarHBondContact NZ-O 2.88Å
717	F	88.3	Confident	86.9	Confident	142 Å²	142	66.2 Å²	66.2	62%	0.623	32%	0.316	S	S	*	.	H	α-helix	trans	-63.9	-41.6	178.9	178	-98.8	0	0	0	112.5	S713 L714 P720 M721	S713-F717 WeakPolarHBondContact O-CB 3.37Å; S713-F717 PolarHBondContact O-N 3.39Å; L714-F717 PolarHBondContact O-N 3.18Å; F717-P720 WeakPolarHBondContact O-CD 3.42Å; F717-M721 HydrophobicContact CD1-SD 4.22Å; F717-M721 HydrophobicContact CE1-SD 3.75Å; F717-M721 HydrophobicContact CZ-SD 4.3Å
718	V	88.2	Confident	87.2	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.024	31%	0.314	C	S	.	.	H	α-helix	trans	-82.5	-9.8	178.5	-60.3	0	0	0	0	114.5	L714 L715 M721 A725 R726 A729	L714-V718 WeakPolarHBondContact O-CG2 3.5Å; L714-V718 PolarHBondContact O-N 2.86Å; L714-V718 VanDerWaalsContact O-N 3.12Å; L715-V718 WeakPolarHBondContact O-CG2 3.38Å; V718-M721 HydrophobicContact CG1-SD 4.48Å; V718-M721 PolarHBondContact O-N 3.07Å; V718-M721 VanDerWaalsContact O-N 3.08Å; V718-A725 HydrophobicContact CB-CB 3.84Å; V718-A725 HydrophobicContact CG1-CB 4.14Å; V718-R726 HydrophobicContact CG2-CG 4.09Å; V718-A729 HydrophobicContact CB-CB 4.42Å; V718-A729 HydrophobicContact CG1-CB 4.11Å; V718-A729 HydrophobicContact CG2-CB 3.6Å
719	Q	84.9	Confident	87.3	Confident	47 Å²	47	67.3 Å²	67.3	22%	0.22	31%	0.313	C	S	.	.	S	Bend	trans	-54.1	-51.3	-179.5	-178.3	67.9	3.1	0	0	113.1	L715 K716 M721 D776 T778	L715-Q719 PolarHBondContact O-N 3.46Å; K716-Q719 WeakPolarHBondContact O-CB 3.4Å; K716-Q719 PolarHBondContact O-N 3.41Å; Q719-M721 VanDerWaalsContact C-N 3.3Å; Q719-M721 PolarHBondContact O-N 3.19Å; Q719-D776 PolarHBondContact NE2-O 3.15Å; Q719-T778 PolarHBondContact NE2-OG1 2.93Å
720	P	87.1	Confident	87.5	Confident	113 Å²	113	65.8 Å²	65.8	73%	0.734	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-17.5	175.5	29.5	-37	0	0	0	114.2	K716 F717 G722	K716-P720 WeakPolarHBondContact O-CD 3.21Å; F717-P720 WeakPolarHBondContact O-CD 3.42Å; P720-G722 PolarHBondContact O-N 3.14Å
721	M	84.6	Confident	87.5	Confident	83 Å²	83	64.8 Å²	64.8	41%	0.409	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	9.8	-178.4	-58.9	-178.3	77.8	0	0	113.8	F717 V718 Q719 A725	F717-M721 HydrophobicContact CD1-SD 4.22Å; F717-M721 HydrophobicContact CE1-SD 3.75Å; F717-M721 HydrophobicContact CZ-SD 4.3Å; V718-M721 HydrophobicContact CG1-SD 4.48Å; V718-M721 PolarHBondContact O-N 3.07Å; V718-M721 VanDerWaalsContact O-N 3.08Å; Q719-M721 VanDerWaalsContact C-N 3.3Å; Q719-M721 PolarHBondContact O-N 3.19Å; M721-A725 HydrophobicContact CB-CB 3.38Å; M721-A725 HydrophobicContact CG-CB 4.47Å; M721-A725 HydrophobicContact SD-CB 4.43Å
722	G	84	Confident	87.6	Confident	32 Å²	32	69.6 Å²	69.6	33%	0.33	33%	0.326	S	S	.	.	H	α-helix	trans	77.6	-174.3	171.1	0	0	0	0	0	115.9	P720 W724 A725 R726	P720-G722 PolarHBondContact O-N 3.14Å; G722-W724 VanDerWaalsContact C-N 3.34Å; G722-W724 PolarHBondContact O-N 3.13Å; G722-A725 PolarHBondContact O-N 3.21Å; G722-R726 WeakPolarHBondContact O-CG 3.27Å; G722-R726 PolarHBondContact O-N 3.03Å
723	R	84.7	Confident	87.8	Confident	157 Å²	157	69.8 Å²	69.8	59%	0.592	33%	0.327	S	S	*	.	H	α-helix	trans	-57.6	-41.5	-171	-66.7	-165.4	170.9	-77.9	2.9	113.6	R727 D780	R723-R727 WeakPolarHBondContact O-CB 3.33Å; R723-R727 VanDerWaalsContact O-CG 3.3Å; R723-R727 WeakPolarHBondContact O-CG 3.49Å; R723-R727 PolarHBondContact O-N 3.36Å; R723-D780 VanDerWaalsContact CB-OD2 3.29Å; R723-D780 WeakPolarHBondContact CB-OD2 3.16Å; R723-D780 VanDerWaalsContact CG-OD2 3.23Å; R723-D780 WeakPolarHBondContact CG-OD2 3.42Å; R723-D780 IonicContact CZ-OD2 2.75Å; R723-D780 IonicContact NH1-OD1 2.66Å; R723-D780 PolarHBondContact NH1-OD1 3.08Å; R723-D780 IonicContact NH1-OD2 3.17Å; R723-D780 PolarHBondContact NH1-OD2 2.98Å
724	W	86.6	Confident	87.9	Confident	140 Å²	140	68 Å²	68	53%	0.53	31%	0.312	S	S	.	.	H	α-helix	trans	-61.9	-49.5	-178.3	176.3	92.7	0	0	0	111.6	G722 R727 W728 L802	G722-W724 VanDerWaalsContact C-N 3.34Å; G722-W724 PolarHBondContact O-N 3.13Å; W724-R727 PolarHBondContact O-N 3.27Å; W724-W728 WeakPolarHBondContact O-CB 3.41Å; W724-W728 PolarHBondContact O-N 3.47Å; W724-L802 HydrophobicContact CH2-CD1 4.27Å; W724-L802 HydrophobicContact CZ3-CD1 4.35Å
725	A	87.3	Confident	87.8	Confident	3 Å²	3	69.5 Å²	69.5	3%	0.025	33%	0.332	C	S	.	.	H	α-helix	trans	-67.7	-40	-177.7	0	0	0	0	0	112	V718 M721 G722 R727 W728 A729	V718-A725 HydrophobicContact CB-CB 3.84Å; V718-A725 HydrophobicContact CG1-CB 4.14Å; M721-A725 HydrophobicContact CB-CB 3.38Å; M721-A725 HydrophobicContact CG-CB 4.47Å; M721-A725 HydrophobicContact SD-CB 4.43Å; G722-A725 PolarHBondContact O-N 3.21Å; A725-R727 PolarHBondContact O-N 3.15Å; A725-W728 WeakPolarHBondContact O-CB 3.48Å; A725-W728 PolarHBondContact O-N 2.94Å; A725-A729 PolarHBondContact O-N 3.48Å
726	R	89.8	Confident	87.9	Confident	26 Å²	26	72.9 Å²	72.9	10%	0.098	36%	0.361	C	S	.	.	H	α-helix	trans	-60.8	-42.3	173.4	-66.8	-170.7	-65.3	102.2	1.3	112	V718 G722 A729 A730 T778 D780	V718-R726 HydrophobicContact CG2-CG 4.09Å; G722-R726 WeakPolarHBondContact O-CG 3.27Å; G722-R726 PolarHBondContact O-N 3.03Å; R726-A729 PolarHBondContact O-N 2.67Å; R726-A730 WeakPolarHBondContact O-CB 3.36Å; R726-A730 PolarHBondContact O-N 3.48Å; R726-T778 PolarHBondContact NH1-O 3.35Å; R726-D780 IonicContact CZ-OD1 3.45Å; R726-D780 IonicContact CZ-OD2 2.75Å; R726-D780 IonicContact NH1-OD1 3.01Å; R726-D780 PolarHBondContact NH1-OD1 3.15Å; R726-D780 IonicContact NH1-OD2 3.74Å; R726-D780 VanDerWaalsContact NH2-CG 3.27Å; R726-D780 IonicContact NH2-OD1 2.74Å; R726-D780 PolarHBondContact NH2-OD1 2.7Å; R726-D780 IonicContact NH2-OD2 3.91Å; R726-D780 PolarHBondContact NH2-OD2 3.12Å
727	R	88.7	Confident	88	Confident	96 Å²	96	68.8 Å²	68.8	36%	0.362	35%	0.345	S	S	.	.	H	α-helix	trans	-68.5	-33.8	174	-70.2	177.4	69.1	-137.1	-5.6	113.2	R723 W724 A725 K731 D780	R723-R727 WeakPolarHBondContact O-CB 3.33Å; R723-R727 VanDerWaalsContact O-CG 3.3Å; R723-R727 WeakPolarHBondContact O-CG 3.49Å; R723-R727 PolarHBondContact O-N 3.36Å; W724-R727 PolarHBondContact O-N 3.27Å; A725-R727 PolarHBondContact O-N 3.15Å; R727-K731 WeakPolarHBondContact O-CB 3.37Å; R727-K731 PolarHBondContact O-N 3.44Å; R727-D780 HydrophobicContact CG-CB 3.72Å
728	W	89.9	Confident	87.9	Confident	90 Å²	90	70 Å²	70	34%	0.341	36%	0.358	S	S	.	.	H	α-helix	trans	-65.7	-45.9	174.1	179.3	103.9	0	0	0	111.5	L714 W724 A725 K731 R732	L714-W728 HydrophobicContact CD1-CZ3 4.38Å; W724-W728 WeakPolarHBondContact O-CB 3.41Å; W724-W728 PolarHBondContact O-N 3.47Å; A725-W728 WeakPolarHBondContact O-CB 3.48Å; A725-W728 PolarHBondContact O-N 2.94Å; W728-K731 PolarHBondContact O-N 3.12Å; W728-R732 HydrophobicContact CD2-CG 4.12Å; W728-R732 HydrophobicContact CE3-CG 4.14Å; W728-R732 HydrophobicContact CH2-CG 4.18Å; W728-R732 HydrophobicContact CZ2-CG 4.19Å; W728-R732 HydrophobicContact CZ3-CG 4.16Å; W728-R732 WeakPolarHBondContact O-CG 3.29Å; W728-R732 PolarHBondContact O-N 2.82Å
729	A	89.6	Confident	87.8	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-65.4	-46.4	177.3	0	0	0	0	0	111.8	L714 V718 A725 R726 K731 R732 L733	L714-A729 HydrophobicContact CD2-CB 4.31Å; L714-A729 HydrophobicContact CG-CB 4.14Å; V718-A729 HydrophobicContact CB-CB 4.42Å; V718-A729 HydrophobicContact CG1-CB 4.11Å; V718-A729 HydrophobicContact CG2-CB 3.6Å; A725-A729 PolarHBondContact O-N 3.48Å; R726-A729 PolarHBondContact O-N 2.67Å; A729-K731 VanDerWaalsContact C-N 3.28Å; A729-K731 PolarHBondContact O-N 2.84Å; A729-R732 PolarHBondContact O-N 2.63Å; A729-R732 VanDerWaalsContact O-N 3.08Å; A729-L733 WeakPolarHBondContact O-CG 3.46Å; A729-L733 PolarHBondContact O-N 3.31Å
730	A	88.9	Confident	87.9	Confident	19 Å²	19	72.1 Å²	72.1	16%	0.157	38%	0.375	C	S	.	.	H	α-helix	trans	-56.1	-42.4	174.8	0	0	0	0	0	111.7	R726 L733 D734	R726-A730 WeakPolarHBondContact O-CB 3.36Å; R726-A730 PolarHBondContact O-N 3.48Å; A730-L733 PolarHBondContact O-N 2.99Å; A730-D734 WeakPolarHBondContact O-CB 3.11Å; A730-D734 PolarHBondContact O-N 2.84Å
731	K	89	Confident	88.1	Confident	159 Å²	159	67.1 Å²	67.1	69%	0.691	34%	0.342	S	S	*	.	H	α-helix	trans	-65.1	-38	175	-175.9	-175	176.3	-170.4	0	113.2	R727 W728 A729 A735	R727-K731 WeakPolarHBondContact O-CB 3.37Å; R727-K731 PolarHBondContact O-N 3.44Å; W728-K731 PolarHBondContact O-N 3.12Å; A729-K731 VanDerWaalsContact C-N 3.28Å; A729-K731 PolarHBondContact O-N 2.84Å; K731-A735 WeakPolarHBondContact O-CB 3.4Å; K731-A735 PolarHBondContact O-N 2.96Å; K731-A735 VanDerWaalsContact O-N 3.13Å
732	R	89.8	Confident	88.1	Confident	107 Å²	107	65 Å²	65	40%	0.404	34%	0.335	S	S	.	.	H	α-helix	trans	-69.1	-38.3	175.3	-68.4	-97.9	173.9	151.3	-3	111.1	W728 A729 A735 A736 D806	W728-R732 HydrophobicContact CD2-CG 4.12Å; W728-R732 HydrophobicContact CE3-CG 4.14Å; W728-R732 HydrophobicContact CH2-CG 4.18Å; W728-R732 HydrophobicContact CZ2-CG 4.19Å; W728-R732 HydrophobicContact CZ3-CG 4.16Å; W728-R732 WeakPolarHBondContact O-CG 3.29Å; W728-R732 PolarHBondContact O-N 2.82Å; A729-R732 PolarHBondContact O-N 2.63Å; A729-R732 VanDerWaalsContact O-N 3.08Å; R732-A735 PolarHBondContact O-N 3.39Å; R732-A736 WeakPolarHBondContact O-CB 3.38Å; R732-A736 PolarHBondContact O-N 2.67Å; R732-A736 VanDerWaalsContact O-N 3.14Å; R732-D806 IonicContact CZ-OD2 3.63Å; R732-D806 IonicContact NH1-OD1 2.67Å; R732-D806 IonicContact NH1-OD2 2.67Å; R732-D806 PolarHBondContact NH1-OD2 2.67Å; R732-D806 IonicContact NH2-OD2 3.68Å; R732-D806 PolarHBondContact NH2-OD2 3.13Å
733	L	91.2	Very high	88	Confident	15 Å²	15	69.3 Å²	69.3	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-70.5	-40.5	175	-69.5	173.2	0	0	0	112.7	Y701 A711 L714 L715 A729 A730 A735 A736 T737 H741	Y701-L733 HydrophobicContact CE1-CD2 4.17Å; A711-L733 HydrophobicContact CB-CD2 4Å; L714-L733 HydrophobicContact CD2-CD2 4.27Å; L714-L733 HydrophobicContact CD2-CG 4.26Å; L715-L733 HydrophobicContact CD1-CD1 3.89Å; L715-L733 HydrophobicContact CD2-CD1 3.82Å; L715-L733 HydrophobicContact CG-CD1 3.77Å; A729-L733 WeakPolarHBondContact O-CG 3.46Å; A729-L733 PolarHBondContact O-N 3.31Å; A730-L733 PolarHBondContact O-N 2.99Å; L733-A735 VanDerWaalsContact C-N 3.33Å; L733-A735 PolarHBondContact O-N 2.88Å; L733-A736 CarbonylContact O-C 3.45Å; L733-A736 PolarHBondContact O-N 2.87Å; L733-A736 VanDerWaalsContact O-N 3.13Å; L733-T737 WeakPolarHBondContact O-CB 3.27Å; L733-T737 WeakPolarHBondContact O-CG2 3.19Å; L733-T737 PolarHBondContact O-N 3.27Å; L733-T737 PolarHBondContact O-OG1 3.35Å; L733-H741 HydrophobicContact CB-CB 4.1Å
734	D	90.7	Very high	88	Confident	30 Å²	30	62.5 Å²	62.5	16%	0.16	32%	0.324	C	S	.	.	H	α-helix	trans	-57.1	-45.9	170.8	-88.1	-32	0	0	0	111.5	A730 A736 T737 D738 G739 S742	A730-D734 WeakPolarHBondContact O-CB 3.11Å; A730-D734 PolarHBondContact O-N 2.84Å; D734-A736 PolarHBondContact O-N 3.16Å; D734-T737 PolarHBondContact O-N 3.14Å; D734-D738 PolarHBondContact O-N 2.91Å; D734-D738 VanDerWaalsContact O-N 3.09Å; D734-G739 PolarHBondContact O-N 3.33Å; D734-S742 VanDerWaalsContact CG-OG 3.26Å; D734-S742 WeakPolarHBondContact OD1-CA 3.45Å; D734-S742 WeakPolarHBondContact OD1-CB 3.43Å; D734-S742 PolarHBondContact OD1-N 3.37Å; D734-S742 PolarHBondContact OD1-OG 3.24Å; D734-S742 WeakPolarHBondContact OD2-CB 3.36Å; D734-S742 PolarHBondContact OD2-OG 3.34Å
