A0A077YZ23_TRITR Loading...

MAP/microtubule affinity-regulating kinase 3

Serine/threonine-protein kinase. Involved in the specific phosphorylation of microtubule-associated proteins for MAP2 and MAP4. Phosphorylates the microtubule-associated protein MAPT/TAU. Phosphorylates CDC25C on 'Ser-216'. Regulates localization and activity of some histone deacetylases by mediating phosphorylation of HDAC7, promoting subsequent interaction between HDAC7 and 14-3-3 and export from the nucleus. Regulates localization and activity of MITF by mediating its phosphorylation, promoting subsequent interaction between MITF and 14-3-3 and retention in the cytosol. Negatively regulates the Hippo signaling pathway and antagonizes the phosphorylation of LATS1. Cooperates with DLG5 to inhibit the kinase activity of STK3/MST2 toward LATS1. Phosphorylates PKP2 and KSR1.

AlphaFold DB , UniProt , Accession A0A077YZ23, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,003 aa.

						>A0A077YZ23_TRITR|A0A077YZ23
MHIYILVNFFQESHGSSRHGSSGCPPGCKSTSTSTRVSSRGRAQDEPHIGNFRLLRTIGKGNFAKVKLAKHLPTGREVAIKIIDKTQLNPGSLQKLFREVRIMKMLNHPNIVKLYQVIETEYTLYLVMEYASGGEVFDYLVAHGRMKEKEARAKFRQIVSAVQYLHQKNIIHRDLKAENLLLGNDMNIKIADFGFSNEFSIGNKLDTFCGSPPYAAPELFQGKKYDGPEVDVWSLGVILYTLVSGSLPFDGQNLKELRERVLRGKYRIPFYMSTDCENLLKKFLVLTPPRRATLEAIMKDRWMNIGFEDDELKPYKEPTRDLNDPRRVNILVQMGYTKAQIIDSLQSEKFDDVFATYLLLGEEVVILFAYDFSCEYIVLNSACGGAPSARSGSSRGQNGETSGSSSTAATGSPYKVPRSSSSQSGGTTAVDKRRMSVATTEAVVTQGPGTSFTGAAVTQTVTLRQNPRSAVFGNTSMGAPGKFRPMTNCRKCASPMLCVVPPLVTSGVSKNAPAARRRGPTIRASFQASNNQHGRESEPKDAGPASARSSAHPSVLAALARYFFFSLTFISLIYIFSTANATSLPSNGVISTSDVKERASAYEFATTPAKTKSNTSSQSNSSSNKVWRLIDSAMPRTVAKVSSPREAESQPVREDELNAENERHHHPGDGSHQKSALHTSPSMPPVLLSKSIVGGNGVSGKDKINHSNACIEDINSVLITSTRSSSQSVQTGNAGGGTAAVTSSSKAAAVSASMSSERPSAIVAPHSANLSSNPFQRQTRSRQTFHGLTGSKTPSSLVRTLFFRDHIFLQLVLLISVQVSPAVRNKHSETNSGFACTCSLCFSGSLAAHDLTVPPIRRTSGTTTQTTFPNSCTSAVVNNTIGMVPTVAGGFPFGPGGNDVVEVKPRSLRFTWSMKTTSSLAPEEMMKEIRKVLDANNCDYEQREKYLLLCVHGDPHTDCLVQWEMEVCKLPRLSLNGVRFKRISGSSIGFKNIASKIAQELNL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.7	Very low	27.4	Very low	176 Å²	176	103.9 Å²	103.9	87%	0.867	50%	0.502	S	S	*	.				0	158.4	0	-73.1	173.7	175	0	0	108.4	I3 D138	M1-I3 PolarHBondContact O-N 3.38Å; M1-D138 PolarHBondContact N-OD2 3.2Å
2	H	24.5	Very low	27.5	Very low	98 Å²	98	104.3 Å²	104.3	45%	0.454	50%	0.502	S	S	.	.			trans	-81.4	99.2	-177.1	-79.9	-67.2	0	0	0	114.2	I58	H2-I58 PolarHBondContact CE1-O 3.26Å; H2-I58 VanDerWaalsContact CE1-O 3.24Å
3	I	31.3	Very low	27.5	Very low	71 Å²	71	104.2 Å²	104.2	36%	0.364	52%	0.519	S	S	.	.			trans	-126.2	61.5	172.3	-52.7	-169.2	0	0	0	112.3	M1 R979	M1-I3 PolarHBondContact O-N 3.38Å; I3-R979 VanDerWaalsContact CG2-CZ 3.46Å
4	Y	27.8	Very low	27.7	Very low	84 Å²	84	110.7 Å²	110.7	33%	0.329	55%	0.547	S	S	.	.			trans	43.9	109.8	137.1	-75.7	-116.8	0	0	0	120.3	L6 K981	Y4-L6 HydrophobicContact CD1-CB 4.32Å; Y4-L6 HydrophobicContact CD1-CD1 3.91Å; Y4-L6 HydrophobicContact CD1-CG 4.16Å; Y4-L6 HydrophobicContact CE1-CD1 4.39Å; Y4-K981 HydrophobicContact CD1-CD 3.96Å; Y4-K981 HydrophobicContact CD1-CG 3.7Å; Y4-K981 HydrophobicContact CD2-CD 3.56Å; Y4-K981 HydrophobicContact CD2-CG 4.22Å; Y4-K981 HydrophobicContact CE1-CD 3.97Å; Y4-K981 HydrophobicContact CE1-CG 3.85Å; Y4-K981 HydrophobicContact CE2-CD 3.6Å; Y4-K981 VanDerWaalsContact CE2-CE 3.43Å; Y4-K981 HydrophobicContact CE2-CG 4.38Å; Y4-K981 HydrophobicContact CG-CD 3.76Å; Y4-K981 HydrophobicContact CG-CG 3.88Å
5	I	28.6	Very low	27.8	Very low	106 Å²	106	108.6 Å²	108.6	54%	0.544	57%	0.565	S	S	.	*			trans	-81.6	142.9	130.2	-70.3	177.1	0	0	0	107.9	V7 E178	I5-V7 HydrophobicContact CG2-CG2 4.47Å; I5-E178 WeakPolarHBondContact CD1-OE2 3.32Å
6	L	27	Very low	27.9	Very low	52 Å²	52	108.8 Å²	108.8	27%	0.272	58%	0.578	S	S	.	*			trans	-138.4	101.2	-170.2	-161.3	169.7	0	0	0	111.5	Y4 N8 K981 R982	Y4-L6 HydrophobicContact CD1-CB 4.32Å; Y4-L6 HydrophobicContact CD1-CD1 3.91Å; Y4-L6 HydrophobicContact CD1-CG 4.16Å; Y4-L6 HydrophobicContact CE1-CD1 4.39Å; L6-N8 WeakPolarHBondContact CD2-OD1 3.28Å; L6-K981 HydrophobicContact CD1-CG 4.29Å; L6-R982 HydrophobicContact CD1-CB 4Å; L6-R982 HydrophobicContact CD2-CB 4.31Å
7	V	28.6	Very low	28.1	Very low	101 Å²	101	108.8 Å²	108.8	61%	0.612	59%	0.589	S	S	*	*			trans	-138.3	56.4	173.9	-164.7	0	0	0	0	109.8	I5 N62	I5-V7 HydrophobicContact CG2-CG2 4.47Å; V7-N62 WeakPolarHBondContact CA-OD1 3.4Å; V7-N62 PolarHBondContact N-OD1 3.2Å; V7-N62 VanDerWaalsContact O-CG 3.24Å; V7-N62 PolarHBondContact O-OD1 2.89Å
8	N	26.7	Very low	28.3	Very low	48 Å²	48	115.9 Å²	115.9	26%	0.257	61%	0.606	S	S	.	*			trans	-79.4	142.8	-177.7	-2.1	113.2	0	0	0	112.7	L6 R982	L6-N8 WeakPolarHBondContact CD2-OD1 3.28Å; N8-R982 PolarHBondContact O-NH1 3.29Å; N8-R982 PolarHBondContact O-NH2 3.5Å; N8-R982 PolarHBondContact OD1-NE 3.09Å; N8-R982 PolarHBondContact OD1-NH2 3.14Å; N8-R982 VanDerWaalsContact OD1-NH2 3.08Å
9	F	24.7	Very low	29	Very low	136 Å²	136	119.7 Å²	119.7	60%	0.596	62%	0.62	S	S	*	*			trans	-142.6	126.7	163.1	-147.5	-93.9	0	0	0	107.3	S987	F9-S987 WeakPolarHBondContact CE2-OG 3.29Å
10	F	27.1	Very low	29	Very low	138 Å²	138	117.6 Å²	117.6	61%	0.605	63%	0.628	S	S	*	*			trans	64.9	159.5	173.1	-88.4	-122.7	0	0	0	115.1
11	Q	29	Very low	29.6	Very low	133 Å²	133	117.7 Å²	117.7	62%	0.621	64%	0.638	S	S	*	*			cis	-155.5	160.6	-16.3	-163.6	162.6	16.2	0	0	104.8
12	E	27.6	Very low	30.3	Very low	108 Å²	108	114.7 Å²	114.7	51%	0.505	64%	0.635	S	S	.	*			cis	168.4	176.7	-22.5	-164.9	158.9	-96.1	0	0	105.8
13	S	28.2	Very low	30.7	Very low	103 Å²	103	113.2 Å²	113.2	72%	0.72	65%	0.646	S	S	*	*			trans	32.8	101	159.2	53.5	0	0	0	0	121.6	G15	S13-G15 PolarHBondContact O-N 3.25Å
14	H	30.3	Very low	30.9	Very low	196 Å²	196	116 Å²	116	91%	0.907	67%	0.671	S	S	*	*			trans	-79.4	94.4	154.6	-96.1	-67.4	0	0	0	110.7	S16	H14-S16 PolarHBondContact O-N 2.77Å
15	G	28.4	Very low	31.5	Very low	79 Å²	79	117.7 Å²	117.7	81%	0.814	69%	0.691	S	S	*	*			trans	-69	113.1	172.9	0	0	0	0	0	112.5	S13	S13-G15 PolarHBondContact O-N 3.25Å
16	S	30.1	Very low	32	Very low	111 Å²	111	119 Å²	119	78%	0.776	71%	0.707	S	S	*	*			trans	-103.2	103.5	171.4	-68.6	0	0	0	0	110.4	H14 R18	H14-S16 PolarHBondContact O-N 2.77Å; S16-R18 PolarHBondContact O-N 3.09Å
17	S	31.9	Very low	32.4	Very low	109 Å²	109	120.2 Å²	120.2	76%	0.762	73%	0.732	S	S	*	*			trans	-66.1	131.7	175	-176.3	0	0	0	0	111.2
18	R	31.5	Very low	32.7	Very low	238 Å²	238	121.8 Å²	121.8	90%	0.898	75%	0.746	S	S	*	*			trans	-127.2	99.5	167.6	-76.7	-173.8	173.5	-173.5	-0.8	108.9	S16	S16-R18 PolarHBondContact O-N 3.09Å
19	H	41.2	Very low	33.1	Very low	188 Å²	188	129.4 Å²	129.4	87%	0.87	78%	0.777	S	S	*	*			trans	-73.6	132.8	156.7	-85.7	-81.5	0	0	0	108.9
20	G	29.6	Very low	33.9	Very low	77 Å²	77	128.6 Å²	128.6	79%	0.794	79%	0.788	S	S	*	*			trans	-108	145.7	172.3	0	0	0	0	0	111.4
21	S	40.3	Very low	34.3	Very low	119 Å²	119	128.6 Å²	128.6	83%	0.832	80%	0.8	S	S	*	*			trans	-155.5	160.4	157	-162	0	0	0	0	110.3
22	S	41.7	Very low	34.8	Very low	113 Å²	113	128.2 Å²	128.2	79%	0.79	81%	0.812	S	S	*	*			trans	-54.3	157.7	-179.5	49.2	0	0	0	0	115.6
23	G	34.1	Very low	35.2	Very low	67 Å²	67	130 Å²	130	69%	0.691	83%	0.831	S	S	*	*			cis	148.3	128.6	-6.4	0	0	0	0	0	114.3
24	C	34.5	Very low	35.6	Very low	131 Å²	131	130.7 Å²	130.7	89%	0.885	84%	0.835	S	S	*	*			trans	61.8	166.1	168.7	-71.6	0	0	0	0	119
25	P	41.1	Very low	35.9	Very low	118 Å²	118	127.2 Å²	127.2	77%	0.766	83%	0.828	S	S	*	*			cis	-126.9	172.2	-41.3	36.1	-21.4	0	0	0	112.6
26	P	39	Very low	36.2	Very low	133 Å²	133	134.9 Å²	134.9	86%	0.864	83%	0.832	S	S	*	*			trans	-104.6	154.1	-168.9	38.2	-33.9	0	0	0	115.9
27	G	35.8	Very low	36.7	Very low	79 Å²	79	136.2 Å²	136.2	81%	0.814	84%	0.836	S	S	*	*			trans	158.7	106.8	152	0	0	0	0	0	119.2
28	C	34.4	Very low	37.1	Very low	134 Å²	134	136.8 Å²	136.8	91%	0.905	84%	0.839	S	S	*	*			trans	-160.9	161.8	141	57.9	0	0	0	0	110.5
29	K	35.2	Very low	37.4	Very low	207 Å²	207	131.3 Å²	131.3	90%	0.9	84%	0.838	S	S	*	*			trans	-134	133.8	-174.3	-53.5	170.5	-175.1	171.5	0	110.9
30	S	40.4	Very low	37.3	Very low	119 Å²	119	134.3 Å²	134.3	83%	0.832	84%	0.841	S	S	*	*			trans	-165.8	115.8	149.3	39.4	0	0	0	0	113.9
31	T	36.4	Very low	37.6	Very low	138 Å²	138	134.4 Å²	134.4	85%	0.847	84%	0.842	S	S	*	*			trans	-35.7	139.3	157.6	44.9	0	0	0	0	117.2
32	S	39.5	Very low	37.7	Very low	126 Å²	126	139.3 Å²	139.3	88%	0.881	84%	0.843	S	S	*	*				-165	152.1	119.2	43.2	0	0	0	0	113
33	T	35.3	Very low	37.8	Very low	146 Å²	146	138.7 Å²	138.7	90%	0.896	84%	0.844	S	S	*	*			trans	-86.1	134.7	-167	-50.9	0	0	0	0	113.3
34	S	38.1	Very low	38.3	Very low	117 Å²	117	144.4 Å²	144.4	82%	0.818	85%	0.853	S	S	*	*			trans	-157.3	168.8	150	-156.7	0	0	0	0	113.8
35	T	36.2	Very low	39.3	Very low	122 Å²	122	146.1 Å²	146.1	75%	0.748	85%	0.853	S	S	*	*			trans	-93.9	138.3	-155.9	43.2	0	0	0	0	117
36	R	35.1	Very low	40.3	Very low	241 Å²	241	145 Å²	145	91%	0.909	84%	0.838	S	S	*	*			trans	19	98.8	142.3	-58.4	176.9	-179.2	169.1	-0.3	119.1
37	V	38.6	Very low	42.5	Very low	139 Å²	139	142 Å²	142	84%	0.842	82%	0.818	S	S	*	*			trans	-153.9	125.8	130.7	-172.9	0	0	0	0	109.5
38	S	41.9	Very low	44.9	Very low	120 Å²	120	142.7 Å²	142.7	84%	0.839	80%	0.8	S	S	*	*			trans	170.1	109.9	143.4	-84.6	0	0	0	0	112.5
39	S	36.2	Very low	47.6	Very low	124 Å²	124	137.7 Å²	137.7	87%	0.867	76%	0.764	S	S	*	*			trans	-124.2	54.5	176.6	47	0	0	0	0	111.9
40	R	40.5	Very low	50.2	Low	250 Å²	250	130.6 Å²	130.6	94%	0.943	75%	0.75	S	S	*	*			trans	-145.4	118.2	175.6	-82.2	171.6	175.9	166	-3.1	110
41	G	35.1	Very low	52.7	Low	79 Å²	79	127.2 Å²	127.2	81%	0.814	72%	0.722	S	S	*	*			trans	156.9	46.5	179	0	0	0	0	0	117.4
42	R	42.2	Very low	55.5	Low	223 Å²	223	120.6 Å²	120.6	84%	0.842	68%	0.682	S	S	*	*			trans	-142.3	27.5	177.5	-82	-166.8	174.9	172.4	-0.2	114.4
43	A	45.2	Very low	58.2	Low	100 Å²	100	118.9 Å²	118.9	83%	0.826	66%	0.656	S	S	*	*			trans	-121.9	18.4	-164.1	0	0	0	0	0	115.8
44	Q	43.3	Very low	61.1	Low	187 Å²	187	113 Å²	113	87%	0.874	62%	0.619	S	S	*	*	S	Bend	trans	-119.2	-5	-169	-88.7	-168.8	-41	0	0	118.3
45	D	55.6	Low	63.8	Low	166 Å²	166	110.1 Å²	110.1	89%	0.888	59%	0.594	S	S	*	*			trans	-126.9	44.2	179.2	-78.1	-62.2	0	0	0	113.3
46	E	63	Low	66.5	Low	94 Å²	94	111.4 Å²	111.4	44%	0.439	59%	0.586	S	S	.	*			trans	-78.2	133.8	158.8	-74.4	-172.6	139.1	0	0	109	H48 R53	E46-H48 PolarHBondContact O-CE1 3.46Å; E46-H48 VanDerWaalsContact O-CE1 3.22Å; E46-H48 PolarHBondContact O-N 3.29Å; E46-H48 PolarHBondContact O-ND1 3.35Å; E46-R53 IonicContact OE1-NH1 2.93Å; E46-R53 WeakPolarHBondContact OE2-CD 3.3Å; E46-R53 IonicContact OE2-CZ 2.8Å; E46-R53 IonicContact OE2-NE 3.52Å; E46-R53 PolarHBondContact OE2-NE 3.39Å; E46-R53 IonicContact OE2-NH1 3.58Å; E46-R53 PolarHBondContact OE2-NH1 3.39Å
47	P	83.8	Confident	69.2	Low	70 Å²	70	102 Å²	102	46%	0.455	56%	0.555	S	S	.	*			trans	-76.6	125.7	-177.3	27.2	-32.4	0	0	0	112	L54	P47-L54 HydrophobicContact CG-CB 4.26Å; P47-L54 VanDerWaalsContact O-CB 3.26Å; P47-L54 WeakPolarHBondContact O-CB 3.27Å; P47-L54 PolarHBondContact O-N 3.18Å
48	H	87	Confident	71.7	Confident	95 Å²	95	97.5 Å²	97.5	44%	0.44	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	158.7	174.9	-58.5	84.6	0	0	0	112.3	E46 F52 R53	E46-H48 PolarHBondContact O-CE1 3.46Å; E46-H48 VanDerWaalsContact O-CE1 3.22Å; E46-H48 PolarHBondContact O-N 3.29Å; E46-H48 PolarHBondContact O-ND1 3.35Å; H48-F52 CarbonylContact C-O 3.55Å; H48-F52 WeakPolarHBondContact CA-O 3.41Å; H48-R53 VanDerWaalsContact CD2-CA 3.42Å; H48-R53 WeakPolarHBondContact CD2-CA 3.33Å
49	I	90.3	Very high	73.8	Confident	28 Å²	28	92.6 Å²	92.6	14%	0.144	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	113.1	166	-179.8	61.5	0	0	0	107.8	N51 F52 L54 I80 I118 Y125	I49-N51 PolarHBondContact O-N 2.7Å; I49-F52 HydrophobicContact CG2-CB 4.29Å; I49-F52 PolarHBondContact N-O 2.63Å; I49-F52 WeakPolarHBondContact O-CD2 3.19Å; I49-F52 PolarHBondContact O-N 2.95Å; I49-L54 HydrophobicContact CG2-CD1 4.08Å; I49-L54 HydrophobicContact CG2-CD2 3.71Å; I49-L54 HydrophobicContact CG2-CG 3.92Å; I49-I80 HydrophobicContact CG2-CD1 4.14Å; I49-I118 HydrophobicContact CG1-CD1 4.27Å; I49-Y125 HydrophobicContact CB-CE1 4.48Å; I49-Y125 HydrophobicContact CD1-CD2 4.48Å; I49-Y125 HydrophobicContact CD1-CE1 4.3Å; I49-Y125 HydrophobicContact CD1-CE2 4.07Å; I49-Y125 HydrophobicContact CG1-CD1 4Å; I49-Y125 HydrophobicContact CG1-CD2 4.4Å; I49-Y125 HydrophobicContact CG1-CE1 3.95Å; I49-Y125 HydrophobicContact CG1-CE2 4.35Å; I49-Y125 HydrophobicContact CG1-CG 4.25Å; I49-Y125 HydrophobicContact CG2-CD1 4.46Å
50	G	90.1	Very high	75.9	Confident	59 Å²	59	93.1 Å²	93.1	61%	0.608	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	-131.8	-168.8	0	0	0	0	0	111.8	F52	G50-F52 PolarHBondContact O-N 3.3Å; G50-F52 VanDerWaalsContact O-N 3.11Å
51	N	92.4	Very high	77.4	Confident	47 Å²	47	83.7 Å²	83.7	25%	0.251	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	13.5	179.5	-67.7	-18.9	0	0	0	114.7	I49 H71 L72 P73	I49-N51 PolarHBondContact O-N 2.7Å; N51-H71 PolarHBondContact O-CD2 3.03Å; N51-L72 WeakPolarHBondContact O-CG 3.23Å; N51-L72 PolarHBondContact O-N 3.08Å; N51-P73 HydrophobicContact CB-CG 4.24Å
52	F	96.5	Very high	79.1	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.5	-174.5	-54	-90.4	0	0	0	113.4	H48 I49 G50 A69 K70 H71 V78 I80 I118 V127 L359	H48-F52 CarbonylContact C-O 3.55Å; H48-F52 WeakPolarHBondContact CA-O 3.41Å; I49-F52 HydrophobicContact CG2-CB 4.29Å; I49-F52 PolarHBondContact N-O 2.63Å; I49-F52 WeakPolarHBondContact O-CD2 3.19Å; I49-F52 PolarHBondContact O-N 2.95Å; G50-F52 PolarHBondContact O-N 3.3Å; G50-F52 VanDerWaalsContact O-N 3.11Å; F52-A69 HydrophobicContact CB-CB 4.29Å; F52-K70 WeakPolarHBondContact CA-O 2.91Å; F52-H71 HydrophobicContact CD1-CB 3.76Å; F52-H71 AromaticContact CD1-CD2 3.7Å; F52-H71 HydrophobicContact CE1-CB 3.61Å; F52-H71 AromaticContact CE1-CD2 3.22Å; F52-H71 WeakPolarHBondContact CE1-CD2 3.47Å; F52-H71 AromaticContact CE1-CG 3.63Å; F52-H71 AromaticContact CE2-CD2 4Å; F52-H71 AromaticContact CZ-CD2 3.37Å; F52-H71 WeakPolarHBondContact CZ-CD2 3.14Å; F52-H71 AromaticContact CZ-NE2 3.99Å; F52-V78 HydrophobicContact CD1-CG2 3.59Å; F52-V78 HydrophobicContact CE1-CG1 4.49Å; F52-V78 HydrophobicContact CE1-CG2 3.81Å; F52-I80 HydrophobicContact CB-CD1 3.78Å; F52-I80 HydrophobicContact CD1-CD1 4.21Å; F52-I80 HydrophobicContact CD2-CD1 4.36Å; F52-I80 HydrophobicContact CG-CD1 3.86Å; F52-I118 HydrophobicContact CD2-CD1 4.32Å; F52-I118 HydrophobicContact CE2-CD1 4.25Å; F52-V127 HydrophobicContact CD1-CG1 4.29Å; F52-V127 HydrophobicContact CD2-CG2 4.4Å; F52-V127 HydrophobicContact CE1-CG1 3.6Å; F52-V127 HydrophobicContact CE2-CG1 4.4Å; F52-V127 HydrophobicContact CE2-CG2 4Å; F52-V127 HydrophobicContact CZ-CB 4.4Å; F52-V127 HydrophobicContact CZ-CG1 3.69Å; F52-V127 HydrophobicContact CZ-CG2 4.1Å; F52-L359 HydrophobicContact CE1-CD1 4.32Å
53	R	96.5	Very high	80.6	Confident	89 Å²	89	76.3 Å²	76.3	34%	0.336	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	116.7	168	-176.8	-176.1	-60.5	-148	2.8	109.7	E46 H48 L55 A69 K70 L72	E46-R53 IonicContact OE1-NH1 2.93Å; E46-R53 WeakPolarHBondContact OE2-CD 3.3Å; E46-R53 IonicContact OE2-CZ 2.8Å; E46-R53 IonicContact OE2-NE 3.52Å; E46-R53 PolarHBondContact OE2-NE 3.39Å; E46-R53 IonicContact OE2-NH1 3.58Å; E46-R53 PolarHBondContact OE2-NH1 3.39Å; H48-R53 VanDerWaalsContact CD2-CA 3.42Å; H48-R53 WeakPolarHBondContact CD2-CA 3.33Å; R53-L55 HydrophobicContact CG-CD2 4.11Å; R53-A69 CarbonylContact O-C 3.47Å; R53-A69 WeakPolarHBondContact O-CA 3.38Å; R53-A69 VanDerWaalsContact O-CB 3.3Å; R53-A69 WeakPolarHBondContact O-CB 3.22Å; R53-K70 PolarHBondContact N-O 2.65Å; R53-K70 PolarHBondContact O-N 2.92Å; R53-L72 HydrophobicContact CB-CD2 4.11Å
54	L	95.5	Very high	82.5	Confident	22 Å²	22	72.8 Å²	72.8	12%	0.115	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	120.8	-179.7	-63.5	176.8	0	0	0	110.9	P47 I49 K67 A69 I80	P47-L54 HydrophobicContact CG-CB 4.26Å; P47-L54 VanDerWaalsContact O-CB 3.26Å; P47-L54 WeakPolarHBondContact O-CB 3.27Å; P47-L54 PolarHBondContact O-N 3.18Å; I49-L54 HydrophobicContact CG2-CD1 4.08Å; I49-L54 HydrophobicContact CG2-CD2 3.71Å; I49-L54 HydrophobicContact CG2-CG 3.92Å; L54-K67 HydrophobicContact CB-CD 3.87Å; L54-K67 HydrophobicContact CD1-CD 4.25Å; L54-K67 HydrophobicContact CD2-CB 4.44Å; L54-K67 HydrophobicContact CD2-CD 4.16Å; L54-K67 HydrophobicContact CG-CD 4.34Å; L54-A69 HydrophobicContact CD2-CB 4Å; L54-I80 HydrophobicContact CD2-CD1 3.93Å
55	L	94.6	Very high	84.7	Confident	57 Å²	57	68.5 Å²	68.5	30%	0.298	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-146.4	178.5	-52.5	179	0	0	0	110.1	R53 L68 K70	R53-L55 HydrophobicContact CG-CD2 4.11Å; L55-L68 CarbonylContact C-O 3.52Å; L55-L68 WeakPolarHBondContact CA-O 3.18Å; L55-L68 HydrophobicContact CB-CB 4.41Å; L55-L68 HydrophobicContact CB-CG 4.44Å; L55-L68 WeakPolarHBondContact CB-O 3.34Å; L55-L68 HydrophobicContact CD1-CD2 4.31Å; L55-L68 HydrophobicContact CD1-CG 4.24Å; L55-L68 PolarHBondContact N-O 3.34Å; L55-K70 HydrophobicContact CD1-CB 4.41Å
56	R	93.4	Very high	86.5	Confident	150 Å²	150	62.1 Å²	62.1	57%	0.566	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.4	149.7	-179.7	63.6	-175	174.6	104.8	2.2	113	I58 K67 L68 Y130	R56-I58 HydrophobicContact CG-CG2 4.17Å; R56-K67 WeakPolarHBondContact O-CA 3.26Å; R56-L68 HydrophobicContact CG-CB 4.2Å; R56-L68 HydrophobicContact CG-CD2 4.26Å; R56-L68 PolarHBondContact O-N 3.03Å; R56-Y130 PolarHBondContact NH2-OH 3.38Å; R56-Y130 VanDerWaalsContact NH2-OH 3.1Å
57	T	92.6	Very high	88.1	Confident	42 Å²	42	59.5 Å²	59.5	26%	0.258	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	134.7	166.3	-55	0	0	0	0	108.9	G59 K60 K65 V66	T57-G59 VanDerWaalsContact CG2-O 3.29Å; T57-G59 WeakPolarHBondContact CG2-O 3.44Å; T57-K60 HydrophobicContact CG2-CG 3.86Å; T57-K65 HydrophobicContact CG2-CG 3.92Å; T57-V66 WeakPolarHBondContact CG2-O 3.37Å
58	I	90.8	Very high	88.7	Confident	45 Å²	45	56.4 Å²	56.4	23%	0.231	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	-19.9	178	61.3	176.1	0	0	0	112.7	H2 R56 V66 L68 A79 Y130	H2-I58 PolarHBondContact CE1-O 3.26Å; H2-I58 VanDerWaalsContact CE1-O 3.24Å; R56-I58 HydrophobicContact CG-CG2 4.17Å; I58-V66 HydrophobicContact CD1-CG1 3.98Å; I58-V66 HydrophobicContact CG1-CB 4.14Å; I58-V66 HydrophobicContact CG1-CG1 3.8Å; I58-V66 PolarHBondContact N-O 3.49Å; I58-L68 HydrophobicContact CD1-CB 4.44Å; I58-L68 HydrophobicContact CG2-CB 3.86Å; I58-A79 HydrophobicContact CD1-CB 4.08Å; I58-Y130 HydrophobicContact CD1-CD2 3.89Å; I58-Y130 HydrophobicContact CD1-CE2 3.84Å
59	G	84.8	Confident	89.2	Confident	17 Å²	17	51.9 Å²	51.9	18%	0.175	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	147.5	176.3	0	0	0	0	0	112	T57 V66	T57-G59 VanDerWaalsContact CG2-O 3.29Å; T57-G59 WeakPolarHBondContact CG2-O 3.44Å; G59-V66 PolarHBondContact N-O 2.99Å; G59-V66 PolarHBondContact O-N 3.48Å
60	K	81.4	Confident	89.5	Confident	135 Å²	135	55 Å²	55	59%	0.587	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.5	113.9	171.9	-65.6	-174.9	-177.7	-177.8	0	108.8	T57	T57-K60 HydrophobicContact CG2-CG 3.86Å
61	G	70.4	Confident	89.8	Confident	52 Å²	52	52.2 Å²	52.2	54%	0.536	26%	0.261	S	S	.	.			trans	-103.7	-167.9	166.3	0	0	0	0	0	110.9	A64	G61-A64 PolarHBondContact N-O 3.44Å
62	N	71.1	Confident	89.8	Confident	56 Å²	56	53.9 Å²	53.9	30%	0.299	27%	0.27	S	S	.	.	S	Bend	trans	-74.5	-45.8	-179.5	-54.3	-55.7	0	0	0	112.3	V7	V7-N62 WeakPolarHBondContact CA-OD1 3.4Å; V7-N62 PolarHBondContact N-OD1 3.2Å; V7-N62 VanDerWaalsContact O-CG 3.24Å; V7-N62 PolarHBondContact O-OD1 2.89Å
63	F	74.8	Confident	89.6	Confident	92 Å²	92	56.1 Å²	56.1	40%	0.404	29%	0.285	S	S	.	.	S	Bend	trans	-109.4	4.3	-177.4	-48.2	-70.9	0	0	0	113.6	Q87 L88	F63-Q87 HydrophobicContact CD1-CB 4.33Å; F63-L88 HydrophobicContact CB-CD2 3.93Å; F63-L88 HydrophobicContact CD1-CD2 4.29Å; F63-L88 HydrophobicContact CG-CD2 4.01Å
64	A	84.7	Confident	89.4	Confident	25 Å²	25	52.8 Å²	52.8	21%	0.207	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	146.6	-169.9	0	0	0	0	0	112.6	G61 K81 I82 I83	G61-A64 PolarHBondContact N-O 3.44Å; A64-K81 HydrophobicContact CB-CG 4.32Å; A64-I82 CarbonylContact C-O 3.47Å; A64-I82 VanDerWaalsContact CA-O 3.26Å; A64-I82 WeakPolarHBondContact CA-O 3.45Å; A64-I83 HydrophobicContact CB-CG1 4.02Å
65	K	90.3	Very high	89.3	Confident	97 Å²	97	53.4 Å²	53.4	42%	0.422	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	119.4	-178.4	-171.1	175	-173.1	174.2	0	109.2	T57 I82	T57-K65 HydrophobicContact CG2-CG 3.92Å; K65-I82 PolarHBondContact N-O 2.95Å; K65-I82 WeakPolarHBondContact O-CB 3.31Å; K65-I82 WeakPolarHBondContact O-CG1 3.47Å; K65-I82 PolarHBondContact O-N 2.79Å
66	V	93.1	Very high	89.3	Confident	33 Å²	33	53.4 Å²	53.4	20%	0.2	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.8	-179.6	-167.3	0	0	0	0	109.3	T57 I58 G59 A79 I80 K81 M128	T57-V66 WeakPolarHBondContact CG2-O 3.37Å; I58-V66 HydrophobicContact CD1-CG1 3.98Å; I58-V66 HydrophobicContact CG1-CB 4.14Å; I58-V66 HydrophobicContact CG1-CG1 3.8Å; I58-V66 PolarHBondContact N-O 3.49Å; G59-V66 PolarHBondContact N-O 2.99Å; G59-V66 PolarHBondContact O-N 3.48Å; V66-A79 HydrophobicContact CG1-CB 4.13Å; V66-I80 CarbonylContact C-O 3.2Å; V66-I80 VanDerWaalsContact CA-O 3.31Å; V66-I80 WeakPolarHBondContact CA-O 3.2Å; V66-K81 HydrophobicContact CG2-CB 4.25Å; V66-K81 HydrophobicContact CG2-CG 4.29Å; V66-M128 HydrophobicContact CG1-CE 4.44Å
67	K	95.8	Very high	89.4	Confident	38 Å²	38	51.1 Å²	51.1	17%	0.165	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	144.9	172	-76.8	-164.2	172	-164	0	111	L54 R56 A79 I80 I82	L54-K67 HydrophobicContact CB-CD 3.87Å; L54-K67 HydrophobicContact CD1-CD 4.25Å; L54-K67 HydrophobicContact CD2-CB 4.44Å; L54-K67 HydrophobicContact CD2-CD 4.16Å; L54-K67 HydrophobicContact CG-CD 4.34Å; R56-K67 WeakPolarHBondContact O-CA 3.26Å; K67-A79 CarbonylContact O-C 3.31Å; K67-A79 WeakPolarHBondContact O-CA 3.44Å; K67-I80 PolarHBondContact N-O 2.73Å; K67-I80 PolarHBondContact O-N 3.03Å; K67-I82 HydrophobicContact CD-CD1 4.15Å; K67-I82 HydrophobicContact CG-CD1 4.16Å
68	L	96.2	Very high	89.6	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.026	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	140	156.2	-178.8	63.2	0	0	0	107.9	L55 R56 I58 E77 Y130	L55-L68 CarbonylContact C-O 3.52Å; L55-L68 WeakPolarHBondContact CA-O 3.18Å; L55-L68 HydrophobicContact CB-CB 4.41Å; L55-L68 HydrophobicContact CB-CG 4.44Å; L55-L68 WeakPolarHBondContact CB-O 3.34Å; L55-L68 HydrophobicContact CD1-CD2 4.31Å; L55-L68 HydrophobicContact CD1-CG 4.24Å; L55-L68 PolarHBondContact N-O 3.34Å; R56-L68 HydrophobicContact CG-CB 4.2Å; R56-L68 HydrophobicContact CG-CD2 4.26Å; R56-L68 PolarHBondContact O-N 3.03Å; I58-L68 HydrophobicContact CD1-CB 4.44Å; I58-L68 HydrophobicContact CG2-CB 3.86Å; L68-E77 HydrophobicContact CD1-CB 4.09Å; L68-Y130 HydrophobicContact CD1-CD1 3.42Å; L68-Y130 VanDerWaalsContact CD1-CD1 3.42Å; L68-Y130 HydrophobicContact CD1-CD2 4Å; L68-Y130 HydrophobicContact CD1-CE1 3.53Å; L68-Y130 HydrophobicContact CD1-CE2 4.13Å; L68-Y130 HydrophobicContact CD1-CG 3.67Å; L68-Y130 HydrophobicContact CD2-CE1 4.41Å
69	A	97.1	Very high	89.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	159.5	175.2	0	0	0	0	0	110.8	F52 R53 L54 E77 V78 I80	F52-A69 HydrophobicContact CB-CB 4.29Å; R53-A69 CarbonylContact O-C 3.47Å; R53-A69 WeakPolarHBondContact O-CA 3.38Å; R53-A69 VanDerWaalsContact O-CB 3.3Å; R53-A69 WeakPolarHBondContact O-CB 3.22Å; L54-A69 HydrophobicContact CD2-CB 4Å; A69-E77 CarbonylContact O-C 3.52Å; A69-E77 WeakPolarHBondContact O-CA 3.49Å; A69-V78 HydrophobicContact CB-CG2 4.03Å; A69-V78 PolarHBondContact N-O 2.75Å; A69-V78 PolarHBondContact O-N 2.65Å; A69-I80 HydrophobicContact CB-CD1 3.55Å; A69-I80 HydrophobicContact CB-CG1 3.9Å
70	K	96.7	Very high	90.4	Very high	94 Å²	94	46.4 Å²	46.4	41%	0.409	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	119.8	174.7	-173.2	172.9	-177.9	173.2	0	110.2	F52 R53 L55 L72 G75 R76	F52-K70 WeakPolarHBondContact CA-O 2.91Å; R53-K70 PolarHBondContact N-O 2.65Å; R53-K70 PolarHBondContact O-N 2.92Å; L55-K70 HydrophobicContact CD1-CB 4.41Å; K70-L72 PolarHBondContact O-N 3.47Å; K70-G75 WeakPolarHBondContact CE-O 3.35Å; K70-R76 CarbonylContact C-O 3.58Å; K70-R76 WeakPolarHBondContact CA-O 3.43Å
71	H	96.2	Very high	91	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	124.4	170.8	-169.9	-128.9	0	0	0	109.1	N51 F52 T74 G75 R76 T356 L359	N51-H71 PolarHBondContact O-CD2 3.03Å; F52-H71 HydrophobicContact CD1-CB 3.76Å; F52-H71 AromaticContact CD1-CD2 3.7Å; F52-H71 HydrophobicContact CE1-CB 3.61Å; F52-H71 AromaticContact CE1-CD2 3.22Å; F52-H71 WeakPolarHBondContact CE1-CD2 3.47Å; F52-H71 AromaticContact CE1-CG 3.63Å; F52-H71 AromaticContact CE2-CD2 4Å; F52-H71 AromaticContact CZ-CD2 3.37Å; F52-H71 WeakPolarHBondContact CZ-CD2 3.14Å; F52-H71 AromaticContact CZ-NE2 3.99Å; H71-T74 PolarHBondContact ND1-OG1 3.19Å; H71-G75 CarbonylContact O-C 3.53Å; H71-G75 WeakPolarHBondContact O-CA 3.43Å; H71-G75 PolarHBondContact O-N 3.28Å; H71-R76 PolarHBondContact N-O 3.22Å; H71-T356 PolarHBondContact CE1-OG1 3.14Å; H71-T356 VanDerWaalsContact CE1-OG1 3.3Å; H71-L359 HydrophobicContact CB-CD1 3.99Å
72	L	93.8	Very high	92.1	Very high	82 Å²	82	39.9 Å²	39.9	43%	0.429	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-48	-172.8	-61.8	173.7	0	0	0	112.7	N51 R53 K70 T74	N51-L72 WeakPolarHBondContact O-CG 3.23Å; N51-L72 PolarHBondContact O-N 3.08Å; R53-L72 HydrophobicContact CB-CD2 4.11Å; K70-L72 PolarHBondContact O-N 3.47Å; L72-T74 PolarHBondContact O-N 3.27Å
73	P	91.6	Very high	93.1	Very high	48 Å²	48	37.6 Å²	37.6	31%	0.312	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-31.9	-178.3	-23.3	33.5	0	0	0	115.2	N51 M334 T356	N51-P73 HydrophobicContact CB-CG 4.24Å; P73-M334 HydrophobicContact CB-CE 3.77Å; P73-M334 HydrophobicContact CB-SD 3.95Å; P73-M334 WeakPolarHBondContact O-CE 3.45Å; P73-T356 HydrophobicContact CB-CG2 4.46Å
74	T	93.4	Very high	93.8	Very high	19 Å²	19	35.5 Å²	35.5	12%	0.117	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-2.6	-175.8	65.5	0	0	0	0	113.8	H71 L72 R76 T356 L359 L360	H71-T74 PolarHBondContact ND1-OG1 3.19Å; L72-T74 PolarHBondContact O-N 3.27Å; T74-R76 PolarHBondContact O-N 3.34Å; T74-R76 VanDerWaalsContact O-N 3.09Å; T74-R76 WeakPolarHBondContact OG1-CG 3.5Å; T74-T356 HydrophobicContact CG2-CG2 4Å; T74-L359 HydrophobicContact CG2-CB 4.17Å; T74-L360 HydrophobicContact CG2-CD2 3.74Å; T74-L360 HydrophobicContact CG2-CG 3.77Å
75	G	93.1	Very high	94	Very high	35 Å²	35	36.1 Å²	36.1	36%	0.361	19%	0.185	S	C	.	.			trans	63.5	8.4	-176.1	0	0	0	0	0	115.5	K70 H71	K70-G75 WeakPolarHBondContact CE-O 3.35Å; H71-G75 CarbonylContact O-C 3.53Å; H71-G75 WeakPolarHBondContact O-CA 3.43Å; H71-G75 PolarHBondContact O-N 3.28Å
76	R	93.6	Very high	93.8	Very high	56 Å²	56	36 Å²	36	21%	0.211	19%	0.192	C	C	.	.			trans	-79	143.5	-172.4	-68.2	-52.3	-146.4	158.4	11.6	113.7	K70 H71 T74 L359 E362 E363	K70-R76 CarbonylContact C-O 3.58Å; K70-R76 WeakPolarHBondContact CA-O 3.43Å; H71-R76 PolarHBondContact N-O 3.22Å; T74-R76 PolarHBondContact O-N 3.34Å; T74-R76 VanDerWaalsContact O-N 3.09Å; T74-R76 WeakPolarHBondContact OG1-CG 3.5Å; R76-L359 HydrophobicContact CB-CD2 4.07Å; R76-L359 HydrophobicContact CG-CB 4.31Å; R76-L359 HydrophobicContact CG-CD2 4.34Å; R76-E362 PolarHBondContact NH2-O 2.96Å; R76-E363 PolarHBondContact NH2-O 3.42Å
77	E	95.9	Very high	93.3	Very high	102 Å²	102	38 Å²	38	48%	0.477	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	137.4	167.6	-65.8	-161.1	135.4	0	0	111.2	L68 A69 Y130	L68-E77 HydrophobicContact CD1-CB 4.09Å; A69-E77 CarbonylContact O-C 3.52Å; A69-E77 WeakPolarHBondContact O-CA 3.49Å; E77-Y130 HydrophobicContact CB-CD1 4.08Å
78	V	96.6	Very high	92.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	157.1	-179.1	-64.2	0	0	0	0	110.5	F52 A69 I80 Y115 V127 M128 L359	F52-V78 HydrophobicContact CD1-CG2 3.59Å; F52-V78 HydrophobicContact CE1-CG1 4.49Å; F52-V78 HydrophobicContact CE1-CG2 3.81Å; A69-V78 HydrophobicContact CB-CG2 4.03Å; A69-V78 PolarHBondContact N-O 2.75Å; A69-V78 PolarHBondContact O-N 2.65Å; V78-I80 HydrophobicContact CG2-CD1 4.4Å; V78-I80 HydrophobicContact CG2-CG1 4.16Å; V78-Y115 HydrophobicContact CG1-CD2 4.1Å; V78-Y115 HydrophobicContact CG1-CE2 4.24Å; V78-V127 HydrophobicContact CB-CG1 3.97Å; V78-V127 HydrophobicContact CG1-CG1 4.25Å; V78-V127 HydrophobicContact CG2-CG1 3.83Å; V78-M128 WeakPolarHBondContact CA-O 3.34Å; V78-M128 WeakPolarHBondContact CB-O 3.27Å; V78-L359 HydrophobicContact CG1-CD1 4.2Å; V78-L359 HydrophobicContact CG1-CD2 3.81Å
79	A	96.4	Very high	91.9	Very high	6 Å²	6	41.8 Å²	41.8	5%	0.05	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120.3	173.4	0	0	0	0	0	109.8	I58 V66 K67 M128 Y130	I58-A79 HydrophobicContact CD1-CB 4.08Å; V66-A79 HydrophobicContact CG1-CB 4.13Å; K67-A79 CarbonylContact O-C 3.31Å; K67-A79 WeakPolarHBondContact O-CA 3.44Å; A79-M128 HydrophobicContact CB-CE 4.23Å; A79-M128 PolarHBondContact N-O 2.95Å; A79-M128 WeakPolarHBondContact O-CA 3.41Å; A79-M128 WeakPolarHBondContact O-CB 3.21Å; A79-M128 PolarHBondContact O-N 3.38Å; A79-Y130 HydrophobicContact CB-CD2 4.49Å
80	I	96.6	Very high	91.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	110.8	179.4	-55	-172.6	0	0	0	109.3	I49 F52 L54 V66 K67 A69 V78 I82 Y125 L126 V127	I49-I80 HydrophobicContact CG2-CD1 4.14Å; F52-I80 HydrophobicContact CB-CD1 3.78Å; F52-I80 HydrophobicContact CD1-CD1 4.21Å; F52-I80 HydrophobicContact CD2-CD1 4.36Å; F52-I80 HydrophobicContact CG-CD1 3.86Å; L54-I80 HydrophobicContact CD2-CD1 3.93Å; V66-I80 CarbonylContact C-O 3.2Å; V66-I80 VanDerWaalsContact CA-O 3.31Å; V66-I80 WeakPolarHBondContact CA-O 3.2Å; K67-I80 PolarHBondContact N-O 2.73Å; K67-I80 PolarHBondContact O-N 3.03Å; A69-I80 HydrophobicContact CB-CD1 3.55Å; A69-I80 HydrophobicContact CB-CG1 3.9Å; V78-I80 HydrophobicContact CG2-CD1 4.4Å; V78-I80 HydrophobicContact CG2-CG1 4.16Å; I80-I82 HydrophobicContact CG2-CG1 4.08Å; I80-I82 PolarHBondContact O-N 2.9Å; I80-Y125 HydrophobicContact CG2-CD1 4.12Å; I80-L126 CarbonylContact C-O 3.51Å; I80-L126 WeakPolarHBondContact CA-O 3.38Å; I80-V127 HydrophobicContact CD1-CG2 4.06Å; I80-V127 HydrophobicContact CG1-CB 4.48Å; I80-V127 HydrophobicContact CG1-CG1 4.29Å; I80-V127 HydrophobicContact CG1-CG2 4.11Å
81	K	94	Very high	90.1	Very high	18 Å²	18	44.1 Å²	44.1	8%	0.078	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	103.9	171.8	-177.9	176.3	171.9	-179	0	107.7	A64 V66 I83 E99 L126 M128 D192	A64-K81 HydrophobicContact CB-CG 4.32Å; V66-K81 HydrophobicContact CG2-CB 4.25Å; V66-K81 HydrophobicContact CG2-CG 4.29Å; K81-I83 HydrophobicContact CD-CD1 4.21Å; K81-I83 HydrophobicContact CG-CD1 4.03Å; K81-I83 HydrophobicContact CG-CG1 3.97Å; K81-E99 IonicContact NZ-OE1 2.76Å; K81-E99 PolarHBondContact NZ-OE1 3.44Å; K81-E99 IonicContact NZ-OE2 3.59Å; K81-E99 PolarHBondContact NZ-OE2 3.18Å; K81-L126 HydrophobicContact CB-CB 4.35Å; K81-L126 PolarHBondContact N-O 2.84Å; K81-L126 PolarHBondContact O-N 3.18Å; K81-M128 HydrophobicContact CB-CE 3.72Å; K81-M128 HydrophobicContact CB-SD 4.26Å; K81-D192 IonicContact NZ-OD1 3.79Å; K81-D192 PolarHBondContact NZ-OD1 3.49Å
82	I	93.8	Very high	89.4	Confident	32 Å²	32	45.4 Å²	45.4	16%	0.164	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.4	179	-48	177	0	0	0	107.8	A64 K65 K67 I80 T123 Y125	A64-I82 CarbonylContact C-O 3.47Å; A64-I82 VanDerWaalsContact CA-O 3.26Å; A64-I82 WeakPolarHBondContact CA-O 3.45Å; K65-I82 PolarHBondContact N-O 2.95Å; K65-I82 WeakPolarHBondContact O-CB 3.31Å; K65-I82 WeakPolarHBondContact O-CG1 3.47Å; K65-I82 PolarHBondContact O-N 2.79Å; K67-I82 HydrophobicContact CD-CD1 4.15Å; K67-I82 HydrophobicContact CG-CD1 4.16Å; I80-I82 HydrophobicContact CG2-CG1 4.08Å; I80-I82 PolarHBondContact O-N 2.9Å; I82-T123 HydrophobicContact CG2-CG2 3.6Å; I82-Y125 HydrophobicContact CB-CD1 4.33Å; I82-Y125 HydrophobicContact CD1-CD1 4.43Å; I82-Y125 HydrophobicContact CD1-CE1 4.31Å; I82-Y125 HydrophobicContact CG1-CD1 3.87Å; I82-Y125 HydrophobicContact CG1-CE1 4.16Å; I82-Y125 HydrophobicContact CG2-CD1 3.95Å; I82-Y125 HydrophobicContact CG2-CE1 3.73Å
83	I	91	Very high	88.9	Confident	7 Å²	7	43.9 Å²	43.9	4%	0.036	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	123.3	-172.3	-51.1	173.4	0	0	0	108.5	A64 K81 L88 L96 T123 L124 L126	A64-I83 HydrophobicContact CB-CG1 4.02Å; K81-I83 HydrophobicContact CD-CD1 4.21Å; K81-I83 HydrophobicContact CG-CD1 4.03Å; K81-I83 HydrophobicContact CG-CG1 3.97Å; I83-L88 HydrophobicContact CG2-CD1 4.13Å; I83-L96 HydrophobicContact CD1-CD1 3.47Å; I83-L96 VanDerWaalsContact CD1-CD1 3.47Å; I83-L96 HydrophobicContact CD1-CD2 4.36Å; I83-L96 HydrophobicContact CG2-CD2 3.92Å; I83-T123 WeakPolarHBondContact O-CA 3.11Å; I83-T123 WeakPolarHBondContact O-CG2 3.12Å; I83-L124 HydrophobicContact CB-CB 4.48Å; I83-L124 PolarHBondContact N-O 3.5Å; I83-L124 PolarHBondContact O-N 3.49Å; I83-L126 HydrophobicContact CD1-CD1 4.11Å; I83-L126 HydrophobicContact CD1-CG 4.41Å
84	D	89.1	Confident	88.4	Confident	48 Å²	48	48.4 Å²	48.4	26%	0.257	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	118.1	176.5	-175.1	-19.2	0	0	0	109.2	T86 Q87 L88	D84-T86 WeakPolarHBondContact OD1-CB 3.33Å; D84-T86 PolarHBondContact OD1-N 3.1Å; D84-T86 PolarHBondContact OD1-OG1 3.36Å; D84-T86 PolarHBondContact OD2-OG1 2.94Å; D84-Q87 HydrophobicContact CB-CG 4.34Å; D84-Q87 PolarHBondContact OD2-NE2 3.19Å; D84-L88 WeakPolarHBondContact O-CG 3.04Å
85	K	89.1	Confident	87.8	Confident	38 Å²	38	52.8 Å²	52.8	17%	0.165	29%	0.287	C	S	.	.	S	Bend	trans	-76.3	-23.8	179.7	-66.8	-171.1	-72.1	166.6	0	112.5	Q87 L88 L93 E119 T120 E121 Y122 L124	K85-Q87 VanDerWaalsContact C-N 3.26Å; K85-Q87 PolarHBondContact O-N 3.5Å; K85-L88 PolarHBondContact O-N 2.69Å; K85-L93 HydrophobicContact CD-CD1 4.36Å; K85-L93 HydrophobicContact CG-CD1 4.36Å; K85-E119 IonicContact NZ-OE1 2.73Å; K85-E119 PolarHBondContact NZ-OE1 3.05Å; K85-T120 WeakPolarHBondContact CE-O 3.14Å; K85-T120 PolarHBondContact NZ-O 2.89Å; K85-E121 WeakPolarHBondContact CE-O 3.46Å; K85-E121 PolarHBondContact NZ-O 2.99Å; K85-Y122 WeakPolarHBondContact CB-O 3.4Å; K85-Y122 PolarHBondContact N-O 2.95Å; K85-L124 HydrophobicContact CG-CB 4.44Å
86	T	87.6	Confident	87.4	Confident	94 Å²	94	51.5 Å²	51.5	58%	0.577	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-28.9	-178.6	70.5	0	0	0	0	112.2	D84 L88 Y122	D84-T86 WeakPolarHBondContact OD1-CB 3.33Å; D84-T86 PolarHBondContact OD1-N 3.1Å; D84-T86 PolarHBondContact OD1-OG1 3.36Å; D84-T86 PolarHBondContact OD2-OG1 2.94Å; T86-L88 VanDerWaalsContact C-N 3.29Å; T86-L88 PolarHBondContact O-N 3.12Å; T86-Y122 HydrophobicContact CG2-CD1 3.78Å; T86-Y122 HydrophobicContact CG2-CG 4.39Å
87	Q	81.5	Confident	87.1	Confident	75 Å²	75	53.2 Å²	53.2	35%	0.35	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	2.1	179	-58.4	-179.4	36.2	0	0	113.4	F63 D84 K85	F63-Q87 HydrophobicContact CD1-CB 4.33Å; D84-Q87 HydrophobicContact CB-CG 4.34Å; D84-Q87 PolarHBondContact OD2-NE2 3.19Å; K85-Q87 VanDerWaalsContact C-N 3.26Å; K85-Q87 PolarHBondContact O-N 3.5Å
88	L	78.5	Confident	86.7	Confident	26 Å²	26	51 Å²	51	14%	0.136	27%	0.269	C	S	.	.			trans	-104.5	121.3	-176.8	-57.4	-178.4	0	0	0	111.7	F63 I83 D84 K85 T86 L93 L96	F63-L88 HydrophobicContact CB-CD2 3.93Å; F63-L88 HydrophobicContact CD1-CD2 4.29Å; F63-L88 HydrophobicContact CG-CD2 4.01Å; I83-L88 HydrophobicContact CG2-CD1 4.13Å; D84-L88 WeakPolarHBondContact O-CG 3.04Å; K85-L88 PolarHBondContact O-N 2.69Å; T86-L88 VanDerWaalsContact C-N 3.29Å; T86-L88 PolarHBondContact O-N 3.12Å; L88-L93 HydrophobicContact CD1-CD1 4.26Å; L88-L96 HydrophobicContact CD1-CD2 3.69Å
89	N	83.3	Confident	86.3	Confident	97 Å²	97	51.6 Å²	51.6	52%	0.519	27%	0.271	S	S	.	.			trans	-64.7	159.8	163.6	68.8	65.9	0	0	0	111	G91 S92 L93	N89-G91 VanDerWaalsContact C-N 3.25Å; N89-G91 PolarHBondContact O-N 3.1Å; N89-G91 VanDerWaalsContact O-N 3.12Å; N89-G91 PolarHBondContact OD1-N 3.3Å; N89-G91 VanDerWaalsContact OD1-N 3.1Å; N89-S92 PolarHBondContact ND2-OG 3.24Å; N89-S92 WeakPolarHBondContact O-CA 3.4Å; N89-S92 WeakPolarHBondContact O-CB 3.39Å; N89-S92 PolarHBondContact O-N 2.95Å; N89-S92 PolarHBondContact OD1-N 3.45Å; N89-L93 PolarHBondContact O-N 2.99Å
90	P	81.4	Confident	86.1	Confident	112 Å²	112	52.1 Å²	52.1	73%	0.727	27%	0.274	S	S	*	.	H	α-helix	trans	-55.4	-34.2	-176.1	-29.2	36.5	0	0	0	114.9	L93 Q94	P90-L93 PolarHBondContact O-N 2.73Å; P90-Q94 WeakPolarHBondContact O-CB 3.39Å; P90-Q94 PolarHBondContact O-N 3.4Å
91	G	76.4	Confident	85.9	Confident	31 Å²	31	57.9 Å²	57.9	32%	0.32	30%	0.295	S	S	.	.	H	α-helix	trans	-71.2	-32.9	176.4	0	0	0	0	0	113.4	N89 K95	N89-G91 VanDerWaalsContact C-N 3.25Å; N89-G91 PolarHBondContact O-N 3.1Å; N89-G91 VanDerWaalsContact O-N 3.12Å; N89-G91 PolarHBondContact OD1-N 3.3Å; N89-G91 VanDerWaalsContact OD1-N 3.1Å; G91-K95 VanDerWaalsContact O-CG 3.3Å; G91-K95 WeakPolarHBondContact O-CG 3.46Å; G91-K95 PolarHBondContact O-N 2.9Å
92	S	79.7	Confident	85.9	Confident	27 Å²	27	57 Å²	57	19%	0.189	29%	0.292	C	S	.	.	H	α-helix	trans	-71.6	-37.1	169.8	-67.8	0	0	0	0	112	N89 K95 L96	N89-S92 PolarHBondContact ND2-OG 3.24Å; N89-S92 WeakPolarHBondContact O-CA 3.4Å; N89-S92 WeakPolarHBondContact O-CB 3.39Å; N89-S92 PolarHBondContact O-N 2.95Å; N89-S92 PolarHBondContact OD1-N 3.45Å; S92-K95 WeakPolarHBondContact O-CB 3.49Å; S92-K95 PolarHBondContact O-N 3.47Å; S92-L96 PolarHBondContact O-N 2.98Å
93	L	83.9	Confident	85.8	Confident	50 Å²	50	55.9 Å²	55.9	26%	0.262	29%	0.286	S	S	.	.	H	α-helix	trans	-65.6	-39.5	174.8	-169.1	68.1	0	0	0	111.7	K85 L88 N89 P90 K95 L96 F97	K85-L93 HydrophobicContact CD-CD1 4.36Å; K85-L93 HydrophobicContact CG-CD1 4.36Å; L88-L93 HydrophobicContact CD1-CD1 4.26Å; N89-L93 PolarHBondContact O-N 2.99Å; P90-L93 PolarHBondContact O-N 2.73Å; L93-K95 PolarHBondContact O-N 3.39Å; L93-L96 HydrophobicContact CD1-CD2 4.43Å; L93-L96 WeakPolarHBondContact O-CB 3.27Å; L93-L96 PolarHBondContact O-N 3.25Å; L93-F97 HydrophobicContact CD1-CE2 4.07Å; L93-F97 HydrophobicContact CD1-CZ 4.41Å; L93-F97 HydrophobicContact CD2-CE2 3.98Å; L93-F97 HydrophobicContact CG-CD2 4.08Å; L93-F97 HydrophobicContact CG-CE2 3.64Å; L93-F97 HydrophobicContact CG-CZ 4.42Å; L93-F97 VanDerWaalsContact O-CD2 3.31Å; L93-F97 WeakPolarHBondContact O-CD2 3.38Å; L93-F97 PolarHBondContact O-N 2.91Å
94	Q	81.6	Confident	85.9	Confident	144 Å²	144	58.5 Å²	58.5	67%	0.673	30%	0.297	S	S	*	.	H	α-helix	trans	-63.1	-40	172.6	-167.9	-173.1	25	0	0	112.3	P90 L96 F97 R98	P90-Q94 WeakPolarHBondContact O-CB 3.39Å; P90-Q94 PolarHBondContact O-N 3.4Å; Q94-L96 VanDerWaalsContact C-N 3.32Å; Q94-L96 PolarHBondContact O-N 3.31Å; Q94-F97 PolarHBondContact O-N 2.94Å; Q94-R98 PolarHBondContact O-N 2.69Å
95	K	80.3	Confident	86	Confident	111 Å²	111	59.9 Å²	59.9	48%	0.483	30%	0.303	S	S	.	.	H	α-helix	trans	-61.6	-40.6	172.4	-70.4	166	-169.4	171.6	0	111.4	G91 S92 L93 R98 E99	G91-K95 VanDerWaalsContact O-CG 3.3Å; G91-K95 WeakPolarHBondContact O-CG 3.46Å; G91-K95 PolarHBondContact O-N 2.9Å; S92-K95 WeakPolarHBondContact O-CB 3.49Å; S92-K95 PolarHBondContact O-N 3.47Å; L93-K95 PolarHBondContact O-N 3.39Å; K95-R98 PolarHBondContact O-N 3.38Å; K95-E99 PolarHBondContact O-N 3.44Å
96	L	85.9	Confident	86.2	Confident	8 Å²	8	58.6 Å²	58.6	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-64.7	-46.8	177.4	178.8	57.4	0	0	0	112.4	I83 L88 S92 L93 Q94 R98 E99 V100 L124	I83-L96 HydrophobicContact CD1-CD1 3.47Å; I83-L96 VanDerWaalsContact CD1-CD1 3.47Å; I83-L96 HydrophobicContact CD1-CD2 4.36Å; I83-L96 HydrophobicContact CG2-CD2 3.92Å; L88-L96 HydrophobicContact CD1-CD2 3.69Å; S92-L96 PolarHBondContact O-N 2.98Å; L93-L96 HydrophobicContact CD1-CD2 4.43Å; L93-L96 WeakPolarHBondContact O-CB 3.27Å; L93-L96 PolarHBondContact O-N 3.25Å; Q94-L96 VanDerWaalsContact C-N 3.32Å; Q94-L96 PolarHBondContact O-N 3.31Å; L96-R98 VanDerWaalsContact C-N 3.26Å; L96-R98 PolarHBondContact O-N 3.45Å; L96-E99 WeakPolarHBondContact O-CB 3.4Å; L96-E99 PolarHBondContact O-N 2.91Å; L96-E99 VanDerWaalsContact O-N 3.11Å; L96-V100 WeakPolarHBondContact O-CG2 3.24Å; L96-V100 PolarHBondContact O-N 3.05Å; L96-L124 HydrophobicContact CD1-CD2 4.03Å; L96-L124 HydrophobicContact CD2-CD2 3.73Å; L96-L124 HydrophobicContact CG-CD2 3.86Å
97	F	87.5	Confident	86.5	Confident	91 Å²	91	55.7 Å²	55.7	40%	0.399	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-33.9	174.9	-72.2	-55.5	0	0	0	112.3	L93 Q94 R101	L93-F97 HydrophobicContact CD1-CE2 4.07Å; L93-F97 HydrophobicContact CD1-CZ 4.41Å; L93-F97 HydrophobicContact CD2-CE2 3.98Å; L93-F97 HydrophobicContact CG-CD2 4.08Å; L93-F97 HydrophobicContact CG-CE2 3.64Å; L93-F97 HydrophobicContact CG-CZ 4.42Å; L93-F97 VanDerWaalsContact O-CD2 3.31Å; L93-F97 WeakPolarHBondContact O-CD2 3.38Å; L93-F97 PolarHBondContact O-N 2.91Å; Q94-F97 PolarHBondContact O-N 2.94Å; F97-R101 WeakPolarHBondContact O-CB 3.28Å; F97-R101 PolarHBondContact O-N 3.3Å
98	R	87.2	Confident	87.1	Confident	57 Å²	57	52.5 Å²	52.5	22%	0.215	26%	0.264	C	S	.	.	H	α-helix	trans	-67.9	-40.4	171	-170	178.9	65.7	-131.5	-10.6	112.5	Q94 K95 L96 V100 R101 I102 S196 N197	Q94-R98 PolarHBondContact O-N 2.69Å; K95-R98 PolarHBondContact O-N 3.38Å; L96-R98 VanDerWaalsContact C-N 3.26Å; L96-R98 PolarHBondContact O-N 3.45Å; R98-V100 VanDerWaalsContact C-N 3.34Å; R98-V100 PolarHBondContact O-N 3.3Å; R98-R101 PolarHBondContact O-N 3.21Å; R98-I102 HydrophobicContact CG-CD1 3.9Å; R98-I102 HydrophobicContact CG-CG1 4.34Å; R98-I102 WeakPolarHBondContact O-CB 3.4Å; R98-I102 WeakPolarHBondContact O-CG1 3.47Å; R98-I102 PolarHBondContact O-N 2.66Å; R98-S196 VanDerWaalsContact CZ-O 3.26Å; R98-S196 PolarHBondContact NE-O 2.96Å; R98-S196 PolarHBondContact NH2-O 2.81Å; R98-N197 VanDerWaalsContact CD-OD1 3.22Å; R98-N197 WeakPolarHBondContact CD-OD1 3.26Å; R98-N197 PolarHBondContact NE-OD1 3.03Å; R98-N197 VanDerWaalsContact NE-OD1 3.14Å; R98-N197 PolarHBondContact NH1-OD1 3.18Å
99	E	87.8	Confident	87.9	Confident	12 Å²	12	54.4 Å²	54.4	6%	0.056	28%	0.278	C	S	.	.	H	α-helix	trans	-56.4	-49.2	174	-171	-174.1	157.4	0	0	110.3	K81 K95 L96 I102 M103 F193 G194	K81-E99 IonicContact NZ-OE1 2.76Å; K81-E99 PolarHBondContact NZ-OE1 3.44Å; K81-E99 IonicContact NZ-OE2 3.59Å; K81-E99 PolarHBondContact NZ-OE2 3.18Å; K95-E99 PolarHBondContact O-N 3.44Å; L96-E99 WeakPolarHBondContact O-CB 3.4Å; L96-E99 PolarHBondContact O-N 2.91Å; L96-E99 VanDerWaalsContact O-N 3.11Å; E99-I102 PolarHBondContact O-N 2.91Å; E99-M103 HydrophobicContact CG-SD 4.05Å; E99-M103 WeakPolarHBondContact O-CB 3.49Å; E99-M103 VanDerWaalsContact O-CG 3.29Å; E99-M103 WeakPolarHBondContact O-CG 3.29Å; E99-M103 PolarHBondContact O-N 3.38Å; E99-F193 HydrophobicContact CG-CB 4.03Å; E99-G194 WeakPolarHBondContact OE2-CA 3.47Å
100	V	91.9	Very high	88.5	Confident	16 Å²	16	50.6 Å²	50.6	10%	0.097	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-46.9	177.9	177.4	0	0	0	0	112	L96 R98 I102 M103 K104 V117 L124 L126	L96-V100 WeakPolarHBondContact O-CG2 3.24Å; L96-V100 PolarHBondContact O-N 3.05Å; R98-V100 VanDerWaalsContact C-N 3.34Å; R98-V100 PolarHBondContact O-N 3.3Å; V100-I102 PolarHBondContact O-N 3.05Å; V100-M103 PolarHBondContact O-N 2.93Å; V100-K104 WeakPolarHBondContact O-CG 3.26Å; V100-K104 PolarHBondContact O-N 2.86Å; V100-V117 HydrophobicContact CG1-CG2 3.91Å; V100-L124 HydrophobicContact CG2-CD2 4.05Å; V100-L126 HydrophobicContact CG2-CD1 4.07Å; V100-L126 HydrophobicContact CG2-CD2 3.68Å
101	R	92.8	Very high	89.2	Confident	121 Å²	121	45.4 Å²	45.4	46%	0.457	22%	0.223	S	C	.	.	H	α-helix	trans	-56.6	-48.8	176.1	167.6	173.7	155.4	135.5	-8.2	111.6	F97 R98 K104 M105 E198	F97-R101 WeakPolarHBondContact O-CB 3.28Å; F97-R101 PolarHBondContact O-N 3.3Å; R98-R101 PolarHBondContact O-N 3.21Å; R101-K104 PolarHBondContact O-N 3.43Å; R101-M105 HydrophobicContact CG-SD 4.23Å; R101-M105 WeakPolarHBondContact O-CG 3.16Å; R101-M105 PolarHBondContact O-N 3.15Å; R101-E198 IonicContact CZ-OE1 3.75Å; R101-E198 VanDerWaalsContact CZ-OE1 3.3Å; R101-E198 IonicContact CZ-OE2 2.63Å; R101-E198 IonicContact NE-OE1 3.94Å; R101-E198 PolarHBondContact NE-OE1 3.36Å; R101-E198 IonicContact NE-OE2 3.03Å; R101-E198 VanDerWaalsContact NH2-CD 3.29Å; R101-E198 IonicContact NH2-OE1 2.75Å; R101-E198 PolarHBondContact NH2-OE1 2.94Å; R101-E198 IonicContact NH2-OE2 3.3Å; R101-E198 PolarHBondContact NH2-OE2 3.34Å
102	I	92.7	Very high	90.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.9	-53.6	176	-75.9	172.7	0	0	0	109.5	R98 E99 V100 K104 M105 L106 I170 F193	R98-I102 HydrophobicContact CG-CD1 3.9Å; R98-I102 HydrophobicContact CG-CG1 4.34Å; R98-I102 WeakPolarHBondContact O-CB 3.4Å; R98-I102 WeakPolarHBondContact O-CG1 3.47Å; R98-I102 PolarHBondContact O-N 2.66Å; E99-I102 PolarHBondContact O-N 2.91Å; V100-I102 PolarHBondContact O-N 3.05Å; I102-K104 VanDerWaalsContact C-N 3.33Å; I102-K104 PolarHBondContact O-N 2.92Å; I102-M105 PolarHBondContact O-N 3.38Å; I102-L106 HydrophobicContact CG2-CD1 3.74Å; I102-L106 HydrophobicContact CG2-CG 4.32Å; I102-L106 WeakPolarHBondContact O-CG 3.42Å; I102-L106 PolarHBondContact O-N 3.48Å; I102-I170 HydrophobicContact CD1-CG2 4.24Å; I102-I170 HydrophobicContact CG1-CD1 4.5Å; I102-I170 HydrophobicContact CG2-CD1 4.28Å; I102-I170 HydrophobicContact CG2-CG2 4.22Å; I102-F193 HydrophobicContact CG2-CB 4.26Å; I102-F193 HydrophobicContact CG2-CD1 4.03Å; I102-F193 HydrophobicContact CG2-CG 4.23Å
103	M	93.5	Very high	90.8	Very high	9 Å²	9	45.4 Å²	45.4	4%	0.044	21%	0.212	C	C	.	.	H	α-helix	trans	-59.4	-36.7	-177.2	-72.9	179.1	74.9	0	0	113.9	E99 V100 M105 L106 L114 L126 M128 F193	E99-M103 HydrophobicContact CG-SD 4.05Å; E99-M103 WeakPolarHBondContact O-CB 3.49Å; E99-M103 VanDerWaalsContact O-CG 3.29Å; E99-M103 WeakPolarHBondContact O-CG 3.29Å; E99-M103 PolarHBondContact O-N 3.38Å; V100-M103 PolarHBondContact O-N 2.93Å; M103-M105 PolarHBondContact O-N 2.89Å; M103-L106 PolarHBondContact O-N 3.46Å; M103-L114 HydrophobicContact CB-CB 4.32Å; M103-L114 HydrophobicContact CB-CD2 4.05Å; M103-L114 HydrophobicContact CE-CB 4.31Å; M103-L114 HydrophobicContact CE-CD1 4.02Å; M103-L126 HydrophobicContact SD-CD1 4.32Å; M103-M128 HydrophobicContact CE-CG 3.97Å; M103-M128 HydrophobicContact CE-SD 3.65Å; M103-F193 HydrophobicContact CG-CB 4.44Å; M103-F193 HydrophobicContact CG-CD2 4.03Å; M103-F193 HydrophobicContact CG-CG 4.49Å
104	K	93.4	Very high	91.4	Very high	62 Å²	62	43.2 Å²	43.2	27%	0.27	20%	0.2	S	C	.	.	H	α-helix	trans	-60.5	-33.2	174.1	-74	-165.1	166.6	-156.6	0	112.8	V100 R101 I102 L114 R320 K349 F350	V100-K104 WeakPolarHBondContact O-CG 3.26Å; V100-K104 PolarHBondContact O-N 2.86Å; R101-K104 PolarHBondContact O-N 3.43Å; I102-K104 VanDerWaalsContact C-N 3.33Å; I102-K104 PolarHBondContact O-N 2.92Å; K104-L114 HydrophobicContact CG-CD2 3.85Å; K104-R320 PolarHBondContact O-NH2 3.38Å; K104-K349 PolarHBondContact NZ-O 3.36Å; K104-F350 HydrophobicContact CB-CD2 4.3Å; K104-F350 HydrophobicContact CB-CE2 3.65Å; K104-F350 HydrophobicContact CB-CZ 3.86Å; K104-F350 HydrophobicContact CD-CD2 3.5Å; K104-F350 VanDerWaalsContact CD-CD2 3.5Å; K104-F350 HydrophobicContact CD-CE2 3.68Å; K104-F350 HydrophobicContact CD-CG 4.28Å; K104-F350 HydrophobicContact CG-CD1 4.48Å; K104-F350 HydrophobicContact CG-CD2 3.59Å; K104-F350 HydrophobicContact CG-CE1 4.36Å; K104-F350 HydrophobicContact CG-CE2 3.46Å; K104-F350 VanDerWaalsContact CG-CE2 3.46Å; K104-F350 HydrophobicContact CG-CG 4.13Å; K104-F350 HydrophobicContact CG-CZ 3.87Å
