A0A5K4EUC0_SCHMA Loading...

Putative clasp2 protein

AlphaFold DB , UniProt , Accession A0A5K4EUC0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,243 aa.

						>A0A5K4EUC0_SCHMA|A0A5K4EUC0
MSNSAADGIERKPGTLSKTSVSGGKSVRKRSTGDPQGAGAVDEDVFRQSFIPSMSITASSGKELTEIINRIKDALSGNPEEWEKRVDALKTLRAIVANGALQYDEFIPLLKTLENSIDLSLRDLRSSVVREACITVAFLSQEIRNRFDRFAESVLQTIIALLSNSAKVMATSGVVAMRFILENTCSSRLLPILISSLSSKSNVTRKCICEFLEIIFRTWPLNILEKNLSVLQDALRRGISDADQEARLFTRRSFPLFVAKFPEQANLFLQNLDSQKRKLIEKDLIAAGLSEGIGAGDTATTGSSRSQPGSQSNLTYQSTKRPNRPVLGTSSLANNTNRSRPPLTSQNEYNTVGRSYRQGSIASNYDSRPRQIGRKLVSQSQPTSREVSPSRLAYFTAYGTTTSNNNDGQKLQFNTTNPNRNGTIGLVDNNNTTTERTTRLLMNSRVPRSQGASRETSPTRSTASGYTMPSYQHNNSFQLTGTNQIGQMNYRRQQQQRPSLGTLSDCADLGDGPLYGRHYSTGNNRGPYGSDDNFSETSSQCSERSGRSVPGYRRQSSSKVTSNLKEIISQLQAVQWSDRKDGLTNLQNYMRSGYPLNPDDIHCLTEIFSKMFADSQSKVVSLFMDTLQFFIKEYNPLLRDWLYTLLIRLLYRQSHEALSSHQKAIQETLFVLRSHFPLNTQFNSCCHFIMDNAHTPNFRVKTCLLEYMKDLILMMSPDLIANPSNEVINAVGKIISWSAEPKSADVRRMASRVVIKLFDLNSTSFSNLLQSLPRGVQDRAHEVLKTYQKTATGGGLINLTDTNHNSPSWKSSSGSLRKYSLPVTTAGRSSMTRSVDQDHMIFSPPSSGRYGSISGPYYSSQRSHNSAGSDSGRVSPESMNRIIRETTDGLQSLSMGASGGGILTSVGITSPTRRVSADPSFTTNDYTYATNGNTGVLRTVQPNNFPNSQPTALQSPNIIPSNVNPSYASSQGTTASNDPTLQSTYGLRTNKALLNTLINYDPGDEMPPEDIMSEILQELSNHNERYEQRKTCMLKLIKLLRDGVISNWDEYFKPTLLILLETLGDDGHETRALALRVLQELVRAKPELFHDFAYLFVIKVLEACRDSEKSVVRAAEDCANTVAQNLPQELCLNVLTPLINDSQLHINLPAIKMQMQVIQNSSPELVHEFINALIPGLVIACNHEESAIRKASVFCLVAIAMKLGDDIWSYLTELNAGKKRLLKLYIDRQQSSATSEDSITTRS
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.2	Very low	34.9	Very low	232 Å²	232	147.3 Å²	147.3	100%	1.143	85%	0.853	S	S	*	*				0	158.1	0	-69.8	163.5	74.8	0	0	108.3
2	S	39.2	Very low	34.6	Very low	120 Å²	120	149.2 Å²	149.2	84%	0.839	84%	0.843	S	S	*	*			trans	48.3	74.9	171.4	54.7	0	0	0	0	117.2
3	N	31.5	Very low	34.8	Very low	166 Å²	166	147.8 Å²	147.8	89%	0.888	84%	0.844	S	S	*	*			trans	-68.3	151.3	144.6	-84.1	-9.9	0	0	0	109.2
4	S	42.3	Very low	34.6	Very low	129 Å²	129	142.9 Å²	142.9	90%	0.902	84%	0.842	S	S	*	*			trans	-156.5	126.8	149.1	-128.5	0	0	0	0	110.9
5	A	34.4	Very low	34.3	Very low	101 Å²	101	142.6 Å²	142.6	84%	0.835	84%	0.843	S	S	*	*			trans	-129.4	145.3	172.4	0	0	0	0	0	107.9
6	A	38	Very low	34.3	Very low	98 Å²	98	143.8 Å²	143.8	81%	0.81	84%	0.843	S	S	*	*			trans	-159.4	147.3	167.9	0	0	0	0	0	111.2
7	D	33.8	Very low	34	Very low	162 Å²	162	141 Å²	141	87%	0.866	83%	0.833	S	S	*	*			trans	-53.6	161.5	165.6	-53.7	-85.4	0	0	0	112.4
8	G	30	Very low	33.7	Very low	67 Å²	67	144.6 Å²	144.6	69%	0.691	84%	0.836	S	S	*	*			cis	107.5	129.1	16.9	0	0	0	0	0	110.8
9	I	36.4	Very low	33.6	Very low	167 Å²	167	144.3 Å²	144.3	86%	0.856	84%	0.837	S	S	*	*			trans	-159.7	136.9	167.9	-108.6	154.5	0	0	0	110.2
10	E	29.1	Very low	33.4	Very low	140 Å²	140	143 Å²	143	65%	0.654	84%	0.836	S	S	*	*			trans	-89.1	147.3	-179	-177.2	-178.4	-159.6	0	0	112.1	K12	E10-K12 IonicContact OE1-NZ 3.23Å; E10-K12 PolarHBondContact OE1-NZ 2.88Å
11	R	31.9	Very low	33.4	Very low	238 Å²	238	143.1 Å²	143.1	90%	0.898	84%	0.839	S	S	*	*			trans	-157.8	132.5	149.5	-118.7	165.5	-108	-157.6	-4.3	112.4
12	K	30.9	Very low	33.1	Very low	170 Å²	170	137.7 Å²	137.7	74%	0.739	82%	0.824	S	S	*	*			trans	-99.8	169.8	-177.2	-101.8	175.1	-170.1	121.2	0	112.2	E10	E10-K12 IonicContact OE1-NZ 3.23Å; E10-K12 PolarHBondContact OE1-NZ 2.88Å
13	P	37.6	Very low	32.5	Very low	131 Å²	131	136 Å²	136	85%	0.851	83%	0.826	S	S	*	*			trans	-88.2	163.1	-151.6	34.9	-38.6	0	0	0	115.8
14	G	32.5	Very low	32.4	Very low	79 Å²	79	131.9 Å²	131.9	81%	0.814	82%	0.822	S	S	*	*			trans	-140.7	138.4	171.7	0	0	0	0	0	112.7
15	T	29.9	Very low	31.7	Very low	139 Å²	139	136 Å²	136	85%	0.853	82%	0.824	S	S	*	*			trans	-80.9	142.9	-177.8	-50.5	0	0	0	0	112.2
16	L	33.2	Very low	31.4	Very low	161 Å²	161	137 Å²	137	84%	0.843	83%	0.825	S	S	*	*			trans	-164	132.6	147.7	-108.9	156.8	0	0	0	115.3
17	S	29.5	Very low	31.1	Very low	97 Å²	97	138.4 Å²	138.4	68%	0.678	82%	0.822	S	S	*	*			trans	30	133	151.3	58.6	0	0	0	0	123.2
18	K	29.1	Very low	30.6	Very low	206 Å²	206	142 Å²	142	90%	0.896	82%	0.824	S	S	*	*			trans	-57.4	140.1	162.3	-56.4	167.9	-179.7	173.2	0	112.9
19	T	31.8	Very low	30.6	Very low	139 Å²	139	148.4 Å²	148.4	85%	0.853	83%	0.833	S	S	*	*			trans	-134.9	149.1	143	50.6	0	0	0	0	109.5
20	S	28.6	Very low	30	Very low	117 Å²	117	151.4 Å²	151.4	82%	0.818	83%	0.833	S	S	*	*			trans	-119.2	114.5	-177.8	56.2	0	0	0	0	110.6
21	V	35.1	Very low	30	Very low	146 Å²	146	150.4 Å²	150.4	89%	0.885	84%	0.842	S	S	*	*			trans	-130.5	139.7	170.1	-177.4	0	0	0	0	108.9
22	S	29.6	Very low	29.8	Very low	119 Å²	119	145.7 Å²	145.7	83%	0.832	84%	0.84	S	S	*	*			trans	-97.6	149.4	-176	53.5	0	0	0	0	112.3
23	G	27.3	Very low	29.5	Very low	85 Å²	85	141.1 Å²	141.1	88%	0.876	84%	0.841	S	S	*	*			trans	131.5	102.9	160.9	0	0	0	0	0	115
24	G	29.1	Very low	29.2	Very low	78 Å²	78	141.3 Å²	141.3	80%	0.804	83%	0.834	S	S	*	*			trans	-170.8	78.5	175.5	0	0	0	0	0	111.6	S26	G24-S26 PolarHBondContact O-N 3.38Å
25	K	27.1	Very low	29.1	Very low	217 Å²	217	143.1 Å²	143.1	94%	0.943	83%	0.832	S	S	*	*			trans	-74.6	110.2	176	-68.4	176	-178.4	172	0	109.3
26	S	29.5	Very low	29.6	Very low	122 Å²	122	142.3 Å²	142.3	85%	0.853	82%	0.818	S	S	*	*			trans	-102.6	149.6	161.1	-165.3	0	0	0	0	110.8	G24	G24-S26 PolarHBondContact O-N 3.38Å