735	A	86.8	Confident	87.8	Confident	83 Å²	83	56.2 Å²	56.2	69%	0.686	30%	0.302	S	S	*	.	H	α-helix	trans	-67.4	-21.5	177.7	0	0	0	0	0	113.7	K731 R732 L733	K731-A735 WeakPolarHBondContact O-CB 3.4Å; K731-A735 PolarHBondContact O-N 2.96Å; K731-A735 VanDerWaalsContact O-N 3.13Å; R732-A735 PolarHBondContact O-N 3.39Å; L733-A735 VanDerWaalsContact C-N 3.33Å; L733-A735 PolarHBondContact O-N 2.88Å
736	A	88.5	Confident	87.3	Confident	81 Å²	81	63.9 Å²	63.9	67%	0.669	33%	0.331	S	S	*	.	H	α-helix	trans	-91	-17.3	175.2	0	0	0	0	0	113.7	R732 L733 D734	R732-A736 WeakPolarHBondContact O-CB 3.38Å; R732-A736 PolarHBondContact O-N 2.67Å; R732-A736 VanDerWaalsContact O-N 3.14Å; L733-A736 CarbonylContact O-C 3.45Å; L733-A736 PolarHBondContact O-N 2.87Å; L733-A736 VanDerWaalsContact O-N 3.13Å; D734-A736 PolarHBondContact O-N 3.16Å
737	T	88.8	Confident	86.6	Confident	17 Å²	17	66.3 Å²	66.3	10%	0.104	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	14.8	-173.6	60.6	0	0	0	0	113.3	V700 Y701 L733 D734 G739 L740 H741	V700-T737 WeakPolarHBondContact O-CG2 3.37Å; Y701-T737 HydrophobicContact CD1-CG2 3.9Å; Y701-T737 HydrophobicContact CE1-CG2 4.25Å; L733-T737 WeakPolarHBondContact O-CB 3.27Å; L733-T737 WeakPolarHBondContact O-CG2 3.19Å; L733-T737 PolarHBondContact O-N 3.27Å; L733-T737 PolarHBondContact O-OG1 3.35Å; D734-T737 PolarHBondContact O-N 3.14Å; T737-G739 PolarHBondContact O-N 2.84Å; T737-L740 WeakPolarHBondContact O-CB 3.3Å; T737-L740 VanDerWaalsContact O-CG 3.27Å; T737-L740 WeakPolarHBondContact O-CG 3.3Å; T737-L740 PolarHBondContact O-N 3.03Å; T737-H741 WeakPolarHBondContact OG1-CB 3.27Å; T737-H741 PolarHBondContact OG1-N 2.88Å; T737-H741 VanDerWaalsContact OG1-N 3.12Å
738	D	87.4	Confident	85.7	Confident	168 Å²	168	62.4 Å²	62.4	90%	0.898	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	27.9	-173.7	-76.1	-35.2	0	0	0	114.1	D734	D734-D738 PolarHBondContact O-N 2.91Å; D734-D738 VanDerWaalsContact O-N 3.09Å
739	G	86.2	Confident	84.4	Confident	21 Å²	21	62.6 Å²	62.6	22%	0.216	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.2	4.1	-177.5	0	0	0	0	0	115.9	D734 T737 H741 S742 Q743	D734-G739 PolarHBondContact O-N 3.33Å; T737-G739 PolarHBondContact O-N 2.84Å; G739-H741 VanDerWaalsContact C-N 3.25Å; G739-H741 PolarHBondContact O-N 2.86Å; G739-S742 PolarHBondContact O-N 3.49Å; G739-S742 PolarHBondContact O-OG 2.91Å; G739-Q743 WeakPolarHBondContact O-CB 3.15Å; G739-Q743 PolarHBondContact O-N 2.86Å
740	L	87.3	Confident	83	Confident	75 Å²	75	65.6 Å²	65.6	39%	0.393	37%	0.371	S	S	.	.	H	α-helix	trans	-63.8	-31	175.4	-66.3	169.6	0	0	0	112.2	V700 T737 Q743 A744	V700-L740 HydrophobicContact CG1-CB 4.5Å; T737-L740 WeakPolarHBondContact O-CB 3.3Å; T737-L740 VanDerWaalsContact O-CG 3.27Å; T737-L740 WeakPolarHBondContact O-CG 3.3Å; T737-L740 PolarHBondContact O-N 3.03Å; L740-Q743 PolarHBondContact O-N 3.05Å; L740-A744 WeakPolarHBondContact O-CB 3.34Å; L740-A744 PolarHBondContact O-N 2.79Å
741	H	90.3	Very high	81.4	Confident	7 Å²	7	69.2 Å²	69.2	3%	0.032	39%	0.385	C	S	.	.	H	α-helix	trans	-58.9	-58.6	173.7	175.5	77.6	0	0	0	111.9	V700 Y701 L733 T737 G739 Q743 A744 C745	V700-H741 HydrophobicContact CG1-CB 4.39Å; Y701-H741 AromaticContact CZ-ND1 3.88Å; Y701-H741 PolarHBondContact OH-ND1 3.08Å; L733-H741 HydrophobicContact CB-CB 4.1Å; T737-H741 WeakPolarHBondContact OG1-CB 3.27Å; T737-H741 PolarHBondContact OG1-N 2.88Å; T737-H741 VanDerWaalsContact OG1-N 3.12Å; G739-H741 VanDerWaalsContact C-N 3.25Å; G739-H741 PolarHBondContact O-N 2.86Å; H741-Q743 VanDerWaalsContact C-N 3.29Å; H741-Q743 PolarHBondContact O-N 2.69Å; H741-A744 PolarHBondContact O-N 2.71Å; H741-C745 WeakPolarHBondContact O-CB 3.3Å; H741-C745 PolarHBondContact O-N 3.28Å; H741-C745 PolarHBondContact O-SG 3.12Å
742	S	84.1	Confident	79.1	Confident	39 Å²	39	67.2 Å²	67.2	27%	0.273	39%	0.388	S	S	.	.	H	α-helix	trans	-65.1	-30.2	176.7	54.2	0	0	0	0	113.2	D734 G739 Y746	D734-S742 VanDerWaalsContact CG-OG 3.26Å; D734-S742 WeakPolarHBondContact OD1-CA 3.45Å; D734-S742 WeakPolarHBondContact OD1-CB 3.43Å; D734-S742 PolarHBondContact OD1-N 3.37Å; D734-S742 PolarHBondContact OD1-OG 3.24Å; D734-S742 WeakPolarHBondContact OD2-CB 3.36Å; D734-S742 PolarHBondContact OD2-OG 3.34Å; G739-S742 PolarHBondContact O-N 3.49Å; G739-S742 PolarHBondContact O-OG 2.91Å; S742-Y746 WeakPolarHBondContact O-CB 3.18Å; S742-Y746 PolarHBondContact O-N 3.33Å
743	Q	83.1	Confident	76.7	Confident	123 Å²	123	65.7 Å²	65.7	58%	0.575	40%	0.398	S	S	*	.	H	α-helix	trans	-62.8	-47	171.5	-177.2	174.5	-28.1	0	0	111.4	G739 L740 H741 Y746 T747	G739-Q743 WeakPolarHBondContact O-CB 3.15Å; G739-Q743 PolarHBondContact O-N 2.86Å; L740-Q743 PolarHBondContact O-N 3.05Å; H741-Q743 VanDerWaalsContact C-N 3.29Å; H741-Q743 PolarHBondContact O-N 2.69Å; Q743-Y746 PolarHBondContact O-N 3.28Å; Q743-T747 WeakPolarHBondContact O-CG2 3.25Å; Q743-T747 PolarHBondContact O-N 3.43Å; Q743-T747 PolarHBondContact O-OG1 2.99Å
744	A	83.8	Confident	74	Confident	14 Å²	14	73.3 Å²	73.3	12%	0.116	43%	0.433	C	S	.	.	H	α-helix	trans	-62.3	-52.5	176.3	0	0	0	0	0	111	V700 L740 H741 Y746 T747 L748	V700-A744 HydrophobicContact CG2-CB 3.49Å; V700-A744 VanDerWaalsContact CG2-CB 3.49Å; L740-A744 WeakPolarHBondContact O-CB 3.34Å; L740-A744 PolarHBondContact O-N 2.79Å; H741-A744 PolarHBondContact O-N 2.71Å; A744-Y746 PolarHBondContact O-N 2.87Å; A744-T747 WeakPolarHBondContact CA-OG1 3.23Å; A744-T747 PolarHBondContact O-N 3.42Å; A744-T747 PolarHBondContact O-OG1 3.15Å; A744-L748 VanDerWaalsContact O-CG 3.25Å; A744-L748 WeakPolarHBondContact O-CG 3.44Å; A744-L748 PolarHBondContact O-N 3.45Å
745	C	81.7	Confident	71.2	Confident	8 Å²	8	78.6 Å²	78.6	5%	0.054	47%	0.466	C	S	.	.	H	α-helix	trans	-53.2	-38.8	175	-69.1	0	0	0	0	112.8	H741 S749 I779	H741-C745 WeakPolarHBondContact O-CB 3.3Å; H741-C745 PolarHBondContact O-N 3.28Å; H741-C745 PolarHBondContact O-SG 3.12Å; C745-S749 VanDerWaalsContact O-CB 3.29Å; C745-S749 WeakPolarHBondContact O-CB 3.17Å; C745-S749 PolarHBondContact O-N 3.22Å; C745-I779 HydrophobicContact CB-CD1 3.7Å; C745-I779 HydrophobicContact CB-CG1 4.29Å; C745-I779 HydrophobicContact CB-CG2 3.95Å; C745-I779 VanDerWaalsContact SG-CD1 3.58Å
746	Y	77	Confident	68.8	Low	164 Å²	164	80.5 Å²	80.5	64%	0.643	47%	0.469	S	S	*	.	H	α-helix	trans	-69.3	-42.2	174.4	-175.5	-102.4	0	0	0	112.6	S742 Q743 A744 L748 S749 S750	S742-Y746 WeakPolarHBondContact O-CB 3.18Å; S742-Y746 PolarHBondContact O-N 3.33Å; Q743-Y746 PolarHBondContact O-N 3.28Å; A744-Y746 PolarHBondContact O-N 2.87Å; Y746-L748 VanDerWaalsContact C-N 3.34Å; Y746-L748 PolarHBondContact O-N 3.23Å; Y746-S749 CarbonylContact O-C 3.56Å; Y746-S749 PolarHBondContact O-N 2.81Å; Y746-S750 VanDerWaalsContact O-CB 3.23Å; Y746-S750 WeakPolarHBondContact O-CB 3.49Å; Y746-S750 PolarHBondContact O-N 3.27Å; Y746-S750 PolarHBondContact O-OG 2.95Å
747	T	75.5	Confident	66.1	Low	76 Å²	76	84.3 Å²	84.3	47%	0.466	47%	0.473	S	S	.	.	H	α-helix	trans	-63.8	-37.6	176.2	52.9	0	0	0	0	112.7	Q743 A744 S750 Q751	Q743-T747 WeakPolarHBondContact O-CG2 3.25Å; Q743-T747 PolarHBondContact O-N 3.43Å; Q743-T747 PolarHBondContact O-OG1 2.99Å; A744-T747 WeakPolarHBondContact CA-OG1 3.23Å; A744-T747 PolarHBondContact O-N 3.42Å; A744-T747 PolarHBondContact O-OG1 3.15Å; T747-S750 PolarHBondContact O-N 3.06Å; T747-Q751 PolarHBondContact O-N 3.33Å
748	L	69.6	Low	63.3	Low	14 Å²	14	88.7 Å²	88.7	7%	0.073	50%	0.502	C	S	.	.	H	α-helix	trans	-66.1	-48.3	175	-59.7	163.1	0	0	0	110.3	A744 Y746 S750 Q751 N770 W771 T772	A744-L748 VanDerWaalsContact O-CG 3.25Å; A744-L748 WeakPolarHBondContact O-CG 3.44Å; A744-L748 PolarHBondContact O-N 3.45Å; Y746-L748 VanDerWaalsContact C-N 3.34Å; Y746-L748 PolarHBondContact O-N 3.23Å; L748-S750 PolarHBondContact O-N 3.21Å; L748-S750 VanDerWaalsContact O-N 3.16Å; L748-Q751 PolarHBondContact O-N 3.04Å; L748-N770 HydrophobicContact CD2-CB 3.99Å; L748-N770 WeakPolarHBondContact CD2-OD1 3.5Å; L748-W771 HydrophobicContact CD1-CZ2 4.11Å; L748-T772 HydrophobicContact CD1-CG2 3.85Å
749	S	63.7	Low	60.7	Low	95 Å²	95	85.5 Å²	85.5	66%	0.664	49%	0.489	S	S	*	.	H	α-helix	trans	-67.2	-9.2	174.9	-177.1	0	0	0	0	114.7	C745 Y746	C745-S749 VanDerWaalsContact O-CB 3.29Å; C745-S749 WeakPolarHBondContact O-CB 3.17Å; C745-S749 PolarHBondContact O-N 3.22Å; Y746-S749 CarbonylContact O-C 3.56Å; Y746-S749 PolarHBondContact O-N 2.81Å
750	S	59.9	Low	58.3	Low	62 Å²	62	94.7 Å²	94.7	43%	0.434	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-3.1	179.5	-60.1	0	0	0	0	113.3	Y746 T747 L748	Y746-S750 VanDerWaalsContact O-CB 3.23Å; Y746-S750 WeakPolarHBondContact O-CB 3.49Å; Y746-S750 PolarHBondContact O-N 3.27Å; Y746-S750 PolarHBondContact O-OG 2.95Å; T747-S750 PolarHBondContact O-N 3.06Å; L748-S750 PolarHBondContact O-N 3.21Å; L748-S750 VanDerWaalsContact O-N 3.16Å
751	Q	55.9	Low	55.9	Low	95 Å²	95	95.2 Å²	95.2	44%	0.444	53%	0.526	S	S	.	.	S	Bend	trans	-71.4	131.6	171.3	-63.9	-169.1	21.8	0	0	109.6	T747 L748 A753	T747-Q751 PolarHBondContact O-N 3.33Å; L748-Q751 PolarHBondContact O-N 3.04Å; Q751-A753 PolarHBondContact O-N 3.39Å
752	P	40.8	Very low	53.6	Low	117 Å²	117	103.1 Å²	103.1	76%	0.76	56%	0.561	S	S	*	*			trans	-72	113.9	178.4	28.6	-32.9	0	0	0	110.1
753	A	38.9	Very low	51.6	Low	75 Å²	75	108 Å²	108	62%	0.62	58%	0.583	S	S	*	*			trans	-56.4	143.6	155.5	0	0	0	0	0	109.1	Q751	Q751-A753 PolarHBondContact O-N 3.39Å
754	H	34.8	Very low	49.5	Very low	175 Å²	175	107.8 Å²	107.8	81%	0.81	58%	0.581	S	S	*	*			trans	67.8	109.8	-177.2	-33.7	-74.9	0	0	0	115.4
755	T	32	Very low	47.3	Very low	141 Å²	141	110.1 Å²	110.1	87%	0.865	60%	0.596	S	S	*	*				177.1	60	122.7	-59.9	0	0	0	0	109.3
756	V	34.8	Very low	45.4	Very low	123 Å²	123	115.1 Å²	115.1	75%	0.745	62%	0.623	S	S	*	*			trans	-143.2	115.7	168.7	-176.8	0	0	0	0	108.2
757	E	31.8	Very low	43.6	Very low	161 Å²	161	113.5 Å²	113.5	75%	0.752	62%	0.624	S	S	*	*			trans	-64.4	146	168	-82.3	-75.2	134.4	0	0	110.2	T759	E757-T759 VanDerWaalsContact C-N 3.29Å; E757-T759 PolarHBondContact O-N 2.78Å
758	P	31.6	Very low	41.9	Very low	110 Å²	110	115.3 Å²	115.3	71%	0.714	63%	0.631	S	S	*	*			trans	-69.8	81.6	-177.2	29.9	-35.7	0	0	0	112
759	T	32.7	Very low	41.2	Very low	100 Å²	100	119.4 Å²	119.4	61%	0.613	65%	0.649	S	S	*	*			trans	-74.3	142.1	166.6	48.2	0	0	0	0	109.8	E757 D761	E757-T759 VanDerWaalsContact C-N 3.29Å; E757-T759 PolarHBondContact O-N 2.78Å; T759-D761 PolarHBondContact O-N 3.44Å
760	F	34.9	Very low	41.6	Very low	215 Å²	215	116.2 Å²	116.2	94%	0.943	63%	0.625	S	S	*	*	S	Bend	trans	-74.1	27.8	-159.1	-86.5	-100.8	0	0	0	116.7
761	D	37.2	Very low	42.3	Very low	85 Å²	85	113.4 Å²	113.4	46%	0.455	61%	0.605	S	S	.	*			trans	-96.2	94.1	177.2	-71	-21.3	0	0	0	111.3	T759 D763 K764	T759-D761 PolarHBondContact O-N 3.44Å; D761-D763 PolarHBondContact O-N 2.75Å; D761-K764 HydrophobicContact CB-CB 4.41Å; D761-K764 HydrophobicContact CB-CD 3.95Å; D761-K764 HydrophobicContact CB-CG 4.21Å; D761-K764 PolarHBondContact O-N 3.17Å; D761-K764 VanDerWaalsContact O-N 3.15Å; D761-K764 WeakPolarHBondContact OD2-CE 3.5Å; D761-K764 IonicContact OD2-NZ 3.62Å; D761-K764 PolarHBondContact OD2-NZ 3.22Å