105	M	90.7	Very high	92.1	Very high	77 Å²	77	36.7 Å²	36.7	38%	0.379	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-3.2	-176.3	-63.5	172.7	65.7	0	0	114.2	R101 I102 M103 K168	R101-M105 HydrophobicContact CG-SD 4.23Å; R101-M105 WeakPolarHBondContact O-CG 3.16Å; R101-M105 PolarHBondContact O-N 3.15Å; I102-M105 PolarHBondContact O-N 3.38Å; M103-M105 PolarHBondContact O-N 2.89Å; M105-K168 VanDerWaalsContact O-CE 3.27Å; M105-K168 WeakPolarHBondContact O-CE 3.21Å; M105-K168 PolarHBondContact O-NZ 2.63Å
106	L	93.6	Very high	92.8	Very high	10 Å²	10	32.2 Å²	32.2	5%	0.052	15%	0.151	C	C	.	.			trans	-104.3	134.2	-177	-63.4	178.8	0	0	0	112.8	I102 M103 I111 Y164 L165 K168 I170 F193	I102-L106 HydrophobicContact CG2-CD1 3.74Å; I102-L106 HydrophobicContact CG2-CG 4.32Å; I102-L106 WeakPolarHBondContact O-CG 3.42Å; I102-L106 PolarHBondContact O-N 3.48Å; M103-L106 PolarHBondContact O-N 3.46Å; L106-I111 HydrophobicContact CB-CG2 4.42Å; L106-I111 HydrophobicContact CD1-CG2 4.32Å; L106-Y164 HydrophobicContact CD2-CD1 4.42Å; L106-Y164 HydrophobicContact CD2-CE1 3.77Å; L106-L165 HydrophobicContact CD1-CD2 3.66Å; L106-L165 HydrophobicContact CD2-CD2 3.48Å; L106-L165 VanDerWaalsContact CD2-CD2 3.48Å; L106-L165 HydrophobicContact CG-CD2 4.23Å; L106-K168 HydrophobicContact CD2-CD 4.2Å; L106-I170 HydrophobicContact CD2-CD1 4.02Å; L106-F193 HydrophobicContact CD1-CD1 3.99Å; L106-F193 HydrophobicContact CD1-CD2 4.39Å; L106-F193 HydrophobicContact CD1-CE1 3.55Å; L106-F193 HydrophobicContact CD1-CE2 4Å; L106-F193 HydrophobicContact CD1-CG 4.41Å; L106-F193 HydrophobicContact CD1-CZ 3.57Å
107	N	93	Very high	93.3	Very high	34 Å²	34	33.5 Å²	33.5	18%	0.182	16%	0.158	C	C	.	.			trans	-159	79.9	-174.5	173.7	37.4	0	0	0	108.5	Y164 E317	N107-Y164 PolarHBondContact N-OH 2.83Å; N107-Y164 PolarHBondContact O-OH 2.98Å; N107-E317 HydrophobicContact CB-CG 4.37Å; N107-E317 VanDerWaalsContact CB-OE1 3.3Å; N107-E317 WeakPolarHBondContact CB-OE1 3.48Å; N107-E317 WeakPolarHBondContact ND2-CG 3.3Å; N107-E317 PolarHBondContact ND2-OE1 2.64Å
108	H	95.1	Very high	93.7	Very high	8 Å²	8	30.6 Å²	30.6	4%	0.037	15%	0.147	C	C	.	.			trans	-137.1	138.3	-179.1	177.6	-80.7	0	0	0	108.6	N110 I111 S160 A161 Y164 Y315	H108-N110 PolarHBondContact ND1-N 3.28Å; H108-N110 PolarHBondContact O-N 3.14Å; H108-I111 HydrophobicContact CB-CB 4.28Å; H108-I111 HydrophobicContact CB-CD1 3.95Å; H108-I111 HydrophobicContact CB-CG1 4.03Å; H108-I111 PolarHBondContact O-N 2.85Å; H108-S160 PolarHBondContact NE2-OG 2.68Å; H108-A161 VanDerWaalsContact CE1-CA 3.45Å; H108-A161 WeakPolarHBondContact CE1-CA 3.19Å; H108-A161 PolarHBondContact CE1-N 2.64Å; H108-A161 PolarHBondContact NE2-N 2.94Å; H108-Y164 HydrophobicContact CB-CD1 3.64Å; H108-Y164 HydrophobicContact CB-CE1 3.6Å; H108-Y164 HydrophobicContact CB-CG 4.2Å; H108-Y164 AromaticContact CD2-CG 3.88Å; H108-Y315 HydrophobicContact CB-CE1 4.41Å; H108-Y315 AromaticContact CD2-CD1 3.42Å; H108-Y315 VanDerWaalsContact CD2-CD1 3.42Å; H108-Y315 WeakPolarHBondContact CD2-CD1 3.48Å; H108-Y315 AromaticContact CD2-CD2 3.98Å; H108-Y315 AromaticContact CD2-CE1 3.9Å; H108-Y315 AromaticContact CD2-CG 3.44Å; H108-Y315 VanDerWaalsContact CD2-CG 3.44Å; H108-Y315 AromaticContact NE2-CG 3.81Å
109	P	94.9	Very high	94	Very high	66 Å²	66	31.5 Å²	31.5	43%	0.429	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-23.9	-172.3	22.5	-35.1	0	0	0	114.2	K189 Y315	P109-K189 VanDerWaalsContact O-CE 3.24Å; P109-K189 WeakPolarHBondContact O-CE 3.22Å; P109-K189 PolarHBondContact O-NZ 2.96Å; P109-Y315 VanDerWaalsContact CD-CZ 3.5Å; P109-Y315 WeakPolarHBondContact CD-OH 3.49Å; P109-Y315 HydrophobicContact CG-CE2 4.09Å
110	N	96.4	Very high	94.2	Very high	16 Å²	16	33.7 Å²	33.7	9%	0.086	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	20.7	177	-53.5	110.7	0	0	0	115.3	H108 Q157 A161 I188 K189 I190	H108-N110 PolarHBondContact ND1-N 3.28Å; H108-N110 PolarHBondContact O-N 3.14Å; N110-Q157 HydrophobicContact CB-CB 4.22Å; N110-A161 HydrophobicContact CB-CB 4.27Å; N110-I188 WeakPolarHBondContact CA-O 3.41Å; N110-I188 HydrophobicContact CB-CG2 4.43Å; N110-I188 VanDerWaalsContact CB-O 3.23Å; N110-I188 WeakPolarHBondContact CB-O 3.47Å; N110-I188 PolarHBondContact ND2-O 2.88Å; N110-K189 WeakPolarHBondContact O-CA 3.3Å; N110-I190 PolarHBondContact O-N 2.89Å
111	I	95.7	Very high	94.2	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.021	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-115.9	143.2	168.9	-65.8	-178.6	0	0	0	108.3	L106 H108 K113 A161 Y164 L165 F193	L106-I111 HydrophobicContact CB-CG2 4.42Å; L106-I111 HydrophobicContact CD1-CG2 4.32Å; H108-I111 HydrophobicContact CB-CB 4.28Å; H108-I111 HydrophobicContact CB-CD1 3.95Å; H108-I111 HydrophobicContact CB-CG1 4.03Å; H108-I111 PolarHBondContact O-N 2.85Å; I111-K113 PolarHBondContact O-N 3.11Å; I111-A161 HydrophobicContact CD1-CB 4.31Å; I111-A161 HydrophobicContact CG1-CB 3.89Å; I111-Y164 HydrophobicContact CD1-CD1 3.84Å; I111-Y164 HydrophobicContact CD1-CE1 4.1Å; I111-L165 HydrophobicContact CD1-CD2 3.94Å; I111-L165 HydrophobicContact CD1-CG 4.12Å; I111-F193 HydrophobicContact CD1-CZ 4.4Å; I111-F193 HydrophobicContact CG2-CE2 3.72Å; I111-F193 HydrophobicContact CG2-CZ 3.59Å
112	V	95.1	Very high	94.1	Very high	10 Å²	10	40.5 Å²	40.5	6%	0.061	20%	0.199	C	C	.	.			trans	-63.7	114.2	173.1	169.9	0	0	0	0	109.8	M128 E129 L181 K189 I190 A191	V112-M128 HydrophobicContact CG1-CB 3.78Å; V112-M128 HydrophobicContact CG1-SD 4.37Å; V112-E129 HydrophobicContact CG1-CB 4.26Å; V112-L181 HydrophobicContact CG2-CD1 4.46Å; V112-K189 HydrophobicContact CG2-CB 3.93Å; V112-I190 WeakPolarHBondContact CG2-O 3.38Å; V112-I190 PolarHBondContact N-O 2.86Å; V112-A191 HydrophobicContact CG2-CB 3.88Å
113	K	94.4	Very high	94	Very high	47 Å²	47	41.8 Å²	41.8	20%	0.204	21%	0.207	C	C	.	.			trans	-73.9	139.9	-178.8	-173.6	173.5	176.1	-179.1	0	111.8	I111 Y115 M128 E129 E362	I111-K113 PolarHBondContact O-N 3.11Å; K113-Y115 HydrophobicContact CD-CE1 3.76Å; K113-Y115 HydrophobicContact CG-CD1 4.48Å; K113-Y115 HydrophobicContact CG-CE1 4.07Å; K113-M128 CarbonylContact O-C 3.55Å; K113-M128 VanDerWaalsContact O-CA 3.27Å; K113-M128 WeakPolarHBondContact O-CA 3.48Å; K113-E129 HydrophobicContact CB-CB 4.22Å; K113-E129 PolarHBondContact N-OE2 3.37Å; K113-E129 PolarHBondContact O-N 2.87Å; K113-E362 IonicContact NZ-OE1 3.67Å; K113-E362 PolarHBondContact NZ-OE1 3.48Å
114	L	95.9	Very high	94	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	135.8	168.8	-174	70.2	0	0	0	109.5	M103 K104 V117 L126 M128 F350	M103-L114 HydrophobicContact CB-CB 4.32Å; M103-L114 HydrophobicContact CB-CD2 4.05Å; M103-L114 HydrophobicContact CE-CB 4.31Å; M103-L114 HydrophobicContact CE-CD1 4.02Å; K104-L114 HydrophobicContact CG-CD2 3.85Å; L114-V117 HydrophobicContact CD2-CG2 3.97Å; L114-L126 HydrophobicContact CD1-CB 4.12Å; L114-M128 HydrophobicContact CD1-CG 4.32Å; L114-F350 HydrophobicContact CB-CD1 4.3Å; L114-F350 HydrophobicContact CB-CE1 4.05Å; L114-F350 HydrophobicContact CD2-CD1 3.78Å; L114-F350 HydrophobicContact CD2-CE1 3.97Å; L114-F350 HydrophobicContact CD2-CG 4.36Å; L114-F350 HydrophobicContact CG-CD1 3.83Å; L114-F350 HydrophobicContact CG-CE1 4.08Å; L114-F350 WeakPolarHBondContact O-CE1 3.43Å
115	Y	95.8	Very high	94.1	Very high	8 Å²	8	40.4 Å²	40.4	3%	0.031	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-45.3	175.4	-63.1	-58.4	0	0	0	112.4	V78 K113 V127 E129 A355 L358 L359	V78-Y115 HydrophobicContact CG1-CD2 4.1Å; V78-Y115 HydrophobicContact CG1-CE2 4.24Å; K113-Y115 HydrophobicContact CD-CE1 3.76Å; K113-Y115 HydrophobicContact CG-CD1 4.48Å; K113-Y115 HydrophobicContact CG-CE1 4.07Å; Y115-V127 PolarHBondContact N-O 3.31Å; Y115-E129 HydrophobicContact CE2-CB 4.15Å; Y115-A355 WeakPolarHBondContact O-CB 3.43Å; Y115-L358 HydrophobicContact CD1-CB 3.75Å; Y115-L358 HydrophobicContact CD1-CD1 4.02Å; Y115-L358 HydrophobicContact CE1-CB 4.08Å; Y115-L359 HydrophobicContact CD1-CD2 4.14Å; Y115-L359 HydrophobicContact CD1-CG 4.21Å; Y115-L359 HydrophobicContact CD2-CD2 3.76Å; Y115-L359 HydrophobicContact CD2-CG 4.35Å; Y115-L359 HydrophobicContact CE1-CD2 3.97Å; Y115-L359 HydrophobicContact CE1-CG 4.42Å; Y115-L359 HydrophobicContact CE2-CD2 3.56Å; Y115-L359 HydrophobicContact CG-CD2 4.04Å; Y115-L359 HydrophobicContact CG-CG 4.18Å
116	Q	96.7	Very high	94.3	Very high	17 Å²	17	36.8 Å²	36.8	8%	0.079	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	150.1	-176.4	-153	170.9	-20	0	0	112.1	I118 V127 F350 D351 D352 A355	Q116-I118 HydrophobicContact CG-CG1 4.09Å; Q116-V127 HydrophobicContact CB-CB 3.78Å; Q116-V127 HydrophobicContact CB-CG2 3.83Å; Q116-V127 PolarHBondContact N-O 3.27Å; Q116-V127 PolarHBondContact O-N 2.83Å; Q116-F350 WeakPolarHBondContact CA-O 3.48Å; Q116-F350 WeakPolarHBondContact CG-O 3.4Å; Q116-D351 WeakPolarHBondContact CG-O 3.21Å; Q116-D352 VanDerWaalsContact NE2-N 3.19Å; Q116-A355 HydrophobicContact CB-CB 3.76Å; Q116-A355 HydrophobicContact CG-CB 4.05Å
117	V	96.1	Very high	94.5	Very high	34 Å²	34	36.3 Å²	36.3	21%	0.206	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.4	163	-176.3	0	0	0	0	107.5	V100 L114 L124 L126 F350	V100-V117 HydrophobicContact CG1-CG2 3.91Å; L114-V117 HydrophobicContact CD2-CG2 3.97Å; V117-L124 HydrophobicContact CG1-CD1 3.76Å; V117-L126 HydrophobicContact CG1-CD2 4.04Å; V117-L126 HydrophobicContact CG2-CD2 4.14Å; V117-F350 HydrophobicContact CG2-CB 4.28Å; V117-F350 PolarHBondContact N-O 3Å
118	I	95.6	Very high	94.7	Very high	30 Å²	30	35.7 Å²	35.7	15%	0.154	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	123.1	172.2	-50.1	171.7	0	0	0	107	I49 F52 Q116 Y125 V127	I49-I118 HydrophobicContact CG1-CD1 4.27Å; F52-I118 HydrophobicContact CD2-CD1 4.32Å; F52-I118 HydrophobicContact CE2-CD1 4.25Å; Q116-I118 HydrophobicContact CG-CG1 4.09Å; I118-Y125 HydrophobicContact CB-CD2 4.47Å; I118-Y125 PolarHBondContact N-O 3.29Å; I118-Y125 PolarHBondContact O-N 2.96Å; I118-V127 HydrophobicContact CD1-CG2 4.4Å
119	E	92.7	Very high	94.7	Very high	77 Å²	77	37 Å²	37	36%	0.36	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	135.5	179.1	-174.2	165.1	-165.8	0	0	110.6	K85 L124	K85-E119 IonicContact NZ-OE1 2.73Å; K85-E119 PolarHBondContact NZ-OE1 3.05Å; E119-L124 HydrophobicContact CB-CD1 3.7Å; E119-L124 HydrophobicContact CG-CD1 3.93Å
120	T	92.3	Very high	94.7	Very high	57 Å²	57	35.6 Å²	35.6	35%	0.35	17%	0.168	S	C	.	.			trans	-117.6	176.9	165	70.7	0	0	0	0	108.9	K85 Y122 T123 Y125	K85-T120 WeakPolarHBondContact CE-O 3.14Å; K85-T120 PolarHBondContact NZ-O 2.89Å; T120-Y122 VanDerWaalsContact C-N 3.28Å; T120-Y122 PolarHBondContact O-N 2.98Å; T120-T123 PolarHBondContact N-O 3.34Å; T120-T123 PolarHBondContact OG1-N 3.34Å; T120-T123 VanDerWaalsContact OG1-N 3.1Å; T120-T123 PolarHBondContact OG1-O 2.8Å; T120-Y125 HydrophobicContact CG2-CE2 4.17Å
121	E	91.3	Very high	94.5	Very high	144 Å²	144	35.3 Å²	35.3	67%	0.673	17%	0.168	S	C	*	.	S	Bend	trans	-52.2	-46.2	176.5	-66.1	178.9	171	0	0	112.3	K85	K85-E121 WeakPolarHBondContact CE-O 3.46Å; K85-E121 PolarHBondContact NZ-O 2.99Å
122	Y	90.5	Very high	94.4	Very high	137 Å²	137	37.7 Å²	37.7	54%	0.537	19%	0.185	S	C	.	.	S	Bend	trans	-103.5	-18.3	-171.4	-48.4	-73	0	0	0	114.4	K85 T86 T120	K85-Y122 WeakPolarHBondContact CB-O 3.4Å; K85-Y122 PolarHBondContact N-O 2.95Å; T86-Y122 HydrophobicContact CG2-CD1 3.78Å; T86-Y122 HydrophobicContact CG2-CG 4.39Å; T120-Y122 VanDerWaalsContact C-N 3.28Å; T120-Y122 PolarHBondContact O-N 2.98Å
123	T	91.8	Very high	94	Very high	27 Å²	27	39 Å²	39	17%	0.166	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	141.3	-169	-45.5	0	0	0	0	112	I82 I83 T120 Y125	I82-T123 HydrophobicContact CG2-CG2 3.6Å; I83-T123 WeakPolarHBondContact O-CA 3.11Å; I83-T123 WeakPolarHBondContact O-CG2 3.12Å; T120-T123 PolarHBondContact N-O 3.34Å; T120-T123 PolarHBondContact OG1-N 3.34Å; T120-T123 VanDerWaalsContact OG1-N 3.1Å; T120-T123 PolarHBondContact OG1-O 2.8Å; T123-Y125 HydrophobicContact CG2-CD2 3.99Å; T123-Y125 HydrophobicContact CG2-CE1 4.15Å; T123-Y125 HydrophobicContact CG2-CE2 3.45Å; T123-Y125 VanDerWaalsContact CG2-CE2 3.45Å
124	L	93.4	Very high	93.7	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.016	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.6	167.7	-168.2	68.5	0	0	0	109.8	I83 K85 L96 V100 V117 E119 L126	I83-L124 HydrophobicContact CB-CB 4.48Å; I83-L124 PolarHBondContact N-O 3.5Å; I83-L124 PolarHBondContact O-N 3.49Å; K85-L124 HydrophobicContact CG-CB 4.44Å; L96-L124 HydrophobicContact CD1-CD2 4.03Å; L96-L124 HydrophobicContact CD2-CD2 3.73Å; L96-L124 HydrophobicContact CG-CD2 3.86Å; V100-L124 HydrophobicContact CG2-CD2 4.05Å; V117-L124 HydrophobicContact CG1-CD1 3.76Å; E119-L124 HydrophobicContact CB-CD1 3.7Å; E119-L124 HydrophobicContact CG-CD1 3.93Å; L124-L126 HydrophobicContact CD2-CD2 3.98Å; L124-L126 HydrophobicContact CG-CD2 4.03Å
125	Y	95.5	Very high	93.4	Very high	39 Å²	39	41.7 Å²	41.7	15%	0.153	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	115.9	177.9	-54.3	-107.2	0	0	0	108.8	I49 I80 I82 I118 T120 T123	I49-Y125 HydrophobicContact CB-CE1 4.48Å; I49-Y125 HydrophobicContact CD1-CD2 4.48Å; I49-Y125 HydrophobicContact CD1-CE1 4.3Å; I49-Y125 HydrophobicContact CD1-CE2 4.07Å; I49-Y125 HydrophobicContact CG1-CD1 4Å; I49-Y125 HydrophobicContact CG1-CD2 4.4Å; I49-Y125 HydrophobicContact CG1-CE1 3.95Å; I49-Y125 HydrophobicContact CG1-CE2 4.35Å; I49-Y125 HydrophobicContact CG1-CG 4.25Å; I49-Y125 HydrophobicContact CG2-CD1 4.46Å; I80-Y125 HydrophobicContact CG2-CD1 4.12Å; I82-Y125 HydrophobicContact CB-CD1 4.33Å; I82-Y125 HydrophobicContact CD1-CD1 4.43Å; I82-Y125 HydrophobicContact CD1-CE1 4.31Å; I82-Y125 HydrophobicContact CG1-CD1 3.87Å; I82-Y125 HydrophobicContact CG1-CE1 4.16Å; I82-Y125 HydrophobicContact CG2-CD1 3.95Å; I82-Y125 HydrophobicContact CG2-CE1 3.73Å; I118-Y125 HydrophobicContact CB-CD2 4.47Å; I118-Y125 PolarHBondContact N-O 3.29Å; I118-Y125 PolarHBondContact O-N 2.96Å; T120-Y125 HydrophobicContact CG2-CE2 4.17Å; T123-Y125 HydrophobicContact CG2-CD2 3.99Å; T123-Y125 HydrophobicContact CG2-CE1 4.15Å; T123-Y125 HydrophobicContact CG2-CE2 3.45Å; T123-Y125 VanDerWaalsContact CG2-CE2 3.45Å
126	L	95.4	Very high	93	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	113.4	173.6	-50.8	-177.7	0	0	0	108.5	I80 K81 I83 V100 M103 L114 V117 L124 M128	I80-L126 CarbonylContact C-O 3.51Å; I80-L126 WeakPolarHBondContact CA-O 3.38Å; K81-L126 HydrophobicContact CB-CB 4.35Å; K81-L126 PolarHBondContact N-O 2.84Å; K81-L126 PolarHBondContact O-N 3.18Å; I83-L126 HydrophobicContact CD1-CD1 4.11Å; I83-L126 HydrophobicContact CD1-CG 4.41Å; V100-L126 HydrophobicContact CG2-CD1 4.07Å; V100-L126 HydrophobicContact CG2-CD2 3.68Å; M103-L126 HydrophobicContact SD-CD1 4.32Å; L114-L126 HydrophobicContact CD1-CB 4.12Å; V117-L126 HydrophobicContact CG1-CD2 4.04Å; V117-L126 HydrophobicContact CG2-CD2 4.14Å; L124-L126 HydrophobicContact CD2-CD2 3.98Å; L124-L126 HydrophobicContact CG-CD2 4.03Å; L126-M128 HydrophobicContact CB-CG 4.37Å
127	V	97.1	Very high	92.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	118.1	178.2	-175.6	0	0	0	0	108.7	F52 V78 I80 Y115 Q116 I118	F52-V127 HydrophobicContact CD1-CG1 4.29Å; F52-V127 HydrophobicContact CD2-CG2 4.4Å; F52-V127 HydrophobicContact CE1-CG1 3.6Å; F52-V127 HydrophobicContact CE2-CG1 4.4Å; F52-V127 HydrophobicContact CE2-CG2 4Å; F52-V127 HydrophobicContact CZ-CB 4.4Å; F52-V127 HydrophobicContact CZ-CG1 3.69Å; F52-V127 HydrophobicContact CZ-CG2 4.1Å; V78-V127 HydrophobicContact CB-CG1 3.97Å; V78-V127 HydrophobicContact CG1-CG1 4.25Å; V78-V127 HydrophobicContact CG2-CG1 3.83Å; I80-V127 HydrophobicContact CD1-CG2 4.06Å; I80-V127 HydrophobicContact CG1-CB 4.48Å; I80-V127 HydrophobicContact CG1-CG1 4.29Å; I80-V127 HydrophobicContact CG1-CG2 4.11Å; Y115-V127 PolarHBondContact N-O 3.31Å; Q116-V127 HydrophobicContact CB-CB 3.78Å; Q116-V127 HydrophobicContact CB-CG2 3.83Å; Q116-V127 PolarHBondContact N-O 3.27Å; Q116-V127 PolarHBondContact O-N 2.83Å; I118-V127 HydrophobicContact CD1-CG2 4.4Å
128	M	96.1	Very high	91.7	Very high	22 Å²	22	44.9 Å²	44.9	11%	0.108	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	167.1	-168.2	-49.3	177	-58.5	0	0	111.9	V66 V78 A79 K81 M103 V112 K113 L114 L126	V66-M128 HydrophobicContact CG1-CE 4.44Å; V78-M128 WeakPolarHBondContact CA-O 3.34Å; V78-M128 WeakPolarHBondContact CB-O 3.27Å; A79-M128 HydrophobicContact CB-CE 4.23Å; A79-M128 PolarHBondContact N-O 2.95Å; A79-M128 WeakPolarHBondContact O-CA 3.41Å; A79-M128 WeakPolarHBondContact O-CB 3.21Å; A79-M128 PolarHBondContact O-N 3.38Å; K81-M128 HydrophobicContact CB-CE 3.72Å; K81-M128 HydrophobicContact CB-SD 4.26Å; M103-M128 HydrophobicContact CE-CG 3.97Å; M103-M128 HydrophobicContact CE-SD 3.65Å; V112-M128 HydrophobicContact CG1-CB 3.78Å; V112-M128 HydrophobicContact CG1-SD 4.37Å; K113-M128 CarbonylContact O-C 3.55Å; K113-M128 VanDerWaalsContact O-CA 3.27Å; K113-M128 WeakPolarHBondContact O-CA 3.48Å; L114-M128 HydrophobicContact CD1-CG 4.32Å; L126-M128 HydrophobicContact CB-CG 4.37Å
129	E	95.2	Very high	91.2	Very high	35 Å²	35	46 Å²	46	16%	0.164	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	136.2	167.7	-169.4	-178.3	-172.8	0	0	112.7	V112 K113 Y115 K189	V112-E129 HydrophobicContact CG1-CB 4.26Å; K113-E129 HydrophobicContact CB-CB 4.22Å; K113-E129 PolarHBondContact N-OE2 3.37Å; K113-E129 PolarHBondContact O-N 2.87Å; Y115-E129 HydrophobicContact CE2-CB 4.15Å; E129-K189 VanDerWaalsContact CD-CE 3.46Å; E129-K189 WeakPolarHBondContact OE1-CE 3.44Å; E129-K189 IonicContact OE1-NZ 2.86Å; E129-K189 PolarHBondContact OE1-NZ 3.35Å; E129-K189 VanDerWaalsContact OE2-CE 3.31Å; E129-K189 WeakPolarHBondContact OE2-CE 3.37Å; E129-K189 IonicContact OE2-NZ 2.64Å; E129-K189 PolarHBondContact OE2-NZ 2.88Å
130	Y	95	Very high	91	Very high	37 Å²	37	42.7 Å²	42.7	15%	0.145	23%	0.225	C	C	.	.			trans	-92.8	113.3	175	176.1	-133.7	0	0	0	111.4	R56 I58 L68 E77 A79 S132	R56-Y130 PolarHBondContact NH2-OH 3.38Å; R56-Y130 VanDerWaalsContact NH2-OH 3.1Å; I58-Y130 HydrophobicContact CD1-CD2 3.89Å; I58-Y130 HydrophobicContact CD1-CE2 3.84Å; L68-Y130 HydrophobicContact CD1-CD1 3.42Å; L68-Y130 VanDerWaalsContact CD1-CD1 3.42Å; L68-Y130 HydrophobicContact CD1-CD2 4Å; L68-Y130 HydrophobicContact CD1-CE1 3.53Å; L68-Y130 HydrophobicContact CD1-CE2 4.13Å; L68-Y130 HydrophobicContact CD1-CG 3.67Å; L68-Y130 HydrophobicContact CD2-CE1 4.41Å; E77-Y130 HydrophobicContact CB-CD1 4.08Å; A79-Y130 HydrophobicContact CB-CD2 4.49Å; Y130-S132 PolarHBondContact O-N 2.81Å
131	A	93.6	Very high	90.6	Very high	10 Å²	10	43.3 Å²	43.3	8%	0.083	23%	0.228	C	C	.	.			trans	-84.4	101.7	170.5	0	0	0	0	0	110.2	L181 L182 K189	A131-L181 HydrophobicContact CB-CB 3.5Å; A131-L181 VanDerWaalsContact CB-CB 3.5Å; A131-L181 HydrophobicContact CB-CD1 3.9Å; A131-L181 HydrophobicContact CB-CG 4.35Å; A131-L182 CarbonylContact C-O 3.56Å; A131-L182 VanDerWaalsContact C-O 3.31Å; A131-L182 WeakPolarHBondContact CB-O 3.41Å; A131-K189 HydrophobicContact CB-CB 4.29Å; A131-K189 HydrophobicContact CB-CG 4.41Å
132	S	91.9	Very high	90.4	Very high	53 Å²	53	40.1 Å²	40.1	37%	0.371	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-27	-169.4	59.6	0	0	0	0	115.2	Y130 G134 L182 N184	Y130-S132 PolarHBondContact O-N 2.81Å; S132-G134 VanDerWaalsContact C-N 3.27Å; S132-G134 PolarHBondContact O-N 2.63Å; S132-L182 PolarHBondContact N-O 3.24Å; S132-N184 WeakPolarHBondContact CB-OD1 3.47Å; S132-N184 PolarHBondContact OG-OD1 3.45Å
133	G	87.5	Confident	90.1	Very high	39 Å²	39	39.6 Å²	39.6	40%	0.402	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-2.5	-179	0	0	0	0	0	115.3	L182	G133-L182 VanDerWaalsContact CA-O 3.3Å; G133-L182 WeakPolarHBondContact CA-O 3.25Å; G133-L182 PolarHBondContact N-O 2.98Å
134	G	88.6	Confident	90	Very high	32 Å²	32	39.1 Å²	39.1	33%	0.33	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	78.2	-157.4	177.9	0	0	0	0	0	114	S132 L181 L182	S132-G134 VanDerWaalsContact C-N 3.27Å; S132-G134 PolarHBondContact O-N 2.63Å; G134-L181 CarbonylContact O-C 3.52Å; G134-L181 VanDerWaalsContact O-CA 3.29Å; G134-L181 WeakPolarHBondContact O-CA 3.35Å; G134-L182 PolarHBondContact O-N 2.85Å
135	E	88.7	Confident	89.9	Confident	74 Å²	74	43.8 Å²	43.8	35%	0.346	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	142	-177.6	-66.1	171.1	-139.1	0	0	112	F137 D138 Y139 L181	E135-F137 PolarHBondContact O-N 3.49Å; E135-D138 HydrophobicContact CB-CB 4.48Å; E135-D138 PolarHBondContact O-N 3.43Å; E135-D138 VanDerWaalsContact O-N 3.16Å; E135-Y139 PolarHBondContact O-N 2.83Å; E135-L181 HydrophobicContact CB-CD2 4.47Å; E135-L181 HydrophobicContact CG-CD2 3.7Å
136	V	88.8	Confident	89.8	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-58.4	-30.8	171.4	172.7	0	0	0	0	111.2	Y139 L140 M146 L180 L182 I188 L242	V136-Y139 WeakPolarHBondContact O-CB 3.5Å; V136-Y139 PolarHBondContact O-N 2.76Å; V136-L140 HydrophobicContact CG1-CD1 4.4Å; V136-L140 WeakPolarHBondContact O-CG 3.28Å; V136-L140 PolarHBondContact O-N 3.27Å; V136-M146 HydrophobicContact CG1-CE 4.37Å; V136-L180 HydrophobicContact CB-CB 4.05Å; V136-L180 WeakPolarHBondContact CB-O 3.46Å; V136-L180 HydrophobicContact CG2-CB 3.78Å; V136-L180 VanDerWaalsContact CG2-O 3.32Å; V136-L180 WeakPolarHBondContact CG2-O 3.49Å; V136-L180 PolarHBondContact N-O 3.49Å; V136-L182 HydrophobicContact CG2-CD1 4.26Å; V136-L182 HydrophobicContact CG2-CD2 3.89Å; V136-L182 HydrophobicContact CG2-CG 3.83Å; V136-I188 HydrophobicContact CG2-CD1 3.56Å; V136-L242 HydrophobicContact CG1-CD2 3.65Å
137	F	81.2	Confident	89.8	Confident	54 Å²	54	49.8 Å²	49.8	24%	0.237	27%	0.274	C	S	.	.	H	α-helix	trans	-64.9	-47.1	174.6	-170.9	-96.6	0	0	0	113	E135 Y139 L140 V141 A177 F910	E135-F137 PolarHBondContact O-N 3.49Å; F137-Y139 PolarHBondContact O-N 3.15Å; F137-L140 PolarHBondContact O-N 2.66Å; F137-L140 VanDerWaalsContact O-N 3.13Å; F137-V141 HydrophobicContact CD1-CG2 4.06Å; F137-V141 HydrophobicContact CE1-CG2 3.78Å; F137-V141 HydrophobicContact CZ-CG2 4.24Å; F137-V141 WeakPolarHBondContact O-CG2 3.31Å; F137-V141 PolarHBondContact O-N 3.14Å; F137-A177 HydrophobicContact CB-CB 4.06Å; F137-A177 HydrophobicContact CD2-CB 4.07Å; F137-F910 HydrophobicContact CE2-CD2 4.43Å; F137-F910 AromaticContact CE2-CE2 3.76Å; F137-F910 HydrophobicContact CE2-CE2 3.76Å; F137-F910 HydrophobicContact CE2-CZ 4.3Å; F137-F910 AromaticContact CZ-CD2 3.85Å; F137-F910 HydrophobicContact CZ-CD2 3.85Å; F137-F910 AromaticContact CZ-CE2 3.55Å; F137-F910 HydrophobicContact CZ-CE2 3.55Å; F137-F910 HydrophobicContact CZ-CZ 4.49Å
138	D	83.8	Confident	89.9	Confident	72 Å²	72	51.3 Å²	51.3	39%	0.385	28%	0.281	S	S	.	.	H	α-helix	trans	-59.5	-37.5	175.3	-105.5	8.5	0	0	0	110.3	M1 E135 V141 A142	M1-D138 PolarHBondContact N-OD2 3.2Å; E135-D138 HydrophobicContact CB-CB 4.48Å; E135-D138 PolarHBondContact O-N 3.43Å; E135-D138 VanDerWaalsContact O-N 3.16Å; D138-V141 PolarHBondContact O-N 3.1Å; D138-A142 WeakPolarHBondContact O-CB 3.3Å; D138-A142 PolarHBondContact O-N 3.26Å
139	Y	85.6	Confident	89.9	Confident	54 Å²	54	58.3 Å²	58.3	21%	0.212	31%	0.311	C	S	.	.	H	α-helix	trans	-61.7	-45.9	173.4	-173.1	-89.1	0	0	0	113	E135 V136 F137 V141 A142 H143 M146 E150 L182 M186	E135-Y139 PolarHBondContact O-N 2.83Å; V136-Y139 WeakPolarHBondContact O-CB 3.5Å; V136-Y139 PolarHBondContact O-N 2.76Å; F137-Y139 PolarHBondContact O-N 3.15Å; Y139-V141 VanDerWaalsContact C-N 3.31Å; Y139-V141 PolarHBondContact O-N 3.08Å; Y139-A142 PolarHBondContact O-N 3.07Å; Y139-H143 AromaticContact CD1-ND1 3.9Å; Y139-H143 AromaticContact CD2-CE1 3.46Å; Y139-H143 VanDerWaalsContact CD2-CE1 3.46Å; Y139-H143 WeakPolarHBondContact CD2-CE1 3.35Å; Y139-H143 AromaticContact CD2-ND1 3.3Å; Y139-H143 VanDerWaalsContact CD2-ND1 3.3Å; Y139-H143 WeakPolarHBondContact CD2-ND1 3.28Å; Y139-H143 HydrophobicContact CE1-CB 4.06Å; Y139-H143 AromaticContact CE1-ND1 3.82Å; Y139-H143 AromaticContact CE2-CE1 3.25Å; Y139-H143 WeakPolarHBondContact CE2-CE1 3.27Å; Y139-H143 AromaticContact CE2-CG 3.87Å; Y139-H143 AromaticContact CE2-ND1 3.2Å; Y139-H143 WeakPolarHBondContact CE2-ND1 3.48Å; Y139-H143 AromaticContact CE2-NE2 3.93Å; Y139-H143 AromaticContact CG-ND1 3.66Å; Y139-H143 AromaticContact CZ-CE1 3.89Å; Y139-H143 AromaticContact CZ-CG 3.69Å; Y139-H143 AromaticContact CZ-ND1 3.46Å; Y139-H143 PolarHBondContact O-N 3.16Å; Y139-H143 PolarHBondContact O-ND1 3.06Å; Y139-M146 HydrophobicContact CD1-CE 3.57Å; Y139-M146 HydrophobicContact CE1-CE 3.84Å; Y139-M146 HydrophobicContact CE1-CG 4.38Å; Y139-E150 PolarHBondContact OH-OE1 3.46Å; Y139-L182 HydrophobicContact CG-CD1 4.44Å; Y139-M186 HydrophobicContact CD2-CE 3.42Å; Y139-M186 VanDerWaalsContact CD2-CE 3.42Å; Y139-M186 HydrophobicContact CE2-CE 3.44Å; Y139-M186 VanDerWaalsContact CE2-CE 3.44Å; Y139-M186 HydrophobicContact CG-CE 4.33Å
140	L	87.7	Confident	89.9	Confident	7 Å²	7	59.6 Å²	59.6	4%	0.037	32%	0.317	C	S	.	.	H	α-helix	trans	-68.2	-27.4	177.4	-69.5	173.9	0	0	0	113.1	V136 F137 G144 M146 T241 L242	V136-L140 HydrophobicContact CG1-CD1 4.4Å; V136-L140 WeakPolarHBondContact O-CG 3.28Å; V136-L140 PolarHBondContact O-N 3.27Å; F137-L140 PolarHBondContact O-N 2.66Å; F137-L140 VanDerWaalsContact O-N 3.13Å; L140-G144 WeakPolarHBondContact CA-O 3.44Å; L140-G144 VanDerWaalsContact CD2-O 3.29Å; L140-G144 WeakPolarHBondContact CD2-O 3Å; L140-G144 CarbonylContact O-C 3.46Å; L140-G144 WeakPolarHBondContact O-CA 3.49Å; L140-G144 PolarHBondContact O-N 3.24Å; L140-M146 HydrophobicContact CD2-CE 4.33Å; L140-M146 HydrophobicContact CD2-CG 3.93Å; L140-M146 HydrophobicContact CD2-SD 4.49Å; L140-T241 HydrophobicContact CD1-CG2 4.19Å; L140-L242 HydrophobicContact CD1-CD2 4.11Å; L140-L242 HydrophobicContact CD2-CD2 4.46Å
141	V	83.6	Confident	90	Very high	70 Å²	70	57.8 Å²	57.8	42%	0.424	31%	0.31	S	S	.	.	H	α-helix	trans	-71.5	-41.6	172.6	170.5	0	0	0	0	110.8	F137 D138 Y139	F137-V141 HydrophobicContact CD1-CG2 4.06Å; F137-V141 HydrophobicContact CE1-CG2 3.78Å; F137-V141 HydrophobicContact CZ-CG2 4.24Å; F137-V141 WeakPolarHBondContact O-CG2 3.31Å; F137-V141 PolarHBondContact O-N 3.14Å; D138-V141 PolarHBondContact O-N 3.1Å; Y139-V141 VanDerWaalsContact C-N 3.31Å; Y139-V141 PolarHBondContact O-N 3.08Å
142	A	86.6	Confident	90.2	Very high	77 Å²	77	58.1 Å²	58.1	64%	0.636	31%	0.309	S	S	*	.	H	α-helix	trans	-74.3	-44.6	-179.1	0	0	0	0	0	113.8	D138 Y139	D138-A142 WeakPolarHBondContact O-CB 3.3Å; D138-A142 PolarHBondContact O-N 3.26Å; Y139-A142 PolarHBondContact O-N 3.07Å
143	H	86.1	Confident	90.4	Very high	125 Å²	125	57.3 Å²	57.3	58%	0.579	31%	0.305	S	S	*	.	H	α-helix	trans	-102.7	-11.2	-172.5	-54.7	89.3	0	0	0	113.6	Y139	Y139-H143 AromaticContact CD1-ND1 3.9Å; Y139-H143 AromaticContact CD2-CE1 3.46Å; Y139-H143 VanDerWaalsContact CD2-CE1 3.46Å; Y139-H143 WeakPolarHBondContact CD2-CE1 3.35Å; Y139-H143 AromaticContact CD2-ND1 3.3Å; Y139-H143 VanDerWaalsContact CD2-ND1 3.3Å; Y139-H143 WeakPolarHBondContact CD2-ND1 3.28Å; Y139-H143 HydrophobicContact CE1-CB 4.06Å; Y139-H143 AromaticContact CE1-ND1 3.82Å; Y139-H143 AromaticContact CE2-CE1 3.25Å; Y139-H143 WeakPolarHBondContact CE2-CE1 3.27Å; Y139-H143 AromaticContact CE2-CG 3.87Å; Y139-H143 AromaticContact CE2-ND1 3.2Å; Y139-H143 WeakPolarHBondContact CE2-ND1 3.48Å; Y139-H143 AromaticContact CE2-NE2 3.93Å; Y139-H143 AromaticContact CG-ND1 3.66Å; Y139-H143 AromaticContact CZ-CE1 3.89Å; Y139-H143 AromaticContact CZ-CG 3.69Å; Y139-H143 AromaticContact CZ-ND1 3.46Å; Y139-H143 PolarHBondContact O-N 3.16Å; Y139-H143 PolarHBondContact O-ND1 3.06Å
144	G	87.7	Confident	90.8	Very high	18 Å²	18	57 Å²	57	19%	0.186	29%	0.293	C	S	.	.			trans	81	-146.5	-170.9	0	0	0	0	0	112.1	L140	L140-G144 WeakPolarHBondContact CA-O 3.44Å; L140-G144 VanDerWaalsContact CD2-O 3.29Å; L140-G144 WeakPolarHBondContact CD2-O 3Å; L140-G144 CarbonylContact O-C 3.46Å; L140-G144 WeakPolarHBondContact O-CA 3.49Å; L140-G144 PolarHBondContact O-N 3.24Å
145	R	92.2	Very high	91.3	Very high	101 Å²	101	55.5 Å²	55.5	38%	0.381	28%	0.277	S	S	.	.	S	Bend	trans	-77.5	140.7	-178.2	74.4	-169.5	-170.9	78.5	-0.4	111.4	V243 S244	R145-V243 WeakPolarHBondContact CD-O 3.36Å; R145-V243 PolarHBondContact NH1-O 3.39Å; R145-S244 VanDerWaalsContact CB-C 3.45Å
146	M	93.7	Very high	91.7	Very high	6 Å²	6	52.7 Å²	52.7	3%	0.03	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-68.4	155.7	172.8	-70.3	177	177.8	0	0	111.2	V136 Y139 L140 E150 A151 L242	V136-M146 HydrophobicContact CG1-CE 4.37Å; Y139-M146 HydrophobicContact CD1-CE 3.57Å; Y139-M146 HydrophobicContact CE1-CE 3.84Å; Y139-M146 HydrophobicContact CE1-CG 4.38Å; L140-M146 HydrophobicContact CD2-CE 4.33Å; L140-M146 HydrophobicContact CD2-CG 3.93Å; L140-M146 HydrophobicContact CD2-SD 4.49Å; M146-E150 HydrophobicContact CB-CG 4.34Å; M146-E150 HydrophobicContact CG-CG 4.28Å; M146-E150 HydrophobicContact SD-CG 4.34Å; M146-A151 HydrophobicContact CB-CB 4.01Å; M146-L242 HydrophobicContact CE-CD2 4.04Å; M146-L242 PolarHBondContact N-O 2.73Å; M146-L242 HydrophobicContact SD-CB 4.41Å; M146-L242 HydrophobicContact SD-CD2 3.65Å
147	K	95.9	Very high	92.1	Very high	159 Å²	159	54.5 Å²	54.5	69%	0.691	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-77.4	148.5	167.1	-68.2	176.6	-177.3	172	0	109.3	K149 E150 A151	K147-K149 VanDerWaalsContact C-N 3.27Å; K147-K149 PolarHBondContact O-N 2.73Å; K147-K149 VanDerWaalsContact O-N 3.14Å; K147-E150 PolarHBondContact N-OE2 2.95Å; K147-E150 WeakPolarHBondContact O-CA 3.32Å; K147-E150 WeakPolarHBondContact O-CB 3.35Å; K147-E150 PolarHBondContact O-N 2.67Å; K147-A151 PolarHBondContact O-N 2.75Å
148	E	97.8	Very high	92.9	Very high	31 Å²	31	52 Å²	52	15%	0.145	26%	0.261	C	S	.	.	H	α-helix	trans	-58.4	-34	-174.7	-71.2	-171.2	-161.8	0	0	114.3	E150 R152 V243 M272 S273 W302	E148-E150 VanDerWaalsContact C-N 3.32Å; E148-E150 PolarHBondContact O-N 3.01Å; E148-R152 WeakPolarHBondContact O-CB 3.12Å; E148-R152 PolarHBondContact O-N 2.86Å; E148-V243 HydrophobicContact CG-CG1 4.23Å; E148-M272 WeakPolarHBondContact OE1-CA 3.23Å; E148-S273 PolarHBondContact OE1-N 3.28Å; E148-S273 PolarHBondContact OE1-OG 3.35Å; E148-S273 WeakPolarHBondContact OE2-CB 3.44Å; E148-S273 PolarHBondContact OE2-OG 3.22Å; E148-W302 HydrophobicContact CB-CZ2 3.9Å; E148-W302 HydrophobicContact CG-CZ2 4.14Å; E148-W302 PolarHBondContact OE2-NE1 2.81Å
149	K	97.1	Very high	93.6	Very high	170 Å²	170	48.5 Å²	48.5	74%	0.739	24%	0.242	S	C	*	.	H	α-helix	trans	-61.8	-38.3	174	-178.5	173.9	179.9	174.1	0	112.8	K147 A153	K147-K149 VanDerWaalsContact C-N 3.27Å; K147-K149 PolarHBondContact O-N 2.73Å; K147-K149 VanDerWaalsContact O-N 3.14Å; K149-A153 PolarHBondContact O-N 3.35Å
150	E	95.5	Very high	94.2	Very high	61 Å²	61	46.6 Å²	46.6	29%	0.285	24%	0.237	S	C	.	.	H	α-helix	trans	-76.7	-48.9	178.9	173.5	-165.2	-171	0	0	110.5	Y139 M146 K147 E148 R152 A153 K154	Y139-E150 PolarHBondContact OH-OE1 3.46Å; M146-E150 HydrophobicContact CB-CG 4.34Å; M146-E150 HydrophobicContact CG-CG 4.28Å; M146-E150 HydrophobicContact SD-CG 4.34Å; K147-E150 PolarHBondContact N-OE2 2.95Å; K147-E150 WeakPolarHBondContact O-CA 3.32Å; K147-E150 WeakPolarHBondContact O-CB 3.35Å; K147-E150 PolarHBondContact O-N 2.67Å; E148-E150 VanDerWaalsContact C-N 3.32Å; E148-E150 PolarHBondContact O-N 3.01Å; E150-R152 PolarHBondContact O-N 3.45Å; E150-A153 WeakPolarHBondContact O-CB 3.38Å; E150-A153 PolarHBondContact O-N 3.04Å; E150-A153 VanDerWaalsContact O-N 3.08Å; E150-K154 PolarHBondContact O-N 3.22Å; E150-K154 VanDerWaalsContact O-N 3.16Å
151	A	96.7	Very high	94.7	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-55.5	-41.1	175.4	0	0	0	0	0	111.2	M146 K147 K154 F155 L242 V243 W302	M146-A151 HydrophobicContact CB-CB 4.01Å; K147-A151 PolarHBondContact O-N 2.75Å; A151-K154 PolarHBondContact O-N 3.4Å; A151-F155 WeakPolarHBondContact O-CB 3.38Å; A151-F155 PolarHBondContact O-N 3.4Å; A151-L242 HydrophobicContact CB-CB 4.24Å; A151-V243 HydrophobicContact CB-CG1 3.72Å; A151-W302 HydrophobicContact CB-CH2 4.26Å
152	R	97.9	Very high	95.3	Very high	17 Å²	17	42.9 Å²	42.9	6%	0.064	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-47.4	173.9	179.4	-176.9	-57.4	130.4	13.4	112.6	E148 E150 K154 F155 R156 W302 I305 F307	E148-R152 WeakPolarHBondContact O-CB 3.12Å; E148-R152 PolarHBondContact O-N 2.86Å; E150-R152 PolarHBondContact O-N 3.45Å; R152-K154 VanDerWaalsContact C-N 3.31Å; R152-K154 PolarHBondContact O-N 3.2Å; R152-F155 PolarHBondContact O-N 3.34Å; R152-R156 HydrophobicContact CG-CG 4.36Å; R152-R156 WeakPolarHBondContact O-CB 3.44Å; R152-R156 VanDerWaalsContact O-CG 3.3Å; R152-R156 WeakPolarHBondContact O-CG 3.44Å; R152-R156 PolarHBondContact O-N 3.46Å; R152-W302 HydrophobicContact CB-CH2 3.82Å; R152-W302 HydrophobicContact CB-CZ2 4.27Å; R152-W302 HydrophobicContact CB-CZ3 3.96Å; R152-W302 WeakPolarHBondContact CD-O 3.44Å; R152-W302 HydrophobicContact CG-CZ3 4.35Å; R152-W302 PolarHBondContact NE-O 3.2Å; R152-I305 WeakPolarHBondContact CD-O 3.47Å; R152-I305 PolarHBondContact NE-O 2.99Å; R152-I305 PolarHBondContact NH1-O 3.43Å; R152-F307 HydrophobicContact CG-CE2 4.17Å
153	A	96.3	Very high	95.8	Very high	36 Å²	36	39.5 Å²	39.5	30%	0.298	19%	0.186	S	C	.	.	H	α-helix	trans	-60	-41.6	179.9	0	0	0	0	0	111.8	K149 E150	K149-A153 PolarHBondContact O-N 3.35Å; E150-A153 WeakPolarHBondContact O-CB 3.38Å; E150-A153 PolarHBondContact O-N 3.04Å; E150-A153 VanDerWaalsContact O-N 3.08Å
154	K	96.1	Very high	96.3	Very high	32 Å²	32	33.9 Å²	33.9	14%	0.139	16%	0.159	C	C	.	.	H	α-helix	trans	-73.2	-38.3	175.1	-54	-52.5	170.7	-171.2	0	112.2	E150 A151 R152 Q157 I158 M186 I188	E150-K154 PolarHBondContact O-N 3.22Å; E150-K154 VanDerWaalsContact O-N 3.16Å; A151-K154 PolarHBondContact O-N 3.4Å; R152-K154 VanDerWaalsContact C-N 3.31Å; R152-K154 PolarHBondContact O-N 3.2Å; K154-Q157 WeakPolarHBondContact O-CB 3.22Å; K154-Q157 PolarHBondContact O-N 3.41Å; K154-I158 WeakPolarHBondContact O-CG1 3.36Å; K154-I158 PolarHBondContact O-N 3.34Å; K154-M186 WeakPolarHBondContact CE-O 3.27Å; K154-M186 PolarHBondContact NZ-O 3.34Å; K154-I188 HydrophobicContact CB-CD1 4.11Å; K154-I188 HydrophobicContact CB-CG1 3.88Å; K154-I188 HydrophobicContact CD-CG1 4.21Å
155	F	97.8	Very high	96.7	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-75.2	-29.2	-177	-162.7	-107.9	0	0	0	113.3	A151 R152 Q157 I158 V159 L235 I238 L239 L242 F283 W302 M303	A151-F155 WeakPolarHBondContact O-CB 3.38Å; A151-F155 PolarHBondContact O-N 3.4Å; R152-F155 PolarHBondContact O-N 3.34Å; F155-Q157 VanDerWaalsContact C-N 3.32Å; F155-Q157 PolarHBondContact O-N 2.96Å; F155-I158 HydrophobicContact CD2-CB 4.44Å; F155-I158 HydrophobicContact CD2-CD1 4.07Å; F155-I158 PolarHBondContact O-N 3.47Å; F155-V159 HydrophobicContact CD1-CG2 3.94Å; F155-V159 HydrophobicContact CE1-CG2 3.61Å; F155-V159 HydrophobicContact CE2-CG2 4.48Å; F155-V159 HydrophobicContact CZ-CG2 3.9Å; F155-V159 WeakPolarHBondContact O-CB 3.26Å; F155-V159 WeakPolarHBondContact O-CG2 3.22Å; F155-V159 PolarHBondContact O-N 3.3Å; F155-L235 HydrophobicContact CE2-CB 4.37Å; F155-L235 HydrophobicContact CE2-CD2 4.22Å; F155-L235 WeakPolarHBondContact CE2-O 3.14Å; F155-L235 HydrophobicContact CZ-CB 4.15Å; F155-L235 WeakPolarHBondContact CZ-O 3.43Å; F155-I238 HydrophobicContact CE2-CG2 4.4Å; F155-L239 HydrophobicContact CD1-CD1 4.04Å; F155-L239 HydrophobicContact CD1-CD2 4.48Å; F155-L239 HydrophobicContact CD2-CB 4.23Å; F155-L239 HydrophobicContact CD2-CD1 4.39Å; F155-L239 HydrophobicContact CE1-CB 4.19Å; F155-L239 HydrophobicContact CE1-CD1 4.3Å; F155-L239 HydrophobicContact CE1-CD2 4.02Å; F155-L239 HydrophobicContact CE1-CG 4.4Å; F155-L239 HydrophobicContact CE2-CB 3.75Å; F155-L239 HydrophobicContact CG-CD1 4.1Å; F155-L239 HydrophobicContact CZ-CB 3.73Å; F155-L239 HydrophobicContact CZ-CD2 4.31Å; F155-L239 HydrophobicContact CZ-CG 4.42Å; F155-L242 HydrophobicContact CD2-CD1 4.15Å; F155-F283 AromaticContact CE1-CE2 3.63Å; F155-F283 HydrophobicContact CE1-CE2 3.63Å; F155-F283 AromaticContact CE1-CZ 3.55Å; F155-F283 HydrophobicContact CE1-CZ 3.55Å; F155-F283 HydrophobicContact CZ-CE1 4.4Å; F155-F283 AromaticContact CZ-CE2 3.71Å; F155-F283 HydrophobicContact CZ-CE2 3.71Å; F155-F283 AromaticContact CZ-CZ 3.49Å; F155-F283 HydrophobicContact CZ-CZ 3.49Å; F155-F283 VanDerWaalsContact CZ-CZ 3.49Å; F155-W302 HydrophobicContact CD1-CZ3 4.26Å; F155-M303 HydrophobicContact CD1-CE 3.96Å; F155-M303 HydrophobicContact CD1-SD 3.6Å; F155-M303 HydrophobicContact CE1-CE 4.45Å; F155-M303 HydrophobicContact CE1-SD 4.03Å
156	R	98.1	Very high	96.8	Very high	16 Å²	16	29.3 Å²	29.3	6%	0.06	14%	0.137	C	C	.	.	H	α-helix	trans	-56	-46	164.8	-74.5	170.6	68.3	89.2	-4.3	111.3	R152 V159 S160 M303 N304 F307 D310 L312	R152-R156 HydrophobicContact CG-CG 4.36Å; R152-R156 WeakPolarHBondContact O-CB 3.44Å; R152-R156 VanDerWaalsContact O-CG 3.3Å; R152-R156 WeakPolarHBondContact O-CG 3.44Å; R152-R156 PolarHBondContact O-N 3.46Å; R156-V159 PolarHBondContact O-N 2.96Å; R156-S160 WeakPolarHBondContact O-CB 3.45Å; R156-S160 PolarHBondContact O-N 3.3Å; R156-M303 WeakPolarHBondContact CD-O 3.37Å; R156-M303 HydrophobicContact CG-CE 4.09Å; R156-M303 PolarHBondContact NH1-O 3.04Å; R156-N304 PolarHBondContact NH1-OD1 2.88Å; R156-F307 VanDerWaalsContact CZ-CG 3.44Å; R156-D310 PolarHBondContact NH2-O 3.24Å; R156-D310 IonicContact NH2-OD2 2.67Å; R156-D310 PolarHBondContact NH2-OD2 3.41Å; R156-L312 HydrophobicContact CB-CD2 4.2Å; R156-L312 HydrophobicContact CG-CD2 4.21Å
157	Q	97.5	Very high	96.8	Very high	39 Å²	39	34.1 Å²	34.1	18%	0.182	16%	0.16	C	C	.	.	H	α-helix	trans	-64	-43.4	177.3	-68.9	177.1	-17.9	0	0	112.4	N110 K154 F155 A161 N187 I188	N110-Q157 HydrophobicContact CB-CB 4.22Å; K154-Q157 WeakPolarHBondContact O-CB 3.22Å; K154-Q157 PolarHBondContact O-N 3.41Å; F155-Q157 VanDerWaalsContact C-N 3.32Å; F155-Q157 PolarHBondContact O-N 2.96Å; Q157-A161 WeakPolarHBondContact O-CB 3.29Å; Q157-A161 PolarHBondContact O-N 2.86Å; Q157-A161 VanDerWaalsContact O-N 3.09Å; Q157-N187 PolarHBondContact NE2-OD1 3.4Å; Q157-I188 HydrophobicContact CB-CB 3.99Å; Q157-I188 HydrophobicContact CB-CG1 4.26Å
158	I	97.8	Very high	96.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.5	-49.6	176.2	-61.2	161.9	0	0	0	110.6	K154 F155 S160 A161 V162 L180 I188 I190 L235 I238 L242	K154-I158 WeakPolarHBondContact O-CG1 3.36Å; K154-I158 PolarHBondContact O-N 3.34Å; F155-I158 HydrophobicContact CD2-CB 4.44Å; F155-I158 HydrophobicContact CD2-CD1 4.07Å; F155-I158 PolarHBondContact O-N 3.47Å; I158-S160 PolarHBondContact O-N 2.92Å; I158-A161 PolarHBondContact O-N 2.95Å; I158-V162 HydrophobicContact CG2-CG2 4.47Å; I158-V162 WeakPolarHBondContact O-CG2 3.36Å; I158-V162 PolarHBondContact O-N 3.27Å; I158-L180 HydrophobicContact CD1-CD1 3.66Å; I158-L180 HydrophobicContact CG1-CD1 4.27Å; I158-L180 HydrophobicContact CG1-CD2 4.25Å; I158-L180 HydrophobicContact CG2-CD2 4.46Å; I158-I188 HydrophobicContact CD1-CD1 4.27Å; I158-I188 HydrophobicContact CD1-CG1 4.43Å; I158-I188 HydrophobicContact CG1-CB 4.42Å; I158-I188 HydrophobicContact CG1-CD1 4.28Å; I158-I188 HydrophobicContact CG1-CG1 4.03Å; I158-I188 HydrophobicContact CG1-CG2 3.75Å; I158-I190 HydrophobicContact CG2-CD1 4.32Å; I158-L235 HydrophobicContact CG2-CD2 3.31Å; I158-I238 HydrophobicContact CD1-CG2 4.19Å; I158-L242 HydrophobicContact CD1-CD1 4.3Å
159	V	98.3	Very high	96.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64	-39.2	-179.2	170	0	0	0	0	111.6	F155 R156 V162 Q163 I297 M298 M303 L312	F155-V159 HydrophobicContact CD1-CG2 3.94Å; F155-V159 HydrophobicContact CE1-CG2 3.61Å; F155-V159 HydrophobicContact CE2-CG2 4.48Å; F155-V159 HydrophobicContact CZ-CG2 3.9Å; F155-V159 WeakPolarHBondContact O-CB 3.26Å; F155-V159 WeakPolarHBondContact O-CG2 3.22Å; F155-V159 PolarHBondContact O-N 3.3Å; R156-V159 PolarHBondContact O-N 2.96Å; V159-V162 PolarHBondContact O-N 2.89Å; V159-Q163 VanDerWaalsContact O-CB 3.25Å; V159-Q163 WeakPolarHBondContact O-CB 3.43Å; V159-Q163 PolarHBondContact O-N 3.29Å; V159-I297 HydrophobicContact CG1-CG2 4.26Å; V159-I297 HydrophobicContact CG2-CG2 4.42Å; V159-M298 HydrophobicContact CG1-CG 3.69Å; V159-M303 HydrophobicContact CB-CE 3.93Å; V159-M303 HydrophobicContact CG1-CE 4.26Å; V159-M303 HydrophobicContact CG2-CE 3.81Å; V159-L312 HydrophobicContact CB-CD2 4.44Å; V159-L312 HydrophobicContact CG1-CD2 4.22Å
160	S	98.1	Very high	96.2	Very high	13 Å²	13	23.9 Å²	23.9	9%	0.091	12%	0.118	C	C	.	.	H	α-helix	trans	-58.2	-48.2	172.8	-172.8	0	0	0	0	111.9	H108 R156 I158 Y164	H108-S160 PolarHBondContact NE2-OG 2.68Å; R156-S160 WeakPolarHBondContact O-CB 3.45Å; R156-S160 PolarHBondContact O-N 3.3Å; I158-S160 PolarHBondContact O-N 2.92Å; S160-Y164 WeakPolarHBondContact O-CB 3.5Å; S160-Y164 PolarHBondContact O-N 3.39Å
161	A	97.4	Very high	96	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-64.5	-43.7	-179.5	0	0	0	0	0	112.6	H108 N110 I111 Q157 I158 Y164 L165 I190	H108-A161 VanDerWaalsContact CE1-CA 3.45Å; H108-A161 WeakPolarHBondContact CE1-CA 3.19Å; H108-A161 PolarHBondContact CE1-N 2.64Å; H108-A161 PolarHBondContact NE2-N 2.94Å; N110-A161 HydrophobicContact CB-CB 4.27Å; I111-A161 HydrophobicContact CD1-CB 4.31Å; I111-A161 HydrophobicContact CG1-CB 3.89Å; Q157-A161 WeakPolarHBondContact O-CB 3.29Å; Q157-A161 PolarHBondContact O-N 2.86Å; Q157-A161 VanDerWaalsContact O-N 3.09Å; I158-A161 PolarHBondContact O-N 2.95Å; A161-Y164 WeakPolarHBondContact O-CB 3.45Å; A161-Y164 PolarHBondContact O-N 3.41Å; A161-L165 WeakPolarHBondContact O-CG 3.39Å; A161-L165 PolarHBondContact O-N 3.1Å; A161-L165 VanDerWaalsContact O-N 3.11Å; A161-I190 HydrophobicContact CB-CD1 3.57Å; A161-I190 HydrophobicContact CB-CG1 4.16Å
162	V	97.2	Very high	95.7	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-74.7	-35.1	-179.3	-176.9	0	0	0	0	112	I158 V159 Y164 L165 H166 L175 I190 D231 L235 L294	I158-V162 HydrophobicContact CG2-CG2 4.47Å; I158-V162 WeakPolarHBondContact O-CG2 3.36Å; I158-V162 PolarHBondContact O-N 3.27Å; V159-V162 PolarHBondContact O-N 2.89Å; V162-Y164 VanDerWaalsContact C-N 3.31Å; V162-Y164 PolarHBondContact O-N 2.84Å; V162-L165 WeakPolarHBondContact O-CB 3.33Å; V162-L165 PolarHBondContact O-N 2.98Å; V162-H166 WeakPolarHBondContact CG1-NE2 3.18Å; V162-H166 PolarHBondContact O-CD2 2.81Å; V162-H166 PolarHBondContact O-N 3.23Å; V162-L175 HydrophobicContact CG1-CD1 3.98Å; V162-L175 HydrophobicContact CG2-CD1 3.83Å; V162-L175 HydrophobicContact CG2-CD2 4.08Å; V162-I190 HydrophobicContact CG2-CD1 3.71Å; V162-D231 HydrophobicContact CG1-CB 4.12Å; V162-L235 HydrophobicContact CB-CD1 4.12Å; V162-L235 HydrophobicContact CG1-CD1 4.01Å; V162-L235 HydrophobicContact CG2-CD1 4.37Å; V162-L235 HydrophobicContact CG2-CD2 4.27Å; V162-L294 HydrophobicContact CB-CD1 4.04Å; V162-L294 HydrophobicContact CG1-CD1 3.77Å
163	Q	97.2	Very high	95.1	Very high	6 Å²	6	21 Å²	21	3%	0.028	11%	0.105	C	C	.	.	H	α-helix	trans	-63.1	-39.2	171.9	-177.5	-80.9	-31.2	0	0	111.3	V159 L165 H166 Q167 L294 M298	V159-Q163 VanDerWaalsContact O-CB 3.25Å; V159-Q163 WeakPolarHBondContact O-CB 3.43Å; V159-Q163 PolarHBondContact O-N 3.29Å; Q163-L165 PolarHBondContact O-N 3.43Å; Q163-H166 PolarHBondContact O-N 3.16Å; Q163-Q167 WeakPolarHBondContact O-CB 3.37Å; Q163-Q167 PolarHBondContact O-N 3.03Å; Q163-L294 HydrophobicContact CB-CB 3.98Å; Q163-L294 HydrophobicContact CB-CD1 4.07Å; Q163-L294 HydrophobicContact CG-CB 4.19Å; Q163-M298 HydrophobicContact CB-CE 3.91Å; Q163-M298 HydrophobicContact CB-SD 4.18Å; Q163-M298 HydrophobicContact CG-CE 3.99Å; Q163-M298 HydrophobicContact CG-SD 3.81Å
164	Y	97.1	Very high	94.7	Very high	6 Å²	6	19.5 Å²	19.5	2%	0.024	9%	0.092	C	C	.	.	H	α-helix	trans	-62.1	-38.5	173.3	167.9	-99.7	0	0	0	113.1	L106 N107 H108 I111 S160 A161 V162 Q167 K168 Y315 E317	L106-Y164 HydrophobicContact CD2-CD1 4.42Å; L106-Y164 HydrophobicContact CD2-CE1 3.77Å; N107-Y164 PolarHBondContact N-OH 2.83Å; N107-Y164 PolarHBondContact O-OH 2.98Å; H108-Y164 HydrophobicContact CB-CD1 3.64Å; H108-Y164 HydrophobicContact CB-CE1 3.6Å; H108-Y164 HydrophobicContact CB-CG 4.2Å; H108-Y164 AromaticContact CD2-CG 3.88Å; I111-Y164 HydrophobicContact CD1-CD1 3.84Å; I111-Y164 HydrophobicContact CD1-CE1 4.1Å; S160-Y164 WeakPolarHBondContact O-CB 3.5Å; S160-Y164 PolarHBondContact O-N 3.39Å; A161-Y164 WeakPolarHBondContact O-CB 3.45Å; A161-Y164 PolarHBondContact O-N 3.41Å; V162-Y164 VanDerWaalsContact C-N 3.31Å; V162-Y164 PolarHBondContact O-N 2.84Å; Y164-Q167 PolarHBondContact O-N 3.11Å; Y164-K168 VanDerWaalsContact CE2-CE 3.45Å; Y164-K168 PolarHBondContact O-N 3.29Å; Y164-K168 WeakPolarHBondContact OH-CE 3.42Å; Y164-K168 PolarHBondContact OH-NZ 2.96Å; Y164-Y315 AromaticContact CD2-CD1 3.73Å; Y164-Y315 HydrophobicContact CD2-CD1 3.73Å; Y164-Y315 HydrophobicContact CE2-CD1 4.01Å; Y164-Y315 HydrophobicContact CE2-CE1 4.39Å; Y164-Y315 HydrophobicContact CG-CD1 4.36Å; Y164-E317 HydrophobicContact CE2-CB 4.19Å; Y164-E317 PolarHBondContact OH-OE2 2.95Å
165	L	95.4	Very high	94.4	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-60.8	-50.4	170.9	-66.5	173	0	0	0	111.1	L106 I111 A161 V162 Q163 Q167 K168 N169 I170 H172 F193	L106-L165 HydrophobicContact CD1-CD2 3.66Å; L106-L165 HydrophobicContact CD2-CD2 3.48Å; L106-L165 VanDerWaalsContact CD2-CD2 3.48Å; L106-L165 HydrophobicContact CG-CD2 4.23Å; I111-L165 HydrophobicContact CD1-CD2 3.94Å; I111-L165 HydrophobicContact CD1-CG 4.12Å; A161-L165 WeakPolarHBondContact O-CG 3.39Å; A161-L165 PolarHBondContact O-N 3.1Å; A161-L165 VanDerWaalsContact O-N 3.11Å; V162-L165 WeakPolarHBondContact O-CB 3.33Å; V162-L165 PolarHBondContact O-N 2.98Å; Q163-L165 PolarHBondContact O-N 3.43Å; L165-Q167 VanDerWaalsContact C-N 3.27Å; L165-Q167 PolarHBondContact O-N 2.84Å; L165-K168 CarbonylContact O-C 3.59Å; L165-K168 PolarHBondContact O-N 2.95Å; L165-N169 PolarHBondContact O-N 3.42Å; L165-I170 CarbonylContact C-O 3.59Å; L165-I170 HydrophobicContact CB-CB 4.4Å; L165-I170 HydrophobicContact CD2-CB 4.47Å; L165-I170 HydrophobicContact CD2-CG2 4.15Å; L165-I170 PolarHBondContact O-N 2.92Å; L165-H172 HydrophobicContact CD1-CB 4.26Å; L165-F193 HydrophobicContact CD1-CE1 3.88Å; L165-F193 HydrophobicContact CD2-CE1 3.71Å; L165-F193 HydrophobicContact CD2-CZ 4.37Å; L165-F193 HydrophobicContact CG-CE1 4.46Å
166	H	94.6	Very high	93.9	Very high	24 Å²	24	18.7 Å²	18.7	11%	0.111	9%	0.088	C	C	.	.	H	α-helix	trans	-61.6	-37	-179.2	-65.6	-178.2	0	0	0	111.5	V162 Q163 K168 N169 I170 P228 D231	V162-H166 WeakPolarHBondContact CG1-NE2 3.18Å; V162-H166 PolarHBondContact O-CD2 2.81Å; V162-H166 PolarHBondContact O-N 3.23Å; Q163-H166 PolarHBondContact O-N 3.16Å; H166-K168 VanDerWaalsContact C-N 3.3Å; H166-K168 PolarHBondContact O-N 3.07Å; H166-N169 WeakPolarHBondContact O-CA 3.26Å; H166-N169 PolarHBondContact O-N 2.88Å; H166-I170 PolarHBondContact CD2-O 2.89Å; H166-I170 PolarHBondContact N-O 2.91Å; H166-P228 PolarHBondContact CE1-O 3.02Å; H166-D231 IonicContact CD2-OD2 3.68Å; H166-D231 IonicContact CE1-OD2 3.9Å; H166-D231 WeakPolarHBondContact NE2-CB 3.22Å; H166-D231 IonicContact NE2-OD2 3.2Å; H166-D231 PolarHBondContact NE2-OD2 3.45Å
