A0A5K4F303_SCHMA Loading...

Frizzled-4

AlphaFold DB , UniProt , Accession A0A5K4F303, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,186 aa.

						>A0A5K4F303_SCHMA|A0A5K4F303
MYILLSAGIFLCFKLIYTSPTSTSTTYGQQRCMKPVPIQIPECQNTFYNYTGMPNLIGQETQFDARHQLQTFKPLITYKCSSKLNFFLCSIYTPMCDVNTHYLIGPCRPLCEHVRARCAPVLRVFDFNWPENLNCSQFPLKNSVGGAMCMEGPEDLEEDINPSKSAISSSSSSDSNSNNNLELKDKINKPNHKDLPLDSSVKQMLQVITLDNEKTPNNEMKQQVPIKGTKDNDDDNDKEQLELNQIMEKLTGEFLTTKSFLPNTLITSHFNKYPLSLPQLAQSIRYCSHLKKSIFYIYINRTGRCAPLCDSNILYTTEAKQLSIMWTSILACICSLITIYTLIRYIMNLSHFRFNEKPIIYIALCQLFYALGFCLSLILGRTNITCGQDLDSGQRIRLQEGLDNGLCVFIFIIQYFFSIASYIWWTMLVIHWSLQRISMITSYISSYCCNTHSPQLRNTCSHHNKQFNNADEINTESNCYCLPINSFCFCTENSFNWNQSEIIMNERLMQPSTKKHQTTNNNNNPNNPILNTTPTNVQQQQQQQQYQPNFQNTLNHTITNGIKRDNSSWSTTINHHNHNHDYCQQQQQQQKYSMVFTSKSDQVSACLAREHVVAWLTAGLFTVGVLVSRQVDADELIPVCGVGRQNTNVLGAFILGPQTVLITLGSIAFTIGFLCLLPCFRKCKCFYWSQCNTNGNQASRHHSVQSKKQNYNQGIDSQLIDGNPTFTKSMVNRSHHHHHHHHRHHHYQPTSHNIHQSHHHAHNHQSLRNHSSQRFNQNYPQHLCYTTSMSSSSSSSCDPMEFRIGLFCFLYLIPLICMNACDLYEYLYRDKWLTVPGYKQHMDDHSTNVNTNNHSNNNNNHKLINNQYPNIYGTRNHPEIMNFASYLWNINEVYGPNPELFMLRIFMSLVTGFTCSLWMWTVKGCCRCSYFNYNCCLSVTNNIETLKQKQWENQNLPRNSKPFELTKQNYLCSNEFIKNNDNNGNKHNYKSKFTRTPDGTTYTLHPYAIYQHTKTPDNYHSQQLGINGQFDHRFPTIGCYSSTSLTNTTTNLDKNPSNIPSLLTKGHLSQLDTNFVGRDLEHSTSTTPGYYSHAKISPNMIIDSMSENASASSIPPPLPPSNNRPSRLPARGDPCVGASSSQVFGLNNKMNTDNLDNHITNSTMNNNNTDNSETENYSLIQFQITS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.4	Very low	58	Low	184 Å²	184	119.1 Å²	119.1	91%	0.906	62%	0.621	S	S	*	*				0	-72.7	0	-164.3	170.7	175.2	0	0	112	I3 L4 L5	M1-I3 VanDerWaalsContact C-N 3.32Å; M1-I3 PolarHBondContact O-N 2.98Å; M1-L4 WeakPolarHBondContact O-CB 3.48Å; M1-L4 PolarHBondContact O-N 2.81Å; M1-L5 PolarHBondContact O-N 3.16Å
2	Y	46.3	Very low	57.7	Low	188 Å²	188	116 Å²	116	74%	0.737	62%	0.615	S	S	*	*	H	α-helix	trans	-49.1	-46.9	-177.4	-162.4	-95.3	0	0	0	114.1	L4 L5 S6	Y2-L4 VanDerWaalsContact C-N 3.27Å; Y2-L4 PolarHBondContact O-N 3.08Å; Y2-L5 PolarHBondContact O-N 3.38Å; Y2-L5 VanDerWaalsContact O-N 3.13Å; Y2-S6 PolarHBondContact O-N 2.88Å; Y2-S6 VanDerWaalsContact O-N 3.11Å; Y2-S6 PolarHBondContact O-OG 3.46Å
3	I	59.9	Low	57.5	Low	137 Å²	137	118.8 Å²	118.8	70%	0.703	62%	0.62	S	S	*	*	H	α-helix	trans	-59.8	-32.8	177.8	-61	172.1	0	0	0	113.1	M1 S6 A7	M1-I3 VanDerWaalsContact C-N 3.32Å; M1-I3 PolarHBondContact O-N 2.98Å; I3-S6 WeakPolarHBondContact CA-OG 3.5Å; I3-S6 PolarHBondContact O-OG 3.27Å; I3-A7 WeakPolarHBondContact O-CB 3.38Å; I3-A7 PolarHBondContact O-N 3.07Å; I3-A7 VanDerWaalsContact O-N 3.16Å
4	L	59.4	Low	57.2	Low	135 Å²	135	123.6 Å²	123.6	71%	0.707	63%	0.633	S	S	*	*	H	α-helix	trans	-73.6	-36.2	178.4	-61.2	170.7	0	0	0	111.3	M1 Y2 A7 G8	M1-L4 WeakPolarHBondContact O-CB 3.48Å; M1-L4 PolarHBondContact O-N 2.81Å; Y2-L4 VanDerWaalsContact C-N 3.27Å; Y2-L4 PolarHBondContact O-N 3.08Å; L4-A7 PolarHBondContact O-N 3.22Å; L4-G8 PolarHBondContact O-N 3.14Å
5	L	57.9	Low	56.8	Low	109 Å²	109	125.7 Å²	125.7	57%	0.571	65%	0.645	S	S	*	*	H	α-helix	trans	-67.3	-41	175.6	-71.3	164.3	0	0	0	111.5	M1 Y2 A7	M1-L5 PolarHBondContact O-N 3.16Å; Y2-L5 PolarHBondContact O-N 3.38Å; Y2-L5 VanDerWaalsContact O-N 3.13Å; L5-A7 VanDerWaalsContact C-N 3.34Å; L5-A7 PolarHBondContact O-N 2.95Å
6	S	65.3	Low	56.3	Low	59 Å²	59	125.5 Å²	125.5	41%	0.413	64%	0.644	S	S	.	*	H	α-helix	trans	-66.7	-32.6	174.7	48.9	0	0	0	0	113.6	Y2 I3	Y2-S6 PolarHBondContact O-N 2.88Å; Y2-S6 VanDerWaalsContact O-N 3.11Å; Y2-S6 PolarHBondContact O-OG 3.46Å; I3-S6 WeakPolarHBondContact CA-OG 3.5Å; I3-S6 PolarHBondContact O-OG 3.27Å
7	A	59	Low	55.2	Low	50 Å²	50	129.4 Å²	129.4	41%	0.413	65%	0.65	S	S	.	*	H	α-helix	trans	-71.1	-39.4	-179.8	0	0	0	0	0	112.9	I3 L4 L5 I9 F10 L11	I3-A7 WeakPolarHBondContact O-CB 3.38Å; I3-A7 PolarHBondContact O-N 3.07Å; I3-A7 VanDerWaalsContact O-N 3.16Å; L4-A7 PolarHBondContact O-N 3.22Å; L5-A7 VanDerWaalsContact C-N 3.34Å; L5-A7 PolarHBondContact O-N 2.95Å; A7-I9 PolarHBondContact O-N 3.39Å; A7-F10 PolarHBondContact O-N 3.18Å; A7-L11 PolarHBondContact O-N 2.9Å
8	G	64.1	Low	54.2	Low	38 Å²	38	129.9 Å²	129.9	39%	0.392	66%	0.662	S	S	.	*	H	α-helix	trans	-61.9	-41.3	-179.8	0	0	0	0	0	113.4	L4 F10 L11 C12	L4-G8 PolarHBondContact O-N 3.14Å; G8-F10 VanDerWaalsContact C-N 3.34Å; G8-F10 PolarHBondContact O-N 2.88Å; G8-L11 PolarHBondContact O-N 3.42Å; G8-C12 PolarHBondContact O-N 3.28Å
9	I	63.4	Low	53.3	Low	116 Å²	116	129.7 Å²	129.7	60%	0.595	67%	0.673	S	S	*	*	H	α-helix	trans	-63.5	-39.2	-177.8	-62.4	168.8	0	0	0	111.5	A7	A7-I9 PolarHBondContact O-N 3.39Å
10	F	58.1	Low	52.4	Low	170 Å²	170	129.9 Å²	129.9	75%	0.746	68%	0.682	S	S	*	*	H	α-helix	trans	-71.2	-29.7	-178.9	-108.7	-85.9	0	0	0	113.8	A7 G8	A7-F10 PolarHBondContact O-N 3.18Å; G8-F10 VanDerWaalsContact C-N 3.34Å; G8-F10 PolarHBondContact O-N 2.88Å
11	L	59.7	Low	51.6	Low	124 Å²	124	130.3 Å²	130.3	65%	0.649	69%	0.691	S	S	*	*	H	α-helix	trans	-73	-38.2	179.2	-77	166	0	0	0	112.3	A7 G8 F13 K14	A7-L11 PolarHBondContact O-N 2.9Å; G8-L11 PolarHBondContact O-N 3.42Å; L11-F13 VanDerWaalsContact C-N 3.28Å; L11-F13 PolarHBondContact O-N 3.43Å; L11-K14 PolarHBondContact O-N 3.01Å
12	C	53.6	Low	51.2	Low	82 Å²	82	127.3 Å²	127.3	55%	0.554	69%	0.688	S	S	*	*	H	α-helix	trans	-59.3	-36.8	178.1	-66.5	0	0	0	0	113	G8 K14 L15	G8-C12 PolarHBondContact O-N 3.28Å; C12-K14 VanDerWaalsContact C-N 3.3Å; C12-K14 PolarHBondContact O-N 2.99Å; C12-L15 PolarHBondContact O-N 3.14Å
13	F	55.6	Low	50.7	Low	153 Å²	153	125.2 Å²	125.2	67%	0.671	70%	0.695	S	S	*	*	H	α-helix	trans	-67.9	-23.3	-179.2	-96	-83.6	0	0	0	114.6	L11	L11-F13 VanDerWaalsContact C-N 3.28Å; L11-F13 PolarHBondContact O-N 3.43Å
14	K	53	Low	49.3	Very low	186 Å²	186	122.1 Å²	122.1	81%	0.809	69%	0.685	S	S	*	*	H	α-helix	trans	-85.4	-13.3	-179.5	-95	-148.3	172.3	-165.3	0	115	L11 C12	L11-K14 PolarHBondContact O-N 3.01Å; C12-K14 VanDerWaalsContact C-N 3.3Å; C12-K14 PolarHBondContact O-N 2.99Å
15	L	50.6	Low	48.2	Very low	154 Å²	154	121.3 Å²	121.3	81%	0.806	69%	0.686	S	S	*	*	S	Bend	trans	-92.5	-0.5	-174.2	-67.6	172.1	0	0	0	114.2	C12	C12-L15 PolarHBondContact O-N 3.14Å
16	I	49.5	Very low	47.3	Very low	123 Å²	123	120.3 Å²	120.3	63%	0.631	68%	0.684	S	S	*	*	S	Bend	trans	-99.6	-10	-169.9	-63.5	172.3	0	0	0	112.9
17	Y	38.1	Very low	46.6	Very low	191 Å²	191	123.1 Å²	123.1	75%	0.749	69%	0.687	S	S	*	*			trans	-133.4	84.7	-168	-71.3	-82.8	0	0	0	115
18	T	36.1	Very low	46.1	Very low	140 Å²	140	122.8 Å²	122.8	86%	0.859	69%	0.688	S	S	*	*			trans	-178.8	128.2	151.8	31.5	0	0	0	0	111.7
19	S	38.2	Very low	45.7	Very low	126 Å²	126	129.2 Å²	129.2	88%	0.881	71%	0.708	S	S	*	*			trans	-169.5	133.8	160.6	-80	0	0	0	0	112.6
20	P	35.6	Very low	45.8	Very low	132 Å²	132	126.6 Å²	126.6	86%	0.857	69%	0.693	S	S	*	*			trans	-125.8	170.4	173.2	40.3	-27.9	0	0	0	115.2
21	T	36	Very low	46.5	Very low	140 Å²	140	127 Å²	127	86%	0.859	69%	0.69	S	S	*	*			trans	-133.1	164.5	-168.6	53	0	0	0	0	115.2
22	S	36	Very low	47.4	Very low	121 Å²	121	121.2 Å²	121.2	85%	0.846	66%	0.66	S	S	*	*			trans	-145.8	-180	177.4	61.4	0	0	0	0	114.7
23	T	34.8	Very low	48.2	Very low	144 Å²	144	126.1 Å²	126.1	88%	0.883	68%	0.677	S	S	*	*			trans	-125.8	170.2	-149.6	51.4	0	0	0	0	117
24	S	32.4	Very low	49.3	Very low	71 Å²	71	126.2 Å²	126.2	50%	0.497	68%	0.677	S	S	.	*			trans	-145.4	166.6	-173.1	48	0	0	0	0	116.2	N134	S24-N134 PolarHBondContact OG-ND2 3.45Å; S24-N134 VanDerWaalsContact OG-ND2 3.07Å
25	T	34.7	Very low	50.7	Low	119 Å²	119	119.1 Å²	119.1	73%	0.73	65%	0.65	S	S	*	*			trans	-84.7	170.4	-159.4	-35.1	0	0	0	0	117.1	Q137	T25-Q137 WeakPolarHBondContact O-CG 3.3Å
26	T	40.6	Very low	52.5	Low	87 Å²	87	114 Å²	114	53%	0.534	63%	0.625	S	S	.	*			trans	-114.4	142.4	-174.6	-42.7	0	0	0	0	114.5	Q137	T26-Q137 WeakPolarHBondContact CG2-O 3.44Å
27	Y	50.2	Low	54.4	Low	119 Å²	119	111.9 Å²	111.9	47%	0.467	62%	0.619	S	S	.	*			trans	-104.6	156.8	173.2	-79.6	-115.1	0	0	0	111.1	L56 Q137	Y27-L56 WeakPolarHBondContact CE1-O 3.41Å; Y27-Q137 HydrophobicContact CD2-CB 3.86Å; Y27-Q137 HydrophobicContact CD2-CG 3.86Å; Y27-Q137 HydrophobicContact CE2-CG 4.12Å; Y27-Q137 PolarHBondContact N-O 3.07Å
28	G	48.3	Very low	56.8	Low	43 Å²	43	103.4 Å²	103.4	44%	0.443	59%	0.587	S	S	.	*			trans	166.3	7.6	170.2	0	0	0	0	0	120.9
29	Q	55.6	Low	59.3	Low	173 Å²	173	102.7 Å²	102.7	81%	0.808	57%	0.574	S	S	*	*			trans	-142.9	63.6	-176.5	-68.2	-171.3	-20.4	0	0	113.7
30	Q	65.4	Low	61.7	Low	60 Å²	60	96.8 Å²	96.8	28%	0.28	53%	0.532	S	S	.	.			trans	-110.2	133.1	178.4	-165.9	166.6	-42.8	0	0	110.8	P54 N55 L103	Q30-P54 PolarHBondContact NE2-O 3.29Å; Q30-P54 VanDerWaalsContact NE2-O 3.09Å; Q30-N55 PolarHBondContact NE2-O 3.49Å; Q30-L103 HydrophobicContact CB-CD1 4.43Å; Q30-L103 HydrophobicContact CG-CD1 4.26Å; Q30-L103 HydrophobicContact CG-CD2 4.41Å; Q30-L103 PolarHBondContact O-N 2.95Å
31	R	72.4	Confident	64	Low	179 Å²	179	93.6 Å²	93.6	68%	0.675	51%	0.512	S	S	*	.	B	Isolated β-bridge	trans	-89.7	142.8	177.1	-76.3	-173.6	178.3	178.4	1.6	111.8	H101 Y102 L103	R31-H101 CarbonylContact C-O 3.58Å; R31-H101 VanDerWaalsContact CA-O 3.24Å; R31-H101 WeakPolarHBondContact CA-O 3.44Å; R31-H101 WeakPolarHBondContact CB-O 3.5Å; R31-Y102 HydrophobicContact CG-CD1 3.63Å; R31-Y102 HydrophobicContact CG-CE1 3.39Å; R31-Y102 HydrophobicContact CG-CG 4.47Å; R31-Y102 PolarHBondContact NE-OH 2.96Å; R31-Y102 PolarHBondContact NH2-OH 3.41Å; R31-L103 WeakPolarHBondContact O-CD1 3.48Å
32	C	78	Confident	66.1	Low	3 Å²	3	88.8 Å²	88.8	2%	0.02	48%	0.479	C	S	.	.			trans	-95.1	125.2	169.9	47.1	0	0	0	0	109.7	K34 C96 H101 L103	C32-K34 VanDerWaalsContact C-N 3.3Å; C32-K34 PolarHBondContact O-N 3.29Å; C32-C96 HydrophobicContact CB-CB 3.73Å; C32-C96 WeakPolarHBondContact CB-SG 3.27Å; C32-C96 WeakPolarHBondContact SG-CB 3.42Å; C32-C96 CovalentContact SG-SG 2.04Å; C32-C96 PolarHBondContact SG-SG 3.49Å; C32-H101 PolarHBondContact N-O 3.08Å; C32-L103 HydrophobicContact CB-CD1 3.52Å; C32-L103 HydrophobicContact CB-CG 4.45Å; C32-L103 VanDerWaalsContact N-CD1 3.3Å
33	M	71.5	Confident	68.4	Low	185 Å²	185	83.2 Å²	83.2	91%	0.911	44%	0.44	S	S	*	.	S	Bend	trans	-73.8	-22.3	-174.8	-163.3	152.4	62.5	0	0	113.2
34	K	77.7	Confident	70.6	Confident	155 Å²	155	80.4 Å²	80.4	67%	0.674	42%	0.417	S	S	*	.	S	Bend	trans	-162.1	143.2	169	-165.4	174.3	-178.1	177.1	0	109.5	C32	C32-K34 VanDerWaalsContact C-N 3.3Å; C32-K34 PolarHBondContact O-N 3.29Å
35	P	83.1	Confident	72.2	Confident	36 Å²	36	83.7 Å²	83.7	23%	0.234	43%	0.429	C	S	.	.			trans	-69.3	134.3	167.9	27.5	-33.6	0	0	0	110.9	Y50 C96 V98	P35-Y50 HydrophobicContact CB-CD1 4.25Å; P35-Y50 HydrophobicContact CB-CG 4.38Å; P35-C96 HydrophobicContact CB-CB 4.45Å; P35-V98 HydrophobicContact CB-CG1 4.45Å; P35-V98 HydrophobicContact CG-CG1 4.38Å
36	V	88.3	Confident	73.8	Confident	48 Å²	48	81.3 Å²	81.3	29%	0.291	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136.8	-178.5	-173.7	0	0	0	0	109.1	Y50 T51	V36-Y50 CarbonylContact O-C 3.51Å; V36-Y50 WeakPolarHBondContact O-CA 3.3Å; V36-T51 PolarHBondContact N-O 2.99Å; V36-T51 PolarHBondContact O-N 3.43Å
37	P	88.8	Confident	75.6	Confident	77 Å²	77	81.4 Å²	81.4	50%	0.5	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	145.8	176.5	26.6	-35.4	0	0	0	111.9	N49 Q62	P37-N49 WeakPolarHBondContact CA-O 3.5Å; P37-Q62 PolarHBondContact O-NE2 2.79Å
38	I	89.9	Confident	77.3	Confident	13 Å²	13	77 Å²	77	7%	0.067	39%	0.39	C	S	.	.			trans	-73.3	129.4	179.7	-60.5	178.3	0	0	0	110.8	I40 C43 Q44 Y48 N49 T51 T93	I38-I40 HydrophobicContact CG2-CB 4.27Å; I38-C43 HydrophobicContact CG2-CB 4.18Å; I38-Q44 HydrophobicContact CG2-CG 4.12Å; I38-Q44 WeakPolarHBondContact O-CG 3.35Å; I38-Q44 PolarHBondContact O-NE2 2.74Å; I38-Y48 HydrophobicContact CD1-CD2 3.89Å; I38-Y48 HydrophobicContact CD1-CE2 3.76Å; I38-Y48 WeakPolarHBondContact CD1-O 3.42Å; I38-N49 PolarHBondContact N-O 3.19Å; I38-T51 HydrophobicContact CG1-CG2 4.01Å; I38-T93 HydrophobicContact CG2-CG2 4.41Å
39	Q	88.6	Confident	79.1	Confident	126 Å²	126	79.2 Å²	79.2	59%	0.589	39%	0.392	S	S	*	.			trans	-109.4	0.3	-178.7	-60.3	-175.1	4.8	0	0	113.3	P41	Q39-P41 WeakPolarHBondContact O-CD 3.27Å
40	I	87.5	Confident	80.6	Confident	1 Å²	1	76.8 Å²	76.8	1%	0.005	38%	0.376	C	S	.	.			trans	-93.2	111.3	-177.4	-53.9	-169.3	0	0	0	109.2	I38 E42 C43 Q44 Q62 A65 R66 L69 T93	I38-I40 HydrophobicContact CG2-CB 4.27Å; I40-E42 HydrophobicContact CG2-CB 4.22Å; I40-E42 WeakPolarHBondContact CG2-OE2 3.33Å; I40-E42 PolarHBondContact O-N 2.95Å; I40-E42 VanDerWaalsContact O-N 3.16Å; I40-C43 CarbonylContact O-C 3.24Å; I40-C43 PolarHBondContact O-N 2.92Å; I40-Q44 WeakPolarHBondContact O-CG 3.48Å; I40-Q44 PolarHBondContact O-N 3.4Å; I40-Q44 VanDerWaalsContact O-N 3.08Å; I40-Q62 HydrophobicContact CG1-CB 4.43Å; I40-A65 HydrophobicContact CD1-CB 4.02Å; I40-R66 HydrophobicContact CD1-CB 3.98Å; I40-R66 HydrophobicContact CG1-CB 4.1Å; I40-R66 HydrophobicContact CG2-CB 4.33Å; I40-R66 HydrophobicContact CG2-CG 4.16Å; I40-L69 HydrophobicContact CG2-CD2 3.69Å; I40-T93 HydrophobicContact CD1-CG2 3.51Å; I40-T93 HydrophobicContact CG1-CG2 4.15Å
41	P	84.1	Confident	81.8	Confident	66 Å²	66	73.9 Å²	73.9	43%	0.429	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-57.1	-33.3	-175.6	-28.4	37.5	0	0	0	114.1	Q39 C43 Q44	Q39-P41 WeakPolarHBondContact O-CD 3.27Å; P41-C43 PolarHBondContact O-N 3.47Å; P41-Q44 PolarHBondContact O-N 2.92Å
42	E	79.3	Confident	82.5	Confident	39 Å²	39	65.4 Å²	65.4	18%	0.182	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-64.7	-16.8	177.7	-62.6	85.3	169.4	0	0	113.7	I40 R66 L69 Q70 N85	I40-E42 HydrophobicContact CG2-CB 4.22Å; I40-E42 WeakPolarHBondContact CG2-OE2 3.33Å; I40-E42 PolarHBondContact O-N 2.95Å; I40-E42 VanDerWaalsContact O-N 3.16Å; E42-R66 IonicContact OE2-NE 3.21Å; E42-L69 HydrophobicContact CB-CD2 3.94Å; E42-Q70 PolarHBondContact OE1-NE2 3.28Å; E42-N85 PolarHBondContact O-ND2 2.75Å
43	C	85.9	Confident	82.9	Confident	3 Å²	3	66.8 Å²	66.8	2%	0.02	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-126.3	5.5	-179.3	-61	0	0	0	0	114.2	I38 I40 P41 T46 C89	I38-C43 HydrophobicContact CG2-CB 4.18Å; I40-C43 CarbonylContact O-C 3.24Å; I40-C43 PolarHBondContact O-N 2.92Å; P41-C43 PolarHBondContact O-N 3.47Å; C43-T46 PolarHBondContact O-OG1 3.05Å; C43-C89 VanDerWaalsContact CA-SG 3.52Å; C43-C89 HydrophobicContact CB-CB 3.83Å; C43-C89 WeakPolarHBondContact CB-SG 3.34Å; C43-C89 VanDerWaalsContact SG-CA 3.54Å; C43-C89 WeakPolarHBondContact SG-CB 3.42Å; C43-C89 CovalentContact SG-SG 2.04Å; C43-C89 PolarHBondContact SG-SG 2.8Å
44	Q	80.9	Confident	83.6	Confident	85 Å²	85	60.7 Å²	60.7	40%	0.397	31%	0.312	S	S	.	.	S	Bend	trans	-78	133	-177.3	-90.5	175.4	-24.6	0	0	112.1	I38 I40 P41 T46	I38-Q44 HydrophobicContact CG2-CG 4.12Å; I38-Q44 WeakPolarHBondContact O-CG 3.35Å; I38-Q44 PolarHBondContact O-NE2 2.74Å; I40-Q44 WeakPolarHBondContact O-CG 3.48Å; I40-Q44 PolarHBondContact O-N 3.4Å; I40-Q44 VanDerWaalsContact O-N 3.08Å; P41-Q44 PolarHBondContact O-N 2.92Å; Q44-T46 PolarHBondContact O-N 3.43Å
45	N	66.2	Low	84.1	Confident	140 Å²	140	53.3 Å²	53.3	75%	0.749	28%	0.28	S	S	*	.	S	Bend	trans	54.7	6.7	176.4	-66	0.9	0	0	0	116.7
46	T	66.7	Low	84.2	Confident	70 Å²	70	52.8 Å²	52.8	43%	0.429	28%	0.275	S	S	.	.	S	Bend	trans	-78	-34.4	-178.5	42.8	0	0	0	0	113.5	C43 Q44	C43-T46 PolarHBondContact O-OG1 3.05Å; Q44-T46 PolarHBondContact O-N 3.43Å
47	F	78.6	Confident	83.9	Confident	89 Å²	89	52.7 Å²	52.7	39%	0.39	27%	0.272	S	S	.	.	S	Bend	trans	-143	-42.4	-170.8	-50.8	-61	0	0	0	114.7	F86	F47-F86 HydrophobicContact CB-CD2 4.13Å; F47-F86 HydrophobicContact CB-CE2 3.99Å; F47-F86 AromaticContact CD1-CD2 3.53Å; F47-F86 HydrophobicContact CD1-CD2 3.53Å; F47-F86 HydrophobicContact CD1-CE2 4.05Å; F47-F86 HydrophobicContact CD2-CB 4.42Å; F47-F86 AromaticContact CD2-CD2 3.64Å; F47-F86 HydrophobicContact CD2-CD2 3.64Å; F47-F86 HydrophobicContact CD2-CE2 4.32Å; F47-F86 HydrophobicContact CD2-CG 4.43Å; F47-F86 HydrophobicContact CE1-CB 4.39Å; F47-F86 AromaticContact CE1-CD2 3.78Å; F47-F86 HydrophobicContact CE1-CD2 3.78Å; F47-F86 HydrophobicContact CE2-CB 3.88Å; F47-F86 AromaticContact CE2-CD2 3.88Å; F47-F86 HydrophobicContact CE2-CD2 3.88Å; F47-F86 HydrophobicContact CE2-CG 4.35Å; F47-F86 AromaticContact CG-CD2 3.47Å; F47-F86 HydrophobicContact CG-CD2 3.47Å; F47-F86 VanDerWaalsContact CG-CD2 3.47Å; F47-F86 AromaticContact CG-CE2 3.85Å; F47-F86 HydrophobicContact CG-CE2 3.85Å; F47-F86 HydrophobicContact CZ-CB 3.86Å; F47-F86 AromaticContact CZ-CD2 3.95Å; F47-F86 HydrophobicContact CZ-CD2 3.95Å; F47-F86 HydrophobicContact CZ-CG 4.43Å
48	Y	85.6	Confident	83.6	Confident	25 Å²	25	51.3 Å²	51.3	10%	0.098	27%	0.272	C	S	.	.			trans	-159.3	159.9	177.9	50.8	-93.6	0	0	0	109.6	I38 C89 S90 T93 M95 M150	I38-Y48 HydrophobicContact CD1-CD2 3.89Å; I38-Y48 HydrophobicContact CD1-CE2 3.76Å; I38-Y48 WeakPolarHBondContact CD1-O 3.42Å; Y48-C89 PolarHBondContact OH-O 3.04Å; Y48-C89 VanDerWaalsContact OH-O 3.09Å; Y48-S90 WeakPolarHBondContact OH-CA 3.32Å; Y48-T93 WeakPolarHBondContact CE2-O 3.18Å; Y48-T93 PolarHBondContact OH-O 3.47Å; Y48-M95 HydrophobicContact CD1-CB 4.36Å; Y48-M95 HydrophobicContact CD2-CB 3.9Å; Y48-M95 HydrophobicContact CD2-CG 4.3Å; Y48-M95 HydrophobicContact CE1-CB 4.39Å; Y48-M95 HydrophobicContact CE2-CB 3.93Å; Y48-M95 HydrophobicContact CG-CB 4.14Å; Y48-M95 HydrophobicContact CG-CG 4.34Å; Y48-M95 HydrophobicContact CG-SD 4.39Å; Y48-M150 HydrophobicContact CD1-SD 4.3Å; Y48-M150 HydrophobicContact CE1-CE 4.33Å; Y48-M150 HydrophobicContact CE1-SD 3.9Å
49	N	86.6	Confident	83.5	Confident	90 Å²	90	51.6 Å²	51.6	48%	0.481	27%	0.273	S	S	.	.	S	Bend	trans	-105.3	-15.1	-165.9	-62.4	-9.1	0	0	0	114.6	P37 I38	P37-N49 WeakPolarHBondContact CA-O 3.5Å; I38-N49 PolarHBondContact N-O 3.19Å
50	Y	88.3	Confident	83.3	Confident	122 Å²	122	53.1 Å²	53.1	48%	0.478	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.4	-173.6	-62.4	-78.9	0	0	0	112.4	P35 V36 C96	P35-Y50 HydrophobicContact CB-CD1 4.25Å; P35-Y50 HydrophobicContact CB-CG 4.38Å; V36-Y50 CarbonylContact O-C 3.51Å; V36-Y50 WeakPolarHBondContact O-CA 3.3Å; Y50-C96 PolarHBondContact O-N 3.32Å
51	T	89.7	Confident	83.3	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	157.5	176.2	-174.2	0	0	0	0	111.3	V36 I38 M53 Q62 T93 P94	V36-T51 PolarHBondContact N-O 2.99Å; V36-T51 PolarHBondContact O-N 3.43Å; I38-T51 HydrophobicContact CG1-CG2 4.01Å; T51-M53 HydrophobicContact CG2-SD 4.46Å; T51-Q62 HydrophobicContact CG2-CG 4.28Å; T51-T93 VanDerWaalsContact OG1-CA 3.26Å; T51-T93 WeakPolarHBondContact OG1-CA 3.23Å; T51-P94 WeakPolarHBondContact CA-O 3.29Å; T51-P94 PolarHBondContact OG1-O 3.05Å
52	G	86.6	Confident	83.6	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.282	C	S	.	.			trans	-100.5	148.1	166.9	0	0	0	0	0	111.7	P94	G52-P94 PolarHBondContact N-O 3.32Å; G52-P94 VanDerWaalsContact N-O 3.15Å
53	M	86.6	Confident	84.1	Confident	33 Å²	33	59.4 Å²	59.4	16%	0.163	31%	0.306	C	S	.	.	S	Bend	trans	-125.7	147.7	167.9	-54.1	-53.7	-54.5	0	0	109.8	T51 N55 Q59 Q62	T51-M53 HydrophobicContact CG2-SD 4.46Å; M53-N55 HydrophobicContact CE-CB 4.19Å; M53-Q59 WeakPolarHBondContact CE-O 3.47Å; M53-Q62 HydrophobicContact CG-CG 4.46Å; M53-Q62 HydrophobicContact SD-CG 3.75Å
54	P	86.8	Confident	84.2	Confident	57 Å²	57	62.5 Å²	62.5	37%	0.37	32%	0.322	S	S	.	.	S	Bend	cis	-65.5	152.1	-7.7	29.6	-35.6	0	0	0	111.9	Q30 Q59 L103	Q30-P54 PolarHBondContact NE2-O 3.29Å; Q30-P54 VanDerWaalsContact NE2-O 3.09Å; P54-Q59 CarbonylContact C-O 3.6Å; P54-Q59 WeakPolarHBondContact CA-O 3.37Å; P54-Q59 VanDerWaalsContact CB-O 3.31Å; P54-Q59 WeakPolarHBondContact CB-O 3.39Å; P54-L103 VanDerWaalsContact O-CD2 3.31Å; P54-L103 WeakPolarHBondContact O-CD2 3.45Å
55	N	88	Confident	84.6	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.303	C	S	.	.			trans	-76.1	-177.5	-176.9	72.4	9.9	0	0	0	112.6	Q30 M53 I57 G58 Q59 Y92 P94	Q30-N55 PolarHBondContact NE2-O 3.49Å; M53-N55 HydrophobicContact CE-CB 4.19Å; N55-I57 PolarHBondContact O-N 2.88Å; N55-I57 PolarHBondContact OD1-N 2.87Å; N55-G58 PolarHBondContact O-N 3.4Å; N55-G58 PolarHBondContact OD1-N 2.88Å; N55-G58 VanDerWaalsContact OD1-N 3.13Å; N55-Q59 PolarHBondContact N-O 3.1Å; N55-Q59 PolarHBondContact ND2-OE1 2.78Å; N55-Q59 PolarHBondContact OD1-N 2.85Å; N55-Y92 WeakPolarHBondContact CB-O 3.31Å; N55-Y92 PolarHBondContact ND2-O 2.89Å; N55-P94 HydrophobicContact CB-CG 4.1Å
56	L	84.1	Confident	85.7	Confident	25 Å²	25	56 Å²	56	13%	0.131	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-16.2	-178.1	-64.4	178.9	0	0	0	113.7	Y27 I91 P94 L103	Y27-L56 WeakPolarHBondContact CE1-O 3.41Å; L56-I91 HydrophobicContact CB-CG2 4.42Å; L56-P94 HydrophobicContact CD1-CB 4.17Å; L56-P94 HydrophobicContact CG-CB 4.07Å; L56-P94 HydrophobicContact CG-CG 4.14Å; L56-L103 HydrophobicContact CD2-CB 4.16Å; L56-L103 HydrophobicContact CD2-CD2 3.99Å; L56-L103 HydrophobicContact CG-CD2 4.4Å
57	I	83.6	Confident	86.7	Confident	45 Å²	45	58.9 Å²	58.9	23%	0.231	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-5.1	174.2	-66.2	165.5	0	0	0	111	N55 Q59 I91 Y92 N132	N55-I57 PolarHBondContact O-N 2.88Å; N55-I57 PolarHBondContact OD1-N 2.87Å; I57-Q59 HydrophobicContact CB-CG 4.45Å; I57-Q59 HydrophobicContact CG2-CG 4.14Å; I57-I91 HydrophobicContact CD1-CG2 3.55Å; I57-I91 HydrophobicContact CG1-CG2 3.78Å; I57-Y92 HydrophobicContact CD1-CD1 3.9Å; I57-Y92 HydrophobicContact CD1-CD2 4.36Å; I57-Y92 HydrophobicContact CD1-CE1 3.37Å; I57-Y92 HydrophobicContact CD1-CE2 3.9Å; I57-Y92 HydrophobicContact CD1-CG 4.35Å; I57-N132 WeakPolarHBondContact CD1-ND2 3.33Å; I57-N132 HydrophobicContact CG1-CB 4.4Å
58	G	82.7	Confident	87	Confident	49 Å²	49	58.1 Å²	58.1	51%	0.505	29%	0.29	S	S	.	.			trans	85.4	12.3	179.5	0	0	0	0	0	114.7	N55	N55-G58 PolarHBondContact O-N 3.4Å; N55-G58 PolarHBondContact OD1-N 2.88Å; N55-G58 VanDerWaalsContact OD1-N 3.13Å
59	Q	86.3	Confident	87.1	Confident	18 Å²	18	57 Å²	57	8%	0.084	29%	0.285	C	S	.	.			trans	-76.9	136.2	177.2	-53.2	178.7	-80.4	0	0	110.4	M53 P54 N55 I57 D64 Q68 Y92	M53-Q59 WeakPolarHBondContact CE-O 3.47Å; P54-Q59 CarbonylContact C-O 3.6Å; P54-Q59 WeakPolarHBondContact CA-O 3.37Å; P54-Q59 VanDerWaalsContact CB-O 3.31Å; P54-Q59 WeakPolarHBondContact CB-O 3.39Å; N55-Q59 PolarHBondContact N-O 3.1Å; N55-Q59 PolarHBondContact ND2-OE1 2.78Å; N55-Q59 PolarHBondContact OD1-N 2.85Å; I57-Q59 HydrophobicContact CB-CG 4.45Å; I57-Q59 HydrophobicContact CG2-CG 4.14Å; Q59-D64 HydrophobicContact CB-CB 4.36Å; Q59-D64 PolarHBondContact NE2-O 2.77Å; Q59-Q68 VanDerWaalsContact NE2-CD 3.34Å; Q59-Y92 VanDerWaalsContact OE1-CD1 3.26Å
60	E	84.3	Confident	87	Confident	159 Å²	159	56 Å²	56	74%	0.743	28%	0.278	S	S	*	.	S	Bend	trans	-85.2	-30.6	-174.4	-61.3	-170.4	164.6	0	0	113.7
61	T	88.9	Confident	86.8	Confident	62 Å²	62	55.2 Å²	55.2	38%	0.38	29%	0.286	S	S	.	.	S	Bend	trans	-115.2	152.9	-179	88	0	0	0	0	113.3	F63 D64 A65	T61-F63 PolarHBondContact O-N 3.11Å; T61-F63 WeakPolarHBondContact OG1-CB 3.48Å; T61-F63 PolarHBondContact OG1-N 2.92Å; T61-D64 WeakPolarHBondContact CB-OD2 3.45Å; T61-D64 WeakPolarHBondContact CG2-OD2 3.44Å; T61-D64 PolarHBondContact N-OD2 2.93Å; T61-D64 PolarHBondContact O-N 3.04Å; T61-D64 PolarHBondContact OG1-N 3.49Å; T61-D64 VanDerWaalsContact OG1-N 3.17Å; T61-D64 PolarHBondContact OG1-OD2 2.89Å; T61-A65 PolarHBondContact O-N 3.46Å
62	Q	89.9	Confident	86.6	Confident	17 Å²	17	56.4 Å²	56.4	8%	0.079	29%	0.291	C	S	.	.	H	α-helix	trans	-68.4	-17.4	171	-68.2	-170.7	52.8	0	0	112.8	P37 I40 T51 M53 R66	P37-Q62 PolarHBondContact O-NE2 2.79Å; I40-Q62 HydrophobicContact CG1-CB 4.43Å; T51-Q62 HydrophobicContact CG2-CG 4.28Å; M53-Q62 HydrophobicContact CG-CG 4.46Å; M53-Q62 HydrophobicContact SD-CG 3.75Å; Q62-R66 WeakPolarHBondContact O-CB 3.45Å; Q62-R66 PolarHBondContact O-N 3.5Å
63	F	88.9	Confident	86.3	Confident	159 Å²	159	61.7 Å²	61.7	70%	0.697	31%	0.314	S	S	*	.	H	α-helix	trans	-71	-45.2	175.8	-178.7	-93	0	0	0	110.9	T61 A65 R66 H67	T61-F63 PolarHBondContact O-N 3.11Å; T61-F63 WeakPolarHBondContact OG1-CB 3.48Å; T61-F63 PolarHBondContact OG1-N 2.92Å; F63-A65 VanDerWaalsContact C-N 3.34Å; F63-A65 PolarHBondContact O-N 3.37Å; F63-R66 WeakPolarHBondContact O-CB 3.48Å; F63-R66 PolarHBondContact O-N 2.88Å; F63-H67 PolarHBondContact O-N 3.11Å
64	D	88.6	Confident	85.8	Confident	67 Å²	67	64.7 Å²	64.7	36%	0.358	34%	0.336	S	S	.	.	H	α-helix	trans	-65	-40.6	175.6	-49.8	-55.3	0	0	0	111.2	Q59 T61 R66 H67 Q68	Q59-D64 HydrophobicContact CB-CB 4.36Å; Q59-D64 PolarHBondContact NE2-O 2.77Å; T61-D64 WeakPolarHBondContact CB-OD2 3.45Å; T61-D64 WeakPolarHBondContact CG2-OD2 3.44Å; T61-D64 PolarHBondContact N-OD2 2.93Å; T61-D64 PolarHBondContact O-N 3.04Å; T61-D64 PolarHBondContact OG1-N 3.49Å; T61-D64 VanDerWaalsContact OG1-N 3.17Å; T61-D64 PolarHBondContact OG1-OD2 2.89Å; D64-R66 VanDerWaalsContact C-N 3.33Å; D64-H67 PolarHBondContact O-N 3Å; D64-Q68 PolarHBondContact O-N 3.3Å; D64-Q68 VanDerWaalsContact O-N 3.1Å
65	A	88.6	Confident	85.4	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-61	-42.3	174.6	0	0	0	0	0	111.5	I40 T61 F63 Q68 L69 Y92	I40-A65 HydrophobicContact CD1-CB 4.02Å; T61-A65 PolarHBondContact O-N 3.46Å; F63-A65 VanDerWaalsContact C-N 3.34Å; F63-A65 PolarHBondContact O-N 3.37Å; A65-Q68 PolarHBondContact O-N 3.1Å; A65-L69 VanDerWaalsContact O-CB 3.24Å; A65-L69 WeakPolarHBondContact O-CB 3.45Å; A65-L69 PolarHBondContact O-N 2.99Å; A65-Y92 HydrophobicContact CB-CD1 4.27Å
66	R	90	Very high	85	Confident	90 Å²	90	64.3 Å²	64.3	34%	0.34	33%	0.33	S	S	.	.	H	α-helix	trans	-62.2	-44.6	174.6	-176	171.9	-173	-170.5	-1.3	112.2	I40 E42 Q62 F63 D64 Q68 L69 Q70	I40-R66 HydrophobicContact CD1-CB 3.98Å; I40-R66 HydrophobicContact CG1-CB 4.1Å; I40-R66 HydrophobicContact CG2-CB 4.33Å; I40-R66 HydrophobicContact CG2-CG 4.16Å; E42-R66 IonicContact OE2-NE 3.21Å; Q62-R66 WeakPolarHBondContact O-CB 3.45Å; Q62-R66 PolarHBondContact O-N 3.5Å; F63-R66 WeakPolarHBondContact O-CB 3.48Å; F63-R66 PolarHBondContact O-N 2.88Å; D64-R66 VanDerWaalsContact C-N 3.33Å; R66-Q68 PolarHBondContact O-N 2.98Å; R66-L69 PolarHBondContact O-N 3.42Å; R66-Q70 HydrophobicContact CG-CG 4.31Å; R66-Q70 WeakPolarHBondContact O-CB 3.44Å; R66-Q70 VanDerWaalsContact O-CG 3.27Å; R66-Q70 WeakPolarHBondContact O-CG 3.49Å; R66-Q70 PolarHBondContact O-N 3.45Å
67	H	88.1	Confident	84.7	Confident	130 Å²	130	66.7 Å²	66.7	60%	0.602	35%	0.346	S	S	*	.	H	α-helix	trans	-60.6	-45.4	179.5	-174.8	-87.7	0	0	0	111.8	F63 D64 Q70	F63-H67 PolarHBondContact O-N 3.11Å; D64-H67 PolarHBondContact O-N 3Å; H67-Q70 PolarHBondContact O-N 2.82Å
68	Q	84.9	Confident	84.3	Confident	73 Å²	73	67 Å²	67	34%	0.341	34%	0.344	S	S	.	.	H	α-helix	trans	-69	-40.3	175.6	-71.1	-164.3	16.2	0	0	113.1	Q59 D64 A65 R66 Q70 T71 F72 Y92	Q59-Q68 VanDerWaalsContact NE2-CD 3.34Å; D64-Q68 PolarHBondContact O-N 3.3Å; D64-Q68 VanDerWaalsContact O-N 3.1Å; A65-Q68 PolarHBondContact O-N 3.1Å; R66-Q68 PolarHBondContact O-N 2.98Å; Q68-Q70 VanDerWaalsContact C-N 3.26Å; Q68-Q70 PolarHBondContact O-N 3.18Å; Q68-T71 VanDerWaalsContact O-CB 3.31Å; Q68-T71 WeakPolarHBondContact O-CB 3.2Å; Q68-T71 PolarHBondContact O-N 3.17Å; Q68-T71 PolarHBondContact O-OG1 3.06Å; Q68-F72 WeakPolarHBondContact O-CD2 3.26Å; Q68-Y92 HydrophobicContact CB-CD1 4.34Å; Q68-Y92 HydrophobicContact CB-CE1 3.45Å; Q68-Y92 VanDerWaalsContact CB-CE1 3.45Å; Q68-Y92 HydrophobicContact CG-CE1 4.37Å; Q68-Y92 PolarHBondContact OE1-OH 3.38Å
69	L	87.8	Confident	84.1	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-60.3	-37.4	176.3	-176.9	69.4	0	0	0	111.6	I40 E42 A65 R66 T71 F72 I76 L88 Y92	I40-L69 HydrophobicContact CG2-CD2 3.69Å; E42-L69 HydrophobicContact CB-CD2 3.94Å; A65-L69 VanDerWaalsContact O-CB 3.24Å; A65-L69 WeakPolarHBondContact O-CB 3.45Å; A65-L69 PolarHBondContact O-N 2.99Å; R66-L69 PolarHBondContact O-N 3.42Å; L69-T71 VanDerWaalsContact C-N 3.26Å; L69-T71 PolarHBondContact O-N 2.81Å; L69-F72 WeakPolarHBondContact O-CA 3.34Å; L69-F72 WeakPolarHBondContact O-CB 3.2Å; L69-F72 PolarHBondContact O-N 2.77Å; L69-I76 HydrophobicContact CD1-CD1 4.42Å; L69-L88 HydrophobicContact CD1-CB 3.61Å; L69-L88 HydrophobicContact CD1-CD1 4.21Å; L69-L88 HydrophobicContact CD1-CG 4.41Å; L69-Y92 HydrophobicContact CB-CG 4.43Å; L69-Y92 HydrophobicContact CD1-CD2 3.98Å; L69-Y92 HydrophobicContact CD1-CG 4.47Å
70	Q	84.4	Confident	83.8	Confident	70 Å²	70	69.4 Å²	69.4	33%	0.327	34%	0.342	S	S	.	.	H	α-helix	trans	-68	-21.6	179.4	-76	179.7	-19.1	0	0	113.5	E42 R66 H67 Q68 F72 K73	E42-Q70 PolarHBondContact OE1-NE2 3.28Å; R66-Q70 HydrophobicContact CG-CG 4.31Å; R66-Q70 WeakPolarHBondContact O-CB 3.44Å; R66-Q70 VanDerWaalsContact O-CG 3.27Å; R66-Q70 WeakPolarHBondContact O-CG 3.49Å; R66-Q70 PolarHBondContact O-N 3.45Å; H67-Q70 PolarHBondContact O-N 2.82Å; Q68-Q70 VanDerWaalsContact C-N 3.26Å; Q68-Q70 PolarHBondContact O-N 3.18Å; Q70-F72 PolarHBondContact O-N 2.94Å; Q70-K73 WeakPolarHBondContact O-CB 3.33Å; Q70-K73 PolarHBondContact O-N 3.39Å
71	T	84.2	Confident	83.9	Confident	105 Å²	105	62 Å²	62	64%	0.644	31%	0.307	S	S	*	.	H	α-helix	trans	-61.5	-31	166.7	-50.7	0	0	0	0	112	Q68 L69 K73 P74	Q68-T71 VanDerWaalsContact O-CB 3.31Å; Q68-T71 WeakPolarHBondContact O-CB 3.2Å; Q68-T71 PolarHBondContact O-N 3.17Å; Q68-T71 PolarHBondContact O-OG1 3.06Å; L69-T71 VanDerWaalsContact C-N 3.26Å; L69-T71 PolarHBondContact O-N 2.81Å; T71-K73 VanDerWaalsContact C-N 3.31Å; T71-P74 WeakPolarHBondContact O-CD 3.4Å
72	F	84.9	Confident	83.7	Confident	24 Å²	24	62.8 Å²	62.8	11%	0.105	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-2.8	173.5	-62.5	-83	0	0	0	113.4	Q68 L69 Q70 P74 L75 I76 L88 Y92 P130 L133	Q68-F72 WeakPolarHBondContact O-CD2 3.26Å; L69-F72 WeakPolarHBondContact O-CA 3.34Å; L69-F72 WeakPolarHBondContact O-CB 3.2Å; L69-F72 PolarHBondContact O-N 2.77Å; Q70-F72 PolarHBondContact O-N 2.94Å; F72-P74 VanDerWaalsContact C-CD 3.48Å; F72-L75 HydrophobicContact CD1-CD2 4.25Å; F72-L75 CarbonylContact O-C 3.55Å; F72-L75 WeakPolarHBondContact O-CA 3.37Å; F72-L75 WeakPolarHBondContact O-CB 3.23Å; F72-L75 PolarHBondContact O-N 3.27Å; F72-I76 HydrophobicContact CB-CD1 4.37Å; F72-I76 WeakPolarHBondContact O-CG1 3.38Å; F72-I76 PolarHBondContact O-N 2.86Å; F72-L88 HydrophobicContact CB-CD1 3.7Å; F72-L88 HydrophobicContact CD1-CD2 4.32Å; F72-L88 HydrophobicContact CD2-CD2 4.19Å; F72-L88 HydrophobicContact CE2-CD2 4.48Å; F72-L88 HydrophobicContact CG-CD1 4.09Å; F72-L88 HydrophobicContact CG-CD2 4.11Å; F72-Y92 HydrophobicContact CD2-CE2 4.31Å; F72-Y92 AromaticContact CE2-CE2 3.99Å; F72-Y92 HydrophobicContact CE2-CE2 3.99Å; F72-P130 HydrophobicContact CE1-CG 4.21Å; F72-P130 HydrophobicContact CZ-CG 4.11Å; F72-L133 HydrophobicContact CE1-CD1 3.92Å; F72-L133 HydrophobicContact CZ-CD1 3.77Å
73	K	81.8	Confident	83.6	Confident	112 Å²	112	63.2 Å²	63.2	49%	0.487	32%	0.317	S	S	.	.	H	α-helix	trans	-54.1	-41.1	-179.4	-172	170.8	-179.4	171.2	0	113.6	Q70 T71 L75 I76 T77	Q70-K73 WeakPolarHBondContact O-CB 3.33Å; Q70-K73 PolarHBondContact O-N 3.39Å; T71-K73 VanDerWaalsContact C-N 3.31Å; K73-L75 VanDerWaalsContact C-N 3.3Å; K73-L75 PolarHBondContact O-N 3.44Å; K73-I76 PolarHBondContact O-N 2.79Å; K73-T77 PolarHBondContact O-N 3.16Å; K73-T77 PolarHBondContact O-OG1 3.13Å; K73-T77 VanDerWaalsContact O-OG1 3.13Å
74	P	75	Confident	83.6	Confident	95 Å²	95	55.8 Å²	55.8	62%	0.617	29%	0.285	S	S	*	.	H	α-helix	trans	-60	-38.5	172.5	-23.6	35.4	0	0	0	112.8	T71 F72 T77 Y78	T71-P74 WeakPolarHBondContact O-CD 3.4Å; F72-P74 VanDerWaalsContact C-CD 3.48Å; P74-T77 PolarHBondContact O-N 3.44Å; P74-Y78 WeakPolarHBondContact O-CB 3.39Å; P74-Y78 PolarHBondContact O-N 2.88Å
75	L	78.9	Confident	83.6	Confident	12 Å²	12	54.3 Å²	54.3	6%	0.063	28%	0.277	C	S	.	.	H	α-helix	trans	-74.4	-32.9	178.7	-161.6	74.7	0	0	0	112.3	F72 K73 Y78 K79 L84 C118 V121 L122	F72-L75 HydrophobicContact CD1-CD2 4.25Å; F72-L75 CarbonylContact O-C 3.55Å; F72-L75 WeakPolarHBondContact O-CA 3.37Å; F72-L75 WeakPolarHBondContact O-CB 3.23Å; F72-L75 PolarHBondContact O-N 3.27Å; K73-L75 VanDerWaalsContact C-N 3.3Å; K73-L75 PolarHBondContact O-N 3.44Å; L75-Y78 CarbonylContact O-C 3.08Å; L75-Y78 WeakPolarHBondContact O-CB 3.45Å; L75-Y78 PolarHBondContact O-N 3.13Å; L75-K79 PolarHBondContact O-N 2.95Å; L75-L84 HydrophobicContact CB-CD2 4.34Å; L75-L84 HydrophobicContact CD2-CD1 4.41Å; L75-L84 HydrophobicContact CD2-CD2 4.12Å; L75-L84 HydrophobicContact CG-CD2 3.91Å; L75-L84 VanDerWaalsContact O-CD2 3.26Å; L75-L84 WeakPolarHBondContact O-CD2 3.49Å; L75-C118 HydrophobicContact CD2-CB 4.4Å; L75-V121 HydrophobicContact CD1-CB 4.2Å; L75-V121 HydrophobicContact CD1-CG1 3.69Å; L75-L122 HydrophobicContact CD1-CD2 4.11Å; L75-L122 HydrophobicContact CD1-CG 4.16Å; L75-L122 HydrophobicContact CD2-CD1 4.18Å; L75-L122 HydrophobicContact CD2-CD2 4.13Å; L75-L122 HydrophobicContact CD2-CG 4.13Å
76	I	80.1	Confident	83.6	Confident	37 Å²	37	55.1 Å²	55.1	19%	0.19	28%	0.28	C	S	.	.	H	α-helix	trans	-66.3	-44.2	170.3	-64.8	165.8	0	0	0	109.7	L69 F72 K73 Y78 K79 L84 L88	L69-I76 HydrophobicContact CD1-CD1 4.42Å; F72-I76 HydrophobicContact CB-CD1 4.37Å; F72-I76 WeakPolarHBondContact O-CG1 3.38Å; F72-I76 PolarHBondContact O-N 2.86Å; K73-I76 PolarHBondContact O-N 2.79Å; I76-Y78 VanDerWaalsContact C-N 3.27Å; I76-Y78 PolarHBondContact O-N 3.37Å; I76-K79 WeakPolarHBondContact O-CG 3.31Å; I76-K79 PolarHBondContact O-N 3.36Å; I76-L84 HydrophobicContact CG1-CD2 4.29Å; I76-L88 HydrophobicContact CD1-CD1 3.81Å; I76-L88 HydrophobicContact CG1-CD1 3.75Å
77	T	76.7	Confident	83.7	Confident	76 Å²	76	50.8 Å²	50.8	47%	0.466	26%	0.264	S	S	.	.	H	α-helix	trans	-60.5	-38.3	170.6	-60.1	0	0	0	0	111.3	K73 P74 K79 Q203	K73-T77 PolarHBondContact O-N 3.16Å; K73-T77 PolarHBondContact O-OG1 3.13Å; K73-T77 VanDerWaalsContact O-OG1 3.13Å; P74-T77 PolarHBondContact O-N 3.44Å; T77-K79 PolarHBondContact O-N 3.08Å; T77-Q203 PolarHBondContact O-NE2 3.41Å
78	Y	76	Confident	83.8	Confident	50 Å²	50	44.7 Å²	44.7	20%	0.196	24%	0.236	C	C	.	.	H	α-helix	trans	-64	-24	173.8	-150.8	-80.9	0	0	0	112.6	P74 L75 I76 C80 V121 F125 D198 S199 S200	P74-Y78 WeakPolarHBondContact O-CB 3.39Å; P74-Y78 PolarHBondContact O-N 2.88Å; L75-Y78 CarbonylContact O-C 3.08Å; L75-Y78 WeakPolarHBondContact O-CB 3.45Å; L75-Y78 PolarHBondContact O-N 3.13Å; I76-Y78 VanDerWaalsContact C-N 3.27Å; I76-Y78 PolarHBondContact O-N 3.37Å; Y78-C80 HydrophobicContact CD1-CB 4.07Å; Y78-C80 PolarHBondContact O-N 3.29Å; Y78-C80 VanDerWaalsContact O-N 3.1Å; Y78-V121 HydrophobicContact CD1-CB 4.45Å; Y78-V121 HydrophobicContact CD1-CG1 3.63Å; Y78-V121 HydrophobicContact CD1-CG2 4.04Å; Y78-V121 HydrophobicContact CD2-CG1 4.06Å; Y78-V121 HydrophobicContact CE1-CB 4.01Å; Y78-V121 HydrophobicContact CE1-CG1 3.32Å; Y78-V121 HydrophobicContact CE1-CG2 3.42Å; Y78-V121 VanDerWaalsContact CE1-CG2 3.42Å; Y78-V121 HydrophobicContact CE2-CG1 3.85Å; Y78-V121 HydrophobicContact CG-CG1 4Å; Y78-V121 VanDerWaalsContact CZ-CG1 3.5Å; Y78-F125 HydrophobicContact CD2-CE2 4.45Å; Y78-F125 HydrophobicContact CE2-CE2 4Å; Y78-F125 HydrophobicContact CE2-CZ 4.17Å; Y78-D198 WeakPolarHBondContact CD1-OD1 3.3Å; Y78-D198 HydrophobicContact CE1-CB 4.46Å; Y78-D198 WeakPolarHBondContact CE1-OD1 3.35Å; Y78-D198 WeakPolarHBondContact CE1-OD2 3.44Å; Y78-S199 CarbonylContact O-C 3.02Å; Y78-S199 WeakPolarHBondContact O-CA 3.37Å; Y78-S199 WeakPolarHBondContact O-CB 3.29Å; Y78-S199 PolarHBondContact O-N 3.26Å; Y78-S199 PolarHBondContact O-OG 3.14Å; Y78-S200 WeakPolarHBondContact CA-OG 3.31Å; Y78-S200 WeakPolarHBondContact CD2-OG 3.4Å; Y78-S200 WeakPolarHBondContact CE2-OG 3.42Å; Y78-S200 PolarHBondContact O-N 2.96Å
79	K	77.1	Confident	84.2	Confident	109 Å²	109	41.2 Å²	41.2	47%	0.474	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	33.9	47.4	-172.5	-26.7	160.4	-171	162.7	0	113.9	L75 I76 T77 S81 S199	L75-K79 PolarHBondContact O-N 2.95Å; I76-K79 WeakPolarHBondContact O-CG 3.31Å; I76-K79 PolarHBondContact O-N 3.36Å; T77-K79 PolarHBondContact O-N 3.08Å; K79-S81 CarbonylContact O-C 3.49Å; K79-S81 PolarHBondContact O-N 3.12Å; K79-S199 WeakPolarHBondContact CB-OG 3.36Å; K79-S199 WeakPolarHBondContact CD-OG 2.99Å; K79-S199 WeakPolarHBondContact CG-OG 3.29Å; K79-S199 PolarHBondContact N-OG 3.28Å
80	C	81.7	Confident	84.3	Confident	9 Å²	9	41.2 Å²	41.2	6%	0.061	22%	0.22	C	C	.	.	S	Bend	trans	-52.2	-24.9	178.9	46.7	0	0	0	0	113.6	Y78 R117 C118 V121	Y78-C80 HydrophobicContact CD1-CB 4.07Å; Y78-C80 PolarHBondContact O-N 3.29Å; Y78-C80 VanDerWaalsContact O-N 3.1Å; C80-R117 WeakPolarHBondContact O-CB 3.36Å; C80-C118 HydrophobicContact CB-CB 3.99Å; C80-C118 WeakPolarHBondContact CB-SG 3.49Å; C80-C118 VanDerWaalsContact SG-CA 3.53Å; C80-C118 WeakPolarHBondContact SG-CB 3.45Å; C80-C118 CovalentContact SG-SG 2.03Å; C80-C118 PolarHBondContact SG-SG 2.92Å; C80-V121 HydrophobicContact CB-CG2 3.89Å
81	S	85.2	Confident	84.6	Confident	3 Å²	3	38 Å²	38	2%	0.021	21%	0.205	C	C	.	.	S	Bend	trans	-132.1	143.9	159	-171.3	0	0	0	0	111.3	K79 K83 L84 H113 R117	K79-S81 CarbonylContact O-C 3.49Å; K79-S81 PolarHBondContact O-N 3.12Å; S81-K83 PolarHBondContact O-N 3.41Å; S81-K83 PolarHBondContact OG-N 3.49Å; S81-L84 VanDerWaalsContact O-CB 3.29Å; S81-L84 WeakPolarHBondContact O-CB 3.34Å; S81-L84 PolarHBondContact O-N 2.81Å; S81-H113 PolarHBondContact OG-CD2 2.93Å; S81-R117 PolarHBondContact OG-NH1 3.46Å
82	S	84.4	Confident	84.9	Confident	79 Å²	79	33.1 Å²	33.1	55%	0.552	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-44.4	-41.4	164.2	43.1	0	0	0	0	111.9	R117 D155	S82-R117 PolarHBondContact OG-NH1 3.41Å; S82-D155 PolarHBondContact OG-OD1 3.04Å
83	K	87.3	Confident	85.2	Confident	26 Å²	26	32 Å²	32	11%	0.113	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	3.9	-175	-41.1	-166.2	-169.3	-167	0	114.2	S81 N85 F86 F87 L110 V114 P153 D155	S81-K83 PolarHBondContact O-N 3.41Å; S81-K83 PolarHBondContact OG-N 3.49Å; K83-N85 PolarHBondContact O-N 3.33Å; K83-F86 PolarHBondContact O-N 3.27Å; K83-F87 WeakPolarHBondContact O-CB 3.23Å; K83-F87 PolarHBondContact O-N 3.38Å; K83-L110 HydrophobicContact CB-CD1 3.69Å; K83-L110 HydrophobicContact CD-CD1 4.02Å; K83-L110 HydrophobicContact CG-CD1 4.45Å; K83-V114 HydrophobicContact CB-CG2 4Å; K83-P153 WeakPolarHBondContact CD-O 3.3Å; K83-P153 WeakPolarHBondContact CE-O 3.43Å; K83-P153 PolarHBondContact NZ-O 2.95Å; K83-D155 WeakPolarHBondContact CE-OD1 2.8Å; K83-D155 WeakPolarHBondContact CE-OD2 3.12Å; K83-D155 IonicContact NZ-OD1 3.1Å; K83-D155 IonicContact NZ-OD2 3.77Å; K83-D155 PolarHBondContact NZ-OD2 3.09Å
84	L	89.5	Confident	85.6	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.021	15%	0.146	C	C	.	.	H	α-helix	trans	-60.7	-47.3	-177.9	175.9	65.4	0	0	0	112.1	L75 I76 S81 F86 F87 L88 V114	L75-L84 HydrophobicContact CB-CD2 4.34Å; L75-L84 HydrophobicContact CD2-CD1 4.41Å; L75-L84 HydrophobicContact CD2-CD2 4.12Å; L75-L84 HydrophobicContact CG-CD2 3.91Å; L75-L84 VanDerWaalsContact O-CD2 3.26Å; L75-L84 WeakPolarHBondContact O-CD2 3.49Å; I76-L84 HydrophobicContact CG1-CD2 4.29Å; S81-L84 VanDerWaalsContact O-CB 3.29Å; S81-L84 WeakPolarHBondContact O-CB 3.34Å; S81-L84 PolarHBondContact O-N 2.81Å; L84-F86 PolarHBondContact O-N 3.15Å; L84-F87 PolarHBondContact O-N 2.83Å; L84-L88 HydrophobicContact CD1-CD1 3.79Å; L84-L88 HydrophobicContact CD1-CG 3.93Å; L84-L88 HydrophobicContact CG-CD1 3.91Å; L84-L88 HydrophobicContact CG-CG 4.4Å; L84-L88 WeakPolarHBondContact O-CG 3.44Å; L84-L88 PolarHBondContact O-N 3.16Å; L84-V114 HydrophobicContact CB-CG1 4.28Å; L84-V114 HydrophobicContact CD1-CG1 3.58Å
85	N	88	Confident	86.2	Confident	36 Å²	36	25.1 Å²	25.1	19%	0.193	13%	0.132	C	C	.	.	H	α-helix	trans	-65.5	-42.4	-177.8	-159.4	47.9	0	0	0	111	E42 K83 F87 L88 C89	E42-N85 PolarHBondContact O-ND2 2.75Å; K83-N85 PolarHBondContact O-N 3.33Å; N85-F87 PolarHBondContact O-N 2.9Å; N85-L88 PolarHBondContact O-N 3.39Å; N85-C89 WeakPolarHBondContact O-CB 3.47Å; N85-C89 PolarHBondContact O-N 3.41Å; N85-C89 PolarHBondContact O-SG 2.91Å
86	F	89.8	Confident	86.6	Confident	16 Å²	16	24.7 Å²	24.7	7%	0.07	13%	0.129	C	C	.	.	H	α-helix	trans	-55.9	-50.7	172.7	-175.5	-85	0	0	0	111.8	F47 K83 L84 L88 C89 S90 L110 M150 G152 P153	F47-F86 HydrophobicContact CB-CD2 4.13Å; F47-F86 HydrophobicContact CB-CE2 3.99Å; F47-F86 AromaticContact CD1-CD2 3.53Å; F47-F86 HydrophobicContact CD1-CD2 3.53Å; F47-F86 HydrophobicContact CD1-CE2 4.05Å; F47-F86 HydrophobicContact CD2-CB 4.42Å; F47-F86 AromaticContact CD2-CD2 3.64Å; F47-F86 HydrophobicContact CD2-CD2 3.64Å; F47-F86 HydrophobicContact CD2-CE2 4.32Å; F47-F86 HydrophobicContact CD2-CG 4.43Å; F47-F86 HydrophobicContact CE1-CB 4.39Å; F47-F86 AromaticContact CE1-CD2 3.78Å; F47-F86 HydrophobicContact CE1-CD2 3.78Å; F47-F86 HydrophobicContact CE2-CB 3.88Å; F47-F86 AromaticContact CE2-CD2 3.88Å; F47-F86 HydrophobicContact CE2-CD2 3.88Å; F47-F86 HydrophobicContact CE2-CG 4.35Å; F47-F86 AromaticContact CG-CD2 3.47Å; F47-F86 HydrophobicContact CG-CD2 3.47Å; F47-F86 VanDerWaalsContact CG-CD2 3.47Å; F47-F86 AromaticContact CG-CE2 3.85Å; F47-F86 HydrophobicContact CG-CE2 3.85Å; F47-F86 HydrophobicContact CZ-CB 3.86Å; F47-F86 AromaticContact CZ-CD2 3.95Å; F47-F86 HydrophobicContact CZ-CD2 3.95Å; F47-F86 HydrophobicContact CZ-CG 4.43Å; K83-F86 PolarHBondContact O-N 3.27Å; L84-F86 PolarHBondContact O-N 3.15Å; F86-L88 PolarHBondContact O-N 2.9Å; F86-C89 PolarHBondContact O-N 2.95Å; F86-S90 WeakPolarHBondContact O-CB 3.46Å; F86-S90 PolarHBondContact O-N 2.98Å; F86-S90 PolarHBondContact O-OG 3.05Å; F86-L110 HydrophobicContact CD1-CD1 4.36Å; F86-L110 HydrophobicContact CD1-CD2 3.59Å; F86-L110 HydrophobicContact CE1-CD2 3.58Å; F86-M150 HydrophobicContact CE1-CB 3.93Å; F86-M150 HydrophobicContact CE1-SD 4.38Å; F86-M150 HydrophobicContact CZ-CB 3.84Å; F86-M150 HydrophobicContact CZ-CG 4.26Å; F86-M150 HydrophobicContact CZ-SD 3.73Å; F86-G152 VanDerWaalsContact CE1-CA 3.44Å; F86-P153 HydrophobicContact CD2-CG 4.49Å
87	F	92	Very high	86.7	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59.7	-47.2	179.9	172.4	-107.7	0	0	0	112.4	K83 L84 N85 S90 I91 P106 L110 C111 V114 W129 L133 F138	K83-F87 WeakPolarHBondContact O-CB 3.23Å; K83-F87 PolarHBondContact O-N 3.38Å; L84-F87 PolarHBondContact O-N 2.83Å; N85-F87 PolarHBondContact O-N 2.9Å; F87-S90 PolarHBondContact O-N 2.95Å; F87-S90 PolarHBondContact O-OG 3.04Å; F87-I91 HydrophobicContact CD2-CD1 4.13Å; F87-I91 HydrophobicContact CE1-CD1 4.01Å; F87-I91 HydrophobicContact CE2-CD1 3.52Å; F87-I91 HydrophobicContact CZ-CD1 3.45Å; F87-I91 VanDerWaalsContact CZ-CD1 3.45Å; F87-I91 PolarHBondContact O-N 3.07Å; F87-P106 HydrophobicContact CD2-CB 3.93Å; F87-P106 HydrophobicContact CD2-CG 4.01Å; F87-P106 HydrophobicContact CE2-CB 4.21Å; F87-P106 HydrophobicContact CE2-CG 3.89Å; F87-L110 HydrophobicContact CB-CG 4.48Å; F87-L110 HydrophobicContact CD2-CG 4.3Å; F87-C111 HydrophobicContact CD2-CB 4.32Å; F87-C111 HydrophobicContact CE2-CB 3.52Å; F87-C111 HydrophobicContact CZ-CB 4.05Å; F87-C111 VanDerWaalsContact CZ-SG 3.56Å; F87-V114 HydrophobicContact CB-CG1 4.49Å; F87-V114 HydrophobicContact CB-CG2 3.95Å; F87-V114 HydrophobicContact CD1-CB 4.28Å; F87-V114 HydrophobicContact CD1-CG1 3.86Å; F87-V114 HydrophobicContact CE1-CG1 4.45Å; F87-V114 HydrophobicContact CG-CB 4.35Å; F87-V114 HydrophobicContact CG-CG1 4.33Å; F87-V114 HydrophobicContact CG-CG2 4.28Å; F87-W129 HydrophobicContact CE1-CH2 4.13Å; F87-W129 AromaticContact CE1-CZ2 3.95Å; F87-W129 HydrophobicContact CE1-CZ2 3.95Å; F87-W129 HydrophobicContact CZ-CZ2 4.26Å; F87-L133 HydrophobicContact CE1-CD1 4.45Å; F87-L133 HydrophobicContact CE1-CD2 4.12Å; F87-L133 HydrophobicContact CZ-CB 4.44Å; F87-L133 HydrophobicContact CZ-CD2 4.28Å; F87-F138 HydrophobicContact CE2-CE2 4.13Å; F87-F138 HydrophobicContact CZ-CE2 4.31Å
88	L	91.1	Very high	86.6	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-64.9	-45.9	178.3	-68.4	172.7	0	0	0	111.9	L69 F72 I76 L84 N85 F86 S90 I91 Y92 L133	L69-L88 HydrophobicContact CD1-CB 3.61Å; L69-L88 HydrophobicContact CD1-CD1 4.21Å; L69-L88 HydrophobicContact CD1-CG 4.41Å; F72-L88 HydrophobicContact CB-CD1 3.7Å; F72-L88 HydrophobicContact CD1-CD2 4.32Å; F72-L88 HydrophobicContact CD2-CD2 4.19Å; F72-L88 HydrophobicContact CE2-CD2 4.48Å; F72-L88 HydrophobicContact CG-CD1 4.09Å; F72-L88 HydrophobicContact CG-CD2 4.11Å; I76-L88 HydrophobicContact CD1-CD1 3.81Å; I76-L88 HydrophobicContact CG1-CD1 3.75Å; L84-L88 HydrophobicContact CD1-CD1 3.79Å; L84-L88 HydrophobicContact CD1-CG 3.93Å; L84-L88 HydrophobicContact CG-CD1 3.91Å; L84-L88 HydrophobicContact CG-CG 4.4Å; L84-L88 WeakPolarHBondContact O-CG 3.44Å; L84-L88 PolarHBondContact O-N 3.16Å; N85-L88 PolarHBondContact O-N 3.39Å; F86-L88 PolarHBondContact O-N 2.9Å; L88-S90 VanDerWaalsContact C-N 3.28Å; L88-S90 PolarHBondContact O-N 2.94Å; L88-I91 PolarHBondContact O-N 2.87Å; L88-I91 VanDerWaalsContact O-N 3.16Å; L88-Y92 HydrophobicContact CD2-CE2 4.43Å; L88-Y92 PolarHBondContact O-N 3.45Å; L88-L133 HydrophobicContact CD2-CD1 4.31Å
89	C	91.7	Very high	86.5	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.007	15%	0.152	C	C	.	.	H	α-helix	trans	-59.9	-37.6	175.3	-64.5	0	0	0	0	112	C43 Y48 N85 F86 I91 T93	C43-C89 VanDerWaalsContact CA-SG 3.52Å; C43-C89 HydrophobicContact CB-CB 3.83Å; C43-C89 WeakPolarHBondContact CB-SG 3.34Å; C43-C89 VanDerWaalsContact SG-CA 3.54Å; C43-C89 WeakPolarHBondContact SG-CB 3.42Å; C43-C89 CovalentContact SG-SG 2.04Å; C43-C89 PolarHBondContact SG-SG 2.8Å; Y48-C89 PolarHBondContact OH-O 3.04Å; Y48-C89 VanDerWaalsContact OH-O 3.09Å; N85-C89 WeakPolarHBondContact O-CB 3.47Å; N85-C89 PolarHBondContact O-N 3.41Å; N85-C89 PolarHBondContact O-SG 2.91Å; F86-C89 PolarHBondContact O-N 2.95Å; C89-I91 PolarHBondContact O-N 3.26Å; C89-T93 CarbonylContact O-C 3.56Å; C89-T93 VanDerWaalsContact O-CA 3.32Å; C89-T93 WeakPolarHBondContact O-CA 3.45Å; C89-T93 PolarHBondContact O-N 3.34Å; C89-T93 PolarHBondContact O-OG1 3.23Å
90	S	90.4	Very high	86.3	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-67.1	-12.7	178.7	74.8	0	0	0	0	115.1	Y48 F86 F87 L88 P106	Y48-S90 WeakPolarHBondContact OH-CA 3.32Å; F86-S90 WeakPolarHBondContact O-CB 3.46Å; F86-S90 PolarHBondContact O-N 2.98Å; F86-S90 PolarHBondContact O-OG 3.05Å; F87-S90 PolarHBondContact O-N 2.95Å; F87-S90 PolarHBondContact O-OG 3.04Å; L88-S90 VanDerWaalsContact C-N 3.28Å; L88-S90 PolarHBondContact O-N 2.94Å; S90-P106 WeakPolarHBondContact OG-CB 3.43Å; S90-P106 WeakPolarHBondContact OG-CD 3.46Å
91	I	91.3	Very high	86	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-107.9	-46.1	177.9	-62.2	171.3	0	0	0	111	L56 I57 F87 L88 C89 P106 L133 F138	L56-I91 HydrophobicContact CB-CG2 4.42Å; I57-I91 HydrophobicContact CD1-CG2 3.55Å; I57-I91 HydrophobicContact CG1-CG2 3.78Å; F87-I91 HydrophobicContact CD2-CD1 4.13Å; F87-I91 HydrophobicContact CE1-CD1 4.01Å; F87-I91 HydrophobicContact CE2-CD1 3.52Å; F87-I91 HydrophobicContact CZ-CD1 3.45Å; F87-I91 VanDerWaalsContact CZ-CD1 3.45Å; F87-I91 PolarHBondContact O-N 3.07Å; L88-I91 PolarHBondContact O-N 2.87Å; L88-I91 VanDerWaalsContact O-N 3.16Å; C89-I91 PolarHBondContact O-N 3.26Å; I91-P106 HydrophobicContact CD1-CG 4Å; I91-P106 HydrophobicContact CG1-CG 3.73Å; I91-L133 HydrophobicContact CD1-CD2 3.58Å; I91-L133 HydrophobicContact CG2-CD2 4.47Å; I91-F138 HydrophobicContact CD1-CE1 4.32Å; I91-F138 HydrophobicContact CD1-CE2 4.15Å; I91-F138 HydrophobicContact CD1-CZ 3.57Å; I91-F138 HydrophobicContact CG1-CE1 4.39Å; I91-F138 HydrophobicContact CG1-CZ 4.12Å
92	Y	90.8	Very high	85.8	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-77.5	-32.4	-178.1	-81.1	-72.9	0	0	0	113.4	N55 I57 Q59 A65 Q68 L69 F72 L88 N132	N55-Y92 WeakPolarHBondContact CB-O 3.31Å; N55-Y92 PolarHBondContact ND2-O 2.89Å; I57-Y92 HydrophobicContact CD1-CD1 3.9Å; I57-Y92 HydrophobicContact CD1-CD2 4.36Å; I57-Y92 HydrophobicContact CD1-CE1 3.37Å; I57-Y92 HydrophobicContact CD1-CE2 3.9Å; I57-Y92 HydrophobicContact CD1-CG 4.35Å; Q59-Y92 VanDerWaalsContact OE1-CD1 3.26Å; A65-Y92 HydrophobicContact CB-CD1 4.27Å; Q68-Y92 HydrophobicContact CB-CD1 4.34Å; Q68-Y92 HydrophobicContact CB-CE1 3.45Å; Q68-Y92 VanDerWaalsContact CB-CE1 3.45Å; Q68-Y92 HydrophobicContact CG-CE1 4.37Å; Q68-Y92 PolarHBondContact OE1-OH 3.38Å; L69-Y92 HydrophobicContact CB-CG 4.43Å; L69-Y92 HydrophobicContact CD1-CD2 3.98Å; L69-Y92 HydrophobicContact CD1-CG 4.47Å; F72-Y92 HydrophobicContact CD2-CE2 4.31Å; F72-Y92 AromaticContact CE2-CE2 3.99Å; F72-Y92 HydrophobicContact CE2-CE2 3.99Å; L88-Y92 HydrophobicContact CD2-CE2 4.43Å; L88-Y92 PolarHBondContact O-N 3.45Å; Y92-N132 PolarHBondContact OH-ND2 3.31Å
93	T	90.8	Very high	85.8	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	-132.1	65.8	175.8	44.7	0	0	0	0	109.9	I38 I40 Y48 T51 C89	I38-T93 HydrophobicContact CG2-CG2 4.41Å; I40-T93 HydrophobicContact CD1-CG2 3.51Å; I40-T93 HydrophobicContact CG1-CG2 4.15Å; Y48-T93 WeakPolarHBondContact CE2-O 3.18Å; Y48-T93 PolarHBondContact OH-O 3.47Å; T51-T93 VanDerWaalsContact OG1-CA 3.26Å; T51-T93 WeakPolarHBondContact OG1-CA 3.23Å; C89-T93 CarbonylContact O-C 3.56Å; C89-T93 VanDerWaalsContact O-CA 3.32Å; C89-T93 WeakPolarHBondContact O-CA 3.45Å; C89-T93 PolarHBondContact O-N 3.34Å; C89-T93 PolarHBondContact O-OG1 3.23Å
94	P	90.4	Very high	85.8	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.154	C	C	.	.			trans	-66.2	139.1	-173.1	28.6	-34.9	0	0	0	111.2	T51 G52 N55 L56 C96 L103 I104	T51-P94 WeakPolarHBondContact CA-O 3.29Å; T51-P94 PolarHBondContact OG1-O 3.05Å; G52-P94 PolarHBondContact N-O 3.32Å; G52-P94 VanDerWaalsContact N-O 3.15Å; N55-P94 HydrophobicContact CB-CG 4.1Å; L56-P94 HydrophobicContact CD1-CB 4.17Å; L56-P94 HydrophobicContact CG-CB 4.07Å; L56-P94 HydrophobicContact CG-CG 4.14Å; P94-C96 PolarHBondContact O-N 2.81Å; P94-L103 HydrophobicContact CB-CB 4.39Å; P94-L103 HydrophobicContact CB-CD2 4.3Å; P94-L103 HydrophobicContact CB-CG 4.47Å; P94-L103 HydrophobicContact CG-CB 4.46Å; P94-L103 HydrophobicContact CG-CD2 3.52Å; P94-L103 HydrophobicContact CG-CG 4.04Å; P94-I104 WeakPolarHBondContact CB-O 3.36Å
95	M	88	Confident	85.7	Confident	63 Å²	63	30.2 Å²	30.2	31%	0.31	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	125.8	-178.7	176.2	174.1	172.9	0	0	110.4	Y48 I104 M150	Y48-M95 HydrophobicContact CD1-CB 4.36Å; Y48-M95 HydrophobicContact CD2-CB 3.9Å; Y48-M95 HydrophobicContact CD2-CG 4.3Å; Y48-M95 HydrophobicContact CE1-CB 4.39Å; Y48-M95 HydrophobicContact CE2-CB 3.93Å; Y48-M95 HydrophobicContact CG-CB 4.14Å; Y48-M95 HydrophobicContact CG-CG 4.34Å; Y48-M95 HydrophobicContact CG-SD 4.39Å; M95-I104 HydrophobicContact CB-CB 4.44Å; M95-I104 PolarHBondContact N-O 3.03Å; M95-I104 PolarHBondContact O-N 2.99Å; M95-M150 HydrophobicContact CB-CE 4.14Å; M95-M150 HydrophobicContact CB-SD 4.45Å
96	C	87.5	Confident	85.9	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.014	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	111.1	170	172.8	0	0	0	0	108.6	C32 P35 Y50 P94 V98	C32-C96 HydrophobicContact CB-CB 3.73Å; C32-C96 WeakPolarHBondContact CB-SG 3.27Å; C32-C96 WeakPolarHBondContact SG-CB 3.42Å; C32-C96 CovalentContact SG-SG 2.04Å; C32-C96 PolarHBondContact SG-SG 3.49Å; P35-C96 HydrophobicContact CB-CB 4.45Å; Y50-C96 PolarHBondContact O-N 3.32Å; P94-C96 PolarHBondContact O-N 2.81Å; C96-V98 PolarHBondContact O-N 2.91Å
97	D	80.8	Confident	86	Confident	22 Å²	22	27.8 Å²	27.8	12%	0.118	15%	0.146	C	C	.	.			trans	-69.7	129.5	175.3	168.3	41.3	0	0	0	110.8	N99 T100 H101 Y102 I104	D97-N99 PolarHBondContact O-N 3Å; D97-N99 PolarHBondContact OD1-N 3Å; D97-N99 PolarHBondContact OD1-ND2 3.16Å; D97-N99 PolarHBondContact OD2-N 3.36Å; D97-T100 VanDerWaalsContact OD2-CB 3.25Å; D97-T100 WeakPolarHBondContact OD2-CB 3.31Å; D97-T100 VanDerWaalsContact OD2-CG2 3.31Å; D97-T100 WeakPolarHBondContact OD2-CG2 3.23Å; D97-T100 PolarHBondContact OD2-N 3.42Å; D97-T100 PolarHBondContact OD2-OG1 2.84Å; D97-H101 WeakPolarHBondContact O-CA 3.36Å; D97-H101 PolarHBondContact O-N 2.95Å; D97-Y102 PolarHBondContact N-O 2.83Å; D97-I104 HydrophobicContact CB-CD1 4.21Å
98	V	75.6	Confident	85.9	Confident	81 Å²	81	30.1 Å²	30.1	49%	0.491	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-19.8	-179.2	-61.3	0	0	0	0	113.2	P35 C96	P35-V98 HydrophobicContact CB-CG1 4.45Å; P35-V98 HydrophobicContact CG-CG1 4.38Å; C96-V98 PolarHBondContact O-N 2.91Å
99	N	73.7	Confident	85.9	Confident	133 Å²	133	33.3 Å²	33.3	71%	0.711	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-40.9	-176.8	-53.5	-80.8	0	0	0	112.5	D97	D97-N99 PolarHBondContact O-N 3Å; D97-N99 PolarHBondContact OD1-N 3Å; D97-N99 PolarHBondContact OD1-ND2 3.16Å; D97-N99 PolarHBondContact OD2-N 3.36Å
100	T	72.9	Confident	85.9	Confident	61 Å²	61	33.6 Å²	33.6	37%	0.374	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-12	-172.9	64.8	0	0	0	0	114.5	D97 Y102	D97-T100 VanDerWaalsContact OD2-CB 3.25Å; D97-T100 WeakPolarHBondContact OD2-CB 3.31Å; D97-T100 VanDerWaalsContact OD2-CG2 3.31Å; D97-T100 WeakPolarHBondContact OD2-CG2 3.23Å; D97-T100 PolarHBondContact OD2-N 3.42Å; D97-T100 PolarHBondContact OD2-OG1 2.84Å; T100-Y102 VanDerWaalsContact C-N 3.32Å; T100-Y102 WeakPolarHBondContact O-CD2 3.22Å; T100-Y102 VanDerWaalsContact O-CE2 3.26Å; T100-Y102 WeakPolarHBondContact O-CE2 3.49Å; T100-Y102 PolarHBondContact O-N 2.93Å
101	H	74.8	Confident	86	Confident	89 Å²	89	33.6 Å²	33.6	41%	0.412	18%	0.177	S	C	.	.			trans	56.9	35.1	-179.1	-63.1	-60.9	0	0	0	115	R31 C32 D97	R31-H101 CarbonylContact C-O 3.58Å; R31-H101 VanDerWaalsContact CA-O 3.24Å; R31-H101 WeakPolarHBondContact CA-O 3.44Å; R31-H101 WeakPolarHBondContact CB-O 3.5Å; C32-H101 PolarHBondContact N-O 3.08Å; D97-H101 WeakPolarHBondContact O-CA 3.36Å; D97-H101 PolarHBondContact O-N 2.95Å
102	Y	80.4	Confident	86	Confident	79 Å²	79	38 Å²	38	31%	0.31	20%	0.197	S	C	.	.	B	Isolated β-bridge	trans	-106.6	150.9	169.7	-65.6	-82.2	0	0	0	112.5	R31 D97 T100	R31-Y102 HydrophobicContact CG-CD1 3.63Å; R31-Y102 HydrophobicContact CG-CE1 3.39Å; R31-Y102 HydrophobicContact CG-CG 4.47Å; R31-Y102 PolarHBondContact NE-OH 2.96Å; R31-Y102 PolarHBondContact NH2-OH 3.41Å; D97-Y102 PolarHBondContact N-O 2.83Å; T100-Y102 VanDerWaalsContact C-N 3.32Å; T100-Y102 WeakPolarHBondContact O-CD2 3.22Å; T100-Y102 VanDerWaalsContact O-CE2 3.26Å; T100-Y102 WeakPolarHBondContact O-CE2 3.49Å; T100-Y102 PolarHBondContact O-N 2.93Å
103	L	85.1	Confident	86	Confident	14 Å²	14	41.3 Å²	41.3	7%	0.073	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	124.4	165.4	-78.5	74.5	0	0	0	108.6	Q30 R31 C32 P54 L56 P94	Q30-L103 HydrophobicContact CB-CD1 4.43Å; Q30-L103 HydrophobicContact CG-CD1 4.26Å; Q30-L103 HydrophobicContact CG-CD2 4.41Å; Q30-L103 PolarHBondContact O-N 2.95Å; R31-L103 WeakPolarHBondContact O-CD1 3.48Å; C32-L103 HydrophobicContact CB-CD1 3.52Å; C32-L103 HydrophobicContact CB-CG 4.45Å; C32-L103 VanDerWaalsContact N-CD1 3.3Å; P54-L103 VanDerWaalsContact O-CD2 3.31Å; P54-L103 WeakPolarHBondContact O-CD2 3.45Å; L56-L103 HydrophobicContact CD2-CB 4.16Å; L56-L103 HydrophobicContact CD2-CD2 3.99Å; L56-L103 HydrophobicContact CG-CD2 4.4Å; P94-L103 HydrophobicContact CB-CB 4.39Å; P94-L103 HydrophobicContact CB-CD2 4.3Å; P94-L103 HydrophobicContact CB-CG 4.47Å; P94-L103 HydrophobicContact CG-CB 4.46Å; P94-L103 HydrophobicContact CG-CD2 3.52Å; P94-L103 HydrophobicContact CG-CG 4.04Å
104	I	87.2	Confident	86	Confident	20 Å²	20	41.3 Å²	41.3	10%	0.103	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	126.6	172.5	-53.3	179.5	0	0	0	107.9	P94 M95 D97 M148 M150	P94-I104 WeakPolarHBondContact CB-O 3.36Å; M95-I104 HydrophobicContact CB-CB 4.44Å; M95-I104 PolarHBondContact N-O 3.03Å; M95-I104 PolarHBondContact O-N 2.99Å; D97-I104 HydrophobicContact CB-CD1 4.21Å; I104-M148 HydrophobicContact CD1-CE 4.23Å; I104-M150 HydrophobicContact CB-CE 4.44Å; I104-M150 HydrophobicContact CG2-CE 4.19Å; I104-M150 HydrophobicContact CG2-CG 3.99Å; I104-M150 WeakPolarHBondContact O-CE 3.12Å
105	G	88.2	Confident	86	Confident	10 Å²	10	46.1 Å²	46.1	10%	0.103	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-174.9	176.8	0	0	0	0	0	113.1	C149 M150	G105-C149 CarbonylContact O-C 3.57Å; G105-C149 VanDerWaalsContact O-CA 3.3Å; G105-C149 WeakPolarHBondContact O-CA 2.79Å; G105-M150 PolarHBondContact O-N 3.35Å
106	P	91.4	Very high	86	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	149.6	174.8	28.7	-32.8	0	0	0	111.7	F87 S90 I91 L110 F138	F87-P106 HydrophobicContact CD2-CB 3.93Å; F87-P106 HydrophobicContact CD2-CG 4.01Å; F87-P106 HydrophobicContact CE2-CB 4.21Å; F87-P106 HydrophobicContact CE2-CG 3.89Å; S90-P106 WeakPolarHBondContact OG-CB 3.43Å; S90-P106 WeakPolarHBondContact OG-CD 3.46Å; I91-P106 HydrophobicContact CD1-CG 4Å; I91-P106 HydrophobicContact CG1-CG 3.73Å; P106-L110 HydrophobicContact CB-CD2 3.65Å; P106-L110 HydrophobicContact CB-CG 4.31Å; P106-F138 HydrophobicContact CG-CD1 3.9Å; P106-F138 HydrophobicContact CG-CD2 4.31Å; P106-F138 HydrophobicContact CG-CE1 3.88Å; P106-F138 HydrophobicContact CG-CE2 4.29Å; P106-F138 HydrophobicContact CG-CG 4.15Å; P106-F138 HydrophobicContact CG-CZ 4.1Å
107	C	91.9	Very high	85.9	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.007	26%	0.256	C	S	.	.			trans	-74.6	156	164.2	-59.1	0	0	0	0	110.7	L110 C111 C149 M150	C107-L110 WeakPolarHBondContact O-CB 3.32Å; C107-L110 PolarHBondContact O-N 3.32Å; C107-C111 PolarHBondContact O-N 3.41Å; C107-C149 WeakPolarHBondContact CA-SG 3.22Å; C107-C149 HydrophobicContact CB-CB 3.95Å; C107-C149 WeakPolarHBondContact CB-SG 3.49Å; C107-C149 WeakPolarHBondContact SG-CB 3.26Å; C107-C149 CovalentContact SG-SG 2.04Å; C107-C149 PolarHBondContact SG-SG 2.81Å; C107-M150 PolarHBondContact N-O 3.1Å
108	R	90.8	Very high	86.2	Confident	50 Å²	50	48.8 Å²	48.8	19%	0.189	25%	0.25	C	S	.	.	H	α-helix	trans	-56.3	-43.3	179.4	-173.8	177	-57.2	-169.8	-2	114.3	L110 C111 E112 C135 S136 F138 P139 L140	R108-L110 VanDerWaalsContact C-N 3.27Å; R108-L110 PolarHBondContact O-N 3.32Å; R108-C111 WeakPolarHBondContact O-CB 3.31Å; R108-C111 PolarHBondContact O-N 3.12Å; R108-C111 VanDerWaalsContact O-N 3.08Å; R108-E112 VanDerWaalsContact CD-OE1 3.23Å; R108-E112 WeakPolarHBondContact CD-OE1 3.5Å; R108-E112 HydrophobicContact CG-CG 4.04Å; R108-E112 VanDerWaalsContact CG-OE1 3.29Å; R108-E112 WeakPolarHBondContact CG-OE1 3.43Å; R108-E112 WeakPolarHBondContact O-CG 3.26Å; R108-E112 PolarHBondContact O-N 3.18Å; R108-C135 HydrophobicContact CG-CB 4.42Å; R108-C135 WeakPolarHBondContact CG-O 3.46Å; R108-C135 PolarHBondContact NE-O 2.86Å; R108-S136 PolarHBondContact NH2-O 3.31Å; R108-F138 HydrophobicContact CB-CB 4.31Å; R108-F138 PolarHBondContact NE-O 3.5Å; R108-F138 PolarHBondContact NH2-O 2.86Å; R108-P139 WeakPolarHBondContact CB-O 3.33Å; R108-P139 PolarHBondContact N-O 2.98Å; R108-L140 HydrophobicContact CB-CD2 4.42Å
109	P	90.3	Very high	86.6	Confident	68 Å²	68	45.6 Å²	45.6	44%	0.442	23%	0.232	S	C	.	.	H	α-helix	trans	-60.8	-34.8	-179.7	-25.4	36.3	0	0	0	113.4	E112 H113 L140	P109-E112 PolarHBondContact O-N 2.88Å; P109-H113 WeakPolarHBondContact O-CB 3.49Å; P109-H113 PolarHBondContact O-N 3.24Å; P109-L140 WeakPolarHBondContact CD-O 3.3Å
110	L	91.2	Very high	86.9	Confident	6 Å²	6	41.6 Å²	41.6	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-64.1	-45.6	173.9	169.6	63.5	0	0	0	111.3	K83 F86 F87 P106 C107 R108 V114 M150	K83-L110 HydrophobicContact CB-CD1 3.69Å; K83-L110 HydrophobicContact CD-CD1 4.02Å; K83-L110 HydrophobicContact CG-CD1 4.45Å; F86-L110 HydrophobicContact CD1-CD1 4.36Å; F86-L110 HydrophobicContact CD1-CD2 3.59Å; F86-L110 HydrophobicContact CE1-CD2 3.58Å; F87-L110 HydrophobicContact CB-CG 4.48Å; F87-L110 HydrophobicContact CD2-CG 4.3Å; P106-L110 HydrophobicContact CB-CD2 3.65Å; P106-L110 HydrophobicContact CB-CG 4.31Å; C107-L110 WeakPolarHBondContact O-CB 3.32Å; C107-L110 PolarHBondContact O-N 3.32Å; R108-L110 VanDerWaalsContact C-N 3.27Å; R108-L110 PolarHBondContact O-N 3.32Å; L110-V114 HydrophobicContact CD1-CG2 4.32Å; L110-V114 WeakPolarHBondContact O-CG2 3.49Å; L110-V114 PolarHBondContact O-N 3.26Å; L110-M150 WeakPolarHBondContact CD2-O 3.48Å
111	C	93.2	Very high	86.9	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.9	-47.7	173.8	-175.6	0	0	0	0	111.7	F87 C107 R108 H113 V114 R115 L133 C135 F138	F87-C111 HydrophobicContact CD2-CB 4.32Å; F87-C111 HydrophobicContact CE2-CB 3.52Å; F87-C111 HydrophobicContact CZ-CB 4.05Å; F87-C111 VanDerWaalsContact CZ-SG 3.56Å; C107-C111 PolarHBondContact O-N 3.41Å; R108-C111 WeakPolarHBondContact O-CB 3.31Å; R108-C111 PolarHBondContact O-N 3.12Å; R108-C111 VanDerWaalsContact O-N 3.08Å; C111-H113 PolarHBondContact O-N 3.22Å; C111-V114 PolarHBondContact O-N 3.06Å; C111-R115 WeakPolarHBondContact O-CB 3.43Å; C111-R115 PolarHBondContact O-N 3.48Å; C111-L133 PolarHBondContact SG-O 3.27Å; C111-C135 HydrophobicContact CB-CB 3.69Å; C111-C135 WeakPolarHBondContact CB-SG 3.45Å; C111-C135 PolarHBondContact O-SG 3.21Å; C111-C135 VanDerWaalsContact O-SG 3.4Å; C111-C135 WeakPolarHBondContact SG-CA 3.44Å; C111-C135 WeakPolarHBondContact SG-CB 3.29Å; C111-C135 CovalentContact SG-SG 2.04Å; C111-C135 PolarHBondContact SG-SG 3.01Å; C111-F138 HydrophobicContact CB-CD2 3.73Å; C111-F138 HydrophobicContact CB-CE2 4.16Å