762	K	42.9	Very low	43.4	Very low	173 Å²	173	109.4 Å²	109.4	75%	0.752	59%	0.587	S	S	*	*	H	α-helix	trans	-55.6	-33.6	174.2	-76.7	-172.3	173.1	-174.3	0	113	K764 S765	K762-K764 PolarHBondContact O-N 2.89Å; K762-S765 PolarHBondContact O-N 3.41Å; K762-S765 PolarHBondContact O-OG 2.73Å
763	D	40.8	Very low	45.1	Very low	141 Å²	141	107.5 Å²	107.5	75%	0.754	57%	0.57	S	S	*	*	H	α-helix	trans	-67.1	-7.9	-177.4	-52.5	-21.3	0	0	0	113.5	D761	D761-D763 PolarHBondContact O-N 2.75Å
764	K	38.4	Very low	46.7	Very low	119 Å²	119	106.3 Å²	106.3	52%	0.517	56%	0.555	S	S	.	*	H	α-helix	trans	-99.9	-21.8	176.9	-72.8	175.8	-175.7	153.6	0	114.7	D761 K762	D761-K764 HydrophobicContact CB-CB 4.41Å; D761-K764 HydrophobicContact CB-CD 3.95Å; D761-K764 HydrophobicContact CB-CG 4.21Å; D761-K764 PolarHBondContact O-N 3.17Å; D761-K764 VanDerWaalsContact O-N 3.15Å; D761-K764 WeakPolarHBondContact OD2-CE 3.5Å; D761-K764 IonicContact OD2-NZ 3.62Å; D761-K764 PolarHBondContact OD2-NZ 3.22Å; K762-K764 PolarHBondContact O-N 2.89Å
765	S	39.1	Very low	48.3	Very low	63 Å²	63	98 Å²	98	44%	0.441	52%	0.517	S	S	.	.	H	α-helix	trans	-65.9	-43.5	175.2	46.2	0	0	0	0	110.9	K762 L767 L768 Q769	K762-S765 PolarHBondContact O-N 3.41Å; K762-S765 PolarHBondContact O-OG 2.73Å; S765-L767 PolarHBondContact O-N 3.09Å; S765-L768 PolarHBondContact O-N 2.66Å; S765-Q769 PolarHBondContact O-N 3.4Å
766	D	41.1	Very low	50.4	Low	114 Å²	114	97.3 Å²	97.3	61%	0.61	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-17	-172.9	-59.8	19.1	0	0	0	112.1
767	L	39.9	Very low	52.4	Low	129 Å²	129	92.2 Å²	92.2	68%	0.675	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-15.1	170.4	-80.8	169.4	0	0	0	113.9	S765	S765-L767 PolarHBondContact O-N 3.09Å
768	L	39.5	Very low	54.7	Low	115 Å²	115	87.8 Å²	87.8	60%	0.602	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-9.4	-178.6	-82.7	164.6	0	0	0	113.7	S765 N770	S765-L768 PolarHBondContact O-N 2.66Å; L768-N770 PolarHBondContact O-N 2.81Å
769	Q	55.5	Low	56.4	Low	99 Å²	99	85.5 Å²	85.5	46%	0.463	44%	0.441	S	S	.	.			trans	-72.2	121.5	177.7	-156.8	70.8	66.8	0	0	110.8	Q693 S765 D773 V774	Q693-Q769 PolarHBondContact NE2-O 2.83Å; S765-Q769 PolarHBondContact O-N 3.4Å; Q769-D773 HydrophobicContact CG-CB 4.35Å; Q769-D773 PolarHBondContact NE2-OD2 2.85Å; Q769-V774 HydrophobicContact CG-CG2 4.01Å
770	N	70.3	Confident	58.1	Low	28 Å²	28	81.5 Å²	81.5	15%	0.15	42%	0.416	C	S	.	.			trans	-72.3	145.8	177.5	-68.6	-50.4	0	0	0	110.3	L748 L768 T772 D773 V774	L748-N770 HydrophobicContact CD2-CB 3.99Å; L748-N770 WeakPolarHBondContact CD2-OD1 3.5Å; L768-N770 PolarHBondContact O-N 2.81Å; N770-T772 WeakPolarHBondContact CB-OG1 3.45Å; N770-T772 PolarHBondContact O-N 3.3Å; N770-T772 VanDerWaalsContact O-N 3.12Å; N770-D773 WeakPolarHBondContact CB-OD2 3.47Å; N770-D773 PolarHBondContact N-OD2 2.86Å; N770-D773 WeakPolarHBondContact O-CB 3.19Å; N770-D773 PolarHBondContact O-N 3.12Å; N770-V774 PolarHBondContact O-N 3.28Å
771	W	76.4	Confident	59.1	Low	4 Å²	4	75.1 Å²	75.1	2%	0.015	40%	0.396	C	S	.	.	H	α-helix	trans	-62.3	-21.9	179.8	68	-101.2	0	0	0	112.8	F689 Q693 L697 L748 D773 V775 I777	F689-W771 HydrophobicContact CD1-CB 4.17Å; F689-W771 HydrophobicContact CE1-CB 3.98Å; Q693-W771 HydrophobicContact CB-CB 4.11Å; Q693-W771 HydrophobicContact CG-CB 4.12Å; L697-W771 HydrophobicContact CD2-CD2 3.75Å; L697-W771 HydrophobicContact CD2-CE3 3.91Å; L697-W771 HydrophobicContact CD2-CG 4.17Å; L697-W771 HydrophobicContact CD2-CZ2 4.4Å; L697-W771 HydrophobicContact CD2-CZ3 4.32Å; L697-W771 HydrophobicContact CG-CD2 4.44Å; L697-W771 HydrophobicContact CG-CG 4.34Å; L748-W771 HydrophobicContact CD1-CZ2 4.11Å; W771-D773 VanDerWaalsContact C-N 3.29Å; W771-D773 PolarHBondContact O-N 3.1Å; W771-V775 WeakPolarHBondContact O-CG2 3.36Å; W771-I777 HydrophobicContact CZ3-CD1 4.36Å
772	T	77.1	Confident	59.8	Low	10 Å²	10	75.4 Å²	75.4	6%	0.061	40%	0.403	C	S	.	.	H	α-helix	trans	-60.9	-38.5	172.3	42	0	0	0	0	112.6	L748 N770 V775 D776 I777 I779	L748-T772 HydrophobicContact CD1-CG2 3.85Å; N770-T772 WeakPolarHBondContact CB-OG1 3.45Å; N770-T772 PolarHBondContact O-N 3.3Å; N770-T772 VanDerWaalsContact O-N 3.12Å; T772-V775 PolarHBondContact O-N 3.39Å; T772-D776 PolarHBondContact O-N 3.23Å; T772-D776 VanDerWaalsContact O-N 3.11Å; T772-I777 PolarHBondContact O-N 2.64Å; T772-I779 HydrophobicContact CG2-CD1 3.52Å; T772-I779 HydrophobicContact CG2-CG1 4.23Å
773	D	76.5	Confident	59.8	Low	78 Å²	78	72 Å²	72	42%	0.417	40%	0.397	S	S	.	.	H	α-helix	trans	-82	-37.6	-171.1	-36.9	-19	0	0	0	109.7	Q769 N770 W771 V775 D776	Q769-D773 HydrophobicContact CG-CB 4.35Å; Q769-D773 PolarHBondContact NE2-OD2 2.85Å; N770-D773 WeakPolarHBondContact CB-OD2 3.47Å; N770-D773 PolarHBondContact N-OD2 2.86Å; N770-D773 WeakPolarHBondContact O-CB 3.19Å; N770-D773 PolarHBondContact O-N 3.12Å; W771-D773 VanDerWaalsContact C-N 3.29Å; W771-D773 PolarHBondContact O-N 3.1Å; D773-V775 PolarHBondContact O-N 3.21Å; D773-V775 VanDerWaalsContact O-N 3.16Å; D773-D776 PolarHBondContact O-N 3Å
774	V	72.5	Confident	59.6	Low	49 Å²	49	69.4 Å²	69.4	30%	0.297	39%	0.387	S	S	.	.	H	α-helix	trans	-58.1	-24.2	171.3	176.2	0	0	0	0	112.3	I688 F689 Q769 N770	I688-V774 HydrophobicContact CB-CG1 4.29Å; I688-V774 HydrophobicContact CD1-CG1 4.16Å; I688-V774 HydrophobicContact CG1-CG1 4.05Å; F689-V774 HydrophobicContact CD1-CG1 4.18Å; F689-V774 HydrophobicContact CE1-CG1 4.22Å; Q769-V774 HydrophobicContact CG-CG2 4.01Å; N770-V774 PolarHBondContact O-N 3.28Å
775	V	69.9	Low	59.5	Low	2 Å²	2	72.5 Å²	72.5	1%	0.012	40%	0.401	C	S	.	.	H	α-helix	trans	-110.6	-11.1	-170.5	-172.8	0	0	0	0	112.3	I688 F689 I712 K716 W771 T772 D773 I777	I688-V775 HydrophobicContact CD1-CG2 4.26Å; F689-V775 HydrophobicContact CE1-CG2 3.31Å; F689-V775 HydrophobicContact CZ-CG2 3.31Å; I712-V775 HydrophobicContact CG2-CG1 3.78Å; K716-V775 HydrophobicContact CD-CG1 4.39Å; K716-V775 WeakPolarHBondContact CE-O 3.38Å; K716-V775 HydrophobicContact CG-CG1 4.24Å; K716-V775 PolarHBondContact NZ-O 2.88Å; W771-V775 WeakPolarHBondContact O-CG2 3.36Å; T772-V775 PolarHBondContact O-N 3.39Å; D773-V775 PolarHBondContact O-N 3.21Å; D773-V775 VanDerWaalsContact O-N 3.16Å; V775-I777 HydrophobicContact CB-CD1 3.94Å; V775-I777 HydrophobicContact CB-CG1 4.27Å; V775-I777 HydrophobicContact CG1-CD1 3.28Å; V775-I777 HydrophobicContact CG1-CG1 3.78Å
776	D	76.4	Confident	59.3	Low	125 Å²	125	75.7 Å²	75.7	67%	0.668	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	54.1	-174.1	-164	18.9	0	0	0	113.2	Q719 T772 D773	Q719-D776 PolarHBondContact NE2-O 3.15Å; T772-D776 PolarHBondContact O-N 3.23Å; T772-D776 VanDerWaalsContact O-N 3.11Å; D773-D776 PolarHBondContact O-N 3Å
777	I	76.5	Confident	59	Low	17 Å²	17	75.9 Å²	75.9	9%	0.087	42%	0.418	C	S	.	.			trans	-109.4	122.9	176.3	-65	162.1	0	0	0	109.8	L715 W771 T772 V775	L715-I777 HydrophobicContact CB-CD1 3.54Å; L715-I777 HydrophobicContact CB-CG1 4.08Å; L715-I777 HydrophobicContact CB-CG2 4.15Å; L715-I777 HydrophobicContact CD1-CD1 3.99Å; L715-I777 HydrophobicContact CD2-CG2 4.4Å; L715-I777 HydrophobicContact CG-CD1 4.38Å; W771-I777 HydrophobicContact CZ3-CD1 4.36Å; T772-I777 PolarHBondContact O-N 2.64Å; V775-I777 HydrophobicContact CB-CD1 3.94Å; V775-I777 HydrophobicContact CB-CG1 4.27Å; V775-I777 HydrophobicContact CG1-CD1 3.28Å; V775-I777 HydrophobicContact CG1-CG1 3.78Å
778	T	79.4	Confident	58.7	Low	67 Å²	67	79 Å²	79	41%	0.411	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-83.5	118	172.9	-48.2	0	0	0	0	110.2	Q719 R726 D780	Q719-T778 PolarHBondContact NE2-OG1 2.93Å; R726-T778 PolarHBondContact NH1-O 3.35Å; T778-D780 PolarHBondContact O-N 2.75Å
779	I	67.7	Low	58.5	Low	62 Å²	62	77.7 Å²	77.7	32%	0.318	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-77.7	120.1	170.7	-67	166.4	0	0	0	109.3	C745 T772	C745-I779 HydrophobicContact CB-CD1 3.7Å; C745-I779 HydrophobicContact CB-CG1 4.29Å; C745-I779 HydrophobicContact CB-CG2 3.95Å; C745-I779 VanDerWaalsContact SG-CD1 3.58Å; T772-I779 HydrophobicContact CG2-CD1 3.52Å; T772-I779 HydrophobicContact CG2-CG1 4.23Å
780	D	68.3	Low	57.3	Low	17 Å²	17	79.5 Å²	79.5	9%	0.091	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-95.9	130.1	162.9	-93	23.1	0	0	0	109.5	R723 R726 R727 T778	R723-D780 VanDerWaalsContact CB-OD2 3.29Å; R723-D780 WeakPolarHBondContact CB-OD2 3.16Å; R723-D780 VanDerWaalsContact CG-OD2 3.23Å; R723-D780 WeakPolarHBondContact CG-OD2 3.42Å; R723-D780 IonicContact CZ-OD2 2.75Å; R723-D780 IonicContact NH1-OD1 2.66Å; R723-D780 PolarHBondContact NH1-OD1 3.08Å; R723-D780 IonicContact NH1-OD2 3.17Å; R723-D780 PolarHBondContact NH1-OD2 2.98Å; R726-D780 IonicContact CZ-OD1 3.45Å; R726-D780 IonicContact CZ-OD2 2.75Å; R726-D780 IonicContact NH1-OD1 3.01Å; R726-D780 PolarHBondContact NH1-OD1 3.15Å; R726-D780 IonicContact NH1-OD2 3.74Å; R726-D780 VanDerWaalsContact NH2-CG 3.27Å; R726-D780 IonicContact NH2-OD1 2.74Å; R726-D780 PolarHBondContact NH2-OD1 2.7Å; R726-D780 IonicContact NH2-OD2 3.91Å; R726-D780 PolarHBondContact NH2-OD2 3.12Å; R727-D780 HydrophobicContact CG-CB 3.72Å; T778-D780 PolarHBondContact O-N 2.75Å
781	P	55.9	Low	55.7	Low	80 Å²	80	84.5 Å²	84.5	52%	0.519	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-65.3	149.9	179.1	26.7	-34.2	0	0	0	111.7	T783	P781-T783 PolarHBondContact O-N 3.42Å
782	P	52	Low	53.9	Low	92 Å²	92	92.7 Å²	92.7	60%	0.597	51%	0.512	S	S	*	.	S	Bend	trans	-67.7	0.4	-173.6	24.2	-33.1	0	0	0	115.6
783	T	42.3	Very low	52	Low	102 Å²	102	100 Å²	100	63%	0.626	55%	0.546	S	S	*	.	S	Bend	trans	-139.7	136.4	169.4	38.9	0	0	0	0	110.6	P781	P781-T783 PolarHBondContact O-N 3.42Å
784	P	36.9	Very low	50.2	Low	85 Å²	85	101.1 Å²	101.1	55%	0.552	56%	0.557	S	S	*	*			trans	-61.1	151.8	162.3	-14.3	29.5	0	0	0	110.1
785	K	37.3	Very low	48.4	Very low	185 Å²	185	106.1 Å²	106.1	80%	0.804	58%	0.577	S	S	*	*			trans	-70.6	137.2	154.4	-68.7	-179	-179.8	177	0	107.3	D787	K785-D787 VanDerWaalsContact C-N 3.28Å; K785-D787 PolarHBondContact O-N 3.18Å; K785-D787 VanDerWaalsContact O-N 3.14Å
786	V	34.2	Very low	46.7	Very low	130 Å²	130	111 Å²	111	79%	0.788	61%	0.609	S	S	*	*			trans	-89.4	73.6	179.6	-174.5	0	0	0	0	108.6
787	D	33.8	Very low	44.6	Very low	117 Å²	117	109.3 Å²	109.3	63%	0.626	61%	0.606	S	S	*	*			trans	-89.2	132.4	164.7	-64	-57.4	0	0	0	107.5	K785 S789	K785-D787 VanDerWaalsContact C-N 3.28Å; K785-D787 PolarHBondContact O-N 3.18Å; K785-D787 VanDerWaalsContact O-N 3.14Å; D787-S789 VanDerWaalsContact C-N 3.25Å; D787-S789 PolarHBondContact O-N 2.79Å; D787-S789 VanDerWaalsContact O-N 3.08Å
788	Q	34.1	Very low	42.9	Very low	196 Å²	196	113.3 Å²	113.3	92%	0.916	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	21.9	-158.2	-65.7	-177.3	-27.7	0	0	115.4
789	S	35	Very low	41.1	Very low	87 Å²	87	112.7 Å²	112.7	61%	0.608	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-36.8	-172	40.3	0	0	0	0	115.3	D787	D787-S789 VanDerWaalsContact C-N 3.25Å; D787-S789 PolarHBondContact O-N 2.79Å; D787-S789 VanDerWaalsContact O-N 3.08Å
790	D	31.8	Very low	39.6	Very low	136 Å²	136	115.1 Å²	115.1	73%	0.727	64%	0.637	S	S	*	*			trans	-116.1	89.7	-158.3	-59.8	-74.5	0	0	0	112.9