167	Q	93.7	Very high	93.1	Very high	107 Å²	107	18.1 Å²	18.1	50%	0.5	9%	0.087	S	C	.	.	H	α-helix	trans	-66.3	-26.3	175.2	-174.5	174.7	-15.7	0	0	113.6	Q163 Y164 L165 N169	Q163-Q167 WeakPolarHBondContact O-CB 3.37Å; Q163-Q167 PolarHBondContact O-N 3.03Å; Y164-Q167 PolarHBondContact O-N 3.11Å; L165-Q167 VanDerWaalsContact C-N 3.27Å; L165-Q167 PolarHBondContact O-N 2.84Å; Q167-N169 VanDerWaalsContact C-N 3.31Å
168	K	93.3	Very high	92.2	Very high	66 Å²	66	18.9 Å²	18.9	29%	0.287	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	10.3	169.4	-72.1	-168.9	-166.5	-108.4	0	113.7	M105 L106 Y164 L165 H166 I170 E317	M105-K168 VanDerWaalsContact O-CE 3.27Å; M105-K168 WeakPolarHBondContact O-CE 3.21Å; M105-K168 PolarHBondContact O-NZ 2.63Å; L106-K168 HydrophobicContact CD2-CD 4.2Å; Y164-K168 VanDerWaalsContact CE2-CE 3.45Å; Y164-K168 PolarHBondContact O-N 3.29Å; Y164-K168 WeakPolarHBondContact OH-CE 3.42Å; Y164-K168 PolarHBondContact OH-NZ 2.96Å; L165-K168 CarbonylContact O-C 3.59Å; L165-K168 PolarHBondContact O-N 2.95Å; H166-K168 VanDerWaalsContact C-N 3.3Å; H166-K168 PolarHBondContact O-N 3.07Å; K168-I170 VanDerWaalsContact C-N 3.35Å; K168-I170 HydrophobicContact CB-CD1 3.95Å; K168-I170 HydrophobicContact CB-CG1 4.39Å; K168-E317 VanDerWaalsContact CE-OE2 3.31Å; K168-E317 WeakPolarHBondContact CE-OE2 3.31Å; K168-E317 IonicContact NZ-OE2 2.67Å; K168-E317 PolarHBondContact NZ-OE2 2.76Å
169	N	92	Very high	91.9	Very high	75 Å²	75	19.6 Å²	19.6	40%	0.401	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	37.4	-172.9	-51.7	-77	0	0	0	113.9	L165 H166 Q167 E198 F199	L165-N169 PolarHBondContact O-N 3.42Å; H166-N169 WeakPolarHBondContact O-CA 3.26Å; H166-N169 PolarHBondContact O-N 2.88Å; Q167-N169 VanDerWaalsContact C-N 3.31Å; N169-E198 CarbonylContact O-C 3.58Å; N169-E198 VanDerWaalsContact O-CA 3.28Å; N169-E198 WeakPolarHBondContact O-CA 3.18Å; N169-F199 HydrophobicContact CB-CD1 4.23Å; N169-F199 HydrophobicContact CB-CE1 4.18Å; N169-F199 HydrophobicContact CB-CG 4.49Å; N169-F199 HydrophobicContact CB-CZ 4.31Å; N169-F199 WeakPolarHBondContact O-CD1 3.46Å; N169-F199 PolarHBondContact O-N 2.87Å
170	I	91.9	Very high	91.6	Very high	3 Å²	3	19.6 Å²	19.6	2%	0.015	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133	176.9	-62.2	160.9	0	0	0	109.5	I102 L106 L165 H166 K168 N197 E198	I102-I170 HydrophobicContact CD1-CG2 4.24Å; I102-I170 HydrophobicContact CG1-CD1 4.5Å; I102-I170 HydrophobicContact CG2-CD1 4.28Å; I102-I170 HydrophobicContact CG2-CG2 4.22Å; L106-I170 HydrophobicContact CD2-CD1 4.02Å; L165-I170 CarbonylContact C-O 3.59Å; L165-I170 HydrophobicContact CB-CB 4.4Å; L165-I170 HydrophobicContact CD2-CB 4.47Å; L165-I170 HydrophobicContact CD2-CG2 4.15Å; L165-I170 PolarHBondContact O-N 2.92Å; H166-I170 PolarHBondContact CD2-O 2.89Å; H166-I170 PolarHBondContact N-O 2.91Å; K168-I170 VanDerWaalsContact C-N 3.35Å; K168-I170 HydrophobicContact CB-CD1 3.95Å; K168-I170 HydrophobicContact CB-CG1 4.39Å; I170-N197 WeakPolarHBondContact CA-O 3.31Å; I170-E198 HydrophobicContact CG1-CG 4.41Å
171	I	91.2	Very high	91.3	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	139	171.4	-53.3	134.6	0	0	0	108.6	R173 S196 N197 F199 L205 G227 D231	I171-R173 HydrophobicContact CB-CG 4.06Å; I171-R173 HydrophobicContact CG2-CG 3.5Å; I171-R173 VanDerWaalsContact CG2-CG 3.5Å; I171-S196 WeakPolarHBondContact O-CA 3.41Å; I171-S196 VanDerWaalsContact O-CB 3.26Å; I171-S196 WeakPolarHBondContact O-CB 3.47Å; I171-N197 PolarHBondContact N-O 2.89Å; I171-N197 PolarHBondContact O-N 3.17Å; I171-N197 VanDerWaalsContact O-N 3.1Å; I171-F199 HydrophobicContact CD1-CB 3.56Å; I171-F199 HydrophobicContact CD1-CD1 3.35Å; I171-F199 HydrophobicContact CD1-CE1 4.15Å; I171-F199 HydrophobicContact CD1-CG 3.67Å; I171-F199 HydrophobicContact CG1-CD1 3.4Å; I171-F199 HydrophobicContact CG1-CE1 3.73Å; I171-F199 HydrophobicContact CG1-CG 4.19Å; I171-L205 HydrophobicContact CD1-CD1 3.75Å; I171-G227 VanDerWaalsContact CD1-CA 3.42Å; I171-D231 HydrophobicContact CG2-CB 4.48Å; I171-D231 VanDerWaalsContact CG2-CG 3.48Å; I171-D231 VanDerWaalsContact CG2-OD2 3.25Å; I171-D231 WeakPolarHBondContact CG2-OD2 3.46Å
172	H	90.3	Very high	91.1	Very high	1 Å²	1	21 Å²	21	1%	0.005	10%	0.101	C	C	.	.			trans	-78.6	-44	-176.9	-167.4	-80.1	0	0	0	112.9	L165 D174 L175 A191 F193 S196 D231	L165-H172 HydrophobicContact CD1-CB 4.26Å; H172-D174 PolarHBondContact CE1-O 3.22Å; H172-D174 VanDerWaalsContact ND1-C 3.35Å; H172-D174 PolarHBondContact ND1-O 3.47Å; H172-D174 PolarHBondContact O-N 2.9Å; H172-L175 HydrophobicContact CB-CD1 4.29Å; H172-L175 HydrophobicContact CB-CD2 3.9Å; H172-L175 HydrophobicContact CB-CG 3.78Å; H172-A191 PolarHBondContact NE2-O 3.36Å; H172-F193 AromaticContact CD2-CD1 3.86Å; H172-F193 AromaticContact CD2-CE1 3.64Å; H172-S196 WeakPolarHBondContact CA-OG 3.14Å; H172-S196 WeakPolarHBondContact O-CA 3.5Å; H172-S196 PolarHBondContact O-N 2.95Å; H172-S196 PolarHBondContact O-OG 3.11Å; H172-D231 PolarHBondContact N-OD2 3.43Å
173	R	86.8	Confident	90.7	Very high	16 Å²	16	21.3 Å²	21.3	6%	0.06	10%	0.104	C	C	.	.	S	Bend	trans	65.8	-17.5	176.5	-55.1	-165.6	-60.5	173	-0.4	118.2	I171 F195 G210 Y225 D231	I171-R173 HydrophobicContact CB-CG 4.06Å; I171-R173 HydrophobicContact CG2-CG 3.5Å; I171-R173 VanDerWaalsContact CG2-CG 3.5Å; R173-F195 PolarHBondContact NE-O 3.35Å; R173-F195 PolarHBondContact NH2-O 3.28Å; R173-G210 WeakPolarHBondContact O-CA 3.5Å; R173-Y225 PolarHBondContact NH1-OH 2.83Å; R173-D231 PolarHBondContact N-OD1 2.93Å
174	D	86.4	Confident	89.6	Confident	5 Å²	5	27.1 Å²	27.1	3%	0.027	14%	0.135	C	C	.	.			trans	-123.6	57.9	165.6	-166.9	38.8	0	0	0	111.1	H172 K176 N179 F195 G210 S211	H172-D174 PolarHBondContact CE1-O 3.22Å; H172-D174 VanDerWaalsContact ND1-C 3.35Å; H172-D174 PolarHBondContact ND1-O 3.47Å; H172-D174 PolarHBondContact O-N 2.9Å; D174-K176 PolarHBondContact O-N 2.93Å; D174-K176 WeakPolarHBondContact OD2-CE 3.37Å; D174-K176 IonicContact OD2-NZ 2.66Å; D174-K176 PolarHBondContact OD2-NZ 2.98Å; D174-N179 PolarHBondContact O-ND2 2.96Å; D174-N179 PolarHBondContact OD2-ND2 2.8Å; D174-F195 HydrophobicContact CB-CB 4.12Å; D174-F195 HydrophobicContact CB-CD2 3.71Å; D174-F195 HydrophobicContact CB-CG 4.16Å; D174-G210 VanDerWaalsContact OD1-CA 3.3Å; D174-G210 WeakPolarHBondContact OD1-CA 3.26Å; D174-S211 WeakPolarHBondContact OD1-CB 3.49Å; D174-S211 PolarHBondContact OD1-N 3.49Å; D174-S211 PolarHBondContact OD1-OG 3.1Å
175	L	91.1	Very high	89.1	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.005	17%	0.165	C	C	.	.			trans	-77.7	116.9	172.1	-74.3	175	0	0	0	110.2	V162 H172 I190 Y214 D231 L235 I238	V162-L175 HydrophobicContact CG1-CD1 3.98Å; V162-L175 HydrophobicContact CG2-CD1 3.83Å; V162-L175 HydrophobicContact CG2-CD2 4.08Å; H172-L175 HydrophobicContact CB-CD1 4.29Å; H172-L175 HydrophobicContact CB-CD2 3.9Å; H172-L175 HydrophobicContact CB-CG 3.78Å; L175-I190 HydrophobicContact CD2-CG2 4.37Å; L175-Y214 WeakPolarHBondContact O-CB 3.49Å; L175-D231 HydrophobicContact CD1-CB 3.65Å; L175-L235 HydrophobicContact CD1-CD2 4.34Å; L175-L235 HydrophobicContact CD1-CG 4.15Å; L175-I238 HydrophobicContact CB-CD1 4.04Å
176	K	86.2	Confident	88.7	Confident	14 Å²	14	36 Å²	36	6%	0.061	18%	0.181	C	C	.	.			trans	-155.2	162.2	-176.9	59.6	-177.3	-178	169.7	0	111.2	D174 E178 N179 S211 Y214	D174-K176 PolarHBondContact O-N 2.93Å; D174-K176 WeakPolarHBondContact OD2-CE 3.37Å; D174-K176 IonicContact OD2-NZ 2.66Å; D174-K176 PolarHBondContact OD2-NZ 2.98Å; K176-E178 HydrophobicContact CD-CB 4.15Å; K176-E178 WeakPolarHBondContact CD-OE2 3.43Å; K176-E178 VanDerWaalsContact CE-OE2 3.23Å; K176-E178 WeakPolarHBondContact CE-OE2 3.35Å; K176-E178 HydrophobicContact CG-CB 4.15Å; K176-E178 IonicContact NZ-OE2 3.33Å; K176-E178 PolarHBondContact NZ-OE2 3.15Å; K176-E178 PolarHBondContact O-N 3.45Å; K176-N179 VanDerWaalsContact CE-ND2 3.27Å; K176-N179 WeakPolarHBondContact CE-ND2 3.46Å; K176-N179 WeakPolarHBondContact CE-OD1 3.42Å; K176-N179 HydrophobicContact CG-CB 3.92Å; K176-N179 PolarHBondContact O-N 2.86Å; K176-S211 VanDerWaalsContact CD-OG 3.3Å; K176-S211 WeakPolarHBondContact CD-OG 3.21Å; K176-S211 PolarHBondContact NZ-OG 3.17Å; K176-Y214 HydrophobicContact CB-CD1 4.14Å; K176-Y214 HydrophobicContact CB-CD2 3.62Å; K176-Y214 HydrophobicContact CB-CE1 4.01Å; K176-Y214 HydrophobicContact CB-CE2 3.46Å; K176-Y214 VanDerWaalsContact CB-CE2 3.46Å; K176-Y214 HydrophobicContact CB-CG 3.95Å
177	A	82.7	Confident	88.7	Confident	4 Å²	4	37.4 Å²	37.4	3%	0.033	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-63.5	-22.5	-177.7	0	0	0	0	0	114.7	F137 Y214	F137-A177 HydrophobicContact CB-CB 4.06Å; F137-A177 HydrophobicContact CD2-CB 4.07Å; A177-Y214 WeakPolarHBondContact CB-OH 3.42Å; A177-Y214 PolarHBondContact N-OH 3.36Å
178	E	78.5	Confident	88.8	Confident	56 Å²	56	32.4 Å²	32.4	26%	0.262	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-70.6	-35.2	173.2	-60.4	139.4	-121.3	0	0	111.9	I5 K176 L180	I5-E178 WeakPolarHBondContact CD1-OE2 3.32Å; K176-E178 HydrophobicContact CD-CB 4.15Å; K176-E178 WeakPolarHBondContact CD-OE2 3.43Å; K176-E178 VanDerWaalsContact CE-OE2 3.23Å; K176-E178 WeakPolarHBondContact CE-OE2 3.35Å; K176-E178 HydrophobicContact CG-CB 4.15Å; K176-E178 IonicContact NZ-OE2 3.33Å; K176-E178 PolarHBondContact NZ-OE2 3.15Å; K176-E178 PolarHBondContact O-N 3.45Å; E178-L180 PolarHBondContact O-N 3.33Å
179	N	89.8	Confident	88.9	Confident	14 Å²	14	30.3 Å²	30.3	8%	0.075	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-86.7	9.1	-179.3	-69	-0.5	0	0	0	112.3	D174 K176 A191	D174-N179 PolarHBondContact O-ND2 2.96Å; D174-N179 PolarHBondContact OD2-ND2 2.8Å; K176-N179 VanDerWaalsContact CE-ND2 3.27Å; K176-N179 WeakPolarHBondContact CE-ND2 3.46Å; K176-N179 WeakPolarHBondContact CE-OD1 3.42Å; K176-N179 HydrophobicContact CG-CB 3.92Å; K176-N179 PolarHBondContact O-N 2.86Å; N179-A191 PolarHBondContact O-N 2.92Å
180	L	92.4	Very high	89.1	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	108.1	173.4	-62.1	-179.2	0	0	0	108.9	V136 I158 E178 I188 I190 I238	V136-L180 HydrophobicContact CB-CB 4.05Å; V136-L180 WeakPolarHBondContact CB-O 3.46Å; V136-L180 HydrophobicContact CG2-CB 3.78Å; V136-L180 VanDerWaalsContact CG2-O 3.32Å; V136-L180 WeakPolarHBondContact CG2-O 3.49Å; V136-L180 PolarHBondContact N-O 3.49Å; I158-L180 HydrophobicContact CD1-CD1 3.66Å; I158-L180 HydrophobicContact CG1-CD1 4.27Å; I158-L180 HydrophobicContact CG1-CD2 4.25Å; I158-L180 HydrophobicContact CG2-CD2 4.46Å; E178-L180 PolarHBondContact O-N 3.33Å; L180-I188 HydrophobicContact CD2-CG2 4.46Å; L180-I190 HydrophobicContact CD2-CD1 4.24Å; L180-I190 HydrophobicContact CD2-CG1 3.76Å; L180-I238 HydrophobicContact CD1-CD1 4.24Å; L180-I238 HydrophobicContact CD1-CG2 3.77Å
181	L	93.2	Very high	89	Confident	41 Å²	41	27.4 Å²	27.4	22%	0.215	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	166.4	177.4	-50.6	-178.6	0	0	0	111.6	V112 A131 G134 E135 I188 K189 A191	V112-L181 HydrophobicContact CG2-CD1 4.46Å; A131-L181 HydrophobicContact CB-CB 3.5Å; A131-L181 VanDerWaalsContact CB-CB 3.5Å; A131-L181 HydrophobicContact CB-CD1 3.9Å; A131-L181 HydrophobicContact CB-CG 4.35Å; G134-L181 CarbonylContact O-C 3.52Å; G134-L181 VanDerWaalsContact O-CA 3.29Å; G134-L181 WeakPolarHBondContact O-CA 3.35Å; E135-L181 HydrophobicContact CB-CD2 4.47Å; E135-L181 HydrophobicContact CG-CD2 3.7Å; L181-I188 CarbonylContact O-C 3.5Å; L181-I188 WeakPolarHBondContact O-CA 3.5Å; L181-K189 HydrophobicContact CB-CB 4.24Å; L181-K189 WeakPolarHBondContact CB-O 3.45Å; L181-K189 PolarHBondContact N-O 3.09Å; L181-K189 PolarHBondContact O-N 2.88Å; L181-A191 HydrophobicContact CD1-CB 3.85Å; L181-A191 HydrophobicContact CG-CB 4.13Å
182	L	91.7	Very high	88.5	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	119.8	178.8	-66.8	163.3	0	0	0	109.5	A131 S132 G133 G134 V136 Y139 M186 N187 I188	A131-L182 CarbonylContact C-O 3.56Å; A131-L182 VanDerWaalsContact C-O 3.31Å; A131-L182 WeakPolarHBondContact CB-O 3.41Å; S132-L182 PolarHBondContact N-O 3.24Å; G133-L182 VanDerWaalsContact CA-O 3.3Å; G133-L182 WeakPolarHBondContact CA-O 3.25Å; G133-L182 PolarHBondContact N-O 2.98Å; G134-L182 PolarHBondContact O-N 2.85Å; V136-L182 HydrophobicContact CG2-CD1 4.26Å; V136-L182 HydrophobicContact CG2-CD2 3.89Å; V136-L182 HydrophobicContact CG2-CG 3.83Å; Y139-L182 HydrophobicContact CG-CD1 4.44Å; L182-M186 HydrophobicContact CB-SD 4.49Å; L182-M186 HydrophobicContact CD1-CE 3.78Å; L182-M186 HydrophobicContact CD1-SD 4.38Å; L182-M186 HydrophobicContact CD2-CB 4.41Å; L182-M186 WeakPolarHBondContact CD2-O 3.33Å; L182-N187 CarbonylContact C-O 3.52Å; L182-N187 WeakPolarHBondContact CA-O 3.2Å; L182-I188 HydrophobicContact CD2-CD1 4.26Å
183	G	88.8	Confident	88	Confident	5 Å²	5	30.4 Å²	30.4	5%	0.052	16%	0.16	C	C	.	.			trans	-77.6	-173.1	172.5	0	0	0	0	0	113	D185 M186 N187	G183-D185 VanDerWaalsContact C-N 3.32Å; G183-D185 PolarHBondContact O-N 2.92Å; G183-M186 WeakPolarHBondContact O-CA 3.48Å; G183-M186 PolarHBondContact O-N 3.49Å; G183-N187 PolarHBondContact N-O 2.87Å
184	N	74.9	Confident	86.9	Confident	128 Å²	128	30.5 Å²	30.5	68%	0.684	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-38.9	-170.1	-64.9	-2.7	0	0	0	114.1	S132 M186	S132-N184 WeakPolarHBondContact CB-OD1 3.47Å; S132-N184 PolarHBondContact OG-OD1 3.45Å; N184-M186 VanDerWaalsContact C-N 3.3Å; N184-M186 PolarHBondContact O-N 3.22Å
185	D	85.6	Confident	85.9	Confident	123 Å²	123	34.5 Å²	34.5	66%	0.658	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.3	26.9	177.6	-29.9	-79.5	0	0	0	112.6	G183 N187	G183-D185 VanDerWaalsContact C-N 3.32Å; G183-D185 PolarHBondContact O-N 2.92Å; D185-N187 PolarHBondContact O-N 3.11Å; D185-N187 VanDerWaalsContact O-N 3.13Å; D185-N187 PolarHBondContact OD2-ND2 2.64Å
186	M	88	Confident	84.8	Confident	70 Å²	70	34.4 Å²	34.4	35%	0.345	18%	0.183	S	C	.	.	S	Bend	trans	58.2	18.7	-169.1	-57.3	-72.2	-75.4	0	0	113.4	Y139 K154 L182 G183 N184	Y139-M186 HydrophobicContact CD2-CE 3.42Å; Y139-M186 VanDerWaalsContact CD2-CE 3.42Å; Y139-M186 HydrophobicContact CE2-CE 3.44Å; Y139-M186 VanDerWaalsContact CE2-CE 3.44Å; Y139-M186 HydrophobicContact CG-CE 4.33Å; K154-M186 WeakPolarHBondContact CE-O 3.27Å; K154-M186 PolarHBondContact NZ-O 3.34Å; L182-M186 HydrophobicContact CB-SD 4.49Å; L182-M186 HydrophobicContact CD1-CE 3.78Å; L182-M186 HydrophobicContact CD1-SD 4.38Å; L182-M186 HydrophobicContact CD2-CB 4.41Å; L182-M186 WeakPolarHBondContact CD2-O 3.33Å; G183-M186 WeakPolarHBondContact O-CA 3.48Å; G183-M186 PolarHBondContact O-N 3.49Å; N184-M186 VanDerWaalsContact C-N 3.3Å; N184-M186 PolarHBondContact O-N 3.22Å
187	N	93.8	Very high	84.1	Confident	54 Å²	54	35.1 Å²	35.1	29%	0.289	19%	0.187	S	C	.	.			trans	-71.1	141.6	178.5	-78.4	-38.2	0	0	0	111	Q157 L182 G183 D185	Q157-N187 PolarHBondContact NE2-OD1 3.4Å; L182-N187 CarbonylContact C-O 3.52Å; L182-N187 WeakPolarHBondContact CA-O 3.2Å; G183-N187 PolarHBondContact N-O 2.87Å; D185-N187 PolarHBondContact O-N 3.11Å; D185-N187 VanDerWaalsContact O-N 3.13Å; D185-N187 PolarHBondContact OD2-ND2 2.64Å
188	I	96.1	Very high	83.5	Confident	1 Å²	1	38 Å²	38	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	141.7	-178.8	-68.7	-68.4	0	0	0	111.1	N110 V136 K154 Q157 I158 L180 L181 L182 I190	N110-I188 WeakPolarHBondContact CA-O 3.41Å; N110-I188 HydrophobicContact CB-CG2 4.43Å; N110-I188 VanDerWaalsContact CB-O 3.23Å; N110-I188 WeakPolarHBondContact CB-O 3.47Å; N110-I188 PolarHBondContact ND2-O 2.88Å; V136-I188 HydrophobicContact CG2-CD1 3.56Å; K154-I188 HydrophobicContact CB-CD1 4.11Å; K154-I188 HydrophobicContact CB-CG1 3.88Å; K154-I188 HydrophobicContact CD-CG1 4.21Å; Q157-I188 HydrophobicContact CB-CB 3.99Å; Q157-I188 HydrophobicContact CB-CG1 4.26Å; I158-I188 HydrophobicContact CD1-CD1 4.27Å; I158-I188 HydrophobicContact CD1-CG1 4.43Å; I158-I188 HydrophobicContact CG1-CB 4.42Å; I158-I188 HydrophobicContact CG1-CD1 4.28Å; I158-I188 HydrophobicContact CG1-CG1 4.03Å; I158-I188 HydrophobicContact CG1-CG2 3.75Å; L180-I188 HydrophobicContact CD2-CG2 4.46Å; L181-I188 CarbonylContact O-C 3.5Å; L181-I188 WeakPolarHBondContact O-CA 3.5Å; L182-I188 HydrophobicContact CD2-CD1 4.26Å; I188-I190 HydrophobicContact CG2-CG1 4.24Å
189	K	95.4	Very high	83.2	Confident	23 Å²	23	36.6 Å²	36.6	10%	0.1	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	107.1	169.4	-67.9	-67.6	-175.6	166.4	0	109.5	P109 N110 V112 E129 A131 L181	P109-K189 VanDerWaalsContact O-CE 3.24Å; P109-K189 WeakPolarHBondContact O-CE 3.22Å; P109-K189 PolarHBondContact O-NZ 2.96Å; N110-K189 WeakPolarHBondContact O-CA 3.3Å; V112-K189 HydrophobicContact CG2-CB 3.93Å; E129-K189 VanDerWaalsContact CD-CE 3.46Å; E129-K189 WeakPolarHBondContact OE1-CE 3.44Å; E129-K189 IonicContact OE1-NZ 2.86Å; E129-K189 PolarHBondContact OE1-NZ 3.35Å; E129-K189 VanDerWaalsContact OE2-CE 3.31Å; E129-K189 WeakPolarHBondContact OE2-CE 3.37Å; E129-K189 IonicContact OE2-NZ 2.64Å; E129-K189 PolarHBondContact OE2-NZ 2.88Å; A131-K189 HydrophobicContact CB-CB 4.29Å; A131-K189 HydrophobicContact CB-CG 4.41Å; L181-K189 HydrophobicContact CB-CB 4.24Å; L181-K189 WeakPolarHBondContact CB-O 3.45Å; L181-K189 PolarHBondContact N-O 3.09Å; L181-K189 PolarHBondContact O-N 2.88Å
190	I	95.6	Very high	81.5	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	135.2	174.2	-54	-168.4	0	0	0	109.5	N110 V112 I158 A161 V162 L175 L180 I188	N110-I190 PolarHBondContact O-N 2.89Å; V112-I190 WeakPolarHBondContact CG2-O 3.38Å; V112-I190 PolarHBondContact N-O 2.86Å; I158-I190 HydrophobicContact CG2-CD1 4.32Å; A161-I190 HydrophobicContact CB-CD1 3.57Å; A161-I190 HydrophobicContact CB-CG1 4.16Å; V162-I190 HydrophobicContact CG2-CD1 3.71Å; L175-I190 HydrophobicContact CD2-CG2 4.37Å; L180-I190 HydrophobicContact CD2-CD1 4.24Å; L180-I190 HydrophobicContact CD2-CG1 3.76Å; I188-I190 HydrophobicContact CG2-CG1 4.24Å
191	A	91.2	Very high	80.4	Confident	16 Å²	16	46.9 Å²	46.9	13%	0.132	25%	0.252	C	S	.	.			trans	-134.2	166.1	-175	0	0	0	0	0	113.1	V112 H172 N179 L181	V112-A191 HydrophobicContact CG2-CB 3.88Å; H172-A191 PolarHBondContact NE2-O 3.36Å; N179-A191 PolarHBondContact O-N 2.92Å; L181-A191 HydrophobicContact CD1-CB 3.85Å; L181-A191 HydrophobicContact CG-CB 4.13Å
192	D	81.2	Confident	79	Confident	62 Å²	62	47.9 Å²	47.9	33%	0.332	27%	0.271	S	S	.	.			trans	64.9	75.9	174	-153.6	39	0	0	0	116.8	K81 G194	K81-D192 IonicContact NZ-OD1 3.79Å; K81-D192 PolarHBondContact NZ-OD1 3.49Å; D192-G194 PolarHBondContact O-N 2.88Å
193	F	79.6	Confident	77.9	Confident	3 Å²	3	53.1 Å²	53.1	1%	0.013	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-78.1	11.3	178.9	-66.8	-86.3	0	0	0	114.5	E99 I102 M103 L106 I111 L165 H172 F195 S196	E99-F193 HydrophobicContact CG-CB 4.03Å; I102-F193 HydrophobicContact CG2-CB 4.26Å; I102-F193 HydrophobicContact CG2-CD1 4.03Å; I102-F193 HydrophobicContact CG2-CG 4.23Å; M103-F193 HydrophobicContact CG-CB 4.44Å; M103-F193 HydrophobicContact CG-CD2 4.03Å; M103-F193 HydrophobicContact CG-CG 4.49Å; L106-F193 HydrophobicContact CD1-CD1 3.99Å; L106-F193 HydrophobicContact CD1-CD2 4.39Å; L106-F193 HydrophobicContact CD1-CE1 3.55Å; L106-F193 HydrophobicContact CD1-CE2 4Å; L106-F193 HydrophobicContact CD1-CG 4.41Å; L106-F193 HydrophobicContact CD1-CZ 3.57Å; I111-F193 HydrophobicContact CD1-CZ 4.4Å; I111-F193 HydrophobicContact CG2-CE2 3.72Å; I111-F193 HydrophobicContact CG2-CZ 3.59Å; L165-F193 HydrophobicContact CD1-CE1 3.88Å; L165-F193 HydrophobicContact CD2-CE1 3.71Å; L165-F193 HydrophobicContact CD2-CZ 4.37Å; L165-F193 HydrophobicContact CG-CE1 4.46Å; H172-F193 AromaticContact CD2-CD1 3.86Å; H172-F193 AromaticContact CD2-CE1 3.64Å; F193-F195 PolarHBondContact O-N 3.19Å; F193-F195 VanDerWaalsContact O-N 3.16Å; F193-S196 WeakPolarHBondContact CA-OG 3.43Å; F193-S196 WeakPolarHBondContact CD1-OG 3.45Å; F193-S196 VanDerWaalsContact O-CB 3.22Å; F193-S196 WeakPolarHBondContact O-CB 3.3Å; F193-S196 PolarHBondContact O-N 3.45Å; F193-S196 PolarHBondContact O-OG 2.8Å
194	G	63.6	Low	77	Confident	18 Å²	18	57.8 Å²	57.8	19%	0.186	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-62.6	-23.4	-173.7	0	0	0	0	0	115.3	E99 D192	E99-G194 WeakPolarHBondContact OE2-CA 3.47Å; D192-G194 PolarHBondContact O-N 2.88Å
195	F	63.9	Low	76.7	Confident	88 Å²	88	52.8 Å²	52.8	39%	0.386	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-94.7	-10.2	172.3	-69.1	-73.4	0	0	0	114	R173 D174 F193 C209	R173-F195 PolarHBondContact NE-O 3.35Å; R173-F195 PolarHBondContact NH2-O 3.28Å; D174-F195 HydrophobicContact CB-CB 4.12Å; D174-F195 HydrophobicContact CB-CD2 3.71Å; D174-F195 HydrophobicContact CB-CG 4.16Å; F193-F195 PolarHBondContact O-N 3.19Å; F193-F195 VanDerWaalsContact O-N 3.16Å; F195-C209 HydrophobicContact CD1-CB 4.13Å
196	S	68.1	Low	75.7	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.283	C	S	.	.			trans	-67.5	156	-173.9	-52.2	0	0	0	0	112.2	R98 I171 H172 F193	R98-S196 VanDerWaalsContact CZ-O 3.26Å; R98-S196 PolarHBondContact NE-O 2.96Å; R98-S196 PolarHBondContact NH2-O 2.81Å; I171-S196 WeakPolarHBondContact O-CA 3.41Å; I171-S196 VanDerWaalsContact O-CB 3.26Å; I171-S196 WeakPolarHBondContact O-CB 3.47Å; H172-S196 WeakPolarHBondContact CA-OG 3.14Å; H172-S196 WeakPolarHBondContact O-CA 3.5Å; H172-S196 PolarHBondContact O-N 2.95Å; H172-S196 PolarHBondContact O-OG 3.11Å; F193-S196 WeakPolarHBondContact CA-OG 3.43Å; F193-S196 WeakPolarHBondContact CD1-OG 3.45Å; F193-S196 VanDerWaalsContact O-CB 3.22Å; F193-S196 WeakPolarHBondContact O-CB 3.3Å; F193-S196 PolarHBondContact O-N 3.45Å; F193-S196 PolarHBondContact O-OG 2.8Å
197	N	72.5	Confident	74.4	Confident	29 Å²	29	51.1 Å²	51.1	16%	0.155	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	151.5	178.4	-158.9	35.9	0	0	0	110.6	R98 I170 I171 L205	R98-N197 VanDerWaalsContact CD-OD1 3.22Å; R98-N197 WeakPolarHBondContact CD-OD1 3.26Å; R98-N197 PolarHBondContact NE-OD1 3.03Å; R98-N197 VanDerWaalsContact NE-OD1 3.14Å; R98-N197 PolarHBondContact NH1-OD1 3.18Å; I170-N197 WeakPolarHBondContact CA-O 3.31Å; I171-N197 PolarHBondContact N-O 2.89Å; I171-N197 PolarHBondContact O-N 3.17Å; I171-N197 VanDerWaalsContact O-N 3.1Å; N197-L205 WeakPolarHBondContact ND2-CD2 3.49Å
198	E	69.7	Low	73.1	Confident	64 Å²	64	53.2 Å²	53.2	30%	0.299	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	148.6	161.6	-68.7	166.8	-144.6	0	0	109	R101 N169 I170	R101-E198 IonicContact CZ-OE1 3.75Å; R101-E198 VanDerWaalsContact CZ-OE1 3.3Å; R101-E198 IonicContact CZ-OE2 2.63Å; R101-E198 IonicContact NE-OE1 3.94Å; R101-E198 PolarHBondContact NE-OE1 3.36Å; R101-E198 IonicContact NE-OE2 3.03Å; R101-E198 VanDerWaalsContact NH2-CD 3.29Å; R101-E198 IonicContact NH2-OE1 2.75Å; R101-E198 PolarHBondContact NH2-OE1 2.94Å; R101-E198 IonicContact NH2-OE2 3.3Å; R101-E198 PolarHBondContact NH2-OE2 3.34Å; N169-E198 CarbonylContact O-C 3.58Å; N169-E198 VanDerWaalsContact O-CA 3.28Å; N169-E198 WeakPolarHBondContact O-CA 3.18Å; I170-E198 HydrophobicContact CG1-CG 4.41Å
199	F	72.7	Confident	71.5	Confident	27 Å²	27	54.2 Å²	54.2	12%	0.118	30%	0.3	C	S	.	.			trans	-123.3	168.3	170.6	67.7	-85.4	0	0	0	111.8	N169 I171 P228	N169-F199 HydrophobicContact CB-CD1 4.23Å; N169-F199 HydrophobicContact CB-CE1 4.18Å; N169-F199 HydrophobicContact CB-CG 4.49Å; N169-F199 HydrophobicContact CB-CZ 4.31Å; N169-F199 WeakPolarHBondContact O-CD1 3.46Å; N169-F199 PolarHBondContact O-N 2.87Å; I171-F199 HydrophobicContact CD1-CB 3.56Å; I171-F199 HydrophobicContact CD1-CD1 3.35Å; I171-F199 HydrophobicContact CD1-CE1 4.15Å; I171-F199 HydrophobicContact CD1-CG 3.67Å; I171-F199 HydrophobicContact CG1-CD1 3.4Å; I171-F199 HydrophobicContact CG1-CE1 3.73Å; I171-F199 HydrophobicContact CG1-CG 4.19Å; F199-P228 HydrophobicContact CE1-CG 3.99Å; F199-P228 HydrophobicContact CE2-CG 3.94Å; F199-P228 HydrophobicContact CZ-CG 3.55Å
200	S	54.2	Low	70	Confident	66 Å²	66	54 Å²	54	46%	0.462	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-143.4	135.5	174	-49.7	0	0	0	0	108.3	G202 N203	S200-G202 PolarHBondContact O-N 2.81Å; S200-G202 VanDerWaalsContact O-N 3.15Å; S200-N203 PolarHBondContact O-N 2.88Å
201	I	69	Low	69.1	Low	165 Å²	165	54.9 Å²	54.9	85%	0.846	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	121.4	-178.5	-58.8	173.6	0	0	0	108.8
202	G	62.7	Low	68.9	Low	61 Å²	61	55.8 Å²	55.8	63%	0.629	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	101	-26.5	-174.3	0	0	0	0	0	115.2	S200 K204	S200-G202 PolarHBondContact O-N 2.81Å; S200-G202 VanDerWaalsContact O-N 3.15Å; G202-K204 PolarHBondContact O-N 2.89Å
203	N	69.7	Low	69.3	Low	113 Å²	113	53.4 Å²	53.4	60%	0.604	30%	0.303	S	S	*	.	B	Isolated β-bridge	trans	-91.8	93.8	179.3	-73.3	-21.8	0	0	0	111	S200	S200-N203 PolarHBondContact O-N 2.88Å
204	K	70	Confident	69.9	Low	103 Å²	103	53.8 Å²	53.8	45%	0.448	30%	0.304	S	S	.	.			trans	-73.1	137.8	179.9	-57.7	-169	-173.1	-62.6	0	112.7	G202 K224 Y225 D226	G202-K204 PolarHBondContact O-N 2.89Å; K204-K224 HydrophobicContact CB-CB 3.75Å; K204-K224 HydrophobicContact CD-CB 4.03Å; K204-Y225 CarbonylContact C-O 3.59Å; K204-Y225 WeakPolarHBondContact CA-O 3.48Å; K204-D226 IonicContact NZ-OD1 2.8Å; K204-D226 PolarHBondContact NZ-OD1 3.33Å; K204-D226 IonicContact NZ-OD2 3.74Å; K204-D226 PolarHBondContact NZ-OD2 3.15Å
205	L	69	Low	71.3	Confident	22 Å²	22	53.1 Å²	53.1	12%	0.115	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-82.4	148.5	171.2	-57.5	177.4	0	0	0	110.5	I171 N197 K224 Y225	I171-L205 HydrophobicContact CD1-CD1 3.75Å; N197-L205 WeakPolarHBondContact ND2-CD2 3.49Å; L205-K224 CarbonylContact O-C 3.57Å; L205-K224 WeakPolarHBondContact O-CA 3Å; L205-Y225 HydrophobicContact CB-CD1 4.42Å; L205-Y225 HydrophobicContact CB-CD2 4.13Å; L205-Y225 HydrophobicContact CB-CE1 3.99Å; L205-Y225 HydrophobicContact CB-CE2 3.66Å; L205-Y225 HydrophobicContact CB-CG 4.48Å; L205-Y225 HydrophobicContact CD1-CE2 3.84Å; L205-Y225 HydrophobicContact CG-CE2 4.34Å; L205-Y225 PolarHBondContact N-O 3.3Å; L205-Y225 VanDerWaalsContact O-CD1 3.22Å; L205-Y225 WeakPolarHBondContact O-CD1 3.38Å; L205-Y225 PolarHBondContact O-N 3.19Å
206	D	63.2	Low	72.7	Confident	91 Å²	91	48.9 Å²	48.9	49%	0.487	28%	0.278	S	S	.	.			trans	-121.9	-15	179.4	45.8	27	0	0	0	114	F208 K224	D206-F208 PolarHBondContact O-N 3.25Å; D206-K224 HydrophobicContact CB-CD 4.05Å; D206-K224 HydrophobicContact CB-CG 4.04Å; D206-K224 IonicContact OD2-NZ 2.73Å; D206-K224 PolarHBondContact OD2-NZ 2.91Å
207	T	62.1	Low	73.9	Confident	67 Å²	67	48.9 Å²	48.9	41%	0.411	28%	0.278	S	S	.	.			trans	-70.5	123.7	-173	-26.2	0	0	0	0	111.9	C209 Y225	T207-C209 PolarHBondContact O-N 3Å; T207-Y225 PolarHBondContact O-OH 3.42Å
208	F	65.2	Low	74.8	Confident	98 Å²	98	47.8 Å²	47.8	43%	0.43	27%	0.272	S	S	.	.			trans	-68.8	116.4	162.3	-168.5	-75.7	0	0	0	108.7	D206 A215 L219 F220	D206-F208 PolarHBondContact O-N 3.25Å; F208-A215 HydrophobicContact CZ-CB 4.38Å; F208-L219 HydrophobicContact CD2-CB 3.7Å; F208-L219 WeakPolarHBondContact CD2-O 3.18Å; F208-L219 HydrophobicContact CE2-CB 3.7Å; F208-F220 HydrophobicContact CE2-CD1 4.43Å
209	C	63.2	Low	75.7	Confident	23 Å²	23	45.3 Å²	45.3	16%	0.155	26%	0.261	C	S	.	.			trans	-144.8	159.9	176.9	-79.6	0	0	0	0	108.8	F195 T207	F195-C209 HydrophobicContact CD1-CB 4.13Å; T207-C209 PolarHBondContact O-N 3Å
210	G	63	Low	76.3	Confident	17 Å²	17	44.6 Å²	44.6	18%	0.175	26%	0.258	C	S	.	.	S	Bend	trans	92.6	166.5	-179.5	0	0	0	0	0	114.6	R173 D174	R173-G210 WeakPolarHBondContact O-CA 3.5Å; D174-G210 VanDerWaalsContact OD1-CA 3.3Å; D174-G210 WeakPolarHBondContact OD1-CA 3.26Å
211	S	77.8	Confident	77.9	Confident	20 Å²	20	45.4 Å²	45.4	14%	0.14	25%	0.254	C	S	.	.			trans	-80.6	122.8	-169.8	-58.6	0	0	0	0	111.7	D174 K176 P213 Y214 A215	D174-S211 WeakPolarHBondContact OD1-CB 3.49Å; D174-S211 PolarHBondContact OD1-N 3.49Å; D174-S211 PolarHBondContact OD1-OG 3.1Å; K176-S211 VanDerWaalsContact CD-OG 3.3Å; K176-S211 WeakPolarHBondContact CD-OG 3.21Å; K176-S211 PolarHBondContact NZ-OG 3.17Å; S211-P213 VanDerWaalsContact C-CD 3.43Å; S211-P213 WeakPolarHBondContact O-CD 3.14Å; S211-Y214 PolarHBondContact O-N 2.77Å; S211-A215 PolarHBondContact O-N 2.71Å
212	P	86.2	Confident	78.4	Confident	35 Å²	35	40.7 Å²	40.7	23%	0.227	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-34.3	-165	-31.5	35.5	0	0	0	118.7	Y214 A215 F220 L254 L257	P212-Y214 PolarHBondContact O-N 3.31Å; P212-A215 PolarHBondContact O-N 2.92Å; P212-F220 HydrophobicContact CB-CZ 4.23Å; P212-F220 WeakPolarHBondContact O-CZ 3.24Å; P212-L254 HydrophobicContact CB-CD1 3.75Å; P212-L254 HydrophobicContact CG-CD1 4.08Å; P212-L257 HydrophobicContact CB-CD2 3.78Å
213	P	89.9	Confident	79.2	Confident	12 Å²	12	43.5 Å²	43.5	8%	0.078	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-21.7	177	-22.8	35.4	0	0	0	114.7	S211 L247 L257 W912	S211-P213 VanDerWaalsContact C-CD 3.43Å; S211-P213 WeakPolarHBondContact O-CD 3.14Å; P213-L247 HydrophobicContact CB-CD1 3.86Å; P213-L247 HydrophobicContact CB-CD2 4.04Å; P213-L247 HydrophobicContact CG-CD1 4.3Å; P213-L257 HydrophobicContact CG-CD2 4.19Å; P213-W912 HydrophobicContact CG-CH2 3.59Å; P213-W912 HydrophobicContact CG-CZ2 3.68Å; P213-W912 HydrophobicContact CG-CZ3 4.34Å
214	Y	92.9	Very high	79.7	Confident	11 Å²	11	44.2 Å²	44.2	4%	0.043	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-10.2	179	-56.5	-93	0	0	0	112.5	L175 K176 A177 S211 P212 S234 V237 I238 L247	L175-Y214 WeakPolarHBondContact O-CB 3.49Å; K176-Y214 HydrophobicContact CB-CD1 4.14Å; K176-Y214 HydrophobicContact CB-CD2 3.62Å; K176-Y214 HydrophobicContact CB-CE1 4.01Å; K176-Y214 HydrophobicContact CB-CE2 3.46Å; K176-Y214 VanDerWaalsContact CB-CE2 3.46Å; K176-Y214 HydrophobicContact CB-CG 3.95Å; A177-Y214 WeakPolarHBondContact CB-OH 3.42Å; A177-Y214 PolarHBondContact N-OH 3.36Å; S211-Y214 PolarHBondContact O-N 2.77Å; P212-Y214 PolarHBondContact O-N 3.31Å; Y214-S234 PolarHBondContact O-OG 2.98Å; Y214-V237 HydrophobicContact CD1-CB 3.96Å; Y214-V237 HydrophobicContact CD1-CG1 3.41Å; Y214-V237 VanDerWaalsContact CD1-CG1 3.41Å; Y214-V237 HydrophobicContact CE1-CG1 3.8Å; Y214-V237 HydrophobicContact CG-CG1 4.09Å; Y214-I238 HydrophobicContact CD1-CG1 4.08Å; Y214-I238 HydrophobicContact CE1-CG1 3.95Å; Y214-L247 HydrophobicContact CE1-CD2 4.35Å; Y214-L247 HydrophobicContact CE2-CD2 4.48Å
215	A	92.1	Very high	80.1	Confident	3 Å²	3	39.8 Å²	39.8	3%	0.025	22%	0.22	C	C	.	.			trans	-68.9	139	-176.6	0	0	0	0	0	112.3	F208 S211 P212 L219 F220 W233	F208-A215 HydrophobicContact CZ-CB 4.38Å; S211-A215 PolarHBondContact O-N 2.71Å; P212-A215 PolarHBondContact O-N 2.92Å; A215-L219 HydrophobicContact CB-CD1 3.97Å; A215-F220 HydrophobicContact CB-CD2 4.46Å; A215-F220 HydrophobicContact CB-CE2 3.76Å; A215-F220 HydrophobicContact CB-CZ 4.27Å; A215-W233 PolarHBondContact O-NE1 3.42Å; A215-W233 VanDerWaalsContact O-NE1 3.11Å
216	A	93.3	Very high	80.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.			trans	-73.8	150	-179.8	0	0	0	0	0	112.5	E218 L219 V230 W233	A216-E218 VanDerWaalsContact CB-CD 3.44Å; A216-E218 HydrophobicContact CB-CG 4.4Å; A216-E218 WeakPolarHBondContact CB-OE1 3.43Å; A216-E218 WeakPolarHBondContact CB-OE2 3.5Å; A216-E218 PolarHBondContact O-N 2.85Å; A216-E218 VanDerWaalsContact O-N 3.15Å; A216-L219 WeakPolarHBondContact O-CB 3.45Å; A216-L219 PolarHBondContact O-N 2.86Å; A216-V230 HydrophobicContact CB-CB 4.36Å; A216-V230 HydrophobicContact CB-CG1 4.07Å; A216-V230 HydrophobicContact CB-CG2 4.26Å; A216-W233 VanDerWaalsContact CA-CD1 3.47Å; A216-W233 HydrophobicContact CB-CB 3.87Å; A216-W233 HydrophobicContact CB-CD2 4.48Å; A216-W233 HydrophobicContact CB-CG 3.82Å
217	P	93.7	Very high	81.3	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.2	-173.3	24.2	-35.5	0	0	0	114.3	F220 Q221 W233 V261 L262 L286	P217-F220 PolarHBondContact O-N 2.82Å; P217-Q221 VanDerWaalsContact O-CG 3.29Å; P217-Q221 WeakPolarHBondContact O-CG 3.45Å; P217-Q221 PolarHBondContact O-N 2.82Å; P217-Q221 PolarHBondContact O-NE2 3.37Å; P217-W233 HydrophobicContact CG-CE3 4.22Å; P217-W233 HydrophobicContact CG-CH2 4.09Å; P217-W233 HydrophobicContact CG-CZ2 4.44Å; P217-W233 HydrophobicContact CG-CZ3 3.96Å; P217-V261 HydrophobicContact CB-CG1 4.07Å; P217-L262 HydrophobicContact CB-CD2 4.05Å; P217-L262 WeakPolarHBondContact O-CD2 3.28Å; P217-L286 HydrophobicContact CB-CD2 4.07Å; P217-L286 HydrophobicContact CG-CD2 3.95Å
218	E	91.7	Very high	82.7	Confident	6 Å²	6	35.2 Å²	35.2	3%	0.028	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-31.6	174.7	61.9	-87.1	-151.1	0	0	113.3	A216 F220 Q221 G222 K223 P288 R291	A216-E218 VanDerWaalsContact CB-CD 3.44Å; A216-E218 HydrophobicContact CB-CG 4.4Å; A216-E218 WeakPolarHBondContact CB-OE1 3.43Å; A216-E218 WeakPolarHBondContact CB-OE2 3.5Å; A216-E218 PolarHBondContact O-N 2.85Å; A216-E218 VanDerWaalsContact O-N 3.15Å; E218-F220 VanDerWaalsContact C-N 3.34Å; E218-Q221 CarbonylContact O-C 3.52Å; E218-Q221 WeakPolarHBondContact O-CA 3.25Å; E218-Q221 WeakPolarHBondContact O-CB 3.43Å; E218-Q221 PolarHBondContact O-N 2.62Å; E218-G222 PolarHBondContact O-N 3.08Å; E218-G222 VanDerWaalsContact O-N 3.17Å; E218-K223 HydrophobicContact CB-CB 4.33Å; E218-K223 PolarHBondContact O-N 3.04Å; E218-K223 VanDerWaalsContact O-N 3.15Å; E218-P288 HydrophobicContact CB-CG 4.24Å; E218-P288 HydrophobicContact CG-CG 4.12Å; E218-R291 IonicContact OE1-CZ 3.8Å; E218-R291 IonicContact OE1-NH1 2.73Å; E218-R291 PolarHBondContact OE1-NH1 3.11Å; E218-R291 IonicContact OE1-NH2 3.14Å; E218-R291 PolarHBondContact OE1-NH2 3.22Å; E218-R291 IonicContact OE2-CZ 2.89Å; E218-R291 IonicContact OE2-NH1 2.92Å; E218-R291 PolarHBondContact OE2-NH1 2.83Å; E218-R291 IonicContact OE2-NH2 3.89Å; E218-R291 PolarHBondContact OE2-NH2 3.46Å
219	L	87.7	Confident	84	Confident	12 Å²	12	32.8 Å²	32.8	6%	0.063	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-64.2	-44.1	172.8	-59.7	178.6	0	0	0	109.5	F208 A215 A216 Q221 G222 Y225 V230	F208-L219 HydrophobicContact CD2-CB 3.7Å; F208-L219 WeakPolarHBondContact CD2-O 3.18Å; F208-L219 HydrophobicContact CE2-CB 3.7Å; A215-L219 HydrophobicContact CB-CD1 3.97Å; A216-L219 WeakPolarHBondContact O-CB 3.45Å; A216-L219 PolarHBondContact O-N 2.86Å; L219-Q221 PolarHBondContact O-N 2.99Å; L219-Q221 VanDerWaalsContact O-N 3.11Å; L219-G222 PolarHBondContact O-N 2.83Å; L219-G222 VanDerWaalsContact O-N 3.08Å; L219-Y225 HydrophobicContact CD2-CD1 3.71Å; L219-Y225 HydrophobicContact CD2-CE1 3.4Å; L219-Y225 VanDerWaalsContact CD2-CE1 3.4Å; L219-Y225 HydrophobicContact CD2-CG 4.41Å; L219-V230 HydrophobicContact CD1-CG1 3.85Å; L219-V230 HydrophobicContact CG-CG1 4.49Å
220	F	86.6	Confident	85.4	Confident	11 Å²	11	31.8 Å²	31.8	5%	0.048	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-66.5	-4.6	171.5	-71.4	-74.8	0	0	0	114.6	F208 P212 A215 P217 E218 L254 R258 V261 L262	F208-F220 HydrophobicContact CE2-CD1 4.43Å; P212-F220 HydrophobicContact CB-CZ 4.23Å; P212-F220 WeakPolarHBondContact O-CZ 3.24Å; A215-F220 HydrophobicContact CB-CD2 4.46Å; A215-F220 HydrophobicContact CB-CE2 3.76Å; A215-F220 HydrophobicContact CB-CZ 4.27Å; P217-F220 PolarHBondContact O-N 2.82Å; E218-F220 VanDerWaalsContact C-N 3.34Å; F220-L254 HydrophobicContact CE1-CD1 3.98Å; F220-R258 HydrophobicContact CB-CG 4.08Å; F220-R258 HydrophobicContact CD1-CB 3.77Å; F220-R258 HydrophobicContact CD1-CG 3.69Å; F220-R258 HydrophobicContact CE1-CB 4.01Å; F220-R258 HydrophobicContact CE1-CG 4.44Å; F220-R258 HydrophobicContact CG-CB 4.48Å; F220-R258 HydrophobicContact CG-CG 4.13Å; F220-R258 VanDerWaalsContact O-CZ 3.31Å; F220-R258 PolarHBondContact O-NE 3.25Å; F220-R258 PolarHBondContact O-NH2 2.81Å; F220-V261 HydrophobicContact CD2-CB 4.33Å; F220-V261 HydrophobicContact CD2-CG1 3.71Å; F220-V261 HydrophobicContact CE2-CB 4.19Å; F220-V261 HydrophobicContact CE2-CG1 3.83Å; F220-V261 HydrophobicContact CE2-CG2 4.17Å; F220-L262 HydrophobicContact CB-CD2 4.19Å; F220-L262 HydrophobicContact CB-CG 4.45Å
221	Q	86.5	Confident	86.9	Confident	83 Å²	83	31 Å²	31	39%	0.388	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-108.5	-1.2	173.8	-67.3	165.5	39.1	0	0	112.7	P217 E218 L219 K223 L262	P217-Q221 VanDerWaalsContact O-CG 3.29Å; P217-Q221 WeakPolarHBondContact O-CG 3.45Å; P217-Q221 PolarHBondContact O-N 2.82Å; P217-Q221 PolarHBondContact O-NE2 3.37Å; E218-Q221 CarbonylContact O-C 3.52Å; E218-Q221 WeakPolarHBondContact O-CA 3.25Å; E218-Q221 WeakPolarHBondContact O-CB 3.43Å; E218-Q221 PolarHBondContact O-N 2.62Å; L219-Q221 PolarHBondContact O-N 2.99Å; L219-Q221 VanDerWaalsContact O-N 3.11Å; Q221-K223 HydrophobicContact CB-CD 4.06Å; Q221-K223 HydrophobicContact CB-CG 3.98Å; Q221-K223 PolarHBondContact O-N 3.38Å; Q221-K223 VanDerWaalsContact OE1-CE 3.24Å; Q221-L262 HydrophobicContact CG-CD2 3.77Å; Q221-L262 VanDerWaalsContact NE2-CD2 3.27Å
222	G	80.7	Confident	87.8	Confident	66 Å²	66	30.3 Å²	30.3	68%	0.68	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.4	19.9	-175.4	0	0	0	0	0	113.9	E218 L219	E218-G222 PolarHBondContact O-N 3.08Å; E218-G222 VanDerWaalsContact O-N 3.17Å; L219-G222 PolarHBondContact O-N 2.83Å; L219-G222 VanDerWaalsContact O-N 3.08Å
223	K	79.5	Confident	88.3	Confident	120 Å²	120	28.7 Å²	28.7	52%	0.522	15%	0.153	S	C	.	.			trans	-83.3	135.7	-175.9	-74.8	178	178.4	169.1	0	110.8	E218 Q221 Y225	E218-K223 HydrophobicContact CB-CB 4.33Å; E218-K223 PolarHBondContact O-N 3.04Å; E218-K223 VanDerWaalsContact O-N 3.15Å; Q221-K223 HydrophobicContact CB-CD 4.06Å; Q221-K223 HydrophobicContact CB-CG 3.98Å; Q221-K223 PolarHBondContact O-N 3.38Å; Q221-K223 VanDerWaalsContact OE1-CE 3.24Å; K223-Y225 PolarHBondContact O-N 3.46Å
224	K	79.5	Confident	88.6	Confident	128 Å²	128	28.2 Å²	28.2	56%	0.557	15%	0.151	S	C	*	.			trans	-61.5	131.2	170.2	-54.1	-148.1	178	-147.1	0	109.9	K204 L205 D206	K204-K224 HydrophobicContact CB-CB 3.75Å; K204-K224 HydrophobicContact CD-CB 4.03Å; L205-K224 CarbonylContact O-C 3.57Å; L205-K224 WeakPolarHBondContact O-CA 3Å; D206-K224 HydrophobicContact CB-CD 4.05Å; D206-K224 HydrophobicContact CB-CG 4.04Å; D206-K224 IonicContact OD2-NZ 2.73Å; D206-K224 PolarHBondContact OD2-NZ 2.91Å
225	Y	78.1	Confident	88.9	Confident	10 Å²	10	27.7 Å²	27.7	4%	0.039	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-122	147.6	-171.5	58.4	-84.2	0	0	0	110.8	R173 K204 L205 T207 L219 K223 V230	R173-Y225 PolarHBondContact NH1-OH 2.83Å; K204-Y225 CarbonylContact C-O 3.59Å; K204-Y225 WeakPolarHBondContact CA-O 3.48Å; L205-Y225 HydrophobicContact CB-CD1 4.42Å; L205-Y225 HydrophobicContact CB-CD2 4.13Å; L205-Y225 HydrophobicContact CB-CE1 3.99Å; L205-Y225 HydrophobicContact CB-CE2 3.66Å; L205-Y225 HydrophobicContact CB-CG 4.48Å; L205-Y225 HydrophobicContact CD1-CE2 3.84Å; L205-Y225 HydrophobicContact CG-CE2 4.34Å; L205-Y225 PolarHBondContact N-O 3.3Å; L205-Y225 VanDerWaalsContact O-CD1 3.22Å; L205-Y225 WeakPolarHBondContact O-CD1 3.38Å; L205-Y225 PolarHBondContact O-N 3.19Å; T207-Y225 PolarHBondContact O-OH 3.42Å; L219-Y225 HydrophobicContact CD2-CD1 3.71Å; L219-Y225 HydrophobicContact CD2-CE1 3.4Å; L219-Y225 VanDerWaalsContact CD2-CE1 3.4Å; L219-Y225 HydrophobicContact CD2-CG 4.41Å; K223-Y225 PolarHBondContact O-N 3.46Å; Y225-V230 HydrophobicContact CD2-CG2 3.53Å; Y225-V230 HydrophobicContact CE2-CG2 3.99Å; Y225-V230 HydrophobicContact CG-CG2 4.03Å
226	D	75.3	Confident	89.1	Confident	60 Å²	60	27.6 Å²	27.6	32%	0.321	15%	0.147	S	C	.	.			trans	-74.8	-40.9	-177.4	-65.3	-78.8	0	0	0	111.4	K204	K204-D226 IonicContact NZ-OD1 2.8Å; K204-D226 PolarHBondContact NZ-OD1 3.33Å; K204-D226 IonicContact NZ-OD2 3.74Å; K204-D226 PolarHBondContact NZ-OD2 3.15Å
227	G	81.9	Confident	89.3	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	146.6	-68.4	161.4	0	0	0	0	0	114.9	I171 E229 V230	I171-G227 VanDerWaalsContact CD1-CA 3.42Å; G227-E229 PolarHBondContact N-OE2 3.44Å; G227-E229 PolarHBondContact O-N 2.74Å; G227-V230 WeakPolarHBondContact O-CB 3.31Å; G227-V230 PolarHBondContact O-N 3.01Å; G227-V230 VanDerWaalsContact O-N 3.11Å
228	P	91.3	Very high	89.4	Confident	25 Å²	25	27.7 Å²	27.7	16%	0.162	15%	0.148	C	C	.	.	H	α-helix	trans	-52.8	-30.8	-174.6	-31.6	39.3	0	0	0	114.5	H166 F199 V230 D231 V232	H166-P228 PolarHBondContact CE1-O 3.02Å; F199-P228 HydrophobicContact CE1-CG 3.99Å; F199-P228 HydrophobicContact CE2-CG 3.94Å; F199-P228 HydrophobicContact CZ-CG 3.55Å; P228-V230 PolarHBondContact O-N 2.84Å; P228-D231 PolarHBondContact O-N 3.04Å; P228-V232 VanDerWaalsContact O-CG2 3.31Å; P228-V232 WeakPolarHBondContact O-CG2 3.31Å; P228-V232 PolarHBondContact O-N 2.97Å
229	E	93.1	Very high	89.7	Confident	47 Å²	47	27.4 Å²	27.4	22%	0.22	15%	0.147	C	C	.	.	H	α-helix	trans	-63.8	-27.2	-176.7	-51.6	70.7	-148.9	0	0	112.3	G227 W233 P288 R291	G227-E229 PolarHBondContact N-OE2 3.44Å; G227-E229 PolarHBondContact O-N 2.74Å; E229-W233 PolarHBondContact O-N 3.3Å; E229-P288 HydrophobicContact CB-CB 3.87Å; E229-P288 HydrophobicContact CG-CB 4.07Å; E229-R291 PolarHBondContact O-NH1 2.87Å
230	V	92.8	Very high	90.2	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.012	15%	0.146	C	C	.	.	H	α-helix	trans	-71.7	-48	177.9	178.4	0	0	0	0	110.2	A216 L219 Y225 G227 P228 V232 W233 S234	A216-V230 HydrophobicContact CB-CB 4.36Å; A216-V230 HydrophobicContact CB-CG1 4.07Å; A216-V230 HydrophobicContact CB-CG2 4.26Å; L219-V230 HydrophobicContact CD1-CG1 3.85Å; L219-V230 HydrophobicContact CG-CG1 4.49Å; Y225-V230 HydrophobicContact CD2-CG2 3.53Å; Y225-V230 HydrophobicContact CE2-CG2 3.99Å; Y225-V230 HydrophobicContact CG-CG2 4.03Å; G227-V230 WeakPolarHBondContact O-CB 3.31Å; G227-V230 PolarHBondContact O-N 3.01Å; G227-V230 VanDerWaalsContact O-N 3.11Å; P228-V230 PolarHBondContact O-N 2.84Å; V230-V232 VanDerWaalsContact C-N 3.3Å; V230-V232 PolarHBondContact O-N 3.02Å; V230-W233 PolarHBondContact O-N 3.23Å; V230-S234 PolarHBondContact O-N 2.9Å; V230-S234 PolarHBondContact O-OG 3.01Å; V230-S234 VanDerWaalsContact O-OG 3.1Å
231	D	94.6	Very high	90.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.2	-39.9	174	-79.7	-6.1	0	0	0	110.8	V162 H166 I171 H172 R173 L175 P228 W233 S234 L235	V162-D231 HydrophobicContact CG1-CB 4.12Å; H166-D231 IonicContact CD2-OD2 3.68Å; H166-D231 IonicContact CE1-OD2 3.9Å; H166-D231 WeakPolarHBondContact NE2-CB 3.22Å; H166-D231 IonicContact NE2-OD2 3.2Å; H166-D231 PolarHBondContact NE2-OD2 3.45Å; I171-D231 HydrophobicContact CG2-CB 4.48Å; I171-D231 VanDerWaalsContact CG2-CG 3.48Å; I171-D231 VanDerWaalsContact CG2-OD2 3.25Å; I171-D231 WeakPolarHBondContact CG2-OD2 3.46Å; H172-D231 PolarHBondContact N-OD2 3.43Å; R173-D231 PolarHBondContact N-OD1 2.93Å; L175-D231 HydrophobicContact CD1-CB 3.65Å; P228-D231 PolarHBondContact O-N 3.04Å; D231-W233 PolarHBondContact O-N 3.49Å; D231-S234 PolarHBondContact O-N 3.09Å; D231-L235 VanDerWaalsContact O-CG 3.28Å; D231-L235 WeakPolarHBondContact O-CG 3.34Å; D231-L235 PolarHBondContact O-N 2.72Å
232	V	97	Very high	91	Very high	6 Å²	6	23.3 Å²	23.3	4%	0.036	13%	0.128	C	C	.	.	H	α-helix	trans	-57.9	-45.6	174.1	170.7	0	0	0	0	111.3	P228 V230 L235 G236 F283 R291 L294	P228-V232 VanDerWaalsContact O-CG2 3.31Å; P228-V232 WeakPolarHBondContact O-CG2 3.31Å; P228-V232 PolarHBondContact O-N 2.97Å; V230-V232 VanDerWaalsContact C-N 3.3Å; V230-V232 PolarHBondContact O-N 3.02Å; V232-L235 PolarHBondContact O-N 2.9Å; V232-G236 PolarHBondContact O-N 3.37Å; V232-F283 HydrophobicContact CG1-CD1 3.77Å; V232-F283 HydrophobicContact CG1-CE1 4.39Å; V232-F283 WeakPolarHBondContact O-CD1 3.3Å; V232-R291 HydrophobicContact CG1-CB 4.02Å; V232-L294 HydrophobicContact CG2-CD2 3.84Å; V232-L294 HydrophobicContact CG2-CG 3.95Å
233	W	96.9	Very high	91.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62	-46.3	174.5	174	-82.7	0	0	0	111.8	A215 A216 P217 E229 V230 D231 L235 G236 V237 F249 V261 L284 L286	A215-W233 PolarHBondContact O-NE1 3.42Å; A215-W233 VanDerWaalsContact O-NE1 3.11Å; A216-W233 VanDerWaalsContact CA-CD1 3.47Å; A216-W233 HydrophobicContact CB-CB 3.87Å; A216-W233 HydrophobicContact CB-CD2 4.48Å; A216-W233 HydrophobicContact CB-CG 3.82Å; P217-W233 HydrophobicContact CG-CE3 4.22Å; P217-W233 HydrophobicContact CG-CH2 4.09Å; P217-W233 HydrophobicContact CG-CZ2 4.44Å; P217-W233 HydrophobicContact CG-CZ3 3.96Å; E229-W233 PolarHBondContact O-N 3.3Å; V230-W233 PolarHBondContact O-N 3.23Å; D231-W233 PolarHBondContact O-N 3.49Å; W233-L235 VanDerWaalsContact C-N 3.27Å; W233-L235 PolarHBondContact O-N 2.77Å; W233-G236 WeakPolarHBondContact O-CA 3.47Å; W233-G236 PolarHBondContact O-N 3.5Å; W233-V237 PolarHBondContact O-N 3Å; W233-V237 VanDerWaalsContact O-N 3.16Å; W233-F249 AromaticContact CH2-CE2 3.94Å; W233-F249 HydrophobicContact CH2-CE2 3.94Å; W233-F249 HydrophobicContact CH2-CZ 4.04Å; W233-F249 HydrophobicContact CZ2-CD2 4.1Å; W233-F249 AromaticContact CZ2-CE2 3.38Å; W233-F249 HydrophobicContact CZ2-CE2 3.38Å; W233-F249 AromaticContact CZ2-CZ 3.95Å; W233-F249 HydrophobicContact CZ2-CZ 3.95Å; W233-V261 HydrophobicContact CZ2-CG1 3.99Å; W233-L284 HydrophobicContact CD2-CD2 3.97Å; W233-L284 HydrophobicContact CE3-CD2 4.12Å; W233-L284 HydrophobicContact CG-CD2 4.46Å; W233-L284 HydrophobicContact CH2-CD2 4.47Å; W233-L284 HydrophobicContact CZ2-CD2 4.33Å; W233-L284 VanDerWaalsContact CZ3-C 3.49Å; W233-L284 HydrophobicContact CZ3-CB 4.24Å; W233-L284 HydrophobicContact CZ3-CD2 4.37Å; W233-L286 HydrophobicContact CH2-CD2 4.05Å; W233-L286 HydrophobicContact CZ3-CD2 4.27Å
234	S	96.2	Very high	92.5	Very high	3 Å²	3	14.8 Å²	14.8	2%	0.021	7%	0.073	C	C	.	.	H	α-helix	trans	-60.1	-35.8	178.5	-55.7	0	0	0	0	112.5	Y214 V230 D231 G236 V237 I238	Y214-S234 PolarHBondContact O-OG 2.98Å; V230-S234 PolarHBondContact O-N 2.9Å; V230-S234 PolarHBondContact O-OG 3.01Å; V230-S234 VanDerWaalsContact O-OG 3.1Å; D231-S234 PolarHBondContact O-N 3.09Å; S234-G236 PolarHBondContact O-N 3.09Å; S234-V237 WeakPolarHBondContact O-CB 3.44Å; S234-V237 PolarHBondContact O-N 3.24Å; S234-I238 WeakPolarHBondContact O-CG1 3.37Å; S234-I238 PolarHBondContact O-N 3.05Å
235	L	97.7	Very high	93	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-64.1	-36.1	172.7	-73.1	170.4	0	0	0	113	F155 I158 V162 L175 D231 V232 W233 I238 L239 F283 L294	F155-L235 HydrophobicContact CE2-CB 4.37Å; F155-L235 HydrophobicContact CE2-CD2 4.22Å; F155-L235 WeakPolarHBondContact CE2-O 3.14Å; F155-L235 HydrophobicContact CZ-CB 4.15Å; F155-L235 WeakPolarHBondContact CZ-O 3.43Å; I158-L235 HydrophobicContact CG2-CD2 3.31Å; V162-L235 HydrophobicContact CB-CD1 4.12Å; V162-L235 HydrophobicContact CG1-CD1 4.01Å; V162-L235 HydrophobicContact CG2-CD1 4.37Å; V162-L235 HydrophobicContact CG2-CD2 4.27Å; L175-L235 HydrophobicContact CD1-CD2 4.34Å; L175-L235 HydrophobicContact CD1-CG 4.15Å; D231-L235 VanDerWaalsContact O-CG 3.28Å; D231-L235 WeakPolarHBondContact O-CG 3.34Å; D231-L235 PolarHBondContact O-N 2.72Å; V232-L235 PolarHBondContact O-N 2.9Å; W233-L235 VanDerWaalsContact C-N 3.27Å; W233-L235 PolarHBondContact O-N 2.77Å; L235-I238 HydrophobicContact CD2-CD1 4.46Å; L235-I238 PolarHBondContact O-N 2.67Å; L235-L239 WeakPolarHBondContact O-CB 3.3Å; L235-L239 PolarHBondContact O-N 2.71Å; L235-F283 HydrophobicContact CB-CD1 4.26Å; L235-F283 HydrophobicContact CB-CE1 3.83Å; L235-F283 HydrophobicContact CB-CZ 4.34Å; L235-L294 HydrophobicContact CD1-CD1 4.1Å; L235-L294 HydrophobicContact CD1-CD2 3.72Å