27	V	30.1	Very low	29.9	Very low	126 Å²	126	136.4 Å²	136.4	76%	0.764	80%	0.796	S	S	*	*			trans	-91.3	123.6	-157.1	174.6	0	0	0	0	112.4	K29	V27-K29 PolarHBondContact O-N 2.87Å
28	R	25.1	Very low	30.4	Very low	238 Å²	238	136.8 Å²	136.8	90%	0.898	81%	0.805	S	S	*	*			trans	-64.7	92.8	163	-77.7	-179.2	169	174.6	-5.3	110.3	R30	R28-R30 PolarHBondContact O-N 3.14Å
29	K	28.4	Very low	31.6	Very low	201 Å²	201	128.9 Å²	128.9	87%	0.874	78%	0.783	S	S	*	*			trans	-81.2	105.3	168.6	-150.3	176	-173.1	-178.2	0	108.5	V27 S31	V27-K29 PolarHBondContact O-N 2.87Å; K29-S31 PolarHBondContact O-N 3.21Å
30	R	23.8	Very low	33.4	Very low	230 Å²	230	123.6 Å²	123.6	87%	0.868	75%	0.753	S	S	*	*			trans	-73.2	111.1	177	-66.6	178.2	-179	163.1	-1	109.7	R28	R28-R30 PolarHBondContact O-N 3.14Å
31	S	29.1	Very low	35.5	Very low	120 Å²	120	118.9 Å²	118.9	84%	0.839	72%	0.72	S	S	*	*			trans	-77	158.3	150.5	47.4	0	0	0	0	109.4	K29	K29-S31 PolarHBondContact O-N 3.21Å
32	T	27.6	Very low	37.7	Very low	139 Å²	139	114.5 Å²	114.5	85%	0.853	69%	0.691	S	S	*	*			trans	-114.7	125.4	-164.9	47.4	0	0	0	0	113.5
33	G	25.7	Very low	40.2	Very low	74 Å²	74	111 Å²	111	76%	0.763	66%	0.662	S	S	*	*			trans	84.9	89.2	153.7	0	0	0	0	0	116.6
34	D	31.4	Very low	42.8	Very low	134 Å²	134	111.9 Å²	111.9	72%	0.717	65%	0.646	S	S	*	*				-165.8	158.1	94.2	-122.3	1.4	0	0	0	111.4	Q36	D34-Q36 PolarHBondContact O-N 3.2Å; D34-Q36 VanDerWaalsContact O-N 3.07Å
35	P	31.1	Very low	45.4	Very low	117 Å²	117	111.6 Å²	111.6	76%	0.76	63%	0.629	S	S	*	*			trans	-78	93.3	175.7	31.5	-30.5	0	0	0	110	G37	P35-G37 VanDerWaalsContact C-N 3.28Å; P35-G37 PolarHBondContact O-N 3.28Å
36	Q	40.5	Very low	48.4	Very low	122 Å²	122	101.2 Å²	101.2	57%	0.57	58%	0.584	S	S	*	*			trans	-62.6	84.8	172.3	-69.5	-168.9	33.5	0	0	111.4	D34 A40	D34-Q36 PolarHBondContact O-N 3.2Å; D34-Q36 VanDerWaalsContact O-N 3.07Å; Q36-A40 HydrophobicContact CB-CB 4.18Å; Q36-A40 HydrophobicContact CG-CB 4.47Å
37	G	37.5	Very low	51.2	Low	37 Å²	37	99.5 Å²	99.5	38%	0.381	56%	0.558	S	S	.	*			trans	-60.4	155.8	172	0	0	0	0	0	111.8	P35 A40 K167	P35-G37 VanDerWaalsContact C-N 3.28Å; P35-G37 PolarHBondContact O-N 3.28Å; G37-A40 PolarHBondContact O-N 2.77Å; G37-K167 PolarHBondContact O-NZ 3.32Å
38	A	41.5	Very low	53.9	Low	105 Å²	105	100.4 Å²	100.4	87%	0.868	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.9	144.3	-173.1	0	0	0	0	0	114.4	A40	A38-A40 VanDerWaalsContact C-N 3.34Å
39	G	54.1	Low	56.8	Low	41 Å²	41	90.3 Å²	90.3	42%	0.423	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	7.8	-178.4	0	0	0	0	0	115.5	K167 V168	G39-K167 CarbonylContact O-C 3.57Å; G39-K167 WeakPolarHBondContact O-CG 3.47Å; G39-V168 WeakPolarHBondContact O-CG2 3.49Å; G39-V168 PolarHBondContact O-N 3.38Å
40	A	69.4	Low	59.7	Low	28 Å²	28	81.3 Å²	81.3	23%	0.231	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-72	145.3	159.2	0	0	0	0	0	109.9	Q36 G37 A38 T171	Q36-A40 HydrophobicContact CB-CB 4.18Å; Q36-A40 HydrophobicContact CG-CB 4.47Å; G37-A40 PolarHBondContact O-N 2.77Å; A38-A40 VanDerWaalsContact C-N 3.34Å; A40-T171 HydrophobicContact CB-CG2 4.37Å
41	V	72.6	Confident	62.3	Low	18 Å²	18	75.5 Å²	75.5	11%	0.109	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-92.3	118.7	164.5	-173.9	0	0	0	0	108.6	F46 V168 T171	V41-F46 HydrophobicContact CG1-CB 4.17Å; V41-F46 HydrophobicContact CG1-CD2 3.94Å; V41-V168 HydrophobicContact CG2-CB 4.45Å; V41-V168 HydrophobicContact CG2-CG1 3.9Å; V41-T171 PolarHBondContact N-OG1 2.71Å
42	D	80.7	Confident	64.3	Low	54 Å²	54	70.8 Å²	70.8	29%	0.289	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-72.8	142.2	175.5	177	-90.2	0	0	0	111.2	D44 V45 F46	D42-D44 WeakPolarHBondContact OD1-CB 3.42Å; D42-D44 PolarHBondContact OD1-N 2.89Å; D42-V45 HydrophobicContact CB-CB 4.16Å; D42-V45 HydrophobicContact CB-CG2 4.01Å; D42-V45 PolarHBondContact O-N 3.3Å; D42-V45 PolarHBondContact OD1-N 3.37Å; D42-V45 VanDerWaalsContact OD1-N 3.09Å; D42-F46 WeakPolarHBondContact O-CB 3.44Å; D42-F46 PolarHBondContact O-N 2.85Å
43	E	83.5	Confident	66.2	Low	46 Å²	46	70.7 Å²	70.7	22%	0.215	44%	0.437	C	S	.	.	H	α-helix	trans	-71.3	-34.3	-173.6	-164.7	-179.2	127.1	0	0	112.9	F46 R47 V175 R178	E43-F46 WeakPolarHBondContact O-CB 3.46Å; E43-F46 PolarHBondContact O-N 3.02Å; E43-R47 WeakPolarHBondContact O-CB 3.48Å; E43-R47 WeakPolarHBondContact O-CG 2.91Å; E43-R47 PolarHBondContact O-N 2.93Å; E43-R47 IonicContact OE1-CZ 2.72Å; E43-R47 VanDerWaalsContact OE1-CZ 3.31Å; E43-R47 IonicContact OE1-NE 3.27Å; E43-R47 PolarHBondContact OE1-NE 2.91Å; E43-R47 IonicContact OE1-NH2 3.85Å; E43-R47 PolarHBondContact OE1-NH2 3.38Å; E43-V175 HydrophobicContact CG-CG1 3.9Å; E43-V175 HydrophobicContact CG-CG2 4.37Å; E43-R178 IonicContact OE2-CZ 3.01Å; E43-R178 IonicContact OE2-NH1 2.75Å; E43-R178 PolarHBondContact OE2-NH1 3.16Å
44	D	81.7	Confident	68.2	Low	103 Å²	103	70 Å²	70	55%	0.551	42%	0.415	S	S	*	.	H	α-helix	trans	-71.2	-37	176.1	-72.7	-36.3	0	0	0	110.5	D42 F46 R47 Q48	D42-D44 WeakPolarHBondContact OD1-CB 3.42Å; D42-D44 PolarHBondContact OD1-N 2.89Å; D44-F46 VanDerWaalsContact C-N 3.34Å; D44-R47 PolarHBondContact O-N 2.97Å; D44-Q48 WeakPolarHBondContact O-CB 3.49Å; D44-Q48 WeakPolarHBondContact O-CG 3.29Å; D44-Q48 PolarHBondContact O-N 2.8Å; D44-Q48 PolarHBondContact O-NE2 2.94Å; D44-Q48 VanDerWaalsContact O-NE2 3.16Å