791	V	36	Very low	38.3	Very low	134 Å²	134	119 Å²	119	81%	0.812	66%	0.657	S	S	*	*			trans	-96.2	82.1	172.2	-175	0	0	0	0	109.5	Q793	V791-Q793 PolarHBondContact O-N 3.17Å
792	E	38.5	Very low	37.5	Very low	176 Å²	176	119 Å²	119	82%	0.822	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-70.5	117.6	166	-72.1	-173.3	135	0	0	109.8
793	Q	37	Very low	36.9	Very low	164 Å²	164	118.5 Å²	118.5	77%	0.766	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-65.9	139.3	168.8	-77.6	-83	-10.8	0	0	109.7	V791 E795	V791-Q793 PolarHBondContact O-N 3.17Å; Q793-E795 PolarHBondContact O-N 3.02Å
794	P	38.6	Very low	36.7	Very low	101 Å²	101	119.9 Å²	119.9	66%	0.656	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-72.1	126.6	171.4	30.2	-32.3	0	0	0	110.1
795	E	34.2	Very low	36.7	Very low	153 Å²	153	125.4 Å²	125.4	72%	0.715	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-65.7	127.7	169.9	-69.3	-163.8	143.7	0	0	110	Q793 C797	Q793-E795 PolarHBondContact O-N 3.02Å; E795-C797 VanDerWaalsContact C-N 3.28Å; E795-C797 PolarHBondContact O-N 3.36Å
796	P	34.1	Very low	36.6	Very low	105 Å²	105	121.2 Å²	121.2	68%	0.682	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-2.2	-166.2	30.6	-36.4	0	0	0	114.7
797	C	33.5	Very low	36.4	Very low	89 Å²	89	120.4 Å²	120.4	60%	0.601	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-11.2	-161.9	53.6	0	0	0	0	117	E795	E795-C797 VanDerWaalsContact C-N 3.28Å; E795-C797 PolarHBondContact O-N 3.36Å
798	L	40.2	Very low	36.2	Very low	101 Å²	101	119.9 Å²	119.9	53%	0.529	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-118.7	-13	178.9	-85.3	170.6	0	0	0	114.7	L802	L798-L802 PolarHBondContact O-N 3.44Å
799	V	42.4	Very low	35.9	Very low	54 Å²	54	118.8 Å²	118.8	33%	0.327	64%	0.636	S	S	.	*	H	α-helix	trans	-68.9	-38.4	-177.4	176.8	0	0	0	0	110.9	N803	V799-N803 VanDerWaalsContact CG1-ND2 3.33Å; V799-N803 WeakPolarHBondContact CG1-ND2 3.35Å; V799-N803 WeakPolarHBondContact O-CB 3.44Å; V799-N803 VanDerWaalsContact O-CG 3.23Å; V799-N803 PolarHBondContact O-N 2.57Å; V799-N803 PolarHBondContact O-ND2 2.92Å; V799-N803 VanDerWaalsContact O-ND2 3.08Å
800	D	36.4	Very low	35.5	Very low	113 Å²	113	119.7 Å²	119.7	60%	0.604	64%	0.643	S	S	*	*	H	α-helix	trans	-71.1	-47.2	-178.5	-66.9	-26.8	0	0	0	112	L802 N803 Q804	D800-L802 VanDerWaalsContact C-N 3.32Å; D800-L802 PolarHBondContact O-N 3.18Å; D800-N803 PolarHBondContact O-N 3.13Å; D800-Q804 VanDerWaalsContact O-CB 3.22Å; D800-Q804 WeakPolarHBondContact O-CB 3.26Å; D800-Q804 PolarHBondContact O-N 2.71Å
801	L	39.9	Very low	35.3	Very low	99 Å²	99	119.1 Å²	119.1	52%	0.518	65%	0.648	S	S	.	*	H	α-helix	trans	-53.2	-48.2	175.1	-103.6	75	0	0	0	111.9	Q804 Y805	L801-Q804 PolarHBondContact O-N 2.84Å; L801-Y805 WeakPolarHBondContact O-CD2 3.38Å; L801-Y805 PolarHBondContact O-N 2.97Å
802	L	40.3	Very low	34.9	Very low	80 Å²	80	118 Å²	118	42%	0.419	65%	0.646	S	S	.	*	H	α-helix	trans	-71.7	-30.7	-177.1	-73	170.7	0	0	0	113.3	W724 L798 D800	W724-L802 HydrophobicContact CH2-CD1 4.27Å; W724-L802 HydrophobicContact CZ3-CD1 4.35Å; L798-L802 PolarHBondContact O-N 3.44Å; D800-L802 VanDerWaalsContact C-N 3.32Å; D800-L802 PolarHBondContact O-N 3.18Å
803	N	39.1	Very low	34.7	Very low	81 Å²	81	117.2 Å²	117.2	43%	0.433	65%	0.647	S	S	.	*	H	α-helix	trans	-78.7	-29.7	174	-70.5	-30.6	0	0	0	112.4	V799 D800 Y805 D806 T807	V799-N803 VanDerWaalsContact CG1-ND2 3.33Å; V799-N803 WeakPolarHBondContact CG1-ND2 3.35Å; V799-N803 WeakPolarHBondContact O-CB 3.44Å; V799-N803 VanDerWaalsContact O-CG 3.23Å; V799-N803 PolarHBondContact O-N 2.57Å; V799-N803 PolarHBondContact O-ND2 2.92Å; V799-N803 VanDerWaalsContact O-ND2 3.08Å; D800-N803 PolarHBondContact O-N 3.13Å; N803-Y805 VanDerWaalsContact C-N 3.34Å; N803-Y805 PolarHBondContact O-N 3.41Å; N803-D806 PolarHBondContact O-N 3.41Å; N803-D806 VanDerWaalsContact O-N 3.15Å; N803-T807 PolarHBondContact O-N 2.76Å; N803-T807 PolarHBondContact O-OG1 3.33Å
804	Q	38	Very low	34.3	Very low	131 Å²	131	116.7 Å²	116.7	61%	0.612	65%	0.65	S	S	*	*	H	α-helix	trans	-65.6	-37.7	179.6	-161.9	164.5	33.2	0	0	111.3	D800 L801 D806 T807	D800-Q804 VanDerWaalsContact O-CB 3.22Å; D800-Q804 WeakPolarHBondContact O-CB 3.26Å; D800-Q804 PolarHBondContact O-N 2.71Å; L801-Q804 PolarHBondContact O-N 2.84Å; Q804-D806 PolarHBondContact O-N 2.83Å; Q804-T807 PolarHBondContact O-N 2.75Å
805	Y	35.8	Very low	34.1	Very low	202 Å²	202	118.4 Å²	118.4	79%	0.792	66%	0.659	S	S	*	*	H	α-helix	trans	-68.4	-26.4	171.3	-74.2	-66.6	0	0	0	114.7	L801 N803 T807	L801-Y805 WeakPolarHBondContact O-CD2 3.38Å; L801-Y805 PolarHBondContact O-N 2.97Å; N803-Y805 VanDerWaalsContact C-N 3.34Å; N803-Y805 PolarHBondContact O-N 3.41Å; Y805-T807 VanDerWaalsContact C-N 3.33Å
806	D	36.2	Very low	33.9	Very low	97 Å²	97	119 Å²	119	52%	0.519	67%	0.667	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.3	-2.5	176.7	-105.6	-6.4	0	0	0	112.6	R732 N803 Q804	R732-D806 IonicContact CZ-OD2 3.63Å; R732-D806 IonicContact NH1-OD1 2.67Å; R732-D806 IonicContact NH1-OD2 2.67Å; R732-D806 PolarHBondContact NH1-OD2 2.67Å; R732-D806 IonicContact NH2-OD2 3.68Å; R732-D806 PolarHBondContact NH2-OD2 3.13Å; N803-D806 PolarHBondContact O-N 3.41Å; N803-D806 VanDerWaalsContact O-N 3.15Å; Q804-D806 PolarHBondContact O-N 2.83Å
807	T	30	Very low	33.5	Very low	112 Å²	112	119 Å²	119	69%	0.687	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137	4	-165.6	-31.1	0	0	0	0	118.2	N803 Q804 Y805	N803-T807 PolarHBondContact O-N 2.76Å; N803-T807 PolarHBondContact O-OG1 3.33Å; Q804-T807 PolarHBondContact O-N 2.75Å; Y805-T807 VanDerWaalsContact C-N 3.33Å
808	V	29	Very low	33.3	Very low	107 Å²	107	119.5 Å²	119.5	65%	0.648	67%	0.674	S	S	*	*			trans	-136.7	91.1	-179	-165.9	0	0	0	0	115.5
809	I	27.3	Very low	32.7	Very low	172 Å²	172	120.6 Å²	120.6	88%	0.882	69%	0.685	S	S	*	*	S	Bend	trans	-146.7	66.8	151.5	-46.7	179	0	0	0	110.2
810	S	26.4	Very low	32	Very low	106 Å²	106	125.3 Å²	125.3	74%	0.741	71%	0.707	S	S	*	*			trans	-170.4	58.8	165.7	63.4	0	0	0	0	114.6
811	C	28.6	Very low	31.6	Very low	125 Å²	125	124 Å²	124	85%	0.845	71%	0.706	S	S	*	*			trans	-142.7	81.5	167.7	-84.4	0	0	0	0	110.8
812	S	27.8	Very low	31.1	Very low	109 Å²	109	125.4 Å²	125.4	76%	0.762	72%	0.72	S	S	*	*			trans	-79.6	126.3	160.5	-53.7	0	0	0	0	108.6
813	N	33.2	Very low	30.6	Very low	160 Å²	160	126.1 Å²	126.1	86%	0.856	73%	0.731	S	S	*	*			trans	-132.8	98.1	167.3	-98.4	8.2	0	0	0	107.9
814	D	29.5	Very low	30.1	Very low	153 Å²	153	128.2 Å²	128.2	82%	0.818	74%	0.743	S	S	*	*			trans	-76	120.1	170.8	-53.9	-75.5	0	0	0	110
815	T	34.5	Very low	29.7	Very low	138 Å²	138	128.7 Å²	128.7	85%	0.847	75%	0.745	S	S	*	*			trans	-148.2	119.8	151.4	38.3	0	0	0	0	109.6
816	N	29	Very low	29.3	Very low	164 Å²	164	124 Å²	124	88%	0.877	74%	0.741	S	S	*	*			trans	-70.8	148.4	173.9	-56.2	-68.2	0	0	0	111.3
817	S	27.2	Very low	29.1	Very low	105 Å²	105	121.6 Å²	121.6	73%	0.734	74%	0.735	S	S	*	*				163.9	141.5	114.3	-170.8	0	0	0	0	114.5
818	S	29.1	Very low	29.2	Very low	100 Å²	100	119.7 Å²	119.7	70%	0.699	73%	0.725	S	S	*	*			trans	51	78.5	145.6	60.4	0	0	0	0	120.6
819	V	26.6	Very low	29.1	Very low	125 Å²	125	120.3 Å²	120.3	76%	0.758	73%	0.732	S	S	*	*				12.9	125.6	115.5	-171.5	0	0	0	0	118.3
820	L	27	Very low	29	Very low	153 Å²	153	117.9 Å²	117.9	80%	0.801	73%	0.725	S	S	*	*				167	112	124.5	-104.2	110.3	0	0	0	107.5
821	S	28.1	Very low	29	Very low	84 Å²	84	118.9 Å²	118.9	59%	0.587	73%	0.726	S	S	*	*				52.4	121.7	66.7	82.6	0	0	0	0	112
822	T	29.8	Very low	28.8	Very low	130 Å²	130	120.9 Å²	120.9	80%	0.798	72%	0.723	S	S	*	*			cis	-169.6	169.3	41.5	44.1	0	0	0	0	109.3
823	S	29.7	Very low	28.9	Very low	94 Å²	94	121.1 Å²	121.1	66%	0.657	72%	0.72	S	S	*	*			cis	-177.3	-167.9	-13.7	52.7	0	0	0	0	109.4
824	N	28.9	Very low	28.5	Very low	126 Å²	126	119.6 Å²	119.6	67%	0.674	72%	0.717	S	S	*	*			trans	82.5	104.5	167	-59.4	37.6	0	0	0	116.4
825	E	28.7	Very low	28.5	Very low	141 Å²	141	119.5 Å²	119.5	66%	0.659	72%	0.715	S	S	*	*				75.7	125.7	85.3	-71.7	174.2	132.4	0	0	113.9
826	S	29	Very low	28.2	Very low	103 Å²	103	117.6 Å²	117.6	72%	0.72	70%	0.703	S	S	*	*				-177.8	-176.1	68.6	48.3	0	0	0	0	112.8	P412	P412-S826 WeakPolarHBondContact CG-O 3.42Å
827	A	31.7	Very low	28	Very low	47 Å²	47	119.7 Å²	119.7	39%	0.388	70%	0.701	S	S	.	*			trans	-40	156.6	-143.4	0	0	0	0	0	125.1	L410 G411 P412	L410-A827 HydrophobicContact CB-CB 4.44Å; L410-A827 HydrophobicContact CD2-CB 3.4Å; L410-A827 VanDerWaalsContact CD2-CB 3.4Å; L410-A827 HydrophobicContact CG-CB 3.67Å; G411-A827 VanDerWaalsContact O-CA 3.31Å; G411-A827 WeakPolarHBondContact O-CA 3.39Å; P412-A827 VanDerWaalsContact CG-CA 3.47Å
828	P	32.2	Very low	28.1	Very low	72 Å²	72	120.4 Å²	120.4	47%	0.468	70%	0.695	S	S	.	*			trans	-110.5	177.8	-176	42.5	-28.5	0	0	0	113	G411 P412	G411-P828 VanDerWaalsContact CA-CD 3.45Å; P412-P828 HydrophobicContact CB-CB 3.67Å; P412-P828 HydrophobicContact CB-CG 3.61Å
829	C	25.7	Very low	28	Very low	119 Å²	119	123.8 Å²	123.8	80%	0.804	70%	0.697	S	S	*	*			trans	-149.7	140	140.3	-153.6	0	0	0	0	110.8
830	V	26	Very low	28.3	Very low	121 Å²	121	127.1 Å²	127.1	73%	0.733	70%	0.701	S	S	*	*			trans	-87.4	132.4	168.3	175	0	0	0	0	108	E832	V830-E832 HydrophobicContact CG1-CG 4.28Å
831	V	26.7	Very low	28.4	Very low	127 Å²	127	125 Å²	125	77%	0.77	69%	0.691	S	S	*	*			trans	-129.8	113.3	157.6	-179.5	0	0	0	0	106.7
832	E	24.7	Very low	28.4	Very low	167 Å²	167	128 Å²	128	78%	0.78	70%	0.7	S	S	*	*			trans	-67.1	152	171.6	-61.7	172.4	106.8	0	0	109.8	V830	V830-E832 HydrophobicContact CG1-CG 4.28Å
833	T	28.5	Very low	28.6	Very low	114 Å²	114	129.5 Å²	129.5	70%	0.699	70%	0.702	S	S	*	*			trans	-138.2	92.2	164.8	-49.6	0	0	0	0	109	I835	T833-I835 PolarHBondContact O-N 3.44Å
834	T	25.8	Very low	28.5	Very low	128 Å²	128	131.5 Å²	131.5	79%	0.785	71%	0.706	S	S	*	*			trans	-60.3	113.7	173.4	44.1	0	0	0	0	110.7
835	I	29.7	Very low	28.4	Very low	152 Å²	152	130.7 Å²	130.7	78%	0.779	71%	0.71	S	S	*	*			trans	-89.5	111.3	174.4	-62.1	179	0	0	0	109.3	T833	T833-I835 PolarHBondContact O-N 3.44Å
836	T	27.4	Very low	28.4	Very low	98 Å²	98	129.5 Å²	129.5	60%	0.601	71%	0.712	S	S	*	*			trans	-79.7	128.9	172.7	43	0	0	0	0	111.2	I838	T836-I838 PolarHBondContact O-N 2.93Å
837	Y	24.9	Very low	28.3	Very low	208 Å²	208	131.3 Å²	131.3	82%	0.816	71%	0.713	S	S	*	*			trans	-72.6	124.8	175.4	-95.2	-95.3	0	0	0	111.8
838	I	28.8	Very low	28.2	Very low	119 Å²	119	134.5 Å²	134.5	61%	0.61	73%	0.728	S	S	*	*			trans	-126.4	98.3	162.2	-44.3	-166.5	0	0	0	109.8	N395 T836	N395-I838 HydrophobicContact CB-CD1 3.87Å; N395-I838 HydrophobicContact CB-CG1 4.42Å; T836-I838 PolarHBondContact O-N 2.93Å
839	K	28.2	Very low	28	Very low	171 Å²	171	136 Å²	136	74%	0.743	74%	0.741	S	S	*	*			trans	-79.3	137.4	167.8	-167.1	178.8	-177.3	-178.3	0	109.2
840	K	32.4	Very low	28.1	Very low	196 Å²	196	134.9 Å²	134.9	85%	0.852	73%	0.734	S	S	*	*			trans	-150.4	112.3	170.1	-153.2	169.9	-170.9	175.7	0	111.8
841	D	29.5	Very low	28.4	Very low	108 Å²	108	136.3 Å²	136.3	58%	0.578	74%	0.737	S	S	*	*			trans	-84.6	166.6	-177.5	-51.9	-76.5	0	0	0	112.8