236	G	97.8	Very high	93.6	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-62.7	-40.4	170.9	0	0	0	0	0	112.9	V232 W233 S234 Y240 L280	V232-G236 PolarHBondContact O-N 3.37Å; W233-G236 WeakPolarHBondContact O-CA 3.47Å; W233-G236 PolarHBondContact O-N 3.5Å; S234-G236 PolarHBondContact O-N 3.09Å; G236-Y240 WeakPolarHBondContact O-CB 3.41Å; G236-Y240 PolarHBondContact O-N 3.04Å; G236-Y240 VanDerWaalsContact O-N 3.09Å; G236-L280 WeakPolarHBondContact O-CD2 3.28Å
237	V	97.2	Very high	94.4	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-64.3	-42.7	174.6	177	0	0	0	0	111	Y214 W233 S234 T241 L247 P248 L284	Y214-V237 HydrophobicContact CD1-CB 3.96Å; Y214-V237 HydrophobicContact CD1-CG1 3.41Å; Y214-V237 VanDerWaalsContact CD1-CG1 3.41Å; Y214-V237 HydrophobicContact CE1-CG1 3.8Å; Y214-V237 HydrophobicContact CG-CG1 4.09Å; W233-V237 PolarHBondContact O-N 3Å; W233-V237 VanDerWaalsContact O-N 3.16Å; S234-V237 WeakPolarHBondContact O-CB 3.44Å; S234-V237 PolarHBondContact O-N 3.24Å; V237-T241 WeakPolarHBondContact O-CB 3.41Å; V237-T241 PolarHBondContact O-N 2.92Å; V237-T241 PolarHBondContact O-OG1 2.99Å; V237-L247 HydrophobicContact CG1-CD2 3.97Å; V237-P248 HydrophobicContact CB-CG 4.29Å; V237-P248 HydrophobicContact CG1-CG 4.07Å; V237-P248 HydrophobicContact CG2-CG 4.05Å; V237-L284 HydrophobicContact CG2-CD2 4.1Å
238	I	96.3	Very high	95	Very high	2 Å²	2	8.7 Å²	8.7	1%	0.01	5%	0.05	C	C	.	.	H	α-helix	trans	-62.9	-49.7	175.9	-70.1	165.2	0	0	0	111	F155 I158 L175 L180 Y214 S234 L235 Y240 T241 L242	F155-I238 HydrophobicContact CE2-CG2 4.4Å; I158-I238 HydrophobicContact CD1-CG2 4.19Å; L175-I238 HydrophobicContact CB-CD1 4.04Å; L180-I238 HydrophobicContact CD1-CD1 4.24Å; L180-I238 HydrophobicContact CD1-CG2 3.77Å; Y214-I238 HydrophobicContact CD1-CG1 4.08Å; Y214-I238 HydrophobicContact CE1-CG1 3.95Å; S234-I238 WeakPolarHBondContact O-CG1 3.37Å; S234-I238 PolarHBondContact O-N 3.05Å; L235-I238 HydrophobicContact CD2-CD1 4.46Å; L235-I238 PolarHBondContact O-N 2.67Å; I238-Y240 PolarHBondContact O-N 3.07Å; I238-T241 WeakPolarHBondContact O-CA 3.29Å; I238-T241 WeakPolarHBondContact O-CB 3.37Å; I238-T241 PolarHBondContact O-N 3.23Å; I238-L242 HydrophobicContact CG2-CD1 4.01Å; I238-L242 HydrophobicContact CG2-CG 4.43Å; I238-L242 WeakPolarHBondContact O-CG 3.39Å; I238-L242 PolarHBondContact O-N 3.25Å
239	L	97.8	Very high	95.2	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-55.4	-51.7	178.7	175.9	58.3	0	0	0	111.6	F155 L235 T241 L242 V243 L279 L280 F283 W302	F155-L239 HydrophobicContact CD1-CD1 4.04Å; F155-L239 HydrophobicContact CD1-CD2 4.48Å; F155-L239 HydrophobicContact CD2-CB 4.23Å; F155-L239 HydrophobicContact CD2-CD1 4.39Å; F155-L239 HydrophobicContact CE1-CB 4.19Å; F155-L239 HydrophobicContact CE1-CD1 4.3Å; F155-L239 HydrophobicContact CE1-CD2 4.02Å; F155-L239 HydrophobicContact CE1-CG 4.4Å; F155-L239 HydrophobicContact CE2-CB 3.75Å; F155-L239 HydrophobicContact CG-CD1 4.1Å; F155-L239 HydrophobicContact CZ-CB 3.73Å; F155-L239 HydrophobicContact CZ-CD2 4.31Å; F155-L239 HydrophobicContact CZ-CG 4.42Å; L235-L239 WeakPolarHBondContact O-CB 3.3Å; L235-L239 PolarHBondContact O-N 2.71Å; L239-T241 PolarHBondContact O-N 3.43Å; L239-L242 PolarHBondContact O-N 3.41Å; L239-V243 HydrophobicContact CD1-CG1 4.24Å; L239-V243 WeakPolarHBondContact O-CG2 3.06Å; L239-V243 PolarHBondContact O-N 3.45Å; L239-V243 VanDerWaalsContact O-N 3.17Å; L239-L279 HydrophobicContact CD2-CD2 3.61Å; L239-L279 HydrophobicContact CD2-CG 3.79Å; L239-L280 HydrophobicContact CB-CD2 4.13Å; L239-L280 HydrophobicContact CD2-CD2 3.87Å; L239-L280 HydrophobicContact CD2-CG 4.11Å; L239-L280 HydrophobicContact CG-CD2 3.98Å; L239-L280 HydrophobicContact CG-CG 4.48Å; L239-F283 HydrophobicContact CD2-CD2 4.24Å; L239-F283 HydrophobicContact CD2-CE2 3.97Å; L239-W302 HydrophobicContact CD1-CH2 3.6Å; L239-W302 HydrophobicContact CD1-CZ2 4.36Å; L239-W302 HydrophobicContact CD1-CZ3 3.75Å
240	Y	97.6	Very high	95	Very high	13 Å²	13	7.1 Å²	7.1	5%	0.051	4%	0.042	C	C	.	.	H	α-helix	trans	-58.3	-38.6	177.5	-179.2	-83.5	0	0	0	111.6	G236 I238 S244 S246 L247 P248 Y266 R267 M272 L280	G236-Y240 WeakPolarHBondContact O-CB 3.41Å; G236-Y240 PolarHBondContact O-N 3.04Å; G236-Y240 VanDerWaalsContact O-N 3.09Å; I238-Y240 PolarHBondContact O-N 3.07Å; Y240-S244 WeakPolarHBondContact CD1-OG 3.09Å; Y240-S244 VanDerWaalsContact CE1-OG 3.24Å; Y240-S244 WeakPolarHBondContact CE1-OG 3.27Å; Y240-S244 VanDerWaalsContact O-CB 3.28Å; Y240-S244 WeakPolarHBondContact O-CB 3.36Å; Y240-S244 PolarHBondContact O-N 3.01Å; Y240-S244 PolarHBondContact O-OG 3.5Å; Y240-S246 WeakPolarHBondContact CD1-O 3.29Å; Y240-S246 WeakPolarHBondContact CE1-O 3.46Å; Y240-L247 VanDerWaalsContact CE1-C 3.47Å; Y240-L247 WeakPolarHBondContact CE1-O 3.35Å; Y240-P248 HydrophobicContact CD1-CB 3.61Å; Y240-P248 HydrophobicContact CD1-CG 4Å; Y240-P248 VanDerWaalsContact CD1-N 3.33Å; Y240-P248 HydrophobicContact CD2-CB 4.19Å; Y240-P248 VanDerWaalsContact CE1-CA 3.41Å; Y240-P248 HydrophobicContact CE1-CB 3.87Å; Y240-P248 HydrophobicContact CE2-CB 4.42Å; Y240-P248 HydrophobicContact CG-CB 3.79Å; Y240-P248 HydrophobicContact CG-CG 4.23Å; Y240-Y266 HydrophobicContact CD2-CD2 4.03Å; Y240-Y266 AromaticContact CE2-CD2 3.92Å; Y240-Y266 HydrophobicContact CE2-CD2 3.92Å; Y240-R267 WeakPolarHBondContact CE2-O 3.23Å; Y240-R267 PolarHBondContact OH-O 3.26Å; Y240-R267 VanDerWaalsContact OH-O 3.07Å; Y240-M272 HydrophobicContact CD2-CE 4.06Å; Y240-M272 HydrophobicContact CE2-CE 4.25Å; Y240-L280 HydrophobicContact CD2-CD1 4.03Å
241	T	94.7	Very high	94.7	Very high	5 Å²	5	7.5 Å²	7.5	3%	0.031	5%	0.046	C	C	.	.	H	α-helix	trans	-67.9	-38.5	178.8	-56.2	0	0	0	0	112.3	L140 V237 I238 L239 G245 S246	L140-T241 HydrophobicContact CD1-CG2 4.19Å; V237-T241 WeakPolarHBondContact O-CB 3.41Å; V237-T241 PolarHBondContact O-N 2.92Å; V237-T241 PolarHBondContact O-OG1 2.99Å; I238-T241 WeakPolarHBondContact O-CA 3.29Å; I238-T241 WeakPolarHBondContact O-CB 3.37Å; I238-T241 PolarHBondContact O-N 3.23Å; L239-T241 PolarHBondContact O-N 3.43Å; T241-G245 WeakPolarHBondContact O-CA 3.37Å; T241-G245 PolarHBondContact O-N 2.93Å; T241-S246 WeakPolarHBondContact CA-O 3.35Å; T241-S246 PolarHBondContact OG1-O 2.86Å
242	L	95.4	Very high	94.3	Very high	3 Å²	3	15.6 Å²	15.6	2%	0.016	8%	0.084	C	C	.	.	H	α-helix	trans	-63.2	-49.5	175.4	-66	164.3	0	0	0	111.9	V136 L140 M146 A151 F155 I158 I238 L239	V136-L242 HydrophobicContact CG1-CD2 3.65Å; L140-L242 HydrophobicContact CD1-CD2 4.11Å; L140-L242 HydrophobicContact CD2-CD2 4.46Å; M146-L242 HydrophobicContact CE-CD2 4.04Å; M146-L242 PolarHBondContact N-O 2.73Å; M146-L242 HydrophobicContact SD-CB 4.41Å; M146-L242 HydrophobicContact SD-CD2 3.65Å; A151-L242 HydrophobicContact CB-CB 4.24Å; F155-L242 HydrophobicContact CD2-CD1 4.15Å; I158-L242 HydrophobicContact CD1-CD1 4.3Å; I238-L242 HydrophobicContact CG2-CD1 4.01Å; I238-L242 HydrophobicContact CG2-CG 4.43Å; I238-L242 WeakPolarHBondContact O-CG 3.39Å; I238-L242 PolarHBondContact O-N 3.25Å; L239-L242 PolarHBondContact O-N 3.41Å
243	V	96.6	Very high	93.8	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.012	10%	0.1	C	C	.	.	H	α-helix	trans	-82.7	-22.2	-171.9	-57	0	0	0	0	114.4	R145 E148 A151 L239 M272 W302	R145-V243 WeakPolarHBondContact CD-O 3.36Å; R145-V243 PolarHBondContact NH1-O 3.39Å; E148-V243 HydrophobicContact CG-CG1 4.23Å; A151-V243 HydrophobicContact CB-CG1 3.72Å; L239-V243 HydrophobicContact CD1-CG1 4.24Å; L239-V243 WeakPolarHBondContact O-CG2 3.06Å; L239-V243 PolarHBondContact O-N 3.45Å; L239-V243 VanDerWaalsContact O-N 3.17Å; V243-M272 HydrophobicContact CG2-CE 3.54Å; V243-W302 HydrophobicContact CG1-CZ2 4.33Å
244	S	93.9	Very high	93.3	Very high	5 Å²	5	23.5 Å²	23.5	4%	0.035	13%	0.125	C	C	.	.	H	α-helix	trans	-105.7	-21.9	176.9	77	0	0	0	0	114.5	R145 Y240 S246	R145-S244 VanDerWaalsContact CB-C 3.45Å; Y240-S244 WeakPolarHBondContact CD1-OG 3.09Å; Y240-S244 VanDerWaalsContact CE1-OG 3.24Å; Y240-S244 WeakPolarHBondContact CE1-OG 3.27Å; Y240-S244 VanDerWaalsContact O-CB 3.28Å; Y240-S244 WeakPolarHBondContact O-CB 3.36Å; Y240-S244 PolarHBondContact O-N 3.01Å; Y240-S244 PolarHBondContact O-OG 3.5Å; S244-S246 VanDerWaalsContact C-N 3.28Å; S244-S246 PolarHBondContact OG-N 3.46Å; S244-S246 VanDerWaalsContact OG-N 3.09Å; S244-S246 PolarHBondContact OG-O 2.69Å; S244-S246 PolarHBondContact OG-OG 2.78Å
245	G	90.1	Very high	93	Very high	3 Å²	3	30.3 Å²	30.3	3%	0.031	16%	0.155	C	C	.	.	S	Bend	trans	69.3	21.7	-169.5	0	0	0	0	0	113.5	T241 R909	T241-G245 WeakPolarHBondContact O-CA 3.37Å; T241-G245 PolarHBondContact O-N 2.93Å; G245-R909 PolarHBondContact O-NE 3.28Å; G245-R909 PolarHBondContact O-NH2 3.43Å
246	S	90.4	Very high	92.7	Very high	28 Å²	28	32.1 Å²	32.1	20%	0.196	16%	0.163	C	C	.	.	S	Bend	trans	-148.6	154.8	-177.3	55.5	0	0	0	0	111.4	Y240 T241 S244	Y240-S246 WeakPolarHBondContact CD1-O 3.29Å; Y240-S246 WeakPolarHBondContact CE1-O 3.46Å; T241-S246 WeakPolarHBondContact CA-O 3.35Å; T241-S246 PolarHBondContact OG1-O 2.86Å; S244-S246 VanDerWaalsContact C-N 3.28Å; S244-S246 PolarHBondContact OG-N 3.46Å; S244-S246 VanDerWaalsContact OG-N 3.09Å; S244-S246 PolarHBondContact OG-O 2.69Å; S244-S246 PolarHBondContact OG-OG 2.78Å
247	L	92.2	Very high	92.4	Very high	24 Å²	24	32.1 Å²	32.1	13%	0.126	16%	0.163	C	C	.	.			trans	-71.3	146.6	173.9	-67.9	162.2	0	0	0	110.7	P213 Y214 V237 Y240 F249 D250 F910	P213-L247 HydrophobicContact CB-CD1 3.86Å; P213-L247 HydrophobicContact CB-CD2 4.04Å; P213-L247 HydrophobicContact CG-CD1 4.3Å; Y214-L247 HydrophobicContact CE1-CD2 4.35Å; Y214-L247 HydrophobicContact CE2-CD2 4.48Å; V237-L247 HydrophobicContact CG1-CD2 3.97Å; Y240-L247 VanDerWaalsContact CE1-C 3.47Å; Y240-L247 WeakPolarHBondContact CE1-O 3.35Å; L247-F249 VanDerWaalsContact C-N 3.33Å; L247-F249 WeakPolarHBondContact CB-O 3.48Å; L247-D250 HydrophobicContact CB-CB 4.43Å; L247-F910 HydrophobicContact CD1-CD1 4.5Å; L247-F910 HydrophobicContact CD1-CE1 4.07Å; L247-F910 HydrophobicContact CG-CE1 4.3Å
248	P	95.4	Very high	92.2	Very high	14 Å²	14	37 Å²	37	9%	0.091	18%	0.181	C	C	.	.	S	Bend	trans	-73.1	-28.8	175.4	28.2	-30.6	0	0	0	112.2	V237 Y240 Y266	V237-P248 HydrophobicContact CB-CG 4.29Å; V237-P248 HydrophobicContact CG1-CG 4.07Å; V237-P248 HydrophobicContact CG2-CG 4.05Å; Y240-P248 HydrophobicContact CD1-CB 3.61Å; Y240-P248 HydrophobicContact CD1-CG 4Å; Y240-P248 VanDerWaalsContact CD1-N 3.33Å; Y240-P248 HydrophobicContact CD2-CB 4.19Å; Y240-P248 VanDerWaalsContact CE1-CA 3.41Å; Y240-P248 HydrophobicContact CE1-CB 3.87Å; Y240-P248 HydrophobicContact CE2-CB 4.42Å; Y240-P248 HydrophobicContact CG-CB 3.79Å; Y240-P248 HydrophobicContact CG-CG 4.23Å; P248-Y266 HydrophobicContact CB-CG 4.33Å
249	F	95	Very high	92.1	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.009	20%	0.204	C	C	.	.	S	Bend	trans	-130.5	125.2	176.6	-39.7	-67.7	0	0	0	107.9	W233 L247 L257 V261 Y266 L284	W233-F249 AromaticContact CH2-CE2 3.94Å; W233-F249 HydrophobicContact CH2-CE2 3.94Å; W233-F249 HydrophobicContact CH2-CZ 4.04Å; W233-F249 HydrophobicContact CZ2-CD2 4.1Å; W233-F249 AromaticContact CZ2-CE2 3.38Å; W233-F249 HydrophobicContact CZ2-CE2 3.38Å; W233-F249 AromaticContact CZ2-CZ 3.95Å; W233-F249 HydrophobicContact CZ2-CZ 3.95Å; L247-F249 VanDerWaalsContact C-N 3.33Å; L247-F249 WeakPolarHBondContact CB-O 3.48Å; F249-L257 HydrophobicContact CB-CD1 4.12Å; F249-V261 HydrophobicContact CB-CG2 3.72Å; F249-V261 HydrophobicContact CD2-CG2 3.98Å; F249-V261 HydrophobicContact CG-CG2 3.93Å; F249-Y266 HydrophobicContact CE1-CD1 4.2Å; F249-Y266 HydrophobicContact CZ-CD1 4.04Å; F249-L284 HydrophobicContact CE2-CD1 4.47Å; F249-L284 HydrophobicContact CE2-CD2 4.31Å; F249-L284 HydrophobicContact CZ-CD1 4.37Å
250	D	89.7	Confident	91.9	Very high	38 Å²	38	45.8 Å²	45.8	20%	0.203	22%	0.219	C	C	.	.			trans	-148.3	159.1	-178.3	-165.2	0.4	0	0	0	107.8	L247 R260 W912 R972	L247-D250 HydrophobicContact CB-CB 4.43Å; D250-R260 WeakPolarHBondContact O-CD 3.24Å; D250-R260 PolarHBondContact O-NH1 2.8Å; D250-W912 PolarHBondContact OD1-NE1 3.06Å; D250-R972 IonicContact OD2-NH1 2.73Å
251	G	85.4	Confident	91.8	Very high	9 Å²	9	45.2 Å²	45.2	9%	0.093	22%	0.216	C	C	.	.			trans	-173.8	160.5	179.6	0	0	0	0	0	114.6	N253	G251-N253 PolarHBondContact O-N 3.1Å
252	Q	86.6	Confident	91.8	Very high	171 Å²	171	47.6 Å²	47.6	80%	0.799	23%	0.229	S	C	*	.	S	Bend	trans	-69.8	-18.1	-174.2	-52.1	-173.4	2.8	0	0	112.7	E256	Q252-E256 WeakPolarHBondContact CB-OE1 3.47Å; Q252-E256 PolarHBondContact N-OE2 2.82Å
253	N	86.8	Confident	91.8	Very high	71 Å²	71	54.5 Å²	54.5	38%	0.38	26%	0.255	S	S	.	.	S	Bend	trans	-154.5	165.8	-176.9	55	74.1	0	0	0	110.1	G251 K255 E256 L257	G251-N253 PolarHBondContact O-N 3.1Å; N253-K255 PolarHBondContact O-N 3.01Å; N253-K255 WeakPolarHBondContact OD1-CB 3.35Å; N253-K255 PolarHBondContact OD1-N 3.2Å; N253-E256 PolarHBondContact ND2-OE1 2.86Å; N253-E256 PolarHBondContact O-N 3Å; N253-E256 PolarHBondContact OD1-N 3.33Å; N253-L257 PolarHBondContact O-N 2.87Å; N253-L257 VanDerWaalsContact O-N 3.14Å
254	L	86.2	Confident	91.7	Very high	101 Å²	101	55 Å²	55	53%	0.529	26%	0.26	S	S	.	.	H	α-helix	trans	-63.8	-26.8	-177	-171.3	61.7	0	0	0	113.4	P212 F220 L257 R258	P212-L254 HydrophobicContact CB-CD1 3.75Å; P212-L254 HydrophobicContact CG-CD1 4.08Å; F220-L254 HydrophobicContact CE1-CD1 3.98Å; L254-L257 HydrophobicContact CD1-CD2 4.38Å; L254-R258 WeakPolarHBondContact O-CB 3.31Å; L254-R258 PolarHBondContact O-N 3.03Å
255	K	89.2	Confident	91.7	Very high	146 Å²	146	62 Å²	62	64%	0.635	29%	0.29	S	S	*	.	H	α-helix	trans	-68.9	-52.3	177.4	177.6	-177.2	170.1	-176.2	0	111	N253 L257 R258 E259	N253-K255 PolarHBondContact O-N 3.01Å; N253-K255 WeakPolarHBondContact OD1-CB 3.35Å; N253-K255 PolarHBondContact OD1-N 3.2Å; K255-L257 VanDerWaalsContact C-N 3.28Å; K255-L257 PolarHBondContact O-N 3.3Å; K255-R258 WeakPolarHBondContact O-CB 3.35Å; K255-R258 PolarHBondContact O-N 3.44Å; K255-E259 WeakPolarHBondContact CE-OE1 3.13Å; K255-E259 WeakPolarHBondContact CG-OE1 3.18Å; K255-E259 WeakPolarHBondContact O-CG 3.21Å; K255-E259 PolarHBondContact O-N 3.4Å
256	E	92.3	Very high	92	Very high	37 Å²	37	64.1 Å²	64.1	17%	0.173	30%	0.298	C	S	.	.	H	α-helix	trans	-56.9	-41.9	173.9	-85.2	179	-124	0	0	112.6	Q252 N253 E259 R260	Q252-E256 WeakPolarHBondContact CB-OE1 3.47Å; Q252-E256 PolarHBondContact N-OE2 2.82Å; N253-E256 PolarHBondContact ND2-OE1 2.86Å; N253-E256 PolarHBondContact O-N 3Å; N253-E256 PolarHBondContact OD1-N 3.33Å; E256-E259 PolarHBondContact O-N 3.34Å; E256-R260 WeakPolarHBondContact O-CB 3.49Å; E256-R260 WeakPolarHBondContact O-CG 3.38Å; E256-R260 PolarHBondContact O-N 3.28Å; E256-R260 IonicContact OE2-CZ 3.34Å; E256-R260 IonicContact OE2-NH1 2.65Å; E256-R260 PolarHBondContact OE2-NH1 2.83Å; E256-R260 IonicContact OE2-NH2 2.73Å; E256-R260 PolarHBondContact OE2-NH2 2.91Å
257	L	91.8	Very high	92.2	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-63.4	-48.4	178	179.6	61.6	0	0	0	110.7	P212 P213 F249 N253 L254 K255 E259 R260 V261 W912	P212-L257 HydrophobicContact CB-CD2 3.78Å; P213-L257 HydrophobicContact CG-CD2 4.19Å; F249-L257 HydrophobicContact CB-CD1 4.12Å; N253-L257 PolarHBondContact O-N 2.87Å; N253-L257 VanDerWaalsContact O-N 3.14Å; L254-L257 HydrophobicContact CD1-CD2 4.38Å; K255-L257 VanDerWaalsContact C-N 3.28Å; K255-L257 PolarHBondContact O-N 3.3Å; L257-E259 VanDerWaalsContact C-N 3.35Å; L257-E259 PolarHBondContact O-N 3.19Å; L257-R260 PolarHBondContact O-N 2.73Å; L257-V261 HydrophobicContact CD1-CG2 4.1Å; L257-V261 HydrophobicContact CG-CG2 4.4Å; L257-V261 WeakPolarHBondContact O-CB 3.26Å; L257-V261 WeakPolarHBondContact O-CG2 3.34Å; L257-V261 PolarHBondContact O-N 2.79Å; L257-W912 HydrophobicContact CD2-CH2 3.79Å; L257-W912 HydrophobicContact CD2-CZ2 3.99Å
258	R	92.1	Very high	92.4	Very high	103 Å²	103	74 Å²	74	39%	0.389	33%	0.333	S	S	.	.	H	α-helix	trans	-55	-48.3	174.6	178.2	174.2	-167.6	-157.7	6.5	111.3	F220 L254 K255 R260 V261 L262	F220-R258 HydrophobicContact CB-CG 4.08Å; F220-R258 HydrophobicContact CD1-CB 3.77Å; F220-R258 HydrophobicContact CD1-CG 3.69Å; F220-R258 HydrophobicContact CE1-CB 4.01Å; F220-R258 HydrophobicContact CE1-CG 4.44Å; F220-R258 HydrophobicContact CG-CB 4.48Å; F220-R258 HydrophobicContact CG-CG 4.13Å; F220-R258 VanDerWaalsContact O-CZ 3.31Å; F220-R258 PolarHBondContact O-NE 3.25Å; F220-R258 PolarHBondContact O-NH2 2.81Å; L254-R258 WeakPolarHBondContact O-CB 3.31Å; L254-R258 PolarHBondContact O-N 3.03Å; K255-R258 WeakPolarHBondContact O-CB 3.35Å; K255-R258 PolarHBondContact O-N 3.44Å; R258-R260 PolarHBondContact O-N 3.15Å; R258-V261 PolarHBondContact O-N 3.29Å; R258-L262 HydrophobicContact CG-CD1 3.68Å; R258-L262 HydrophobicContact CG-CG 4.29Å; R258-L262 VanDerWaalsContact O-CB 3.29Å; R258-L262 WeakPolarHBondContact O-CB 3.39Å; R258-L262 WeakPolarHBondContact O-CG 3.48Å; R258-L262 PolarHBondContact O-N 3.39Å
259	E	94.3	Very high	92.4	Very high	103 Å²	103	74.1 Å²	74.1	48%	0.481	33%	0.333	S	S	.	.	H	α-helix	trans	-60.6	-41.4	177.7	-72.8	168.2	-171.8	0	0	112.3	K255 E256 L257 R263	K255-E259 WeakPolarHBondContact CE-OE1 3.13Å; K255-E259 WeakPolarHBondContact CG-OE1 3.18Å; K255-E259 WeakPolarHBondContact O-CG 3.21Å; K255-E259 PolarHBondContact O-N 3.4Å; E256-E259 PolarHBondContact O-N 3.34Å; L257-E259 VanDerWaalsContact C-N 3.35Å; L257-E259 PolarHBondContact O-N 3.19Å; E259-R263 WeakPolarHBondContact O-CB 3.45Å; E259-R263 PolarHBondContact O-N 2.73Å; E259-R263 VanDerWaalsContact O-N 3.08Å
260	R	95	Very high	92.4	Very high	84 Å²	84	83 Å²	83	32%	0.317	37%	0.372	S	S	.	.	H	α-helix	trans	-71.9	-40	178.9	-71.8	171	-171.7	135.7	16.1	112.8	D250 E256 L257 R258 R263 G264	D250-R260 WeakPolarHBondContact O-CD 3.24Å; D250-R260 PolarHBondContact O-NH1 2.8Å; E256-R260 WeakPolarHBondContact O-CB 3.49Å; E256-R260 WeakPolarHBondContact O-CG 3.38Å; E256-R260 PolarHBondContact O-N 3.28Å; E256-R260 IonicContact OE2-CZ 3.34Å; E256-R260 IonicContact OE2-NH1 2.65Å; E256-R260 PolarHBondContact OE2-NH1 2.83Å; E256-R260 IonicContact OE2-NH2 2.73Å; E256-R260 PolarHBondContact OE2-NH2 2.91Å; L257-R260 PolarHBondContact O-N 2.73Å; R258-R260 PolarHBondContact O-N 3.15Å; R260-R263 PolarHBondContact O-N 2.99Å; R260-G264 PolarHBondContact O-N 3.01Å
261	V	94.6	Very high	92.7	Very high	0 Å²	0	84.9 Å²	84.9	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-63.9	-50.4	174.4	167.6	0	0	0	0	110.8	P217 F220 W233 F249 L257 R258 R263 G264 L286	P217-V261 HydrophobicContact CB-CG1 4.07Å; F220-V261 HydrophobicContact CD2-CB 4.33Å; F220-V261 HydrophobicContact CD2-CG1 3.71Å; F220-V261 HydrophobicContact CE2-CB 4.19Å; F220-V261 HydrophobicContact CE2-CG1 3.83Å; F220-V261 HydrophobicContact CE2-CG2 4.17Å; W233-V261 HydrophobicContact CZ2-CG1 3.99Å; F249-V261 HydrophobicContact CB-CG2 3.72Å; F249-V261 HydrophobicContact CD2-CG2 3.98Å; F249-V261 HydrophobicContact CG-CG2 3.93Å; L257-V261 HydrophobicContact CD1-CG2 4.1Å; L257-V261 HydrophobicContact CG-CG2 4.4Å; L257-V261 WeakPolarHBondContact O-CB 3.26Å; L257-V261 WeakPolarHBondContact O-CG2 3.34Å; L257-V261 PolarHBondContact O-N 2.79Å; R258-V261 PolarHBondContact O-N 3.29Å; V261-R263 PolarHBondContact O-N 3.02Å; V261-G264 PolarHBondContact O-N 3.08Å; V261-L286 WeakPolarHBondContact O-CD2 3.44Å
262	L	94.7	Very high	93.3	Very high	56 Å²	56	85.3 Å²	85.3	29%	0.293	38%	0.377	S	S	.	.	H	α-helix	trans	-62.3	-29.4	178.2	-69.3	174.2	0	0	0	112.8	P217 F220 Q221 R258 L286	P217-L262 HydrophobicContact CB-CD2 4.05Å; P217-L262 WeakPolarHBondContact O-CD2 3.28Å; F220-L262 HydrophobicContact CB-CD2 4.19Å; F220-L262 HydrophobicContact CB-CG 4.45Å; Q221-L262 HydrophobicContact CG-CD2 3.77Å; Q221-L262 VanDerWaalsContact NE2-CD2 3.27Å; R258-L262 HydrophobicContact CG-CD1 3.68Å; R258-L262 HydrophobicContact CG-CG 4.29Å; R258-L262 VanDerWaalsContact O-CB 3.29Å; R258-L262 WeakPolarHBondContact O-CB 3.39Å; R258-L262 WeakPolarHBondContact O-CG 3.48Å; R258-L262 PolarHBondContact O-N 3.39Å; L262-L286 WeakPolarHBondContact O-CD1 3.2Å
263	R	95.4	Very high	93.8	Very high	147 Å²	147	79 Å²	79	56%	0.555	35%	0.352	S	S	*	.	H	α-helix	trans	-76.1	-21.7	174.2	-168.9	-178.8	70.9	172.1	4.4	113.3	E259 R260 V261 K265	E259-R263 WeakPolarHBondContact O-CB 3.45Å; E259-R263 PolarHBondContact O-N 2.73Å; E259-R263 VanDerWaalsContact O-N 3.08Å; R260-R263 PolarHBondContact O-N 2.99Å; V261-R263 PolarHBondContact O-N 3.02Å; R263-K265 HydrophobicContact CG-CB 4.38Å; R263-K265 HydrophobicContact CG-CD 4.25Å; R263-K265 HydrophobicContact CG-CG 4.24Å; R263-K265 PolarHBondContact O-N 2.82Å
264	G	94	Very high	94.3	Very high	13 Å²	13	80.2 Å²	80.2	13%	0.134	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	8.3	176.6	0	0	0	0	0	116.5	R260 V261 Y266	R260-G264 PolarHBondContact O-N 3.01Å; V261-G264 PolarHBondContact O-N 3.08Å; G264-Y266 WeakPolarHBondContact O-CD1 3.37Å
265	K	94.8	Very high	94.9	Very high	152 Å²	152	77 Å²	77	66%	0.661	35%	0.345	S	S	*	.			trans	-97.3	107.8	-175.1	-70.6	-176.3	-178.7	-175.3	0	111.9	R263	R263-K265 HydrophobicContact CG-CB 4.38Å; R263-K265 HydrophobicContact CG-CD 4.25Å; R263-K265 HydrophobicContact CG-CG 4.24Å; R263-K265 PolarHBondContact O-N 2.82Å
266	Y	96.1	Very high	95.3	Very high	48 Å²	48	70 Å²	70	19%	0.188	32%	0.315	C	S	.	.			trans	-107.2	166.8	173.1	56.7	-81.4	0	0	0	111.3	Y240 P248 F249 G264 I268 L280 L284	Y240-Y266 HydrophobicContact CD2-CD2 4.03Å; Y240-Y266 AromaticContact CE2-CD2 3.92Å; Y240-Y266 HydrophobicContact CE2-CD2 3.92Å; P248-Y266 HydrophobicContact CB-CG 4.33Å; F249-Y266 HydrophobicContact CE1-CD1 4.2Å; F249-Y266 HydrophobicContact CZ-CD1 4.04Å; G264-Y266 WeakPolarHBondContact O-CD1 3.37Å; Y266-I268 HydrophobicContact CD2-CD1 3.9Å; Y266-I268 HydrophobicContact CE2-CD1 3.49Å; Y266-I268 VanDerWaalsContact CE2-CD1 3.49Å; Y266-L280 HydrophobicContact CE2-CB 4.24Å; Y266-L280 HydrophobicContact CE2-CD1 4.33Å; Y266-L284 HydrophobicContact CD1-CD1 3.88Å; Y266-L284 HydrophobicContact CE1-CB 3.98Å; Y266-L284 HydrophobicContact CE1-CD1 3.69Å; Y266-L284 HydrophobicContact CE1-CG 4.48Å; Y266-L284 HydrophobicContact CE2-CD1 4.39Å; Y266-L284 HydrophobicContact CG-CD1 4.35Å
267	R	95.1	Very high	95.6	Very high	200 Å²	200	70.7 Å²	70.7	76%	0.755	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-98.4	127.6	-177.9	177.3	-179	-179.8	175.8	3	110.8	Y240 P269	Y240-R267 WeakPolarHBondContact CE2-O 3.23Å; Y240-R267 PolarHBondContact OH-O 3.26Å; Y240-R267 VanDerWaalsContact OH-O 3.07Å; R267-P269 WeakPolarHBondContact O-CD 3.45Å
268	I	96.4	Very high	95.9	Very high	59 Å²	59	73.8 Å²	73.8	30%	0.303	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-80.7	123.1	167.7	-51.1	-52.1	0	0	0	109.3	Y266 M272 E277	Y266-I268 HydrophobicContact CD2-CD1 3.9Å; Y266-I268 HydrophobicContact CE2-CD1 3.49Å; Y266-I268 VanDerWaalsContact CE2-CD1 3.49Å; I268-M272 HydrophobicContact CD1-SD 4.13Å; I268-M272 HydrophobicContact CG2-CB 4.23Å; I268-M272 HydrophobicContact CG2-CG 4.48Å; I268-M272 HydrophobicContact CG2-SD 3.97Å; I268-E277 HydrophobicContact CD1-CB 4.47Å; I268-E277 HydrophobicContact CD1-CG 3.75Å; I268-E277 HydrophobicContact CG1-CG 4.03Å
269	P	95	Very high	96.2	Very high	16 Å²	16	68.9 Å²	68.9	10%	0.104	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-77.3	146	170.9	-11.9	28.9	0	0	0	111.2	R267 Y271 M272	R267-P269 WeakPolarHBondContact O-CD 3.45Å; P269-Y271 HydrophobicContact CB-CD1 3.91Å; P269-Y271 HydrophobicContact CB-CD2 3.96Å; P269-Y271 HydrophobicContact CB-CE1 3.51Å; P269-Y271 HydrophobicContact CB-CE2 3.55Å; P269-Y271 HydrophobicContact CB-CG 4.13Å; P269-Y271 HydrophobicContact CG-CE1 4.41Å; P269-Y271 HydrophobicContact CG-CE2 3.85Å; P269-Y271 PolarHBondContact O-N 3.17Å; P269-M272 HydrophobicContact CG-CE 4.39Å; P269-M272 WeakPolarHBondContact O-CB 3.36Å; P269-M272 PolarHBondContact O-N 2.78Å
270	F	95.6	Very high	96.4	Very high	189 Å²	189	64 Å²	64	83%	0.829	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-13.2	-179.5	71.8	-93.3	0	0	0	115.5
271	Y	95.5	Very high	96.5	Very high	77 Å²	77	64.7 Å²	64.7	30%	0.302	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	0.8	-179.1	57.2	-113	0	0	0	113.7	P269	P269-Y271 HydrophobicContact CB-CD1 3.91Å; P269-Y271 HydrophobicContact CB-CD2 3.96Å; P269-Y271 HydrophobicContact CB-CE1 3.51Å; P269-Y271 HydrophobicContact CB-CE2 3.55Å; P269-Y271 HydrophobicContact CB-CG 4.13Å; P269-Y271 HydrophobicContact CG-CE1 4.41Å; P269-Y271 HydrophobicContact CG-CE2 3.85Å; P269-Y271 PolarHBondContact O-N 3.17Å
272	M	97.2	Very high	96.7	Very high	19 Å²	19	68.5 Å²	68.5	9%	0.094	32%	0.315	C	S	.	.	S	Bend	trans	-86.6	135.5	176.1	-179.1	179.5	-78.1	0	0	109.1	E148 Y240 V243 I268 P269 C276 L280	E148-M272 WeakPolarHBondContact OE1-CA 3.23Å; Y240-M272 HydrophobicContact CD2-CE 4.06Å; Y240-M272 HydrophobicContact CE2-CE 4.25Å; V243-M272 HydrophobicContact CG2-CE 3.54Å; I268-M272 HydrophobicContact CD1-SD 4.13Å; I268-M272 HydrophobicContact CG2-CB 4.23Å; I268-M272 HydrophobicContact CG2-CG 4.48Å; I268-M272 HydrophobicContact CG2-SD 3.97Å; P269-M272 HydrophobicContact CG-CE 4.39Å; P269-M272 WeakPolarHBondContact O-CB 3.36Å; P269-M272 PolarHBondContact O-N 2.78Å; M272-C276 HydrophobicContact CG-CB 3.8Å; M272-L280 HydrophobicContact CE-CD1 3.71Å; M272-L280 HydrophobicContact SD-CD1 3.71Å
273	S	97.9	Very high	96.8	Very high	38 Å²	38	65.8 Å²	65.8	27%	0.266	30%	0.301	S	S	.	.			trans	-72.4	150.8	177.1	69.4	0	0	0	0	112	E148 D275 C276 E277	E148-S273 PolarHBondContact OE1-N 3.28Å; E148-S273 PolarHBondContact OE1-OG 3.35Å; E148-S273 WeakPolarHBondContact OE2-CB 3.44Å; E148-S273 PolarHBondContact OE2-OG 3.22Å; S273-D275 PolarHBondContact O-N 2.6Å; S273-C276 WeakPolarHBondContact O-CB 3.47Å; S273-C276 PolarHBondContact O-N 3.49Å; S273-C276 WeakPolarHBondContact OG-CB 3.36Å; S273-C276 PolarHBondContact OG-N 2.99Å; S273-C276 VanDerWaalsContact OG-N 3.1Å; S273-E277 PolarHBondContact O-N 2.98Å
274	T	97.9	Very high	96.9	Very high	96 Å²	96	59.4 Å²	59.4	59%	0.589	28%	0.278	S	S	*	.	H	α-helix	trans	-57.9	-33	173.6	-40.4	0	0	0	0	111.8	E277 N278	T274-E277 PolarHBondContact O-N 3.29Å; T274-N278 VanDerWaalsContact O-CB 3.3Å; T274-N278 WeakPolarHBondContact O-CB 3.23Å; T274-N278 PolarHBondContact O-N 2.86Å; T274-N278 PolarHBondContact O-ND2 3.3Å
275	D	98.1	Very high	97.1	Very high	34 Å²	34	60.1 Å²	60.1	18%	0.182	28%	0.279	C	S	.	.	H	α-helix	trans	-66.6	-41.5	174.4	-65.6	-58.5	0	0	0	111.7	S273 N278 L279 R301 W302 I305	S273-D275 PolarHBondContact O-N 2.6Å; D275-N278 PolarHBondContact O-N 3.36Å; D275-L279 PolarHBondContact O-N 3.21Å; D275-R301 WeakPolarHBondContact OD1-CD 3.34Å; D275-R301 IonicContact OD1-CZ 3.42Å; D275-R301 IonicContact OD1-NE 2.84Å; D275-R301 IonicContact OD1-NH1 3.03Å; D275-R301 PolarHBondContact OD1-NH1 3.46Å; D275-R301 IonicContact OD2-CZ 2.67Å; D275-R301 IonicContact OD2-NH1 2.88Å; D275-R301 PolarHBondContact OD2-NH1 3.36Å; D275-W302 HydrophobicContact CB-CB 4.06Å; D275-W302 HydrophobicContact CB-CG 4.42Å; D275-I305 HydrophobicContact CB-CD1 4.39Å
276	C	98.3	Very high	97.1	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-42.1	174.4	-167.9	0	0	0	0	111.8	M272 S273 N278 L279 L280 W302	M272-C276 HydrophobicContact CG-CB 3.8Å; S273-C276 WeakPolarHBondContact O-CB 3.47Å; S273-C276 PolarHBondContact O-N 3.49Å; S273-C276 WeakPolarHBondContact OG-CB 3.36Å; S273-C276 PolarHBondContact OG-N 2.99Å; S273-C276 VanDerWaalsContact OG-N 3.1Å; C276-N278 VanDerWaalsContact C-N 3.34Å; C276-N278 PolarHBondContact O-N 3.05Å; C276-L279 PolarHBondContact O-N 3Å; C276-L280 WeakPolarHBondContact O-CG 3.13Å; C276-L280 PolarHBondContact O-N 2.82Å; C276-W302 HydrophobicContact CB-CG 4.38Å; C276-W302 VanDerWaalsContact N-CD1 3.34Å
277	E	98	Very high	97	Very high	51 Å²	51	56.9 Å²	56.9	24%	0.238	28%	0.275	C	S	.	.	H	α-helix	trans	-60.1	-43.8	173.6	-177.7	-172.9	148.5	0	0	111.5	I268 S273 T274 L280 K281	I268-E277 HydrophobicContact CD1-CB 4.47Å; I268-E277 HydrophobicContact CD1-CG 3.75Å; I268-E277 HydrophobicContact CG1-CG 4.03Å; S273-E277 PolarHBondContact O-N 2.98Å; T274-E277 PolarHBondContact O-N 3.29Å; E277-L280 PolarHBondContact O-N 2.72Å; E277-K281 WeakPolarHBondContact O-CG 3.48Å; E277-K281 PolarHBondContact O-N 2.85Å; E277-K281 WeakPolarHBondContact OE1-CE 3.46Å; E277-K281 IonicContact OE1-NZ 3.19Å; E277-K281 PolarHBondContact OE1-NZ 3.34Å
278	N	98.1	Very high	96.9	Very high	65 Å²	65	49 Å²	49	35%	0.348	25%	0.249	S	C	.	.	H	α-helix	trans	-67.6	-35.2	179.2	-72.2	-20.7	0	0	0	112.7	T274 D275 C276 K281 K282	T274-N278 VanDerWaalsContact O-CB 3.3Å; T274-N278 WeakPolarHBondContact O-CB 3.23Å; T274-N278 PolarHBondContact O-N 2.86Å; T274-N278 PolarHBondContact O-ND2 3.3Å; D275-N278 PolarHBondContact O-N 3.36Å; C276-N278 VanDerWaalsContact C-N 3.34Å; C276-N278 PolarHBondContact O-N 3.05Å; N278-K281 PolarHBondContact O-N 2.9Å; N278-K281 PolarHBondContact OD1-NZ 2.97Å; N278-K281 VanDerWaalsContact OD1-NZ 3.12Å; N278-K282 PolarHBondContact O-N 3.42Å
279	L	98.3	Very high	96.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.5	-44.6	170.4	177.7	57.1	0	0	0	111.6	L239 D275 C276 K281 K282 F283 I297 D300 W302 M303	L239-L279 HydrophobicContact CD2-CD2 3.61Å; L239-L279 HydrophobicContact CD2-CG 3.79Å; D275-L279 PolarHBondContact O-N 3.21Å; C276-L279 PolarHBondContact O-N 3Å; L279-K281 VanDerWaalsContact C-N 3.28Å; L279-K281 PolarHBondContact O-N 3.42Å; L279-K282 WeakPolarHBondContact O-CB 3.48Å; L279-K282 PolarHBondContact O-N 3.16Å; L279-F283 HydrophobicContact CD1-CD2 4.1Å; L279-F283 HydrophobicContact CD1-CE2 3.61Å; L279-F283 HydrophobicContact CD1-CZ 4.4Å; L279-F283 HydrophobicContact CD2-CE2 4.28Å; L279-F283 HydrophobicContact CG-CD2 4.14Å; L279-F283 HydrophobicContact CG-CE2 3.76Å; L279-F283 WeakPolarHBondContact O-CD2 3.49Å; L279-F283 PolarHBondContact O-N 2.95Å; L279-I297 HydrophobicContact CD1-CD1 3.64Å; L279-I297 HydrophobicContact CD1-CG2 4.22Å; L279-D300 HydrophobicContact CD1-CB 3.99Å; L279-W302 HydrophobicContact CB-CB 4.23Å; L279-W302 HydrophobicContact CD2-CB 4.03Å; L279-W302 HydrophobicContact CD2-CD2 3.98Å; L279-W302 HydrophobicContact CD2-CE3 3.37Å; L279-W302 HydrophobicContact CD2-CG 4.28Å; L279-W302 HydrophobicContact CD2-CZ3 4.12Å; L279-M303 HydrophobicContact CD2-CG 4.08Å; L279-M303 HydrophobicContact CD2-SD 3.86Å
280	L	98.4	Very high	96.6	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-60	-37.1	176.1	-74.7	167.6	0	0	0	112.6	G236 L239 Y240 Y266 M272 C276 E277 K282 F283 L284	G236-L280 WeakPolarHBondContact O-CD2 3.28Å; L239-L280 HydrophobicContact CB-CD2 4.13Å; L239-L280 HydrophobicContact CD2-CD2 3.87Å; L239-L280 HydrophobicContact CD2-CG 4.11Å; L239-L280 HydrophobicContact CG-CD2 3.98Å; L239-L280 HydrophobicContact CG-CG 4.48Å; Y240-L280 HydrophobicContact CD2-CD1 4.03Å; Y266-L280 HydrophobicContact CE2-CB 4.24Å; Y266-L280 HydrophobicContact CE2-CD1 4.33Å; M272-L280 HydrophobicContact CE-CD1 3.71Å; M272-L280 HydrophobicContact SD-CD1 3.71Å; C276-L280 WeakPolarHBondContact O-CG 3.13Å; C276-L280 PolarHBondContact O-N 2.82Å; E277-L280 PolarHBondContact O-N 2.72Å; L280-K282 PolarHBondContact O-N 3.13Å; L280-F283 PolarHBondContact O-N 3.48Å; L280-L284 HydrophobicContact CD2-CD1 4.35Å; L280-L284 PolarHBondContact O-N 3.03Å
281	K	97.5	Very high	96.7	Very high	99 Å²	99	52 Å²	52	43%	0.43	26%	0.264	S	S	.	.	H	α-helix	trans	-62.8	-21.3	173.5	-72.2	169	-171.2	153.9	0	113.9	E277 N278 L279 V285	E277-K281 WeakPolarHBondContact O-CG 3.48Å; E277-K281 PolarHBondContact O-N 2.85Å; E277-K281 WeakPolarHBondContact OE1-CE 3.46Å; E277-K281 IonicContact OE1-NZ 3.19Å; E277-K281 PolarHBondContact OE1-NZ 3.34Å; N278-K281 PolarHBondContact O-N 2.9Å; N278-K281 PolarHBondContact OD1-NZ 2.97Å; N278-K281 VanDerWaalsContact OD1-NZ 3.12Å; L279-K281 VanDerWaalsContact C-N 3.28Å; L279-K281 PolarHBondContact O-N 3.42Å; K281-V285 WeakPolarHBondContact O-CG2 3.48Å
282	K	97.8	Very high	96.6	Very high	79 Å²	79	49.4 Å²	49.4	34%	0.343	26%	0.259	S	S	.	.	H	α-helix	trans	-83.5	-29.3	175.3	-67.4	176.1	174.9	-178.7	0	112.9	N278 L279 L280 A292 I297 D300	N278-K282 PolarHBondContact O-N 3.42Å; L279-K282 WeakPolarHBondContact O-CB 3.48Å; L279-K282 PolarHBondContact O-N 3.16Å; L280-K282 PolarHBondContact O-N 3.13Å; K282-A292 HydrophobicContact CB-CB 3.97Å; K282-A292 PolarHBondContact O-N 2.78Å; K282-A292 VanDerWaalsContact O-N 3.13Å; K282-I297 HydrophobicContact CB-CD1 3.68Å; K282-I297 HydrophobicContact CD-CD1 4.3Å; K282-D300 WeakPolarHBondContact CE-OD2 3.18Å; K282-D300 IonicContact NZ-OD2 2.71Å; K282-D300 PolarHBondContact NZ-OD2 3.46Å
283	F	97.8	Very high	96.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-83.8	-54.3	176.4	-73	-67.3	0	0	0	112.8	F155 V232 L235 L239 L279 L280 V285 L294 I297	F155-F283 AromaticContact CE1-CE2 3.63Å; F155-F283 HydrophobicContact CE1-CE2 3.63Å; F155-F283 AromaticContact CE1-CZ 3.55Å; F155-F283 HydrophobicContact CE1-CZ 3.55Å; F155-F283 HydrophobicContact CZ-CE1 4.4Å; F155-F283 AromaticContact CZ-CE2 3.71Å; F155-F283 HydrophobicContact CZ-CE2 3.71Å; F155-F283 AromaticContact CZ-CZ 3.49Å; F155-F283 HydrophobicContact CZ-CZ 3.49Å; F155-F283 VanDerWaalsContact CZ-CZ 3.49Å; V232-F283 HydrophobicContact CG1-CD1 3.77Å; V232-F283 HydrophobicContact CG1-CE1 4.39Å; V232-F283 WeakPolarHBondContact O-CD1 3.3Å; L235-F283 HydrophobicContact CB-CD1 4.26Å; L235-F283 HydrophobicContact CB-CE1 3.83Å; L235-F283 HydrophobicContact CB-CZ 4.34Å; L239-F283 HydrophobicContact CD2-CD2 4.24Å; L239-F283 HydrophobicContact CD2-CE2 3.97Å; L279-F283 HydrophobicContact CD1-CD2 4.1Å; L279-F283 HydrophobicContact CD1-CE2 3.61Å; L279-F283 HydrophobicContact CD1-CZ 4.4Å; L279-F283 HydrophobicContact CD2-CE2 4.28Å; L279-F283 HydrophobicContact CG-CD2 4.14Å; L279-F283 HydrophobicContact CG-CE2 3.76Å; L279-F283 WeakPolarHBondContact O-CD2 3.49Å; L279-F283 PolarHBondContact O-N 2.95Å; L280-F283 PolarHBondContact O-N 3.48Å; F283-V285 PolarHBondContact O-N 2.89Å; F283-L294 HydrophobicContact CE1-CD2 4.18Å; F283-I297 HydrophobicContact CD1-CD1 4.16Å; F283-I297 HydrophobicContact CD1-CG1 4.48Å; F283-I297 HydrophobicContact CD2-CD1 4.24Å; F283-I297 HydrophobicContact CE1-CD1 3.96Å; F283-I297 HydrophobicContact CE1-CG1 3.99Å; F283-I297 HydrophobicContact CE1-CG2 4.05Å; F283-I297 HydrophobicContact CE2-CD1 4.04Å; F283-I297 HydrophobicContact CE2-CG2 4.24Å; F283-I297 HydrophobicContact CG-CD1 4.32Å; F283-I297 HydrophobicContact CZ-CB 4.46Å; F283-I297 HydrophobicContact CZ-CD1 3.91Å; F283-I297 HydrophobicContact CZ-CG1 4.15Å; F283-I297 HydrophobicContact CZ-CG2 3.51Å
284	L	97.5	Very high	96.5	Very high	12 Å²	12	51.4 Å²	51.4	6%	0.063	27%	0.27	C	S	.	.	S	Bend	trans	-85	41.2	-167.7	-61.3	179.7	0	0	0	113	W233 V237 F249 Y266 L280	W233-L284 HydrophobicContact CD2-CD2 3.97Å; W233-L284 HydrophobicContact CE3-CD2 4.12Å; W233-L284 HydrophobicContact CG-CD2 4.46Å; W233-L284 HydrophobicContact CH2-CD2 4.47Å; W233-L284 HydrophobicContact CZ2-CD2 4.33Å; W233-L284 VanDerWaalsContact CZ3-C 3.49Å; W233-L284 HydrophobicContact CZ3-CB 4.24Å; W233-L284 HydrophobicContact CZ3-CD2 4.37Å; V237-L284 HydrophobicContact CG2-CD2 4.1Å; F249-L284 HydrophobicContact CE2-CD1 4.47Å; F249-L284 HydrophobicContact CE2-CD2 4.31Å; F249-L284 HydrophobicContact CZ-CD1 4.37Å; Y266-L284 HydrophobicContact CD1-CD1 3.88Å; Y266-L284 HydrophobicContact CE1-CB 3.98Å; Y266-L284 HydrophobicContact CE1-CD1 3.69Å; Y266-L284 HydrophobicContact CE1-CG 4.48Å; Y266-L284 HydrophobicContact CE2-CD1 4.39Å; Y266-L284 HydrophobicContact CG-CD1 4.35Å; L280-L284 HydrophobicContact CD2-CD1 4.35Å; L280-L284 PolarHBondContact O-N 3.03Å
285	V	97.1	Very high	96.4	Very high	28 Å²	28	52.1 Å²	52.1	17%	0.17	27%	0.267	C	S	.	.			trans	-83.9	125.9	176.2	-170.9	0	0	0	0	109.6	K281 F283 T287 R290 R291	K281-V285 WeakPolarHBondContact O-CG2 3.48Å; F283-V285 PolarHBondContact O-N 2.89Å; V285-T287 VanDerWaalsContact C-N 3.32Å; V285-T287 PolarHBondContact O-N 3.35Å; V285-R290 HydrophobicContact CG1-CB 3.8Å; V285-R291 HydrophobicContact CB-CG 3.83Å; V285-R291 HydrophobicContact CG2-CG 4.44Å; V285-R291 PolarHBondContact O-NE 3.38Å; V285-R291 PolarHBondContact O-NH2 2.85Å
286	L	95.5	Very high	96.3	Very high	67 Å²	67	52.8 Å²	52.8	35%	0.351	28%	0.278	S	S	.	.	S	Bend	trans	-60.8	-38.7	-178.2	-70.5	175	0	0	0	113.1	P217 W233 V261 L262 P288 R291	P217-L286 HydrophobicContact CB-CD2 4.07Å; P217-L286 HydrophobicContact CG-CD2 3.95Å; W233-L286 HydrophobicContact CH2-CD2 4.05Å; W233-L286 HydrophobicContact CZ3-CD2 4.27Å; V261-L286 WeakPolarHBondContact O-CD2 3.44Å; L262-L286 WeakPolarHBondContact O-CD1 3.2Å; L286-P288 WeakPolarHBondContact O-CD 3.48Å; L286-R291 PolarHBondContact O-NH2 2.84Å
287	T	93.3	Very high	96.2	Very high	66 Å²	66	52.8 Å²	52.8	41%	0.405	28%	0.278	S	S	.	.	S	Bend	trans	-81.8	115	177.6	-51.7	0	0	0	0	110.3	V285 R290	V285-T287 VanDerWaalsContact C-N 3.32Å; V285-T287 PolarHBondContact O-N 3.35Å; T287-R290 HydrophobicContact CG2-CB 4.33Å; T287-R290 HydrophobicContact CG2-CG 3.9Å; T287-R290 PolarHBondContact O-N 2.96Å
288	P	93.1	Very high	96.2	Very high	34 Å²	34	50.4 Å²	50.4	22%	0.221	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-60.9	-46.1	-172.8	-17.7	27.9	0	0	0	114	E218 E229 L286 R290 R291	E218-P288 HydrophobicContact CB-CG 4.24Å; E218-P288 HydrophobicContact CG-CG 4.12Å; E229-P288 HydrophobicContact CB-CB 3.87Å; E229-P288 HydrophobicContact CG-CB 4.07Å; L286-P288 WeakPolarHBondContact O-CD 3.48Å; P288-R290 PolarHBondContact O-N 3.24Å; P288-R291 WeakPolarHBondContact O-CB 3.34Å; P288-R291 PolarHBondContact O-N 2.86Å
289	P	91.6	Very high	96.2	Very high	117 Å²	117	54.1 Å²	54.1	76%	0.76	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-65.5	1.4	175.2	-23.6	35.5	0	0	0	116
290	R	94.6	Very high	96.2	Very high	190 Å²	190	54.6 Å²	54.6	72%	0.717	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-110.4	0.6	173.5	-65	-176.8	63.5	-159.8	-0.9	113.2	V285 T287 P288	V285-R290 HydrophobicContact CG1-CB 3.8Å; T287-R290 HydrophobicContact CG2-CB 4.33Å; T287-R290 HydrophobicContact CG2-CG 3.9Å; T287-R290 PolarHBondContact O-N 2.96Å; P288-R290 PolarHBondContact O-N 3.24Å
291	R	96.2	Very high	96.1	Very high	19 Å²	19	62.7 Å²	62.7	7%	0.072	31%	0.312	C	S	.	.	S	Bend	trans	-71.6	148	167.7	-64.2	176.8	-165.3	143	16	108.9	E218 E229 V232 V285 L286 P288	E218-R291 IonicContact OE1-CZ 3.8Å; E218-R291 IonicContact OE1-NH1 2.73Å; E218-R291 PolarHBondContact OE1-NH1 3.11Å; E218-R291 IonicContact OE1-NH2 3.14Å; E218-R291 PolarHBondContact OE1-NH2 3.22Å; E218-R291 IonicContact OE2-CZ 2.89Å; E218-R291 IonicContact OE2-NH1 2.92Å; E218-R291 PolarHBondContact OE2-NH1 2.83Å; E218-R291 IonicContact OE2-NH2 3.89Å; E218-R291 PolarHBondContact OE2-NH2 3.46Å; E229-R291 PolarHBondContact O-NH1 2.87Å; V232-R291 HydrophobicContact CG1-CB 4.02Å; V285-R291 HydrophobicContact CB-CG 3.83Å; V285-R291 HydrophobicContact CG2-CG 4.44Å; V285-R291 PolarHBondContact O-NE 3.38Å; V285-R291 PolarHBondContact O-NH2 2.85Å; L286-R291 PolarHBondContact O-NH2 2.84Å; P288-R291 WeakPolarHBondContact O-CB 3.34Å; P288-R291 PolarHBondContact O-N 2.86Å
292	A	95.2	Very high	96.2	Very high	23 Å²	23	58 Å²	58	19%	0.19	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-72.1	140.5	173	0	0	0	0	0	110.5	K282 A296 I297	K282-A292 HydrophobicContact CB-CB 3.97Å; K282-A292 PolarHBondContact O-N 2.78Å; K282-A292 VanDerWaalsContact O-N 3.13Å; A292-A296 HydrophobicContact CB-CB 4.33Å; A292-I297 HydrophobicContact CB-CD1 3.9Å; A292-I297 HydrophobicContact CB-CG1 3.92Å
293	T	95	Very high	96.2	Very high	92 Å²	92	54.2 Å²	54.2	56%	0.564	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-64.7	156.1	169.2	60.7	0	0	0	0	110.2	E295 A296 I297	T293-E295 PolarHBondContact O-N 3.37Å; T293-A296 PolarHBondContact O-N 2.65Å; T293-A296 PolarHBondContact OG1-N 2.81Å; T293-I297 WeakPolarHBondContact O-CG1 3.32Å; T293-I297 PolarHBondContact O-N 2.82Å
294	L	96.7	Very high	96.2	Very high	7 Å²	7	55 Å²	55	4%	0.037	28%	0.28	C	S	.	.	H	α-helix	trans	-61.1	-31.4	179.2	-67.4	-175.2	0	0	0	112.7	V162 Q163 V232 L235 F283 A296 I297 M298	V162-L294 HydrophobicContact CB-CD1 4.04Å; V162-L294 HydrophobicContact CG1-CD1 3.77Å; Q163-L294 HydrophobicContact CB-CB 3.98Å; Q163-L294 HydrophobicContact CB-CD1 4.07Å; Q163-L294 HydrophobicContact CG-CB 4.19Å; V232-L294 HydrophobicContact CG2-CD2 3.84Å; V232-L294 HydrophobicContact CG2-CG 3.95Å; L235-L294 HydrophobicContact CD1-CD1 4.1Å; L235-L294 HydrophobicContact CD1-CD2 3.72Å; F283-L294 HydrophobicContact CE1-CD2 4.18Å; L294-A296 VanDerWaalsContact C-N 3.33Å; L294-A296 PolarHBondContact O-N 3.36Å; L294-I297 WeakPolarHBondContact O-CB 3.29Å; L294-I297 PolarHBondContact O-N 3.32Å; L294-M298 WeakPolarHBondContact O-CB 3.5Å; L294-M298 WeakPolarHBondContact O-CG 3.47Å; L294-M298 PolarHBondContact O-N 2.93Å
295	E	95.2	Very high	96.2	Very high	112 Å²	112	57 Å²	57	52%	0.523	29%	0.29	S	S	.	.	H	α-helix	trans	-64.9	-33	173.4	-59.6	-173.7	170.2	0	0	113.4	T293 P314	T293-E295 PolarHBondContact O-N 3.37Å; E295-P314 HydrophobicContact CG-CG 4.48Å
296	A	96.3	Very high	96.1	Very high	48 Å²	48	58.3 Å²	58.3	40%	0.397	31%	0.309	S	S	.	.	H	α-helix	trans	-79.7	-27	174	0	0	0	0	0	112.6	A292 T293 L294	A292-A296 HydrophobicContact CB-CB 4.33Å; T293-A296 PolarHBondContact O-N 2.65Å; T293-A296 PolarHBondContact OG1-N 2.81Å; L294-A296 VanDerWaalsContact C-N 3.33Å; L294-A296 PolarHBondContact O-N 3.36Å
297	I	97.9	Very high	96.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-71.3	-41.1	171.3	-71.2	-70.4	0	0	0	111.2	V159 L279 K282 F283 A292 T293 L294 K299 D300 M303	V159-I297 HydrophobicContact CG1-CG2 4.26Å; V159-I297 HydrophobicContact CG2-CG2 4.42Å; L279-I297 HydrophobicContact CD1-CD1 3.64Å; L279-I297 HydrophobicContact CD1-CG2 4.22Å; K282-I297 HydrophobicContact CB-CD1 3.68Å; K282-I297 HydrophobicContact CD-CD1 4.3Å; F283-I297 HydrophobicContact CD1-CD1 4.16Å; F283-I297 HydrophobicContact CD1-CG1 4.48Å; F283-I297 HydrophobicContact CD2-CD1 4.24Å; F283-I297 HydrophobicContact CE1-CD1 3.96Å; F283-I297 HydrophobicContact CE1-CG1 3.99Å; F283-I297 HydrophobicContact CE1-CG2 4.05Å; F283-I297 HydrophobicContact CE2-CD1 4.04Å; F283-I297 HydrophobicContact CE2-CG2 4.24Å; F283-I297 HydrophobicContact CG-CD1 4.32Å; F283-I297 HydrophobicContact CZ-CB 4.46Å; F283-I297 HydrophobicContact CZ-CD1 3.91Å; F283-I297 HydrophobicContact CZ-CG1 4.15Å; F283-I297 HydrophobicContact CZ-CG2 3.51Å; A292-I297 HydrophobicContact CB-CD1 3.9Å; A292-I297 HydrophobicContact CB-CG1 3.92Å; T293-I297 WeakPolarHBondContact O-CG1 3.32Å; T293-I297 PolarHBondContact O-N 2.82Å; L294-I297 WeakPolarHBondContact O-CB 3.29Å; L294-I297 PolarHBondContact O-N 3.32Å; I297-K299 PolarHBondContact O-N 3.2Å; I297-D300 WeakPolarHBondContact O-CB 3.3Å; I297-D300 PolarHBondContact O-N 3.5Å; I297-M303 VanDerWaalsContact O-CG 3.31Å; I297-M303 WeakPolarHBondContact O-CG 3.44Å
298	M	97.8	Very high	96	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-57.6	-33.6	-179.7	-78	168.5	132.3	0	0	112.6	V159 Q163 L294 D300 N304 L312 P314	V159-M298 HydrophobicContact CG1-CG 3.69Å; Q163-M298 HydrophobicContact CB-CE 3.91Å; Q163-M298 HydrophobicContact CB-SD 4.18Å; Q163-M298 HydrophobicContact CG-CE 3.99Å; Q163-M298 HydrophobicContact CG-SD 3.81Å; L294-M298 WeakPolarHBondContact O-CB 3.5Å; L294-M298 WeakPolarHBondContact O-CG 3.47Å; L294-M298 PolarHBondContact O-N 2.93Å; M298-D300 VanDerWaalsContact C-N 3.31Å; M298-N304 PolarHBondContact O-ND2 2.95Å; M298-L312 HydrophobicContact CB-CB 4.42Å; M298-L312 HydrophobicContact CB-CD2 4.29Å; M298-L312 HydrophobicContact CB-CG 4.22Å; M298-L312 HydrophobicContact CE-CD1 4.45Å; M298-L312 HydrophobicContact CE-CD2 4.38Å; M298-L312 HydrophobicContact CE-CG 4.04Å; M298-L312 HydrophobicContact CG-CD2 3.82Å; M298-L312 HydrophobicContact CG-CG 3.95Å; M298-P314 HydrophobicContact SD-CG 4.3Å
299	K	96.9	Very high	95.9	Very high	142 Å²	142	67.6 Å²	67.6	62%	0.617	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	7.5	176.3	-53.2	-176.9	-174.9	179.4	0	114	I297 E311	I297-K299 PolarHBondContact O-N 3.2Å; K299-E311 WeakPolarHBondContact CA-OE1 3.38Å; K299-E311 WeakPolarHBondContact CB-OE1 3.42Å; K299-E311 WeakPolarHBondContact CG-OE1 3.4Å
300	D	97.9	Very high	96	Very high	10 Å²	10	66.5 Å²	66.5	5%	0.053	34%	0.335	C	S	.	.			trans	-69.1	145.6	179.7	-173.7	-96.1	0	0	0	111.8	L279 K282 I297 M298 W302 M303 N304	L279-D300 HydrophobicContact CD1-CB 3.99Å; K282-D300 WeakPolarHBondContact CE-OD2 3.18Å; K282-D300 IonicContact NZ-OD2 2.71Å; K282-D300 PolarHBondContact NZ-OD2 3.46Å; I297-D300 WeakPolarHBondContact O-CB 3.3Å; I297-D300 PolarHBondContact O-N 3.5Å; M298-D300 VanDerWaalsContact C-N 3.31Å; D300-W302 VanDerWaalsContact C-N 3.32Å; D300-W302 PolarHBondContact O-N 3.04Å; D300-W302 WeakPolarHBondContact OD1-CB 3.42Å; D300-W302 PolarHBondContact OD1-N 3.16Å; D300-M303 HydrophobicContact CB-CB 4.44Å; D300-M303 HydrophobicContact CB-CG 4.05Å; D300-M303 WeakPolarHBondContact O-CB 3.48Å; D300-M303 PolarHBondContact O-N 2.88Å; D300-N304 PolarHBondContact O-N 3.11Å; D300-N304 PolarHBondContact O-ND2 3.24Å
301	R	97.5	Very high	96	Very high	170 Å²	170	60.9 Å²	60.9	64%	0.642	32%	0.317	S	S	*	.	H	α-helix	trans	-55.2	-46	178.1	-172.9	173.7	-176	-125.4	4.2	111.6	D275 M303 N304 I305	D275-R301 WeakPolarHBondContact OD1-CD 3.34Å; D275-R301 IonicContact OD1-CZ 3.42Å; D275-R301 IonicContact OD1-NE 2.84Å; D275-R301 IonicContact OD1-NH1 3.03Å; D275-R301 PolarHBondContact OD1-NH1 3.46Å; D275-R301 IonicContact OD2-CZ 2.67Å; D275-R301 IonicContact OD2-NH1 2.88Å; D275-R301 PolarHBondContact OD2-NH1 3.36Å; R301-M303 VanDerWaalsContact C-N 3.26Å; R301-M303 PolarHBondContact O-N 3.1Å; R301-N304 PolarHBondContact O-N 3.34Å; R301-I305 HydrophobicContact CG-CD1 4.41Å; R301-I305 HydrophobicContact CG-CG1 4.45Å; R301-I305 WeakPolarHBondContact O-CG1 3.29Å; R301-I305 PolarHBondContact O-N 3.02Å
302	W	98.3	Very high	96.1	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.5	-26.8	179.6	-169.4	90.8	0	0	0	112.9	E148 A151 R152 F155 L239 V243 D275 C276 L279 D300 N304	E148-W302 HydrophobicContact CB-CZ2 3.9Å; E148-W302 HydrophobicContact CG-CZ2 4.14Å; E148-W302 PolarHBondContact OE2-NE1 2.81Å; A151-W302 HydrophobicContact CB-CH2 4.26Å; R152-W302 HydrophobicContact CB-CH2 3.82Å; R152-W302 HydrophobicContact CB-CZ2 4.27Å; R152-W302 HydrophobicContact CB-CZ3 3.96Å; R152-W302 WeakPolarHBondContact CD-O 3.44Å; R152-W302 HydrophobicContact CG-CZ3 4.35Å; R152-W302 PolarHBondContact NE-O 3.2Å; F155-W302 HydrophobicContact CD1-CZ3 4.26Å; L239-W302 HydrophobicContact CD1-CH2 3.6Å; L239-W302 HydrophobicContact CD1-CZ2 4.36Å; L239-W302 HydrophobicContact CD1-CZ3 3.75Å; V243-W302 HydrophobicContact CG1-CZ2 4.33Å; D275-W302 HydrophobicContact CB-CB 4.06Å; D275-W302 HydrophobicContact CB-CG 4.42Å; C276-W302 HydrophobicContact CB-CG 4.38Å; C276-W302 VanDerWaalsContact N-CD1 3.34Å; L279-W302 HydrophobicContact CB-CB 4.23Å; L279-W302 HydrophobicContact CD2-CB 4.03Å; L279-W302 HydrophobicContact CD2-CD2 3.98Å; L279-W302 HydrophobicContact CD2-CE3 3.37Å; L279-W302 HydrophobicContact CD2-CG 4.28Å; L279-W302 HydrophobicContact CD2-CZ3 4.12Å; D300-W302 VanDerWaalsContact C-N 3.32Å; D300-W302 PolarHBondContact O-N 3.04Å; D300-W302 WeakPolarHBondContact OD1-CB 3.42Å; D300-W302 PolarHBondContact OD1-N 3.16Å; W302-N304 VanDerWaalsContact C-N 3.29Å; W302-N304 PolarHBondContact O-N 3.35Å