112	E	91.9	Very high	87.1	Confident	95 Å²	95	36 Å²	36	44%	0.444	19%	0.185	S	C	.	.	H	α-helix	trans	-63.6	-40.9	-178	-72.4	172	167.8	0	0	111.6	R108 P109 R115 A116 C135	R108-E112 VanDerWaalsContact CD-OE1 3.23Å; R108-E112 WeakPolarHBondContact CD-OE1 3.5Å; R108-E112 HydrophobicContact CG-CG 4.04Å; R108-E112 VanDerWaalsContact CG-OE1 3.29Å; R108-E112 WeakPolarHBondContact CG-OE1 3.43Å; R108-E112 WeakPolarHBondContact O-CG 3.26Å; R108-E112 PolarHBondContact O-N 3.18Å; P109-E112 PolarHBondContact O-N 2.88Å; E112-R115 PolarHBondContact O-N 3.18Å; E112-A116 WeakPolarHBondContact O-CB 3.5Å; E112-A116 PolarHBondContact O-N 3.02Å; E112-C135 HydrophobicContact CG-CB 3.88Å
113	H	89.5	Confident	86.6	Confident	73 Å²	73	35 Å²	35	34%	0.338	18%	0.181	S	C	.	.	H	α-helix	trans	-62.8	-45.2	174.3	176.8	104.4	0	0	0	112.6	S81 P109 C111 R117 D155	S81-H113 PolarHBondContact OG-CD2 2.93Å; P109-H113 WeakPolarHBondContact O-CB 3.49Å; P109-H113 PolarHBondContact O-N 3.24Å; C111-H113 PolarHBondContact O-N 3.22Å; H113-R117 PolarHBondContact NE2-NH1 3.03Å; H113-R117 PolarHBondContact NE2-NH2 3.26Å; H113-R117 PolarHBondContact O-N 3.17Å; H113-D155 IonicContact NE2-OD2 2.73Å; H113-D155 PolarHBondContact NE2-OD2 3.39Å; H113-D155 VanDerWaalsContact NE2-OD2 3.1Å
114	V	91.3	Very high	85.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68.6	-44.7	176.6	175.3	0	0	0	0	110.8	K83 L84 F87 L110 C111 A116 R117 C118 W129	K83-V114 HydrophobicContact CB-CG2 4Å; L84-V114 HydrophobicContact CB-CG1 4.28Å; L84-V114 HydrophobicContact CD1-CG1 3.58Å; F87-V114 HydrophobicContact CB-CG1 4.49Å; F87-V114 HydrophobicContact CB-CG2 3.95Å; F87-V114 HydrophobicContact CD1-CB 4.28Å; F87-V114 HydrophobicContact CD1-CG1 3.86Å; F87-V114 HydrophobicContact CE1-CG1 4.45Å; F87-V114 HydrophobicContact CG-CB 4.35Å; F87-V114 HydrophobicContact CG-CG1 4.33Å; F87-V114 HydrophobicContact CG-CG2 4.28Å; L110-V114 HydrophobicContact CD1-CG2 4.32Å; L110-V114 WeakPolarHBondContact O-CG2 3.49Å; L110-V114 PolarHBondContact O-N 3.26Å; C111-V114 PolarHBondContact O-N 3.06Å; V114-A116 PolarHBondContact O-N 3.45Å; V114-R117 PolarHBondContact O-N 3.15Å; V114-C118 HydrophobicContact CG1-CB 4.47Å; V114-C118 WeakPolarHBondContact O-CB 3.37Å; V114-C118 PolarHBondContact O-N 3.33Å; V114-W129 HydrophobicContact CG1-CH2 4.24Å
115	R	91.1	Very high	84.6	Confident	102 Å²	102	40.1 Å²	40.1	39%	0.385	21%	0.207	S	C	.	.	H	α-helix	trans	-58.9	-43.3	176.1	-178	177	178.9	-161.6	1.7	111.9	C111 E112 R117 C118 A119 W129	C111-R115 WeakPolarHBondContact O-CB 3.43Å; C111-R115 PolarHBondContact O-N 3.48Å; E112-R115 PolarHBondContact O-N 3.18Å; R115-R117 VanDerWaalsContact C-N 3.31Å; R115-R117 PolarHBondContact O-N 2.75Å; R115-C118 PolarHBondContact O-N 3.48Å; R115-A119 HydrophobicContact CG-CB 4.08Å; R115-A119 WeakPolarHBondContact O-CB 3.22Å; R115-A119 PolarHBondContact O-N 3.18Å; R115-W129 HydrophobicContact CB-CD2 4.3Å; R115-W129 HydrophobicContact CB-CE3 4.47Å; R115-W129 HydrophobicContact CB-CH2 4.06Å; R115-W129 HydrophobicContact CB-CZ2 3.84Å; R115-W129 HydrophobicContact CB-CZ3 4.37Å; R115-W129 HydrophobicContact CG-CD2 3.77Å; R115-W129 HydrophobicContact CG-CE3 4.16Å; R115-W129 HydrophobicContact CG-CG 4.13Å; R115-W129 HydrophobicContact CG-CZ2 4.2Å
116	A	87.4	Confident	83.6	Confident	68 Å²	68	46.3 Å²	46.3	56%	0.562	24%	0.238	S	C	*	.	H	α-helix	trans	-59.6	-39.5	179.4	0	0	0	0	0	112.6	E112 V114 P120	E112-A116 WeakPolarHBondContact O-CB 3.5Å; E112-A116 PolarHBondContact O-N 3.02Å; V114-A116 PolarHBondContact O-N 3.45Å; A116-P120 VanDerWaalsContact O-CD 3.27Å; A116-P120 WeakPolarHBondContact O-CD 3.48Å; A116-P120 WeakPolarHBondContact O-CG 3.44Å
117	R	84.6	Confident	82.7	Confident	75 Å²	75	52.7 Å²	52.7	28%	0.283	27%	0.266	S	S	.	.	H	α-helix	trans	-85.5	-33.3	178.8	-60.3	177.7	171	172.2	-7.1	113.6	C80 S81 S82 H113 V114 R115 D155 P196	C80-R117 WeakPolarHBondContact O-CB 3.36Å; S81-R117 PolarHBondContact OG-NH1 3.46Å; S82-R117 PolarHBondContact OG-NH1 3.41Å; H113-R117 PolarHBondContact NE2-NH1 3.03Å; H113-R117 PolarHBondContact NE2-NH2 3.26Å; H113-R117 PolarHBondContact O-N 3.17Å; V114-R117 PolarHBondContact O-N 3.15Å; R115-R117 VanDerWaalsContact C-N 3.31Å; R115-R117 PolarHBondContact O-N 2.75Å; R117-D155 IonicContact NH1-OD1 3.89Å; R117-P196 HydrophobicContact CG-CG 4.3Å
118	C	86.8	Confident	82.2	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-99.5	-26.8	-171.7	-66.5	0	0	0	0	115.6	L75 C80 V114 R115 P120 V121 L122 W129	L75-C118 HydrophobicContact CD2-CB 4.4Å; C80-C118 HydrophobicContact CB-CB 3.99Å; C80-C118 WeakPolarHBondContact CB-SG 3.49Å; C80-C118 VanDerWaalsContact SG-CA 3.53Å; C80-C118 WeakPolarHBondContact SG-CB 3.45Å; C80-C118 CovalentContact SG-SG 2.03Å; C80-C118 PolarHBondContact SG-SG 2.92Å; V114-C118 HydrophobicContact CG1-CB 4.47Å; V114-C118 WeakPolarHBondContact O-CB 3.37Å; V114-C118 PolarHBondContact O-N 3.33Å; R115-C118 PolarHBondContact O-N 3.48Å; C118-P120 VanDerWaalsContact C-CD 3.49Å; C118-V121 WeakPolarHBondContact O-CB 3.43Å; C118-V121 PolarHBondContact O-N 2.88Å; C118-V121 VanDerWaalsContact O-N 3.12Å; C118-L122 PolarHBondContact O-N 3.2Å; C118-L122 VanDerWaalsContact O-N 3.12Å; C118-W129 HydrophobicContact CB-CZ3 3.94Å
119	A	85.9	Confident	81.9	Confident	14 Å²	14	58.1 Å²	58.1	12%	0.116	30%	0.296	C	S	.	.	H	α-helix	trans	-67.1	-28.4	174.5	0	0	0	0	0	114.5	R115 V121 R123 W129	R115-A119 HydrophobicContact CG-CB 4.08Å; R115-A119 WeakPolarHBondContact O-CB 3.22Å; R115-A119 PolarHBondContact O-N 3.18Å; A119-V121 VanDerWaalsContact C-N 3.29Å; A119-R123 VanDerWaalsContact O-CG 3.27Å; A119-R123 WeakPolarHBondContact O-CG 3.5Å; A119-R123 PolarHBondContact O-N 2.66Å; A119-R123 PolarHBondContact O-NE 3.05Å; A119-W129 HydrophobicContact CB-CB 4.33Å; A119-W129 HydrophobicContact CB-CD2 4.36Å; A119-W129 HydrophobicContact CB-CE3 3.8Å
120	P	78.7	Confident	81.7	Confident	49 Å²	49	56.4 Å²	56.4	32%	0.318	29%	0.285	S	S	.	.	H	α-helix	trans	-62.4	-35.3	166.4	-22.9	34.4	0	0	0	113	A116 C118 V124	A116-P120 VanDerWaalsContact O-CD 3.27Å; A116-P120 WeakPolarHBondContact O-CD 3.48Å; A116-P120 WeakPolarHBondContact O-CG 3.44Å; C118-P120 VanDerWaalsContact C-CD 3.49Å; P120-V124 PolarHBondContact O-N 2.93Å
121	V	73.6	Confident	81.4	Confident	12 Å²	12	64.2 Å²	64.2	7%	0.073	32%	0.321	C	S	.	.	H	α-helix	trans	-72.2	-50	-177.5	176.8	0	0	0	0	111.5	L75 Y78 C80 C118 A119 R123 V124 F125	L75-V121 HydrophobicContact CD1-CB 4.2Å; L75-V121 HydrophobicContact CD1-CG1 3.69Å; Y78-V121 HydrophobicContact CD1-CB 4.45Å; Y78-V121 HydrophobicContact CD1-CG1 3.63Å; Y78-V121 HydrophobicContact CD1-CG2 4.04Å; Y78-V121 HydrophobicContact CD2-CG1 4.06Å; Y78-V121 HydrophobicContact CE1-CB 4.01Å; Y78-V121 HydrophobicContact CE1-CG1 3.32Å; Y78-V121 HydrophobicContact CE1-CG2 3.42Å; Y78-V121 VanDerWaalsContact CE1-CG2 3.42Å; Y78-V121 HydrophobicContact CE2-CG1 3.85Å; Y78-V121 HydrophobicContact CG-CG1 4Å; Y78-V121 VanDerWaalsContact CZ-CG1 3.5Å; C80-V121 HydrophobicContact CB-CG2 3.89Å; C118-V121 WeakPolarHBondContact O-CB 3.43Å; C118-V121 PolarHBondContact O-N 2.88Å; C118-V121 VanDerWaalsContact O-N 3.12Å; A119-V121 VanDerWaalsContact C-N 3.29Å; V121-R123 PolarHBondContact O-N 2.91Å; V121-V124 WeakPolarHBondContact O-CB 3.4Å; V121-V124 PolarHBondContact O-N 3.19Å; V121-F125 HydrophobicContact CG1-CD2 4.4Å; V121-F125 HydrophobicContact CG1-CE2 4.02Å; V121-F125 WeakPolarHBondContact O-CD2 3.18Å
122	L	78.3	Confident	80.9	Confident	21 Å²	21	66.7 Å²	66.7	11%	0.11	33%	0.334	C	S	.	.	H	α-helix	trans	-55.6	-38.8	177.9	-74	169.3	0	0	0	111.7	L75 C118 V124 F125 D126 F127 W129	L75-L122 HydrophobicContact CD1-CD2 4.11Å; L75-L122 HydrophobicContact CD1-CG 4.16Å; L75-L122 HydrophobicContact CD2-CD1 4.18Å; L75-L122 HydrophobicContact CD2-CD2 4.13Å; L75-L122 HydrophobicContact CD2-CG 4.13Å; C118-L122 PolarHBondContact O-N 3.2Å; C118-L122 VanDerWaalsContact O-N 3.12Å; L122-V124 VanDerWaalsContact C-N 3.3Å; L122-V124 PolarHBondContact O-N 3.1Å; L122-F125 CarbonylContact O-C 3.53Å; L122-F125 WeakPolarHBondContact O-CA 3.44Å; L122-F125 PolarHBondContact O-N 3.25Å; L122-D126 PolarHBondContact O-N 2.99Å; L122-F127 CarbonylContact C-O 3.6Å; L122-F127 HydrophobicContact CB-CB 4.11Å; L122-F127 WeakPolarHBondContact CB-O 3.39Å; L122-F127 HydrophobicContact CD2-CB 4.15Å; L122-F127 PolarHBondContact O-N 2.94Å; L122-W129 HydrophobicContact CD1-CE3 3.91Å; L122-W129 HydrophobicContact CD1-CZ3 4.23Å
123	R	71.4	Confident	80.7	Confident	58 Å²	58	62.2 Å²	62.2	22%	0.219	31%	0.313	C	S	.	.	H	α-helix	trans	-65.6	-24.2	177.3	-72.6	-177.7	-69.1	150.5	-3.3	114.7	A119 V121 F125 D126 F127 H841 H845	A119-R123 VanDerWaalsContact O-CG 3.27Å; A119-R123 WeakPolarHBondContact O-CG 3.5Å; A119-R123 PolarHBondContact O-N 2.66Å; A119-R123 PolarHBondContact O-NE 3.05Å; V121-R123 PolarHBondContact O-N 2.91Å; R123-F125 PolarHBondContact O-N 3.24Å; R123-D126 PolarHBondContact O-N 2.96Å; R123-F127 PolarHBondContact N-O 3.07Å; R123-H841 VanDerWaalsContact CD-NE2 3.34Å; R123-H841 WeakPolarHBondContact CD-NE2 3.29Å; R123-H845 PolarHBondContact NH1-NE2 3.13Å; R123-H845 PolarHBondContact NH2-NE2 3.11Å
124	V	61.9	Low	80.6	Confident	67 Å²	67	60.1 Å²	60.1	41%	0.406	31%	0.305	S	S	.	.	H	α-helix	trans	-71.8	-20.3	172.7	173.1	0	0	0	0	111.6	P120 V121 L122 Y886	P120-V124 PolarHBondContact O-N 2.93Å; V121-V124 WeakPolarHBondContact O-CB 3.4Å; V121-V124 PolarHBondContact O-N 3.19Å; L122-V124 VanDerWaalsContact C-N 3.3Å; L122-V124 PolarHBondContact O-N 3.1Å; V124-Y886 PolarHBondContact O-OH 2.32Å
125	F	66.6	Low	80.5	Confident	73 Å²	73	60.2 Å²	60.2	32%	0.32	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	23.6	176.3	-59	-73.1	0	0	0	112.3	Y78 V121 L122 R123 F127 F883	Y78-F125 HydrophobicContact CD2-CE2 4.45Å; Y78-F125 HydrophobicContact CE2-CE2 4Å; Y78-F125 HydrophobicContact CE2-CZ 4.17Å; V121-F125 HydrophobicContact CG1-CD2 4.4Å; V121-F125 HydrophobicContact CG1-CE2 4.02Å; V121-F125 WeakPolarHBondContact O-CD2 3.18Å; L122-F125 CarbonylContact O-C 3.53Å; L122-F125 WeakPolarHBondContact O-CA 3.44Å; L122-F125 PolarHBondContact O-N 3.25Å; R123-F125 PolarHBondContact O-N 3.24Å; F125-F127 HydrophobicContact CB-CD2 3.82Å; F125-F127 HydrophobicContact CB-CE2 4.24Å; F125-F127 WeakPolarHBondContact O-CD2 3.41Å; F125-F127 WeakPolarHBondContact O-CE2 3.16Å; F125-F127 PolarHBondContact O-N 3.46Å; F125-F127 VanDerWaalsContact O-N 3.12Å; F125-F883 HydrophobicContact CE1-CD2 4.41Å
126	D	67.3	Low	80.3	Confident	140 Å²	140	57.6 Å²	57.6	75%	0.749	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	17.1	-176.7	-67	-53.5	0	0	0	115.7	L122 R123	L122-D126 PolarHBondContact O-N 2.99Å; R123-D126 PolarHBondContact O-N 2.96Å
127	F	72.9	Confident	80.1	Confident	135 Å²	135	55.7 Å²	55.7	59%	0.592	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-97.1	128.8	175.1	-65.7	-72.2	0	0	0	112.3	L122 R123 F125	L122-F127 CarbonylContact C-O 3.6Å; L122-F127 HydrophobicContact CB-CB 4.11Å; L122-F127 WeakPolarHBondContact CB-O 3.39Å; L122-F127 HydrophobicContact CD2-CB 4.15Å; L122-F127 PolarHBondContact O-N 2.94Å; R123-F127 PolarHBondContact N-O 3.07Å; F125-F127 HydrophobicContact CB-CD2 3.82Å; F125-F127 HydrophobicContact CB-CE2 4.24Å; F125-F127 WeakPolarHBondContact O-CD2 3.41Å; F125-F127 WeakPolarHBondContact O-CE2 3.16Å; F125-F127 PolarHBondContact O-N 3.46Å; F125-F127 VanDerWaalsContact O-N 3.12Å
128	N	81.7	Confident	80.2	Confident	129 Å²	129	52.7 Å²	52.7	69%	0.69	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-76.7	161.3	169.5	-80.3	-54.6	0	0	0	111.8	P130	N128-P130 WeakPolarHBondContact O-CD 3.34Å
129	W	85.3	Confident	80.2	Confident	35 Å²	35	53.9 Å²	53.9	13%	0.133	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-65.9	121.5	172.6	-175.2	-94.3	0	0	0	109.9	F87 V114 R115 C118 A119 L122 L133	F87-W129 HydrophobicContact CE1-CH2 4.13Å; F87-W129 AromaticContact CE1-CZ2 3.95Å; F87-W129 HydrophobicContact CE1-CZ2 3.95Å; F87-W129 HydrophobicContact CZ-CZ2 4.26Å; V114-W129 HydrophobicContact CG1-CH2 4.24Å; R115-W129 HydrophobicContact CB-CD2 4.3Å; R115-W129 HydrophobicContact CB-CE3 4.47Å; R115-W129 HydrophobicContact CB-CH2 4.06Å; R115-W129 HydrophobicContact CB-CZ2 3.84Å; R115-W129 HydrophobicContact CB-CZ3 4.37Å; R115-W129 HydrophobicContact CG-CD2 3.77Å; R115-W129 HydrophobicContact CG-CE3 4.16Å; R115-W129 HydrophobicContact CG-CG 4.13Å; R115-W129 HydrophobicContact CG-CZ2 4.2Å; C118-W129 HydrophobicContact CB-CZ3 3.94Å; A119-W129 HydrophobicContact CB-CB 4.33Å; A119-W129 HydrophobicContact CB-CD2 4.36Å; A119-W129 HydrophobicContact CB-CE3 3.8Å; L122-W129 HydrophobicContact CD1-CE3 3.91Å; L122-W129 HydrophobicContact CD1-CZ3 4.23Å; W129-L133 HydrophobicContact CZ2-CB 3.86Å; W129-L133 HydrophobicContact CZ2-CD1 4.33Å; W129-L133 PolarHBondContact NE1-O 3.16Å
130	P	85.1	Confident	80.2	Confident	32 Å²	32	58.5 Å²	58.5	21%	0.208	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-61.8	142.9	-171.3	-26.4	35.6	0	0	0	114.7	F72 N128 N132 L133	F72-P130 HydrophobicContact CE1-CG 4.21Å; F72-P130 HydrophobicContact CZ-CG 4.11Å; N128-P130 WeakPolarHBondContact O-CD 3.34Å; P130-N132 VanDerWaalsContact C-N 3.28Å; P130-N132 WeakPolarHBondContact CB-OD1 3.27Å; P130-N132 PolarHBondContact O-N 3.47Å; P130-L133 HydrophobicContact CB-CD1 4.27Å; P130-L133 HydrophobicContact CB-CG 4.27Å; P130-L133 HydrophobicContact CG-CD1 4.11Å; P130-L133 PolarHBondContact O-N 3.42Å
131	E	84.5	Confident	80.4	Confident	170 Å²	170	62.9 Å²	62.9	79%	0.794	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-64.6	-31.3	-178.1	-61.8	-170.8	163.5	0	0	112.9	L133 N134 Q137	E131-L133 PolarHBondContact O-N 3.41Å; E131-N134 VanDerWaalsContact O-CB 3.29Å; E131-N134 WeakPolarHBondContact O-CB 3.44Å; E131-N134 PolarHBondContact O-N 3.17Å; E131-Q137 PolarHBondContact O-NE2 2.97Å
132	N	82.5	Confident	80.7	Confident	52 Å²	52	66.4 Å²	66.4	28%	0.278	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-74.1	-0.8	173.7	68	-53.9	0	0	0	113.9	I57 Y92 P130	I57-N132 WeakPolarHBondContact CD1-ND2 3.33Å; I57-N132 HydrophobicContact CG1-CB 4.4Å; Y92-N132 PolarHBondContact OH-ND2 3.31Å; P130-N132 VanDerWaalsContact C-N 3.28Å; P130-N132 WeakPolarHBondContact CB-OD1 3.27Å; P130-N132 PolarHBondContact O-N 3.47Å
133	L	87.5	Confident	80.5	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.01	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-119	14.4	173.7	-58.8	179.7	0	0	0	111.6	F72 F87 L88 I91 C111 W129 P130 E131 C135	F72-L133 HydrophobicContact CE1-CD1 3.92Å; F72-L133 HydrophobicContact CZ-CD1 3.77Å; F87-L133 HydrophobicContact CE1-CD1 4.45Å; F87-L133 HydrophobicContact CE1-CD2 4.12Å; F87-L133 HydrophobicContact CZ-CB 4.44Å; F87-L133 HydrophobicContact CZ-CD2 4.28Å; L88-L133 HydrophobicContact CD2-CD1 4.31Å; I91-L133 HydrophobicContact CD1-CD2 3.58Å; I91-L133 HydrophobicContact CG2-CD2 4.47Å; C111-L133 PolarHBondContact SG-O 3.27Å; W129-L133 HydrophobicContact CZ2-CB 3.86Å; W129-L133 HydrophobicContact CZ2-CD1 4.33Å; W129-L133 PolarHBondContact NE1-O 3.16Å; P130-L133 HydrophobicContact CB-CD1 4.27Å; P130-L133 HydrophobicContact CB-CG 4.27Å; P130-L133 HydrophobicContact CG-CD1 4.11Å; P130-L133 PolarHBondContact O-N 3.42Å; E131-L133 PolarHBondContact O-N 3.41Å; L133-C135 PolarHBondContact O-N 2.89Å
134	N	87.7	Confident	80.1	Confident	29 Å²	29	72.7 Å²	72.7	16%	0.155	38%	0.381	C	S	.	.			trans	-66.8	113.1	-175.3	174.6	6.7	0	0	0	111.7	S24 E131 S136 Q137	S24-N134 PolarHBondContact OG-ND2 3.45Å; S24-N134 VanDerWaalsContact OG-ND2 3.07Å; E131-N134 VanDerWaalsContact O-CB 3.29Å; E131-N134 WeakPolarHBondContact O-CB 3.44Å; E131-N134 PolarHBondContact O-N 3.17Å; N134-S136 PolarHBondContact O-N 3.09Å; N134-S136 PolarHBondContact OD1-N 3.03Å; N134-Q137 HydrophobicContact CB-CG 4.39Å; N134-Q137 WeakPolarHBondContact O-CB 3.49Å; N134-Q137 WeakPolarHBondContact O-CG 3.41Å; N134-Q137 PolarHBondContact O-N 3.25Å
135	C	90.6	Very high	79.9	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.007	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-59.8	-20.9	-171.6	-53.6	0	0	0	0	116.1	R108 C111 E112 L133 Q137 F138	R108-C135 HydrophobicContact CG-CB 4.42Å; R108-C135 WeakPolarHBondContact CG-O 3.46Å; R108-C135 PolarHBondContact NE-O 2.86Å; C111-C135 HydrophobicContact CB-CB 3.69Å; C111-C135 WeakPolarHBondContact CB-SG 3.45Å; C111-C135 PolarHBondContact O-SG 3.21Å; C111-C135 VanDerWaalsContact O-SG 3.4Å; C111-C135 WeakPolarHBondContact SG-CA 3.44Å; C111-C135 WeakPolarHBondContact SG-CB 3.29Å; C111-C135 CovalentContact SG-SG 2.04Å; C111-C135 PolarHBondContact SG-SG 3.01Å; E112-C135 HydrophobicContact CG-CB 3.88Å; L133-C135 PolarHBondContact O-N 2.89Å; C135-Q137 PolarHBondContact O-N 3.2Å; C135-Q137 VanDerWaalsContact O-N 3.15Å; C135-F138 PolarHBondContact O-N 3.01Å; C135-F138 VanDerWaalsContact O-N 3.14Å
136	S	86.2	Confident	79.8	Confident	47 Å²	47	72 Å²	72	33%	0.329	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-58.3	-22.7	170.2	-60.8	0	0	0	0	113.1	R108 N134 F138	R108-S136 PolarHBondContact NH2-O 3.31Å; N134-S136 PolarHBondContact O-N 3.09Å; N134-S136 PolarHBondContact OD1-N 3.03Å; S136-F138 VanDerWaalsContact C-N 3.32Å; S136-F138 PolarHBondContact O-N 3.46Å
137	Q	83.6	Confident	79.8	Confident	29 Å²	29	66.6 Å²	66.6	14%	0.136	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-70.8	-23.5	178.4	-67.6	168.9	2.6	0	0	113.2	T25 T26 Y27 E131 N134 C135	T25-Q137 WeakPolarHBondContact O-CG 3.3Å; T26-Q137 WeakPolarHBondContact CG2-O 3.44Å; Y27-Q137 HydrophobicContact CD2-CB 3.86Å; Y27-Q137 HydrophobicContact CD2-CG 3.86Å; Y27-Q137 HydrophobicContact CE2-CG 4.12Å; Y27-Q137 PolarHBondContact N-O 3.07Å; E131-Q137 PolarHBondContact O-NE2 2.97Å; N134-Q137 HydrophobicContact CB-CG 4.39Å; N134-Q137 WeakPolarHBondContact O-CB 3.49Å; N134-Q137 WeakPolarHBondContact O-CG 3.41Å; N134-Q137 PolarHBondContact O-N 3.25Å; C135-Q137 PolarHBondContact O-N 3.2Å; C135-Q137 VanDerWaalsContact O-N 3.15Å
138	F	87	Confident	80.1	Confident	11 Å²	11	63.9 Å²	63.9	5%	0.048	37%	0.373	C	S	.	.	S	Bend	trans	-97.2	150.2	-171.6	-56.6	-58.1	0	0	0	113.4	F87 I91 P106 R108 C111 C135 S136	F87-F138 HydrophobicContact CE2-CE2 4.13Å; F87-F138 HydrophobicContact CZ-CE2 4.31Å; I91-F138 HydrophobicContact CD1-CE1 4.32Å; I91-F138 HydrophobicContact CD1-CE2 4.15Å; I91-F138 HydrophobicContact CD1-CZ 3.57Å; I91-F138 HydrophobicContact CG1-CE1 4.39Å; I91-F138 HydrophobicContact CG1-CZ 4.12Å; P106-F138 HydrophobicContact CG-CD1 3.9Å; P106-F138 HydrophobicContact CG-CD2 4.31Å; P106-F138 HydrophobicContact CG-CE1 3.88Å; P106-F138 HydrophobicContact CG-CE2 4.29Å; P106-F138 HydrophobicContact CG-CG 4.15Å; P106-F138 HydrophobicContact CG-CZ 4.1Å; R108-F138 HydrophobicContact CB-CB 4.31Å; R108-F138 PolarHBondContact NE-O 3.5Å; R108-F138 PolarHBondContact NH2-O 2.86Å; C111-F138 HydrophobicContact CB-CD2 3.73Å; C111-F138 HydrophobicContact CB-CE2 4.16Å; C135-F138 PolarHBondContact O-N 3.01Å; C135-F138 VanDerWaalsContact O-N 3.14Å; S136-F138 VanDerWaalsContact C-N 3.32Å; S136-F138 PolarHBondContact O-N 3.46Å
139	P	86.8	Confident	80.5	Confident	25 Å²	25	58.1 Å²	58.1	16%	0.162	34%	0.343	C	S	.	.			trans	-70.5	148.6	176.6	30.1	-36.5	0	0	0	112.1	R108 A147 C149	R108-P139 WeakPolarHBondContact CB-O 3.33Å; R108-P139 PolarHBondContact N-O 2.98Å; P139-A147 HydrophobicContact CB-CB 4.11Å; P139-A147 HydrophobicContact CG-CB 4.26Å; P139-C149 HydrophobicContact CG-CB 3.7Å
140	L	84.4	Confident	80.6	Confident	111 Å²	111	57.7 Å²	57.7	58%	0.581	34%	0.342	S	S	*	.	S	Bend	trans	-72	-35.4	-172.6	-85.4	158	0	0	0	114.8	R108 P109	R108-L140 HydrophobicContact CB-CD2 4.42Å; P109-L140 WeakPolarHBondContact CD-O 3.3Å
141	K	82.6	Confident	80.5	Confident	142 Å²	142	61.4 Å²	61.4	62%	0.617	36%	0.357	S	S	*	.	S	Bend	trans	-163.2	154.6	-176.2	58.4	175.5	-177.1	175.8	0	110.1	S143	K141-S143 PolarHBondContact O-OG 3.01Å
142	N	81.2	Confident	80.4	Confident	85 Å²	85	54.6 Å²	54.6	46%	0.455	33%	0.332	S	S	.	.			trans	-56.8	142.2	168.2	-164.5	-0.5	0	0	0	110.9
143	S	73.1	Confident	80.3	Confident	49 Å²	49	54.7 Å²	54.7	34%	0.343	34%	0.336	S	S	.	.			trans	-146.5	131	-172.9	-64.3	0	0	0	0	111	K141 G145 G146	K141-S143 PolarHBondContact O-OG 3.01Å; S143-G145 PolarHBondContact O-N 3.33Å; S143-G146 WeakPolarHBondContact O-CA 3.47Å; S143-G146 PolarHBondContact O-N 3.31Å
144	V	62.7	Low	79.2	Confident	163 Å²	163	63.3 Å²	63.3	99%	0.988	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	117.3	-179.7	-176	0	0	0	0	110	G146	V144-G146 VanDerWaalsContact C-N 3.25Å; V144-G146 PolarHBondContact O-N 3.02Å
145	G	59.3	Low	77.7	Confident	89 Å²	89	64.2 Å²	64.2	92%	0.918	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	5.1	-173.2	0	0	0	0	0	115.1	S143	S143-G145 PolarHBondContact O-N 3.33Å
146	G	63.8	Low	75.7	Confident	37 Å²	37	72.8 Å²	72.8	38%	0.381	43%	0.426	S	S	.	.	S	Bend	trans	-106.4	-160.7	176.1	0	0	0	0	0	113.1	S143 V144	S143-G146 WeakPolarHBondContact O-CA 3.47Å; S143-G146 PolarHBondContact O-N 3.31Å; V144-G146 VanDerWaalsContact C-N 3.25Å; V144-G146 PolarHBondContact O-N 3.02Å
147	A	67.2	Low	73.4	Confident	26 Å²	26	77.8 Å²	77.8	22%	0.215	44%	0.444	C	S	.	.			trans	-73.4	127.7	173.9	0	0	0	0	0	110.9	P139	P139-A147 HydrophobicContact CB-CB 4.11Å; P139-A147 HydrophobicContact CG-CB 4.26Å
148	M	80	Confident	70.9	Confident	78 Å²	78	85.1 Å²	85.1	38%	0.384	48%	0.478	S	S	.	.			trans	-83.5	145	169.4	-59.7	-174.9	-66	0	0	109.7	I104	I104-M148 HydrophobicContact CD1-CE 4.23Å
149	C	88.7	Confident	68.1	Low	8 Å²	8	92.2 Å²	92.2	5%	0.054	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	165.9	176.7	62.5	0	0	0	0	110.6	G105 C107 P139	G105-C149 CarbonylContact O-C 3.57Å; G105-C149 VanDerWaalsContact O-CA 3.3Å; G105-C149 WeakPolarHBondContact O-CA 2.79Å; C107-C149 WeakPolarHBondContact CA-SG 3.22Å; C107-C149 HydrophobicContact CB-CB 3.95Å; C107-C149 WeakPolarHBondContact CB-SG 3.49Å; C107-C149 WeakPolarHBondContact SG-CB 3.26Å; C107-C149 CovalentContact SG-SG 2.04Å; C107-C149 PolarHBondContact SG-SG 2.81Å; P139-C149 HydrophobicContact CG-CB 3.7Å
150	M	87.7	Confident	65.6	Low	25 Å²	25	98 Å²	98	12%	0.123	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	121.4	176.2	-70.5	174.6	-85.6	0	0	111.2	Y48 F86 M95 I104 G105 C107 L110 G152	Y48-M150 HydrophobicContact CD1-SD 4.3Å; Y48-M150 HydrophobicContact CE1-CE 4.33Å; Y48-M150 HydrophobicContact CE1-SD 3.9Å; F86-M150 HydrophobicContact CE1-CB 3.93Å; F86-M150 HydrophobicContact CE1-SD 4.38Å; F86-M150 HydrophobicContact CZ-CB 3.84Å; F86-M150 HydrophobicContact CZ-CG 4.26Å; F86-M150 HydrophobicContact CZ-SD 3.73Å; M95-M150 HydrophobicContact CB-CE 4.14Å; M95-M150 HydrophobicContact CB-SD 4.45Å; I104-M150 HydrophobicContact CB-CE 4.44Å; I104-M150 HydrophobicContact CG2-CE 4.19Å; I104-M150 HydrophobicContact CG2-CG 3.99Å; I104-M150 WeakPolarHBondContact O-CE 3.12Å; G105-M150 PolarHBondContact O-N 3.35Å; C107-M150 PolarHBondContact N-O 3.1Å; L110-M150 WeakPolarHBondContact CD2-O 3.48Å; M150-G152 VanDerWaalsContact C-N 3.29Å
151	E	83.5	Confident	63.1	Low	110 Å²	110	99.9 Å²	99.9	51%	0.514	56%	0.555	S	S	.	*			trans	-69.1	-26.8	171	-69.7	78.1	-167.8	0	0	112.9
152	G	81.6	Confident	60.5	Low	27 Å²	27	99.3 Å²	99.3	28%	0.278	57%	0.566	S	S	.	*			trans	86.4	176.4	-177.9	0	0	0	0	0	114.1	F86 M150	F86-G152 VanDerWaalsContact CE1-CA 3.44Å; M150-G152 VanDerWaalsContact C-N 3.29Å
153	P	80.4	Confident	58	Low	55 Å²	55	99.8 Å²	99.8	36%	0.357	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-68.8	150.9	-176.2	27.7	-35	0	0	0	112.6	K83 F86	K83-P153 WeakPolarHBondContact CD-O 3.3Å; K83-P153 WeakPolarHBondContact CE-O 3.43Å; K83-P153 PolarHBondContact NZ-O 2.95Å; F86-P153 HydrophobicContact CD2-CG 4.49Å
154	E	64.7	Low	56.1	Low	183 Å²	183	107.7 Å²	107.7	86%	0.855	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-68.8	152.4	171.1	-63.4	177.4	164	0	0	110.7
155	D	56	Low	54.5	Low	48 Å²	48	105.8 Å²	105.8	26%	0.257	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-87.7	119.7	-178.7	-71.8	-73.4	0	0	0	110.8	S82 K83 H113 R117 E157	S82-D155 PolarHBondContact OG-OD1 3.04Å; K83-D155 WeakPolarHBondContact CE-OD1 2.8Å; K83-D155 WeakPolarHBondContact CE-OD2 3.12Å; K83-D155 IonicContact NZ-OD1 3.1Å; K83-D155 IonicContact NZ-OD2 3.77Å; K83-D155 PolarHBondContact NZ-OD2 3.09Å; H113-D155 IonicContact NE2-OD2 2.73Å; H113-D155 PolarHBondContact NE2-OD2 3.39Å; H113-D155 VanDerWaalsContact NE2-OD2 3.1Å; R117-D155 IonicContact NH1-OD1 3.89Å; D155-E157 PolarHBondContact O-N 3.45Å
156	L	48.4	Very low	53.1	Low	180 Å²	180	106 Å²	106	94%	0.942	59%	0.591	S	S	*	*	S	Bend	trans	-76.5	31.3	176.5	-64.3	171.4	0	0	0	113.7
157	E	38.2	Very low	51.7	Low	153 Å²	153	112.2 Å²	112.2	72%	0.715	61%	0.614	S	S	*	*			trans	-137	47.5	176	-70	-172	175.7	0	0	110.6	D155 K202	D155-E157 PolarHBondContact O-N 3.45Å; E157-K202 IonicContact OE1-NZ 2.7Å; E157-K202 PolarHBondContact OE1-NZ 3.01Å; E157-K202 IonicContact OE2-NZ 3.46Å; E157-K202 PolarHBondContact OE2-NZ 3.3Å
158	E	32.1	Very low	49.9	Very low	183 Å²	183	115.6 Å²	115.6	86%	0.855	64%	0.636	S	S	*	*			trans	-103.7	97.7	165.6	-77.4	-156.6	162.8	0	0	111.6
159	D	28.5	Very low	47.5	Very low	159 Å²	159	116.8 Å²	116.8	85%	0.85	65%	0.652	S	S	*	*			trans	-150.4	150.9	157.5	-136.2	-31.5	0	0	0	110.4
160	I	33.2	Very low	44.9	Very low	148 Å²	148	121.3 Å²	121.3	76%	0.759	68%	0.684	S	S	*	*			trans	75.1	74.6	-171.1	-43.6	168.7	0	0	0	115.6
161	N	31.5	Very low	42	Very low	150 Å²	150	125 Å²	125	80%	0.802	71%	0.712	S	S	*	*			trans	-159.5	86.5	141.3	-116.5	-33.9	0	0	0	112.3	S163	N161-S163 PolarHBondContact O-N 3.21Å
162	P	28.1	Very low	39.5	Very low	129 Å²	129	124.8 Å²	124.8	84%	0.838	72%	0.723	S	S	*	*			trans	-83.1	67.2	-168.7	34.5	-37.2	0	0	0	113.7
163	S	29.9	Very low	36.9	Very low	96 Å²	96	128.4 Å²	128.4	67%	0.671	74%	0.744	S	S	*	*			trans	-160.1	63.2	174.1	65.4	0	0	0	0	116.8	N161	N161-S163 PolarHBondContact O-N 3.21Å
164	K	32.4	Very low	34.6	Very low	214 Å²	214	133.5 Å²	133.5	93%	0.93	77%	0.768	S	S	*	*			trans	-167	64.7	155.2	-114.1	162.8	-171.1	178.2	0	115.6
165	S	28.9	Very low	32.8	Very low	124 Å²	124	130 Å²	130	87%	0.867	76%	0.763	S	S	*	*			trans	-134.6	65.5	176.3	62.8	0	0	0	0	113.2
166	A	30.5	Very low	31.7	Very low	92 Å²	92	135.4 Å²	135.4	76%	0.76	79%	0.793	S	S	*	*			trans	-168.3	163.4	163.2	0	0	0	0	0	112.5
167	I	33.2	Very low	30.8	Very low	169 Å²	169	130.7 Å²	130.7	87%	0.867	78%	0.775	S	S	*	*			trans	70	100.8	166.6	-47	-175.7	0	0	0	116
168	S	30.9	Very low	30.6	Very low	96 Å²	96	129.6 Å²	129.6	67%	0.671	77%	0.773	S	S	*	*			trans	-80.9	172.5	168.7	53.4	0	0	0	0	113.6
169	S	29.1	Very low	30.6	Very low	103 Å²	103	126.9 Å²	126.9	72%	0.72	77%	0.765	S	S	*	*			trans	73.8	158.3	148.8	48.4	0	0	0	0	120.8
170	S	33.2	Very low	30.9	Very low	103 Å²	103	126.8 Å²	126.8	72%	0.72	76%	0.764	S	S	*	*			trans	61	82.5	169.4	47.3	0	0	0	0	119.4
171	S	28.3	Very low	30.8	Very low	104 Å²	104	127.4 Å²	127.4	73%	0.727	77%	0.769	S	S	*	*				46.8	151.8	111.2	63.6	0	0	0	0	123.3
172	S	30.4	Very low	30.9	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	77%	0.774	S	S	*	*			trans	69	112.5	156.7	40.4	0	0	0	0	119
173	S	27.6	Very low	31.1	Very low	103 Å²	103	130.4 Å²	130.4	72%	0.72	77%	0.77	S	S	*	*			trans	2.3	132.9	135.3	-36.8	0	0	0	0	117.9
174	D	32	Very low	30.9	Very low	162 Å²	162	134.2 Å²	134.2	87%	0.866	78%	0.775	S	S	*	*				-161.4	163.7	86.6	-100.6	-16.8	0	0	0	113.1
175	S	26.9	Very low	30.8	Very low	108 Å²	108	131.6 Å²	131.6	76%	0.755	77%	0.771	S	S	*	*			trans	-91.4	137.2	-178.3	52	0	0	0	0	112.2
176	N	33	Very low	30.9	Very low	163 Å²	163	135.7 Å²	135.7	87%	0.872	77%	0.773	S	S	*	*			trans	-154.6	157.5	137	-132.2	-37.7	0	0	0	113.9
177	S	29.2	Very low	30.9	Very low	81 Å²	81	138.7 Å²	138.7	57%	0.566	78%	0.775	S	S	*	*			trans	-94	146.4	177	177.2	0	0	0	0	110.6
178	N	34.7	Very low	30.7	Very low	129 Å²	129	138.1 Å²	138.1	69%	0.69	77%	0.773	S	S	*	*				169.9	135.1	114.7	-82.9	-26.8	0	0	0	114.4
179	N	30.2	Very low	30.5	Very low	126 Å²	126	142.4 Å²	142.4	67%	0.674	78%	0.78	S	S	*	*			trans	51.8	108.8	138.7	-51.8	-18.3	0	0	0	120.4
180	N	35.2	Very low	30.5	Very low	157 Å²	157	141.9 Å²	141.9	84%	0.84	77%	0.774	S	S	*	*				170.8	104.9	113.8	-80.3	-25	0	0	0	107.5
181	L	30.6	Very low	30.2	Very low	162 Å²	162	143.7 Å²	143.7	85%	0.848	78%	0.776	S	S	*	*				78	70.8	62.4	-161.4	125	0	0	0	114
182	E	35.6	Very low	30.7	Very low	198 Å²	198	143.9 Å²	143.9	93%	0.925	77%	0.765	S	S	*	*			trans	-137.6	149.4	144.2	-139.2	179.2	144.3	0	0	108.7
183	L	30.5	Very low	30.6	Very low	143 Å²	143	147.5 Å²	147.5	75%	0.749	77%	0.767	S	S	*	*			trans	-144.6	138.4	-147.9	179.2	65.2	0	0	0	114.7
184	K	26.8	Very low	30.9	Very low	177 Å²	177	149.4 Å²	149.4	77%	0.77	77%	0.769	S	S	*	*			trans	86.9	147.7	173.5	-69.6	141.3	-179.9	177.3	0	117.7
185	D	30.8	Very low	31.1	Very low	159 Å²	159	145.7 Å²	145.7	85%	0.85	75%	0.749	S	S	*	*	S	Bend	trans	115.1	9.9	163.1	-68.6	10.4	0	0	0	118.8
186	K	30	Very low	31.5	Very low	209 Å²	209	143.4 Å²	143.4	91%	0.909	73%	0.732	S	S	*	*			trans	-137.7	89.4	166	-66.7	178.9	-174	166.7	0	112.7
187	I	30.5	Very low	31.6	Very low	156 Å²	156	139.3 Å²	139.3	80%	0.8	71%	0.709	S	S	*	*	S	Bend	trans	-125.2	130.6	165.8	-67.3	175.1	0	0	0	108.2
188	N	29.1	Very low	32.1	Very low	156 Å²	156	136.4 Å²	136.4	83%	0.834	69%	0.688	S	S	*	*			trans	55.8	58.7	170.8	-60.6	-0.5	0	0	0	117.1
189	K	26.2	Very low	32.1	Very low	187 Å²	187	130.9 Å²	130.9	81%	0.813	66%	0.659	S	S	*	*			trans	-93.7	112.4	150.9	-171.5	168.5	-171	165.6	0	108.4	N191	K189-N191 PolarHBondContact O-N 3.34Å
190	P	28.9	Very low	32.4	Very low	91 Å²	91	126 Å²	126	59%	0.591	64%	0.635	S	S	*	*			trans	-69.9	125.3	179.2	28	-33.4	0	0	0	110.2	H192	P190-H192 PolarHBondContact O-N 2.87Å
191	N	28	Very low	32.6	Very low	141 Å²	141	119.8 Å²	119.8	75%	0.754	60%	0.603	S	S	*	*			trans	-77.7	69.4	177.1	-83.8	-18.7	0	0	0	111.2	K189 K193	K189-N191 PolarHBondContact O-N 3.34Å; N191-K193 PolarHBondContact O-N 3.4Å
192	H	39.3	Very low	32.9	Very low	108 Å²	108	115 Å²	115	50%	0.5	58%	0.575	S	S	.	*			trans	-84.8	27.6	172.6	-81.7	-57.5	0	0	0	113.6	P190 D194	P190-H192 PolarHBondContact O-N 2.87Å; H192-D194 VanDerWaalsContact C-N 3.33Å; H192-D194 PolarHBondContact O-N 2.88Å
193	K	28.5	Very low	33.1	Very low	181 Å²	181	108 Å²	108	79%	0.787	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-27.4	-176	-79.8	-163.8	165.2	-161.8	0	113.8	N191	N191-K193 PolarHBondContact O-N 3.4Å
194	D	32.9	Very low	33.3	Very low	143 Å²	143	105.9 Å²	105.9	77%	0.765	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.3	38.4	-165.2	-45.9	-73	0	0	0	112.4	H192 P196	H192-D194 VanDerWaalsContact C-N 3.33Å; H192-D194 PolarHBondContact O-N 2.88Å; D194-P196 VanDerWaalsContact O-CD 3.26Å; D194-P196 WeakPolarHBondContact O-CD 3.4Å
195	L	36	Very low	33.9	Very low	84 Å²	84	98.7 Å²	98.7	44%	0.44	50%	0.499	S	S	.	.			trans	-89.4	98.1	173.4	-170.3	70.9	0	0	0	109.4	R285	L195-R285 PolarHBondContact O-NH1 2.7Å
196	P	35	Very low	34.2	Very low	61 Å²	61	95.5 Å²	95.5	40%	0.396	48%	0.48	S	S	.	.			trans	-60.3	150.4	-163.7	25.5	-36.2	0	0	0	112.2	R117 D194 D198 R285	R117-P196 HydrophobicContact CG-CG 4.3Å; D194-P196 VanDerWaalsContact O-CD 3.26Å; D194-P196 WeakPolarHBondContact O-CD 3.4Å; P196-D198 VanDerWaalsContact C-N 3.29Å; P196-D198 PolarHBondContact O-N 2.88Å; P196-R285 PolarHBondContact O-NH1 2.04Å
197	L	35.7	Very low	34.6	Very low	76 Å²	76	88.4 Å²	88.4	40%	0.398	45%	0.454	S	S	.	.			trans	-67.5	90.9	-179.9	-162.3	76.7	0	0	0	110	V201 K202 L205	L197-V201 HydrophobicContact CD1-CG1 3.97Å; L197-V201 HydrophobicContact CG-CG1 4.31Å; L197-K202 HydrophobicContact CB-CG 4.35Å; L197-K202 HydrophobicContact CD2-CG 3.86Å; L197-K202 HydrophobicContact CG-CG 4.17Å; L197-K202 WeakPolarHBondContact O-CE 3.4Å; L197-K202 WeakPolarHBondContact O-CG 3.36Å; L197-L205 HydrophobicContact CD2-CD2 4.23Å
198	D	39.1	Very low	34.9	Very low	21 Å²	21	84.2 Å²	84.2	11%	0.112	43%	0.432	C	S	.	.			trans	-33.5	144.8	171.1	171.8	59.7	0	0	0	113.9	Y78 P196 S200 V201 K202	Y78-D198 WeakPolarHBondContact CD1-OD1 3.3Å; Y78-D198 HydrophobicContact CE1-CB 4.46Å; Y78-D198 WeakPolarHBondContact CE1-OD1 3.35Å; Y78-D198 WeakPolarHBondContact CE1-OD2 3.44Å; P196-D198 VanDerWaalsContact C-N 3.29Å; P196-D198 PolarHBondContact O-N 2.88Å; D198-S200 WeakPolarHBondContact OD2-CB 3.36Å; D198-S200 PolarHBondContact OD2-N 3.12Å; D198-V201 HydrophobicContact CB-CB 4.41Å; D198-V201 HydrophobicContact CB-CG2 4.29Å; D198-V201 CarbonylContact O-C 3.46Å; D198-V201 WeakPolarHBondContact O-CA 3.47Å; D198-V201 WeakPolarHBondContact O-CB 3.28Å; D198-V201 PolarHBondContact O-N 3.18Å; D198-V201 PolarHBondContact OD2-N 3.1Å; D198-K202 PolarHBondContact O-N 3.02Å
199	S	35.2	Very low	35.2	Very low	13 Å²	13	79.6 Å²	79.6	9%	0.091	41%	0.41	C	S	.	.	H	α-helix	trans	-83.6	-19.3	-171.8	122	0	0	0	0	115.9	Y78 K79 K202 Q203	Y78-S199 CarbonylContact O-C 3.02Å; Y78-S199 WeakPolarHBondContact O-CA 3.37Å; Y78-S199 WeakPolarHBondContact O-CB 3.29Å; Y78-S199 PolarHBondContact O-N 3.26Å; Y78-S199 PolarHBondContact O-OG 3.14Å; K79-S199 WeakPolarHBondContact CB-OG 3.36Å; K79-S199 WeakPolarHBondContact CD-OG 2.99Å; K79-S199 WeakPolarHBondContact CG-OG 3.29Å; K79-S199 PolarHBondContact N-OG 3.28Å; S199-K202 PolarHBondContact O-N 3.39Å; S199-Q203 WeakPolarHBondContact O-CB 3.49Å; S199-Q203 WeakPolarHBondContact O-CG 3.46Å; S199-Q203 PolarHBondContact O-N 3.21Å; S199-Q203 PolarHBondContact O-NE2 3.23Å; S199-Q203 PolarHBondContact OG-NE2 3.12Å
200	S	35.8	Very low	35.6	Very low	23 Å²	23	76.5 Å²	76.5	16%	0.161	40%	0.401	C	S	.	.	H	α-helix	trans	-63.9	-37.1	162.6	-78.4	0	0	0	0	109.6	Y78 D198 Q203 M204	Y78-S200 WeakPolarHBondContact CA-OG 3.31Å; Y78-S200 WeakPolarHBondContact CD2-OG 3.4Å; Y78-S200 WeakPolarHBondContact CE2-OG 3.42Å; Y78-S200 PolarHBondContact O-N 2.96Å; D198-S200 WeakPolarHBondContact OD2-CB 3.36Å; D198-S200 PolarHBondContact OD2-N 3.12Å; S200-Q203 PolarHBondContact O-N 3.32Å; S200-M204 WeakPolarHBondContact O-CB 3.46Å; S200-M204 WeakPolarHBondContact O-CG 3.4Å; S200-M204 PolarHBondContact O-N 3.3Å
201	V	39.7	Very low	35.9	Very low	27 Å²	27	77.4 Å²	77.4	16%	0.164	40%	0.401	C	S	.	.	H	α-helix	trans	-72.2	-41.3	174.1	-175.7	0	0	0	0	112.1	L197 D198 Q203 L205 A281	L197-V201 HydrophobicContact CD1-CG1 3.97Å; L197-V201 HydrophobicContact CG-CG1 4.31Å; D198-V201 HydrophobicContact CB-CB 4.41Å; D198-V201 HydrophobicContact CB-CG2 4.29Å; D198-V201 CarbonylContact O-C 3.46Å; D198-V201 WeakPolarHBondContact O-CA 3.47Å; D198-V201 WeakPolarHBondContact O-CB 3.28Å; D198-V201 PolarHBondContact O-N 3.18Å; D198-V201 PolarHBondContact OD2-N 3.1Å; V201-Q203 VanDerWaalsContact C-N 3.27Å; V201-Q203 PolarHBondContact O-N 2.83Å; V201-L205 HydrophobicContact CG1-CD1 4.36Å; V201-L205 WeakPolarHBondContact O-CB 3.37Å; V201-L205 PolarHBondContact O-N 3.42Å; V201-A281 HydrophobicContact CG1-CB 3.68Å
202	K	37.9	Very low	36.2	Very low	62 Å²	62	77.2 Å²	77.2	27%	0.27	40%	0.4	S	S	.	.	H	α-helix	trans	-62.1	-32.6	169.8	-75.2	-177.7	176.8	-177.8	0	111.3	E157 L197 D198 S199 Q206	E157-K202 IonicContact OE1-NZ 2.7Å; E157-K202 PolarHBondContact OE1-NZ 3.01Å; E157-K202 IonicContact OE2-NZ 3.46Å; E157-K202 PolarHBondContact OE2-NZ 3.3Å; L197-K202 HydrophobicContact CB-CG 4.35Å; L197-K202 HydrophobicContact CD2-CG 3.86Å; L197-K202 HydrophobicContact CG-CG 4.17Å; L197-K202 WeakPolarHBondContact O-CE 3.4Å; L197-K202 WeakPolarHBondContact O-CG 3.36Å; D198-K202 PolarHBondContact O-N 3.02Å; S199-K202 PolarHBondContact O-N 3.39Å; K202-Q206 VanDerWaalsContact O-CB 3.25Å; K202-Q206 WeakPolarHBondContact O-CB 3.31Å; K202-Q206 WeakPolarHBondContact O-CG 3.31Å; K202-Q206 PolarHBondContact O-N 2.99Å; K202-Q206 PolarHBondContact O-OE1 3.11Å
203	Q	39.6	Very low	36	Very low	51 Å²	51	80.6 Å²	80.6	24%	0.238	42%	0.416	C	S	.	.	H	α-helix	trans	-78.7	-42.5	179.3	-78.5	170	74.1	0	0	112.9	T77 S199 S200 V201 L205 Q206 V207	T77-Q203 PolarHBondContact O-NE2 3.41Å; S199-Q203 WeakPolarHBondContact O-CB 3.49Å; S199-Q203 WeakPolarHBondContact O-CG 3.46Å; S199-Q203 PolarHBondContact O-N 3.21Å; S199-Q203 PolarHBondContact O-NE2 3.23Å; S199-Q203 PolarHBondContact OG-NE2 3.12Å; S200-Q203 PolarHBondContact O-N 3.32Å; V201-Q203 VanDerWaalsContact C-N 3.27Å; V201-Q203 PolarHBondContact O-N 2.83Å; Q203-L205 PolarHBondContact O-N 3.18Å; Q203-Q206 PolarHBondContact O-N 3.17Å; Q203-V207 WeakPolarHBondContact O-CB 3.48Å; Q203-V207 VanDerWaalsContact O-CG2 3.28Å; Q203-V207 WeakPolarHBondContact O-CG2 3.42Å; Q203-V207 PolarHBondContact O-N 3.32Å
204	M	34.8	Very low	36.2	Very low	97 Å²	97	80.3 Å²	80.3	48%	0.478	42%	0.415	S	S	.	.	H	α-helix	trans	-61.8	-34.9	169.4	-70.5	179.8	-159.6	0	0	111.3	S200 I208 F883	S200-M204 WeakPolarHBondContact O-CB 3.46Å; S200-M204 WeakPolarHBondContact O-CG 3.4Å; S200-M204 PolarHBondContact O-N 3.3Å; M204-I208 WeakPolarHBondContact O-CD1 3.44Å; M204-F883 HydrophobicContact CE-CE1 4.04Å
205	L	39.1	Very low	36	Very low	26 Å²	26	79.2 Å²	79.2	14%	0.136	41%	0.413	C	S	.	.	H	α-helix	trans	-63.9	-56.3	167.9	-100.8	63.4	0	0	0	111.2	L197 V201 Q203 V207 I208 T209 L277 P278 A281	L197-L205 HydrophobicContact CD2-CD2 4.23Å; V201-L205 HydrophobicContact CG1-CD1 4.36Å; V201-L205 WeakPolarHBondContact O-CB 3.37Å; V201-L205 PolarHBondContact O-N 3.42Å; Q203-L205 PolarHBondContact O-N 3.18Å; L205-V207 VanDerWaalsContact C-N 3.34Å; L205-V207 PolarHBondContact O-N 3Å; L205-I208 CarbonylContact O-C 3.57Å; L205-I208 PolarHBondContact O-N 3.07Å; L205-T209 WeakPolarHBondContact O-CG2 3.37Å; L205-T209 PolarHBondContact O-N 3.47Å; L205-T209 PolarHBondContact O-OG1 2.91Å; L205-T209 VanDerWaalsContact O-OG1 3.12Å; L205-L277 HydrophobicContact CB-CD2 4.47Å; L205-L277 HydrophobicContact CD1-CD2 3.79Å; L205-L277 HydrophobicContact CD1-CG 3.92Å; L205-L277 HydrophobicContact CG-CD2 3.99Å; L205-L277 HydrophobicContact CG-CG 4.5Å; L205-P278 HydrophobicContact CD2-CB 4.45Å; L205-P278 HydrophobicContact CD2-CG 4.29Å; L205-A281 HydrophobicContact CD1-CB 3.47Å; L205-A281 VanDerWaalsContact CD1-CB 3.47Å
206	Q	37.9	Very low	35.8	Very low	93 Å²	93	80.7 Å²	80.7	44%	0.435	43%	0.428	S	S	.	.	H	α-helix	trans	-54.7	-45.5	-176.6	-79.9	165.5	-22	0	0	112.5	K202 Q203 I208 T209 L210	K202-Q206 VanDerWaalsContact O-CB 3.25Å; K202-Q206 WeakPolarHBondContact O-CB 3.31Å; K202-Q206 WeakPolarHBondContact O-CG 3.31Å; K202-Q206 PolarHBondContact O-N 2.99Å; K202-Q206 PolarHBondContact O-OE1 3.11Å; Q203-Q206 PolarHBondContact O-N 3.17Å; Q206-I208 PolarHBondContact O-N 3.36Å; Q206-I208 VanDerWaalsContact O-N 3.08Å; Q206-T209 WeakPolarHBondContact CA-OG1 3.34Å; Q206-T209 PolarHBondContact O-N 3.5Å; Q206-L210 HydrophobicContact CB-CD1 4.21Å; Q206-L210 WeakPolarHBondContact O-CB 3.34Å; Q206-L210 WeakPolarHBondContact O-CD1 3.42Å; Q206-L210 WeakPolarHBondContact O-CG 3.27Å; Q206-L210 PolarHBondContact O-N 3.38Å
207	V	38.2	Very low	35.5	Very low	60 Å²	60	85.6 Å²	85.6	36%	0.364	45%	0.451	S	S	.	.	H	α-helix	trans	-58.9	-22.9	177.5	170.3	0	0	0	0	113.1	Q203 L205 F254	Q203-V207 WeakPolarHBondContact O-CB 3.48Å; Q203-V207 VanDerWaalsContact O-CG2 3.28Å; Q203-V207 WeakPolarHBondContact O-CG2 3.42Å; Q203-V207 PolarHBondContact O-N 3.32Å; L205-V207 VanDerWaalsContact C-N 3.34Å; L205-V207 PolarHBondContact O-N 3Å; V207-F254 HydrophobicContact CB-CE2 4.45Å; V207-F254 HydrophobicContact CG1-CD1 4.23Å; V207-F254 HydrophobicContact CG1-CD2 3.71Å; V207-F254 HydrophobicContact CG1-CE1 4.37Å; V207-F254 HydrophobicContact CG1-CE2 3.87Å; V207-F254 HydrophobicContact CG1-CG 3.9Å; V207-F254 HydrophobicContact CG1-CZ 4.2Å; V207-F254 HydrophobicContact CG2-CD2 4.33Å; V207-F254 HydrophobicContact CG2-CE1 4.26Å; V207-F254 HydrophobicContact CG2-CE2 3.62Å; V207-F254 HydrophobicContact CG2-CZ 3.58Å
208	I	36.5	Very low	35.3	Very low	68 Å²	68	89.1 Å²	89.1	35%	0.349	47%	0.47	S	S	.	.	H	α-helix	trans	-113.3	-13.9	-176.9	-58.9	170.4	0	0	0	112	M204 L205 Q206 L250 L277	M204-I208 WeakPolarHBondContact O-CD1 3.44Å; L205-I208 CarbonylContact O-C 3.57Å; L205-I208 PolarHBondContact O-N 3.07Å; Q206-I208 PolarHBondContact O-N 3.36Å; Q206-I208 VanDerWaalsContact O-N 3.08Å; I208-L250 HydrophobicContact CG2-CD2 4.26Å; I208-L277 HydrophobicContact CB-CD2 3.55Å; I208-L277 HydrophobicContact CD1-CD1 3.88Å; I208-L277 HydrophobicContact CD1-CD2 3.83Å; I208-L277 HydrophobicContact CG1-CD2 4.22Å; I208-L277 HydrophobicContact CG2-CD2 3.68Å
209	T	34.8	Very low	34.7	Very low	59 Å²	59	97.1 Å²	97.1	36%	0.362	51%	0.507	S	S	.	.	H	α-helix	trans	-96.5	-22.3	173.1	61.2	0	0	0	0	113.6	L205 Q206 D211 N212	L205-T209 WeakPolarHBondContact O-CG2 3.37Å; L205-T209 PolarHBondContact O-N 3.47Å; L205-T209 PolarHBondContact O-OG1 2.91Å; L205-T209 VanDerWaalsContact O-OG1 3.12Å; Q206-T209 WeakPolarHBondContact CA-OG1 3.34Å; Q206-T209 PolarHBondContact O-N 3.5Å; T209-D211 PolarHBondContact O-N 2.72Å; T209-D211 VanDerWaalsContact O-N 3.13Å; T209-N212 PolarHBondContact O-N 3.41Å; T209-N212 VanDerWaalsContact O-N 3.14Å
210	L	35.6	Very low	34.4	Very low	121 Å²	121	104.3 Å²	104.3	63%	0.634	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-17.6	-171.4	-88.5	166.8	0	0	0	115.7	Q206	Q206-L210 HydrophobicContact CB-CD1 4.21Å; Q206-L210 WeakPolarHBondContact O-CB 3.34Å; Q206-L210 WeakPolarHBondContact O-CD1 3.42Å; Q206-L210 WeakPolarHBondContact O-CG 3.27Å; Q206-L210 PolarHBondContact O-N 3.38Å
211	D	33.5	Very low	33.8	Very low	111 Å²	111	112.9 Å²	112.9	59%	0.594	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-7.7	177.5	-121	8.6	0	0	0	113.8	T209	T209-D211 PolarHBondContact O-N 2.72Å; T209-D211 VanDerWaalsContact O-N 3.13Å
212	N	34.8	Very low	33.3	Very low	137 Å²	137	119.4 Å²	119.4	73%	0.733	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-85.2	-6.9	177.4	-84.6	-40.1	0	0	0	113.9	T209 K214	T209-N212 PolarHBondContact O-N 3.41Å; T209-N212 VanDerWaalsContact O-N 3.14Å; N212-K214 PolarHBondContact O-N 3.48Å
213	E	36.4	Very low	32.7	Very low	178 Å²	178	124.8 Å²	124.8	83%	0.832	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-94.9	19.7	-174.5	-146.1	176.3	154.9	0	0	113.8
214	K	32.4	Very low	32.1	Very low	176 Å²	176	127.9 Å²	127.9	77%	0.765	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-112.4	1	-177.4	-95.5	175.4	-176.6	160.9	0	116.2	N212	N212-K214 PolarHBondContact O-N 3.48Å
215	T	28.2	Very low	31.7	Very low	119 Å²	119	128.8 Å²	128.8	73%	0.73	67%	0.665	S	S	*	*	S	Bend	trans	-111.6	116.9	178	-38.1	0	0	0	0	109.3	N217	T215-N217 PolarHBondContact O-N 3.19Å
216	P	32.1	Very low	31.2	Very low	116 Å²	116	135.7 Å²	135.7	75%	0.753	70%	0.701	S	S	*	*			trans	-71.2	131.4	-172.7	27.2	-33.7	0	0	0	112	N218	P216-N218 PolarHBondContact O-N 3.04Å
217	N	27.8	Very low	30.7	Very low	164 Å²	164	141.2 Å²	141.2	88%	0.877	72%	0.723	S	S	*	*			trans	-58.8	124.2	179.6	-70	-73	0	0	0	112.6	T215	T215-N217 PolarHBondContact O-N 3.19Å
218	N	31.4	Very low	30.1	Very low	150 Å²	150	141.7 Å²	141.7	80%	0.802	74%	0.741	S	S	*	*			trans	-137.3	126	152.9	-87.5	-36.4	0	0	0	109.7	P216	P216-N218 PolarHBondContact O-N 3.04Å
219	E	27	Very low	29.9	Very low	188 Å²	188	145.2 Å²	145.2	88%	0.879	77%	0.766	S	S	*	*			trans	41.6	89.4	150	-52.5	-169.7	130.9	0	0	119.9
220	M	28.3	Very low	29.6	Very low	165 Å²	165	151 Å²	151	81%	0.813	79%	0.786	S	S	*	*				-156.2	106.3	119.2	-161.2	153	66.1	0	0	113.8
221	K	24.7	Very low	29.4	Very low	203 Å²	203	151.7 Å²	151.7	88%	0.883	79%	0.79	S	S	*	*			trans	-102.3	95.2	156	-84.9	-174.9	176.1	176.9	0	108.7
222	Q	27.9	Very low	29.4	Very low	163 Å²	163	154 Å²	154	76%	0.762	80%	0.802	S	S	*	*			trans	-165.5	160.7	155.3	-115.5	150	11.8	0	0	115.1
223	Q	25.4	Very low	29.2	Very low	175 Å²	175	154.5 Å²	154.5	82%	0.818	81%	0.805	S	S	*	*			trans	-72.9	138.5	177.2	-53.8	120	-66.4	0	0	110.9
224	V	27.5	Very low	29.4	Very low	117 Å²	117	153.4 Å²	153.4	71%	0.709	81%	0.805	S	S	*	*			trans	-130.7	114.3	162.7	-175.7	0	0	0	0	109.4
225	P	26	Very low	29.8	Very low	115 Å²	115	151.7 Å²	151.7	75%	0.747	80%	0.804	S	S	*	*			trans	-82.7	132.6	174.2	32.1	-31.9	0	0	0	110.9	K227	P225-K227 PolarHBondContact O-N 3.16Å
226	I	28.5	Very low	30.2	Very low	172 Å²	172	150.8 Å²	150.8	88%	0.882	80%	0.795	S	S	*	*			trans	-71.5	104	-178	-57.9	172.8	0	0	0	110.8
227	K	27.5	Very low	30.6	Very low	208 Å²	208	151.6 Å²	151.6	90%	0.904	79%	0.793	S	S	*	*			trans	-135.4	100.1	157.7	-100	-177.8	175.7	174.9	0	108.3	P225	P225-K227 PolarHBondContact O-N 3.16Å
228	G	25.9	Very low	31.1	Very low	71 Å²	71	150.2 Å²	150.2	73%	0.732	78%	0.779	S	S	*	*			trans	-71.3	151.5	-174.4	0	0	0	0	0	114.1
229	T	31.4	Very low	31.5	Very low	142 Å²	142	150.1 Å²	150.1	87%	0.871	77%	0.774	S	S	*	*			trans	-126.7	154.3	146.4	-60	0	0	0	0	106.3
230	K	30	Very low	32	Very low	181 Å²	181	147.1 Å²	147.1	79%	0.787	76%	0.76	S	S	*	*			trans	-75.4	157.4	178.6	-60.6	178.1	171.5	-166.9	0	111.1
231	D	31.1	Very low	32.6	Very low	135 Å²	135	144 Å²	144	72%	0.722	75%	0.746	S	S	*	*				156.8	158.6	121	-73.8	-21.1	0	0	0	108.8
232	N	33.8	Very low	33.6	Very low	159 Å²	159	139.5 Å²	139.5	85%	0.85	73%	0.728	S	S	*	*			trans	76.1	77.1	-172.2	-47.9	-27.3	0	0	0	115.3
233	D	30.4	Very low	34.1	Very low	147 Å²	147	136.8 Å²	136.8	79%	0.786	72%	0.718	S	S	*	*			trans	-79.8	113.5	158.7	-55.6	-72.9	0	0	0	109
234	D	40.3	Very low	34.9	Very low	156 Å²	156	133.3 Å²	133.3	83%	0.834	71%	0.705	S	S	*	*	S	Bend	trans	-171.6	-35.2	161.6	-101.9	-27.8	0	0	0	112.6
235	D	40.5	Very low	35.9	Very low	140 Å²	140	132.7 Å²	132.7	75%	0.749	69%	0.694	S	S	*	*	S	Bend	trans	-81.6	-21.8	-174.4	-87.2	-54	0	0	0	115.7	D237 K238	D235-D237 VanDerWaalsContact C-N 3.33Å; D235-D237 PolarHBondContact O-N 3.06Å; D235-K238 PolarHBondContact O-N 3.48Å
236	N	35.7	Very low	36.7	Very low	99 Å²	99	131.6 Å²	131.6	53%	0.529	68%	0.682	S	S	.	*	H	α-helix	trans	-61.7	-31.6	-169.6	-93.8	-53.7	0	0	0	114.9	K238 E239 Q240	N236-K238 PolarHBondContact O-N 3.01Å; N236-E239 PolarHBondContact O-N 3.46Å; N236-Q240 PolarHBondContact O-N 2.81Å
237	D	40.8	Very low	37.1	Very low	133 Å²	133	125.9 Å²	125.9	71%	0.711	65%	0.651	S	S	*	*	H	α-helix	trans	-66.7	-26	-176.8	-73.7	-10.4	0	0	0	112	D235 L241	D235-D237 VanDerWaalsContact C-N 3.33Å; D235-D237 PolarHBondContact O-N 3.06Å; D237-L241 WeakPolarHBondContact O-CB 3.34Å; D237-L241 PolarHBondContact O-N 3.4Å; D237-L241 VanDerWaalsContact O-N 3.11Å
238	K	40.1	Very low	37.8	Very low	136 Å²	136	122.6 Å²	122.6	59%	0.591	64%	0.639	S	S	*	*	H	α-helix	trans	-78	-40.3	-180	-162.5	178.4	179.3	-171.7	0	112.2	D235 N236 L241 E242	D235-K238 PolarHBondContact O-N 3.48Å; N236-K238 PolarHBondContact O-N 3.01Å; K238-L241 PolarHBondContact O-N 3.22Å; K238-E242 PolarHBondContact O-N 2.96Å
239	E	38.9	Very low	38.4	Very low	147 Å²	147	126.5 Å²	126.5	69%	0.687	64%	0.636	S	S	*	*	H	α-helix	trans	-66.9	-37.5	175.9	-166.9	175.2	169	0	0	111.3	N236 L243	N236-E239 PolarHBondContact O-N 3.46Å; E239-L243 WeakPolarHBondContact O-CB 3.43Å; E239-L243 PolarHBondContact O-N 2.89Å
240	Q	38.4	Very low	38.5	Very low	125 Å²	125	123.5 Å²	123.5	58%	0.584	61%	0.614	S	S	*	*	H	α-helix	trans	-65.9	-37.9	170.7	-70.9	-160.8	13.1	0	0	112.9	N236 L243 N244	N236-Q240 PolarHBondContact O-N 2.81Å; Q240-L243 PolarHBondContact O-N 3.35Å; Q240-N244 WeakPolarHBondContact O-CB 3.48Å; Q240-N244 VanDerWaalsContact O-CG 3.26Å; Q240-N244 PolarHBondContact O-N 3.22Å; Q240-N244 PolarHBondContact O-ND2 2.94Å
241	L	39.5	Very low	39.1	Very low	100 Å²	100	116.6 Å²	116.6	52%	0.524	59%	0.587	S	S	.	*	H	α-helix	trans	-65.7	-43.4	177.7	-173.5	63.2	0	0	0	111.8	D237 K238 N244 Q245	D237-L241 WeakPolarHBondContact O-CB 3.34Å; D237-L241 PolarHBondContact O-N 3.4Å; D237-L241 VanDerWaalsContact O-N 3.11Å; K238-L241 PolarHBondContact O-N 3.22Å; L241-N244 PolarHBondContact O-N 3.24Å; L241-Q245 WeakPolarHBondContact O-CG 3.11Å; L241-Q245 PolarHBondContact O-N 3.27Å
242	E	45.4	Very low	39.3	Very low	108 Å²	108	112.1 Å²	112.1	51%	0.505	57%	0.573	S	S	.	*	H	α-helix	trans	-66.2	-41.2	175.6	-71.6	-174.4	-166.6	0	0	111.8	K238 N244 Q245 I246	K238-E242 PolarHBondContact O-N 2.96Å; E242-N244 VanDerWaalsContact C-N 3.33Å; E242-N244 PolarHBondContact O-N 3.2Å; E242-Q245 PolarHBondContact O-N 3.07Å; E242-I246 WeakPolarHBondContact O-CB 3.45Å; E242-I246 WeakPolarHBondContact O-CD1 3.47Å; E242-I246 VanDerWaalsContact O-CG1 3.26Å; E242-I246 WeakPolarHBondContact O-CG1 3.38Å; E242-I246 PolarHBondContact O-N 3.03Å
243	L	39.1	Very low	39.4	Very low	107 Å²	107	113.3 Å²	113.3	56%	0.56	57%	0.574	S	S	*	*	H	α-helix	trans	-60.9	-40.9	174.9	-174.5	64.5	0	0	0	112.4	E239 Q240 I246 M247	E239-L243 WeakPolarHBondContact O-CB 3.43Å; E239-L243 PolarHBondContact O-N 2.89Å; Q240-L243 PolarHBondContact O-N 3.35Å; L243-I246 PolarHBondContact O-N 3.26Å; L243-M247 WeakPolarHBondContact O-CG 3.31Å; L243-M247 PolarHBondContact O-N 3.11Å
244	N	43	Very low	39.6	Very low	101 Å²	101	113.1 Å²	113.1	54%	0.54	57%	0.566	S	S	.	*	H	α-helix	trans	-66.1	-42.2	175.7	-74.4	-40.2	0	0	0	111.8	Q240 L241 E242 I246 M247 E248	Q240-N244 WeakPolarHBondContact O-CB 3.48Å; Q240-N244 VanDerWaalsContact O-CG 3.26Å; Q240-N244 PolarHBondContact O-N 3.22Å; Q240-N244 PolarHBondContact O-ND2 2.94Å; L241-N244 PolarHBondContact O-N 3.24Å; E242-N244 VanDerWaalsContact C-N 3.33Å; E242-N244 PolarHBondContact O-N 3.2Å; N244-I246 VanDerWaalsContact C-N 3.33Å; N244-I246 PolarHBondContact O-N 2.98Å; N244-M247 PolarHBondContact O-N 3.39Å; N244-E248 WeakPolarHBondContact O-CB 3.49Å; N244-E248 PolarHBondContact O-N 3.02Å
245	Q	46.7	Very low	39.2	Very low	104 Å²	104	108 Å²	108	49%	0.486	54%	0.538	S	S	.	.	H	α-helix	trans	-65	-33.9	175.1	-73.2	179.6	5.2	0	0	112.9	L241 E242 K249	L241-Q245 WeakPolarHBondContact O-CG 3.11Å; L241-Q245 PolarHBondContact O-N 3.27Å; E242-Q245 PolarHBondContact O-N 3.07Å; Q245-K249 PolarHBondContact O-N 3.41Å
246	I	43.9	Very low	38.9	Very low	93 Å²	93	106.4 Å²	106.4	48%	0.477	53%	0.534	S	S	.	.	H	α-helix	trans	-66.4	-44.4	173.4	-71	163.1	0	0	0	110.3	E242 L243 N244 K249 L250	E242-I246 WeakPolarHBondContact O-CB 3.45Å; E242-I246 WeakPolarHBondContact O-CD1 3.47Å; E242-I246 VanDerWaalsContact O-CG1 3.26Å; E242-I246 WeakPolarHBondContact O-CG1 3.38Å; E242-I246 PolarHBondContact O-N 3.03Å; L243-I246 PolarHBondContact O-N 3.26Å; N244-I246 VanDerWaalsContact C-N 3.33Å; N244-I246 PolarHBondContact O-N 2.98Å; I246-K249 PolarHBondContact O-N 3.2Å; I246-L250 HydrophobicContact CG2-CD1 3.83Å; I246-L250 HydrophobicContact CG2-CG 4.47Å; I246-L250 WeakPolarHBondContact O-CB 3.49Å; I246-L250 VanDerWaalsContact O-CG 3.26Å; I246-L250 WeakPolarHBondContact O-CG 3.18Å; I246-L250 PolarHBondContact O-N 3.26Å
247	M	37.1	Very low	38.9	Very low	51 Å²	51	106.6 Å²	106.6	25%	0.251	54%	0.539	S	S	.	.	H	α-helix	trans	-65.9	-35.2	175.5	-74.2	-62.1	-62.6	0	0	113.2	L243 N244 L250 T251 T267	L243-M247 WeakPolarHBondContact O-CG 3.31Å; L243-M247 PolarHBondContact O-N 3.11Å; N244-M247 PolarHBondContact O-N 3.39Å; M247-L250 PolarHBondContact O-N 3.16Å; M247-L250 HydrophobicContact SD-CD1 4.18Å; M247-T251 PolarHBondContact O-N 3.16Å; M247-T251 PolarHBondContact O-OG1 3.41Å; M247-T267 HydrophobicContact CE-CG2 4.06Å
248	E	42.7	Very low	38.3	Very low	139 Å²	139	110.1 Å²	110.1	65%	0.65	55%	0.548	S	S	*	.	H	α-helix	trans	-67.2	-43.5	174.5	-168.6	170.8	-149.1	0	0	111.2	N244 T251 G252	N244-E248 WeakPolarHBondContact O-CB 3.49Å; N244-E248 PolarHBondContact O-N 3.02Å; E248-T251 PolarHBondContact O-N 3.09Å; E248-T251 PolarHBondContact O-OG1 3.33Å; E248-G252 WeakPolarHBondContact O-CA 3.46Å; E248-G252 PolarHBondContact O-N 3.12Å
249	K	37	Very low	38	Very low	153 Å²	153	107.1 Å²	107.1	67%	0.665	54%	0.544	S	S	*	.	H	α-helix	trans	-60.7	-46.2	170.7	-81	-177	170.7	-174.6	0	113.1	Q245 I246 T251 G252	Q245-K249 PolarHBondContact O-N 3.41Å; I246-K249 PolarHBondContact O-N 3.2Å; K249-T251 PolarHBondContact O-N 3.19Å; K249-T251 VanDerWaalsContact O-N 3.07Å; K249-G252 PolarHBondContact O-N 3.46Å
250	L	33.9	Very low	37.7	Very low	79 Å²	79	104.1 Å²	104.1	41%	0.414	53%	0.529	S	S	.	.	H	α-helix	trans	-62.1	-13.9	178.1	-76.2	167.5	0	0	0	113.6	I208 I246 M247	I208-L250 HydrophobicContact CG2-CD2 4.26Å; I246-L250 HydrophobicContact CG2-CD1 3.83Å; I246-L250 HydrophobicContact CG2-CG 4.47Å; I246-L250 WeakPolarHBondContact O-CB 3.49Å; I246-L250 VanDerWaalsContact O-CG 3.26Å; I246-L250 WeakPolarHBondContact O-CG 3.18Å; I246-L250 PolarHBondContact O-N 3.26Å; M247-L250 PolarHBondContact O-N 3.16Å; M247-L250 HydrophobicContact SD-CD1 4.18Å
251	T	42	Very low	37.6	Very low	36 Å²	36	100.4 Å²	100.4	22%	0.221	51%	0.513	C	S	.	.	H	α-helix	trans	-116	-16.9	177.4	53.3	0	0	0	0	114.3	M247 E248 K249 L255	M247-T251 PolarHBondContact O-N 3.16Å; M247-T251 PolarHBondContact O-OG1 3.41Å; E248-T251 PolarHBondContact O-N 3.09Å; E248-T251 PolarHBondContact O-OG1 3.33Å; K249-T251 PolarHBondContact O-N 3.19Å; K249-T251 VanDerWaalsContact O-N 3.07Å; T251-L255 HydrophobicContact CG2-CD1 4.15Å
252	G	35.5	Very low	37.5	Very low	41 Å²	41	99 Å²	99	42%	0.423	51%	0.51	S	S	.	.	H	α-helix	trans	-76.5	-39.4	-170.2	0	0	0	0	0	116.1	E248 K249 T256	E248-G252 WeakPolarHBondContact O-CA 3.46Å; E248-G252 PolarHBondContact O-N 3.12Å; K249-G252 PolarHBondContact O-N 3.46Å; G252-T256 VanDerWaalsContact O-CG2 3.24Å; G252-T256 WeakPolarHBondContact O-CG2 3.36Å
253	E	37.5	Very low	37	Very low	185 Å²	185	96.8 Å²	96.8	86%	0.864	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-20.2	-174.3	-69.9	-166.6	120.4	0	0	114.7
254	F	32.8	Very low	37.2	Very low	143 Å²	143	97 Å²	97	63%	0.627	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-4.9	-172.5	-133.3	-92.6	0	0	0	115.5	V207	V207-F254 HydrophobicContact CB-CE2 4.45Å; V207-F254 HydrophobicContact CG1-CD1 4.23Å; V207-F254 HydrophobicContact CG1-CD2 3.71Å; V207-F254 HydrophobicContact CG1-CE1 4.37Å; V207-F254 HydrophobicContact CG1-CE2 3.87Å; V207-F254 HydrophobicContact CG1-CG 3.9Å; V207-F254 HydrophobicContact CG1-CZ 4.2Å; V207-F254 HydrophobicContact CG2-CD2 4.33Å; V207-F254 HydrophobicContact CG2-CE1 4.26Å; V207-F254 HydrophobicContact CG2-CE2 3.62Å; V207-F254 HydrophobicContact CG2-CZ 3.58Å
255	L	33.7	Very low	37.3	Very low	47 Å²	47	95.4 Å²	95.4	25%	0.246	50%	0.498	C	S	.	.	S	Bend	trans	-124.5	9.8	-171.8	-62	169.6	0	0	0	114.1	T251 T257 N263	T251-L255 HydrophobicContact CG2-CD1 4.15Å; L255-T257 VanDerWaalsContact C-N 3.28Å; L255-T257 PolarHBondContact O-N 3.38Å; L255-N263 WeakPolarHBondContact CD1-OD1 3.36Å
256	T	33.5	Very low	37.5	Very low	108 Å²	108	92.6 Å²	92.6	66%	0.663	49%	0.486	S	S	*	.			trans	-74.2	-13.4	-178.4	48.3	0	0	0	0	114.3	G252 K258	G252-T256 VanDerWaalsContact O-CG2 3.24Å; G252-T256 WeakPolarHBondContact O-CG2 3.36Å; T256-K258 PolarHBondContact O-N 3.41Å; T256-K258 VanDerWaalsContact O-N 3.15Å
257	T	35	Very low	37.8	Very low	103 Å²	103	89.9 Å²	89.9	63%	0.632	47%	0.474	S	S	*	.	S	Bend	trans	-80.8	89	172.7	40.9	0	0	0	0	111.5	L255 S259	L255-T257 VanDerWaalsContact C-N 3.28Å; L255-T257 PolarHBondContact O-N 3.38Å; T257-S259 PolarHBondContact O-N 2.99Å
258	K	29.1	Very low	38.7	Very low	207 Å²	207	90.5 Å²	90.5	90%	0.9	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-23.1	89.6	175.1	-69.6	179.4	176.5	175.7	0	115.4	T256	T256-K258 PolarHBondContact O-N 3.41Å; T256-K258 VanDerWaalsContact O-N 3.15Å
259	S	32.6	Very low	39.7	Very low	72 Å²	72	84.5 Å²	84.5	50%	0.503	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	170.7	-38	153.1	42.4	0	0	0	0	113.3	T257 L261 N882	T257-S259 PolarHBondContact O-N 2.99Å; S259-L261 PolarHBondContact O-N 3.49Å; S259-L261 VanDerWaalsContact O-N 3.17Å; S259-N882 VanDerWaalsContact C-ND2 3.32Å; S259-N882 PolarHBondContact O-ND2 3.5Å
260	F	33.9	Very low	41.2	Very low	84 Å²	84	80.3 Å²	80.3	37%	0.368	44%	0.437	S	S	.	.	S	Bend	trans	-75.5	105.2	-166	-86.7	-110.4	0	0	0	113.8	N882 F883	F260-N882 WeakPolarHBondContact CD1-OD1 3.1Å; F260-N882 WeakPolarHBondContact CG-OD1 3.38Å; F260-F883 HydrophobicContact CE1-CB 3.91Å
261	L	36.4	Very low	42.7	Very low	47 Å²	47	82.4 Å²	82.4	25%	0.246	45%	0.449	C	S	.	.			trans	63	145	172.3	-68.6	152.4	0	0	0	116.1	S259 N263 I266 A884	S259-L261 PolarHBondContact O-N 3.49Å; S259-L261 VanDerWaalsContact O-N 3.17Å; L261-N263 PolarHBondContact O-N 3.31Å; L261-I266 HydrophobicContact CB-CD1 3.67Å; L261-I266 HydrophobicContact CB-CG1 4.1Å; L261-I266 HydrophobicContact CD1-CD1 3.55Å; L261-I266 HydrophobicContact CD1-CG1 4.19Å; L261-I266 HydrophobicContact CD2-CD1 4.49Å; L261-I266 HydrophobicContact CD2-CG1 4.31Å; L261-I266 HydrophobicContact CG-CD1 4.04Å; L261-I266 HydrophobicContact CG-CG1 4.39Å; L261-A884 HydrophobicContact CB-CB 4.32Å; L261-A884 HydrophobicContact CD1-CB 4.48Å; L261-A884 HydrophobicContact CD2-CB 3.7Å; L261-A884 HydrophobicContact CG-CB 3.5Å
262	P	36	Very low	44.1	Very low	72 Å²	72	86 Å²	86	47%	0.468	46%	0.461	S	S	.	.			trans	-75.2	115.2	162	-4.8	22	0	0	0	108.8	T264 L265 I266	P262-T264 PolarHBondContact O-N 3.39Å; P262-T264 VanDerWaalsContact O-N 3.1Å; P262-L265 HydrophobicContact CB-CB 4.16Å; P262-L265 HydrophobicContact CG-CB 4.22Å; P262-L265 PolarHBondContact O-N 3.08Å; P262-I266 PolarHBondContact O-N 3.1Å
263	N	36.4	Very low	45.9	Very low	61 Å²	61	84.6 Å²	84.6	33%	0.326	44%	0.443	S	S	.	.	H	α-helix	trans	-51.9	-36.1	179.1	-61.4	12.9	0	0	0	112	L255 L261 L265 T267	L255-N263 WeakPolarHBondContact CD1-OD1 3.36Å; L261-N263 PolarHBondContact O-N 3.31Å; N263-L265 VanDerWaalsContact C-N 3.35Å; N263-L265 PolarHBondContact O-N 2.72Å; N263-T267 WeakPolarHBondContact O-CB 3.26Å; N263-T267 PolarHBondContact O-N 3.47Å; N263-T267 PolarHBondContact O-OG1 2.89Å
264	T	43.8	Very low	47.3	Very low	111 Å²	111	80.5 Å²	80.5	68%	0.681	43%	0.433	S	S	*	.	H	α-helix	trans	-59	-39.5	175.1	52	0	0	0	0	113.2	P262 S268	P262-T264 PolarHBondContact O-N 3.39Å; P262-T264 VanDerWaalsContact O-N 3.1Å; T264-S268 WeakPolarHBondContact O-CB 3.36Å; T264-S268 PolarHBondContact O-N 2.93Å
265	L	43.6	Very low	49.1	Very low	68 Å²	68	74.5 Å²	74.5	36%	0.356	41%	0.407	S	S	.	.	H	α-helix	trans	-75.3	-41.7	-176.2	-155.2	80.4	0	0	0	111.5	P262 N263 S268 H269 W888	P262-L265 HydrophobicContact CB-CB 4.16Å; P262-L265 HydrophobicContact CG-CB 4.22Å; P262-L265 PolarHBondContact O-N 3.08Å; N263-L265 VanDerWaalsContact C-N 3.35Å; N263-L265 PolarHBondContact O-N 2.72Å; L265-S268 PolarHBondContact O-N 2.76Å; L265-S268 PolarHBondContact O-OG 2.85Å; L265-H269 PolarHBondContact O-N 3.29Å; L265-H269 VanDerWaalsContact O-N 3.12Å; L265-W888 HydrophobicContact CD2-CD2 4.14Å; L265-W888 HydrophobicContact CD2-CE3 4.04Å; L265-W888 HydrophobicContact CD2-CH2 3.79Å; L265-W888 HydrophobicContact CD2-CZ2 3.88Å; L265-W888 HydrophobicContact CD2-CZ3 3.88Å; L265-W888 HydrophobicContact CG-CH2 4.26Å; L265-W888 HydrophobicContact CG-CZ2 4.46Å
266	I	50.3	Low	50.7	Low	44 Å²	44	75 Å²	75	23%	0.226	42%	0.415	C	S	.	.	H	α-helix	trans	-59.4	-51.1	172.8	-57.6	177.2	0	0	0	109.9	L261 P262 S268 H269 F270	L261-I266 HydrophobicContact CB-CD1 3.67Å; L261-I266 HydrophobicContact CB-CG1 4.1Å; L261-I266 HydrophobicContact CD1-CD1 3.55Å; L261-I266 HydrophobicContact CD1-CG1 4.19Å; L261-I266 HydrophobicContact CD2-CD1 4.49Å; L261-I266 HydrophobicContact CD2-CG1 4.31Å; L261-I266 HydrophobicContact CG-CD1 4.04Å; L261-I266 HydrophobicContact CG-CG1 4.39Å; P262-I266 PolarHBondContact O-N 3.1Å; I266-S268 VanDerWaalsContact C-N 3.28Å; I266-S268 PolarHBondContact O-N 3.2Å; I266-H269 WeakPolarHBondContact O-CA 3.01Å; I266-H269 WeakPolarHBondContact O-CB 3.05Å; I266-H269 PolarHBondContact O-N 3.46Å; I266-F270 HydrophobicContact CG2-CD2 3.59Å; I266-F270 HydrophobicContact CG2-CE2 3.59Å; I266-F270 PolarHBondContact O-N 2.75Å
267	T	50.7	Low	52.2	Low	36 Å²	36	71.4 Å²	71.4	22%	0.221	39%	0.391	C	S	.	.	H	α-helix	trans	-58.1	-41.6	179.5	-57.3	0	0	0	0	111	M247 N263 H269 N271	M247-T267 HydrophobicContact CE-CG2 4.06Å; N263-T267 WeakPolarHBondContact O-CB 3.26Å; N263-T267 PolarHBondContact O-N 3.47Å; N263-T267 PolarHBondContact O-OG1 2.89Å; T267-H269 VanDerWaalsContact C-N 3.28Å; T267-H269 PolarHBondContact O-N 3.45Å; T267-N271 WeakPolarHBondContact O-CB 3.48Å; T267-N271 PolarHBondContact O-N 2.83Å; T267-N271 PolarHBondContact O-OD1 3.05Å