842	N	28.7	Very low	28.4	Very low	146 Å²	146	135.8 Å²	135.8	78%	0.781	74%	0.739	S	S	*	*			trans	73.3	118.9	169.6	-51.6	-61.7	0	0	0	118.3
843	L	33.3	Very low	28.7	Very low	163 Å²	163	131.4 Å²	131.4	85%	0.853	74%	0.738	S	S	*	*				-165.8	105.7	110.9	-103.1	167.7	0	0	0	113.8
844	N	27.6	Very low	28.7	Very low	135 Å²	135	131.3 Å²	131.3	72%	0.722	74%	0.742	S	S	*	*			trans	14.9	125.3	147.4	-63.6	-23	0	0	0	123.2
845	S	27.7	Very low	28.7	Very low	109 Å²	109	132 Å²	132	76%	0.762	74%	0.741	S	S	*	*				78.8	178.1	120.1	84.3	0	0	0	0	121.9
846	V	28.7	Very low	28.7	Very low	116 Å²	116	131.9 Å²	131.9	70%	0.703	74%	0.742	S	S	*	*			trans	77.5	90.4	-177.4	-171.2	0	0	0	0	113.3
847	N	26.9	Very low	28.9	Very low	141 Å²	141	134.4 Å²	134.4	75%	0.754	75%	0.75	S	S	*	*				79.2	150.5	88.9	-69.7	-12.3	0	0	0	113
848	T	29.2	Very low	29	Very low	114 Å²	114	130.3 Å²	130.3	70%	0.699	75%	0.749	S	S	*	*			cis	-165.5	151.7	9.6	-0.8	0	0	0	0	111.1
849	S	28.4	Very low	29	Very low	104 Å²	104	130 Å²	130	73%	0.727	75%	0.752	S	S	*	*			trans	59	158.5	138.2	76.5	0	0	0	0	121.6
850	S	27.7	Very low	29	Very low	95 Å²	95	127.1 Å²	127.1	66%	0.664	75%	0.754	S	S	*	*			cis	178.6	179	-22.4	57	0	0	0	0	109.7
851	L	30.6	Very low	28.7	Very low	151 Å²	151	124.3 Å²	124.3	79%	0.791	75%	0.746	S	S	*	*			trans	70.9	131.6	177.9	-75.2	70.3	0	0	0	114.7
852	S	27.3	Very low	28.6	Very low	116 Å²	116	126.1 Å²	126.1	81%	0.811	76%	0.756	S	S	*	*			cis	92.6	138.4	11.8	94.9	0	0	0	0	118.4
853	G	31.6	Very low	28.5	Very low	75 Å²	75	123.5 Å²	123.5	77%	0.773	75%	0.749	S	S	*	*			trans	111.5	137.8	-177.8	0	0	0	0	0	112.8
854	S	27.4	Very low	28.3	Very low	112 Å²	112	121.6 Å²	121.6	78%	0.783	75%	0.748	S	S	*	*			cis	-157.2	179.2	-10.7	-159.1	0	0	0	0	111.2
855	L	25.8	Very low	28.3	Very low	143 Å²	143	119.8 Å²	119.8	75%	0.749	75%	0.746	S	S	*	*			trans	-38.8	148.3	171.2	-77.5	65.4	0	0	0	113.6
856	D	30.6	Very low	28.2	Very low	150 Å²	150	120.9 Å²	120.9	80%	0.802	75%	0.748	S	S	*	*				-158.8	160.8	74	-99.9	-39.1	0	0	0	115.8
857	I	30.9	Very low	28	Very low	151 Å²	151	120 Å²	120	77%	0.774	75%	0.747	S	S	*	*			trans	-123	133.9	172.4	-58.5	169	0	0	0	108.5
858	P	27.9	Very low	27.9	Very low	122 Å²	122	123 Å²	123	79%	0.792	75%	0.754	S	S	*	*			trans	-132.6	139.5	139.4	33.9	-22.3	0	0	0	113.6
859	V	28	Very low	27.8	Very low	111 Å²	111	123 Å²	123	67%	0.673	76%	0.757	S	S	*	*			trans	-82.5	132.4	172.6	168.2	0	0	0	0	110.4	I861	V859-I861 HydrophobicContact CG1-CD1 3.76Å; V859-I861 HydrophobicContact CG1-CG1 3.77Å
860	S	28.7	Very low	27.9	Very low	112 Å²	112	125.5 Å²	125.5	78%	0.783	76%	0.762	S	S	*	*			trans	-157.9	117.8	156.1	-74.6	0	0	0	0	106.7
861	I	25.4	Very low	28	Very low	136 Å²	136	128.1 Å²	128.1	70%	0.697	77%	0.769	S	S	*	*			cis	61	73.9	49.2	-45.6	172.8	0	0	0	111.8	V859	V859-I861 HydrophobicContact CG1-CD1 3.76Å; V859-I861 HydrophobicContact CG1-CG1 3.77Å
862	N	28.6	Very low	27.8	Very low	147 Å²	147	128.1 Å²	128.1	79%	0.786	77%	0.77	S	S	*	*			trans	-165.9	115.2	135.4	-94.6	-42.4	0	0	0	106.8
863	S	26.1	Very low	27.8	Very low	90 Å²	90	129.8 Å²	129.8	63%	0.629	77%	0.767	S	S	*	*				101.6	151.6	50.1	70.5	0	0	0	0	110.8
864	C	28.6	Very low	27.7	Very low	124 Å²	124	131.3 Å²	131.3	84%	0.838	77%	0.765	S	S	*	*			trans	65.8	140.6	-165.7	-53.6	0	0	0	0	115.2
865	S	28	Very low	27.8	Very low	97 Å²	97	132.4 Å²	132.4	68%	0.678	76%	0.762	S	S	*	*			cis	-172.4	122.5	-25.1	42.4	0	0	0	0	110.6
866	V	25.1	Very low	28.2	Very low	131 Å²	131	130.6 Å²	130.6	79%	0.794	76%	0.762	S	S	*	*				63.9	139.9	126.3	-179.3	0	0	0	0	121
867	S	25.6	Very low	28.3	Very low	99 Å²	99	131.7 Å²	131.7	69%	0.692	76%	0.762	S	S	*	*			trans	64.3	125	168.6	51.2	0	0	0	0	117.1
868	F	25.5	Very low	28.3	Very low	203 Å²	203	131.8 Å²	131.8	89%	0.89	76%	0.763	S	S	*	*				63	112.6	57.1	-83	-77.5	0	0	0	114.8
869	C	27.2	Very low	28.6	Very low	114 Å²	114	131.9 Å²	131.9	77%	0.77	76%	0.761	S	S	*	*			trans	-157.5	124.5	145.7	-92.7	0	0	0	0	109.6
870	N	30.3	Very low	28.9	Very low	157 Å²	157	131.2 Å²	131.2	84%	0.84	76%	0.762	S	S	*	*			trans	-74.2	156.4	142.1	-66.6	-28.6	0	0	0	107
871	N	28.2	Very low	29.2	Very low	149 Å²	149	132.4 Å²	132.4	80%	0.797	76%	0.759	S	S	*	*			trans	-158.2	100.8	152.1	-93.6	-31.4	0	0	0	110.6
872	D	28	Very low	29.6	Very low	151 Å²	151	131.3 Å²	131.3	81%	0.807	76%	0.764	S	S	*	*			trans	-64.2	172.6	136.4	-97.2	-54.7	0	0	0	110.1
873	M	27	Very low	30	Very low	152 Å²	152	128.4 Å²	128.4	75%	0.749	76%	0.76	S	S	*	*			trans	62.8	110.9	169.4	-65	-155.4	72.3	0	0	118.1
874	S	29.7	Very low	30.3	Very low	107 Å²	107	131.4 Å²	131.4	75%	0.748	77%	0.768	S	S	*	*	S	Bend	trans	-72.2	126.6	139.8	-57.3	0	0	0	0	109.4
875	N	29.7	Very low	30.6	Very low	134 Å²	134	132.2 Å²	132.2	72%	0.717	76%	0.764	S	S	*	*	S	Bend	trans	76.4	111.8	161.4	-55	-29	0	0	0	120.7
876	S	32.4	Very low	30.8	Very low	106 Å²	106	133.4 Å²	133.4	74%	0.741	77%	0.767	S	S	*	*			trans	106.2	96.2	134.9	68.7	0	0	0	0	122.8
877	Q	33.7	Very low	31.3	Very low	173 Å²	173	132.1 Å²	132.1	81%	0.808	76%	0.764	S	S	*	*			trans	80.1	93.2	132.5	-63.1	-179.2	-61.5	0	0	124
878	L	31.1	Very low	31.6	Very low	153 Å²	153	134.7 Å²	134.7	80%	0.801	77%	0.77	S	S	*	*				82	122.8	116.8	-71.6	167.2	0	0	0	124.8
879	V	34.2	Very low	31.9	Very low	123 Å²	123	132.7 Å²	132.7	75%	0.745	77%	0.767	S	S	*	*			trans	99.7	104	135.5	173.7	0	0	0	0	122.7
880	S	33.7	Very low	32.3	Very low	98 Å²	98	132.8 Å²	132.8	69%	0.685	77%	0.766	S	S	*	*				53.6	150.9	128.7	-65.4	0	0	0	0	124.7
881	D	34.8	Very low	32.3	Very low	137 Å²	137	133.3 Å²	133.3	73%	0.733	76%	0.763	S	S	*	*			cis	-168.6	162.9	-6.9	-117.8	-60.1	0	0	0	115.5
882	S	35.2	Very low	32.6	Very low	113 Å²	113	132.9 Å²	132.9	79%	0.79	76%	0.756	S	S	*	*			trans	65	175.9	157.4	-71.4	0	0	0	0	121.4
883	A	35.4	Very low	32.8	Very low	85 Å²	85	131.5 Å²	131.5	70%	0.702	75%	0.749	S	S	*	*			cis	177.9	167.8	-37.8	0	0	0	0	0	109.9
884	L	33.5	Very low	33.1	Very low	153 Å²	153	129 Å²	129	80%	0.801	75%	0.746	S	S	*	*			cis	-170.6	167.8	-26	-101.1	172.9	0	0	0	112
885	N	34.1	Very low	33	Very low	142 Å²	142	128.8 Å²	128.8	76%	0.759	75%	0.745	S	S	*	*			trans	71.7	160.8	157.2	-72.5	-10.3	0	0	0	123.1
886	V	32.8	Very low	32.9	Very low	122 Å²	122	128.4 Å²	128.4	74%	0.739	75%	0.748	S	S	*	*			cis	-175.2	159.1	-41.8	124.8	0	0	0	0	113.7
887	S	34.4	Very low	32.7	Very low	103 Å²	103	134.3 Å²	134.3	72%	0.72	75%	0.754	S	S	*	*			trans	86.6	110.8	154.9	61.5	0	0	0	0	126.5
888	N	32.2	Very low	32.6	Very low	153 Å²	153	134.5 Å²	134.5	82%	0.818	76%	0.755	S	S	*	*			trans	12.1	139.7	136.3	-49.4	-10.2	0	0	0	125.2
889	I	32.5	Very low	32.6	Very low	162 Å²	162	133.7 Å²	133.7	83%	0.831	76%	0.756	S	S	*	*				168.5	135.6	107.9	-85.3	168.9	0	0	0	111
890	P	35.1	Very low	32.4	Very low	116 Å²	116	134.9 Å²	134.9	75%	0.753	76%	0.758	S	S	*	*			trans	-117	158.5	-178.9	40.6	-32.1	0	0	0	116.2
891	Q	31.4	Very low	32.5	Very low	168 Å²	168	137.9 Å²	137.9	79%	0.785	77%	0.766	S	S	*	*			trans	-165.4	150.8	151.3	-120.5	-174.7	51.7	0	0	115.7
892	Q	33.5	Very low	32.6	Very low	139 Å²	139	137.5 Å²	137.5	65%	0.65	76%	0.764	S	S	*	*			trans	79.4	116.3	149.6	-76.8	-169.5	59.3	0	0	123.9
893	N	32.3	Very low	32.7	Very low	122 Å²	122	138.3 Å²	138.3	65%	0.652	76%	0.759	S	S	*	*				91.6	139.4	129.3	-58.5	-11.8	0	0	0	122.9
894	S	32.3	Very low	32.7	Very low	99 Å²	99	140.2 Å²	140.2	69%	0.692	76%	0.758	S	S	*	*			trans	43.3	111.7	154.7	53.1	0	0	0	0	119
895	S	28	Very low	32.6	Very low	103 Å²	103	139.9 Å²	139.9	72%	0.72	76%	0.757	S	S	*	*				58.6	106.6	62.8	82.6	0	0	0	0	115.5
896	T	27.8	Very low	32.7	Very low	127 Å²	127	138.1 Å²	138.1	78%	0.779	75%	0.751	S	S	*	*				174.8	146.3	110.6	29.7	0	0	0	0	114.1
897	R	28.8	Very low	32.7	Very low	229 Å²	229	138.6 Å²	138.6	86%	0.864	75%	0.748	S	S	*	*			trans	71.8	139.7	146.7	-78.9	176.8	169.3	147.6	-1.8	122.2
898	E	30.9	Very low	32.4	Very low	178 Å²	178	140.5 Å²	140.5	83%	0.832	75%	0.749	S	S	*	*			trans	-71.5	151.8	160.9	-49.4	113.5	140.3	0	0	111.6
899	V	31.2	Very low	32.3	Very low	136 Å²	136	138.3 Å²	138.3	82%	0.824	74%	0.744	S	S	*	*			trans	-140	146.7	144.6	-177.1	0	0	0	0	106.5
900	D	30.7	Very low	32.2	Very low	148 Å²	148	138.7 Å²	138.7	79%	0.791	74%	0.742	S	S	*	*			trans	-63.8	151.1	175	-45	-101.9	0	0	0	112.5
901	D	36.6	Very low	31.9	Very low	160 Å²	160	138.5 Å²	138.5	86%	0.856	74%	0.744	S	S	*	*			trans	-165.8	156.3	148.9	-95.6	-27.9	0	0	0	107.3
902	D	35.5	Very low	32	Very low	129 Å²	129	137 Å²	137	69%	0.69	75%	0.746	S	S	*	*				-168.2	159	-54	-149.3	-0.4	0	0	0	105.3
903	L	37.5	Very low	32	Very low	131 Å²	131	135.8 Å²	135.8	69%	0.686	75%	0.75	S	S	*	*			trans	59.9	167.5	168.5	-80	76.4	0	0	0	117
904	D	34.8	Very low	31.9	Very low	125 Å²	125	135 Å²	135	67%	0.668	75%	0.752	S	S	*	*			cis	-159.8	163.2	-38.8	-109.9	-10.7	0	0	0	108
905	D	33.2	Very low	32.5	Very low	146 Å²	146	136.8 Å²	136.8	78%	0.781	76%	0.76	S	S	*	*			trans	62.6	169.9	147.6	-85.8	-9.1	0	0	0	118.3
906	V	34.4	Very low	32.4	Very low	105 Å²	105	139.7 Å²	139.7	64%	0.636	77%	0.766	S	S	*	*			cis	-152.1	151.5	4.3	94.1	0	0	0	0	111.1
907	I	33.8	Very low	32.7	Very low	132 Å²	132	137.6 Å²	137.6	68%	0.677	76%	0.762	S	S	*	*			trans	48	111.8	152.5	-69	161.2	0	0	0	118.7
908	I	28.6	Very low	32.7	Very low	143 Å²	143	132.1 Å²	132.1	73%	0.733	75%	0.754	S	S	*	*				84.5	140.8	68.6	-75.2	167.9	0	0	0	114.3
909	C	29.5	Very low	32.8	Very low	106 Å²	106	132.5 Å²	132.5	72%	0.716	76%	0.755	S	S	*	*			trans	70	156.6	167.1	-78.4	0	0	0	0	118
910	E	31	Very low	32.7	Very low	170 Å²	170	131.6 Å²	131.6	79%	0.794	75%	0.75	S	S	*	*			cis	-162.1	174.7	-25.1	-169.8	150.9	-162.9	0	0	110
911	S	28.3	Very low	33.1	Very low	113 Å²	113	130.3 Å²	130.3	79%	0.79	75%	0.75	S	S	*	*			trans	-68.8	137.2	-176.9	-49.8	0	0	0	0	114.4
912	V	34.4	Very low	32.9	Very low	137 Å²	137	129.6 Å²	129.6	83%	0.83	75%	0.746	S	S	*	*			trans	-135.9	123	167.5	-174.9	0	0	0	0	110.6
913	P	32.4	Very low	33	Very low	112 Å²	112	129.4 Å²	129.4	73%	0.727	75%	0.75	S	S	*	*			trans	-90.7	-177.6	176.1	40.1	-37.1	0	0	0	111.8
914	P	31.6	Very low	32.8	Very low	107 Å²	107	130 Å²	130	70%	0.695	75%	0.753	S	S	*	*			trans	-84.3	163.2	-151.4	34.8	-37.6	0	0	0	115.7	I916	P914-I916 PolarHBondContact O-N 3.27Å
915	P	42.8	Very low	32.7	Very low	135 Å²	135	129.4 Å²	129.4	88%	0.877	75%	0.754	S	S	*	*			trans	-74.5	107.2	172.3	30.9	-34.1	0	0	0	112
916	I	27.6	Very low	32.7	Very low	164 Å²	164	129 Å²	129	84%	0.841	75%	0.75	S	S	*	*			trans	-98.6	114.1	156.1	-61	172.5	0	0	0	107.3	P914	P914-I916 PolarHBondContact O-N 3.27Å
917	A	32.4	Very low	32.4	Very low	83 Å²	83	130.5 Å²	130.5	69%	0.686	75%	0.754	S	S	*	*			trans	-168	108.9	159.1	0	0	0	0	0	112.8
918	T	29	Very low	32.4	Very low	114 Å²	114	131.4 Å²	131.4	70%	0.699	76%	0.756	S	S	*	*			trans	27.9	128.6	133.5	57.7	0	0	0	0	120.8
919	H	33.6	Very low	32.3	Very low	186 Å²	186	132.6 Å²	132.6	86%	0.861	76%	0.758	S	S	*	*				-168.1	129.4	100.4	-99.7	-69.4	0	0	0	112.4
920	T	28.8	Very low	32.4	Very low	118 Å²	118	138.5 Å²	138.5	72%	0.724	77%	0.767	S	S	*	*			trans	-108.4	157.8	168.1	48.7	0	0	0	0	110.9
921	P	40.4	Very low	32.4	Very low	121 Å²	121	136.8 Å²	136.8	79%	0.786	76%	0.763	S	S	*	*				-126	136.6	117.1	4.5	16.9	0	0	0	110.5
922	N	32.6	Very low	32.6	Very low	144 Å²	144	136.8 Å²	136.8	77%	0.77	76%	0.758	S	S	*	*				88.2	161.5	62.2	-81.9	11.3	0	0	0	114.3