45	V	82.6	Confident	70	Confident	71 Å²	71	68.8 Å²	68.8	43%	0.43	42%	0.417	S	S	.	.	H	α-helix	trans	-68.4	-33.2	173	179.8	0	0	0	0	111.8	D42 S49	D42-V45 HydrophobicContact CB-CB 4.16Å; D42-V45 HydrophobicContact CB-CG2 4.01Å; D42-V45 PolarHBondContact O-N 3.3Å; D42-V45 PolarHBondContact OD1-N 3.37Å; D42-V45 VanDerWaalsContact OD1-N 3.09Å; V45-S49 PolarHBondContact O-N 3.49Å; V45-S49 PolarHBondContact O-OG 3.49Å
46	F	89.9	Confident	72.2	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-66.5	-48.1	172.3	-169.2	-85.8	0	0	0	110.9	V41 D42 E43 D44 Q48 S49 F50 C133 I134 A137 V175 A176 F179	V41-F46 HydrophobicContact CG1-CB 4.17Å; V41-F46 HydrophobicContact CG1-CD2 3.94Å; D42-F46 WeakPolarHBondContact O-CB 3.44Å; D42-F46 PolarHBondContact O-N 2.85Å; E43-F46 WeakPolarHBondContact O-CB 3.46Å; E43-F46 PolarHBondContact O-N 3.02Å; D44-F46 VanDerWaalsContact C-N 3.34Å; F46-Q48 PolarHBondContact O-N 3.38Å; F46-S49 VanDerWaalsContact O-CB 3.29Å; F46-S49 WeakPolarHBondContact O-CB 3.23Å; F46-S49 PolarHBondContact O-N 3.26Å; F46-F50 AromaticContact CD1-CE1 3.64Å; F46-F50 HydrophobicContact CD1-CE1 3.64Å; F46-F50 HydrophobicContact CD1-CZ 4.36Å; F46-F50 AromaticContact CE1-CE1 3.7Å; F46-F50 HydrophobicContact CE1-CE1 3.7Å; F46-F50 HydrophobicContact CE1-CZ 4.31Å; F46-F50 VanDerWaalsContact O-CD1 3.32Å; F46-F50 WeakPolarHBondContact O-CD1 3.29Å; F46-C133 HydrophobicContact CE2-CB 4.27Å; F46-C133 HydrophobicContact CZ-CB 4.25Å; F46-I134 HydrophobicContact CD1-CG1 4.37Å; F46-I134 HydrophobicContact CD2-CD1 4.31Å; F46-I134 HydrophobicContact CD2-CG1 3.66Å; F46-I134 HydrophobicContact CE1-CG1 4.14Å; F46-I134 HydrophobicContact CE2-CB 4.47Å; F46-I134 HydrophobicContact CE2-CD1 4.36Å; F46-I134 HydrophobicContact CE2-CG1 3.39Å; F46-I134 HydrophobicContact CG-CG1 4.16Å; F46-I134 HydrophobicContact CZ-CB 4.31Å; F46-I134 HydrophobicContact CZ-CG1 3.67Å; F46-A137 HydrophobicContact CE1-CB 3.55Å; F46-A137 HydrophobicContact CZ-CB 4Å; F46-V175 HydrophobicContact CB-CG1 4.25Å; F46-V175 HydrophobicContact CD1-CB 4.32Å; F46-V175 HydrophobicContact CD1-CG1 3.35Å; F46-V175 HydrophobicContact CD2-CB 4.35Å; F46-V175 HydrophobicContact CD2-CG1 4.17Å; F46-V175 HydrophobicContact CE1-CB 4.28Å; F46-V175 HydrophobicContact CE1-CG1 3.51Å; F46-V175 HydrophobicContact CE2-CB 4.31Å; F46-V175 HydrophobicContact CE2-CG1 4.32Å; F46-V175 HydrophobicContact CG-CB 4.35Å; F46-V175 HydrophobicContact CG-CG1 3.7Å; F46-V175 HydrophobicContact CZ-CB 4.27Å; F46-V175 HydrophobicContact CZ-CG1 4.01Å; F46-A176 HydrophobicContact CZ-CB 4.33Å; F46-F179 HydrophobicContact CD1-CE2 4.24Å; F46-F179 HydrophobicContact CE1-CD2 4.31Å; F46-F179 HydrophobicContact CE1-CE2 4.34Å
47	R	88.6	Confident	74.2	Confident	85 Å²	85	63.8 Å²	63.8	32%	0.321	39%	0.39	S	S	.	.	H	α-helix	trans	-57.5	-44.5	172.8	-77	171.4	-170.2	-90.6	2.2	112.2	E43 D44 S49 F50 F179 E182	E43-R47 WeakPolarHBondContact O-CB 3.48Å; E43-R47 WeakPolarHBondContact O-CG 2.91Å; E43-R47 PolarHBondContact O-N 2.93Å; E43-R47 IonicContact OE1-CZ 2.72Å; E43-R47 VanDerWaalsContact OE1-CZ 3.31Å; E43-R47 IonicContact OE1-NE 3.27Å; E43-R47 PolarHBondContact OE1-NE 2.91Å; E43-R47 IonicContact OE1-NH2 3.85Å; E43-R47 PolarHBondContact OE1-NH2 3.38Å; D44-R47 PolarHBondContact O-N 2.97Å; R47-S49 PolarHBondContact O-N 3.3Å; R47-S49 VanDerWaalsContact O-N 3.16Å; R47-F50 VanDerWaalsContact O-CB 3.25Å; R47-F50 WeakPolarHBondContact O-CB 3.2Å; R47-F50 WeakPolarHBondContact O-CG 3.35Å; R47-F50 PolarHBondContact O-N 3.23Å; R47-F179 HydrophobicContact CG-CE2 4.28Å; R47-F179 HydrophobicContact CG-CZ 3.66Å; R47-E182 IonicContact NH2-OE2 2.71Å
48	Q	86.9	Confident	76.3	Confident	146 Å²	146	62.6 Å²	62.6	68%	0.682	38%	0.377	S	S	*	.	H	α-helix	trans	-62.2	-19.8	175	-74	162.7	48.3	0	0	113.5	D44 F46 F50	D44-Q48 WeakPolarHBondContact O-CB 3.49Å; D44-Q48 WeakPolarHBondContact O-CG 3.29Å; D44-Q48 PolarHBondContact O-N 2.8Å; D44-Q48 PolarHBondContact O-NE2 2.94Å; D44-Q48 VanDerWaalsContact O-NE2 3.16Å; F46-Q48 PolarHBondContact O-N 3.38Å; Q48-F50 VanDerWaalsContact C-N 3.33Å
49	S	86.5	Confident	78.3	Confident	26 Å²	26	62 Å²	62	18%	0.182	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-6.5	176.6	-52.7	0	0	0	0	113.3	V45 F46 R47 R93 R130	V45-S49 PolarHBondContact O-N 3.49Å; V45-S49 PolarHBondContact O-OG 3.49Å; F46-S49 VanDerWaalsContact O-CB 3.29Å; F46-S49 WeakPolarHBondContact O-CB 3.23Å; F46-S49 PolarHBondContact O-N 3.26Å; R47-S49 PolarHBondContact O-N 3.3Å; R47-S49 VanDerWaalsContact O-N 3.16Å; S49-R93 PolarHBondContact O-NE 3.43Å; S49-R93 PolarHBondContact O-NH2 2.98Å; S49-R130 PolarHBondContact OG-NH2 3.16Å