268	S	57.5	Low	53.8	Low	64 Å²	64	69.8 Å²	69.8	45%	0.448	38%	0.383	S	S	.	.	H	α-helix	trans	-64.6	-27.7	175	80.5	0	0	0	0	114.3	T264 L265 I266 K272	T264-S268 WeakPolarHBondContact O-CB 3.36Å; T264-S268 PolarHBondContact O-N 2.93Å; L265-S268 PolarHBondContact O-N 2.76Å; L265-S268 PolarHBondContact O-OG 2.85Å; I266-S268 VanDerWaalsContact C-N 3.28Å; I266-S268 PolarHBondContact O-N 3.2Å; S268-K272 WeakPolarHBondContact O-CB 3.46Å; S268-K272 PolarHBondContact O-N 3.35Å
269	H	63.1	Low	55.8	Low	14 Å²	14	62.7 Å²	62.7	7%	0.065	35%	0.352	C	S	.	.	H	α-helix	trans	-76	-53.9	175.8	179.5	-71.5	0	0	0	110.5	L265 I266 T267 N271 K272 Y273 I294 F295	L265-H269 PolarHBondContact O-N 3.29Å; L265-H269 VanDerWaalsContact O-N 3.12Å; I266-H269 WeakPolarHBondContact O-CA 3.01Å; I266-H269 WeakPolarHBondContact O-CB 3.05Å; I266-H269 PolarHBondContact O-N 3.46Å; T267-H269 VanDerWaalsContact C-N 3.28Å; T267-H269 PolarHBondContact O-N 3.45Å; H269-N271 PolarHBondContact O-N 2.99Å; H269-K272 CarbonylContact O-C 3.34Å; H269-K272 PolarHBondContact O-N 3.26Å; H269-K272 VanDerWaalsContact O-N 3.1Å; H269-Y273 AromaticContact CD2-CD2 3.88Å; H269-Y273 AromaticContact CG-CD2 4Å; H269-Y273 AromaticContact NE2-CD2 3.88Å; H269-Y273 WeakPolarHBondContact O-CD2 3.36Å; H269-Y273 PolarHBondContact O-N 3.38Å; H269-I294 PolarHBondContact CE1-O 3.17Å; H269-I294 PolarHBondContact NE2-O 3.19Å; H269-F295 AromaticContact CD2-CE1 3.68Å; H269-F295 AromaticContact CD2-CZ 3.98Å
270	F	67.3	Low	57.6	Low	65 Å²	65	59.9 Å²	59.9	29%	0.285	33%	0.332	S	S	.	.	H	α-helix	trans	-62.4	-41.1	179.3	-78.8	-78.8	0	0	0	112.7	I266 K272 Y273 P274 L277 L280	I266-F270 HydrophobicContact CG2-CD2 3.59Å; I266-F270 HydrophobicContact CG2-CE2 3.59Å; I266-F270 PolarHBondContact O-N 2.75Å; F270-K272 PolarHBondContact O-N 3.17Å; F270-Y273 CarbonylContact O-C 3.58Å; F270-Y273 VanDerWaalsContact O-C 3.24Å; F270-Y273 PolarHBondContact O-N 2.84Å; F270-P274 WeakPolarHBondContact O-CA 3.45Å; F270-L277 HydrophobicContact CZ-CD1 4.31Å; F270-L280 HydrophobicContact CE1-CD2 3.56Å; F270-L280 HydrophobicContact CE2-CD2 4.34Å; F270-L280 HydrophobicContact CZ-CD2 3.36Å
271	N	67.1	Low	59.2	Low	122 Å²	122	56.5 Å²	56.5	65%	0.652	32%	0.319	S	S	*	.	H	α-helix	trans	-63.9	-23.9	177.1	-69	6.2	0	0	0	112.8	T267 H269	T267-N271 WeakPolarHBondContact O-CB 3.48Å; T267-N271 PolarHBondContact O-N 2.83Å; T267-N271 PolarHBondContact O-OD1 3.05Å; H269-N271 PolarHBondContact O-N 2.99Å
272	K	71	Confident	61.2	Low	111 Å²	111	56.8 Å²	56.8	48%	0.483	32%	0.319	S	S	.	.	H	α-helix	trans	-94.9	-27.3	176.2	-166.1	179.2	177.3	-159.4	0	113	S268 H269 F270 D310	S268-K272 WeakPolarHBondContact O-CB 3.46Å; S268-K272 PolarHBondContact O-N 3.35Å; H269-K272 CarbonylContact O-C 3.34Å; H269-K272 PolarHBondContact O-N 3.26Å; H269-K272 VanDerWaalsContact O-N 3.1Å; F270-K272 PolarHBondContact O-N 3.17Å; K272-D310 PolarHBondContact NZ-O 3.22Å
273	Y	73.2	Confident	63.1	Low	13 Å²	13	53.4 Å²	53.4	5%	0.051	30%	0.297	C	S	.	.	S	Bend	trans	-135.5	75.2	-175.6	-47.2	-61	0	0	0	110.2	H269 F270 L275 F295 L308 D310 S311	H269-Y273 AromaticContact CD2-CD2 3.88Å; H269-Y273 AromaticContact CG-CD2 4Å; H269-Y273 AromaticContact NE2-CD2 3.88Å; H269-Y273 WeakPolarHBondContact O-CD2 3.36Å; H269-Y273 PolarHBondContact O-N 3.38Å; F270-Y273 CarbonylContact O-C 3.58Å; F270-Y273 VanDerWaalsContact O-C 3.24Å; F270-Y273 PolarHBondContact O-N 2.84Å; Y273-L275 VanDerWaalsContact C-N 3.27Å; Y273-L275 PolarHBondContact O-N 3.46Å; Y273-F295 AromaticContact CE2-CD1 3.98Å; Y273-F295 HydrophobicContact CE2-CD1 3.98Å; Y273-F295 AromaticContact CE2-CE1 3.83Å; Y273-F295 HydrophobicContact CE2-CE1 3.83Å; Y273-L308 HydrophobicContact CD1-CB 4.44Å; Y273-L308 HydrophobicContact CD1-CD2 3.47Å; Y273-L308 VanDerWaalsContact CD1-CD2 3.47Å; Y273-L308 HydrophobicContact CD2-CD2 4.34Å; Y273-L308 HydrophobicContact CE1-CB 4.4Å; Y273-L308 HydrophobicContact CE1-CD2 4.21Å; Y273-L308 HydrophobicContact CG-CD2 3.54Å; Y273-D310 PolarHBondContact OH-O 3.35Å; Y273-S311 WeakPolarHBondContact OH-CA 3.28Å
274	P	67.2	Low	64.9	Low	99 Å²	99	52.9 Å²	52.9	64%	0.643	29%	0.294	S	S	*	.			trans	-72.9	79.5	-178.1	30.4	-36	0	0	0	111.2	F270	F270-P274 WeakPolarHBondContact O-CA 3.45Å
275	L	69.1	Low	66.2	Low	17 Å²	17	49.7 Å²	49.7	9%	0.089	27%	0.27	C	S	.	.			trans	-82.7	141.8	165.6	-85.3	67.1	0	0	0	109.1	Y273 L277 L280 I297 L308 Q394	Y273-L275 VanDerWaalsContact C-N 3.27Å; Y273-L275 PolarHBondContact O-N 3.46Å; L275-L277 PolarHBondContact O-N 3.02Å; L275-L280 HydrophobicContact CB-CB 4.22Å; L275-L280 HydrophobicContact CD2-CB 4.2Å; L275-L280 HydrophobicContact CD2-CD1 4.3Å; L275-I297 HydrophobicContact CD2-CD1 3.99Å; L275-I297 HydrophobicContact CD2-CG1 4.21Å; L275-I297 HydrophobicContact CG-CD1 4.27Å; L275-L308 HydrophobicContact CD1-CD2 4.16Å; L275-Q394 HydrophobicContact CD1-CG 4.07Å
276	S	68.1	Low	68	Low	58 Å²	58	49.2 Å²	49.2	41%	0.406	26%	0.263	S	S	.	.			trans	-61.4	141.1	162.6	71.7	0	0	0	0	109.3	P278 Q279 L280	S276-P278 VanDerWaalsContact C-CD 3.46Å; S276-P278 VanDerWaalsContact C-N 3.32Å; S276-Q279 WeakPolarHBondContact O-CB 3.29Å; S276-Q279 PolarHBondContact O-N 3.33Å; S276-Q279 VanDerWaalsContact OG-CG 3.3Å; S276-Q279 WeakPolarHBondContact OG-CG 3.26Å; S276-Q279 PolarHBondContact OG-OE1 3.35Å; S276-L280 PolarHBondContact O-N 3.47Å
277	L	64.4	Low	69.6	Low	31 Å²	31	47.1 Å²	47.1	16%	0.162	25%	0.253	C	S	.	.	H	α-helix	trans	-55.9	-38.9	-176.6	-171.5	81.3	0	0	0	113.6	L205 I208 F270 L275 Q279 L280 A281	L205-L277 HydrophobicContact CB-CD2 4.47Å; L205-L277 HydrophobicContact CD1-CD2 3.79Å; L205-L277 HydrophobicContact CD1-CG 3.92Å; L205-L277 HydrophobicContact CG-CD2 3.99Å; L205-L277 HydrophobicContact CG-CG 4.5Å; I208-L277 HydrophobicContact CB-CD2 3.55Å; I208-L277 HydrophobicContact CD1-CD1 3.88Å; I208-L277 HydrophobicContact CD1-CD2 3.83Å; I208-L277 HydrophobicContact CG1-CD2 4.22Å; I208-L277 HydrophobicContact CG2-CD2 3.68Å; F270-L277 HydrophobicContact CZ-CD1 4.31Å; L275-L277 PolarHBondContact O-N 3.02Å; L277-Q279 VanDerWaalsContact C-N 3.32Å; L277-Q279 PolarHBondContact O-N 2.9Å; L277-L280 PolarHBondContact O-N 2.91Å; L277-A281 WeakPolarHBondContact O-CB 3.38Å; L277-A281 PolarHBondContact O-N 3.31Å
278	P	68.7	Low	70.8	Confident	70 Å²	70	48.5 Å²	48.5	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-58.9	-38.6	173	-25.3	36.4	0	0	0	113.5	L205 S276 Q282	L205-P278 HydrophobicContact CD2-CB 4.45Å; L205-P278 HydrophobicContact CD2-CG 4.29Å; S276-P278 VanDerWaalsContact C-CD 3.46Å; S276-P278 VanDerWaalsContact C-N 3.32Å; P278-Q282 VanDerWaalsContact O-CB 3.3Å; P278-Q282 WeakPolarHBondContact O-CB 3.3Å; P278-Q282 PolarHBondContact O-N 3.13Å
279	Q	71	Confident	71.7	Confident	57 Å²	57	47.3 Å²	47.3	27%	0.266	25%	0.251	S	S	.	.	H	α-helix	trans	-69.1	-39.8	176	-71.4	164	-37.9	0	0	112	S276 L277 Q282 S283	S276-Q279 WeakPolarHBondContact O-CB 3.29Å; S276-Q279 PolarHBondContact O-N 3.33Å; S276-Q279 VanDerWaalsContact OG-CG 3.3Å; S276-Q279 WeakPolarHBondContact OG-CG 3.26Å; S276-Q279 PolarHBondContact OG-OE1 3.35Å; L277-Q279 VanDerWaalsContact C-N 3.32Å; L277-Q279 PolarHBondContact O-N 2.9Å; Q279-Q282 PolarHBondContact O-N 3.28Å; Q279-S283 VanDerWaalsContact O-CB 3.3Å; Q279-S283 WeakPolarHBondContact O-CB 3.39Å; Q279-S283 PolarHBondContact O-N 2.94Å; Q279-S283 PolarHBondContact O-OG 2.99Å
280	L	71.8	Confident	72.5	Confident	14 Å²	14	47.6 Å²	47.6	7%	0.073	25%	0.253	C	S	.	.	H	α-helix	trans	-65.6	-46.4	175.3	178.4	62.2	0	0	0	111.2	F270 L275 S276 L277 Q282 S283 I284	F270-L280 HydrophobicContact CE1-CD2 3.56Å; F270-L280 HydrophobicContact CE2-CD2 4.34Å; F270-L280 HydrophobicContact CZ-CD2 3.36Å; L275-L280 HydrophobicContact CB-CB 4.22Å; L275-L280 HydrophobicContact CD2-CB 4.2Å; L275-L280 HydrophobicContact CD2-CD1 4.3Å; S276-L280 PolarHBondContact O-N 3.47Å; L277-L280 PolarHBondContact O-N 2.91Å; L280-Q282 VanDerWaalsContact C-N 3.34Å; L280-Q282 PolarHBondContact O-N 3.44Å; L280-S283 PolarHBondContact O-N 3.18Å; L280-S283 VanDerWaalsContact O-N 3.09Å; L280-I284 HydrophobicContact CD1-CD1 3.91Å; L280-I284 HydrophobicContact CD1-CG1 4.08Å; L280-I284 HydrophobicContact CD2-CD1 4.47Å; L280-I284 HydrophobicContact CG-CD1 3.82Å; L280-I284 HydrophobicContact CG-CG1 4.39Å; L280-I284 WeakPolarHBondContact O-CG1 3.37Å; L280-I284 PolarHBondContact O-N 3.39Å
281	A	67	Low	72.9	Confident	13 Å²	13	46.5 Å²	46.5	11%	0.107	25%	0.248	C	C	.	.	H	α-helix	trans	-60	-40.9	175.6	0	0	0	0	0	112.8	V201 L205 L277 R285	V201-A281 HydrophobicContact CG1-CB 3.68Å; L205-A281 HydrophobicContact CD1-CB 3.47Å; L205-A281 VanDerWaalsContact CD1-CB 3.47Å; L277-A281 WeakPolarHBondContact O-CB 3.38Å; L277-A281 PolarHBondContact O-N 3.31Å; A281-R285 PolarHBondContact O-N 3.03Å
282	Q	77.5	Confident	73.3	Confident	52 Å²	52	44.2 Å²	44.2	24%	0.243	23%	0.233	C	C	.	.	H	α-helix	trans	-63.3	-44.5	171.7	-166.2	-173.7	3.1	0	0	110.8	P278 Q279 L280 R285 Y286 N300	P278-Q282 VanDerWaalsContact O-CB 3.3Å; P278-Q282 WeakPolarHBondContact O-CB 3.3Å; P278-Q282 PolarHBondContact O-N 3.13Å; Q279-Q282 PolarHBondContact O-N 3.28Å; L280-Q282 VanDerWaalsContact C-N 3.34Å; L280-Q282 PolarHBondContact O-N 3.44Å; Q282-R285 WeakPolarHBondContact O-CB 3.49Å; Q282-R285 PolarHBondContact O-N 3.24Å; Q282-Y286 HydrophobicContact CG-CD2 3.79Å; Q282-Y286 HydrophobicContact CG-CE2 3.65Å; Q282-Y286 VanDerWaalsContact O-CD2 3.29Å; Q282-Y286 WeakPolarHBondContact O-CD2 3.28Å; Q282-Y286 PolarHBondContact O-N 3.37Å; Q282-N300 PolarHBondContact NE2-OD1 3.49Å; Q282-N300 PolarHBondContact OE1-ND2 3.45Å
283	S	77.2	Confident	73.5	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.007	21%	0.213	C	C	.	.	H	α-helix	trans	-65.9	-46.8	-177.1	-59.6	0	0	0	0	112.6	Q279 L280 R285 Y286 C287 Y296 I297 Y298	Q279-S283 VanDerWaalsContact O-CB 3.3Å; Q279-S283 WeakPolarHBondContact O-CB 3.39Å; Q279-S283 PolarHBondContact O-N 2.94Å; Q279-S283 PolarHBondContact O-OG 2.99Å; L280-S283 PolarHBondContact O-N 3.18Å; L280-S283 VanDerWaalsContact O-N 3.09Å; S283-R285 PolarHBondContact O-N 3.31Å; S283-Y286 PolarHBondContact O-N 3.18Å; S283-C287 WeakPolarHBondContact O-CA 3.5Å; S283-C287 WeakPolarHBondContact O-CB 3.47Å; S283-C287 PolarHBondContact O-N 2.91Å; S283-C287 PolarHBondContact O-SG 2.95Å; S283-C287 VanDerWaalsContact O-SG 3.39Å; S283-Y296 WeakPolarHBondContact CB-O 3.48Å; S283-I297 WeakPolarHBondContact OG-CA 3.34Å; S283-I297 WeakPolarHBondContact OG-CG1 3.48Å; S283-Y298 PolarHBondContact OG-N 3.18Å
284	I	73.3	Confident	73.6	Confident	51 Å²	51	39.6 Å²	39.6	26%	0.262	21%	0.214	S	C	.	.	H	α-helix	trans	-56.8	-39	175.7	-68.4	168.3	0	0	0	110.9	L280 S288 I294	L280-I284 HydrophobicContact CD1-CD1 3.91Å; L280-I284 HydrophobicContact CD1-CG1 4.08Å; L280-I284 HydrophobicContact CD2-CD1 4.47Å; L280-I284 HydrophobicContact CG-CD1 3.82Å; L280-I284 HydrophobicContact CG-CG1 4.39Å; L280-I284 WeakPolarHBondContact O-CG1 3.37Å; L280-I284 PolarHBondContact O-N 3.39Å; I284-S288 VanDerWaalsContact O-CA 3.26Å; I284-S288 WeakPolarHBondContact O-CA 3.32Å; I284-S288 VanDerWaalsContact O-CB 3.24Å; I284-S288 WeakPolarHBondContact O-CB 3.48Å; I284-S288 PolarHBondContact O-N 2.89Å; I284-I294 HydrophobicContact CD1-CG2 3.96Å; I284-I294 HydrophobicContact CG1-CG2 4.04Å
285	R	71.8	Confident	74.4	Confident	44 Å²	44	35.9 Å²	35.9	17%	0.166	19%	0.188	C	C	.	.	H	α-helix	trans	-61.4	-59.7	177.5	171.8	-173.5	-60.1	-117.9	-17.4	112.6	L195 P196 A281 Q282 S283 S288	L195-R285 PolarHBondContact O-NH1 2.7Å; P196-R285 PolarHBondContact O-NH1 2.04Å; A281-R285 PolarHBondContact O-N 3.03Å; Q282-R285 WeakPolarHBondContact O-CB 3.49Å; Q282-R285 PolarHBondContact O-N 3.24Å; S283-R285 PolarHBondContact O-N 3.31Å; R285-S288 WeakPolarHBondContact O-CB 3.38Å; R285-S288 PolarHBondContact O-OG 3.02Å
286	Y	79.9	Confident	75.1	Confident	57 Å²	57	35.5 Å²	35.5	22%	0.224	19%	0.186	C	C	.	.	H	α-helix	trans	-76	-28.3	-174.4	-67.5	-79	0	0	0	112.7	Q282 S283 H289 Y298	Q282-Y286 HydrophobicContact CG-CD2 3.79Å; Q282-Y286 HydrophobicContact CG-CE2 3.65Å; Q282-Y286 VanDerWaalsContact O-CD2 3.29Å; Q282-Y286 WeakPolarHBondContact O-CD2 3.28Å; Q282-Y286 PolarHBondContact O-N 3.37Å; S283-Y286 PolarHBondContact O-N 3.18Å; Y286-H289 PolarHBondContact O-CE1 3.24Å; Y286-H289 PolarHBondContact O-ND1 2.84Å; Y286-H289 VanDerWaalsContact O-ND1 3.09Å; Y286-Y298 HydrophobicContact CD1-CE1 4.32Å; Y286-Y298 HydrophobicContact CD1-CE2 4.24Å; Y286-Y298 AromaticContact CD2-CD1 3.61Å; Y286-Y298 HydrophobicContact CD2-CD1 3.61Å; Y286-Y298 HydrophobicContact CD2-CD2 4.37Å; Y286-Y298 AromaticContact CD2-CE1 3.8Å; Y286-Y298 HydrophobicContact CD2-CE1 3.8Å; Y286-Y298 AromaticContact CD2-CG 3.9Å; Y286-Y298 HydrophobicContact CD2-CG 3.9Å; Y286-Y298 HydrophobicContact CE2-CD1 4.2Å; Y286-Y298 HydrophobicContact CE2-CE1 4.12Å; Y286-Y298 AromaticContact CG-CD1 3.96Å; Y286-Y298 HydrophobicContact CG-CD1 3.96Å; Y286-Y298 AromaticContact CG-CD2 3.94Å; Y286-Y298 HydrophobicContact CG-CD2 3.94Å; Y286-Y298 AromaticContact CG-CE1 3.93Å; Y286-Y298 HydrophobicContact CG-CE1 3.93Å; Y286-Y298 AromaticContact CG-CE2 3.91Å; Y286-Y298 HydrophobicContact CG-CE2 3.91Å; Y286-Y298 AromaticContact CG-CG 3.95Å; Y286-Y298 HydrophobicContact CG-CG 3.95Å; Y286-Y298 AromaticContact CG-CZ 3.89Å
287	C	84.4	Confident	76	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	9.6	179.9	-49.2	0	0	0	0	113.7	S283 H289 L290 S293 C305	S283-C287 WeakPolarHBondContact O-CA 3.5Å; S283-C287 WeakPolarHBondContact O-CB 3.47Å; S283-C287 PolarHBondContact O-N 2.91Å; S283-C287 PolarHBondContact O-SG 2.95Å; S283-C287 VanDerWaalsContact O-SG 3.39Å; C287-H289 PolarHBondContact O-N 2.97Å; C287-H289 VanDerWaalsContact O-N 3.11Å; C287-L290 HydrophobicContact CB-CD1 4.32Å; C287-L290 WeakPolarHBondContact O-CB 3.32Å; C287-L290 PolarHBondContact O-N 3.07Å; C287-S293 VanDerWaalsContact O-CB 3.23Å; C287-S293 WeakPolarHBondContact O-CB 3.37Å; C287-C305 WeakPolarHBondContact CA-SG 3.24Å; C287-C305 HydrophobicContact CB-CB 3.92Å; C287-C305 WeakPolarHBondContact CB-SG 3.42Å; C287-C305 WeakPolarHBondContact SG-CB 3.45Å; C287-C305 CovalentContact SG-SG 2.03Å; C287-C305 PolarHBondContact SG-SG 3.29Å
288	S	76.9	Confident	76.9	Confident	65 Å²	65	33.6 Å²	33.6	46%	0.455	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-30.9	177	46.9	0	0	0	0	114.2	I284 R285 L290	I284-S288 VanDerWaalsContact O-CA 3.26Å; I284-S288 WeakPolarHBondContact O-CA 3.32Å; I284-S288 VanDerWaalsContact O-CB 3.24Å; I284-S288 WeakPolarHBondContact O-CB 3.48Å; I284-S288 PolarHBondContact O-N 2.89Å; R285-S288 WeakPolarHBondContact O-CB 3.38Å; R285-S288 PolarHBondContact O-OG 3.02Å; S288-L290 PolarHBondContact O-N 3.4Å
289	H	76.6	Confident	77.6	Confident	40 Å²	40	30.6 Å²	30.6	19%	0.185	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-12.1	178.7	68	-86.9	0	0	0	114.9	Y286 C287 T834 V835 Y838	Y286-H289 PolarHBondContact O-CE1 3.24Å; Y286-H289 PolarHBondContact O-ND1 2.84Å; Y286-H289 VanDerWaalsContact O-ND1 3.09Å; C287-H289 PolarHBondContact O-N 2.97Å; C287-H289 VanDerWaalsContact O-N 3.11Å; H289-T834 VanDerWaalsContact O-CA 3.28Å; H289-T834 WeakPolarHBondContact O-CA 3.38Å; H289-V835 PolarHBondContact O-N 3.28Å; H289-Y838 HydrophobicContact CB-CD1 3.74Å; H289-Y838 HydrophobicContact CB-CD2 3.53Å; H289-Y838 HydrophobicContact CB-CE1 3.52Å; H289-Y838 HydrophobicContact CB-CE2 3.31Å; H289-Y838 HydrophobicContact CB-CG 3.73Å; H289-Y838 AromaticContact CD2-CE1 3.65Å; H289-Y838 AromaticContact CD2-CZ 3.93Å; H289-Y838 AromaticContact CG-CE1 3.75Å; H289-Y838 AromaticContact CG-CZ 3.58Å
290	L	78.9	Confident	78	Confident	20 Å²	20	32.7 Å²	32.7	11%	0.105	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-98.2	135.8	-177.2	-60.1	172	0	0	0	111.3	C287 S288 K292 S293 Y296 C305 L833	C287-L290 HydrophobicContact CB-CD1 4.32Å; C287-L290 WeakPolarHBondContact O-CB 3.32Å; C287-L290 PolarHBondContact O-N 3.07Å; S288-L290 PolarHBondContact O-N 3.4Å; L290-K292 PolarHBondContact O-N 2.93Å; L290-S293 PolarHBondContact O-N 3.3Å; L290-S293 VanDerWaalsContact O-N 3.1Å; L290-Y296 HydrophobicContact CB-CD2 4.07Å; L290-Y296 HydrophobicContact CB-CE2 3.73Å; L290-Y296 HydrophobicContact CD1-CD1 3.65Å; L290-Y296 HydrophobicContact CD1-CD2 4.07Å; L290-Y296 HydrophobicContact CD1-CE1 3.67Å; L290-Y296 HydrophobicContact CD1-CE2 4.08Å; L290-Y296 HydrophobicContact CD1-CG 3.85Å; L290-Y296 HydrophobicContact CG-CE2 4.5Å; L290-C305 HydrophobicContact CD1-CB 3.71Å; L290-L833 CarbonylContact C-O 3.52Å; L290-L833 VanDerWaalsContact CA-O 3.32Å; L290-L833 WeakPolarHBondContact CA-O 3.35Å
291	K	75.3	Confident	78.2	Confident	42 Å²	42	38.4 Å²	38.4	18%	0.183	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	126.6	173.8	-173.9	165.6	-175.6	176.4	0	109.1	L833 I890 V893	K291-L833 PolarHBondContact N-O 3.47Å; K291-I890 HydrophobicContact CD-CD1 4.29Å; K291-I890 HydrophobicContact CG-CD1 4.07Å; K291-V893 PolarHBondContact NZ-O 3.04Å
292	K	76.9	Confident	78.8	Confident	74 Å²	74	40 Å²	40	32%	0.322	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	49.9	-170.6	-48.8	169.5	170	170.2	0	113.5	L290 I294 F295 N312 I313	L290-K292 PolarHBondContact O-N 2.93Å; K292-I294 PolarHBondContact O-N 3.01Å; K292-F295 HydrophobicContact CB-CD2 3.82Å; K292-F295 HydrophobicContact CB-CE2 4.3Å; K292-F295 HydrophobicContact CD-CD2 4.5Å; K292-F295 PolarHBondContact O-N 3.44Å; K292-N312 PolarHBondContact NZ-O 2.85Å; K292-I313 PolarHBondContact NZ-O 3.03Å
293	S	74.1	Confident	79	Confident	9 Å²	9	39.5 Å²	39.5	6%	0.063	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-46	-33.8	-176.4	59	0	0	0	0	115.8	C287 L290 F295 Y296	C287-S293 VanDerWaalsContact O-CB 3.23Å; C287-S293 WeakPolarHBondContact O-CB 3.37Å; L290-S293 PolarHBondContact O-N 3.3Å; L290-S293 VanDerWaalsContact O-N 3.1Å; S293-F295 PolarHBondContact O-N 3.42Å; S293-F295 VanDerWaalsContact O-N 3.11Å; S293-Y296 PolarHBondContact O-N 3.08Å
294	I	75.5	Confident	79.2	Confident	17 Å²	17	44.2 Å²	44.2	9%	0.087	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-61.1	-11.2	175.9	57.9	166	0	0	0	115.8	H269 I284 K292 W888	H269-I294 PolarHBondContact CE1-O 3.17Å; H269-I294 PolarHBondContact NE2-O 3.19Å; I284-I294 HydrophobicContact CD1-CG2 3.96Å; I284-I294 HydrophobicContact CG1-CG2 4.04Å; K292-I294 PolarHBondContact O-N 3.01Å; I294-W888 HydrophobicContact CD1-CD2 4.17Å; I294-W888 VanDerWaalsContact CD1-CE2 3.48Å; I294-W888 HydrophobicContact CD1-CE3 4.43Å; I294-W888 HydrophobicContact CD1-CH2 3.51Å; I294-W888 HydrophobicContact CD1-CZ2 3.13Å; I294-W888 HydrophobicContact CD1-CZ3 4.13Å
295	F	84.5	Confident	79.9	Confident	22 Å²	22	42.7 Å²	42.7	10%	0.096	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-100.3	14	172.2	-61.4	-82.8	0	0	0	112.9	H269 Y273 K292 S293 P307 L308 I313 W888	H269-F295 AromaticContact CD2-CE1 3.68Å; H269-F295 AromaticContact CD2-CZ 3.98Å; Y273-F295 AromaticContact CE2-CD1 3.98Å; Y273-F295 HydrophobicContact CE2-CD1 3.98Å; Y273-F295 AromaticContact CE2-CE1 3.83Å; Y273-F295 HydrophobicContact CE2-CE1 3.83Å; K292-F295 HydrophobicContact CB-CD2 3.82Å; K292-F295 HydrophobicContact CB-CE2 4.3Å; K292-F295 HydrophobicContact CD-CD2 4.5Å; K292-F295 PolarHBondContact O-N 3.44Å; S293-F295 PolarHBondContact O-N 3.42Å; S293-F295 VanDerWaalsContact O-N 3.11Å; F295-P307 WeakPolarHBondContact O-CA 3.3Å; F295-L308 VanDerWaalsContact O-CD1 3.26Å; F295-L308 WeakPolarHBondContact O-CD1 3.45Å; F295-L308 PolarHBondContact O-N 2.66Å; F295-I313 HydrophobicContact CB-CD1 4.06Å; F295-I313 HydrophobicContact CB-CG1 3.95Å; F295-W888 HydrophobicContact CE2-CH2 4.06Å; F295-W888 AromaticContact CE2-CZ3 3.89Å; F295-W888 HydrophobicContact CE2-CZ3 3.89Å; F295-W888 AromaticContact CZ-CH2 3.84Å; F295-W888 HydrophobicContact CZ-CH2 3.84Å; F295-W888 AromaticContact CZ-CZ3 3.91Å; F295-W888 HydrophobicContact CZ-CZ3 3.91Å
296	Y	84.1	Confident	80.7	Confident	9 Å²	9	40.6 Å²	40.6	4%	0.035	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	145.7	170.7	-60.9	-96.5	0	0	0	110.7	S283 L290 S293 C305 A306 P307 I313	S283-Y296 WeakPolarHBondContact CB-O 3.48Å; L290-Y296 HydrophobicContact CB-CD2 4.07Å; L290-Y296 HydrophobicContact CB-CE2 3.73Å; L290-Y296 HydrophobicContact CD1-CD1 3.65Å; L290-Y296 HydrophobicContact CD1-CD2 4.07Å; L290-Y296 HydrophobicContact CD1-CE1 3.67Å; L290-Y296 HydrophobicContact CD1-CE2 4.08Å; L290-Y296 HydrophobicContact CD1-CG 3.85Å; L290-Y296 HydrophobicContact CG-CE2 4.5Å; S293-Y296 PolarHBondContact O-N 3.08Å; Y296-C305 HydrophobicContact CD1-CB 4.39Å; Y296-A306 CarbonylContact C-O 3.55Å; Y296-A306 VanDerWaalsContact CA-O 3.3Å; Y296-A306 WeakPolarHBondContact CA-O 3.33Å; Y296-P307 HydrophobicContact CD1-CB 3.84Å; Y296-P307 HydrophobicContact CD1-CG 4.36Å; Y296-P307 HydrophobicContact CE1-CB 3.76Å; Y296-P307 HydrophobicContact CE1-CG 4.15Å; Y296-I313 HydrophobicContact CE1-CD1 4.23Å; Y296-I313 HydrophobicContact CE2-CD1 4.01Å; Y296-I313 HydrophobicContact CE2-CG2 4.19Å
297	I	85.5	Confident	81.2	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	139.4	170.1	-165.8	167.2	0	0	0	109.9	L275 S283 I299 C305 A306 L308 Q394 I396	L275-I297 HydrophobicContact CD2-CD1 3.99Å; L275-I297 HydrophobicContact CD2-CG1 4.21Å; L275-I297 HydrophobicContact CG-CD1 4.27Å; S283-I297 WeakPolarHBondContact OG-CA 3.34Å; S283-I297 WeakPolarHBondContact OG-CG1 3.48Å; I297-I299 HydrophobicContact CG2-CG1 4.38Å; I297-C305 CarbonylContact O-C 3.56Å; I297-C305 WeakPolarHBondContact O-CA 3.47Å; I297-A306 HydrophobicContact CG2-CB 4.16Å; I297-A306 PolarHBondContact N-O 3.31Å; I297-A306 PolarHBondContact O-N 3.45Å; I297-L308 HydrophobicContact CB-CD1 4.21Å; I297-L308 HydrophobicContact CG2-CD1 4.49Å; I297-Q394 HydrophobicContact CD1-CB 4.48Å; I297-I396 HydrophobicContact CG2-CG2 3.61Å
298	Y	84	Confident	81.3	Confident	45 Å²	45	37.9 Å²	37.9	18%	0.176	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	120	176.9	-176.6	-105.6	0	0	0	111.2	S283 Y286 N300 G303	S283-Y298 PolarHBondContact OG-N 3.18Å; Y286-Y298 HydrophobicContact CD1-CE1 4.32Å; Y286-Y298 HydrophobicContact CD1-CE2 4.24Å; Y286-Y298 AromaticContact CD2-CD1 3.61Å; Y286-Y298 HydrophobicContact CD2-CD1 3.61Å; Y286-Y298 HydrophobicContact CD2-CD2 4.37Å; Y286-Y298 AromaticContact CD2-CE1 3.8Å; Y286-Y298 HydrophobicContact CD2-CE1 3.8Å; Y286-Y298 AromaticContact CD2-CG 3.9Å; Y286-Y298 HydrophobicContact CD2-CG 3.9Å; Y286-Y298 HydrophobicContact CE2-CD1 4.2Å; Y286-Y298 HydrophobicContact CE2-CE1 4.12Å; Y286-Y298 AromaticContact CG-CD1 3.96Å; Y286-Y298 HydrophobicContact CG-CD1 3.96Å; Y286-Y298 AromaticContact CG-CD2 3.94Å; Y286-Y298 HydrophobicContact CG-CD2 3.94Å; Y286-Y298 AromaticContact CG-CE1 3.93Å; Y286-Y298 HydrophobicContact CG-CE1 3.93Å; Y286-Y298 AromaticContact CG-CE2 3.91Å; Y286-Y298 HydrophobicContact CG-CE2 3.91Å; Y286-Y298 AromaticContact CG-CG 3.95Å; Y286-Y298 HydrophobicContact CG-CG 3.95Å; Y286-Y298 AromaticContact CG-CZ 3.89Å; Y298-N300 WeakPolarHBondContact CE1-OD1 3.34Å; Y298-G303 WeakPolarHBondContact CE2-O 3.32Å
299	I	83.6	Confident	81.9	Confident	6 Å²	6	35 Å²	35	3%	0.031	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	103	-176.3	-61.3	-177.5	0	0	0	109.4	I297 R301 T302 G303 R304 A306 I396	I297-I299 HydrophobicContact CG2-CG1 4.38Å; I299-R301 VanDerWaalsContact C-N 3.25Å; I299-R301 HydrophobicContact CG2-CG 3.39Å; I299-R301 PolarHBondContact O-N 3.21Å; I299-T302 HydrophobicContact CG2-CG2 4.17Å; I299-T302 WeakPolarHBondContact CG2-OG1 3.32Å; I299-T302 PolarHBondContact O-N 3.2Å; I299-T302 PolarHBondContact O-OG1 2.94Å; I299-G303 PolarHBondContact O-N 3.31Å; I299-R304 PolarHBondContact N-O 2.97Å; I299-A306 HydrophobicContact CD1-CB 3.52Å; I299-A306 HydrophobicContact CG1-CB 4.17Å; I299-I396 HydrophobicContact CD1-CD1 3.83Å
300	N	78.3	Confident	82.3	Confident	101 Å²	101	36.3 Å²	36.3	54%	0.54	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-36.2	-177.1	-75.5	-48.6	0	0	0	113.7	Q282 Y298	Q282-N300 PolarHBondContact NE2-OD1 3.49Å; Q282-N300 PolarHBondContact OE1-ND2 3.45Å; Y298-N300 WeakPolarHBondContact CE1-OD1 3.34Å
301	R	77	Confident	82.5	Confident	135 Å²	135	35.5 Å²	35.5	51%	0.509	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-35.4	-179.2	56.9	176.9	176.7	105	2.1	114.1	I299 D389 D391	I299-R301 VanDerWaalsContact C-N 3.25Å; I299-R301 HydrophobicContact CG2-CG 3.39Å; I299-R301 PolarHBondContact O-N 3.21Å; R301-D389 IonicContact CZ-OD1 2.7Å; R301-D389 IonicContact NE-OD1 3.73Å; R301-D389 PolarHBondContact NE-OD1 3.3Å; R301-D389 IonicContact NH2-OD1 3.6Å; R301-D389 PolarHBondContact NH2-OD1 2.98Å; R301-D391 WeakPolarHBondContact CD-OD2 3.38Å; R301-D391 WeakPolarHBondContact CG-OD2 3.48Å; R301-D391 IonicContact NE-OD2 2.75Å; R301-D391 PolarHBondContact NE-OD2 2.98Å
302	T	79.9	Confident	83	Confident	46 Å²	46	36 Å²	36	28%	0.282	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-20.8	178.9	61.2	0	0	0	0	113	I299 R304	I299-T302 HydrophobicContact CG2-CG2 4.17Å; I299-T302 WeakPolarHBondContact CG2-OG1 3.32Å; I299-T302 PolarHBondContact O-N 3.2Å; I299-T302 PolarHBondContact O-OG1 2.94Å; T302-R304 PolarHBondContact O-N 3.23Å; T302-R304 PolarHBondContact OG1-N 3.39Å
303	G	80.6	Confident	83.3	Confident	42 Å²	42	33.1 Å²	33.1	43%	0.433	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	15.7	-171.1	0	0	0	0	0	113.8	Y298 I299	Y298-G303 WeakPolarHBondContact CE2-O 3.32Å; I299-G303 PolarHBondContact O-N 3.31Å
304	R	83.1	Confident	83.8	Confident	99 Å²	99	34.8 Å²	34.8	37%	0.374	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	154	-175.8	-62.6	-179.8	179.1	162.7	0.3	111.9	I299 T302 E400	I299-R304 PolarHBondContact N-O 2.97Å; T302-R304 PolarHBondContact O-N 3.23Å; T302-R304 PolarHBondContact OG1-N 3.39Å; R304-E400 IonicContact NH1-OE1 2.74Å; R304-E400 PolarHBondContact NH1-OE1 3.15Å
305	C	86.7	Confident	84.4	Confident	19 Å²	19	34.7 Å²	34.7	13%	0.128	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126	167.5	-67.9	0	0	0	0	109.8	C287 L290 Y296 I297 Q399	C287-C305 WeakPolarHBondContact CA-SG 3.24Å; C287-C305 HydrophobicContact CB-CB 3.92Å; C287-C305 WeakPolarHBondContact CB-SG 3.42Å; C287-C305 WeakPolarHBondContact SG-CB 3.45Å; C287-C305 CovalentContact SG-SG 2.03Å; C287-C305 PolarHBondContact SG-SG 3.29Å; L290-C305 HydrophobicContact CD1-CB 3.71Å; Y296-C305 HydrophobicContact CD1-CB 4.39Å; I297-C305 CarbonylContact O-C 3.56Å; I297-C305 WeakPolarHBondContact O-CA 3.47Å; C305-Q399 PolarHBondContact O-NE2 2.96Å
306	A	88.6	Confident	84.6	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129.1	178.6	0	0	0	0	0	111	Y296 I297 I299 I396 Q399	Y296-A306 CarbonylContact C-O 3.55Å; Y296-A306 VanDerWaalsContact CA-O 3.3Å; Y296-A306 WeakPolarHBondContact CA-O 3.33Å; I297-A306 HydrophobicContact CG2-CB 4.16Å; I297-A306 PolarHBondContact N-O 3.31Å; I297-A306 PolarHBondContact O-N 3.45Å; I299-A306 HydrophobicContact CD1-CB 3.52Å; I299-A306 HydrophobicContact CG1-CB 4.17Å; A306-I396 HydrophobicContact CB-CB 4.34Å; A306-I396 HydrophobicContact CB-CD1 4.23Å; A306-I396 HydrophobicContact CB-CG2 4.24Å; A306-Q399 HydrophobicContact CB-CG 4.12Å
307	P	90	Very high	84.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	140.7	178.2	22.7	-23.8	0	0	0	111.8	F295 Y296 I313 R397	F295-P307 WeakPolarHBondContact O-CA 3.3Å; Y296-P307 HydrophobicContact CD1-CB 3.84Å; Y296-P307 HydrophobicContact CD1-CG 4.36Å; Y296-P307 HydrophobicContact CE1-CB 3.76Å; Y296-P307 HydrophobicContact CE1-CG 4.15Å; P307-I313 HydrophobicContact CB-CD1 3.46Å; P307-I313 VanDerWaalsContact CB-CD1 3.46Å; P307-R397 HydrophobicContact CG-CB 4.24Å; P307-R397 PolarHBondContact O-N 3.09Å
308	L	88.2	Confident	84.9	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-69	140	177.3	-78.1	77.3	0	0	0	110.6	Y273 L275 F295 I297 D310 S311 Q394	Y273-L308 HydrophobicContact CD1-CB 4.44Å; Y273-L308 HydrophobicContact CD1-CD2 3.47Å; Y273-L308 VanDerWaalsContact CD1-CD2 3.47Å; Y273-L308 HydrophobicContact CD2-CD2 4.34Å; Y273-L308 HydrophobicContact CE1-CB 4.4Å; Y273-L308 HydrophobicContact CE1-CD2 4.21Å; Y273-L308 HydrophobicContact CG-CD2 3.54Å; L275-L308 HydrophobicContact CD1-CD2 4.16Å; F295-L308 VanDerWaalsContact O-CD1 3.26Å; F295-L308 WeakPolarHBondContact O-CD1 3.45Å; F295-L308 PolarHBondContact O-N 2.66Å; I297-L308 HydrophobicContact CB-CD1 4.21Å; I297-L308 HydrophobicContact CG2-CD1 4.49Å; L308-D310 PolarHBondContact O-N 3.48Å; L308-S311 WeakPolarHBondContact O-CB 3.41Å; L308-S311 PolarHBondContact O-N 3.1Å; L308-S311 PolarHBondContact O-OG 3.48Å; L308-Q394 HydrophobicContact CD2-CG 3.87Å; L308-Q394 HydrophobicContact CG-CG 4.09Å
309	C	88.8	Confident	85.1	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.034	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-44.2	-161.4	-160.2	0	0	0	0	114.6	S311 C386 R395	C309-S311 VanDerWaalsContact C-N 3.31Å; C309-S311 PolarHBondContact O-N 3.35Å; C309-C386 HydrophobicContact CB-CB 3.78Å; C309-C386 WeakPolarHBondContact CB-SG 3.39Å; C309-C386 WeakPolarHBondContact SG-CA 3.32Å; C309-C386 WeakPolarHBondContact SG-CB 3.37Å; C309-C386 CovalentContact SG-SG 2.03Å; C309-C386 PolarHBondContact SG-SG 3.13Å; C309-R395 HydrophobicContact CB-CB 4.4Å; C309-R395 PolarHBondContact N-O 3.29Å
310	D	84.4	Confident	85.5	Confident	66 Å²	66	46.7 Å²	46.7	35%	0.353	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	20.6	-176.4	-59.5	-63	0	0	0	113.3	K272 Y273 L308	K272-D310 PolarHBondContact NZ-O 3.22Å; Y273-D310 PolarHBondContact OH-O 3.35Å; L308-D310 PolarHBondContact O-N 3.48Å
311	S	84.3	Confident	86.1	Confident	4 Å²	4	47.3 Å²	47.3	3%	0.028	25%	0.246	C	C	.	.			trans	-83.9	155.1	179.8	67.4	0	0	0	0	113.1	Y273 L308 C309 I313 K320	Y273-S311 WeakPolarHBondContact OH-CA 3.28Å; L308-S311 WeakPolarHBondContact O-CB 3.41Å; L308-S311 PolarHBondContact O-N 3.1Å; L308-S311 PolarHBondContact O-OG 3.48Å; C309-S311 VanDerWaalsContact C-N 3.31Å; C309-S311 PolarHBondContact O-N 3.35Å; S311-I313 WeakPolarHBondContact OG-CD1 3.42Å; S311-I313 WeakPolarHBondContact OG-CG1 3.35Å; S311-K320 PolarHBondContact O-NZ 2.91Å
312	N	84.9	Confident	86.8	Confident	53 Å²	53	45.5 Å²	45.5	28%	0.283	25%	0.246	S	C	.	.			trans	-110.7	79.3	179.6	-75.1	-16.4	0	0	0	110.1	K292 Y315 T317 K320	K292-N312 PolarHBondContact NZ-O 2.85Å; N312-Y315 WeakPolarHBondContact CA-O 3.41Å; N312-Y315 WeakPolarHBondContact CB-O 3.34Å; N312-Y315 PolarHBondContact OD1-O 3.36Å; N312-T317 PolarHBondContact ND2-N 3.33Å; N312-T317 PolarHBondContact ND2-OG1 3.08Å; N312-K320 PolarHBondContact OD1-NZ 2.9Å
313	I	83.8	Confident	87.4	Confident	13 Å²	13	43.3 Å²	43.3	7%	0.067	23%	0.233	C	C	.	.	S	Bend	trans	-89.8	-66.1	-174.5	-50.3	178.8	0	0	0	108.9	K292 F295 Y296 P307 S311 E635	K292-I313 PolarHBondContact NZ-O 3.03Å; F295-I313 HydrophobicContact CB-CD1 4.06Å; F295-I313 HydrophobicContact CB-CG1 3.95Å; Y296-I313 HydrophobicContact CE1-CD1 4.23Å; Y296-I313 HydrophobicContact CE2-CD1 4.01Å; Y296-I313 HydrophobicContact CE2-CG2 4.19Å; P307-I313 HydrophobicContact CB-CD1 3.46Å; P307-I313 VanDerWaalsContact CB-CD1 3.46Å; S311-I313 WeakPolarHBondContact OG-CD1 3.42Å; S311-I313 WeakPolarHBondContact OG-CG1 3.35Å; I313-E635 PolarHBondContact N-OE1 3.29Å
314	L	84.5	Confident	88	Confident	43 Å²	43	43 Å²	43	23%	0.225	22%	0.221	C	C	.	.	S	Bend	trans	-86.6	-37.5	177.2	-84.3	54	0	0	0	112.2	E635 L833 P896	L314-E635 PolarHBondContact N-OE1 3.23Å; L314-E635 VanDerWaalsContact N-OE1 3.11Å; L314-E635 PolarHBondContact N-OE2 3Å; L314-L833 HydrophobicContact CD1-CD2 3.83Å; L314-P896 HydrophobicContact CB-CG 3.9Å; L314-P896 HydrophobicContact CD2-CG 3.97Å; L314-P896 HydrophobicContact CG-CG 3.81Å
315	Y	88.6	Confident	88.3	Confident	15 Å²	15	43.7 Å²	43.7	6%	0.059	23%	0.23	C	C	.	.	S	Bend	trans	-129.7	146.8	-169	-53.9	-70.5	0	0	0	112.8	N312 K320 E635 L636 P896 P898 F901	N312-Y315 WeakPolarHBondContact CA-O 3.41Å; N312-Y315 WeakPolarHBondContact CB-O 3.34Å; N312-Y315 PolarHBondContact OD1-O 3.36Å; Y315-K320 VanDerWaalsContact O-CE 3.25Å; Y315-K320 WeakPolarHBondContact O-CE 3.38Å; Y315-K320 PolarHBondContact O-NZ 2.82Å; Y315-K320 VanDerWaalsContact O-NZ 3.12Å; Y315-E635 HydrophobicContact CD2-CB 4.43Å; Y315-E635 HydrophobicContact CD2-CG 4.16Å; Y315-E635 PolarHBondContact N-OE1 2.83Å; Y315-L636 HydrophobicContact CD1-CD1 4.05Å; Y315-L636 HydrophobicContact CD2-CB 4.01Å; Y315-L636 HydrophobicContact CD2-CD1 3.83Å; Y315-L636 HydrophobicContact CD2-CG 4.48Å; Y315-L636 HydrophobicContact CE1-CD1 4.37Å; Y315-L636 HydrophobicContact CE2-CB 3.9Å; Y315-L636 HydrophobicContact CE2-CD1 4.17Å; Y315-L636 HydrophobicContact CE2-CG 4.46Å; Y315-L636 HydrophobicContact CG-CD1 3.76Å; Y315-P896 HydrophobicContact CE1-CB 4.18Å; Y315-P896 HydrophobicContact CE1-CG 3.72Å; Y315-P896 WeakPolarHBondContact CE1-O 3.47Å; Y315-P898 HydrophobicContact CD1-CB 3.98Å; Y315-P898 HydrophobicContact CE1-CB 3.79Å; Y315-F901 VanDerWaalsContact OH-CD2 3.27Å; Y315-F901 WeakPolarHBondContact OH-CD2 3.39Å; Y315-F901 WeakPolarHBondContact OH-CE2 3.41Å
316	T	87.1	Confident	88.6	Confident	80 Å²	80	47.1 Å²	47.1	49%	0.491	24%	0.24	S	C	.	.			trans	-71.5	162.8	173.2	63	0	0	0	0	111.8	E318 A319 K320	T316-E318 VanDerWaalsContact C-N 3.27Å; T316-E318 PolarHBondContact O-N 2.88Å; T316-A319 PolarHBondContact O-N 2.87Å; T316-A319 WeakPolarHBondContact OG1-CB 3.48Å; T316-A319 PolarHBondContact OG1-N 3.46Å; T316-K320 WeakPolarHBondContact O-CG 3.44Å; T316-K320 PolarHBondContact O-N 3.18Å; T316-K320 VanDerWaalsContact O-N 3.13Å
317	T	88	Confident	88.8	Confident	73 Å²	73	47.3 Å²	47.3	45%	0.448	24%	0.242	S	C	.	.	H	α-helix	trans	-58.9	-40	175.5	-47.3	0	0	0	0	111.7	N312 K320 Q321	N312-T317 PolarHBondContact ND2-N 3.33Å; N312-T317 PolarHBondContact ND2-OG1 3.08Å; T317-K320 WeakPolarHBondContact O-CB 3.35Å; T317-K320 PolarHBondContact O-N 2.85Å; T317-Q321 WeakPolarHBondContact O-CG 3.34Å; T317-Q321 PolarHBondContact O-N 3.33Å
318	E	88.3	Confident	88.8	Confident	153 Å²	153	47.8 Å²	47.8	72%	0.715	25%	0.245	S	C	*	.	H	α-helix	trans	-63.9	-48.6	179.3	-64.5	168.2	-172.8	0	0	111.6	T316 K320 Q321 L322	T316-E318 VanDerWaalsContact C-N 3.27Å; T316-E318 PolarHBondContact O-N 2.88Å; E318-K320 VanDerWaalsContact C-N 3.26Å; E318-K320 PolarHBondContact O-N 3.07Å; E318-Q321 PolarHBondContact O-N 3.2Å; E318-L322 WeakPolarHBondContact O-CB 3.3Å; E318-L322 PolarHBondContact O-N 3.11Å
319	A	88.9	Confident	89.1	Confident	18 Å²	18	52.7 Å²	52.7	15%	0.149	27%	0.27	C	S	.	.	H	α-helix	trans	-60.3	-37.1	176.8	0	0	0	0	0	111.9	T316 S323	T316-A319 PolarHBondContact O-N 2.87Å; T316-A319 WeakPolarHBondContact OG1-CB 3.48Å; T316-A319 PolarHBondContact OG1-N 3.46Å; A319-S323 VanDerWaalsContact O-CB 3.27Å; A319-S323 WeakPolarHBondContact O-CB 3.28Å; A319-S323 PolarHBondContact O-N 2.95Å; A319-S323 PolarHBondContact O-OG 2.92Å
320	K	91.8	Very high	89.3	Confident	15 Å²	15	53.9 Å²	53.9	7%	0.065	28%	0.276	C	S	.	.	H	α-helix	trans	-65.2	-49.5	173.7	-69.7	166.1	-177.1	172.9	0	111.5	S311 N312 Y315 T316 T317 E318 S323 I324 E635	S311-K320 PolarHBondContact O-NZ 2.91Å; N312-K320 PolarHBondContact OD1-NZ 2.9Å; Y315-K320 VanDerWaalsContact O-CE 3.25Å; Y315-K320 WeakPolarHBondContact O-CE 3.38Å; Y315-K320 PolarHBondContact O-NZ 2.82Å; Y315-K320 VanDerWaalsContact O-NZ 3.12Å; T316-K320 WeakPolarHBondContact O-CG 3.44Å; T316-K320 PolarHBondContact O-N 3.18Å; T316-K320 VanDerWaalsContact O-N 3.13Å; T317-K320 WeakPolarHBondContact O-CB 3.35Å; T317-K320 PolarHBondContact O-N 2.85Å; E318-K320 VanDerWaalsContact C-N 3.26Å; E318-K320 PolarHBondContact O-N 3.07Å; K320-S323 PolarHBondContact O-N 3.03Å; K320-I324 WeakPolarHBondContact O-CB 3.47Å; K320-I324 WeakPolarHBondContact O-CD1 3.38Å; K320-I324 WeakPolarHBondContact O-CG1 3.43Å; K320-I324 PolarHBondContact O-N 3.17Å; K320-E635 VanDerWaalsContact CE-CG 3.5Å; K320-E635 WeakPolarHBondContact CE-O 3.48Å; K320-E635 WeakPolarHBondContact CE-OE1 3.05Å; K320-E635 IonicContact NZ-OE1 3.94Å; K320-E635 PolarHBondContact NZ-OE1 3.11Å
321	Q	91.1	Very high	89.9	Confident	113 Å²	113	50.7 Å²	50.7	53%	0.528	26%	0.259	S	S	.	.	H	α-helix	trans	-62.8	-46.2	179.7	-74.8	178.3	-13	0	0	112.2	T317 E318 S323 I324 M325	T317-Q321 WeakPolarHBondContact O-CG 3.34Å; T317-Q321 PolarHBondContact O-N 3.33Å; E318-Q321 PolarHBondContact O-N 3.2Å; Q321-S323 PolarHBondContact O-N 3.46Å; Q321-I324 PolarHBondContact O-N 2.92Å; Q321-M325 WeakPolarHBondContact O-CG 3.31Å; Q321-M325 PolarHBondContact O-N 3.08Å
322	L	92	Very high	90.4	Very high	97 Å²	97	52.9 Å²	52.9	51%	0.508	27%	0.273	S	S	.	.	H	α-helix	trans	-56.5	-49.9	175.2	178.7	61.8	0	0	0	111.3	E318 I324 M325 W326	E318-L322 WeakPolarHBondContact O-CB 3.3Å; E318-L322 PolarHBondContact O-N 3.11Å; L322-I324 VanDerWaalsContact C-N 3.34Å; L322-I324 PolarHBondContact O-N 3.43Å; L322-M325 PolarHBondContact O-N 3.4Å; L322-W326 WeakPolarHBondContact O-CB 3.36Å; L322-W326 PolarHBondContact O-N 3.49Å
323	S	92.6	Very high	90.8	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.007	28%	0.277	C	S	.	.	H	α-helix	trans	-60.7	-40.9	178.5	-58.4	0	0	0	0	112.2	A319 K320 Q321 T327 L636	A319-S323 VanDerWaalsContact O-CB 3.27Å; A319-S323 WeakPolarHBondContact O-CB 3.28Å; A319-S323 PolarHBondContact O-N 2.95Å; A319-S323 PolarHBondContact O-OG 2.92Å; K320-S323 PolarHBondContact O-N 3.03Å; Q321-S323 PolarHBondContact O-N 3.46Å; S323-T327 WeakPolarHBondContact O-CB 3.16Å; S323-T327 VanDerWaalsContact O-CG2 3.25Å; S323-T327 WeakPolarHBondContact O-CG2 3.36Å; S323-T327 PolarHBondContact O-N 3.27Å; S323-T327 PolarHBondContact O-OG1 2.9Å; S323-L636 WeakPolarHBondContact OG-CD1 3.47Å
324	I	91.9	Very high	91.4	Very high	35 Å²	35	53.1 Å²	53.1	18%	0.179	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-51.3	177.9	-71.6	167.2	0	0	0	111	K320 Q321 L322 T327 S328	K320-I324 WeakPolarHBondContact O-CB 3.47Å; K320-I324 WeakPolarHBondContact O-CD1 3.38Å; K320-I324 WeakPolarHBondContact O-CG1 3.43Å; K320-I324 PolarHBondContact O-N 3.17Å; Q321-I324 PolarHBondContact O-N 2.92Å; L322-I324 VanDerWaalsContact C-N 3.34Å; L322-I324 PolarHBondContact O-N 3.43Å; I324-T327 PolarHBondContact O-OG1 3.34Å; I324-S328 VanDerWaalsContact O-CB 3.23Å; I324-S328 WeakPolarHBondContact O-CB 3.48Å; I324-S328 PolarHBondContact O-N 2.95Å; I324-S328 VanDerWaalsContact O-N 3.08Å; I324-S328 PolarHBondContact O-OG 3.45Å
325	M	90.1	Very high	91.9	Very high	114 Å²	114	51.3 Å²	51.3	56%	0.562	27%	0.265	S	S	*	.	H	α-helix	trans	-62.4	-49.6	-178.7	-68.5	-174.3	-68.5	0	0	111.1	Q321 L322 S328 I329	Q321-M325 WeakPolarHBondContact O-CG 3.31Å; Q321-M325 PolarHBondContact O-N 3.08Å; L322-M325 PolarHBondContact O-N 3.4Å; M325-S328 PolarHBondContact O-N 2.93Å; M325-I329 WeakPolarHBondContact O-CD1 3.4Å; M325-I329 VanDerWaalsContact O-CG1 3.25Å; M325-I329 WeakPolarHBondContact O-CG1 3.24Å; M325-I329 PolarHBondContact O-N 3.23Å
326	W	93.4	Very high	92.2	Very high	91 Å²	91	56.4 Å²	56.4	35%	0.345	29%	0.293	S	S	.	.	H	α-helix	trans	-65.6	-45.3	-175.7	-176.9	92.4	0	0	0	112.8	L322 S328 I329 L330 M902 F906	L322-W326 WeakPolarHBondContact O-CB 3.36Å; L322-W326 PolarHBondContact O-N 3.49Å; W326-S328 PolarHBondContact O-N 3.43Å; W326-I329 PolarHBondContact O-N 3.36Å; W326-L330 HydrophobicContact CD2-CD1 3.72Å; W326-L330 HydrophobicContact CE3-CD1 3.76Å; W326-L330 HydrophobicContact CH2-CD1 3.83Å; W326-L330 HydrophobicContact CZ2-CD1 3.72Å; W326-L330 HydrophobicContact CZ3-CD1 3.8Å; W326-L330 WeakPolarHBondContact O-CG 3.32Å; W326-L330 PolarHBondContact O-N 2.82Å; W326-L330 VanDerWaalsContact O-N 3.15Å; W326-M902 HydrophobicContact CE3-CB 4.21Å; W326-M902 HydrophobicContact CE3-CG 4.28Å; W326-M902 HydrophobicContact CE3-SD 4.27Å; W326-M902 HydrophobicContact CH2-CB 3.83Å; W326-M902 WeakPolarHBondContact CH2-O 3.47Å; W326-M902 HydrophobicContact CZ3-CB 3.57Å; W326-M902 HydrophobicContact CZ3-CG 4.11Å; W326-M902 WeakPolarHBondContact CZ3-O 3.37Å; W326-F906 HydrophobicContact CH2-CB 3.5Å; W326-F906 HydrophobicContact CH2-CG 4.32Å; W326-F906 HydrophobicContact CZ2-CB 4.24Å; W326-F906 HydrophobicContact CZ3-CB 4.2Å
327	T	92.7	Very high	92.5	Very high	4 Å²	4	54.4 Å²	54.4	3%	0.025	28%	0.279	C	S	.	.	H	α-helix	trans	-66	-38.4	176.5	55.5	0	0	0	0	112	S323 I324 A331 I637 I905	S323-T327 WeakPolarHBondContact O-CB 3.16Å; S323-T327 VanDerWaalsContact O-CG2 3.25Å; S323-T327 WeakPolarHBondContact O-CG2 3.36Å; S323-T327 PolarHBondContact O-N 3.27Å; S323-T327 PolarHBondContact O-OG1 2.9Å; I324-T327 PolarHBondContact O-OG1 3.34Å; T327-A331 VanDerWaalsContact O-CB 3.24Å; T327-A331 WeakPolarHBondContact O-CB 3.35Å; T327-A331 PolarHBondContact O-N 3.14Å; T327-I637 HydrophobicContact CG2-CG2 4.39Å; T327-I905 HydrophobicContact CG2-CB 4.32Å; T327-I905 HydrophobicContact CG2-CD1 3.84Å; T327-I905 HydrophobicContact CG2-CG2 3.83Å
328	S	89.9	Confident	92.8	Very high	10 Å²	10	51 Å²	51	7%	0.07	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-43.8	177.7	-59.5	0	0	0	0	112.4	I324 M325 W326 A331 C332	I324-S328 VanDerWaalsContact O-CB 3.23Å; I324-S328 WeakPolarHBondContact O-CB 3.48Å; I324-S328 PolarHBondContact O-N 2.95Å; I324-S328 VanDerWaalsContact O-N 3.08Å; I324-S328 PolarHBondContact O-OG 3.45Å; M325-S328 PolarHBondContact O-N 2.93Å; W326-S328 PolarHBondContact O-N 3.43Å; S328-A331 PolarHBondContact O-N 3.19Å; S328-C332 WeakPolarHBondContact O-CB 3.39Å; S328-C332 PolarHBondContact O-N 3.26Å; S328-C332 PolarHBondContact O-SG 3.32Å
329	I	93.4	Very high	93.1	Very high	103 Å²	103	46.7 Å²	46.7	53%	0.528	24%	0.239	S	C	.	.	H	α-helix	trans	-61.1	-49.7	177.5	-70.4	163.2	0	0	0	110.4	M325 W326 A331 C332 I333	M325-I329 WeakPolarHBondContact O-CD1 3.4Å; M325-I329 VanDerWaalsContact O-CG1 3.25Å; M325-I329 WeakPolarHBondContact O-CG1 3.24Å; M325-I329 PolarHBondContact O-N 3.23Å; W326-I329 PolarHBondContact O-N 3.36Å; I329-A331 PolarHBondContact O-N 3.33Å; I329-C332 PolarHBondContact O-N 3.27Å; I329-I333 HydrophobicContact CG2-CD1 3.85Å; I329-I333 VanDerWaalsContact O-CG1 3.32Å; I329-I333 WeakPolarHBondContact O-CG1 3.11Å; I329-I333 PolarHBondContact O-N 3.07Å; I329-I333 VanDerWaalsContact O-N 3.08Å
330	L	94.6	Very high	93.2	Very high	30 Å²	30	50.9 Å²	50.9	16%	0.157	25%	0.252	C	S	.	.	H	α-helix	trans	-62.8	-40.6	178.7	-69.9	173.2	0	0	0	112.4	W326 I333 C334 F906 L909	W326-L330 HydrophobicContact CD2-CD1 3.72Å; W326-L330 HydrophobicContact CE3-CD1 3.76Å; W326-L330 HydrophobicContact CH2-CD1 3.83Å; W326-L330 HydrophobicContact CZ2-CD1 3.72Å; W326-L330 HydrophobicContact CZ3-CD1 3.8Å; W326-L330 WeakPolarHBondContact O-CG 3.32Å; W326-L330 PolarHBondContact O-N 2.82Å; W326-L330 VanDerWaalsContact O-N 3.15Å; L330-I333 PolarHBondContact O-N 2.92Å; L330-C334 WeakPolarHBondContact O-CB 3.44Å; L330-C334 PolarHBondContact O-N 3.14Å; L330-F906 HydrophobicContact CD1-CB 4.46Å; L330-F906 HydrophobicContact CD1-CD2 4.02Å; L330-L909 HydrophobicContact CB-CD1 3.66Å
331	A	95.4	Very high	93	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-66	-39.4	177.9	0	0	0	0	0	112.3	T327 S328 I329 C334 S335 F373 L909	T327-A331 VanDerWaalsContact O-CB 3.24Å; T327-A331 WeakPolarHBondContact O-CB 3.35Å; T327-A331 PolarHBondContact O-N 3.14Å; S328-A331 PolarHBondContact O-N 3.19Å; I329-A331 PolarHBondContact O-N 3.33Å; A331-C334 PolarHBondContact O-N 3.14Å; A331-S335 VanDerWaalsContact O-CB 3.31Å; A331-S335 WeakPolarHBondContact O-CB 3.37Å; A331-S335 PolarHBondContact O-N 3.09Å; A331-S335 PolarHBondContact O-OG 3.38Å; A331-F373 HydrophobicContact CB-CB 3.68Å; A331-F373 HydrophobicContact CB-CD2 4.21Å; A331-F373 HydrophobicContact CB-CG 4.29Å; A331-L909 HydrophobicContact CB-CD1 4.3Å; A331-L909 HydrophobicContact CB-CD2 4.41Å
332	C	94.9	Very high	93	Very high	49 Å²	49	45.9 Å²	45.9	33%	0.331	23%	0.229	S	C	.	.	H	α-helix	trans	-63	-47	174.5	-69.5	0	0	0	0	111.5	S328 I329 C334 S335 L336	S328-C332 WeakPolarHBondContact O-CB 3.39Å; S328-C332 PolarHBondContact O-N 3.26Å; S328-C332 PolarHBondContact O-SG 3.32Å; I329-C332 PolarHBondContact O-N 3.27Å; C332-C334 PolarHBondContact O-N 3.25Å; C332-S335 PolarHBondContact O-N 3.19Å; C332-L336 WeakPolarHBondContact O-CG 3.49Å; C332-L336 PolarHBondContact O-N 3.38Å
333	I	94.9	Very high	92.9	Very high	71 Å²	71	45.2 Å²	45.2	36%	0.364	23%	0.225	S	C	.	.	H	α-helix	trans	-62.3	-45	178.5	-63.5	165.4	0	0	0	110.7	I329 L330 S335 L336 I337 F913	I329-I333 HydrophobicContact CG2-CD1 3.85Å; I329-I333 VanDerWaalsContact O-CG1 3.32Å; I329-I333 WeakPolarHBondContact O-CG1 3.11Å; I329-I333 PolarHBondContact O-N 3.07Å; I329-I333 VanDerWaalsContact O-N 3.08Å; L330-I333 PolarHBondContact O-N 2.92Å; I333-S335 PolarHBondContact O-N 3.36Å; I333-L336 PolarHBondContact O-N 3.24Å; I333-I337 HydrophobicContact CG2-CD1 3.79Å; I333-I337 WeakPolarHBondContact O-CB 3.4Å; I333-I337 WeakPolarHBondContact O-CG1 3.49Å; I333-I337 PolarHBondContact O-N 2.82Å; I333-I337 VanDerWaalsContact O-N 3.12Å; I333-F913 HydrophobicContact CB-CZ 4.27Å; I333-F913 HydrophobicContact CG2-CE1 3.71Å; I333-F913 HydrophobicContact CG2-CZ 3.7Å
334	C	95	Very high	92.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-43.1	176.8	-170.3	0	0	0	0	111.9	L330 A331 C332 I337 T338 A370 L909 F913	L330-C334 WeakPolarHBondContact O-CB 3.44Å; L330-C334 PolarHBondContact O-N 3.14Å; A331-C334 PolarHBondContact O-N 3.14Å; C332-C334 PolarHBondContact O-N 3.25Å; C334-I337 PolarHBondContact O-N 3.03Å; C334-T338 WeakPolarHBondContact O-CB 3.38Å; C334-T338 WeakPolarHBondContact O-CG2 3.28Å; C334-T338 PolarHBondContact O-N 2.96Å; C334-T338 PolarHBondContact O-OG1 3.38Å; C334-A370 HydrophobicContact CB-CB 4.34Å; C334-L909 HydrophobicContact CB-CD2 4.18Å; C334-L909 PolarHBondContact SG-O 3.49Å; C334-L909 VanDerWaalsContact SG-O 3.36Å; C334-F913 HydrophobicContact CB-CD2 4.32Å; C334-F913 HydrophobicContact CB-CE2 3.7Å; C334-F913 HydrophobicContact CB-CZ 4.18Å
335	S	95.4	Very high	91.8	Very high	6 Å²	6	46.9 Å²	46.9	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-46.4	177.2	-59.5	0	0	0	0	111.7	A331 C332 I333 I337 T338 I339 A370	A331-S335 VanDerWaalsContact O-CB 3.31Å; A331-S335 WeakPolarHBondContact O-CB 3.37Å; A331-S335 PolarHBondContact O-N 3.09Å; A331-S335 PolarHBondContact O-OG 3.38Å; C332-S335 PolarHBondContact O-N 3.19Å; I333-S335 PolarHBondContact O-N 3.36Å; S335-I337 PolarHBondContact O-N 3.31Å; S335-T338 WeakPolarHBondContact CA-OG1 3.5Å; S335-T338 PolarHBondContact O-N 2.94Å; S335-T338 PolarHBondContact O-OG1 3.27Å; S335-T338 VanDerWaalsContact O-OG1 3.1Å; S335-I339 VanDerWaalsContact O-CB 3.27Å; S335-I339 WeakPolarHBondContact O-CB 3.2Å; S335-I339 WeakPolarHBondContact O-CD1 3.44Å; S335-I339 WeakPolarHBondContact O-CG1 3.35Å; S335-I339 PolarHBondContact O-N 3.01Å; S335-A370 VanDerWaalsContact OG-CB 3.31Å; S335-A370 WeakPolarHBondContact OG-CB 3.44Å
336	L	94.7	Very high	91.6	Very high	121 Å²	121	47.3 Å²	47.3	63%	0.634	23%	0.233	S	C	*	.	H	α-helix	trans	-62.4	-42.7	178.6	-70	169.5	0	0	0	112.4	C332 I333 Y340	C332-L336 WeakPolarHBondContact O-CG 3.49Å; C332-L336 PolarHBondContact O-N 3.38Å; I333-L336 PolarHBondContact O-N 3.24Å; L336-Y340 WeakPolarHBondContact O-CB 3.18Å; L336-Y340 PolarHBondContact O-N 3.03Å
337	I	94	Very high	91	Very high	39 Å²	39	47.3 Å²	47.3	20%	0.2	24%	0.238	C	C	.	.	H	α-helix	trans	-70.1	-38.5	-178.9	-73.2	171.4	0	0	0	112	I333 C334 S335 T341 F913 W920	I333-I337 HydrophobicContact CG2-CD1 3.79Å; I333-I337 WeakPolarHBondContact O-CB 3.4Å; I333-I337 WeakPolarHBondContact O-CG1 3.49Å; I333-I337 PolarHBondContact O-N 2.82Å; I333-I337 VanDerWaalsContact O-N 3.12Å; C334-I337 PolarHBondContact O-N 3.03Å; S335-I337 PolarHBondContact O-N 3.31Å; I337-T341 WeakPolarHBondContact O-CB 3.25Å; I337-T341 PolarHBondContact O-N 3.27Å; I337-T341 VanDerWaalsContact O-N 3.12Å; I337-T341 PolarHBondContact O-OG1 3.33Å; I337-F913 HydrophobicContact CD1-CD1 3.82Å; I337-F913 HydrophobicContact CD1-CE1 3.55Å; I337-W920 HydrophobicContact CG2-CH2 4.23Å; I337-W920 HydrophobicContact CG2-CZ2 4Å
338	T	93.9	Very high	90.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-73.3	-42.1	175.7	50.2	0	0	0	0	112	C334 S335 Y340 T341 L342	C334-T338 WeakPolarHBondContact O-CB 3.38Å; C334-T338 WeakPolarHBondContact O-CG2 3.28Å; C334-T338 PolarHBondContact O-N 2.96Å; C334-T338 PolarHBondContact O-OG1 3.38Å; S335-T338 WeakPolarHBondContact CA-OG1 3.5Å; S335-T338 PolarHBondContact O-N 2.94Å; S335-T338 PolarHBondContact O-OG1 3.27Å; S335-T338 VanDerWaalsContact O-OG1 3.1Å; T338-Y340 PolarHBondContact O-N 2.64Å; T338-T341 PolarHBondContact O-N 3.07Å; T338-L342 WeakPolarHBondContact O-CB 3.41Å; T338-L342 WeakPolarHBondContact O-CG 3.37Å; T338-L342 PolarHBondContact O-N 2.93Å
339	I	94.4	Very high	89.3	Confident	64 Å²	64	55.1 Å²	55.1	33%	0.328	28%	0.278	S	S	.	.	H	α-helix	trans	-54.1	-51.9	171.2	-74.7	164.2	0	0	0	110.6	S335 T341 L342 I343 L367	S335-I339 VanDerWaalsContact O-CB 3.27Å; S335-I339 WeakPolarHBondContact O-CB 3.2Å; S335-I339 WeakPolarHBondContact O-CD1 3.44Å; S335-I339 WeakPolarHBondContact O-CG1 3.35Å; S335-I339 PolarHBondContact O-N 3.01Å; I339-T341 VanDerWaalsContact C-N 3.29Å; I339-T341 PolarHBondContact O-N 2.92Å; I339-L342 PolarHBondContact O-N 3.21Å; I339-I343 HydrophobicContact CG2-CD1 3.61Å; I339-I343 HydrophobicContact CG2-CG1 4.33Å; I339-I343 WeakPolarHBondContact O-CB 3.33Å; I339-I343 WeakPolarHBondContact O-CG1 3.42Å; I339-I343 PolarHBondContact O-N 3.17Å; I339-L367 HydrophobicContact CD1-CD1 3.97Å; I339-L367 HydrophobicContact CG1-CD1 3.59Å; I339-L367 HydrophobicContact CG1-CD2 3.68Å; I339-L367 HydrophobicContact CG1-CG 4.31Å
340	Y	91.1	Very high	88	Confident	106 Å²	106	56.2 Å²	56.2	42%	0.416	30%	0.295	S	S	.	.	H	α-helix	trans	-58.6	-42.1	178.8	175.7	-119.6	0	0	0	111.9	L336 T338 I343 R344 W920	L336-Y340 WeakPolarHBondContact O-CB 3.18Å; L336-Y340 PolarHBondContact O-N 3.03Å; T338-Y340 PolarHBondContact O-N 2.64Å; Y340-I343 PolarHBondContact O-N 3.39Å; Y340-R344 HydrophobicContact CD2-CG 4.39Å; Y340-R344 HydrophobicContact CE2-CG 4.11Å; Y340-R344 VanDerWaalsContact O-CG 3.3Å; Y340-R344 WeakPolarHBondContact O-CG 3.26Å; Y340-R344 PolarHBondContact O-N 2.9Å; Y340-W920 AromaticContact CD1-CZ2 3.86Å; Y340-W920 HydrophobicContact CD1-CZ2 3.86Å; Y340-W920 HydrophobicContact CE1-CZ2 4.18Å
341	T	88.1	Confident	86.6	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.012	31%	0.309	C	S	.	.	H	α-helix	trans	-64.8	-41.3	177.7	-62.4	0	0	0	0	112.5	I337 T338 I339 R344 Y345 S916 M919 W920	I337-T341 WeakPolarHBondContact O-CB 3.25Å; I337-T341 PolarHBondContact O-N 3.27Å; I337-T341 VanDerWaalsContact O-N 3.12Å; I337-T341 PolarHBondContact O-OG1 3.33Å; T338-T341 PolarHBondContact O-N 3.07Å; I339-T341 VanDerWaalsContact C-N 3.29Å; I339-T341 PolarHBondContact O-N 2.92Å; T341-R344 PolarHBondContact O-N 3.27Å; T341-Y345 PolarHBondContact O-N 3.35Å; T341-S916 WeakPolarHBondContact OG1-CB 3.48Å; T341-S916 PolarHBondContact OG1-OG 2.94Å; T341-M919 HydrophobicContact CG2-CB 3.66Å; T341-M919 HydrophobicContact CG2-CE 4.16Å; T341-M919 HydrophobicContact CG2-CG 3.65Å; T341-W920 PolarHBondContact OG1-NE1 3Å; T341-W920 VanDerWaalsContact OG1-NE1 3.1Å
342	L	90.6	Very high	85.3	Confident	20 Å²	20	60.9 Å²	60.9	11%	0.105	32%	0.315	C	S	.	.	H	α-helix	trans	-69.5	-40.1	177.6	-69.9	164.9	0	0	0	112.1	T338 I339 R344 Y345 I346 I360 A363 L364 L367	T338-L342 WeakPolarHBondContact O-CB 3.41Å; T338-L342 WeakPolarHBondContact O-CG 3.37Å; T338-L342 PolarHBondContact O-N 2.93Å; I339-L342 PolarHBondContact O-N 3.21Å; L342-R344 VanDerWaalsContact C-N 3.35Å; L342-R344 PolarHBondContact O-N 3.06Å; L342-Y345 WeakPolarHBondContact O-CB 3.23Å; L342-Y345 PolarHBondContact O-N 3.24Å; L342-I346 VanDerWaalsContact O-CG1 3.31Å; L342-I346 WeakPolarHBondContact O-CG1 3.42Å; L342-I346 PolarHBondContact O-N 3.3Å; L342-I360 HydrophobicContact CD2-CG2 3.89Å; L342-A363 HydrophobicContact CD2-CB 4.41Å; L342-L364 HydrophobicContact CD1-CB 4.43Å; L342-L364 HydrophobicContact CD2-CB 4.22Å; L342-L367 HydrophobicContact CD1-CB 4.13Å; L342-L367 HydrophobicContact CD1-CD2 3.62Å
343	I	89	Confident	84	Confident	84 Å²	84	65 Å²	65	43%	0.431	32%	0.324	S	S	.	.	H	α-helix	trans	-57.2	-48.4	171.8	-72.3	170	0	0	0	110.2	I339 Y340 Y345 I346 M347	I339-I343 HydrophobicContact CG2-CD1 3.61Å; I339-I343 HydrophobicContact CG2-CG1 4.33Å; I339-I343 WeakPolarHBondContact O-CB 3.33Å; I339-I343 WeakPolarHBondContact O-CG1 3.42Å; I339-I343 PolarHBondContact O-N 3.17Å; Y340-I343 PolarHBondContact O-N 3.39Å; I343-Y345 VanDerWaalsContact C-N 3.28Å; I343-Y345 PolarHBondContact O-N 2.99Å; I343-I346 PolarHBondContact O-N 3.39Å; I343-M347 HydrophobicContact CG2-CG 4.4Å; I343-M347 HydrophobicContact CG2-SD 3.54Å; I343-M347 VanDerWaalsContact CG2-SD 3.54Å; I343-M347 WeakPolarHBondContact O-CB 3.46Å; I343-M347 VanDerWaalsContact O-CG 3.22Å; I343-M347 WeakPolarHBondContact O-CG 3.36Å; I343-M347 PolarHBondContact O-N 3.05Å
344	R	81.3	Confident	82.6	Confident	48 Å²	48	64.1 Å²	64.1	18%	0.181	32%	0.317	C	S	.	.	H	α-helix	trans	-61.4	-34.6	177.2	-69.6	-175.4	80.3	178.9	10.1	113.3	Y340 T341 L342 N348 G924 C928	Y340-R344 HydrophobicContact CD2-CG 4.39Å; Y340-R344 HydrophobicContact CE2-CG 4.11Å; Y340-R344 VanDerWaalsContact O-CG 3.3Å; Y340-R344 WeakPolarHBondContact O-CG 3.26Å; Y340-R344 PolarHBondContact O-N 2.9Å; T341-R344 PolarHBondContact O-N 3.27Å; L342-R344 VanDerWaalsContact C-N 3.35Å; L342-R344 PolarHBondContact O-N 3.06Å; R344-N348 PolarHBondContact O-N 3.41Å; R344-N348 PolarHBondContact O-ND2 2.99Å; R344-G924 PolarHBondContact NH2-O 3.22Å; R344-C928 PolarHBondContact NH2-SG 3.43Å
345	Y	81.9	Confident	81.5	Confident	23 Å²	23	66.4 Å²	66.4	9%	0.09	33%	0.329	C	S	.	.	H	α-helix	trans	-66.1	-52.1	173.5	171.4	-96.5	0	0	0	111.6	T341 L342 I343 M347 N348 L349 F352 I360 M919	T341-Y345 PolarHBondContact O-N 3.35Å; L342-Y345 WeakPolarHBondContact O-CB 3.23Å; L342-Y345 PolarHBondContact O-N 3.24Å; I343-Y345 VanDerWaalsContact C-N 3.28Å; I343-Y345 PolarHBondContact O-N 2.99Å; Y345-M347 VanDerWaalsContact C-N 3.29Å; Y345-M347 PolarHBondContact O-N 3.33Å; Y345-N348 CarbonylContact O-C 3.44Å; Y345-N348 VanDerWaalsContact O-C 3.29Å; Y345-N348 PolarHBondContact O-N 2.96Å; Y345-L349 HydrophobicContact CE1-CD1 3.72Å; Y345-L349 PolarHBondContact O-N 3.34Å; Y345-L349 VanDerWaalsContact O-N 3.08Å; Y345-L349 WeakPolarHBondContact OH-CD1 3.17Å; Y345-F352 HydrophobicContact CD2-CB 4.4Å; Y345-F352 HydrophobicContact CD2-CD1 4.06Å; Y345-F352 AromaticContact CD2-CD2 3.34Å; Y345-F352 HydrophobicContact CD2-CD2 3.34Å; Y345-F352 HydrophobicContact CD2-CE1 4.22Å; Y345-F352 AromaticContact CD2-CE2 3.51Å; Y345-F352 HydrophobicContact CD2-CE2 3.51Å; Y345-F352 AromaticContact CD2-CG 3.64Å; Y345-F352 HydrophobicContact CD2-CG 3.64Å; Y345-F352 AromaticContact CD2-CZ 3.96Å; Y345-F352 HydrophobicContact CD2-CZ 3.96Å; Y345-F352 HydrophobicContact CE2-CB 3.86Å; Y345-F352 HydrophobicContact CE2-CD1 4.31Å; Y345-F352 AromaticContact CE2-CD2 3.53Å; Y345-F352 HydrophobicContact CE2-CD2 3.53Å; Y345-F352 HydrophobicContact CE2-CE2 4.19Å; Y345-F352 AromaticContact CE2-CG 3.6Å; Y345-F352 HydrophobicContact CE2-CG 3.6Å; Y345-F352 HydrophobicContact CG-CD2 4.41Å; Y345-F352 HydrophobicContact CG-CE2 4.28Å; Y345-I360 HydrophobicContact CD1-CG2 3.69Å; Y345-I360 HydrophobicContact CD2-CD1 3.51Å; Y345-I360 HydrophobicContact CD2-CG1 3.7Å; Y345-I360 HydrophobicContact CD2-CG2 4.06Å; Y345-I360 HydrophobicContact CE1-CG2 3.83Å; Y345-I360 HydrophobicContact CE2-CB 4.44Å; Y345-I360 HydrophobicContact CE2-CD1 3.96Å; Y345-I360 HydrophobicContact CE2-CG1 3.62Å; Y345-I360 HydrophobicContact CE2-CG2 4.2Å; Y345-I360 HydrophobicContact CG-CD1 4.06Å; Y345-I360 HydrophobicContact CG-CG1 4.3Å; Y345-I360 HydrophobicContact CG-CG2 3.81Å; Y345-M919 HydrophobicContact CD2-CE 4.4Å
346	I	84.4	Confident	80.6	Confident	122 Å²	122	66.2 Å²	66.2	63%	0.626	33%	0.328	S	S	*	.	H	α-helix	trans	-56.3	-44.7	-179.8	-68.1	163.2	0	0	0	110.7	L342 I343 N348	L342-I346 VanDerWaalsContact O-CG1 3.31Å; L342-I346 WeakPolarHBondContact O-CG1 3.42Å; L342-I346 PolarHBondContact O-N 3.3Å; I343-I346 PolarHBondContact O-N 3.39Å; I346-N348 PolarHBondContact O-N 3.09Å; I346-N348 VanDerWaalsContact O-N 3.16Å
347	M	81.4	Confident	80	Confident	92 Å²	92	63.1 Å²	63.1	45%	0.453	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-13.5	177.9	-66.5	168.5	74.4	0	0	114.5	I343 Y345 F931	I343-M347 HydrophobicContact CG2-CG 4.4Å; I343-M347 HydrophobicContact CG2-SD 3.54Å; I343-M347 VanDerWaalsContact CG2-SD 3.54Å; I343-M347 WeakPolarHBondContact O-CB 3.46Å; I343-M347 VanDerWaalsContact O-CG 3.22Å; I343-M347 WeakPolarHBondContact O-CG 3.36Å; I343-M347 PolarHBondContact O-N 3.05Å; Y345-M347 VanDerWaalsContact C-N 3.29Å; Y345-M347 PolarHBondContact O-N 3.33Å; M347-F931 HydrophobicContact CE-CD1 4.02Å; M347-F931 HydrophobicContact CE-CD2 4.16Å; M347-F931 HydrophobicContact CE-CE1 3.41Å; M347-F931 VanDerWaalsContact CE-CE1 3.41Å; M347-F931 HydrophobicContact CE-CE2 3.57Å; M347-F931 HydrophobicContact CE-CG 4.37Å; M347-F931 HydrophobicContact CE-CZ 3.16Å
348	N	74.1	Confident	79.7	Confident	65 Å²	65	61.5 Å²	61.5	35%	0.348	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134	31.3	-176	-63.4	-90.4	0	0	0	112.3	R344 Y345 I346 S350 H351 F352	R344-N348 PolarHBondContact O-N 3.41Å; R344-N348 PolarHBondContact O-ND2 2.99Å; Y345-N348 CarbonylContact O-C 3.44Å; Y345-N348 VanDerWaalsContact O-C 3.29Å; Y345-N348 PolarHBondContact O-N 2.96Å; I346-N348 PolarHBondContact O-N 3.09Å; I346-N348 VanDerWaalsContact O-N 3.16Å; N348-S350 PolarHBondContact O-N 3.28Å; N348-H351 PolarHBondContact O-N 3.41Å; N348-F352 HydrophobicContact CB-CE2 4.02Å; N348-F352 WeakPolarHBondContact O-CD2 3.26Å; N348-F352 WeakPolarHBondContact O-CE2 3.17Å
349	L	73.7	Confident	79.4	Confident	112 Å²	112	61.5 Å²	61.5	59%	0.586	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-49.8	-34.2	-172.2	-175.2	63.7	0	0	0	114.3	Y345 H351	Y345-L349 HydrophobicContact CE1-CD1 3.72Å; Y345-L349 PolarHBondContact O-N 3.34Å; Y345-L349 VanDerWaalsContact O-N 3.08Å; Y345-L349 WeakPolarHBondContact OH-CD1 3.17Å; L349-H351 VanDerWaalsContact C-N 3.29Å; L349-H351 PolarHBondContact O-N 3.07Å
350	S	65.8	Low	79.2	Confident	126 Å²	126	58.8 Å²	58.8	88%	0.881	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-73.3	-9.6	-180	56	0	0	0	0	115.3	N348	N348-S350 PolarHBondContact O-N 3.28Å
351	H	65.5	Low	79.2	Confident	98 Å²	98	55.1 Å²	55.1	45%	0.454	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-107.8	1.5	-171.4	-163.7	56.9	0	0	0	114.9	N348 L349 K923	N348-H351 PolarHBondContact O-N 3.41Å; L349-H351 VanDerWaalsContact C-N 3.29Å; L349-H351 PolarHBondContact O-N 3.07Å; H351-K923 PolarHBondContact O-NZ 3.04Å
352	F	67.7	Low	79.5	Confident	31 Å²	31	55 Å²	55	14%	0.136	27%	0.272	C	S	.	.			trans	-93	126.4	178	-68.4	-84.7	0	0	0	111.5	Y345 N348 E356 M919 K923	Y345-F352 HydrophobicContact CD2-CB 4.4Å; Y345-F352 HydrophobicContact CD2-CD1 4.06Å; Y345-F352 AromaticContact CD2-CD2 3.34Å; Y345-F352 HydrophobicContact CD2-CD2 3.34Å; Y345-F352 HydrophobicContact CD2-CE1 4.22Å; Y345-F352 AromaticContact CD2-CE2 3.51Å; Y345-F352 HydrophobicContact CD2-CE2 3.51Å; Y345-F352 AromaticContact CD2-CG 3.64Å; Y345-F352 HydrophobicContact CD2-CG 3.64Å; Y345-F352 AromaticContact CD2-CZ 3.96Å; Y345-F352 HydrophobicContact CD2-CZ 3.96Å; Y345-F352 HydrophobicContact CE2-CB 3.86Å; Y345-F352 HydrophobicContact CE2-CD1 4.31Å; Y345-F352 AromaticContact CE2-CD2 3.53Å; Y345-F352 HydrophobicContact CE2-CD2 3.53Å; Y345-F352 HydrophobicContact CE2-CE2 4.19Å; Y345-F352 AromaticContact CE2-CG 3.6Å; Y345-F352 HydrophobicContact CE2-CG 3.6Å; Y345-F352 HydrophobicContact CG-CD2 4.41Å; Y345-F352 HydrophobicContact CG-CE2 4.28Å; N348-F352 HydrophobicContact CB-CE2 4.02Å; N348-F352 WeakPolarHBondContact O-CD2 3.26Å; N348-F352 WeakPolarHBondContact O-CE2 3.17Å; F352-E356 VanDerWaalsContact CA-OE2 3.26Å; F352-E356 WeakPolarHBondContact CA-OE2 3.4Å; F352-E356 VanDerWaalsContact CD1-OE2 3.29Å; F352-E356 WeakPolarHBondContact CD1-OE2 3.24Å; F352-M919 HydrophobicContact CD1-CE 4.32Å; F352-M919 HydrophobicContact CD1-SD 4.44Å; F352-M919 HydrophobicContact CE1-CE 3.41Å; F352-M919 VanDerWaalsContact CE1-CE 3.41Å; F352-M919 HydrophobicContact CE1-SD 3.8Å; F352-M919 HydrophobicContact CZ-CE 3.63Å; F352-K923 HydrophobicContact CE1-CD 4.31Å
353	R	66.8	Low	79.6	Confident	135 Å²	135	54.1 Å²	54.1	51%	0.509	27%	0.268	S	S	.	.			trans	-69.2	152.9	177.4	-63.3	178.2	170.5	-161	-0.6	109.1	N355 E356 D798	R353-N355 VanDerWaalsContact C-N 3.28Å; R353-N355 PolarHBondContact O-N 3.45Å; R353-E356 HydrophobicContact CB-CG 3.91Å; R353-E356 WeakPolarHBondContact CB-OE1 3.38Å; R353-E356 WeakPolarHBondContact CG-OE1 3.4Å; R353-E356 VanDerWaalsContact N-CD 3.29Å; R353-E356 PolarHBondContact N-OE2 3.33Å; R353-E356 VanDerWaalsContact O-CB 3.3Å; R353-E356 WeakPolarHBondContact O-CB 3.37Å; R353-E356 PolarHBondContact O-N 3.01Å; R353-D798 IonicContact NH1-OD2 2.91Å