923	V	35.5	Very low	32.4	Very low	126 Å²	126	135.8 Å²	135.8	76%	0.764	75%	0.748	S	S	*	*			trans	86.3	83.7	-167.4	-170.2	0	0	0	0	111.9
924	D	33.5	Very low	32.5	Very low	142 Å²	142	137.4 Å²	137.4	76%	0.759	75%	0.751	S	S	*	*				85.1	143.3	72	-70.1	-44.9	0	0	0	111.8
925	V	32.9	Very low	32.5	Very low	113 Å²	113	136 Å²	136	69%	0.685	75%	0.748	S	S	*	*			cis	-162	151.6	17.6	88.9	0	0	0	0	113.7
926	I	33.7	Very low	31.9	Very low	137 Å²	137	138 Å²	138	70%	0.703	75%	0.745	S	S	*	*			trans	61.3	123.4	156.6	-74.5	157.4	0	0	0	119.2
927	L	28.2	Very low	32.2	Very low	138 Å²	138	139.7 Å²	139.7	72%	0.723	75%	0.75	S	S	*	*				70.5	141.1	62.5	-76.2	168.4	0	0	0	113.7
928	Q	32.8	Very low	32	Very low	151 Å²	151	140.9 Å²	140.9	71%	0.706	75%	0.754	S	S	*	*			cis	-137.2	149.1	13.3	-88.2	135.3	19.8	0	0	109.6
929	Q	27.9	Very low	32.3	Very low	168 Å²	168	143.6 Å²	143.6	79%	0.785	76%	0.758	S	S	*	*				46.5	118.6	79	-82.1	-171.8	-12.8	0	0	117.3
930	Y	32	Very low	32.4	Very low	229 Å²	229	143 Å²	143	90%	0.898	75%	0.753	S	S	*	*				-157.6	166.1	124.7	-109.2	-72.3	0	0	0	110.7
931	N	29.5	Very low	32.4	Very low	134 Å²	134	144.1 Å²	144.1	72%	0.717	75%	0.754	S	S	*	*			trans	-137.2	-172.9	-168.8	-171.5	12.4	0	0	0	109.3
932	V	33.8	Very low	32.2	Very low	113 Å²	113	144.3 Å²	144.3	69%	0.685	76%	0.755	S	S	*	*			trans	122.7	89.7	163.7	178.6	0	0	0	0	113.3
933	N	29.8	Very low	32	Very low	117 Å²	117	143.7 Å²	143.7	63%	0.626	75%	0.751	S	S	*	*				49.3	162	116.3	-54.3	-2.5	0	0	0	123.4
934	D	33.6	Very low	31.9	Very low	146 Å²	146	146.1 Å²	146.1	78%	0.781	76%	0.758	S	S	*	*			trans	77.8	147	155.1	-56.9	-33.9	0	0	0	118.9
935	A	31.6	Very low	31.7	Very low	77 Å²	77	143.3 Å²	143.3	64%	0.636	76%	0.755	S	S	*	*			cis	-176.8	143.3	-37.9	0	0	0	0	0	107.5
936	Q	30.5	Very low	31.8	Very low	176 Å²	176	144.4 Å²	144.4	82%	0.822	76%	0.762	S	S	*	*			trans	37	120.8	158.1	-59.9	-176.8	-5.2	0	0	120
937	Q	33.5	Very low	31.7	Very low	200 Å²	200	147 Å²	147	94%	0.935	77%	0.768	S	S	*	*				-168.7	166	112.6	-106.1	155.3	82.9	0	0	113.2
938	S	28.3	Very low	32	Very low	109 Å²	109	148 Å²	148	76%	0.762	77%	0.773	S	S	*	*			trans	-133.5	114.3	-172.8	59.5	0	0	0	0	112.2
939	E	36.9	Very low	32.2	Very low	170 Å²	170	146.3 Å²	146.3	79%	0.794	78%	0.775	S	S	*	*			trans	-147.6	162.3	166.8	-77.9	-148.9	116.5	0	0	109.5
940	K	34.5	Very low	32.4	Very low	173 Å²	173	147 Å²	147	75%	0.752	78%	0.778	S	S	*	*			cis	-176.7	137.4	-30.1	-176.3	169.6	174.4	-177.1	0	107.1
941	L	29.3	Very low	32.6	Very low	142 Å²	142	143.8 Å²	143.8	74%	0.743	78%	0.777	S	S	*	*			trans	-40.7	154	-177.1	-65.9	163.4	0	0	0	116.4	L943	L941-L943 HydrophobicContact CB-CD1 4.41Å; L941-L943 HydrophobicContact CD1-CD1 4Å; L941-L943 HydrophobicContact CD2-CD1 4.25Å; L941-L943 HydrophobicContact CG-CD1 4.47Å
942	P	35.3	Very low	32.6	Very low	125 Å²	125	145.7 Å²	145.7	81%	0.812	78%	0.781	S	S	*	*				-130.2	157.1	100.6	37.7	-32.1	0	0	0	115.5
943	L	28.7	Very low	32.4	Very low	132 Å²	132	147.9 Å²	147.9	69%	0.691	79%	0.788	S	S	*	*			trans	-89.2	154.3	171.6	-72.9	70.5	0	0	0	111.1	L941	L941-L943 HydrophobicContact CB-CD1 4.41Å; L941-L943 HydrophobicContact CD1-CD1 4Å; L941-L943 HydrophobicContact CD2-CD1 4.25Å; L941-L943 HydrophobicContact CG-CD1 4.47Å
944	I	32.9	Very low	32.2	Very low	177 Å²	177	148.1 Å²	148.1	91%	0.908	79%	0.793	S	S	*	*			trans	-133.2	141.8	142.5	-61.5	-175.9	0	0	0	107.5
945	A	30.4	Very low	32	Very low	83 Å²	83	148.2 Å²	148.2	69%	0.686	79%	0.792	S	S	*	*			trans	-151.1	140.5	-174.7	0	0	0	0	0	114.4
946	T	34.9	Very low	31.8	Very low	135 Å²	135	149.8 Å²	149.8	83%	0.828	79%	0.794	S	S	*	*			trans	-150.9	112.8	171.1	47	0	0	0	0	106.7
947	K	32.4	Very low	31.7	Very low	192 Å²	192	148.5 Å²	148.5	84%	0.835	79%	0.793	S	S	*	*			cis	87.8	133	25.3	-152.4	-176.2	-172.7	-173.1	0	114
948	L	34.3	Very low	31.5	Very low	159 Å²	159	144 Å²	144	83%	0.832	77%	0.772	S	S	*	*			trans	90.6	144.5	179.8	-56.4	169.6	0	0	0	115.9
949	P	37.3	Very low	31.3	Very low	115 Å²	115	144.3 Å²	144.3	75%	0.747	77%	0.773	S	S	*	*			cis	-133.3	-179.4	-38.6	39.2	-24.1	0	0	0	113.4
950	E	31.1	Very low	30.9	Very low	183 Å²	183	140.3 Å²	140.3	86%	0.855	77%	0.769	S	S	*	*			trans	-75.8	155.7	164.8	-59.3	166	146.7	0	0	110.5
951	D	35.4	Very low	30.4	Very low	162 Å²	162	137.2 Å²	137.2	87%	0.866	77%	0.769	S	S	*	*			trans	-156.1	159.7	148.6	-106	-31.7	0	0	0	109.7
952	E	29.9	Very low	30.4	Very low	173 Å²	173	135.8 Å²	135.8	81%	0.808	77%	0.771	S	S	*	*			trans	-73.7	166.7	-169.2	-54.8	176.1	107.2	0	0	112.6
953	I	30.3	Very low	30.1	Very low	160 Å²	160	134.4 Å²	134.4	82%	0.821	76%	0.764	S	S	*	*				-164.3	134.6	76.1	-82.2	159.9	0	0	0	110.4
954	T	25.7	Very low	30	Very low	121 Å²	121	134 Å²	134	74%	0.742	77%	0.767	S	S	*	*			trans	-96.3	-177.2	164.8	43.1	0	0	0	0	110.9
955	I	28.9	Very low	29.9	Very low	149 Å²	149	134.5 Å²	134.5	76%	0.764	76%	0.762	S	S	*	*			trans	107.3	100.2	-177.2	-61.8	156.4	0	0	0	110.2
956	T	28.3	Very low	29.9	Very low	109 Å²	109	134.8 Å²	134.8	67%	0.669	76%	0.759	S	S	*	*				76.5	111	55.8	71.3	0	0	0	0	115.9
957	D	26.9	Very low	29.7	Very low	149 Å²	149	134.3 Å²	134.3	80%	0.797	76%	0.756	S	S	*	*			trans	69	148.5	142.1	-62.8	-34.4	0	0	0	124
958	E	30.1	Very low	29.6	Very low	106 Å²	106	131 Å²	131	50%	0.495	75%	0.748	S	S	.	*			trans	66.3	109.5	154.4	-74.7	178.6	134.2	0	0	123	P222 P223	P222-E958 HydrophobicContact CG-CB 3.82Å; P222-E958 WeakPolarHBondContact CG-OE2 3.43Å; P223-E958 VanDerWaalsContact CB-CD 3.48Å; P223-E958 WeakPolarHBondContact CB-OE1 3.26Å; P223-E958 WeakPolarHBondContact CB-OE2 3.42Å; P223-E958 WeakPolarHBondContact CG-OE2 3.23Å
959	C	23.8	Very low	29.4	Very low	115 Å²	115	133.9 Å²	133.9	78%	0.777	75%	0.749	S	S	*	*				52	137	115.6	-65.3	0	0	0	0	123.1
960	A	27.6	Very low	29.1	Very low	86 Å²	86	134.2 Å²	134.2	71%	0.711	75%	0.749	S	S	*	*			trans	94.7	99.2	139.4	0	0	0	0	0	120.9
961	S	26	Very low	29.1	Very low	108 Å²	108	131.7 Å²	131.7	76%	0.755	75%	0.746	S	S	*	*				82.8	159.6	119.5	79.5	0	0	0	0	121.2
962	S	28.1	Very low	29	Very low	112 Å²	112	129.7 Å²	129.7	78%	0.783	74%	0.741	S	S	*	*			trans	72	144.4	170.9	78.1	0	0	0	0	117.5
963	S	28.5	Very low	29	Very low	97 Å²	97	126.5 Å²	126.5	68%	0.678	74%	0.738	S	S	*	*			cis	-170.8	140.2	-20.2	50.5	0	0	0	0	112.4
964	V	27.8	Very low	29.1	Very low	124 Å²	124	126.4 Å²	126.4	75%	0.752	74%	0.739	S	S	*	*			trans	58.7	118.6	134.4	179.6	0	0	0	0	116.9
965	K	30.6	Very low	29.4	Very low	186 Å²	186	127 Å²	127	81%	0.809	74%	0.743	S	S	*	*				-161.7	122.9	82.5	-83.8	175.8	-171.6	172.6	0	110.3
966	S	30	Very low	29.6	Very low	89 Å²	89	125.7 Å²	125.7	62%	0.622	74%	0.744	S	S	*	*				56.9	125	86.4	71.4	0	0	0	0	113.3
967	V	31.3	Very low	29.5	Very low	126 Å²	126	126.1 Å²	126.1	76%	0.764	75%	0.752	S	S	*	*				-167.8	152.7	68.7	152.9	0	0	0	0	108.5
968	D	29.2	Very low	29.7	Very low	122 Å²	122	126 Å²	126	65%	0.652	75%	0.75	S	S	*	*			cis	-167.1	155	-26.5	-86.7	-27.8	0	0	0	107.1
969	Y	30.6	Very low	29.8	Very low	220 Å²	220	127.9 Å²	127.9	86%	0.863	76%	0.763	S	S	*	*			trans	171.5	91.4	136.6	-104	-74.6	0	0	0	113.1
970	V	30.9	Very low	29.8	Very low	122 Å²	122	130.9 Å²	130.9	74%	0.739	77%	0.766	S	S	*	*			trans	35.6	104.2	133.2	-173.4	0	0	0	0	117.4
971	V	30.3	Very low	30.2	Very low	130 Å²	130	134.1 Å²	134.1	79%	0.788	77%	0.766	S	S	*	*			cis	65.2	136.8	47.3	-177.6	0	0	0	0	112.7
972	P	34.1	Very low	30.4	Very low	119 Å²	119	136.5 Å²	136.5	77%	0.773	77%	0.765	S	S	*	*			cis	-127.2	179	13.5	29	-6.2	0	0	0	117
973	S	30.3	Very low	30.5	Very low	107 Å²	107	137.3 Å²	137.3	75%	0.748	76%	0.76	S	S	*	*			trans	-107.7	155.8	165.3	55.3	0	0	0	0	111.5
974	D	33.1	Very low	30.6	Very low	157 Å²	157	138.5 Å²	138.5	84%	0.84	76%	0.759	S	S	*	*			trans	-138.4	126	164.7	-99.3	-44.4	0	0	0	112.1
975	T	31	Very low	30.6	Very low	135 Å²	135	137.6 Å²	137.6	83%	0.828	76%	0.758	S	S	*	*			trans	-151.8	126.1	165.1	53.8	0	0	0	0	110
976	P	33.3	Very low	30.7	Very low	121 Å²	121	134.2 Å²	134.2	79%	0.786	75%	0.753	S	S	*	*			trans	-117	119	164.2	33.8	-21.6	0	0	0	111.7
977	S	25.6	Very low	30.7	Very low	118 Å²	118	136.2 Å²	136.2	83%	0.825	76%	0.757	S	S	*	*			trans	-85.8	125	161.9	46.5	0	0	0	0	109.6
978	L	32	Very low	30.9	Very low	146 Å²	146	137.7 Å²	137.7	76%	0.764	76%	0.755	S	S	*	*			trans	-144.1	128.3	168.7	-78.1	-178.4	0	0	0	112.8
979	N	31	Very low	31.2	Very low	145 Å²	145	138.3 Å²	138.3	78%	0.775	76%	0.757	S	S	*	*			trans	65.4	115.3	143.2	-56	-3.6	0	0	0	120.5
980	E	25.2	Very low	31.3	Very low	179 Å²	179	134 Å²	134	84%	0.836	75%	0.749	S	S	*	*			trans	-65.4	148.7	144.4	-51.6	172.8	135.6	0	0	110.2
981	H	34.6	Very low	31.5	Very low	153 Å²	153	134.2 Å²	134.2	71%	0.708	75%	0.746	S	S	*	*			trans	167.6	134.9	132.3	-106.4	-113.8	0	0	0	111.4
982	E	31.4	Very low	31.7	Very low	158 Å²	158	135.1 Å²	135.1	74%	0.738	74%	0.741	S	S	*	*			trans	56.1	158.5	144.8	-64.5	176.6	115.4	0	0	120.5
983	L	29.1	Very low	31.7	Very low	129 Å²	129	135.8 Å²	135.8	68%	0.675	73%	0.734	S	S	*	*			cis	-159.4	171	-31.9	-112.1	173.4	0	0	0	107.8
984	D	30.5	Very low	32	Very low	123 Å²	123	137.6 Å²	137.6	66%	0.658	73%	0.734	S	S	*	*			trans	52.3	101.6	147	-67.9	-22.1	0	0	0	122.7
985	S	28.8	Very low	32	Very low	105 Å²	105	134.6 Å²	134.6	73%	0.734	73%	0.725	S	S	*	*				90.8	168.2	106.6	79.2	0	0	0	0	122.7
986	V	33.1	Very low	31.9	Very low	115 Å²	115	136.4 Å²	136.4	70%	0.697	73%	0.725	S	S	*	*			trans	74.8	97	168.7	-169.2	0	0	0	0	118.2
987	D	29.3	Very low	31.9	Very low	130 Å²	130	138 Å²	138	70%	0.695	73%	0.725	S	S	*	*				31.1	148.6	118.8	-49.7	-66.1	0	0	0	120
988	H	34.8	Very low	32.1	Very low	157 Å²	157	137.4 Å²	137.4	73%	0.727	72%	0.72	S	S	*	*				169.2	166.9	56.1	-133.7	4.8	0	0	0	110.3
989	I	37.1	Very low	32	Very low	136 Å²	136	133.9 Å²	133.9	70%	0.697	71%	0.712	S	S	*	*			trans	69.8	137.4	146.7	-71.3	164.7	0	0	0	118.9
990	N	33	Very low	32	Very low	129 Å²	129	134.2 Å²	134.2	69%	0.69	71%	0.714	S	S	*	*			cis	-175.9	178.1	-26.4	-119	15.4	0	0	0	110.8
991	N	34.8	Very low	32.2	Very low	126 Å²	126	130.2 Å²	130.2	67%	0.674	71%	0.706	S	S	*	*			trans	76.1	124.2	162.1	-62.5	3.4	0	0	0	116.9
992	E	34	Very low	31.9	Very low	150 Å²	150	127.4 Å²	127.4	70%	0.701	70%	0.703	S	S	*	*				80.1	141.5	56.7	-72.4	-161.8	123.7	0	0	113
993	Q	34.5	Very low	31.7	Very low	132 Å²	132	126.4 Å²	126.4	62%	0.617	70%	0.703	S	S	*	*			cis	-163.8	176.4	15.2	-133.7	172.4	39.5	0	0	111.5
994	I	35.1	Very low	31.6	Very low	145 Å²	145	125 Å²	125	74%	0.744	70%	0.704	S	S	*	*			trans	69.3	139.2	153.6	-69.6	160.9	0	0	0	116.7
995	S	33.6	Very low	31.4	Very low	95 Å²	95	126 Å²	126	66%	0.664	71%	0.709	S	S	*	*			cis	-166	130.5	-12.6	52.2	0	0	0	0	107.6
996	E	28.7	Very low	31.2	Very low	173 Å²	173	128 Å²	128	81%	0.808	71%	0.711	S	S	*	*				90.3	149	76.8	-153.6	-174.5	-131.8	0	0	114.2
997	I	33.8	Very low	30.9	Very low	154 Å²	154	131 Å²	131	79%	0.79	71%	0.714	S	S	*	*			trans	74.4	140.3	169.9	-47.1	-179.2	0	0	0	116.9
998	S	29.1	Very low	30.8	Very low	105 Å²	105	131.1 Å²	131.1	73%	0.734	72%	0.72	S	S	*	*			cis	-173.3	162.5	-33.5	-164.1	0	0	0	0	110.6
999	A	31	Very low	30.4	Very low	72 Å²	72	126.9 Å²	126.9	60%	0.595	71%	0.712	S	S	*	*			trans	68.5	131.2	149	0	0	0	0	0	122.5
1000	D	31.6	Very low	30	Very low	153 Å²	153	128.6 Å²	128.6	82%	0.818	72%	0.722	S	S	*	*			trans	60.8	151.1	130.9	-59.7	-10.7	0	0	0	122.5