303	M	97.9	Very high	96.1	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-72	-23	177.7	-67.7	-62.4	-73.2	0	0	113.3	F155 R156 V159 L279 I297 D300 R301 L312	F155-M303 HydrophobicContact CD1-CE 3.96Å; F155-M303 HydrophobicContact CD1-SD 3.6Å; F155-M303 HydrophobicContact CE1-CE 4.45Å; F155-M303 HydrophobicContact CE1-SD 4.03Å; R156-M303 WeakPolarHBondContact CD-O 3.37Å; R156-M303 HydrophobicContact CG-CE 4.09Å; R156-M303 PolarHBondContact NH1-O 3.04Å; V159-M303 HydrophobicContact CB-CE 3.93Å; V159-M303 HydrophobicContact CG1-CE 4.26Å; V159-M303 HydrophobicContact CG2-CE 3.81Å; L279-M303 HydrophobicContact CD2-CG 4.08Å; L279-M303 HydrophobicContact CD2-SD 3.86Å; I297-M303 VanDerWaalsContact O-CG 3.31Å; I297-M303 WeakPolarHBondContact O-CG 3.44Å; D300-M303 HydrophobicContact CB-CB 4.44Å; D300-M303 HydrophobicContact CB-CG 4.05Å; D300-M303 WeakPolarHBondContact O-CB 3.48Å; D300-M303 PolarHBondContact O-N 2.88Å; R301-M303 VanDerWaalsContact C-N 3.26Å; R301-M303 PolarHBondContact O-N 3.1Å; M303-L312 HydrophobicContact CE-CD2 3.71Å
304	N	97.9	Very high	96.2	Very high	18 Å²	18	63.4 Å²	63.4	10%	0.096	32%	0.323	C	S	.	.	H	α-helix	trans	-120.3	0.4	-169.1	-59.1	-69.4	0	0	0	115.2	R156 M298 D300 R301 W302 G306 F307 E311 L312	R156-N304 PolarHBondContact NH1-OD1 2.88Å; M298-N304 PolarHBondContact O-ND2 2.95Å; D300-N304 PolarHBondContact O-N 3.11Å; D300-N304 PolarHBondContact O-ND2 3.24Å; R301-N304 PolarHBondContact O-N 3.34Å; W302-N304 VanDerWaalsContact C-N 3.29Å; W302-N304 PolarHBondContact O-N 3.35Å; N304-G306 PolarHBondContact O-N 3.33Å; N304-G306 VanDerWaalsContact O-N 3.16Å; N304-F307 CarbonylContact O-C 3.51Å; N304-F307 WeakPolarHBondContact O-CA 3.46Å; N304-F307 PolarHBondContact O-N 3.44Å; N304-E311 WeakPolarHBondContact OD1-CA 2.92Å; N304-L312 PolarHBondContact OD1-N 3.23Å
305	I	97.1	Very high	96.2	Very high	54 Å²	54	65.7 Å²	65.7	28%	0.277	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	117.8	169.4	-70.2	158.8	0	0	0	110.1	R152 D275 R301 E308	R152-I305 WeakPolarHBondContact CD-O 3.47Å; R152-I305 PolarHBondContact NE-O 2.99Å; R152-I305 PolarHBondContact NH1-O 3.43Å; D275-I305 HydrophobicContact CB-CD1 4.39Å; R301-I305 HydrophobicContact CG-CD1 4.41Å; R301-I305 HydrophobicContact CG-CG1 4.45Å; R301-I305 WeakPolarHBondContact O-CG1 3.29Å; R301-I305 PolarHBondContact O-N 3.02Å; I305-E308 WeakPolarHBondContact CA-OE1 3.22Å
306	G	95.8	Very high	96.2	Very high	54 Å²	54	69.2 Å²	69.2	56%	0.557	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	16.9	-173.2	0	0	0	0	0	114.5	N304 E308	N304-G306 PolarHBondContact O-N 3.33Å; N304-G306 VanDerWaalsContact O-N 3.16Å; G306-E308 VanDerWaalsContact C-OE2 3.24Å; G306-E308 WeakPolarHBondContact CA-OE2 3.36Å; G306-E308 VanDerWaalsContact N-CD 3.29Å; G306-E308 PolarHBondContact N-OE1 3.24Å; G306-E308 PolarHBondContact N-OE2 2.9Å
307	F	95.3	Very high	95.9	Very high	63 Å²	63	70 Å²	70	28%	0.276	34%	0.34	S	S	.	.			trans	-142.8	35.1	175.7	-64	-88.8	0	0	0	110.1	R152 R156 N304 D309 D310 E311	R152-F307 HydrophobicContact CG-CE2 4.17Å; R156-F307 VanDerWaalsContact CZ-CG 3.44Å; N304-F307 CarbonylContact O-C 3.51Å; N304-F307 WeakPolarHBondContact O-CA 3.46Å; N304-F307 PolarHBondContact O-N 3.44Å; F307-D309 VanDerWaalsContact C-N 3.33Å; F307-D309 PolarHBondContact O-N 3.44Å; F307-D310 CarbonylContact O-C 3.6Å; F307-D310 PolarHBondContact O-N 3.36Å; F307-E311 PolarHBondContact O-N 2.93Å
308	E	91.3	Very high	95.5	Very high	130 Å²	130	73.4 Å²	73.4	61%	0.607	36%	0.363	S	S	*	.	S	Bend	trans	-62	-38.4	-173.2	-70.4	73.3	-167.8	0	0	112.4	I305 G306	I305-E308 WeakPolarHBondContact CA-OE1 3.22Å; G306-E308 VanDerWaalsContact C-OE2 3.24Å; G306-E308 WeakPolarHBondContact CA-OE2 3.36Å; G306-E308 VanDerWaalsContact N-CD 3.29Å; G306-E308 PolarHBondContact N-OE1 3.24Å; G306-E308 PolarHBondContact N-OE2 2.9Å
309	D	91.9	Very high	94.8	Very high	170 Å²	170	80 Å²	80	91%	0.909	40%	0.403	S	S	*	.	S	Bend	trans	-79.7	-16.6	174.7	-53.8	-62.4	0	0	0	113.3	F307	F307-D309 VanDerWaalsContact C-N 3.33Å; F307-D309 PolarHBondContact O-N 3.44Å
310	D	93.7	Very high	94	Very high	94 Å²	94	76.7 Å²	76.7	50%	0.503	39%	0.387	S	S	.	.	S	Bend	trans	-121.2	58.3	-178.8	179.9	49.5	0	0	0	110.5	R156 F307 L312	R156-D310 PolarHBondContact NH2-O 3.24Å; R156-D310 IonicContact NH2-OD2 2.67Å; R156-D310 PolarHBondContact NH2-OD2 3.41Å; F307-D310 CarbonylContact O-C 3.6Å; F307-D310 PolarHBondContact O-N 3.36Å; D310-L312 PolarHBondContact O-N 2.65Å
311	E	95.2	Very high	93.2	Very high	72 Å²	72	80.3 Å²	80.3	34%	0.336	41%	0.406	S	S	.	.			trans	-57.1	131	174.9	-168.6	-165.1	-165.4	0	0	110.2	K299 N304 F307 K313	K299-E311 WeakPolarHBondContact CA-OE1 3.38Å; K299-E311 WeakPolarHBondContact CB-OE1 3.42Å; K299-E311 WeakPolarHBondContact CG-OE1 3.4Å; N304-E311 WeakPolarHBondContact OD1-CA 2.92Å; F307-E311 PolarHBondContact O-N 2.93Å; E311-K313 VanDerWaalsContact O-CD 3.26Å; E311-K313 WeakPolarHBondContact O-CD 3.35Å; E311-K313 VanDerWaalsContact O-CE 3.24Å; E311-K313 WeakPolarHBondContact O-CE 3.21Å; E311-K313 WeakPolarHBondContact O-CG 3.43Å; E311-K313 PolarHBondContact O-N 2.62Å; E311-K313 PolarHBondContact O-NZ 2.92Å
312	L	96.5	Very high	92.4	Very high	19 Å²	19	74 Å²	74	10%	0.099	39%	0.385	C	S	.	.			trans	-62.5	122.5	-177	-177.7	62.5	0	0	0	110.8	R156 V159 M298 M303 N304 D310	R156-L312 HydrophobicContact CB-CD2 4.2Å; R156-L312 HydrophobicContact CG-CD2 4.21Å; V159-L312 HydrophobicContact CB-CD2 4.44Å; V159-L312 HydrophobicContact CG1-CD2 4.22Å; M298-L312 HydrophobicContact CB-CB 4.42Å; M298-L312 HydrophobicContact CB-CD2 4.29Å; M298-L312 HydrophobicContact CB-CG 4.22Å; M298-L312 HydrophobicContact CE-CD1 4.45Å; M298-L312 HydrophobicContact CE-CD2 4.38Å; M298-L312 HydrophobicContact CE-CG 4.04Å; M298-L312 HydrophobicContact CG-CD2 3.82Å; M298-L312 HydrophobicContact CG-CG 3.95Å; M303-L312 HydrophobicContact CE-CD2 3.71Å; N304-L312 PolarHBondContact OD1-N 3.23Å; D310-L312 PolarHBondContact O-N 2.65Å
313	K	96.1	Very high	91.6	Very high	115 Å²	115	80.3 Å²	80.3	50%	0.5	42%	0.418	S	S	.	.			trans	-121.4	154.9	-176.7	-70.3	141.7	-170.3	129.6	0	111.1	E311 Y315	E311-K313 VanDerWaalsContact O-CD 3.26Å; E311-K313 WeakPolarHBondContact O-CD 3.35Å; E311-K313 VanDerWaalsContact O-CE 3.24Å; E311-K313 WeakPolarHBondContact O-CE 3.21Å; E311-K313 WeakPolarHBondContact O-CG 3.43Å; E311-K313 PolarHBondContact O-N 2.62Å; E311-K313 PolarHBondContact O-NZ 2.92Å; K313-Y315 PolarHBondContact O-N 2.82Å
314	P	96.7	Very high	91.2	Very high	52 Å²	52	80.7 Å²	80.7	34%	0.338	42%	0.421	S	S	.	.			trans	-46.8	131.7	171.3	-34.3	39.5	0	0	0	113.6	E295 M298 K316	E295-P314 HydrophobicContact CG-CG 4.48Å; M298-P314 HydrophobicContact SD-CG 4.3Å; P314-K316 PolarHBondContact O-N 3.19Å
315	Y	96.9	Very high	90.9	Very high	55 Å²	55	84 Å²	84	22%	0.216	44%	0.443	C	S	.	.			trans	-72.8	119	-175.1	-178.8	-100.6	0	0	0	111.3	H108 P109 Y164 K313 E317 P318	H108-Y315 HydrophobicContact CB-CE1 4.41Å; H108-Y315 AromaticContact CD2-CD1 3.42Å; H108-Y315 VanDerWaalsContact CD2-CD1 3.42Å; H108-Y315 WeakPolarHBondContact CD2-CD1 3.48Å; H108-Y315 AromaticContact CD2-CD2 3.98Å; H108-Y315 AromaticContact CD2-CE1 3.9Å; H108-Y315 AromaticContact CD2-CG 3.44Å; H108-Y315 VanDerWaalsContact CD2-CG 3.44Å; H108-Y315 AromaticContact NE2-CG 3.81Å; P109-Y315 VanDerWaalsContact CD-CZ 3.5Å; P109-Y315 WeakPolarHBondContact CD-OH 3.49Å; P109-Y315 HydrophobicContact CG-CE2 4.09Å; Y164-Y315 AromaticContact CD2-CD1 3.73Å; Y164-Y315 HydrophobicContact CD2-CD1 3.73Å; Y164-Y315 HydrophobicContact CE2-CD1 4.01Å; Y164-Y315 HydrophobicContact CE2-CE1 4.39Å; Y164-Y315 HydrophobicContact CG-CD1 4.36Å; K313-Y315 PolarHBondContact O-N 2.82Å; Y315-E317 HydrophobicContact CE1-CB 4.3Å; Y315-P318 WeakPolarHBondContact OH-CD 3.36Å
316	K	94.7	Very high	90.6	Very high	186 Å²	186	89.8 Å²	89.8	81%	0.809	46%	0.461	S	S	*	.			trans	-89.6	113.2	171.6	-65.1	-175.1	179.8	-178.1	0	109	P314	P314-K316 PolarHBondContact O-N 3.19Å
317	E	91.6	Very high	90.5	Very high	64 Å²	64	89.6 Å²	89.6	30%	0.299	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-62.6	124.9	177.4	-168.7	175	154.7	0	0	110.5	N107 Y164 K168 Y315 R320	N107-E317 HydrophobicContact CB-CG 4.37Å; N107-E317 VanDerWaalsContact CB-OE1 3.3Å; N107-E317 WeakPolarHBondContact CB-OE1 3.48Å; N107-E317 WeakPolarHBondContact ND2-CG 3.3Å; N107-E317 PolarHBondContact ND2-OE1 2.64Å; Y164-E317 HydrophobicContact CE2-CB 4.19Å; Y164-E317 PolarHBondContact OH-OE2 2.95Å; K168-E317 VanDerWaalsContact CE-OE2 3.31Å; K168-E317 WeakPolarHBondContact CE-OE2 3.31Å; K168-E317 IonicContact NZ-OE2 2.67Å; K168-E317 PolarHBondContact NZ-OE2 2.76Å; Y315-E317 HydrophobicContact CE1-CB 4.3Å; E317-R320 IonicContact OE1-NE 2.69Å
318	P	88.5	Confident	90.4	Very high	73 Å²	73	88 Å²	88	47%	0.474	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-69.7	145.3	174.4	29.6	-34.3	0	0	0	110.1	Y315 R320	Y315-P318 WeakPolarHBondContact OH-CD 3.36Å; P318-R320 PolarHBondContact O-N 3.08Å
319	T	83.3	Confident	90.5	Very high	140 Å²	140	85.9 Å²	85.9	86%	0.859	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-56.3	123.4	170.2	48.1	0	0	0	0	109.7	D321	T319-D321 PolarHBondContact O-N 2.76Å; T319-D321 VanDerWaalsContact O-N 3.15Å
320	R	80.6	Confident	90.5	Very high	71 Å²	71	80.7 Å²	80.7	27%	0.268	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-59.5	117.7	177.6	-64.4	177.4	-178	-173.6	1.7	109	K104 E317 P318 L322 E348	K104-R320 PolarHBondContact O-NH2 3.38Å; E317-R320 IonicContact OE1-NE 2.69Å; P318-R320 PolarHBondContact O-N 3.08Å; R320-L322 HydrophobicContact CB-CD2 4.33Å; R320-L322 HydrophobicContact CB-CG 4.29Å; R320-L322 PolarHBondContact O-N 3.1Å; R320-E348 VanDerWaalsContact CD-OE1 3.27Å; R320-E348 WeakPolarHBondContact CD-OE1 3.49Å; R320-E348 IonicContact CZ-OE1 3.64Å; R320-E348 IonicContact CZ-OE2 2.69Å; R320-E348 IonicContact NE-OE1 3.44Å; R320-E348 IonicContact NH1-OE1 3.54Å; R320-E348 PolarHBondContact NH1-OE1 3.42Å; R320-E348 IonicContact NH1-OE2 3.51Å; R320-E348 PolarHBondContact NH1-OE2 3.44Å
321	D	80.4	Confident	90.5	Very high	86 Å²	86	76.2 Å²	76.2	46%	0.46	38%	0.38	S	S	.	.			trans	-73.5	98.9	172.4	178.2	13	0	0	0	109.1	T319 N323 D324 Y357	T319-D321 PolarHBondContact O-N 2.76Å; T319-D321 VanDerWaalsContact O-N 3.15Å; D321-N323 PolarHBondContact OD1-N 2.95Å; D321-D324 PolarHBondContact OD1-N 3.25Å; D321-Y357 WeakPolarHBondContact O-CE1 3.29Å; D321-Y357 PolarHBondContact O-OH 2.9Å
322	L	80.8	Confident	90.5	Very high	39 Å²	39	75.5 Å²	75.5	20%	0.204	38%	0.38	C	S	.	.			trans	-96.5	9.5	175.9	-58.8	175.7	0	0	0	112.2	R320 L345 Y357	R320-L322 HydrophobicContact CB-CD2 4.33Å; R320-L322 HydrophobicContact CB-CG 4.29Å; R320-L322 PolarHBondContact O-N 3.1Å; L322-L345 HydrophobicContact CB-CB 4.36Å; L322-L345 HydrophobicContact CD2-CB 4.31Å; L322-L345 HydrophobicContact CD2-CD2 4.13Å; L322-Y357 WeakPolarHBondContact CA-OH 3.33Å; L322-Y357 HydrophobicContact CD2-CE1 4.4Å
323	N	82.1	Confident	90.3	Very high	131 Å²	131	82.4 Å²	82.4	70%	0.701	41%	0.412	S	S	*	.			trans	-124.3	7.1	-169.8	-68.8	-42.1	0	0	0	114.4	D321 P325 Y357	D321-N323 PolarHBondContact OD1-N 2.95Å; N323-P325 WeakPolarHBondContact O-CD 3.31Å; N323-Y357 PolarHBondContact N-OH 3.02Å
324	D	89.4	Confident	90.1	Very high	8 Å²	8	80.3 Å²	80.3	4%	0.043	41%	0.405	C	S	.	.			trans	-57	106.9	179.4	-174.6	-19.4	0	0	0	110.4	D321 R326 R327 V328 Y357	D321-D324 PolarHBondContact OD1-N 3.25Å; D324-R326 PolarHBondContact O-N 2.96Å; D324-R326 WeakPolarHBondContact OD1-CB 3.33Å; D324-R326 IonicContact OD1-CZ 2.75Å; D324-R326 PolarHBondContact OD1-N 3.19Å; D324-R326 VanDerWaalsContact OD1-N 3.08Å; D324-R326 IonicContact OD1-NE 3.07Å; D324-R326 PolarHBondContact OD1-NE 3.01Å; D324-R326 IonicContact OD1-NH2 2.68Å; D324-R326 IonicContact OD2-CZ 3.7Å; D324-R326 IonicContact OD2-NE 2.64Å; D324-R326 IonicContact OD2-NH2 3.87Å; D324-R326 PolarHBondContact OD2-NH2 3.4Å; D324-R327 HydrophobicContact CB-CB 4.34Å; D324-R327 HydrophobicContact CB-CG 4Å; D324-R327 PolarHBondContact O-N 2.99Å; D324-R327 VanDerWaalsContact O-N 3.1Å; D324-R327 IonicContact OD2-CZ 2.63Å; D324-R327 IonicContact OD2-NE 3.62Å; D324-R327 PolarHBondContact OD2-NE 2.82Å; D324-R327 IonicContact OD2-NH2 3.51Å; D324-R327 PolarHBondContact OD2-NH2 2.69Å; D324-V328 PolarHBondContact O-N 2.69Å; D324-V328 VanDerWaalsContact O-N 3.14Å; D324-Y357 PolarHBondContact N-OH 3.26Å; D324-Y357 VanDerWaalsContact N-OH 3.16Å
325	P	90.4	Very high	90	Very high	87 Å²	87	80.9 Å²	80.9	57%	0.565	42%	0.42	S	S	*	.	H	α-helix	trans	-64.6	-23.1	-170.9	-22.8	35.3	0	0	0	112.5	N323 N329	N323-P325 WeakPolarHBondContact O-CD 3.31Å; P325-N329 VanDerWaalsContact O-CB 3.27Å; P325-N329 WeakPolarHBondContact O-CB 3.23Å; P325-N329 PolarHBondContact O-N 3.3Å; P325-N329 PolarHBondContact O-ND2 2.97Å
326	R	92.4	Very high	89.8	Confident	176 Å²	176	80.1 Å²	80.1	66%	0.664	42%	0.417	S	S	*	.	H	α-helix	trans	-69.8	-43.7	178.8	-56.9	168	-63.4	175.3	6.9	110.5	D324 N329 I330	D324-R326 PolarHBondContact O-N 2.96Å; D324-R326 WeakPolarHBondContact OD1-CB 3.33Å; D324-R326 IonicContact OD1-CZ 2.75Å; D324-R326 PolarHBondContact OD1-N 3.19Å; D324-R326 VanDerWaalsContact OD1-N 3.08Å; D324-R326 IonicContact OD1-NE 3.07Å; D324-R326 PolarHBondContact OD1-NE 3.01Å; D324-R326 IonicContact OD1-NH2 2.68Å; D324-R326 IonicContact OD2-CZ 3.7Å; D324-R326 IonicContact OD2-NE 2.64Å; D324-R326 IonicContact OD2-NH2 3.87Å; D324-R326 PolarHBondContact OD2-NH2 3.4Å; R326-N329 PolarHBondContact O-N 3.06Å; R326-I330 WeakPolarHBondContact O-CD1 3.34Å; R326-I330 VanDerWaalsContact O-CG1 3.28Å; R326-I330 WeakPolarHBondContact O-CG1 3.36Å; R326-I330 PolarHBondContact O-N 3.31Å
327	R	93.2	Very high	89.8	Confident	50 Å²	50	74.7 Å²	74.7	19%	0.189	40%	0.399	C	S	.	.	H	α-helix	trans	-68.2	-42.3	177.2	-58.6	178.8	-148.8	-174.2	1.5	111.1	D324 N329 I330 L331 Y357 L360 G361	D324-R327 HydrophobicContact CB-CB 4.34Å; D324-R327 HydrophobicContact CB-CG 4Å; D324-R327 PolarHBondContact O-N 2.99Å; D324-R327 VanDerWaalsContact O-N 3.1Å; D324-R327 IonicContact OD2-CZ 2.63Å; D324-R327 IonicContact OD2-NE 3.62Å; D324-R327 PolarHBondContact OD2-NE 2.82Å; D324-R327 IonicContact OD2-NH2 3.51Å; D324-R327 PolarHBondContact OD2-NH2 2.69Å; R327-N329 VanDerWaalsContact C-N 3.34Å; R327-N329 PolarHBondContact O-N 2.97Å; R327-I330 PolarHBondContact O-N 2.69Å; R327-L331 WeakPolarHBondContact O-CG 3.42Å; R327-L331 PolarHBondContact O-N 2.85Å; R327-Y357 HydrophobicContact CB-CD2 3.71Å; R327-Y357 HydrophobicContact CB-CE2 3.53Å; R327-Y357 HydrophobicContact CG-CE2 4.32Å; R327-L360 HydrophobicContact CG-CB 4.24Å; R327-G361 VanDerWaalsContact CZ-CA 3.44Å; R327-G361 VanDerWaalsContact NH1-CA 3.32Å
328	V	93	Very high	89.9	Confident	30 Å²	30	77.6 Å²	77.6	18%	0.182	41%	0.411	C	S	.	.	H	α-helix	trans	-60.5	-43.2	174.5	177.4	0	0	0	0	110.9	D324 L331 V332 I341 Y357	D324-V328 PolarHBondContact O-N 2.69Å; D324-V328 VanDerWaalsContact O-N 3.14Å; V328-L331 PolarHBondContact O-N 3.17Å; V328-V332 WeakPolarHBondContact O-CG2 3.11Å; V328-V332 PolarHBondContact O-N 3.06Å; V328-I341 HydrophobicContact CG1-CD1 4.38Å; V328-I341 HydrophobicContact CG1-CG2 4.42Å; V328-I341 HydrophobicContact CG2-CG2 4.31Å; V328-Y357 HydrophobicContact CG2-CE2 4.27Å
329	N	93.1	Very high	90.1	Very high	86 Å²	86	77.5 Å²	77.5	46%	0.46	42%	0.417	S	S	.	.	H	α-helix	trans	-64.7	-39.4	176.5	-73.2	-16.1	0	0	0	112.7	P325 R326 R327 V332 Q333	P325-N329 VanDerWaalsContact O-CB 3.27Å; P325-N329 WeakPolarHBondContact O-CB 3.23Å; P325-N329 PolarHBondContact O-N 3.3Å; P325-N329 PolarHBondContact O-ND2 2.97Å; R326-N329 PolarHBondContact O-N 3.06Å; R327-N329 VanDerWaalsContact C-N 3.34Å; R327-N329 PolarHBondContact O-N 2.97Å; N329-V332 PolarHBondContact O-N 2.81Å; N329-Q333 WeakPolarHBondContact O-CG 3.47Å; N329-Q333 PolarHBondContact O-N 3.26Å
330	I	92.8	Very high	90.6	Very high	60 Å²	60	75.4 Å²	75.4	31%	0.308	40%	0.397	S	S	.	.	H	α-helix	trans	-63.6	-42	174.6	-67.8	162.6	0	0	0	110.8	R326 R327 V332 Q333 M334 L360	R326-I330 WeakPolarHBondContact O-CD1 3.34Å; R326-I330 VanDerWaalsContact O-CG1 3.28Å; R326-I330 WeakPolarHBondContact O-CG1 3.36Å; R326-I330 PolarHBondContact O-N 3.31Å; R327-I330 PolarHBondContact O-N 2.69Å; I330-V332 VanDerWaalsContact C-N 3.33Å; I330-V332 PolarHBondContact O-N 2.92Å; I330-Q333 CarbonylContact O-C 3.59Å; I330-Q333 WeakPolarHBondContact O-CB 3.31Å; I330-Q333 PolarHBondContact O-N 2.96Å; I330-M334 HydrophobicContact CG2-CE 3.67Å; I330-M334 HydrophobicContact CG2-SD 4.16Å; I330-M334 WeakPolarHBondContact O-CG 3.4Å; I330-M334 PolarHBondContact O-N 3.48Å; I330-L360 HydrophobicContact CB-CD1 4.07Å; I330-L360 HydrophobicContact CD1-CD2 4.35Å; I330-L360 HydrophobicContact CG2-CD1 3.69Å; I330-L360 HydrophobicContact CG2-CD2 3.96Å
331	L	94	Very high	91.3	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-63.3	-37.8	175.2	-70.9	168.2	0	0	0	112.4	R327 V328 M334 G335 Y336 I341 T356 Y357 L360	R327-L331 WeakPolarHBondContact O-CG 3.42Å; R327-L331 PolarHBondContact O-N 2.85Å; V328-L331 PolarHBondContact O-N 3.17Å; L331-M334 CarbonylContact O-C 3.57Å; L331-M334 WeakPolarHBondContact O-CB 3.39Å; L331-M334 PolarHBondContact O-N 2.84Å; L331-G335 PolarHBondContact O-N 2.67Å; L331-Y336 HydrophobicContact CB-CD2 4.12Å; L331-Y336 HydrophobicContact CD2-CD2 3.73Å; L331-Y336 HydrophobicContact CD2-CE2 3.87Å; L331-Y336 WeakPolarHBondContact O-CD2 3.49Å; L331-Y336 PolarHBondContact O-N 3.23Å; L331-Y336 VanDerWaalsContact O-N 3.08Å; L331-I341 HydrophobicContact CB-CD1 3.52Å; L331-I341 HydrophobicContact CB-CG1 4.02Å; L331-I341 HydrophobicContact CD1-CD1 4.41Å; L331-I341 HydrophobicContact CD1-CG1 4.22Å; L331-I341 HydrophobicContact CD1-CG2 3.96Å; L331-T356 HydrophobicContact CD2-CG2 3.47Å; L331-T356 VanDerWaalsContact CD2-CG2 3.47Å; L331-Y357 HydrophobicContact CD1-CD2 3.85Å; L331-Y357 HydrophobicContact CD1-CG 4.42Å; L331-L360 HydrophobicContact CG-CD1 4.39Å
332	V	94.5	Very high	91.9	Very high	57 Å²	57	72.2 Å²	72.2	35%	0.345	38%	0.384	S	S	.	.	H	α-helix	trans	-65.5	-38.6	173.1	172	0	0	0	0	111.3	V328 N329 I330 M334 G335 Y336 K338 I341	V328-V332 WeakPolarHBondContact O-CG2 3.11Å; V328-V332 PolarHBondContact O-N 3.06Å; N329-V332 PolarHBondContact O-N 2.81Å; I330-V332 VanDerWaalsContact C-N 3.33Å; I330-V332 PolarHBondContact O-N 2.92Å; V332-M334 VanDerWaalsContact C-N 3.28Å; V332-M334 PolarHBondContact O-N 3.22Å; V332-G335 PolarHBondContact O-N 3.21Å; V332-Y336 WeakPolarHBondContact CA-O 3.3Å; V332-K338 HydrophobicContact CG2-CG 3.78Å; V332-I341 HydrophobicContact CG2-CD1 3.75Å
333	Q	92.3	Very high	92.5	Very high	164 Å²	164	74.1 Å²	74.1	77%	0.766	39%	0.394	S	S	*	.	H	α-helix	trans	-66.9	-27.3	172.7	-71.9	171.9	-20.8	0	0	113	N329 I330 G335	N329-Q333 WeakPolarHBondContact O-CG 3.47Å; N329-Q333 PolarHBondContact O-N 3.26Å; I330-Q333 CarbonylContact O-C 3.59Å; I330-Q333 WeakPolarHBondContact O-CB 3.31Å; I330-Q333 PolarHBondContact O-N 2.96Å; Q333-G335 PolarHBondContact O-N 2.83Å
334	M	92	Very high	93.1	Very high	72 Å²	72	67.9 Å²	67.9	36%	0.355	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-0.9	170.6	-68.3	172.6	175.2	0	0	113.5	P73 I330 L331 V332 Y336 T356	P73-M334 HydrophobicContact CB-CE 3.77Å; P73-M334 HydrophobicContact CB-SD 3.95Å; P73-M334 WeakPolarHBondContact O-CE 3.45Å; I330-M334 HydrophobicContact CG2-CE 3.67Å; I330-M334 HydrophobicContact CG2-SD 4.16Å; I330-M334 WeakPolarHBondContact O-CG 3.4Å; I330-M334 PolarHBondContact O-N 3.48Å; L331-M334 CarbonylContact O-C 3.57Å; L331-M334 WeakPolarHBondContact O-CB 3.39Å; L331-M334 PolarHBondContact O-N 2.84Å; V332-M334 VanDerWaalsContact C-N 3.28Å; V332-M334 PolarHBondContact O-N 3.22Å; M334-Y336 HydrophobicContact CB-CD2 4.11Å; M334-Y336 HydrophobicContact CB-CE2 4.11Å; M334-T356 HydrophobicContact SD-CG2 3.77Å
335	G	93.5	Very high	93.2	Very high	63 Å²	63	67.7 Å²	67.7	65%	0.649	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	97	-0.4	175	0	0	0	0	0	115.7	L331 V332 Q333	L331-G335 PolarHBondContact O-N 2.67Å; V332-G335 PolarHBondContact O-N 3.21Å; Q333-G335 PolarHBondContact O-N 2.83Å
336	Y	93.7	Very high	93.3	Very high	39 Å²	39	70.3 Å²	70.3	15%	0.153	37%	0.365	C	S	.	.			trans	-77	133.7	176.9	-57.6	-69.9	0	0	0	111.3	L331 V332 M334 D352 V353	L331-Y336 HydrophobicContact CB-CD2 4.12Å; L331-Y336 HydrophobicContact CD2-CD2 3.73Å; L331-Y336 HydrophobicContact CD2-CE2 3.87Å; L331-Y336 WeakPolarHBondContact O-CD2 3.49Å; L331-Y336 PolarHBondContact O-N 3.23Å; L331-Y336 VanDerWaalsContact O-N 3.08Å; V332-Y336 WeakPolarHBondContact CA-O 3.3Å; M334-Y336 HydrophobicContact CB-CD2 4.11Å; M334-Y336 HydrophobicContact CB-CE2 4.11Å; Y336-D352 PolarHBondContact OH-OD2 2.77Å; Y336-D352 VanDerWaalsContact OH-OD2 3.05Å; Y336-V353 HydrophobicContact CD1-CG2 3.54Å; Y336-V353 HydrophobicContact CE1-CG2 3.54Å; Y336-V353 HydrophobicContact CG-CG2 4.07Å
337	T	94.8	Very high	93.2	Very high	72 Å²	72	65 Å²	65	44%	0.442	36%	0.355	S	S	.	.			trans	-71.6	149.3	175.7	68.2	0	0	0	0	111.2	A339 Q340 I341	T337-A339 PolarHBondContact O-N 3.16Å; T337-A339 VanDerWaalsContact O-N 3.14Å; T337-Q340 PolarHBondContact O-N 3.13Å; T337-Q340 VanDerWaalsContact O-N 3.09Å; T337-Q340 VanDerWaalsContact OG1-CD 3.29Å; T337-Q340 WeakPolarHBondContact OG1-CG 3.45Å; T337-Q340 PolarHBondContact OG1-N 3.2Å; T337-Q340 PolarHBondContact OG1-OE1 3.38Å; T337-I341 WeakPolarHBondContact O-CG1 3.15Å; T337-I341 PolarHBondContact O-N 3.26Å
338	K	92.7	Very high	93.1	Very high	126 Å²	126	65.5 Å²	65.5	55%	0.548	36%	0.359	S	S	.	.	H	α-helix	trans	-55.4	-32.9	175.4	-68.8	-174.7	177.6	-178.6	0	112.8	V332 I342	V332-K338 HydrophobicContact CG2-CG 3.78Å; K338-I342 WeakPolarHBondContact O-CB 3.43Å; K338-I342 WeakPolarHBondContact O-CD1 3.5Å; K338-I342 WeakPolarHBondContact O-CG1 3.45Å; K338-I342 PolarHBondContact O-N 3.38Å
339	A	93.3	Very high	93.1	Very high	71 Å²	71	68 Å²	68	59%	0.587	37%	0.368	S	S	*	.	H	α-helix	trans	-64.9	-48.2	175.8	0	0	0	0	0	112.3	T337 I341 I342 D343	T337-A339 PolarHBondContact O-N 3.16Å; T337-A339 VanDerWaalsContact O-N 3.14Å; A339-I341 VanDerWaalsContact C-N 3.34Å; A339-I341 PolarHBondContact O-N 2.83Å; A339-I342 PolarHBondContact O-N 2.72Å; A339-D343 VanDerWaalsContact O-CB 3.29Å; A339-D343 WeakPolarHBondContact O-CB 3.39Å; A339-D343 PolarHBondContact O-N 3.41Å
340	Q	94.3	Very high	93.2	Very high	96 Å²	96	64.3 Å²	64.3	45%	0.449	35%	0.348	S	S	.	.	H	α-helix	trans	-61.6	-40.8	175.8	-71.5	160.7	-52.5	0	0	112	T337 S344	T337-Q340 PolarHBondContact O-N 3.13Å; T337-Q340 VanDerWaalsContact O-N 3.09Å; T337-Q340 VanDerWaalsContact OG1-CD 3.29Å; T337-Q340 WeakPolarHBondContact OG1-CG 3.45Å; T337-Q340 PolarHBondContact OG1-N 3.2Å; T337-Q340 PolarHBondContact OG1-OE1 3.38Å; Q340-S344 VanDerWaalsContact O-CB 3.22Å; Q340-S344 WeakPolarHBondContact O-CB 3.39Å; Q340-S344 PolarHBondContact O-N 3.2Å
341	I	94.1	Very high	93.3	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-61.7	-48.9	176.9	-62.1	162.1	0	0	0	110.5	V328 L331 V332 T337 A339 L345 V353	V328-I341 HydrophobicContact CG1-CD1 4.38Å; V328-I341 HydrophobicContact CG1-CG2 4.42Å; V328-I341 HydrophobicContact CG2-CG2 4.31Å; L331-I341 HydrophobicContact CB-CD1 3.52Å; L331-I341 HydrophobicContact CB-CG1 4.02Å; L331-I341 HydrophobicContact CD1-CD1 4.41Å; L331-I341 HydrophobicContact CD1-CG1 4.22Å; L331-I341 HydrophobicContact CD1-CG2 3.96Å; V332-I341 HydrophobicContact CG2-CD1 3.75Å; T337-I341 WeakPolarHBondContact O-CG1 3.15Å; T337-I341 PolarHBondContact O-N 3.26Å; A339-I341 VanDerWaalsContact C-N 3.34Å; A339-I341 PolarHBondContact O-N 2.83Å; I341-L345 HydrophobicContact CG2-CD1 3.69Å; I341-L345 HydrophobicContact CG2-CG 4.35Å; I341-L345 WeakPolarHBondContact O-CB 3.12Å; I341-L345 WeakPolarHBondContact O-CG 3.35Å; I341-L345 PolarHBondContact O-N 3.34Å; I341-V353 HydrophobicContact CB-CG1 4.43Å; I341-V353 HydrophobicContact CG1-CG1 4.09Å
342	I	92.6	Very high	93.4	Very high	88 Å²	88	66 Å²	66	45%	0.451	36%	0.357	S	S	.	.	H	α-helix	trans	-63.4	-45.4	180	-69.7	165.6	0	0	0	111.2	K338 A339 L345 Q346	K338-I342 WeakPolarHBondContact O-CB 3.43Å; K338-I342 WeakPolarHBondContact O-CD1 3.5Å; K338-I342 WeakPolarHBondContact O-CG1 3.45Å; K338-I342 PolarHBondContact O-N 3.38Å; A339-I342 PolarHBondContact O-N 2.72Å; I342-L345 PolarHBondContact O-N 2.87Å; I342-Q346 HydrophobicContact CG2-CG 4.16Å; I342-Q346 VanDerWaalsContact O-CB 3.26Å; I342-Q346 WeakPolarHBondContact O-CB 3.38Å; I342-Q346 VanDerWaalsContact O-CG 3.27Å; I342-Q346 WeakPolarHBondContact O-CG 3.35Å; I342-Q346 PolarHBondContact O-N 3.03Å
343	D	94.2	Very high	93.4	Very high	79 Å²	79	63.6 Å²	63.6	42%	0.422	34%	0.343	S	S	.	.	H	α-helix	trans	-61.2	-50.1	178.1	165.6	47.6	0	0	0	112.4	A339 L345 S347 K349	A339-D343 VanDerWaalsContact O-CB 3.29Å; A339-D343 WeakPolarHBondContact O-CB 3.39Å; A339-D343 PolarHBondContact O-N 3.41Å; D343-L345 PolarHBondContact O-N 2.91Å; D343-S347 PolarHBondContact O-N 2.7Å; D343-S347 PolarHBondContact O-OG 2.99Å; D343-K349 VanDerWaalsContact OD1-CE 3.28Å; D343-K349 WeakPolarHBondContact OD1-CE 3.21Å; D343-K349 IonicContact OD1-NZ 2.76Å; D343-K349 PolarHBondContact OD1-NZ 2.91Å; D343-K349 IonicContact OD2-NZ 2.77Å; D343-K349 PolarHBondContact OD2-NZ 3.05Å
344	S	94.5	Very high	93.6	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.007	31%	0.307	C	S	.	.	H	α-helix	trans	-58.1	-46.4	176.2	165.4	0	0	0	0	112.6	Q340 E348 K349 D351 F354	Q340-S344 VanDerWaalsContact O-CB 3.22Å; Q340-S344 WeakPolarHBondContact O-CB 3.39Å; Q340-S344 PolarHBondContact O-N 3.2Å; S344-E348 PolarHBondContact O-N 2.92Å; S344-K349 PolarHBondContact O-N 3.04Å; S344-D351 WeakPolarHBondContact CB-OD2 3.49Å; S344-D351 PolarHBondContact OG-OD1 3.39Å; S344-D351 PolarHBondContact OG-OD2 3.26Å; S344-F354 WeakPolarHBondContact OG-CB 3.32Å; S344-F354 PolarHBondContact OG-N 3.33Å
345	L	92.8	Very high	93.7	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-71.6	-46.1	-178.5	-66.2	176.9	0	0	0	112.6	L322 I341 I342 D343 S347 E348 F354 Y357	L322-L345 HydrophobicContact CB-CB 4.36Å; L322-L345 HydrophobicContact CD2-CB 4.31Å; L322-L345 HydrophobicContact CD2-CD2 4.13Å; I341-L345 HydrophobicContact CG2-CD1 3.69Å; I341-L345 HydrophobicContact CG2-CG 4.35Å; I341-L345 WeakPolarHBondContact O-CB 3.12Å; I341-L345 WeakPolarHBondContact O-CG 3.35Å; I341-L345 PolarHBondContact O-N 3.34Å; I342-L345 PolarHBondContact O-N 2.87Å; D343-L345 PolarHBondContact O-N 2.91Å; L345-S347 VanDerWaalsContact C-N 3.35Å; L345-S347 PolarHBondContact O-N 3.09Å; L345-E348 PolarHBondContact O-N 3.44Å; L345-F354 HydrophobicContact CD2-CD2 3.87Å; L345-F354 HydrophobicContact CD2-CE2 4.28Å; L345-Y357 HydrophobicContact CD1-CD1 4.47Å; L345-Y357 HydrophobicContact CD1-CD2 3.83Å; L345-Y357 HydrophobicContact CD1-CE2 3.94Å; L345-Y357 HydrophobicContact CD1-CG 4.12Å; L345-Y357 HydrophobicContact CD2-CD1 3.58Å; L345-Y357 HydrophobicContact CD2-CD2 4.13Å; L345-Y357 HydrophobicContact CD2-CE1 4.22Å; L345-Y357 HydrophobicContact CD2-CG 3.55Å; L345-Y357 HydrophobicContact CG-CG 4.48Å
346	Q	91	Very high	93.8	Very high	142 Å²	142	49.4 Å²	49.4	66%	0.664	26%	0.259	S	S	*	.	H	α-helix	trans	-71.1	-26.8	-175.7	-72.8	-174.9	-2.6	0	0	114.1	I342	I342-Q346 HydrophobicContact CG2-CG 4.16Å; I342-Q346 VanDerWaalsContact O-CB 3.26Å; I342-Q346 WeakPolarHBondContact O-CB 3.38Å; I342-Q346 VanDerWaalsContact O-CG 3.27Å; I342-Q346 WeakPolarHBondContact O-CG 3.35Å; I342-Q346 PolarHBondContact O-N 3.03Å
347	S	90.6	Very high	93.9	Very high	64 Å²	64	47.6 Å²	47.6	45%	0.448	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	0.9	177.1	62.8	0	0	0	0	113.9	D343 L345 K349	D343-S347 PolarHBondContact O-N 2.7Å; D343-S347 PolarHBondContact O-OG 2.99Å; L345-S347 VanDerWaalsContact C-N 3.35Å; L345-S347 PolarHBondContact O-N 3.09Å; S347-K349 PolarHBondContact O-N 3.4Å; S347-K349 WeakPolarHBondContact OG-CE 3.46Å; S347-K349 VanDerWaalsContact OG-CG 3.23Å; S347-K349 WeakPolarHBondContact OG-CG 3.47Å
348	E	91.5	Very high	93.8	Very high	61 Å²	61	45.3 Å²	45.3	29%	0.285	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	59	180	-52.9	-159.7	144.8	0	0	113.1	R320 S344 L345 F350 F354	R320-E348 VanDerWaalsContact CD-OE1 3.27Å; R320-E348 WeakPolarHBondContact CD-OE1 3.49Å; R320-E348 IonicContact CZ-OE1 3.64Å; R320-E348 IonicContact CZ-OE2 2.69Å; R320-E348 IonicContact NE-OE1 3.44Å; R320-E348 IonicContact NH1-OE1 3.54Å; R320-E348 PolarHBondContact NH1-OE1 3.42Å; R320-E348 IonicContact NH1-OE2 3.51Å; R320-E348 PolarHBondContact NH1-OE2 3.44Å; S344-E348 PolarHBondContact O-N 2.92Å; L345-E348 PolarHBondContact O-N 3.44Å; E348-F350 VanDerWaalsContact C-N 3.3Å; E348-F350 HydrophobicContact CB-CE2 4.11Å; E348-F350 WeakPolarHBondContact O-CD2 3.4Å; E348-F350 PolarHBondContact O-N 3.07Å; E348-F354 HydrophobicContact CB-CE2 3.98Å; E348-F354 HydrophobicContact CB-CZ 4Å; E348-F354 HydrophobicContact CG-CE2 4.04Å; E348-F354 HydrophobicContact CG-CZ 4.15Å
349	K	93.1	Very high	93.9	Very high	82 Å²	82	39.4 Å²	39.4	36%	0.357	21%	0.211	S	C	.	.			trans	-65.7	-32.1	-172.9	-62.2	-167.2	-178.4	-175.5	0	113.2	K104 D343 S344 S347 D351	K104-K349 PolarHBondContact NZ-O 3.36Å; D343-K349 VanDerWaalsContact OD1-CE 3.28Å; D343-K349 WeakPolarHBondContact OD1-CE 3.21Å; D343-K349 IonicContact OD1-NZ 2.76Å; D343-K349 PolarHBondContact OD1-NZ 2.91Å; D343-K349 IonicContact OD2-NZ 2.77Å; D343-K349 PolarHBondContact OD2-NZ 3.05Å; S344-K349 PolarHBondContact O-N 3.04Å; S347-K349 PolarHBondContact O-N 3.4Å; S347-K349 WeakPolarHBondContact OG-CE 3.46Å; S347-K349 VanDerWaalsContact OG-CG 3.23Å; S347-K349 WeakPolarHBondContact OG-CG 3.47Å; K349-D351 VanDerWaalsContact C-N 3.26Å; K349-D351 HydrophobicContact CB-CB 4.13Å; K349-D351 WeakPolarHBondContact CB-OD2 3.5Å; K349-D351 WeakPolarHBondContact CD-OD2 3.47Å
350	F	95.2	Very high	93.9	Very high	9 Å²	9	37.7 Å²	37.7	4%	0.039	19%	0.192	C	C	.	.			trans	57.4	42.1	-163.5	-61.9	-104.5	0	0	0	111.3	K104 L114 Q116 V117 E348 F354	K104-F350 HydrophobicContact CB-CD2 4.3Å; K104-F350 HydrophobicContact CB-CE2 3.65Å; K104-F350 HydrophobicContact CB-CZ 3.86Å; K104-F350 HydrophobicContact CD-CD2 3.5Å; K104-F350 VanDerWaalsContact CD-CD2 3.5Å; K104-F350 HydrophobicContact CD-CE2 3.68Å; K104-F350 HydrophobicContact CD-CG 4.28Å; K104-F350 HydrophobicContact CG-CD1 4.48Å; K104-F350 HydrophobicContact CG-CD2 3.59Å; K104-F350 HydrophobicContact CG-CE1 4.36Å; K104-F350 HydrophobicContact CG-CE2 3.46Å; K104-F350 VanDerWaalsContact CG-CE2 3.46Å; K104-F350 HydrophobicContact CG-CG 4.13Å; K104-F350 HydrophobicContact CG-CZ 3.87Å; L114-F350 HydrophobicContact CB-CD1 4.3Å; L114-F350 HydrophobicContact CB-CE1 4.05Å; L114-F350 HydrophobicContact CD2-CD1 3.78Å; L114-F350 HydrophobicContact CD2-CE1 3.97Å; L114-F350 HydrophobicContact CD2-CG 4.36Å; L114-F350 HydrophobicContact CG-CD1 3.83Å; L114-F350 HydrophobicContact CG-CE1 4.08Å; L114-F350 WeakPolarHBondContact O-CE1 3.43Å; Q116-F350 WeakPolarHBondContact CA-O 3.48Å; Q116-F350 WeakPolarHBondContact CG-O 3.4Å; V117-F350 HydrophobicContact CG2-CB 4.28Å; V117-F350 PolarHBondContact N-O 3Å; E348-F350 VanDerWaalsContact C-N 3.3Å; E348-F350 HydrophobicContact CB-CE2 4.11Å; E348-F350 WeakPolarHBondContact O-CD2 3.4Å; E348-F350 PolarHBondContact O-N 3.07Å; F350-F354 HydrophobicContact CB-CD1 4.41Å; F350-F354 AromaticContact CD1-CD1 3.98Å; F350-F354 HydrophobicContact CD1-CD1 3.98Å; F350-F354 AromaticContact CD1-CE1 3.8Å; F350-F354 HydrophobicContact CD1-CE1 3.8Å; F350-F354 HydrophobicContact CD2-CD1 4.35Å; F350-F354 HydrophobicContact CD2-CE1 4.06Å; F350-F354 HydrophobicContact CE1-CD1 4.33Å; F350-F354 AromaticContact CE1-CE1 3.68Å; F350-F354 HydrophobicContact CE1-CE1 3.68Å; F350-F354 AromaticContact CE2-CE1 3.93Å; F350-F354 HydrophobicContact CE2-CE1 3.93Å; F350-F354 HydrophobicContact CE2-CZ 4.3Å; F350-F354 AromaticContact CG-CD1 3.99Å; F350-F354 HydrophobicContact CG-CD1 3.99Å; F350-F354 AromaticContact CG-CE1 3.99Å; F350-F354 HydrophobicContact CG-CE1 3.99Å; F350-F354 AromaticContact CZ-CE1 3.74Å; F350-F354 HydrophobicContact CZ-CE1 3.74Å; F350-F354 HydrophobicContact CZ-CZ 4.29Å
351	D	95.4	Very high	93.5	Very high	38 Å²	38	34.5 Å²	34.5	20%	0.203	18%	0.184	C	C	.	.	S	Bend	trans	-88.5	-174.4	167.5	59	19.2	0	0	0	111.1	Q116 S344 K349 V353 F354 A355	Q116-D351 WeakPolarHBondContact CG-O 3.21Å; S344-D351 WeakPolarHBondContact CB-OD2 3.49Å; S344-D351 PolarHBondContact OG-OD1 3.39Å; S344-D351 PolarHBondContact OG-OD2 3.26Å; K349-D351 VanDerWaalsContact C-N 3.26Å; K349-D351 HydrophobicContact CB-CB 4.13Å; K349-D351 WeakPolarHBondContact CB-OD2 3.5Å; K349-D351 WeakPolarHBondContact CD-OD2 3.47Å; D351-V353 VanDerWaalsContact C-N 3.34Å; D351-V353 PolarHBondContact OD1-N 3.18Å; D351-F354 PolarHBondContact O-N 3.44Å; D351-F354 VanDerWaalsContact OD1-CB 3.29Å; D351-F354 WeakPolarHBondContact OD1-CB 3.37Å; D351-F354 PolarHBondContact OD1-N 3.08Å; D351-A355 VanDerWaalsContact O-CB 3.26Å; D351-A355 WeakPolarHBondContact O-CB 3.46Å; D351-A355 PolarHBondContact O-N 3.19Å
352	D	94.6	Very high	92.8	Very high	56 Å²	56	37.1 Å²	37.1	30%	0.299	20%	0.196	S	C	.	.	H	α-helix	trans	-66.6	-33.9	-178.3	62.1	-39.8	0	0	0	112.9	Q116 Y336 T356	Q116-D352 VanDerWaalsContact NE2-N 3.19Å; Y336-D352 PolarHBondContact OH-OD2 2.77Å; Y336-D352 VanDerWaalsContact OH-OD2 3.05Å; D352-T356 VanDerWaalsContact O-CB 3.24Å; D352-T356 WeakPolarHBondContact O-CB 3.41Å; D352-T356 PolarHBondContact O-N 3.46Å; D352-T356 PolarHBondContact O-OG1 3.16Å
353	V	95.7	Very high	91.2	Very high	8 Å²	8	42 Å²	42	5%	0.048	22%	0.217	C	C	.	.	H	α-helix	trans	-64.5	-49.6	173.9	-178.4	0	0	0	0	110.6	Y336 I341 D351 T356 Y357	Y336-V353 HydrophobicContact CD1-CG2 3.54Å; Y336-V353 HydrophobicContact CE1-CG2 3.54Å; Y336-V353 HydrophobicContact CG-CG2 4.07Å; I341-V353 HydrophobicContact CB-CG1 4.43Å; I341-V353 HydrophobicContact CG1-CG1 4.09Å; D351-V353 VanDerWaalsContact C-N 3.34Å; D351-V353 PolarHBondContact OD1-N 3.18Å; V353-T356 PolarHBondContact O-N 3.22Å; V353-Y357 PolarHBondContact O-N 3.18Å
354	F	95.2	Very high	88.9	Confident	1 Å²	1	40.9 Å²	40.9	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-46.7	178	-165.2	-98.6	0	0	0	111.2	S344 L345 E348 F350 D351 T356 Y357 L358	S344-F354 WeakPolarHBondContact OG-CB 3.32Å; S344-F354 PolarHBondContact OG-N 3.33Å; L345-F354 HydrophobicContact CD2-CD2 3.87Å; L345-F354 HydrophobicContact CD2-CE2 4.28Å; E348-F354 HydrophobicContact CB-CE2 3.98Å; E348-F354 HydrophobicContact CB-CZ 4Å; E348-F354 HydrophobicContact CG-CE2 4.04Å; E348-F354 HydrophobicContact CG-CZ 4.15Å; F350-F354 HydrophobicContact CB-CD1 4.41Å; F350-F354 AromaticContact CD1-CD1 3.98Å; F350-F354 HydrophobicContact CD1-CD1 3.98Å; F350-F354 AromaticContact CD1-CE1 3.8Å; F350-F354 HydrophobicContact CD1-CE1 3.8Å; F350-F354 HydrophobicContact CD2-CD1 4.35Å; F350-F354 HydrophobicContact CD2-CE1 4.06Å; F350-F354 HydrophobicContact CE1-CD1 4.33Å; F350-F354 AromaticContact CE1-CE1 3.68Å; F350-F354 HydrophobicContact CE1-CE1 3.68Å; F350-F354 AromaticContact CE2-CE1 3.93Å; F350-F354 HydrophobicContact CE2-CE1 3.93Å; F350-F354 HydrophobicContact CE2-CZ 4.3Å; F350-F354 AromaticContact CG-CD1 3.99Å; F350-F354 HydrophobicContact CG-CD1 3.99Å; F350-F354 AromaticContact CG-CE1 3.99Å; F350-F354 HydrophobicContact CG-CE1 3.99Å; F350-F354 AromaticContact CZ-CE1 3.74Å; F350-F354 HydrophobicContact CZ-CE1 3.74Å; F350-F354 HydrophobicContact CZ-CZ 4.29Å; D351-F354 PolarHBondContact O-N 3.44Å; D351-F354 VanDerWaalsContact OD1-CB 3.29Å; D351-F354 WeakPolarHBondContact OD1-CB 3.37Å; D351-F354 PolarHBondContact OD1-N 3.08Å; F354-T356 PolarHBondContact O-N 2.86Å; F354-Y357 PolarHBondContact O-N 2.97Å; F354-L358 HydrophobicContact CD1-CD1 3.77Å; F354-L358 HydrophobicContact CD1-CG 4.37Å; F354-L358 HydrophobicContact CE1-CD1 3.5Å; F354-L358 VanDerWaalsContact CE1-CD1 3.5Å; F354-L358 HydrophobicContact CE1-CG 4.26Å; F354-L358 HydrophobicContact CZ-CD1 4.3Å; F354-L358 WeakPolarHBondContact O-CG 3.48Å; F354-L358 PolarHBondContact O-N 3.24Å
355	A	95.4	Very high	85.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-43.6	177.6	0	0	0	0	0	111.9	Y115 Q116 D351 L358 L359	Y115-A355 WeakPolarHBondContact O-CB 3.43Å; Q116-A355 HydrophobicContact CB-CB 3.76Å; Q116-A355 HydrophobicContact CG-CB 4.05Å; D351-A355 VanDerWaalsContact O-CB 3.26Å; D351-A355 WeakPolarHBondContact O-CB 3.46Å; D351-A355 PolarHBondContact O-N 3.19Å; A355-L358 PolarHBondContact O-N 3.02Å; A355-L359 VanDerWaalsContact O-CB 3.32Å; A355-L359 WeakPolarHBondContact O-CB 3.49Å; A355-L359 VanDerWaalsContact O-CG 3.23Å; A355-L359 WeakPolarHBondContact O-CG 3.4Å; A355-L359 PolarHBondContact O-N 3.43Å
356	T	95.6	Very high	83	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.5	-44.5	177.5	-57.1	0	0	0	0	111.1	H71 P73 T74 L331 M334 D352 V353 F354 L358 L359 L360	H71-T356 PolarHBondContact CE1-OG1 3.14Å; H71-T356 VanDerWaalsContact CE1-OG1 3.3Å; P73-T356 HydrophobicContact CB-CG2 4.46Å; T74-T356 HydrophobicContact CG2-CG2 4Å; L331-T356 HydrophobicContact CD2-CG2 3.47Å; L331-T356 VanDerWaalsContact CD2-CG2 3.47Å; M334-T356 HydrophobicContact SD-CG2 3.77Å; D352-T356 VanDerWaalsContact O-CB 3.24Å; D352-T356 WeakPolarHBondContact O-CB 3.41Å; D352-T356 PolarHBondContact O-N 3.46Å; D352-T356 PolarHBondContact O-OG1 3.16Å; V353-T356 PolarHBondContact O-N 3.22Å; F354-T356 PolarHBondContact O-N 2.86Å; T356-L358 VanDerWaalsContact C-N 3.34Å; T356-L358 PolarHBondContact O-N 2.84Å; T356-L359 PolarHBondContact O-N 2.9Å; T356-L360 HydrophobicContact CG2-CD1 4.13Å; T356-L360 HydrophobicContact CG2-CG 4.43Å; T356-L360 WeakPolarHBondContact O-CB 3.23Å; T356-L360 VanDerWaalsContact O-CG 3.28Å; T356-L360 WeakPolarHBondContact O-CG 3.42Å; T356-L360 PolarHBondContact O-N 3.22Å
357	Y	94.8	Very high	80	Confident	1 Å²	1	51.2 Å²	51.2	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-58.1	-43.6	176.1	-176.1	-92.9	0	0	0	112.7	D321 L322 N323 D324 R327 V328 L331 L345 V353 F354 G361	D321-Y357 WeakPolarHBondContact O-CE1 3.29Å; D321-Y357 PolarHBondContact O-OH 2.9Å; L322-Y357 WeakPolarHBondContact CA-OH 3.33Å; L322-Y357 HydrophobicContact CD2-CE1 4.4Å; N323-Y357 PolarHBondContact N-OH 3.02Å; D324-Y357 PolarHBondContact N-OH 3.26Å; D324-Y357 VanDerWaalsContact N-OH 3.16Å; R327-Y357 HydrophobicContact CB-CD2 3.71Å; R327-Y357 HydrophobicContact CB-CE2 3.53Å; R327-Y357 HydrophobicContact CG-CE2 4.32Å; V328-Y357 HydrophobicContact CG2-CE2 4.27Å; L331-Y357 HydrophobicContact CD1-CD2 3.85Å; L331-Y357 HydrophobicContact CD1-CG 4.42Å; L345-Y357 HydrophobicContact CD1-CD1 4.47Å; L345-Y357 HydrophobicContact CD1-CD2 3.83Å; L345-Y357 HydrophobicContact CD1-CE2 3.94Å; L345-Y357 HydrophobicContact CD1-CG 4.12Å; L345-Y357 HydrophobicContact CD2-CD1 3.58Å; L345-Y357 HydrophobicContact CD2-CD2 4.13Å; L345-Y357 HydrophobicContact CD2-CE1 4.22Å; L345-Y357 HydrophobicContact CD2-CG 3.55Å; L345-Y357 HydrophobicContact CG-CG 4.48Å; V353-Y357 PolarHBondContact O-N 3.18Å; F354-Y357 PolarHBondContact O-N 2.97Å; Y357-G361 PolarHBondContact O-N 3.4Å
358	L	93.7	Very high	77.3	Confident	23 Å²	23	56.5 Å²	56.5	12%	0.12	29%	0.291	C	S	.	.	H	α-helix	trans	-68.3	-43.9	177.1	-69	-179.5	0	0	0	112.1	Y115 F354 A355 T356 L360 G361 E362	Y115-L358 HydrophobicContact CD1-CB 3.75Å; Y115-L358 HydrophobicContact CD1-CD1 4.02Å; Y115-L358 HydrophobicContact CE1-CB 4.08Å; F354-L358 HydrophobicContact CD1-CD1 3.77Å; F354-L358 HydrophobicContact CD1-CG 4.37Å; F354-L358 HydrophobicContact CE1-CD1 3.5Å; F354-L358 VanDerWaalsContact CE1-CD1 3.5Å; F354-L358 HydrophobicContact CE1-CG 4.26Å; F354-L358 HydrophobicContact CZ-CD1 4.3Å; F354-L358 WeakPolarHBondContact O-CG 3.48Å; F354-L358 PolarHBondContact O-N 3.24Å; A355-L358 PolarHBondContact O-N 3.02Å; T356-L358 VanDerWaalsContact C-N 3.34Å; T356-L358 PolarHBondContact O-N 2.84Å; L358-L360 VanDerWaalsContact C-N 3.3Å; L358-L360 PolarHBondContact O-N 3.32Å; L358-G361 WeakPolarHBondContact O-CA 3.21Å; L358-G361 PolarHBondContact O-N 3.08Å; L358-E362 PolarHBondContact O-N 2.8Å
359	L	94.5	Very high	74.2	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-71.1	-21.4	-178.5	-71.3	170.2	0	0	0	114	F52 H71 T74 R76 V78 Y115 A355 T356 G361	F52-L359 HydrophobicContact CE1-CD1 4.32Å; H71-L359 HydrophobicContact CB-CD1 3.99Å; T74-L359 HydrophobicContact CG2-CB 4.17Å; R76-L359 HydrophobicContact CB-CD2 4.07Å; R76-L359 HydrophobicContact CG-CB 4.31Å; R76-L359 HydrophobicContact CG-CD2 4.34Å; V78-L359 HydrophobicContact CG1-CD1 4.2Å; V78-L359 HydrophobicContact CG1-CD2 3.81Å; Y115-L359 HydrophobicContact CD1-CD2 4.14Å; Y115-L359 HydrophobicContact CD1-CG 4.21Å; Y115-L359 HydrophobicContact CD2-CD2 3.76Å; Y115-L359 HydrophobicContact CD2-CG 4.35Å; Y115-L359 HydrophobicContact CE1-CD2 3.97Å; Y115-L359 HydrophobicContact CE1-CG 4.42Å; Y115-L359 HydrophobicContact CE2-CD2 3.56Å; Y115-L359 HydrophobicContact CG-CD2 4.04Å; Y115-L359 HydrophobicContact CG-CG 4.18Å; A355-L359 VanDerWaalsContact O-CB 3.32Å; A355-L359 WeakPolarHBondContact O-CB 3.49Å; A355-L359 VanDerWaalsContact O-CG 3.23Å; A355-L359 WeakPolarHBondContact O-CG 3.4Å; A355-L359 PolarHBondContact O-N 3.43Å; T356-L359 PolarHBondContact O-N 2.9Å; L359-G361 VanDerWaalsContact C-N 3.31Å
360	L	92.9	Very high	71.4	Confident	35 Å²	35	63.6 Å²	63.6	18%	0.183	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-20.1	165.7	-73.2	170.6	0	0	0	112.9	T74 R327 I330 L331 T356 L358	T74-L360 HydrophobicContact CG2-CD2 3.74Å; T74-L360 HydrophobicContact CG2-CG 3.77Å; R327-L360 HydrophobicContact CG-CB 4.24Å; I330-L360 HydrophobicContact CB-CD1 4.07Å; I330-L360 HydrophobicContact CD1-CD2 4.35Å; I330-L360 HydrophobicContact CG2-CD1 3.69Å; I330-L360 HydrophobicContact CG2-CD2 3.96Å; L331-L360 HydrophobicContact CG-CD1 4.39Å; T356-L360 HydrophobicContact CG2-CD1 4.13Å; T356-L360 HydrophobicContact CG2-CG 4.43Å; T356-L360 WeakPolarHBondContact O-CB 3.23Å; T356-L360 VanDerWaalsContact O-CG 3.28Å; T356-L360 WeakPolarHBondContact O-CG 3.42Å; T356-L360 PolarHBondContact O-N 3.22Å; L358-L360 VanDerWaalsContact C-N 3.3Å; L358-L360 PolarHBondContact O-N 3.32Å
361	G	85.7	Confident	68.3	Low	28 Å²	28	69.1 Å²	69.1	29%	0.289	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-24.2	-175.6	0	0	0	0	0	115.4	R327 Y357 L358 L359	R327-G361 VanDerWaalsContact CZ-CA 3.44Å; R327-G361 VanDerWaalsContact NH1-CA 3.32Å; Y357-G361 PolarHBondContact O-N 3.4Å; L358-G361 WeakPolarHBondContact O-CA 3.21Å; L358-G361 PolarHBondContact O-N 3.08Å; L359-G361 VanDerWaalsContact C-N 3.31Å
362	E	78.9	Confident	65.1	Low	56 Å²	56	77.8 Å²	77.8	26%	0.262	40%	0.399	S	S	.	.	S	Bend	trans	-65.4	138.2	167.9	-53.1	-55.7	143.5	0	0	109	R76 K113 L358 V364	R76-E362 PolarHBondContact NH2-O 2.96Å; K113-E362 IonicContact NZ-OE1 3.67Å; K113-E362 PolarHBondContact NZ-OE1 3.48Å; L358-E362 PolarHBondContact O-N 2.8Å; E362-V364 VanDerWaalsContact O-CG2 3.28Å; E362-V364 WeakPolarHBondContact O-CG2 3.24Å; E362-V364 PolarHBondContact O-N 3.13Å; E362-V364 VanDerWaalsContact O-N 3.09Å
363	E	59.1	Low	62.1	Low	191 Å²	191	79.4 Å²	79.4	89%	0.893	42%	0.415	S	S	*	.			trans	-62.1	112.5	-174.4	-70.7	-164.4	144.8	0	0	113.2	R76	R76-E363 PolarHBondContact NH2-O 3.42Å
364	V	46.3	Very low	58.8	Low	56 Å²	56	84.4 Å²	84.4	34%	0.339	45%	0.448	S	S	.	.			trans	-95.9	118.6	-175.4	-153.3	0	0	0	0	110.1	E362 I366	E362-V364 VanDerWaalsContact O-CG2 3.28Å; E362-V364 WeakPolarHBondContact O-CG2 3.24Å; E362-V364 PolarHBondContact O-N 3.13Å; E362-V364 VanDerWaalsContact O-N 3.09Å; V364-I366 HydrophobicContact CB-CD1 3.95Å; V364-I366 HydrophobicContact CB-CG1 3.78Å; V364-I366 HydrophobicContact CG1-CD1 4.02Å; V364-I366 HydrophobicContact CG1-CG1 3.53Å; V364-I366 HydrophobicContact CG2-CD1 4.44Å; V364-I366 PolarHBondContact O-N 2.94Å
365	V	31.5	Very low	55.6	Low	134 Å²	134	92.1 Å²	92.1	81%	0.812	49%	0.485	S	S	*	.			trans	-73.4	75.7	165.2	-175.1	0	0	0	0	108.4	L367	V365-L367 PolarHBondContact O-N 2.88Å; V365-L367 VanDerWaalsContact O-N 3.16Å
366	I	33.1	Very low	52.3	Low	105 Å²	105	102.1 Å²	102.1	54%	0.538	52%	0.524	S	S	.	.			trans	-76.8	98.8	176.1	-75	169.9	0	0	0	108.8	V364 F368	V364-I366 HydrophobicContact CB-CD1 3.95Å; V364-I366 HydrophobicContact CB-CG1 3.78Å; V364-I366 HydrophobicContact CG1-CD1 4.02Å; V364-I366 HydrophobicContact CG1-CG1 3.53Å; V364-I366 HydrophobicContact CG2-CD1 4.44Å; V364-I366 PolarHBondContact O-N 2.94Å; I366-F368 HydrophobicContact CG1-CD2 4.44Å; I366-F368 HydrophobicContact CG2-CB 3.62Å; I366-F368 HydrophobicContact CG2-CD2 3.67Å; I366-F368 HydrophobicContact CG2-CG 3.98Å; I366-F368 PolarHBondContact O-N 2.89Å
367	L	27.7	Very low	49.3	Very low	125 Å²	125	109.2 Å²	109.2	65%	0.654	56%	0.56	S	S	*	*			trans	-87.9	65.5	155.7	-62.8	-171.4	0	0	0	109.4	V365 M496	V365-L367 PolarHBondContact O-N 2.88Å; V365-L367 VanDerWaalsContact O-N 3.16Å; L367-M496 HydrophobicContact CB-CE 4.49Å; L367-M496 HydrophobicContact CD1-CE 4.13Å; L367-M496 HydrophobicContact CD2-CE 3.65Å; L367-M496 HydrophobicContact CG-CE 4.3Å
368	F	33	Very low	46.1	Very low	174 Å²	174	113.6 Å²	113.6	76%	0.763	59%	0.587	S	S	*	*			trans	-115.3	66.5	164.7	-63.5	-49.2	0	0	0	110.1	I366 Y370	I366-F368 HydrophobicContact CG1-CD2 4.44Å; I366-F368 HydrophobicContact CG2-CB 3.62Å; I366-F368 HydrophobicContact CG2-CD2 3.67Å; I366-F368 HydrophobicContact CG2-CG 3.98Å; I366-F368 PolarHBondContact O-N 2.89Å; F368-Y370 VanDerWaalsContact C-N 3.33Å
369	A	27.7	Very low	43.1	Very low	84 Å²	84	119.4 Å²	119.4	69%	0.694	62%	0.617	S	S	*	*			trans	-89.1	81.6	144.1	0	0	0	0	0	107
370	Y	34.1	Very low	40.1	Very low	208 Å²	208	125.5 Å²	125.5	82%	0.816	65%	0.65	S	S	*	*	S	Bend	trans	-157.9	130.8	155.4	-105.6	-63.8	0	0	0	109.5	F368	F368-Y370 VanDerWaalsContact C-N 3.33Å
371	D	28.5	Very low	37.1	Very low	125 Å²	125	129.4 Å²	129.4	67%	0.668	68%	0.68	S	S	*	*			trans	-61.9	147.5	-155.9	-47.9	-75.2	0	0	0	115.9
372	F	29.1	Very low	34.6	Very low	220 Å²	220	132.3 Å²	132.3	97%	0.965	70%	0.701	S	S	*	*			trans	-141.2	67.3	153	-129.7	-84.1	0	0	0	110.7
373	S	30.6	Very low	32.3	Very low	91 Å²	91	135.7 Å²	135.7	64%	0.636	73%	0.729	S	S	*	*			trans	-122.4	109.1	173.1	56.6	0	0	0	0	109.9
374	C	26.8	Very low	30.9	Very low	112 Å²	112	130.7 Å²	130.7	76%	0.757	73%	0.73	S	S	*	*			trans	64.6	156.7	177.9	-59.4	0	0	0	0	115
375	E	29	Very low	30.3	Very low	164 Å²	164	132 Å²	132	77%	0.766	76%	0.755	S	S	*	*			cis	-145.5	158.7	-3.8	-140.4	156.9	-144.1	0	0	111.5
376	Y	25.8	Very low	30.3	Very low	210 Å²	210	130.3 Å²	130.3	82%	0.824	75%	0.754	S	S	*	*			trans	-103.3	97.3	177.2	-178	-86.5	0	0	0	109.6	V378	Y376-V378 HydrophobicContact CE1-CG2 4.1Å
377	I	32.4	Very low	30.6	Very low	148 Å²	148	131 Å²	131	76%	0.759	77%	0.766	S	S	*	*			trans	-132.3	133.7	166.9	-63	-175.2	0	0	0	109.4
378	V	28.7	Very low	30.9	Very low	93 Å²	93	130.9 Å²	130.9	56%	0.564	78%	0.775	S	S	*	*			trans	-105.5	136	179	-171.4	0	0	0	0	108.3	Y376	Y376-V378 HydrophobicContact CE1-CG2 4.1Å
379	L	29.4	Very low	31	Very low	145 Å²	145	126.4 Å²	126.4	76%	0.759	77%	0.771	S	S	*	*			trans	159.5	142.1	131.9	-84.8	160.3	0	0	0	113.9
380	N	31.5	Very low	31.5	Very low	132 Å²	132	134.1 Å²	134.1	71%	0.706	78%	0.782	S	S	*	*			trans	50.9	102.9	145.4	-64.2	-2.7	0	0	0	122.2
381	S	30.3	Very low	31.7	Very low	116 Å²	116	130.6 Å²	130.6	81%	0.811	79%	0.787	S	S	*	*				68.6	164.2	108.4	-57.5	0	0	0	0	122.5
382	A	33.6	Very low	32.1	Very low	89 Å²	89	127.6 Å²	127.6	74%	0.736	79%	0.786	S	S	*	*			trans	74.8	74.9	160.2	0	0	0	0	0	119.4
383	C	29.2	Very low	32.6	Very low	127 Å²	127	123.1 Å²	123.1	86%	0.858	78%	0.782	S	S	*	*			trans	28.6	118	130.5	60.2	0	0	0	0	122.2
384	G	31.4	Very low	33	Very low	87 Å²	87	123.3 Å²	123.3	90%	0.897	78%	0.783	S	S	*	*				90.1	156	121.7	0	0	0	0	0	118.8
385	G	32.9	Very low	33.6	Very low	84 Å²	84	130 Å²	130	87%	0.866	79%	0.793	S	S	*	*			trans	114.5	116.9	170.2	0	0	0	0	0	115.1