354	F	66.9	Low	79.9	Confident	52 Å²	52	52.8 Å²	52.8	23%	0.228	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-48.4	-48.8	-179.5	-174.5	-87.4	0	0	0	113	E356 K357 H431 V603 L607	F354-E356 PolarHBondContact O-N 3.46Å; F354-E356 VanDerWaalsContact O-N 3.11Å; F354-K357 WeakPolarHBondContact O-CB 3.39Å; F354-K357 WeakPolarHBondContact O-CG 3.45Å; F354-K357 PolarHBondContact O-N 3.12Å; F354-K357 VanDerWaalsContact O-N 3.13Å; F354-H431 AromaticContact CD1-NE2 3.8Å; F354-H431 AromaticContact CE1-NE2 3.75Å; F354-V603 HydrophobicContact CD2-CG1 3.42Å; F354-V603 VanDerWaalsContact CD2-CG1 3.42Å; F354-V603 HydrophobicContact CE1-CG1 4.47Å; F354-V603 HydrophobicContact CE2-CG1 3.24Å; F354-V603 HydrophobicContact CG-CG1 4.12Å; F354-V603 HydrophobicContact CZ-CG1 3.83Å; F354-L607 HydrophobicContact CD2-CD2 4.45Å; F354-L607 HydrophobicContact CE2-CB 3.71Å; F354-L607 HydrophobicContact CE2-CD1 4.18Å; F354-L607 HydrophobicContact CE2-CD2 3.85Å; F354-L607 HydrophobicContact CE2-CG 4.12Å; F354-L607 HydrophobicContact CZ-CB 3.8Å; F354-L607 HydrophobicContact CZ-CD1 4Å; F354-L607 HydrophobicContact CZ-CD2 4.48Å; F354-L607 HydrophobicContact CZ-CG 4.3Å
355	N	71.5	Confident	80.6	Confident	48 Å²	48	50.5 Å²	50.5	26%	0.257	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-67.2	-10.1	-178.1	-56.1	-9.5	0	0	0	114.3	R353 H431 Q435 I804	R353-N355 VanDerWaalsContact C-N 3.28Å; R353-N355 PolarHBondContact O-N 3.45Å; N355-H431 PolarHBondContact OD1-NE2 3.1Å; N355-Q435 PolarHBondContact ND2-OE1 3.23Å; N355-I804 HydrophobicContact CB-CD1 4.05Å
356	E	76.7	Confident	81.2	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.009	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-88.9	-19.6	177.9	-53.2	171.3	-178.9	0	0	111.5	F352 R353 F354 I359 M800 W918 K923	F352-E356 VanDerWaalsContact CA-OE2 3.26Å; F352-E356 WeakPolarHBondContact CA-OE2 3.4Å; F352-E356 VanDerWaalsContact CD1-OE2 3.29Å; F352-E356 WeakPolarHBondContact CD1-OE2 3.24Å; R353-E356 HydrophobicContact CB-CG 3.91Å; R353-E356 WeakPolarHBondContact CB-OE1 3.38Å; R353-E356 WeakPolarHBondContact CG-OE1 3.4Å; R353-E356 VanDerWaalsContact N-CD 3.29Å; R353-E356 PolarHBondContact N-OE2 3.33Å; R353-E356 VanDerWaalsContact O-CB 3.3Å; R353-E356 WeakPolarHBondContact O-CB 3.37Å; R353-E356 PolarHBondContact O-N 3.01Å; F354-E356 PolarHBondContact O-N 3.46Å; F354-E356 VanDerWaalsContact O-N 3.11Å; E356-I359 PolarHBondContact O-N 3.49Å; E356-M800 HydrophobicContact CG-CE 3.7Å; E356-M800 WeakPolarHBondContact OE1-CE 3.46Å; E356-W918 HydrophobicContact CB-CH2 4.11Å; E356-W918 HydrophobicContact CG-CH2 4.02Å; E356-K923 IonicContact OE1-NZ 2.66Å; E356-K923 PolarHBondContact OE1-NZ 2.91Å; E356-K923 IonicContact OE2-NZ 3.48Å; E356-K923 PolarHBondContact OE2-NZ 3.32Å
357	K	81.7	Confident	81.8	Confident	56 Å²	56	44.8 Å²	44.8	24%	0.243	23%	0.225	C	C	.	.	H	α-helix	trans	-60.3	-41.6	-172.3	-67.7	-175.3	176.2	-174	0	115.1	F354 I359 I360 Y361 L607	F354-K357 WeakPolarHBondContact O-CB 3.39Å; F354-K357 WeakPolarHBondContact O-CG 3.45Å; F354-K357 PolarHBondContact O-N 3.12Å; F354-K357 VanDerWaalsContact O-N 3.13Å; K357-I359 PolarHBondContact O-N 3.37Å; K357-I360 VanDerWaalsContact O-CB 3.3Å; K357-I360 WeakPolarHBondContact O-CB 3.31Å; K357-I360 PolarHBondContact O-N 2.93Å; K357-Y361 HydrophobicContact CB-CE2 4.01Å; K357-Y361 WeakPolarHBondContact O-CD2 3.08Å; K357-Y361 PolarHBondContact O-N 3.02Å; K357-L607 HydrophobicContact CD-CD2 3.84Å
358	P	87.1	Confident	82.5	Confident	6 Å²	6	44.1 Å²	44.1	4%	0.039	22%	0.22	C	C	.	.	H	α-helix	trans	-58.8	-33	-179.9	-25.9	35.7	0	0	0	113.6	I360 Y361 I362 W424 L428	P358-I360 PolarHBondContact O-N 2.96Å; P358-Y361 PolarHBondContact O-N 3.25Å; P358-Y361 VanDerWaalsContact O-N 3.11Å; P358-I362 WeakPolarHBondContact O-CG1 3.25Å; P358-I362 PolarHBondContact O-N 3.03Å; P358-W424 HydrophobicContact CB-CE3 4.14Å; P358-L428 HydrophobicContact CB-CB 4.08Å; P358-L428 HydrophobicContact CB-CD1 4.12Å; P358-L428 HydrophobicContact CG-CD1 4.19Å
359	I	88.8	Confident	83.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.4	-30.2	178.6	-58.5	171.5	0	0	0	111.1	E356 K357 A363 L428 F807 C915 W918	E356-I359 PolarHBondContact O-N 3.49Å; K357-I359 PolarHBondContact O-N 3.37Å; I359-A363 WeakPolarHBondContact O-CB 3.27Å; I359-A363 PolarHBondContact O-N 3.43Å; I359-L428 HydrophobicContact CD1-CD2 4.19Å; I359-L428 HydrophobicContact CG1-CD1 4.46Å; I359-L428 HydrophobicContact CG1-CD2 3.58Å; I359-F807 HydrophobicContact CD1-CD1 3.98Å; I359-F807 HydrophobicContact CD1-CE1 4.18Å; I359-F807 HydrophobicContact CD1-CG 4.46Å; I359-F807 HydrophobicContact CG1-CD1 4.17Å; I359-F807 HydrophobicContact CG1-CE1 3.87Å; I359-F807 HydrophobicContact CG1-CZ 4.45Å; I359-F807 HydrophobicContact CG2-CE1 4.35Å; I359-F807 HydrophobicContact CG2-CE2 4.48Å; I359-F807 HydrophobicContact CG2-CZ 4.09Å; I359-C915 HydrophobicContact CG2-CB 4.46Å; I359-W918 HydrophobicContact CB-CZ3 4.5Å; I359-W918 HydrophobicContact CD1-CD2 3.96Å; I359-W918 HydrophobicContact CD1-CE3 3.93Å; I359-W918 HydrophobicContact CD1-CH2 3.54Å; I359-W918 HydrophobicContact CD1-CZ2 3.54Å; I359-W918 HydrophobicContact CD1-CZ3 3.74Å; I359-W918 HydrophobicContact CG2-CD2 4.48Å; I359-W918 HydrophobicContact CG2-CE3 3.95Å; I359-W918 HydrophobicContact CG2-CZ3 4.31Å
360	I	89	Confident	84.7	Confident	6 Å²	6	37 Å²	37	3%	0.031	18%	0.18	C	C	.	.	H	α-helix	trans	-70.8	-39.8	174.8	-46.1	-60.5	0	0	0	111.1	L342 Y345 K357 P358 A363 L364 M919	L342-I360 HydrophobicContact CD2-CG2 3.89Å; Y345-I360 HydrophobicContact CD1-CG2 3.69Å; Y345-I360 HydrophobicContact CD2-CD1 3.51Å; Y345-I360 HydrophobicContact CD2-CG1 3.7Å; Y345-I360 HydrophobicContact CD2-CG2 4.06Å; Y345-I360 HydrophobicContact CE1-CG2 3.83Å; Y345-I360 HydrophobicContact CE2-CB 4.44Å; Y345-I360 HydrophobicContact CE2-CD1 3.96Å; Y345-I360 HydrophobicContact CE2-CG1 3.62Å; Y345-I360 HydrophobicContact CE2-CG2 4.2Å; Y345-I360 HydrophobicContact CG-CD1 4.06Å; Y345-I360 HydrophobicContact CG-CG1 4.3Å; Y345-I360 HydrophobicContact CG-CG2 3.81Å; K357-I360 VanDerWaalsContact O-CB 3.3Å; K357-I360 WeakPolarHBondContact O-CB 3.31Å; K357-I360 PolarHBondContact O-N 2.93Å; P358-I360 PolarHBondContact O-N 2.96Å; I360-A363 PolarHBondContact O-N 3.39Å; I360-L364 WeakPolarHBondContact O-CB 3.45Å; I360-L364 PolarHBondContact O-N 3.18Å; I360-M919 HydrophobicContact CD1-CE 3.35Å; I360-M919 HydrophobicContact CD1-CG 4.47Å; I360-M919 HydrophobicContact CD1-SD 3.44Å; I360-M919 WeakPolarHBondContact CD1-SD 3.41Å
361	Y	92	Very high	86.1	Confident	29 Å²	29	33.5 Å²	33.5	11%	0.114	15%	0.151	C	C	.	.	H	α-helix	trans	-71.5	-34.6	178	-50.6	-45.1	0	0	0	111.6	K357 P358 L364 C365 W424 H611	K357-Y361 HydrophobicContact CB-CE2 4.01Å; K357-Y361 WeakPolarHBondContact O-CD2 3.08Å; K357-Y361 PolarHBondContact O-N 3.02Å; P358-Y361 PolarHBondContact O-N 3.25Å; P358-Y361 VanDerWaalsContact O-N 3.11Å; Y361-L364 PolarHBondContact O-N 3.26Å; Y361-C365 PolarHBondContact O-N 3.42Å; Y361-C365 PolarHBondContact O-SG 3.11Å; Y361-W424 HydrophobicContact CD2-CD2 4.21Å; Y361-W424 HydrophobicContact CD2-CE3 4.05Å; Y361-W424 AromaticContact CD2-CH2 3.59Å; Y361-W424 HydrophobicContact CD2-CH2 3.59Å; Y361-W424 AromaticContact CD2-CZ2 3.73Å; Y361-W424 HydrophobicContact CD2-CZ2 3.73Å; Y361-W424 AromaticContact CD2-CZ3 3.76Å; Y361-W424 HydrophobicContact CD2-CZ3 3.76Å; Y361-W424 HydrophobicContact CE2-CH2 4.06Å; Y361-W424 HydrophobicContact CE2-CZ2 4.47Å; Y361-W424 HydrophobicContact CE2-CZ3 4.34Å; Y361-W424 HydrophobicContact CG-CH2 4.43Å; Y361-W424 HydrophobicContact CG-CZ2 4.12Å; Y361-H611 AromaticContact CD1-CE1 3.12Å; Y361-H611 WeakPolarHBondContact CD1-CE1 3Å; Y361-H611 AromaticContact CD2-CE1 3.12Å; Y361-H611 WeakPolarHBondContact CD2-CE1 3.4Å; Y361-H611 AromaticContact CE1-CE1 2.79Å; Y361-H611 WeakPolarHBondContact CE1-CE1 3.43Å; Y361-H611 AromaticContact CE1-NE2 3.82Å; Y361-H611 AromaticContact CE2-CE1 2.8Å; Y361-H611 WeakPolarHBondContact CE2-CE1 3.26Å; Y361-H611 AromaticContact CE2-NE2 3.22Å; Y361-H611 WeakPolarHBondContact CE2-NE2 3.5Å; Y361-H611 AromaticContact CG-CE1 3.3Å; Y361-H611 AromaticContact CZ-CE1 2.63Å; Y361-H611 AromaticContact CZ-NE2 2.87Å; Y361-H611 PolarHBondContact OH-CE1 3.31Å; Y361-H611 VanDerWaalsContact OH-CE1 3.24Å; Y361-H611 PolarHBondContact OH-NE2 3.5Å
362	I	93.6	Very high	87.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.5	-49.1	166.9	-63.1	170.2	0	0	0	110.4	P358 L364 C365 Q366 W424 W425 L428 Y811 C915	P358-I362 WeakPolarHBondContact O-CG1 3.25Å; P358-I362 PolarHBondContact O-N 3.03Å; I362-L364 VanDerWaalsContact C-N 3.27Å; I362-L364 PolarHBondContact O-N 2.92Å; I362-C365 WeakPolarHBondContact O-CB 3.38Å; I362-C365 PolarHBondContact O-N 2.96Å; I362-Q366 HydrophobicContact CG2-CG 4.44Å; I362-Q366 WeakPolarHBondContact O-CG 3.24Å; I362-Q366 PolarHBondContact O-N 3.12Å; I362-W424 HydrophobicContact CD1-CB 4.33Å; I362-W424 HydrophobicContact CG1-CB 3.6Å; I362-W425 HydrophobicContact CD1-CB 4.22Å; I362-L428 HydrophobicContact CD1-CD2 4.32Å; I362-Y811 HydrophobicContact CG2-CE2 3.65Å; I362-Y811 WeakPolarHBondContact CG2-OH 3.36Å; I362-C915 WeakPolarHBondContact CG2-SG 3.38Å
363	A	93.4	Very high	88.8	Confident	2 Å²	2	27.8 Å²	27.8	2%	0.017	13%	0.125	C	C	.	.	H	α-helix	trans	-60.9	-34.5	177.9	0	0	0	0	0	113.2	L342 I359 I360 L367 C915	L342-A363 HydrophobicContact CD2-CB 4.41Å; I359-A363 WeakPolarHBondContact O-CB 3.27Å; I359-A363 PolarHBondContact O-N 3.43Å; I360-A363 PolarHBondContact O-N 3.39Å; A363-L367 PolarHBondContact O-N 2.8Å; A363-C915 HydrophobicContact CB-CB 4.1Å
364	L	94.2	Very high	90.1	Very high	56 Å²	56	22.1 Å²	22.1	29%	0.293	11%	0.106	S	C	.	.	H	α-helix	trans	-69	-43.6	173.8	-179.9	146.2	0	0	0	111.9	L342 I360 Y361 I362 Q366 L367 F368 F417 W615	L342-L364 HydrophobicContact CD1-CB 4.43Å; L342-L364 HydrophobicContact CD2-CB 4.22Å; I360-L364 WeakPolarHBondContact O-CB 3.45Å; I360-L364 PolarHBondContact O-N 3.18Å; Y361-L364 PolarHBondContact O-N 3.26Å; I362-L364 VanDerWaalsContact C-N 3.27Å; I362-L364 PolarHBondContact O-N 2.92Å; L364-Q366 VanDerWaalsContact C-N 3.33Å; L364-Q366 PolarHBondContact O-N 2.93Å; L364-L367 PolarHBondContact O-N 2.91Å; L364-F368 HydrophobicContact CD2-CD2 3.9Å; L364-F368 HydrophobicContact CD2-CE2 3.88Å; L364-F368 HydrophobicContact CG-CD2 4.19Å; L364-F368 HydrophobicContact CG-CE2 4.01Å; L364-F368 WeakPolarHBondContact O-CD2 3.32Å; L364-F368 PolarHBondContact O-N 3.48Å; L364-F368 VanDerWaalsContact O-N 3.17Å; L364-F417 HydrophobicContact CD2-CE1 4.18Å; L364-W615 HydrophobicContact CD2-CH2 4.21Å
365	C	96.5	Very high	91.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-58.5	-45.6	172.5	-71.2	0	0	0	0	111.7	Y361 I362 L367 F368 Y369 F417	Y361-C365 PolarHBondContact O-N 3.42Å; Y361-C365 PolarHBondContact O-SG 3.11Å; I362-C365 WeakPolarHBondContact O-CB 3.38Å; I362-C365 PolarHBondContact O-N 2.96Å; C365-L367 VanDerWaalsContact C-N 3.34Å; C365-L367 PolarHBondContact O-N 2.83Å; C365-F368 PolarHBondContact O-N 2.9Å; C365-Y369 WeakPolarHBondContact O-CB 3.49Å; C365-Y369 PolarHBondContact O-N 3.19Å; C365-F417 HydrophobicContact CB-CB 4.25Å; C365-F417 HydrophobicContact CB-CD1 4.35Å; C365-F417 WeakPolarHBondContact CB-O 3.47Å
366	Q	95.3	Very high	92.3	Very high	4 Å²	4	20 Å²	20	2%	0.019	10%	0.097	C	C	.	.	H	α-helix	trans	-68.1	-31.4	-179.5	-67.4	-56.3	-32.3	0	0	113.1	I362 L364 A370 S421 T911	I362-Q366 HydrophobicContact CG2-CG 4.44Å; I362-Q366 WeakPolarHBondContact O-CG 3.24Å; I362-Q366 PolarHBondContact O-N 3.12Å; L364-Q366 VanDerWaalsContact C-N 3.33Å; L364-Q366 PolarHBondContact O-N 2.93Å; Q366-A370 WeakPolarHBondContact O-CB 3.25Å; Q366-A370 PolarHBondContact O-N 3.12Å; Q366-S421 PolarHBondContact NE2-OG 3.33Å; Q366-T911 WeakPolarHBondContact CG-OG1 3.44Å; Q366-T911 PolarHBondContact NE2-OG1 2.81Å; Q366-T911 PolarHBondContact OE1-OG1 3.19Å
367	L	96.2	Very high	93	Very high	20 Å²	20	24.5 Å²	24.5	11%	0.105	12%	0.12	C	C	.	.	H	α-helix	trans	-60.3	-54.3	168.3	173.4	56.1	0	0	0	111.3	I339 L342 A363 L364 C365 Y369 A370 L371	I339-L367 HydrophobicContact CD1-CD1 3.97Å; I339-L367 HydrophobicContact CG1-CD1 3.59Å; I339-L367 HydrophobicContact CG1-CD2 3.68Å; I339-L367 HydrophobicContact CG1-CG 4.31Å; L342-L367 HydrophobicContact CD1-CB 4.13Å; L342-L367 HydrophobicContact CD1-CD2 3.62Å; A363-L367 PolarHBondContact O-N 2.8Å; L364-L367 PolarHBondContact O-N 2.91Å; C365-L367 VanDerWaalsContact C-N 3.34Å; C365-L367 PolarHBondContact O-N 2.83Å; L367-Y369 VanDerWaalsContact C-N 3.31Å; L367-Y369 PolarHBondContact O-N 3.46Å; L367-A370 PolarHBondContact O-N 3.46Å; L367-L371 HydrophobicContact CD1-CD1 3.83Å; L367-L371 HydrophobicContact CD1-CD2 4.35Å; L367-L371 HydrophobicContact CD1-CG 3.78Å; L367-L371 HydrophobicContact CG-CD1 3.88Å; L367-L371 HydrophobicContact CG-CG 4.28Å; L367-L371 WeakPolarHBondContact O-CB 3.38Å; L367-L371 WeakPolarHBondContact O-CG 3.31Å; L367-L371 PolarHBondContact O-N 2.97Å
368	F	96.9	Very high	93.5	Very high	78 Å²	78	28.3 Å²	28.3	34%	0.342	14%	0.142	S	C	.	.	H	α-helix	trans	-63.8	-36.9	-178.5	-77.6	-70.9	0	0	0	112.7	L364 C365 L371 G372 I413 F417	L364-F368 HydrophobicContact CD2-CD2 3.9Å; L364-F368 HydrophobicContact CD2-CE2 3.88Å; L364-F368 HydrophobicContact CG-CD2 4.19Å; L364-F368 HydrophobicContact CG-CE2 4.01Å; L364-F368 WeakPolarHBondContact O-CD2 3.32Å; L364-F368 PolarHBondContact O-N 3.48Å; L364-F368 VanDerWaalsContact O-N 3.17Å; C365-F368 PolarHBondContact O-N 2.9Å; F368-L371 HydrophobicContact CD1-CD1 4.25Å; F368-L371 PolarHBondContact O-N 3.33Å; F368-G372 PolarHBondContact O-N 3.05Å; F368-I413 HydrophobicContact CB-CG2 4.42Å; F368-I413 WeakPolarHBondContact O-CG2 3.48Å; F368-F417 HydrophobicContact CB-CB 4.21Å; F368-F417 HydrophobicContact CB-CD1 4.05Å; F368-F417 HydrophobicContact CB-CD2 3.3Å; F368-F417 HydrophobicContact CB-CE1 4.24Å; F368-F417 HydrophobicContact CB-CE2 3.54Å; F368-F417 HydrophobicContact CB-CG 3.58Å; F368-F417 HydrophobicContact CB-CZ 4Å; F368-F417 HydrophobicContact CD1-CE2 4.09Å; F368-F417 HydrophobicContact CD1-CZ 4.32Å; F368-F417 HydrophobicContact CD2-CD1 4.16Å; F368-F417 HydrophobicContact CD2-CD2 4.45Å; F368-F417 AromaticContact CD2-CE1 3.67Å; F368-F417 HydrophobicContact CD2-CE1 3.67Å; F368-F417 HydrophobicContact CD2-CE2 4.01Å; F368-F417 AromaticContact CD2-CZ 3.59Å; F368-F417 HydrophobicContact CD2-CZ 3.59Å; F368-F417 HydrophobicContact CE2-CE1 4.33Å; F368-F417 HydrophobicContact CE2-CZ 4.12Å; F368-F417 HydrophobicContact CG-CD1 4.42Å; F368-F417 AromaticContact CG-CD2 3.95Å; F368-F417 HydrophobicContact CG-CD2 3.95Å; F368-F417 HydrophobicContact CG-CE1 4.13Å; F368-F417 AromaticContact CG-CE2 3.62Å; F368-F417 HydrophobicContact CG-CE2 3.62Å; F368-F417 HydrophobicContact CG-CG 4.34Å; F368-F417 AromaticContact CG-CZ 3.72Å; F368-F417 HydrophobicContact CG-CZ 3.72Å
369	Y	96.4	Very high	93.8	Very high	29 Å²	29	30.7 Å²	30.7	11%	0.114	15%	0.154	C	C	.	.	H	α-helix	trans	-59.1	-46.9	173.1	-176.3	-102.8	0	0	0	112.3	C365 L367 G372 F373 Q414 S908 L909	C365-Y369 WeakPolarHBondContact O-CB 3.49Å; C365-Y369 PolarHBondContact O-N 3.19Å; L367-Y369 VanDerWaalsContact C-N 3.31Å; L367-Y369 PolarHBondContact O-N 3.46Å; Y369-G372 PolarHBondContact O-N 3.38Å; Y369-F373 HydrophobicContact CD1-CE2 4.18Å; Y369-F373 AromaticContact CE1-CE2 3.63Å; Y369-F373 HydrophobicContact CE1-CE2 3.63Å; Y369-F373 HydrophobicContact CE1-CZ 4.28Å; Y369-F373 AromaticContact CZ-CE2 3.83Å; Y369-Q414 HydrophobicContact CD2-CB 4.11Å; Y369-Q414 HydrophobicContact CD2-CG 4.36Å; Y369-Q414 WeakPolarHBondContact CD2-O 3.49Å; Y369-Q414 HydrophobicContact CE2-CB 4.06Å; Y369-Q414 HydrophobicContact CE2-CG 4.42Å; Y369-S908 WeakPolarHBondContact CE1-OG 3.38Å; Y369-L909 HydrophobicContact CD1-CD2 4.43Å
370	A	96.4	Very high	93.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.8	-37.7	176.6	0	0	0	0	0	112.7	C334 S335 Q366 L367 G372 F373 C374 L909	C334-A370 HydrophobicContact CB-CB 4.34Å; S335-A370 VanDerWaalsContact OG-CB 3.31Å; S335-A370 WeakPolarHBondContact OG-CB 3.44Å; Q366-A370 WeakPolarHBondContact O-CB 3.25Å; Q366-A370 PolarHBondContact O-N 3.12Å; L367-A370 PolarHBondContact O-N 3.46Å; A370-G372 PolarHBondContact O-N 3.35Å; A370-F373 PolarHBondContact O-N 3.01Å; A370-C374 PolarHBondContact O-N 3.27Å; A370-C374 PolarHBondContact O-SG 3.44Å; A370-L909 HydrophobicContact CB-CD2 3.84Å
371	L	94.9	Very high	94	Very high	52 Å²	52	34 Å²	34	27%	0.272	17%	0.174	S	C	.	.	H	α-helix	trans	-60.9	-31.2	173.2	-74.1	174	0	0	0	112.3	L367 F368 F373 C374 L375	L367-L371 HydrophobicContact CD1-CD1 3.83Å; L367-L371 HydrophobicContact CD1-CD2 4.35Å; L367-L371 HydrophobicContact CD1-CG 3.78Å; L367-L371 HydrophobicContact CG-CD1 3.88Å; L367-L371 HydrophobicContact CG-CG 4.28Å; L367-L371 WeakPolarHBondContact O-CB 3.38Å; L367-L371 WeakPolarHBondContact O-CG 3.31Å; L367-L371 PolarHBondContact O-N 2.97Å; F368-L371 HydrophobicContact CD1-CD1 4.25Å; F368-L371 PolarHBondContact O-N 3.33Å; L371-F373 VanDerWaalsContact C-N 3.32Å; L371-F373 PolarHBondContact O-N 2.9Å; L371-C374 PolarHBondContact O-N 2.92Å; L371-C374 VanDerWaalsContact O-N 3.14Å; L371-L375 WeakPolarHBondContact O-CB 3.44Å; L371-L375 VanDerWaalsContact O-CG 3.27Å; L371-L375 WeakPolarHBondContact O-CG 3.22Å; L371-L375 PolarHBondContact O-N 3.22Å
372	G	94.7	Very high	93.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-53.8	-46.3	172.8	0	0	0	0	0	112.7	F368 Y369 A370 S376	F368-G372 PolarHBondContact O-N 3.05Å; Y369-G372 PolarHBondContact O-N 3.38Å; A370-G372 PolarHBondContact O-N 3.35Å; G372-S376 PolarHBondContact O-N 3.16Å; G372-S376 PolarHBondContact O-OG 3.17Å
373	F	95.3	Very high	93.7	Very high	8 Å²	8	40 Å²	40	4%	0.035	21%	0.211	C	C	.	.	H	α-helix	trans	-69.8	-36.3	176	-61.6	-75.5	0	0	0	112.6	A331 Y369 A370 L371 S376 L377 Q414 I637 V639 I905	A331-F373 HydrophobicContact CB-CB 3.68Å; A331-F373 HydrophobicContact CB-CD2 4.21Å; A331-F373 HydrophobicContact CB-CG 4.29Å; Y369-F373 HydrophobicContact CD1-CE2 4.18Å; Y369-F373 AromaticContact CE1-CE2 3.63Å; Y369-F373 HydrophobicContact CE1-CE2 3.63Å; Y369-F373 HydrophobicContact CE1-CZ 4.28Å; Y369-F373 AromaticContact CZ-CE2 3.83Å; A370-F373 PolarHBondContact O-N 3.01Å; L371-F373 VanDerWaalsContact C-N 3.32Å; L371-F373 PolarHBondContact O-N 2.9Å; F373-S376 WeakPolarHBondContact O-CB 3.37Å; F373-S376 PolarHBondContact O-N 2.97Å; F373-L377 PolarHBondContact O-N 3.47Å; F373-Q414 VanDerWaalsContact CE1-NE2 3.33Å; F373-Q414 VanDerWaalsContact CZ-NE2 3.33Å; F373-I637 HydrophobicContact CE1-CD1 3.85Å; F373-V639 HydrophobicContact CD1-CG1 3.96Å; F373-V639 HydrophobicContact CE1-CG1 3.96Å; F373-I905 HydrophobicContact CE1-CG2 4.45Å; F373-I905 HydrophobicContact CE2-CG2 4.33Å; F373-I905 HydrophobicContact CZ-CG2 3.97Å
374	C	94.2	Very high	93.7	Very high	17 Å²	17	39.9 Å²	39.9	12%	0.115	21%	0.21	C	C	.	.	H	α-helix	trans	-65	-41	177.6	-57.2	0	0	0	0	111.4	A370 L371 L377 I378	A370-C374 PolarHBondContact O-N 3.27Å; A370-C374 PolarHBondContact O-SG 3.44Å; L371-C374 PolarHBondContact O-N 2.92Å; L371-C374 VanDerWaalsContact O-N 3.14Å; C374-L377 PolarHBondContact O-N 2.87Å; C374-I378 WeakPolarHBondContact O-CG1 3.48Å; C374-I378 PolarHBondContact O-N 3Å
375	L	93.7	Very high	93.6	Very high	55 Å²	55	37.2 Å²	37.2	29%	0.288	20%	0.196	S	C	.	.	H	α-helix	trans	-64.6	-40.8	173.1	-70.1	165.5	0	0	0	111.3	L371 L377 I378 L379 F409 I410 I413	L371-L375 WeakPolarHBondContact O-CB 3.44Å; L371-L375 VanDerWaalsContact O-CG 3.27Å; L371-L375 WeakPolarHBondContact O-CG 3.22Å; L371-L375 PolarHBondContact O-N 3.22Å; L375-L377 VanDerWaalsContact C-N 3.29Å; L375-L377 PolarHBondContact O-N 3.42Å; L375-I378 PolarHBondContact O-N 3.3Å; L375-L379 WeakPolarHBondContact O-CB 3.19Å; L375-L379 VanDerWaalsContact O-CG 3.32Å; L375-L379 WeakPolarHBondContact O-CG 3.49Å; L375-L379 PolarHBondContact O-N 3.01Å; L375-F409 HydrophobicContact CD1-CE1 4.16Å; L375-I410 HydrophobicContact CB-CD1 3.67Å; L375-I410 HydrophobicContact CD1-CD1 4.49Å; L375-I413 HydrophobicContact CD1-CD1 4.09Å
376	S	92.1	Very high	93.4	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.007	20%	0.2	C	C	.	.	H	α-helix	trans	-60	-34.8	174.1	-74.4	0	0	0	0	114.2	G372 F373 G380 P638	G372-S376 PolarHBondContact O-N 3.16Å; G372-S376 PolarHBondContact O-OG 3.17Å; F373-S376 WeakPolarHBondContact O-CB 3.37Å; F373-S376 PolarHBondContact O-N 2.97Å; S376-G380 PolarHBondContact O-N 3.43Å; S376-P638 WeakPolarHBondContact CB-O 3.29Å; S376-P638 PolarHBondContact OG-O 3.48Å
377	L	91	Very high	93.1	Very high	95 Å²	95	38.4 Å²	38.4	50%	0.497	21%	0.208	S	C	.	.	H	α-helix	trans	-67.2	-44.9	173.9	-176.5	69.7	0	0	0	111.4	F373 C374 L375	F373-L377 PolarHBondContact O-N 3.47Å; C374-L377 PolarHBondContact O-N 2.87Å; L375-L377 VanDerWaalsContact C-N 3.29Å; L375-L377 PolarHBondContact O-N 3.42Å
378	I	91.9	Very high	92.5	Very high	137 Å²	137	44.4 Å²	44.4	70%	0.703	24%	0.235	S	C	*	.	H	α-helix	trans	-69.1	-41.1	-177.1	-65.4	163.7	0	0	0	111.8	C374 L375	C374-I378 WeakPolarHBondContact O-CG1 3.48Å; C374-I378 PolarHBondContact O-N 3Å; L375-I378 PolarHBondContact O-N 3.3Å
379	L	92.6	Very high	91.7	Very high	55 Å²	55	40.9 Å²	40.9	29%	0.288	22%	0.22	S	C	.	.	H	α-helix	trans	-78.6	-20.2	-177.2	-68.6	169.1	0	0	0	113.4	L375 N383 I384 L406 I410	L375-L379 WeakPolarHBondContact O-CB 3.19Å; L375-L379 VanDerWaalsContact O-CG 3.32Å; L375-L379 WeakPolarHBondContact O-CG 3.49Å; L375-L379 PolarHBondContact O-N 3.01Å; L379-N383 PolarHBondContact O-ND2 3.35Å; L379-I384 HydrophobicContact CB-CD1 3.82Å; L379-I384 HydrophobicContact CB-CG1 4.36Å; L379-I384 HydrophobicContact CD1-CD1 4.2Å; L379-L406 HydrophobicContact CD1-CD2 4.29Å; L379-L406 HydrophobicContact CD2-CD2 4.46Å; L379-I410 HydrophobicContact CD1-CD1 4.34Å
380	G	90.8	Very high	90.8	Very high	25 Å²	25	47.2 Å²	47.2	26%	0.258	26%	0.255	S	S	.	.			trans	82.1	142.1	178.9	0	0	0	0	0	114.2	S376 T382 N383	S376-G380 PolarHBondContact O-N 3.43Å; G380-T382 PolarHBondContact O-N 2.98Å; G380-N383 PolarHBondContact O-N 2.98Å
381	R	91.6	Very high	89.5	Confident	50 Å²	50	51.7 Å²	51.7	19%	0.189	28%	0.279	C	S	.	.	H	α-helix	trans	-54.9	-50.2	-174.3	177.8	169.3	172.2	128.6	4.1	113.4	N383 I384 T385 E635 L636 P638	R381-N383 PolarHBondContact O-N 2.77Å; R381-I384 PolarHBondContact O-N 3.06Å; R381-I384 VanDerWaalsContact O-N 3.11Å; R381-T385 HydrophobicContact CG-CG2 4.38Å; R381-T385 PolarHBondContact O-N 3.22Å; R381-T385 PolarHBondContact O-OG1 3.33Å; R381-E635 PolarHBondContact NH1-O 3.26Å; R381-E635 VanDerWaalsContact NH1-O 3.13Å; R381-E635 PolarHBondContact NH2-O 2.74Å; R381-L636 PolarHBondContact NH1-O 2.94Å; R381-L636 VanDerWaalsContact NH1-O 3.09Å; R381-P638 HydrophobicContact CB-CB 3.83Å; R381-P638 HydrophobicContact CG-CB 3.96Å
382	T	90	Very high	88.3	Confident	66 Å²	66	50.6 Å²	50.6	41%	0.405	28%	0.275	S	S	.	.	H	α-helix	trans	-58.1	-35.6	-174.9	47.5	0	0	0	0	113.1	G380 I384 C386	G380-T382 PolarHBondContact O-N 2.98Å; T382-I384 VanDerWaalsContact C-N 3.34Å; T382-C386 VanDerWaalsContact O-CB 3.26Å; T382-C386 WeakPolarHBondContact O-CB 3.25Å; T382-C386 PolarHBondContact O-N 3.25Å
383	N	90.3	Very high	87.4	Confident	90 Å²	90	52.9 Å²	52.9	48%	0.481	30%	0.299	S	S	.	.	H	α-helix	trans	-76.3	-23	-177.1	-59.3	-24.3	0	0	0	112.7	L379 G380 R381 N404 L406	L379-N383 PolarHBondContact O-ND2 3.35Å; G380-N383 PolarHBondContact O-N 2.98Å; R381-N383 PolarHBondContact O-N 2.77Å; N383-N404 PolarHBondContact O-ND2 2.68Å; N383-L406 HydrophobicContact CB-CD1 4.1Å
384	I	92.8	Very high	86.6	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-97.8	-44.1	-179.5	-68.5	164.9	0	0	0	111.8	L379 R381 T382 L398 L406 C407 I410	L379-I384 HydrophobicContact CB-CD1 3.82Å; L379-I384 HydrophobicContact CB-CG1 4.36Å; L379-I384 HydrophobicContact CD1-CD1 4.2Å; R381-I384 PolarHBondContact O-N 3.06Å; R381-I384 VanDerWaalsContact O-N 3.11Å; T382-I384 VanDerWaalsContact C-N 3.34Å; I384-L398 VanDerWaalsContact O-CD1 3.31Å; I384-L398 WeakPolarHBondContact O-CD1 3.34Å; I384-L406 HydrophobicContact CG1-CB 4.19Å; I384-C407 WeakPolarHBondContact O-CB 3.37Å; I384-I410 HydrophobicContact CD1-CG1 4.1Å
385	T	92.3	Very high	86.2	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-96.1	-21.7	-170.7	61	0	0	0	0	114.5	R381 R397 L398 A633	R381-T385 HydrophobicContact CG-CG2 4.38Å; R381-T385 PolarHBondContact O-N 3.22Å; R381-T385 PolarHBondContact O-OG1 3.33Å; T385-R397 WeakPolarHBondContact O-CA 3.06Å; T385-L398 PolarHBondContact O-N 3.48Å; T385-A633 HydrophobicContact CG2-CB 4.12Å; T385-A633 WeakPolarHBondContact O-CB 3.06Å
386	C	92.1	Very high	85.9	Confident	11 Å²	11	57.2 Å²	57.2	7%	0.074	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	147.7	-177.8	-46.8	0	0	0	0	112	C309 T382 I396	C309-C386 HydrophobicContact CB-CB 3.78Å; C309-C386 WeakPolarHBondContact CB-SG 3.39Å; C309-C386 WeakPolarHBondContact SG-CA 3.32Å; C309-C386 WeakPolarHBondContact SG-CB 3.37Å; C309-C386 CovalentContact SG-SG 2.03Å; C309-C386 PolarHBondContact SG-SG 3.13Å; T382-C386 VanDerWaalsContact O-CB 3.26Å; T382-C386 WeakPolarHBondContact O-CB 3.25Å; T382-C386 PolarHBondContact O-N 3.25Å; C386-I396 WeakPolarHBondContact CA-O 3.44Å
387	G	88	Confident	85.8	Confident	18 Å²	18	58 Å²	58	19%	0.186	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	156.2	159.6	0	0	0	0	0	109.5	R395 I396	G387-R395 CarbonylContact O-C 3.29Å; G387-R395 WeakPolarHBondContact O-CA 3.31Å; G387-I396 PolarHBondContact N-O 3.09Å; G387-I396 PolarHBondContact O-N 2.91Å
388	Q	84.7	Confident	85.8	Confident	145 Å²	145	54.1 Å²	54.1	68%	0.678	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	129.2	162.2	-69.5	-177.1	-84.8	0	0	108.1	R395	Q388-R395 HydrophobicContact CG-CG 4.13Å
389	D	79.2	Confident	85.4	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.027	26%	0.264	C	S	.	.			trans	-80.7	135.8	170.5	172.4	64.1	0	0	0	110.4	R301 D391 S392 G393 Q394 I396	R301-D389 IonicContact CZ-OD1 2.7Å; R301-D389 IonicContact NE-OD1 3.73Å; R301-D389 PolarHBondContact NE-OD1 3.3Å; R301-D389 IonicContact NH2-OD1 3.6Å; R301-D389 PolarHBondContact NH2-OD1 2.98Å; D389-D391 PolarHBondContact OD2-N 3.34Å; D389-S392 WeakPolarHBondContact CB-OG 3.45Å; D389-S392 WeakPolarHBondContact OD2-CB 3.32Å; D389-S392 PolarHBondContact OD2-N 2.91Å; D389-S392 PolarHBondContact OD2-OG 3.43Å; D389-G393 VanDerWaalsContact O-CA 3.25Å; D389-G393 WeakPolarHBondContact O-CA 3.46Å; D389-G393 PolarHBondContact O-N 3.15Å; D389-Q394 PolarHBondContact N-O 3.04Å; D389-I396 HydrophobicContact CB-CD1 4.03Å; D389-I396 HydrophobicContact CB-CG1 4.23Å; D389-I396 HydrophobicContact CB-CG2 4.31Å
390	L	77.3	Confident	85	Confident	161 Å²	161	48.2 Å²	48.2	84%	0.843	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-30.2	-174.5	-72.6	164	0	0	0	113.1
391	D	69.6	Low	84.4	Confident	95 Å²	95	47 Å²	47	51%	0.508	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-25.3	-175	-57.7	-44.3	0	0	0	112.2	R301 D389	R301-D391 WeakPolarHBondContact CD-OD2 3.38Å; R301-D391 WeakPolarHBondContact CG-OD2 3.48Å; R301-D391 IonicContact NE-OD2 2.75Å; R301-D391 PolarHBondContact NE-OD2 2.98Å; D389-D391 PolarHBondContact OD2-N 3.34Å
392	S	70.2	Confident	84.2	Confident	29 Å²	29	49 Å²	49	20%	0.203	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-15.5	-176.4	61.1	0	0	0	0	115.3	D389 Q394	D389-S392 WeakPolarHBondContact CB-OG 3.45Å; D389-S392 WeakPolarHBondContact OD2-CB 3.32Å; D389-S392 PolarHBondContact OD2-N 2.91Å; D389-S392 PolarHBondContact OD2-OG 3.43Å; S392-Q394 PolarHBondContact O-N 2.88Å; S392-Q394 PolarHBondContact OG-N 3.44Å
393	G	75.7	Confident	83.8	Confident	48 Å²	48	52 Å²	52	50%	0.495	28%	0.276	S	S	.	.			trans	70	-12.6	-171.7	0	0	0	0	0	114.9	D389	D389-G393 VanDerWaalsContact O-CA 3.25Å; D389-G393 WeakPolarHBondContact O-CA 3.46Å; D389-G393 PolarHBondContact O-N 3.15Å
394	Q	77.9	Confident	83.8	Confident	24 Å²	24	49.2 Å²	49.2	11%	0.112	26%	0.261	C	S	.	.			trans	-74.2	147.5	-171.6	-171.4	57.3	30	0	0	112	L275 I297 L308 D389 S392 I396	L275-Q394 HydrophobicContact CD1-CG 4.07Å; I297-Q394 HydrophobicContact CD1-CB 4.48Å; L308-Q394 HydrophobicContact CD2-CG 3.87Å; L308-Q394 HydrophobicContact CG-CG 4.09Å; D389-Q394 PolarHBondContact N-O 3.04Å; S392-Q394 PolarHBondContact O-N 2.88Å; S392-Q394 PolarHBondContact OG-N 3.44Å; Q394-I396 PolarHBondContact O-N 3.2Å
395	R	85.4	Confident	83.8	Confident	134 Å²	134	51.9 Å²	51.9	51%	0.506	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	103.7	172.2	-70.2	-177.6	-178.7	165.1	2.5	110.9	C309 G387 Q388	C309-R395 HydrophobicContact CB-CB 4.4Å; C309-R395 PolarHBondContact N-O 3.29Å; G387-R395 CarbonylContact O-C 3.29Å; G387-R395 WeakPolarHBondContact O-CA 3.31Å; Q388-R395 HydrophobicContact CG-CG 4.13Å
396	I	88.6	Confident	83.8	Confident	12 Å²	12	54.8 Å²	54.8	6%	0.062	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	155.7	174.4	60.9	165.5	0	0	0	111.2	I297 I299 A306 C386 G387 D389 Q394	I297-I396 HydrophobicContact CG2-CG2 3.61Å; I299-I396 HydrophobicContact CD1-CD1 3.83Å; A306-I396 HydrophobicContact CB-CB 4.34Å; A306-I396 HydrophobicContact CB-CD1 4.23Å; A306-I396 HydrophobicContact CB-CG2 4.24Å; C386-I396 WeakPolarHBondContact CA-O 3.44Å; G387-I396 PolarHBondContact N-O 3.09Å; G387-I396 PolarHBondContact O-N 2.91Å; D389-I396 HydrophobicContact CB-CD1 4.03Å; D389-I396 HydrophobicContact CB-CG1 4.23Å; D389-I396 HydrophobicContact CB-CG2 4.31Å; Q394-I396 PolarHBondContact O-N 3.2Å
397	R	90.2	Very high	84	Confident	18 Å²	18	54.3 Å²	54.3	7%	0.068	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	129.6	164.5	180	163.4	58.8	92.6	-9.1	108.5	P307 T385 Q399 A633	P307-R397 HydrophobicContact CG-CB 4.24Å; P307-R397 PolarHBondContact O-N 3.09Å; T385-R397 WeakPolarHBondContact O-CA 3.06Å; R397-Q399 PolarHBondContact O-N 3.28Å; R397-A633 WeakPolarHBondContact CD-O 3.32Å; R397-A633 HydrophobicContact CG-CB 3.65Å; R397-A633 PolarHBondContact NH1-O 2.81Å
398	L	90.3	Very high	84.3	Confident	14 Å²	14	54.4 Å²	54.4	7%	0.073	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-59.9	130.8	-172.1	-66.1	164.8	0	0	0	112.5	I384 T385 N404 C407 A633	I384-L398 VanDerWaalsContact O-CD1 3.31Å; I384-L398 WeakPolarHBondContact O-CD1 3.34Å; T385-L398 PolarHBondContact O-N 3.48Å; L398-N404 HydrophobicContact CD1-CB 3.69Å; L398-N404 HydrophobicContact CD2-CB 4.34Å; L398-C407 HydrophobicContact CD1-CB 3.74Å; L398-A633 HydrophobicContact CB-CB 4.09Å; L398-A633 PolarHBondContact O-N 3.24Å
399	Q	83.7	Confident	84.8	Confident	18 Å²	18	52.6 Å²	52.6	8%	0.084	29%	0.288	C	S	.	.	S	Bend	trans	-103.4	-34.7	172.4	-42.7	-163	-71.7	0	0	112.5	C305 A306 R397	C305-Q399 PolarHBondContact O-NE2 2.96Å; A306-Q399 HydrophobicContact CB-CG 4.12Å; R397-Q399 PolarHBondContact O-N 3.28Å
400	E	83.4	Confident	85.5	Confident	49 Å²	49	52.4 Å²	52.4	23%	0.229	29%	0.286	C	S	.	.	S	Bend	trans	-116.2	77.1	176.2	-65.4	-170.2	-143.9	0	0	107.5	R304 L402 D403	R304-E400 IonicContact NH1-OE1 2.74Å; R304-E400 PolarHBondContact NH1-OE1 3.15Å; E400-L402 PolarHBondContact O-N 3.49Å; E400-D403 PolarHBondContact O-N 3.07Å; E400-D403 VanDerWaalsContact O-N 3.15Å
401	G	79.9	Confident	86.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-55.9	-15.6	-173.8	0	0	0	0	0	115.1	D403 N404 C407 V408 V631	G401-D403 PolarHBondContact O-N 3.33Å; G401-N404 CarbonylContact O-C 3.21Å; G401-N404 PolarHBondContact O-N 3.42Å; G401-C407 VanDerWaalsContact CA-SG 3.58Å; G401-V408 WeakPolarHBondContact O-CG2 2.99Å; G401-V631 WeakPolarHBondContact CA-O 3.36Å; G401-V631 PolarHBondContact N-O 2.8Å
402	L	85.8	Confident	87.6	Confident	92 Å²	92	43.3 Å²	43.3	48%	0.482	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-57	-27.9	175.2	-166.5	60.9	0	0	0	113.4	E400 N404 V408	E400-L402 PolarHBondContact O-N 3.49Å; L402-N404 VanDerWaalsContact C-N 3.27Å; L402-N404 PolarHBondContact O-N 2.92Å; L402-V408 VanDerWaalsContact CA-CG2 3.5Å; L402-V408 HydrophobicContact CD1-CG2 4.18Å
403	D	83.3	Confident	88.8	Confident	129 Å²	129	42.9 Å²	42.9	69%	0.69	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-72.2	-17.3	176.4	-66.4	-12.8	0	0	0	113	E400 G401	E400-D403 PolarHBondContact O-N 3.07Å; E400-D403 VanDerWaalsContact O-N 3.15Å; G401-D403 PolarHBondContact O-N 3.33Å
404	N	90.2	Very high	89.8	Confident	31 Å²	31	41.3 Å²	41.3	17%	0.166	21%	0.213	C	C	.	.			trans	-120	105	177.1	-179.1	-24	0	0	0	110.8	N383 L398 G401 L402 L406 C407 V408	N383-N404 PolarHBondContact O-ND2 2.68Å; L398-N404 HydrophobicContact CD1-CB 3.69Å; L398-N404 HydrophobicContact CD2-CB 4.34Å; G401-N404 CarbonylContact O-C 3.21Å; G401-N404 PolarHBondContact O-N 3.42Å; L402-N404 VanDerWaalsContact C-N 3.27Å; L402-N404 PolarHBondContact O-N 2.92Å; N404-L406 PolarHBondContact O-N 3.08Å; N404-L406 VanDerWaalsContact O-N 3.09Å; N404-L406 WeakPolarHBondContact OD1-CB 3.44Å; N404-L406 PolarHBondContact OD1-N 3.15Å; N404-C407 HydrophobicContact CB-CB 4.03Å; N404-C407 VanDerWaalsContact O-CB 3.32Å; N404-C407 WeakPolarHBondContact O-CB 3.32Å; N404-C407 PolarHBondContact O-N 3.5Å; N404-C407 PolarHBondContact OD1-N 3.35Å; N404-V408 PolarHBondContact O-N 3.39Å; N404-V408 VanDerWaalsContact O-N 3.12Å
405	G	92.1	Very high	90.6	Very high	56 Å²	56	41 Å²	41	58%	0.577	21%	0.211	S	C	*	.	H	α-helix	trans	-55.3	-29.4	-178.4	0	0	0	0	0	115.3	F409	G405-F409 WeakPolarHBondContact O-CB 3.44Å; G405-F409 PolarHBondContact O-N 3.37Å
406	L	93.2	Very high	91.2	Very high	62 Å²	62	36.8 Å²	36.8	33%	0.325	20%	0.196	S	C	.	.	H	α-helix	trans	-72.1	-40.8	176.1	-59.7	-179.6	0	0	0	111.5	L379 N383 I384 N404 F409 I410	L379-L406 HydrophobicContact CD1-CD2 4.29Å; L379-L406 HydrophobicContact CD2-CD2 4.46Å; N383-L406 HydrophobicContact CB-CD1 4.1Å; I384-L406 HydrophobicContact CG1-CB 4.19Å; N404-L406 PolarHBondContact O-N 3.08Å; N404-L406 VanDerWaalsContact O-N 3.09Å; N404-L406 WeakPolarHBondContact OD1-CB 3.44Å; N404-L406 PolarHBondContact OD1-N 3.15Å; L406-F409 PolarHBondContact O-N 3.48Å; L406-I410 WeakPolarHBondContact O-CG1 3.4Å; L406-I410 PolarHBondContact O-N 2.99Å; L406-I410 VanDerWaalsContact O-N 3.07Å
407	C	94.7	Very high	91.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.5	-47.9	174	179.1	0	0	0	0	110.9	I384 L398 G401 N404 F411 C640	I384-C407 WeakPolarHBondContact O-CB 3.37Å; L398-C407 HydrophobicContact CD1-CB 3.74Å; G401-C407 VanDerWaalsContact CA-SG 3.58Å; N404-C407 HydrophobicContact CB-CB 4.03Å; N404-C407 VanDerWaalsContact O-CB 3.32Å; N404-C407 WeakPolarHBondContact O-CB 3.32Å; N404-C407 PolarHBondContact O-N 3.5Å; N404-C407 PolarHBondContact OD1-N 3.35Å; C407-F411 VanDerWaalsContact O-CB 3.27Å; C407-F411 WeakPolarHBondContact O-CB 3.49Å; C407-F411 PolarHBondContact O-N 3.34Å; C407-C640 VanDerWaalsContact CA-SG 3.5Å; C407-C640 HydrophobicContact CB-CB 4.16Å; C407-C640 WeakPolarHBondContact CB-SG 3.38Å; C407-C640 WeakPolarHBondContact O-CB 3.43Å; C407-C640 WeakPolarHBondContact SG-CB 3.26Å; C407-C640 CovalentContact SG-SG 2.03Å; C407-C640 PolarHBondContact SG-SG 3.39Å
408	V	94.7	Very high	91.8	Very high	20 Å²	20	37.8 Å²	37.8	12%	0.121	20%	0.203	C	C	.	.	H	α-helix	trans	-61.6	-45.2	175.1	-173.5	0	0	0	0	112	G401 L402 N404 F411 I412 L626	G401-V408 WeakPolarHBondContact O-CG2 2.99Å; L402-V408 VanDerWaalsContact CA-CG2 3.5Å; L402-V408 HydrophobicContact CD1-CG2 4.18Å; N404-V408 PolarHBondContact O-N 3.39Å; N404-V408 VanDerWaalsContact O-N 3.12Å; V408-F411 PolarHBondContact O-N 3.28Å; V408-I412 HydrophobicContact CG1-CD1 3.59Å; V408-I412 HydrophobicContact CG1-CG1 4.02Å; V408-I412 WeakPolarHBondContact O-CB 3.25Å; V408-I412 WeakPolarHBondContact O-CG1 3.36Å; V408-I412 PolarHBondContact O-N 3.11Å; V408-L626 HydrophobicContact CG1-CD2 4.05Å
409	F	94.9	Very high	92	Very high	108 Å²	108	37.4 Å²	37.4	47%	0.474	20%	0.201	S	C	.	.	H	α-helix	trans	-62.7	-47.4	-175.4	179.6	-109.8	0	0	0	112.2	L375 G405 L406 I412 I413	L375-F409 HydrophobicContact CD1-CE1 4.16Å; G405-F409 WeakPolarHBondContact O-CB 3.44Å; G405-F409 PolarHBondContact O-N 3.37Å; L406-F409 PolarHBondContact O-N 3.48Å; F409-I412 PolarHBondContact O-N 2.82Å; F409-I413 HydrophobicContact CD1-CD1 4.06Å; F409-I413 HydrophobicContact CD2-CD1 4.32Å; F409-I413 HydrophobicContact CE1-CD1 3.66Å; F409-I413 HydrophobicContact CE2-CD1 3.94Å; F409-I413 HydrophobicContact CG-CD1 4.38Å; F409-I413 HydrophobicContact CZ-CD1 3.6Å; F409-I413 WeakPolarHBondContact O-CG1 3.35Å; F409-I413 PolarHBondContact O-N 3.32Å; F409-I413 VanDerWaalsContact O-N 3.12Å
410	I	95.1	Very high	92.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.5	-43.6	174.7	-61.7	-61	0	0	0	110.7	L375 L379 I384 L406 I413 Q414 V639	L375-I410 HydrophobicContact CB-CD1 3.67Å; L375-I410 HydrophobicContact CD1-CD1 4.49Å; L379-I410 HydrophobicContact CD1-CD1 4.34Å; I384-I410 HydrophobicContact CD1-CG1 4.1Å; L406-I410 WeakPolarHBondContact O-CG1 3.4Å; L406-I410 PolarHBondContact O-N 2.99Å; L406-I410 VanDerWaalsContact O-N 3.07Å; I410-I413 PolarHBondContact O-N 3.5Å; I410-Q414 WeakPolarHBondContact O-CG 3.32Å; I410-Q414 PolarHBondContact O-N 3.16Å; I410-V639 HydrophobicContact CG2-CB 4.21Å; I410-V639 HydrophobicContact CG2-CG1 4.22Å
411	F	95.4	Very high	93.2	Very high	3 Å²	3	34.2 Å²	34.2	1%	0.013	19%	0.186	C	C	.	.	H	α-helix	trans	-58	-50	175.9	162.6	-104.8	0	0	0	112.4	C407 V408 I413 Q414 Y415 V625 L626 V631 C640 V642	C407-F411 VanDerWaalsContact O-CB 3.27Å; C407-F411 WeakPolarHBondContact O-CB 3.49Å; C407-F411 PolarHBondContact O-N 3.34Å; V408-F411 PolarHBondContact O-N 3.28Å; F411-I413 PolarHBondContact O-N 3.22Å; F411-Q414 PolarHBondContact O-N 3.27Å; F411-Y415 VanDerWaalsContact CE2-CB 3.46Å; F411-Y415 HydrophobicContact CE2-CD1 4.4Å; F411-Y415 AromaticContact CE2-CD2 3.97Å; F411-Y415 HydrophobicContact CE2-CD2 3.97Å; F411-Y415 AromaticContact CE2-CG 3.69Å; F411-Y415 HydrophobicContact CE2-CG 3.69Å; F411-Y415 HydrophobicContact CZ-CD1 4.02Å; F411-Y415 HydrophobicContact CZ-CD2 4.33Å; F411-Y415 AromaticContact CZ-CG 3.77Å; F411-Y415 HydrophobicContact CZ-CG 3.77Å; F411-Y415 VanDerWaalsContact O-CB 3.24Å; F411-Y415 WeakPolarHBondContact O-CB 3.42Å; F411-Y415 PolarHBondContact O-N 2.9Å; F411-V625 HydrophobicContact CE1-CG1 3.98Å; F411-V625 HydrophobicContact CE2-CG1 4.13Å; F411-V625 HydrophobicContact CZ-CB 4.05Å; F411-V625 HydrophobicContact CZ-CG1 3.37Å; F411-L626 HydrophobicContact CD1-CD2 4.19Å; F411-L626 HydrophobicContact CE1-CD2 3.92Å; F411-L626 HydrophobicContact CE1-CG 4.32Å; F411-V631 HydrophobicContact CB-CG1 3.88Å; F411-V631 HydrophobicContact CD1-CG1 3.92Å; F411-V631 HydrophobicContact CD1-CG2 3.83Å; F411-V631 HydrophobicContact CD2-CG1 4.05Å; F411-V631 HydrophobicContact CD2-CG2 4.48Å; F411-V631 HydrophobicContact CE1-CG2 3.77Å; F411-V631 HydrophobicContact CE2-CG2 4.41Å; F411-V631 HydrophobicContact CG-CG1 3.62Å; F411-V631 HydrophobicContact CG-CG2 4.22Å; F411-V631 HydrophobicContact CZ-CG2 4.1Å; F411-C640 HydrophobicContact CB-CB 4.06Å; F411-V642 HydrophobicContact CE2-CB 4.43Å; F411-V642 HydrophobicContact CE2-CG1 4.43Å
412	I	95.9	Very high	93.9	Very high	62 Å²	62	34.4 Å²	34.4	32%	0.318	19%	0.187	S	C	.	.	H	α-helix	trans	-59.9	-47.7	-179	-74.2	176.9	0	0	0	110.2	V408 F409 Q414 F416 T622 L626	V408-I412 HydrophobicContact CG1-CD1 3.59Å; V408-I412 HydrophobicContact CG1-CG1 4.02Å; V408-I412 WeakPolarHBondContact O-CB 3.25Å; V408-I412 WeakPolarHBondContact O-CG1 3.36Å; V408-I412 PolarHBondContact O-N 3.11Å; F409-I412 PolarHBondContact O-N 2.82Å; I412-Q414 PolarHBondContact O-N 3.38Å; I412-F416 WeakPolarHBondContact O-CB 3.47Å; I412-F416 PolarHBondContact O-N 2.69Å; I412-T622 HydrophobicContact CG1-CG2 4.29Å; I412-L626 HydrophobicContact CD1-CD1 4Å; I412-L626 HydrophobicContact CG1-CD1 4.32Å; I412-L626 HydrophobicContact CG1-CD2 4.48Å
413	I	95.5	Very high	94.4	Very high	21 Å²	21	30.6 Å²	30.6	11%	0.108	17%	0.167	C	C	.	.	H	α-helix	trans	-58	-52.2	178.3	-70.5	170.3	0	0	0	110.3	F368 L375 F409 I410 F411 F417	F368-I413 HydrophobicContact CB-CG2 4.42Å; F368-I413 WeakPolarHBondContact O-CG2 3.48Å; L375-I413 HydrophobicContact CD1-CD1 4.09Å; F409-I413 HydrophobicContact CD1-CD1 4.06Å; F409-I413 HydrophobicContact CD2-CD1 4.32Å; F409-I413 HydrophobicContact CE1-CD1 3.66Å; F409-I413 HydrophobicContact CE2-CD1 3.94Å; F409-I413 HydrophobicContact CG-CD1 4.38Å; F409-I413 HydrophobicContact CZ-CD1 3.6Å; F409-I413 WeakPolarHBondContact O-CG1 3.35Å; F409-I413 PolarHBondContact O-N 3.32Å; F409-I413 VanDerWaalsContact O-N 3.12Å; I410-I413 PolarHBondContact O-N 3.5Å; F411-I413 PolarHBondContact O-N 3.22Å; I413-F417 HydrophobicContact CG2-CD2 4.32Å; I413-F417 WeakPolarHBondContact O-CB 3.31Å; I413-F417 VanDerWaalsContact O-CD2 3.31Å; I413-F417 WeakPolarHBondContact O-CD2 3.27Å; I413-F417 PolarHBondContact O-N 3.32Å
414	Q	94.8	Very high	94.9	Very high	15 Å²	15	24.5 Å²	24.5	7%	0.07	13%	0.134	C	C	.	.	H	α-helix	trans	-69.7	-39.6	-175.2	-68.7	-171.2	-32	0	0	112.8	Y369 F373 I410 F411 I412 S418	Y369-Q414 HydrophobicContact CD2-CB 4.11Å; Y369-Q414 HydrophobicContact CD2-CG 4.36Å; Y369-Q414 WeakPolarHBondContact CD2-O 3.49Å; Y369-Q414 HydrophobicContact CE2-CB 4.06Å; Y369-Q414 HydrophobicContact CE2-CG 4.42Å; F373-Q414 VanDerWaalsContact CE1-NE2 3.33Å; F373-Q414 VanDerWaalsContact CZ-NE2 3.33Å; I410-Q414 WeakPolarHBondContact O-CG 3.32Å; I410-Q414 PolarHBondContact O-N 3.16Å; F411-Q414 PolarHBondContact O-N 3.27Å; I412-Q414 PolarHBondContact O-N 3.38Å; Q414-S418 WeakPolarHBondContact O-CB 3.32Å; Q414-S418 PolarHBondContact O-N 3.03Å
415	Y	95.9	Very high	95.1	Very high	18 Å²	18	23 Å²	23	7%	0.071	13%	0.126	C	C	.	.	H	α-helix	trans	-74.8	-50.5	-178.7	-173.8	-96.5	0	0	0	112.4	F411 F417 S418 I419 F621 T622 V625 V642 F653	F411-Y415 VanDerWaalsContact CE2-CB 3.46Å; F411-Y415 HydrophobicContact CE2-CD1 4.4Å; F411-Y415 AromaticContact CE2-CD2 3.97Å; F411-Y415 HydrophobicContact CE2-CD2 3.97Å; F411-Y415 AromaticContact CE2-CG 3.69Å; F411-Y415 HydrophobicContact CE2-CG 3.69Å; F411-Y415 HydrophobicContact CZ-CD1 4.02Å; F411-Y415 HydrophobicContact CZ-CD2 4.33Å; F411-Y415 AromaticContact CZ-CG 3.77Å; F411-Y415 HydrophobicContact CZ-CG 3.77Å; F411-Y415 VanDerWaalsContact O-CB 3.24Å; F411-Y415 WeakPolarHBondContact O-CB 3.42Å; F411-Y415 PolarHBondContact O-N 2.9Å; Y415-F417 PolarHBondContact O-N 2.96Å; Y415-S418 PolarHBondContact O-N 3.11Å; Y415-I419 HydrophobicContact CD1-CG1 4.31Å; Y415-I419 HydrophobicContact CD2-CG1 4.41Å; Y415-I419 HydrophobicContact CE1-CG1 3.96Å; Y415-I419 HydrophobicContact CE2-CD1 4.33Å; Y415-I419 HydrophobicContact CE2-CG1 4.07Å; Y415-I419 WeakPolarHBondContact O-CG1 3.31Å; Y415-I419 PolarHBondContact O-N 3.01Å; Y415-F621 HydrophobicContact CE1-CB 4.2Å; Y415-T622 HydrophobicContact CD1-CG2 4.31Å; Y415-V625 HydrophobicContact CE1-CG2 3.9Å; Y415-V625 HydrophobicContact CE2-CG2 4.31Å; Y415-V642 HydrophobicContact CD2-CG1 4.27Å; Y415-V642 HydrophobicContact CE2-CG1 4Å; Y415-F653 PolarHBondContact OH-O 2.91Å
416	F	96.6	Very high	95.2	Very high	44 Å²	44	20.7 Å²	20.7	19%	0.193	10%	0.101	C	C	.	.	H	α-helix	trans	-59.8	-51	-177.5	176.1	-92.8	0	0	0	111.5	I412 I419 A420 W615 A618	I412-F416 WeakPolarHBondContact O-CB 3.47Å; I412-F416 PolarHBondContact O-N 2.69Å; F416-I419 PolarHBondContact O-N 3.33Å; F416-A420 VanDerWaalsContact O-CB 3.26Å; F416-A420 WeakPolarHBondContact O-CB 3.39Å; F416-A420 PolarHBondContact O-N 3.41Å; F416-W615 AromaticContact CE1-CE3 3.83Å; F416-W615 HydrophobicContact CE1-CE3 3.83Å; F416-W615 HydrophobicContact CE1-CZ3 4.01Å; F416-W615 AromaticContact CZ-CE3 3.79Å; F416-W615 HydrophobicContact CZ-CE3 3.79Å; F416-W615 HydrophobicContact CZ-CZ3 4.42Å; F416-A618 HydrophobicContact CD2-CB 3.99Å; F416-A618 HydrophobicContact CE2-CB 3.8Å; F416-A618 HydrophobicContact CZ-CB 4.32Å
417	F	96.7	Very high	95.1	Very high	33 Å²	33	19.5 Å²	19.5	15%	0.145	9%	0.094	C	C	.	.	H	α-helix	trans	-72.7	-29.9	-177.4	-71.1	-70.4	0	0	0	112.6	L364 C365 F368 I413 Y415 S421 W615	L364-F417 HydrophobicContact CD2-CE1 4.18Å; C365-F417 HydrophobicContact CB-CB 4.25Å; C365-F417 HydrophobicContact CB-CD1 4.35Å; C365-F417 WeakPolarHBondContact CB-O 3.47Å; F368-F417 HydrophobicContact CB-CB 4.21Å; F368-F417 HydrophobicContact CB-CD1 4.05Å; F368-F417 HydrophobicContact CB-CD2 3.3Å; F368-F417 HydrophobicContact CB-CE1 4.24Å; F368-F417 HydrophobicContact CB-CE2 3.54Å; F368-F417 HydrophobicContact CB-CG 3.58Å; F368-F417 HydrophobicContact CB-CZ 4Å; F368-F417 HydrophobicContact CD1-CE2 4.09Å; F368-F417 HydrophobicContact CD1-CZ 4.32Å; F368-F417 HydrophobicContact CD2-CD1 4.16Å; F368-F417 HydrophobicContact CD2-CD2 4.45Å; F368-F417 AromaticContact CD2-CE1 3.67Å; F368-F417 HydrophobicContact CD2-CE1 3.67Å; F368-F417 HydrophobicContact CD2-CE2 4.01Å; F368-F417 AromaticContact CD2-CZ 3.59Å; F368-F417 HydrophobicContact CD2-CZ 3.59Å; F368-F417 HydrophobicContact CE2-CE1 4.33Å; F368-F417 HydrophobicContact CE2-CZ 4.12Å; F368-F417 HydrophobicContact CG-CD1 4.42Å; F368-F417 AromaticContact CG-CD2 3.95Å; F368-F417 HydrophobicContact CG-CD2 3.95Å; F368-F417 HydrophobicContact CG-CE1 4.13Å; F368-F417 AromaticContact CG-CE2 3.62Å; F368-F417 HydrophobicContact CG-CE2 3.62Å; F368-F417 HydrophobicContact CG-CG 4.34Å; F368-F417 AromaticContact CG-CZ 3.72Å; F368-F417 HydrophobicContact CG-CZ 3.72Å; I413-F417 HydrophobicContact CG2-CD2 4.32Å; I413-F417 WeakPolarHBondContact O-CB 3.31Å; I413-F417 VanDerWaalsContact O-CD2 3.31Å; I413-F417 WeakPolarHBondContact O-CD2 3.27Å; I413-F417 PolarHBondContact O-N 3.32Å; Y415-F417 PolarHBondContact O-N 2.96Å; F417-S421 VanDerWaalsContact O-CB 3.3Å; F417-S421 WeakPolarHBondContact O-CB 3.42Å; F417-S421 PolarHBondContact O-N 3.29Å; F417-W615 HydrophobicContact CD1-CZ3 4.36Å; F417-W615 HydrophobicContact CE1-CZ3 4.31Å
418	S	95.2	Very high	94.9	Very high	19 Å²	19	19.6 Å²	19.6	13%	0.133	10%	0.095	C	C	.	.	H	α-helix	trans	-62.2	-54.9	169.9	-179.8	0	0	0	0	111.4	Q414 Y415 A420 S421 Y422	Q414-S418 WeakPolarHBondContact O-CB 3.32Å; Q414-S418 PolarHBondContact O-N 3.03Å; Y415-S418 PolarHBondContact O-N 3.11Å; S418-A420 VanDerWaalsContact C-N 3.35Å; S418-A420 PolarHBondContact O-N 3.37Å; S418-S421 WeakPolarHBondContact O-CA 3.28Å; S418-S421 VanDerWaalsContact O-CB 3.28Å; S418-S421 WeakPolarHBondContact O-CB 3.36Å; S418-S421 PolarHBondContact O-N 2.89Å; S418-Y422 WeakPolarHBondContact O-CD2 3.39Å; S418-Y422 PolarHBondContact O-N 3.33Å; S418-Y422 VanDerWaalsContact O-N 3.12Å
419	I	95.5	Very high	94.9	Very high	5 Å²	5	18.7 Å²	18.7	3%	0.026	9%	0.089	C	C	.	.	H	α-helix	trans	-60.4	-43.6	179.6	-65.3	-64.1	0	0	0	111.2	Y415 F416 S421 Y422 I423 A618 F621 P657	Y415-I419 HydrophobicContact CD1-CG1 4.31Å; Y415-I419 HydrophobicContact CD2-CG1 4.41Å; Y415-I419 HydrophobicContact CE1-CG1 3.96Å; Y415-I419 HydrophobicContact CE2-CD1 4.33Å; Y415-I419 HydrophobicContact CE2-CG1 4.07Å; Y415-I419 WeakPolarHBondContact O-CG1 3.31Å; Y415-I419 PolarHBondContact O-N 3.01Å; F416-I419 PolarHBondContact O-N 3.33Å; I419-S421 VanDerWaalsContact C-N 3.29Å; I419-S421 PolarHBondContact O-N 2.03Å; I419-Y422 PolarHBondContact O-N 3.26Å; I419-I423 HydrophobicContact CG2-CD1 3.77Å; I419-I423 WeakPolarHBondContact O-CD1 3.29Å; I419-I423 WeakPolarHBondContact O-CG1 3.42Å; I419-I423 PolarHBondContact O-N 3.36Å; I419-A618 HydrophobicContact CG2-CB 4.3Å; I419-F621 HydrophobicContact CG2-CB 4.36Å; I419-F621 HydrophobicContact CG2-CD2 3.96Å; I419-F621 HydrophobicContact CG2-CG 4.43Å; I419-P657 HydrophobicContact CD1-CB 4.49Å
420	A	96.3	Very high	94.7	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-59.2	-37.7	173.7	0	0	0	0	0	112.6	F416 S418 I423 W424 W615 A618	F416-A420 VanDerWaalsContact O-CB 3.26Å; F416-A420 WeakPolarHBondContact O-CB 3.39Å; F416-A420 PolarHBondContact O-N 3.41Å; S418-A420 VanDerWaalsContact C-N 3.35Å; S418-A420 PolarHBondContact O-N 3.37Å; A420-I423 PolarHBondContact O-N 3.42Å; A420-W424 WeakPolarHBondContact O-CB 3.48Å; A420-W424 PolarHBondContact O-N 3.2Å; A420-W615 HydrophobicContact CB-CE3 3.98Å; A420-W615 HydrophobicContact CB-CZ3 3.62Å; A420-A618 HydrophobicContact CB-CB 3.83Å
421	S	95.1	Very high	94.3	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-64.8	-37.1	176.4	-165.2	0	0	0	0	112.9	Q366 F417 S418 I419 W425 Y811	Q366-S421 PolarHBondContact NE2-OG 3.33Å; F417-S421 VanDerWaalsContact O-CB 3.3Å; F417-S421 WeakPolarHBondContact O-CB 3.42Å; F417-S421 PolarHBondContact O-N 3.29Å; S418-S421 WeakPolarHBondContact O-CA 3.28Å; S418-S421 VanDerWaalsContact O-CB 3.28Å; S418-S421 WeakPolarHBondContact O-CB 3.36Å; S418-S421 PolarHBondContact O-N 2.89Å; I419-S421 VanDerWaalsContact C-N 3.29Å; I419-S421 PolarHBondContact O-N 2.03Å; S421-W425 PolarHBondContact O-N 2.84Å; S421-W425 VanDerWaalsContact O-N 3.16Å; S421-Y811 PolarHBondContact OG-OH 3.2Å
422	Y	95.5	Very high	94	Very high	5 Å²	5	18.1 Å²	18.1	2%	0.02	9%	0.089	C	C	.	.	H	α-helix	trans	-66.6	-45.8	173.3	-82.5	-120.5	0	0	0	110.5	S418 I419 W424 W425 T426 Q658 L661 I662 L815 M818	S418-Y422 WeakPolarHBondContact O-CD2 3.39Å; S418-Y422 PolarHBondContact O-N 3.33Å; S418-Y422 VanDerWaalsContact O-N 3.12Å; I419-Y422 PolarHBondContact O-N 3.26Å; Y422-W424 PolarHBondContact O-N 3.22Å; Y422-W425 PolarHBondContact O-N 3.23Å; Y422-T426 PolarHBondContact O-N 3.34Å; Y422-T426 PolarHBondContact O-OG1 2.96Å; Y422-Q658 HydrophobicContact CD1-CB 4.34Å; Y422-Q658 HydrophobicContact CD1-CG 4.16Å; Y422-Q658 HydrophobicContact CE1-CB 3.8Å; Y422-Q658 HydrophobicContact CE1-CG 3.54Å; Y422-Q658 PolarHBondContact OH-OE1 2.94Å; Y422-L661 HydrophobicContact CD1-CB 4.45Å; Y422-I662 HydrophobicContact CD1-CG1 4.3Å; Y422-I662 HydrophobicContact CE1-CD1 3.94Å; Y422-I662 HydrophobicContact CE1-CG1 4.05Å; Y422-L815 HydrophobicContact CD1-CD2 4.06Å; Y422-L815 HydrophobicContact CD2-CD2 4.12Å; Y422-L815 HydrophobicContact CE1-CD2 3.73Å; Y422-L815 HydrophobicContact CE2-CD2 3.77Å; Y422-L815 HydrophobicContact CG-CD2 4.26Å; Y422-M818 HydrophobicContact CE2-CE 4.36Å
423	I	95	Very high	93.6	Very high	11 Å²	11	15.5 Å²	15.5	6%	0.056	8%	0.076	C	C	.	.	H	α-helix	trans	-61.2	-45.2	179.4	-62.5	155.6	0	0	0	111.1	I419 A420 W425 T426 M427 A614 T617 A618 L661	I419-I423 HydrophobicContact CG2-CD1 3.77Å; I419-I423 WeakPolarHBondContact O-CD1 3.29Å; I419-I423 WeakPolarHBondContact O-CG1 3.42Å; I419-I423 PolarHBondContact O-N 3.36Å; A420-I423 PolarHBondContact O-N 3.42Å; I423-W425 VanDerWaalsContact C-N 3.34Å; I423-W425 PolarHBondContact O-N 3.37Å; I423-T426 PolarHBondContact O-N 3.49Å; I423-M427 HydrophobicContact CG2-CE 3.99Å; I423-M427 HydrophobicContact CG2-CG 4.46Å; I423-M427 HydrophobicContact CG2-SD 4.43Å; I423-M427 WeakPolarHBondContact O-CB 3.27Å; I423-M427 WeakPolarHBondContact O-CG 3.48Å; I423-M427 PolarHBondContact O-N 3Å; I423-A614 HydrophobicContact CG2-CB 4.13Å; I423-T617 WeakPolarHBondContact CD1-OG1 3.49Å; I423-A618 HydrophobicContact CD1-CB 4.02Å; I423-L661 HydrophobicContact CG1-CD1 3.81Å; I423-L661 HydrophobicContact CG1-CD2 4.1Å
424	W	94.7	Very high	93.2	Very high	1 Å²	1	16.6 Å²	16.6	0%	0.004	8%	0.082	C	C	.	.	H	α-helix	trans	-63.2	-35.8	176.5	-81.1	119.1	0	0	0	113.2	P358 Y361 I362 A420 Y422 M427 L428 H611 A614 W615	P358-W424 HydrophobicContact CB-CE3 4.14Å; Y361-W424 HydrophobicContact CD2-CD2 4.21Å; Y361-W424 HydrophobicContact CD2-CE3 4.05Å; Y361-W424 AromaticContact CD2-CH2 3.59Å; Y361-W424 HydrophobicContact CD2-CH2 3.59Å; Y361-W424 AromaticContact CD2-CZ2 3.73Å; Y361-W424 HydrophobicContact CD2-CZ2 3.73Å; Y361-W424 AromaticContact CD2-CZ3 3.76Å; Y361-W424 HydrophobicContact CD2-CZ3 3.76Å; Y361-W424 HydrophobicContact CE2-CH2 4.06Å; Y361-W424 HydrophobicContact CE2-CZ2 4.47Å; Y361-W424 HydrophobicContact CE2-CZ3 4.34Å; Y361-W424 HydrophobicContact CG-CH2 4.43Å; Y361-W424 HydrophobicContact CG-CZ2 4.12Å; I362-W424 HydrophobicContact CD1-CB 4.33Å; I362-W424 HydrophobicContact CG1-CB 3.6Å; A420-W424 WeakPolarHBondContact O-CB 3.48Å; A420-W424 PolarHBondContact O-N 3.2Å; Y422-W424 PolarHBondContact O-N 3.22Å; W424-M427 HydrophobicContact CE3-SD 4.29Å; W424-M427 HydrophobicContact CZ3-SD 4.25Å; W424-L428 WeakPolarHBondContact O-CB 3.42Å; W424-L428 PolarHBondContact O-N 2.87Å; W424-H611 AromaticContact CH2-CE1 3.96Å; W424-H611 AromaticContact CH2-CG 3.97Å; W424-H611 AromaticContact CH2-ND1 3.47Å; W424-H611 WeakPolarHBondContact CH2-ND1 3.46Å; W424-H611 AromaticContact CZ2-CE1 3.81Å; W424-H611 AromaticContact CZ2-ND1 3.4Å; W424-H611 WeakPolarHBondContact CZ2-ND1 3.39Å; W424-A614 HydrophobicContact CD2-CB 4.1Å; W424-A614 HydrophobicContact CE3-CB 4.5Å; W424-A614 HydrophobicContact CH2-CB 4.05Å; W424-A614 HydrophobicContact CZ2-CB 3.6Å; W424-A614 HydrophobicContact CZ3-CB 4.48Å; W424-W615 AromaticContact CE2-CZ2 3.98Å; W424-W615 AromaticContact CZ2-CE2 3.95Å; W424-W615 HydrophobicContact CZ2-CZ2 4.08Å; W424-W615 AromaticContact CZ2-NE1 3.78Å; W424-W615 AromaticContact NE1-CE2 3.7Å; W424-W615 AromaticContact NE1-CH2 3.44Å; W424-W615 AromaticContact NE1-CZ2 3.31Å; W424-W615 VanDerWaalsContact NE1-CZ2 3.31Å; W424-W615 AromaticContact NE1-CZ3 3.93Å
425	W	95	Very high	92.5	Very high	1 Å²	1	17.2 Å²	17.2	0%	0.004	9%	0.085	C	C	.	.	H	α-helix	trans	-65.4	-50.2	171.4	173.1	87.1	0	0	0	111.2	I362 S421 Y422 I423 M427 L428 V429 C808 Y811 L812 L815	I362-W425 HydrophobicContact CD1-CB 4.22Å; S421-W425 PolarHBondContact O-N 2.84Å; S421-W425 VanDerWaalsContact O-N 3.16Å; Y422-W425 PolarHBondContact O-N 3.23Å; I423-W425 VanDerWaalsContact C-N 3.34Å; I423-W425 PolarHBondContact O-N 3.37Å; W425-M427 VanDerWaalsContact C-N 3.29Å; W425-M427 PolarHBondContact O-N 3.35Å; W425-L428 WeakPolarHBondContact O-CB 3.25Å; W425-L428 PolarHBondContact O-N 3.25Å; W425-L428 VanDerWaalsContact O-N 3.07Å; W425-V429 HydrophobicContact CD2-CG2 4.15Å; W425-V429 HydrophobicContact CZ2-CG2 3.93Å; W425-V429 WeakPolarHBondContact O-CG2 3.45Å; W425-V429 PolarHBondContact O-N 3.43Å; W425-C808 PolarHBondContact NE1-O 2.8Å; W425-Y811 HydrophobicContact CB-CD1 4.26Å; W425-Y811 HydrophobicContact CB-CE1 4.02Å; W425-Y811 AromaticContact CD1-CD1 3.18Å; W425-Y811 AromaticContact CD1-CE1 3.84Å; W425-Y811 AromaticContact CD1-CG 3.62Å; W425-Y811 HydrophobicContact CD2-CD1 4.42Å; W425-Y811 AromaticContact CG-CD1 3.72Å; W425-Y811 HydrophobicContact CG-CD1 3.72Å; W425-Y811 AromaticContact CG-CE1 3.97Å; W425-Y811 HydrophobicContact CG-CE1 3.97Å; W425-Y811 AromaticContact NE1-CD1 3.63Å; W425-L812 HydrophobicContact CH2-CD1 3.81Å; W425-L812 HydrophobicContact CZ2-CB 4.14Å; W425-L812 HydrophobicContact CZ2-CD1 3.86Å; W425-L812 HydrophobicContact CZ2-CG 4.5Å; W425-L815 HydrophobicContact CD2-CD1 3.46Å; W425-L815 VanDerWaalsContact CD2-CD1 3.46Å; W425-L815 HydrophobicContact CE3-CD1 3.53Å; W425-L815 HydrophobicContact CG-CD1 3.97Å; W425-L815 HydrophobicContact CH2-CD1 4.15Å; W425-L815 HydrophobicContact CZ2-CD1 4.08Å; W425-L815 HydrophobicContact CZ3-CD1 3.88Å
426	T	94.1	Very high	91.8	Very high	7 Å²	7	16.6 Å²	16.6	4%	0.043	8%	0.083	C	C	.	.	H	α-helix	trans	-57.7	-41.9	178.5	-57.5	0	0	0	0	111.4	Y422 I423 V429 I430 L661 L664	Y422-T426 PolarHBondContact O-N 3.34Å; Y422-T426 PolarHBondContact O-OG1 2.96Å; I423-T426 PolarHBondContact O-N 3.49Å; T426-V429 PolarHBondContact O-N 3.06Å; T426-I430 HydrophobicContact CG2-CD1 3.88Å; T426-I430 VanDerWaalsContact O-CG1 3.28Å; T426-I430 WeakPolarHBondContact O-CG1 3.47Å; T426-I430 PolarHBondContact O-N 3.1Å; T426-L661 HydrophobicContact CG2-CD2 4.44Å; T426-L661 PolarHBondContact OG1-O 3.35Å; T426-L664 HydrophobicContact CG2-CB 4.13Å
427	M	91	Very high	91.1	Very high	37 Å²	37	16.8 Å²	16.8	18%	0.182	9%	0.085	C	C	.	.	H	α-helix	trans	-62.8	-44.2	173.3	-74.9	-172.1	176.8	0	0	113.1	I423 W424 W425 V429 I430 H431 E610 V613 A614	I423-M427 HydrophobicContact CG2-CE 3.99Å; I423-M427 HydrophobicContact CG2-CG 4.46Å; I423-M427 HydrophobicContact CG2-SD 4.43Å; I423-M427 WeakPolarHBondContact O-CB 3.27Å; I423-M427 WeakPolarHBondContact O-CG 3.48Å; I423-M427 PolarHBondContact O-N 3Å; W424-M427 HydrophobicContact CE3-SD 4.29Å; W424-M427 HydrophobicContact CZ3-SD 4.25Å; W425-M427 VanDerWaalsContact C-N 3.29Å; W425-M427 PolarHBondContact O-N 3.35Å; M427-V429 VanDerWaalsContact C-N 3.31Å; M427-V429 PolarHBondContact O-N 3.41Å; M427-I430 PolarHBondContact O-N 2.86Å; M427-H431 WeakPolarHBondContact O-CB 3.36Å; M427-H431 PolarHBondContact O-N 3.29Å; M427-E610 HydrophobicContact SD-CB 4.4Å; M427-V613 HydrophobicContact CE-CB 3.81Å; M427-V613 HydrophobicContact CE-CG1 3.54Å; M427-A614 HydrophobicContact CE-CB 3.92Å; M427-A614 HydrophobicContact SD-CB 3.96Å
428	L	91.2	Very high	89.9	Confident	2 Å²	2	16.7 Å²	16.7	1%	0.01	9%	0.089	C	C	.	.	H	α-helix	trans	-59.4	-41.7	177.2	176.1	62.4	0	0	0	111.6	P358 I359 I362 W424 W425 W432 I804 F807	P358-L428 HydrophobicContact CB-CB 4.08Å; P358-L428 HydrophobicContact CB-CD1 4.12Å; P358-L428 HydrophobicContact CG-CD1 4.19Å; I359-L428 HydrophobicContact CD1-CD2 4.19Å; I359-L428 HydrophobicContact CG1-CD1 4.46Å; I359-L428 HydrophobicContact CG1-CD2 3.58Å; I362-L428 HydrophobicContact CD1-CD2 4.32Å; W424-L428 WeakPolarHBondContact O-CB 3.42Å; W424-L428 PolarHBondContact O-N 2.87Å; W425-L428 WeakPolarHBondContact O-CB 3.25Å; W425-L428 PolarHBondContact O-N 3.25Å; W425-L428 VanDerWaalsContact O-N 3.07Å; L428-W432 VanDerWaalsContact O-CB 3.28Å; L428-W432 WeakPolarHBondContact O-CB 3.33Å; L428-W432 PolarHBondContact O-N 3.35Å; L428-I804 HydrophobicContact CD1-CG2 4.04Å; L428-F807 HydrophobicContact CD2-CD1 3.9Å; L428-F807 HydrophobicContact CD2-CE1 3.73Å
429	V	93.1	Very high	88.6	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-69.3	-40.1	177.5	-171.6	0	0	0	0	112.1	W425 T426 M427 W432 S433 G665 A668 F669 C808	W425-V429 HydrophobicContact CD2-CG2 4.15Å; W425-V429 HydrophobicContact CZ2-CG2 3.93Å; W425-V429 WeakPolarHBondContact O-CG2 3.45Å; W425-V429 PolarHBondContact O-N 3.43Å; T426-V429 PolarHBondContact O-N 3.06Å; M427-V429 VanDerWaalsContact C-N 3.31Å; M427-V429 PolarHBondContact O-N 3.41Å; V429-W432 HydrophobicContact CG1-CE3 4.39Å; V429-W432 PolarHBondContact O-N 2.8Å; V429-S433 PolarHBondContact O-N 3.02Å; V429-S433 PolarHBondContact O-OG 2.93Å; V429-G665 WeakPolarHBondContact CG1-O 3.38Å; V429-A668 HydrophobicContact CB-CB 4.47Å; V429-A668 HydrophobicContact CG1-CB 3.88Å; V429-F669 HydrophobicContact CG1-CB 3.72Å; V429-F669 HydrophobicContact CG1-CD2 4.44Å; V429-F669 VanDerWaalsContact CG1-N 3.33Å; V429-C808 HydrophobicContact CG2-CB 3.88Å
430	I	90.5	Very high	87.4	Confident	67 Å²	67	21.2 Å²	21.2	34%	0.344	11%	0.11	S	C	.	.	H	α-helix	trans	-64.4	-45.5	175.4	-70.4	166.9	0	0	0	111	T426 M427 W432 S433 L434 A668	T426-I430 HydrophobicContact CG2-CD1 3.88Å; T426-I430 VanDerWaalsContact O-CG1 3.28Å; T426-I430 WeakPolarHBondContact O-CG1 3.47Å; T426-I430 PolarHBondContact O-N 3.1Å; M427-I430 PolarHBondContact O-N 2.86Å; I430-W432 VanDerWaalsContact C-N 3.32Å; I430-W432 PolarHBondContact O-N 3.06Å; I430-S433 PolarHBondContact O-N 3.08Å; I430-S433 PolarHBondContact O-OG 3.34Å; I430-S433 VanDerWaalsContact O-OG 3.1Å; I430-L434 HydrophobicContact CG2-CD1 3.73Å; I430-L434 HydrophobicContact CG2-CG 4.25Å; I430-L434 WeakPolarHBondContact O-CB 3.5Å; I430-L434 VanDerWaalsContact O-CG 3.26Å; I430-L434 WeakPolarHBondContact O-CG 3.41Å; I430-L434 PolarHBondContact O-N 3.15Å; I430-A668 HydrophobicContact CG1-CB 3.74Å
431	H	86.5	Confident	86.2	Confident	30 Å²	30	24 Å²	24	14%	0.139	13%	0.127	C	C	.	.	H	α-helix	trans	-61.4	-41.3	177.1	-175.8	39.9	0	0	0	111.6	F354 N355 M427 Q435	F354-H431 AromaticContact CD1-NE2 3.8Å; F354-H431 AromaticContact CE1-NE2 3.75Å; N355-H431 PolarHBondContact OD1-NE2 3.1Å; M427-H431 WeakPolarHBondContact O-CB 3.36Å; M427-H431 PolarHBondContact O-N 3.29Å; H431-Q435 PolarHBondContact CD2-NE2 3.23Å; H431-Q435 PolarHBondContact CE1-NE2 3.04Å; H431-Q435 VanDerWaalsContact CE1-NE2 3.3Å; H431-Q435 PolarHBondContact ND1-NE2 3.37Å; H431-Q435 PolarHBondContact NE2-NE2 3.2Å; H431-Q435 VanDerWaalsContact NE2-NE2 3.12Å; H431-Q435 VanDerWaalsContact O-CG 3.28Å; H431-Q435 WeakPolarHBondContact O-CG 3.39Å; H431-Q435 PolarHBondContact O-N 2.89Å; H431-Q435 VanDerWaalsContact O-N 3.08Å; H431-Q435 PolarHBondContact O-NE2 3.27Å
432	W	89.3	Confident	84.7	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-64.2	-44.1	175.1	174	81.9	0	0	0	112.8	L428 V429 I430 R436 F669 F673 L676 E801 I804 G805	L428-W432 VanDerWaalsContact O-CB 3.28Å; L428-W432 WeakPolarHBondContact O-CB 3.33Å; L428-W432 PolarHBondContact O-N 3.35Å; V429-W432 HydrophobicContact CG1-CE3 4.39Å; V429-W432 PolarHBondContact O-N 2.8Å; I430-W432 VanDerWaalsContact C-N 3.32Å; I430-W432 PolarHBondContact O-N 3.06Å; W432-R436 WeakPolarHBondContact O-CG 3.42Å; W432-R436 PolarHBondContact O-N 3.41Å; W432-F669 HydrophobicContact CH2-CD2 4.05Å; W432-F669 AromaticContact CH2-CE2 3.93Å; W432-F669 HydrophobicContact CH2-CE2 3.93Å; W432-F669 AromaticContact CZ3-CD2 3.79Å; W432-F669 HydrophobicContact CZ3-CD2 3.79Å; W432-F669 HydrophobicContact CZ3-CE2 4.16Å; W432-F669 WeakPolarHBondContact CZ3-O 3.36Å; W432-F673 HydrophobicContact CH2-CB 4.44Å; W432-L676 HydrophobicContact CH2-CD1 4.13Å; W432-L676 HydrophobicContact CZ2-CD1 3.53Å; W432-E801 PolarHBondContact NE1-O 3.07Å; W432-I804 HydrophobicContact CB-CG2 4.32Å; W432-I804 HydrophobicContact CG-CG2 4.21Å; W432-G805 VanDerWaalsContact CE2-CA 3.46Å; W432-G805 VanDerWaalsContact CZ2-CA 3.42Å