50	F	88.5	Confident	79.9	Confident	12 Å²	12	62.3 Å²	62.3	5%	0.053	36%	0.362	C	S	.	.	S	Bend	trans	-62.2	-48.9	-172.1	-82.5	16.4	0	0	0	113	F46 R47 Q48 P52 R93 I134 A137 F138 F179	F46-F50 AromaticContact CD1-CE1 3.64Å; F46-F50 HydrophobicContact CD1-CE1 3.64Å; F46-F50 HydrophobicContact CD1-CZ 4.36Å; F46-F50 AromaticContact CE1-CE1 3.7Å; F46-F50 HydrophobicContact CE1-CE1 3.7Å; F46-F50 HydrophobicContact CE1-CZ 4.31Å; F46-F50 VanDerWaalsContact O-CD1 3.32Å; F46-F50 WeakPolarHBondContact O-CD1 3.29Å; R47-F50 VanDerWaalsContact O-CB 3.25Å; R47-F50 WeakPolarHBondContact O-CB 3.2Å; R47-F50 WeakPolarHBondContact O-CG 3.35Å; R47-F50 PolarHBondContact O-N 3.23Å; Q48-F50 VanDerWaalsContact C-N 3.33Å; F50-P52 WeakPolarHBondContact O-CD 3.45Å; F50-R93 WeakPolarHBondContact O-CB 3.36Å; F50-R93 WeakPolarHBondContact O-CD 2.95Å; F50-R93 PolarHBondContact O-NE 2.96Å; F50-I134 HydrophobicContact CD1-CG2 3.91Å; F50-I134 HydrophobicContact CE1-CG2 4.33Å; F50-A137 HydrophobicContact CE1-CB 4.06Å; F50-A137 HydrophobicContact CZ-CB 3.86Å; F50-F138 HydrophobicContact CB-CB 4.48Å; F50-F138 HydrophobicContact CB-CD2 3.76Å; F50-F138 HydrophobicContact CB-CE2 4.33Å; F50-F138 HydrophobicContact CB-CG 4.31Å; F50-F138 HydrophobicContact CD1-CB 4.38Å; F50-F138 HydrophobicContact CD2-CB 4.17Å; F50-F138 AromaticContact CD2-CD2 3.6Å; F50-F138 HydrophobicContact CD2-CD2 3.6Å; F50-F138 HydrophobicContact CD2-CG 4.34Å; F50-F138 HydrophobicContact CE2-CB 4.4Å; F50-F138 HydrophobicContact CE2-CD2 4.36Å; F50-F138 HydrophobicContact CG-CB 4.12Å; F50-F138 AromaticContact CG-CD2 3.89Å; F50-F138 HydrophobicContact CG-CD2 3.89Å; F50-F138 HydrophobicContact CG-CG 4.37Å; F50-F179 HydrophobicContact CE1-CZ 4.38Å; F50-F179 HydrophobicContact CE2-CD1 4.08Å; F50-F179 AromaticContact CE2-CE1 3.5Å; F50-F179 HydrophobicContact CE2-CE1 3.5Å; F50-F179 VanDerWaalsContact CE2-CE1 3.5Å; F50-F179 AromaticContact CE2-CZ 3.8Å; F50-F179 HydrophobicContact CE2-CZ 3.8Å; F50-F179 AromaticContact CZ-CD1 3.85Å; F50-F179 HydrophobicContact CZ-CD1 3.85Å; F50-F179 HydrophobicContact CZ-CD2 4.15Å; F50-F179 AromaticContact CZ-CE1 3.44Å; F50-F179 HydrophobicContact CZ-CE1 3.44Å; F50-F179 VanDerWaalsContact CZ-CE1 3.44Å; F50-F179 AromaticContact CZ-CE2 3.78Å; F50-F179 HydrophobicContact CZ-CE2 3.78Å; F50-F179 HydrophobicContact CZ-CG 4.18Å; F50-F179 AromaticContact CZ-CZ 3.4Å; F50-F179 HydrophobicContact CZ-CZ 3.4Å
51	I	79	Confident	80.8	Confident	108 Å²	108	61.4 Å²	61.4	55%	0.554	36%	0.356	S	S	*	.	S	Bend	trans	-102.3	106.6	177.1	-55.9	178.1	0	0	0	107.8	A97 F138	I51-A97 HydrophobicContact CD1-CB 4.09Å; I51-A97 HydrophobicContact CG1-CB 3.96Å; I51-A97 HydrophobicContact CG2-CB 4.02Å; I51-F138 HydrophobicContact CG1-CE2 4.32Å; I51-F138 HydrophobicContact CG1-CZ 4.39Å
52	P	72.1	Confident	81.5	Confident	20 Å²	20	68.6 Å²	68.6	13%	0.13	39%	0.386	C	S	.	.			trans	-67.2	156	173.6	25.9	-28.4	0	0	0	110.2	F50 M54 K90 R93 A94	F50-P52 WeakPolarHBondContact O-CD 3.45Å; P52-M54 HydrophobicContact CB-CG 4.17Å; P52-M54 HydrophobicContact CB-SD 4.01Å; P52-M54 HydrophobicContact CG-CG 4.02Å; P52-M54 HydrophobicContact CG-SD 4.01Å; P52-M54 PolarHBondContact O-N 3.44Å; P52-K90 HydrophobicContact CB-CB 4.07Å; P52-K90 HydrophobicContact CB-CG 4.24Å; P52-K90 HydrophobicContact CG-CB 3.87Å; P52-K90 HydrophobicContact CG-CG 4.44Å; P52-K90 VanDerWaalsContact CG-O 3.31Å; P52-K90 WeakPolarHBondContact CG-O 3.31Å; P52-R93 HydrophobicContact CG-CB 4.45Å; P52-A94 HydrophobicContact CG-CB 4.29Å
53	S	67.2	Low	82	Confident	137 Å²	137	69.1 Å²	69.1	96%	0.958	39%	0.386	S	S	*	.	S	Bend	trans	-73.1	30	-174.3	64.9	0	0	0	0	114.9
54	M	67.7	Low	82.4	Confident	59 Å²	59	66.9 Å²	66.9	29%	0.291	38%	0.376	S	S	.	.			trans	-120.5	118.4	-177.3	64.5	-152.3	-70.9	0	0	109.7	P52 I56 K90 T91 A94	P52-M54 HydrophobicContact CB-CG 4.17Å; P52-M54 HydrophobicContact CB-SD 4.01Å; P52-M54 HydrophobicContact CG-CG 4.02Å; P52-M54 HydrophobicContact CG-SD 4.01Å; P52-M54 PolarHBondContact O-N 3.44Å; M54-I56 HydrophobicContact CE-CD1 3.67Å; M54-I56 PolarHBondContact O-N 3.4Å; M54-K90 HydrophobicContact SD-CB 3.76Å; M54-T91 WeakPolarHBondContact CE-OG1 3.41Å; M54-A94 HydrophobicContact CG-CB 3.72Å; M54-A94 WeakPolarHBondContact O-CB 3.39Å
55	S	68.8	Low	83	Confident	109 Å²	109	64.2 Å²	64.2	76%	0.762	36%	0.363	S	S	*	.			trans	-86.6	99.9	174.6	54	0	0	0	0	109.5
56	I	77.9	Confident	83.5	Confident	53 Å²	53	66.6 Å²	66.6	27%	0.272	37%	0.37	S	S	.	.			trans	-121.2	114.8	172.3	-58	176.6	0	0	0	107.1	M54 I67 T91 A94 I95 N98	M54-I56 HydrophobicContact CE-CD1 3.67Å; M54-I56 PolarHBondContact O-N 3.4Å; I56-I67 HydrophobicContact CG2-CD1 4.37Å; I56-T91 HydrophobicContact CD1-CG2 3.92Å; I56-A94 HydrophobicContact CB-CB 4.36Å; I56-I95 HydrophobicContact CB-CG2 4.19Å; I56-I95 HydrophobicContact CG2-CG2 3.72Å; I56-I95 WeakPolarHBondContact O-CA 3.22Å; I56-N98 PolarHBondContact N-ND2 3.41Å; I56-N98 WeakPolarHBondContact O-CB 3.07Å; I56-N98 PolarHBondContact O-ND2 3.16Å; I56-N98 VanDerWaalsContact O-ND2 3.15Å
57	T	81.7	Confident	83.6	Confident	81 Å²	81	67.1 Å²	67.1	50%	0.497	37%	0.372	S	S	.	.			trans	-104.5	148	176	45.3	0	0	0	0	109.5	N98	T57-N98 HydrophobicContact CG2-CB 3.82Å
58	A	81.4	Confident	83.9	Confident	12 Å²	12	63 Å²	63	10%	0.099	36%	0.357	C	S	.	.			trans	-97.8	128.9	160.7	0	0	0	0	0	109.2	L64 I67 Y103	A58-L64 HydrophobicContact CB-CB 3.75Å; A58-L64 HydrophobicContact CB-CD1 4.14Å; A58-I67 HydrophobicContact CB-CD1 4.27Å; A58-Y103 HydrophobicContact CB-CE2 4.11Å; A58-Y103 PolarHBondContact O-OH 3.44Å
59	S	83	Confident	84.3	Confident	93 Å²	93	59.3 Å²	59.3	65%	0.65	34%	0.342	S	S	*	.	S	Bend	trans	-90.6	-9.8	-178.8	-31.7	0	0	0	0	112.7	E63	S59-E63 WeakPolarHBondContact CA-OE2 3.2Å; S59-E63 WeakPolarHBondContact CB-OE2 3.38Å; S59-E63 PolarHBondContact N-OE2 3.27Å; S59-E63 PolarHBondContact OG-OE2 2.85Å