1001	S	28.3	Very low	29.9	Very low	94 Å²	94	127.8 Å²	127.8	66%	0.657	73%	0.726	S	S	*	*			cis	-167.4	148.2	-23.5	56.6	0	0	0	0	111.2
1002	S	28.3	Very low	29.7	Very low	94 Å²	94	125.4 Å²	125.4	66%	0.657	73%	0.732	S	S	*	*			trans	63.1	152.1	148.5	80.6	0	0	0	0	122.6
1003	N	27.1	Very low	29.7	Very low	138 Å²	138	124.6 Å²	124.6	74%	0.738	74%	0.742	S	S	*	*			trans	69.5	97	145.7	-63	-28.3	0	0	0	122.4
1004	S	26.5	Very low	29.5	Very low	99 Å²	99	123.1 Å²	123.1	69%	0.692	75%	0.747	S	S	*	*				91.3	157.8	109.2	82.7	0	0	0	0	122
1005	L	26.9	Very low	29.3	Very low	143 Å²	143	126.6 Å²	126.6	75%	0.749	76%	0.757	S	S	*	*			trans	67.3	98.1	154.1	-68.4	165.8	0	0	0	120.6
1006	L	25.3	Very low	29.1	Very low	149 Å²	149	126.6 Å²	126.6	78%	0.78	76%	0.757	S	S	*	*				54.5	138.4	122.7	-68.3	177	0	0	0	122.4
1007	K	26.6	Very low	29.4	Very low	177 Å²	177	126 Å²	126	77%	0.77	76%	0.758	S	S	*	*			trans	92.9	125.9	132.8	-112.6	178.3	-178.6	177.7	0	120.1
1008	T	26.2	Very low	29.2	Very low	132 Å²	132	125.3 Å²	125.3	81%	0.81	76%	0.756	S	S	*	*			trans	69.6	152.2	152.7	12.2	0	0	0	0	116
1009	A	28.1	Very low	29.5	Very low	69 Å²	69	126 Å²	126	57%	0.57	76%	0.756	S	S	*	*			cis	-159.5	160.1	3	0	0	0	0	0	111.6
1010	L	28.2	Very low	29.7	Very low	171 Å²	171	126.9 Å²	126.9	90%	0.895	76%	0.758	S	S	*	*			trans	63.1	159.1	156.2	-56.3	166.4	0	0	0	115.5
1011	S	30.5	Very low	30	Very low	113 Å²	113	127.3 Å²	127.3	79%	0.79	76%	0.755	S	S	*	*			cis	-160.7	153.8	-16	41.3	0	0	0	0	105.3
1012	G	30.3	Very low	30.3	Very low	76 Å²	76	127.5 Å²	127.5	78%	0.784	75%	0.749	S	S	*	*			cis	130.6	109	15.1	0	0	0	0	0	109.2
1013	S	34	Very low	30.3	Very low	132 Å²	132	132.7 Å²	132.7	92%	0.923	75%	0.754	S	S	*	*			trans	-161.4	159	162.3	58	0	0	0	0	109.5
1014	S	29.7	Very low	30.4	Very low	102 Å²	102	133.8 Å²	133.8	71%	0.713	76%	0.758	S	S	*	*			trans	-150.7	143.6	-163.2	56.2	0	0	0	0	111.6
1015	F	32	Very low	30.4	Very low	217 Å²	217	134.9 Å²	134.9	95%	0.952	76%	0.761	S	S	*	*			trans	-131.9	149	155.7	-97	-84.8	0	0	0	110.3
1016	S	29.8	Very low	30.4	Very low	96 Å²	96	133.8 Å²	133.8	67%	0.671	76%	0.76	S	S	*	*			trans	-153.3	160.2	-167.5	58.1	0	0	0	0	111.3
1017	L	33.3	Very low	30.5	Very low	160 Å²	160	134.9 Å²	134.9	84%	0.838	76%	0.761	S	S	*	*			trans	-168.8	105.5	157.6	-94.6	162.6	0	0	0	104.3
1018	N	31.1	Very low	30.5	Very low	139 Å²	139	133.8 Å²	133.8	74%	0.743	76%	0.763	S	S	*	*				58.2	135.9	83.7	-68.1	-14	0	0	0	113
1019	T	36	Very low	30.5	Very low	120 Å²	120	137.3 Å²	137.3	74%	0.736	77%	0.767	S	S	*	*			cis	-140.6	133.7	33.1	47.3	0	0	0	0	112.4
1020	S	34.6	Very low	30.4	Very low	91 Å²	91	137 Å²	137	64%	0.636	77%	0.772	S	S	*	*				66.8	143.4	89.7	99.2	0	0	0	0	115
1021	H	37.6	Very low	30.3	Very low	162 Å²	162	135.6 Å²	135.6	75%	0.75	77%	0.77	S	S	*	*			cis	-156.8	163	15	-105.2	-51.1	0	0	0	109
1022	D	34.1	Very low	30.2	Very low	98 Å²	98	135.6 Å²	135.6	52%	0.524	77%	0.765	S	S	.	*			cis	-151.8	-77.4	-6.8	-164.2	60.1	0	0	0	114
1023	R	28.1	Very low	30	Very low	202 Å²	202	139.6 Å²	139.6	76%	0.762	77%	0.768	S	S	*	*			trans	-157.2	169.8	-157.2	-73.1	-179.8	-174.9	103.7	-5.1	111
1024	I	30.3	Very low	29.6	Very low	162 Å²	162	136.3 Å²	136.3	83%	0.831	76%	0.755	S	S	*	*				-157.2	153.4	56.8	-78.6	174.6	0	0	0	112.5
1025	T	26.8	Very low	29.5	Very low	122 Å²	122	138.3 Å²	138.3	75%	0.748	76%	0.757	S	S	*	*			trans	-85.2	163.9	176.4	47.7	0	0	0	0	114.1
1026	V	26.9	Very low	29.3	Very low	120 Å²	120	135.4 Å²	135.4	73%	0.727	75%	0.747	S	S	*	*				172.6	125.8	124.7	151	0	0	0	0	114.7
1027	Q	26.2	Very low	29.3	Very low	172 Å²	172	136.5 Å²	136.5	80%	0.804	75%	0.745	S	S	*	*			trans	32.1	128.6	145.7	-52.5	175.7	-6.8	0	0	124.4
1028	N	27.7	Very low	29.1	Very low	153 Å²	153	132.6 Å²	132.6	82%	0.818	73%	0.731	S	S	*	*			trans	-0.9	124.4	131.4	-61	-18.8	0	0	0	119
1029	K	25.4	Very low	28.9	Very low	206 Å²	206	135 Å²	135	90%	0.896	74%	0.735	S	S	*	*				175.8	124.9	102.5	-100.7	-179.2	176.1	-180	0	113.8
1030	G	26.1	Very low	28.6	Very low	64 Å²	64	132.6 Å²	132.6	66%	0.66	73%	0.734	S	S	*	*				60.9	147.4	118.5	0	0	0	0	0	122.2
1031	T	25.1	Very low	28.3	Very low	140 Å²	140	135.5 Å²	135.5	86%	0.859	74%	0.743	S	S	*	*			trans	60.5	140.2	155.1	43	0	0	0	0	118.2
1032	V	28.3	Very low	27.8	Very low	113 Å²	113	135.9 Å²	135.9	69%	0.685	75%	0.749	S	S	*	*			cis	166.2	158.5	-12.4	125	0	0	0	0	103.4
1033	D	26.1	Very low	27.4	Very low	161 Å²	161	135.9 Å²	135.9	86%	0.861	76%	0.757	S	S	*	*			trans	63.3	131	174.1	-61.5	-27.9	0	0	0	118.4
1034	G	27	Very low	27.4	Very low	63 Å²	63	131.9 Å²	131.9	65%	0.649	76%	0.76	S	S	*	*				133.5	98.1	112.2	0	0	0	0	0	117.5
1035	L	27.5	Very low	27.3	Very low	144 Å²	144	127.1 Å²	127.1	75%	0.754	75%	0.751	S	S	*	*			trans	68	143.8	135.9	-57.7	170.7	0	0	0	119.4
1036	E	28.2	Very low	27.3	Very low	156 Å²	156	126.8 Å²	126.8	73%	0.729	75%	0.753	S	S	*	*				52.5	139.7	124.9	-62.1	174.8	-176.5	0	0	120.6
1037	D	28.3	Very low	27.3	Very low	118 Å²	118	128 Å²	128	63%	0.631	76%	0.756	S	S	*	*			cis	-162.7	150.2	-5.9	-133.8	30.4	0	0	0	114.1
1038	S	29.7	Very low	27.3	Very low	78 Å²	78	125.1 Å²	125.1	55%	0.545	75%	0.753	S	S	.	*			trans	51.8	164.1	130.5	-63.9	0	0	0	0	124.9
1039	F	28.1	Very low	27.3	Very low	191 Å²	191	122.2 Å²	122.2	84%	0.838	75%	0.745	S	S	*	*			trans	85.7	146	155.5	-54.4	-62.7	0	0	0	120.4
1040	G	28.8	Very low	27.5	Very low	69 Å²	69	118.3 Å²	118.3	71%	0.711	74%	0.739	S	S	*	*			trans	83.7	79.6	-178.5	0	0	0	0	0	113.8
1041	N	28.6	Very low	27.6	Very low	152 Å²	152	120.4 Å²	120.4	81%	0.813	74%	0.739	S	S	*	*			cis	56.1	99.4	30.2	-115.3	8.1	0	0	0	113.7
1042	L	26.6	Very low	27.7	Very low	169 Å²	169	121.5 Å²	121.5	89%	0.885	74%	0.736	S	S	*	*			trans	169.5	116.2	138.9	-87.6	161.4	0	0	0	106.3
1043	S	26.4	Very low	27.6	Very low	99 Å²	99	120.6 Å²	120.6	69%	0.692	73%	0.734	S	S	*	*			cis	95.3	150.1	49.6	-172.5	0	0	0	0	112.2
1044	S	27.6	Very low	27.6	Very low	117 Å²	117	118.3 Å²	118.3	82%	0.818	73%	0.726	S	S	*	*			trans	60	124.6	-171.7	62.4	0	0	0	0	115.3
1045	G	27.6	Very low	27.7	Very low	62 Å²	62	123.4 Å²	123.4	64%	0.639	73%	0.733	S	S	*	*			cis	111.5	169.9	-4.8	0	0	0	0	0	113.9
1046	S	27.9	Very low	27.9	Very low	115 Å²	115	121.2 Å²	121.2	80%	0.804	73%	0.73	S	S	*	*			trans	63.5	145.6	-169.4	72.9	0	0	0	0	115.6
1047	D	27.2	Very low	27.8	Very low	147 Å²	147	121.2 Å²	121.2	79%	0.786	73%	0.734	S	S	*	*			cis	-177.1	-179	-34.2	-107.7	-46.8	0	0	0	106.1
1048	C	26.2	Very low	27.8	Very low	110 Å²	110	124.8 Å²	124.8	74%	0.743	74%	0.744	S	S	*	*			trans	62.1	97.4	164.3	-67	0	0	0	0	115.2
1049	S	27.3	Very low	27.8	Very low	93 Å²	93	128.2 Å²	128.2	65%	0.65	76%	0.756	S	S	*	*				69.6	133.6	87.8	75.1	0	0	0	0	112.9
1050	T	29.9	Very low	27.9	Very low	124 Å²	124	125.7 Å²	125.7	76%	0.761	75%	0.751	S	S	*	*				-151	110.6	52.2	-65.9	0	0	0	0	107.9
1051	V	27.2	Very low	28	Very low	108 Å²	108	126.2 Å²	126.2	66%	0.655	74%	0.743	S	S	*	*				59.8	89.3	89.9	178.2	0	0	0	0	112.9
1052	M	27.1	Very low	28.2	Very low	163 Å²	163	124.3 Å²	124.3	80%	0.803	73%	0.729	S	S	*	*				-171.4	117.2	121.8	-88.4	-62.4	153.6	0	0	105.1
1053	S	26.9	Very low	28.4	Very low	93 Å²	93	122.2 Å²	122.2	65%	0.65	72%	0.718	S	S	*	*				58.4	125	63.7	-61.7	0	0	0	0	111.8
1054	T	26.7	Very low	28.9	Very low	113 Å²	113	125.7 Å²	125.7	69%	0.693	73%	0.727	S	S	*	*			cis	-155.5	158.8	1.5	27.4	0	0	0	0	106.7
1055	H	29.2	Very low	29.1	Very low	171 Å²	171	124.1 Å²	124.1	79%	0.792	71%	0.713	S	S	*	*				-168.1	159.5	64.9	-107.8	-85.2	0	0	0	112.3
1056	S	30.5	Very low	29.5	Very low	98 Å²	98	129.5 Å²	129.5	69%	0.685	72%	0.721	S	S	*	*			trans	-101.7	-172	160.2	54.3	0	0	0	0	110.6
1057	L	26.3	Very low	29.5	Very low	156 Å²	156	132.9 Å²	132.9	82%	0.817	72%	0.722	S	S	*	*			trans	83.5	132.6	-166.9	-49.6	175.2	0	0	0	111.2
1058	F	28.1	Very low	29.6	Very low	193 Å²	193	132.9 Å²	132.9	85%	0.846	72%	0.717	S	S	*	*			cis	68.2	115.6	27	-99.9	-79.9	0	0	0	115.6
1059	L	30.4	Very low	29.7	Very low	150 Å²	150	135.9 Å²	135.9	79%	0.785	73%	0.725	S	S	*	*			trans	78.2	144.5	167.6	-55.4	170.2	0	0	0	119.6
1060	D	29.6	Very low	29.8	Very low	138 Å²	138	136.8 Å²	136.8	74%	0.738	73%	0.728	S	S	*	*			trans	39.3	111.5	148.7	-57.3	-40.9	0	0	0	123.6
1061	S	30.1	Very low	29.9	Very low	79 Å²	79	138.1 Å²	138.1	55%	0.552	74%	0.736	S	S	*	*			trans	85.1	137.5	136	79.9	0	0	0	0	122.9	S7	S7-S1061 PolarHBondContact OG-OG 3.25Å
1062	H	34.1	Very low	29.9	Very low	112 Å²	112	137.6 Å²	137.6	52%	0.519	74%	0.737	S	S	.	*			trans	79.5	121	155.4	-74.9	-75.9	0	0	0	124.9	N6	N6-H1062 PolarHBondContact O-CD2 3.25Å
1063	L	31.2	Very low	30.2	Very low	125 Å²	125	136.2 Å²	136.2	65%	0.654	74%	0.737	S	S	*	*			trans	64.2	140.6	132.3	-76.2	163.1	0	0	0	123.8	T1065	L1063-T1065 HydrophobicContact CD2-CG2 4Å
1064	I	36.5	Very low	30.6	Very low	172 Å²	172	137 Å²	137	88%	0.882	74%	0.741	S	S	*	*			trans	-132.1	125.9	151.9	-67.4	-178.1	0	0	0	109.3
1065	T	31.2	Very low	30.7	Very low	85 Å²	85	139.3 Å²	139.3	52%	0.521	74%	0.743	S	S	.	*			trans	-160.9	151.9	-175.5	40.2	0	0	0	0	109.2	L1063	L1063-T1065 HydrophobicContact CD2-CG2 4Å
1066	H	34.9	Very low	30.9	Very low	174 Å²	174	139.1 Å²	139.1	81%	0.806	75%	0.746	S	S	*	*			cis	-155.1	152.2	-5.9	-99	-51.4	0	0	0	107.7
1067	K	29.9	Very low	30.8	Very low	187 Å²	187	141.5 Å²	141.5	81%	0.813	75%	0.746	S	S	*	*			trans	-151.4	141.8	158	-88	-159.2	167.4	-178.3	0	112
1068	E	27.9	Very low	31	Very low	146 Å²	146	141.5 Å²	141.5	68%	0.682	75%	0.747	S	S	*	*			cis	-175.6	122.1	-23.8	-127.3	174	174	0	0	106.4
1069	L	28.7	Very low	31.1	Very low	174 Å²	174	140 Å²	140	91%	0.911	74%	0.743	S	S	*	*			trans	-178.5	117.1	152	-105.8	159.6	0	0	0	110.4
1070	P	29.3	Very low	31	Very low	112 Å²	112	140.4 Å²	140.4	73%	0.727	74%	0.744	S	S	*	*			trans	-103.7	142.9	-174	36.7	-32.2	0	0	0	114
1071	V	32.2	Very low	31	Very low	151 Å²	151	137.7 Å²	137.7	92%	0.915	74%	0.741	S	S	*	*			trans	-134.8	147.7	151.1	-174.8	0	0	0	0	107.3
1072	S	28	Very low	30.9	Very low	97 Å²	97	139.7 Å²	139.7	68%	0.678	75%	0.75	S	S	*	*			trans	-141.7	-165.1	-162.5	59.3	0	0	0	0	112.8
1073	V	33.2	Very low	30.7	Very low	135 Å²	135	140.6 Å²	140.6	82%	0.818	76%	0.758	S	S	*	*			trans	70.7	154	175.1	-104.6	0	0	0	0	115.8
1074	P	34.3	Very low	30.6	Very low	110 Å²	110	142.9 Å²	142.9	71%	0.714	77%	0.765	S	S	*	*				-137.5	-166.9	-102.1	46.3	-29.6	0	0	0	115.4
1075	H	28.5	Very low	30.3	Very low	161 Å²	161	140.8 Å²	140.8	75%	0.745	76%	0.764	S	S	*	*			trans	16.2	131.3	146.4	-103.2	23.2	0	0	0	119.2
1076	I	33.5	Very low	30.3	Very low	166 Å²	166	144.5 Å²	144.5	85%	0.851	78%	0.781	S	S	*	*				-156.7	138.3	112.9	-103	154	0	0	0	109.2
1077	E	28	Very low	30.3	Very low	148 Å²	148	141.9 Å²	141.9	69%	0.692	78%	0.78	S	S	*	*			trans	-73.5	149.4	169.6	-58.1	169.3	104.3	0	0	109.9
1078	N	32.3	Very low	30.3	Very low	156 Å²	156	140.8 Å²	140.8	83%	0.834	78%	0.781	S	S	*	*				-164.7	154.9	116.5	-109.1	-67.3	0	0	0	113.8
1079	Q	29.2	Very low	30.5	Very low	162 Å²	162	139 Å²	139	76%	0.757	78%	0.784	S	S	*	*			trans	-84.4	157.1	170.4	-55.5	162.5	31.7	0	0	108.9
1080	I	29.1	Very low	30.5	Very low	158 Å²	158	135.6 Å²	135.6	81%	0.81	78%	0.775	S	S	*	*				173.6	123.7	116.6	-88.4	157.9	0	0	0	111.7
1081	A	28	Very low	30.6	Very low	81 Å²	81	136.7 Å²	136.7	67%	0.669	78%	0.784	S	S	*	*			trans	26.8	123.8	148.1	0	0	0	0	0	123