433	S	89.2	Confident	82.7	Confident	7 Å²	7	31.5 Å²	31.5	5%	0.049	17%	0.166	C	C	.	.	H	α-helix	trans	-69.7	-39.6	178.7	71.5	0	0	0	0	112.2	V429 I430 Q435 R436 I437 A668	V429-S433 PolarHBondContact O-N 3.02Å; V429-S433 PolarHBondContact O-OG 2.93Å; I430-S433 PolarHBondContact O-N 3.08Å; I430-S433 PolarHBondContact O-OG 3.34Å; I430-S433 VanDerWaalsContact O-OG 3.1Å; S433-Q435 PolarHBondContact O-N 3Å; S433-R436 PolarHBondContact O-N 2.62Å; S433-I437 VanDerWaalsContact O-CG1 3.3Å; S433-I437 WeakPolarHBondContact O-CG1 3.37Å; S433-I437 PolarHBondContact O-N 3.44Å; S433-A668 WeakPolarHBondContact CB-O 3.27Å
434	L	85.3	Confident	80.9	Confident	44 Å²	44	35.3 Å²	35.3	23%	0.23	19%	0.186	C	C	.	.	H	α-helix	trans	-63.2	-39.1	175.9	-71.5	173.4	0	0	0	112.9	I430 R436 I437 S438 F487	I430-L434 HydrophobicContact CG2-CD1 3.73Å; I430-L434 HydrophobicContact CG2-CG 4.25Å; I430-L434 WeakPolarHBondContact O-CB 3.5Å; I430-L434 VanDerWaalsContact O-CG 3.26Å; I430-L434 WeakPolarHBondContact O-CG 3.41Å; I430-L434 PolarHBondContact O-N 3.15Å; L434-R436 VanDerWaalsContact C-N 3.33Å; L434-R436 PolarHBondContact O-N 2.99Å; L434-I437 HydrophobicContact CD2-CD1 4.41Å; L434-I437 PolarHBondContact O-N 2.99Å; L434-S438 WeakPolarHBondContact O-CB 3.44Å; L434-S438 PolarHBondContact O-N 3.47Å; L434-F487 HydrophobicContact CB-CD2 4.27Å; L434-F487 HydrophobicContact CB-CE2 3.62Å; L434-F487 HydrophobicContact CB-CZ 4.22Å; L434-F487 HydrophobicContact CD1-CE2 4.25Å; L434-F487 HydrophobicContact CG-CE2 4.42Å
435	Q	80.4	Confident	78.8	Confident	28 Å²	28	38.6 Å²	38.6	13%	0.131	21%	0.209	C	C	.	.	H	α-helix	trans	-57.1	-46.6	171.4	-75.8	163	58.6	0	0	111.7	N355 H431 S433 S438 M439	N355-Q435 PolarHBondContact ND2-OE1 3.23Å; H431-Q435 PolarHBondContact CD2-NE2 3.23Å; H431-Q435 PolarHBondContact CE1-NE2 3.04Å; H431-Q435 VanDerWaalsContact CE1-NE2 3.3Å; H431-Q435 PolarHBondContact ND1-NE2 3.37Å; H431-Q435 PolarHBondContact NE2-NE2 3.2Å; H431-Q435 VanDerWaalsContact NE2-NE2 3.12Å; H431-Q435 VanDerWaalsContact O-CG 3.28Å; H431-Q435 WeakPolarHBondContact O-CG 3.39Å; H431-Q435 PolarHBondContact O-N 2.89Å; H431-Q435 VanDerWaalsContact O-N 3.08Å; H431-Q435 PolarHBondContact O-NE2 3.27Å; S433-Q435 PolarHBondContact O-N 3Å; Q435-S438 PolarHBondContact O-N 3.41Å; Q435-M439 PolarHBondContact O-N 2.91Å
436	R	81.2	Confident	76.2	Confident	6 Å²	6	41.9 Å²	41.9	2%	0.023	23%	0.232	C	C	.	.	H	α-helix	trans	-66.1	-38.8	179.1	-66.6	-57	-52	161.7	8.8	112.3	W432 S433 L434 M439 I440 C675 E801	W432-R436 WeakPolarHBondContact O-CG 3.42Å; W432-R436 PolarHBondContact O-N 3.41Å; S433-R436 PolarHBondContact O-N 2.62Å; L434-R436 VanDerWaalsContact C-N 3.33Å; L434-R436 PolarHBondContact O-N 2.99Å; R436-M439 PolarHBondContact NH1-SD 3.26Å; R436-I440 WeakPolarHBondContact O-CG1 3.39Å; R436-I440 PolarHBondContact O-N 3.39Å; R436-C675 HydrophobicContact CB-CB 3.76Å; R436-C675 PolarHBondContact NE-O 3.47Å; R436-C675 PolarHBondContact NH2-O 3.01Å; R436-E801 WeakPolarHBondContact CD-OE2 3.18Å; R436-E801 IonicContact CZ-OE2 3.45Å; R436-E801 IonicContact NE-OE2 3.52Å; R436-E801 IonicContact NH1-OE2 3.58Å; R436-E801 PolarHBondContact NH1-OE2 3.24Å
437	I	81.9	Confident	73.5	Confident	47 Å²	47	45.8 Å²	45.8	24%	0.241	25%	0.247	C	C	.	.	H	α-helix	trans	-62.7	-47.8	172.6	-66.6	163.8	0	0	0	110.1	S433 L434 M439 I440 T441 I671	S433-I437 VanDerWaalsContact O-CG1 3.3Å; S433-I437 WeakPolarHBondContact O-CG1 3.37Å; S433-I437 PolarHBondContact O-N 3.44Å; L434-I437 HydrophobicContact CD2-CD1 4.41Å; L434-I437 PolarHBondContact O-N 2.99Å; I437-M439 PolarHBondContact O-N 2.92Å; I437-I440 CarbonylContact O-C 3.59Å; I437-I440 WeakPolarHBondContact O-CA 3.4Å; I437-I440 WeakPolarHBondContact O-CB 3.38Å; I437-I440 PolarHBondContact O-N 3.36Å; I437-T441 HydrophobicContact CG2-CG2 4.18Å; I437-T441 PolarHBondContact O-N 2.96Å; I437-T441 PolarHBondContact O-OG1 3.41Å; I437-I671 HydrophobicContact CD1-CG2 3.87Å; I437-I671 HydrophobicContact CG1-CG2 4.34Å
438	S	72.1	Confident	70.6	Confident	32 Å²	32	47.1 Å²	47.1	22%	0.224	26%	0.259	C	S	.	.	H	α-helix	trans	-62.1	-38.3	-179.5	180	0	0	0	0	113.3	L434 Q435 I440 T441 S442 F487	L434-S438 WeakPolarHBondContact O-CB 3.44Å; L434-S438 PolarHBondContact O-N 3.47Å; Q435-S438 PolarHBondContact O-N 3.41Å; S438-I440 VanDerWaalsContact C-N 3.31Å; S438-I440 PolarHBondContact O-N 3.44Å; S438-T441 WeakPolarHBondContact CA-OG1 3.5Å; S438-T441 PolarHBondContact O-OG1 2.95Å; S438-S442 VanDerWaalsContact O-CB 3.29Å; S438-S442 WeakPolarHBondContact O-CB 3.44Å; S438-S442 PolarHBondContact O-N 2.67Å; S438-S442 PolarHBondContact O-OG 3.5Å; S438-F487 VanDerWaalsContact CB-CE1 3.41Å; S438-F487 WeakPolarHBondContact OG-CD1 3.21Å; S438-F487 WeakPolarHBondContact OG-CE1 3.38Å
439	M	68.5	Low	67.6	Low	73 Å²	73	51.4 Å²	51.4	36%	0.36	29%	0.288	S	S	.	.	H	α-helix	trans	-62.9	-39	172.3	-173.4	-176.4	-72.6	0	0	111.4	Q435 R436 I437 Y443	Q435-M439 PolarHBondContact O-N 2.91Å; R436-M439 PolarHBondContact NH1-SD 3.26Å; I437-M439 PolarHBondContact O-N 2.92Å; M439-Y443 WeakPolarHBondContact O-CB 3.33Å; M439-Y443 PolarHBondContact O-N 2.03Å
440	I	70.7	Confident	65	Low	46 Å²	46	54.3 Å²	54.3	24%	0.236	30%	0.303	C	S	.	.	H	α-helix	trans	-72.8	-44	178.9	-71.4	169.2	0	0	0	112	R436 I437 S438 S442 Y443 I444 C675	R436-I440 WeakPolarHBondContact O-CG1 3.39Å; R436-I440 PolarHBondContact O-N 3.39Å; I437-I440 CarbonylContact O-C 3.59Å; I437-I440 WeakPolarHBondContact O-CA 3.4Å; I437-I440 WeakPolarHBondContact O-CB 3.38Å; I437-I440 PolarHBondContact O-N 3.36Å; S438-I440 VanDerWaalsContact C-N 3.31Å; S438-I440 PolarHBondContact O-N 3.44Å; I440-S442 VanDerWaalsContact C-N 3.32Å; I440-S442 PolarHBondContact O-N 3.44Å; I440-Y443 WeakPolarHBondContact O-CB 3.13Å; I440-Y443 PolarHBondContact O-N 3.13Å; I440-Y443 VanDerWaalsContact O-N 3.16Å; I440-I444 HydrophobicContact CG2-CD1 3.65Å; I440-I444 HydrophobicContact CG2-CG1 4.3Å; I440-I444 WeakPolarHBondContact O-CG1 3.48Å; I440-I444 PolarHBondContact O-N 3.01Å; I440-C675 HydrophobicContact CD1-CB 3.5Å
441	T	69.3	Low	62.4	Low	59 Å²	59	55.8 Å²	55.8	36%	0.362	32%	0.316	S	S	.	.	H	α-helix	trans	-64.7	-38.9	177.8	55.3	0	0	0	0	111.3	I437 S438 Y443 I444 S445	I437-T441 HydrophobicContact CG2-CG2 4.18Å; I437-T441 PolarHBondContact O-N 2.96Å; I437-T441 PolarHBondContact O-OG1 3.41Å; S438-T441 WeakPolarHBondContact CA-OG1 3.5Å; S438-T441 PolarHBondContact O-OG1 2.95Å; T441-Y443 VanDerWaalsContact C-N 3.35Å; T441-Y443 PolarHBondContact O-N 3.33Å; T441-I444 PolarHBondContact O-N 3.28Å; T441-S445 VanDerWaalsContact O-CB 3.31Å; T441-S445 WeakPolarHBondContact O-CB 3.45Å; T441-S445 PolarHBondContact O-N 3.18Å
442	S	63.5	Low	59.8	Low	70 Å²	70	60.2 Å²	60.2	49%	0.49	34%	0.336	S	S	.	.	H	α-helix	trans	-61	-41.9	171.7	-56.5	0	0	0	0	112	S438 I440 S446	S438-S442 VanDerWaalsContact O-CB 3.29Å; S438-S442 WeakPolarHBondContact O-CB 3.44Å; S438-S442 PolarHBondContact O-N 2.67Å; S438-S442 PolarHBondContact O-OG 3.5Å; I440-S442 VanDerWaalsContact C-N 3.32Å; I440-S442 PolarHBondContact O-N 3.44Å; S442-S446 VanDerWaalsContact O-CB 3.29Å; S442-S446 WeakPolarHBondContact O-CB 3.24Å; S442-S446 PolarHBondContact O-N 2.89Å
443	Y	53.9	Low	57.1	Low	92 Å²	92	63.7 Å²	63.7	36%	0.361	36%	0.361	S	S	.	.	H	α-helix	trans	-65.9	-41.8	176.1	-179.7	-83.4	0	0	0	112.4	M439 I440 T441 Y447 K682	M439-Y443 WeakPolarHBondContact O-CB 3.33Å; M439-Y443 PolarHBondContact O-N 2.03Å; I440-Y443 WeakPolarHBondContact O-CB 3.13Å; I440-Y443 PolarHBondContact O-N 3.13Å; I440-Y443 VanDerWaalsContact O-N 3.16Å; T441-Y443 VanDerWaalsContact C-N 3.35Å; T441-Y443 PolarHBondContact O-N 3.33Å; Y443-Y447 HydrophobicContact CD1-CD2 4.42Å; Y443-Y447 AromaticContact CE1-CD2 3.7Å; Y443-Y447 HydrophobicContact CE1-CD2 3.7Å; Y443-Y447 AromaticContact CE1-CE2 3.95Å; Y443-Y447 HydrophobicContact CE1-CE2 3.95Å; Y443-Y447 AromaticContact CZ-CD2 3.79Å; Y443-Y447 AromaticContact CZ-CE2 3.68Å; Y443-Y447 PolarHBondContact O-N 3.4Å; Y443-Y447 VanDerWaalsContact O-N 3.08Å; Y443-Y447 VanDerWaalsContact OH-CE2 3.29Å; Y443-Y447 WeakPolarHBondContact OH-CE2 3.47Å; Y443-K682 PolarHBondContact OH-NZ 3.22Å
444	I	57.3	Low	54.7	Low	90 Å²	90	68.2 Å²	68.2	46%	0.462	39%	0.39	S	S	.	.	H	α-helix	trans	-67	-48.3	178.3	-68.8	167.7	0	0	0	110.5	I440 T441 S446 Y447 C448	I440-I444 HydrophobicContact CG2-CD1 3.65Å; I440-I444 HydrophobicContact CG2-CG1 4.3Å; I440-I444 WeakPolarHBondContact O-CG1 3.48Å; I440-I444 PolarHBondContact O-N 3.01Å; T441-I444 PolarHBondContact O-N 3.28Å; I444-S446 VanDerWaalsContact C-N 3.33Å; I444-S446 PolarHBondContact O-N 3.41Å; I444-Y447 WeakPolarHBondContact O-CA 3.44Å; I444-Y447 VanDerWaalsContact O-CB 3.28Å; I444-Y447 WeakPolarHBondContact O-CB 3.42Å; I444-Y447 PolarHBondContact O-N 3.38Å; I444-C448 PolarHBondContact O-N 3.06Å; I444-C448 PolarHBondContact O-SG 2.75Å
445	S	50.8	Low	52.2	Low	71 Å²	71	74 Å²	74	50%	0.497	42%	0.416	S	S	.	.	H	α-helix	trans	-56.2	-46.8	175.6	174.2	0	0	0	0	111.3	T441 Y447 C448 C449	T441-S445 VanDerWaalsContact O-CB 3.31Å; T441-S445 WeakPolarHBondContact O-CB 3.45Å; T441-S445 PolarHBondContact O-N 3.18Å; S445-Y447 PolarHBondContact O-N 2.91Å; S445-C448 PolarHBondContact O-N 2.93Å; S445-C449 PolarHBondContact O-N 3.09Å; S445-C449 PolarHBondContact O-SG 3.45Å; S445-C449 VanDerWaalsContact O-SG 3.35Å
446	S	41.2	Very low	49.9	Very low	69 Å²	69	78.1 Å²	78.1	48%	0.483	44%	0.438	S	S	.	.	H	α-helix	trans	-62.2	-24.6	174.4	-174.3	0	0	0	0	113.7	S442 I444 N450	S442-S446 VanDerWaalsContact O-CB 3.29Å; S442-S446 WeakPolarHBondContact O-CB 3.24Å; S442-S446 PolarHBondContact O-N 2.89Å; I444-S446 VanDerWaalsContact C-N 3.33Å; I444-S446 PolarHBondContact O-N 3.41Å; S446-N450 PolarHBondContact O-ND2 3Å
447	Y	37.5	Very low	47.5	Very low	90 Å²	90	83.7 Å²	83.7	35%	0.353	46%	0.459	S	S	.	.	H	α-helix	trans	-77.1	-50.3	173.2	-123.3	-95.2	0	0	0	110.9	Y443 I444 S445 C449 N450 T451 H735	Y443-Y447 HydrophobicContact CD1-CD2 4.42Å; Y443-Y447 AromaticContact CE1-CD2 3.7Å; Y443-Y447 HydrophobicContact CE1-CD2 3.7Å; Y443-Y447 AromaticContact CE1-CE2 3.95Å; Y443-Y447 HydrophobicContact CE1-CE2 3.95Å; Y443-Y447 AromaticContact CZ-CD2 3.79Å; Y443-Y447 AromaticContact CZ-CE2 3.68Å; Y443-Y447 PolarHBondContact O-N 3.4Å; Y443-Y447 VanDerWaalsContact O-N 3.08Å; Y443-Y447 VanDerWaalsContact OH-CE2 3.29Å; Y443-Y447 WeakPolarHBondContact OH-CE2 3.47Å; I444-Y447 WeakPolarHBondContact O-CA 3.44Å; I444-Y447 VanDerWaalsContact O-CB 3.28Å; I444-Y447 WeakPolarHBondContact O-CB 3.42Å; I444-Y447 PolarHBondContact O-N 3.38Å; S445-Y447 PolarHBondContact O-N 2.91Å; Y447-C449 PolarHBondContact O-N 2.71Å; Y447-N450 PolarHBondContact O-N 3.38Å; Y447-T451 PolarHBondContact O-N 3.28Å; Y447-T451 VanDerWaalsContact O-N 3.11Å; Y447-T451 PolarHBondContact O-OG1 2.93Å; Y447-H735 AromaticContact CE2-CD2 3.67Å; Y447-H735 AromaticContact CZ-CD2 3.72Å
448	C	28.6	Very low	45.2	Very low	64 Å²	64	87.7 Å²	87.7	43%	0.432	48%	0.481	S	S	.	.	H	α-helix	trans	-56.7	-45.5	179.7	-68.2	0	0	0	0	112.4	I444 S445 N450 T451	I444-C448 PolarHBondContact O-N 3.06Å; I444-C448 PolarHBondContact O-SG 2.75Å; S445-C448 PolarHBondContact O-N 2.93Å; C448-N450 PolarHBondContact O-N 3.11Å; C448-T451 WeakPolarHBondContact CA-OG1 3.44Å; C448-T451 PolarHBondContact O-N 2.87Å; C448-T451 PolarHBondContact O-OG1 2.93Å
449	C	29.8	Very low	43.2	Very low	92 Å²	92	90.9 Å²	90.9	62%	0.622	50%	0.499	S	S	*	.	H	α-helix	trans	-62.2	-24.2	176.2	-64.3	0	0	0	0	113.5	S445 Y447	S445-C449 PolarHBondContact O-N 3.09Å; S445-C449 PolarHBondContact O-SG 3.45Å; S445-C449 VanDerWaalsContact O-SG 3.35Å; Y447-C449 PolarHBondContact O-N 2.71Å
450	N	36.6	Very low	41.2	Very low	61 Å²	61	92.9 Å²	92.9	33%	0.326	52%	0.519	S	S	.	.	H	α-helix	trans	-88.4	-27	178.7	-87.6	-71.2	0	0	0	113.7	S446 Y447 C448 R457	S446-N450 PolarHBondContact O-ND2 3Å; Y447-N450 PolarHBondContact O-N 3.38Å; C448-N450 PolarHBondContact O-N 3.11Å; N450-R457 PolarHBondContact O-NH2 2.79Å
451	T	36.8	Very low	39.2	Very low	99 Å²	99	95.7 Å²	95.7	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-80.6	-9.2	-177.9	44.7	0	0	0	0	114.8	Y447 C448	Y447-T451 PolarHBondContact O-N 3.28Å; Y447-T451 VanDerWaalsContact O-N 3.11Å; Y447-T451 PolarHBondContact O-OG1 2.93Å; C448-T451 WeakPolarHBondContact CA-OG1 3.44Å; C448-T451 PolarHBondContact O-N 2.87Å; C448-T451 PolarHBondContact O-OG1 2.93Å
452	H	32.4	Very low	37.3	Very low	123 Å²	123	99.7 Å²	99.7	57%	0.569	56%	0.557	S	S	*	*	S	Bend	trans	-74.2	144.6	175.1	-90.4	-112.6	0	0	0	113.5	R457	H452-R457 PolarHBondContact O-NH2 3.49Å
453	S	33.1	Very low	35.7	Very low	74 Å²	74	105.2 Å²	105.2	52%	0.517	58%	0.575	S	S	.	*			trans	-52.8	145.5	-171.9	-178.1	0	0	0	0	113.5	Q455 L456	S453-Q455 PolarHBondContact O-N 2.88Å; S453-L456 PolarHBondContact O-N 3.42Å
454	P	37.1	Very low	34.5	Very low	103 Å²	103	108.6 Å²	108.6	67%	0.669	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-52.5	-29.6	-178.1	-28.8	35.9	0	0	0	115.3	L456 R457	P454-L456 VanDerWaalsContact C-N 3.3Å; P454-L456 PolarHBondContact O-N 2.96Å; P454-R457 WeakPolarHBondContact O-CB 3.42Å; P454-R457 PolarHBondContact O-N 2.86Å
455	Q	34.3	Very low	33.1	Very low	166 Å²	166	112.6 Å²	112.6	78%	0.776	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-62.1	-30.9	-177.4	-63.7	-68.5	4.5	0	0	113.9	S453	S453-Q455 PolarHBondContact O-N 2.88Å
456	L	31.6	Very low	31.9	Very low	113 Å²	113	117.4 Å²	117.4	59%	0.592	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-89.3	-4.4	-179.9	-109.2	71.9	0	0	0	113.9	S453 P454 N458 T459	S453-L456 PolarHBondContact O-N 3.42Å; P454-L456 VanDerWaalsContact C-N 3.3Å; P454-L456 PolarHBondContact O-N 2.96Å; L456-N458 PolarHBondContact O-N 3.3Å; L456-T459 PolarHBondContact O-OG1 2.74Å
457	R	30.1	Very low	31.3	Very low	124 Å²	124	124.1 Å²	124.1	47%	0.468	65%	0.649	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.4	-15.5	-170.4	-157.3	163.1	-65.8	-132.1	-2.3	113.8	N450 H452 P454	N450-R457 PolarHBondContact O-NH2 2.79Å; H452-R457 PolarHBondContact O-NH2 3.49Å; P454-R457 WeakPolarHBondContact O-CB 3.42Å; P454-R457 PolarHBondContact O-N 2.86Å
458	N	33.1	Very low	30.8	Very low	131 Å²	131	126.5 Å²	126.5	70%	0.701	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-21	-174.6	-66.9	-11.9	0	0	0	114.4	L456	L456-N458 PolarHBondContact O-N 3.3Å
459	T	31.6	Very low	31	Very low	98 Å²	98	131.3 Å²	131.3	60%	0.601	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-76.9	-33.3	-178.4	52.4	0	0	0	0	112.6	L456 S461	L456-T459 PolarHBondContact O-OG1 2.74Å; T459-S461 VanDerWaalsContact C-N 3.26Å; T459-S461 PolarHBondContact O-N 2.89Å
460	C	26.3	Very low	30.9	Very low	116 Å²	116	130.8 Å²	130.8	78%	0.784	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-80.9	12.7	-174.6	-65.9	0	0	0	0	115.3
461	S	28.6	Very low	30.4	Very low	104 Å²	104	135.6 Å²	135.6	73%	0.727	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-134.5	9.8	-176.7	-72.2	0	0	0	0	115.3	T459	T459-S461 VanDerWaalsContact C-N 3.26Å; T459-S461 PolarHBondContact O-N 2.89Å
462	H	29.3	Very low	30.1	Very low	143 Å²	143	139.5 Å²	139.5	66%	0.662	73%	0.728	S	S	*	*			trans	-125.7	1.9	-170.4	-119.1	-86.7	0	0	0	117.2	N464	H462-N464 PolarHBondContact O-N 3.38Å
463	H	29.5	Very low	29.8	Very low	186 Å²	186	140.4 Å²	140.4	86%	0.861	74%	0.736	S	S	*	*			trans	-73	26.8	-174.6	-116.6	-76.7	0	0	0	116.1
464	N	28.4	Very low	29.5	Very low	164 Å²	164	143.6 Å²	143.6	88%	0.877	75%	0.747	S	S	*	*	S	Bend	trans	-136.3	48	-179.7	-115.3	-33.5	0	0	0	111.5	H462	H462-N464 PolarHBondContact O-N 3.38Å
465	K	28	Very low	29	Very low	174 Å²	174	145.5 Å²	145.5	76%	0.757	76%	0.757	S	S	*	*	S	Bend	trans	-149.5	147.5	164	-112.6	166.6	-175.2	177	0	110.6
466	Q	26.7	Very low	28.7	Very low	171 Å²	171	145.6 Å²	145.6	80%	0.799	76%	0.757	S	S	*	*			trans	-60.1	138.7	-172.4	-54.5	131.6	-79.9	0	0	111.7
467	F	27.9	Very low	28.6	Very low	211 Å²	211	145.7 Å²	145.7	93%	0.925	77%	0.768	S	S	*	*			trans	-150.2	131.8	137.1	-111.5	-74.5	0	0	0	110.3
468	N	27.2	Very low	28.5	Very low	139 Å²	139	144.6 Å²	144.6	74%	0.743	77%	0.771	S	S	*	*			trans	-89.1	130.4	164.5	-60.2	-23.6	0	0	0	107.3
469	N	32	Very low	28.1	Very low	166 Å²	166	143.4 Å²	143.4	89%	0.888	77%	0.772	S	S	*	*				177.2	168.9	129	-87.4	-8.4	0	0	0	109.4
470	A	27.8	Very low	27.8	Very low	80 Å²	80	147.9 Å²	147.9	66%	0.661	78%	0.779	S	S	*	*			trans	-91.2	177.5	-173.7	0	0	0	0	0	113.2
471	D	27.4	Very low	27.9	Very low	162 Å²	162	146 Å²	146	87%	0.866	77%	0.766	S	S	*	*			trans	79.9	159.3	165.1	-50.2	-39.8	0	0	0	118.1
472	E	30.1	Very low	27.9	Very low	182 Å²	182	147.3 Å²	147.3	85%	0.85	76%	0.764	S	S	*	*			trans	75.6	63.2	177.2	-149.2	151.3	-121.2	0	0	119.7
473	I	27	Very low	28	Very low	142 Å²	142	146.7 Å²	146.7	73%	0.728	77%	0.773	S	S	*	*				57.8	119.4	116.9	-62	169.8	0	0	0	119.8
474	N	25.2	Very low	28.1	Very low	141 Å²	141	143.4 Å²	143.4	75%	0.754	76%	0.761	S	S	*	*			trans	63.8	99	154.7	-62.5	-15	0	0	0	120.5
475	T	26.4	Very low	28.5	Very low	142 Å²	142	141.3 Å²	141.3	87%	0.871	75%	0.75	S	S	*	*				163.8	78.7	110.7	38.9	0	0	0	0	112.7	S477	T475-S477 PolarHBondContact O-N 2.71Å
476	E	29.1	Very low	29.2	Very low	168 Å²	168	136.3 Å²	136.3	79%	0.785	74%	0.736	S	S	*	*			trans	-81.9	117.3	174.2	-71.8	-163.3	148.3	0	0	113.3	N478	E476-N478 VanDerWaalsContact C-N 3.33Å; E476-N478 PolarHBondContact O-N 3.47Å; E476-N478 PolarHBondContact OE2-ND2 3.22Å
477	S	28.4	Very low	29.7	Very low	116 Å²	116	130.7 Å²	130.7	81%	0.811	71%	0.709	S	S	*	*			trans	-83.3	66.6	176.3	44.2	0	0	0	0	112.9	T475 C479	T475-S477 PolarHBondContact O-N 2.71Å; S477-C479 PolarHBondContact O-N 2.94Å
478	N	27.9	Very low	29.6	Very low	100 Å²	100	125.8 Å²	125.8	54%	0.535	70%	0.7	S	S	.	*			trans	-64.7	113.1	-178	-82.9	-60.3	0	0	0	113.3	E476 Y480	E476-N478 VanDerWaalsContact C-N 3.33Å; E476-N478 PolarHBondContact O-N 3.47Å; E476-N478 PolarHBondContact OE2-ND2 3.22Å; N478-Y480 HydrophobicContact CB-CE2 4.05Å; N478-Y480 WeakPolarHBondContact O-CD2 3.46Å; N478-Y480 PolarHBondContact O-N 2.7Å
479	C	25.9	Very low	29.6	Very low	106 Å²	106	124.6 Å²	124.6	72%	0.716	69%	0.688	S	S	*	*			trans	-83.7	107.3	178.9	-70.9	0	0	0	0	112	S477	S477-C479 PolarHBondContact O-N 2.94Å
480	Y	25.9	Very low	29.1	Very low	192 Å²	192	121.6 Å²	121.6	75%	0.753	68%	0.679	S	S	*	*			trans	-88.7	121.7	175.8	-68.2	-86.5	0	0	0	112.2	N478	N478-Y480 HydrophobicContact CB-CE2 4.05Å; N478-Y480 WeakPolarHBondContact O-CD2 3.46Å; N478-Y480 PolarHBondContact O-N 2.7Å
481	C	27.8	Very low	29.2	Very low	76 Å²	76	123.5 Å²	123.5	51%	0.514	68%	0.683	S	S	.	*			trans	-92.7	108.1	172.9	-67	0	0	0	0	110.8
482	L	29.3	Very low	29.2	Very low	132 Å²	132	124.3 Å²	124.3	69%	0.691	68%	0.681	S	S	*	*			trans	-76.6	133.8	169.6	-87.5	86.8	0	0	0	111.4	I484	L482-I484 PolarHBondContact O-N 3.46Å; L482-I484 VanDerWaalsContact O-N 3.07Å
483	P	30.3	Very low	29.1	Very low	131 Å²	131	123 Å²	123	85%	0.851	68%	0.68	S	S	*	*			trans	-86.4	73.1	-175.8	35.1	-36.4	0	0	0	112.6
484	I	31.3	Very low	29.1	Very low	117 Å²	117	121.2 Å²	121.2	60%	0.6	68%	0.68	S	S	*	*	S	Bend	trans	-117.8	113.8	171.3	-55.1	-179.6	0	0	0	109.7	L482	L482-I484 PolarHBondContact O-N 3.46Å; L482-I484 VanDerWaalsContact O-N 3.07Å
485	N	38.2	Very low	29.1	Very low	120 Å²	120	124.3 Å²	124.3	64%	0.642	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.1	74.1	170.9	-62.9	-15.2	0	0	0	116.7	F487	N485-F487 WeakPolarHBondContact O-CD2 3.35Å; N485-F487 PolarHBondContact O-N 3.21Å
486	S	41.9	Very low	29	Very low	68 Å²	68	123.3 Å²	123.3	48%	0.476	68%	0.677	S	S	.	*	T	Hydrogen-bonded Turn	trans	62.8	-1.9	154.3	-57	0	0	0	0	119.4	C606	S486-C606 PolarHBondContact OG-SG 2.7Å
487	F	37	Very low	28.8	Very low	54 Å²	54	127.1 Å²	127.1	24%	0.237	68%	0.684	C	S	.	*			trans	-135.3	129.5	-178.7	-65.2	-84.5	0	0	0	111.7	L434 S438 N485 F489	L434-F487 HydrophobicContact CB-CD2 4.27Å; L434-F487 HydrophobicContact CB-CE2 3.62Å; L434-F487 HydrophobicContact CB-CZ 4.22Å; L434-F487 HydrophobicContact CD1-CE2 4.25Å; L434-F487 HydrophobicContact CG-CE2 4.42Å; S438-F487 VanDerWaalsContact CB-CE1 3.41Å; S438-F487 WeakPolarHBondContact OG-CD1 3.21Å; S438-F487 WeakPolarHBondContact OG-CE1 3.38Å; N485-F487 WeakPolarHBondContact O-CD2 3.35Å; N485-F487 PolarHBondContact O-N 3.21Å; F487-F489 HydrophobicContact CB-CE2 4.28Å; F487-F489 WeakPolarHBondContact O-CD2 3.36Å; F487-F489 PolarHBondContact O-N 3.21Å
488	C	25.6	Very low	28.7	Very low	107 Å²	107	127.7 Å²	127.7	72%	0.723	68%	0.678	S	S	*	*			trans	-72.5	121.4	172	-64.1	0	0	0	0	109.9
489	F	26.3	Very low	28.7	Very low	114 Å²	114	131 Å²	131	50%	0.5	69%	0.69	S	S	.	*			trans	-98.7	126.7	168.2	-73.3	-95.1	0	0	0	109.4	F487	F487-F489 HydrophobicContact CB-CE2 4.28Å; F487-F489 WeakPolarHBondContact O-CD2 3.36Å; F487-F489 PolarHBondContact O-N 3.21Å
490	C	22.9	Very low	29	Very low	103 Å²	103	131.1 Å²	131.1	70%	0.696	69%	0.692	S	S	*	*			trans	-105.3	118.4	160.3	-62.8	0	0	0	0	107.3
491	T	28.7	Very low	29.3	Very low	121 Å²	121	130.2 Å²	130.2	74%	0.742	70%	0.695	S	S	*	*			trans	-122.2	104.2	180	51.5	0	0	0	0	110.2	N493	T491-N493 PolarHBondContact O-N 3.11Å
492	E	28	Very low	29.4	Very low	178 Å²	178	133.9 Å²	133.9	83%	0.832	71%	0.707	S	S	*	*			trans	-68.6	107.2	159.2	-69.9	-178.8	128.7	0	0	108.4
493	N	29.1	Very low	29.4	Very low	156 Å²	156	133.8 Å²	133.8	83%	0.834	71%	0.707	S	S	*	*				-174.1	146.4	124	-94.9	-47.8	0	0	0	111.3	T491	T491-N493 PolarHBondContact O-N 3.11Å
494	S	25.2	Very low	29.5	Very low	103 Å²	103	136.3 Å²	136.3	72%	0.72	71%	0.709	S	S	*	*			trans	-67.1	138.6	-179	54.2	0	0	0	0	113.2
495	F	25.8	Very low	29.4	Very low	207 Å²	207	138 Å²	138	91%	0.908	72%	0.72	S	S	*	*			trans	-145.3	139.4	133.5	-117.1	-79	0	0	0	110.2
496	N	24.1	Very low	29.1	Very low	120 Å²	120	140.4 Å²	140.4	64%	0.642	73%	0.727	S	S	*	*			trans	-104	125.2	-167	-178.1	8.4	0	0	0	111.3
497	W	26.1	Very low	28.4	Very low	248 Å²	248	147 Å²	147	94%	0.939	74%	0.741	S	S	*	*			trans	-138.7	130.9	160.6	-83.7	95.8	0	0	0	109.1
498	N	25.5	Very low	27.8	Very low	128 Å²	128	152 Å²	152	68%	0.684	77%	0.77	S	S	*	*			trans	-99.3	165.3	-164.9	-115.2	-12.7	0	0	0	113.5
499	Q	28.3	Very low	28	Very low	171 Å²	171	155.8 Å²	155.8	80%	0.799	78%	0.779	S	S	*	*			trans	81.6	148.8	156.3	-75.2	167.5	-85.7	0	0	121.2
500	S	32.1	Very low	28.1	Very low	107 Å²	107	158.9 Å²	158.9	75%	0.748	80%	0.795	S	S	*	*			trans	55.1	96	-174.4	47	0	0	0	0	114.4
501	E	30.9	Very low	28.4	Very low	173 Å²	173	160.2 Å²	160.2	81%	0.808	80%	0.802	S	S	*	*				58.4	122.6	62.2	-57	-166.3	102.1	0	0	115.1
502	I	30.8	Very low	28.3	Very low	153 Å²	153	160.2 Å²	160.2	79%	0.785	81%	0.808	S	S	*	*				-166.8	113.9	96.9	-91.4	160.7	0	0	0	111.5
503	I	30.1	Very low	28.3	Very low	131 Å²	131	157 Å²	157	67%	0.672	80%	0.8	S	S	*	*			trans	25.8	120.4	139	-27.8	178.7	0	0	0	119.7
504	M	32.2	Very low	28.3	Very low	183 Å²	183	158.2 Å²	158.2	90%	0.901	80%	0.798	S	S	*	*				179.2	131.2	106.5	-91.9	-172.3	-165.6	0	0	115.1
505	N	29	Very low	28.4	Very low	154 Å²	154	161.4 Å²	161.4	82%	0.824	80%	0.799	S	S	*	*			trans	-90.8	151.8	161.4	-79.3	-51.6	0	0	0	109.6
506	E	31.4	Very low	28.6	Very low	169 Å²	169	157.8 Å²	157.8	79%	0.79	79%	0.785	S	S	*	*				-174.8	175.1	100.6	-97.4	-120.4	91.1	0	0	113.8
507	R	26.6	Very low	28.9	Very low	206 Å²	206	158.9 Å²	158.9	78%	0.777	79%	0.786	S	S	*	*			trans	-98.9	169.2	-164.5	-69	174.8	-88.8	-154.3	-10.5	113.3
508	L	25.5	Very low	29.1	Very low	161 Å²	161	151.8 Å²	151.8	84%	0.843	77%	0.77	S	S	*	*			trans	75.7	135.3	165.1	-58.7	152.3	0	0	0	114.3
509	M	29.3	Very low	29.3	Very low	185 Å²	185	150.7 Å²	150.7	91%	0.911	77%	0.768	S	S	*	*				-142.4	151.9	53.3	-61.7	-163	179	0	0	115.5
510	Q	29.5	Very low	29.4	Very low	179 Å²	179	148.7 Å²	148.7	84%	0.836	76%	0.763	S	S	*	*			trans	-95.7	150.6	160.3	-69.9	-180	-16.6	0	0	110.6
511	P	27.2	Very low	29.5	Very low	131 Å²	131	149.2 Å²	149.2	85%	0.851	76%	0.757	S	S	*	*			trans	-94.9	106.1	167.9	34.1	-29	0	0	0	112.1
512	S	27.5	Very low	29.7	Very low	122 Å²	122	147 Å²	147	85%	0.853	75%	0.751	S	S	*	*			trans	-161.8	164.9	149.8	-160.6	0	0	0	0	112.3
513	T	28.1	Very low	30.1	Very low	111 Å²	111	146.6 Å²	146.6	68%	0.681	75%	0.751	S	S	*	*			trans	-114	153.6	-159.9	64.1	0	0	0	0	115.7
514	K	28.3	Very low	30.3	Very low	180 Å²	180	147.8 Å²	147.8	78%	0.783	76%	0.758	S	S	*	*			trans	73.5	120.2	147	-75.4	161.8	-178.8	171	0	120.1
515	K	28.3	Very low	30.8	Very low	170 Å²	170	143.3 Å²	143.3	74%	0.739	74%	0.743	S	S	*	*			trans	67.4	147.1	138.7	-60.6	-169.6	162.1	-157.7	0	116.4
516	H	30	Very low	31.4	Very low	132 Å²	132	143 Å²	143	61%	0.611	74%	0.741	S	S	*	*			cis	-166.8	163.6	-9.2	-99.3	-21.7	0	0	0	105.7
517	Q	30.3	Very low	31.6	Very low	142 Å²	142	142.2 Å²	142.2	66%	0.664	74%	0.743	S	S	*	*			cis	-159.6	167.2	8.2	-132.5	175.7	-99.3	0	0	112.4
518	T	29.7	Very low	32.3	Very low	99 Å²	99	136.7 Å²	136.7	61%	0.607	73%	0.733	S	S	*	*			trans	9.9	147.8	142.4	55.4	0	0	0	0	121.7
519	T	29.4	Very low	32.6	Very low	106 Å²	106	136 Å²	136	65%	0.65	73%	0.729	S	S	*	*			cis	-165.5	160.9	20.3	-3.5	0	0	0	0	113.3
520	N	31.5	Very low	32.9	Very low	129 Å²	129	134 Å²	134	69%	0.69	72%	0.721	S	S	*	*			trans	68.3	149.2	148.9	-67.2	-0.5	0	0	0	117.9
521	N	34.4	Very low	33	Very low	118 Å²	118	131.8 Å²	131.8	63%	0.631	72%	0.715	S	S	*	*			cis	-167.9	159.9	-5.6	-109.1	-1	0	0	0	107.6
522	N	35.3	Very low	33.4	Very low	125 Å²	125	132 Å²	132	67%	0.668	71%	0.714	S	S	*	*			cis	-163.8	-174.9	-6.6	-138	-9.9	0	0	0	110.5
523	N	38.4	Very low	33.7	Very low	146 Å²	146	132.6 Å²	132.6	78%	0.781	71%	0.713	S	S	*	*			trans	86.1	89.1	157	-59.8	-12.6	0	0	0	120.4
524	N	35.6	Very low	34.2	Very low	155 Å²	155	132.5 Å²	132.5	83%	0.829	71%	0.714	S	S	*	*			trans	-63.4	-164.1	144.4	-141.2	12.3	0	0	0	110.3
525	P	41.7	Very low	34.5	Very low	89 Å²	89	130.2 Å²	130.2	58%	0.578	72%	0.715	S	S	*	*			cis	-140.1	175.6	-1.7	32.7	-8.4	0	0	0	117.7
526	N	41.6	Very low	34.6	Very low	147 Å²	147	128.9 Å²	128.9	79%	0.786	72%	0.716	S	S	*	*				158.5	80.7	124.9	-77	-25.8	0	0	0	116.5
527	N	36	Very low	34.8	Very low	154 Å²	154	129.6 Å²	129.6	82%	0.824	73%	0.729	S	S	*	*				-16.4	-177.9	130	-116.4	-0.3	0	0	0	119.1
528	P	41.4	Very low	34.7	Very low	90 Å²	90	130.1 Å²	130.1	58%	0.584	73%	0.732	S	S	*	*			cis	-147.8	-164.4	-5	27.3	1.1	0	0	0	117.2
529	I	31.9	Very low	34.8	Very low	147 Å²	147	132.4 Å²	132.4	75%	0.754	74%	0.736	S	S	*	*			trans	80.4	142.7	154.4	-36	-170.3	0	0	0	115.9
530	L	35.8	Very low	34.9	Very low	142 Å²	142	134.2 Å²	134.2	74%	0.743	74%	0.737	S	S	*	*			cis	-145.9	149.2	28.4	-168.5	60.3	0	0	0	116.6
531	N	30.4	Very low	34.8	Very low	132 Å²	132	135.8 Å²	135.8	71%	0.706	74%	0.74	S	S	*	*			trans	-15.6	155.8	159.1	-48	-13.8	0	0	0	119.4
532	T	36.1	Very low	34.6	Very low	136 Å²	136	137.5 Å²	137.5	83%	0.834	74%	0.744	S	S	*	*				-152.7	172.5	53.6	43.2	0	0	0	0	116.7
533	T	32.5	Very low	34.4	Very low	135 Å²	135	139 Å²	139	83%	0.828	75%	0.747	S	S	*	*			trans	-136.4	-157.3	-169.7	46	0	0	0	0	111.3
534	P	40.5	Very low	33.9	Very low	108 Å²	108	140.6 Å²	140.6	70%	0.701	75%	0.75	S	S	*	*				-131.2	179.4	-78.4	40.8	-25.7	0	0	0	114.6
535	T	33.1	Very low	33.6	Very low	132 Å²	132	140.8 Å²	140.8	81%	0.81	75%	0.746	S	S	*	*			trans	-164.4	135.8	146	14.1	0	0	0	0	117
536	N	29.9	Very low	33	Very low	143 Å²	143	146.1 Å²	146.1	77%	0.765	76%	0.756	S	S	*	*			trans	-3.4	159.8	145.9	-54.5	-36.6	0	0	0	120.6
537	V	34.2	Very low	32.2	Very low	146 Å²	146	147 Å²	147	89%	0.885	76%	0.755	S	S	*	*			cis	-148.6	165.8	46.1	173.3	0	0	0	0	113.4
538	Q	28.8	Very low	32.3	Very low	153 Å²	153	145.2 Å²	145.2	72%	0.715	75%	0.752	S	S	*	*			trans	-105.7	175	-167.3	-50.7	173	-31.6	0	0	116.9
539	Q	31.3	Very low	31.6	Very low	147 Å²	147	148.3 Å²	148.3	69%	0.687	76%	0.764	S	S	*	*			trans	73.8	154.9	153.1	-74.7	178.5	71.7	0	0	118.1
540	Q	32.3	Very low	31.5	Very low	145 Å²	145	149.6 Å²	149.6	68%	0.678	76%	0.764	S	S	*	*			cis	-139.6	157.3	-8.8	-106.4	170	50.6	0	0	106.8
541	Q	30.3	Very low	31.2	Very low	162 Å²	162	148.9 Å²	148.9	76%	0.757	76%	0.757	S	S	*	*			cis	95.4	136.6	45.1	-128.8	-169.3	37	0	0	116
542	Q	29.3	Very low	31.1	Very low	154 Å²	154	150.7 Å²	150.7	72%	0.72	77%	0.767	S	S	*	*			trans	77.2	151.1	176.7	-54.3	-171.6	27.7	0	0	117.9
543	Q	30.3	Very low	30.8	Very low	156 Å²	156	149 Å²	149	73%	0.729	76%	0.757	S	S	*	*			cis	-116.6	158.9	-14.7	-76.4	105.3	34.2	0	0	109.3
544	Q	29.1	Very low	30.7	Very low	180 Å²	180	150.8 Å²	150.8	84%	0.841	76%	0.76	S	S	*	*				47.4	139.6	68.3	-62.5	-172.9	1.3	0	0	114.1
545	Q	29	Very low	30.1	Very low	159 Å²	159	153.6 Å²	153.6	74%	0.743	77%	0.769	S	S	*	*			cis	-146.1	174.2	24.9	-131.2	162.1	-56.7	0	0	108.1
546	Y	28.6	Very low	30	Very low	200 Å²	200	156.1 Å²	156.1	78%	0.784	77%	0.771	S	S	*	*			cis	-172	148.7	41.6	-153.7	-83.3	0	0	0	110.2
547	Q	25.8	Very low	30	Very low	165 Å²	165	155.3 Å²	155.3	77%	0.771	77%	0.772	S	S	*	*			trans	-153.8	139.3	171.3	-168.9	-179.6	15.7	0	0	110.7
548	P	37.4	Very low	30	Very low	118 Å²	118	155.6 Å²	155.6	77%	0.766	77%	0.767	S	S	*	*			trans	-84.7	147.6	179.9	32.6	-34	0	0	0	113.7
549	N	27.4	Very low	29.9	Very low	154 Å²	154	154.1 Å²	154.1	82%	0.824	77%	0.769	S	S	*	*			trans	-101.4	147.1	-169.8	-66.4	-66.9	0	0	0	114.5
550	F	29.1	Very low	29.9	Very low	174 Å²	174	154.7 Å²	154.7	76%	0.763	78%	0.776	S	S	*	*			trans	-172.1	134.2	147.5	-128.6	-113.1	0	0	0	106.9
551	Q	29.6	Very low	29.9	Very low	127 Å²	127	151.1 Å²	151.1	59%	0.593	78%	0.779	S	S	*	*			cis	-150	132.8	-3.9	-169.2	77.4	-39.5	0	0	107.7
552	N	27.6	Very low	29.9	Very low	170 Å²	170	151.1 Å²	151.1	91%	0.909	78%	0.782	S	S	*	*			trans	-124.9	81.4	-178.6	-143.8	-2.4	0	0	0	109.5
553	T	30	Very low	29.9	Very low	102 Å²	102	151.7 Å²	151.7	63%	0.626	78%	0.782	S	S	*	*			trans	-152.8	56.7	-165.3	-38.5	0	0	0	0	114.4
554	L	31	Very low	29.8	Very low	171 Å²	171	154 Å²	154	90%	0.895	79%	0.785	S	S	*	*			trans	-162.3	75.1	149.5	-138	72.4	0	0	0	112.8
555	N	27.8	Very low	29.9	Very low	168 Å²	168	152.5 Å²	152.5	90%	0.898	78%	0.782	S	S	*	*			trans	-142.1	71	166.6	-106.8	-31.3	0	0	0	109.7
556	H	31.3	Very low	29.7	Very low	184 Å²	184	152.1 Å²	152.1	85%	0.852	79%	0.785	S	S	*	*			trans	-150.5	159.1	173.5	-127.4	-104	0	0	0	109.4
557	T	30.2	Very low	29.6	Very low	127 Å²	127	148.4 Å²	148.4	78%	0.779	79%	0.788	S	S	*	*	S	Bend	trans	81.4	134.9	-178.9	-17.5	0	0	0	0	116
558	I	32.9	Very low	29.7	Very low	152 Å²	152	145.6 Å²	145.6	78%	0.779	79%	0.787	S	S	*	*			trans	65	57.9	169.4	-30.4	-174.3	0	0	0	117.3
559	T	28.5	Very low	29.3	Very low	122 Å²	122	151.6 Å²	151.6	75%	0.748	79%	0.794	S	S	*	*				-76.5	163.7	128.5	40.5	0	0	0	0	110.1
560	N	30.9	Very low	29.1	Very low	158 Å²	158	149 Å²	149	85%	0.845	79%	0.788	S	S	*	*			trans	81.9	105.3	-178.6	-50.2	-36.8	0	0	0	115.7
561	G	31	Very low	29	Very low	71 Å²	71	146.6 Å²	146.6	73%	0.732	79%	0.788	S	S	*	*			trans	-174.8	69.5	179.2	0	0	0	0	0	115.1
562	I	31.7	Very low	28.9	Very low	161 Å²	161	146.4 Å²	146.4	83%	0.826	80%	0.796	S	S	*	*			trans	46.7	96.3	147.5	-55.5	168.6	0	0	0	116.2
563	K	29.1	Very low	28.9	Very low	167 Å²	167	145 Å²	145	73%	0.726	79%	0.786	S	S	*	*				54.9	115.1	91.4	-79.3	-172.9	-177.6	173.8	0	116.4
564	R	27.9	Very low	28.9	Very low	205 Å²	205	146.9 Å²	146.9	77%	0.774	79%	0.793	S	S	*	*			trans	70	163.6	149.2	-56.7	-178.8	-170.9	158.8	-2.7	115.8
565	D	31.4	Very low	29.1	Very low	148 Å²	148	148.4 Å²	148.4	79%	0.791	80%	0.795	S	S	*	*			cis	-127.2	170.7	9.5	-100.8	-58.3	0	0	0	114.1
566	N	24.2	Very low	29.3	Very low	151 Å²	151	148.6 Å²	148.6	81%	0.807	79%	0.79	S	S	*	*			trans	-97.8	169.4	177.7	-109.7	-20.9	0	0	0	112.1
567	S	26.9	Very low	29.4	Very low	121 Å²	121	146.1 Å²	146.1	85%	0.846	78%	0.783	S	S	*	*			trans	66.8	112	166.6	68.7	0	0	0	0	118.1
568	S	28	Very low	29.8	Very low	106 Å²	106	147.9 Å²	147.9	74%	0.741	78%	0.782	S	S	*	*			trans	-158.8	104.5	156.8	-173.7	0	0	0	0	110.2
569	W	28	Very low	29.9	Very low	245 Å²	245	148 Å²	148	93%	0.928	79%	0.785	S	S	*	*			trans	55.8	113.4	158.9	-62.8	76.9	0	0	0	120
570	S	23.7	Very low	30.3	Very low	99 Å²	99	149.6 Å²	149.6	69%	0.692	78%	0.783	S	S	*	*			trans	-73.6	176.7	165.8	48.4	0	0	0	0	112.8
571	T	27.4	Very low	30.5	Very low	124 Å²	124	146.9 Å²	146.9	76%	0.761	77%	0.769	S	S	*	*			trans	61.4	108.8	170.3	55.9	0	0	0	0	117.4
572	T	28.5	Very low	30.6	Very low	122 Å²	122	151.5 Å²	151.5	75%	0.748	77%	0.765	S	S	*	*				178.8	109.1	100.3	-72.4	0	0	0	0	111.9
573	I	27.1	Very low	30.3	Very low	140 Å²	140	146.9 Å²	146.9	72%	0.718	75%	0.747	S	S	*	*			trans	51.5	125	138.2	-57	177.1	0	0	0	120
574	N	29.4	Very low	30.8	Very low	142 Å²	142	144.4 Å²	144.4	76%	0.759	74%	0.737	S	S	*	*			trans	60.9	87.8	156.2	-62	-10	0	0	0	120.1
575	H	35.4	Very low	31.4	Very low	203 Å²	203	140.2 Å²	140.2	94%	0.94	73%	0.727	S	S	*	*				-153.2	120.6	126.2	-109.2	-75.2	0	0	0	109.6
576	H	31.8	Very low	31.7	Very low	172 Å²	172	138 Å²	138	80%	0.796	71%	0.712	S	S	*	*			trans	-127.7	155	-173.4	-146.8	40	0	0	0	110.8
577	N	32.7	Very low	32.5	Very low	133 Å²	133	136.7 Å²	136.7	71%	0.711	70%	0.701	S	S	*	*			trans	55.1	95.7	173.7	-62.5	-13.2	0	0	0	117.7
578	H	39.5	Very low	33.2	Very low	163 Å²	163	136.2 Å²	136.2	76%	0.755	69%	0.685	S	S	*	*	S	Bend	trans	-155.4	-11	148.5	-124.3	-54.3	0	0	0	116.4
579	N	35.1	Very low	33.7	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	68%	0.68	S	S	*	*	S	Bend	trans	-97	1.9	-171.9	-73.1	-4.9	0	0	0	115.6
580	H	37.5	Very low	34.1	Very low	155 Å²	155	131.2 Å²	131.2	72%	0.718	66%	0.66	S	S	*	*	S	Bend	trans	-88.9	-27.9	-174.4	-136.5	-55.6	0	0	0	114
581	D	35.2	Very low	34.3	Very low	102 Å²	102	133.9 Å²	133.9	55%	0.545	66%	0.66	S	S	.	*	H	α-helix	trans	-72	-33.7	-177.5	-57.3	-63.8	0	0	0	113	C583 Q584 Q585	D581-C583 PolarHBondContact O-N 3.05Å; D581-Q584 PolarHBondContact O-N 3.2Å; D581-Q584 VanDerWaalsContact O-N 3.1Å; D581-Q585 PolarHBondContact O-N 3.46Å
582	Y	31.9	Very low	34.5	Very low	167 Å²	167	136 Å²	136	66%	0.655	66%	0.655	S	S	*	*	H	α-helix	trans	-62.1	-34.6	-178.6	-138.5	-93	0	0	0	112	Q586	Y582-Q586 PolarHBondContact O-N 3.47Å; Y582-Q586 VanDerWaalsContact O-N 3.14Å
583	C	26.4	Very low	34.6	Very low	65 Å²	65	133.1 Å²	133.1	44%	0.439	64%	0.64	S	S	.	*	H	α-helix	trans	-73.9	-35	176	-162.3	0	0	0	0	112.1	D581 Q587	D581-C583 PolarHBondContact O-N 3.05Å; C583-Q587 WeakPolarHBondContact O-CG 3.49Å; C583-Q587 PolarHBondContact O-N 3.33Å
584	Q	39.1	Very low	34.6	Very low	114 Å²	114	132.2 Å²	132.2	53%	0.533	63%	0.634	S	S	.	*	H	α-helix	trans	-68.8	-37.9	172	-79.8	-163.7	-6.4	0	0	112.2	D581 Q587 Q588	D581-Q584 PolarHBondContact O-N 3.2Å; D581-Q584 VanDerWaalsContact O-N 3.1Å; Q584-Q587 PolarHBondContact O-N 3.11Å; Q584-Q588 WeakPolarHBondContact O-CB 3.28Å; Q584-Q588 WeakPolarHBondContact O-CG 3.49Å; Q584-Q588 PolarHBondContact O-N 3.25Å
585	Q	39.6	Very low	35	Very low	118 Å²	118	130.1 Å²	130.1	55%	0.551	63%	0.626	S	S	*	*	H	α-helix	trans	-62.2	-41.6	173.8	-86	-171.7	-15.3	0	0	112.1	D581 Q588 Q589	D581-Q585 PolarHBondContact O-N 3.46Å; Q585-Q588 PolarHBondContact O-N 3.04Å; Q585-Q589 WeakPolarHBondContact O-CB 3.42Å; Q585-Q589 WeakPolarHBondContact O-CG 3.33Å; Q585-Q589 PolarHBondContact O-N 2.95Å
586	Q	39.3	Very low	34.7	Very low	102 Å²	102	128.3 Å²	128.3	48%	0.477	62%	0.616	S	S	.	*	H	α-helix	trans	-65	-42.1	174.2	-73.7	-173.3	-6.3	0	0	112.5	Y582 Q588 Q589 Q590	Y582-Q586 PolarHBondContact O-N 3.47Å; Y582-Q586 VanDerWaalsContact O-N 3.14Å; Q586-Q588 PolarHBondContact O-N 2.8Å; Q586-Q589 PolarHBondContact O-N 3.29Å; Q586-Q590 WeakPolarHBondContact O-CB 3.39Å; Q586-Q590 WeakPolarHBondContact O-CG 3.43Å; Q586-Q590 PolarHBondContact O-N 2.95Å
587	Q	39.3	Very low	34.9	Very low	122 Å²	122	123.3 Å²	123.3	57%	0.57	60%	0.597	S	S	*	*	H	α-helix	trans	-65	-37.2	175.2	-74.1	-177.3	-2.7	0	0	112.7	C583 Q584 K591	C583-Q587 WeakPolarHBondContact O-CG 3.49Å; C583-Q587 PolarHBondContact O-N 3.33Å; Q584-Q587 PolarHBondContact O-N 3.11Å; Q587-K591 VanDerWaalsContact O-CB 3.31Å; Q587-K591 WeakPolarHBondContact O-CB 3.37Å; Q587-K591 PolarHBondContact O-N 3.46Å
588	Q	42	Very low	35.2	Very low	111 Å²	111	119.8 Å²	119.8	52%	0.519	58%	0.583	S	S	.	*	H	α-helix	trans	-65.5	-45.5	171.9	-75.6	-173.5	-0.1	0	0	111.3	Q584 Q585 Q586 Q590 K591 Y592	Q584-Q588 WeakPolarHBondContact O-CB 3.28Å; Q584-Q588 WeakPolarHBondContact O-CG 3.49Å; Q584-Q588 PolarHBondContact O-N 3.25Å; Q585-Q588 PolarHBondContact O-N 3.04Å; Q586-Q588 PolarHBondContact O-N 2.8Å; Q588-Q590 VanDerWaalsContact C-N 3.34Å; Q588-Q590 PolarHBondContact O-N 2.94Å; Q588-K591 PolarHBondContact O-N 2.93Å; Q588-Y592 HydrophobicContact CB-CD2 4.49Å; Q588-Y592 WeakPolarHBondContact O-CB 3.34Å; Q588-Y592 VanDerWaalsContact O-CD2 3.23Å; Q588-Y592 WeakPolarHBondContact O-CD2 3.49Å; Q588-Y592 PolarHBondContact O-N 2.73Å
589	Q	39.1	Very low	35.2	Very low	136 Å²	136	119.2 Å²	119.2	64%	0.636	58%	0.578	S	S	*	*	H	α-helix	trans	-59.4	-42.7	176	-77.5	-178.7	-12.4	0	0	112.1	Q585 Q586 Y592 S593	Q585-Q589 WeakPolarHBondContact O-CB 3.42Å; Q585-Q589 WeakPolarHBondContact O-CG 3.33Å; Q585-Q589 PolarHBondContact O-N 2.95Å; Q586-Q589 PolarHBondContact O-N 3.29Å; Q589-Y592 PolarHBondContact O-N 2.96Å; Q589-S593 WeakPolarHBondContact O-CB 3.19Å; Q589-S593 PolarHBondContact O-N 3.48Å; Q589-S593 PolarHBondContact O-OG 2.91Å
590	Q	35.6	Very low	35.7	Very low	110 Å²	110	114.7 Å²	114.7	51%	0.514	56%	0.559	S	S	.	*	H	α-helix	trans	-65.3	-37.7	174.8	-74.2	178.2	-11	0	0	112.8	Q586 Q588 S593 M594	Q586-Q590 WeakPolarHBondContact O-CB 3.39Å; Q586-Q590 WeakPolarHBondContact O-CG 3.43Å; Q586-Q590 PolarHBondContact O-N 2.95Å; Q588-Q590 VanDerWaalsContact C-N 3.34Å; Q588-Q590 PolarHBondContact O-N 2.94Å; Q590-S593 WeakPolarHBondContact CA-OG 3.5Å; Q590-S593 PolarHBondContact O-N 3.21Å; Q590-S593 PolarHBondContact O-OG 3.39Å; Q590-M594 HydrophobicContact CB-CE 4.24Å; Q590-M594 WeakPolarHBondContact O-CB 3.27Å; Q590-M594 WeakPolarHBondContact O-CE 3.3Å; Q590-M594 PolarHBondContact O-N 3.05Å
591	K	29.4	Very low	36.4	Very low	156 Å²	156	111.6 Å²	111.6	68%	0.678	55%	0.547	S	S	*	.	H	α-helix	trans	-70.1	-40.8	176.7	-167.1	168.8	-174.7	173	0	111.8	Q587 Q588 V595	Q587-K591 VanDerWaalsContact O-CB 3.31Å; Q587-K591 WeakPolarHBondContact O-CB 3.37Å; Q587-K591 PolarHBondContact O-N 3.46Å; Q588-K591 PolarHBondContact O-N 2.93Å; K591-V595 WeakPolarHBondContact O-CG2 3.26Å; K591-V595 PolarHBondContact O-N 2.86Å; K591-V595 VanDerWaalsContact O-N 3.15Å
592	Y	31.3	Very low	37.5	Very low	168 Å²	168	112.7 Å²	112.7	66%	0.659	55%	0.549	S	S	*	.	H	α-helix	trans	-66.4	-40.3	172.3	-82.7	-68.2	0	0	0	111.9	Q588 Q589 V595 F596	Q588-Y592 HydrophobicContact CB-CD2 4.49Å; Q588-Y592 WeakPolarHBondContact O-CB 3.34Å; Q588-Y592 VanDerWaalsContact O-CD2 3.23Å; Q588-Y592 WeakPolarHBondContact O-CD2 3.49Å; Q588-Y592 PolarHBondContact O-N 2.73Å; Q589-Y592 PolarHBondContact O-N 2.96Å; Y592-V595 PolarHBondContact O-N 3.24Å; Y592-F596 WeakPolarHBondContact O-CB 3.42Å; Y592-F596 PolarHBondContact O-N 3.23Å
593	S	30	Very low	38.9	Very low	62 Å²	62	107.6 Å²	107.6	43%	0.434	54%	0.535	S	S	.	.	H	α-helix	trans	-65.8	-43.3	177.2	69.8	0	0	0	0	111.8	Q589 Q590 V595 F596 T597	Q589-S593 WeakPolarHBondContact O-CB 3.19Å; Q589-S593 PolarHBondContact O-N 3.48Å; Q589-S593 PolarHBondContact O-OG 2.91Å; Q590-S593 WeakPolarHBondContact CA-OG 3.5Å; Q590-S593 PolarHBondContact O-N 3.21Å; Q590-S593 PolarHBondContact O-OG 3.39Å; S593-V595 VanDerWaalsContact C-N 3.33Å; S593-V595 PolarHBondContact O-N 3.41Å; S593-F596 PolarHBondContact O-N 3.28Å; S593-F596 VanDerWaalsContact O-N 3.12Å; S593-T597 WeakPolarHBondContact O-CG2 3.5Å; S593-T597 PolarHBondContact O-N 3.34Å; S593-T597 PolarHBondContact O-OG1 3.13Å
594	M	27.6	Very low	40.6	Very low	121 Å²	121	107.8 Å²	107.8	60%	0.596	54%	0.538	S	S	*	.	H	α-helix	trans	-63.9	-33.6	176	-81.2	-175.6	-89.9	0	0	113.4	Q590 T597 S598	Q590-M594 HydrophobicContact CB-CE 4.24Å; Q590-M594 WeakPolarHBondContact O-CB 3.27Å; Q590-M594 WeakPolarHBondContact O-CE 3.3Å; Q590-M594 PolarHBondContact O-N 3.05Å; M594-T597 WeakPolarHBondContact CA-OG1 3.43Å; M594-T597 PolarHBondContact O-OG1 2.67Å; M594-T597 VanDerWaalsContact O-OG1 3.13Å; M594-S598 VanDerWaalsContact O-CB 3.23Å; M594-S598 WeakPolarHBondContact O-CB 3.44Å; M594-S598 PolarHBondContact O-N 3.26Å
595	V	37.4	Very low	42.1	Very low	97 Å²	97	105.1 Å²	105.1	59%	0.588	54%	0.535	S	S	*	.	H	α-helix	trans	-71.9	-34.7	172.5	171.8	0	0	0	0	111.3	K591 Y592 S593 K599	K591-V595 WeakPolarHBondContact O-CG2 3.26Å; K591-V595 PolarHBondContact O-N 2.86Å; K591-V595 VanDerWaalsContact O-N 3.15Å; Y592-V595 PolarHBondContact O-N 3.24Å; S593-V595 VanDerWaalsContact C-N 3.33Å; S593-V595 PolarHBondContact O-N 3.41Å; V595-K599 PolarHBondContact O-N 3.11Å
596	F	29.5	Very low	43.4	Very low	166 Å²	166	100.5 Å²	100.5	73%	0.728	52%	0.516	S	S	*	.	H	α-helix	trans	-72.7	-40.3	176.9	-131.6	-87.9	0	0	0	112.7	Y592 S593 K599 S600	Y592-F596 WeakPolarHBondContact O-CB 3.42Å; Y592-F596 PolarHBondContact O-N 3.23Å; S593-F596 PolarHBondContact O-N 3.28Å; S593-F596 VanDerWaalsContact O-N 3.12Å; F596-K599 PolarHBondContact O-N 3.03Å; F596-S600 PolarHBondContact O-N 3.19Å; F596-S600 PolarHBondContact O-OG 3.4Å
597	T	36.1	Very low	44.8	Very low	66 Å²	66	96.5 Å²	96.5	41%	0.405	50%	0.497	S	S	.	.	H	α-helix	trans	-64.2	-49.6	173.8	56.8	0	0	0	0	110.2	S593 M594 K599 S600 D601	S593-T597 WeakPolarHBondContact O-CG2 3.5Å; S593-T597 PolarHBondContact O-N 3.34Å; S593-T597 PolarHBondContact O-OG1 3.13Å; M594-T597 WeakPolarHBondContact CA-OG1 3.43Å; M594-T597 PolarHBondContact O-OG1 2.67Å; M594-T597 VanDerWaalsContact O-OG1 3.13Å; T597-K599 PolarHBondContact O-N 2.81Å; T597-S600 WeakPolarHBondContact CA-OG 3.44Å; T597-S600 PolarHBondContact O-N 3.32Å; T597-S600 PolarHBondContact O-OG 3.37Å; T597-D601 VanDerWaalsContact O-CB 3.31Å; T597-D601 WeakPolarHBondContact O-CB 3.42Å; T597-D601 PolarHBondContact O-N 3.09Å; T597-D601 VanDerWaalsContact O-OD1 3.13Å; T597-D601 VanDerWaalsContact O-OD2 3.13Å
598	S	37.3	Very low	46.7	Very low	59 Å²	59	93.3 Å²	93.3	41%	0.413	49%	0.492	S	S	.	.	H	α-helix	trans	-47.5	-42.7	174.2	177.4	0	0	0	0	112.6	M594 Q602	M594-S598 VanDerWaalsContact O-CB 3.23Å; M594-S598 WeakPolarHBondContact O-CB 3.44Å; M594-S598 PolarHBondContact O-N 3.26Å; S598-Q602 WeakPolarHBondContact O-CB 3.28Å; S598-Q602 VanDerWaalsContact O-CG 3.26Å; S598-Q602 WeakPolarHBondContact O-CG 3.3Å; S598-Q602 PolarHBondContact O-N 3.46Å; S598-Q602 VanDerWaalsContact O-N 3.12Å
599	K	39.4	Very low	48.5	Very low	152 Å²	152	95 Å²	95	66%	0.661	49%	0.493	S	S	*	.	H	α-helix	trans	-76.7	-34.1	177.5	-161.3	167.7	-173.5	171.7	0	114.4	V595 F596 T597 D601 V603	V595-K599 PolarHBondContact O-N 3.11Å; F596-K599 PolarHBondContact O-N 3.03Å; T597-K599 PolarHBondContact O-N 2.81Å; K599-D601 VanDerWaalsContact C-N 3.33Å; K599-V603 WeakPolarHBondContact O-CB 3.48Å; K599-V603 VanDerWaalsContact O-CG2 3.22Å; K599-V603 WeakPolarHBondContact O-CG2 3.3Å; K599-V603 PolarHBondContact O-N 2.76Å
600	S	47.6	Very low	50.5	Low	60 Å²	60	90.4 Å²	90.4	42%	0.42	47%	0.472	S	S	.	.	H	α-helix	trans	-67.9	-36.7	172.2	57.6	0	0	0	0	112.1	F596 T597 V603 S604	F596-S600 PolarHBondContact O-N 3.19Å; F596-S600 PolarHBondContact O-OG 3.4Å; T597-S600 WeakPolarHBondContact CA-OG 3.44Å; T597-S600 PolarHBondContact O-N 3.32Å; T597-S600 PolarHBondContact O-OG 3.37Å; S600-V603 PolarHBondContact O-N 3.37Å; S600-S604 PolarHBondContact O-N 3.14Å
601	D	51.8	Low	53	Low	89 Å²	89	87.7 Å²	87.7	48%	0.476	46%	0.459	S	S	.	.	H	α-helix	trans	-76.1	-42.7	-171.9	-56.3	-12.4	0	0	0	109.7	T597 K599 V603 S604 A605	T597-D601 VanDerWaalsContact O-CB 3.31Å; T597-D601 WeakPolarHBondContact O-CB 3.42Å; T597-D601 PolarHBondContact O-N 3.09Å; T597-D601 VanDerWaalsContact O-OD1 3.13Å; T597-D601 VanDerWaalsContact O-OD2 3.13Å; K599-D601 VanDerWaalsContact C-N 3.33Å; D601-V603 VanDerWaalsContact C-N 3.33Å; D601-V603 PolarHBondContact O-N 2.86Å; D601-S604 PolarHBondContact O-N 3.49Å; D601-S604 PolarHBondContact O-OG 3.24Å; D601-A605 WeakPolarHBondContact O-CB 3.29Å; D601-A605 PolarHBondContact O-N 2.91Å
602	Q	56.9	Low	55.9	Low	125 Å²	125	84.6 Å²	84.6	58%	0.584	45%	0.453	S	S	*	.	H	α-helix	trans	-55.7	-43.9	167.6	-75.3	177.3	1.3	0	0	112.7	S598 A605 C606	S598-Q602 WeakPolarHBondContact O-CB 3.28Å; S598-Q602 VanDerWaalsContact O-CG 3.26Å; S598-Q602 WeakPolarHBondContact O-CG 3.3Å; S598-Q602 PolarHBondContact O-N 3.46Å; S598-Q602 VanDerWaalsContact O-N 3.12Å; Q602-A605 PolarHBondContact O-N 3.06Å; Q602-C606 PolarHBondContact O-N 2.82Å
603	V	62.3	Low	58.7	Low	60 Å²	60	80 Å²	80	36%	0.364	44%	0.442	S	S	.	.	H	α-helix	trans	-67.8	-36.2	179.1	166.7	0	0	0	0	111.7	F354 K599 S600 D601 L607	F354-V603 HydrophobicContact CD2-CG1 3.42Å; F354-V603 VanDerWaalsContact CD2-CG1 3.42Å; F354-V603 HydrophobicContact CE1-CG1 4.47Å; F354-V603 HydrophobicContact CE2-CG1 3.24Å; F354-V603 HydrophobicContact CG-CG1 4.12Å; F354-V603 HydrophobicContact CZ-CG1 3.83Å; K599-V603 WeakPolarHBondContact O-CB 3.48Å; K599-V603 VanDerWaalsContact O-CG2 3.22Å; K599-V603 WeakPolarHBondContact O-CG2 3.3Å; K599-V603 PolarHBondContact O-N 2.76Å; S600-V603 PolarHBondContact O-N 3.37Å; D601-V603 VanDerWaalsContact C-N 3.33Å; D601-V603 PolarHBondContact O-N 2.86Å; V603-L607 PolarHBondContact O-N 2.74Å; V603-L607 VanDerWaalsContact O-N 3.16Å
604	S	62.8	Low	61.6	Low	70 Å²	70	77 Å²	77	49%	0.49	42%	0.422	S	S	.	.	H	α-helix	trans	-67.5	-41.7	174.5	78.2	0	0	0	0	112.4	S600 D601 L607 A608	S600-S604 PolarHBondContact O-N 3.14Å; D601-S604 PolarHBondContact O-N 3.49Å; D601-S604 PolarHBondContact O-OG 3.24Å; S604-L607 PolarHBondContact O-N 3.03Å; S604-A608 PolarHBondContact O-N 3.43Å
605	A	68.9	Low	64.8	Low	57 Å²	57	74.3 Å²	74.3	47%	0.471	41%	0.405	S	S	.	.	H	α-helix	trans	-64.8	-38.5	176.6	0	0	0	0	0	112.6	D601 Q602 A608 R609	D601-A605 WeakPolarHBondContact O-CB 3.29Å; D601-A605 PolarHBondContact O-N 2.91Å; Q602-A605 PolarHBondContact O-N 3.06Å; A605-A608 PolarHBondContact O-N 3Å; A605-R609 PolarHBondContact O-N 3.09Å; A605-R609 VanDerWaalsContact O-N 3.09Å
606	C	66.7	Low	67.5	Low	22 Å²	22	74.5 Å²	74.5	15%	0.149	40%	0.402	C	S	.	.	H	α-helix	trans	-63	-45	172	-74.8	0	0	0	0	112.2	S486 Q602 A608 R609 E610	S486-C606 PolarHBondContact OG-SG 2.7Å; Q602-C606 PolarHBondContact O-N 2.82Å; C606-A608 VanDerWaalsContact C-N 3.33Å; C606-A608 PolarHBondContact O-N 2.92Å; C606-R609 WeakPolarHBondContact O-CB 2.99Å; C606-R609 PolarHBondContact O-N 2.76Å; C606-R609 PolarHBondContact SG-NH2 3.42Å; C606-E610 WeakPolarHBondContact O-CG 3.5Å; C606-E610 PolarHBondContact O-N 3.45Å
607	L	69.9	Low	70.5	Confident	17 Å²	17	68.8 Å²	68.8	9%	0.089	38%	0.381	C	S	.	.	H	α-helix	trans	-63.3	-38.1	177.4	-172.7	64	0	0	0	112.6	F354 K357 V603 S604 R609 E610 H611	F354-L607 HydrophobicContact CD2-CD2 4.45Å; F354-L607 HydrophobicContact CE2-CB 3.71Å; F354-L607 HydrophobicContact CE2-CD1 4.18Å; F354-L607 HydrophobicContact CE2-CD2 3.85Å; F354-L607 HydrophobicContact CE2-CG 4.12Å; F354-L607 HydrophobicContact CZ-CB 3.8Å; F354-L607 HydrophobicContact CZ-CD1 4Å; F354-L607 HydrophobicContact CZ-CD2 4.48Å; F354-L607 HydrophobicContact CZ-CG 4.3Å; K357-L607 HydrophobicContact CD-CD2 3.84Å; V603-L607 PolarHBondContact O-N 2.74Å; V603-L607 VanDerWaalsContact O-N 3.16Å; S604-L607 PolarHBondContact O-N 3.03Å; L607-R609 VanDerWaalsContact C-N 3.33Å; L607-E610 PolarHBondContact O-N 2.73Å; L607-H611 WeakPolarHBondContact O-CB 3.36Å; L607-H611 PolarHBondContact O-CD2 2.84Å; L607-H611 VanDerWaalsContact O-CD2 3.25Å; L607-H611 PolarHBondContact O-N 2.67Å
608	A	78	Confident	73.3	Confident	55 Å²	55	65.6 Å²	65.6	46%	0.455	36%	0.361	S	S	.	.	H	α-helix	trans	-62.5	-41.1	174.6	0	0	0	0	0	111.6	S604 A605 C606 H611 V612	S604-A608 PolarHBondContact O-N 3.43Å; A605-A608 PolarHBondContact O-N 3Å; C606-A608 VanDerWaalsContact C-N 3.33Å; C606-A608 PolarHBondContact O-N 2.92Å; A608-H611 WeakPolarHBondContact O-CB 3.37Å; A608-H611 PolarHBondContact O-N 3.26Å; A608-V612 WeakPolarHBondContact O-CG2 3.44Å; A608-V612 PolarHBondContact O-N 3.12Å
609	R	81.2	Confident	76.1	Confident	146 Å²	146	63.9 Å²	63.9	55%	0.551	35%	0.352	S	S	*	.	H	α-helix	trans	-66.1	-42.8	174.4	171	167.4	51.9	-156.9	-7.4	112.6	A605 C606 L607 H611 V612 V613	A605-R609 PolarHBondContact O-N 3.09Å; A605-R609 VanDerWaalsContact O-N 3.09Å; C606-R609 WeakPolarHBondContact O-CB 2.99Å; C606-R609 PolarHBondContact O-N 2.76Å; C606-R609 PolarHBondContact SG-NH2 3.42Å; L607-R609 VanDerWaalsContact C-N 3.33Å; R609-H611 VanDerWaalsContact C-N 3.34Å; R609-H611 PolarHBondContact O-N 2.64Å; R609-V612 PolarHBondContact O-N 3.39Å; R609-V613 WeakPolarHBondContact O-CG2 3.49Å; R609-V613 PolarHBondContact O-N 2.81Å
610	E	81.7	Confident	78.8	Confident	41 Å²	41	61.9 Å²	61.9	19%	0.192	35%	0.349	C	S	.	.	H	α-helix	trans	-58.6	-45.8	174.2	-73.7	163.7	-162.8	0	0	111.2	M427 C606 L607 V613 A614	M427-E610 HydrophobicContact SD-CB 4.4Å; C606-E610 WeakPolarHBondContact O-CG 3.5Å; C606-E610 PolarHBondContact O-N 3.45Å; L607-E610 PolarHBondContact O-N 2.73Å; E610-V613 PolarHBondContact O-N 3.36Å; E610-A614 WeakPolarHBondContact O-CB 3.37Å; E610-A614 PolarHBondContact O-N 2.94Å
611	H	88.1	Confident	81	Confident	52 Å²	52	62.8 Å²	62.8	24%	0.241	35%	0.345	C	S	.	.	H	α-helix	trans	-57.6	-49.8	173.4	-89.6	-64	0	0	0	113.2	Y361 W424 L607 A608 R609 V613 A614 W615	Y361-H611 AromaticContact CD1-CE1 3.12Å; Y361-H611 WeakPolarHBondContact CD1-CE1 3Å; Y361-H611 AromaticContact CD2-CE1 3.12Å; Y361-H611 WeakPolarHBondContact CD2-CE1 3.4Å; Y361-H611 AromaticContact CE1-CE1 2.79Å; Y361-H611 WeakPolarHBondContact CE1-CE1 3.43Å; Y361-H611 AromaticContact CE1-NE2 3.82Å; Y361-H611 AromaticContact CE2-CE1 2.8Å; Y361-H611 WeakPolarHBondContact CE2-CE1 3.26Å; Y361-H611 AromaticContact CE2-NE2 3.22Å; Y361-H611 WeakPolarHBondContact CE2-NE2 3.5Å; Y361-H611 AromaticContact CG-CE1 3.3Å; Y361-H611 AromaticContact CZ-CE1 2.63Å; Y361-H611 AromaticContact CZ-NE2 2.87Å; Y361-H611 PolarHBondContact OH-CE1 3.31Å; Y361-H611 VanDerWaalsContact OH-CE1 3.24Å; Y361-H611 PolarHBondContact OH-NE2 3.5Å; W424-H611 AromaticContact CH2-CE1 3.96Å; W424-H611 AromaticContact CH2-CG 3.97Å; W424-H611 AromaticContact CH2-ND1 3.47Å; W424-H611 WeakPolarHBondContact CH2-ND1 3.46Å; W424-H611 AromaticContact CZ2-CE1 3.81Å; W424-H611 AromaticContact CZ2-ND1 3.4Å; W424-H611 WeakPolarHBondContact CZ2-ND1 3.39Å; L607-H611 WeakPolarHBondContact O-CB 3.36Å; L607-H611 PolarHBondContact O-CD2 2.84Å; L607-H611 VanDerWaalsContact O-CD2 3.25Å; L607-H611 PolarHBondContact O-N 2.67Å; A608-H611 WeakPolarHBondContact O-CB 3.37Å; A608-H611 PolarHBondContact O-N 3.26Å; R609-H611 VanDerWaalsContact C-N 3.34Å; R609-H611 PolarHBondContact O-N 2.64Å; H611-V613 PolarHBondContact O-N 2.99Å; H611-A614 PolarHBondContact O-N 3.26Å; H611-W615 AromaticContact ND1-CD1 3.88Å; H611-W615 AromaticContact ND1-NE1 3.23Å; H611-W615 PolarHBondContact ND1-NE1 2.98Å; H611-W615 PolarHBondContact O-N 2.71Å
612	V	89.9	Confident	83.1	Confident	92 Å²	92	58.9 Å²	58.9	56%	0.558	33%	0.325	S	S	*	.	H	α-helix	trans	-59.1	-48.1	178.8	169	0	0	0	0	110.2	A608 R609 A614 L616	A608-V612 WeakPolarHBondContact O-CG2 3.44Å; A608-V612 PolarHBondContact O-N 3.12Å; R609-V612 PolarHBondContact O-N 3.39Å; V612-A614 PolarHBondContact O-N 2.82Å; V612-L616 WeakPolarHBondContact O-CB 3.49Å; V612-L616 PolarHBondContact O-N 2.97Å
613	V	89	Confident	85	Confident	70 Å²	70	57 Å²	57	42%	0.424	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-44.8	179.5	174.5	0	0	0	0	111.4	M427 R609 E610 H611 T617	M427-V613 HydrophobicContact CE-CB 3.81Å; M427-V613 HydrophobicContact CE-CG1 3.54Å; R609-V613 WeakPolarHBondContact O-CG2 3.49Å; R609-V613 PolarHBondContact O-N 2.81Å; E610-V613 PolarHBondContact O-N 3.36Å; H611-V613 PolarHBondContact O-N 2.99Å; V613-T617 HydrophobicContact CG1-CG2 4.37Å; V613-T617 WeakPolarHBondContact O-CB 3.45Å; V613-T617 WeakPolarHBondContact O-CG2 3.36Å; V613-T617 PolarHBondContact O-N 3.38Å; V613-T617 VanDerWaalsContact O-N 3.07Å; V613-T617 PolarHBondContact O-OG1 3.37Å
614	A	91.1	Very high	86.4	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-63.3	-50.4	-177.1	0	0	0	0	0	112.8	I423 W424 M427 E610 H611 V612 T617 A618	I423-A614 HydrophobicContact CG2-CB 4.13Å; W424-A614 HydrophobicContact CD2-CB 4.1Å; W424-A614 HydrophobicContact CE3-CB 4.5Å; W424-A614 HydrophobicContact CH2-CB 4.05Å; W424-A614 HydrophobicContact CZ2-CB 3.6Å; W424-A614 HydrophobicContact CZ3-CB 4.48Å; M427-A614 HydrophobicContact CE-CB 3.92Å; M427-A614 HydrophobicContact SD-CB 3.96Å; E610-A614 WeakPolarHBondContact O-CB 3.37Å; E610-A614 PolarHBondContact O-N 2.94Å; H611-A614 PolarHBondContact O-N 3.26Å; V612-A614 PolarHBondContact O-N 2.82Å; A614-T617 PolarHBondContact O-OG1 3.16Å; A614-A618 PolarHBondContact O-N 3.5Å
615	W	95.1	Very high	87.9	Confident	65 Å²	65	52.1 Å²	52.1	25%	0.246	30%	0.295	C	S	.	.	H	α-helix	trans	-77.1	-35.9	-177.1	-59.2	121.1	0	0	0	112.7	L364 F416 F417 A420 W424 H611 G619	L364-W615 HydrophobicContact CD2-CH2 4.21Å; F416-W615 AromaticContact CE1-CE3 3.83Å; F416-W615 HydrophobicContact CE1-CE3 3.83Å; F416-W615 HydrophobicContact CE1-CZ3 4.01Å; F416-W615 AromaticContact CZ-CE3 3.79Å; F416-W615 HydrophobicContact CZ-CE3 3.79Å; F416-W615 HydrophobicContact CZ-CZ3 4.42Å; F417-W615 HydrophobicContact CD1-CZ3 4.36Å; F417-W615 HydrophobicContact CE1-CZ3 4.31Å; A420-W615 HydrophobicContact CB-CE3 3.98Å; A420-W615 HydrophobicContact CB-CZ3 3.62Å; W424-W615 AromaticContact CE2-CZ2 3.98Å; W424-W615 AromaticContact CZ2-CE2 3.95Å; W424-W615 HydrophobicContact CZ2-CZ2 4.08Å; W424-W615 AromaticContact CZ2-NE1 3.78Å; W424-W615 AromaticContact NE1-CE2 3.7Å; W424-W615 AromaticContact NE1-CH2 3.44Å; W424-W615 AromaticContact NE1-CZ2 3.31Å; W424-W615 VanDerWaalsContact NE1-CZ2 3.31Å; W424-W615 AromaticContact NE1-CZ3 3.93Å; H611-W615 AromaticContact ND1-CD1 3.88Å; H611-W615 AromaticContact ND1-NE1 3.23Å; H611-W615 PolarHBondContact ND1-NE1 2.98Å; H611-W615 PolarHBondContact O-N 2.71Å; W615-G619 PolarHBondContact O-N 3.36Å
616	L	94.5	Very high	89.1	Confident	101 Å²	101	51.6 Å²	51.6	53%	0.529	28%	0.283	S	S	.	.	H	α-helix	trans	-69.5	-39.2	179.1	-173	146	0	0	0	111.8	V612 G619 L620	V612-L616 WeakPolarHBondContact O-CB 3.49Å; V612-L616 PolarHBondContact O-N 2.97Å; L616-G619 PolarHBondContact O-N 3.18Å; L616-L620 HydrophobicContact CD2-CD1 3.58Å; L616-L620 HydrophobicContact CD2-CG 4.05Å; L616-L620 WeakPolarHBondContact O-CG 3.44Å; L616-L620 PolarHBondContact O-N 3.28Å
617	T	92.6	Very high	90.3	Very high	45 Å²	45	55.9 Å²	55.9	28%	0.276	31%	0.309	S	S	.	.	H	α-helix	trans	-67.6	-43.1	176.4	51.5	0	0	0	0	112.1	I423 V613 A614 G619 L620 F621	I423-T617 WeakPolarHBondContact CD1-OG1 3.49Å; V613-T617 HydrophobicContact CG1-CG2 4.37Å; V613-T617 WeakPolarHBondContact O-CB 3.45Å; V613-T617 WeakPolarHBondContact O-CG2 3.36Å; V613-T617 PolarHBondContact O-N 3.38Å; V613-T617 VanDerWaalsContact O-N 3.07Å; V613-T617 PolarHBondContact O-OG1 3.37Å; A614-T617 PolarHBondContact O-OG1 3.16Å; T617-G619 VanDerWaalsContact C-N 3.28Å; T617-G619 PolarHBondContact O-N 3.13Å; T617-L620 PolarHBondContact O-N 3.03Å; T617-F621 WeakPolarHBondContact O-CD2 3.21Å; T617-F621 PolarHBondContact O-N 3.43Å
618	A	95.3	Very high	91.3	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-59.4	-38.7	171.6	0	0	0	0	0	112.5	F416 I419 A420 I423 A614 T622	F416-A618 HydrophobicContact CD2-CB 3.99Å; F416-A618 HydrophobicContact CE2-CB 3.8Å; F416-A618 HydrophobicContact CZ-CB 4.32Å; I419-A618 HydrophobicContact CG2-CB 4.3Å; A420-A618 HydrophobicContact CB-CB 3.83Å; I423-A618 HydrophobicContact CD1-CB 4.02Å; A614-A618 PolarHBondContact O-N 3.5Å; A618-T622 PolarHBondContact O-N 3.49Å; A618-T622 VanDerWaalsContact O-N 3.09Å; A618-T622 PolarHBondContact O-OG1 2.92Å
619	G	95.9	Very high	91.9	Very high	22 Å²	22	61 Å²	61	23%	0.227	32%	0.32	C	S	.	.	H	α-helix	trans	-62.1	-49.7	173.8	0	0	0	0	0	112.6	W615 L616 T617 F621 T622 V623	W615-G619 PolarHBondContact O-N 3.36Å; L616-G619 PolarHBondContact O-N 3.18Å; T617-G619 VanDerWaalsContact C-N 3.28Å; T617-G619 PolarHBondContact O-N 3.13Å; G619-F621 PolarHBondContact O-N 3.37Å; G619-T622 WeakPolarHBondContact O-CB 3.36Å; G619-T622 PolarHBondContact O-N 2.83Å; G619-T622 VanDerWaalsContact O-N 3.13Å; G619-V623 WeakPolarHBondContact O-CG2 3.48Å; G619-V623 PolarHBondContact O-N 3.39Å
620	L	95.6	Very high	92.2	Very high	111 Å²	111	56 Å²	56	58%	0.581	30%	0.302	S	S	*	.	H	α-helix	trans	-60.4	-42.3	178.3	-73	177.9	0	0	0	112.7	L616 T617 T622 V623 G624	L616-L620 HydrophobicContact CD2-CD1 3.58Å; L616-L620 HydrophobicContact CD2-CG 4.05Å; L616-L620 WeakPolarHBondContact O-CG 3.44Å; L616-L620 PolarHBondContact O-N 3.28Å; T617-L620 PolarHBondContact O-N 3.03Å; L620-T622 VanDerWaalsContact C-N 3.33Å; L620-T622 PolarHBondContact O-N 2.99Å; L620-V623 PolarHBondContact O-N 3.26Å; L620-G624 PolarHBondContact O-N 3.49Å
621	F	94.3	Very high	92.8	Very high	78 Å²	78	54.4 Å²	54.4	34%	0.342	30%	0.295	S	S	.	.	H	α-helix	trans	-60.9	-42.6	173.5	-80	-64.2	0	0	0	111.8	Y415 I419 T617 G619 G624 V625 P657	Y415-F621 HydrophobicContact CE1-CB 4.2Å; I419-F621 HydrophobicContact CG2-CB 4.36Å; I419-F621 HydrophobicContact CG2-CD2 3.96Å; I419-F621 HydrophobicContact CG2-CG 4.43Å; T617-F621 WeakPolarHBondContact O-CD2 3.21Å; T617-F621 PolarHBondContact O-N 3.43Å; G619-F621 PolarHBondContact O-N 3.37Å; F621-G624 PolarHBondContact O-N 3.21Å; F621-V625 PolarHBondContact O-N 3.18Å; F621-V625 VanDerWaalsContact O-N 3.1Å; F621-P657 HydrophobicContact CD1-CB 4.46Å; F621-P657 HydrophobicContact CD1-CG 4.08Å; F621-P657 HydrophobicContact CE1-CB 4.03Å; F621-P657 HydrophobicContact CE1-CG 3.72Å; F621-P657 HydrophobicContact CZ-CB 4.16Å; F621-P657 HydrophobicContact CZ-CG 4.33Å
622	T	95.7	Very high	93	Very high	8 Å²	8	52.2 Å²	52.2	5%	0.049	29%	0.285	C	S	.	.	H	α-helix	trans	-65.2	-43.3	179.2	-53	0	0	0	0	111.5	I412 Y415 A618 G619 L620 V625 L626	I412-T622 HydrophobicContact CG1-CG2 4.29Å; Y415-T622 HydrophobicContact CD1-CG2 4.31Å; A618-T622 PolarHBondContact O-N 3.49Å; A618-T622 VanDerWaalsContact O-N 3.09Å; A618-T622 PolarHBondContact O-OG1 2.92Å; G619-T622 WeakPolarHBondContact O-CB 3.36Å; G619-T622 PolarHBondContact O-N 2.83Å; G619-T622 VanDerWaalsContact O-N 3.13Å; L620-T622 VanDerWaalsContact C-N 3.33Å; L620-T622 PolarHBondContact O-N 2.99Å; T622-V625 PolarHBondContact O-N 3.23Å; T622-L626 HydrophobicContact CG2-CD1 4.36Å; T622-L626 WeakPolarHBondContact O-CG 3.14Å; T622-L626 PolarHBondContact O-N 3.11Å
623	V	95.3	Very high	93.1	Very high	84 Å²	84	47.8 Å²	47.8	51%	0.509	26%	0.259	S	S	.	.	H	α-helix	trans	-63.2	-43.2	174.8	172.4	0	0	0	0	111.2	G619 L620 V625 L626 V627	G619-V623 WeakPolarHBondContact O-CG2 3.48Å; G619-V623 PolarHBondContact O-N 3.39Å; L620-V623 PolarHBondContact O-N 3.26Å; V623-V625 VanDerWaalsContact C-N 3.29Å; V623-V625 PolarHBondContact O-N 3.41Å; V623-L626 PolarHBondContact O-N 3.42Å; V623-L626 VanDerWaalsContact O-N 3.15Å; V623-V627 HydrophobicContact CG1-CG2 4.24Å; V623-V627 WeakPolarHBondContact O-CG2 3.3Å; V623-V627 PolarHBondContact O-N 2.98Å
624	G	93.1	Very high	93.2	Very high	29 Å²	29	45 Å²	45	30%	0.299	24%	0.241	S	C	.	.	H	α-helix	trans	-58	-39.2	176.7	0	0	0	0	0	113.2	L620 F621 S628	L620-G624 PolarHBondContact O-N 3.49Å; F621-G624 PolarHBondContact O-N 3.21Å; G624-S628 PolarHBondContact O-N 2.78Å
625	V	93.9	Very high	93.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.8	-45.2	173.5	173	0	0	0	0	111.9	F411 Y415 F621 T622 V623 V627 S628 V631 V642 F653	F411-V625 HydrophobicContact CE1-CG1 3.98Å; F411-V625 HydrophobicContact CE2-CG1 4.13Å; F411-V625 HydrophobicContact CZ-CB 4.05Å; F411-V625 HydrophobicContact CZ-CG1 3.37Å; Y415-V625 HydrophobicContact CE1-CG2 3.9Å; Y415-V625 HydrophobicContact CE2-CG2 4.31Å; F621-V625 PolarHBondContact O-N 3.18Å; F621-V625 VanDerWaalsContact O-N 3.1Å; T622-V625 PolarHBondContact O-N 3.23Å; V623-V625 VanDerWaalsContact C-N 3.29Å; V623-V625 PolarHBondContact O-N 3.41Å; V625-V627 VanDerWaalsContact C-N 3.32Å; V625-V627 PolarHBondContact O-N 3.21Å; V625-S628 WeakPolarHBondContact O-CB 3.47Å; V625-S628 PolarHBondContact O-N 3.43Å; V625-S628 PolarHBondContact O-OG 3.1Å; V625-V631 HydrophobicContact CG1-CG2 3.91Å; V625-V642 HydrophobicContact CG1-CB 3.63Å; V625-V642 HydrophobicContact CG1-CG1 4.2Å; V625-V642 HydrophobicContact CG1-CG2 3.69Å; V625-V642 HydrophobicContact CG2-CG1 4.32Å; V625-V642 HydrophobicContact CG2-CG2 4.28Å; V625-F653 HydrophobicContact CG2-CB 3.77Å; V625-F653 HydrophobicContact CG2-CD1 3.43Å; V625-F653 VanDerWaalsContact CG2-CD1 3.43Å; V625-F653 HydrophobicContact CG2-CE1 4.14Å; V625-F653 HydrophobicContact CG2-CG 3.72Å