60	S	88.4	Confident	84.6	Confident	48 Å²	48	65 Å²	65	34%	0.336	36%	0.359	S	S	.	.	S	Bend	trans	-159.3	161.5	173.9	64.7	0	0	0	0	110.9	K62 E63 L64 Y103	S60-K62 PolarHBondContact O-N 2.96Å; S60-E63 PolarHBondContact O-N 3.23Å; S60-E63 VanDerWaalsContact O-N 3.17Å; S60-E63 PolarHBondContact OG-N 2.93Å; S60-L64 PolarHBondContact O-N 3.45Å; S60-Y103 PolarHBondContact N-OH 2.75Å
61	G	87.5	Confident	84.9	Confident	9 Å²	9	64.7 Å²	64.7	9%	0.093	36%	0.358	C	S	.	.	H	α-helix	trans	-61.1	-26.4	173.6	0	0	0	0	0	114	T65 E105	G61-T65 WeakPolarHBondContact O-CB 3.47Å; G61-T65 PolarHBondContact O-N 2.66Å; G61-T65 PolarHBondContact O-OG1 2.91Å; G61-E105 WeakPolarHBondContact CA-OE1 3.39Å
62	K	89.1	Confident	85.7	Confident	169 Å²	169	62.5 Å²	62.5	74%	0.735	35%	0.345	S	S	*	.	H	α-helix	trans	-68.3	-49.1	171.6	-66.9	-172.3	177.9	-175.5	0	111.8	S60 L64 T65 E66	S60-K62 PolarHBondContact O-N 2.96Å; K62-L64 VanDerWaalsContact C-N 3.28Å; K62-L64 PolarHBondContact O-N 3.36Å; K62-T65 WeakPolarHBondContact O-CB 3.28Å; K62-T65 PolarHBondContact O-N 3.08Å; K62-T65 VanDerWaalsContact O-N 3.15Å; K62-E66 PolarHBondContact O-N 2.92Å
63	E	90.7	Very high	86.7	Confident	64 Å²	64	66.4 Å²	66.4	30%	0.299	36%	0.364	S	S	.	.	H	α-helix	trans	-61.8	-38.8	174.8	-177	175	-153.6	0	0	111.2	S59 S60 T65 E66 I67	S59-E63 WeakPolarHBondContact CA-OE2 3.2Å; S59-E63 WeakPolarHBondContact CB-OE2 3.38Å; S59-E63 PolarHBondContact N-OE2 3.27Å; S59-E63 PolarHBondContact OG-OE2 2.85Å; S60-E63 PolarHBondContact O-N 3.23Å; S60-E63 VanDerWaalsContact O-N 3.17Å; S60-E63 PolarHBondContact OG-N 2.93Å; E63-T65 PolarHBondContact O-N 2.7Å; E63-E66 PolarHBondContact O-N 3.19Å; E63-I67 HydrophobicContact CG-CD1 3.96Å; E63-I67 HydrophobicContact CG-CG1 4.47Å; E63-I67 VanDerWaalsContact O-CG1 3.26Å; E63-I67 WeakPolarHBondContact O-CG1 3.17Å; E63-I67 PolarHBondContact O-N 2.97Å
64	L	92.1	Very high	88	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-59.1	-45.8	173.1	-179.8	62	0	0	0	111.8	A58 S60 K62 E66 I67 I68 I95 A100 Y103 F106 L109	A58-L64 HydrophobicContact CB-CB 3.75Å; A58-L64 HydrophobicContact CB-CD1 4.14Å; S60-L64 PolarHBondContact O-N 3.45Å; K62-L64 VanDerWaalsContact C-N 3.28Å; K62-L64 PolarHBondContact O-N 3.36Å; L64-E66 PolarHBondContact O-N 3.18Å; L64-I67 PolarHBondContact O-N 3.47Å; L64-I68 HydrophobicContact CD1-CG1 4.2Å; L64-I68 HydrophobicContact CG-CG1 4.45Å; L64-I68 WeakPolarHBondContact O-CG1 3.35Å; L64-I68 PolarHBondContact O-N 3.49Å; L64-I95 HydrophobicContact CD1-CD1 3.99Å; L64-A100 HydrophobicContact CD1-CB 3.79Å; L64-A100 HydrophobicContact CD2-CB 4.44Å; L64-Y103 HydrophobicContact CD2-CD2 3.8Å; L64-Y103 HydrophobicContact CD2-CG 3.88Å; L64-F106 HydrophobicContact CD1-CD2 4.27Å; L64-F106 HydrophobicContact CD2-CB 4.01Å; L64-F106 HydrophobicContact CD2-CD2 4.18Å; L64-L109 HydrophobicContact CD2-CD1 4.34Å; L64-L109 HydrophobicContact CG-CD1 4.14Å
65	T	93.2	Very high	89.2	Confident	46 Å²	46	58.6 Å²	58.6	28%	0.282	32%	0.317	S	S	.	.	H	α-helix	trans	-58.9	-46.1	175.8	-59.3	0	0	0	0	111.2	G61 K62 E63 I67 I68 N69 L109	G61-T65 WeakPolarHBondContact O-CB 3.47Å; G61-T65 PolarHBondContact O-N 2.66Å; G61-T65 PolarHBondContact O-OG1 2.91Å; K62-T65 WeakPolarHBondContact O-CB 3.28Å; K62-T65 PolarHBondContact O-N 3.08Å; K62-T65 VanDerWaalsContact O-N 3.15Å; E63-T65 PolarHBondContact O-N 2.7Å; T65-I67 VanDerWaalsContact C-N 3.33Å; T65-I67 PolarHBondContact O-N 3.04Å; T65-I68 PolarHBondContact O-N 3.03Å; T65-N69 WeakPolarHBondContact O-CB 3.27Å; T65-N69 PolarHBondContact O-N 3.17Å; T65-L109 HydrophobicContact CG2-CD2 4.06Å
66	E	92.8	Very high	90.2	Very high	121 Å²	121	56.8 Å²	56.8	57%	0.565	30%	0.304	S	S	*	.	H	α-helix	trans	-64.5	-32.9	176.3	-70.6	176.3	-157.9	0	0	113.2	K62 E63 L64 R70	K62-E66 PolarHBondContact O-N 2.92Å; E63-E66 PolarHBondContact O-N 3.19Å; L64-E66 PolarHBondContact O-N 3.18Å; E66-R70 WeakPolarHBondContact O-CG 3.46Å; E66-R70 PolarHBondContact O-N 2.85Å; E66-R70 PolarHBondContact O-NE 3.39Å
67	I	93.1	Very high	90.4	Very high	11 Å²	11	55.8 Å²	55.8	6%	0.056	31%	0.308	C	S	.	.	H	α-helix	trans	-72.3	-45.5	173.9	-64.4	162.5	0	0	0	110.6	I56 A58 E63 L64 T65 N69 R70 I71 T91 I95	I56-I67 HydrophobicContact CG2-CD1 4.37Å; A58-I67 HydrophobicContact CB-CD1 4.27Å; E63-I67 HydrophobicContact CG-CD1 3.96Å; E63-I67 HydrophobicContact CG-CG1 4.47Å; E63-I67 VanDerWaalsContact O-CG1 3.26Å; E63-I67 WeakPolarHBondContact O-CG1 3.17Å; E63-I67 PolarHBondContact O-N 2.97Å; L64-I67 PolarHBondContact O-N 3.47Å; T65-I67 VanDerWaalsContact C-N 3.33Å; T65-I67 PolarHBondContact O-N 3.04Å; I67-N69 PolarHBondContact O-N 2.82Å; I67-R70 PolarHBondContact O-N 3.07Å; I67-I71 HydrophobicContact CG2-CD1 3.83Å; I67-I71 HydrophobicContact CG2-CG1 4.48Å; I67-I71 WeakPolarHBondContact O-CG1 3.49Å; I67-I71 PolarHBondContact O-N 3.22Å; I67-T91 HydrophobicContact CG2-CG2 4.2Å; I67-I95 HydrophobicContact CD1-CG2 4.36Å; I67-I95 HydrophobicContact CG2-CD1 3.92Å; I67-I95 HydrophobicContact CG2-CG2 4.05Å