386	A	31.1	Very low	34	Very low	97 Å²	97	125.4 Å²	125.4	80%	0.802	79%	0.789	S	S	*	*			trans	-151.3	163.6	164.7	0	0	0	0	0	107.3
387	P	39.7	Very low	34.8	Very low	121 Å²	121	124 Å²	124	79%	0.786	79%	0.79	S	S	*	*			cis	-131.4	-171.2	-13.1	37.3	-19.4	0	0	0	113.7
388	S	33.2	Very low	35.2	Very low	121 Å²	121	124.1 Å²	124.1	85%	0.846	79%	0.793	S	S	*	*			trans	95.6	158	146.7	-152.1	0	0	0	0	121.1
389	A	37	Very low	35.7	Very low	81 Å²	81	122.5 Å²	122.5	67%	0.669	79%	0.794	S	S	*	*			trans	85.7	99	160.3	0	0	0	0	0	122.9
390	R	36.4	Very low	36.3	Very low	246 Å²	246	124.7 Å²	124.7	93%	0.928	80%	0.801	S	S	*	*				78.2	137.8	126.3	-72.7	-179.9	161.7	-176.5	-5.9	123.6
391	S	38.9	Very low	36.7	Very low	133 Å²	133	124.8 Å²	124.8	93%	0.93	81%	0.806	S	S	*	*			trans	77.9	133.3	149.2	-154.5	0	0	0	0	118.9
392	G	37	Very low	37.1	Very low	63 Å²	63	124.6 Å²	124.6	65%	0.649	81%	0.805	S	S	*	*			cis	168.9	165.1	-7.3	0	0	0	0	0	114.5
393	S	39.3	Very low	37.3	Very low	125 Å²	125	123.3 Å²	123.3	87%	0.874	80%	0.8	S	S	*	*			trans	66.9	149.4	170.9	-78.7	0	0	0	0	119
394	S	40	Very low	37.6	Very low	95 Å²	95	122.3 Å²	122.3	66%	0.664	79%	0.794	S	S	*	*			cis	-166.5	150	-11.5	53.6	0	0	0	0	113.7
395	R	38.2	Very low	37.8	Very low	253 Å²	253	123.1 Å²	123.1	96%	0.955	79%	0.786	S	S	*	*			trans	65.3	139.3	160.5	-71.4	173.6	163.6	159.2	-6.4	118.6
396	G	38.3	Very low	37.9	Very low	67 Å²	67	123.6 Å²	123.6	69%	0.691	78%	0.776	S	S	*	*			cis	164.8	164.1	-11.5	0	0	0	0	0	115.2
397	Q	43.4	Very low	38.1	Very low	181 Å²	181	124.8 Å²	124.8	85%	0.846	77%	0.774	S	S	*	*			trans	67.5	152.5	172.9	-56	-176.9	13	0	0	116.8
398	N	40.2	Very low	37.8	Very low	151 Å²	151	123.5 Å²	123.5	81%	0.807	77%	0.774	S	S	*	*			cis	-163.1	151.4	-24.7	-94.7	-10.6	0	0	0	105.4
399	G	39.5	Very low	37.7	Very low	58 Å²	58	121.9 Å²	121.9	60%	0.598	77%	0.768	S	S	*	*			cis	179	166.7	-7.5	0	0	0	0	0	110.6
400	E	40.5	Very low	37.4	Very low	191 Å²	191	124.9 Å²	124.9	89%	0.893	78%	0.778	S	S	*	*			trans	64.1	151.3	154.4	-53.2	-176.8	146.3	0	0	119.7
401	T	39.9	Very low	37.3	Very low	135 Å²	135	117.1 Å²	117.1	83%	0.828	77%	0.774	S	S	*	*			cis	-158.2	161.2	-30.9	33	0	0	0	0	106
402	S	40.4	Very low	37	Very low	112 Å²	112	116.3 Å²	116.3	78%	0.783	77%	0.768	S	S	*	*			cis	-139.2	-166.4	-6.4	65.6	0	0	0	0	107.4
403	G	35.9	Very low	37.1	Very low	61 Å²	61	117.5 Å²	117.5	63%	0.629	77%	0.765	S	S	*	*			cis	100.8	130.3	1.3	0	0	0	0	0	114.1
404	S	37.3	Very low	36.7	Very low	106 Å²	106	121.6 Å²	121.6	74%	0.741	76%	0.763	S	S	*	*			cis	-175	168.2	-12.9	48.5	0	0	0	0	109.7
405	S	35.8	Very low	36.3	Very low	104 Å²	104	126.5 Å²	126.5	73%	0.727	77%	0.772	S	S	*	*			trans	57.2	150.2	146.4	51.7	0	0	0	0	121.3
406	S	34.3	Very low	36.3	Very low	94 Å²	94	120.4 Å²	120.4	66%	0.657	76%	0.763	S	S	*	*			cis	-172.9	-177.3	-16.8	54.3	0	0	0	0	109.9
407	T	34.5	Very low	36.3	Very low	123 Å²	123	123.1 Å²	123.1	76%	0.755	77%	0.768	S	S	*	*			trans	60.8	104.6	148.1	43.6	0	0	0	0	121.1
408	A	32.8	Very low	35.7	Very low	94 Å²	94	125.7 Å²	125.7	78%	0.777	77%	0.77	S	S	*	*				83.3	120.1	116.2	0	0	0	0	0	122.4
409	A	31.7	Very low	35.7	Very low	87 Å²	87	123.8 Å²	123.8	72%	0.719	77%	0.768	S	S	*	*			trans	79.7	137.4	132.6	0	0	0	0	0	122
410	T	30.8	Very low	35.6	Very low	144 Å²	144	126.3 Å²	126.3	88%	0.883	78%	0.777	S	S	*	*			trans	53.1	110.4	151.3	50.2	0	0	0	0	119.8
411	G	33.8	Very low	35.5	Very low	83 Å²	83	122 Å²	122	86%	0.856	77%	0.768	S	S	*	*			trans	168.2	110.1	163.2	0	0	0	0	0	114.8
412	S	32.9	Very low	35.5	Very low	115 Å²	115	120.2 Å²	120.2	80%	0.804	76%	0.761	S	S	*	*			trans	-100.5	174.5	157.7	-138	0	0	0	0	107.6
413	P	39.9	Very low	35.5	Very low	88 Å²	88	123.3 Å²	123.3	57%	0.571	76%	0.763	S	S	*	*			cis	-140.7	-171.9	-3.1	21.6	6.3	0	0	0	114.6
414	Y	30.1	Very low	35.6	Very low	212 Å²	212	125.7 Å²	125.7	83%	0.831	77%	0.77	S	S	*	*			trans	77.9	138.8	148.6	-65.2	-51	0	0	0	124.5
415	K	32.7	Very low	35.6	Very low	198 Å²	198	124.6 Å²	124.6	86%	0.861	78%	0.775	S	S	*	*			trans	94.5	128.8	140.3	-83.6	170.8	-178.4	-179.6	0	122.7
416	V	37.9	Very low	35.7	Very low	125 Å²	125	122.7 Å²	122.7	76%	0.758	77%	0.772	S	S	*	*			trans	-59.5	158.2	168.6	-126	0	0	0	0	114.3	R418	V416-R418 HydrophobicContact CG1-CB 4.48Å
417	P	37.7	Very low	35.8	Very low	123 Å²	123	125.3 Å²	125.3	80%	0.799	78%	0.784	S	S	*	*				-132.8	166.8	89	39.1	-30.1	0	0	0	113.5
418	R	31.4	Very low	36	Very low	236 Å²	236	125.3 Å²	125.3	89%	0.891	78%	0.784	S	S	*	*			cis	97.3	84.9	5.2	-158.8	-167.5	-163.3	-168.5	6	118.5	V416	V416-R418 HydrophobicContact CG1-CB 4.48Å
419	S	39.2	Very low	36.1	Very low	111 Å²	111	125.1 Å²	125.1	78%	0.776	78%	0.783	S	S	*	*			trans	-169.2	124.3	153.3	48.2	0	0	0	0	109.9
420	S	38.4	Very low	36.4	Very low	110 Å²	110	128.4 Å²	128.4	77%	0.769	79%	0.793	S	S	*	*				89.4	135.8	99.2	66	0	0	0	0	114.7
421	S	38.4	Very low	36.6	Very low	101 Å²	101	127.1 Å²	127.1	71%	0.706	78%	0.781	S	S	*	*			cis	-167	172.2	-1.2	48.5	0	0	0	0	112.8
422	S	39.3	Very low	36.6	Very low	97 Å²	97	131.1 Å²	131.1	68%	0.678	78%	0.775	S	S	*	*			trans	66.2	141.9	153.5	37.8	0	0	0	0	119.9
423	Q	40.5	Very low	36.7	Very low	177 Å²	177	137.4 Å²	137.4	83%	0.827	78%	0.781	S	S	*	*			cis	-159.9	161.1	-5.5	-122.5	166.4	0.7	0	0	112.1
424	S	38.2	Very low	36.3	Very low	111 Å²	111	142.9 Å²	142.9	78%	0.776	79%	0.79	S	S	*	*			trans	20.6	136.7	159.3	51.2	0	0	0	0	121.9
425	G	37.4	Very low	36.5	Very low	83 Å²	83	139.5 Å²	139.5	86%	0.856	78%	0.784	S	S	*	*			cis	108.7	146.4	13.1	0	0	0	0	0	112.3
426	G	37.7	Very low	36.4	Very low	64 Å²	64	134.3 Å²	134.3	66%	0.66	77%	0.773	S	S	*	*			cis	166.6	179.7	-0.4	0	0	0	0	0	112.1
427	T	37.4	Very low	35.9	Very low	149 Å²	149	135 Å²	135	91%	0.914	78%	0.777	S	S	*	*			trans	70.2	156.3	171.9	86.5	0	0	0	0	117.3
428	T	37.9	Very low	35.6	Very low	124 Å²	124	133.2 Å²	133.2	76%	0.761	77%	0.773	S	S	*	*			cis	-133.6	143.9	-7.1	45.5	0	0	0	0	108.6
429	A	34	Very low	35.6	Very low	90 Å²	90	126.6 Å²	126.6	74%	0.744	76%	0.758	S	S	*	*				60.5	119.9	68.4	0	0	0	0	0	117.3
430	V	38.5	Very low	35.2	Very low	155 Å²	155	124.6 Å²	124.6	94%	0.939	74%	0.741	S	S	*	*			trans	179.6	174.7	141.8	145.7	0	0	0	0	111.7
431	D	35	Very low	34.9	Very low	117 Å²	117	124.8 Å²	124.8	63%	0.626	73%	0.73	S	S	*	*			trans	-92.6	161.6	-138.4	-116.6	-70.5	0	0	0	122.3
432	K	33.2	Very low	34.6	Very low	167 Å²	167	123.4 Å²	123.4	73%	0.726	73%	0.725	S	S	*	*			trans	-41.1	145.1	163.6	-49.5	160.9	-158.6	72.3	0	116.6
433	R	35.4	Very low	34.2	Very low	248 Å²	248	124.9 Å²	124.9	94%	0.936	73%	0.73	S	S	*	*				177.2	161.9	125.9	-93.2	159.8	-161.5	-148.8	6.9	108.4
434	R	32	Very low	33.8	Very low	203 Å²	203	122.4 Å²	122.4	77%	0.766	73%	0.726	S	S	*	*			cis	157.2	137.7	-27.1	-170.9	-152.1	173	-163.7	-0.5	104.5
435	M	33.6	Very low	33.5	Very low	140 Å²	140	121.7 Å²	121.7	69%	0.69	72%	0.718	S	S	*	*			trans	74.9	170.1	170	-43.2	-165.3	74.9	0	0	116.4
436	S	30.7	Very low	33.2	Very low	90 Å²	90	126.9 Å²	126.9	63%	0.629	72%	0.719	S	S	*	*				-172.9	139.3	-70.3	53	0	0	0	0	113.3
437	V	29.2	Very low	33	Very low	139 Å²	139	127.4 Å²	127.4	84%	0.842	73%	0.725	S	S	*	*			trans	69.6	122.4	154.4	176.4	0	0	0	0	119.9
438	A	29.6	Very low	32.9	Very low	86 Å²	86	126.6 Å²	126.6	71%	0.711	72%	0.722	S	S	*	*			trans	60.1	168.5	154.4	0	0	0	0	0	118.5
439	T	32	Very low	32.6	Very low	97 Å²	97	124.2 Å²	124.2	60%	0.595	72%	0.723	S	S	*	*			cis	-156.5	165.4	4.8	-22.7	0	0	0	0	109.7
440	T	31.8	Very low	32.6	Very low	68 Å²	68	126.8 Å²	126.8	42%	0.417	73%	0.729	S	S	.	*			trans	58.3	163	158.4	54.8	0	0	0	0	118.3	S795 L797	T440-S795 WeakPolarHBondContact CG2-OG 3.4Å; T440-L797 VanDerWaalsContact C-CD1 3.5Å
441	E	32.2	Very low	32.3	Very low	114 Å²	114	124.3 Å²	124.3	53%	0.533	72%	0.719	S	S	.	*			cis	-155.1	141.9	-27.3	-105.7	-173.4	112.2	0	0	105.7	S795 S796	E441-S795 VanDerWaalsContact CD-OG 3.23Å; E441-S795 WeakPolarHBondContact OE1-CB 3.47Å; E441-S795 WeakPolarHBondContact OE2-CB 3.38Å; E441-S795 PolarHBondContact OE2-OG 2.73Å; E441-S796 VanDerWaalsContact CG-OG 3.23Å; E441-S796 WeakPolarHBondContact CG-OG 3.36Å
442	A	30.6	Very low	32.2	Very low	73 Å²	73	128 Å²	128	60%	0.603	73%	0.73	S	S	*	*				83.8	148.7	63.6	0	0	0	0	0	116
443	V	30.9	Very low	32.3	Very low	127 Å²	127	126.1 Å²	126.1	77%	0.77	73%	0.732	S	S	*	*			trans	90.4	140.6	159.7	-175.7	0	0	0	0	120.2
444	V	32.3	Very low	32.2	Very low	125 Å²	125	117.8 Å²	117.8	76%	0.758	72%	0.724	S	S	*	*			trans	78.4	137.3	156	138.9	0	0	0	0	120.8
445	T	32.7	Very low	32.2	Very low	97 Å²	97	112.9 Å²	112.9	60%	0.595	73%	0.726	S	S	*	*			cis	-166.9	158.4	-30.6	16.4	0	0	0	0	112.7
446	Q	29.6	Very low	32	Very low	191 Å²	191	110.6 Å²	110.6	89%	0.893	73%	0.73	S	S	*	*			trans	62.8	138.8	141.6	-68.9	166.1	20.5	0	0	123
447	G	33.7	Very low	32.2	Very low	75 Å²	75	111.8 Å²	111.8	77%	0.773	73%	0.733	S	S	*	*			trans	174.3	112.5	165.8	0	0	0	0	0	112
448	P	36.5	Very low	32.2	Very low	132 Å²	132	111.1 Å²	111.1	86%	0.857	73%	0.729	S	S	*	*			trans	-120.8	160.7	-170.1	40.7	-31.3	0	0	0	116.6
449	G	30.4	Very low	32.4	Very low	75 Å²	75	114.9 Å²	114.9	77%	0.773	73%	0.732	S	S	*	*			trans	85.3	166.9	168.9	0	0	0	0	0	115
450	T	34.9	Very low	32.2	Very low	143 Å²	143	116.6 Å²	116.6	88%	0.877	74%	0.743	S	S	*	*			cis	-144.9	-174.2	1	52.6	0	0	0	0	110.9
451	S	31.1	Very low	32.2	Very low	104 Å²	104	118.8 Å²	118.8	73%	0.727	76%	0.756	S	S	*	*			trans	-135.4	136.5	-165.7	56.7	0	0	0	0	114.6
452	F	34.6	Very low	32	Very low	194 Å²	194	118.8 Å²	118.8	85%	0.851	76%	0.764	S	S	*	*			trans	-155.4	150.2	167.3	-87.4	-87.1	0	0	0	107.6
453	T	34	Very low	32	Very low	128 Å²	128	121.7 Å²	121.7	79%	0.785	77%	0.768	S	S	*	*			cis	172.1	155.3	-16.9	26	0	0	0	0	106
454	G	33.2	Very low	31.9	Very low	73 Å²	73	125.3 Å²	125.3	75%	0.753	77%	0.768	S	S	*	*			trans	112.6	105.4	171.2	0	0	0	0	0	113
455	A	33.1	Very low	32	Very low	99 Å²	99	126.9 Å²	126.9	82%	0.818	77%	0.767	S	S	*	*				74.2	105.6	55.4	0	0	0	0	0	112
456	A	29.2	Very low	31.9	Very low	93 Å²	93	129.7 Å²	129.7	77%	0.769	78%	0.779	S	S	*	*				71	133.5	95.8	0	0	0	0	0	112.2
457	V	34.8	Very low	32.2	Very low	115 Å²	115	125.3 Å²	125.3	70%	0.697	77%	0.767	S	S	*	*				-164	131.4	55.8	168.4	0	0	0	0	106
458	T	28.6	Very low	32.1	Very low	124 Å²	124	132.6 Å²	132.6	76%	0.761	77%	0.771	S	S	*	*				63.8	149.9	80.9	-37.9	0	0	0	0	115.9
459	Q	34.1	Very low	31.7	Very low	165 Å²	165	131.8 Å²	131.8	77%	0.771	77%	0.768	S	S	*	*			trans	81.5	123.9	-179	-47.7	-176.7	25.3	0	0	113.7
460	T	27	Very low	31.9	Very low	134 Å²	134	132.9 Å²	132.9	82%	0.822	77%	0.77	S	S	*	*			cis	95.5	154.6	35.3	-56.9	0	0	0	0	112.3
461	V	32.2	Very low	31.7	Very low	114 Å²	114	131.9 Å²	131.9	69%	0.691	76%	0.764	S	S	*	*			trans	93.5	71.3	172.8	-164.4	0	0	0	0	117.7
462	T	28.1	Very low	31.7	Very low	114 Å²	114	136.9 Å²	136.9	70%	0.699	77%	0.773	S	S	*	*				51.6	156.8	120.9	65.4	0	0	0	0	125.2
463	L	30.6	Very low	31.6	Very low	133 Å²	133	130.6 Å²	130.6	70%	0.696	76%	0.762	S	S	*	*			trans	83	119.5	147.5	-76.4	159.1	0	0	0	120.8
464	R	28.9	Very low	31.5	Very low	204 Å²	204	132.4 Å²	132.4	77%	0.77	77%	0.767	S	S	*	*			trans	67	157.8	143.7	-67.7	176.1	179.2	-178.2	1	116.6
465	Q	34.7	Very low	31.3	Very low	158 Å²	158	135.4 Å²	135.4	74%	0.738	77%	0.771	S	S	*	*			cis	-150.1	152.6	-7.5	-127.2	154.4	-24.4	0	0	109.4
466	N	30.3	Very low	31.3	Very low	155 Å²	155	136 Å²	136	83%	0.829	77%	0.77	S	S	*	*			trans	-93.7	137	170.4	-176.6	9.2	0	0	0	109.9
467	P	36.7	Very low	31.5	Very low	99 Å²	99	140.5 Å²	140.5	64%	0.643	78%	0.777	S	S	*	*			trans	-146.5	132.9	141.9	34.7	-16.8	0	0	0	117.5
468	R	32	Very low	31.4	Very low	228 Å²	228	138.7 Å²	138.7	86%	0.86	78%	0.782	S	S	*	*				62.2	108.8	127.3	-62.3	176.3	172.8	168.5	-4	121.7
469	S	27.8	Very low	31.6	Very low	115 Å²	115	137.8 Å²	137.8	80%	0.804	79%	0.786	S	S	*	*				20.2	127	120.4	-44.2	0	0	0	0	122.5
470	A	34.2	Very low	31.7	Very low	99 Å²	99	136.2 Å²	136.2	82%	0.818	79%	0.791	S	S	*	*			trans	-146.2	132.6	132.5	0	0	0	0	0	106.8
471	V	29.8	Very low	32	Very low	121 Å²	121	133.5 Å²	133.5	73%	0.733	79%	0.789	S	S	*	*			cis	84.8	93.5	27.1	-173.3	0	0	0	0	114.6
472	F	32.9	Very low	32	Very low	210 Å²	210	137.4 Å²	137.4	92%	0.921	80%	0.797	S	S	*	*			trans	-176.8	144.4	143.9	-90.5	-68.6	0	0	0	104.8
473	G	31.3	Very low	32	Very low	61 Å²	61	141.2 Å²	141.2	63%	0.629	80%	0.804	S	S	*	*			cis	111.2	126.4	26.4	0	0	0	0	0	108
474	N	32.5	Very low	32	Very low	166 Å²	166	146.6 Å²	146.6	89%	0.888	82%	0.815	S	S	*	*			cis	-149.5	-175.2	12.5	-88.2	-9.8	0	0	0	112.8
475	T	29.3	Very low	32.2	Very low	137 Å²	137	141.7 Å²	141.7	84%	0.84	81%	0.81	S	S	*	*			trans	-91.4	147.4	-171.6	44.1	0	0	0	0	117.7
476	S	33.3	Very low	32.3	Very low	112 Å²	112	143.8 Å²	143.8	78%	0.783	82%	0.822	S	S	*	*			trans	-162.8	130.1	141	52.2	0	0	0	0	108.6
477	M	31.9	Very low	32.5	Very low	187 Å²	187	142.4 Å²	142.4	92%	0.921	82%	0.819	S	S	*	*				66.1	102.6	56.2	-71.6	-73	-80.7	0	0	114
478	G	32.5	Very low	32.5	Very low	77 Å²	77	144.7 Å²	144.7	79%	0.794	83%	0.826	S	S	*	*			trans	166	61.7	173.1	0	0	0	0	0	121.4
479	A	33.2	Very low	32.6	Very low	104 Å²	104	137.8 Å²	137.8	86%	0.86	81%	0.812	S	S	*	*			trans	59	166	149.7	0	0	0	0	0	121.7
480	P	36.8	Very low	32.9	Very low	133 Å²	133	143 Å²	143	86%	0.864	81%	0.814	S	S	*	*			trans	-111.5	151.3	-174.1	39.4	-30.9	0	0	0	115.7
481	G	32.3	Very low	32.8	Very low	77 Å²	77	147.6 Å²	147.6	79%	0.794	82%	0.815	S	S	*	*			trans	-166	94.4	179.7	0	0	0	0	0	119.1
482	K	31.9	Very low	32.7	Very low	196 Å²	196	147.7 Å²	147.7	85%	0.852	82%	0.82	S	S	*	*			trans	23	128.3	143.8	-63	176	-179.9	174.4	0	122.1
483	F	28.2	Very low	32.7	Very low	193 Å²	193	142.6 Å²	142.6	85%	0.846	82%	0.817	S	S	*	*			trans	55.2	119.9	136	-92.6	-103.9	0	0	0	121.6
484	R	32	Very low	32.8	Very low	247 Å²	247	145.3 Å²	145.3	93%	0.932	83%	0.826	S	S	*	*				-161.4	137.5	109.2	-107	171.4	-170.1	-111.7	2.2	111.6
485	P	32.4	Very low	33	Very low	101 Å²	101	142.9 Å²	142.9	66%	0.656	82%	0.819	S	S	*	*			trans	-87.4	160.7	171.9	35.7	-34.3	0	0	0	111.7
486	M	36	Very low	33.1	Very low	201 Å²	201	142.7 Å²	142.7	99%	0.99	81%	0.81	S	S	*	*			trans	-123.8	116.6	163.2	-92.5	-168	162.9	0	0	111
487	T	34.6	Very low	32.9	Very low	126 Å²	126	144.5 Å²	144.5	77%	0.773	81%	0.811	S	S	*	*			trans	-105.8	136.4	174.7	50.4	0	0	0	0	110.1
488	N	37.4	Very low	32.8	Very low	147 Å²	147	141.8 Å²	141.8	79%	0.786	81%	0.808	S	S	*	*			trans	-151.4	120.9	150.2	-118.8	-31.1	0	0	0	112.6
489	C	33.3	Very low	32.6	Very low	83 Å²	83	143.6 Å²	143.6	56%	0.561	80%	0.804	S	S	*	*			trans	42.5	130.9	130.5	-70.8	0	0	0	0	120.2
490	R	35	Very low	32.6	Very low	224 Å²	224	144.6 Å²	144.6	85%	0.845	80%	0.799	S	S	*	*			cis	-155.1	166	4.7	-89.1	140.2	-161.2	180	7.2	106.8
491	K	32.7	Very low	32.7	Very low	196 Å²	196	143.8 Å²	143.8	85%	0.852	79%	0.794	S	S	*	*			cis	-148.4	164.6	10.5	-157.4	-175.9	-179.6	-176.6	0	108.9
492	C	26.9	Very low	32.7	Very low	124 Å²	124	145.3 Å²	145.3	84%	0.838	79%	0.79	S	S	*	*			trans	-117.5	144.8	171.9	-54.5	0	0	0	0	111.5
493	A	33.9	Very low	32.6	Very low	102 Å²	102	143.8 Å²	143.8	84%	0.843	79%	0.79	S	S	*	*			trans	-166.7	111.2	158.2	0	0	0	0	0	110.8
494	S	33	Very low	32.9	Very low	118 Å²	118	140.6 Å²	140.6	83%	0.825	79%	0.786	S	S	*	*			trans	-92.4	165.1	154.2	-51.5	0	0	0	0	108.3
495	P	36.6	Very low	32.8	Very low	115 Å²	115	135 Å²	135	75%	0.747	78%	0.78	S	S	*	*				-142.8	178.1	82.7	39.7	-24.9	0	0	0	114.3
496	M	30.6	Very low	33	Very low	133 Å²	133	136.2 Å²	136.2	66%	0.655	79%	0.79	S	S	*	*			trans	-56.9	147.3	153	-75.2	-176.4	167	0	0	110.5	L367	L367-M496 HydrophobicContact CB-CE 4.49Å; L367-M496 HydrophobicContact CD1-CE 4.13Å; L367-M496 HydrophobicContact CD2-CE 3.65Å; L367-M496 HydrophobicContact CG-CE 4.3Å
497	L	29.9	Very low	32.7	Very low	151 Å²	151	130.1 Å²	130.1	79%	0.791	78%	0.779	S	S	*	*			trans	-160.9	129.8	146.1	-113.2	169.2	0	0	0	110.8	V499	L497-V499 HydrophobicContact CD2-CG2 4.5Å
498	C	29.5	Very low	32.7	Very low	129 Å²	129	130.9 Å²	130.9	87%	0.872	78%	0.783	S	S	*	*			trans	-83	111.8	168.9	-62.2	0	0	0	0	109.5
499	V	27.6	Very low	32.3	Very low	116 Å²	116	128.3 Å²	128.3	70%	0.703	78%	0.777	S	S	*	*			trans	-140.7	132	167.8	174.6	0	0	0	0	110.7	L497	L497-V499 HydrophobicContact CD2-CG2 4.5Å
500	V	34.5	Very low	32.5	Very low	125 Å²	125	133.9 Å²	133.9	76%	0.758	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-82.1	130.3	169.3	177.1	0	0	0	0	109
501	P	38.8	Very low	32.4	Very low	116 Å²	116	130.6 Å²	130.6	75%	0.753	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-64.6	124.4	172	-19.9	32.7	0	0	0	110.7
502	P	32.9	Very low	32.6	Very low	109 Å²	109	125.9 Å²	125.9	71%	0.708	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-80.9	153.4	-172.4	31.9	-35.9	0	0	0	113.5	V504	P502-V504 PolarHBondContact O-N 3.19Å
503	L	28.1	Very low	33.1	Very low	163 Å²	163	125.8 Å²	125.8	85%	0.853	79%	0.786	S	S	*	*			trans	-83.2	102.6	172.8	-170	98.2	0	0	0	110
504	V	34.3	Very low	33	Very low	127 Å²	127	125.8 Å²	125.8	77%	0.77	79%	0.787	S	S	*	*			trans	-135	129.6	173.3	-173.5	0	0	0	0	111.5	P502	P502-V504 PolarHBondContact O-N 3.19Å
505	T	30.6	Very low	33.2	Very low	129 Å²	129	125.3 Å²	125.3	79%	0.791	79%	0.79	S	S	*	*			trans	-95.9	137.7	177.7	52.3	0	0	0	0	112
506	S	36.2	Very low	33	Very low	126 Å²	126	129 Å²	129	88%	0.881	79%	0.789	S	S	*	*			trans	-161.6	143	147.9	44.8	0	0	0	0	109.7
507	G	31	Very low	33.4	Very low	74 Å²	74	134.2 Å²	134.2	76%	0.763	80%	0.801	S	S	*	*			trans	-133.3	152.1	179	0	0	0	0	0	111.2
508	V	33.8	Very low	33.7	Very low	141 Å²	141	137 Å²	137	86%	0.855	80%	0.801	S	S	*	*			trans	-131.5	116.7	168.9	178.7	0	0	0	0	108.1
509	S	29.7	Very low	34	Very low	94 Å²	94	134.4 Å²	134.4	66%	0.657	80%	0.796	S	S	*	*			trans	-89.7	141.7	174.6	175.5	0	0	0	0	111.1
510	K	37.9	Very low	34.8	Very low	199 Å²	199	134.7 Å²	134.7	87%	0.865	80%	0.8	S	S	*	*			trans	-140.8	125.2	150.9	-71.1	-161.9	176.4	-174.7	0	110.5
511	N	31.8	Very low	34.7	Very low	155 Å²	155	135.4 Å²	135.4	83%	0.829	81%	0.805	S	S	*	*			trans	-81.7	147.8	178.1	-63.7	-37.2	0	0	0	112.1
512	A	37.2	Very low	34.7	Very low	98 Å²	98	137.1 Å²	137.1	81%	0.81	81%	0.806	S	S	*	*			trans	-160.1	151.9	147.5	0	0	0	0	0	109.7
513	P	37	Very low	34.5	Very low	121 Å²	121	143 Å²	143	79%	0.786	81%	0.814	S	S	*	*			trans	-128.4	162.5	-141.4	40.6	-26.6	0	0	0	118.4
514	A	32.9	Very low	34.7	Very low	103 Å²	103	139.8 Å²	139.8	85%	0.851	81%	0.811	S	S	*	*			trans	56	121.1	141.3	0	0	0	0	0	122.4
515	A	36.5	Very low	34.6	Very low	107 Å²	107	139.3 Å²	139.3	88%	0.884	81%	0.814	S	S	*	*			trans	-143.2	148.3	143.7	0	0	0	0	0	110.5
516	R	32.5	Very low	34.4	Very low	194 Å²	194	142.4 Å²	142.4	73%	0.732	82%	0.817	S	S	*	*			trans	-114	153.2	-171.6	-77.6	176.2	165.5	176.8	-1.3	113.7
517	R	38.3	Very low	34.1	Very low	242 Å²	242	145.2 Å²	145.2	91%	0.913	82%	0.816	S	S	*	*				-173.9	114.3	129.6	-93.5	148.9	-163	-108.7	5.4	106.4
518	R	36.2	Very low	34.1	Very low	210 Å²	210	146.2 Å²	146.2	79%	0.792	82%	0.817	S	S	*	*				48.2	127	63	-69.9	-171.9	169.9	-166.7	-5	111.8
519	G	36.8	Very low	33.9	Very low	74 Å²	74	145.1 Å²	145.1	76%	0.763	82%	0.815	S	S	*	*			cis	168.7	-161	2.8	0	0	0	0	0	108
520	P	43.1	Very low	34	Very low	121 Å²	121	147.5 Å²	147.5	79%	0.786	82%	0.821	S	S	*	*			cis	-132.1	-175.8	-6.6	42.9	-26.9	0	0	0	114.4
521	T	33.2	Very low	33.7	Very low	141 Å²	141	143.1 Å²	143.1	87%	0.865	81%	0.807	S	S	*	*			trans	-128.6	135.3	165.1	-53.7	0	0	0	0	109.7
522	I	37.8	Very low	33.9	Very low	151 Å²	151	144.9 Å²	144.9	77%	0.774	81%	0.81	S	S	*	*			trans	-142.2	110.1	171.7	-61.9	-176.1	0	0	0	104.8
523	R	30.1	Very low	33.7	Very low	233 Å²	233	148.1 Å²	148.1	88%	0.879	81%	0.808	S	S	*	*				88.1	128.9	63.8	-171.5	179.8	-174.4	167.5	4.1	111.5
524	A	31.6	Very low	33.5	Very low	96 Å²	96	145.4 Å²	145.4	79%	0.793	80%	0.802	S	S	*	*			trans	-94.6	153.5	-173.6	0	0	0	0	0	113.7
525	S	32.7	Very low	33.5	Very low	117 Å²	117	150.8 Å²	150.8	82%	0.818	80%	0.801	S	S	*	*			trans	-158.8	142.8	161.8	48.7	0	0	0	0	111.6
526	F	26.5	Very low	33.2	Very low	194 Å²	194	152.7 Å²	152.7	85%	0.851	79%	0.791	S	S	*	*			trans	-44.1	155.4	168.9	-76.6	-119.7	0	0	0	113.8
527	Q	28.6	Very low	33.3	Very low	184 Å²	184	148.3 Å²	148.3	86%	0.86	79%	0.79	S	S	*	*				168.9	171.4	86.7	-136	165.9	10.1	0	0	113.1
528	A	31.4	Very low	32.9	Very low	95 Å²	95	145.5 Å²	145.5	79%	0.785	79%	0.788	S	S	*	*			trans	62	97.9	155	0	0	0	0	0	120.9
529	S	29.3	Very low	33.2	Very low	118 Å²	118	140.1 Å²	140.1	83%	0.825	78%	0.78	S	S	*	*			trans	-78.6	142.5	147.8	-48.3	0	0	0	0	110.5
530	N	33.5	Very low	32.9	Very low	145 Å²	145	145.2 Å²	145.2	78%	0.775	78%	0.781	S	S	*	*			trans	-166.4	139.3	140.8	-119.1	-17.7	0	0	0	115.8
531	N	31.6	Very low	32.3	Very low	107 Å²	107	146.3 Å²	146.3	57%	0.572	78%	0.78	S	S	*	*			trans	31.3	121.1	149.1	-64.2	-28.7	0	0	0	122.2
532	Q	36.1	Very low	32.4	Very low	192 Å²	192	144.4 Å²	144.4	90%	0.897	78%	0.779	S	S	*	*				-148.2	127.1	93.5	-90.4	160.9	20.5	0	0	107.2
533	H	32.6	Very low	32.1	Very low	165 Å²	165	140.8 Å²	140.8	76%	0.764	78%	0.778	S	S	*	*				83.9	128.3	52.9	-88.1	57.3	0	0	0	114.9
534	G	33.2	Very low	32.8	Very low	65 Å²	65	135.9 Å²	135.9	67%	0.67	78%	0.777	S	S	*	*			trans	116.8	93.8	-169.5	0	0	0	0	0	110.8
535	R	31.2	Very low	32.8	Very low	216 Å²	216	136.2 Å²	136.2	82%	0.815	78%	0.779	S	S	*	*				70.2	144.6	70.5	-64.5	-170.4	143.2	163.2	1.1	113.7
536	E	30.5	Very low	32.7	Very low	146 Å²	146	136 Å²	136	68%	0.682	78%	0.778	S	S	*	*			cis	-173.4	151.9	-13.9	-103.8	148.4	-168.3	0	0	105
537	S	34.7	Very low	32.9	Very low	102 Å²	102	130.7 Å²	130.7	71%	0.713	77%	0.77	S	S	*	*			cis	-172.2	148.2	-17.4	51.8	0	0	0	0	110.6
538	E	31.2	Very low	33	Very low	184 Å²	184	132.9 Å²	132.9	86%	0.86	77%	0.771	S	S	*	*			trans	68.3	158.9	166.1	-78.9	-74.5	93.5	0	0	120.5
539	P	41.2	Very low	33.1	Very low	97 Å²	97	133.7 Å²	133.7	63%	0.63	77%	0.77	S	S	*	*			trans	-108.2	178.8	-173.8	42.5	-36.2	0	0	0	114.5
540	K	31.1	Very low	33.2	Very low	181 Å²	181	133.2 Å²	133.2	79%	0.787	77%	0.767	S	S	*	*			trans	-178.3	143.3	133	-101.4	164.5	-172.6	170	0	116.3
541	D	29.8	Very low	33.3	Very low	143 Å²	143	130.6 Å²	130.6	77%	0.765	77%	0.766	S	S	*	*			trans	59.1	163.2	139.1	-58.7	-31.5	0	0	0	124.5
542	A	35	Very low	33.5	Very low	102 Å²	102	134.3 Å²	134.3	84%	0.843	78%	0.779	S	S	*	*			trans	77.1	66.1	151.2	0	0	0	0	0	121
543	G	31.1	Very low	33.4	Very low	74 Å²	74	130.1 Å²	130.1	76%	0.763	77%	0.769	S	S	*	*				96.6	172.4	101.6	0	0	0	0	0	120.5
544	P	45.3	Very low	33.3	Very low	131 Å²	131	127.6 Å²	127.6	85%	0.851	77%	0.769	S	S	*	*			trans	-134.1	150.2	-149.7	39.5	-21.9	0	0	0	117.4
545	A	31.7	Very low	33.2	Very low	102 Å²	102	131.8 Å²	131.8	84%	0.843	78%	0.782	S	S	*	*			trans	-169.1	157.9	155.6	0	0	0	0	0	110.4
546	S	30.8	Very low	33	Very low	112 Å²	112	129.7 Å²	129.7	78%	0.783	79%	0.786	S	S	*	*			cis	-172.6	160.6	-29.2	-173.6	0	0	0	0	108.1
547	A	31.6	Very low	32.9	Very low	84 Å²	84	127.3 Å²	127.3	69%	0.694	79%	0.792	S	S	*	*			trans	67.8	151.3	161.1	0	0	0	0	0	117.6
548	R	30.8	Very low	32.7	Very low	230 Å²	230	127.1 Å²	127.1	87%	0.868	80%	0.796	S	S	*	*			cis	-159.9	160.9	-7.5	-123.9	171.2	-175.4	174.5	-0.2	110.9
549	S	32.5	Very low	32.5	Very low	111 Å²	111	126.7 Å²	126.7	78%	0.776	80%	0.799	S	S	*	*			trans	62.3	142.3	156.9	42.6	0	0	0	0	119.4
550	S	32.7	Very low	31.8	Very low	109 Å²	109	126.3 Å²	126.3	76%	0.762	80%	0.804	S	S	*	*			cis	-169.1	152.3	-8.7	45	0	0	0	0	112.3
551	A	35.5	Very low	31.6	Very low	90 Å²	90	129 Å²	129	74%	0.744	81%	0.809	S	S	*	*			trans	68	141.3	161.1	0	0	0	0	0	118.5
552	H	34.5	Very low	31.5	Very low	184 Å²	184	133.1 Å²	133.1	85%	0.852	82%	0.815	S	S	*	*			cis	-152	158.3	-23.3	-125.2	-94.2	0	0	0	107.7
553	P	35.3	Very low	31.2	Very low	105 Å²	105	138.2 Å²	138.2	68%	0.682	82%	0.819	S	S	*	*			trans	-107	-170.5	-159.4	41.3	-35.3	0	0	0	115.3
554	S	30.2	Very low	31	Very low	111 Å²	111	143.6 Å²	143.6	78%	0.776	82%	0.821	S	S	*	*			trans	91	110.5	164.5	76.2	0	0	0	0	118.6
555	V	29.8	Very low	30.1	Very low	154 Å²	154	148 Å²	148	93%	0.933	83%	0.828	S	S	*	*			trans	-137.1	69.5	156.1	-174	0	0	0	0	107.5
556	L	27.9	Very low	30	Very low	171 Å²	171	148.1 Å²	148.1	90%	0.895	82%	0.822	S	S	*	*			trans	-153.2	77.5	175.3	-138.7	177.4	0	0	0	109.7
557	A	29.2	Very low	29.9	Very low	97 Å²	97	149.6 Å²	149.6	80%	0.802	82%	0.821	S	S	*	*			trans	-155.9	156.6	179.2	0	0	0	0	0	111.7
558	A	28.7	Very low	29.8	Very low	97 Å²	97	151.6 Å²	151.6	80%	0.802	82%	0.824	S	S	*	*			trans	60.6	80.6	166.5	0	0	0	0	0	117.8
559	L	27.3	Very low	29.7	Very low	176 Å²	176	147.8 Å²	147.8	92%	0.921	81%	0.814	S	S	*	*	S	Bend	trans	-60.5	151.2	133.4	-78	168.6	0	0	0	109.4
560	A	27.9	Very low	29.9	Very low	89 Å²	89	149.1 Å²	149.1	74%	0.736	81%	0.811	S	S	*	*	S	Bend	trans	59.2	89.7	170.4	0	0	0	0	0	117.8
561	R	25.3	Very low	29.7	Very low	238 Å²	238	149 Å²	149	90%	0.898	81%	0.81	S	S	*	*			trans	179.8	102.5	135.3	-98.4	164.4	-148.4	-159.3	5.8	110.7
562	Y	29.4	Very low	29.4	Very low	229 Å²	229	152 Å²	152	90%	0.898	81%	0.813	S	S	*	*			trans	-175.6	52.7	143.3	-103.4	-63.1	0	0	0	111.9	F564	Y562-F564 PolarHBondContact O-N 3.06Å
563	F	27.7	Very low	29.4	Very low	209 Å²	209	150.3 Å²	150.3	92%	0.917	81%	0.809	S	S	*	*			trans	-74.5	108.4	146.7	-100.8	-94.9	0	0	0	106.3
564	F	26.7	Very low	29.1	Very low	186 Å²	186	155.3 Å²	155.3	82%	0.816	82%	0.816	S	S	*	*			trans	166.4	70.2	151.6	-98.9	-66.3	0	0	0	110.9	Y562	Y562-F564 PolarHBondContact O-N 3.06Å
565	F	26.7	Very low	29	Very low	224 Å²	224	156.9 Å²	156.9	98%	0.982	81%	0.814	S	S	*	*	S	Bend	trans	-163.8	55.7	145.5	-113.4	-70.4	0	0	0	109.6
566	S	30.8	Very low	28.9	Very low	104 Å²	104	158.1 Å²	158.1	73%	0.727	81%	0.807	S	S	*	*	S	Bend	trans	-152.7	145.3	172.1	-177.8	0	0	0	0	106.6
567	L	27.4	Very low	29	Very low	144 Å²	144	155.2 Å²	155.2	75%	0.754	80%	0.801	S	S	*	*			trans	67.7	75.5	-172	-54.5	171.6	0	0	0	116
568	T	29.2	Very low	29.1	Very low	125 Å²	125	157.1 Å²	157.1	77%	0.767	80%	0.803	S	S	*	*				-135.7	142.4	126.6	48.8	0	0	0	0	107.8
569	F	30.2	Very low	29.2	Very low	151 Å²	151	157 Å²	157	66%	0.662	80%	0.801	S	S	*	*	S	Bend	trans	60.2	113.3	-166.4	-60	-91.4	0	0	0	114	H706	F569-H706 AromaticContact CE1-CE1 3.3Å; F569-H706 WeakPolarHBondContact CE1-CE1 3.2Å; F569-H706 AromaticContact CE1-ND1 3.76Å; F569-H706 AromaticContact CE1-NE2 3.53Å; F569-H706 AromaticContact CE2-CE1 3.84Å; F569-H706 AromaticContact CZ-CE1 3.19Å; F569-H706 WeakPolarHBondContact CZ-CE1 3.37Å; F569-H706 AromaticContact CZ-NE2 3.41Å; F569-H706 WeakPolarHBondContact CZ-NE2 3.49Å
570	I	35.2	Very low	29.5	Very low	138 Å²	138	156.7 Å²	156.7	71%	0.708	80%	0.801	S	S	*	*	S	Bend	cis	-135.6	121.7	-2.1	-59.9	178.3	0	0	0	108.7
571	S	29	Very low	29.8	Very low	107 Å²	107	156.2 Å²	156.2	75%	0.748	80%	0.797	S	S	*	*			trans	-144.7	59.3	163.3	-65.7	0	0	0	0	108.9
572	L	29.3	Very low	30.3	Very low	153 Å²	153	151.4 Å²	151.4	80%	0.801	79%	0.794	S	S	*	*			trans	-142.6	72.9	172.6	-93.8	176.5	0	0	0	109.1
573	I	33.9	Very low	30.6	Very low	148 Å²	148	145.5 Å²	145.5	76%	0.759	79%	0.786	S	S	*	*	S	Bend	trans	-177.9	143.3	158.6	-96.4	151	0	0	0	104.8
574	Y	29.6	Very low	31	Very low	211 Å²	211	143.4 Å²	143.4	83%	0.827	78%	0.784	S	S	*	*			trans	62.5	63	-165.2	-71.7	-76.5	0	0	0	115.7
575	I	28.7	Very low	31.5	Very low	143 Å²	143	139.6 Å²	139.6	73%	0.733	78%	0.778	S	S	*	*				-94.3	150.3	127.4	-59.5	178.7	0	0	0	106.3
576	F	27.7	Very low	32	Very low	181 Å²	181	133.6 Å²	133.6	79%	0.794	76%	0.764	S	S	*	*			trans	84	141.3	-175.9	-67.5	-79.5	0	0	0	118
577	S	30.3	Very low	32.3	Very low	110 Å²	110	136.4 Å²	136.4	77%	0.769	77%	0.77	S	S	*	*			trans	61.8	119.7	-168.5	-67.9	0	0	0	0	114
578	T	29.6	Very low	32.6	Very low	137 Å²	137	132.8 Å²	132.8	84%	0.84	77%	0.768	S	S	*	*	S	Bend	cis	-139.4	167.5	19.6	51.3	0	0	0	0	114.1
579	A	32.5	Very low	32.8	Very low	93 Å²	93	133.5 Å²	133.5	77%	0.769	77%	0.772	S	S	*	*			trans	68.5	134.2	-178.3	0	0	0	0	0	115.2
580	N	33.3	Very low	32.9	Very low	170 Å²	170	134.4 Å²	134.4	91%	0.909	78%	0.782	S	S	*	*			cis	-127.4	-175	20.3	-103.6	-30.9	0	0	0	114.1
581	A	34.2	Very low	32.7	Very low	80 Å²	80	132.7 Å²	132.7	66%	0.661	78%	0.783	S	S	*	*			trans	-106.5	-176.6	-162.2	0	0	0	0	0	116.2
582	T	34	Very low	32.9	Very low	136 Å²	136	133.8 Å²	133.8	83%	0.834	79%	0.785	S	S	*	*			trans	85.5	142	160.2	48.1	0	0	0	0	122.1
583	S	36.2	Very low	33.3	Very low	105 Å²	105	130.9 Å²	130.9	73%	0.734	78%	0.777	S	S	*	*			trans	65.6	87.4	165.7	42.2	0	0	0	0	121.7
584	L	35.8	Very low	33.3	Very low	166 Å²	166	130.6 Å²	130.6	87%	0.869	78%	0.777	S	S	*	*				33.3	154	102.9	-62.7	170.6	0	0	0	120.5
585	P	38.7	Very low	33.6	Very low	105 Å²	105	127.2 Å²	127.2	68%	0.682	78%	0.778	S	S	*	*			cis	-143.9	-178.1	-24.6	39.2	-20.1	0	0	0	116.7
586	S	36.7	Very low	33.9	Very low	98 Å²	98	128.2 Å²	128.2	69%	0.685	78%	0.777	S	S	*	*			trans	107.6	123.6	138.3	78.9	0	0	0	0	122.8
587	N	36.3	Very low	34.2	Very low	163 Å²	163	125.4 Å²	125.4	87%	0.872	77%	0.767	S	S	*	*			trans	78.4	140.1	140.6	-58.1	-10.7	0	0	0	123.8
588	G	35.1	Very low	34.4	Very low	69 Å²	69	130.6 Å²	130.6	71%	0.711	77%	0.769	S	S	*	*			trans	86.1	98.3	170	0	0	0	0	0	114.9
589	V	31.7	Very low	34.6	Very low	140 Å²	140	128.4 Å²	128.4	85%	0.848	77%	0.765	S	S	*	*			cis	71.9	106.5	35.9	-166.9	0	0	0	0	114.8
590	I	33.7	Very low	34.8	Very low	169 Å²	169	129 Å²	129	87%	0.867	76%	0.764	S	S	*	*			trans	179.6	162.5	131.8	-92.7	162.9	0	0	0	109.1
591	S	29.5	Very low	34.8	Very low	103 Å²	103	124.1 Å²	124.1	72%	0.72	75%	0.747	S	S	*	*			trans	-125.5	-160.1	-169.7	-169.2	0	0	0	0	112.3
592	T	34.7	Very low	34.8	Very low	130 Å²	130	131.2 Å²	131.2	80%	0.798	76%	0.759	S	S	*	*			trans	88.4	155	175.5	72.2	0	0	0	0	118
593	S	35.9	Very low	34.7	Very low	91 Å²	91	133.1 Å²	133.1	64%	0.636	76%	0.758	S	S	*	*				-167.5	169	-59.6	53.4	0	0	0	0	112.3
594	D	34	Very low	34.5	Very low	142 Å²	142	136.2 Å²	136.2	76%	0.759	76%	0.759	S	S	*	*			trans	75	163.6	151.7	-60.3	-54.3	0	0	0	123
595	V	36.2	Very low	34.5	Very low	141 Å²	141	132.5 Å²	132.5	86%	0.855	75%	0.752	S	S	*	*			trans	82.2	130.1	162.6	-174.2	0	0	0	0	118
596	K	35.3	Very low	34.3	Very low	163 Å²	163	132.5 Å²	132.5	71%	0.709	75%	0.75	S	S	*	*			cis	-172.9	149.3	-25.2	-154.4	-173.9	-179.3	-142.7	0	110.9
597	E	34.3	Very low	34.2	Very low	122 Å²	122	133.8 Å²	133.8	57%	0.57	75%	0.754	S	S	*	*			trans	62.4	158.2	160.8	-87	173.7	77.8	0	0	118.3
598	R	34.9	Very low	34.2	Very low	219 Å²	219	132.1 Å²	132.1	83%	0.826	75%	0.752	S	S	*	*			cis	-142.2	168.5	12	-151.5	166.6	173.8	117.8	-14.5	113
599	A	34.4	Very low	34.3	Very low	91 Å²	91	133.9 Å²	133.9	75%	0.752	76%	0.759	S	S	*	*			trans	-72.8	-177.7	-173.4	0	0	0	0	0	114.6
600	S	35	Very low	34.3	Very low	106 Å²	106	136.9 Å²	136.9	74%	0.741	76%	0.761	S	S	*	*			cis	-168.6	152.3	27.2	56.1	0	0	0	0	116.9
601	A	34.2	Very low	34.4	Very low	68 Å²	68	135.9 Å²	135.9	56%	0.562	76%	0.763	S	S	*	*			trans	61.8	148.1	146.5	0	0	0	0	0	119.3
602	Y	33.3	Very low	34.6	Very low	229 Å²	229	140.4 Å²	140.4	90%	0.898	77%	0.77	S	S	*	*			cis	-136	164.9	29.9	-92.1	-93.9	0	0	0	116
603	E	32.9	Very low	34.6	Very low	175 Å²	175	139.6 Å²	139.6	82%	0.818	77%	0.769	S	S	*	*			trans	-151.8	164.6	-163.8	-82.9	170.7	93.4	0	0	110.1
604	F	31.9	Very low	34.4	Very low	171 Å²	171	142.3 Å²	142.3	75%	0.75	78%	0.776	S	S	*	*			cis	-169.1	141.6	-13	167.1	-82.1	0	0	0	109.6	T606	F604-T606 HydrophobicContact CE1-CG2 4.46Å; F604-T606 WeakPolarHBondContact CE1-OG1 3.29Å
605	A	34.9	Very low	34.4	Very low	88 Å²	88	141.4 Å²	141.4	73%	0.727	78%	0.776	S	S	*	*			trans	-160.1	119.8	164.6	0	0	0	0	0	110.4
606	T	34.4	Very low	34.1	Very low	104 Å²	104	139.3 Å²	139.3	64%	0.638	77%	0.768	S	S	*	*				50.7	133.3	70.6	2.7	0	0	0	0	114.1	F604	F604-T606 HydrophobicContact CE1-CG2 4.46Å; F604-T606 WeakPolarHBondContact CE1-OG1 3.29Å
607	T	36	Very low	33.9	Very low	126 Å²	126	136.5 Å²	136.5	77%	0.773	77%	0.769	S	S	*	*			cis	-150.1	161.6	24.5	46.8	0	0	0	0	113.8
608	P	35.2	Very low	33.7	Very low	128 Å²	128	139.4 Å²	139.4	83%	0.831	78%	0.783	S	S	*	*			trans	-102.7	154.6	173.3	38.4	-32.7	0	0	0	115.2
609	A	38	Very low	33.6	Very low	105 Å²	105	134.5 Å²	134.5	87%	0.868	78%	0.782	S	S	*	*			trans	-142.5	157.2	170.5	0	0	0	0	0	112.4
610	K	31.6	Very low	33.2	Very low	204 Å²	204	137.8 Å²	137.8	89%	0.887	79%	0.787	S	S	*	*			trans	-107.7	154.5	-172.8	-59.2	166.8	-178.9	167.6	0	111.9
611	T	35.3	Very low	33.1	Very low	147 Å²	147	138.8 Å²	138.8	90%	0.902	79%	0.794	S	S	*	*			trans	-164.8	160.6	134.6	-79.1	0	0	0	0	109.6
612	K	33	Very low	32.9	Very low	199 Å²	199	140.6 Å²	140.6	87%	0.865	80%	0.802	S	S	*	*			trans	-111.4	146.3	-169.3	-49.1	165.8	-179	174.1	0	112
613	S	35.3	Very low	32.8	Very low	112 Å²	112	135.3 Å²	135.3	78%	0.783	80%	0.799	S	S	*	*				-176.4	144.3	125.5	49.8	0	0	0	0	114.1
614	N	32.6	Very low	32.8	Very low	148 Å²	148	135 Å²	135	79%	0.791	80%	0.803	S	S	*	*			trans	-2.5	151.3	150.4	-51.3	-4.5	0	0	0	119.1
615	T	33.2	Very low	32.8	Very low	123 Å²	123	136.4 Å²	136.4	76%	0.755	81%	0.808	S	S	*	*			cis	-160.4	158.1	18.2	-16	0	0	0	0	113.7
616	S	31.2	Very low	32.5	Very low	98 Å²	98	138.2 Å²	138.2	69%	0.685	81%	0.81	S	S	*	*			trans	58.4	119.3	147.1	61.1	0	0	0	0	123.5
617	S	30.8	Very low	32.4	Very low	104 Å²	104	141.7 Å²	141.7	73%	0.727	81%	0.812	S	S	*	*			trans	80.5	117.5	130.2	59.6	0	0	0	0	124
618	Q	30.2	Very low	32.1	Very low	183 Å²	183	147.2 Å²	147.2	86%	0.855	82%	0.818	S	S	*	*			trans	110.1	136.6	134	-79.9	-179.8	11.3	0	0	122.1
619	S	31.6	Very low	31.9	Very low	115 Å²	115	148.4 Å²	148.4	80%	0.804	82%	0.817	S	S	*	*			trans	54.3	106	166.7	49.5	0	0	0	0	119.8
620	N	27.1	Very low	31.9	Very low	161 Å²	161	149 Å²	149	86%	0.861	81%	0.805	S	S	*	*			trans	-70.8	136.7	161	-70.2	-32.1	0	0	0	111.2
621	S	31.6	Very low	32.1	Very low	127 Å²	127	146.4 Å²	146.4	89%	0.888	80%	0.8	S	S	*	*			trans	-141	89.7	158.6	-172.9	0	0	0	0	109.3
622	S	30.6	Very low	31.9	Very low	105 Å²	105	145.1 Å²	145.1	73%	0.734	80%	0.797	S	S	*	*			trans	-103.7	101.4	-174.4	-66.1	0	0	0	0	111.3
623	S	30.6	Very low	31.8	Very low	119 Å²	119	139.2 Å²	139.2	83%	0.832	79%	0.785	S	S	*	*			trans	174.6	70	136.7	-79.9	0	0	0	0	113
624	N	32.8	Very low	31.7	Very low	169 Å²	169	140.9 Å²	140.9	90%	0.904	78%	0.783	S	S	*	*			trans	-95.5	94.9	161.9	-95.1	-35.7	0	0	0	109.5
625	K	33.2	Very low	31.8	Very low	199 Å²	199	139.5 Å²	139.5	87%	0.865	78%	0.782	S	S	*	*			trans	-161.9	148.8	170.1	-110.1	161	-172.4	177.5	0	111.1
626	V	28.8	Very low	31.8	Very low	126 Å²	126	144.2 Å²	144.2	76%	0.764	79%	0.786	S	S	*	*			trans	66.3	69.9	175.4	-160.7	0	0	0	0	116.5
627	W	31.9	Very low	31.8	Very low	177 Å²	177	146.1 Å²	146.1	67%	0.67	79%	0.794	S	S	*	*			trans	-147.4	91.8	136.5	-80.5	125.1	0	0	0	109.6	I630	W627-I630 HydrophobicContact CE3-CD1 3.93Å; W627-I630 HydrophobicContact CE3-CG1 4.48Å; W627-I630 HydrophobicContact CH2-CD1 4.23Å; W627-I630 HydrophobicContact CZ3-CD1 3.54Å; W627-I630 HydrophobicContact CZ3-CG1 4.37Å
628	R	29.1	Very low	31.9	Very low	242 Å²	242	146.9 Å²	146.9	91%	0.913	79%	0.793	S	S	*	*			trans	-143.7	66.8	170.4	-80.4	-169.7	177.9	171.1	-1	109.5
629	L	31.4	Very low	31.9	Very low	154 Å²	154	142.6 Å²	142.6	81%	0.806	79%	0.789	S	S	*	*	S	Bend	trans	-162.4	5.4	176.3	-114.3	160.1	0	0	0	115.7
630	I	38	Very low	31.9	Very low	118 Å²	118	145.7 Å²	145.7	61%	0.605	79%	0.788	S	S	*	*	S	Bend	trans	-113.2	-27	-175.3	-66.8	-177.3	0	0	0	113.4	W627 S632	W627-I630 HydrophobicContact CE3-CD1 3.93Å; W627-I630 HydrophobicContact CE3-CG1 4.48Å; W627-I630 HydrophobicContact CH2-CD1 4.23Å; W627-I630 HydrophobicContact CZ3-CD1 3.54Å; W627-I630 HydrophobicContact CZ3-CG1 4.37Å; I630-S632 VanDerWaalsContact C-N 3.3Å; I630-S632 PolarHBondContact O-N 3.05Å
631	D	35.6	Very low	32.1	Very low	148 Å²	148	144.9 Å²	144.9	79%	0.791	79%	0.789	S	S	*	*	S	Bend	trans	-78.9	-3.5	-175.1	-60.5	-55.3	0	0	0	115.4	A633	D631-A633 VanDerWaalsContact C-N 3.35Å; D631-A633 PolarHBondContact O-N 2.83Å
632	S	31.8	Very low	32.2	Very low	120 Å²	120	143.1 Å²	143.1	84%	0.839	78%	0.777	S	S	*	*	S	Bend	trans	-88.4	17.6	-168.7	-53.3	0	0	0	0	115.6	I630	I630-S632 VanDerWaalsContact C-N 3.3Å; I630-S632 PolarHBondContact O-N 3.05Å
633	A	31	Very low	32.3	Very low	75 Å²	75	143.3 Å²	143.3	62%	0.62	78%	0.778	S	S	*	*			trans	-134.1	57.1	-172.1	0	0	0	0	0	114.2	D631	D631-A633 VanDerWaalsContact C-N 3.35Å; D631-A633 PolarHBondContact O-N 2.83Å
634	M	33.5	Very low	32.8	Very low	147 Å²	147	143.2 Å²	143.2	72%	0.724	78%	0.775	S	S	*	*			trans	-129.4	94.4	178	-85.8	-77.7	-175.1	0	0	112.3	R636	M634-R636 PolarHBondContact O-N 2.86Å
635	P	33.3	Very low	32.9	Very low	119 Å²	119	146.9 Å²	146.9	77%	0.773	78%	0.776	S	S	*	*			trans	-74.1	107.5	173.3	-12.3	28.5	0	0	0	111.1	T637	P635-T637 PolarHBondContact O-N 3.05Å
636	R	34.4	Very low	32.8	Very low	223 Å²	223	147 Å²	147	84%	0.842	78%	0.779	S	S	*	*			trans	-83.6	88.7	172.2	-75.3	-172.3	174	-169.5	-0.6	111.3	M634 V638	M634-R636 PolarHBondContact O-N 2.86Å; R636-V638 PolarHBondContact O-N 3.36Å; R636-V638 VanDerWaalsContact O-N 3.09Å
637	T	31	Very low	33.4	Very low	138 Å²	138	146 Å²	146	85%	0.847	79%	0.785	S	S	*	*			trans	-76.4	87.3	169.8	36	0	0	0	0	111.6	P635 A639	P635-T637 PolarHBondContact O-N 3.05Å; T637-A639 PolarHBondContact O-N 3.36Å
638	V	32.3	Very low	33.3	Very low	119 Å²	119	145.7 Å²	145.7	72%	0.721	79%	0.791	S	S	*	*			trans	-83.8	99.7	174.8	-178.5	0	0	0	0	110.4	R636 K640	R636-V638 PolarHBondContact O-N 3.36Å; R636-V638 VanDerWaalsContact O-N 3.09Å; V638-K640 PolarHBondContact O-N 3.06Å
639	A	31.3	Very low	33.6	Very low	93 Å²	93	140 Å²	140	77%	0.769	79%	0.788	S	S	*	*			trans	-74.8	100.3	171	0	0	0	0	0	110.7	T637 V641	T637-A639 PolarHBondContact O-N 3.36Å; A639-V641 PolarHBondContact O-N 3.26Å
640	K	30.8	Very low	33.8	Very low	180 Å²	180	140.4 Å²	140.4	78%	0.783	79%	0.786	S	S	*	*			trans	-90.9	92	-175.1	-170.3	-177.9	-177.8	-175.6	0	111.5	V638 S642	V638-K640 PolarHBondContact O-N 3.06Å; K640-S642 PolarHBondContact O-N 3.08Å
641	V	32.1	Very low	33.9	Very low	144 Å²	144	140 Å²	140	87%	0.873	79%	0.791	S	S	*	*			trans	-87.8	95.4	170.8	-177.1	0	0	0	0	109.6	A639	A639-V641 PolarHBondContact O-N 3.26Å
642	S	33.4	Very low	33.9	Very low	91 Å²	91	138.5 Å²	138.5	64%	0.636	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-96.1	118.9	172.7	47.7	0	0	0	0	111.1	K640	K640-S642 PolarHBondContact O-N 3.08Å
643	S	32.5	Very low	34.2	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-66.6	134	168.5	-174.3	0	0	0	0	110.3
644	P	39.9	Very low	34.5	Very low	118 Å²	118	145.8 Å²	145.8	77%	0.766	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-70.8	151.3	166.1	31.2	-33.2	0	0	0	110.2
645	R	35.8	Very low	34.9	Very low	245 Å²	245	145.4 Å²	145.4	93%	0.925	79%	0.787	S	S	*	*			trans	-118.2	136.2	160.6	-85.6	-176.4	169.4	176.2	-4.3	107.4
646	E	30.2	Very low	35.2	Very low	201 Å²	201	147 Å²	147	94%	0.939	78%	0.784	S	S	*	*			trans	-73.9	146.2	171.8	-65.3	161.9	133.3	0	0	110.2
647	A	41.5	Very low	35.7	Very low	107 Å²	107	142.2 Å²	142.2	88%	0.884	77%	0.774	S	S	*	*			trans	-149.3	125.1	164.1	0	0	0	0	0	107
648	E	31	Very low	36	Very low	169 Å²	169	142 Å²	142	79%	0.79	77%	0.768	S	S	*	*			trans	-113.1	129.7	-165.8	-175.3	179.4	-165.9	0	0	110.9
649	S	34.9	Very low	36.4	Very low	123 Å²	123	140 Å²	140	86%	0.86	76%	0.764	S	S	*	*			trans	-157.3	128.4	170.9	-67.8	0	0	0	0	109.9
650	Q	35	Very low	36.8	Very low	163 Å²	163	144 Å²	144	76%	0.762	77%	0.767	S	S	*	*			trans	-101	-170	-178.1	-49.4	-179.2	-17.3	0	0	111.1
651	P	40.3	Very low	37.1	Very low	110 Å²	110	141.9 Å²	141.9	71%	0.714	76%	0.764	S	S	*	*			cis	-133.1	-153.2	-15.6	27.5	-2.3	0	0	0	113.3
652	V	36.7	Very low	37.4	Very low	115 Å²	115	141.1 Å²	141.1	70%	0.697	75%	0.751	S	S	*	*			trans	94	100.3	167.8	-172	0	0	0	0	113.4
653	R	36.9	Very low	37.6	Very low	207 Å²	207	145.2 Å²	145.2	78%	0.781	75%	0.753	S	S	*	*				67.7	141.1	82.9	-67.6	-163.9	-161.6	121	-3.3	113.4
654	E	37.5	Very low	38	Very low	141 Å²	141	146.7 Å²	146.7	66%	0.659	75%	0.747	S	S	*	*			cis	-150.3	157.8	17.6	-107.9	127.4	-142.5	0	0	111.2
655	D	41.4	Very low	38	Very low	140 Å²	140	148.1 Å²	148.1	75%	0.749	74%	0.744	S	S	*	*			trans	54.9	153.4	136.5	-57.6	1.5	0	0	0	124.1
656	E	41.1	Very low	38.2	Very low	152 Å²	152	144.6 Å²	144.6	71%	0.71	74%	0.737	S	S	*	*			cis	-170.2	165.7	-30	-145.1	-162.5	166.4	0	0	112
657	L	44	Very low	38.9	Very low	123 Å²	123	140.9 Å²	140.9	64%	0.644	73%	0.73	S	S	*	*			trans	63.8	155.5	159.5	-54.6	171.5	0	0	0	119.6
658	N	36.6	Very low	38.8	Very low	132 Å²	132	139.5 Å²	139.5	71%	0.706	73%	0.727	S	S	*	*			cis	-153.8	145.7	-8.7	-110.6	-18	0	0	0	108.4
659	A	42.2	Very low	39.1	Very low	79 Å²	79	140.1 Å²	140.1	65%	0.653	74%	0.736	S	S	*	*				72.4	141.3	71.1	0	0	0	0	0	114.4
660	E	38.9	Very low	39.2	Very low	176 Å²	176	137.3 Å²	137.3	82%	0.822	73%	0.727	S	S	*	*			cis	-165.2	-163.7	4.8	-135.2	170.1	-170.3	0	0	114.2
661	N	37.2	Very low	39.3	Very low	135 Å²	135	134.9 Å²	134.9	72%	0.722	73%	0.728	S	S	*	*			trans	75.7	129.6	-179.6	-73.8	-23	0	0	0	118.4
662	E	37.8	Very low	39.3	Very low	128 Å²	128	138 Å²	138	60%	0.598	73%	0.732	S	S	*	*			cis	88	145.6	25.2	-59.7	-153.5	104.3	0	0	115.7
663	R	37.5	Very low	39.2	Very low	177 Å²	177	140.9 Å²	140.9	67%	0.668	74%	0.738	S	S	*	*			cis	-160.3	162	7.4	-134.2	179.6	-88	174.2	-3.5	113.6
664	H	41.4	Very low	39	Very low	139 Å²	139	140.5 Å²	140.5	64%	0.644	74%	0.742	S	S	*	*			trans	75.8	126.1	151	-68.8	-58.6	0	0	0	127.8
665	H	40.9	Very low	38.9	Very low	149 Å²	149	139 Å²	139	69%	0.69	75%	0.747	S	S	*	*			trans	70.7	109.5	132.1	-64.1	-43.2	0	0	0	127.4
666	H	40	Very low	38.7	Very low	170 Å²	170	136.6 Å²	136.6	79%	0.787	75%	0.747	S	S	*	*				23.6	161.2	113.9	-68.7	-53.9	0	0	0	123.3
667	P	44.8	Very low	38.3	Very low	123 Å²	123	136.5 Å²	136.5	80%	0.799	75%	0.75	S	S	*	*			cis	-141.6	-179.7	-39.2	41.5	-24.2	0	0	0	114
668	G	38.8	Very low	38	Very low	79 Å²	79	137.7 Å²	137.7	81%	0.814	75%	0.752	S	S	*	*			trans	173.7	143.2	166.9	0	0	0	0	0	116.5
669	D	37.7	Very low	37.9	Very low	181 Å²	181	136.7 Å²	136.7	97%	0.968	75%	0.751	S	S	*	*			trans	-49.3	160	-174.3	-80.2	-60.7	0	0	0	119
670	G	37	Very low	37.5	Very low	65 Å²	65	138.3 Å²	138.3	67%	0.67	76%	0.758	S	S	*	*			trans	167.4	41.7	168.9	0	0	0	0	0	122.2
671	S	36.9	Very low	37.7	Very low	112 Å²	112	135 Å²	135	78%	0.783	75%	0.751	S	S	*	*			trans	70.8	132.2	164	77.8	0	0	0	0	121.6
672	H	39.6	Very low	37.6	Very low	175 Å²	175	133.1 Å²	133.1	81%	0.81	75%	0.749	S	S	*	*			trans	52.7	115.5	157.1	-61.6	-56.6	0	0	0	124
673	Q	34.8	Very low	37.7	Very low	175 Å²	175	135.1 Å²	135.1	82%	0.818	76%	0.76	S	S	*	*			trans	-60.2	152.9	162.2	-55.8	126	-40	0	0	112.2
674	K	33.5	Very low	37.9	Very low	200 Å²	200	131.4 Å²	131.4	87%	0.87	76%	0.759	S	S	*	*			cis	71.5	87.6	-2	-150.5	-175.9	-169.6	-179.6	0	119.5
675	S	35.7	Very low	37.9	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	76%	0.764	S	S	*	*			trans	-174.4	125.3	139.1	53.7	0	0	0	0	109.5
676	A	35.4	Very low	37.7	Very low	91 Å²	91	129.1 Å²	129.1	75%	0.752	77%	0.767	S	S	*	*			cis	89.2	171.5	39.2	0	0	0	0	0	114
677	L	34.7	Very low	37.3	Very low	149 Å²	149	128.3 Å²	128.3	78%	0.78	77%	0.768	S	S	*	*			trans	75.6	123.5	-167.6	-45.1	173.5	0	0	0	113.2
678	H	36.1	Very low	36.8	Very low	148 Å²	148	129.1 Å²	129.1	69%	0.685	77%	0.765	S	S	*	*			cis	-147.1	132.4	-10.2	-106.5	-72.2	0	0	0	107.1
679	T	36.2	Very low	36.5	Very low	112 Å²	112	129.7 Å²	129.7	69%	0.687	76%	0.756	S	S	*	*				40.8	138.8	100.5	74.9	0	0	0	0	115.7
680	S	33.2	Very low	36.4	Very low	113 Å²	113	130.1 Å²	130.1	79%	0.79	75%	0.75	S	S	*	*			cis	-156.9	173.5	8.4	-113.3	0	0	0	0	111.5
681	P	42.9	Very low	36.2	Very low	106 Å²	106	131.5 Å²	131.5	69%	0.688	75%	0.749	S	S	*	*			trans	-117.3	-178.7	-149.1	44.6	-38	0	0	0	116.7
682	S	35.5	Very low	36.1	Very low	95 Å²	95	133.4 Å²	133.4	66%	0.664	75%	0.749	S	S	*	*			trans	31.3	153.6	136.9	74.9	0	0	0	0	121.6
683	M	40	Very low	35.7	Very low	170 Å²	170	131.7 Å²	131.7	84%	0.837	75%	0.75	S	S	*	*				174.9	-167	59.3	-132.8	-169.8	172.4	0	0	107.4
684	P	41	Very low	35.6	Very low	99 Å²	99	127.2 Å²	127.2	64%	0.643	75%	0.751	S	S	*	*			cis	-129.2	176.2	-32.8	38.1	-23	0	0	0	113.7
685	P	42	Very low	35.6	Very low	117 Å²	117	121 Å²	121	76%	0.76	74%	0.744	S	S	*	*			trans	-109.1	171.9	163.4	39.7	-31.7	0	0	0	114
686	V	35.9	Very low	35.4	Very low	123 Å²	123	124.3 Å²	124.3	75%	0.745	75%	0.753	S	S	*	*			trans	-140.2	117	173.9	-169.2	0	0	0	0	106.2
687	L	32.9	Very low	35.2	Very low	154 Å²	154	123.5 Å²	123.5	81%	0.806	75%	0.753	S	S	*	*				57.9	144.1	78.6	-54	178.7	0	0	0	113.1
688	L	33.8	Very low	35.2	Very low	139 Å²	139	123.1 Å²	123.1	73%	0.728	76%	0.757	S	S	*	*			cis	-148.8	142.4	26.3	-104.4	103.1	0	0	0	113.8
689	S	32	Very low	34.8	Very low	91 Å²	91	121.7 Å²	121.7	64%	0.636	76%	0.764	S	S	*	*			trans	58.4	149.5	131.1	86.6	0	0	0	0	121.6
690	K	35.7	Very low	34.7	Very low	191 Å²	191	119.5 Å²	119.5	83%	0.83	76%	0.763	S	S	*	*			cis	-136.7	-159.4	13.4	-58.2	173.8	-177.8	175.9	0	108.8
691	S	33.3	Very low	34.7	Very low	94 Å²	94	123.8 Å²	123.8	66%	0.657	77%	0.768	S	S	*	*			cis	-161.4	164.9	3.2	-143.8	0	0	0	0	114.3
692	I	34.2	Very low	34.2	Very low	152 Å²	152	126.6 Å²	126.6	78%	0.779	78%	0.777	S	S	*	*			trans	-7.2	148	142.3	-63.6	167	0	0	0	117.7
693	V	31.8	Very low	34.1	Very low	138 Å²	138	131.7 Å²	131.7	84%	0.836	79%	0.787	S	S	*	*			cis	178	149.3	-27.3	121.1	0	0	0	0	108.7
694	G	32.7	Very low	33.9	Very low	81 Å²	81	131.2 Å²	131.2	84%	0.835	79%	0.786	S	S	*	*			trans	84.4	157.1	169.7	0	0	0	0	0	116.2
695	G	32.7	Very low	33.6	Very low	71 Å²	71	133.7 Å²	133.7	73%	0.732	79%	0.794	S	S	*	*			cis	172.1	126.6	-9.6	0	0	0	0	0	113.4
696	N	31.9	Very low	33.2	Very low	177 Å²	177	134.8 Å²	134.8	95%	0.947	79%	0.789	S	S	*	*			trans	55.4	128.8	171.5	-67	-6.3	0	0	0	120
697	G	31.2	Very low	33	Very low	73 Å²	73	134.3 Å²	134.3	75%	0.753	79%	0.791	S	S	*	*			trans	149.4	122.9	148.4	0	0	0	0	0	118.6
698	V	33.5	Very low	33	Very low	142 Å²	142	133 Å²	133	86%	0.861	79%	0.785	S	S	*	*			trans	57.7	91.4	147.9	-164	0	0	0	0	119.6	G700	V698-G700 PolarHBondContact O-N 2.96Å
699	S	29.1	Very low	32.9	Very low	117 Å²	117	131.1 Å²	131.1	82%	0.818	79%	0.789	S	S	*	*			trans	16.2	93.2	136.7	177.4	0	0	0	0	119.6
700	G	34.5	Very low	32.8	Very low	66 Å²	66	133 Å²	133	68%	0.68	80%	0.801	S	S	*	*			trans	-121	142.6	154.8	0	0	0	0	0	110.8	V698	V698-G700 PolarHBondContact O-N 2.96Å
701	K	31.6	Very low	32.7	Very low	204 Å²	204	128.8 Å²	128.8	89%	0.887	79%	0.787	S	S	*	*			trans	-105.4	75	-177.8	-78	-176.7	177.8	171.6	0	112.4
702	D	33.9	Very low	32.7	Very low	164 Å²	164	133 Å²	133	88%	0.877	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.5	127.8	170	-68.3	-46.3	0	0	0	111.3
703	K	33.4	Very low	32.5	Very low	203 Å²	203	133.2 Å²	133.2	88%	0.883	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-96.9	133.3	172.1	-85.7	-171.2	172.9	-176.1	0	110.5
704	I	34.3	Very low	32.5	Very low	159 Å²	159	132.7 Å²	132.7	82%	0.815	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-62	139.4	-175.6	-64.1	165.4	0	0	0	111.3
705	N	35.6	Very low	32.5	Very low	152 Å²	152	135.6 Å²	135.6	81%	0.813	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-60.6	133.9	-180	-83.1	-44.9	0	0	0	113	S707	N705-S707 PolarHBondContact O-N 3.07Å
706	H	32.9	Very low	32.5	Very low	140 Å²	140	138 Å²	138	65%	0.648	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-71.7	127.1	177.7	-85.4	-112.7	0	0	0	112.2	F569	F569-H706 AromaticContact CE1-CE1 3.3Å; F569-H706 WeakPolarHBondContact CE1-CE1 3.2Å; F569-H706 AromaticContact CE1-ND1 3.76Å; F569-H706 AromaticContact CE1-NE2 3.53Å; F569-H706 AromaticContact CE2-CE1 3.84Å; F569-H706 AromaticContact CZ-CE1 3.19Å; F569-H706 WeakPolarHBondContact CZ-CE1 3.37Å; F569-H706 AromaticContact CZ-NE2 3.41Å; F569-H706 WeakPolarHBondContact CZ-NE2 3.49Å
707	S	31.6	Very low	32.5	Very low	112 Å²	112	135.5 Å²	135.5	78%	0.783	78%	0.783	S	S	*	*			trans	-138.3	69.1	166.8	42.6	0	0	0	0	110.2	N705	N705-S707 PolarHBondContact O-N 3.07Å