626	L	93.7	Very high	92.9	Very high	45 Å²	45	42.5 Å²	42.5	24%	0.236	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-40.3	179.3	-68.8	169.3	0	0	0	111.7	V408 F411 I412 T622 V623 S628 R629	V408-L626 HydrophobicContact CG1-CD2 4.05Å; F411-L626 HydrophobicContact CD1-CD2 4.19Å; F411-L626 HydrophobicContact CE1-CD2 3.92Å; F411-L626 HydrophobicContact CE1-CG 4.32Å; I412-L626 HydrophobicContact CD1-CD1 4Å; I412-L626 HydrophobicContact CG1-CD1 4.32Å; I412-L626 HydrophobicContact CG1-CD2 4.48Å; T622-L626 HydrophobicContact CG2-CD1 4.36Å; T622-L626 WeakPolarHBondContact O-CG 3.14Å; T622-L626 PolarHBondContact O-N 3.11Å; V623-L626 PolarHBondContact O-N 3.42Å; V623-L626 VanDerWaalsContact O-N 3.15Å; L626-S628 VanDerWaalsContact C-N 3.26Å; L626-S628 PolarHBondContact O-N 3.25Å; L626-R629 PolarHBondContact O-N 3.12Å
627	V	93.1	Very high	92.9	Very high	113 Å²	113	37.9 Å²	37.9	69%	0.685	21%	0.208	S	C	*	.	H	α-helix	trans	-62.8	-31.3	173.7	171.7	0	0	0	0	112	V623 V625 R629	V623-V627 HydrophobicContact CG1-CG2 4.24Å; V623-V627 WeakPolarHBondContact O-CG2 3.3Å; V623-V627 PolarHBondContact O-N 2.98Å; V625-V627 VanDerWaalsContact C-N 3.32Å; V625-V627 PolarHBondContact O-N 3.21Å; V627-R629 PolarHBondContact O-N 2.81Å
628	S	90	Very high	92.8	Very high	28 Å²	28	36.2 Å²	36.2	20%	0.196	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-11.5	178.2	82.9	0	0	0	0	114.9	G624 V625 L626 Q630	G624-S628 PolarHBondContact O-N 2.78Å; V625-S628 WeakPolarHBondContact O-CB 3.47Å; V625-S628 PolarHBondContact O-N 3.43Å; V625-S628 PolarHBondContact O-OG 3.1Å; L626-S628 VanDerWaalsContact C-N 3.26Å; L626-S628 PolarHBondContact O-N 3.25Å; S628-Q630 WeakPolarHBondContact O-CG 3.01Å; S628-Q630 PolarHBondContact O-N 3.21Å; S628-Q630 VanDerWaalsContact O-N 3.11Å; S628-Q630 PolarHBondContact O-NE2 3.18Å
629	R	89.8	Confident	92.7	Very high	152 Å²	152	36.4 Å²	36.4	57%	0.574	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	47	33.1	-177.3	-62.9	-168.8	179.7	-162.5	1.3	115.4	L626 V627	L626-R629 PolarHBondContact O-N 3.12Å; V627-R629 PolarHBondContact O-N 2.81Å
630	Q	88.6	Confident	92.7	Very high	40 Å²	40	35.6 Å²	35.6	19%	0.187	19%	0.19	C	C	.	.			trans	-124.1	51.9	-178.7	-76.2	163.5	99.8	0	0	111.2	S628 V642 G643 N646 V649	S628-Q630 WeakPolarHBondContact O-CG 3.01Å; S628-Q630 PolarHBondContact O-N 3.21Å; S628-Q630 VanDerWaalsContact O-N 3.11Å; S628-Q630 PolarHBondContact O-NE2 3.18Å; Q630-V642 WeakPolarHBondContact O-CA 3.33Å; Q630-G643 PolarHBondContact O-N 3.47Å; Q630-N646 PolarHBondContact OE1-ND2 3.45Å; Q630-V649 HydrophobicContact CB-CG1 3.99Å
631	V	93.3	Very high	92.6	Very high	7 Å²	7	30.7 Å²	30.7	4%	0.042	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	104.6	169.5	177.3	0	0	0	0	107.6	G401 F411 V625 C640	G401-V631 WeakPolarHBondContact CA-O 3.36Å; G401-V631 PolarHBondContact N-O 2.8Å; F411-V631 HydrophobicContact CB-CG1 3.88Å; F411-V631 HydrophobicContact CD1-CG1 3.92Å; F411-V631 HydrophobicContact CD1-CG2 3.83Å; F411-V631 HydrophobicContact CD2-CG1 4.05Å; F411-V631 HydrophobicContact CD2-CG2 4.48Å; F411-V631 HydrophobicContact CE1-CG2 3.77Å; F411-V631 HydrophobicContact CE2-CG2 4.41Å; F411-V631 HydrophobicContact CG-CG1 3.62Å; F411-V631 HydrophobicContact CG-CG2 4.22Å; F411-V631 HydrophobicContact CZ-CG2 4.1Å; V625-V631 HydrophobicContact CG1-CG2 3.91Å; V631-C640 HydrophobicContact CG1-CB 4Å
632	D	92.2	Very high	92.5	Very high	6 Å²	6	27 Å²	27	3%	0.032	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	150.3	-177.6	-65.4	-63.4	0	0	0	111.2	C640 G641 R644 Q645	D632-C640 CarbonylContact O-C 3.45Å; D632-C640 VanDerWaalsContact O-CA 3.25Å; D632-C640 WeakPolarHBondContact O-CA 3.34Å; D632-G641 PolarHBondContact N-O 3.47Å; D632-G641 PolarHBondContact O-N 3.01Å; D632-G641 VanDerWaalsContact O-O 3.08Å; D632-R644 HydrophobicContact CB-CB 3.68Å; D632-R644 HydrophobicContact CB-CG 4.06Å; D632-R644 WeakPolarHBondContact OD2-CA 3.47Å; D632-R644 PolarHBondContact OD2-N 2.98Å; D632-Q645 HydrophobicContact CB-CG 4.4Å; D632-Q645 WeakPolarHBondContact OD1-CG 3.41Å; D632-Q645 PolarHBondContact OD1-NE2 3.04Å; D632-Q645 PolarHBondContact OD2-N 2.82Å
633	A	92.6	Very high	91.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	142.9	163.9	0	0	0	0	0	112	T385 R397 L398	T385-A633 HydrophobicContact CG2-CB 4.12Å; T385-A633 WeakPolarHBondContact O-CB 3.06Å; R397-A633 WeakPolarHBondContact CD-O 3.32Å; R397-A633 HydrophobicContact CG-CB 3.65Å; R397-A633 PolarHBondContact NH1-O 2.81Å; L398-A633 HydrophobicContact CB-CB 4.09Å; L398-A633 PolarHBondContact O-N 3.24Å
634	D	91.8	Very high	91.6	Very high	11 Å²	11	24.2 Å²	24.2	6%	0.059	13%	0.13	C	C	.	.	P	Polyproline II helix	trans	-76.9	151.9	177.1	-167.3	-24.2	0	0	0	111.7	L636 I637 V639 R644	D634-L636 PolarHBondContact OD1-N 3.28Å; D634-I637 HydrophobicContact CB-CG1 4.31Å; D634-I637 WeakPolarHBondContact CB-O 3.46Å; D634-I637 VanDerWaalsContact OD2-CG1 3.31Å; D634-I637 WeakPolarHBondContact OD2-CG1 3.3Å; D634-V639 HydrophobicContact CB-CG2 4.06Å; D634-V639 WeakPolarHBondContact CB-O 3.41Å; D634-V639 PolarHBondContact N-O 3.28Å; D634-R644 IonicContact OD1-NH1 2.73Å; D634-R644 IonicContact OD2-CZ 3.99Å; D634-R644 IonicContact OD2-NH1 2.7Å; D634-R644 PolarHBondContact OD2-NH1 3Å; D634-R644 IonicContact OD2-NH2 3.18Å; D634-R644 PolarHBondContact OD2-NH2 2.63Å
635	E	89.3	Confident	91.1	Very high	9 Å²	9	25.2 Å²	25.2	4%	0.042	13%	0.127	C	C	.	.	S	Bend	trans	-88.6	-33.4	173.8	179.3	174.4	169.4	0	0	112	I313 L314 Y315 K320 R381	I313-E635 PolarHBondContact N-OE1 3.29Å; L314-E635 PolarHBondContact N-OE1 3.23Å; L314-E635 VanDerWaalsContact N-OE1 3.11Å; L314-E635 PolarHBondContact N-OE2 3Å; Y315-E635 HydrophobicContact CD2-CB 4.43Å; Y315-E635 HydrophobicContact CD2-CG 4.16Å; Y315-E635 PolarHBondContact N-OE1 2.83Å; K320-E635 VanDerWaalsContact CE-CG 3.5Å; K320-E635 WeakPolarHBondContact CE-O 3.48Å; K320-E635 WeakPolarHBondContact CE-OE1 3.05Å; K320-E635 IonicContact NZ-OE1 3.94Å; K320-E635 PolarHBondContact NZ-OE1 3.11Å; R381-E635 PolarHBondContact NH1-O 3.26Å; R381-E635 VanDerWaalsContact NH1-O 3.13Å; R381-E635 PolarHBondContact NH2-O 2.74Å
636	L	91.1	Very high	90.7	Very high	3 Å²	3	27.8 Å²	27.8	2%	0.016	14%	0.14	C	C	.	.	S	Bend	trans	-78.4	-49.3	-174.6	-168.9	64	0	0	0	111.3	Y315 S323 R381 D634 P898 F901	Y315-L636 HydrophobicContact CD1-CD1 4.05Å; Y315-L636 HydrophobicContact CD2-CB 4.01Å; Y315-L636 HydrophobicContact CD2-CD1 3.83Å; Y315-L636 HydrophobicContact CD2-CG 4.48Å; Y315-L636 HydrophobicContact CE1-CD1 4.37Å; Y315-L636 HydrophobicContact CE2-CB 3.9Å; Y315-L636 HydrophobicContact CE2-CD1 4.17Å; Y315-L636 HydrophobicContact CE2-CG 4.46Å; Y315-L636 HydrophobicContact CG-CD1 3.76Å; S323-L636 WeakPolarHBondContact OG-CD1 3.47Å; R381-L636 PolarHBondContact NH1-O 2.94Å; R381-L636 VanDerWaalsContact NH1-O 3.09Å; D634-L636 PolarHBondContact OD1-N 3.28Å; L636-P898 HydrophobicContact CD1-CB 4.36Å; L636-P898 HydrophobicContact CD2-CB 4.5Å; L636-F901 HydrophobicContact CD2-CB 3.81Å
637	I	92.6	Very high	90.5	Very high	5 Å²	5	26.2 Å²	26.2	3%	0.026	13%	0.133	C	C	.	.	S	Bend	trans	-125	156.3	-172.5	47.2	157.6	0	0	0	112.7	T327 F373 D634 V639 I905	T327-I637 HydrophobicContact CG2-CG2 4.39Å; F373-I637 HydrophobicContact CE1-CD1 3.85Å; D634-I637 HydrophobicContact CB-CG1 4.31Å; D634-I637 WeakPolarHBondContact CB-O 3.46Å; D634-I637 VanDerWaalsContact OD2-CG1 3.31Å; D634-I637 WeakPolarHBondContact OD2-CG1 3.3Å; I637-V639 VanDerWaalsContact C-N 3.26Å; I637-V639 HydrophobicContact CD1-CG1 4.16Å; I637-V639 HydrophobicContact CD1-CG2 3.54Å; I637-V639 HydrophobicContact CG1-CG2 3.94Å; I637-V639 PolarHBondContact O-N 3.18Å; I637-I905 HydrophobicContact CD1-CD1 3.72Å
638	P	92.3	Very high	90.4	Very high	10 Å²	10	26.6 Å²	26.6	7%	0.065	13%	0.131	C	C	.	.	S	Bend	trans	-78.2	61.7	-176.5	32.3	-39.4	0	0	0	113.5	S376 R381	S376-P638 WeakPolarHBondContact CB-O 3.29Å; S376-P638 PolarHBondContact OG-O 3.48Å; R381-P638 HydrophobicContact CB-CB 3.83Å; R381-P638 HydrophobicContact CG-CB 3.96Å
639	V	93.5	Very high	90.4	Very high	4 Å²	4	26 Å²	26	2%	0.024	13%	0.126	C	C	.	.			trans	-135.8	165.2	177.5	-53.9	0	0	0	0	111.2	F373 I410 D634 I637	F373-V639 HydrophobicContact CD1-CG1 3.96Å; F373-V639 HydrophobicContact CE1-CG1 3.96Å; I410-V639 HydrophobicContact CG2-CB 4.21Å; I410-V639 HydrophobicContact CG2-CG1 4.22Å; D634-V639 HydrophobicContact CB-CG2 4.06Å; D634-V639 WeakPolarHBondContact CB-O 3.41Å; D634-V639 PolarHBondContact N-O 3.28Å; I637-V639 VanDerWaalsContact C-N 3.26Å; I637-V639 HydrophobicContact CD1-CG1 4.16Å; I637-V639 HydrophobicContact CD1-CG2 3.54Å; I637-V639 HydrophobicContact CG1-CG2 3.94Å; I637-V639 PolarHBondContact O-N 3.18Å
640	C	94.4	Very high	90.5	Very high	4 Å²	4	18.7 Å²	18.7	3%	0.027	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	146.5	170.2	-67.2	0	0	0	0	111.2	C407 F411 V631 D632	C407-C640 VanDerWaalsContact CA-SG 3.5Å; C407-C640 HydrophobicContact CB-CB 4.16Å; C407-C640 WeakPolarHBondContact CB-SG 3.38Å; C407-C640 WeakPolarHBondContact O-CB 3.43Å; C407-C640 WeakPolarHBondContact SG-CB 3.26Å; C407-C640 CovalentContact SG-SG 2.03Å; C407-C640 PolarHBondContact SG-SG 3.39Å; F411-C640 HydrophobicContact CB-CB 4.06Å; V631-C640 HydrophobicContact CG1-CB 4Å; D632-C640 CarbonylContact O-C 3.45Å; D632-C640 VanDerWaalsContact O-CA 3.25Å; D632-C640 WeakPolarHBondContact O-CA 3.34Å
641	G	93	Very high	90.7	Very high	9 Å²	9	17.5 Å²	17.5	9%	0.093	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	157.5	-173.6	0	0	0	0	0	112.5	D632	D632-G641 PolarHBondContact N-O 3.47Å; D632-G641 PolarHBondContact O-N 3.01Å; D632-G641 VanDerWaalsContact O-O 3.08Å
642	V	92.5	Very high	90.6	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	137.5	-177.2	54.4	0	0	0	0	112.5	F411 Y415 V625 Q630 R644 V649 F653 I654	F411-V642 HydrophobicContact CE2-CB 4.43Å; F411-V642 HydrophobicContact CE2-CG1 4.43Å; Y415-V642 HydrophobicContact CD2-CG1 4.27Å; Y415-V642 HydrophobicContact CE2-CG1 4Å; V625-V642 HydrophobicContact CG1-CB 3.63Å; V625-V642 HydrophobicContact CG1-CG1 4.2Å; V625-V642 HydrophobicContact CG1-CG2 3.69Å; V625-V642 HydrophobicContact CG2-CG1 4.32Å; V625-V642 HydrophobicContact CG2-CG2 4.28Å; Q630-V642 WeakPolarHBondContact O-CA 3.33Å; V642-R644 PolarHBondContact O-N 3.34Å; V642-V649 HydrophobicContact CG2-CG1 3.5Å; V642-V649 VanDerWaalsContact CG2-CG1 3.5Å; V642-F653 HydrophobicContact CG1-CB 4.21Å; V642-F653 HydrophobicContact CG2-CB 4Å; V642-F653 HydrophobicContact CG2-CD2 4.28Å; V642-F653 HydrophobicContact CG2-CG 4.37Å; V642-I654 HydrophobicContact CG1-CD1 3.79Å; V642-I654 HydrophobicContact CG1-CG1 3.64Å
643	G	84.7	Confident	90.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	33.1	170.8	0	0	0	0	0	115.5	Q630 N646 R829	Q630-G643 PolarHBondContact O-N 3.47Å; G643-N646 WeakPolarHBondContact CA-O 3.5Å; G643-R829 PolarHBondContact O-NE 2.67Å; G643-R829 PolarHBondContact O-NH2 3.02Å
644	R	87.9	Confident	90.8	Very high	34 Å²	34	23.3 Å²	23.3	13%	0.128	13%	0.133	C	C	.	.	S	Bend	trans	-77.6	-24.7	173.8	-53.1	-52.8	-158.6	88	20.9	112.5	D632 D634 V642 E825 R829	D632-R644 HydrophobicContact CB-CB 3.68Å; D632-R644 HydrophobicContact CB-CG 4.06Å; D632-R644 WeakPolarHBondContact OD2-CA 3.47Å; D632-R644 PolarHBondContact OD2-N 2.98Å; D634-R644 IonicContact OD1-NH1 2.73Å; D634-R644 IonicContact OD2-CZ 3.99Å; D634-R644 IonicContact OD2-NH1 2.7Å; D634-R644 PolarHBondContact OD2-NH1 3Å; D634-R644 IonicContact OD2-NH2 3.18Å; D634-R644 PolarHBondContact OD2-NH2 2.63Å; V642-R644 PolarHBondContact O-N 3.34Å; R644-E825 IonicContact NH1-OE1 2.83Å; R644-R829 PolarHBondContact O-NE 2.83Å; R644-R829 PolarHBondContact O-NH1 2.84Å
645	Q	82.3	Confident	90.9	Very high	50 Å²	50	23.8 Å²	23.8	23%	0.234	14%	0.136	C	C	.	.	S	Bend	trans	-105	-15.7	175	-62.8	-177.8	79.4	0	0	112.9	D632	D632-Q645 HydrophobicContact CB-CG 4.4Å; D632-Q645 WeakPolarHBondContact OD1-CG 3.41Å; D632-Q645 PolarHBondContact OD1-NE2 3.04Å; D632-Q645 PolarHBondContact OD2-N 2.82Å
646	N	86.5	Confident	91.1	Very high	53 Å²	53	24.7 Å²	24.7	28%	0.283	15%	0.148	S	C	.	.			trans	-124.3	107.7	178.5	-175.1	-10.3	0	0	0	112.2	Q630 G643 N648 V649 L650	Q630-N646 PolarHBondContact OE1-ND2 3.45Å; G643-N646 WeakPolarHBondContact CA-O 3.5Å; N646-N648 VanDerWaalsContact C-N 3.33Å; N646-N648 PolarHBondContact O-N 2.94Å; N646-N648 WeakPolarHBondContact OD1-CB 3.24Å; N646-N648 PolarHBondContact OD1-N 3.36Å; N646-N648 VanDerWaalsContact OD1-N 3.13Å; N646-V649 HydrophobicContact CB-CB 4.16Å; N646-V649 HydrophobicContact CB-CG2 4.35Å; N646-V649 WeakPolarHBondContact ND2-CG2 3.38Å; N646-V649 PolarHBondContact O-N 2.6Å; N646-L650 PolarHBondContact O-N 3.27Å; N646-L650 VanDerWaalsContact O-N 3.16Å
647	T	89.4	Confident	91.3	Very high	13 Å²	13	25.1 Å²	25.1	8%	0.08	15%	0.151	C	C	.	.	H	α-helix	trans	-59.2	-37.5	-178.6	-49.4	0	0	0	0	113.2	V649 L650 G651 Y826 R829 D830	T647-V649 VanDerWaalsContact C-N 3.27Å; T647-V649 PolarHBondContact O-N 3.13Å; T647-L650 WeakPolarHBondContact O-CB 3.42Å; T647-L650 PolarHBondContact O-N 3.18Å; T647-G651 PolarHBondContact O-N 2.93Å; T647-G651 VanDerWaalsContact O-N 3.13Å; T647-Y826 HydrophobicContact CG2-CD2 3.75Å; T647-Y826 HydrophobicContact CG2-CE2 3.99Å; T647-Y826 HydrophobicContact CG2-CG 4.38Å; T647-Y826 VanDerWaalsContact CG2-O 3.3Å; T647-Y826 WeakPolarHBondContact CG2-O 3.32Å; T647-Y826 WeakPolarHBondContact O-CD2 3.23Å; T647-Y826 WeakPolarHBondContact O-CE2 3.28Å; T647-R829 WeakPolarHBondContact OG1-CD 3.38Å; T647-D830 WeakPolarHBondContact CB-OD1 3.26Å; T647-D830 PolarHBondContact OG1-OD1 3.13Å
648	N	89.7	Confident	91.4	Very high	120 Å²	120	25.4 Å²	25.4	64%	0.642	15%	0.152	S	C	*	.	H	α-helix	trans	-64.5	-35.9	179.2	-64	-15.5	0	0	0	111.6	N646 G651 A652	N646-N648 VanDerWaalsContact C-N 3.33Å; N646-N648 PolarHBondContact O-N 2.94Å; N646-N648 WeakPolarHBondContact OD1-CB 3.24Å; N646-N648 PolarHBondContact OD1-N 3.36Å; N646-N648 VanDerWaalsContact OD1-N 3.13Å; N648-G651 PolarHBondContact O-N 2.76Å; N648-A652 WeakPolarHBondContact O-CB 3.2Å; N648-A652 PolarHBondContact O-N 2.85Å
649	V	91.6	Very high	91.5	Very high	15 Å²	15	27.3 Å²	27.3	9%	0.091	16%	0.163	C	C	.	.	H	α-helix	trans	-79.1	-31.9	-178	166.6	0	0	0	0	111.6	Q630 V642 N646 T647 G651 A652 F653	Q630-V649 HydrophobicContact CB-CG1 3.99Å; V642-V649 HydrophobicContact CG2-CG1 3.5Å; V642-V649 VanDerWaalsContact CG2-CG1 3.5Å; N646-V649 HydrophobicContact CB-CB 4.16Å; N646-V649 HydrophobicContact CB-CG2 4.35Å; N646-V649 WeakPolarHBondContact ND2-CG2 3.38Å; N646-V649 PolarHBondContact O-N 2.6Å; T647-V649 VanDerWaalsContact C-N 3.27Å; T647-V649 PolarHBondContact O-N 3.13Å; V649-G651 VanDerWaalsContact C-N 3.35Å; V649-A652 PolarHBondContact O-N 3.28Å; V649-F653 HydrophobicContact CG1-CD2 3.88Å; V649-F653 HydrophobicContact CG1-CE2 4.32Å; V649-F653 PolarHBondContact O-N 2.9Å
650	L	90.8	Very high	91.7	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-57.8	-48.6	166	-173.2	78.7	0	0	0	111.1	N646 T647 I654 L655 E825	N646-L650 PolarHBondContact O-N 3.27Å; N646-L650 VanDerWaalsContact O-N 3.16Å; T647-L650 WeakPolarHBondContact O-CB 3.42Å; T647-L650 PolarHBondContact O-N 3.18Å; L650-I654 HydrophobicContact CD1-CB 4.46Å; L650-I654 HydrophobicContact CD1-CD1 3.85Å; L650-I654 HydrophobicContact CD1-CG1 4.32Å; L650-I654 WeakPolarHBondContact O-CB 3.26Å; L650-I654 PolarHBondContact O-N 3.11Å; L650-L655 PolarHBondContact O-N 3.37Å; L650-E825 HydrophobicContact CD2-CB 4.13Å; L650-E825 HydrophobicContact CD2-CG 3.89Å
651	G	92.2	Very high	91.7	Very high	15 Å²	15	31.9 Å²	31.9	16%	0.155	19%	0.19	C	C	.	.	I	π-helix	trans	-59.1	-48	178.2	0	0	0	0	0	112.4	T647 N648 V649 G656	T647-G651 PolarHBondContact O-N 2.93Å; T647-G651 VanDerWaalsContact O-N 3.13Å; N648-G651 PolarHBondContact O-N 2.76Å; V649-G651 VanDerWaalsContact C-N 3.35Å; G651-G656 PolarHBondContact O-N 3.16Å
652	A	92.2	Very high	91.8	Very high	59 Å²	59	32 Å²	32	49%	0.488	19%	0.189	S	C	.	.	I	π-helix	trans	-68.8	-41.8	-176.4	0	0	0	0	0	114.4	N648 V649 P657	N648-A652 WeakPolarHBondContact O-CB 3.2Å; N648-A652 PolarHBondContact O-N 2.85Å; V649-A652 PolarHBondContact O-N 3.28Å; A652-P657 WeakPolarHBondContact O-CD 3.15Å
653	F	94.6	Very high	91.9	Very high	51 Å²	51	35.8 Å²	35.8	22%	0.224	21%	0.211	C	C	.	.	I	π-helix	trans	-108.1	-14.5	-169.2	-68.2	-79.2	0	0	0	115.7	Y415 V625 V642 V649	Y415-F653 PolarHBondContact OH-O 2.91Å; V625-F653 HydrophobicContact CG2-CB 3.77Å; V625-F653 HydrophobicContact CG2-CD1 3.43Å; V625-F653 VanDerWaalsContact CG2-CD1 3.43Å; V625-F653 HydrophobicContact CG2-CE1 4.14Å; V625-F653 HydrophobicContact CG2-CG 3.72Å; V642-F653 HydrophobicContact CG1-CB 4.21Å; V642-F653 HydrophobicContact CG2-CB 4Å; V642-F653 HydrophobicContact CG2-CD2 4.28Å; V642-F653 HydrophobicContact CG2-CG 4.37Å; V649-F653 HydrophobicContact CG1-CD2 3.88Å; V649-F653 HydrophobicContact CG1-CE2 4.32Å; V649-F653 PolarHBondContact O-N 2.9Å
654	I	94.2	Very high	92.4	Very high	25 Å²	25	40 Å²	40	13%	0.128	23%	0.234	C	C	.	.	I	π-helix	trans	-111.4	-63	173.7	-53.8	-163.5	0	0	0	110.2	V642 L650 G656 Q658 D822	V642-I654 HydrophobicContact CG1-CD1 3.79Å; V642-I654 HydrophobicContact CG1-CG1 3.64Å; L650-I654 HydrophobicContact CD1-CB 4.46Å; L650-I654 HydrophobicContact CD1-CD1 3.85Å; L650-I654 HydrophobicContact CD1-CG1 4.32Å; L650-I654 WeakPolarHBondContact O-CB 3.26Å; L650-I654 PolarHBondContact O-N 3.11Å; I654-G656 PolarHBondContact O-N 3.48Å; I654-Q658 VanDerWaalsContact CG2-NE2 3.28Å; I654-Q658 WeakPolarHBondContact O-CB 3.49Å; I654-Q658 VanDerWaalsContact O-CG 3.31Å; I654-Q658 WeakPolarHBondContact O-CG 3.15Å; I654-Q658 PolarHBondContact O-N 2.89Å; I654-D822 WeakPolarHBondContact CG2-OD2 3.35Å
655	L	94.5	Very high	92.8	Very high	21 Å²	21	38.4 Å²	38.4	11%	0.11	23%	0.228	C	C	.	.	I	π-helix	trans	-66.3	-42.5	-170.3	-172	65.6	0	0	0	112.4	L650 T659 D822 L823 Y826	L650-L655 PolarHBondContact O-N 3.37Å; L655-T659 HydrophobicContact CD1-CG2 4.15Å; L655-T659 HydrophobicContact CG-CG2 4.34Å; L655-T659 WeakPolarHBondContact O-CB 3.37Å; L655-T659 VanDerWaalsContact O-CG2 3.29Å; L655-T659 WeakPolarHBondContact O-CG2 3.48Å; L655-T659 PolarHBondContact O-N 2.97Å; L655-T659 PolarHBondContact O-OG1 3.01Å; L655-D822 HydrophobicContact CD1-CB 4.19Å; L655-L823 HydrophobicContact CD1-CB 4.11Å; L655-L823 HydrophobicContact CD2-CD1 4Å; L655-Y826 HydrophobicContact CD2-CD1 4.41Å; L655-Y826 HydrophobicContact CD2-CG 4.23Å
656	G	93.5	Very high	93.4	Very high	28 Å²	28	37.5 Å²	37.5	29%	0.289	23%	0.227	S	C	.	.	H	α-helix	trans	-59	-60.6	178.1	0	0	0	0	0	113.6	G651 I654 Q658 T659 V660	G651-G656 PolarHBondContact O-N 3.16Å; I654-G656 PolarHBondContact O-N 3.48Å; G656-Q658 VanDerWaalsContact C-N 3.33Å; G656-Q658 PolarHBondContact O-N 3.41Å; G656-T659 PolarHBondContact O-N 3.41Å; G656-T659 PolarHBondContact O-OG1 3.4Å; G656-V660 WeakPolarHBondContact O-CG2 3.46Å; G656-V660 PolarHBondContact O-N 3Å; G656-V660 VanDerWaalsContact O-N 3.11Å
657	P	94.6	Very high	93.7	Very high	12 Å²	12	39 Å²	39	8%	0.078	23%	0.234	C	C	.	.	H	α-helix	trans	-58	-41.5	179.8	-27.6	36.3	0	0	0	113.2	I419 F621 A652 L661	I419-P657 HydrophobicContact CD1-CB 4.49Å; F621-P657 HydrophobicContact CD1-CB 4.46Å; F621-P657 HydrophobicContact CD1-CG 4.08Å; F621-P657 HydrophobicContact CE1-CB 4.03Å; F621-P657 HydrophobicContact CE1-CG 3.72Å; F621-P657 HydrophobicContact CZ-CB 4.16Å; F621-P657 HydrophobicContact CZ-CG 4.33Å; A652-P657 WeakPolarHBondContact O-CD 3.15Å; P657-L661 WeakPolarHBondContact O-CB 3.45Å; P657-L661 WeakPolarHBondContact O-CG 3.29Å; P657-L661 PolarHBondContact O-N 3.24Å
658	Q	95.2	Very high	93.9	Very high	11 Å²	11	38.9 Å²	38.9	5%	0.051	23%	0.234	C	C	.	.	H	α-helix	trans	-64	-48.5	176.7	-72	-174.9	20.7	0	0	112.9	Y422 I654 G656 V660 L661 I662 N819 D822	Y422-Q658 HydrophobicContact CD1-CB 4.34Å; Y422-Q658 HydrophobicContact CD1-CG 4.16Å; Y422-Q658 HydrophobicContact CE1-CB 3.8Å; Y422-Q658 HydrophobicContact CE1-CG 3.54Å; Y422-Q658 PolarHBondContact OH-OE1 2.94Å; I654-Q658 VanDerWaalsContact CG2-NE2 3.28Å; I654-Q658 WeakPolarHBondContact O-CB 3.49Å; I654-Q658 VanDerWaalsContact O-CG 3.31Å; I654-Q658 WeakPolarHBondContact O-CG 3.15Å; I654-Q658 PolarHBondContact O-N 2.89Å; G656-Q658 VanDerWaalsContact C-N 3.33Å; G656-Q658 PolarHBondContact O-N 3.41Å; Q658-V660 VanDerWaalsContact C-N 3.29Å; Q658-V660 PolarHBondContact O-N 3.48Å; Q658-L661 PolarHBondContact O-N 2.97Å; Q658-I662 WeakPolarHBondContact O-CB 3.25Å; Q658-I662 VanDerWaalsContact O-CG1 3.31Å; Q658-I662 WeakPolarHBondContact O-CG1 3.47Å; Q658-I662 PolarHBondContact O-N 2.97Å; Q658-N819 VanDerWaalsContact CB-ND2 3.32Å; Q658-N819 WeakPolarHBondContact CB-ND2 3.16Å; Q658-N819 PolarHBondContact OE1-ND2 3.05Å; Q658-D822 PolarHBondContact NE2-OD2 3.2Å; Q658-D822 PolarHBondContact OE1-OD2 2.99Å
659	T	95.3	Very high	94.1	Very high	50 Å²	50	34.4 Å²	34.4	31%	0.307	21%	0.209	S	C	.	.	H	α-helix	trans	-62	-38.8	-178.2	47.6	0	0	0	0	111.3	L655 G656 T663 N819	L655-T659 HydrophobicContact CD1-CG2 4.15Å; L655-T659 HydrophobicContact CG-CG2 4.34Å; L655-T659 WeakPolarHBondContact O-CB 3.37Å; L655-T659 VanDerWaalsContact O-CG2 3.29Å; L655-T659 WeakPolarHBondContact O-CG2 3.48Å; L655-T659 PolarHBondContact O-N 2.97Å; L655-T659 PolarHBondContact O-OG1 3.01Å; G656-T659 PolarHBondContact O-N 3.41Å; G656-T659 PolarHBondContact O-OG1 3.4Å; T659-T663 WeakPolarHBondContact O-CB 3.44Å; T659-T663 VanDerWaalsContact O-CG2 3.28Å; T659-T663 WeakPolarHBondContact O-CG2 3.33Å; T659-T663 PolarHBondContact O-N 3.35Å; T659-T663 PolarHBondContact O-OG1 2.89Å; T659-N819 VanDerWaalsContact CG2-OD1 3.24Å; T659-N819 WeakPolarHBondContact CG2-OD1 3.07Å
660	V	95.9	Very high	94.2	Very high	80 Å²	80	37.3 Å²	37.3	49%	0.485	23%	0.227	S	C	.	.	H	α-helix	trans	-63.9	-47.3	174.2	173.7	0	0	0	0	111.5	G656 Q658 T663 L664	G656-V660 WeakPolarHBondContact O-CG2 3.46Å; G656-V660 PolarHBondContact O-N 3Å; G656-V660 VanDerWaalsContact O-N 3.11Å; Q658-V660 VanDerWaalsContact C-N 3.29Å; Q658-V660 PolarHBondContact O-N 3.48Å; V660-T663 PolarHBondContact O-N 3.29Å; V660-T663 PolarHBondContact O-OG1 2.93Å; V660-T663 VanDerWaalsContact O-OG1 3.08Å; V660-L664 HydrophobicContact CG1-CD1 3.78Å; V660-L664 HydrophobicContact CG1-CG 4.41Å; V660-L664 WeakPolarHBondContact O-CB 3.09Å; V660-L664 VanDerWaalsContact O-CG 3.25Å; V660-L664 WeakPolarHBondContact O-CG 3.12Å; V660-L664 PolarHBondContact O-N 3.43Å
661	L	95.3	Very high	94.2	Very high	24 Å²	24	40.7 Å²	40.7	13%	0.126	24%	0.244	C	C	.	.	H	α-helix	trans	-66.9	-40.1	-179.7	-71.2	169.2	0	0	0	112.9	Y422 I423 T426 P657 Q658 G665	Y422-L661 HydrophobicContact CD1-CB 4.45Å; I423-L661 HydrophobicContact CG1-CD1 3.81Å; I423-L661 HydrophobicContact CG1-CD2 4.1Å; T426-L661 HydrophobicContact CG2-CD2 4.44Å; T426-L661 PolarHBondContact OG1-O 3.35Å; P657-L661 WeakPolarHBondContact O-CB 3.45Å; P657-L661 WeakPolarHBondContact O-CG 3.29Å; P657-L661 PolarHBondContact O-N 3.24Å; Q658-L661 PolarHBondContact O-N 2.97Å; L661-G665 PolarHBondContact O-N 3.33Å
662	I	95.5	Very high	94	Very high	12 Å²	12	40 Å²	40	6%	0.062	24%	0.237	C	C	.	.	H	α-helix	trans	-64.5	-45.9	175.1	-69.2	170.4	0	0	0	110.9	Y422 Q658 G665 S666 L812 L815 I816 N819	Y422-I662 HydrophobicContact CD1-CG1 4.3Å; Y422-I662 HydrophobicContact CE1-CD1 3.94Å; Y422-I662 HydrophobicContact CE1-CG1 4.05Å; Q658-I662 WeakPolarHBondContact O-CB 3.25Å; Q658-I662 VanDerWaalsContact O-CG1 3.31Å; Q658-I662 WeakPolarHBondContact O-CG1 3.47Å; Q658-I662 PolarHBondContact O-N 2.97Å; I662-G665 PolarHBondContact O-N 3.12Å; I662-S666 VanDerWaalsContact O-CB 3.27Å; I662-S666 WeakPolarHBondContact O-CB 3.43Å; I662-S666 PolarHBondContact O-N 2.74Å; I662-S666 PolarHBondContact O-OG 2.85Å; I662-L812 HydrophobicContact CG2-CD1 4.21Å; I662-L815 HydrophobicContact CD1-CB 4.07Å; I662-L815 WeakPolarHBondContact CD1-O 3.27Å; I662-L815 HydrophobicContact CG1-CB 4.15Å; I662-I816 HydrophobicContact CG2-CG1 4.49Å; I662-N819 HydrophobicContact CD1-CB 3.61Å
663	T	95.1	Very high	93.9	Very high	78 Å²	78	41.7 Å²	41.7	48%	0.479	23%	0.234	S	C	.	.	H	α-helix	trans	-67.9	-44.5	-178.7	49.9	0	0	0	0	112	T659 V660 G665 S666 I667	T659-T663 WeakPolarHBondContact O-CB 3.44Å; T659-T663 VanDerWaalsContact O-CG2 3.28Å; T659-T663 WeakPolarHBondContact O-CG2 3.33Å; T659-T663 PolarHBondContact O-N 3.35Å; T659-T663 PolarHBondContact O-OG1 2.89Å; V660-T663 PolarHBondContact O-N 3.29Å; V660-T663 PolarHBondContact O-OG1 2.93Å; V660-T663 VanDerWaalsContact O-OG1 3.08Å; T663-G665 PolarHBondContact O-N 3.36Å; T663-S666 PolarHBondContact O-N 2.89Å; T663-I667 VanDerWaalsContact O-CG1 3.27Å; T663-I667 WeakPolarHBondContact O-CG1 3.35Å; T663-I667 PolarHBondContact O-N 3.48Å
664	L	95.1	Very high	93.6	Very high	90 Å²	90	44.5 Å²	44.5	47%	0.471	25%	0.25	S	S	.	.	H	α-helix	trans	-58.2	-46.7	173.7	-71.9	171.7	0	0	0	112	T426 V660 I667 A668	T426-L664 HydrophobicContact CG2-CB 4.13Å; V660-L664 HydrophobicContact CG1-CD1 3.78Å; V660-L664 HydrophobicContact CG1-CG 4.41Å; V660-L664 WeakPolarHBondContact O-CB 3.09Å; V660-L664 VanDerWaalsContact O-CG 3.25Å; V660-L664 WeakPolarHBondContact O-CG 3.12Å; V660-L664 PolarHBondContact O-N 3.43Å; L664-I667 PolarHBondContact O-N 3.34Å; L664-A668 PolarHBondContact O-N 2.94Å
665	G	94.6	Very high	93.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.7	-38.1	176.2	0	0	0	0	0	112.8	V429 L661 I662 T663 A668 F669	V429-G665 WeakPolarHBondContact CG1-O 3.38Å; L661-G665 PolarHBondContact O-N 3.33Å; I662-G665 PolarHBondContact O-N 3.12Å; T663-G665 PolarHBondContact O-N 3.36Å; G665-A668 PolarHBondContact O-N 3.03Å; G665-F669 WeakPolarHBondContact O-CB 3.06Å; G665-F669 PolarHBondContact O-N 2.98Å
666	S	94.7	Very high	92.6	Very high	31 Å²	31	43.6 Å²	43.6	22%	0.217	25%	0.247	C	C	.	.	H	α-helix	trans	-67.5	-38	177.2	-59.5	0	0	0	0	112.5	I662 T663 F669 T670	I662-S666 VanDerWaalsContact O-CB 3.27Å; I662-S666 WeakPolarHBondContact O-CB 3.43Å; I662-S666 PolarHBondContact O-N 2.74Å; I662-S666 PolarHBondContact O-OG 2.85Å; T663-S666 PolarHBondContact O-N 2.89Å; S666-F669 PolarHBondContact O-N 3.11Å; S666-T670 WeakPolarHBondContact O-CG2 3.38Å; S666-T670 PolarHBondContact O-N 3.46Å; S666-T670 PolarHBondContact O-OG1 2.8Å; S666-T670 VanDerWaalsContact O-OG1 3.1Å
667	I	94.6	Very high	91.9	Very high	85 Å²	85	45.2 Å²	45.2	44%	0.436	25%	0.249	S	C	.	.	H	α-helix	trans	-62.9	-49.7	172.3	-68.2	162.7	0	0	0	109.7	T663 L664 F669 T670 I671	T663-I667 VanDerWaalsContact O-CG1 3.27Å; T663-I667 WeakPolarHBondContact O-CG1 3.35Å; T663-I667 PolarHBondContact O-N 3.48Å; L664-I667 PolarHBondContact O-N 3.34Å; I667-F669 VanDerWaalsContact C-N 3.3Å; I667-F669 PolarHBondContact O-N 2.99Å; I667-T670 PolarHBondContact O-N 3Å; I667-T670 PolarHBondContact O-OG1 3.29Å; I667-I671 HydrophobicContact CG2-CD1 3.86Å; I667-I671 VanDerWaalsContact O-CG1 3.31Å; I667-I671 WeakPolarHBondContact O-CG1 3.42Å; I667-I671 PolarHBondContact O-N 3.36Å
668	A	93.4	Very high	90.9	Very high	10 Å²	10	47.5 Å²	47.5	8%	0.083	26%	0.264	C	S	.	.	H	α-helix	trans	-59.2	-39.3	175.2	0	0	0	0	0	112.7	V429 I430 S433 L664 G665 I671 G672	V429-A668 HydrophobicContact CB-CB 4.47Å; V429-A668 HydrophobicContact CG1-CB 3.88Å; I430-A668 HydrophobicContact CG1-CB 3.74Å; S433-A668 WeakPolarHBondContact CB-O 3.27Å; L664-A668 PolarHBondContact O-N 2.94Å; G665-A668 PolarHBondContact O-N 3.03Å; A668-I671 PolarHBondContact O-N 3.49Å; A668-G672 PolarHBondContact O-N 3.25Å
669	F	94.1	Very high	89.7	Confident	26 Å²	26	48.1 Å²	48.1	11%	0.114	27%	0.269	C	S	.	.	H	α-helix	trans	-63.3	-49.7	177.8	-178.7	-101.2	0	0	0	111.6	V429 W432 G665 S666 I667 I671 G672 F673 C808 F809	V429-F669 HydrophobicContact CG1-CB 3.72Å; V429-F669 HydrophobicContact CG1-CD2 4.44Å; V429-F669 VanDerWaalsContact CG1-N 3.33Å; W432-F669 HydrophobicContact CH2-CD2 4.05Å; W432-F669 AromaticContact CH2-CE2 3.93Å; W432-F669 HydrophobicContact CH2-CE2 3.93Å; W432-F669 AromaticContact CZ3-CD2 3.79Å; W432-F669 HydrophobicContact CZ3-CD2 3.79Å; W432-F669 HydrophobicContact CZ3-CE2 4.16Å; W432-F669 WeakPolarHBondContact CZ3-O 3.36Å; G665-F669 WeakPolarHBondContact O-CB 3.06Å; G665-F669 PolarHBondContact O-N 2.98Å; S666-F669 PolarHBondContact O-N 3.11Å; I667-F669 VanDerWaalsContact C-N 3.3Å; I667-F669 PolarHBondContact O-N 2.99Å; F669-I671 VanDerWaalsContact C-N 3.34Å; F669-I671 PolarHBondContact O-N 3.38Å; F669-G672 PolarHBondContact O-N 3.04Å; F669-F673 HydrophobicContact CE1-CB 4.48Å; F669-F673 WeakPolarHBondContact O-CB 3.45Å; F669-F673 PolarHBondContact O-N 3.45Å; F669-C808 HydrophobicContact CD2-CB 4.39Å; F669-F809 AromaticContact CE1-CD2 3.85Å; F669-F809 HydrophobicContact CE1-CD2 3.85Å; F669-F809 HydrophobicContact CE2-CB 3.94Å; F669-F809 HydrophobicContact CZ-CB 3.74Å; F669-F809 AromaticContact CZ-CD2 3.77Å; F669-F809 HydrophobicContact CZ-CD2 3.77Å; F669-F809 HydrophobicContact CZ-CG 4.13Å
670	T	91.9	Very high	88.4	Confident	76 Å²	76	50.5 Å²	50.5	47%	0.466	28%	0.275	S	S	.	.	H	α-helix	trans	-62.2	-40.3	179.2	51.4	0	0	0	0	112.1	S666 I667 F673 L674	S666-T670 WeakPolarHBondContact O-CG2 3.38Å; S666-T670 PolarHBondContact O-N 3.46Å; S666-T670 PolarHBondContact O-OG1 2.8Å; S666-T670 VanDerWaalsContact O-OG1 3.1Å; I667-T670 PolarHBondContact O-N 3Å; I667-T670 PolarHBondContact O-OG1 3.29Å; T670-F673 PolarHBondContact O-N 2.85Å; T670-L674 WeakPolarHBondContact O-CB 3.49Å; T670-L674 VanDerWaalsContact O-CG 3.24Å; T670-L674 WeakPolarHBondContact O-CG 3.39Å; T670-L674 PolarHBondContact O-N 3.07Å
671	I	91.5	Very high	86.9	Confident	70 Å²	70	55.9 Å²	55.9	36%	0.359	29%	0.287	S	S	.	.	H	α-helix	trans	-60.1	-51.6	173.4	-65.8	165.1	0	0	0	110.7	I437 I667 A668 F669 F673 L674 C675	I437-I671 HydrophobicContact CD1-CG2 3.87Å; I437-I671 HydrophobicContact CG1-CG2 4.34Å; I667-I671 HydrophobicContact CG2-CD1 3.86Å; I667-I671 VanDerWaalsContact O-CG1 3.31Å; I667-I671 WeakPolarHBondContact O-CG1 3.42Å; I667-I671 PolarHBondContact O-N 3.36Å; A668-I671 PolarHBondContact O-N 3.49Å; F669-I671 VanDerWaalsContact C-N 3.34Å; F669-I671 PolarHBondContact O-N 3.38Å; I671-F673 VanDerWaalsContact C-N 3.31Å; I671-F673 PolarHBondContact O-N 3.5Å; I671-L674 PolarHBondContact O-N 2.95Å; I671-C675 PolarHBondContact O-N 3.26Å; I671-C675 PolarHBondContact O-SG 2.84Å
672	G	88.5	Confident	84.9	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-35.8	179.3	0	0	0	0	0	113.6	A668 F669 C675 L676	A668-G672 PolarHBondContact O-N 3.25Å; F669-G672 PolarHBondContact O-N 3.04Å; G672-C675 CarbonylContact O-C 3.59Å; G672-C675 WeakPolarHBondContact O-CB 3.24Å; G672-C675 PolarHBondContact O-N 3.09Å; G672-L676 PolarHBondContact O-N 2.9Å
673	F	89	Confident	82.4	Confident	96 Å²	96	64.2 Å²	64.2	42%	0.421	33%	0.333	S	S	.	.	H	α-helix	trans	-68.5	-43	175	-177	-95.5	0	0	0	112.4	W432 F669 T670 I671 C675 L676 L677	W432-F673 HydrophobicContact CH2-CB 4.44Å; F669-F673 HydrophobicContact CE1-CB 4.48Å; F669-F673 WeakPolarHBondContact O-CB 3.45Å; F669-F673 PolarHBondContact O-N 3.45Å; T670-F673 PolarHBondContact O-N 2.85Å; I671-F673 VanDerWaalsContact C-N 3.31Å; I671-F673 PolarHBondContact O-N 3.5Å; F673-C675 PolarHBondContact O-N 2.7Å; F673-L676 WeakPolarHBondContact O-CB 3.45Å; F673-L676 PolarHBondContact O-N 3.4Å; F673-L677 HydrophobicContact CE1-CD2 4.02Å; F673-L677 HydrophobicContact CZ-CD2 4.37Å; F673-L677 PolarHBondContact O-N 2.85Å
674	L	88.6	Confident	79.5	Confident	109 Å²	109	67.5 Å²	67.5	57%	0.571	34%	0.34	S	S	*	.	H	α-helix	trans	-59.1	-38.5	171.8	-70.1	169.8	0	0	0	110.9	T670 I671 L676 L677 P678	T670-L674 WeakPolarHBondContact O-CB 3.49Å; T670-L674 VanDerWaalsContact O-CG 3.24Å; T670-L674 WeakPolarHBondContact O-CG 3.39Å; T670-L674 PolarHBondContact O-N 3.07Å; I671-L674 PolarHBondContact O-N 2.95Å; L674-L676 PolarHBondContact O-N 3.39Å; L674-L677 HydrophobicContact CD2-CD1 3.82Å; L674-L677 PolarHBondContact O-N 2.82Å; L674-P678 WeakPolarHBondContact O-CD 3.38Å
675	C	85.7	Confident	76.4	Confident	21 Å²	21	67.8 Å²	67.8	14%	0.142	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-3.9	172.3	-66.1	0	0	0	0	115.2	R436 I440 I671 G672 F673	R436-C675 HydrophobicContact CB-CB 3.76Å; R436-C675 PolarHBondContact NE-O 3.47Å; R436-C675 PolarHBondContact NH2-O 3.01Å; I440-C675 HydrophobicContact CD1-CB 3.5Å; I671-C675 PolarHBondContact O-N 3.26Å; I671-C675 PolarHBondContact O-SG 2.84Å; G672-C675 CarbonylContact O-C 3.59Å; G672-C675 WeakPolarHBondContact O-CB 3.24Å; G672-C675 PolarHBondContact O-N 3.09Å; F673-C675 PolarHBondContact O-N 2.7Å
676	L	81.9	Confident	73.3	Confident	7 Å²	7	75.7 Å²	75.7	4%	0.037	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-23.4	169.8	-76.7	169.7	0	0	0	113.3	W432 G672 F673 L674 P678 C679 F680	W432-L676 HydrophobicContact CH2-CD1 4.13Å; W432-L676 HydrophobicContact CZ2-CD1 3.53Å; G672-L676 PolarHBondContact O-N 2.9Å; F673-L676 WeakPolarHBondContact O-CB 3.45Å; F673-L676 PolarHBondContact O-N 3.4Å; L674-L676 PolarHBondContact O-N 3.39Å; L676-P678 VanDerWaalsContact C-N 3.29Å; L676-C679 WeakPolarHBondContact O-CB 3.28Å; L676-C679 PolarHBondContact O-N 3.21Å; L676-F680 HydrophobicContact CB-CD2 4.46Å; L676-F680 HydrophobicContact CB-CE2 3.97Å; L676-F680 WeakPolarHBondContact O-CD2 3.21Å; L676-F680 PolarHBondContact O-N 3.02Å
677	L	80.1	Confident	70.2	Confident	62 Å²	62	81.7 Å²	81.7	33%	0.325	40%	0.403	S	S	.	.	H	α-helix	trans	-52.4	-36.1	178.1	-61.2	-179.3	0	0	0	114.4	F673 L674 C679 F680 R681	F673-L677 HydrophobicContact CE1-CD2 4.02Å; F673-L677 HydrophobicContact CZ-CD2 4.37Å; F673-L677 PolarHBondContact O-N 2.85Å; L674-L677 HydrophobicContact CD2-CD1 3.82Å; L674-L677 PolarHBondContact O-N 2.82Å; L677-C679 VanDerWaalsContact C-N 3.33Å; L677-C679 PolarHBondContact O-N 3.14Å; L677-F680 PolarHBondContact O-N 3.24Å; L677-R681 PolarHBondContact O-N 3.24Å; L677-R681 VanDerWaalsContact O-N 3.11Å
678	P	73.9	Confident	67.1	Low	60 Å²	60	86.1 Å²	86.1	39%	0.39	41%	0.414	S	S	.	.	H	α-helix	trans	-62.7	-32.2	173.5	-25.2	36.2	0	0	0	114.4	L674 L676 K682	L674-P678 WeakPolarHBondContact O-CD 3.38Å; L676-P678 VanDerWaalsContact C-N 3.29Å; P678-K682 WeakPolarHBondContact O-CB 3.14Å; P678-K682 VanDerWaalsContact O-CG 3.31Å; P678-K682 WeakPolarHBondContact O-CG 3.34Å; P678-K682 PolarHBondContact O-N 2.87Å
679	C	68.6	Low	64.1	Low	23 Å²	23	91.1 Å²	91.1	16%	0.155	45%	0.449	C	S	.	.	H	α-helix	trans	-65.7	-50.3	174.7	-76.6	0	0	0	0	110.8	L676 L677 R681 K682 C683 C797	L676-C679 WeakPolarHBondContact O-CB 3.28Å; L676-C679 PolarHBondContact O-N 3.21Å; L677-C679 VanDerWaalsContact C-N 3.33Å; L677-C679 PolarHBondContact O-N 3.14Å; C679-R681 PolarHBondContact O-N 2.96Å; C679-K682 PolarHBondContact O-N 3.25Å; C679-C683 PolarHBondContact O-N 3.31Å; C679-C683 PolarHBondContact O-SG 3.09Å; C679-C797 HydrophobicContact CB-CB 3.66Å; C679-C797 WeakPolarHBondContact CB-SG 3.33Å; C679-C797 WeakPolarHBondContact SG-CB 3.36Å; C679-C797 CovalentContact SG-SG 2.04Å; C679-C797 PolarHBondContact SG-SG 3.24Å
680	F	69.4	Low	61.1	Low	100 Å²	100	94 Å²	94	44%	0.439	46%	0.462	S	S	.	.	H	α-helix	trans	-61.3	-31.2	179.9	-64.4	-66.1	0	0	0	113	L676 L677 F802	L676-F680 HydrophobicContact CB-CD2 4.46Å; L676-F680 HydrophobicContact CB-CE2 3.97Å; L676-F680 WeakPolarHBondContact O-CD2 3.21Å; L676-F680 PolarHBondContact O-N 3.02Å; L677-F680 PolarHBondContact O-N 3.24Å; F680-F802 HydrophobicContact CZ-CD2 4.05Å; F680-F802 AromaticContact CZ-CE2 3.85Å; F680-F802 HydrophobicContact CZ-CE2 3.85Å
681	R	63.4	Low	58.1	Low	193 Å²	193	96.2 Å²	96.2	73%	0.728	48%	0.48	S	S	*	.	H	α-helix	trans	-75.1	-44.9	172.5	-75.4	179.9	165.9	154.3	-3	112.7	L677 C679 C683 K684	L677-R681 PolarHBondContact O-N 3.24Å; L677-R681 VanDerWaalsContact O-N 3.11Å; C679-R681 PolarHBondContact O-N 2.96Å; R681-C683 VanDerWaalsContact C-N 3.3Å; R681-C683 PolarHBondContact O-N 2.03Å; R681-K684 PolarHBondContact O-N 3.41Å
682	K	53	Low	55.2	Low	113 Å²	113	97.8 Å²	97.8	49%	0.491	49%	0.489	S	S	.	.	H	α-helix	trans	-63.6	-31.4	179.9	-78.2	178.1	172.2	-174.4	0	113.6	Y443 P678 C679 K684 C685	Y443-K682 PolarHBondContact OH-NZ 3.22Å; P678-K682 WeakPolarHBondContact O-CB 3.14Å; P678-K682 VanDerWaalsContact O-CG 3.31Å; P678-K682 WeakPolarHBondContact O-CG 3.34Å; P678-K682 PolarHBondContact O-N 2.87Å; C679-K682 PolarHBondContact O-N 3.25Å; K682-K684 PolarHBondContact O-N 2.66Å; K682-C685 PolarHBondContact O-N 2.89Å
683	C	43.5	Very low	53	Low	99 Å²	99	103.8 Å²	103.8	67%	0.669	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-8.6	177.1	-65	0	0	0	0	114.6	C679 R681	C679-C683 PolarHBondContact O-N 3.31Å; C679-C683 PolarHBondContact O-SG 3.09Å; R681-C683 VanDerWaalsContact C-N 3.3Å; R681-C683 PolarHBondContact O-N 2.03Å
684	K	35.2	Very low	50.5	Low	146 Å²	146	105 Å²	105	64%	0.635	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-18	178.4	-64.9	-162.4	171.3	-160.4	0	114.7	R681 K682 F686	R681-K684 PolarHBondContact O-N 3.41Å; K682-K684 PolarHBondContact O-N 2.66Å; K684-F686 PolarHBondContact O-N 3.26Å
685	C	28.9	Very low	48.2	Very low	97 Å²	97	102.2 Å²	102.2	66%	0.655	54%	0.535	S	S	*	.			trans	-97.6	85	-172.8	-61.4	0	0	0	0	111.9	K682	K682-C685 PolarHBondContact O-N 2.89Å
686	F	30	Very low	46.1	Very low	166 Å²	166	108.6 Å²	108.6	73%	0.728	57%	0.567	S	S	*	*			trans	-104.4	94.7	178.3	-132.4	-77.6	0	0	0	111	K684 W688	K684-F686 PolarHBondContact O-N 3.26Å; F686-W688 AromaticContact CD1-NE1 3.84Å
687	Y	29.4	Very low	44	Very low	157 Å²	157	114 Å²	114	62%	0.616	59%	0.592	S	S	*	*			trans	-75.5	136	175.6	-80.4	-84.7	0	0	0	111.6
688	W	29.7	Very low	42	Very low	177 Å²	177	113.4 Å²	113.4	67%	0.67	60%	0.596	S	S	*	*			trans	-117.5	130.1	171.5	-66.1	75.4	0	0	0	108.6	F686	F686-W688 AromaticContact CD1-NE1 3.84Å
689	S	29.3	Very low	40.4	Very low	116 Å²	116	115.2 Å²	115.2	81%	0.811	61%	0.61	S	S	*	*			trans	-116.9	142.6	168.9	58.9	0	0	0	0	109.8
690	Q	32	Very low	39.2	Very low	85 Å²	85	123.4 Å²	123.4	40%	0.397	64%	0.638	S	S	.	*			trans	-130	117	-172.9	-172.9	169.2	6	0	0	110.5	N692	Q690-N692 PolarHBondContact O-N 3.41Å
691	C	27.8	Very low	37.9	Very low	123 Å²	123	122.5 Å²	122.5	83%	0.831	64%	0.635	S	S	*	*			trans	-86	98.9	168	-65.4	0	0	0	0	108.9
692	N	31.4	Very low	37	Very low	103 Å²	103	120 Å²	120	55%	0.551	63%	0.631	S	S	*	*			trans	-84.1	123.6	177.1	-175	9.3	0	0	0	111	Q690 N694	Q690-N692 PolarHBondContact O-N 3.41Å; N692-N694 PolarHBondContact OD1-N 3.45Å; N692-N694 VanDerWaalsContact OD1-N 3.15Å; N692-N694 PolarHBondContact OD1-O 3.47Å
693	T	43.1	Very low	36.6	Very low	126 Å²	126	117.4 Å²	117.4	77%	0.773	63%	0.627	S	S	*	*	S	Bend	trans	-124.9	-4.2	170.9	58	0	0	0	0	113.6
694	N	35.5	Very low	36.8	Very low	121 Å²	121	116.6 Å²	116.6	65%	0.647	62%	0.619	S	S	*	*	S	Bend	trans	-156.6	118	-179.5	-85	-67.5	0	0	0	110.1	N692 N696	N692-N694 PolarHBondContact OD1-N 3.45Å; N692-N694 VanDerWaalsContact OD1-N 3.15Å; N692-N694 PolarHBondContact OD1-O 3.47Å; N694-N696 PolarHBondContact O-N 3.41Å
695	G	39.9	Very low	37.2	Very low	52 Å²	52	113.1 Å²	113.1	54%	0.536	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-61.2	-15.7	-166.5	0	0	0	0	0	117.4	Q697 A698	G695-Q697 PolarHBondContact O-N 3.48Å; G695-A698 PolarHBondContact O-N 3.35Å
696	N	41.7	Very low	37.9	Very low	154 Å²	154	111.1 Å²	111.1	82%	0.824	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-70	0.5	-173.1	-69.9	-10.2	0	0	0	115.5	N694	N694-N696 PolarHBondContact O-N 3.41Å
697	Q	37.9	Very low	38.5	Very low	122 Å²	122	111.2 Å²	111.2	57%	0.57	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-93.7	-21.3	175.2	-68.6	-171.7	-9.3	0	0	114.2	G695 S699 R700 H701	G695-Q697 PolarHBondContact O-N 3.48Å; Q697-S699 PolarHBondContact O-N 3.3Å; Q697-R700 PolarHBondContact O-N 3.47Å; Q697-R700 VanDerWaalsContact O-N 3.16Å; Q697-H701 PolarHBondContact O-N 3.38Å
698	A	38.7	Very low	39	Very low	48 Å²	48	110 Å²	110	40%	0.397	59%	0.59	S	S	.	*	H	α-helix	trans	-59.5	-47.6	-173.7	0	0	0	0	0	113	G695 R700 H701 H702	G695-A698 PolarHBondContact O-N 3.35Å; A698-R700 PolarHBondContact O-N 2.91Å; A698-R700 VanDerWaalsContact O-N 3.16Å; A698-H701 PolarHBondContact O-N 2.87Å; A698-H701 VanDerWaalsContact O-N 3.09Å; A698-H702 PolarHBondContact O-N 3.44Å
699	S	40.9	Very low	39.5	Very low	99 Å²	99	107.6 Å²	107.6	69%	0.692	59%	0.586	S	S	*	*	H	α-helix	trans	-61.8	-25.4	-179.9	-43.1	0	0	0	0	113.4	Q697	Q697-S699 PolarHBondContact O-N 3.3Å
700	R	42.7	Very low	39.9	Very low	194 Å²	194	109 Å²	109	73%	0.732	59%	0.585	S	S	*	*	H	α-helix	trans	-84.5	-23	179.1	-148.8	-178.8	-64.4	-176.1	0.4	112.5	Q697 A698 S703	Q697-R700 PolarHBondContact O-N 3.47Å; Q697-R700 VanDerWaalsContact O-N 3.16Å; A698-R700 PolarHBondContact O-N 2.91Å; A698-R700 VanDerWaalsContact O-N 3.16Å; R700-S703 PolarHBondContact O-OG 3.31Å
701	H	41.4	Very low	40.1	Very low	82 Å²	82	114.6 Å²	114.6	38%	0.38	60%	0.603	S	S	.	*	H	α-helix	trans	-77.5	-42.9	171.3	-94.2	-113.3	0	0	0	112.1	Q697 A698 S703 V704 Q705	Q697-H701 PolarHBondContact O-N 3.38Å; A698-H701 PolarHBondContact O-N 2.87Å; A698-H701 VanDerWaalsContact O-N 3.09Å; H701-S703 VanDerWaalsContact C-N 3.25Å; H701-S703 PolarHBondContact O-N 3.45Å; H701-V704 PolarHBondContact O-N 3.1Å; H701-Q705 PolarHBondContact O-N 3.48Å
702	H	44.3	Very low	40.3	Very low	141 Å²	141	113.2 Å²	113.2	65%	0.653	59%	0.588	S	S	*	*	H	α-helix	trans	-54.5	-38.6	177.5	-94	-88.3	0	0	0	113.4	A698 V704 Q705 S706	A698-H702 PolarHBondContact O-N 3.44Å; H702-V704 VanDerWaalsContact C-N 3.3Å; H702-V704 PolarHBondContact O-N 2.97Å; H702-Q705 PolarHBondContact O-N 2.84Å; H702-S706 PolarHBondContact O-N 3.25Å; H702-S706 PolarHBondContact O-OG 2.91Å
703	S	44.9	Very low	40.3	Very low	58 Å²	58	118.2 Å²	118.2	41%	0.406	61%	0.608	S	S	.	*	H	α-helix	trans	-75.1	-14.3	178.1	65.3	0	0	0	0	114.7	R700 H701 K707	R700-S703 PolarHBondContact O-OG 3.31Å; H701-S703 VanDerWaalsContact C-N 3.25Å; H701-S703 PolarHBondContact O-N 3.45Å; S703-K707 WeakPolarHBondContact O-CB 3.37Å; S703-K707 WeakPolarHBondContact O-CG 2.86Å
704	V	48.4	Very low	40	Very low	81 Å²	81	115 Å²	115	49%	0.491	60%	0.6	S	S	.	*	H	α-helix	trans	-91.7	-36.2	171.7	177	0	0	0	0	110.8	H701 H702 K708	H701-V704 PolarHBondContact O-N 3.1Å; H702-V704 VanDerWaalsContact C-N 3.3Å; H702-V704 PolarHBondContact O-N 2.97Å; V704-K708 PolarHBondContact O-N 3.2Å; V704-K708 VanDerWaalsContact O-N 3.11Å
705	Q	44	Very low	40.1	Very low	74 Å²	74	113.7 Å²	113.7	35%	0.346	59%	0.592	S	S	.	*	H	α-helix	trans	-63.3	-49.8	173.3	-106.5	159.6	-60.5	0	0	111.6	H701 H702 K707 K708 Q709	H701-Q705 PolarHBondContact O-N 3.48Å; H702-Q705 PolarHBondContact O-N 2.84Å; Q705-K707 VanDerWaalsContact C-N 3.34Å; Q705-K707 PolarHBondContact O-N 3.38Å; Q705-K708 PolarHBondContact O-N 2.77Å; Q705-Q709 WeakPolarHBondContact O-CG 3.16Å; Q705-Q709 PolarHBondContact O-N 3.38Å
706	S	42.9	Very low	39.8	Very low	54 Å²	54	119 Å²	119	38%	0.378	61%	0.608	S	S	.	*	H	α-helix	trans	-61.8	-40.4	177.7	62.5	0	0	0	0	112.6	H702 K708 Q709 N710	H702-S706 PolarHBondContact O-N 3.25Å; H702-S706 PolarHBondContact O-OG 2.91Å; S706-K708 VanDerWaalsContact C-N 3.27Å; S706-K708 PolarHBondContact O-N 3.05Å; S706-Q709 PolarHBondContact O-N 3.44Å; S706-N710 PolarHBondContact O-N 2.89Å; S706-N710 VanDerWaalsContact O-N 3.15Å
707	K	42.7	Very low	39.5	Very low	169 Å²	169	115.2 Å²	115.2	74%	0.735	59%	0.594	S	S	*	*	H	α-helix	trans	-65.2	-23.4	174.3	-81.2	-175.2	172.9	-176.4	0	114.3	S703 Q705	S703-K707 WeakPolarHBondContact O-CB 3.37Å; S703-K707 WeakPolarHBondContact O-CG 2.86Å; Q705-K707 VanDerWaalsContact C-N 3.34Å; Q705-K707 PolarHBondContact O-N 3.38Å
708	K	39	Very low	39.2	Very low	130 Å²	130	116 Å²	116	57%	0.565	60%	0.597	S	S	*	*	H	α-helix	trans	-88.7	-37.3	174.1	-81.9	-175	170.8	-177.3	0	113.1	V704 Q705 S706 N710 Y711	V704-K708 PolarHBondContact O-N 3.2Å; V704-K708 VanDerWaalsContact O-N 3.11Å; Q705-K708 PolarHBondContact O-N 2.77Å; S706-K708 VanDerWaalsContact C-N 3.27Å; S706-K708 PolarHBondContact O-N 3.05Å; K708-N710 VanDerWaalsContact C-N 3.34Å; K708-N710 PolarHBondContact O-N 2.93Å; K708-Y711 PolarHBondContact O-N 3.18Å
709	Q	40.2	Very low	38.8	Very low	127 Å²	127	119.6 Å²	119.6	59%	0.593	61%	0.609	S	S	*	*	H	α-helix	trans	-63.4	-39.1	177.1	-73.7	175.1	-55.7	0	0	111.8	Q705 S706 Y711	Q705-Q709 WeakPolarHBondContact O-CG 3.16Å; Q705-Q709 PolarHBondContact O-N 3.38Å; S706-Q709 PolarHBondContact O-N 3.44Å; Q709-Y711 PolarHBondContact O-N 3.14Å; Q709-Y711 VanDerWaalsContact O-N 3.09Å
710	N	39.4	Very low	38.6	Very low	147 Å²	147	120.3 Å²	120.3	79%	0.786	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-0.4	178.2	-75.3	4.9	0	0	0	115.3	S706 K708	S706-N710 PolarHBondContact O-N 2.89Å; S706-N710 VanDerWaalsContact O-N 3.15Å; K708-N710 VanDerWaalsContact C-N 3.34Å; K708-N710 PolarHBondContact O-N 2.93Å
711	Y	36.3	Very low	38.1	Very low	201 Å²	201	118 Å²	118	79%	0.788	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.9	-5.8	-176.8	-145.1	-93.6	0	0	0	114.6	K708 Q709	K708-Y711 PolarHBondContact O-N 3.18Å; Q709-Y711 PolarHBondContact O-N 3.14Å; Q709-Y711 VanDerWaalsContact O-N 3.09Å
712	N	32	Very low	37.6	Very low	95 Å²	95	118 Å²	118	51%	0.508	63%	0.628	S	S	.	*			trans	-149.6	108.8	177.8	-78.4	-81.1	0	0	0	111.5	G714 I715	N712-G714 PolarHBondContact O-N 3.13Å; N712-I715 HydrophobicContact CB-CD1 3.59Å; N712-I715 HydrophobicContact CB-CG1 3.99Å
713	Q	31	Very low	36.9	Very low	208 Å²	208	117.1 Å²	117.1	97%	0.972	63%	0.628	S	S	*	*	S	Bend	trans	-69.8	124	164.7	-69	178.9	-13.9	0	0	109.4
714	G	36.8	Very low	36.4	Very low	58 Å²	58	119.2 Å²	119.2	60%	0.598	64%	0.64	S	S	*	*			trans	101.5	39.7	174.8	0	0	0	0	0	116.8	N712	N712-G714 PolarHBondContact O-N 3.13Å
715	I	36.9	Very low	35.7	Very low	94 Å²	94	121 Å²	121	48%	0.482	65%	0.652	S	S	.	*			trans	-114.5	96	166.5	-53.7	179.5	0	0	0	109.8	N712 S717	N712-I715 HydrophobicContact CB-CD1 3.59Å; N712-I715 HydrophobicContact CB-CG1 3.99Å; I715-S717 PolarHBondContact O-N 3.28Å; I715-S717 PolarHBondContact O-OG 2.75Å
716	D	34	Very low	35	Very low	162 Å²	162	124.4 Å²	124.4	87%	0.866	67%	0.666	S	S	*	*			trans	-64.5	120.7	170.4	-75.2	-48.1	0	0	0	110.5
717	S	35.5	Very low	34.6	Very low	76 Å²	76	126.1 Å²	126.1	53%	0.531	67%	0.674	S	S	.	*			trans	-127.4	88.8	-174.3	-57.8	0	0	0	0	109.8	I715	I715-S717 PolarHBondContact O-N 3.28Å; I715-S717 PolarHBondContact O-OG 2.75Å
718	Q	31.1	Very low	34	Very low	138 Å²	138	127.9 Å²	127.9	65%	0.645	68%	0.682	S	S	*	*			trans	-84.3	129.2	177.2	-70.7	-173.8	-13.6	0	0	111.5
719	L	30.4	Very low	33.6	Very low	123 Å²	123	125.7 Å²	125.7	64%	0.644	68%	0.683	S	S	*	*			trans	-93	137	170.6	-162.3	77.4	0	0	0	108.6
720	I	37.5	Very low	33.2	Very low	115 Å²	115	125.9 Å²	125.9	59%	0.59	69%	0.685	S	S	*	*			trans	-136.9	119.8	178	-58.8	175.2	0	0	0	109
721	D	30.9	Very low	33	Very low	145 Å²	145	123.6 Å²	123.6	78%	0.775	68%	0.676	S	S	*	*			trans	-77.7	132.8	179.1	-68.2	-56.7	0	0	0	112.4	N723	D721-N723 PolarHBondContact O-N 3.1Å
722	G	31.6	Very low	32.6	Very low	81 Å²	81	121.7 Å²	121.7	84%	0.835	68%	0.68	S	S	*	*			trans	-81.9	72.2	-171.2	0	0	0	0	0	115
723	N	30	Very low	32.5	Very low	124 Å²	124	128.5 Å²	128.5	66%	0.663	70%	0.698	S	S	*	*			trans	-93.1	123.1	172.5	-154	1.8	0	0	0	110.4	D721 T725	D721-N723 PolarHBondContact O-N 3.1Å; N723-T725 VanDerWaalsContact C-N 3.3Å; N723-T725 PolarHBondContact O-N 3.33Å; N723-T725 VanDerWaalsContact O-N 3.1Å
724	P	34.5	Very low	32.4	Very low	101 Å²	101	121.7 Å²	121.7	66%	0.656	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	0.9	-157.4	29.4	-36.7	0	0	0	116.6
725	T	32.4	Very low	32	Very low	119 Å²	119	123.2 Å²	123.2	73%	0.73	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-11.4	-167.8	47.3	0	0	0	0	115.7	N723	N723-T725 VanDerWaalsContact C-N 3.3Å; N723-T725 PolarHBondContact O-N 3.33Å; N723-T725 VanDerWaalsContact O-N 3.1Å
726	F	30.6	Very low	31.7	Very low	145 Å²	145	125.2 Å²	125.2	64%	0.636	67%	0.672	S	S	*	*			trans	-97.7	7.8	-173.2	-138	-98.9	0	0	0	115.1	K728	F726-K728 VanDerWaalsContact C-N 3.3Å; F726-K728 PolarHBondContact O-N 3.12Å; F726-K728 VanDerWaalsContact O-N 3.17Å
727	T	33.7	Very low	31.5	Very low	91 Å²	91	125.2 Å²	125.2	56%	0.558	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-6.5	-163.4	51.6	0	0	0	0	116.1	V731	T727-V731 VanDerWaalsContact O-CG2 3.3Å; T727-V731 WeakPolarHBondContact O-CG2 3.33Å
728	K	30.3	Very low	31.3	Very low	206 Å²	206	129.4 Å²	129.4	90%	0.896	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-17	-173.2	-117.7	177.7	-178.4	178.9	0	115.9	F726	F726-K728 VanDerWaalsContact C-N 3.3Å; F726-K728 PolarHBondContact O-N 3.12Å; F726-K728 VanDerWaalsContact O-N 3.17Å
729	S	31.3	Very low	31.3	Very low	83 Å²	83	130.5 Å²	130.5	58%	0.58	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	-24.5	-176.2	57.1	0	0	0	0	114.5
730	M	31.2	Very low	31.2	Very low	131 Å²	131	132.2 Å²	132.2	65%	0.645	69%	0.687	S	S	*	*	S	Bend	trans	-82.4	-11.4	-178	-69.1	-173.8	168.5	0	0	114.7	N732 R733	M730-N732 VanDerWaalsContact C-N 3.28Å; M730-N732 PolarHBondContact O-N 3.28Å; M730-R733 PolarHBondContact O-N 2.96Å
731	V	35	Very low	31	Very low	100 Å²	100	134.6 Å²	134.6	61%	0.606	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-62.7	-29.4	-171.9	177.1	0	0	0	0	113.3	T727 R733	T727-V731 VanDerWaalsContact O-CG2 3.3Å; T727-V731 WeakPolarHBondContact O-CG2 3.33Å; V731-R733 PolarHBondContact O-N 3.3Å
732	N	28	Very low	30.9	Very low	161 Å²	161	135.1 Å²	135.1	86%	0.861	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-79.6	9.2	179.6	-79.6	-0	0	0	0	114.8	M730	M730-N732 VanDerWaalsContact C-N 3.28Å; M730-N732 PolarHBondContact O-N 3.28Å
733	R	30.7	Very low	30.8	Very low	237 Å²	237	141 Å²	141	89%	0.894	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-126.5	1.9	-178.7	-105.8	-176.5	-179.9	-176.7	1	116.4	M730 V731	M730-R733 PolarHBondContact O-N 2.96Å; V731-R733 PolarHBondContact O-N 3.3Å
734	S	28.2	Very low	30.9	Very low	65 Å²	65	142.8 Å²	142.8	46%	0.455	69%	0.693	S	S	.	*			trans	-144	125.3	179.5	52.6	0	0	0	0	112.9
735	H	29	Very low	30.9	Very low	91 Å²	91	144.9 Å²	144.9	42%	0.421	69%	0.694	S	S	.	*	S	Bend	trans	-87.7	138.1	167.4	-80.6	-66.5	0	0	0	110.3	Y447	Y447-H735 AromaticContact CE2-CD2 3.67Å; Y447-H735 AromaticContact CZ-CD2 3.72Å
736	H	29.9	Very low	31	Very low	136 Å²	136	147 Å²	147	63%	0.63	70%	0.695	S	S	*	*			trans	67.8	80.8	-179.2	-58.4	-55.7	0	0	0	117.1
737	H	30.6	Very low	31	Very low	161 Å²	161	150.3 Å²	150.3	75%	0.745	71%	0.705	S	S	*	*			trans	-112.6	113.1	144.2	-94.4	-53.5	0	0	0	110.2
738	H	30.9	Very low	30.9	Very low	165 Å²	165	153.2 Å²	153.2	76%	0.764	71%	0.712	S	S	*	*			trans	-95	130.5	152.5	-105.8	-56.1	0	0	0	107.9	H740	H738-H740 PolarHBondContact O-N 3.11Å; H738-H740 VanDerWaalsContact O-N 3.07Å
739	H	31.7	Very low	30.9	Very low	161 Å²	161	149.2 Å²	149.2	75%	0.745	71%	0.707	S	S	*	*			trans	-69.2	102.3	172.8	-93.4	-87.4	0	0	0	110.5	H741	H739-H741 VanDerWaalsContact C-N 3.28Å; H739-H741 PolarHBondContact O-N 3Å
740	H	28.3	Very low	31	Very low	159 Å²	159	151.2 Å²	151.2	74%	0.736	72%	0.717	S	S	*	*			trans	-71.5	85.8	162	-96.6	-82.4	0	0	0	109.8	H738 H742	H738-H740 PolarHBondContact O-N 3.11Å; H738-H740 VanDerWaalsContact O-N 3.07Å; H740-H742 PolarHBondContact O-N 3.02Å
741	H	31.8	Very low	30.8	Very low	164 Å²	164	150.1 Å²	150.1	76%	0.759	72%	0.722	S	S	*	*			trans	-67.4	97.4	167.2	-99.4	-69.1	0	0	0	109.9	H739 R743	H739-H741 VanDerWaalsContact C-N 3.28Å; H739-H741 PolarHBondContact O-N 3Å; H741-R743 PolarHBondContact O-N 3.31Å
742	H	29.1	Very low	30.7	Very low	156 Å²	156	154.3 Å²	154.3	72%	0.722	73%	0.734	S	S	*	*			trans	-69.3	78.8	164.3	-99.3	-83.6	0	0	0	110.1	H740 H744	H740-H742 PolarHBondContact O-N 3.02Å; H742-H744 PolarHBondContact O-N 3.08Å
743	R	29.8	Very low	30.7	Very low	204 Å²	204	153.7 Å²	153.7	77%	0.77	73%	0.731	S	S	*	*			trans	-78.8	84.9	177	-153.6	-177	-147.4	-176.9	7.9	109.8	H741 H745	H741-R743 PolarHBondContact O-N 3.31Å; R743-H745 PolarHBondContact O-N 2.73Å
744	H	31.3	Very low	30.6	Very low	162 Å²	162	149.9 Å²	149.9	75%	0.75	73%	0.727	S	S	*	*			trans	-61	109.3	166.6	-94.7	-84.8	0	0	0	109.3	H742 H746	H742-H744 PolarHBondContact O-N 3.08Å; H744-H746 PolarHBondContact O-N 3.2Å
745	H	36.2	Very low	30.7	Very low	146 Å²	146	154.8 Å²	154.8	68%	0.676	74%	0.742	S	S	*	*			trans	-72.7	89.2	172.5	-89.7	-91.6	0	0	0	110.2	R743 Y747	R743-H745 PolarHBondContact O-N 2.73Å; H745-Y747 PolarHBondContact O-N 3.41Å
746	H	33.7	Very low	30.7	Very low	162 Å²	162	159 Å²	159	75%	0.75	76%	0.762	S	S	*	*			trans	-65.3	120.1	157.1	-99.5	-92.3	0	0	0	108.6	H744 Q748	H744-H746 PolarHBondContact O-N 3.2Å; H746-Q748 PolarHBondContact O-N 2.75Å
747	Y	29.8	Very low	30.6	Very low	216 Å²	216	157.8 Å²	157.8	85%	0.847	77%	0.769	S	S	*	*			trans	-93.1	87.6	-178.9	-140.3	-89	0	0	0	109.6	H745	H745-Y747 PolarHBondContact O-N 3.41Å
748	Q	33.1	Very low	30.6	Very low	151 Å²	151	158.7 Å²	158.7	71%	0.706	77%	0.773	S	S	*	*			trans	-106.8	127.5	164.3	-82.6	178.5	-66.5	0	0	109	H746 T750	H746-Q748 PolarHBondContact O-N 2.75Å; Q748-T750 PolarHBondContact O-N 3.33Å; Q748-T750 VanDerWaalsContact O-N 3.1Å
749	P	30.3	Very low	30.8	Very low	122 Å²	122	158.8 Å²	158.8	79%	0.792	77%	0.774	S	S	*	*			trans	-83.5	83.2	180	33.1	-33.5	0	0	0	110.6
750	T	31.6	Very low	30.7	Very low	126 Å²	126	158.1 Å²	158.1	77%	0.773	77%	0.77	S	S	*	*			trans	-104.8	94.9	175.9	53.8	0	0	0	0	111.3	Q748 H752	Q748-T750 PolarHBondContact O-N 3.33Å; Q748-T750 VanDerWaalsContact O-N 3.1Å; T750-H752 PolarHBondContact O-N 2.76Å
751	S	27	Very low	30.9	Very low	108 Å²	108	155.5 Å²	155.5	76%	0.755	78%	0.776	S	S	*	*			trans	-80.9	109.8	167.3	52.7	0	0	0	0	110.5
752	H	33.5	Very low	30.9	Very low	187 Å²	187	155.1 Å²	155.1	87%	0.866	78%	0.775	S	S	*	*			trans	-168.8	147.9	135.3	-109.5	-77.8	0	0	0	110.8	T750	T750-H752 PolarHBondContact O-N 2.76Å
753	N	27.7	Very low	30.9	Very low	148 Å²	148	153.3 Å²	153.3	79%	0.791	77%	0.77	S	S	*	*			trans	-81.3	158.5	-179.5	-56.5	-46.3	0	0	0	111.9
754	I	30	Very low	30.9	Very low	158 Å²	158	152.6 Å²	152.6	81%	0.81	78%	0.775	S	S	*	*				-168	147.6	127.1	-97.2	150.2	0	0	0	109.6
755	H	29.2	Very low	31	Very low	167 Å²	167	153.1 Å²	153.1	77%	0.773	78%	0.778	S	S	*	*			trans	-24.2	144	175.9	-61.8	-89.4	0	0	0	117.1
756	Q	28.9	Very low	30.5	Very low	180 Å²	180	151.5 Å²	151.5	84%	0.841	78%	0.783	S	S	*	*				-165.4	171	55.9	-132.9	154.8	29.7	0	0	113.1
757	S	27.7	Very low	30.4	Very low	110 Å²	110	150.8 Å²	150.8	77%	0.769	78%	0.784	S	S	*	*			trans	62	109.6	171	66.8	0	0	0	0	120.7
758	H	30.1	Very low	30.5	Very low	181 Å²	181	151 Å²	151	84%	0.838	78%	0.783	S	S	*	*			trans	-166.4	127.7	161	-112.4	-61.7	0	0	0	113.3
759	H	35.2	Very low	30.2	Very low	167 Å²	167	151 Å²	151	77%	0.773	79%	0.788	S	S	*	*			trans	-165.2	140.3	149.7	-78.6	-75.2	0	0	0	106.1
760	H	31	Very low	30.4	Very low	146 Å²	146	154.4 Å²	154.4	68%	0.676	79%	0.793	S	S	*	*			cis	-150.3	131.1	-8.8	-117.5	-47.6	0	0	0	108.9
761	A	31.7	Very low	30.4	Very low	104 Å²	104	153 Å²	153	86%	0.86	79%	0.788	S	S	*	*			trans	-158.6	111	163.1	0	0	0	0	0	110.7
762	H	32.7	Very low	30.6	Very low	157 Å²	157	152.1 Å²	152.1	73%	0.727	78%	0.782	S	S	*	*			trans	-109	157.8	172.4	-93.2	-67.1	0	0	0	107.8
763	N	27.9	Very low	30.3	Very low	117 Å²	117	151.8 Å²	151.8	63%	0.626	78%	0.781	S	S	*	*			cis	-167.5	145.4	-16.8	-150.6	1.2	0	0	0	106.3
764	H	30.3	Very low	30.3	Very low	190 Å²	190	156.6 Å²	156.6	88%	0.88	79%	0.788	S	S	*	*			trans	-158.2	146.2	152.9	-119.1	-86.9	0	0	0	111
765	Q	32.7	Very low	30.2	Very low	173 Å²	173	158.3 Å²	158.3	81%	0.808	79%	0.79	S	S	*	*			trans	-99.9	158	-156.6	-66.3	170.4	-50.5	0	0	114.7
766	S	27.5	Very low	30.1	Very low	112 Å²	112	155.9 Å²	155.9	78%	0.783	78%	0.783	S	S	*	*			trans	-127.8	143.1	178	62	0	0	0	0	112.9
767	L	30.5	Very low	30.1	Very low	147 Å²	147	154.4 Å²	154.4	77%	0.77	78%	0.776	S	S	*	*			trans	-158.6	147.2	167.5	-85.7	113.6	0	0	0	109.5
768	R	31.5	Very low	30.1	Very low	221 Å²	221	155.3 Å²	155.3	83%	0.834	77%	0.772	S	S	*	*			cis	-162	148.6	-28	-167.4	178.1	-71.1	-171.2	-0.8	107.2
769	N	26.5	Very low	29.9	Very low	150 Å²	150	152.6 Å²	152.6	80%	0.802	76%	0.755	S	S	*	*			trans	-68.5	155.6	-174.2	-62.3	-19.5	0	0	0	114.7
770	H	34.9	Very low	29.5	Very low	193 Å²	193	150.3 Å²	150.3	89%	0.894	76%	0.755	S	S	*	*			trans	-140.7	163	141.4	-114.7	-85.5	0	0	0	109.7
771	S	31	Very low	29.3	Very low	96 Å²	96	150.8 Å²	150.8	67%	0.671	76%	0.758	S	S	*	*			trans	-135.2	167.1	-142.5	57	0	0	0	0	117
772	S	31.4	Very low	29.1	Very low	91 Å²	91	153.1 Å²	153.1	64%	0.636	75%	0.75	S	S	*	*			trans	97.6	115.3	148.1	-61.8	0	0	0	0	120.6
773	Q	28	Very low	28.9	Very low	180 Å²	180	153.5 Å²	153.5	84%	0.841	76%	0.757	S	S	*	*				69	105.9	128.4	-63.1	170.3	-14	0	0	120.2
774	R	28.1	Very low	28.9	Very low	249 Å²	249	153.2 Å²	153.2	94%	0.94	76%	0.763	S	S	*	*				-155.3	143	108.9	-103.4	171.9	-160.3	-157.7	4.1	111.3
775	F	27.6	Very low	28.6	Very low	193 Å²	193	153.1 Å²	153.1	85%	0.846	76%	0.756	S	S	*	*			trans	-72.1	168	162.1	-82.1	-121.9	0	0	0	108.3
776	N	26.4	Very low	28.3	Very low	117 Å²	117	151.6 Å²	151.6	63%	0.626	76%	0.759	S	S	*	*			cis	-163.1	174.6	30.1	-152.4	-0.3	0	0	0	113.5
777	Q	29.6	Very low	28.3	Very low	148 Å²	148	152.3 Å²	152.3	69%	0.692	76%	0.759	S	S	*	*			trans	72.5	135	150.1	-79.7	149.9	-37.9	0	0	122.8
778	N	28.4	Very low	28	Very low	129 Å²	129	150.7 Å²	150.7	69%	0.69	76%	0.76	S	S	*	*			trans	63.1	88.6	146.6	-56.4	-2	0	0	0	121.5
779	Y	25.6	Very low	27.7	Very low	125 Å²	125	146.4 Å²	146.4	49%	0.49	75%	0.751	S	S	.	*				175.9	136.1	102.6	-108.5	-81.8	0	0	0	112.9	Q781 T1015 P1016	Y779-Q781 PolarHBondContact O-N 3.48Å; Y779-T1015 HydrophobicContact CD2-CG2 4.23Å; Y779-P1016 HydrophobicContact CE1-CG 4.21Å; Y779-P1016 PolarHBondContact OH-O 2.58Å
780	P	25.3	Very low	27.6	Very low	118 Å²	118	145.1 Å²	145.1	77%	0.766	75%	0.753	S	S	*	*			trans	-97.9	90.8	-171.2	36.2	-34.2	0	0	0	114.7
781	Q	26.8	Very low	27.1	Very low	156 Å²	156	140.7 Å²	140.7	73%	0.729	74%	0.744	S	S	*	*			trans	-136	-2.5	170.4	-72.3	-164.8	-16.5	0	0	116.5	Y779 L783	Y779-Q781 PolarHBondContact O-N 3.48Å; Q781-L783 PolarHBondContact O-N 3.01Å
782	H	27.5	Very low	27	Very low	153 Å²	153	138.7 Å²	138.7	71%	0.708	73%	0.73	S	S	*	*			trans	-93.5	97.1	-179.9	-76.7	-77.8	0	0	0	113	H1012	H782-H1012 AromaticContact NE2-NE2 3.98Å
783	L	29.4	Very low	26.8	Very low	165 Å²	165	140.8 Å²	140.8	86%	0.864	75%	0.745	S	S	*	*			trans	-147.8	45	171.8	-153	83.9	0	0	0	114.4	Q781	Q781-L783 PolarHBondContact O-N 3.01Å
784	C	28.2	Very low	27.3	Very low	111 Å²	111	135.6 Å²	135.6	75%	0.75	73%	0.729	S	S	*	*	S	Bend	trans	-152.8	17.8	176.2	-112.8	0	0	0	0	116.6
785	Y	24.7	Very low	28.1	Very low	188 Å²	188	128.1 Å²	128.1	74%	0.737	71%	0.714	S	S	*	*			trans	-132.8	37	-169.2	-85.1	-74.2	0	0	0	115.8
786	T	25.7	Very low	29.1	Very low	141 Å²	141	124 Å²	124	87%	0.865	71%	0.709	S	S	*	*			trans	-144	64.1	169.5	57.2	0	0	0	0	113.1
787	T	27.5	Very low	30.7	Very low	127 Å²	127	120.2 Å²	120.2	78%	0.779	69%	0.692	S	S	*	*			trans	-129.8	91.5	168.3	30.6	0	0	0	0	110.3	M789	T787-M789 PolarHBondContact O-N 3.47Å
788	S	24.8	Very low	32.5	Very low	113 Å²	113	116.5 Å²	116.5	79%	0.79	68%	0.677	S	S	*	*			trans	-83	107.7	-177.8	53.2	0	0	0	0	112.4
789	M	24.5	Very low	34.7	Very low	132 Å²	132	114.7 Å²	114.7	65%	0.65	67%	0.672	S	S	*	*	S	Bend	trans	65.9	143.4	157.8	-61.2	172	69.2	0	0	118.7	T787	T787-M789 PolarHBondContact O-N 3.47Å
790	S	23.6	Very low	37	Very low	122 Å²	122	109.9 Å²	109.9	85%	0.853	65%	0.654	S	S	*	*			trans	57.8	67.5	164.6	51.1	0	0	0	0	118.8
791	S	24.9	Very low	39.5	Very low	100 Å²	100	105.4 Å²	105.4	70%	0.699	62%	0.623	S	S	*	*			trans	-147.9	135.7	157.5	54.9	0	0	0	0	114.3
792	S	28.8	Very low	42.1	Very low	55 Å²	55	102.9 Å²	102.9	39%	0.385	61%	0.61	S	S	.	*			trans	33.3	86.5	170.1	55.1	0	0	0	0	119	S794	S792-S794 PolarHBondContact O-N 3.34Å; S792-S794 VanDerWaalsContact O-N 3.1Å
793	S	28.1	Very low	44.8	Very low	134 Å²	134	101.1 Å²	101.1	94%	0.937	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	40.5	173.3	63.1	0	0	0	0	114.7
794	S	38.1	Very low	47.5	Very low	72 Å²	72	93.5 Å²	93.5	50%	0.503	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-146.7	0.3	-168.2	61	0	0	0	0	116.4	S792	S792-S794 PolarHBondContact O-N 3.34Å; S792-S794 VanDerWaalsContact O-N 3.1Å
795	S	44.1	Very low	50.4	Low	92 Å²	92	88.4 Å²	88.4	64%	0.643	52%	0.524	S	S	*	.	S	Bend	trans	-123.5	-14.2	-165.7	57.2	0	0	0	0	116.6
796	S	48.3	Very low	53.5	Low	105 Å²	105	83.3 Å²	83.3	73%	0.734	51%	0.509	S	S	*	.	S	Bend	trans	-94.4	126.8	174.5	-157.7	0	0	0	0	109.9	D798	S796-D798 PolarHBondContact O-N 2.95Å