68	I	94.7	Very high	90.5	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.4	-41.8	179.2	-66	-70.7	0	0	0	111.4	L64 T65 R70 I71 K72 L92 I95 F106 L109 L113	L64-I68 HydrophobicContact CD1-CG1 4.2Å; L64-I68 HydrophobicContact CG-CG1 4.45Å; L64-I68 WeakPolarHBondContact O-CG1 3.35Å; L64-I68 PolarHBondContact O-N 3.49Å; T65-I68 PolarHBondContact O-N 3.03Å; I68-R70 PolarHBondContact O-N 3.42Å; I68-I71 HydrophobicContact CD1-CD1 4.36Å; I68-I71 CarbonylContact O-C 3.54Å; I68-I71 WeakPolarHBondContact O-CA 3.37Å; I68-I71 WeakPolarHBondContact O-CB 3.24Å; I68-I71 PolarHBondContact O-N 3.48Å; I68-I71 VanDerWaalsContact O-N 3.12Å; I68-K72 PolarHBondContact O-N 3.08Å; I68-L92 HydrophobicContact CD1-CD1 3.71Å; I68-I95 HydrophobicContact CD1-CD1 3.71Å; I68-I95 HydrophobicContact CG1-CD1 4.39Å; I68-F106 HydrophobicContact CD1-CE2 4.18Å; I68-L109 HydrophobicContact CB-CB 4.37Å; I68-L109 HydrophobicContact CB-CD2 4.48Å; I68-L109 HydrophobicContact CG1-CB 4.19Å; I68-L109 HydrophobicContact CG1-CD1 4.29Å; I68-L109 HydrophobicContact CG2-CB 4.03Å; I68-L109 HydrophobicContact CG2-CD2 4.38Å; I68-L113 HydrophobicContact CD1-CD1 4.24Å; I68-L113 HydrophobicContact CG2-CD1 4.15Å; I68-L113 HydrophobicContact CG2-CD2 4.17Å; I68-L113 HydrophobicContact CG2-CG 4.15Å
69	N	94.1	Very high	90.6	Very high	68 Å²	68	59.3 Å²	59.3	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-62.6	-43.3	176.7	-72	-16.5	0	0	0	111.6	T65 I67 I71 K72 D73	T65-N69 WeakPolarHBondContact O-CB 3.27Å; T65-N69 PolarHBondContact O-N 3.17Å; I67-N69 PolarHBondContact O-N 2.82Å; N69-I71 VanDerWaalsContact C-N 3.28Å; N69-I71 PolarHBondContact O-N 2.88Å; N69-K72 WeakPolarHBondContact O-CA 3.2Å; N69-K72 VanDerWaalsContact O-CB 3.31Å; N69-K72 WeakPolarHBondContact O-CB 3.35Å; N69-K72 PolarHBondContact O-N 3.4Å; N69-D73 PolarHBondContact O-N 2.72Å
70	R	93.9	Very high	90.6	Very high	146 Å²	146	60.3 Å²	60.3	55%	0.551	32%	0.32	S	S	*	.	H	α-helix	trans	-62.1	-33	173.1	-75.3	177.2	-72	173	-6.1	113.3	E66 I67 I68 A74	E66-R70 WeakPolarHBondContact O-CG 3.46Å; E66-R70 PolarHBondContact O-N 2.85Å; E66-R70 PolarHBondContact O-NE 3.39Å; I67-R70 PolarHBondContact O-N 3.07Å; I68-R70 PolarHBondContact O-N 3.42Å; R70-A74 VanDerWaalsContact O-CB 3.26Å; R70-A74 WeakPolarHBondContact O-CB 3.49Å; R70-A74 PolarHBondContact O-N 2.72Å; R70-A74 VanDerWaalsContact O-N 3.14Å
71	I	95.2	Very high	90.6	Very high	5 Å²	5	61.4 Å²	61.4	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-68	-44.6	171.3	-69.4	161.5	0	0	0	110.4	I67 I68 N69 A74 L75 A88 T91 L92 I95 L113	I67-I71 HydrophobicContact CG2-CD1 3.83Å; I67-I71 HydrophobicContact CG2-CG1 4.48Å; I67-I71 WeakPolarHBondContact O-CG1 3.49Å; I67-I71 PolarHBondContact O-N 3.22Å; I68-I71 HydrophobicContact CD1-CD1 4.36Å; I68-I71 CarbonylContact O-C 3.54Å; I68-I71 WeakPolarHBondContact O-CA 3.37Å; I68-I71 WeakPolarHBondContact O-CB 3.24Å; I68-I71 PolarHBondContact O-N 3.48Å; I68-I71 VanDerWaalsContact O-N 3.12Å; N69-I71 VanDerWaalsContact C-N 3.28Å; N69-I71 PolarHBondContact O-N 2.88Å; I71-A74 PolarHBondContact O-N 2.82Å; I71-L75 HydrophobicContact CG2-CD1 3.71Å; I71-L75 HydrophobicContact CG2-CG 4.3Å; I71-L75 WeakPolarHBondContact O-CB 3.3Å; I71-L75 WeakPolarHBondContact O-CG 3.46Å; I71-L75 PolarHBondContact O-N 3.19Å; I71-A88 HydrophobicContact CG2-CB 4.39Å; I71-T91 HydrophobicContact CD1-CG2 4.03Å; I71-T91 HydrophobicContact CG1-CG2 4.22Å; I71-L92 HydrophobicContact CD1-CB 4.08Å; I71-L92 HydrophobicContact CD1-CD1 4.32Å; I71-L92 HydrophobicContact CG2-CB 4.41Å; I71-I95 HydrophobicContact CD1-CD1 3.9Å; I71-L113 HydrophobicContact CG2-CD1 3.98Å; I71-L113 HydrophobicContact CG2-CD2 4.25Å
72	K	95.4	Very high	90.9	Very high	62 Å²	62	64.7 Å²	64.7	27%	0.27	33%	0.329	S	S	.	.	H	α-helix	trans	-55.4	-55.6	177.4	-169.9	-171.6	176.5	-163.2	0	110.4	I68 N69 A74 L75 S76 L113	I68-K72 PolarHBondContact O-N 3.08Å; N69-K72 WeakPolarHBondContact O-CA 3.2Å; N69-K72 VanDerWaalsContact O-CB 3.31Å; N69-K72 WeakPolarHBondContact O-CB 3.35Å; N69-K72 PolarHBondContact O-N 3.4Å; K72-A74 VanDerWaalsContact C-N 3.34Å; K72-A74 PolarHBondContact O-N 3.14Å; K72-L75 PolarHBondContact O-N 2.99Å; K72-S76 PolarHBondContact O-N 3.12Å; K72-S76 PolarHBondContact O-OG 3.48Å; K72-L113 HydrophobicContact CB-CD2 3.54Å; K72-L113 HydrophobicContact CG-CD2 4.01Å
73	D	93	Very high	91.1	Very high	101 Å²	101	62.5 Å²	62.5	54%	0.54	32%	0.322	S	S	.	.	H	α-helix	trans	-60	-42.4	-178.6	-60.4	-22.7	0	0	0	112	N69 L75 G77	N69-D73 PolarHBondContact O-N 2.72Å; D73-L75 VanDerWaalsContact C-N 3.3Å; D73-L75 PolarHBondContact O-N 3.12Å; D73-G77 WeakPolarHBondContact O-CA 3.42Å; D73-G77 PolarHBondContact O-N 2.85Å
74	A	93.3	Very high	91.2	Very high	31 Å²	31	62.5 Å²	62.5	26%	0.256	32%	0.321	S	S	.	.	H	α-helix	trans	-64.9	-34.2	176.3	0	0	0	0	0	112.4	R70 I71 K72 R85 A88	R70-A74 VanDerWaalsContact O-CB 3.26Å; R70-A74 WeakPolarHBondContact O-CB 3.49Å; R70-A74 PolarHBondContact O-N 2.72Å; R70-A74 VanDerWaalsContact O-N 3.14Å; I71-A74 PolarHBondContact O-N 2.82Å; K72-A74 VanDerWaalsContact C-N 3.34Å; K72-A74 PolarHBondContact O-N 3.14Å; A74-R85 WeakPolarHBondContact O-CG 3.48Å; A74-A88 HydrophobicContact CB-CB 3.75Å
75	L	94.1	Very high	91.3	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-82.2	-31.6	-179.9	-66.4	176.7	0	0	0	114.1	I71 K72 D73 R85 A88 L89 I117	I71-L75 HydrophobicContact CG2-CD1 3.71Å; I71-L75 HydrophobicContact CG2-CG 4.3Å; I71-L75 WeakPolarHBondContact O-CB 3.3Å; I71-L75 WeakPolarHBondContact O-CG 3.46Å; I71-L75 PolarHBondContact O-N 3.19Å; K72-L75 PolarHBondContact O-N 2.99Å; D73-L75 VanDerWaalsContact C-N 3.3Å; D73-L75 PolarHBondContact O-N 3.12Å; L75-R85 HydrophobicContact CD2-CB 4.12Å; L75-R85 HydrophobicContact CD2-CG 4.42Å; L75-R85 WeakPolarHBondContact CD2-O 3.49Å; L75-R85 PolarHBondContact O-NE 2.72Å; L75-A88 HydrophobicContact CD2-CB 4Å; L75-A88 HydrophobicContact CG-CB 4.09Å; L75-L89 HydrophobicContact CD1-CD2 4.26Å; L75-L89 HydrophobicContact CD2-CD1 4.47Å; L75-L89 HydrophobicContact CD2-CD2 4.16Å; L75-L89 HydrophobicContact CD2-CG 3.83Å; L75-I117 HydrophobicContact CD1-CG1 4.04Å