708	N	32.6	Very low	32.4	Very low	127 Å²	127	139.1 Å²	139.1	68%	0.679	78%	0.784	S	S	*	*			trans	-146.8	106.1	178.8	-97.3	-24	0	0	0	112.5	I711	N708-I711 WeakPolarHBondContact OD1-CD1 3.43Å
709	A	32.6	Very low	32.3	Very low	100 Å²	100	138.8 Å²	138.8	83%	0.826	78%	0.776	S	S	*	*			trans	-164.8	126.3	156.7	0	0	0	0	0	108.2
710	C	30.8	Very low	32.4	Very low	130 Å²	130	139 Å²	139	88%	0.878	77%	0.772	S	S	*	*	S	Bend	cis	-109.4	143.5	1.3	-55	0	0	0	0	111
711	I	32.2	Very low	32.2	Very low	103 Å²	103	140.8 Å²	140.8	53%	0.528	77%	0.774	S	S	.	*			trans	-129.4	144	175.9	-80.7	-173.1	0	0	0	109.1	N708	N708-I711 WeakPolarHBondContact OD1-CD1 3.43Å
712	E	33.2	Very low	32.4	Very low	182 Å²	182	137.6 Å²	137.6	85%	0.85	77%	0.772	S	S	*	*			trans	44.7	133.5	161.8	-71	151.9	-153.4	0	0	121.5
713	D	29.9	Very low	32.2	Very low	156 Å²	156	141 Å²	141	83%	0.834	77%	0.773	S	S	*	*				-145.2	161.5	125.6	-151.7	-21.4	0	0	0	109.4
714	I	32.3	Very low	32.2	Very low	127 Å²	127	136 Å²	136	65%	0.651	76%	0.763	S	S	*	*	S	Bend	trans	74.4	82.7	180	-44.3	173.7	0	0	0	115.8
715	N	31.9	Very low	32.3	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	76%	0.758	S	S	*	*				-179.1	125.6	125.9	-90	-33.5	0	0	0	114
716	S	33.3	Very low	32.2	Very low	121 Å²	121	130.8 Å²	130.8	85%	0.846	75%	0.753	S	S	*	*			trans	65.4	171.9	176.9	69.7	0	0	0	0	116
717	V	32.6	Very low	32.4	Very low	125 Å²	125	132.1 Å²	132.1	76%	0.758	76%	0.759	S	S	*	*			cis	-139.8	125.4	11.3	178.2	0	0	0	0	107.8
718	L	29.5	Very low	32.4	Very low	149 Å²	149	131.8 Å²	131.8	78%	0.78	76%	0.757	S	S	*	*				78.7	108.9	76	-143.1	92.3	0	0	0	118.4
719	I	31.2	Very low	32.5	Very low	135 Å²	135	131 Å²	131	69%	0.692	76%	0.757	S	S	*	*			trans	80	121.1	139.7	-91.2	173.7	0	0	0	124.4
720	T	29.8	Very low	32.7	Very low	121 Å²	121	134.4 Å²	134.4	74%	0.742	76%	0.755	S	S	*	*			trans	62.8	159.9	150.3	60.2	0	0	0	0	121.5
721	S	30.8	Very low	33	Very low	103 Å²	103	134.4 Å²	134.4	72%	0.72	75%	0.752	S	S	*	*			cis	-174.6	139.2	-25.1	-91.2	0	0	0	0	111.5
722	T	35.2	Very low	33.2	Very low	138 Å²	138	132.5 Å²	132.5	85%	0.847	76%	0.758	S	S	*	*			trans	176.1	132.2	147.5	30.9	0	0	0	0	108.4
723	R	30.9	Very low	33.3	Very low	235 Å²	235	131.8 Å²	131.8	89%	0.887	76%	0.76	S	S	*	*				54.5	127.2	68.6	-101.4	-166.6	165.5	-178.4	-4.2	113.4
724	S	33.3	Very low	33.6	Very low	98 Å²	98	128.6 Å²	128.6	69%	0.685	76%	0.755	S	S	*	*			cis	-144.3	-154	0.6	-51.7	0	0	0	0	108.2
725	S	35.2	Very low	33.8	Very low	101 Å²	101	126.8 Å²	126.8	71%	0.706	77%	0.767	S	S	*	*			cis	-165.8	159.8	-1.1	-130.1	0	0	0	0	110
726	S	35.5	Very low	33.9	Very low	101 Å²	101	124 Å²	124	71%	0.706	77%	0.772	S	S	*	*			trans	65.1	149.3	155.9	-62.9	0	0	0	0	119.5
727	Q	35.3	Very low	34	Very low	167 Å²	167	121.4 Å²	121.4	78%	0.78	77%	0.765	S	S	*	*			cis	-160.2	139.3	-4.3	-124.7	169.7	11.1	0	0	112.3
728	S	32.5	Very low	34.2	Very low	105 Å²	105	122.4 Å²	122.4	73%	0.734	77%	0.772	S	S	*	*			trans	55.8	156.7	149.8	60.2	0	0	0	0	119.9
729	V	34.9	Very low	34.5	Very low	111 Å²	111	119.4 Å²	119.4	67%	0.673	77%	0.769	S	S	*	*			cis	-153	126.9	36.9	163.8	0	0	0	0	111.5
730	Q	36.4	Very low	34.7	Very low	171 Å²	171	117.8 Å²	117.8	80%	0.799	78%	0.775	S	S	*	*			trans	52.8	154.6	142.8	-61.2	173.5	-10.1	0	0	121.8
731	T	36.9	Very low	35	Very low	130 Å²	130	118.1 Å²	118.1	80%	0.798	78%	0.777	S	S	*	*			cis	-158.6	145.1	0.6	2.3	0	0	0	0	113.7
732	G	35.8	Very low	35.4	Very low	64 Å²	64	119 Å²	119	66%	0.66	78%	0.778	S	S	*	*			trans	70.5	164.5	155.8	0	0	0	0	0	119.2
733	N	35.2	Very low	35.5	Very low	166 Å²	166	117.6 Å²	117.6	89%	0.888	77%	0.774	S	S	*	*			cis	-173.6	162.3	-16.4	-101.6	-6	0	0	0	108.3
734	A	37.9	Very low	36	Very low	90 Å²	90	111.4 Å²	111.4	74%	0.744	77%	0.767	S	S	*	*			cis	-169.7	146	-28.8	0	0	0	0	0	110.2
735	G	34.9	Very low	36.3	Very low	88 Å²	88	111.6 Å²	111.6	91%	0.907	77%	0.768	S	S	*	*			trans	77.3	158.9	173.6	0	0	0	0	0	116.6
736	G	34.8	Very low	36.3	Very low	84 Å²	84	116.2 Å²	116.2	87%	0.866	78%	0.775	S	S	*	*			cis	167.6	154.1	-9.9	0	0	0	0	0	113.1
737	G	35.9	Very low	36.4	Very low	68 Å²	68	116 Å²	116	70%	0.701	78%	0.78	S	S	*	*			trans	112.3	114.4	159.3	0	0	0	0	0	120.4
738	T	36.4	Very low	36.4	Very low	146 Å²	146	113.4 Å²	113.4	90%	0.896	79%	0.787	S	S	*	*				43.6	148	125.7	54.6	0	0	0	0	123.4
739	A	35.9	Very low	36.4	Very low	86 Å²	86	113 Å²	113	71%	0.711	79%	0.79	S	S	*	*			cis	-174.7	156.5	-13.7	0	0	0	0	0	112.4
740	A	34.3	Very low	36.5	Very low	100 Å²	100	114.8 Å²	114.8	83%	0.826	80%	0.801	S	S	*	*			trans	58	172.2	156.9	0	0	0	0	0	118.1
741	V	36.8	Very low	36.5	Very low	129 Å²	129	111.9 Å²	111.9	78%	0.782	80%	0.799	S	S	*	*			cis	-142.1	164	18.4	175.6	0	0	0	0	110.8
742	T	38.6	Very low	36.5	Very low	122 Å²	122	110.2 Å²	110.2	75%	0.748	80%	0.799	S	S	*	*			trans	-33.8	174.4	179.9	66.7	0	0	0	0	119.9
743	S	38.7	Very low	36.4	Very low	108 Å²	108	112 Å²	112	76%	0.755	80%	0.801	S	S	*	*			cis	-174.2	175.1	19.6	4.5	0	0	0	0	109.5
744	S	39.7	Very low	36.5	Very low	105 Å²	105	112.4 Å²	112.4	73%	0.734	80%	0.8	S	S	*	*			cis	177.6	153	-28.7	-173.5	0	0	0	0	111
745	S	40	Very low	36.5	Very low	102 Å²	102	112.1 Å²	112.1	71%	0.713	79%	0.793	S	S	*	*			trans	67.1	157	161.7	72.4	0	0	0	0	120
746	K	36.4	Very low	36.7	Very low	197 Å²	197	113.1 Å²	113.1	86%	0.857	79%	0.785	S	S	*	*			cis	-165.8	144.4	-18.7	-99.2	171.2	-177.5	179.1	0	105.5
747	A	36.6	Very low	36.8	Very low	97 Å²	97	118.4 Å²	118.4	80%	0.802	79%	0.788	S	S	*	*			cis	89.3	112.2	36.1	0	0	0	0	0	116
748	A	34.8	Very low	36.9	Very low	112 Å²	112	126.7 Å²	126.7	93%	0.926	80%	0.798	S	S	*	*			trans	-172.5	149.8	156.8	0	0	0	0	0	112.4
749	A	33.4	Very low	37.2	Very low	98 Å²	98	125 Å²	125	81%	0.81	79%	0.789	S	S	*	*			trans	-162.3	153.5	173.8	0	0	0	0	0	112.2
750	V	36.8	Very low	37.2	Very low	148 Å²	148	126.6 Å²	126.6	90%	0.897	80%	0.795	S	S	*	*			trans	-147.1	165.9	171.3	-167	0	0	0	0	109.9
751	S	35.7	Very low	37.2	Very low	109 Å²	109	125.8 Å²	125.8	76%	0.762	79%	0.788	S	S	*	*			trans	-139.8	175.4	-164.3	-49.8	0	0	0	0	114.9
752	A	36.9	Very low	37.1	Very low	96 Å²	96	127.1 Å²	127.1	79%	0.793	79%	0.789	S	S	*	*			trans	76.2	153.9	165.3	0	0	0	0	0	116.8
753	S	35.3	Very low	37.1	Very low	101 Å²	101	128 Å²	128	71%	0.706	79%	0.794	S	S	*	*			cis	-163.4	153.4	-5.8	-126.3	0	0	0	0	113.1
754	M	37.3	Very low	36.9	Very low	174 Å²	174	126.7 Å²	126.7	86%	0.857	79%	0.79	S	S	*	*			trans	64	155.4	153	-63.1	177.5	84.1	0	0	118.6
755	S	37.4	Very low	37	Very low	85 Å²	85	126.5 Å²	126.5	59%	0.594	79%	0.786	S	S	*	*			cis	-166.6	158.7	-14.5	44.6	0	0	0	0	111.6
756	S	38.9	Very low	36.9	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	79%	0.793	S	S	*	*			trans	63.8	148.7	151	52.9	0	0	0	0	119.9
757	E	36.5	Very low	36.7	Very low	195 Å²	195	126.6 Å²	126.6	91%	0.911	79%	0.791	S	S	*	*			cis	-131.2	-136.5	3.7	-73.5	-155.2	113.1	0	0	114.5
758	R	38.2	Very low	36.8	Very low	243 Å²	243	126.8 Å²	126.8	92%	0.917	79%	0.793	S	S	*	*			trans	-122.9	169.8	-149.8	-103.2	-170.3	167.5	-160.3	-1.6	116
759	P	43.8	Very low	36.8	Very low	109 Å²	109	128.1 Å²	128.1	71%	0.708	79%	0.785	S	S	*	*			trans	-112.8	-179.3	-166.4	43.7	-37	0	0	0	115.7
760	S	35.6	Very low	37	Very low	121 Å²	121	130 Å²	130	85%	0.846	78%	0.781	S	S	*	*			trans	127.4	146.7	161.9	-62.5	0	0	0	0	111.9
761	A	34.9	Very low	36.9	Very low	82 Å²	82	128.2 Å²	128.2	68%	0.678	77%	0.774	S	S	*	*			cis	-170.1	-170.9	-20.3	0	0	0	0	0	108.9
762	I	34.6	Very low	37	Very low	157 Å²	157	128.5 Å²	128.5	81%	0.805	78%	0.777	S	S	*	*			trans	82.7	117.9	151.2	-71.3	167.3	0	0	0	119.8
763	V	36.9	Very low	36.8	Very low	140 Å²	140	131.1 Å²	131.1	85%	0.848	78%	0.777	S	S	*	*			trans	78.6	150.7	148.7	167.2	0	0	0	0	120.7
764	A	34.6	Very low	37.2	Very low	82 Å²	82	131.1 Å²	131.1	68%	0.678	78%	0.775	S	S	*	*			trans	-135.1	-156.8	-179.7	0	0	0	0	0	107.3
765	P	42.7	Very low	37	Very low	100 Å²	100	131.8 Å²	131.8	65%	0.649	77%	0.773	S	S	*	*			cis	-118.1	-173.6	-30.1	39.8	-25.4	0	0	0	111
766	H	37	Very low	36.9	Very low	183 Å²	183	136.7 Å²	136.7	85%	0.847	79%	0.787	S	S	*	*				174.4	163.2	123.6	-101.3	-78	0	0	0	112.4
767	S	33.4	Very low	36.7	Very low	118 Å²	118	142 Å²	142	83%	0.825	79%	0.79	S	S	*	*			trans	-108.4	132.3	-169.8	-41.5	0	0	0	0	113.2
768	A	38.3	Very low	36.7	Very low	102 Å²	102	142 Å²	142	84%	0.843	79%	0.79	S	S	*	*			trans	-177.1	165.8	152	0	0	0	0	0	110.7
769	N	34.7	Very low	36.4	Very low	139 Å²	139	136.9 Å²	136.9	74%	0.743	79%	0.786	S	S	*	*			cis	-168.1	167.2	-47.2	-160.9	-2.1	0	0	0	107.6
770	L	37.5	Very low	36	Very low	139 Å²	139	143.9 Å²	143.9	73%	0.728	80%	0.798	S	S	*	*			trans	68	116.2	164.9	-55	170.4	0	0	0	116.2
771	S	34.7	Very low	35.8	Very low	109 Å²	109	143.2 Å²	143.2	76%	0.762	79%	0.794	S	S	*	*				76.6	143	92.8	86.9	0	0	0	0	114.9
772	S	37.4	Very low	35.8	Very low	116 Å²	116	149.8 Å²	149.8	81%	0.811	80%	0.801	S	S	*	*			cis	-153.3	171.2	22	58.8	0	0	0	0	115.5
773	N	33.4	Very low	35.9	Very low	150 Å²	150	150.3 Å²	150.3	80%	0.802	80%	0.8	S	S	*	*			trans	-68.2	-176	171.6	-112.8	-18.9	0	0	0	113.5
774	P	42.9	Very low	35.7	Very low	102 Å²	102	149.3 Å²	149.3	66%	0.662	79%	0.794	S	S	*	*			cis	-141.1	-177.5	-3.2	33.4	-10.3	0	0	0	117.6
775	F	33	Very low	35.7	Very low	187 Å²	187	155.2 Å²	155.2	82%	0.82	81%	0.805	S	S	*	*			trans	60.7	130.3	144.8	-102.7	-119.1	0	0	0	122.5
776	Q	36.3	Very low	35.4	Very low	188 Å²	188	158.7 Å²	158.7	88%	0.879	81%	0.813	S	S	*	*				-169.5	177.3	91.1	-154.7	157.2	10.4	0	0	111.7
777	R	34.2	Very low	35.3	Very low	221 Å²	221	153.2 Å²	153.2	83%	0.834	81%	0.805	S	S	*	*			trans	-98.4	158.1	-172.5	-56.6	170.9	173.6	169.5	-4.2	113.4
778	Q	36.7	Very low	35.4	Very low	193 Å²	193	155.2 Å²	155.2	90%	0.902	81%	0.806	S	S	*	*				-165.5	169.5	119.9	-109.2	175.4	21.6	0	0	113.7
779	T	31.4	Very low	35.4	Very low	136 Å²	136	156.8 Å²	156.8	83%	0.834	81%	0.805	S	S	*	*			trans	-140.9	155.1	-172.3	51	0	0	0	0	112
780	R	36.9	Very low	35.3	Very low	256 Å²	256	153.2 Å²	153.2	97%	0.966	80%	0.801	S	S	*	*			trans	-157.6	170.7	161.4	-113.9	170.7	-174.1	-166.3	0.5	111.9
781	S	29.8	Very low	35	Very low	108 Å²	108	152 Å²	152	76%	0.755	80%	0.804	S	S	*	*			trans	-151.8	-173.7	-157.3	63.8	0	0	0	0	114.5
782	R	35.2	Very low	35	Very low	219 Å²	219	156.6 Å²	156.6	83%	0.826	81%	0.81	S	S	*	*			trans	84.1	151.9	-174.6	-62.8	-178	165.2	-178.5	-4.8	114.1
783	Q	36.8	Very low	34.7	Very low	168 Å²	168	157.6 Å²	157.6	79%	0.785	81%	0.812	S	S	*	*			cis	-142.6	-176	11.6	-142.2	148.6	-9.8	0	0	112.8
784	T	33.3	Very low	35	Very low	119 Å²	119	156.1 Å²	156.1	73%	0.73	81%	0.811	S	S	*	*			trans	-128.5	151.9	-160.4	49.8	0	0	0	0	114.9
785	F	34	Very low	34.5	Very low	207 Å²	207	154.7 Å²	154.7	91%	0.908	80%	0.803	S	S	*	*			trans	-150.1	173.3	144.8	-136.6	-100.3	0	0	0	113
786	H	37.5	Very low	34.4	Very low	173 Å²	173	148.1 Å²	148.1	80%	0.801	78%	0.78	S	S	*	*			trans	-110	154.4	-152.6	-88.5	-109.7	0	0	0	118
787	G	34.2	Very low	34.2	Very low	67 Å²	67	144.2 Å²	144.2	69%	0.691	77%	0.765	S	S	*	*			trans	118.3	137.8	147.2	0	0	0	0	0	116
788	L	35.4	Very low	33.9	Very low	160 Å²	160	139.5 Å²	139.5	84%	0.838	76%	0.76	S	S	*	*			cis	-148.9	150	-11	-91.8	174.2	0	0	0	109.9
789	T	37.3	Very low	33.5	Very low	136 Å²	136	141 Å²	141	83%	0.834	76%	0.758	S	S	*	*			trans	25.1	125.5	156	56.4	0	0	0	0	121.1
790	G	32.9	Very low	33.3	Very low	64 Å²	64	140.3 Å²	140.3	66%	0.66	75%	0.753	S	S	*	*			cis	157.8	167.9	-7.8	0	0	0	0	0	114.9
791	S	32.3	Very low	33	Very low	113 Å²	113	135.8 Å²	135.8	79%	0.79	75%	0.747	S	S	*	*			trans	59.8	140.4	160.7	54.6	0	0	0	0	120.3
792	K	34	Very low	32.9	Very low	205 Å²	205	138.3 Å²	138.3	89%	0.891	75%	0.745	S	S	*	*			cis	-153.5	176	-0.9	-116.3	165.3	-173	177.7	0	110.8
793	T	31	Very low	32.5	Very low	138 Å²	138	136.8 Å²	136.8	85%	0.847	75%	0.745	S	S	*	*			trans	-89.5	168.4	-162.2	37.1	0	0	0	0	116.2
794	P	38.9	Very low	32.1	Very low	119 Å²	119	138.7 Å²	138.7	77%	0.773	75%	0.745	S	S	*	*			trans	-105.2	172.4	-166.1	41.2	-35.9	0	0	0	114.7
795	S	34.3	Very low	31.9	Very low	71 Å²	71	138.3 Å²	138.3	50%	0.497	74%	0.738	S	S	.	*			trans	-168.5	-156.6	142.8	66.9	0	0	0	0	115.6	T440 E441	T440-S795 WeakPolarHBondContact CG2-OG 3.4Å; E441-S795 VanDerWaalsContact CD-OG 3.23Å; E441-S795 WeakPolarHBondContact OE1-CB 3.47Å; E441-S795 WeakPolarHBondContact OE2-CB 3.38Å; E441-S795 PolarHBondContact OE2-OG 2.73Å
796	S	30.2	Very low	31.8	Very low	49 Å²	49	137.4 Å²	137.4	34%	0.343	74%	0.737	S	S	.	*			trans	-112.7	-176.9	-136.4	71.9	0	0	0	0	119.1	E441	E441-S796 VanDerWaalsContact CG-OG 3.23Å; E441-S796 WeakPolarHBondContact CG-OG 3.36Å
797	L	32	Very low	31.4	Very low	107 Å²	107	136.5 Å²	136.5	56%	0.56	74%	0.736	S	S	*	*			trans	91.7	88.3	159.8	-78	161.2	0	0	0	121.6	T440	T440-L797 VanDerWaalsContact C-CD1 3.5Å
798	V	28	Very low	31.3	Very low	121 Å²	121	141.9 Å²	141.9	73%	0.733	74%	0.741	S	S	*	*				64.8	141.3	115.5	169.6	0	0	0	0	122.1
799	R	27	Very low	31	Very low	226 Å²	226	140.8 Å²	140.8	85%	0.853	74%	0.735	S	S	*	*			trans	85.8	94.1	163.4	-88.3	170.2	-179.5	174.7	0.6	120
800	T	28	Very low	30.7	Very low	121 Å²	121	142.6 Å²	142.6	74%	0.742	73%	0.734	S	S	*	*				62.2	112.5	121.3	-45.6	0	0	0	0	120.1
801	L	30.2	Very low	30.5	Very low	160 Å²	160	146.2 Å²	146.2	84%	0.838	74%	0.737	S	S	*	*				-169.6	173.1	117	-99.1	174.4	0	0	0	112.3
802	F	27.5	Very low	30.4	Very low	161 Å²	161	146.6 Å²	146.6	71%	0.706	73%	0.734	S	S	*	*			trans	-80	163.7	-161	-83.6	-104.7	0	0	0	118
803	F	26.8	Very low	30.1	Very low	187 Å²	187	143.7 Å²	143.7	82%	0.82	73%	0.728	S	S	*	*			trans	59.4	110.9	153.7	-83.7	-69.4	0	0	0	117.2
804	R	28.4	Very low	29.9	Very low	209 Å²	209	144.1 Å²	144.1	79%	0.789	72%	0.724	S	S	*	*				-178.1	155.5	79.9	-84.5	179.5	69.9	177.7	-2.2	113
805	D	30.2	Very low	29.6	Very low	110 Å²	110	145.5 Å²	145.5	59%	0.588	72%	0.724	S	S	*	*			trans	40.3	148.2	139.2	-43.7	-21.7	0	0	0	125.1
806	H	30.9	Very low	29.6	Very low	189 Å²	189	148 Å²	148	88%	0.875	74%	0.741	S	S	*	*			trans	82.1	166.2	156.7	-100.4	-100.9	0	0	0	121.5
807	I	30.3	Very low	29.6	Very low	153 Å²	153	151.6 Å²	151.6	79%	0.785	76%	0.761	S	S	*	*			trans	90.5	119.6	-163.5	-62.6	168.3	0	0	0	111.5
808	F	30.8	Very low	29.5	Very low	181 Å²	181	154.4 Å²	154.4	79%	0.794	77%	0.771	S	S	*	*			cis	-152	-153.6	7.7	-138.1	-137.2	0	0	0	111
809	L	29.3	Very low	29.5	Very low	136 Å²	136	155.1 Å²	155.1	71%	0.712	78%	0.775	S	S	*	*				-150.2	-176.4	-106.1	-128.7	164.7	0	0	0	110.8
810	Q	30.8	Very low	29.8	Very low	174 Å²	174	149.5 Å²	149.5	81%	0.813	77%	0.771	S	S	*	*			trans	69.6	139.7	-174.5	-62.4	-171	-7.8	0	0	115.3
811	L	30.1	Very low	30.3	Very low	141 Å²	141	149.4 Å²	149.4	74%	0.738	77%	0.772	S	S	*	*			cis	-146.9	128.6	-0.5	-152.1	64.6	0	0	0	105.4
812	V	29.2	Very low	30.1	Very low	120 Å²	120	145.8 Å²	145.8	73%	0.727	77%	0.765	S	S	*	*				47.6	122.9	82	-178.1	0	0	0	0	111.8
813	L	27.8	Very low	30	Very low	145 Å²	145	144.2 Å²	144.2	76%	0.759	77%	0.769	S	S	*	*			cis	-145	173.5	25.4	-167.7	59.8	0	0	0	114.1
814	L	28.1	Very low	30	Very low	146 Å²	146	146.3 Å²	146.3	76%	0.764	77%	0.771	S	S	*	*			trans	-49	157.2	171.1	-57.3	156.3	0	0	0	116.8
815	I	32.1	Very low	30	Very low	149 Å²	149	143.7 Å²	143.7	76%	0.764	77%	0.773	S	S	*	*				-177.9	138	102.5	-89.8	161.6	0	0	0	110.8	V817	I815-V817 HydrophobicContact CG2-CG2 3.9Å
816	S	34.1	Very low	29.9	Very low	124 Å²	124	147 Å²	147	87%	0.867	78%	0.782	S	S	*	*			trans	-116.9	130	164.1	-59.8	0	0	0	0	109.4
817	V	30.5	Very low	29.8	Very low	123 Å²	123	145.8 Å²	145.8	75%	0.745	78%	0.776	S	S	*	*			trans	-144.1	141.9	163.8	-168.3	0	0	0	0	108.8	I815	I815-V817 HydrophobicContact CG2-CG2 3.9Å
818	Q	29.4	Very low	29.6	Very low	166 Å²	166	142 Å²	142	78%	0.776	76%	0.764	S	S	*	*			trans	-71	172.2	171.9	-54.8	101.1	-92.7	0	0	112.4
819	V	28.7	Very low	29.5	Very low	136 Å²	136	141 Å²	141	82%	0.824	76%	0.761	S	S	*	*				179.4	136.4	113.6	149.2	0	0	0	0	110.2
820	S	33.2	Very low	29.4	Very low	108 Å²	108	139.6 Å²	139.6	76%	0.755	76%	0.758	S	S	*	*			trans	-87.5	155.3	172.3	-49.3	0	0	0	0	111.2
821	P	37.1	Very low	29.3	Very low	120 Å²	120	138.1 Å²	138.1	78%	0.779	76%	0.756	S	S	*	*				-137.2	153.4	107.2	33	-19.4	0	0	0	112.3
822	A	25.8	Very low	29.3	Very low	83 Å²	83	136.6 Å²	136.6	69%	0.686	76%	0.757	S	S	*	*			cis	81.2	92.3	30.3	0	0	0	0	0	115.4
823	V	26.4	Very low	29.3	Very low	129 Å²	129	134.1 Å²	134.1	78%	0.782	76%	0.756	S	S	*	*			trans	55.1	114	144	-173.5	0	0	0	0	118
824	R	27.4	Very low	29.5	Very low	230 Å²	230	137.5 Å²	137.5	87%	0.868	77%	0.765	S	S	*	*				-172.5	140.2	90.4	-156.1	162.6	-81	-171	-6.1	112.5
825	N	28.2	Very low	29.5	Very low	155 Å²	155	134.8 Å²	134.8	83%	0.829	76%	0.764	S	S	*	*			trans	-69.2	153.6	164.9	-73.5	-13.6	0	0	0	110.9
826	K	28.1	Very low	29.4	Very low	180 Å²	180	134 Å²	134	78%	0.783	77%	0.77	S	S	*	*				-179.2	130.6	126.8	-103.1	-173.3	170.7	-168.2	0	111.2
827	H	27.9	Very low	29.1	Very low	162 Å²	162	133.8 Å²	133.8	75%	0.75	76%	0.763	S	S	*	*			trans	50.2	153.4	147.3	-61.5	-65.5	0	0	0	120.3
828	S	26.3	Very low	29.2	Very low	74 Å²	74	133.7 Å²	133.7	52%	0.517	77%	0.767	S	S	.	*			cis	-165.6	177.2	-19.8	45.1	0	0	0	0	107.2
829	E	28.2	Very low	29.3	Very low	160 Å²	160	130.6 Å²	130.6	75%	0.748	76%	0.764	S	S	*	*			trans	66.7	147.6	155.3	-75.9	144.5	-107.5	0	0	118.8
830	T	27.5	Very low	29.6	Very low	106 Å²	106	131.8 Å²	131.8	65%	0.65	77%	0.765	S	S	*	*			cis	-161.3	172	-36.6	12	0	0	0	0	106.7
831	N	30.2	Very low	29.6	Very low	144 Å²	144	131.2 Å²	131.2	77%	0.77	76%	0.76	S	S	*	*			trans	71	153.3	158.3	-59.5	-28.2	0	0	0	118.5
832	S	28.6	Very low	29.3	Very low	108 Å²	108	134.3 Å²	134.3	76%	0.755	76%	0.761	S	S	*	*			cis	-166.9	156.7	-34.5	52	0	0	0	0	109.3
833	G	29.9	Very low	29.6	Very low	68 Å²	68	134.8 Å²	134.8	70%	0.701	76%	0.759	S	S	*	*			trans	79.9	154.8	172.8	0	0	0	0	0	114.9
834	F	32.1	Very low	29.9	Very low	216 Å²	216	132.4 Å²	132.4	95%	0.947	76%	0.761	S	S	*	*			cis	-124.6	152.1	-1.6	-100.5	-101.3	0	0	0	111.2
835	A	26.9	Very low	30.1	Very low	90 Å²	90	126.7 Å²	126.7	74%	0.744	76%	0.757	S	S	*	*			trans	-108	161.6	-179.9	0	0	0	0	0	111.6
836	C	31.2	Very low	30.1	Very low	131 Å²	131	127 Å²	127	89%	0.885	76%	0.757	S	S	*	*			trans	-151.4	139.1	149.2	-158.1	0	0	0	0	110.2
837	T	27.9	Very low	30.4	Very low	120 Å²	120	123 Å²	123	74%	0.736	76%	0.758	S	S	*	*			trans	-150.8	139.7	-170.9	47.4	0	0	0	0	111.9
838	C	31.9	Very low	30.5	Very low	121 Å²	121	118.8 Å²	118.8	82%	0.818	75%	0.751	S	S	*	*			trans	-147.3	136.2	154.4	-84.6	0	0	0	0	106.4
839	S	32.7	Very low	31	Very low	102 Å²	102	123.3 Å²	123.3	71%	0.713	76%	0.764	S	S	*	*			cis	71	139.8	41.9	-54.4	0	0	0	0	111.8
840	L	33.3	Very low	31.1	Very low	161 Å²	161	121.5 Å²	121.5	84%	0.843	76%	0.759	S	S	*	*			cis	-123.3	174.4	13.6	-62.6	163.4	0	0	0	109
841	C	33.1	Very low	31.5	Very low	96 Å²	96	123.4 Å²	123.4	65%	0.649	77%	0.765	S	S	*	*			cis	-171.1	-169.2	-18	-97.7	0	0	0	0	105.2
842	F	31.9	Very low	31.5	Very low	185 Å²	185	121.9 Å²	121.9	81%	0.811	76%	0.76	S	S	*	*			cis	-167.4	175.6	-4.9	-125.1	-148.2	0	0	0	105.3
843	S	32.1	Very low	31.7	Very low	92 Å²	92	122.9 Å²	122.9	64%	0.643	76%	0.762	S	S	*	*			cis	-176.3	127.3	-38.4	-90.3	0	0	0	0	109.5
844	G	32.3	Very low	32	Very low	80 Å²	80	124.8 Å²	124.8	83%	0.825	76%	0.762	S	S	*	*			trans	81.6	158.6	166	0	0	0	0	0	117.8
845	S	31.9	Very low	32.3	Very low	110 Å²	110	120 Å²	120	77%	0.769	75%	0.753	S	S	*	*			cis	-164	157.7	-11	-154.7	0	0	0	0	113.7
846	L	28.9	Very low	32.5	Very low	160 Å²	160	123.3 Å²	123.3	84%	0.838	76%	0.756	S	S	*	*			trans	68.2	129.5	154.1	-79.3	157.5	0	0	0	123.3
847	A	32.9	Very low	32.4	Very low	97 Å²	97	128.5 Å²	128.5	80%	0.802	76%	0.757	S	S	*	*			trans	72	145.2	143.4	0	0	0	0	0	120.9
848	A	30.9	Very low	32.4	Very low	73 Å²	73	134.4 Å²	134.4	60%	0.603	77%	0.766	S	S	*	*			cis	-167.5	163.7	-22.2	0	0	0	0	0	110.6
849	H	36.5	Very low	32.4	Very low	170 Å²	170	135.8 Å²	135.8	79%	0.787	77%	0.771	S	S	*	*			trans	66	148.7	164.4	-65.2	-64.4	0	0	0	118.9
850	D	29.5	Very low	32.2	Very low	121 Å²	121	136.7 Å²	136.7	65%	0.647	78%	0.777	S	S	*	*			cis	-166.2	178.9	-28.3	-144.8	-46.2	0	0	0	109.6
851	L	36.2	Very low	31.9	Very low	147 Å²	147	132.4 Å²	132.4	77%	0.77	77%	0.772	S	S	*	*			trans	70.6	73.3	165.2	-53.4	-177.4	0	0	0	119
852	T	31.5	Very low	31.7	Very low	111 Å²	111	134.2 Å²	134.2	68%	0.681	78%	0.78	S	S	*	*				22.3	140.8	93.7	-15.6	0	0	0	0	116.5
853	V	33.3	Very low	31.4	Very low	129 Å²	129	131.6 Å²	131.6	78%	0.782	78%	0.779	S	S	*	*			cis	-155.4	-163.4	46.5	-139.8	0	0	0	0	112.3
854	P	35.2	Very low	31.4	Very low	109 Å²	109	133.6 Å²	133.6	71%	0.708	79%	0.788	S	S	*	*				-123.2	179.8	-128.9	43.3	-23.1	0	0	0	116.8
855	P	38.4	Very low	31	Very low	116 Å²	116	138.9 Å²	138.9	75%	0.753	79%	0.791	S	S	*	*			trans	-91.5	161.2	173.8	36.6	-36.5	0	0	0	113.7
856	I	30.2	Very low	31	Very low	158 Å²	158	140.3 Å²	140.3	81%	0.81	80%	0.795	S	S	*	*			trans	-172.8	145.8	149.3	-109.1	158.3	0	0	0	116.4
857	R	29.7	Very low	30.8	Very low	241 Å²	241	138.1 Å²	138.1	91%	0.909	79%	0.789	S	S	*	*			trans	73.2	143.5	157.9	-86.7	168.8	-167.5	-150.7	0.8	123.7
858	R	27.5	Very low	30.6	Very low	243 Å²	243	142.7 Å²	142.7	92%	0.917	79%	0.791	S	S	*	*			trans	-85.6	149.8	166.1	-57.7	168.1	174.1	162.3	-5.1	110.5
859	T	33.4	Very low	30.8	Very low	150 Å²	150	143.6 Å²	143.6	92%	0.92	79%	0.79	S	S	*	*			trans	-135.4	164.4	149.7	50.4	0	0	0	0	109.3
860	S	27	Very low	30.7	Very low	121 Å²	121	142.7 Å²	142.7	85%	0.846	79%	0.792	S	S	*	*			trans	-136.3	134.9	-170.3	55.9	0	0	0	0	111.9
861	G	27.8	Very low	30.6	Very low	71 Å²	71	141.9 Å²	141.9	73%	0.732	80%	0.795	S	S	*	*			trans	139.2	149.8	155.8	0	0	0	0	0	116.9
862	T	29	Very low	30.2	Very low	134 Å²	134	140.2 Å²	140.2	82%	0.822	79%	0.794	S	S	*	*			trans	72.7	89.8	150.6	-42	0	0	0	0	119
863	T	26.1	Very low	30.2	Very low	131 Å²	131	141 Å²	141	80%	0.804	80%	0.8	S	S	*	*				12.9	113	128.1	-48.1	0	0	0	0	119.2
864	T	30.6	Very low	30.2	Very low	134 Å²	134	140.2 Å²	140.2	82%	0.822	80%	0.799	S	S	*	*			trans	-149.9	151.7	131.4	6.7	0	0	0	0	110.5
865	Q	25.6	Very low	29.9	Very low	191 Å²	191	139.3 Å²	139.3	89%	0.893	80%	0.801	S	S	*	*			trans	-94.3	127.7	170.8	-64.4	175.4	4	0	0	109.5
866	T	30.5	Very low	29.5	Very low	140 Å²	140	140 Å²	140	86%	0.859	80%	0.803	S	S	*	*			trans	-149.8	122.4	157.7	10.4	0	0	0	0	110.5
867	T	25.8	Very low	29.6	Very low	113 Å²	113	138.7 Å²	138.7	69%	0.693	80%	0.802	S	S	*	*			trans	-72	146.7	174.1	-48.2	0	0	0	0	110.8
868	F	28.1	Very low	29.6	Very low	194 Å²	194	133.8 Å²	133.8	85%	0.851	79%	0.794	S	S	*	*				167.6	158.9	129	-84.8	-52.6	0	0	0	111.2
869	P	34.6	Very low	29.9	Very low	91 Å²	91	129.4 Å²	129.4	59%	0.591	79%	0.789	S	S	*	*			trans	-133.4	-155.3	-133.6	40	-19	0	0	0	114.3
870	N	33.7	Very low	29.9	Very low	152 Å²	152	127.5 Å²	127.5	81%	0.813	78%	0.777	S	S	*	*			trans	85.3	142.1	172	-48.6	-37.7	0	0	0	114.3
871	S	29.1	Very low	30.1	Very low	103 Å²	103	129.9 Å²	129.9	72%	0.72	78%	0.778	S	S	*	*			cis	-156.2	178.3	-3.9	-159.2	0	0	0	0	111.4
872	C	27.1	Very low	30.2	Very low	112 Å²	112	129.6 Å²	129.6	76%	0.757	78%	0.776	S	S	*	*			trans	72.4	125.2	166.1	-59	0	0	0	0	116
873	T	32.4	Very low	30.4	Very low	129 Å²	129	132.1 Å²	132.1	79%	0.791	78%	0.781	S	S	*	*			cis	-143.7	156.6	10.1	51.3	0	0	0	0	113.8
874	S	32.6	Very low	30.5	Very low	111 Å²	111	131.6 Å²	131.6	78%	0.776	78%	0.777	S	S	*	*			trans	30	110.1	160.1	-55.3	0	0	0	0	120.5
875	A	29.5	Very low	30.7	Very low	90 Å²	90	131.2 Å²	131.2	74%	0.744	78%	0.777	S	S	*	*				64	95.6	72.7	0	0	0	0	0	113.6
876	V	29.5	Very low	30.9	Very low	131 Å²	131	127.6 Å²	127.6	79%	0.794	77%	0.768	S	S	*	*				68.8	110	72.7	177.9	0	0	0	0	114.6
877	V	32.4	Very low	31.4	Very low	131 Å²	131	128 Å²	128	79%	0.794	77%	0.77	S	S	*	*				-148.8	121.5	120.4	178.5	0	0	0	0	109.1
878	N	29.8	Very low	31.6	Very low	137 Å²	137	126.4 Å²	126.4	73%	0.733	77%	0.768	S	S	*	*			trans	-78.8	152.5	170.8	-76.7	-28.1	0	0	0	111.6
879	N	32.6	Very low	32	Very low	151 Å²	151	120.7 Å²	120.7	81%	0.807	76%	0.764	S	S	*	*			trans	-151.7	139.2	139.7	-137.6	-8.2	0	0	0	111.4
880	T	33.7	Very low	31.8	Very low	111 Å²	111	120.1 Å²	120.1	68%	0.681	78%	0.775	S	S	*	*			trans	-127	143.3	-163.1	-53.4	0	0	0	0	111
881	I	32.4	Very low	32.1	Very low	170 Å²	170	122.4 Å²	122.4	87%	0.872	78%	0.778	S	S	*	*			trans	-171	117.3	154.2	-91.5	138.6	0	0	0	103.9
882	G	28.4	Very low	32.3	Very low	66 Å²	66	123.3 Å²	123.3	68%	0.68	78%	0.781	S	S	*	*				111	147.6	85.9	0	0	0	0	0	108.8
883	M	33.1	Very low	32.5	Very low	186 Å²	186	128.1 Å²	128.1	92%	0.916	79%	0.79	S	S	*	*			cis	-139.2	161	9.7	-57.5	-178.3	74.5	0	0	111.7
884	V	28.9	Very low	32.6	Very low	120 Å²	120	124.7 Å²	124.7	73%	0.727	78%	0.78	S	S	*	*			trans	-120.2	137.5	168.5	174.2	0	0	0	0	108.3	T886	V884-T886 PolarHBondContact O-N 2.79Å
885	P	34.2	Very low	32.7	Very low	126 Å²	126	126.3 Å²	126.3	82%	0.818	79%	0.788	S	S	*	*			trans	-82.9	97.9	168.7	32.1	-30.8	0	0	0	110.3
886	T	30.8	Very low	32.7	Very low	116 Å²	116	126 Å²	126	71%	0.712	79%	0.793	S	S	*	*			trans	-76.4	128.5	174.1	-60.5	0	0	0	0	111	V884 A888	V884-T886 PolarHBondContact O-N 2.79Å; T886-A888 HydrophobicContact CG2-CB 4.3Å
887	V	39.9	Very low	32.7	Very low	147 Å²	147	122.7 Å²	122.7	89%	0.891	79%	0.786	S	S	*	*			trans	-111.4	113.1	159.1	179.9	0	0	0	0	107.4
888	A	31.3	Very low	32.8	Very low	81 Å²	81	124.2 Å²	124.2	67%	0.669	79%	0.789	S	S	*	*			trans	-98	126.9	-175.4	0	0	0	0	0	111.7	T886	T886-A888 HydrophobicContact CG2-CB 4.3Å
889	G	35.2	Very low	33.1	Very low	74 Å²	74	125.1 Å²	125.1	76%	0.763	79%	0.794	S	S	*	*			trans	-143.6	102.1	167.2	0	0	0	0	0	108.2
890	G	31	Very low	33.8	Very low	79 Å²	79	124.1 Å²	124.1	81%	0.814	79%	0.793	S	S	*	*			trans	-86.9	142.4	-166.9	0	0	0	0	0	114.4
891	F	39.5	Very low	34.6	Very low	200 Å²	200	124.9 Å²	124.9	88%	0.877	80%	0.798	S	S	*	*			trans	-113.3	145	155.9	-81.2	-87.8	0	0	0	109
892	P	34.2	Very low	35.9	Very low	122 Å²	122	122.5 Å²	122.5	79%	0.792	78%	0.783	S	S	*	*			trans	-76.6	144.3	-176.7	31.4	-34.8	0	0	0	112	G894	P892-G894 PolarHBondContact O-N 3.18Å
893	F	31.4	Very low	37.9	Very low	213 Å²	213	123.4 Å²	123.4	93%	0.934	78%	0.775	S	S	*	*			trans	-68.5	128.5	172.4	-88.6	-100.5	0	0	0	111.5
894	G	34.8	Very low	40.2	Very low	57 Å²	57	120.8 Å²	120.8	59%	0.588	76%	0.758	S	S	*	*			trans	-111.2	148.6	155.6	0	0	0	0	0	109.5	P892 G896	P892-G894 PolarHBondContact O-N 3.18Å; G894-G896 PolarHBondContact O-N 3.35Å
895	P	34.4	Very low	42.8	Very low	145 Å²	145	116 Å²	116	94%	0.942	73%	0.73	S	S	*	*	S	Bend	trans	-80.2	113.8	-177.1	30.6	-33.1	0	0	0	111.9
896	G	28.5	Very low	45.2	Very low	82 Å²	82	113.7 Å²	113.7	85%	0.845	71%	0.705	S	S	*	*			trans	134.5	115.1	166.8	0	0	0	0	0	114.2	G894	G894-G896 PolarHBondContact O-N 3.35Å
897	G	30.3	Very low	47.5	Very low	62 Å²	62	111.6 Å²	111.6	64%	0.639	70%	0.695	S	S	*	*			trans	141.4	107.9	175.7	0	0	0	0	0	112.4	D899	G897-D899 VanDerWaalsContact C-N 3.27Å; G897-D899 PolarHBondContact O-N 3.03Å; G897-D899 VanDerWaalsContact O-N 3.1Å
898	N	34.1	Very low	48.9	Very low	163 Å²	163	105.9 Å²	105.9	87%	0.872	66%	0.659	S	S	*	*			trans	-85.1	65.8	175.2	-75.5	-11.2	0	0	0	110.7	V900	N898-V900 VanDerWaalsContact C-N 3.29Å; N898-V900 PolarHBondContact O-N 3.4Å
899	D	35.4	Very low	49.8	Very low	156 Å²	156	106.6 Å²	106.6	83%	0.834	64%	0.644	S	S	*	*			trans	-74.3	81.1	177	-79.9	-22.7	0	0	0	111.2	G897 V901	G897-D899 VanDerWaalsContact C-N 3.27Å; G897-D899 PolarHBondContact O-N 3.03Å; G897-D899 VanDerWaalsContact O-N 3.1Å; D899-V901 PolarHBondContact O-N 3.12Å; D899-V901 VanDerWaalsContact O-N 3.14Å
900	V	48.4	Very low	50.7	Low	131 Å²	131	104.7 Å²	104.7	79%	0.794	62%	0.615	S	S	*	*			trans	-66.3	109.1	171.4	-179.6	0	0	0	0	108.8	N898 E902	N898-V900 VanDerWaalsContact C-N 3.29Å; N898-V900 PolarHBondContact O-N 3.4Å; V900-E902 PolarHBondContact O-N 3.38Å
901	V	51	Low	52	Low	127 Å²	127	103.4 Å²	103.4	77%	0.77	59%	0.592	S	S	*	*			trans	-60	109.2	-178.8	-179.8	0	0	0	0	110.5	D899 V903	D899-V901 PolarHBondContact O-N 3.12Å; D899-V901 VanDerWaalsContact O-N 3.14Å; V901-V903 PolarHBondContact O-N 2.81Å
902	E	59.7	Low	52.2	Low	119 Å²	119	100.1 Å²	100.1	56%	0.556	57%	0.574	S	S	*	*			trans	-69	93.4	-176.1	-170.8	-164.2	-177.1	0	0	111.6	V900 K904	V900-E902 PolarHBondContact O-N 3.38Å; E902-K904 PolarHBondContact O-N 3.39Å; E902-K904 WeakPolarHBondContact OE2-CE 3.3Å; E902-K904 IonicContact OE2-NZ 3.18Å; E902-K904 PolarHBondContact OE2-NZ 2.88Å
903	V	70.5	Confident	53.3	Low	86 Å²	86	96.7 Å²	96.7	52%	0.521	55%	0.552	S	S	.	*			trans	-60.3	129	170.3	179.4	0	0	0	0	109.5	V901 K945 Y946	V901-V903 PolarHBondContact O-N 2.81Å; V903-K945 HydrophobicContact CB-CD 3.92Å; V903-K945 HydrophobicContact CG1-CB 4.19Å; V903-K945 HydrophobicContact CG1-CD 4.25Å; V903-K945 WeakPolarHBondContact O-CD 3.22Å; V903-K945 PolarHBondContact O-NZ 3.36Å; V903-Y946 WeakPolarHBondContact O-CE2 3.35Å; V903-Y946 PolarHBondContact O-OH 2.93Å
904	K	80.9	Confident	54.9	Low	131 Å²	131	88 Å²	88	57%	0.57	52%	0.515	S	S	*	.			trans	-115.3	155.2	-172.5	-78.9	159	-174.1	168.7	0	112.4	E902	E902-K904 PolarHBondContact O-N 3.39Å; E902-K904 WeakPolarHBondContact OE2-CE 3.3Å; E902-K904 IonicContact OE2-NZ 3.18Å; E902-K904 PolarHBondContact OE2-NZ 2.88Å
905	P	83.4	Confident	56.5	Low	19 Å²	19	89.6 Å²	89.6	12%	0.123	51%	0.506	C	S	.	.			trans	-62.7	149.1	-178.1	-20.8	31.4	0	0	0	112.8	S907 P922 Y946 K969	P905-S907 PolarHBondContact O-N 3.45Å; P905-P922 HydrophobicContact CG-CB 3.58Å; P905-P922 HydrophobicContact CG-CG 3.44Å; P905-P922 VanDerWaalsContact CG-CG 3.44Å; P905-Y946 HydrophobicContact CB-CD2 4.19Å; P905-Y946 HydrophobicContact CB-CE2 4.34Å; P905-Y946 HydrophobicContact CB-CG 4.37Å; P905-Y946 HydrophobicContact CG-CD1 4.29Å; P905-Y946 HydrophobicContact CG-CD2 4.1Å; P905-Y946 HydrophobicContact CG-CE1 4.04Å; P905-Y946 HydrophobicContact CG-CE2 3.81Å; P905-Y946 HydrophobicContact CG-CG 4.29Å; P905-Y946 VanDerWaalsContact N-CE2 3.27Å; P905-K969 HydrophobicContact CB-CB 4.41Å
906	R	84.6	Confident	58.5	Low	77 Å²	77	84 Å²	84	29%	0.291	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	130.5	175.4	-165.1	170.3	-68.9	127.9	0.8	109.4	E944 E966 C968 K969	R906-E944 IonicContact CZ-OE2 3.19Å; R906-E944 IonicContact NH1-OE2 2.69Å; R906-E944 IonicContact NH2-OE1 3.55Å; R906-E944 PolarHBondContact NH2-OE1 3.16Å; R906-E944 IonicContact NH2-OE2 2.64Å; R906-E944 PolarHBondContact NH2-OE2 2.79Å; R906-E966 VanDerWaalsContact CB-OE1 3.31Å; R906-E966 WeakPolarHBondContact CB-OE1 3.4Å; R906-E966 VanDerWaalsContact CD-OE1 3.24Å; R906-E966 WeakPolarHBondContact CD-OE1 3.17Å; R906-E966 IonicContact CZ-OE1 2.73Å; R906-E966 IonicContact NE-OE1 2.62Å; R906-E966 IonicContact NH1-OE1 2.71Å; R906-E966 PolarHBondContact NH1-OE1 2.81Å; R906-E966 IonicContact NH1-OE2 2.64Å; R906-C968 CarbonylContact O-C 3.55Å; R906-C968 VanDerWaalsContact O-CA 3.29Å; R906-C968 WeakPolarHBondContact O-CA 3.37Å; R906-K969 PolarHBondContact O-N 3.01Å
907	S	79.7	Confident	61.1	Low	72 Å²	72	83 Å²	83	50%	0.503	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	107.7	-176.2	168.8	0	0	0	0	110.7	P905 P971	P905-S907 PolarHBondContact O-N 3.45Å; S907-P971 WeakPolarHBondContact OG-CG 3.5Å
908	L	67.5	Low	63.7	Low	28 Å²	28	80.1 Å²	80.1	15%	0.147	42%	0.417	C	S	.	.			trans	-89.5	133.9	177.1	-65.8	-177.7	0	0	0	111.5	C968 K969 L970	L908-C968 HydrophobicContact CD1-CB 3.68Å; L908-C968 VanDerWaalsContact CD1-SG 3.51Å; L908-C968 HydrophobicContact CG-CB 3.81Å; L908-K969 PolarHBondContact N-O 3.21Å; L908-L970 HydrophobicContact CB-CD2 4.1Å
909	R	52.1	Low	66.2	Low	95 Å²	95	77.4 Å²	77.4	36%	0.358	41%	0.41	S	S	.	.	S	Bend	trans	-84.6	-16.2	179.5	-168.7	173	-176.6	89.2	1.3	113.3	G245 R972	G245-R909 PolarHBondContact O-NE 3.28Å; G245-R909 PolarHBondContact O-NH2 3.43Å; R909-R972 PolarHBondContact O-NE 2.77Å; R909-R972 PolarHBondContact O-NH2 2.82Å
910	F	54	Low	68.6	Low	34 Å²	34	73.1 Å²	73.1	15%	0.149	39%	0.387	C	S	.	.			trans	-142	150	-176.1	-56.6	-89	0	0	0	110.1	F137 L247	F137-F910 HydrophobicContact CE2-CD2 4.43Å; F137-F910 AromaticContact CE2-CE2 3.76Å; F137-F910 HydrophobicContact CE2-CE2 3.76Å; F137-F910 HydrophobicContact CE2-CZ 4.3Å; F137-F910 AromaticContact CZ-CD2 3.85Å; F137-F910 HydrophobicContact CZ-CD2 3.85Å; F137-F910 AromaticContact CZ-CE2 3.55Å; F137-F910 HydrophobicContact CZ-CE2 3.55Å; F137-F910 HydrophobicContact CZ-CZ 4.49Å; L247-F910 HydrophobicContact CD1-CD1 4.5Å; L247-F910 HydrophobicContact CD1-CE1 4.07Å; L247-F910 HydrophobicContact CG-CE1 4.3Å
911	T	57.5	Low	70.6	Confident	52 Å²	52	69.3 Å²	69.3	32%	0.319	37%	0.37	S	S	.	.			trans	-95.8	2.7	-171.2	45.7	0	0	0	0	115	S913 M914 L970 L973	T911-S913 PolarHBondContact O-N 3.31Å; T911-M914 HydrophobicContact CG2-SD 4.1Å; T911-M914 WeakPolarHBondContact O-CB 3.03Å; T911-M914 WeakPolarHBondContact O-CG 3.37Å; T911-M914 PolarHBondContact O-N 3.05Å; T911-M914 VanDerWaalsContact O-N 3.08Å; T911-L970 HydrophobicContact CG2-CD1 3.92Å; T911-L970 HydrophobicContact CG2-CD2 4.12Å; T911-L973 HydrophobicContact CG2-CD1 4.39Å
912	W	44.4	Very low	72.5	Confident	132 Å²	132	64.2 Å²	64.2	50%	0.5	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	11.4	-163.7	-82.8	63.4	0	0	0	117.6	P213 D250 L257	P213-W912 HydrophobicContact CG-CH2 3.59Å; P213-W912 HydrophobicContact CG-CZ2 3.68Å; P213-W912 HydrophobicContact CG-CZ3 4.34Å; D250-W912 PolarHBondContact OD1-NE1 3.06Å; L257-W912 HydrophobicContact CD2-CH2 3.79Å; L257-W912 HydrophobicContact CD2-CZ2 3.99Å
913	S	56.8	Low	74	Confident	49 Å²	49	61.7 Å²	61.7	34%	0.343	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.9	23.1	171.8	51.5	0	0	0	0	113.7	T911 R979	T911-S913 PolarHBondContact O-N 3.31Å; S913-R979 WeakPolarHBondContact OG-CD 3.39Å; S913-R979 PolarHBondContact OG-NE 2.67Å
914	M	64.8	Low	75	Confident	32 Å²	32	61.6 Å²	61.6	16%	0.158	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	136.3	-175.2	-56.3	-176.2	77.3	0	0	110.8	T911 L970 V978	T911-M914 HydrophobicContact CG2-SD 4.1Å; T911-M914 WeakPolarHBondContact O-CB 3.03Å; T911-M914 WeakPolarHBondContact O-CG 3.37Å; T911-M914 PolarHBondContact O-N 3.05Å; T911-M914 VanDerWaalsContact O-N 3.08Å; M914-L970 HydrophobicContact CE-CD1 3.72Å; M914-L970 HydrophobicContact CE-CD2 4.01Å; M914-L970 HydrophobicContact CE-CG 3.97Å; M914-L970 HydrophobicContact SD-CD1 3.72Å; M914-L970 HydrophobicContact SD-CD2 3.51Å; M914-L970 VanDerWaalsContact SD-CD2 3.51Å; M914-L970 HydrophobicContact SD-CG 4.02Å; M914-V978 WeakPolarHBondContact CA-O 3.39Å
915	K	69.1	Low	75.5	Confident	89 Å²	89	55.4 Å²	55.4	39%	0.387	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-31.9	176.5	-71.1	-159.5	170.8	-165.3	0	113.5	V978 F980 A994 S995 A998	K915-V978 PolarHBondContact N-O 3.35Å; K915-V978 VanDerWaalsContact N-O 3.13Å; K915-F980 HydrophobicContact CB-CD2 3.97Å; K915-F980 HydrophobicContact CB-CE2 3.84Å; K915-F980 HydrophobicContact CD-CD2 3.92Å; K915-F980 HydrophobicContact CD-CE2 4.04Å; K915-F980 HydrophobicContact CD-CG 4.37Å; K915-F980 HydrophobicContact CG-CD2 3.82Å; K915-F980 HydrophobicContact CG-CE2 4.12Å; K915-A994 VanDerWaalsContact CD-O 3.31Å; K915-A994 WeakPolarHBondContact CD-O 3.08Å; K915-A994 WeakPolarHBondContact CE-O 3.46Å; K915-A994 PolarHBondContact NZ-O 3.17Å; K915-S995 PolarHBondContact NZ-OG 2.73Å; K915-A998 HydrophobicContact CB-CB 3.91Å; K915-A998 HydrophobicContact CD-CB 3.59Å; K915-A998 HydrophobicContact CG-CB 4.41Å
916	T	74.9	Confident	76.1	Confident	28 Å²	28	54.7 Å²	54.7	17%	0.172	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	143.5	-175	-40	0	0	0	0	109.9	G977 V978 L1003	T916-G977 CarbonylContact O-C 3.47Å; T916-G977 WeakPolarHBondContact O-CA 3.49Å; T916-V978 PolarHBondContact O-N 2.85Å; T916-L1003 HydrophobicContact CG2-CB 3.86Å; T916-L1003 HydrophobicContact CG2-CD1 4.21Å
917	T	83.4	Confident	76.5	Confident	61 Å²	61	56.3 Å²	56.3	37%	0.374	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	140	176.7	52.7	0	0	0	0	110	L970 N976	T917-L970 HydrophobicContact CG2-CD1 3.79Å; T917-N976 CarbonylContact C-O 3.54Å; T917-N976 VanDerWaalsContact CA-O 3.32Å; T917-N976 WeakPolarHBondContact CA-O 3.33Å
918	S	86.3	Confident	77.1	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.014	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	149.2	-169.5	-173	0	0	0	0	112.4	L920 L975 N976 L1003	S918-L920 VanDerWaalsContact OG-CB 3.27Å; S918-L920 WeakPolarHBondContact OG-CB 3.28Å; S918-L920 WeakPolarHBondContact OG-CG 3.14Å; S918-L920 PolarHBondContact OG-N 2.95Å; S918-L975 WeakPolarHBondContact O-CB 3.46Å; S918-N976 PolarHBondContact N-O 3.49Å; S918-N976 PolarHBondContact O-N 3.23Å; S918-L1003 WeakPolarHBondContact CA-OXT 2.99Å; S918-L1003 WeakPolarHBondContact CB-OXT 3.16Å; S918-L1003 PolarHBondContact OG-OXT 2.68Å
919	S	85.1	Confident	78.4	Confident	105 Å²	105	53 Å²	53	73%	0.734	27%	0.274	S	S	*	.	S	Bend	trans	-87	-6.7	165.5	55	0	0	0	0	113.4
920	L	87.4	Confident	80.5	Confident	67 Å²	67	51.9 Å²	51.9	35%	0.351	27%	0.27	S	S	.	.	S	Bend	trans	-64.6	153.2	179	-64.2	173.1	0	0	0	111.8	S918 M925 N976 L1003	S918-L920 VanDerWaalsContact OG-CB 3.27Å; S918-L920 WeakPolarHBondContact OG-CB 3.28Å; S918-L920 WeakPolarHBondContact OG-CG 3.14Å; S918-L920 PolarHBondContact OG-N 2.95Å; L920-M925 HydrophobicContact CB-CG 3.94Å; L920-N976 PolarHBondContact O-ND2 2.92Å; L920-L1003 HydrophobicContact CD1-CD2 3.92Å
921	A	89.6	Confident	82.5	Confident	51 Å²	51	55.8 Å²	55.8	42%	0.421	29%	0.287	S	S	.	.			trans	-62.8	143.6	172.4	0	0	0	0	0	110.3	E923 E924 M925	A921-E923 PolarHBondContact O-N 3.36Å; A921-E923 VanDerWaalsContact O-N 3.13Å; A921-E924 HydrophobicContact CB-CG 4.28Å; A921-E924 PolarHBondContact O-N 3.49Å; A921-M925 PolarHBondContact O-N 2.87Å
922	P	90.1	Very high	84.3	Confident	19 Å²	19	53.6 Å²	53.6	12%	0.123	27%	0.274	C	S	.	.	H	α-helix	trans	-54.7	-36.3	-176.6	-26.2	35.2	0	0	0	113.6	P905 M925 M926 Y946 V967	P905-P922 HydrophobicContact CG-CB 3.58Å; P905-P922 HydrophobicContact CG-CG 3.44Å; P905-P922 VanDerWaalsContact CG-CG 3.44Å; P922-M925 PolarHBondContact O-N 3.29Å; P922-M926 VanDerWaalsContact O-CG 3.27Å; P922-M926 WeakPolarHBondContact O-CG 3.34Å; P922-M926 PolarHBondContact O-N 3.28Å; P922-Y946 HydrophobicContact CB-CD1 4.01Å; P922-Y946 HydrophobicContact CB-CE1 3.46Å; P922-Y946 VanDerWaalsContact CB-CE1 3.46Å; P922-V967 HydrophobicContact CB-CG1 4.05Å
923	E	91.1	Very high	86.7	Confident	67 Å²	67	47.3 Å²	47.3	31%	0.313	25%	0.25	S	C	.	.	H	α-helix	trans	-62.1	-40.4	175.7	-75.7	62.7	-151.1	0	0	112.6	A921 M926 K927 K945 Y946	A921-E923 PolarHBondContact O-N 3.36Å; A921-E923 VanDerWaalsContact O-N 3.13Å; E923-M926 PolarHBondContact O-N 2.95Å; E923-K927 WeakPolarHBondContact O-CG 3.46Å; E923-K927 PolarHBondContact O-N 3.48Å; E923-K945 WeakPolarHBondContact OE1-CE 3.29Å; E923-K945 IonicContact OE1-NZ 3.57Å; E923-K945 PolarHBondContact OE1-NZ 3.47Å; E923-Y946 WeakPolarHBondContact OE1-CE1 3.18Å; E923-Y946 PolarHBondContact OE1-OH 3.36Å
924	E	91.8	Very high	88.5	Confident	84 Å²	84	49.5 Å²	49.5	39%	0.393	26%	0.257	S	S	.	.	H	α-helix	trans	-72.7	-40.3	176.3	-57.9	-50.2	126	0	0	111.1	A921 M926 K927 E928	A921-E924 HydrophobicContact CB-CG 4.28Å; A921-E924 PolarHBondContact O-N 3.49Å; E924-M926 VanDerWaalsContact C-N 3.26Å; E924-M926 PolarHBondContact O-N 2.87Å; E924-K927 WeakPolarHBondContact O-CB 3.2Å; E924-K927 PolarHBondContact O-N 3.34Å; E924-K927 WeakPolarHBondContact OE1-CE 3.25Å; E924-K927 IonicContact OE1-NZ 2.71Å; E924-K927 PolarHBondContact OE1-NZ 2.9Å; E924-K927 WeakPolarHBondContact OE2-CD 3.3Å; E924-K927 WeakPolarHBondContact OE2-CE 3.46Å; E924-K927 IonicContact OE2-NZ 2.65Å; E924-K927 PolarHBondContact OE2-NZ 3.48Å; E924-E928 PolarHBondContact O-N 3.02Å
925	M	92.8	Very high	89.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-56.8	-42	172.1	-60.2	-176.9	71.3	0	0	111.6	L920 A921 P922 K927 E928 I929 V967 N976 V978 L1003	L920-M925 HydrophobicContact CB-CG 3.94Å; A921-M925 PolarHBondContact O-N 2.87Å; P922-M925 PolarHBondContact O-N 3.29Å; M925-K927 VanDerWaalsContact C-N 3.31Å; M925-K927 PolarHBondContact O-N 3.08Å; M925-E928 PolarHBondContact O-N 3.39Å; M925-I929 WeakPolarHBondContact O-CB 3.49Å; M925-I929 WeakPolarHBondContact O-CD1 3.49Å; M925-I929 WeakPolarHBondContact O-CG1 3.24Å; M925-I929 PolarHBondContact O-N 2.98Å; M925-V967 HydrophobicContact CB-CG1 4.42Å; M925-V967 HydrophobicContact CB-CG2 4.12Å; M925-V967 HydrophobicContact CE-CG1 4.34Å; M925-V967 HydrophobicContact SD-CG1 3.83Å; M925-N976 HydrophobicContact CE-CB 4.3Å; M925-N976 HydrophobicContact SD-CB 3.36Å; M925-N976 WeakPolarHBondContact SD-CB 3.17Å; M925-V978 HydrophobicContact CE-CG2 3.66Å; M925-L1003 HydrophobicContact CB-CD2 4.15Å; M925-L1003 HydrophobicContact CE-CD1 4Å; M925-L1003 HydrophobicContact CE-CD2 4.28Å; M925-L1003 HydrophobicContact CG-CD2 3.99Å
926	M	94.4	Very high	91.1	Very high	5 Å²	5	47.6 Å²	47.6	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-66.5	-28.8	176.7	-72.2	-61.5	-60.6	0	0	113.1	P922 E923 E924 I929 R930 Q942 Y946 L948 V967	P922-M926 VanDerWaalsContact O-CG 3.27Å; P922-M926 WeakPolarHBondContact O-CG 3.34Å; P922-M926 PolarHBondContact O-N 3.28Å; E923-M926 PolarHBondContact O-N 2.95Å; E924-M926 VanDerWaalsContact C-N 3.26Å; E924-M926 PolarHBondContact O-N 2.87Å; M926-I929 HydrophobicContact SD-CD1 4.34Å; M926-R930 PolarHBondContact O-N 3Å; M926-R930 PolarHBondContact O-NE 3.47Å; M926-R930 PolarHBondContact O-NH2 3.34Å; M926-Q942 VanDerWaalsContact CE-NE2 3.29Å; M926-Y946 HydrophobicContact CG-CD1 3.97Å; M926-L948 HydrophobicContact CE-CD1 4.03Å; M926-L948 HydrophobicContact CE-CG 3.96Å; M926-V967 HydrophobicContact CG-CG2 4.11Å; M926-V967 HydrophobicContact SD-CB 4.16Å; M926-V967 HydrophobicContact SD-CG2 3.53Å; M926-V967 VanDerWaalsContact SD-CG2 3.53Å
927	K	93	Very high	91.9	Very high	110 Å²	110	53.2 Å²	53.2	48%	0.478	29%	0.291	S	S	.	.	H	α-helix	trans	-69.5	-48.3	170.7	-65.2	175.6	-160.9	165.9	0	110.9	E923 E924 M925 I929 R930 K931	E923-K927 WeakPolarHBondContact O-CG 3.46Å; E923-K927 PolarHBondContact O-N 3.48Å; E924-K927 WeakPolarHBondContact O-CB 3.2Å; E924-K927 PolarHBondContact O-N 3.34Å; E924-K927 WeakPolarHBondContact OE1-CE 3.25Å; E924-K927 IonicContact OE1-NZ 2.71Å; E924-K927 PolarHBondContact OE1-NZ 2.9Å; E924-K927 WeakPolarHBondContact OE2-CD 3.3Å; E924-K927 WeakPolarHBondContact OE2-CE 3.46Å; E924-K927 IonicContact OE2-NZ 2.65Å; E924-K927 PolarHBondContact OE2-NZ 3.48Å; M925-K927 VanDerWaalsContact C-N 3.31Å; M925-K927 PolarHBondContact O-N 3.08Å; K927-I929 PolarHBondContact O-N 2.85Å; K927-R930 PolarHBondContact O-N 3.09Å; K927-K931 WeakPolarHBondContact O-CB 3.18Å; K927-K931 PolarHBondContact O-N 2.7Å
928	E	93.8	Very high	92.4	Very high	30 Å²	30	50.6 Å²	50.6	14%	0.14	28%	0.275	C	S	.	.	H	α-helix	trans	-64.1	-39.9	-178.4	-172.3	60.3	-162.3	0	0	111.7	E924 M925 R930 K931 V932 L1001 L1003	E924-E928 PolarHBondContact O-N 3.02Å; M925-E928 PolarHBondContact O-N 3.39Å; E928-R930 PolarHBondContact O-N 3.17Å; E928-K931 PolarHBondContact O-N 2.94Å; E928-K931 IonicContact OE1-NZ 3.05Å; E928-K931 PolarHBondContact OE1-NZ 2.93Å; E928-K931 IonicContact OE2-NZ 3.06Å; E928-K931 PolarHBondContact OE2-NZ 3.13Å; E928-V932 WeakPolarHBondContact O-CG2 3.09Å; E928-V932 PolarHBondContact O-N 3.2Å; E928-L1001 HydrophobicContact CG-CD2 4.24Å; E928-L1003 HydrophobicContact CB-CD2 4.24Å; E928-L1003 HydrophobicContact CG-CD2 4.26Å
929	I	94.4	Very high	92.7	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-58.3	-47.7	173.4	-69.4	161.5	0	0	0	111.8	M925 M926 K927 V932 L933 L948 M965 V967 V978 L1001	M925-I929 WeakPolarHBondContact O-CB 3.49Å; M925-I929 WeakPolarHBondContact O-CD1 3.49Å; M925-I929 WeakPolarHBondContact O-CG1 3.24Å; M925-I929 PolarHBondContact O-N 2.98Å; M926-I929 HydrophobicContact SD-CD1 4.34Å; K927-I929 PolarHBondContact O-N 2.85Å; I929-V932 PolarHBondContact O-N 3.31Å; I929-L933 HydrophobicContact CG2-CD1 3.76Å; I929-L933 HydrophobicContact CG2-CG 4.43Å; I929-L933 VanDerWaalsContact O-CG 3.29Å; I929-L933 WeakPolarHBondContact O-CG 3.41Å; I929-L933 PolarHBondContact O-N 3.3Å; I929-L948 HydrophobicContact CG2-CD1 3.56Å; I929-M965 HydrophobicContact CG1-CE 4.18Å; I929-M965 HydrophobicContact CG2-CE 3.6Å; I929-M965 HydrophobicContact CG2-SD 4.22Å; I929-V967 HydrophobicContact CD1-CG2 3.43Å; I929-V967 VanDerWaalsContact CD1-CG2 3.43Å; I929-V978 HydrophobicContact CD1-CG1 4.13Å; I929-V978 HydrophobicContact CD1-CG2 3.87Å; I929-V978 HydrophobicContact CG1-CG2 4.42Å; I929-L1001 HydrophobicContact CB-CD2 4.32Å; I929-L1001 HydrophobicContact CG1-CD1 4.46Å; I929-L1001 HydrophobicContact CG1-CD2 3.68Å
930	R	96	Very high	93.2	Very high	71 Å²	71	55 Å²	55	27%	0.268	29%	0.285	S	S	.	.	H	α-helix	trans	-63	-47.9	177.9	-74.9	-177.9	-67.9	-105.3	-6.2	111.3	M926 K927 E928 V932 L933 D934 Y940 L948	M926-R930 PolarHBondContact O-N 3Å; M926-R930 PolarHBondContact O-NE 3.47Å; M926-R930 PolarHBondContact O-NH2 3.34Å; K927-R930 PolarHBondContact O-N 3.09Å; E928-R930 PolarHBondContact O-N 3.17Å; R930-V932 VanDerWaalsContact C-N 3.28Å; R930-V932 PolarHBondContact O-N 2.92Å; R930-L933 PolarHBondContact O-N 3.33Å; R930-L933 VanDerWaalsContact O-N 3.07Å; R930-D934 WeakPolarHBondContact O-CB 3.32Å; R930-D934 PolarHBondContact O-N 3.01Å; R930-D934 VanDerWaalsContact O-OD2 3.12Å; R930-Y940 HydrophobicContact CB-CE2 4.36Å; R930-Y940 HydrophobicContact CG-CD2 4.38Å; R930-Y940 HydrophobicContact CG-CE2 3.67Å; R930-L948 HydrophobicContact CG-CD1 4.21Å
931	K	95.2	Very high	93.5	Very high	117 Å²	117	56.1 Å²	56.1	51%	0.509	29%	0.288	S	S	.	.	H	α-helix	trans	-53.6	-40.4	175	160.6	169.9	161.2	-81.2	0	113.3	K927 E928 A935	K927-K931 WeakPolarHBondContact O-CB 3.18Å; K927-K931 PolarHBondContact O-N 2.7Å; E928-K931 PolarHBondContact O-N 2.94Å; E928-K931 IonicContact OE1-NZ 3.05Å; E928-K931 PolarHBondContact OE1-NZ 2.93Å; E928-K931 IonicContact OE2-NZ 3.06Å; E928-K931 PolarHBondContact OE2-NZ 3.13Å; K931-A935 WeakPolarHBondContact O-CB 3.49Å; K931-A935 PolarHBondContact O-N 2.76Å; K931-A935 VanDerWaalsContact O-N 3.12Å
932	V	95.5	Very high	93.7	Very high	6 Å²	6	57.4 Å²	57.4	4%	0.036	29%	0.285	C	S	.	.	H	α-helix	trans	-75.3	-37	177.6	174.3	0	0	0	0	111.7	E928 I929 R930 A935 N936 I997 E1000 L1001	E928-V932 WeakPolarHBondContact O-CG2 3.09Å; E928-V932 PolarHBondContact O-N 3.2Å; I929-V932 PolarHBondContact O-N 3.31Å; R930-V932 VanDerWaalsContact C-N 3.28Å; R930-V932 PolarHBondContact O-N 2.92Å; V932-A935 PolarHBondContact O-N 2.82Å; V932-N936 WeakPolarHBondContact O-CB 3.19Å; V932-N936 PolarHBondContact O-N 3.5Å; V932-N936 PolarHBondContact O-ND2 2.9Å; V932-I997 HydrophobicContact CG1-CB 4.49Å; V932-I997 HydrophobicContact CG1-CD1 3.91Å; V932-I997 HydrophobicContact CG1-CG2 4.07Å; V932-E1000 HydrophobicContact CG1-CB 3.78Å; V932-E1000 HydrophobicContact CG2-CB 4.48Å; V932-E1000 WeakPolarHBondContact CG2-O 3.13Å; V932-L1001 HydrophobicContact CB-CD2 4.29Å; V932-L1001 HydrophobicContact CG2-CD2 4.13Å
933	L	95.9	Very high	93.6	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.1	-45	172.7	-70.1	164.7	0	0	0	111.8	I929 R930 A935 N936 N937 C938 Y940 L948 C950 W963 M965 I997	I929-L933 HydrophobicContact CG2-CD1 3.76Å; I929-L933 HydrophobicContact CG2-CG 4.43Å; I929-L933 VanDerWaalsContact O-CG 3.29Å; I929-L933 WeakPolarHBondContact O-CG 3.41Å; I929-L933 PolarHBondContact O-N 3.3Å; R930-L933 PolarHBondContact O-N 3.33Å; R930-L933 VanDerWaalsContact O-N 3.07Å; L933-A935 VanDerWaalsContact C-N 3.3Å; L933-A935 PolarHBondContact O-N 2.73Å; L933-N936 CarbonylContact O-C 3.55Å; L933-N936 PolarHBondContact O-N 2.67Å; L933-N937 PolarHBondContact O-N 2.9Å; L933-C938 HydrophobicContact CB-CB 4.1Å; L933-C938 HydrophobicContact CD2-CB 3.58Å; L933-C938 HydrophobicContact CG-CB 4.46Å; L933-C938 PolarHBondContact O-N 2.92Å; L933-Y940 HydrophobicContact CB-CD1 3.62Å; L933-Y940 HydrophobicContact CB-CE1 3.75Å; L933-Y940 HydrophobicContact CD1-CD1 3.76Å; L933-Y940 HydrophobicContact CD1-CE1 4.37Å; L933-Y940 HydrophobicContact CD1-CG 4.06Å; L933-Y940 HydrophobicContact CG-CD1 4.28Å; L933-L948 HydrophobicContact CD1-CD1 3.87Å; L933-C950 HydrophobicContact CD2-CB 4.31Å; L933-W963 HydrophobicContact CD2-CZ2 3.94Å; L933-M965 HydrophobicContact CD1-SD 4.31Å; L933-M965 HydrophobicContact CD2-SD 4.08Å; L933-M965 HydrophobicContact CG-SD 4.49Å; L933-I997 HydrophobicContact CD2-CD1 4.07Å