797	C	60.9	Low	56.6	Low	38 Å²	38	77 Å²	77	26%	0.257	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-78.6	117.1	-179.9	-141.4	0	0	0	0	108.9	C679	C679-C797 HydrophobicContact CB-CB 3.66Å; C679-C797 WeakPolarHBondContact CB-SG 3.33Å; C679-C797 WeakPolarHBondContact SG-CB 3.36Å; C679-C797 CovalentContact SG-SG 2.04Å; C679-C797 PolarHBondContact SG-SG 3.24Å
798	D	68.2	Low	59.7	Low	71 Å²	71	71 Å²	71	38%	0.38	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-65.9	120.3	-163.5	-142.9	21.4	0	0	0	110.5	R353 S796 M800 E801	R353-D798 IonicContact NH1-OD2 2.91Å; S796-D798 PolarHBondContact O-N 2.95Å; D798-M800 PolarHBondContact O-N 3.29Å; D798-E801 HydrophobicContact CB-CG 4.11Å; D798-E801 WeakPolarHBondContact O-CB 3.5Å; D798-E801 PolarHBondContact O-N 2.8Å
799	P	74.2	Confident	62.8	Low	90 Å²	90	70.3 Å²	70.3	58%	0.584	42%	0.415	S	S	*	.	H	α-helix	trans	-65.4	-13.9	-169.7	25.3	-35	0	0	0	113.2	R803	P799-R803 WeakPolarHBondContact O-CG 3.06Å; P799-R803 PolarHBondContact O-N 3.24Å
800	M	73.8	Confident	66	Low	25 Å²	25	68.2 Å²	68.2	12%	0.123	41%	0.406	C	S	.	.	H	α-helix	trans	-76.4	-37.5	172.7	-166.1	62	-172.2	0	0	112.8	E356 D798 F802 R803 I804 W918 V922	E356-M800 HydrophobicContact CG-CE 3.7Å; E356-M800 WeakPolarHBondContact OE1-CE 3.46Å; D798-M800 PolarHBondContact O-N 3.29Å; M800-F802 VanDerWaalsContact C-N 3.31Å; M800-F802 PolarHBondContact O-N 3.38Å; M800-R803 PolarHBondContact O-N 3.42Å; M800-I804 HydrophobicContact CE-CD1 4.46Å; M800-I804 HydrophobicContact CE-CG1 4.44Å; M800-I804 HydrophobicContact CG-CD1 4.43Å; M800-I804 WeakPolarHBondContact O-CG1 3.33Å; M800-I804 PolarHBondContact O-N 2.63Å; M800-W918 HydrophobicContact CE-CH2 3.6Å; M800-W918 HydrophobicContact CE-CZ2 3.51Å; M800-V922 HydrophobicContact CE-CG1 4.13Å; M800-V922 HydrophobicContact CE-CG2 4.42Å; M800-V922 HydrophobicContact SD-CG1 4.34Å
801	E	76.8	Confident	69.3	Low	23 Å²	23	62.4 Å²	62.4	11%	0.107	37%	0.366	C	S	.	.	H	α-helix	trans	-63.2	-40	176.8	-67.8	180	178.6	0	0	111	W432 R436 D798 I804 G805	W432-E801 PolarHBondContact NE1-O 3.07Å; R436-E801 WeakPolarHBondContact CD-OE2 3.18Å; R436-E801 IonicContact CZ-OE2 3.45Å; R436-E801 IonicContact NE-OE2 3.52Å; R436-E801 IonicContact NH1-OE2 3.58Å; R436-E801 PolarHBondContact NH1-OE2 3.24Å; D798-E801 HydrophobicContact CB-CG 4.11Å; D798-E801 WeakPolarHBondContact O-CB 3.5Å; D798-E801 PolarHBondContact O-N 2.8Å; E801-I804 PolarHBondContact O-N 3.08Å; E801-G805 PolarHBondContact O-N 3.22Å
802	F	82	Confident	72.6	Confident	104 Å²	104	58.6 Å²	58.6	46%	0.456	34%	0.337	S	S	.	.	H	α-helix	trans	-64.6	-41.4	174.8	-179	-103.4	0	0	0	112.2	F680 M800 I804 G805 L806	F680-F802 HydrophobicContact CZ-CD2 4.05Å; F680-F802 AromaticContact CZ-CE2 3.85Å; F680-F802 HydrophobicContact CZ-CE2 3.85Å; M800-F802 VanDerWaalsContact C-N 3.31Å; M800-F802 PolarHBondContact O-N 3.38Å; F802-I804 VanDerWaalsContact C-N 3.33Å; F802-I804 PolarHBondContact O-N 2.92Å; F802-G805 PolarHBondContact O-N 2.73Å; F802-L806 WeakPolarHBondContact O-CB 3.18Å; F802-L806 PolarHBondContact O-N 2.91Å
803	R	84.3	Confident	75.6	Confident	116 Å²	116	60.5 Å²	60.5	44%	0.438	34%	0.342	S	S	.	.	H	α-helix	trans	-64.1	-33.8	175.9	-75.5	174.6	179.6	-138.3	1.9	113.3	P799 M800 F807	P799-R803 WeakPolarHBondContact O-CG 3.06Å; P799-R803 PolarHBondContact O-N 3.24Å; M800-R803 PolarHBondContact O-N 3.42Å; R803-F807 PolarHBondContact O-N 3.5Å; R803-F807 VanDerWaalsContact O-N 3.13Å
804	I	86.8	Confident	78.8	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-70.1	-45.4	173.6	-67.3	167.8	0	0	0	109.9	N355 L428 W432 M800 E801 F802 L806 F807 C808 W918	N355-I804 HydrophobicContact CB-CD1 4.05Å; L428-I804 HydrophobicContact CD1-CG2 4.04Å; W432-I804 HydrophobicContact CB-CG2 4.32Å; W432-I804 HydrophobicContact CG-CG2 4.21Å; M800-I804 HydrophobicContact CE-CD1 4.46Å; M800-I804 HydrophobicContact CE-CG1 4.44Å; M800-I804 HydrophobicContact CG-CD1 4.43Å; M800-I804 WeakPolarHBondContact O-CG1 3.33Å; M800-I804 PolarHBondContact O-N 2.63Å; E801-I804 PolarHBondContact O-N 3.08Å; F802-I804 VanDerWaalsContact C-N 3.33Å; F802-I804 PolarHBondContact O-N 2.92Å; I804-L806 VanDerWaalsContact C-N 3.35Å; I804-L806 PolarHBondContact O-N 2.87Å; I804-F807 WeakPolarHBondContact O-CB 3.37Å; I804-F807 PolarHBondContact O-N 3.44Å; I804-F807 VanDerWaalsContact O-N 3.17Å; I804-C808 PolarHBondContact O-N 3.41Å; I804-C808 PolarHBondContact O-SG 2.77Å; I804-W918 HydrophobicContact CG1-CZ2 4.21Å
805	G	88.7	Confident	81.5	Confident	5 Å²	5	51 Å²	51	5%	0.052	28%	0.276	C	S	.	.	H	α-helix	trans	-58	-43.7	175.4	0	0	0	0	0	113.4	W432 E801 F802 C808 F809	W432-G805 VanDerWaalsContact CE2-CA 3.46Å; W432-G805 VanDerWaalsContact CZ2-CA 3.42Å; E801-G805 PolarHBondContact O-N 3.22Å; F802-G805 PolarHBondContact O-N 2.73Å; G805-C808 PolarHBondContact O-N 3.39Å; G805-F809 PolarHBondContact O-N 3.08Å
806	L	88.8	Confident	83.9	Confident	81 Å²	81	51 Å²	51	42%	0.424	27%	0.267	S	S	.	.	H	α-helix	trans	-62.8	-41.4	175.3	-180	60.7	0	0	0	112.2	F802 I804 F809 L810	F802-L806 WeakPolarHBondContact O-CB 3.18Å; F802-L806 PolarHBondContact O-N 2.91Å; I804-L806 VanDerWaalsContact C-N 3.35Å; I804-L806 PolarHBondContact O-N 2.87Å; L806-F809 PolarHBondContact O-N 2.77Å; L806-L810 HydrophobicContact CD1-CD1 4.26Å; L806-L810 HydrophobicContact CD1-CG 4.31Å; L806-L810 HydrophobicContact CG-CD1 4.16Å; L806-L810 WeakPolarHBondContact O-CG 3.04Å; L806-L810 PolarHBondContact O-N 3.22Å
807	F	90.8	Very high	86.1	Confident	7 Å²	7	47.5 Å²	47.5	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-60.9	-48.1	173.8	171	-97.1	0	0	0	111.7	I359 L428 R803 I804 F809 L810 Y811 W918	I359-F807 HydrophobicContact CD1-CD1 3.98Å; I359-F807 HydrophobicContact CD1-CE1 4.18Å; I359-F807 HydrophobicContact CD1-CG 4.46Å; I359-F807 HydrophobicContact CG1-CD1 4.17Å; I359-F807 HydrophobicContact CG1-CE1 3.87Å; I359-F807 HydrophobicContact CG1-CZ 4.45Å; I359-F807 HydrophobicContact CG2-CE1 4.35Å; I359-F807 HydrophobicContact CG2-CE2 4.48Å; I359-F807 HydrophobicContact CG2-CZ 4.09Å; L428-F807 HydrophobicContact CD2-CD1 3.9Å; L428-F807 HydrophobicContact CD2-CE1 3.73Å; R803-F807 PolarHBondContact O-N 3.5Å; R803-F807 VanDerWaalsContact O-N 3.13Å; I804-F807 WeakPolarHBondContact O-CB 3.37Å; I804-F807 PolarHBondContact O-N 3.44Å; I804-F807 VanDerWaalsContact O-N 3.17Å; F807-F809 VanDerWaalsContact C-N 3.27Å; F807-F809 PolarHBondContact O-N 3.41Å; F807-L810 PolarHBondContact O-N 2.93Å; F807-Y811 HydrophobicContact CE1-CD2 4.23Å; F807-Y811 HydrophobicContact CE2-CD2 4.16Å; F807-Y811 AromaticContact CZ-CD2 3.6Å; F807-Y811 HydrophobicContact CZ-CD2 3.6Å; F807-Y811 HydrophobicContact CZ-CE2 4.22Å; F807-Y811 HydrophobicContact CZ-CG 4.43Å; F807-Y811 WeakPolarHBondContact O-CB 3.43Å; F807-Y811 PolarHBondContact O-N 2.84Å; F807-W918 HydrophobicContact CD2-CB 4.01Å; F807-W918 AromaticContact CD2-CD1 3.81Å; F807-W918 AromaticContact CD2-CG 3.96Å; F807-W918 HydrophobicContact CD2-CG 3.96Å; F807-W918 HydrophobicContact CE2-CB 4.4Å; F807-W918 AromaticContact CG-CD1 3.93Å; F807-W918 HydrophobicContact CG-CG 4.37Å
808	C	92.2	Very high	87.7	Confident	1 Å²	1	46 Å²	46	1%	0.007	23%	0.232	C	C	.	.	H	α-helix	trans	-58.6	-38.1	178.2	-65.4	0	0	0	0	112.6	W425 V429 F669 I804 G805 L812	W425-C808 PolarHBondContact NE1-O 2.8Å; V429-C808 HydrophobicContact CG2-CB 3.88Å; F669-C808 HydrophobicContact CD2-CB 4.39Å; I804-C808 PolarHBondContact O-N 3.41Å; I804-C808 PolarHBondContact O-SG 2.77Å; G805-C808 PolarHBondContact O-N 3.39Å; C808-L812 PolarHBondContact O-N 3.17Å
809	F	91.7	Very high	89	Confident	99 Å²	99	43.8 Å²	43.8	43%	0.434	22%	0.22	S	C	.	.	H	α-helix	trans	-67.9	-46.9	175.3	-179.5	-104.9	0	0	0	112.9	F669 G805 L806 F807 Y811 L812	F669-F809 AromaticContact CE1-CD2 3.85Å; F669-F809 HydrophobicContact CE1-CD2 3.85Å; F669-F809 HydrophobicContact CE2-CB 3.94Å; F669-F809 HydrophobicContact CZ-CB 3.74Å; F669-F809 AromaticContact CZ-CD2 3.77Å; F669-F809 HydrophobicContact CZ-CD2 3.77Å; F669-F809 HydrophobicContact CZ-CG 4.13Å; G805-F809 PolarHBondContact O-N 3.08Å; L806-F809 PolarHBondContact O-N 2.77Å; F807-F809 VanDerWaalsContact C-N 3.27Å; F807-F809 PolarHBondContact O-N 3.41Å; F809-Y811 VanDerWaalsContact C-N 3.26Å; F809-Y811 PolarHBondContact O-N 2.74Å; F809-L812 WeakPolarHBondContact O-CB 2.94Å; F809-L812 PolarHBondContact O-N 3.03Å
810	L	91.4	Very high	90	Very high	88 Å²	88	42 Å²	42	46%	0.461	21%	0.213	S	C	.	.	H	α-helix	trans	-63.9	-33.5	177.4	-69.6	171.6	0	0	0	112	L806 F807 P814	L806-L810 HydrophobicContact CD1-CD1 4.26Å; L806-L810 HydrophobicContact CD1-CG 4.31Å; L806-L810 HydrophobicContact CG-CD1 4.16Å; L806-L810 WeakPolarHBondContact O-CG 3.04Å; L806-L810 PolarHBondContact O-N 3.22Å; F807-L810 PolarHBondContact O-N 2.93Å; L810-P814 VanDerWaalsContact O-CD 3.24Å; L810-P814 WeakPolarHBondContact O-CD 3.17Å
811	Y	93.1	Very high	91	Very high	1 Å²	1	41.1 Å²	41.1	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-70.8	-29.2	176.6	-160.5	-77.5	0	0	0	112.9	I362 S421 W425 F807 F809 I813 P814 L815 T911	I362-Y811 HydrophobicContact CG2-CE2 3.65Å; I362-Y811 WeakPolarHBondContact CG2-OH 3.36Å; S421-Y811 PolarHBondContact OG-OH 3.2Å; W425-Y811 HydrophobicContact CB-CD1 4.26Å; W425-Y811 HydrophobicContact CB-CE1 4.02Å; W425-Y811 AromaticContact CD1-CD1 3.18Å; W425-Y811 AromaticContact CD1-CE1 3.84Å; W425-Y811 AromaticContact CD1-CG 3.62Å; W425-Y811 HydrophobicContact CD2-CD1 4.42Å; W425-Y811 AromaticContact CG-CD1 3.72Å; W425-Y811 HydrophobicContact CG-CD1 3.72Å; W425-Y811 AromaticContact CG-CE1 3.97Å; W425-Y811 HydrophobicContact CG-CE1 3.97Å; W425-Y811 AromaticContact NE1-CD1 3.63Å; F807-Y811 HydrophobicContact CE1-CD2 4.23Å; F807-Y811 HydrophobicContact CE2-CD2 4.16Å; F807-Y811 AromaticContact CZ-CD2 3.6Å; F807-Y811 HydrophobicContact CZ-CD2 3.6Å; F807-Y811 HydrophobicContact CZ-CE2 4.22Å; F807-Y811 HydrophobicContact CZ-CG 4.43Å; F807-Y811 WeakPolarHBondContact O-CB 3.43Å; F807-Y811 PolarHBondContact O-N 2.84Å; F809-Y811 VanDerWaalsContact C-N 3.26Å; F809-Y811 PolarHBondContact O-N 2.74Å; Y811-I813 VanDerWaalsContact C-N 3.26Å; Y811-I813 PolarHBondContact O-N 3.46Å; Y811-P814 WeakPolarHBondContact O-CD 3.1Å; Y811-L815 HydrophobicContact CD1-CD1 3.8Å; Y811-L815 HydrophobicContact CD1-CD2 4.38Å; Y811-L815 HydrophobicContact CD1-CG 3.87Å; Y811-L815 HydrophobicContact CE1-CD1 3.93Å; Y811-L815 HydrophobicContact CE1-CD2 3.87Å; Y811-L815 HydrophobicContact CE1-CG 3.87Å; Y811-T911 HydrophobicContact CD2-CG2 4.47Å; Y811-T911 HydrophobicContact CE1-CG2 4.12Å; Y811-T911 HydrophobicContact CE2-CG2 3.93Å
812	L	93.2	Very high	91.8	Very high	20 Å²	20	40.3 Å²	40.3	11%	0.105	21%	0.206	C	C	.	.	H	α-helix	trans	-63.7	-29.7	178.6	179.7	59.8	0	0	0	112.8	W425 I662 C808 F809 L815 I816	W425-L812 HydrophobicContact CH2-CD1 3.81Å; W425-L812 HydrophobicContact CZ2-CB 4.14Å; W425-L812 HydrophobicContact CZ2-CD1 3.86Å; W425-L812 HydrophobicContact CZ2-CG 4.5Å; I662-L812 HydrophobicContact CG2-CD1 4.21Å; C808-L812 PolarHBondContact O-N 3.17Å; F809-L812 WeakPolarHBondContact O-CB 2.94Å; F809-L812 PolarHBondContact O-N 3.03Å; L812-L815 PolarHBondContact O-N 2.75Å; L812-I816 HydrophobicContact CD1-CD1 3.89Å; L812-I816 HydrophobicContact CD1-CG1 3.93Å; L812-I816 HydrophobicContact CD2-CD1 4.29Å; L812-I816 HydrophobicContact CG-CD1 3.74Å; L812-I816 HydrophobicContact CG-CG1 4.22Å; L812-I816 WeakPolarHBondContact O-CG1 3.27Å; L812-I816 PolarHBondContact O-N 3.39Å
813	I	92.8	Very high	92.4	Very high	94 Å²	94	39 Å²	39	48%	0.482	20%	0.203	S	C	.	.	H	α-helix	trans	-64.3	-53.4	-177.4	-63.9	168	0	0	0	111.4	Y811 L815 I816 C817	Y811-I813 VanDerWaalsContact C-N 3.26Å; Y811-I813 PolarHBondContact O-N 3.46Å; I813-L815 VanDerWaalsContact C-N 3.32Å; I813-L815 PolarHBondContact O-N 3.2Å; I813-I816 PolarHBondContact O-N 3Å; I813-C817 PolarHBondContact O-N 3.14Å; I813-C817 VanDerWaalsContact O-N 3.09Å
814	P	94.8	Very high	92.8	Very high	6 Å²	6	36.5 Å²	36.5	4%	0.039	19%	0.194	C	C	.	.	H	α-helix	trans	-53.1	-42.2	168.7	-31.7	36.1	0	0	0	115	L810 Y811 C817 M818 M907 V910 T911	L810-P814 VanDerWaalsContact O-CD 3.24Å; L810-P814 WeakPolarHBondContact O-CD 3.17Å; Y811-P814 WeakPolarHBondContact O-CD 3.1Å; P814-C817 PolarHBondContact O-N 2.69Å; P814-M818 HydrophobicContact CB-CE 4.42Å; P814-M818 WeakPolarHBondContact O-CG 3.47Å; P814-M818 PolarHBondContact O-N 2.88Å; P814-M907 HydrophobicContact CB-CB 4.32Å; P814-M907 WeakPolarHBondContact CB-O 3.43Å; P814-V910 HydrophobicContact CG-CG1 4.21Å; P814-T911 HydrophobicContact CB-CG2 3.74Å; P814-T911 HydrophobicContact CG-CG2 4.22Å
815	L	94.5	Very high	93.1	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-45.9	-178.9	-68.7	-175.3	0	0	0	112.2	Y422 W425 I662 Y811 L812 I813 M818 N819	Y422-L815 HydrophobicContact CD1-CD2 4.06Å; Y422-L815 HydrophobicContact CD2-CD2 4.12Å; Y422-L815 HydrophobicContact CE1-CD2 3.73Å; Y422-L815 HydrophobicContact CE2-CD2 3.77Å; Y422-L815 HydrophobicContact CG-CD2 4.26Å; W425-L815 HydrophobicContact CD2-CD1 3.46Å; W425-L815 VanDerWaalsContact CD2-CD1 3.46Å; W425-L815 HydrophobicContact CE3-CD1 3.53Å; W425-L815 HydrophobicContact CG-CD1 3.97Å; W425-L815 HydrophobicContact CH2-CD1 4.15Å; W425-L815 HydrophobicContact CZ2-CD1 4.08Å; W425-L815 HydrophobicContact CZ3-CD1 3.88Å; I662-L815 HydrophobicContact CD1-CB 4.07Å; I662-L815 WeakPolarHBondContact CD1-O 3.27Å; I662-L815 HydrophobicContact CG1-CB 4.15Å; Y811-L815 HydrophobicContact CD1-CD1 3.8Å; Y811-L815 HydrophobicContact CD1-CD2 4.38Å; Y811-L815 HydrophobicContact CD1-CG 3.87Å; Y811-L815 HydrophobicContact CE1-CD1 3.93Å; Y811-L815 HydrophobicContact CE1-CD2 3.87Å; Y811-L815 HydrophobicContact CE1-CG 3.87Å; L812-L815 PolarHBondContact O-N 2.75Å; I813-L815 VanDerWaalsContact C-N 3.32Å; I813-L815 PolarHBondContact O-N 3.2Å; L815-M818 HydrophobicContact CD2-CE 3.81Å; L815-N819 VanDerWaalsContact O-CB 3.32Å; L815-N819 WeakPolarHBondContact O-CB 3.34Å; L815-N819 PolarHBondContact O-N 3.18Å; L815-N819 VanDerWaalsContact O-N 3.11Å
816	I	94.4	Very high	93.3	Very high	92 Å²	92	40.4 Å²	40.4	47%	0.472	21%	0.208	S	C	.	.	H	α-helix	trans	-63.9	-42.3	176.2	-68.1	172.2	0	0	0	110.5	I662 L812 I813 N819 A820	I662-I816 HydrophobicContact CG2-CG1 4.49Å; L812-I816 HydrophobicContact CD1-CD1 3.89Å; L812-I816 HydrophobicContact CD1-CG1 3.93Å; L812-I816 HydrophobicContact CD2-CD1 4.29Å; L812-I816 HydrophobicContact CG-CD1 3.74Å; L812-I816 HydrophobicContact CG-CG1 4.22Å; L812-I816 WeakPolarHBondContact O-CG1 3.27Å; L812-I816 PolarHBondContact O-N 3.39Å; I813-I816 PolarHBondContact O-N 3Å; I816-N819 PolarHBondContact O-N 3.38Å; I816-A820 WeakPolarHBondContact O-CB 2.83Å; I816-A820 PolarHBondContact O-N 3.41Å
817	C	94.9	Very high	93.4	Very high	31 Å²	31	41.2 Å²	41.2	21%	0.209	21%	0.212	C	C	.	.	H	α-helix	trans	-64.8	-46.1	-179.1	-170.2	0	0	0	0	112.4	I813 P814 N819 A820 C821 M907	I813-C817 PolarHBondContact O-N 3.14Å; I813-C817 VanDerWaalsContact O-N 3.09Å; P814-C817 PolarHBondContact O-N 2.69Å; C817-N819 VanDerWaalsContact C-N 3.35Å; C817-N819 PolarHBondContact O-N 2.96Å; C817-A820 PolarHBondContact O-N 3.41Å; C817-C821 PolarHBondContact O-N 3.26Å; C817-C821 VanDerWaalsContact O-N 3.09Å; C817-C821 PolarHBondContact O-SG 3.37Å; C817-M907 HydrophobicContact CB-CG 4Å
818	M	95	Very high	93.3	Very high	8 Å²	8	45.5 Å²	45.5	4%	0.039	23%	0.228	C	C	.	.	H	α-helix	trans	-58.4	-46.7	174.4	-73.1	-174.2	-77	0	0	111.8	Y422 P814 L815 A820 C821 D822 R904 M907 S908	Y422-M818 HydrophobicContact CE2-CE 4.36Å; P814-M818 HydrophobicContact CB-CE 4.42Å; P814-M818 WeakPolarHBondContact O-CG 3.47Å; P814-M818 PolarHBondContact O-N 2.88Å; L815-M818 HydrophobicContact CD2-CE 3.81Å; M818-A820 VanDerWaalsContact C-N 3.33Å; M818-A820 PolarHBondContact O-N 2.82Å; M818-C821 WeakPolarHBondContact O-CB 3.2Å; M818-C821 PolarHBondContact O-N 3.33Å; M818-C821 VanDerWaalsContact O-N 3.12Å; M818-D822 PolarHBondContact O-N 3.17Å; M818-R904 HydrophobicContact CB-CG 4.32Å; M818-R904 HydrophobicContact CG-CG 4.15Å; M818-M907 HydrophobicContact CG-CB 4.04Å; M818-S908 WeakPolarHBondContact SD-CA 3.03Å; M818-S908 WeakPolarHBondContact SD-CB 3.3Å; M818-S908 PolarHBondContact SD-OG 3.49Å; M818-S908 VanDerWaalsContact SD-OG 3.41Å
819	N	94.5	Very high	93.1	Very high	23 Å²	23	46 Å²	46	12%	0.123	23%	0.23	C	C	.	.	H	α-helix	trans	-66.9	-33.3	-177.8	-167.3	-113	0	0	0	112.9	Q658 T659 I662 L815 I816 C817 D822 L823	Q658-N819 VanDerWaalsContact CB-ND2 3.32Å; Q658-N819 WeakPolarHBondContact CB-ND2 3.16Å; Q658-N819 PolarHBondContact OE1-ND2 3.05Å; T659-N819 VanDerWaalsContact CG2-OD1 3.24Å; T659-N819 WeakPolarHBondContact CG2-OD1 3.07Å; I662-N819 HydrophobicContact CD1-CB 3.61Å; L815-N819 VanDerWaalsContact O-CB 3.32Å; L815-N819 WeakPolarHBondContact O-CB 3.34Å; L815-N819 PolarHBondContact O-N 3.18Å; L815-N819 VanDerWaalsContact O-N 3.11Å; I816-N819 PolarHBondContact O-N 3.38Å; C817-N819 VanDerWaalsContact C-N 3.35Å; C817-N819 PolarHBondContact O-N 2.96Å; N819-D822 PolarHBondContact O-N 2.76Å; N819-L823 WeakPolarHBondContact O-CB 3.34Å; N819-L823 PolarHBondContact O-N 3.24Å
820	A	94.6	Very high	92.7	Very high	53 Å²	53	43.7 Å²	43.7	44%	0.438	22%	0.222	S	C	.	.	H	α-helix	trans	-67.6	-35.6	171.6	0	0	0	0	0	112.6	I816 C817 M818 L823 Y824	I816-A820 WeakPolarHBondContact O-CB 2.83Å; I816-A820 PolarHBondContact O-N 3.41Å; C817-A820 PolarHBondContact O-N 3.41Å; M818-A820 VanDerWaalsContact C-N 3.33Å; M818-A820 PolarHBondContact O-N 2.82Å; A820-L823 PolarHBondContact O-N 3.07Å; A820-Y824 PolarHBondContact O-N 2.86Å
821	C	95	Very high	92.3	Very high	7 Å²	7	46.2 Å²	46.2	5%	0.047	23%	0.23	C	C	.	.	H	α-helix	trans	-66.2	-42.1	173.1	-60.4	0	0	0	0	111.4	C817 M818 L823 Y824 E825 L900 R904	C817-C821 PolarHBondContact O-N 3.26Å; C817-C821 VanDerWaalsContact O-N 3.09Å; C817-C821 PolarHBondContact O-SG 3.37Å; M818-C821 WeakPolarHBondContact O-CB 3.2Å; M818-C821 PolarHBondContact O-N 3.33Å; M818-C821 VanDerWaalsContact O-N 3.12Å; C821-L823 VanDerWaalsContact C-N 3.34Å; C821-Y824 PolarHBondContact O-N 2.89Å; C821-E825 PolarHBondContact O-N 2.89Å; C821-L900 HydrophobicContact CB-CD2 4.49Å; C821-L900 HydrophobicContact CB-CG 4.23Å; C821-R904 HydrophobicContact CB-CB 3.88Å; C821-R904 HydrophobicContact CB-CG 4.29Å
822	D	93.5	Very high	91.9	Very high	6 Å²	6	46.7 Å²	46.7	3%	0.032	23%	0.231	C	C	.	.	H	α-helix	trans	-65.8	-36	176.6	-68.6	-15.4	0	0	0	112.1	I654 L655 Q658 M818 N819 E825 Y826 R904	I654-D822 WeakPolarHBondContact CG2-OD2 3.35Å; L655-D822 HydrophobicContact CD1-CB 4.19Å; Q658-D822 PolarHBondContact NE2-OD2 3.2Å; Q658-D822 PolarHBondContact OE1-OD2 2.99Å; M818-D822 PolarHBondContact O-N 3.17Å; N819-D822 PolarHBondContact O-N 2.76Å; D822-E825 PolarHBondContact O-N 2.86Å; D822-Y826 WeakPolarHBondContact O-CB 3.22Å; D822-Y826 PolarHBondContact O-N 3.1Å; D822-R904 WeakPolarHBondContact OD1-CD 3.36Å; D822-R904 IonicContact OD1-CZ 2.71Å; D822-R904 IonicContact OD1-NE 3.92Å; D822-R904 IonicContact OD1-NH1 3.68Å; D822-R904 PolarHBondContact OD1-NH1 3.26Å
823	L	94.9	Very high	91.4	Very high	75 Å²	75	47.1 Å²	47.1	39%	0.393	23%	0.233	S	C	.	.	H	α-helix	trans	-65.7	-40.5	172.3	177.8	61.9	0	0	0	112.1	L655 N819 A820 C821 Y826 L827	L655-L823 HydrophobicContact CD1-CB 4.11Å; L655-L823 HydrophobicContact CD2-CD1 4Å; N819-L823 WeakPolarHBondContact O-CB 3.34Å; N819-L823 PolarHBondContact O-N 3.24Å; A820-L823 PolarHBondContact O-N 3.07Å; C821-L823 VanDerWaalsContact C-N 3.34Å; L823-Y826 PolarHBondContact O-N 3.07Å; L823-L827 HydrophobicContact CD1-CD1 4.01Å; L823-L827 HydrophobicContact CD1-CG 4.11Å; L823-L827 HydrophobicContact CG-CD1 3.97Å; L823-L827 HydrophobicContact CG-CG 4.46Å; L823-L827 WeakPolarHBondContact O-CB 3.35Å; L823-L827 VanDerWaalsContact O-CG 3.29Å; L823-L827 WeakPolarHBondContact O-CG 3.05Å; L823-L827 PolarHBondContact O-N 3.1Å
824	Y	93.6	Very high	90.7	Very high	65 Å²	65	44.3 Å²	44.3	26%	0.255	22%	0.221	S	C	.	.	H	α-helix	trans	-65.7	-43.2	174.6	176.3	-88	0	0	0	111.6	A820 C821 Y826 L827 Y828 W832 L900	A820-Y824 PolarHBondContact O-N 2.86Å; C821-Y824 PolarHBondContact O-N 2.89Å; Y824-Y826 VanDerWaalsContact C-N 3.29Å; Y824-Y826 PolarHBondContact O-N 3.47Å; Y824-L827 PolarHBondContact O-N 3.09Å; Y824-Y828 AromaticContact CD2-CD2 3.76Å; Y824-Y828 HydrophobicContact CD2-CD2 3.76Å; Y824-Y828 AromaticContact CD2-CE2 3.81Å; Y824-Y828 HydrophobicContact CD2-CE2 3.81Å; Y824-Y828 AromaticContact CE2-CD2 3.84Å; Y824-Y828 HydrophobicContact CE2-CD2 3.84Å; Y824-Y828 AromaticContact CE2-CE2 3.88Å; Y824-Y828 HydrophobicContact CE2-CE2 3.88Å; Y824-Y828 HydrophobicContact CE2-CG 4.45Å; Y824-Y828 HydrophobicContact CG-CD2 4.24Å; Y824-Y828 WeakPolarHBondContact O-CD2 3.03Å; Y824-Y828 PolarHBondContact O-N 3.22Å; Y824-W832 AromaticContact CD1-CH2 3.82Å; Y824-W832 HydrophobicContact CD1-CH2 3.82Å; Y824-W832 HydrophobicContact CD1-CZ2 4.11Å; Y824-W832 AromaticContact CE1-CH2 3.49Å; Y824-W832 HydrophobicContact CE1-CH2 3.49Å; Y824-W832 VanDerWaalsContact CE1-CH2 3.49Å; Y824-W832 AromaticContact CE1-CZ2 3.37Å; Y824-W832 HydrophobicContact CE1-CZ2 3.37Å; Y824-W832 AromaticContact CZ-CZ2 3.84Å; Y824-L900 HydrophobicContact CD1-CD2 3.14Å; Y824-L900 HydrophobicContact CD2-CD2 4.26Å; Y824-L900 HydrophobicContact CE1-CD2 3.63Å; Y824-L900 HydrophobicContact CG-CD2 3.49Å; Y824-L900 VanDerWaalsContact CG-CD2 3.49Å
825	E	92.2	Very high	89.6	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-57.5	-43.4	173.3	-172.6	173.4	-177.9	0	0	110.7	R644 L650 C821 D822 R829 W832 F901 R904	R644-E825 IonicContact NH1-OE1 2.83Å; L650-E825 HydrophobicContact CD2-CB 4.13Å; L650-E825 HydrophobicContact CD2-CG 3.89Å; C821-E825 PolarHBondContact O-N 2.89Å; D822-E825 PolarHBondContact O-N 2.86Å; E825-R829 VanDerWaalsContact O-CB 3.28Å; E825-R829 WeakPolarHBondContact O-CB 3.39Å; E825-R829 PolarHBondContact O-N 3.21Å; E825-R829 IonicContact OE1-CZ 2.66Å; E825-R829 IonicContact OE1-NH1 2.69Å; E825-R829 PolarHBondContact OE1-NH1 2.77Å; E825-R829 IonicContact OE1-NH2 2.88Å; E825-R829 PolarHBondContact OE1-NH2 3.44Å; E825-W832 HydrophobicContact CG-CZ3 4.49Å; E825-F901 HydrophobicContact CB-CE1 4.3Å; E825-F901 HydrophobicContact CB-CZ 4.5Å; E825-F901 HydrophobicContact CG-CE1 3.96Å; E825-F901 HydrophobicContact CG-CZ 4.31Å; E825-R904 IonicContact OE2-CZ 3.56Å; E825-R904 IonicContact OE2-NH1 2.67Å; E825-R904 PolarHBondContact OE2-NH1 2.69Å; E825-R904 IonicContact OE2-NH2 3.14Å; E825-R904 PolarHBondContact OE2-NH2 3.05Å
826	Y	93.4	Very high	88.3	Confident	89 Å²	89	50.6 Å²	50.6	35%	0.349	26%	0.261	S	S	.	.	H	α-helix	trans	-62.7	-45.1	175.5	179	-97.2	0	0	0	113.8	T647 L655 D822 L823 Y824 Y828	T647-Y826 HydrophobicContact CG2-CD2 3.75Å; T647-Y826 HydrophobicContact CG2-CE2 3.99Å; T647-Y826 HydrophobicContact CG2-CG 4.38Å; T647-Y826 VanDerWaalsContact CG2-O 3.3Å; T647-Y826 WeakPolarHBondContact CG2-O 3.32Å; T647-Y826 WeakPolarHBondContact O-CD2 3.23Å; T647-Y826 WeakPolarHBondContact O-CE2 3.28Å; L655-Y826 HydrophobicContact CD2-CD1 4.41Å; L655-Y826 HydrophobicContact CD2-CG 4.23Å; D822-Y826 WeakPolarHBondContact O-CB 3.22Å; D822-Y826 PolarHBondContact O-N 3.1Å; L823-Y826 PolarHBondContact O-N 3.07Å; Y824-Y826 VanDerWaalsContact C-N 3.29Å; Y824-Y826 PolarHBondContact O-N 3.47Å; Y826-Y828 PolarHBondContact O-N 3.45Å
827	L	91.6	Very high	86.6	Confident	98 Å²	98	48.2 Å²	48.2	51%	0.513	26%	0.259	S	S	.	.	H	α-helix	trans	-73.3	-22.7	-174.7	-72.9	172.2	0	0	0	114.4	L823 Y824	L823-L827 HydrophobicContact CD1-CD1 4.01Å; L823-L827 HydrophobicContact CD1-CG 4.11Å; L823-L827 HydrophobicContact CG-CD1 3.97Å; L823-L827 HydrophobicContact CG-CG 4.46Å; L823-L827 WeakPolarHBondContact O-CB 3.35Å; L823-L827 VanDerWaalsContact O-CG 3.29Å; L823-L827 WeakPolarHBondContact O-CG 3.05Å; L823-L827 PolarHBondContact O-N 3.1Å; Y824-L827 PolarHBondContact O-N 3.09Å
828	Y	88.8	Confident	84.8	Confident	96 Å²	96	50.2 Å²	50.2	38%	0.376	26%	0.263	S	S	.	.	H	α-helix	trans	-120	-13	-172.7	-68.9	-93.5	0	0	0	115.2	Y824 Y826 D830 K831 W832	Y824-Y828 AromaticContact CD2-CD2 3.76Å; Y824-Y828 HydrophobicContact CD2-CD2 3.76Å; Y824-Y828 AromaticContact CD2-CE2 3.81Å; Y824-Y828 HydrophobicContact CD2-CE2 3.81Å; Y824-Y828 AromaticContact CE2-CD2 3.84Å; Y824-Y828 HydrophobicContact CE2-CD2 3.84Å; Y824-Y828 AromaticContact CE2-CE2 3.88Å; Y824-Y828 HydrophobicContact CE2-CE2 3.88Å; Y824-Y828 HydrophobicContact CE2-CG 4.45Å; Y824-Y828 HydrophobicContact CG-CD2 4.24Å; Y824-Y828 WeakPolarHBondContact O-CD2 3.03Å; Y824-Y828 PolarHBondContact O-N 3.22Å; Y826-Y828 PolarHBondContact O-N 3.45Å; Y828-D830 PolarHBondContact O-N 3.46Å; Y828-K831 HydrophobicContact CD1-CD 4.2Å; Y828-K831 WeakPolarHBondContact O-CB 3.26Å; Y828-K831 PolarHBondContact O-N 3.34Å; Y828-W832 HydrophobicContact CG-CZ2 4.28Å; Y828-W832 PolarHBondContact O-N 3.22Å
829	R	87.9	Confident	82.8	Confident	12 Å²	12	56 Å²	56	5%	0.045	29%	0.288	C	S	.	.	H	α-helix	trans	-48.9	-52.9	-177	-172.5	-168.5	-55.8	-56.9	11.7	113.3	G643 R644 T647 E825 K831 W832 L833	G643-R829 PolarHBondContact O-NE 2.67Å; G643-R829 PolarHBondContact O-NH2 3.02Å; R644-R829 PolarHBondContact O-NE 2.83Å; R644-R829 PolarHBondContact O-NH1 2.84Å; T647-R829 WeakPolarHBondContact OG1-CD 3.38Å; E825-R829 VanDerWaalsContact O-CB 3.28Å; E825-R829 WeakPolarHBondContact O-CB 3.39Å; E825-R829 PolarHBondContact O-N 3.21Å; E825-R829 IonicContact OE1-CZ 2.66Å; E825-R829 IonicContact OE1-NH1 2.69Å; E825-R829 PolarHBondContact OE1-NH1 2.77Å; E825-R829 IonicContact OE1-NH2 2.88Å; E825-R829 PolarHBondContact OE1-NH2 3.44Å; R829-K831 PolarHBondContact O-N 3.49Å; R829-W832 HydrophobicContact CB-CE3 4.45Å; R829-W832 PolarHBondContact O-N 3.47Å; R829-L833 HydrophobicContact CG-CD1 3.68Å; R829-L833 HydrophobicContact CG-CG 4.3Å; R829-L833 PolarHBondContact O-N 3.12Å; R829-L833 VanDerWaalsContact O-N 3.14Å
830	D	83.1	Confident	80.4	Confident	50 Å²	50	61.5 Å²	61.5	27%	0.267	31%	0.313	S	S	.	.	H	α-helix	trans	-54.7	-42.3	-177.9	-70.8	23.4	0	0	0	111.3	T647 Y828 W832 L833 T834 K839	T647-D830 WeakPolarHBondContact CB-OD1 3.26Å; T647-D830 PolarHBondContact OG1-OD1 3.13Å; Y828-D830 PolarHBondContact O-N 3.46Å; D830-W832 VanDerWaalsContact C-N 3.3Å; D830-W832 PolarHBondContact O-N 3.2Å; D830-L833 PolarHBondContact O-N 3.41Å; D830-T834 PolarHBondContact O-N 2.95Å; D830-T834 PolarHBondContact O-OG1 3.01Å; D830-K839 IonicContact OD2-NZ 3.5Å; D830-K839 PolarHBondContact OD2-NZ 2.95Å
831	K	82.4	Confident	77.8	Confident	142 Å²	142	62.1 Å²	62.1	62%	0.617	31%	0.306	S	S	*	.	H	α-helix	trans	-68.9	-24.6	-178.6	-60.6	176.8	-179.9	173.9	0	113.5	Y828 R829	Y828-K831 HydrophobicContact CD1-CD 4.2Å; Y828-K831 WeakPolarHBondContact O-CB 3.26Å; Y828-K831 PolarHBondContact O-N 3.34Å; R829-K831 PolarHBondContact O-N 3.49Å
832	W	84.4	Confident	75	Confident	10 Å²	10	65.8 Å²	65.8	4%	0.038	32%	0.324	C	S	.	.	H	α-helix	trans	-81.7	-31.1	173.8	-56.6	-35	0	0	0	112.5	Y824 E825 Y828 R829 D830 Y894 P896 F901	Y824-W832 AromaticContact CD1-CH2 3.82Å; Y824-W832 HydrophobicContact CD1-CH2 3.82Å; Y824-W832 HydrophobicContact CD1-CZ2 4.11Å; Y824-W832 AromaticContact CE1-CH2 3.49Å; Y824-W832 HydrophobicContact CE1-CH2 3.49Å; Y824-W832 VanDerWaalsContact CE1-CH2 3.49Å; Y824-W832 AromaticContact CE1-CZ2 3.37Å; Y824-W832 HydrophobicContact CE1-CZ2 3.37Å; Y824-W832 AromaticContact CZ-CZ2 3.84Å; E825-W832 HydrophobicContact CG-CZ3 4.49Å; Y828-W832 HydrophobicContact CG-CZ2 4.28Å; Y828-W832 PolarHBondContact O-N 3.22Å; R829-W832 HydrophobicContact CB-CE3 4.45Å; R829-W832 PolarHBondContact O-N 3.47Å; D830-W832 VanDerWaalsContact C-N 3.3Å; D830-W832 PolarHBondContact O-N 3.2Å; W832-Y894 VanDerWaalsContact CD1-O 3.25Å; W832-P896 HydrophobicContact CD2-CB 3.73Å; W832-P896 HydrophobicContact CD2-CG 4.19Å; W832-P896 HydrophobicContact CE3-CB 3.77Å; W832-P896 HydrophobicContact CE3-CG 4.27Å; W832-P896 HydrophobicContact CG-CB 4.4Å; W832-P896 HydrophobicContact CG-CG 4.45Å; W832-P896 HydrophobicContact CH2-CB 3.97Å; W832-P896 HydrophobicContact CZ2-CB 3.87Å; W832-P896 HydrophobicContact CZ3-CB 3.91Å; W832-F901 HydrophobicContact CH2-CZ 4.07Å; W832-F901 AromaticContact CZ3-CZ 3.97Å; W832-F901 HydrophobicContact CZ3-CZ 3.97Å
833	L	83.3	Confident	72.3	Confident	29 Å²	29	70.4 Å²	70.4	15%	0.152	35%	0.348	C	S	.	.	H	α-helix	trans	-91.6	-40.3	-174.4	-70.9	177.1	0	0	0	113.9	L290 K291 L314 R829 D830	L290-L833 CarbonylContact C-O 3.52Å; L290-L833 VanDerWaalsContact CA-O 3.32Å; L290-L833 WeakPolarHBondContact CA-O 3.35Å; K291-L833 PolarHBondContact N-O 3.47Å; L314-L833 HydrophobicContact CD1-CD2 3.83Å; R829-L833 HydrophobicContact CG-CD1 3.68Å; R829-L833 HydrophobicContact CG-CG 4.3Å; R829-L833 PolarHBondContact O-N 3.12Å; R829-L833 VanDerWaalsContact O-N 3.14Å; D830-L833 PolarHBondContact O-N 3.41Å
834	T	78.6	Confident	69.5	Low	36 Å²	36	71.3 Å²	71.3	22%	0.221	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-96.9	152	-175.9	64.1	0	0	0	0	112.6	H289 D830 Y838	H289-T834 VanDerWaalsContact O-CA 3.28Å; H289-T834 WeakPolarHBondContact O-CA 3.38Å; D830-T834 PolarHBondContact O-N 2.95Å; D830-T834 PolarHBondContact O-OG1 3.01Å; T834-Y838 HydrophobicContact CG2-CD1 4.32Å
835	V	70.3	Confident	66.9	Low	32 Å²	32	74.3 Å²	74.3	19%	0.194	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-65.5	148.3	166.3	-59.6	0	0	0	0	111	H289 I890	H289-V835 PolarHBondContact O-N 3.28Å; V835-I890 HydrophobicContact CG1-CD1 4.36Å
836	P	67.2	Low	64.1	Low	106 Å²	106	77.9 Å²	77.9	69%	0.688	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	153.5	170.8	-26	35.7	0	0	0	112.5	Y838	P836-Y838 PolarHBondContact O-N 2.85Å
837	G	58.9	Low	61.3	Low	42 Å²	42	77.8 Å²	77.8	43%	0.433	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	-30.7	179.9	0	0	0	0	0	115.9	K839 Q840	G837-K839 VanDerWaalsContact C-N 3.29Å; G837-K839 PolarHBondContact O-N 2.84Å; G837-K839 VanDerWaalsContact O-N 3.08Å; G837-Q840 PolarHBondContact O-N 3.12Å; G837-Q840 VanDerWaalsContact O-N 3.14Å
838	Y	58.7	Low	58.6	Low	74 Å²	74	78.3 Å²	78.3	29%	0.29	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-42.2	-172.2	177.3	-114	0	0	0	114.6	H289 T834 P836 Q840 H841 M842	H289-Y838 HydrophobicContact CB-CD1 3.74Å; H289-Y838 HydrophobicContact CB-CD2 3.53Å; H289-Y838 HydrophobicContact CB-CE1 3.52Å; H289-Y838 HydrophobicContact CB-CE2 3.31Å; H289-Y838 HydrophobicContact CB-CG 3.73Å; H289-Y838 AromaticContact CD2-CE1 3.65Å; H289-Y838 AromaticContact CD2-CZ 3.93Å; H289-Y838 AromaticContact CG-CE1 3.75Å; H289-Y838 AromaticContact CG-CZ 3.58Å; T834-Y838 HydrophobicContact CG2-CD1 4.32Å; P836-Y838 PolarHBondContact O-N 2.85Å; Y838-Q840 VanDerWaalsContact C-N 3.33Å; Y838-Q840 PolarHBondContact O-N 2.78Å; Y838-H841 PolarHBondContact O-N 2.72Å; Y838-M842 HydrophobicContact CE2-CE 4.09Å; Y838-M842 WeakPolarHBondContact OH-CE 3.19Å
839	K	51.4	Low	56	Low	129 Å²	129	78.9 Å²	78.9	56%	0.561	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-32.8	-173.6	-152.2	165.6	-171.9	174.8	0	112.9	D830 G837 H841 M842	D830-K839 IonicContact OD2-NZ 3.5Å; D830-K839 PolarHBondContact OD2-NZ 2.95Å; G837-K839 VanDerWaalsContact C-N 3.29Å; G837-K839 PolarHBondContact O-N 2.84Å; G837-K839 VanDerWaalsContact O-N 3.08Å; K839-H841 VanDerWaalsContact C-N 3.25Å; K839-H841 PolarHBondContact O-N 3.44Å; K839-M842 PolarHBondContact O-N 3.09Å
840	Q	43.9	Very low	53.3	Low	138 Å²	138	85.3 Å²	85.3	65%	0.645	46%	0.456	S	S	*	.	H	α-helix	trans	-63	-32.7	176.5	-67.9	168.3	-93.9	0	0	111.7	G837 Y838 M842	G837-Q840 PolarHBondContact O-N 3.12Å; G837-Q840 VanDerWaalsContact O-N 3.14Å; Y838-Q840 VanDerWaalsContact C-N 3.33Å; Y838-Q840 PolarHBondContact O-N 2.78Å; Q840-M842 PolarHBondContact O-N 3.41Å
841	H	40.3	Very low	50.9	Low	66 Å²	66	87.4 Å²	87.4	31%	0.306	47%	0.47	S	S	.	.	H	α-helix	trans	-76.6	-13.3	-176.8	-98.1	-27.2	0	0	0	116.1	R123 Y838 K839 H845	R123-H841 VanDerWaalsContact CD-NE2 3.34Å; R123-H841 WeakPolarHBondContact CD-NE2 3.29Å; Y838-H841 PolarHBondContact O-N 2.72Å; K839-H841 VanDerWaalsContact C-N 3.25Å; K839-H841 PolarHBondContact O-N 3.44Å; H841-H845 PolarHBondContact O-CD2 3.43Å
842	M	36	Very low	48.5	Very low	85 Å²	85	87.8 Å²	87.8	42%	0.419	48%	0.479	S	S	.	.	H	α-helix	trans	-86.3	-31.2	176.1	-76.5	-65.1	-179.7	0	0	112.8	Y838 K839 Q840 H845 S846	Y838-M842 HydrophobicContact CE2-CE 4.09Å; Y838-M842 WeakPolarHBondContact OH-CE 3.19Å; K839-M842 PolarHBondContact O-N 3.09Å; Q840-M842 PolarHBondContact O-N 3.41Å; M842-H845 PolarHBondContact O-N 3.37Å; M842-S846 WeakPolarHBondContact O-CB 2.99Å; M842-S846 PolarHBondContact O-N 3.43Å; M842-S846 PolarHBondContact O-OG 2.83Å
843	D	37.5	Very low	46	Very low	102 Å²	102	94.3 Å²	94.3	55%	0.545	52%	0.515	S	S	.	.	H	α-helix	trans	-74	-38.2	179.9	-63.6	-36.2	0	0	0	111.3	H845 S846 T847	D843-H845 VanDerWaalsContact C-N 3.33Å; D843-H845 PolarHBondContact O-N 3.28Å; D843-S846 PolarHBondContact O-N 3.43Å; D843-T847 WeakPolarHBondContact O-CG2 3.37Å; D843-T847 PolarHBondContact O-N 3.48Å; D843-T847 PolarHBondContact O-OG1 3.36Å
844	D	35.3	Very low	43.5	Very low	94 Å²	94	101.2 Å²	101.2	50%	0.503	55%	0.546	S	S	.	.	H	α-helix	trans	-61.4	-36.1	172.1	-72.6	-21.3	0	0	0	113.3	T847 N848	D844-T847 PolarHBondContact O-OG1 3.1Å; D844-N848 PolarHBondContact O-ND2 3.36Å
845	H	38.7	Very low	41.4	Very low	129 Å²	129	104.2 Å²	104.2	60%	0.597	57%	0.569	S	S	*	*	H	α-helix	trans	-78.1	-31.2	176.5	-92.7	-78.6	0	0	0	112.4	R123 H841 M842 D843 V849	R123-H845 PolarHBondContact NH1-NE2 3.13Å; R123-H845 PolarHBondContact NH2-NE2 3.11Å; H841-H845 PolarHBondContact O-CD2 3.43Å; M842-H845 PolarHBondContact O-N 3.37Å; D843-H845 VanDerWaalsContact C-N 3.33Å; D843-H845 PolarHBondContact O-N 3.28Å; H845-V849 WeakPolarHBondContact O-CG2 3.17Å
846	S	35.1	Very low	39.6	Very low	77 Å²	77	109.7 Å²	109.7	54%	0.538	60%	0.597	S	S	.	*	H	α-helix	trans	-77.2	-28.7	-179.5	-59.5	0	0	0	0	113.3	M842 D843	M842-S846 WeakPolarHBondContact O-CB 2.99Å; M842-S846 PolarHBondContact O-N 3.43Å; M842-S846 PolarHBondContact O-OG 2.83Å; D843-S846 PolarHBondContact O-N 3.43Å
847	T	33.8	Very low	38.2	Very low	86 Å²	86	111.2 Å²	111.2	53%	0.528	60%	0.599	S	S	.	*	H	α-helix	trans	-81.9	-23.1	-177.9	46.2	0	0	0	0	114.2	D843 D844	D843-T847 WeakPolarHBondContact O-CG2 3.37Å; D843-T847 PolarHBondContact O-N 3.48Å; D843-T847 PolarHBondContact O-OG1 3.36Å; D844-T847 PolarHBondContact O-OG1 3.1Å
848	N	34.7	Very low	37.1	Very low	110 Å²	110	115.6 Å²	115.6	59%	0.588	61%	0.613	S	S	*	*	S	Bend	trans	-89.7	-5.2	-177	-82.4	-74.1	0	0	0	115.5	D844	D844-N848 PolarHBondContact O-ND2 3.36Å
849	V	34.9	Very low	36.1	Very low	108 Å²	108	118.5 Å²	118.5	66%	0.655	63%	0.633	S	S	*	*	S	Bend	trans	-90.2	-20.5	-176	176.7	0	0	0	0	113.1	H845	H845-V849 WeakPolarHBondContact O-CG2 3.17Å
850	N	31.6	Very low	35.4	Very low	147 Å²	147	120 Å²	120	79%	0.786	65%	0.647	S	S	*	*	S	Bend	trans	-109.8	8.5	-173.5	-72.9	-33.9	0	0	0	114.8
851	T	32.2	Very low	34.8	Very low	94 Å²	94	122.7 Å²	122.7	58%	0.577	66%	0.66	S	S	*	*			trans	-107.1	18.1	-174.6	41.7	0	0	0	0	114.4	N853	T851-N853 PolarHBondContact O-N 2.73Å
852	N	31	Very low	34.4	Very low	150 Å²	150	128.9 Å²	128.9	80%	0.802	69%	0.686	S	S	*	*			trans	-73.8	63.5	164.7	-82.6	-29.5	0	0	0	111.6
853	N	31.6	Very low	34	Very low	146 Å²	146	131.9 Å²	131.9	78%	0.781	70%	0.702	S	S	*	*	S	Bend	trans	-173.6	144	154.6	-96.3	-37.1	0	0	0	112.1	T851	T851-N853 PolarHBondContact O-N 2.73Å
854	H	32.2	Very low	33.7	Very low	174 Å²	174	135 Å²	135	81%	0.806	72%	0.717	S	S	*	*			trans	68.6	101.2	170.4	-82.2	-61.9	0	0	0	121.7
855	S	34.1	Very low	33.3	Very low	100 Å²	100	137.3 Å²	137.3	70%	0.699	73%	0.73	S	S	*	*				72.5	101.1	122.6	-59	0	0	0	0	122.1
856	N	32.8	Very low	32.8	Very low	146 Å²	146	137.8 Å²	137.8	78%	0.781	74%	0.737	S	S	*	*				14.9	119.5	129.6	-64.4	-3.5	0	0	0	119.6
857	N	37.9	Very low	32.4	Very low	138 Å²	138	142.3 Å²	142.3	74%	0.738	75%	0.749	S	S	*	*				166.8	122.5	100.5	-89.1	-38.4	0	0	0	114.9
858	N	35	Very low	32.1	Very low	135 Å²	135	148.3 Å²	148.3	72%	0.722	76%	0.764	S	S	*	*			trans	41.1	142.7	133.5	-60.4	-11.4	0	0	0	124.1
859	N	37.6	Very low	31.8	Very low	135 Å²	135	148.2 Å²	148.2	72%	0.722	77%	0.769	S	S	*	*			trans	79.2	100	153.3	-54.4	-24.2	0	0	0	119.6
860	N	38	Very low	31.4	Very low	161 Å²	161	151 Å²	151	86%	0.861	78%	0.78	S	S	*	*				173.2	139	92.1	-88.7	-54.8	0	0	0	113.9
861	H	31.4	Very low	31.3	Very low	194 Å²	194	150.4 Å²	150.4	90%	0.898	78%	0.776	S	S	*	*			trans	-76.6	127.1	163.9	-100.6	-100.9	0	0	0	110.7
862	K	30.6	Very low	31.1	Very low	196 Å²	196	154.2 Å²	154.2	85%	0.852	78%	0.781	S	S	*	*			trans	-162.5	144.8	141.9	-121.3	167.2	-177.8	174.5	0	114.9
863	L	27.4	Very low	30.8	Very low	147 Å²	147	151.2 Å²	151.2	77%	0.77	79%	0.786	S	S	*	*			trans	-19.6	132.7	176.3	-74.3	68.4	0	0	0	117.5
864	I	32.6	Very low	30.8	Very low	167 Å²	167	150.1 Å²	150.1	86%	0.856	78%	0.784	S	S	*	*				-143.7	117.5	117	-90.8	140.2	0	0	0	107.6
865	N	25.8	Very low	30.6	Very low	143 Å²	143	153.6 Å²	153.6	77%	0.765	79%	0.79	S	S	*	*			trans	-83.8	137.4	154.4	-75	-13.2	0	0	0	107
866	N	28.2	Very low	30.4	Very low	140 Å²	140	156.1 Å²	156.1	75%	0.749	80%	0.796	S	S	*	*			trans	177.2	149.7	131.3	-92.3	-9.2	0	0	0	113.8
867	Q	27.4	Very low	30.3	Very low	172 Å²	172	156.8 Å²	156.8	80%	0.804	79%	0.794	S	S	*	*			trans	59.2	68.2	154.5	-75.4	158	-68.7	0	0	118.7
868	Y	27	Very low	29.8	Very low	211 Å²	211	156.6 Å²	156.6	83%	0.827	80%	0.8	S	S	*	*				-76	131.3	125.6	-80.8	-95.5	0	0	0	108.9	N870	Y868-N870 PolarHBondContact O-N 3.15Å
869	P	29.5	Very low	29.7	Very low	109 Å²	109	158.1 Å²	158.1	71%	0.708	80%	0.803	S	S	*	*			trans	-77.3	112.5	166.7	30.2	-30.4	0	0	0	109.6	I871	P869-I871 PolarHBondContact O-N 2.84Å
870	N	26.3	Very low	29.5	Very low	165 Å²	165	158.3 Å²	158.3	88%	0.882	80%	0.802	S	S	*	*			trans	-68.7	99.3	174.9	-79.7	-32.8	0	0	0	110.7	Y868	Y868-N870 PolarHBondContact O-N 3.15Å
871	I	27.8	Very low	29.2	Very low	136 Å²	136	159.1 Å²	159.1	70%	0.697	80%	0.803	S	S	*	*			trans	-125.9	95.5	165.1	-58.1	178.4	0	0	0	107.9	P869	P869-I871 PolarHBondContact O-N 2.84Å
872	Y	29.2	Very low	29.7	Very low	174 Å²	174	150.8 Å²	150.8	68%	0.682	77%	0.765	S	S	*	*			trans	164.8	72.8	146.9	-87.8	-58.9	0	0	0	109.1	T874 N891	Y872-T874 PolarHBondContact O-N 2.93Å; Y872-N891 PolarHBondContact OH-ND2 3.19Å; Y872-N891 VanDerWaalsContact OH-ND2 3.09Å
873	G	24.3	Very low	30.2	Very low	87 Å²	87	144.7 Å²	144.7	90%	0.897	74%	0.739	S	S	*	*			trans	-84.8	74.8	179.7	0	0	0	0	0	113.5
874	T	30.7	Very low	30.8	Very low	122 Å²	122	138 Å²	138	75%	0.748	71%	0.705	S	S	*	*			trans	-133.9	95.1	166	49	0	0	0	0	110.9	Y872 N876	Y872-T874 PolarHBondContact O-N 2.93Å; T874-N876 VanDerWaalsContact C-N 3.33Å; T874-N876 PolarHBondContact O-N 3.35Å
875	R	28.1	Very low	31.2	Very low	247 Å²	247	132.2 Å²	132.2	93%	0.932	68%	0.679	S	S	*	*			trans	-82.1	72.6	-178.9	-171.9	-174.6	-175.3	170.2	1.9	110.9
876	N	30.9	Very low	32	Very low	154 Å²	154	130.8 Å²	130.8	82%	0.824	66%	0.664	S	S	*	*	S	Bend	trans	-142.5	151.6	170	-86.7	-34.8	0	0	0	110.7	T874	T874-N876 VanDerWaalsContact C-N 3.33Å; T874-N876 PolarHBondContact O-N 3.35Å
877	H	30.3	Very low	32.8	Very low	160 Å²	160	126 Å²	126	74%	0.741	64%	0.638	S	S	*	*			trans	-32.3	139	-168.4	-90.5	-118.4	0	0	0	119.2	E879	H877-E879 VanDerWaalsContact C-N 3.32Å; H877-E879 HydrophobicContact CB-CG 4.36Å; H877-E879 PolarHBondContact O-N 3.03Å
878	P	28.6	Very low	33.8	Very low	133 Å²	133	122.2 Å²	122.2	86%	0.864	62%	0.617	S	S	*	*			trans	-81.9	70.2	169.6	36.1	-35.1	0	0	0	111.7	I880	P878-I880 PolarHBondContact O-N 3.41Å
879	E	31.3	Very low	34.2	Very low	167 Å²	167	116.2 Å²	116.2	78%	0.78	60%	0.599	S	S	*	*			trans	-77.3	106.4	170	-69.5	-161.8	156.3	0	0	111.1	H877 M881	H877-E879 VanDerWaalsContact C-N 3.32Å; H877-E879 HydrophobicContact CB-CG 4.36Å; H877-E879 PolarHBondContact O-N 3.03Å; E879-M881 PolarHBondContact O-N 3.13Å
880	I	33.9	Very low	35	Very low	139 Å²	139	114 Å²	114	71%	0.713	58%	0.58	S	S	*	*			trans	40.6	70.7	160.4	-44.8	-179	0	0	0	113.8	P878 N882	P878-I880 PolarHBondContact O-N 3.41Å; I880-N882 PolarHBondContact O-N 2.86Å
881	M	32.7	Very low	35.7	Very low	179 Å²	179	109.8 Å²	109.8	88%	0.882	56%	0.558	S	S	*	*			trans	-67.2	103.2	169.3	-137.4	-179.6	179.6	0	0	109.4	E879	E879-M881 PolarHBondContact O-N 3.13Å
882	N	40.8	Very low	36.6	Very low	18 Å²	18	112.9 Å²	112.9	10%	0.096	57%	0.57	C	S	.	*			trans	-62.7	134.6	-166.9	-174.3	-8.2	0	0	0	112.6	S259 F260 I880 A884 S885 Y886	S259-N882 VanDerWaalsContact C-ND2 3.32Å; S259-N882 PolarHBondContact O-ND2 3.5Å; F260-N882 WeakPolarHBondContact CD1-OD1 3.1Å; F260-N882 WeakPolarHBondContact CG-OD1 3.38Å; I880-N882 PolarHBondContact O-N 2.86Å; N882-A884 HydrophobicContact CB-CB 4.49Å; N882-A884 VanDerWaalsContact CG-CB 3.49Å; N882-A884 PolarHBondContact O-N 3.12Å; N882-A884 WeakPolarHBondContact OD1-CB 3.16Å; N882-A884 PolarHBondContact OD1-N 3.3Å; N882-A884 VanDerWaalsContact OD1-N 3.1Å; N882-S885 CarbonylContact O-C 3.52Å; N882-S885 WeakPolarHBondContact O-CA 3.44Å; N882-S885 WeakPolarHBondContact O-CB 3.09Å; N882-S885 PolarHBondContact O-N 3.42Å; N882-Y886 PolarHBondContact O-N 3.29Å
883	F	41.8	Very low	37.6	Very low	68 Å²	68	107.8 Å²	107.8	30%	0.298	56%	0.556	S	S	.	*	H	α-helix	trans	-60.6	-29.5	177.4	-174.5	-110.9	0	0	0	111.9	F125 M204 F260 S885 Y886 L887	F125-F883 HydrophobicContact CE1-CD2 4.41Å; M204-F883 HydrophobicContact CE-CE1 4.04Å; F260-F883 HydrophobicContact CE1-CB 3.91Å; F883-S885 VanDerWaalsContact C-N 3.33Å; F883-S885 PolarHBondContact O-N 2.99Å; F883-Y886 PolarHBondContact O-N 2.82Å; F883-L887 HydrophobicContact CD1-CD1 4.02Å; F883-L887 HydrophobicContact CE1-CD1 3.58Å; F883-L887 HydrophobicContact CE1-CG 4.17Å; F883-L887 HydrophobicContact CZ-CD1 4.05Å; F883-L887 HydrophobicContact CZ-CD2 4.4Å; F883-L887 HydrophobicContact CZ-CG 4.23Å; F883-L887 PolarHBondContact O-N 3.43Å; F883-L887 VanDerWaalsContact O-N 3.08Å
884	A	40	Very low	39.3	Very low	8 Å²	8	112.4 Å²	112.4	7%	0.066	55%	0.548	C	S	.	.	H	α-helix	trans	-51.8	-51.6	166.6	0	0	0	0	0	112	L261 N882 Y886 L887 W888	L261-A884 HydrophobicContact CB-CB 4.32Å; L261-A884 HydrophobicContact CD1-CB 4.48Å; L261-A884 HydrophobicContact CD2-CB 3.7Å; L261-A884 HydrophobicContact CG-CB 3.5Å; N882-A884 HydrophobicContact CB-CB 4.49Å; N882-A884 VanDerWaalsContact CG-CB 3.49Å; N882-A884 PolarHBondContact O-N 3.12Å; N882-A884 WeakPolarHBondContact OD1-CB 3.16Å; N882-A884 PolarHBondContact OD1-N 3.3Å; N882-A884 VanDerWaalsContact OD1-N 3.1Å; A884-Y886 VanDerWaalsContact C-N 3.34Å; A884-L887 PolarHBondContact O-N 3.02Å; A884-W888 PolarHBondContact O-N 2.89Å
885	S	40	Very low	41.2	Very low	44 Å²	44	108.6 Å²	108.6	31%	0.308	53%	0.533	S	S	.	.	H	α-helix	trans	-69.9	-31	179.9	-56.7	0	0	0	0	111.6	N882 F883 N889	N882-S885 CarbonylContact O-C 3.52Å; N882-S885 WeakPolarHBondContact O-CA 3.44Å; N882-S885 WeakPolarHBondContact O-CB 3.09Å; N882-S885 PolarHBondContact O-N 3.42Å; F883-S885 VanDerWaalsContact C-N 3.33Å; F883-S885 PolarHBondContact O-N 2.99Å; S885-N889 CarbonylContact O-C 3.51Å; S885-N889 WeakPolarHBondContact O-CA 3.4Å; S885-N889 VanDerWaalsContact O-CB 3.29Å; S885-N889 WeakPolarHBondContact O-CB 3.46Å; S885-N889 PolarHBondContact O-N 2.96Å
886	Y	43.8	Very low	44	Very low	114 Å²	114	97.2 Å²	97.2	45%	0.447	49%	0.491	S	S	.	.	H	α-helix	trans	-68	-39.2	175.1	-164.2	-88.8	0	0	0	112.5	V124 N882 F883 A884	V124-Y886 PolarHBondContact O-OH 2.32Å; N882-Y886 PolarHBondContact O-N 3.29Å; F883-Y886 PolarHBondContact O-N 2.82Å; A884-Y886 VanDerWaalsContact C-N 3.34Å
887	L	45	Very low	46.6	Very low	40 Å²	40	94.1 Å²	94.1	21%	0.209	47%	0.474	C	S	.	.	H	α-helix	trans	-72.7	-27.9	178.6	-73.6	175.9	0	0	0	114.3	F883 A884	F883-L887 HydrophobicContact CD1-CD1 4.02Å; F883-L887 HydrophobicContact CE1-CD1 3.58Å; F883-L887 HydrophobicContact CE1-CG 4.17Å; F883-L887 HydrophobicContact CZ-CD1 4.05Å; F883-L887 HydrophobicContact CZ-CD2 4.4Å; F883-L887 HydrophobicContact CZ-CG 4.23Å; F883-L887 PolarHBondContact O-N 3.43Å; F883-L887 VanDerWaalsContact O-N 3.08Å; A884-L887 PolarHBondContact O-N 3.02Å
888	W	47.7	Very low	49.4	Very low	91 Å²	91	88.2 Å²	88.2	35%	0.345	45%	0.45	S	S	.	.	H	α-helix	trans	-120.4	-32.4	-170.9	-69	92.2	0	0	0	114.9	L265 I294 F295 A884	L265-W888 HydrophobicContact CD2-CD2 4.14Å; L265-W888 HydrophobicContact CD2-CE3 4.04Å; L265-W888 HydrophobicContact CD2-CH2 3.79Å; L265-W888 HydrophobicContact CD2-CZ2 3.88Å; L265-W888 HydrophobicContact CD2-CZ3 3.88Å; L265-W888 HydrophobicContact CG-CH2 4.26Å; L265-W888 HydrophobicContact CG-CZ2 4.46Å; I294-W888 HydrophobicContact CD1-CD2 4.17Å; I294-W888 VanDerWaalsContact CD1-CE2 3.48Å; I294-W888 HydrophobicContact CD1-CE3 4.43Å; I294-W888 HydrophobicContact CD1-CH2 3.51Å; I294-W888 HydrophobicContact CD1-CZ2 3.13Å; I294-W888 HydrophobicContact CD1-CZ3 4.13Å; F295-W888 HydrophobicContact CE2-CH2 4.06Å; F295-W888 AromaticContact CE2-CZ3 3.89Å; F295-W888 HydrophobicContact CE2-CZ3 3.89Å; F295-W888 AromaticContact CZ-CH2 3.84Å; F295-W888 HydrophobicContact CZ-CH2 3.84Å; F295-W888 AromaticContact CZ-CZ3 3.91Å; F295-W888 HydrophobicContact CZ-CZ3 3.91Å; A884-W888 PolarHBondContact O-N 2.89Å
889	N	35.1	Very low	52.3	Low	86 Å²	86	88.6 Å²	88.6	46%	0.46	44%	0.44	S	S	.	.			trans	-110.8	66.4	-176.1	-172.2	42.8	0	0	0	111.7	S885 N891	S885-N889 CarbonylContact O-C 3.51Å; S885-N889 WeakPolarHBondContact O-CA 3.4Å; S885-N889 VanDerWaalsContact O-CB 3.29Å; S885-N889 WeakPolarHBondContact O-CB 3.46Å; S885-N889 PolarHBondContact O-N 2.96Å; N889-N891 PolarHBondContact O-N 3.05Å
890	I	47.4	Very low	55.1	Low	62 Å²	62	83 Å²	83	32%	0.318	42%	0.415	S	S	.	.			trans	-69.5	121.4	140	-47.3	-177.4	0	0	0	104.6	K291 V835	K291-I890 HydrophobicContact CD-CD1 4.29Å; K291-I890 HydrophobicContact CG-CD1 4.07Å; V835-I890 HydrophobicContact CG1-CD1 4.36Å
891	N	39.6	Very low	57.8	Low	77 Å²	77	77 Å²	77	41%	0.412	38%	0.384	S	S	.	.			trans	-44.5	158.9	168	-73.1	-7.8	0	0	0	110.1	Y872 N889 V893	Y872-N891 PolarHBondContact OH-ND2 3.19Å; Y872-N891 VanDerWaalsContact OH-ND2 3.09Å; N889-N891 PolarHBondContact O-N 3.05Å; N891-V893 WeakPolarHBondContact O-CG2 3.23Å; N891-V893 PolarHBondContact O-N 2.03Å
892	E	47.5	Very low	60.7	Low	201 Å²	201	69.8 Å²	69.8	94%	0.939	35%	0.349	S	S	*	.	S	Bend	trans	-69.5	55.8	-168.2	-160.7	164.5	-145.4	0	0	115.3	Y894	E892-Y894 PolarHBondContact O-N 3.31Å
893	V	50.6	Low	63.2	Low	67 Å²	67	71.9 Å²	71.9	41%	0.406	36%	0.359	S	S	.	.			trans	-82.1	95.9	-179.6	177.5	0	0	0	0	107.1	K291 N891	K291-V893 PolarHBondContact NZ-O 3.04Å; N891-V893 WeakPolarHBondContact O-CG2 3.23Å; N891-V893 PolarHBondContact O-N 2.03Å
894	Y	59.7	Low	65.7	Low	184 Å²	184	70 Å²	70	72%	0.722	35%	0.351	S	S	*	.			trans	46	91.1	167.2	-58.4	-80.1	0	0	0	115.1	W832 E892	W832-Y894 VanDerWaalsContact CD1-O 3.25Å; E892-Y894 PolarHBondContact O-N 3.31Å
895	G	70.2	Confident	68.2	Low	41 Å²	41	70 Å²	70	42%	0.423	35%	0.349	S	S	.	.			trans	-77.4	169.6	151.1	0	0	0	0	0	111.6
896	P	86.3	Confident	70.9	Confident	8 Å²	8	71.7 Å²	71.7	5%	0.052	35%	0.351	C	S	.	.			trans	-73.3	132	167.2	26.8	-30.1	0	0	0	111.5	L314 Y315 W832 P898 F901	L314-P896 HydrophobicContact CB-CG 3.9Å; L314-P896 HydrophobicContact CD2-CG 3.97Å; L314-P896 HydrophobicContact CG-CG 3.81Å; Y315-P896 HydrophobicContact CE1-CB 4.18Å; Y315-P896 HydrophobicContact CE1-CG 3.72Å; Y315-P896 WeakPolarHBondContact CE1-O 3.47Å; W832-P896 HydrophobicContact CD2-CB 3.73Å; W832-P896 HydrophobicContact CD2-CG 4.19Å; W832-P896 HydrophobicContact CE3-CB 3.77Å; W832-P896 HydrophobicContact CE3-CG 4.27Å; W832-P896 HydrophobicContact CG-CB 4.4Å; W832-P896 HydrophobicContact CG-CG 4.45Å; W832-P896 HydrophobicContact CH2-CB 3.97Å; W832-P896 HydrophobicContact CZ2-CB 3.87Å; W832-P896 HydrophobicContact CZ3-CB 3.91Å; P896-P898 VanDerWaalsContact O-CD 3.28Å; P896-P898 WeakPolarHBondContact O-CD 3.29Å; P896-F901 HydrophobicContact CB-CE2 3.86Å; P896-F901 HydrophobicContact CB-CZ 4.27Å
897	N	86.5	Confident	73.3	Confident	90 Å²	90	68.1 Å²	68.1	48%	0.481	34%	0.339	S	S	.	.			trans	-71.4	112.2	175.1	-67	4	0	0	0	110	E899 L900 F901	N897-E899 PolarHBondContact O-N 3.26Å; N897-L900 PolarHBondContact O-N 3.28Å; N897-F901 WeakPolarHBondContact O-CD2 3.43Å
898	P	88.3	Confident	75.7	Confident	36 Å²	36	66.4 Å²	66.4	23%	0.234	33%	0.33	C	S	.	.	H	α-helix	trans	-63.1	-27.7	-175.2	25.4	-34.2	0	0	0	112.7	Y315 L636 P896 L900 F901 M902	Y315-P898 HydrophobicContact CD1-CB 3.98Å; Y315-P898 HydrophobicContact CE1-CB 3.79Å; L636-P898 HydrophobicContact CD1-CB 4.36Å; L636-P898 HydrophobicContact CD2-CB 4.5Å; P896-P898 VanDerWaalsContact O-CD 3.28Å; P896-P898 WeakPolarHBondContact O-CD 3.29Å; P898-L900 VanDerWaalsContact C-N 3.25Å; P898-L900 PolarHBondContact O-N 2.78Å; P898-F901 PolarHBondContact O-N 3.49Å; P898-F901 VanDerWaalsContact O-N 3.11Å; P898-M902 PolarHBondContact O-N 2.76Å
899	E	89.3	Confident	77.9	Confident	140 Å²	140	62.1 Å²	62.1	65%	0.654	31%	0.314	S	S	*	.	H	α-helix	trans	-54.5	-37.1	177.2	-57.8	178.7	145.5	0	0	113	N897 M902 L903	N897-E899 PolarHBondContact O-N 3.26Å; E899-M902 HydrophobicContact CG-CE 4.42Å; E899-M902 PolarHBondContact O-N 2.9Å; E899-L903 WeakPolarHBondContact O-CB 3.08Å; E899-L903 PolarHBondContact O-N 2.04Å
900	L	90.7	Very high	80.8	Confident	49 Å²	49	59.5 Å²	59.5	26%	0.257	30%	0.301	S	S	.	.	H	α-helix	trans	-71.5	-34.7	-180	-165.9	75.7	0	0	0	112	C821 Y824 N897 P898 L903 R904	C821-L900 HydrophobicContact CB-CD2 4.49Å; C821-L900 HydrophobicContact CB-CG 4.23Å; Y824-L900 HydrophobicContact CD1-CD2 3.14Å; Y824-L900 HydrophobicContact CD2-CD2 4.26Å; Y824-L900 HydrophobicContact CE1-CD2 3.63Å; Y824-L900 HydrophobicContact CG-CD2 3.49Å; Y824-L900 VanDerWaalsContact CG-CD2 3.49Å; N897-L900 PolarHBondContact O-N 3.28Å; P898-L900 VanDerWaalsContact C-N 3.25Å; P898-L900 PolarHBondContact O-N 2.78Å; L900-L903 HydrophobicContact CD1-CD2 4.2Å; L900-L903 WeakPolarHBondContact O-CB 3.43Å; L900-L903 PolarHBondContact O-N 3.46Å; L900-R904 PolarHBondContact O-N 2.87Å
901	F	91	Very high	82.9	Confident	14 Å²	14	56.5 Å²	56.5	6%	0.061	29%	0.286	C	S	.	.	H	α-helix	trans	-71	-37.6	175.5	-62.4	-94.5	0	0	0	110.9	Y315 L636 E825 W832 P896 N897 P898 I905	Y315-F901 VanDerWaalsContact OH-CD2 3.27Å; Y315-F901 WeakPolarHBondContact OH-CD2 3.39Å; Y315-F901 WeakPolarHBondContact OH-CE2 3.41Å; L636-F901 HydrophobicContact CD2-CB 3.81Å; E825-F901 HydrophobicContact CB-CE1 4.3Å; E825-F901 HydrophobicContact CB-CZ 4.5Å; E825-F901 HydrophobicContact CG-CE1 3.96Å; E825-F901 HydrophobicContact CG-CZ 4.31Å; W832-F901 HydrophobicContact CH2-CZ 4.07Å; W832-F901 AromaticContact CZ3-CZ 3.97Å; W832-F901 HydrophobicContact CZ3-CZ 3.97Å; P896-F901 HydrophobicContact CB-CE2 3.86Å; P896-F901 HydrophobicContact CB-CZ 4.27Å; N897-F901 WeakPolarHBondContact O-CD2 3.43Å; P898-F901 PolarHBondContact O-N 3.49Å; P898-F901 VanDerWaalsContact O-N 3.11Å; F901-I905 WeakPolarHBondContact O-CD1 3.34Å; F901-I905 WeakPolarHBondContact O-CG1 3.09Å; F901-I905 PolarHBondContact O-N 3.04Å
902	M	92.6	Very high	85.4	Confident	27 Å²	27	52.9 Å²	52.9	13%	0.133	27%	0.266	C	S	.	.	H	α-helix	trans	-63.7	-43.5	169.7	-70.3	-167	-67.2	0	0	111.6	W326 P898 E899 R904 I905 F906	W326-M902 HydrophobicContact CE3-CB 4.21Å; W326-M902 HydrophobicContact CE3-CG 4.28Å; W326-M902 HydrophobicContact CE3-SD 4.27Å; W326-M902 HydrophobicContact CH2-CB 3.83Å; W326-M902 WeakPolarHBondContact CH2-O 3.47Å; W326-M902 HydrophobicContact CZ3-CB 3.57Å; W326-M902 HydrophobicContact CZ3-CG 4.11Å; W326-M902 WeakPolarHBondContact CZ3-O 3.37Å; P898-M902 PolarHBondContact O-N 2.76Å; E899-M902 HydrophobicContact CG-CE 4.42Å; E899-M902 PolarHBondContact O-N 2.9Å; M902-R904 PolarHBondContact O-N 3.43Å; M902-I905 PolarHBondContact O-N 3.4Å; M902-F906 PolarHBondContact O-N 3.39Å
903	L	93.6	Very high	87.5	Confident	62 Å²	62	45.8 Å²	45.8	33%	0.325	23%	0.232	S	C	.	.	H	α-helix	trans	-58.5	-45	176.5	-177.7	65.7	0	0	0	112.2	E899 L900 I905 F906 M907	E899-L903 WeakPolarHBondContact O-CB 3.08Å; E899-L903 PolarHBondContact O-N 2.04Å; L900-L903 HydrophobicContact CD1-CD2 4.2Å; L900-L903 WeakPolarHBondContact O-CB 3.43Å; L900-L903 PolarHBondContact O-N 3.46Å; L903-I905 VanDerWaalsContact C-N 3.33Å; L903-I905 PolarHBondContact O-N 3.19Å; L903-F906 PolarHBondContact O-N 2.96Å; L903-M907 HydrophobicContact CD1-CE 3.74Å; L903-M907 HydrophobicContact CD1-CG 4.19Å; L903-M907 HydrophobicContact CG-CG 4.43Å; L903-M907 WeakPolarHBondContact O-CB 3.48Å; L903-M907 WeakPolarHBondContact O-CG 3.42Å; L903-M907 PolarHBondContact O-N 2.94Å
904	R	94.6	Very high	89.4	Confident	30 Å²	30	44.2 Å²	44.2	11%	0.113	22%	0.223	C	C	.	.	H	α-helix	trans	-54.6	-48.1	174.3	-179.2	177.5	64.3	-167	-6.4	111.6	M818 C821 D822 E825 L900 M902 M907 S908	M818-R904 HydrophobicContact CB-CG 4.32Å; M818-R904 HydrophobicContact CG-CG 4.15Å; C821-R904 HydrophobicContact CB-CB 3.88Å; C821-R904 HydrophobicContact CB-CG 4.29Å; D822-R904 WeakPolarHBondContact OD1-CD 3.36Å; D822-R904 IonicContact OD1-CZ 2.71Å; D822-R904 IonicContact OD1-NE 3.92Å; D822-R904 IonicContact OD1-NH1 3.68Å; D822-R904 PolarHBondContact OD1-NH1 3.26Å; E825-R904 IonicContact OE2-CZ 3.56Å; E825-R904 IonicContact OE2-NH1 2.67Å; E825-R904 PolarHBondContact OE2-NH1 2.69Å; E825-R904 IonicContact OE2-NH2 3.14Å; E825-R904 PolarHBondContact OE2-NH2 3.05Å; L900-R904 PolarHBondContact O-N 2.87Å; M902-R904 PolarHBondContact O-N 3.43Å; R904-M907 PolarHBondContact O-N 3.42Å; R904-S908 PolarHBondContact O-N 3.47Å
905	I	93.4	Very high	90.8	Very high	7 Å²	7	35.4 Å²	35.4	4%	0.036	19%	0.189	C	C	.	.	H	α-helix	trans	-68.2	-42.9	-177.4	-62.4	163.1	0	0	0	110.9	T327 F373 I637 F901 M902 L903 S908 L909	T327-I905 HydrophobicContact CG2-CB 4.32Å; T327-I905 HydrophobicContact CG2-CD1 3.84Å; T327-I905 HydrophobicContact CG2-CG2 3.83Å; F373-I905 HydrophobicContact CE1-CG2 4.45Å; F373-I905 HydrophobicContact CE2-CG2 4.33Å; F373-I905 HydrophobicContact CZ-CG2 3.97Å; I637-I905 HydrophobicContact CD1-CD1 3.72Å; F901-I905 WeakPolarHBondContact O-CD1 3.34Å; F901-I905 WeakPolarHBondContact O-CG1 3.09Å; F901-I905 PolarHBondContact O-N 3.04Å; M902-I905 PolarHBondContact O-N 3.4Å; L903-I905 VanDerWaalsContact C-N 3.33Å; L903-I905 PolarHBondContact O-N 3.19Å; I905-S908 WeakPolarHBondContact O-CB 3.4Å; I905-S908 PolarHBondContact O-N 2.85Å; I905-L909 HydrophobicContact CG2-CD1 4.12Å; I905-L909 WeakPolarHBondContact O-CG 3.2Å; I905-L909 PolarHBondContact O-N 3.29Å
906	F	95	Very high	91.7	Very high	79 Å²	79	33.5 Å²	33.5	35%	0.346	17%	0.169	S	C	.	.	H	α-helix	trans	-60.4	-48.2	174.9	166.2	-95.7	0	0	0	112	W326 L330 M902 L903 S908 L909 V910	W326-F906 HydrophobicContact CH2-CB 3.5Å; W326-F906 HydrophobicContact CH2-CG 4.32Å; W326-F906 HydrophobicContact CZ2-CB 4.24Å; W326-F906 HydrophobicContact CZ3-CB 4.2Å; L330-F906 HydrophobicContact CD1-CB 4.46Å; L330-F906 HydrophobicContact CD1-CD2 4.02Å; M902-F906 PolarHBondContact O-N 3.39Å; L903-F906 PolarHBondContact O-N 2.96Å; F906-S908 VanDerWaalsContact C-N 3.26Å; F906-S908 PolarHBondContact O-N 2.91Å; F906-L909 PolarHBondContact O-N 3.17Å; F906-L909 VanDerWaalsContact O-N 3.16Å; F906-V910 HydrophobicContact CD1-CG2 4.08Å; F906-V910 HydrophobicContact CD2-CG2 4.13Å; F906-V910 HydrophobicContact CE1-CG2 3.74Å; F906-V910 HydrophobicContact CE2-CG2 3.8Å; F906-V910 HydrophobicContact CG-CG2 4.27Å; F906-V910 HydrophobicContact CZ-CG2 3.59Å; F906-V910 WeakPolarHBondContact O-CB 3.04Å; F906-V910 VanDerWaalsContact O-CG2 3.26Å; F906-V910 WeakPolarHBondContact O-CG2 3.09Å; F906-V910 PolarHBondContact O-N 3.49Å
907	M	95.5	Very high	91.7	Very high	40 Å²	40	37.7 Å²	37.7	20%	0.197	19%	0.19	C	C	.	.	H	α-helix	trans	-61.3	-37.3	177.8	-70.6	-65.3	173.8	0	0	111.8	P814 C817 M818 L903 R904 V910	P814-M907 HydrophobicContact CB-CB 4.32Å; P814-M907 WeakPolarHBondContact CB-O 3.43Å; C817-M907 HydrophobicContact CB-CG 4Å; M818-M907 HydrophobicContact CG-CB 4.04Å; L903-M907 HydrophobicContact CD1-CE 3.74Å; L903-M907 HydrophobicContact CD1-CG 4.19Å; L903-M907 HydrophobicContact CG-CG 4.43Å; L903-M907 WeakPolarHBondContact O-CB 3.48Å; L903-M907 WeakPolarHBondContact O-CG 3.42Å; L903-M907 PolarHBondContact O-N 2.94Å; R904-M907 PolarHBondContact O-N 3.42Å; M907-V910 PolarHBondContact O-N 3.43Å
908	S	94.7	Very high	91.5	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.021	17%	0.171	C	C	.	.	H	α-helix	trans	-58.6	-55.2	171.3	-152	0	0	0	0	111.5	Y369 M818 R904 I905 F906 V910 T911	Y369-S908 WeakPolarHBondContact CE1-OG 3.38Å; M818-S908 WeakPolarHBondContact SD-CA 3.03Å; M818-S908 WeakPolarHBondContact SD-CB 3.3Å; M818-S908 PolarHBondContact SD-OG 3.49Å; M818-S908 VanDerWaalsContact SD-OG 3.41Å; R904-S908 PolarHBondContact O-N 3.47Å; I905-S908 WeakPolarHBondContact O-CB 3.4Å; I905-S908 PolarHBondContact O-N 2.85Å; F906-S908 VanDerWaalsContact C-N 3.26Å; F906-S908 PolarHBondContact O-N 2.91Å; S908-V910 VanDerWaalsContact C-N 3.32Å; S908-V910 PolarHBondContact O-N 2.92Å; S908-T911 WeakPolarHBondContact O-CB 3.47Å; S908-T911 PolarHBondContact O-N 3.3Å; S908-T911 VanDerWaalsContact O-N 3.11Å; S908-T911 PolarHBondContact O-OG1 3.43Å
909	L	94.9	Very high	91.1	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-61.9	-36.6	-179.5	-67.4	172.9	0	0	0	112.7	L330 A331 C334 Y369 A370 I905 F906 T911 G912 F913	L330-L909 HydrophobicContact CB-CD1 3.66Å; A331-L909 HydrophobicContact CB-CD1 4.3Å; A331-L909 HydrophobicContact CB-CD2 4.41Å; C334-L909 HydrophobicContact CB-CD2 4.18Å; C334-L909 PolarHBondContact SG-O 3.49Å; C334-L909 VanDerWaalsContact SG-O 3.36Å; Y369-L909 HydrophobicContact CD1-CD2 4.43Å; A370-L909 HydrophobicContact CB-CD2 3.84Å; I905-L909 HydrophobicContact CG2-CD1 4.12Å; I905-L909 WeakPolarHBondContact O-CG 3.2Å; I905-L909 PolarHBondContact O-N 3.29Å; F906-L909 PolarHBondContact O-N 3.17Å; F906-L909 VanDerWaalsContact O-N 3.16Å; L909-T911 PolarHBondContact O-N 2.94Å; L909-T911 VanDerWaalsContact O-N 3.14Å; L909-G912 PolarHBondContact O-N 3.29Å; L909-F913 VanDerWaalsContact O-CD2 3.3Å; L909-F913 WeakPolarHBondContact O-CD2 3.38Å
910	V	94.3	Very high	90.6	Very high	31 Å²	31	30.9 Å²	30.9	19%	0.188	15%	0.148	C	C	.	.	H	α-helix	trans	-53.5	-31.3	175.4	162.8	0	0	0	0	112.2	P814 F906 M907 S908 G912 F913 T914	P814-V910 HydrophobicContact CG-CG1 4.21Å; F906-V910 HydrophobicContact CD1-CG2 4.08Å; F906-V910 HydrophobicContact CD2-CG2 4.13Å; F906-V910 HydrophobicContact CE1-CG2 3.74Å; F906-V910 HydrophobicContact CE2-CG2 3.8Å; F906-V910 HydrophobicContact CG-CG2 4.27Å; F906-V910 HydrophobicContact CZ-CG2 3.59Å; F906-V910 WeakPolarHBondContact O-CB 3.04Å; F906-V910 VanDerWaalsContact O-CG2 3.26Å; F906-V910 WeakPolarHBondContact O-CG2 3.09Å; F906-V910 PolarHBondContact O-N 3.49Å; M907-V910 PolarHBondContact O-N 3.43Å; S908-V910 VanDerWaalsContact C-N 3.32Å; S908-V910 PolarHBondContact O-N 2.92Å; V910-G912 VanDerWaalsContact C-N 3.31Å; V910-G912 PolarHBondContact O-N 3.49Å; V910-F913 WeakPolarHBondContact O-CB 3.27Å; V910-F913 PolarHBondContact O-N 3.34Å; V910-F913 VanDerWaalsContact O-N 3.14Å; V910-T914 HydrophobicContact CG1-CG2 4.21Å; V910-T914 PolarHBondContact O-N 3.32Å
911	T	92.7	Very high	89.9	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-35.7	175.7	68	0	0	0	0	113.1	Q366 Y811 P814 S908 L909 T914 C915	Q366-T911 WeakPolarHBondContact CG-OG1 3.44Å; Q366-T911 PolarHBondContact NE2-OG1 2.81Å; Q366-T911 PolarHBondContact OE1-OG1 3.19Å; Y811-T911 HydrophobicContact CD2-CG2 4.47Å; Y811-T911 HydrophobicContact CE1-CG2 4.12Å; Y811-T911 HydrophobicContact CE2-CG2 3.93Å; P814-T911 HydrophobicContact CB-CG2 3.74Å; P814-T911 HydrophobicContact CG-CG2 4.22Å; S908-T911 WeakPolarHBondContact O-CB 3.47Å; S908-T911 PolarHBondContact O-N 3.3Å; S908-T911 VanDerWaalsContact O-N 3.11Å; S908-T911 PolarHBondContact O-OG1 3.43Å; L909-T911 PolarHBondContact O-N 2.94Å; L909-T911 VanDerWaalsContact O-N 3.14Å; T911-T914 PolarHBondContact O-N 3.08Å; T911-T914 PolarHBondContact O-OG1 2.86Å; T911-T914 VanDerWaalsContact O-OG1 3.07Å; T911-C915 PolarHBondContact O-N 3Å; T911-C915 VanDerWaalsContact O-N 3.09Å; T911-C915 PolarHBondContact O-SG 2.89Å; T911-C915 VanDerWaalsContact O-SG 3.35Å
912	G	91.5	Very high	88.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66.6	-35.6	173.4	0	0	0	0	0	112.9	L909 V910 S916	L909-G912 PolarHBondContact O-N 3.29Å; V910-G912 VanDerWaalsContact C-N 3.31Å; V910-G912 PolarHBondContact O-N 3.49Å; G912-S916 WeakPolarHBondContact O-CB 3.49Å; G912-S916 PolarHBondContact O-N 2.99Å; G912-S916 PolarHBondContact O-OG 3.15Å