76	S	89.7	Confident	91.4	Very high	70 Å²	70	61.3 Å²	61.3	49%	0.49	31%	0.313	S	S	.	.	H	α-helix	trans	-91.4	-2	174.5	57.1	0	0	0	0	114.2	K72	K72-S76 PolarHBondContact O-N 3.12Å; K72-S76 PolarHBondContact O-OG 3.48Å
77	G	82.7	Confident	91.4	Very high	33 Å²	33	59.2 Å²	59.2	34%	0.34	31%	0.306	S	S	.	.	S	Bend	trans	-68.6	-170.4	176	0	0	0	0	0	114.5	D73	D73-G77 WeakPolarHBondContact O-CA 3.42Å; D73-G77 PolarHBondContact O-N 2.85Å
78	N	82.7	Confident	91.5	Very high	93 Å²	93	59 Å²	59	50%	0.497	31%	0.306	S	S	.	.			trans	-56.8	124.5	-177.1	179.8	-12.3	0	0	0	111.2	E80 E81	N78-E80 PolarHBondContact O-N 3.17Å; N78-E80 PolarHBondContact OD1-N 3.35Å; N78-E81 HydrophobicContact CB-CG 4.31Å; N78-E81 PolarHBondContact O-N 3.41Å
79	P	83.3	Confident	91.5	Very high	74 Å²	74	59 Å²	59	48%	0.481	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-16.9	-176.8	24.5	-35.3	0	0	0	114.4	E81 R125	P79-E81 VanDerWaalsContact C-N 3.33Å; P79-R125 PolarHBondContact O-NH1 3.14Å; P79-R125 VanDerWaalsContact O-NH1 3.12Å
80	E	84.1	Confident	91.6	Very high	114 Å²	114	58.4 Å²	58.4	53%	0.533	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-20.5	172.6	-65.1	-54.3	107.4	0	0	113.6	N78 W82 R125	N78-E80 PolarHBondContact O-N 3.17Å; N78-E80 PolarHBondContact OD1-N 3.35Å; E80-W82 PolarHBondContact O-N 3.19Å; E80-R125 IonicContact OE1-CZ 3.16Å; E80-R125 IonicContact OE1-NH1 2.72Å; E80-R125 PolarHBondContact OE1-NH1 3.39Å; E80-R125 IonicContact OE1-NH2 3.85Å; E80-R125 PolarHBondContact OE1-NH2 3.43Å; E80-R125 IonicContact OE2-CZ 3.48Å; E80-R125 IonicContact OE2-NH1 2.71Å; E80-R125 IonicContact OE2-NH2 2.88Å; E80-R125 PolarHBondContact OE2-NH2 2.74Å
81	E	88.8	Confident	91.6	Very high	70 Å²	70	52.7 Å²	52.7	33%	0.327	28%	0.281	S	S	.	.			trans	-81.8	41.7	175.2	-58	-160.3	133.9	0	0	112.5	N78 P79 E83 K84 R85	N78-E81 HydrophobicContact CB-CG 4.31Å; N78-E81 PolarHBondContact O-N 3.41Å; P79-E81 VanDerWaalsContact C-N 3.33Å; E81-E83 PolarHBondContact O-N 2.85Å; E81-E83 VanDerWaalsContact O-N 3.11Å; E81-K84 HydrophobicContact CB-CD 4.23Å; E81-K84 HydrophobicContact CB-CG 4.37Å; E81-K84 VanDerWaalsContact CD-CE 3.49Å; E81-K84 WeakPolarHBondContact O-CB 3.18Å; E81-K84 PolarHBondContact O-N 3.48Å; E81-K84 WeakPolarHBondContact OE1-CE 3.1Å; E81-K84 IonicContact OE1-NZ 3.56Å; E81-K84 PolarHBondContact OE1-NZ 3.09Å; E81-K84 WeakPolarHBondContact OE2-CD 3.29Å; E81-K84 WeakPolarHBondContact OE2-CE 3.33Å; E81-K84 IonicContact OE2-NZ 3.58Å; E81-K84 PolarHBondContact OE2-NZ 3.47Å; E81-R85 PolarHBondContact O-N 3.35Å
82	W	92	Very high	91.6	Very high	78 Å²	78	52.5 Å²	52.5	30%	0.295	28%	0.28	S	S	.	.	H	α-helix	trans	-58.7	-27.5	-171.7	72.6	-88.7	0	0	0	114.1	E80 R85 V86 S127 V128	E80-W82 PolarHBondContact O-N 3.19Å; W82-R85 PolarHBondContact O-N 3.45Å; W82-V86 HydrophobicContact CE3-CG2 4.19Å; W82-V86 HydrophobicContact CZ3-CG2 4.45Å; W82-V86 WeakPolarHBondContact O-CG2 3.26Å; W82-V86 PolarHBondContact O-N 2.97Å; W82-S127 VanDerWaalsContact CE3-OG 3.29Å; W82-S127 VanDerWaalsContact CZ3-OG 3.24Å; W82-S127 WeakPolarHBondContact CZ3-OG 3.18Å; W82-V128 HydrophobicContact CB-CG2 3.76Å; W82-V128 HydrophobicContact CE3-CG2 4.21Å
83	E	94.4	Very high	91.5	Very high	123 Å²	123	49.8 Å²	49.8	58%	0.575	27%	0.268	S	S	*	.	H	α-helix	trans	-67.8	-43.3	174.8	-64	-170.7	144	0	0	111.7	E81 R85 V86 D87	E81-E83 PolarHBondContact O-N 2.85Å; E81-E83 VanDerWaalsContact O-N 3.11Å; E83-R85 VanDerWaalsContact C-N 3.29Å; E83-R85 PolarHBondContact O-N 2.92Å; E83-V86 WeakPolarHBondContact O-CB 3.46Å; E83-V86 PolarHBondContact O-N 3.09Å; E83-D87 PolarHBondContact O-N 3.08Å
84	K	92.5	Very high	91.5	Very high	65 Å²	65	45 Å²	45	28%	0.283	24%	0.242	S	C	.	.	H	α-helix	trans	-62.9	-37.9	174.7	-59.1	-172.1	-164.3	167.3	0	111.4	E81 D87 A88 A693	E81-K84 HydrophobicContact CB-CD 4.23Å; E81-K84 HydrophobicContact CB-CG 4.37Å; E81-K84 VanDerWaalsContact CD-CE 3.49Å; E81-K84 WeakPolarHBondContact O-CB 3.18Å; E81-K84 PolarHBondContact O-N 3.48Å; E81-K84 WeakPolarHBondContact OE1-CE 3.1Å; E81-K84 IonicContact OE1-NZ 3.56Å; E81-K84 PolarHBondContact OE1-NZ 3.09Å; E81-K84 WeakPolarHBondContact OE2-CD 3.29Å; E81-K84 WeakPolarHBondContact OE2-CE 3.33Å; E81-K84 IonicContact OE2-NZ 3.58Å; E81-K84 PolarHBondContact OE2-NZ 3.47Å; K84-D87 PolarHBondContact O-N 3.46Å; K84-A88 WeakPolarHBondContact O-CB 3.35Å; K84-A88 PolarHBondContact O-N 3.41Å; K84-A693 VanDerWaalsContact NZ-CB 3.33Å
85	R	94.2	Very high	91.5	Very high	6 Å²	6	43.5 Å²	43.5	2%	0.023	23%	0.23	C	C	.	.	H	α-helix	trans	-63.7	-43.5	176	-70.1	175.7	60.9	-137.5	-6.1	111.7	A74 L75 E81 W82 E83 A88 L89 L119 S120 D123	A74-R85 WeakPolarHBondContact O-CG 3.48Å; L75-R85 HydrophobicContact CD2-CB 4.12Å; L75-R85 HydrophobicContact CD2-CG 4.42Å; L75-R85 WeakPolarHBondContact CD2-O 3.49Å; L75-R85 PolarHBondContact O-NE 2.72Å; E81-R85 PolarHBondContact O-N 3.35Å; W82-R85 PolarHBondContact O-N 3.45Å; E83-R85 VanDerWaalsContact C-N 3.29Å; E83-R85 PolarHBondContact O-N 2.92Å; R85-A88 PolarHBondContact O-N 3.02Å; R85-L89 WeakPolarHBondContact O-CG 3.37Å; R85-L89 PolarHBondContact O-N 3.05Å; R85-L119 PolarHBondContact NH2-O 3Å; R85-S120 PolarHBondContact NH2-OG 2.83Å; R85-D123 IonicContact CZ-OD2 3.49Å; R85-D123 IonicContact NH1-OD2 2.72Å; R85-D123 PolarHBondContact NH1-OD2 2.99Å; R85-D123 IonicContact NH2-OD2 3.76Å; R85-D123 PolarHBondContact NH2-OD2 3.42Å