934	D	94.5	Very high	93.5	Very high	94 Å²	94	64.6 Å²	64.6	50%	0.503	31%	0.311	S	S	.	.	H	α-helix	trans	-56.5	-43.4	174.8	-60.6	-33.1	0	0	0	111	R930 N936 Y940	R930-D934 WeakPolarHBondContact O-CB 3.32Å; R930-D934 PolarHBondContact O-N 3.01Å; R930-D934 VanDerWaalsContact O-OD2 3.12Å; D934-N936 PolarHBondContact O-N 2.76Å; D934-Y940 WeakPolarHBondContact OD1-CE1 3.31Å; D934-Y940 PolarHBondContact OD1-OH 2.99Å
935	A	94.3	Very high	93.5	Very high	70 Å²	70	64.7 Å²	64.7	58%	0.579	31%	0.31	S	S	*	.	H	α-helix	trans	-72.2	-12.5	178.5	0	0	0	0	0	114.2	K931 V932 L933	K931-A935 WeakPolarHBondContact O-CB 3.49Å; K931-A935 PolarHBondContact O-N 2.76Å; K931-A935 VanDerWaalsContact O-N 3.12Å; V932-A935 PolarHBondContact O-N 2.82Å; L933-A935 VanDerWaalsContact C-N 3.3Å; L933-A935 PolarHBondContact O-N 2.73Å
936	N	93.1	Very high	93.6	Very high	12 Å²	12	65.4 Å²	65.4	6%	0.064	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	12.6	-179.1	-82.5	-93.5	0	0	0	113.1	V932 L933 D934 C938 K996 I997 E1000	V932-N936 WeakPolarHBondContact O-CB 3.19Å; V932-N936 PolarHBondContact O-N 3.5Å; V932-N936 PolarHBondContact O-ND2 2.9Å; L933-N936 CarbonylContact O-C 3.55Å; L933-N936 PolarHBondContact O-N 2.67Å; D934-N936 PolarHBondContact O-N 2.76Å; N936-C938 PolarHBondContact O-N 3.2Å; N936-C938 PolarHBondContact O-SG 2.95Å; N936-C938 VanDerWaalsContact O-SG 3.4Å; N936-K996 WeakPolarHBondContact OD1-CD 3.36Å; N936-K996 PolarHBondContact OD1-NZ 3.13Å; N936-I997 HydrophobicContact CB-CD1 3.57Å; N936-E1000 PolarHBondContact ND2-OE2 3.1Å
937	N	92.4	Very high	93.5	Very high	145 Å²	145	65.8 Å²	65.8	78%	0.775	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	40.2	-174.9	-60	1.1	0	0	0	112.3	L933	L933-N937 PolarHBondContact O-N 2.9Å
938	C	93	Very high	93.6	Very high	6 Å²	6	60.6 Å²	60.6	4%	0.041	29%	0.293	C	S	.	.			trans	-98.6	118	176.5	-62.3	0	0	0	0	109.4	L933 N936 Y940 V951 W963	L933-C938 HydrophobicContact CB-CB 4.1Å; L933-C938 HydrophobicContact CD2-CB 3.58Å; L933-C938 HydrophobicContact CG-CB 4.46Å; L933-C938 PolarHBondContact O-N 2.92Å; N936-C938 PolarHBondContact O-N 3.2Å; N936-C938 PolarHBondContact O-SG 2.95Å; N936-C938 VanDerWaalsContact O-SG 3.4Å; C938-Y940 WeakPolarHBondContact O-CD1 3.24Å; C938-V951 CarbonylContact C-O 3.49Å; C938-V951 WeakPolarHBondContact CA-O 3.42Å; C938-W963 HydrophobicContact CB-CH2 4.27Å
939	D	93.1	Very high	93.7	Very high	121 Å²	121	60.1 Å²	60.1	65%	0.647	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	146.7	170.8	-66.7	-53.8	0	0	0	110.4	C950 V951	D939-C950 CarbonylContact O-C 3.06Å; D939-C950 VanDerWaalsContact O-CA 3.29Å; D939-C950 WeakPolarHBondContact O-CA 3.37Å; D939-V951 HydrophobicContact CB-CB 4.36Å; D939-V951 PolarHBondContact N-O 2.92Å; D939-V951 PolarHBondContact O-N 2.85Å
940	Y	95.4	Very high	93.8	Very high	80 Å²	80	60.1 Å²	60.1	31%	0.314	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	153.1	175.7	57.6	-95.2	0	0	0	115	R930 L933 D934 C938 L948 L949	R930-Y940 HydrophobicContact CB-CE2 4.36Å; R930-Y940 HydrophobicContact CG-CD2 4.38Å; R930-Y940 HydrophobicContact CG-CE2 3.67Å; L933-Y940 HydrophobicContact CB-CD1 3.62Å; L933-Y940 HydrophobicContact CB-CE1 3.75Å; L933-Y940 HydrophobicContact CD1-CD1 3.76Å; L933-Y940 HydrophobicContact CD1-CE1 4.37Å; L933-Y940 HydrophobicContact CD1-CG 4.06Å; L933-Y940 HydrophobicContact CG-CD1 4.28Å; D934-Y940 WeakPolarHBondContact OD1-CE1 3.31Å; D934-Y940 PolarHBondContact OD1-OH 2.99Å; C938-Y940 WeakPolarHBondContact O-CD1 3.24Å; Y940-L948 HydrophobicContact CD2-CD2 3.72Å; Y940-L948 HydrophobicContact CE2-CD2 4.49Å; Y940-L948 HydrophobicContact CG-CD2 4.32Å; Y940-L949 CarbonylContact C-O 3.48Å; Y940-L949 WeakPolarHBondContact CA-O 3.21Å
941	E	94.2	Very high	93.7	Very high	89 Å²	89	58.5 Å²	58.5	42%	0.416	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	129.6	179.2	-171.8	-166.8	160.7	0	0	110.2	R943 L948 L949	E941-R943 VanDerWaalsContact CD-NH2 3.28Å; E941-R943 PolarHBondContact O-N 3.25Å; E941-R943 IonicContact OE1-CZ 3.5Å; E941-R943 IonicContact OE1-NE 3.46Å; E941-R943 PolarHBondContact OE1-NE 2.9Å; E941-R943 IonicContact OE1-NH1 3.45Å; E941-R943 PolarHBondContact OE1-NH1 2.85Å; E941-R943 IonicContact OE1-NH2 3.94Å; E941-R943 PolarHBondContact OE1-NH2 2.93Å; E941-R943 IonicContact OE2-CZ 2.73Å; E941-R943 IonicContact OE2-NE 2.69Å; E941-R943 PolarHBondContact OE2-NE 2.94Å; E941-R943 IonicContact OE2-NH2 3.98Å; E941-R943 PolarHBondContact OE2-NH2 3.29Å; E941-L948 CarbonylContact O-C 3.36Å; E941-L948 WeakPolarHBondContact O-CA 3.41Å; E941-L949 PolarHBondContact N-O 3.02Å; E941-L949 PolarHBondContact O-N 2.64Å
942	Q	93.1	Very high	93.6	Very high	78 Å²	78	56 Å²	56	36%	0.364	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	102.6	179.5	-166.3	76	79	0	0	110.4	M926 E944 L947 L948	M926-Q942 VanDerWaalsContact CE-NE2 3.29Å; Q942-E944 PolarHBondContact NE2-O 3.1Å; Q942-L947 PolarHBondContact NE2-O 3.37Å; Q942-L948 HydrophobicContact CB-CD2 4.22Å
943	R	88.6	Confident	93.3	Very high	144 Å²	144	57.3 Å²	57.3	54%	0.543	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-37.3	-176.1	-66.2	-64.2	-169.8	162.9	-6	113.6	E941 L947 L949	E941-R943 VanDerWaalsContact CD-NH2 3.28Å; E941-R943 PolarHBondContact O-N 3.25Å; E941-R943 IonicContact OE1-CZ 3.5Å; E941-R943 IonicContact OE1-NE 3.46Å; E941-R943 PolarHBondContact OE1-NE 2.9Å; E941-R943 IonicContact OE1-NH1 3.45Å; E941-R943 PolarHBondContact OE1-NH1 2.85Å; E941-R943 IonicContact OE1-NH2 3.94Å; E941-R943 PolarHBondContact OE1-NH2 2.93Å; E941-R943 IonicContact OE2-CZ 2.73Å; E941-R943 IonicContact OE2-NE 2.69Å; E941-R943 PolarHBondContact OE2-NE 2.94Å; E941-R943 IonicContact OE2-NH2 3.98Å; E941-R943 PolarHBondContact OE2-NH2 3.29Å; R943-L947 HydrophobicContact CB-CD2 4.2Å; R943-L947 HydrophobicContact CB-CG 4.41Å; R943-L947 PolarHBondContact N-O 3.26Å; R943-L949 HydrophobicContact CG-CB 3.84Å
944	E	90.1	Very high	92.5	Very high	94 Å²	94	61 Å²	61	44%	0.439	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	166.9	169.8	-52	175.1	155.8	0	0	108	R906 Q942 Y946 L947	R906-E944 IonicContact CZ-OE2 3.19Å; R906-E944 IonicContact NH1-OE2 2.69Å; R906-E944 IonicContact NH2-OE1 3.55Å; R906-E944 PolarHBondContact NH2-OE1 3.16Å; R906-E944 IonicContact NH2-OE2 2.64Å; R906-E944 PolarHBondContact NH2-OE2 2.79Å; Q942-E944 PolarHBondContact NE2-O 3.1Å; E944-Y946 PolarHBondContact O-N 3.17Å; E944-L947 HydrophobicContact CB-CB 3.75Å; E944-L947 HydrophobicContact CG-CB 4.1Å; E944-L947 HydrophobicContact CG-CD2 3.96Å; E944-L947 PolarHBondContact N-O 3.24Å; E944-L947 PolarHBondContact O-N 3.47Å; E944-L947 VanDerWaalsContact O-O 3.13Å
945	K	91.1	Very high	91.7	Very high	86 Å²	86	61.1 Å²	61.1	37%	0.374	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-31.5	-177.9	-176.2	-178.7	171.1	-161.9	0	114.1	V903 E923	V903-K945 HydrophobicContact CB-CD 3.92Å; V903-K945 HydrophobicContact CG1-CB 4.19Å; V903-K945 HydrophobicContact CG1-CD 4.25Å; V903-K945 WeakPolarHBondContact O-CD 3.22Å; V903-K945 PolarHBondContact O-NZ 3.36Å; E923-K945 WeakPolarHBondContact OE1-CE 3.29Å; E923-K945 IonicContact OE1-NZ 3.57Å; E923-K945 PolarHBondContact OE1-NZ 3.47Å
946	Y	93.9	Very high	90.7	Very high	14 Å²	14	65.8 Å²	65.8	6%	0.055	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	15.7	-178.6	-55.6	-69.7	0	0	0	113.8	V903 P905 P922 E923 M926 E944 E966 V967	V903-Y946 WeakPolarHBondContact O-CE2 3.35Å; V903-Y946 PolarHBondContact O-OH 2.93Å; P905-Y946 HydrophobicContact CB-CD2 4.19Å; P905-Y946 HydrophobicContact CB-CE2 4.34Å; P905-Y946 HydrophobicContact CB-CG 4.37Å; P905-Y946 HydrophobicContact CG-CD1 4.29Å; P905-Y946 HydrophobicContact CG-CD2 4.1Å; P905-Y946 HydrophobicContact CG-CE1 4.04Å; P905-Y946 HydrophobicContact CG-CE2 3.81Å; P905-Y946 HydrophobicContact CG-CG 4.29Å; P905-Y946 VanDerWaalsContact N-CE2 3.27Å; P922-Y946 HydrophobicContact CB-CD1 4.01Å; P922-Y946 HydrophobicContact CB-CE1 3.46Å; P922-Y946 VanDerWaalsContact CB-CE1 3.46Å; E923-Y946 WeakPolarHBondContact OE1-CE1 3.18Å; E923-Y946 PolarHBondContact OE1-OH 3.36Å; M926-Y946 HydrophobicContact CG-CD1 3.97Å; E944-Y946 PolarHBondContact O-N 3.17Å; Y946-E966 WeakPolarHBondContact O-CA 3.37Å; Y946-V967 PolarHBondContact O-N 3.2Å
947	L	93.6	Very high	89.7	Confident	13 Å²	13	67.9 Å²	67.9	7%	0.068	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	117.8	-177.9	-175.2	68.9	0	0	0	110.7	Q942 R943 E944 E964 M965 E966	Q942-L947 PolarHBondContact NE2-O 3.37Å; R943-L947 HydrophobicContact CB-CD2 4.2Å; R943-L947 HydrophobicContact CB-CG 4.41Å; R943-L947 PolarHBondContact N-O 3.26Å; E944-L947 HydrophobicContact CB-CB 3.75Å; E944-L947 HydrophobicContact CG-CB 4.1Å; E944-L947 HydrophobicContact CG-CD2 3.96Å; E944-L947 PolarHBondContact N-O 3.24Å; E944-L947 PolarHBondContact O-N 3.47Å; E944-L947 VanDerWaalsContact O-O 3.13Å; L947-E964 HydrophobicContact CD1-CB 4.05Å; L947-E964 HydrophobicContact CD1-CG 4.26Å; L947-M965 WeakPolarHBondContact CA-O 3.41Å; L947-E966 HydrophobicContact CD1-CB 3.75Å; L947-E966 HydrophobicContact CD1-CG 3.98Å
948	L	95.6	Very high	88.5	Confident	1 Å²	1	67 Å²	67	1%	0.005	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	144.2	170.2	-69	164.2	0	0	0	110	M926 I929 R930 L933 Y940 E941 Q942 E964 M965	M926-L948 HydrophobicContact CE-CD1 4.03Å; M926-L948 HydrophobicContact CE-CG 3.96Å; I929-L948 HydrophobicContact CG2-CD1 3.56Å; R930-L948 HydrophobicContact CG-CD1 4.21Å; L933-L948 HydrophobicContact CD1-CD1 3.87Å; Y940-L948 HydrophobicContact CD2-CD2 3.72Å; Y940-L948 HydrophobicContact CE2-CD2 4.49Å; Y940-L948 HydrophobicContact CG-CD2 4.32Å; E941-L948 CarbonylContact O-C 3.36Å; E941-L948 WeakPolarHBondContact O-CA 3.41Å; Q942-L948 HydrophobicContact CB-CD2 4.22Å; L948-E964 CarbonylContact O-C 3.51Å; L948-E964 VanDerWaalsContact O-CA 3.23Å; L948-E964 WeakPolarHBondContact O-CA 3.35Å; L948-M965 HydrophobicContact CB-CB 4.47Å; L948-M965 PolarHBondContact N-O 2.94Å; L948-M965 PolarHBondContact O-N 2.66Å
949	L	95.3	Very high	87.8	Confident	21 Å²	21	70.8 Å²	70.8	11%	0.11	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.9	162	179.2	66.7	0	0	0	107.4	Y940 E941 R943 Q962 E964 I983	Y940-L949 CarbonylContact C-O 3.48Å; Y940-L949 WeakPolarHBondContact CA-O 3.21Å; E941-L949 PolarHBondContact N-O 3.02Å; E941-L949 PolarHBondContact O-N 2.64Å; R943-L949 HydrophobicContact CG-CB 3.84Å; L949-Q962 HydrophobicContact CD1-CG 3.84Å; L949-Q962 HydrophobicContact CG-CG 4.42Å; L949-E964 HydrophobicContact CD1-CG 4.04Å; L949-I983 HydrophobicContact CD1-CG1 4.05Å
950	C	95.6	Very high	87.6	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	148.8	-172.1	-55.3	0	0	0	0	111.2	L933 D939 Q962 W963	L933-C950 HydrophobicContact CD2-CB 4.31Å; D939-C950 CarbonylContact O-C 3.06Å; D939-C950 VanDerWaalsContact O-CA 3.29Å; D939-C950 WeakPolarHBondContact O-CA 3.37Å; C950-Q962 CarbonylContact O-C 3.51Å; C950-Q962 VanDerWaalsContact O-CA 3.31Å; C950-Q962 WeakPolarHBondContact O-CA 3.4Å; C950-Q962 WeakPolarHBondContact O-CG 3.34Å; C950-W963 HydrophobicContact CB-CD2 3.79Å; C950-W963 VanDerWaalsContact CB-CE2 3.46Å; C950-W963 HydrophobicContact CB-CE3 4.17Å; C950-W963 HydrophobicContact CB-CG 4.33Å; C950-W963 HydrophobicContact CB-CH2 3.99Å; C950-W963 HydrophobicContact CB-CZ2 3.59Å; C950-W963 HydrophobicContact CB-CZ3 4.26Å; C950-W963 PolarHBondContact N-O 3.44Å; C950-W963 PolarHBondContact O-N 3.14Å
951	V	94.6	Very high	87.4	Confident	37 Å²	37	63.8 Å²	63.8	22%	0.224	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	143.9	177.1	-179.2	0	0	0	0	109.5	C938 D939 L960 V961 Q962	C938-V951 CarbonylContact C-O 3.49Å; C938-V951 WeakPolarHBondContact CA-O 3.42Å; D939-V951 HydrophobicContact CB-CB 4.36Å; D939-V951 PolarHBondContact N-O 2.92Å; D939-V951 PolarHBondContact O-N 2.85Å; V951-L960 HydrophobicContact CG1-CD1 3.61Å; V951-V961 WeakPolarHBondContact CA-O 3.4Å; V951-Q962 HydrophobicContact CG2-CB 4.43Å; V951-Q962 HydrophobicContact CG2-CG 3.98Å
952	H	93.5	Very high	87.4	Confident	65 Å²	65	62.3 Å²	62.3	30%	0.301	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	143.2	172.7	169.8	-77	0	0	0	110.3	V961 W963 I993	H952-V961 PolarHBondContact N-O 3.45Å; H952-V961 PolarHBondContact O-N 2.78Å; H952-W963 HydrophobicContact CB-CH2 3.73Å; H952-W963 HydrophobicContact CB-CZ3 3.71Å; H952-I993 HydrophobicContact CB-CG1 4.15Å
953	G	88.4	Confident	87.4	Confident	33 Å²	33	58.6 Å²	58.6	34%	0.34	31%	0.306	S	S	.	.	S	Bend	trans	103.8	161.8	-176.5	0	0	0	0	0	112.4	L960	G953-L960 WeakPolarHBondContact O-CD1 3.1Å
954	D	80.2	Confident	87.7	Confident	78 Å²	78	53.5 Å²	53.5	42%	0.417	29%	0.289	S	S	.	.			trans	-76.3	124.7	-179.6	179.8	-3.6	0	0	0	110.6	H956 T957	D954-H956 PolarHBondContact O-N 2.73Å; D954-H956 IonicContact OD1-CE1 3.66Å; D954-H956 IonicContact OD1-CG 2.73Å; D954-H956 PolarHBondContact OD1-N 2.8Å; D954-H956 IonicContact OD1-ND1 3.45Å; D954-H956 PolarHBondContact OD1-ND1 3.12Å; D954-H956 IonicContact OD2-ND1 3.55Å; D954-T957 HydrophobicContact CB-CG2 4.04Å; D954-T957 PolarHBondContact O-N 3.19Å; D954-T957 PolarHBondContact O-OG1 3.1Å
955	P	76.5	Confident	87.9	Confident	97 Å²	97	49.1 Å²	49.1	63%	0.63	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-19	175.3	-27.8	36.1	0	0	0	116.1	T957 L960	P955-T957 VanDerWaalsContact C-N 3.29Å; P955-L960 HydrophobicContact CG-CD1 4.26Å
956	H	73.9	Confident	88	Confident	168 Å²	168	45.3 Å²	45.3	78%	0.778	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	8.3	177.4	-48.2	89.8	0	0	0	113	D954	D954-H956 PolarHBondContact O-N 2.73Å; D954-H956 IonicContact OD1-CE1 3.66Å; D954-H956 IonicContact OD1-CG 2.73Å; D954-H956 PolarHBondContact OD1-N 2.8Å; D954-H956 IonicContact OD1-ND1 3.45Å; D954-H956 PolarHBondContact OD1-ND1 3.12Å; D954-H956 IonicContact OD2-ND1 3.55Å
957	T	71	Confident	87.9	Confident	56 Å²	56	44.7 Å²	44.7	34%	0.344	25%	0.249	S	C	.	.	S	Bend	trans	-138.9	153.3	-174.4	70.5	0	0	0	0	113.2	D954 P955 C959 L960	D954-T957 HydrophobicContact CB-CG2 4.04Å; D954-T957 PolarHBondContact O-N 3.19Å; D954-T957 PolarHBondContact O-OG1 3.1Å; P955-T957 VanDerWaalsContact C-N 3.29Å; T957-C959 PolarHBondContact O-N 3.24Å; T957-C959 WeakPolarHBondContact OG1-CB 3.35Å; T957-C959 PolarHBondContact OG1-N 3.48Å; T957-L960 PolarHBondContact O-N 3.03Å; T957-L960 VanDerWaalsContact O-N 3.1Å
958	D	68.2	Low	87.7	Confident	126 Å²	126	44 Å²	44	67%	0.674	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-1.4	175.8	-42.6	-31.6	0	0	0	113.3	L960	D958-L960 VanDerWaalsContact C-N 3.3Å
959	C	78.8	Confident	87.3	Confident	86 Å²	86	49.1 Å²	49.1	58%	0.581	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-7.8	172.4	-65	0	0	0	0	113.3	T957 V961	T957-C959 PolarHBondContact O-N 3.24Å; T957-C959 WeakPolarHBondContact OG1-CB 3.35Å; T957-C959 PolarHBondContact OG1-N 3.48Å; C959-V961 PolarHBondContact O-N 2.61Å
960	L	88.6	Confident	86.7	Confident	52 Å²	52	48.3 Å²	48.3	27%	0.272	26%	0.264	S	S	.	.			trans	-63.5	124.1	175.1	-172.6	73.1	0	0	0	111.2	V951 G953 P955 T957 D958 G985	V951-L960 HydrophobicContact CG1-CD1 3.61Å; G953-L960 WeakPolarHBondContact O-CD1 3.1Å; P955-L960 HydrophobicContact CG-CD1 4.26Å; T957-L960 PolarHBondContact O-N 3.03Å; T957-L960 VanDerWaalsContact O-N 3.1Å; D958-L960 VanDerWaalsContact C-N 3.3Å; L960-G985 WeakPolarHBondContact O-CA 3.48Å
961	V	91.3	Very high	85.6	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.012	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	133.5	176.9	-177.6	0	0	0	0	109.9	V951 H952 C959 W963 F990 I993	V951-V961 WeakPolarHBondContact CA-O 3.4Å; H952-V961 PolarHBondContact N-O 3.45Å; H952-V961 PolarHBondContact O-N 2.78Å; C959-V961 PolarHBondContact O-N 2.61Å; V961-W963 HydrophobicContact CG1-CE3 3.92Å; V961-W963 HydrophobicContact CG1-CZ3 4.36Å; V961-F990 HydrophobicContact CG1-CB 3.73Å; V961-F990 HydrophobicContact CG1-CD2 4.05Å; V961-F990 HydrophobicContact CG1-CG 4.38Å; V961-I993 HydrophobicContact CG1-CG2 4.41Å
962	Q	93.8	Very high	84.4	Confident	57 Å²	57	55.8 Å²	55.8	27%	0.266	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	137.2	172	-169.7	175.6	40	0	0	110.3	L949 C950 V951 I983 S984	L949-Q962 HydrophobicContact CD1-CG 3.84Å; L949-Q962 HydrophobicContact CG-CG 4.42Å; C950-Q962 CarbonylContact O-C 3.51Å; C950-Q962 VanDerWaalsContact O-CA 3.31Å; C950-Q962 WeakPolarHBondContact O-CA 3.4Å; C950-Q962 WeakPolarHBondContact O-CG 3.34Å; V951-Q962 HydrophobicContact CG2-CB 4.43Å; V951-Q962 HydrophobicContact CG2-CG 3.98Å; Q962-I983 HydrophobicContact CB-CB 4.16Å; Q962-I983 HydrophobicContact CG-CB 4.02Å; Q962-I983 HydrophobicContact CG-CG1 4.5Å; Q962-I983 HydrophobicContact CG-CG2 4.26Å; Q962-I983 PolarHBondContact O-N 3.33Å; Q962-S984 WeakPolarHBondContact CB-OG 3.47Å; Q962-S984 PolarHBondContact N-O 3.31Å; Q962-S984 PolarHBondContact O-N 3.46Å; Q962-S984 VanDerWaalsContact O-N 3.17Å
963	W	93.5	Very high	83.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	155.1	176.9	70	100.3	0	0	0	112.3	L933 C938 C950 H952 V961 M965 F980 K981 F990 I993	L933-W963 HydrophobicContact CD2-CZ2 3.94Å; C938-W963 HydrophobicContact CB-CH2 4.27Å; C950-W963 HydrophobicContact CB-CD2 3.79Å; C950-W963 VanDerWaalsContact CB-CE2 3.46Å; C950-W963 HydrophobicContact CB-CE3 4.17Å; C950-W963 HydrophobicContact CB-CG 4.33Å; C950-W963 HydrophobicContact CB-CH2 3.99Å; C950-W963 HydrophobicContact CB-CZ2 3.59Å; C950-W963 HydrophobicContact CB-CZ3 4.26Å; C950-W963 PolarHBondContact N-O 3.44Å; C950-W963 PolarHBondContact O-N 3.14Å; H952-W963 HydrophobicContact CB-CH2 3.73Å; H952-W963 HydrophobicContact CB-CZ3 3.71Å; V961-W963 HydrophobicContact CG1-CE3 3.92Å; V961-W963 HydrophobicContact CG1-CZ3 4.36Å; W963-M965 VanDerWaalsContact CD1-CG 3.5Å; W963-M965 VanDerWaalsContact NE1-CG 3.29Å; W963-M965 PolarHBondContact NE1-SD 2.94Å; W963-M965 VanDerWaalsContact NE1-SD 3.38Å; W963-F980 AromaticContact CD1-CD1 3.91Å; W963-F980 AromaticContact NE1-CD1 3.88Å; W963-K981 CarbonylContact C-O 3.59Å; W963-K981 VanDerWaalsContact CA-O 3.3Å; W963-K981 WeakPolarHBondContact CA-O 3.28Å; W963-K981 WeakPolarHBondContact CB-O 3.29Å; W963-F990 HydrophobicContact CB-CD2 3.97Å; W963-F990 HydrophobicContact CB-CE2 3.56Å; W963-F990 HydrophobicContact CG-CD2 4.29Å; W963-F990 AromaticContact CG-CE2 3.86Å; W963-F990 HydrophobicContact CG-CE2 3.86Å; W963-I993 HydrophobicContact CE3-CG2 4.44Å; W963-I993 HydrophobicContact CH2-CG1 3.8Å; W963-I993 HydrophobicContact CH2-CG2 4.1Å; W963-I993 HydrophobicContact CZ2-CG1 4.3Å; W963-I993 HydrophobicContact CZ3-CG1 4.45Å; W963-I993 HydrophobicContact CZ3-CG2 4.01Å
964	E	94.3	Very high	83	Confident	38 Å²	38	61 Å²	61	18%	0.178	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	145.1	165.5	-75	167.7	-143.8	0	0	111	L947 L948 L949 F980 K981 I983	L947-E964 HydrophobicContact CD1-CB 4.05Å; L947-E964 HydrophobicContact CD1-CG 4.26Å; L948-E964 CarbonylContact O-C 3.51Å; L948-E964 VanDerWaalsContact O-CA 3.23Å; L948-E964 WeakPolarHBondContact O-CA 3.35Å; L949-E964 HydrophobicContact CD1-CG 4.04Å; E964-F980 WeakPolarHBondContact O-CA 3.49Å; E964-K981 HydrophobicContact CB-CB 4.3Å; E964-K981 VanDerWaalsContact CD-CE 3.41Å; E964-K981 PolarHBondContact N-O 2.52Å; E964-K981 PolarHBondContact O-N 2.88Å; E964-K981 WeakPolarHBondContact OE1-CE 3.47Å; E964-K981 IonicContact OE1-NZ 2.71Å; E964-K981 PolarHBondContact OE1-NZ 2.98Å; E964-K981 WeakPolarHBondContact OE2-CE 3.32Å; E964-K981 IonicContact OE2-NZ 2.62Å; E964-K981 PolarHBondContact OE2-NZ 2.96Å; E964-I983 HydrophobicContact CG-CD1 4.18Å; E964-I983 HydrophobicContact CG-CG1 4.33Å; E964-I983 WeakPolarHBondContact OE1-CD1 3.5Å
965	M	93.5	Very high	83.3	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.6	166.4	-68.1	-175.9	61.5	0	0	109.9	I929 L933 L947 L948 W963 V978 R979 F980 I997 L1001	I929-M965 HydrophobicContact CG1-CE 4.18Å; I929-M965 HydrophobicContact CG2-CE 3.6Å; I929-M965 HydrophobicContact CG2-SD 4.22Å; L933-M965 HydrophobicContact CD1-SD 4.31Å; L933-M965 HydrophobicContact CD2-SD 4.08Å; L933-M965 HydrophobicContact CG-SD 4.49Å; L947-M965 WeakPolarHBondContact CA-O 3.41Å; L948-M965 HydrophobicContact CB-CB 4.47Å; L948-M965 PolarHBondContact N-O 2.94Å; L948-M965 PolarHBondContact O-N 2.66Å; W963-M965 VanDerWaalsContact CD1-CG 3.5Å; W963-M965 VanDerWaalsContact NE1-CG 3.29Å; W963-M965 PolarHBondContact NE1-SD 2.94Å; W963-M965 VanDerWaalsContact NE1-SD 3.38Å; M965-V978 HydrophobicContact CE-CG1 3.78Å; M965-R979 WeakPolarHBondContact CA-O 3.39Å; M965-F980 HydrophobicContact CE-CD1 4.4Å; M965-F980 HydrophobicContact CE-CE1 3.61Å; M965-F980 HydrophobicContact CE-CE2 4.22Å; M965-F980 HydrophobicContact CE-CZ 3.51Å; M965-F980 HydrophobicContact CG-CD1 3.95Å; M965-F980 HydrophobicContact CG-CE1 4.04Å; M965-F980 HydrophobicContact SD-CD1 4.19Å; M965-F980 HydrophobicContact SD-CE1 3.68Å; M965-F980 HydrophobicContact SD-CZ 4.23Å; M965-I997 HydrophobicContact CE-CG2 3.92Å; M965-I997 HydrophobicContact SD-CG2 4.18Å; M965-L1001 HydrophobicContact CE-CD1 4.25Å
966	E	93.1	Very high	83.8	Confident	5 Å²	5	56.1 Å²	56.1	2%	0.023	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.5	-174.7	-168.4	-172.1	169.1	0	0	111	R906 Y946 L947 C968 R979	R906-E966 VanDerWaalsContact CB-OE1 3.31Å; R906-E966 WeakPolarHBondContact CB-OE1 3.4Å; R906-E966 VanDerWaalsContact CD-OE1 3.24Å; R906-E966 WeakPolarHBondContact CD-OE1 3.17Å; R906-E966 IonicContact CZ-OE1 2.73Å; R906-E966 IonicContact NE-OE1 2.62Å; R906-E966 IonicContact NH1-OE1 2.71Å; R906-E966 PolarHBondContact NH1-OE1 2.81Å; R906-E966 IonicContact NH1-OE2 2.64Å; Y946-E966 WeakPolarHBondContact O-CA 3.37Å; L947-E966 HydrophobicContact CD1-CB 3.75Å; L947-E966 HydrophobicContact CD1-CG 3.98Å; E966-C968 PolarHBondContact OE1-SG 3.25Å; E966-R979 HydrophobicContact CB-CB 4.35Å; E966-R979 PolarHBondContact N-O 2.87Å; E966-R979 PolarHBondContact O-N 2.9Å; E966-R979 IonicContact OE2-NH1 3.55Å; E966-R979 PolarHBondContact OE2-NH1 2.85Å
967	V	92.3	Very high	84.6	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	118.3	168.8	174.2	0	0	0	0	109.1	P922 M925 M926 I929 Y946	P922-V967 HydrophobicContact CB-CG1 4.05Å; M925-V967 HydrophobicContact CB-CG1 4.42Å; M925-V967 HydrophobicContact CB-CG2 4.12Å; M925-V967 HydrophobicContact CE-CG1 4.34Å; M925-V967 HydrophobicContact SD-CG1 3.83Å; M926-V967 HydrophobicContact CG-CG2 4.11Å; M926-V967 HydrophobicContact SD-CB 4.16Å; M926-V967 HydrophobicContact SD-CG2 3.53Å; M926-V967 VanDerWaalsContact SD-CG2 3.53Å; I929-V967 HydrophobicContact CD1-CG2 3.43Å; I929-V967 VanDerWaalsContact CD1-CG2 3.43Å; Y946-V967 PolarHBondContact O-N 3.2Å
968	C	89.9	Confident	85.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	149.2	-176	-61.1	0	0	0	0	111.5	R906 L908 E966 N976 G977	R906-C968 CarbonylContact O-C 3.55Å; R906-C968 VanDerWaalsContact O-CA 3.29Å; R906-C968 WeakPolarHBondContact O-CA 3.37Å; L908-C968 HydrophobicContact CD1-CB 3.68Å; L908-C968 VanDerWaalsContact CD1-SG 3.51Å; L908-C968 HydrophobicContact CG-CB 3.81Å; E966-C968 PolarHBondContact OE1-SG 3.25Å; C968-N976 CarbonylContact O-C 3.59Å; C968-N976 VanDerWaalsContact O-CA 3.28Å; C968-N976 WeakPolarHBondContact O-CA 3.39Å; C968-G977 PolarHBondContact N-O 3.4Å; C968-G977 PolarHBondContact O-N 3.39Å
969	K	87.3	Confident	86.5	Confident	107 Å²	107	39.8 Å²	39.8	47%	0.465	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	143.2	171.3	-174.8	167.9	-174.5	169.5	0	110.9	P905 R906 L908 P971	P905-K969 HydrophobicContact CB-CB 4.41Å; R906-K969 PolarHBondContact O-N 3.01Å; L908-K969 PolarHBondContact N-O 3.21Å; K969-P971 WeakPolarHBondContact O-CD 3.17Å
970	L	83.4	Confident	87.1	Confident	4 Å²	4	36.4 Å²	36.4	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	88.6	177.2	-60.9	177.2	0	0	0	112.1	L908 T911 M914 T917 R972 L973 S974 L975	L908-L970 HydrophobicContact CB-CD2 4.1Å; T911-L970 HydrophobicContact CG2-CD1 3.92Å; T911-L970 HydrophobicContact CG2-CD2 4.12Å; M914-L970 HydrophobicContact CE-CD1 3.72Å; M914-L970 HydrophobicContact CE-CD2 4.01Å; M914-L970 HydrophobicContact CE-CG 3.97Å; M914-L970 HydrophobicContact SD-CD1 3.72Å; M914-L970 HydrophobicContact SD-CD2 3.51Å; M914-L970 VanDerWaalsContact SD-CD2 3.51Å; M914-L970 HydrophobicContact SD-CG 4.02Å; T917-L970 HydrophobicContact CG2-CD1 3.79Å; L970-R972 PolarHBondContact O-N 2.88Å; L970-L973 HydrophobicContact CB-CB 4.39Å; L970-L973 HydrophobicContact CD1-CD1 4.08Å; L970-L973 PolarHBondContact O-N 3.06Å; L970-S974 PolarHBondContact O-N 3.33Å; L970-L975 WeakPolarHBondContact CA-O 3.39Å; L970-L975 WeakPolarHBondContact CB-O 3.36Å; L970-L975 PolarHBondContact N-O 3.07Å
971	P	70.8	Confident	87.2	Confident	76 Å²	76	34.7 Å²	34.7	49%	0.494	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-18.8	-178.6	-23.5	33.2	0	0	0	115.1	S907 K969	S907-P971 WeakPolarHBondContact OG-CG 3.5Å; K969-P971 WeakPolarHBondContact O-CD 3.17Å
972	R	69.5	Low	87.2	Confident	118 Å²	118	35.2 Å²	35.2	45%	0.445	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-22.3	176.8	-68.2	-171.7	-178.4	172.1	8.7	114.2	D250 R909 L970	D250-R972 IonicContact OD2-NH1 2.73Å; R909-R972 PolarHBondContact O-NE 2.77Å; R909-R972 PolarHBondContact O-NH2 2.82Å; L970-R972 PolarHBondContact O-N 2.88Å
973	L	71.5	Confident	87	Confident	95 Å²	95	35.4 Å²	35.4	50%	0.497	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-8.4	-177.4	-60.8	-177.3	0	0	0	112.9	T911 L970 L975	T911-L973 HydrophobicContact CG2-CD1 4.39Å; L970-L973 HydrophobicContact CB-CB 4.39Å; L970-L973 HydrophobicContact CD1-CD1 4.08Å; L970-L973 PolarHBondContact O-N 3.06Å; L973-L975 HydrophobicContact CB-CB 4.27Å; L973-L975 HydrophobicContact CB-CD1 4.36Å; L973-L975 HydrophobicContact CB-CG 4.19Å; L973-L975 PolarHBondContact O-N 3.46Å
974	S	81.3	Confident	86.8	Confident	114 Å²	114	37.6 Å²	37.6	80%	0.797	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	19.1	-169.2	-59.9	0	0	0	0	114.4	L970	L970-S974 PolarHBondContact O-N 3.33Å
975	L	86	Confident	86.4	Confident	52 Å²	52	37.1 Å²	37.1	27%	0.272	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	167.2	177.6	-62.1	-179.4	0	0	0	111.4	S918 L970 L973	S918-L975 WeakPolarHBondContact O-CB 3.46Å; L970-L975 WeakPolarHBondContact CA-O 3.39Å; L970-L975 WeakPolarHBondContact CB-O 3.36Å; L970-L975 PolarHBondContact N-O 3.07Å; L973-L975 HydrophobicContact CB-CB 4.27Å; L973-L975 HydrophobicContact CB-CD1 4.36Å; L973-L975 HydrophobicContact CB-CG 4.19Å; L973-L975 PolarHBondContact O-N 3.46Å
976	N	88.6	Confident	85.9	Confident	20 Å²	20	39.2 Å²	39.2	11%	0.107	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	176.3	159.8	-60.1	-50.1	0	0	0	109.2	T917 S918 L920 M925 C968	T917-N976 CarbonylContact C-O 3.54Å; T917-N976 VanDerWaalsContact CA-O 3.32Å; T917-N976 WeakPolarHBondContact CA-O 3.33Å; S918-N976 PolarHBondContact N-O 3.49Å; S918-N976 PolarHBondContact O-N 3.23Å; L920-N976 PolarHBondContact O-ND2 2.92Å; M925-N976 HydrophobicContact CE-CB 4.3Å; M925-N976 HydrophobicContact SD-CB 3.36Å; M925-N976 WeakPolarHBondContact SD-CB 3.17Å; C968-N976 CarbonylContact O-C 3.59Å; C968-N976 VanDerWaalsContact O-CA 3.28Å; C968-N976 WeakPolarHBondContact O-CA 3.39Å
977	G	89.1	Confident	85.3	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.3	167.4	172	0	0	0	0	0	113.8	T916 C968	T916-G977 CarbonylContact O-C 3.47Å; T916-G977 WeakPolarHBondContact O-CA 3.49Å; C968-G977 PolarHBondContact N-O 3.4Å; C968-G977 PolarHBondContact O-N 3.39Å
978	V	91.2	Very high	84.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	124	-171	-170	0	0	0	0	111	M914 K915 T916 M925 I929 M965 F980 L1001 L1003	M914-V978 WeakPolarHBondContact CA-O 3.39Å; K915-V978 PolarHBondContact N-O 3.35Å; K915-V978 VanDerWaalsContact N-O 3.13Å; T916-V978 PolarHBondContact O-N 2.85Å; M925-V978 HydrophobicContact CE-CG2 3.66Å; I929-V978 HydrophobicContact CD1-CG1 4.13Å; I929-V978 HydrophobicContact CD1-CG2 3.87Å; I929-V978 HydrophobicContact CG1-CG2 4.42Å; M965-V978 HydrophobicContact CE-CG1 3.78Å; V978-F980 HydrophobicContact CB-CE2 4.3Å; V978-F980 HydrophobicContact CG1-CD2 4.2Å; V978-F980 HydrophobicContact CG1-CE2 3.76Å; V978-F980 HydrophobicContact CG1-CZ 4.34Å; V978-L1001 HydrophobicContact CG2-CD1 4.46Å; V978-L1003 HydrophobicContact CG2-CD1 3.53Å
979	R	89.3	Confident	84.5	Confident	7 Å²	7	46.5 Å²	46.5	3%	0.026	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.1	176.5	174.5	172.3	-178.9	-80.1	-18.6	110.1	I3 S913 M965 E966	I3-R979 VanDerWaalsContact CG2-CZ 3.46Å; S913-R979 WeakPolarHBondContact OG-CD 3.39Å; S913-R979 PolarHBondContact OG-NE 2.67Å; M965-R979 WeakPolarHBondContact CA-O 3.39Å; E966-R979 HydrophobicContact CB-CB 4.35Å; E966-R979 PolarHBondContact N-O 2.87Å; E966-R979 PolarHBondContact O-N 2.9Å; E966-R979 IonicContact OE2-NH1 3.55Å; E966-R979 PolarHBondContact OE2-NH1 2.85Å
980	F	91.5	Very high	84.7	Confident	15 Å²	15	42.8 Å²	42.8	7%	0.066	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	138.9	178.2	-70.1	-108.1	0	0	0	110.2	K915 W963 E964 M965 V978 F990 A994 I997 A998 L1001	K915-F980 HydrophobicContact CB-CD2 3.97Å; K915-F980 HydrophobicContact CB-CE2 3.84Å; K915-F980 HydrophobicContact CD-CD2 3.92Å; K915-F980 HydrophobicContact CD-CE2 4.04Å; K915-F980 HydrophobicContact CD-CG 4.37Å; K915-F980 HydrophobicContact CG-CD2 3.82Å; K915-F980 HydrophobicContact CG-CE2 4.12Å; W963-F980 AromaticContact CD1-CD1 3.91Å; W963-F980 AromaticContact NE1-CD1 3.88Å; E964-F980 WeakPolarHBondContact O-CA 3.49Å; M965-F980 HydrophobicContact CE-CD1 4.4Å; M965-F980 HydrophobicContact CE-CE1 3.61Å; M965-F980 HydrophobicContact CE-CE2 4.22Å; M965-F980 HydrophobicContact CE-CZ 3.51Å; M965-F980 HydrophobicContact CG-CD1 3.95Å; M965-F980 HydrophobicContact CG-CE1 4.04Å; M965-F980 HydrophobicContact SD-CD1 4.19Å; M965-F980 HydrophobicContact SD-CE1 3.68Å; M965-F980 HydrophobicContact SD-CZ 4.23Å; V978-F980 HydrophobicContact CB-CE2 4.3Å; V978-F980 HydrophobicContact CG1-CD2 4.2Å; V978-F980 HydrophobicContact CG1-CE2 3.76Å; V978-F980 HydrophobicContact CG1-CZ 4.34Å; F980-F990 HydrophobicContact CB-CZ 4.19Å; F980-A994 HydrophobicContact CD1-CB 3.72Å; F980-A994 HydrophobicContact CE1-CB 4.08Å; F980-A994 HydrophobicContact CG-CB 4.48Å; F980-I997 HydrophobicContact CE1-CB 4.27Å; F980-I997 HydrophobicContact CE1-CG2 3.94Å; F980-I997 HydrophobicContact CZ-CB 4.48Å; F980-I997 HydrophobicContact CZ-CG2 3.95Å; F980-A998 HydrophobicContact CE2-CB 4.32Å; F980-A998 HydrophobicContact CZ-CB 4.15Å; F980-L1001 HydrophobicContact CZ-CD1 4.2Å
981	K	89.1	Confident	84.9	Confident	15 Å²	15	49 Å²	49	7%	0.065	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	101.1	-176.7	-170.3	-164.3	93.7	-177.3	0	112	Y4 L6 W963 E964 I983	Y4-K981 HydrophobicContact CD1-CD 3.96Å; Y4-K981 HydrophobicContact CD1-CG 3.7Å; Y4-K981 HydrophobicContact CD2-CD 3.56Å; Y4-K981 HydrophobicContact CD2-CG 4.22Å; Y4-K981 HydrophobicContact CE1-CD 3.97Å; Y4-K981 HydrophobicContact CE1-CG 3.85Å; Y4-K981 HydrophobicContact CE2-CD 3.6Å; Y4-K981 VanDerWaalsContact CE2-CE 3.43Å; Y4-K981 HydrophobicContact CE2-CG 4.38Å; Y4-K981 HydrophobicContact CG-CD 3.76Å; Y4-K981 HydrophobicContact CG-CG 3.88Å; L6-K981 HydrophobicContact CD1-CG 4.29Å; W963-K981 CarbonylContact C-O 3.59Å; W963-K981 VanDerWaalsContact CA-O 3.3Å; W963-K981 WeakPolarHBondContact CA-O 3.28Å; W963-K981 WeakPolarHBondContact CB-O 3.29Å; E964-K981 HydrophobicContact CB-CB 4.3Å; E964-K981 VanDerWaalsContact CD-CE 3.41Å; E964-K981 PolarHBondContact N-O 2.52Å; E964-K981 PolarHBondContact O-N 2.88Å; E964-K981 WeakPolarHBondContact OE1-CE 3.47Å; E964-K981 IonicContact OE1-NZ 2.71Å; E964-K981 PolarHBondContact OE1-NZ 2.98Å; E964-K981 WeakPolarHBondContact OE2-CE 3.32Å; E964-K981 IonicContact OE2-NZ 2.62Å; E964-K981 PolarHBondContact OE2-NZ 2.96Å; K981-I983 VanDerWaalsContact CE-CD1 3.43Å
982	R	91.4	Very high	85.7	Confident	14 Å²	14	50 Å²	50	5%	0.053	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	137.7	174.8	175.3	167.6	50.6	140.9	1.3	111.7	L6 N8 S984 G985 F990	L6-R982 HydrophobicContact CD1-CB 4Å; L6-R982 HydrophobicContact CD2-CB 4.31Å; N8-R982 PolarHBondContact O-NH1 3.29Å; N8-R982 PolarHBondContact O-NH2 3.5Å; N8-R982 PolarHBondContact OD1-NE 3.09Å; N8-R982 PolarHBondContact OD1-NH2 3.14Å; N8-R982 VanDerWaalsContact OD1-NH2 3.08Å; R982-S984 WeakPolarHBondContact CD-O 3.42Å; R982-S984 WeakPolarHBondContact CG-O 3.36Å; R982-G985 WeakPolarHBondContact CD-O 3.14Å; R982-G985 PolarHBondContact NH1-O 2.9Å; R982-F990 HydrophobicContact CB-CD1 3.84Å; R982-F990 HydrophobicContact CB-CD2 3.84Å; R982-F990 HydrophobicContact CB-CE1 3.93Å; R982-F990 HydrophobicContact CB-CE2 3.95Å; R982-F990 HydrophobicContact CB-CG 3.78Å; R982-F990 HydrophobicContact CB-CZ 3.99Å; R982-F990 HydrophobicContact CG-CB 4.43Å; R982-F990 HydrophobicContact CG-CD2 4.43Å; R982-F990 HydrophobicContact CG-CG 4.22Å
983	I	90.5	Very high	86.8	Confident	60 Å²	60	44.9 Å²	44.9	31%	0.308	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	-43	174.5	-58.8	-58	0	0	0	110.3	L949 Q962 E964 K981	L949-I983 HydrophobicContact CD1-CG1 4.05Å; Q962-I983 HydrophobicContact CB-CB 4.16Å; Q962-I983 HydrophobicContact CG-CB 4.02Å; Q962-I983 HydrophobicContact CG-CG1 4.5Å; Q962-I983 HydrophobicContact CG-CG2 4.26Å; Q962-I983 PolarHBondContact O-N 3.33Å; E964-I983 HydrophobicContact CG-CD1 4.18Å; E964-I983 HydrophobicContact CG-CG1 4.33Å; E964-I983 WeakPolarHBondContact OE1-CD1 3.5Å; K981-I983 VanDerWaalsContact CE-CD1 3.43Å
984	S	90.1	Very high	87.6	Confident	46 Å²	46	40.4 Å²	40.4	32%	0.322	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	175.4	176.7	70.7	0	0	0	0	111.8	Q962 R982	Q962-S984 WeakPolarHBondContact CB-OG 3.47Å; Q962-S984 PolarHBondContact N-O 3.31Å; Q962-S984 PolarHBondContact O-N 3.46Å; Q962-S984 VanDerWaalsContact O-N 3.17Å; R982-S984 WeakPolarHBondContact CD-O 3.42Å; R982-S984 WeakPolarHBondContact CG-O 3.36Å
985	G	84.3	Confident	88	Confident	29 Å²	29	36.7 Å²	36.7	30%	0.299	21%	0.208	S	C	.	.	S	Bend	trans	90.9	167.2	178.6	0	0	0	0	0	114.8	L960 R982	L960-G985 WeakPolarHBondContact O-CA 3.48Å; R982-G985 WeakPolarHBondContact CD-O 3.14Å; R982-G985 PolarHBondContact NH1-O 2.9Å
986	S	83.4	Confident	88.2	Confident	46 Å²	46	38.7 Å²	38.7	32%	0.322	21%	0.214	S	C	.	.			trans	-62.8	148.9	-176.1	71.2	0	0	0	0	112.7	I988 G989 F990	S986-I988 VanDerWaalsContact C-N 3.29Å; S986-I988 PolarHBondContact O-N 3.04Å; S986-G989 PolarHBondContact O-N 3.21Å; S986-G989 PolarHBondContact OG-N 2.73Å; S986-F990 PolarHBondContact O-N 3.43Å
987	S	81.7	Confident	88.4	Confident	41 Å²	41	37.7 Å²	37.7	29%	0.287	21%	0.209	S	C	.	.	H	α-helix	trans	-65.6	-34.2	-179.7	54.2	0	0	0	0	112.1	F9 K991	F9-S987 WeakPolarHBondContact CE2-OG 3.29Å; S987-K991 VanDerWaalsContact O-CB 3.26Å; S987-K991 WeakPolarHBondContact O-CB 3.33Å; S987-K991 PolarHBondContact O-N 3.41Å
988	I	80.1	Confident	88.4	Confident	99 Å²	99	38.7 Å²	38.7	51%	0.508	22%	0.217	S	C	.	.	H	α-helix	trans	-71.2	-45.1	174.1	-172.9	60	0	0	0	111.9	S986 F990 K991 N992	S986-I988 VanDerWaalsContact C-N 3.29Å; S986-I988 PolarHBondContact O-N 3.04Å; I988-F990 PolarHBondContact O-N 3Å; I988-K991 PolarHBondContact O-N 2.97Å; I988-N992 WeakPolarHBondContact O-CB 3.27Å; I988-N992 PolarHBondContact O-N 3.04Å; I988-N992 PolarHBondContact O-OD1 3.18Å
989	G	84.8	Confident	88.2	Confident	18 Å²	18	46.6 Å²	46.6	19%	0.186	25%	0.254	C	S	.	.	H	α-helix	trans	-57.9	-49.9	176.7	0	0	0	0	0	111.8	S986 K991 N992 I993	S986-G989 PolarHBondContact O-N 3.21Å; S986-G989 PolarHBondContact OG-N 2.73Å; G989-K991 PolarHBondContact O-N 3Å; G989-N992 PolarHBondContact O-N 3.2Å; G989-I993 WeakPolarHBondContact O-CG2 3.46Å; G989-I993 PolarHBondContact O-N 3.03Å
990	F	90.7	Very high	88.3	Confident	29 Å²	29	50.1 Å²	50.1	13%	0.127	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-42.6	174.6	173.8	-108.5	0	0	0	113.1	V961 W963 F980 R982 S986 I988 N992 A994	V961-F990 HydrophobicContact CG1-CB 3.73Å; V961-F990 HydrophobicContact CG1-CD2 4.05Å; V961-F990 HydrophobicContact CG1-CG 4.38Å; W963-F990 HydrophobicContact CB-CD2 3.97Å; W963-F990 HydrophobicContact CB-CE2 3.56Å; W963-F990 HydrophobicContact CG-CD2 4.29Å; W963-F990 AromaticContact CG-CE2 3.86Å; W963-F990 HydrophobicContact CG-CE2 3.86Å; F980-F990 HydrophobicContact CB-CZ 4.19Å; R982-F990 HydrophobicContact CB-CD1 3.84Å; R982-F990 HydrophobicContact CB-CD2 3.84Å; R982-F990 HydrophobicContact CB-CE1 3.93Å; R982-F990 HydrophobicContact CB-CE2 3.95Å; R982-F990 HydrophobicContact CB-CG 3.78Å; R982-F990 HydrophobicContact CB-CZ 3.99Å; R982-F990 HydrophobicContact CG-CB 4.43Å; R982-F990 HydrophobicContact CG-CD2 4.43Å; R982-F990 HydrophobicContact CG-CG 4.22Å; S986-F990 PolarHBondContact O-N 3.43Å; I988-F990 PolarHBondContact O-N 3Å; F990-N992 VanDerWaalsContact C-N 3.25Å; F990-N992 PolarHBondContact O-N 3.05Å; F990-A994 HydrophobicContact CD2-CB 3.99Å; F990-A994 HydrophobicContact CE2-CB 3.65Å; F990-A994 HydrophobicContact CZ-CB 4Å; F990-A994 WeakPolarHBondContact O-CB 3.27Å; F990-A994 PolarHBondContact O-N 2.64Å
991	K	86.9	Confident	88.1	Confident	136 Å²	136	49.9 Å²	49.9	59%	0.591	27%	0.27	S	S	*	.	H	α-helix	trans	-58.8	-40.5	176.3	-176.5	-176.7	176.2	-172	0	111	S987 I988 G989 S995	S987-K991 VanDerWaalsContact O-CB 3.26Å; S987-K991 WeakPolarHBondContact O-CB 3.33Å; S987-K991 PolarHBondContact O-N 3.41Å; I988-K991 PolarHBondContact O-N 2.97Å; G989-K991 PolarHBondContact O-N 3Å; K991-S995 WeakPolarHBondContact O-CB 3.48Å; K991-S995 PolarHBondContact O-N 2.92Å; K991-S995 PolarHBondContact O-OG 3.01Å
992	N	88	Confident	87.8	Confident	97 Å²	97	55.3 Å²	55.3	52%	0.519	30%	0.3	S	S	.	.	H	α-helix	trans	-67.9	-62.1	-179.3	-66.2	-6.6	0	0	0	111	I988 G989 F990 A994 S995 K996	I988-N992 WeakPolarHBondContact O-CB 3.27Å; I988-N992 PolarHBondContact O-N 3.04Å; I988-N992 PolarHBondContact O-OD1 3.18Å; G989-N992 PolarHBondContact O-N 3.2Å; F990-N992 VanDerWaalsContact C-N 3.25Å; F990-N992 PolarHBondContact O-N 3.05Å; N992-A994 PolarHBondContact O-N 3.4Å; N992-S995 PolarHBondContact O-N 2.93Å; N992-S995 VanDerWaalsContact O-N 3.1Å; N992-K996 PolarHBondContact O-N 2.9Å
993	I	92.2	Very high	87.3	Confident	10 Å²	10	57 Å²	57	5%	0.051	31%	0.31	C	S	.	.	H	α-helix	trans	-62.7	-46.5	-175.6	-169.7	58.2	0	0	0	112	H952 V961 W963 G989 S995 K996 I997	H952-I993 HydrophobicContact CB-CG1 4.15Å; V961-I993 HydrophobicContact CG1-CG2 4.41Å; W963-I993 HydrophobicContact CE3-CG2 4.44Å; W963-I993 HydrophobicContact CH2-CG1 3.8Å; W963-I993 HydrophobicContact CH2-CG2 4.1Å; W963-I993 HydrophobicContact CZ2-CG1 4.3Å; W963-I993 HydrophobicContact CZ3-CG1 4.45Å; W963-I993 HydrophobicContact CZ3-CG2 4.01Å; G989-I993 WeakPolarHBondContact O-CG2 3.46Å; G989-I993 PolarHBondContact O-N 3.03Å; I993-S995 PolarHBondContact O-N 2.87Å; I993-S995 VanDerWaalsContact O-N 3.08Å; I993-K996 PolarHBondContact O-N 2.95Å; I993-I997 HydrophobicContact CD1-CD1 4.48Å; I993-I997 HydrophobicContact CD1-CG1 4.23Å; I993-I997 HydrophobicContact CG1-CG1 4.26Å; I993-I997 VanDerWaalsContact O-CG1 3.31Å; I993-I997 WeakPolarHBondContact O-CG1 3.42Å; I993-I997 PolarHBondContact O-N 2.71Å
994	A	90.4	Very high	87.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-70.1	-8.8	-179.8	0	0	0	0	0	113.2	K915 F980 F990 N992 A998	K915-A994 VanDerWaalsContact CD-O 3.31Å; K915-A994 WeakPolarHBondContact CD-O 3.08Å; K915-A994 WeakPolarHBondContact CE-O 3.46Å; K915-A994 PolarHBondContact NZ-O 3.17Å; F980-A994 HydrophobicContact CD1-CB 3.72Å; F980-A994 HydrophobicContact CE1-CB 4.08Å; F980-A994 HydrophobicContact CG-CB 4.48Å; F990-A994 HydrophobicContact CD2-CB 3.99Å; F990-A994 HydrophobicContact CE2-CB 3.65Å; F990-A994 HydrophobicContact CZ-CB 4Å; F990-A994 WeakPolarHBondContact O-CB 3.27Å; F990-A994 PolarHBondContact O-N 2.64Å; N992-A994 PolarHBondContact O-N 3.4Å; A994-A998 WeakPolarHBondContact O-CB 3.5Å
995	S	87.8	Confident	87	Confident	37 Å²	37	57.4 Å²	57.4	26%	0.259	31%	0.309	S	S	.	.	H	α-helix	trans	-95.3	-36.3	171.1	-55	0	0	0	0	111.9	K915 K991 N992 I993 A998 Q999	K915-S995 PolarHBondContact NZ-OG 2.73Å; K991-S995 WeakPolarHBondContact O-CB 3.48Å; K991-S995 PolarHBondContact O-N 2.92Å; K991-S995 PolarHBondContact O-OG 3.01Å; N992-S995 PolarHBondContact O-N 2.93Å; N992-S995 VanDerWaalsContact O-N 3.1Å; I993-S995 PolarHBondContact O-N 2.87Å; I993-S995 VanDerWaalsContact O-N 3.08Å; S995-A998 PolarHBondContact O-N 2.6Å; S995-Q999 WeakPolarHBondContact O-CG 3.4Å; S995-Q999 PolarHBondContact O-N 3.15Å
996	K	90.3	Very high	87.2	Confident	93 Å²	93	58.9 Å²	58.9	40%	0.404	31%	0.31	S	S	.	.	H	α-helix	trans	-58	-53.5	169.5	-171.6	176.6	-170.3	-67.2	0	111.1	N936 N992 I993 A998 Q999 E1000	N936-K996 WeakPolarHBondContact OD1-CD 3.36Å; N936-K996 PolarHBondContact OD1-NZ 3.13Å; N992-K996 PolarHBondContact O-N 2.9Å; I993-K996 PolarHBondContact O-N 2.95Å; K996-A998 VanDerWaalsContact C-N 3.27Å; K996-A998 PolarHBondContact O-N 3.43Å; K996-Q999 PolarHBondContact O-N 2.71Å; K996-E1000 WeakPolarHBondContact CE-OE1 2.78Å; K996-E1000 VanDerWaalsContact CG-OE1 3.23Å; K996-E1000 WeakPolarHBondContact CG-OE1 3.4Å; K996-E1000 IonicContact NZ-OE1 3.81Å; K996-E1000 PolarHBondContact NZ-OE1 3.21Å; K996-E1000 IonicContact NZ-OE2 2.74Å; K996-E1000 PolarHBondContact O-N 3.14Å
997	I	92.9	Very high	87.4	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-54.4	-43.5	174.4	-61.3	-67.4	0	0	0	111.1	V932 L933 N936 M965 F980 I993 Q999 E1000 L1001	V932-I997 HydrophobicContact CG1-CB 4.49Å; V932-I997 HydrophobicContact CG1-CD1 3.91Å; V932-I997 HydrophobicContact CG1-CG2 4.07Å; L933-I997 HydrophobicContact CD2-CD1 4.07Å; N936-I997 HydrophobicContact CB-CD1 3.57Å; M965-I997 HydrophobicContact CE-CG2 3.92Å; M965-I997 HydrophobicContact SD-CG2 4.18Å; F980-I997 HydrophobicContact CE1-CB 4.27Å; F980-I997 HydrophobicContact CE1-CG2 3.94Å; F980-I997 HydrophobicContact CZ-CB 4.48Å; F980-I997 HydrophobicContact CZ-CG2 3.95Å; I993-I997 HydrophobicContact CD1-CD1 4.48Å; I993-I997 HydrophobicContact CD1-CG1 4.23Å; I993-I997 HydrophobicContact CG1-CG1 4.26Å; I993-I997 VanDerWaalsContact O-CG1 3.31Å; I993-I997 WeakPolarHBondContact O-CG1 3.42Å; I993-I997 PolarHBondContact O-N 2.71Å; I997-Q999 VanDerWaalsContact C-N 3.29Å; I997-Q999 PolarHBondContact O-N 3Å; I997-E1000 PolarHBondContact O-N 2.89Å; I997-L1001 HydrophobicContact CG2-CD1 4.24Å; I997-L1001 HydrophobicContact CG2-CG 4.39Å; I997-L1001 VanDerWaalsContact O-CG 3.24Å; I997-L1001 WeakPolarHBondContact O-CG 3.23Å; I997-L1001 PolarHBondContact O-N 2.65Å; I997-L1001 VanDerWaalsContact O-N 3.08Å
998	A	89.8	Confident	87.8	Confident	20 Å²	20	60.9 Å²	60.9	17%	0.165	31%	0.31	C	S	.	.	H	α-helix	trans	-71.8	-18.5	-178.5	0	0	0	0	0	114.8	K915 F980 A994 S995 K996	K915-A998 HydrophobicContact CB-CB 3.91Å; K915-A998 HydrophobicContact CD-CB 3.59Å; K915-A998 HydrophobicContact CG-CB 4.41Å; F980-A998 HydrophobicContact CE2-CB 4.32Å; F980-A998 HydrophobicContact CZ-CB 4.15Å; A994-A998 WeakPolarHBondContact O-CB 3.5Å; S995-A998 PolarHBondContact O-N 2.6Å; K996-A998 VanDerWaalsContact C-N 3.27Å; K996-A998 PolarHBondContact O-N 3.43Å
999	Q	87.5	Confident	88.3	Confident	167 Å²	167	58.3 Å²	58.3	78%	0.78	30%	0.297	S	S	*	.	H	α-helix	trans	-88.9	-28.6	174.1	-73.7	170.3	-23.2	0	0	112.4	S995 K996 I997	S995-Q999 WeakPolarHBondContact O-CG 3.4Å; S995-Q999 PolarHBondContact O-N 3.15Å; K996-Q999 PolarHBondContact O-N 2.71Å; I997-Q999 VanDerWaalsContact C-N 3.29Å; I997-Q999 PolarHBondContact O-N 3Å
1000	E	90.7	Very high	88.5	Confident	80 Å²	80	61.2 Å²	61.2	37%	0.374	31%	0.305	S	S	.	.	H	α-helix	trans	-88.4	-13.2	179	-68.8	174.7	-155.9	0	0	113.3	V932 N936 K996 I997 N1002	V932-E1000 HydrophobicContact CG1-CB 3.78Å; V932-E1000 HydrophobicContact CG2-CB 4.48Å; V932-E1000 WeakPolarHBondContact CG2-O 3.13Å; N936-E1000 PolarHBondContact ND2-OE2 3.1Å; K996-E1000 WeakPolarHBondContact CE-OE1 2.78Å; K996-E1000 VanDerWaalsContact CG-OE1 3.23Å; K996-E1000 WeakPolarHBondContact CG-OE1 3.4Å; K996-E1000 IonicContact NZ-OE1 3.81Å; K996-E1000 PolarHBondContact NZ-OE1 3.21Å; K996-E1000 IonicContact NZ-OE2 2.74Å; K996-E1000 PolarHBondContact O-N 3.14Å; I997-E1000 PolarHBondContact O-N 2.89Å; E1000-N1002 PolarHBondContact O-N 3.38Å; E1000-N1002 VanDerWaalsContact O-N 3.17Å
1001	L	88.2	Confident	88.4	Confident	10 Å²	10	63.7 Å²	63.7	5%	0.052	32%	0.319	C	S	.	.			trans	-68.7	101.7	172	-84.6	174.6	0	0	0	112.2	E928 I929 V932 M965 V978 F980 I997 L1003	E928-L1001 HydrophobicContact CG-CD2 4.24Å; I929-L1001 HydrophobicContact CB-CD2 4.32Å; I929-L1001 HydrophobicContact CG1-CD1 4.46Å; I929-L1001 HydrophobicContact CG1-CD2 3.68Å; V932-L1001 HydrophobicContact CB-CD2 4.29Å; V932-L1001 HydrophobicContact CG2-CD2 4.13Å; M965-L1001 HydrophobicContact CE-CD1 4.25Å; V978-L1001 HydrophobicContact CG2-CD1 4.46Å; F980-L1001 HydrophobicContact CZ-CD1 4.2Å; I997-L1001 HydrophobicContact CG2-CD1 4.24Å; I997-L1001 HydrophobicContact CG2-CG 4.39Å; I997-L1001 VanDerWaalsContact O-CG 3.24Å; I997-L1001 WeakPolarHBondContact O-CG 3.23Å; I997-L1001 PolarHBondContact O-N 2.65Å; I997-L1001 VanDerWaalsContact O-N 3.08Å; L1001-L1003 HydrophobicContact CB-CD1 3.92Å; L1001-L1003 HydrophobicContact CB-CG 4.05Å; L1001-L1003 HydrophobicContact CD1-CD1 3.99Å; L1001-L1003 HydrophobicContact CD2-CD1 3.98Å; L1001-L1003 HydrophobicContact CD2-CG 4.26Å; L1001-L1003 HydrophobicContact CG-CD1 4.19Å; L1001-L1003 PolarHBondContact O-N 3.49Å; L1001-L1003 VanDerWaalsContact O-N 3.1Å
1002	N	82.4	Confident	88.5	Confident	130 Å²	130	57.7 Å²	57.7	70%	0.695	30%	0.296	S	S	*	.			trans	-80.2	85.9	175.2	-170.2	43	0	0	0	111	E1000	E1000-N1002 PolarHBondContact O-N 3.38Å; E1000-N1002 VanDerWaalsContact O-N 3.17Å
1003	L	81.8	Confident	88.5	Confident	48 Å²	48	54.1 Å²	54.1	25%	0.251	28%	0.276	S	S	.	.			trans	-131	0	-165.3	-75.2	-174.7	0	0	0	113.9	T916 S918 L920 M925 E928 V978 L1001	T916-L1003 HydrophobicContact CG2-CB 3.86Å; T916-L1003 HydrophobicContact CG2-CD1 4.21Å; S918-L1003 WeakPolarHBondContact CA-OXT 2.99Å; S918-L1003 WeakPolarHBondContact CB-OXT 3.16Å; S918-L1003 PolarHBondContact OG-OXT 2.68Å; L920-L1003 HydrophobicContact CD1-CD2 3.92Å; M925-L1003 HydrophobicContact CB-CD2 4.15Å; M925-L1003 HydrophobicContact CE-CD1 4Å; M925-L1003 HydrophobicContact CE-CD2 4.28Å; M925-L1003 HydrophobicContact CG-CD2 3.99Å; E928-L1003 HydrophobicContact CB-CD2 4.24Å; E928-L1003 HydrophobicContact CG-CD2 4.26Å; V978-L1003 HydrophobicContact CG2-CD1 3.53Å; L1001-L1003 HydrophobicContact CB-CD1 3.92Å; L1001-L1003 HydrophobicContact CB-CG 4.05Å; L1001-L1003 HydrophobicContact CD1-CD1 3.99Å; L1001-L1003 HydrophobicContact CD2-CD1 3.98Å; L1001-L1003 HydrophobicContact CD2-CG 4.26Å; L1001-L1003 HydrophobicContact CG-CD1 4.19Å; L1001-L1003 PolarHBondContact O-N 3.49Å; L1001-L1003 VanDerWaalsContact O-N 3.1Å

Retrieved 1,003 of 1,003 residues in 948.5 ms (Link to these results)

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