913	F	90.9	Very high	87.2	Confident	52 Å²	52	34.2 Å²	34.2	23%	0.228	17%	0.169	C	C	.	.	H	α-helix	trans	-66.7	-45.8	172.3	-67.8	-98.6	0	0	0	111.6	I333 C334 I337 L909 V910 C915 S916 L917	I333-F913 HydrophobicContact CB-CZ 4.27Å; I333-F913 HydrophobicContact CG2-CE1 3.71Å; I333-F913 HydrophobicContact CG2-CZ 3.7Å; C334-F913 HydrophobicContact CB-CD2 4.32Å; C334-F913 HydrophobicContact CB-CE2 3.7Å; C334-F913 HydrophobicContact CB-CZ 4.18Å; I337-F913 HydrophobicContact CD1-CD1 3.82Å; I337-F913 HydrophobicContact CD1-CE1 3.55Å; L909-F913 VanDerWaalsContact O-CD2 3.3Å; L909-F913 WeakPolarHBondContact O-CD2 3.38Å; V910-F913 WeakPolarHBondContact O-CB 3.27Å; V910-F913 PolarHBondContact O-N 3.34Å; V910-F913 VanDerWaalsContact O-N 3.14Å; F913-C915 PolarHBondContact O-N 3.31Å; F913-S916 PolarHBondContact O-N 2.04Å; F913-S916 VanDerWaalsContact O-N 3.17Å; F913-L917 WeakPolarHBondContact O-CB 3.24Å; F913-L917 VanDerWaalsContact O-CG 3.32Å; F913-L917 WeakPolarHBondContact O-CG 3.31Å; F913-L917 PolarHBondContact O-N 2.98Å
914	T	90.6	Very high	85.3	Confident	34 Å²	34	31.6 Å²	31.6	21%	0.209	16%	0.157	C	C	.	.	H	α-helix	trans	-66.6	-39.1	-178	60.3	0	0	0	0	112.5	V910 T911 S916 W918	V910-T914 HydrophobicContact CG1-CG2 4.21Å; V910-T914 PolarHBondContact O-N 3.32Å; T911-T914 PolarHBondContact O-N 3.08Å; T911-T914 PolarHBondContact O-OG1 2.86Å; T911-T914 VanDerWaalsContact O-OG1 3.07Å; T914-S916 VanDerWaalsContact C-N 3.32Å; T914-S916 PolarHBondContact O-N 2.79Å; T914-W918 WeakPolarHBondContact O-CB 3.49Å; T914-W918 PolarHBondContact O-N 3.14Å
915	C	90.9	Very high	83.1	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-57.4	-44.2	170	-72.4	0	0	0	0	112.4	I359 I362 A363 T911 F913 M919	I359-C915 HydrophobicContact CG2-CB 4.46Å; I362-C915 WeakPolarHBondContact CG2-SG 3.38Å; A363-C915 HydrophobicContact CB-CB 4.1Å; T911-C915 PolarHBondContact O-N 3Å; T911-C915 VanDerWaalsContact O-N 3.09Å; T911-C915 PolarHBondContact O-SG 2.89Å; T911-C915 VanDerWaalsContact O-SG 3.35Å; F913-C915 PolarHBondContact O-N 3.31Å; C915-M919 WeakPolarHBondContact O-CG 3.06Å; C915-M919 PolarHBondContact O-N 3.07Å
916	S	88.5	Confident	80.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-70.4	-44.7	-177.5	-59.3	0	0	0	0	112.3	T341 G912 F913 T914 W918 M919 W920	T341-S916 WeakPolarHBondContact OG1-CB 3.48Å; T341-S916 PolarHBondContact OG1-OG 2.94Å; G912-S916 WeakPolarHBondContact O-CB 3.49Å; G912-S916 PolarHBondContact O-N 2.99Å; G912-S916 PolarHBondContact O-OG 3.15Å; F913-S916 PolarHBondContact O-N 2.04Å; F913-S916 VanDerWaalsContact O-N 3.17Å; T914-S916 VanDerWaalsContact C-N 3.32Å; T914-S916 PolarHBondContact O-N 2.79Å; S916-W918 PolarHBondContact O-N 2.93Å; S916-M919 WeakPolarHBondContact O-CB 3.03Å; S916-M919 PolarHBondContact O-N 2.95Å; S916-W920 VanDerWaalsContact O-CG 3.29Å; S916-W920 PolarHBondContact O-N 3.36Å; S916-W920 VanDerWaalsContact O-N 3.14Å; S916-W920 PolarHBondContact O-NE1 3.35Å
917	L	85.9	Confident	78.6	Confident	96 Å²	96	40.8 Å²	40.8	50%	0.503	22%	0.218	S	C	.	.	H	α-helix	trans	-59.7	-44.5	174	-71.4	170	0	0	0	111.4	F913 M919 W920 T921	F913-L917 WeakPolarHBondContact O-CB 3.24Å; F913-L917 VanDerWaalsContact O-CG 3.32Å; F913-L917 WeakPolarHBondContact O-CG 3.31Å; F913-L917 PolarHBondContact O-N 2.98Å; L917-M919 VanDerWaalsContact C-N 3.34Å; L917-M919 PolarHBondContact O-N 3.48Å; L917-W920 HydrophobicContact CD2-CE3 4.23Å; L917-W920 HydrophobicContact CD2-CZ3 4.33Å; L917-W920 PolarHBondContact O-N 3.31Å; L917-W920 VanDerWaalsContact O-N 3.08Å; L917-T921 WeakPolarHBondContact O-CG2 3.33Å; L917-T921 PolarHBondContact O-N 3.47Å
918	W	83.2	Confident	76.3	Confident	20 Å²	20	41 Å²	41	8%	0.076	22%	0.223	C	C	.	.	H	α-helix	trans	-55.1	-49.6	176.6	-175.4	92.5	0	0	0	111.5	E356 I359 M800 I804 F807 T914 S916 W920 T921 V922	E356-W918 HydrophobicContact CB-CH2 4.11Å; E356-W918 HydrophobicContact CG-CH2 4.02Å; I359-W918 HydrophobicContact CB-CZ3 4.5Å; I359-W918 HydrophobicContact CD1-CD2 3.96Å; I359-W918 HydrophobicContact CD1-CE3 3.93Å; I359-W918 HydrophobicContact CD1-CH2 3.54Å; I359-W918 HydrophobicContact CD1-CZ2 3.54Å; I359-W918 HydrophobicContact CD1-CZ3 3.74Å; I359-W918 HydrophobicContact CG2-CD2 4.48Å; I359-W918 HydrophobicContact CG2-CE3 3.95Å; I359-W918 HydrophobicContact CG2-CZ3 4.31Å; M800-W918 HydrophobicContact CE-CH2 3.6Å; M800-W918 HydrophobicContact CE-CZ2 3.51Å; I804-W918 HydrophobicContact CG1-CZ2 4.21Å; F807-W918 HydrophobicContact CD2-CB 4.01Å; F807-W918 AromaticContact CD2-CD1 3.81Å; F807-W918 AromaticContact CD2-CG 3.96Å; F807-W918 HydrophobicContact CD2-CG 3.96Å; F807-W918 HydrophobicContact CE2-CB 4.4Å; F807-W918 AromaticContact CG-CD1 3.93Å; F807-W918 HydrophobicContact CG-CG 4.37Å; T914-W918 WeakPolarHBondContact O-CB 3.49Å; T914-W918 PolarHBondContact O-N 3.14Å; S916-W918 PolarHBondContact O-N 2.93Å; W918-W920 VanDerWaalsContact C-N 3.25Å; W918-W920 PolarHBondContact O-N 2.84Å; W918-T921 PolarHBondContact O-N 3.21Å; W918-T921 VanDerWaalsContact O-N 3.09Å; W918-T921 PolarHBondContact O-OG1 3.32Å; W918-V922 HydrophobicContact CD2-CG2 4.12Å; W918-V922 HydrophobicContact CE3-CG2 4.28Å; W918-V922 HydrophobicContact CH2-CG2 4.14Å; W918-V922 HydrophobicContact CZ2-CG2 3.98Å; W918-V922 HydrophobicContact CZ3-CG2 4.29Å; W918-V922 PolarHBondContact O-N 3.16Å
919	M	79	Confident	74.3	Confident	17 Å²	17	45.2 Å²	45.2	8%	0.084	25%	0.252	C	S	.	.	H	α-helix	trans	-56.7	-37.5	176.7	-76.1	-73.5	-76.5	0	0	112.9	T341 Y345 F352 I360 C915 S916 L917	T341-M919 HydrophobicContact CG2-CB 3.66Å; T341-M919 HydrophobicContact CG2-CE 4.16Å; T341-M919 HydrophobicContact CG2-CG 3.65Å; Y345-M919 HydrophobicContact CD2-CE 4.4Å; F352-M919 HydrophobicContact CD1-CE 4.32Å; F352-M919 HydrophobicContact CD1-SD 4.44Å; F352-M919 HydrophobicContact CE1-CE 3.41Å; F352-M919 VanDerWaalsContact CE1-CE 3.41Å; F352-M919 HydrophobicContact CE1-SD 3.8Å; F352-M919 HydrophobicContact CZ-CE 3.63Å; I360-M919 HydrophobicContact CD1-CE 3.35Å; I360-M919 HydrophobicContact CD1-CG 4.47Å; I360-M919 HydrophobicContact CD1-SD 3.44Å; I360-M919 WeakPolarHBondContact CD1-SD 3.41Å; C915-M919 WeakPolarHBondContact O-CG 3.06Å; C915-M919 PolarHBondContact O-N 3.07Å; S916-M919 WeakPolarHBondContact O-CB 3.03Å; S916-M919 PolarHBondContact O-N 2.95Å; L917-M919 VanDerWaalsContact C-N 3.34Å; L917-M919 PolarHBondContact O-N 3.48Å
920	W	78.4	Confident	72.3	Confident	86 Å²	86	50.8 Å²	50.8	33%	0.326	27%	0.274	S	S	.	.	I	π-helix	trans	-72	-35.1	178.5	-57.3	0.8	0	0	0	112	I337 Y340 T341 S916 L917 W918 G924	I337-W920 HydrophobicContact CG2-CH2 4.23Å; I337-W920 HydrophobicContact CG2-CZ2 4Å; Y340-W920 AromaticContact CD1-CZ2 3.86Å; Y340-W920 HydrophobicContact CD1-CZ2 3.86Å; Y340-W920 HydrophobicContact CE1-CZ2 4.18Å; T341-W920 PolarHBondContact OG1-NE1 3Å; T341-W920 VanDerWaalsContact OG1-NE1 3.1Å; S916-W920 VanDerWaalsContact O-CG 3.29Å; S916-W920 PolarHBondContact O-N 3.36Å; S916-W920 VanDerWaalsContact O-N 3.14Å; S916-W920 PolarHBondContact O-NE1 3.35Å; L917-W920 HydrophobicContact CD2-CE3 4.23Å; L917-W920 HydrophobicContact CD2-CZ3 4.33Å; L917-W920 PolarHBondContact O-N 3.31Å; L917-W920 VanDerWaalsContact O-N 3.08Å; W918-W920 VanDerWaalsContact C-N 3.25Å; W918-W920 PolarHBondContact O-N 2.84Å; W920-G924 WeakPolarHBondContact O-CA 3.42Å; W920-G924 PolarHBondContact O-N 3.47Å
921	T	77.5	Confident	70.3	Confident	97 Å²	97	53.8 Å²	53.8	60%	0.595	28%	0.284	S	S	*	.	I	π-helix	trans	-72.6	-27.6	179.2	66.6	0	0	0	0	115.1	L917 W918	L917-T921 WeakPolarHBondContact O-CG2 3.33Å; L917-T921 PolarHBondContact O-N 3.47Å; W918-T921 PolarHBondContact O-N 3.21Å; W918-T921 VanDerWaalsContact O-N 3.09Å; W918-T921 PolarHBondContact O-OG1 3.32Å
922	V	65.2	Low	68.6	Low	15 Å²	15	59 Å²	59	9%	0.091	31%	0.312	C	S	.	.	I	π-helix	trans	-79.9	-47.5	-174.7	180	0	0	0	0	111.6	M800 W918 Y1007	M800-V922 HydrophobicContact CE-CG1 4.13Å; M800-V922 HydrophobicContact CE-CG2 4.42Å; M800-V922 HydrophobicContact SD-CG1 4.34Å; W918-V922 HydrophobicContact CD2-CG2 4.12Å; W918-V922 HydrophobicContact CE3-CG2 4.28Å; W918-V922 HydrophobicContact CH2-CG2 4.14Å; W918-V922 HydrophobicContact CZ2-CG2 3.98Å; W918-V922 HydrophobicContact CZ3-CG2 4.29Å; W918-V922 PolarHBondContact O-N 3.16Å; V922-Y1007 PolarHBondContact O-OH 2.6Å
923	K	61.8	Low	67.1	Low	49 Å²	49	65.9 Å²	65.9	21%	0.213	34%	0.339	C	S	.	.	I	π-helix	trans	-134.7	-3.9	-173	-75.7	146.1	-173.1	-179.1	0	114.2	H351 F352 E356	H351-K923 PolarHBondContact O-NZ 3.04Å; F352-K923 HydrophobicContact CE1-CD 4.31Å; E356-K923 IonicContact OE1-NZ 2.66Å; E356-K923 PolarHBondContact OE1-NZ 2.91Å; E356-K923 IonicContact OE2-NZ 3.48Å; E356-K923 PolarHBondContact OE2-NZ 3.32Å
924	G	53.8	Low	65.6	Low	7 Å²	7	66.3 Å²	66.3	7%	0.072	34%	0.344	C	S	.	.	I	π-helix	trans	-76.8	-33.1	-158.7	0	0	0	0	0	116.8	R344 W920	R344-G924 PolarHBondContact NH2-O 3.22Å; W920-G924 WeakPolarHBondContact O-CA 3.42Å; W920-G924 PolarHBondContact O-N 3.47Å
925	C	47.8	Very low	63.5	Low	110 Å²	110	67.2 Å²	67.2	74%	0.743	35%	0.351	S	S	*	.	H	α-helix	trans	-75.8	-60.5	-168.4	-154.6	0	0	0	0	112.8	R927	C925-R927 PolarHBondContact O-N 3.36Å
926	C	44	Very low	61.4	Low	92 Å²	92	71.1 Å²	71.1	62%	0.622	38%	0.377	S	S	*	.	H	α-helix	trans	-69.2	-7.7	-169.7	-52.9	0	0	0	0	115.6
927	R	50.7	Low	59.9	Low	107 Å²	107	74.3 Å²	74.3	40%	0.404	39%	0.394	S	S	.	.	H	α-helix	trans	-104.5	-14.3	-175.7	-135.3	75.2	-170.7	-157.3	5.9	115.3	C925 Y930 F931	C925-R927 PolarHBondContact O-N 3.36Å; R927-Y930 PolarHBondContact O-N 3.19Å; R927-F931 PolarHBondContact O-N 3.33Å
928	C	47	Very low	58.4	Low	45 Å²	45	72.8 Å²	72.8	30%	0.304	39%	0.391	S	S	.	.	H	α-helix	trans	-63	-45.4	174.4	-81.8	0	0	0	0	111.6	R344 Y930 F931 N932	R344-C928 PolarHBondContact NH2-SG 3.43Å; C928-Y930 VanDerWaalsContact C-N 3.3Å; C928-Y930 PolarHBondContact O-N 3.33Å; C928-F931 PolarHBondContact O-N 2.9Å; C928-N932 WeakPolarHBondContact O-CB 3.32Å; C928-N932 PolarHBondContact O-N 3.48Å
929	S	52.8	Low	57.1	Low	90 Å²	90	75.5 Å²	75.5	63%	0.629	41%	0.41	S	S	*	.	H	α-helix	trans	-61.2	-38.6	175.7	-44	0	0	0	0	112.1	Y933	S929-Y933 VanDerWaalsContact O-CB 3.23Å; S929-Y933 WeakPolarHBondContact O-CB 3.29Å; S929-Y933 PolarHBondContact O-N 2.91Å
930	Y	51.8	Low	56.1	Low	119 Å²	119	77.7 Å²	77.7	47%	0.467	43%	0.425	S	S	.	.	H	α-helix	trans	-70.3	-35.8	177.7	-167.3	-97.5	0	0	0	112.8	R927 C928 N934	R927-Y930 PolarHBondContact O-N 3.19Å; C928-Y930 VanDerWaalsContact C-N 3.3Å; C928-Y930 PolarHBondContact O-N 3.33Å; Y930-N934 VanDerWaalsContact CE1-ND2 3.27Å; Y930-N934 WeakPolarHBondContact CE1-ND2 3.45Å; Y930-N934 WeakPolarHBondContact O-CB 3.38Å; Y930-N934 PolarHBondContact O-N 3.31Å
931	F	52.3	Low	55	Low	93 Å²	93	77.2 Å²	77.2	41%	0.408	43%	0.428	S	S	.	.	H	α-helix	trans	-74.8	-41.9	174.9	-171.1	-91	0	0	0	112.2	M347 R927 C928 Y933 N934 C935	M347-F931 HydrophobicContact CE-CD1 4.02Å; M347-F931 HydrophobicContact CE-CD2 4.16Å; M347-F931 HydrophobicContact CE-CE1 3.41Å; M347-F931 VanDerWaalsContact CE-CE1 3.41Å; M347-F931 HydrophobicContact CE-CE2 3.57Å; M347-F931 HydrophobicContact CE-CG 4.37Å; M347-F931 HydrophobicContact CE-CZ 3.16Å; R927-F931 PolarHBondContact O-N 3.33Å; C928-F931 PolarHBondContact O-N 2.9Å; F931-Y933 VanDerWaalsContact C-N 3.28Å; F931-Y933 PolarHBondContact O-N 2.04Å; F931-N934 PolarHBondContact O-N 3.4Å; F931-C935 HydrophobicContact CD1-CB 4.27Å; F931-C935 HydrophobicContact CE1-CB 3.84Å; F931-C935 HydrophobicContact CZ-CB 4.27Å; F931-C935 WeakPolarHBondContact O-CB 3.3Å; F931-C935 PolarHBondContact O-N 2.88Å
932	N	57.6	Low	54.2	Low	110 Å²	110	76.9 Å²	76.9	59%	0.588	42%	0.423	S	S	*	.	H	α-helix	trans	-60.6	-40.5	172.9	-79.7	7.1	0	0	0	110.9	C928 C936	C928-N932 WeakPolarHBondContact O-CB 3.32Å; C928-N932 PolarHBondContact O-N 3.48Å; N932-C936 VanDerWaalsContact O-CB 3.32Å; N932-C936 WeakPolarHBondContact O-CB 3.39Å; N932-C936 PolarHBondContact O-N 3.41Å; N932-C936 PolarHBondContact O-SG 3.35Å
933	Y	58.6	Low	54.1	Low	144 Å²	144	80.1 Å²	80.1	57%	0.565	44%	0.439	S	S	*	.	H	α-helix	trans	-59.8	-53.6	172.5	-173.9	-95.4	0	0	0	111.6	S929 F931 C935 C936 L937	S929-Y933 VanDerWaalsContact O-CB 3.23Å; S929-Y933 WeakPolarHBondContact O-CB 3.29Å; S929-Y933 PolarHBondContact O-N 2.91Å; F931-Y933 VanDerWaalsContact C-N 3.28Å; F931-Y933 PolarHBondContact O-N 2.04Å; Y933-C935 VanDerWaalsContact C-N 3.33Å; Y933-C935 PolarHBondContact O-N 3.03Å; Y933-C936 PolarHBondContact O-N 3.19Å; Y933-L937 HydrophobicContact CE1-CD1 4.37Å; Y933-L937 HydrophobicContact CE1-CD2 4.2Å; Y933-L937 VanDerWaalsContact O-CB 3.31Å; Y933-L937 WeakPolarHBondContact O-CB 3.19Å; Y933-L937 PolarHBondContact O-N 3.3Å
934	N	59.8	Low	54.2	Low	61 Å²	61	83.5 Å²	83.5	33%	0.326	46%	0.456	S	S	.	.	H	α-helix	trans	-68.2	-28.3	-179.4	-77.9	7.7	0	0	0	114	Y930 F931 S938	Y930-N934 VanDerWaalsContact CE1-ND2 3.27Å; Y930-N934 WeakPolarHBondContact CE1-ND2 3.45Å; Y930-N934 WeakPolarHBondContact O-CB 3.38Å; Y930-N934 PolarHBondContact O-N 3.31Å; F931-N934 PolarHBondContact O-N 3.4Å; N934-S938 VanDerWaalsContact O-CB 3.23Å; N934-S938 WeakPolarHBondContact O-CB 3.48Å; N934-S938 PolarHBondContact O-N 2.91Å
935	C	46.7	Very low	54.4	Low	54 Å²	54	86.4 Å²	86.4	37%	0.365	47%	0.472	S	S	.	.	H	α-helix	trans	-71.7	-47.1	174.1	-168.2	0	0	0	0	110.1	F931 Y933 L937 S938 V939	F931-C935 HydrophobicContact CD1-CB 4.27Å; F931-C935 HydrophobicContact CE1-CB 3.84Å; F931-C935 HydrophobicContact CZ-CB 4.27Å; F931-C935 WeakPolarHBondContact O-CB 3.3Å; F931-C935 PolarHBondContact O-N 2.88Å; Y933-C935 VanDerWaalsContact C-N 3.33Å; Y933-C935 PolarHBondContact O-N 3.03Å; C935-L937 VanDerWaalsContact C-N 3.33Å; C935-L937 PolarHBondContact O-N 2.87Å; C935-S938 PolarHBondContact O-N 3.09Å; C935-V939 WeakPolarHBondContact O-CB 3.42Å; C935-V939 WeakPolarHBondContact O-CG2 3.4Å; C935-V939 PolarHBondContact O-N 2.96Å
936	C	48	Very low	55	Low	81 Å²	81	86.6 Å²	86.6	55%	0.547	47%	0.465	S	S	.	.	H	α-helix	trans	-57.3	-46.3	170.7	-68.7	0	0	0	0	111	N932 Y933 S938 V939 T940	N932-C936 VanDerWaalsContact O-CB 3.32Å; N932-C936 WeakPolarHBondContact O-CB 3.39Å; N932-C936 PolarHBondContact O-N 3.41Å; N932-C936 PolarHBondContact O-SG 3.35Å; Y933-C936 PolarHBondContact O-N 3.19Å; C936-S938 VanDerWaalsContact C-N 3.35Å; C936-S938 PolarHBondContact O-N 3.16Å; C936-V939 CarbonylContact O-C 3.55Å; C936-V939 PolarHBondContact O-N 3.45Å; C936-V939 VanDerWaalsContact O-N 3.16Å; C936-T940 WeakPolarHBondContact O-CG2 3.45Å; C936-T940 PolarHBondContact O-N 3.28Å; C936-T940 PolarHBondContact O-OG1 2.85Å
937	L	56.3	Low	55.7	Low	68 Å²	68	88.8 Å²	88.8	36%	0.356	46%	0.464	S	S	.	.	H	α-helix	trans	-63.6	-38.7	179.2	-153.4	78	0	0	0	112	Y933 C935 T940 N941	Y933-L937 HydrophobicContact CE1-CD1 4.37Å; Y933-L937 HydrophobicContact CE1-CD2 4.2Å; Y933-L937 VanDerWaalsContact O-CB 3.31Å; Y933-L937 WeakPolarHBondContact O-CB 3.19Å; Y933-L937 PolarHBondContact O-N 3.3Å; C935-L937 VanDerWaalsContact C-N 3.33Å; C935-L937 PolarHBondContact O-N 2.87Å; L937-T940 WeakPolarHBondContact CA-OG1 3.32Å; L937-T940 PolarHBondContact O-OG1 2.8Å; L937-T940 VanDerWaalsContact O-OG1 3.06Å; L937-N941 WeakPolarHBondContact O-CB 3.4Å; L937-N941 PolarHBondContact O-N 2.88Å; L937-N941 PolarHBondContact O-ND2 3.18Å; L937-N941 PolarHBondContact O-OD1 2.95Å
938	S	54.7	Low	56.3	Low	63 Å²	63	89.3 Å²	89.3	44%	0.441	47%	0.471	S	S	.	.	H	α-helix	trans	-65.2	-42.7	173.2	-173.9	0	0	0	0	111.3	N934 C935 C936 N942	N934-S938 VanDerWaalsContact O-CB 3.23Å; N934-S938 WeakPolarHBondContact O-CB 3.48Å; N934-S938 PolarHBondContact O-N 2.91Å; C935-S938 PolarHBondContact O-N 3.09Å; C936-S938 VanDerWaalsContact C-N 3.35Å; C936-S938 PolarHBondContact O-N 3.16Å; S938-N942 WeakPolarHBondContact O-CB 3.39Å; S938-N942 PolarHBondContact O-N 3.08Å; S938-N942 PolarHBondContact O-ND2 2.97Å; S938-N942 PolarHBondContact OG-ND2 3.32Å
939	V	54.6	Low	56.6	Low	77 Å²	77	93.5 Å²	93.5	47%	0.467	48%	0.484	S	S	.	.	H	α-helix	trans	-68	-42.9	177.8	171.2	0	0	0	0	111.4	C935 C936 N942 I943	C935-V939 WeakPolarHBondContact O-CB 3.42Å; C935-V939 WeakPolarHBondContact O-CG2 3.4Å; C935-V939 PolarHBondContact O-N 2.96Å; C936-V939 CarbonylContact O-C 3.55Å; C936-V939 PolarHBondContact O-N 3.45Å; C936-V939 VanDerWaalsContact O-N 3.16Å; V939-N942 PolarHBondContact O-N 2.67Å; V939-I943 HydrophobicContact CG1-CD1 3.74Å; V939-I943 HydrophobicContact CG1-CG1 4.49Å; V939-I943 WeakPolarHBondContact O-CB 3.19Å; V939-I943 VanDerWaalsContact O-CG1 3.26Å; V939-I943 WeakPolarHBondContact O-CG1 3.26Å; V939-I943 PolarHBondContact O-N 3.48Å
940	T	59.8	Low	57	Low	64 Å²	64	95 Å²	95	39%	0.393	48%	0.481	S	S	.	.	H	α-helix	trans	-63.8	-45.4	174.8	54.1	0	0	0	0	111.1	C936 L937 N942 I943 E944	C936-T940 WeakPolarHBondContact O-CG2 3.45Å; C936-T940 PolarHBondContact O-N 3.28Å; C936-T940 PolarHBondContact O-OG1 2.85Å; L937-T940 WeakPolarHBondContact CA-OG1 3.32Å; L937-T940 PolarHBondContact O-OG1 2.8Å; L937-T940 VanDerWaalsContact O-OG1 3.06Å; T940-N942 VanDerWaalsContact C-N 3.31Å; T940-N942 PolarHBondContact O-N 3.01Å; T940-I943 CarbonylContact O-C 3.55Å; T940-I943 PolarHBondContact O-N 3.23Å; T940-I943 VanDerWaalsContact O-N 3.11Å; T940-E944 WeakPolarHBondContact O-CB 3.46Å; T940-E944 WeakPolarHBondContact O-CG 3.49Å; T940-E944 PolarHBondContact O-N 2.95Å
941	N	54.1	Low	56.8	Low	75 Å²	75	97.1 Å²	97.1	40%	0.401	49%	0.488	S	S	.	.	H	α-helix	trans	-65.9	-33.6	179.4	-65.1	6	0	0	0	112	L937 T945	L937-N941 WeakPolarHBondContact O-CB 3.4Å; L937-N941 PolarHBondContact O-N 2.88Å; L937-N941 PolarHBondContact O-ND2 3.18Å; L937-N941 PolarHBondContact O-OD1 2.95Å; N941-T945 WeakPolarHBondContact O-CB 3.41Å; N941-T945 WeakPolarHBondContact O-CG2 3.47Å; N941-T945 PolarHBondContact O-N 3.48Å; N941-T945 PolarHBondContact O-OG1 3.1Å
942	N	60.4	Low	56.7	Low	91 Å²	91	97.1 Å²	97.1	49%	0.487	49%	0.49	S	S	.	.	H	α-helix	trans	-70.4	-37.9	171.5	-77.8	-59.2	0	0	0	112.1	S938 V939 T940 T945 L946	S938-N942 WeakPolarHBondContact O-CB 3.39Å; S938-N942 PolarHBondContact O-N 3.08Å; S938-N942 PolarHBondContact O-ND2 2.97Å; S938-N942 PolarHBondContact OG-ND2 3.32Å; V939-N942 PolarHBondContact O-N 2.67Å; T940-N942 VanDerWaalsContact C-N 3.31Å; T940-N942 PolarHBondContact O-N 3.01Å; N942-T945 WeakPolarHBondContact CA-OG1 3.16Å; N942-T945 PolarHBondContact O-OG1 2.9Å; N942-L946 VanDerWaalsContact O-CB 3.29Å; N942-L946 WeakPolarHBondContact O-CB 3.39Å; N942-L946 WeakPolarHBondContact O-CD1 3.32Å; N942-L946 WeakPolarHBondContact O-CG 3.43Å; N942-L946 PolarHBondContact O-N 2.92Å
943	I	63.4	Low	56.4	Low	83 Å²	83	98.7 Å²	98.7	43%	0.426	50%	0.498	S	S	.	.	H	α-helix	trans	-68	-39.6	174.8	-71.2	166.8	0	0	0	111.4	V939 T940 L946 K947	V939-I943 HydrophobicContact CG1-CD1 3.74Å; V939-I943 HydrophobicContact CG1-CG1 4.49Å; V939-I943 WeakPolarHBondContact O-CB 3.19Å; V939-I943 VanDerWaalsContact O-CG1 3.26Å; V939-I943 WeakPolarHBondContact O-CG1 3.26Å; V939-I943 PolarHBondContact O-N 3.48Å; T940-I943 CarbonylContact O-C 3.55Å; T940-I943 PolarHBondContact O-N 3.23Å; T940-I943 VanDerWaalsContact O-N 3.11Å; I943-L946 PolarHBondContact O-N 2.66Å; I943-K947 WeakPolarHBondContact O-CG 3.14Å; I943-K947 PolarHBondContact O-N 3.22Å
944	E	63.1	Low	56.1	Low	120 Å²	120	98.8 Å²	98.8	56%	0.561	50%	0.504	S	S	*	.	H	α-helix	trans	-68	-45.9	176.2	-74.4	-176.6	166.9	0	0	111.5	T940 L946 K947 Q948	T940-E944 WeakPolarHBondContact O-CB 3.46Å; T940-E944 WeakPolarHBondContact O-CG 3.49Å; T940-E944 PolarHBondContact O-N 2.95Å; E944-L946 VanDerWaalsContact C-N 3.31Å; E944-L946 PolarHBondContact O-N 2.91Å; E944-K947 WeakPolarHBondContact O-CB 3.31Å; E944-K947 PolarHBondContact O-N 2.84Å; E944-Q948 WeakPolarHBondContact O-CB 3.31Å; E944-Q948 PolarHBondContact O-N 3.36Å
945	T	60	Low	55.7	Low	67 Å²	67	100.4 Å²	100.4	41%	0.411	51%	0.512	S	S	.	.	H	α-helix	trans	-67.6	-28.3	175.1	51.2	0	0	0	0	113.2	N941 N942 K949	N941-T945 WeakPolarHBondContact O-CB 3.41Å; N941-T945 WeakPolarHBondContact O-CG2 3.47Å; N941-T945 PolarHBondContact O-N 3.48Å; N941-T945 PolarHBondContact O-OG1 3.1Å; N942-T945 WeakPolarHBondContact CA-OG1 3.16Å; N942-T945 PolarHBondContact O-OG1 2.9Å; T945-K949 WeakPolarHBondContact O-CB 3.03Å; T945-K949 WeakPolarHBondContact O-CG 3.08Å; T945-K949 PolarHBondContact O-N 3.27Å
946	L	58.7	Low	55.3	Low	114 Å²	114	103.8 Å²	103.8	60%	0.597	53%	0.526	S	S	*	.	H	α-helix	trans	-67.4	-46.3	168.2	-78.7	168.6	0	0	0	111.8	N942 I943 E944 Q948 K949 Q950	N942-L946 VanDerWaalsContact O-CB 3.29Å; N942-L946 WeakPolarHBondContact O-CB 3.39Å; N942-L946 WeakPolarHBondContact O-CD1 3.32Å; N942-L946 WeakPolarHBondContact O-CG 3.43Å; N942-L946 PolarHBondContact O-N 2.92Å; I943-L946 PolarHBondContact O-N 2.66Å; E944-L946 VanDerWaalsContact C-N 3.31Å; E944-L946 PolarHBondContact O-N 2.91Å; L946-Q948 VanDerWaalsContact C-N 3.31Å; L946-Q948 PolarHBondContact O-N 3.07Å; L946-K949 PolarHBondContact O-N 3.45Å; L946-Q950 VanDerWaalsContact O-CB 3.3Å; L946-Q950 WeakPolarHBondContact O-CB 3.43Å; L946-Q950 PolarHBondContact O-N 3.49Å
947	K	60	Low	55	Low	138 Å²	138	105.8 Å²	105.8	60%	0.6	54%	0.538	S	S	*	.	H	α-helix	trans	-59.7	-40.3	173.3	-78.1	179.2	175.6	-178.5	0	112.1	I943 E944 Q950 W951	I943-K947 WeakPolarHBondContact O-CG 3.14Å; I943-K947 PolarHBondContact O-N 3.22Å; E944-K947 WeakPolarHBondContact O-CB 3.31Å; E944-K947 PolarHBondContact O-N 2.84Å; K947-Q950 PolarHBondContact O-N 3.19Å; K947-W951 WeakPolarHBondContact O-CB 3.4Å; K947-W951 PolarHBondContact O-N 3.28Å
948	Q	62.2	Low	53.8	Low	118 Å²	118	114.1 Å²	114.1	55%	0.551	57%	0.565	S	S	*	*	H	α-helix	trans	-68.1	-44.6	-179.6	-163.9	166.2	9.3	0	0	111.2	E944 L946 Q950 W951 E952	E944-Q948 WeakPolarHBondContact O-CB 3.31Å; E944-Q948 PolarHBondContact O-N 3.36Å; L946-Q948 VanDerWaalsContact C-N 3.31Å; L946-Q948 PolarHBondContact O-N 3.07Å; Q948-Q950 VanDerWaalsContact C-N 3.31Å; Q948-Q950 PolarHBondContact O-N 3.34Å; Q948-W951 WeakPolarHBondContact O-CB 3.31Å; Q948-W951 PolarHBondContact O-N 3.17Å; Q948-E952 WeakPolarHBondContact O-CG 3.25Å; Q948-E952 PolarHBondContact O-N 3.46Å
949	K	54.8	Low	52.9	Low	133 Å²	133	119 Å²	119	58%	0.578	59%	0.586	S	S	*	*	H	α-helix	trans	-62.1	-36	170.3	-75.9	-179.2	176.6	-173.5	0	113.1	T945 L946 W951 N953	T945-K949 WeakPolarHBondContact O-CB 3.03Å; T945-K949 WeakPolarHBondContact O-CG 3.08Å; T945-K949 PolarHBondContact O-N 3.27Å; L946-K949 PolarHBondContact O-N 3.45Å; K949-W951 VanDerWaalsContact C-N 3.32Å; K949-N953 VanDerWaalsContact O-CB 3.27Å; K949-N953 WeakPolarHBondContact O-CB 3.26Å; K949-N953 VanDerWaalsContact O-CG 3.28Å; K949-N953 PolarHBondContact O-N 3.2Å; K949-N953 PolarHBondContact O-ND2 2.86Å
950	Q	60.8	Low	52	Low	122 Å²	122	121 Å²	121	57%	0.57	60%	0.603	S	S	*	*	H	α-helix	trans	-67.8	-34.1	176	-169	171.6	6.1	0	0	111.6	L946 K947 Q948 Q954	L946-Q950 VanDerWaalsContact O-CB 3.3Å; L946-Q950 WeakPolarHBondContact O-CB 3.43Å; L946-Q950 PolarHBondContact O-N 3.49Å; K947-Q950 PolarHBondContact O-N 3.19Å; Q948-Q950 VanDerWaalsContact C-N 3.31Å; Q948-Q950 PolarHBondContact O-N 3.34Å; Q950-Q954 WeakPolarHBondContact O-CG 3.14Å; Q950-Q954 PolarHBondContact O-N 2.89Å
951	W	46.1	Very low	50.7	Low	163 Å²	163	127.8 Å²	127.8	62%	0.617	63%	0.628	S	S	*	*	H	α-helix	trans	-72.8	-43	173.3	-172.8	84	0	0	0	112.5	K947 Q948 K949 Q954 N955	K947-W951 WeakPolarHBondContact O-CB 3.4Å; K947-W951 PolarHBondContact O-N 3.28Å; Q948-W951 WeakPolarHBondContact O-CB 3.31Å; Q948-W951 PolarHBondContact O-N 3.17Å; K949-W951 VanDerWaalsContact C-N 3.32Å; W951-Q954 PolarHBondContact O-N 2.85Å; W951-Q954 VanDerWaalsContact O-N 3.16Å; W951-N955 PolarHBondContact O-N 3.2Å; W951-N955 PolarHBondContact O-ND2 3.04Å
952	E	51	Low	49.7	Very low	93 Å²	93	130.4 Å²	130.4	44%	0.435	65%	0.649	S	S	.	*	H	α-helix	trans	-61.2	-45.6	174.4	-72.2	178.5	134.3	0	0	111.7	Q948 Q954 N955 L956	Q948-E952 WeakPolarHBondContact O-CG 3.25Å; Q948-E952 PolarHBondContact O-N 3.46Å; E952-Q954 PolarHBondContact O-N 3.15Å; E952-Q954 VanDerWaalsContact O-N 3.14Å; E952-N955 PolarHBondContact O-N 2.96Å; E952-N955 VanDerWaalsContact O-N 3.08Å; E952-L956 HydrophobicContact CB-CD1 4.28Å; E952-L956 PolarHBondContact O-N 2.98Å
953	N	52.1	Low	48.2	Very low	143 Å²	143	135.9 Å²	135.9	77%	0.765	67%	0.669	S	S	*	*	H	α-helix	trans	-62.9	-16.8	176	-79.1	-20.2	0	0	0	114.2	K949	K949-N953 VanDerWaalsContact O-CB 3.27Å; K949-N953 WeakPolarHBondContact O-CB 3.26Å; K949-N953 VanDerWaalsContact O-CG 3.28Å; K949-N953 PolarHBondContact O-N 3.2Å; K949-N953 PolarHBondContact O-ND2 2.86Å
954	Q	51	Low	46.6	Very low	146 Å²	146	140.1 Å²	140.1	68%	0.682	69%	0.687	S	S	*	*	H	α-helix	trans	-95.1	-16.9	174.9	-76.8	-177.2	-19.4	0	0	113.6	Q950 W951 E952	Q950-Q954 WeakPolarHBondContact O-CG 3.14Å; Q950-Q954 PolarHBondContact O-N 2.89Å; W951-Q954 PolarHBondContact O-N 2.85Å; W951-Q954 VanDerWaalsContact O-N 3.16Å; E952-Q954 PolarHBondContact O-N 3.15Å; E952-Q954 VanDerWaalsContact O-N 3.14Å
955	N	51.9	Low	45	Very low	95 Å²	95	142.4 Å²	142.4	51%	0.508	70%	0.702	S	S	.	*	H	α-helix	trans	-121.7	-11.4	-168.9	-69.1	-78.3	0	0	0	115.5	W951 E952	W951-N955 PolarHBondContact O-N 3.2Å; W951-N955 PolarHBondContact O-ND2 3.04Å; E952-N955 PolarHBondContact O-N 2.96Å; E952-N955 VanDerWaalsContact O-N 3.08Å
956	L	37.8	Very low	43.6	Very low	126 Å²	126	145.5 Å²	145.5	66%	0.66	72%	0.721	S	S	*	*	S	Bend	trans	-87.9	134.7	175.2	-91.6	79.9	0	0	0	113.3	E952	E952-L956 HydrophobicContact CB-CD1 4.28Å; E952-L956 PolarHBondContact O-N 2.98Å
957	P	42.1	Very low	42.1	Very low	123 Å²	123	148 Å²	148	80%	0.799	73%	0.726	S	S	*	*			trans	-61.6	140.5	170.4	-23.4	34.3	0	0	0	113	N959	P957-N959 PolarHBondContact O-N 3.13Å
958	R	30.6	Very low	40.6	Very low	243 Å²	243	149 Å²	149	92%	0.917	73%	0.734	S	S	*	*	S	Bend	trans	-68.6	93.8	175.6	-78.2	179.4	-92.6	-161.7	-8.2	111.4
959	N	36.1	Very low	39	Very low	164 Å²	164	149.9 Å²	149.9	88%	0.877	74%	0.742	S	S	*	*			trans	-169.3	66.8	156.6	-101.6	-20.6	0	0	0	114.9	P957	P957-N959 PolarHBondContact O-N 3.13Å
960	S	36.6	Very low	37.7	Very low	120 Å²	120	152.5 Å²	152.5	84%	0.839	75%	0.75	S	S	*	*			trans	-170.1	154.8	150.9	48.3	0	0	0	0	111
961	K	32	Very low	36.1	Very low	207 Å²	207	153.9 Å²	153.9	90%	0.9	76%	0.76	S	S	*	*			trans	-100.5	131.2	175.6	-70.2	-179.6	177.4	179.5	0	110
962	P	32.1	Very low	35.1	Very low	130 Å²	130	151.6 Å²	151.6	84%	0.844	77%	0.768	S	S	*	*			trans	-75.6	153.7	166.3	32.6	-33.6	0	0	0	110.9
963	F	29.2	Very low	34	Very low	206 Å²	206	151.6 Å²	151.6	90%	0.904	78%	0.778	S	S	*	*			trans	-111.3	145.9	174.1	-162.8	-92.1	0	0	0	109.4
964	E	29.6	Very low	32.8	Very low	172 Å²	172	152.4 Å²	152.4	80%	0.804	78%	0.782	S	S	*	*			trans	-74.1	149.9	-177.4	-65.8	-176.7	103.7	0	0	112.6
965	L	30	Very low	31.8	Very low	168 Å²	168	153.3 Å²	153.3	88%	0.88	79%	0.786	S	S	*	*			trans	-134.7	105.5	166.2	-157.7	79.6	0	0	0	111
966	T	30.8	Very low	30.6	Very low	132 Å²	132	158.5 Å²	158.5	81%	0.81	81%	0.805	S	S	*	*			trans	-68.9	128.6	179	-26.1	0	0	0	0	110.5	Q968	T966-Q968 PolarHBondContact O-N 2.97Å
967	K	28.3	Very low	30.2	Very low	165 Å²	165	158.8 Å²	158.8	72%	0.717	81%	0.806	S	S	*	*			trans	-71.5	126	-178.2	-82.7	-172.2	177.5	-178.1	0	112.5	Y970	K967-Y970 HydrophobicContact CD-CE2 4.34Å; K967-Y970 PolarHBondContact NZ-OH 3.21Å
968	Q	26.8	Very low	29.5	Very low	161 Å²	161	161.7 Å²	161.7	75%	0.752	81%	0.806	S	S	*	*			trans	-117.1	151.7	154.7	-78.1	-173.9	-21.9	0	0	110.4	T966	T966-Q968 PolarHBondContact O-N 2.97Å
969	N	29.4	Very low	29.6	Very low	136 Å²	136	157.3 Å²	157.3	73%	0.727	80%	0.801	S	S	*	*			trans	50	95.5	155.8	-56.9	-16.7	0	0	0	118.9	L971	N969-L971 PolarHBondContact O-N 3.09Å; N969-L971 VanDerWaalsContact O-N 3.11Å
970	Y	28.2	Very low	29.3	Very low	188 Å²	188	156.1 Å²	156.1	74%	0.737	79%	0.794	S	S	*	*			trans	-76.8	88.3	159.6	-84.4	-81.3	0	0	0	111.4	K967	K967-Y970 HydrophobicContact CD-CE2 4.34Å; K967-Y970 PolarHBondContact NZ-OH 3.21Å
971	L	27.3	Very low	29.2	Very low	150 Å²	150	158 Å²	158	79%	0.785	80%	0.795	S	S	*	*			trans	-107	94.8	162.6	-95.1	165.9	0	0	0	109.3	N969 S973	N969-L971 PolarHBondContact O-N 3.09Å; N969-L971 VanDerWaalsContact O-N 3.11Å; L971-S973 VanDerWaalsContact C-N 3.29Å; L971-S973 PolarHBondContact O-N 3.46Å
972	C	25.4	Very low	29.3	Very low	115 Å²	115	154.1 Å²	154.1	78%	0.777	78%	0.784	S	S	*	*			trans	-78.9	76.6	174.2	-69.7	0	0	0	0	111.3
973	S	27.4	Very low	29.4	Very low	94 Å²	94	155.9 Å²	155.9	66%	0.657	79%	0.786	S	S	*	*			trans	-74.9	129.3	160.2	-71.1	0	0	0	0	109.7	L971 E975	L971-S973 VanDerWaalsContact C-N 3.29Å; L971-S973 PolarHBondContact O-N 3.46Å; S973-E975 PolarHBondContact O-N 2.04Å
974	N	26.3	Very low	29.6	Very low	159 Å²	159	149.3 Å²	149.3	85%	0.85	78%	0.777	S	S	*	*			trans	-80.7	77.6	176.3	-78.2	-28.7	0	0	0	111.3
975	E	29.3	Very low	29.7	Very low	165 Å²	165	147.8 Å²	147.8	77%	0.771	77%	0.774	S	S	*	*			trans	-94.6	94.8	165.3	-73.1	-160.6	118.8	0	0	111	S973 I977	S973-E975 PolarHBondContact O-N 2.04Å; E975-I977 VanDerWaalsContact C-N 3.3Å; E975-I977 PolarHBondContact O-N 3.31Å
976	F	27	Very low	29.7	Very low	205 Å²	205	148.3 Å²	148.3	90%	0.899	77%	0.769	S	S	*	*			trans	-76.6	84	167.2	-114.4	-81.9	0	0	0	109.6	K978	F976-K978 PolarHBondContact O-N 3.06Å
977	I	30.5	Very low	29.8	Very low	131 Å²	131	151 Å²	151	67%	0.672	77%	0.772	S	S	*	*			trans	-60	122.8	173.5	-67	175.6	0	0	0	109	E975 N979	E975-I977 VanDerWaalsContact C-N 3.3Å; E975-I977 PolarHBondContact O-N 3.31Å; I977-N979 PolarHBondContact O-N 3.45Å
978	K	26.5	Very low	29.8	Very low	184 Å²	184	149.6 Å²	149.6	80%	0.8	77%	0.773	S	S	*	*			trans	-69.1	123.8	160.3	-72.4	177.1	177	177	0	108	F976	F976-K978 PolarHBondContact O-N 3.06Å
979	N	33.4	Very low	30	Very low	151 Å²	151	153.7 Å²	153.7	81%	0.807	78%	0.783	S	S	*	*			trans	-112.8	139.2	144.9	-92.7	-13.5	0	0	0	108.7	I977	I977-N979 PolarHBondContact O-N 3.45Å
980	N	29.2	Very low	29.9	Very low	139 Å²	139	156.2 Å²	156.2	74%	0.743	79%	0.788	S	S	*	*			trans	-71	148.3	161.4	-57.8	-41.5	0	0	0	107.4
981	D	35.8	Very low	29.9	Very low	159 Å²	159	152.6 Å²	152.6	85%	0.85	79%	0.79	S	S	*	*				-149.5	157.9	129.4	-122.2	-37.2	0	0	0	111.5
982	N	33.9	Very low	29.9	Very low	126 Å²	126	153.9 Å²	153.9	67%	0.674	79%	0.789	S	S	*	*			trans	-100.5	140.6	-167	-63.3	-80.7	0	0	0	112.7
983	N	34.5	Very low	29.9	Very low	167 Å²	167	156.8 Å²	156.8	89%	0.893	79%	0.789	S	S	*	*			trans	131.5	155.2	141.3	-68.4	-46.8	0	0	0	115.2
984	G	32.1	Very low	30	Very low	68 Å²	68	157.5 Å²	157.5	70%	0.701	79%	0.789	S	S	*	*			trans	106.7	64.9	145.6	0	0	0	0	0	119.4
985	N	32.8	Very low	30	Very low	141 Å²	141	161.1 Å²	161.1	75%	0.754	79%	0.791	S	S	*	*			trans	49.9	112.3	146.6	-72.7	-43.2	0	0	0	121.6
986	K	29	Very low	30	Very low	178 Å²	178	159.3 Å²	159.3	77%	0.774	79%	0.791	S	S	*	*				44.1	120.3	126.6	-61.2	170.7	179.7	170.5	0	119.1
987	H	32.5	Very low	30.2	Very low	188 Å²	188	154.6 Å²	154.6	87%	0.87	78%	0.782	S	S	*	*				-154.7	162	100.8	-107.8	-83.3	0	0	0	110.6
988	N	29.7	Very low	30.2	Very low	137 Å²	137	155.6 Å²	155.6	73%	0.733	79%	0.788	S	S	*	*			trans	-95.3	132.4	-163.6	-67.5	-60.8	0	0	0	114.5
989	Y	29.5	Very low	30.3	Very low	246 Å²	246	150.9 Å²	150.9	97%	0.965	79%	0.792	S	S	*	*			trans	-144.9	147.9	132.4	-97.8	-78.4	0	0	0	108.8
990	K	27.1	Very low	30.2	Very low	190 Å²	190	147.7 Å²	147.7	83%	0.826	78%	0.778	S	S	*	*			trans	-139.9	97.6	-151.3	-171	-178.8	-175.5	176	0	115.8
991	S	29.1	Very low	30.1	Very low	112 Å²	112	147.6 Å²	147.6	78%	0.783	78%	0.782	S	S	*	*			trans	-145.9	116	157.6	44.7	0	0	0	0	108.4
992	K	27.5	Very low	29.8	Very low	176 Å²	176	148 Å²	148	77%	0.765	77%	0.773	S	S	*	*				51.7	121.6	73.4	-79.8	-168.3	169.8	-174.4	0	111.7
993	F	26.3	Very low	29.5	Very low	176 Å²	176	148.2 Å²	148.2	77%	0.772	78%	0.779	S	S	*	*			cis	-140.1	-175.3	21	-138.8	-110.4	0	0	0	114.5
994	T	28.7	Very low	29.3	Very low	109 Å²	109	148 Å²	148	67%	0.669	78%	0.778	S	S	*	*			trans	-74	161.6	-162	48.4	0	0	0	0	118
995	R	26.2	Very low	29.2	Very low	235 Å²	235	151 Å²	151	89%	0.887	77%	0.773	S	S	*	*			trans	-55.3	151.9	159.3	-90	-179.8	167.8	146.3	-3.1	112.8
996	T	29.1	Very low	29.3	Very low	127 Å²	127	148.1 Å²	148.1	78%	0.779	76%	0.762	S	S	*	*			trans	-126.7	151.3	148.3	49.5	0	0	0	0	109.3
997	P	31	Very low	29.5	Very low	107 Å²	107	146.8 Å²	146.8	70%	0.695	75%	0.753	S	S	*	*			trans	-80.3	141.3	169.8	33.7	-32.6	0	0	0	110.8
998	D	31.7	Very low	29.6	Very low	152 Å²	152	141.8 Å²	141.8	81%	0.813	75%	0.745	S	S	*	*			trans	179.7	135.1	137.2	-93.1	-23.7	0	0	0	110.4	T1000	D998-T1000 PolarHBondContact O-N 3.38Å
999	G	27.8	Very low	29.7	Very low	85 Å²	85	142.4 Å²	142.4	88%	0.876	75%	0.746	S	S	*	*			trans	-82.2	69.9	-165.6	0	0	0	0	0	115.3
1000	T	30.2	Very low	29.7	Very low	84 Å²	84	140.2 Å²	140.2	52%	0.515	74%	0.738	S	S	.	*			trans	-114.8	94.3	175.8	45.1	0	0	0	0	112.8	D998 Y1002	D998-T1000 PolarHBondContact O-N 3.38Å; T1000-Y1002 WeakPolarHBondContact O-CD2 3.46Å; T1000-Y1002 PolarHBondContact O-N 2.85Å; T1000-Y1002 WeakPolarHBondContact OG1-CE2 3.36Å
1001	T	28.2	Very low	29.8	Very low	136 Å²	136	139.3 Å²	139.3	83%	0.834	74%	0.736	S	S	*	*			trans	-75.5	85.6	176.4	-51.5	0	0	0	0	111.2	T1003	T1001-T1003 PolarHBondContact O-N 3.37Å; T1001-T1003 VanDerWaalsContact O-N 3.08Å
1002	Y	28.5	Very low	29.9	Very low	167 Å²	167	140.7 Å²	140.7	66%	0.655	73%	0.73	S	S	*	*			trans	-68.9	101.9	173.1	-71.5	-82.5	0	0	0	111.3	T1000 L1004	T1000-Y1002 WeakPolarHBondContact O-CD2 3.46Å; T1000-Y1002 PolarHBondContact O-N 2.85Å; T1000-Y1002 WeakPolarHBondContact OG1-CE2 3.36Å; Y1002-L1004 PolarHBondContact O-N 3.28Å; Y1002-L1004 VanDerWaalsContact O-N 3.13Å
1003	T	29.1	Very low	29.9	Very low	131 Å²	131	139.2 Å²	139.2	80%	0.804	74%	0.736	S	S	*	*			trans	-68.6	104.6	168.5	42.6	0	0	0	0	109.8	T1001 H1005	T1001-T1003 PolarHBondContact O-N 3.37Å; T1001-T1003 VanDerWaalsContact O-N 3.08Å; T1003-H1005 PolarHBondContact O-N 3.01Å
1004	L	30.1	Very low	30.1	Very low	164 Å²	164	140.5 Å²	140.5	86%	0.859	74%	0.741	S	S	*	*			trans	-65.5	106.4	-171.7	-158.6	77.8	0	0	0	111.7	Y1002	Y1002-L1004 PolarHBondContact O-N 3.28Å; Y1002-L1004 VanDerWaalsContact O-N 3.13Å
1005	H	30	Very low	30.2	Very low	130 Å²	130	140 Å²	140	60%	0.602	74%	0.738	S	S	*	*			trans	-72.4	127.9	-174.8	-164.3	-101.3	0	0	0	111.1	T1003 Y1007	T1003-H1005 PolarHBondContact O-N 3.01Å; H1005-Y1007 AromaticContact CE1-CD2 3.55Å; H1005-Y1007 AromaticContact ND1-CD2 3.69Å; H1005-Y1007 PolarHBondContact O-N 2.9Å
1006	P	33.1	Very low	30.5	Very low	81 Å²	81	132.5 Å²	132.5	53%	0.526	72%	0.72	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.2	23.5	-162.2	-20.8	35	0	0	0	118.3
1007	Y	35.1	Very low	30.6	Very low	149 Å²	149	133.4 Å²	133.4	58%	0.584	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	3.8	-173.1	-84.1	-95	0	0	0	114.7	V922 H1005 I1009	V922-Y1007 PolarHBondContact O-OH 2.6Å; H1005-Y1007 AromaticContact CE1-CD2 3.55Å; H1005-Y1007 AromaticContact ND1-CD2 3.69Å; H1005-Y1007 PolarHBondContact O-N 2.9Å; Y1007-I1009 PolarHBondContact O-N 2.8Å
1008	A	33.5	Very low	30.5	Very low	84 Å²	84	135.3 Å²	135.3	69%	0.694	72%	0.724	S	S	*	*	S	Bend	trans	-87.6	4.7	-170.9	0	0	0	0	0	116
1009	I	32.1	Very low	30.3	Very low	150 Å²	150	138.4 Å²	138.4	77%	0.769	73%	0.726	S	S	*	*	S	Bend	trans	-135.9	89.8	-176	-51.2	176.6	0	0	0	110	Y1007	Y1007-I1009 PolarHBondContact O-N 2.8Å
1010	Y	29.3	Very low	30.4	Very low	200 Å²	200	142.1 Å²	142.1	78%	0.784	72%	0.72	S	S	*	*			trans	176.9	69.6	151.9	-102.2	-62.5	0	0	0	111.4
1011	Q	29.5	Very low	30.3	Very low	171 Å²	171	142.4 Å²	142.4	80%	0.799	73%	0.726	S	S	*	*			trans	-165	71.9	168.1	-123.4	175.3	14.2	0	0	112.8
1012	H	30.4	Very low	30.3	Very low	141 Å²	141	144.1 Å²	144.1	65%	0.653	72%	0.724	S	S	*	*			trans	-165.7	89.4	166.1	-101.1	-58.7	0	0	0	111.7	H782	H782-H1012 AromaticContact NE2-NE2 3.98Å
1013	T	28.8	Very low	30.2	Very low	144 Å²	144	144.1 Å²	144.1	88%	0.883	73%	0.73	S	S	*	*			trans	-174.2	76.5	158.8	35.1	0	0	0	0	109.7
1014	K	29	Very low	30.1	Very low	204 Å²	204	146 Å²	146	89%	0.887	73%	0.734	S	S	*	*			trans	-165.6	94.5	157.5	-120.1	178.7	-178.1	-178.1	0	110	P1016	K1014-P1016 WeakPolarHBondContact O-CD 3.44Å
1015	T	31.3	Very low	30	Very low	99 Å²	99	141.3 Å²	141.3	61%	0.607	73%	0.725	S	S	*	*			trans	-90.6	119.8	168.9	42.1	0	0	0	0	109.2	Y779	Y779-T1015 HydrophobicContact CD2-CG2 4.23Å
1016	P	32.7	Very low	30	Very low	77 Å²	77	142.7 Å²	142.7	50%	0.5	74%	0.736	S	S	.	*			trans	-70.2	126.7	159.3	-14	26.1	0	0	0	110.1	Y779 K1014	Y779-P1016 HydrophobicContact CE1-CG 4.21Å; Y779-P1016 PolarHBondContact OH-O 2.58Å; K1014-P1016 WeakPolarHBondContact O-CD 3.44Å
1017	D	31.2	Very low	29.8	Very low	145 Å²	145	146.7 Å²	146.7	78%	0.775	75%	0.753	S	S	*	*			trans	-107.9	131.9	164	-73.4	-58	0	0	0	108.9
1018	N	29.4	Very low	29.5	Very low	148 Å²	148	143.1 Å²	143.1	79%	0.791	76%	0.761	S	S	*	*			trans	-158.5	84.2	-175.6	-166.4	17.4	0	0	0	111.1
1019	Y	27.7	Very low	29.3	Very low	217 Å²	217	148.7 Å²	148.7	85%	0.851	77%	0.773	S	S	*	*			trans	-160.4	114.7	157.1	-104.4	-67.4	0	0	0	112.5
1020	H	29.9	Very low	29.3	Very low	163 Å²	163	151.1 Å²	151.1	76%	0.755	78%	0.778	S	S	*	*			trans	41.4	126.8	146.8	-97.2	-73.1	0	0	0	123.9
1021	S	27.1	Very low	29	Very low	89 Å²	89	148.3 Å²	148.3	62%	0.622	78%	0.777	S	S	*	*			trans	88.9	124.8	133	-62	0	0	0	0	121.4
1022	Q	29.1	Very low	29.1	Very low	172 Å²	172	148.8 Å²	148.8	80%	0.804	78%	0.779	S	S	*	*			trans	59.8	103.1	147.6	-67.1	167.9	-27.6	0	0	117.3
1023	Q	25.2	Very low	28.9	Very low	167 Å²	167	153 Å²	153	78%	0.78	79%	0.789	S	S	*	*				94.9	134.7	56.4	-173	-178.2	18.7	0	0	111.9
1024	L	27.6	Very low	28.7	Very low	171 Å²	171	155.6 Å²	155.6	90%	0.895	79%	0.788	S	S	*	*			trans	64.6	139.2	-164.5	-55.4	104.4	0	0	0	114
1025	G	27.2	Very low	28.7	Very low	65 Å²	65	150.9 Å²	150.9	67%	0.67	78%	0.778	S	S	*	*			cis	168.3	170.8	-8.2	0	0	0	0	0	112.6
1026	I	31	Very low	28.4	Very low	160 Å²	160	152.8 Å²	152.8	82%	0.821	79%	0.79	S	S	*	*			trans	75.1	92.7	166.8	-47.3	170.4	0	0	0	116.9
1027	N	28.4	Very low	28.3	Very low	164 Å²	164	155.9 Å²	155.9	88%	0.877	80%	0.801	S	S	*	*			trans	35.7	109.2	132.2	-55.6	-1.7	0	0	0	120
1028	G	28.6	Very low	28	Very low	74 Å²	74	152.3 Å²	152.3	76%	0.763	80%	0.798	S	S	*	*			trans	-166	67.7	166	0	0	0	0	0	112.3
1029	Q	30.4	Very low	27.8	Very low	201 Å²	201	151.1 Å²	151.1	94%	0.939	80%	0.8	S	S	*	*			trans	-103.3	91.5	-172.3	-165.9	165	1.1	0	0	111.3
1030	F	30.8	Very low	27.6	Very low	201 Å²	201	151.3 Å²	151.3	88%	0.882	80%	0.801	S	S	*	*			trans	-83.2	141.3	179.8	-107.9	-92.5	0	0	0	112.7
1031	D	24.9	Very low	27.5	Very low	142 Å²	142	148.7 Å²	148.7	76%	0.759	80%	0.801	S	S	*	*			trans	-61.5	130.3	173.6	-92.6	-59.1	0	0	0	113.1
1032	H	30.2	Very low	27.6	Very low	181 Å²	181	149.4 Å²	149.4	84%	0.838	81%	0.806	S	S	*	*			trans	-140	128.4	146.8	-93.9	-74.4	0	0	0	110.8
1033	R	26.7	Very low	27.7	Very low	230 Å²	230	148.3 Å²	148.3	87%	0.868	81%	0.812	S	S	*	*			trans	-74.1	135.5	-164.2	-57.3	169.7	-166.8	-178.5	2.5	112.3	P1035	R1033-P1035 WeakPolarHBondContact O-CD 3.24Å
1034	F	24.4	Very low	27.7	Very low	197 Å²	197	145.4 Å²	145.4	86%	0.864	81%	0.809	S	S	*	*			trans	-80.7	125	156.9	-81.1	-95.8	0	0	0	110
1035	P	28.6	Very low	27.8	Very low	105 Å²	105	144.8 Å²	144.8	68%	0.682	81%	0.806	S	S	*	*			trans	-96.6	90.1	165.1	34.3	-27.8	0	0	0	110.3	R1033 I1037	R1033-P1035 WeakPolarHBondContact O-CD 3.24Å; P1035-I1037 HydrophobicContact CB-CD1 4.25Å; P1035-I1037 HydrophobicContact CB-CG1 4.38Å; P1035-I1037 PolarHBondContact O-N 3.48Å
1036	T	25.6	Very low	28	Very low	139 Å²	139	146.8 Å²	146.8	85%	0.853	81%	0.806	S	S	*	*			trans	-74.3	93.4	166.2	-54.1	0	0	0	0	108.7
1037	I	30	Very low	27.9	Very low	142 Å²	142	146 Å²	146	73%	0.728	80%	0.803	S	S	*	*			trans	-127.3	105.8	178.5	-57.5	177	0	0	0	109.5	P1035	P1035-I1037 HydrophobicContact CB-CD1 4.25Å; P1035-I1037 HydrophobicContact CB-CG1 4.38Å; P1035-I1037 PolarHBondContact O-N 3.48Å
1038	G	24.9	Very low	28	Very low	70 Å²	70	144.3 Å²	144.3	72%	0.722	80%	0.799	S	S	*	*			trans	-97.3	156.3	149.9	0	0	0	0	0	109.2
1039	C	25	Very low	28	Very low	123 Å²	123	146.2 Å²	146.2	83%	0.831	80%	0.796	S	S	*	*			trans	-149.2	139.2	167.1	-95.6	0	0	0	0	111.3
1040	Y	24.4	Very low	28.1	Very low	221 Å²	221	142.7 Å²	142.7	87%	0.867	79%	0.788	S	S	*	*			trans	-81.7	154.5	162	-81	-110.5	0	0	0	110.1
1041	S	28.4	Very low	28.1	Very low	109 Å²	109	140.4 Å²	140.4	76%	0.762	79%	0.785	S	S	*	*			trans	-168.6	107.5	152.6	46.4	0	0	0	0	104.7
1042	S	28.7	Very low	28.5	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	79%	0.792	S	S	*	*			cis	48.3	108	39.9	44.6	0	0	0	0	112.8
1043	T	30.1	Very low	28.5	Very low	149 Å²	149	138.7 Å²	138.7	91%	0.914	78%	0.781	S	S	*	*			trans	-76	158.7	-179.2	19.5	0	0	0	0	112.5
1044	S	26.4	Very low	28.9	Very low	105 Å²	105	135.1 Å²	135.1	73%	0.734	77%	0.772	S	S	*	*			trans	-82.6	150.8	-169.8	47.6	0	0	0	0	115.1
1045	L	29.3	Very low	29.2	Very low	159 Å²	159	132.9 Å²	132.9	83%	0.832	77%	0.769	S	S	*	*			trans	157.1	137.4	142.7	-104	66.6	0	0	0	107.3
1046	T	30.5	Very low	29.4	Very low	107 Å²	107	133.5 Å²	133.5	66%	0.656	77%	0.773	S	S	*	*			cis	-150.2	145.1	0.4	36.1	0	0	0	0	111.3
1047	N	28.5	Very low	29.5	Very low	142 Å²	142	132.2 Å²	132.2	76%	0.759	77%	0.77	S	S	*	*			trans	47.4	149.5	142.3	-62.5	-2.3	0	0	0	124.3
1048	T	31.9	Very low	29.7	Very low	129 Å²	129	132.3 Å²	132.3	79%	0.791	77%	0.772	S	S	*	*			trans	62.6	138.2	155.3	46.2	0	0	0	0	119.4
1049	T	28.8	Very low	30.1	Very low	114 Å²	114	136.3 Å²	136.3	70%	0.699	78%	0.775	S	S	*	*			cis	-176.5	161.1	-31.7	12.3	0	0	0	0	107.5
1050	T	32.8	Very low	30.3	Very low	127 Å²	127	135.5 Å²	135.5	78%	0.779	77%	0.768	S	S	*	*			trans	68.4	129.6	-179.9	69.3	0	0	0	0	114.5
1051	N	29.7	Very low	30.5	Very low	153 Å²	153	130 Å²	130	82%	0.818	76%	0.763	S	S	*	*			cis	93.4	99.7	34.5	-76.2	-10.4	0	0	0	114.2
1052	L	33.2	Very low	30.5	Very low	172 Å²	172	132.7 Å²	132.7	90%	0.901	77%	0.767	S	S	*	*			trans	154.9	109.2	151	-87.2	156.5	0	0	0	106.8
1053	D	31.4	Very low	30.6	Very low	116 Å²	116	134.5 Å²	134.5	62%	0.62	77%	0.768	S	S	*	*			cis	105.4	129.8	27	-167.2	25	0	0	0	113.2
1054	K	33.4	Very low	30.8	Very low	154 Å²	154	132.9 Å²	132.9	67%	0.67	76%	0.758	S	S	*	*			trans	69.5	113.5	169.8	-76.6	139.7	-165.8	153.3	0	124.2
1055	N	30.7	Very low	30.8	Very low	151 Å²	151	137.5 Å²	137.5	81%	0.807	77%	0.765	S	S	*	*				85.3	131.4	122.6	-75.4	2.8	0	0	0	122.8
1056	P	33.1	Very low	30.7	Very low	117 Å²	117	133.4 Å²	133.4	76%	0.76	76%	0.761	S	S	*	*			trans	-108.1	149.2	163.9	38.8	-30.1	0	0	0	113.7
1057	S	29.3	Very low	30.9	Very low	113 Å²	113	136.5 Å²	136.5	79%	0.79	77%	0.768	S	S	*	*			trans	178.4	134.9	141	47.7	0	0	0	0	112.5
1058	N	32.8	Very low	30.9	Very low	144 Å²	144	136.5 Å²	136.5	77%	0.77	77%	0.767	S	S	*	*			trans	177.2	107.3	153.9	-93.3	-21	0	0	0	107
1059	I	33.1	Very low	30.7	Very low	153 Å²	153	134.4 Å²	134.4	79%	0.785	76%	0.757	S	S	*	*				104.5	138.6	82.1	-87	175.6	0	0	0	109.6
1060	P	30.1	Very low	30.8	Very low	107 Å²	107	137 Å²	137	70%	0.695	76%	0.762	S	S	*	*			trans	-124.2	167.7	-153	39.9	-24.6	0	0	0	117
1061	S	27.5	Very low	30.6	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	76%	0.762	S	S	*	*			trans	54	118.5	148.4	60.4	0	0	0	0	120.7
1062	L	30.2	Very low	30.5	Very low	164 Å²	164	137 Å²	137	86%	0.859	76%	0.756	S	S	*	*			trans	-148.7	127.3	159.8	-145.8	78.9	0	0	0	114.9
1063	L	29.6	Very low	30.2	Very low	143 Å²	143	133.7 Å²	133.7	75%	0.749	74%	0.743	S	S	*	*			trans	41.3	97.6	149.2	-66.9	168.1	0	0	0	123.2
1064	T	33.7	Very low	29.9	Very low	114 Å²	114	134.6 Å²	134.6	70%	0.699	75%	0.748	S	S	*	*				44.6	118.3	104.9	-44.5	0	0	0	0	122.4
1065	K	26.7	Very low	29.6	Very low	203 Å²	203	136.4 Å²	136.4	88%	0.883	76%	0.756	S	S	*	*			trans	44.2	118.8	148.1	-62.4	177.8	176	-179.2	0	121.1
1066	G	28	Very low	29.4	Very low	72 Å²	72	135.7 Å²	135.7	74%	0.742	76%	0.757	S	S	*	*				113.3	116.3	100.7	0	0	0	0	0	120.1
1067	H	33.6	Very low	29.2	Very low	173 Å²	173	133.3 Å²	133.3	80%	0.801	75%	0.753	S	S	*	*			trans	-164.7	134	137.2	-118.7	-103	0	0	0	105.9
1068	L	30	Very low	29	Very low	142 Å²	142	138 Å²	138	74%	0.743	75%	0.754	S	S	*	*				55.4	130.9	63.3	-89.7	82.9	0	0	0	114.1
1069	S	27.2	Very low	28.8	Very low	85 Å²	85	136.9 Å²	136.9	59%	0.594	75%	0.748	S	S	*	*			cis	176.9	169.3	-13.9	41.1	0	0	0	0	109.8
1070	Q	30.5	Very low	28.5	Very low	169 Å²	169	136 Å²	136	79%	0.79	74%	0.744	S	S	*	*			trans	83.2	149.2	162.8	-55.6	-179.3	-29.7	0	0	118.6
1071	L	29.2	Very low	28.3	Very low	149 Å²	149	137.9 Å²	137.9	78%	0.78	74%	0.743	S	S	*	*			trans	67.1	142.2	162.6	-60.2	144.5	0	0	0	118.1
1072	D	26.6	Very low	28.4	Very low	131 Å²	131	139.7 Å²	139.7	70%	0.701	74%	0.74	S	S	*	*			cis	-156.9	-172.2	-38	-140.2	-73.9	0	0	0	110.2
1073	T	27.2	Very low	28.1	Very low	101 Å²	101	136.5 Å²	136.5	62%	0.62	73%	0.731	S	S	*	*			trans	-70.6	159.6	-178.4	49.3	0	0	0	0	115.8
1074	N	25.3	Very low	28.2	Very low	135 Å²	135	136.8 Å²	136.8	72%	0.722	74%	0.739	S	S	*	*			trans	89.6	173.1	161.9	-48	-63.7	0	0	0	118.9
1075	F	28	Very low	27.8	Very low	193 Å²	193	136.1 Å²	136.1	85%	0.846	74%	0.739	S	S	*	*			trans	67.7	109.9	-166.6	-70	-94.3	0	0	0	113.9
1076	V	26.9	Very low	28.1	Very low	135 Å²	135	133.1 Å²	133.1	82%	0.818	74%	0.738	S	S	*	*			cis	68.3	98.2	16.5	-170.5	0	0	0	0	115
1077	G	27.5	Very low	28.2	Very low	67 Å²	67	136 Å²	136	69%	0.691	74%	0.742	S	S	*	*			trans	75	167.1	171.2	0	0	0	0	0	114.3
1078	R	24.8	Very low	28.2	Very low	213 Å²	213	133.9 Å²	133.9	80%	0.804	74%	0.743	S	S	*	*			cis	-164.4	174.2	-15.8	-156.5	-167.3	-74.2	146.9	-1.8	106.1
1079	D	29.7	Very low	28.2	Very low	120 Å²	120	130.8 Å²	130.8	64%	0.642	75%	0.745	S	S	*	*			trans	68.8	156.3	161	-48.3	-35.5	0	0	0	114.4
1080	L	26.8	Very low	28.4	Very low	133 Å²	133	137 Å²	137	70%	0.696	76%	0.757	S	S	*	*			cis	-153.4	159.3	-38	-145.1	70.1	0	0	0	108.6
1081	E	25.9	Very low	28.4	Very low	147 Å²	147	140 Å²	140	69%	0.687	76%	0.763	S	S	*	*			trans	67.5	157.3	144.4	-92.2	176.3	-154.8	0	0	125.3
1082	H	28.9	Very low	28.5	Very low	145 Å²	145	136.5 Å²	136.5	67%	0.671	75%	0.751	S	S	*	*			trans	57.1	87.8	151.5	-70.6	104.5	0	0	0	122.5
1083	S	24.2	Very low	28.7	Very low	97 Å²	97	139 Å²	139	68%	0.678	76%	0.758	S	S	*	*				32	126.7	121.4	60.8	0	0	0	0	121.7
1084	T	31.1	Very low	28.9	Very low	148 Å²	148	139 Å²	139	91%	0.908	77%	0.769	S	S	*	*			trans	-157.8	162.8	136.5	-0.3	0	0	0	0	112.2
1085	S	26	Very low	29	Very low	100 Å²	100	142.2 Å²	142.2	70%	0.699	78%	0.776	S	S	*	*			trans	-83.8	154.8	-172.2	54.2	0	0	0	0	115.1
1086	T	32.6	Very low	29.1	Very low	141 Å²	141	141.1 Å²	141.1	87%	0.865	78%	0.777	S	S	*	*				-178.1	129.8	119.1	23	0	0	0	0	114.4
1087	T	29.9	Very low	29.1	Very low	133 Å²	133	139.6 Å²	139.6	82%	0.816	77%	0.772	S	S	*	*			trans	-85	166.4	156.6	26.1	0	0	0	0	109.5
1088	P	34.2	Very low	29.6	Very low	127 Å²	127	141.8 Å²	141.8	83%	0.825	77%	0.774	S	S	*	*			cis	-151.2	-175.5	47.1	42.2	-20.1	0	0	0	117.9
1089	G	30.5	Very low	29.8	Very low	77 Å²	77	139.2 Å²	139.2	79%	0.794	78%	0.777	S	S	*	*			trans	173.9	101.3	168.7	0	0	0	0	0	115.8
1090	Y	30.3	Very low	29.8	Very low	215 Å²	215	141.5 Å²	141.5	84%	0.843	79%	0.785	S	S	*	*			trans	-70.7	152	179.2	-85.2	-110.5	0	0	0	114.7
1091	Y	31.9	Very low	29.9	Very low	233 Å²	233	141.2 Å²	141.2	91%	0.914	78%	0.784	S	S	*	*				-165.7	159.1	119.3	-105.9	-70.7	0	0	0	111.1
1092	S	30.2	Very low	30.3	Very low	76 Å²	76	142.2 Å²	142.2	53%	0.531	79%	0.792	S	S	.	*			trans	-145.9	170.3	-161.3	55.1	0	0	0	0	115.8
1093	H	31.1	Very low	30.3	Very low	183 Å²	183	141.8 Å²	141.8	85%	0.847	79%	0.794	S	S	*	*			trans	75.6	152.9	177.1	-50.2	-80.9	0	0	0	115.6
1094	A	32.1	Very low	30.5	Very low	102 Å²	102	142.3 Å²	142.3	84%	0.843	80%	0.798	S	S	*	*			cis	-132.1	170.7	11.4	0	0	0	0	0	114.3
1095	K	26.2	Very low	30.8	Very low	202 Å²	202	144.8 Å²	144.8	88%	0.878	80%	0.802	S	S	*	*			trans	-132	117.9	-171.4	170.4	-168.1	177.4	-176.2	0	110.1
1096	I	31.2	Very low	31	Very low	170 Å²	170	145 Å²	145	87%	0.872	80%	0.803	S	S	*	*			trans	-138.7	133.1	165.4	-59.4	-177.8	0	0	0	109.5
1097	S	25.7	Very low	31.1	Very low	102 Å²	102	145.9 Å²	145.9	71%	0.713	80%	0.798	S	S	*	*			trans	-158	137	166.8	170.4	0	0	0	0	108.2
1098	P	37.7	Very low	31.3	Very low	113 Å²	113	146.1 Å²	146.1	73%	0.734	79%	0.794	S	S	*	*			trans	-126.3	126.9	158.2	33.8	-20.5	0	0	0	111.8
1099	N	30.2	Very low	31.3	Very low	160 Å²	160	144.8 Å²	144.8	86%	0.856	79%	0.793	S	S	*	*			trans	-85.6	119.6	156.7	-76.3	-13.8	0	0	0	108
1100	M	30	Very low	31.5	Very low	167 Å²	167	146.2 Å²	146.2	82%	0.823	79%	0.791	S	S	*	*			trans	-156.5	118.2	156.8	-148.9	162.9	-175.7	0	0	113.1
1101	I	28.1	Very low	31.7	Very low	128 Å²	128	140.7 Å²	140.7	66%	0.656	79%	0.79	S	S	*	*			trans	30.1	121.3	141.6	-49.7	171.9	0	0	0	118.3
1102	I	33.8	Very low	31.9	Very low	167 Å²	167	134.9 Å²	134.9	86%	0.856	78%	0.783	S	S	*	*				-153	137	127.3	-101.7	153.4	0	0	0	108.2
1103	D	29.2	Very low	32.2	Very low	136 Å²	136	136.8 Å²	136.8	73%	0.727	80%	0.797	S	S	*	*			trans	-85.3	162.7	-178.6	-82.5	-66.3	0	0	0	113.6
1104	S	28.9	Very low	32.6	Very low	108 Å²	108	135.7 Å²	135.7	76%	0.755	80%	0.795	S	S	*	*			trans	55.3	111.8	152.1	62.8	0	0	0	0	119.3
1105	M	36.7	Very low	33.3	Very low	200 Å²	200	136.4 Å²	136.4	99%	0.985	79%	0.791	S	S	*	*				-157	124.2	125.9	-109.2	170.5	-164	0	0	110.4
1106	S	31.3	Very low	34.2	Very low	105 Å²	105	132 Å²	132	73%	0.734	78%	0.783	S	S	*	*			trans	-99.4	152.4	175.6	50.8	0	0	0	0	110.8
1107	E	34.5	Very low	34.5	Very low	160 Å²	160	129.9 Å²	129.9	75%	0.748	78%	0.781	S	S	*	*				177.1	128.9	107.1	-91.3	-163.4	118.8	0	0	113.9
1108	N	33.6	Very low	35.3	Very low	138 Å²	138	133 Å²	133	74%	0.738	79%	0.789	S	S	*	*			trans	48.9	98.2	132.8	-53.5	-25.6	0	0	0	121.7
1109	A	34.4	Very low	35.4	Very low	98 Å²	98	132.9 Å²	132.9	81%	0.81	79%	0.788	S	S	*	*				-179	147.7	122.9	0	0	0	0	0	111.7
1110	S	34.1	Very low	35.8	Very low	108 Å²	108	131.4 Å²	131.4	76%	0.755	79%	0.787	S	S	*	*			cis	178.2	144.5	-45.5	45.8	0	0	0	0	108.4
1111	A	34.9	Very low	36.2	Very low	99 Å²	99	129.2 Å²	129.2	82%	0.818	79%	0.788	S	S	*	*			trans	68.7	146.3	-178.6	0	0	0	0	0	115.4
1112	S	35.1	Very low	36.6	Very low	110 Å²	110	130.6 Å²	130.6	77%	0.769	80%	0.797	S	S	*	*			cis	-170.9	155.2	-6.8	39.7	0	0	0	0	108.8
1113	S	36.9	Very low	36.8	Very low	116 Å²	116	130.9 Å²	130.9	81%	0.811	80%	0.8	S	S	*	*			cis	-163.7	169.1	-8.1	46.3	0	0	0	0	109.5
1114	I	39.8	Very low	37	Very low	160 Å²	160	135.5 Å²	135.5	82%	0.821	81%	0.807	S	S	*	*			trans	-144.4	146.1	180	-59.3	172.5	0	0	0	109.2
1115	P	47	Very low	37.6	Very low	117 Å²	117	135 Å²	135	76%	0.76	80%	0.802	S	S	*	*			trans	-110.8	157.8	156.1	32.8	-20.9	0	0	0	113.3
1116	P	44.9	Very low	37.5	Very low	109 Å²	109	130.9 Å²	130.9	71%	0.708	79%	0.793	S	S	*	*			trans	-120.1	172	-137.2	41	-31.2	0	0	0	116.6
1117	P	37.6	Very low	37.7	Very low	127 Å²	127	137.8 Å²	137.8	83%	0.825	80%	0.802	S	S	*	*			trans	-79.7	163	169.4	34.4	-36.4	0	0	0	113.3
1118	L	42.3	Very low	37.6	Very low	167 Å²	167	137.9 Å²	137.9	87%	0.874	81%	0.807	S	S	*	*			trans	-129.2	160.7	179.1	-80.1	171.8	0	0	0	112.6
1119	P	40.8	Very low	37.7	Very low	110 Å²	110	137 Å²	137	71%	0.714	81%	0.809	S	S	*	*			trans	-102.7	169.8	-152	39.6	-37.5	0	0	0	115.8
1120	P	37.7	Very low	37.7	Very low	130 Å²	130	136.1 Å²	136.1	84%	0.844	80%	0.802	S	S	*	*			trans	-85.4	153.4	177.4	34.8	-36	0	0	0	113.8
1121	S	38.8	Very low	37.5	Very low	120 Å²	120	143.1 Å²	143.1	84%	0.839	81%	0.812	S	S	*	*			trans	-148.5	149.7	163.2	66.6	0	0	0	0	112.2
1122	N	35.3	Very low	37.4	Very low	157 Å²	157	142 Å²	142	84%	0.84	81%	0.81	S	S	*	*			trans	-86.1	153.2	-179.6	-69.2	-60.2	0	0	0	111.9
1123	N	38.2	Very low	37.2	Very low	174 Å²	174	144.1 Å²	144.1	93%	0.93	81%	0.813	S	S	*	*			trans	-155.6	153.7	137.1	-101.5	-36.9	0	0	0	113.1
1124	R	33.6	Very low	37.4	Very low	232 Å²	232	143.9 Å²	143.9	88%	0.875	81%	0.809	S	S	*	*			trans	-138.1	-169.4	-173	-127	-166.6	173	-154.7	3.6	107
1125	P	41.8	Very low	36.7	Very low	99 Å²	99	141.5 Å²	141.5	64%	0.643	81%	0.805	S	S	*	*			cis	-130.7	168.8	-38.9	36.4	-21.5	0	0	0	113.6
1126	S	35.3	Very low	35.9	Very low	113 Å²	113	142.9 Å²	142.9	79%	0.79	81%	0.811	S	S	*	*			trans	161.7	151.6	142.5	41.6	0	0	0	0	110.7
1127	R	34.3	Very low	35.2	Very low	249 Å²	249	140.8 Å²	140.8	94%	0.94	81%	0.809	S	S	*	*			cis	-149	158	-2.4	-120.7	174.9	-162	-156.6	6.1	110.1
1128	L	33.3	Very low	34.8	Very low	162 Å²	162	139.6 Å²	139.6	85%	0.848	81%	0.81	S	S	*	*			trans	-92.5	178.9	173.3	-84.5	154	0	0	0	111.4
1129	P	36	Very low	34.3	Very low	120 Å²	120	136.6 Å²	136.6	78%	0.779	80%	0.803	S	S	*	*			cis	-122.4	-147.2	2	30.5	-4.8	0	0	0	111.3
1130	A	33.9	Very low	33.7	Very low	80 Å²	80	136.1 Å²	136.1	66%	0.661	80%	0.802	S	S	*	*			cis	-164.5	160.1	6.9	0	0	0	0	0	114.5
1131	R	31.2	Very low	33.5	Very low	254 Å²	254	134.9 Å²	134.9	96%	0.958	80%	0.797	S	S	*	*			trans	48.3	130.5	144.5	-74.5	178.6	165.2	160	-4.4	122.5
1132	G	32.7	Very low	33	Very low	76 Å²	76	137.7 Å²	137.7	78%	0.784	80%	0.796	S	S	*	*			trans	172.9	26.3	158.1	0	0	0	0	0	122.5
1133	D	29.4	Very low	32.7	Very low	154 Å²	154	134.7 Å²	134.7	82%	0.824	78%	0.784	S	S	*	*			trans	-79.9	176.9	176.9	-46.4	-82	0	0	0	113.6
1134	P	40.9	Very low	32.1	Very low	112 Å²	112	135.4 Å²	135.4	73%	0.727	78%	0.779	S	S	*	*				-134	-146.3	-60	38.7	-19.6	0	0	0	111.6
1135	C	26	Very low	32.1	Very low	110 Å²	110	127.4 Å²	127.4	74%	0.743	77%	0.769	S	S	*	*			trans	113.4	119.1	149.5	-73.4	0	0	0	0	122.5
1136	V	29.7	Very low	31.4	Very low	146 Å²	146	129.1 Å²	129.1	89%	0.885	77%	0.772	S	S	*	*				77.7	131	127.4	177.1	0	0	0	0	121.7
1137	G	30.4	Very low	31.1	Very low	65 Å²	65	129.9 Å²	129.9	67%	0.67	77%	0.767	S	S	*	*			trans	147	98.6	165.8	0	0	0	0	0	110.7
1138	A	29.9	Very low	31	Very low	101 Å²	101	124.9 Å²	124.9	84%	0.835	76%	0.759	S	S	*	*				67.3	131	67.3	0	0	0	0	0	113.1
1139	S	31.1	Very low	30.7	Very low	104 Å²	104	124.8 Å²	124.8	73%	0.727	75%	0.752	S	S	*	*			cis	-167.1	149.2	1.8	49.5	0	0	0	0	114.1
1140	S	29.4	Very low	30.2	Very low	101 Å²	101	126.4 Å²	126.4	71%	0.706	75%	0.751	S	S	*	*			trans	20.5	135.2	146.3	61.1	0	0	0	0	123.3
1141	S	32.1	Very low	30.1	Very low	104 Å²	104	130.5 Å²	130.5	73%	0.727	76%	0.761	S	S	*	*				166.5	132.8	115.7	-74.5	0	0	0	0	110.6
1142	Q	29.2	Very low	29.9	Very low	178 Å²	178	123.9 Å²	123.9	83%	0.832	75%	0.749	S	S	*	*				74	137.3	52.9	-71	-155.7	-0.1	0	0	113.8
1143	V	27.7	Very low	29.9	Very low	95 Å²	95	126.3 Å²	126.3	58%	0.576	74%	0.744	S	S	*	*			cis	-158	179.7	-12.3	151.5	0	0	0	0	107
1144	F	27.3	Very low	29.9	Very low	188 Å²	188	125.5 Å²	125.5	83%	0.825	74%	0.74	S	S	*	*			trans	86.1	144.4	169	-54.5	-74.6	0	0	0	116.8	L1146	F1144-L1146 HydrophobicContact CD1-CD1 4.31Å
1145	G	31.9	Very low	29.5	Very low	64 Å²	64	127.4 Å²	127.4	66%	0.66	74%	0.743	S	S	*	*			cis	-158.5	138.7	-5.1	0	0	0	0	0	110.5
1146	L	28.2	Very low	29.7	Very low	136 Å²	136	128.1 Å²	128.1	71%	0.712	74%	0.74	S	S	*	*				78.1	103.4	88.9	-76.4	171.4	0	0	0	116	F1144	F1144-L1146 HydrophobicContact CD1-CD1 4.31Å
1147	N	28.2	Very low	29.7	Very low	129 Å²	129	126.9 Å²	126.9	69%	0.69	73%	0.728	S	S	*	*			trans	85.5	144.3	130.4	-70	-1.7	0	0	0	123.2
1148	N	31.8	Very low	29.9	Very low	144 Å²	144	132.8 Å²	132.8	77%	0.77	74%	0.738	S	S	*	*			trans	79	153.2	150.1	-65.8	-25.5	0	0	0	119.6
1149	K	26.9	Very low	29.8	Very low	160 Å²	160	133.9 Å²	133.9	70%	0.696	73%	0.728	S	S	*	*			cis	-173.9	143.1	-30.9	-175.5	165.1	176	178.2	0	106.6
1150	M	25.7	Very low	29.9	Very low	153 Å²	153	135.5 Å²	135.5	75%	0.754	73%	0.734	S	S	*	*			trans	31.1	128.6	160.6	-67.6	164.5	161.6	0	0	119.5
1151	N	32.1	Very low	29.8	Very low	166 Å²	166	137.4 Å²	137.4	89%	0.888	74%	0.736	S	S	*	*				-149.1	133.8	114.8	-107.3	-0.2	0	0	0	110.4
1152	T	26.8	Very low	29.8	Very low	115 Å²	115	138.5 Å²	138.5	71%	0.706	74%	0.744	S	S	*	*			trans	-82.1	158.2	156.7	50.3	0	0	0	0	108.8
1153	D	33	Very low	29.7	Very low	127 Å²	127	136.4 Å²	136.4	68%	0.679	74%	0.744	S	S	*	*				160.3	140.4	124.2	-81.1	5.2	0	0	0	110.2
1154	N	28.7	Very low	29.9	Very low	138 Å²	138	140.7 Å²	140.7	74%	0.738	76%	0.76	S	S	*	*			trans	29.8	136.1	144.6	-47.9	-38.7	0	0	0	118.9
1155	L	33.1	Very low	30	Very low	152 Å²	152	138.7 Å²	138.7	80%	0.796	76%	0.758	S	S	*	*				-164.7	130.3	61.5	-169.3	66.1	0	0	0	114.2
1156	D	30.4	Very low	30	Very low	124 Å²	124	142.8 Å²	142.8	66%	0.663	76%	0.764	S	S	*	*			trans	9.8	142.4	149.6	-67.8	-46.7	0	0	0	124.8
1157	N	29.1	Very low	30.1	Very low	120 Å²	120	143.5 Å²	143.5	64%	0.642	77%	0.769	S	S	*	*			trans	58.3	120	136.2	-66.1	-40.8	0	0	0	121.4
1158	H	34.6	Very low	30.4	Very low	189 Å²	189	144.5 Å²	144.5	88%	0.875	77%	0.774	S	S	*	*				-146	132.8	110	-127.8	-76.2	0	0	0	114
1159	I	27.7	Very low	30.2	Very low	124 Å²	124	143.3 Å²	143.3	64%	0.636	77%	0.772	S	S	*	*			trans	-99.5	141.6	175.3	-65.5	160.2	0	0	0	108.9
1160	T	33.9	Very low	30.4	Very low	138 Å²	138	141.7 Å²	141.7	85%	0.847	77%	0.771	S	S	*	*			trans	-160	137.4	142.7	12.8	0	0	0	0	112.3
1161	N	27.3	Very low	30.6	Very low	141 Å²	141	140.9 Å²	140.9	75%	0.754	77%	0.77	S	S	*	*			trans	-84.1	150.3	173.6	-63.2	-43.3	0	0	0	111.5
1162	S	32.1	Very low	30.3	Very low	127 Å²	127	137.9 Å²	137.9	89%	0.888	76%	0.762	S	S	*	*			trans	-144.4	71.8	160.3	-78.8	0	0	0	0	111.2
1163	T	26.8	Very low	30.5	Very low	135 Å²	135	141.3 Å²	141.3	83%	0.828	77%	0.77	S	S	*	*			trans	-73.2	121.1	163.7	46.6	0	0	0	0	109.8
1164	M	32.8	Very low	30.1	Very low	184 Å²	184	141.2 Å²	141.2	91%	0.906	78%	0.775	S	S	*	*			trans	-130.9	117.8	161.7	-102.4	-171.2	165.3	0	0	110.7
1165	N	28.1	Very low	30.3	Very low	147 Å²	147	143.9 Å²	143.9	79%	0.786	78%	0.783	S	S	*	*			trans	-58.7	142.1	159.8	-76.2	-31.5	0	0	0	109.2
1166	N	33	Very low	30	Very low	149 Å²	149	143.2 Å²	143.2	80%	0.797	78%	0.78	S	S	*	*			trans	-145.5	106.3	140.4	-102.8	-31	0	0	0	108.9	N1168	N1166-N1168 PolarHBondContact O-N 3.4Å
1167	N	29.5	Very low	30.1	Very low	151 Å²	151	148.8 Å²	148.8	81%	0.807	79%	0.793	S	S	*	*			trans	-65.3	122	159	-66.7	-34.9	0	0	0	106.9
1168	N	34.1	Very low	30.1	Very low	150 Å²	150	147.9 Å²	147.9	80%	0.802	80%	0.796	S	S	*	*			trans	-142	106.8	151.9	-94.1	-31.4	0	0	0	107.8	N1166	N1166-N1168 PolarHBondContact O-N 3.4Å
1169	T	28.5	Very low	29.7	Very low	119 Å²	119	146.4 Å²	146.4	73%	0.73	79%	0.794	S	S	*	*			trans	-59.8	142.9	156.8	51.7	0	0	0	0	108.6
1170	D	30.4	Very low	29.9	Very low	127 Å²	127	147.2 Å²	147.2	68%	0.679	80%	0.798	S	S	*	*				172.8	146.7	114.3	-89.7	4.6	0	0	0	112.5
1171	N	30.3	Very low	29.6	Very low	135 Å²	135	147.8 Å²	147.8	72%	0.722	79%	0.791	S	S	*	*			trans	58.2	99.6	152.5	-56.9	-28.5	0	0	0	117.4
1172	S	26.2	Very low	29.7	Very low	104 Å²	104	149.2 Å²	149.2	73%	0.727	79%	0.791	S	S	*	*				75.1	129.5	96.4	72.9	0	0	0	0	113.2
1173	E	31.2	Very low	29.5	Very low	186 Å²	186	150.9 Å²	150.9	87%	0.869	79%	0.785	S	S	*	*				-130.1	148.7	54.5	-67.4	166	139	0	0	114.5
1174	T	25.4	Very low	29.6	Very low	126 Å²	126	151.7 Å²	151.7	77%	0.773	78%	0.783	S	S	*	*			trans	-119.9	101	175	50.3	0	0	0	0	110.1
1175	E	31.7	Very low	29.2	Very low	194 Å²	194	148.4 Å²	148.4	91%	0.907	77%	0.773	S	S	*	*			trans	-86.2	114.3	174	-74.2	-134.9	113.8	0	0	112.3
1176	N	27.3	Very low	29.1	Very low	138 Å²	138	150.6 Å²	150.6	74%	0.738	80%	0.8	S	S	*	*			trans	-62.9	132.2	-174.6	-57.2	-84.8	0	0	0	114
1177	Y	32.1	Very low	28.9	Very low	240 Å²	240	150.7 Å²	150.7	94%	0.941	80%	0.8	S	S	*	*			trans	-128.1	122.8	138.2	-89.5	-83	0	0	0	109.4
1178	S	30	Very low	28.9	Very low	102 Å²	102	150.6 Å²	150.6	71%	0.713	80%	0.799	S	S	*	*			trans	-90.7	143.9	-161.5	43.1	0	0	0	0	114.1	I1180	S1178-I1180 PolarHBondContact O-N 2.87Å
1179	L	25.8	Very low	28.6	Very low	157 Å²	157	150.7 Å²	150.7	82%	0.822	80%	0.799	S	S	*	*			trans	-58.3	125.1	165.7	-108.2	72	0	0	0	110.3
1180	I	30.8	Very low	28.6	Very low	142 Å²	142	152.5 Å²	152.5	73%	0.728	80%	0.803	S	S	*	*			trans	-99.2	86.7	161	-59	-177	0	0	0	108	S1178 F1182	S1178-I1180 PolarHBondContact O-N 2.87Å; I1180-F1182 HydrophobicContact CG2-CD2 3.66Å; I1180-F1182 HydrophobicContact CG2-CE2 3.95Å; I1180-F1182 PolarHBondContact O-N 2.98Å
1181	Q	27.5	Very low	28.5	Very low	150 Å²	150	154.1 Å²	154.1	70%	0.701	81%	0.811	S	S	*	*			trans	-76.8	108.6	167.3	-109.5	-74.4	-14.4	0	0	109
1182	F	30.3	Very low	28.4	Very low	171 Å²	171	155.4 Å²	155.4	75%	0.75	82%	0.817	S	S	*	*			trans	-98.4	92.4	169.6	-107.3	-71.1	0	0	0	110.2	I1180 I1184	I1180-F1182 HydrophobicContact CG2-CD2 3.66Å; I1180-F1182 HydrophobicContact CG2-CE2 3.95Å; I1180-F1182 PolarHBondContact O-N 2.98Å; F1182-I1184 PolarHBondContact O-N 3.2Å
1183	Q	27.3	Very low	28.5	Very low	161 Å²	161	159.1 Å²	159.1	75%	0.752	82%	0.823	S	S	*	*			trans	-66.7	127.7	159.1	-68.9	-171.3	-66.9	0	0	108.9
1184	I	29.2	Very low	28.3	Very low	153 Å²	153	157 Å²	157	79%	0.785	82%	0.82	S	S	*	*			trans	-108.8	114.5	166	-61.6	177.9	0	0	0	107	F1182	F1182-I1184 PolarHBondContact O-N 3.2Å
1185	T	25.1	Very low	28.6	Very low	115 Å²	115	159.6 Å²	159.6	71%	0.706	82%	0.824	S	S	*	*			trans	-128	132.9	175.8	46.7	0	0	0	0	109.7
1186	S	25.6	Very low	28.3	Very low	192 Å²	192	156.5 Å²	156.5	100%	1.343	82%	0.816	S	S	*	*			trans	64	0	179.5	174	0	0	0	0	115

Retrieved 1,186 of 1,186 residues in 845.9 ms (Link to these results)

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