1082	V	27.9	Very low	30.6	Very low	122 Å²	122	134.7 Å²	134.7	74%	0.739	78%	0.776	S	S	*	*				53.7	103.2	117.1	-176.2	0	0	0	0	118.1
1083	N	29.8	Very low	30.9	Very low	131 Å²	131	138.3 Å²	138.3	70%	0.701	78%	0.783	S	S	*	*				-177.9	140.8	109.2	-100.1	-45.2	0	0	0	115.9
1084	H	30.9	Very low	31	Very low	172 Å²	172	137 Å²	137	80%	0.796	78%	0.775	S	S	*	*			trans	47.6	150.5	141.9	-71.6	-49.5	0	0	0	125.5
1085	C	30.2	Very low	31.1	Very low	128 Å²	128	137.3 Å²	137.3	87%	0.865	78%	0.775	S	S	*	*			trans	97.8	134.9	150.7	-73	0	0	0	0	120.1
1086	N	29.7	Very low	31.5	Very low	163 Å²	163	136.8 Å²	136.8	87%	0.872	78%	0.778	S	S	*	*			trans	-94	171.4	-168	-98.7	2.2	0	0	0	113
1087	P	34.8	Very low	31.5	Very low	120 Å²	120	133.2 Å²	133.2	78%	0.779	77%	0.768	S	S	*	*			trans	-95.4	166.7	-153.7	37.6	-38.3	0	0	0	116
1088	I	31.1	Very low	31.8	Very low	164 Å²	164	133.3 Å²	133.3	84%	0.841	77%	0.772	S	S	*	*			trans	-143.8	136.6	176.7	-67.3	-177.5	0	0	0	112.1
1089	S	31.1	Very low	32	Very low	108 Å²	108	132.2 Å²	132.2	76%	0.755	77%	0.771	S	S	*	*			trans	66.9	130.1	156.6	-155.5	0	0	0	0	122.9
1090	S	30	Very low	32	Very low	102 Å²	102	131.2 Å²	131.2	71%	0.713	77%	0.771	S	S	*	*			trans	-68.9	171.8	159.6	48.1	0	0	0	0	115.2
1091	C	31.4	Very low	32.4	Very low	136 Å²	136	128.7 Å²	128.7	92%	0.919	77%	0.765	S	S	*	*			trans	-155.6	167.9	143	-99.1	0	0	0	0	110.6
1092	S	31.2	Very low	32.5	Very low	108 Å²	108	130.5 Å²	130.5	76%	0.755	77%	0.767	S	S	*	*			trans	-143.3	-158.8	-169.5	54.7	0	0	0	0	112.6
1093	E	35	Very low	32.7	Very low	174 Å²	174	130.1 Å²	130.1	81%	0.813	77%	0.765	S	S	*	*			trans	96.2	145.5	173.5	-57.9	-179.1	169	0	0	115.9
1094	T	36	Very low	32.9	Very low	106 Å²	106	132.5 Å²	132.5	65%	0.65	77%	0.772	S	S	*	*			cis	-170.9	155.2	-3.4	22.8	0	0	0	0	113.1
1095	T	36.1	Very low	32.9	Very low	117 Å²	117	130.9 Å²	130.9	72%	0.718	77%	0.77	S	S	*	*			trans	62.3	154.7	147.3	53.1	0	0	0	0	120.9
1096	D	36.1	Very low	33.1	Very low	150 Å²	150	131.7 Å²	131.7	80%	0.802	76%	0.76	S	S	*	*			cis	-156	170.1	4.4	-120.7	-16.8	0	0	0	114.2
1097	S	33	Very low	33.1	Very low	92 Å²	92	134.3 Å²	134.3	64%	0.643	76%	0.76	S	S	*	*			trans	-85.2	168.6	-169.7	61.2	0	0	0	0	119.2
1098	L	34.6	Very low	33	Very low	150 Å²	150	132.4 Å²	132.4	79%	0.785	76%	0.762	S	S	*	*				169.5	122.5	120.9	-90.9	163.4	0	0	0	119.5
1099	T	36.1	Very low	33	Very low	133 Å²	133	133.3 Å²	133.3	82%	0.816	76%	0.762	S	S	*	*			trans	70.3	125.9	141.1	45.7	0	0	0	0	127.4
1100	D	29.7	Very low	33	Very low	140 Å²	140	134.9 Å²	134.9	75%	0.749	76%	0.761	S	S	*	*			trans	-61.6	-169	155.9	-128.8	-10.3	0	0	0	114.2
1101	P	38	Very low	33.1	Very low	106 Å²	106	140.2 Å²	140.2	69%	0.688	77%	0.767	S	S	*	*			cis	-143.1	158.7	10.6	35.7	-11.8	0	0	0	121.4
1102	V	30.5	Very low	33.2	Very low	118 Å²	118	138.2 Å²	138.2	72%	0.715	76%	0.76	S	S	*	*			trans	41.4	139.8	130.7	-170.2	0	0	0	0	122.7
1103	V	32.3	Very low	33.2	Very low	114 Å²	114	139.8 Å²	139.8	69%	0.691	76%	0.76	S	S	*	*				162.8	117.1	128.6	159	0	0	0	0	114.7
1104	Q	34.1	Very low	33.1	Very low	181 Å²	181	139.6 Å²	139.6	85%	0.846	77%	0.765	S	S	*	*			trans	43	168.6	140.5	-57.9	174	-6.1	0	0	123.8
1105	N	30.8	Very low	32.7	Very low	139 Å²	139	145 Å²	145	74%	0.743	77%	0.773	S	S	*	*			cis	-178.4	169.8	-40.8	-163	1.9	0	0	0	109.6
1106	Q	33.9	Very low	32.6	Very low	144 Å²	144	146.3 Å²	146.3	67%	0.673	78%	0.781	S	S	*	*			trans	88.2	121.8	153.6	-65.8	-169.7	-5.4	0	0	125.6
1107	Y	29.3	Very low	32.3	Very low	218 Å²	218	145.1 Å²	145.1	86%	0.855	77%	0.774	S	S	*	*			trans	58.8	139.7	132.3	-63.2	-57.5	0	0	0	126.1
1108	G	33	Very low	32.4	Very low	80 Å²	80	148.6 Å²	148.6	83%	0.825	78%	0.784	S	S	*	*			trans	166.2	115	155	0	0	0	0	0	115.6
1109	E	30.5	Very low	32.2	Very low	183 Å²	183	148.3 Å²	148.3	86%	0.855	78%	0.783	S	S	*	*			trans	-110.6	173	176.4	-64.3	179.6	131.9	0	0	112.6
1110	I	32.3	Very low	32.1	Very low	141 Å²	141	146.9 Å²	146.9	72%	0.723	79%	0.785	S	S	*	*				147.2	119.5	128.3	-78.6	170.5	0	0	0	115.7
1111	Y	30.7	Very low	32.1	Very low	215 Å²	215	147.7 Å²	147.7	84%	0.843	79%	0.789	S	S	*	*			trans	42.8	159.4	142.7	-66.1	-106.4	0	0	0	121.8
1112	A	34.4	Very low	31.6	Very low	94 Å²	94	148 Å²	148	78%	0.777	79%	0.794	S	S	*	*			cis	-160.2	169.2	28.5	0	0	0	0	0	115.1
1113	D	30.4	Very low	31.5	Very low	141 Å²	141	146.7 Å²	146.7	75%	0.754	80%	0.795	S	S	*	*			trans	-71.6	163.6	174.1	-78.6	-68.3	0	0	0	116.2
1114	N	34.3	Very low	31.3	Very low	169 Å²	169	148.5 Å²	148.5	90%	0.904	80%	0.799	S	S	*	*				-163	159.1	123	-106.1	-62.7	0	0	0	114.5
1115	R	27.1	Very low	30.9	Very low	221 Å²	221	148.8 Å²	148.8	83%	0.834	80%	0.798	S	S	*	*			trans	-114.7	167.2	-172.4	-56.3	174.8	176.2	-175.4	-3.6	113.2
1116	V	33.9	Very low	30.7	Very low	144 Å²	144	150 Å²	150	87%	0.873	81%	0.805	S	S	*	*			trans	-169.4	149.3	131.2	135.7	0	0	0	0	111.4
1117	N	29.6	Very low	30.5	Very low	125 Å²	125	149.2 Å²	149.2	67%	0.668	81%	0.81	S	S	*	*			trans	-87.6	167.6	179	-64.3	14.1	0	0	0	113
1118	I	34.5	Very low	30.5	Very low	165 Å²	165	143 Å²	143	85%	0.846	80%	0.804	S	S	*	*				-171.3	143.5	116.4	-94.7	153.2	0	0	0	110.4
1119	D	30.4	Very low	30.4	Very low	144 Å²	144	148.3 Å²	148.3	77%	0.77	81%	0.807	S	S	*	*			trans	-88.4	149.9	-175.2	-39.8	-95.7	0	0	0	113.9
1120	A	34.7	Very low	30.4	Very low	102 Å²	102	145 Å²	145	84%	0.843	80%	0.804	S	S	*	*			trans	-165.5	150.9	151.1	0	0	0	0	0	111.5
1121	D	29.8	Very low	30.4	Very low	158 Å²	158	142.3 Å²	142.3	85%	0.845	80%	0.797	S	S	*	*			trans	-81.9	160.6	-172.9	-72.4	-72.8	0	0	0	116.4
1122	S	28.2	Very low	30.7	Very low	113 Å²	113	139.9 Å²	139.9	79%	0.79	79%	0.794	S	S	*	*			trans	97.9	119.1	141.9	75.8	0	0	0	0	121.3
1123	A	28	Very low	30.5	Very low	89 Å²	89	139.8 Å²	139.8	74%	0.736	79%	0.787	S	S	*	*			trans	78.8	137	141.2	0	0	0	0	0	121.6
1124	I	26.7	Very low	30.6	Very low	153 Å²	153	140 Å²	140	79%	0.785	79%	0.787	S	S	*	*			trans	80.2	110.9	151.2	-68.4	159.3	0	0	0	118.2
1125	F	27	Very low	30.3	Very low	186 Å²	186	138.2 Å²	138.2	82%	0.816	78%	0.777	S	S	*	*			trans	48.4	109.8	149.7	-78.7	-108.2	0	0	0	120
1126	D	27	Very low	30.6	Very low	165 Å²	165	135.8 Å²	135.8	88%	0.882	78%	0.779	S	S	*	*			trans	-90.1	138.3	156.9	-82.3	-48.7	0	0	0	112.2
1127	T	28.3	Very low	30.4	Very low	127 Å²	127	133.1 Å²	133.1	78%	0.779	77%	0.767	S	S	*	*			trans	-142.2	165.6	165.1	49.3	0	0	0	0	109.2
1128	A	30.7	Very low	30.4	Very low	88 Å²	88	134.4 Å²	134.4	73%	0.727	77%	0.774	S	S	*	*			trans	75.5	109.2	-174.4	0	0	0	0	0	115
1129	E	29.6	Very low	30.2	Very low	192 Å²	192	131.4 Å²	131.4	90%	0.897	77%	0.768	S	S	*	*				65.1	158	69.9	-68.6	-161.3	134.1	0	0	116
1130	S	31.4	Very low	30	Very low	114 Å²	114	132.6 Å²	132.6	80%	0.797	77%	0.771	S	S	*	*			trans	90.2	132.7	162.6	-151.5	0	0	0	0	116.2
1131	S	32.2	Very low	29.6	Very low	83 Å²	83	134.8 Å²	134.8	58%	0.58	77%	0.768	S	S	*	*			cis	-171.9	-166.1	-10.5	43.4	0	0	0	0	111.3
1132	H	36	Very low	29.5	Very low	165 Å²	165	133.7 Å²	133.7	76%	0.764	76%	0.761	S	S	*	*			trans	89.4	110.8	169.3	-59.1	-71.7	0	0	0	116.4
1133	S	31	Very low	29.5	Very low	92 Å²	92	134.3 Å²	134.3	64%	0.643	76%	0.755	S	S	*	*			cis	92.6	143.3	47.5	74.8	0	0	0	0	112.9
1134	L	32.7	Very low	29.4	Very low	144 Å²	144	136.2 Å²	136.2	75%	0.754	75%	0.753	S	S	*	*			cis	-145.6	145.4	25.6	-72.5	161.9	0	0	0	114.5
1135	I	27.7	Very low	29.5	Very low	133 Å²	133	135.3 Å²	135.3	68%	0.682	76%	0.755	S	S	*	*				12.9	126.5	126	-22.8	173.8	0	0	0	118.9
1136	L	32.8	Very low	29.5	Very low	169 Å²	169	132 Å²	132	89%	0.885	75%	0.754	S	S	*	*				-179.5	169.9	110.9	-96.2	171	0	0	0	113.9
1137	S	30.7	Very low	29.6	Very low	88 Å²	88	132.6 Å²	132.6	62%	0.615	75%	0.751	S	S	*	*			trans	-138.3	172	-148.9	-38.8	0	0	0	0	114.8
1138	N	30	Very low	29.7	Very low	152 Å²	152	131.9 Å²	131.9	81%	0.813	75%	0.747	S	S	*	*			trans	93.1	132.6	148.5	-64.4	-13.1	0	0	0	121.1
1139	S	28.7	Very low	29.8	Very low	103 Å²	103	133.9 Å²	133.9	72%	0.72	75%	0.745	S	S	*	*			trans	78.6	101	135.4	-66.9	0	0	0	0	121.7
1140	M	26.3	Very low	29.8	Very low	168 Å²	168	133.1 Å²	133.1	83%	0.828	74%	0.742	S	S	*	*				70.4	144.1	105.4	-139.3	-176.6	-159.2	0	0	119.6
1141	L	27.5	Very low	29.9	Very low	149 Å²	149	136 Å²	136	78%	0.78	74%	0.743	S	S	*	*			trans	66.4	148.4	174.5	-55.5	168.5	0	0	0	112.5
1142	L	26.6	Very low	29.8	Very low	135 Å²	135	139.2 Å²	139.2	71%	0.707	75%	0.752	S	S	*	*			cis	179.9	-177.9	-20.2	-157.3	104.9	0	0	0	102
1143	D	28.4	Very low	29.7	Very low	125 Å²	125	137.3 Å²	137.3	67%	0.668	75%	0.752	S	S	*	*			trans	67.4	117.8	175	-61	-53.8	0	0	0	114.9
1144	N	26.8	Very low	29.9	Very low	130 Å²	130	137 Å²	137	70%	0.695	75%	0.75	S	S	*	*				93.9	147.6	55.6	-78.4	-44.4	0	0	0	112.1
1145	T	29	Very low	30	Very low	133 Å²	133	136.2 Å²	136.2	82%	0.816	75%	0.747	S	S	*	*			trans	66.5	128	-171.7	69.1	0	0	0	0	113.6
1146	C	26.1	Very low	30.3	Very low	117 Å²	117	135.6 Å²	135.6	79%	0.791	75%	0.745	S	S	*	*			cis	67.2	103.3	18.5	-59.4	0	0	0	0	116.6
1147	E	29.7	Very low	30.4	Very low	177 Å²	177	133.8 Å²	133.8	83%	0.827	74%	0.736	S	S	*	*			trans	169.5	131.6	139.2	-91.6	158.4	-155.9	0	0	106.5
1148	T	30.7	Very low	30.5	Very low	112 Å²	112	135.8 Å²	135.8	69%	0.687	74%	0.739	S	S	*	*			cis	85.5	146.5	28.6	73.4	0	0	0	0	116.4
1149	N	31	Very low	30.7	Very low	130 Å²	130	133.7 Å²	133.7	70%	0.695	74%	0.736	S	S	*	*			trans	80	154.8	176.3	-41.8	-49.5	0	0	0	115.2
1150	E	30.6	Very low	31	Very low	177 Å²	177	133.5 Å²	133.5	83%	0.827	73%	0.734	S	S	*	*			cis	-122.4	151.6	1.4	-62.2	172.2	136.6	0	0	109.2
1151	Q	32.3	Very low	31.3	Very low	175 Å²	175	132.2 Å²	132.2	82%	0.818	74%	0.736	S	S	*	*			cis	73.9	165.3	34.2	-81.8	-146.3	28.9	0	0	117.1
1152	L	31.9	Very low	31.5	Very low	149 Å²	149	134.1 Å²	134.1	78%	0.78	76%	0.762	S	S	*	*			trans	81.5	134.6	-159.6	-51.3	166.8	0	0	0	113.2
1153	T	33.9	Very low	31.7	Very low	125 Å²	125	134.1 Å²	134.1	77%	0.767	76%	0.764	S	S	*	*			cis	-161.4	162	-10.1	22.8	0	0	0	0	107.4
1154	S	33.5	Very low	31.9	Very low	86 Å²	86	134.6 Å²	134.6	60%	0.601	77%	0.77	S	S	*	*			cis	-166.2	174	-5.9	51.3	0	0	0	0	110.3
1155	N	34.7	Very low	32.2	Very low	128 Å²	128	134.8 Å²	134.8	68%	0.684	77%	0.774	S	S	*	*			trans	75	102	149	-66.8	-17.5	0	0	0	121.2
1156	N	35.6	Very low	32.4	Very low	120 Å²	120	134.9 Å²	134.9	64%	0.642	77%	0.771	S	S	*	*				93.1	109.3	116.4	-64.1	-13	0	0	0	121
1157	N	35	Very low	32.8	Very low	130 Å²	130	136.1 Å²	136.1	70%	0.695	77%	0.77	S	S	*	*				79.5	143.9	124.2	-62.2	-8.6	0	0	0	119.3
1158	I	33	Very low	33	Very low	131 Å²	131	133.3 Å²	133.3	67%	0.672	77%	0.766	S	S	*	*			cis	-166.2	150.1	-21.4	-118.6	162.6	0	0	0	105.7
1159	S	33.8	Very low	33.1	Very low	108 Å²	108	134.9 Å²	134.9	76%	0.755	77%	0.772	S	S	*	*			trans	62.1	152.3	167.3	66.4	0	0	0	0	117.9
1160	S	33.9	Very low	33.3	Very low	98 Å²	98	135.2 Å²	135.2	69%	0.685	78%	0.778	S	S	*	*			cis	-167	139	-17.3	44.6	0	0	0	0	111.5
1161	V	33.4	Very low	33.5	Very low	141 Å²	141	131.8 Å²	131.8	86%	0.855	77%	0.774	S	S	*	*			trans	48	99.6	142.4	-172.4	0	0	0	0	118.1
1162	S	31.1	Very low	33.6	Very low	190 Å²	190	127.8 Å²	127.8	100%	1.329	77%	0.77	S	S	*	*				-151.1	0	116.7	69.9	0	0	0	0	109.8

Retrieved 1,162 of 1,162 residues in 391.8 ms (Link to these results)

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