86	V	94.7	Very high	91.4	Very high	14 Å²	14	43.7 Å²	43.7	9%	0.085	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-41.6	172.5	159.3	0	0	0	0	111.9	W82 E83 L89 K90 V128 E131	W82-V86 HydrophobicContact CE3-CG2 4.19Å; W82-V86 HydrophobicContact CZ3-CG2 4.45Å; W82-V86 WeakPolarHBondContact O-CG2 3.26Å; W82-V86 PolarHBondContact O-N 2.97Å; E83-V86 WeakPolarHBondContact O-CB 3.46Å; E83-V86 PolarHBondContact O-N 3.09Å; V86-L89 PolarHBondContact O-N 3.46Å; V86-K90 VanDerWaalsContact CG1-CE 3.49Å; V86-K90 WeakPolarHBondContact O-CG 3.45Å; V86-K90 PolarHBondContact O-N 2.85Å; V86-K90 VanDerWaalsContact O-N 3.15Å; V86-V128 HydrophobicContact CG2-CG2 4.14Å; V86-E131 HydrophobicContact CG1-CG 4.13Å; V86-E131 HydrophobicContact CG2-CB 4.2Å; V86-E131 HydrophobicContact CG2-CG 4.47Å
87	D	93.7	Very high	91.5	Very high	78 Å²	78	42.1 Å²	42.1	42%	0.417	22%	0.223	S	C	.	.	H	α-helix	trans	-76.3	-28.5	178.7	-74.3	-13.3	0	0	0	113.7	E83 K84 K90 T91	E83-D87 PolarHBondContact O-N 3.08Å; K84-D87 PolarHBondContact O-N 3.46Å; D87-K90 PolarHBondContact O-N 3.29Å; D87-K90 WeakPolarHBondContact OD1-CD 3.36Å; D87-K90 WeakPolarHBondContact OD1-CE 3.47Å; D87-K90 IonicContact OD1-NZ 2.74Å; D87-K90 PolarHBondContact OD1-NZ 3.12Å; D87-T91 WeakPolarHBondContact O-CB 3.12Å; D87-T91 PolarHBondContact O-N 3.41Å; D87-T91 PolarHBondContact O-OG1 3.1Å
88	A	94.7	Very high	91.8	Very high	7 Å²	7	43.7 Å²	43.7	6%	0.058	22%	0.223	C	C	.	.	H	α-helix	trans	-65.8	-41.6	169.2	0	0	0	0	0	111.6	I71 A74 L75 K84 R85 K90 T91 L92	I71-A88 HydrophobicContact CG2-CB 4.39Å; A74-A88 HydrophobicContact CB-CB 3.75Å; L75-A88 HydrophobicContact CD2-CB 4Å; L75-A88 HydrophobicContact CG-CB 4.09Å; K84-A88 WeakPolarHBondContact O-CB 3.35Å; K84-A88 PolarHBondContact O-N 3.41Å; R85-A88 PolarHBondContact O-N 3.02Å; A88-K90 VanDerWaalsContact C-N 3.34Å; A88-K90 PolarHBondContact O-N 2.87Å; A88-T91 WeakPolarHBondContact O-CB 3.44Å; A88-T91 PolarHBondContact O-N 3.49Å; A88-L92 PolarHBondContact O-N 3.15Å
89	L	95.6	Very high	92	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.4	-39.2	173.1	-72.8	167	0	0	0	112.5	L75 R85 V86 R93 I117 E131 A132 T135	L75-L89 HydrophobicContact CD1-CD2 4.26Å; L75-L89 HydrophobicContact CD2-CD1 4.47Å; L75-L89 HydrophobicContact CD2-CD2 4.16Å; L75-L89 HydrophobicContact CD2-CG 3.83Å; R85-L89 WeakPolarHBondContact O-CG 3.37Å; R85-L89 PolarHBondContact O-N 3.05Å; V86-L89 PolarHBondContact O-N 3.46Å; L89-R93 PolarHBondContact O-N 2.87Å; L89-I117 HydrophobicContact CD2-CG1 4.34Å; L89-E131 HydrophobicContact CB-CG 3.87Å; L89-E131 HydrophobicContact CD1-CB 3.97Å; L89-E131 HydrophobicContact CD1-CG 4.12Å; L89-A132 HydrophobicContact CD1-CB 3.96Å; L89-T135 HydrophobicContact CD2-CG2 4.09Å; L89-T135 PolarHBondContact O-OG1 2.9Å; L89-T135 VanDerWaalsContact O-OG1 3.07Å
90	K	95	Very high	92.3	Very high	55 Å²	55	36.6 Å²	36.6	24%	0.239	19%	0.185	C	C	.	.	H	α-helix	trans	-65.5	-44.1	172	-68	170.1	-158.5	161.1	0	111.8	P52 M54 V86 D87 A88 L92 R93 A94 E131	P52-K90 HydrophobicContact CB-CB 4.07Å; P52-K90 HydrophobicContact CB-CG 4.24Å; P52-K90 HydrophobicContact CG-CB 3.87Å; P52-K90 HydrophobicContact CG-CG 4.44Å; P52-K90 VanDerWaalsContact CG-O 3.31Å; P52-K90 WeakPolarHBondContact CG-O 3.31Å; M54-K90 HydrophobicContact SD-CB 3.76Å; V86-K90 VanDerWaalsContact CG1-CE 3.49Å; V86-K90 WeakPolarHBondContact O-CG 3.45Å; V86-K90 PolarHBondContact O-N 2.85Å; V86-K90 VanDerWaalsContact O-N 3.15Å; D87-K90 PolarHBondContact O-N 3.29Å; D87-K90 WeakPolarHBondContact OD1-CD 3.36Å; D87-K90 WeakPolarHBondContact OD1-CE 3.47Å; D87-K90 IonicContact OD1-NZ 2.74Å; D87-K90 PolarHBondContact OD1-NZ 3.12Å; A88-K90 VanDerWaalsContact C-N 3.34Å; A88-K90 PolarHBondContact O-N 2.87Å; K90-L92 VanDerWaalsContact C-N 3.29Å; K90-L92 PolarHBondContact O-N 2.8Å; K90-R93 PolarHBondContact O-N 3.35Å; K90-R93 VanDerWaalsContact O-N 3.09Å; K90-A94 PolarHBondContact O-N 3.49Å; K90-E131 VanDerWaalsContact CG-OE1 3.25Å; K90-E131 WeakPolarHBondContact CG-OE1 3.47Å
91	T	93.7	Very high	92.5	Very high	26 Å²	26	33.2 Å²	33.2	16%	0.16	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-40.6	179	-58.6	0	0	0	0	111.2	M54 I56 I67 I71 D87 A88 R93 A94 I95	M54-T91 WeakPolarHBondContact CE-OG1 3.41Å; I56-T91 HydrophobicContact CD1-CG2 3.92Å; I67-T91 HydrophobicContact CG2-CG2 4.2Å; I71-T91 HydrophobicContact CD1-CG2 4.03Å; I71-T91 HydrophobicContact CG1-CG2 4.22Å; D87-T91 WeakPolarHBondContact O-CB 3.12Å; D87-T91 PolarHBondContact O-N 3.41Å; D87-T91 PolarHBondContact O-OG1 3.1Å; A88-T91 WeakPolarHBondContact O-CB 3.44Å; A88-T91 PolarHBondContact O-N 3.49Å; T91-R93 PolarHBondContact O-N 2.92Å; T91-A94 WeakPolarHBondContact O-CB 3.26Å; T91-A94 PolarHBondContact O-N 2.81Å; T91-I95 PolarHBondContact O-N 2.81Å
92	L	95.1	Very high	92.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-41.7	173.8	-175.6	56.8	0	0	0	112.7	I68 I71 A88 K90 I95 V96 F106 L110 L113 I117 T135 L139	I68-L92 HydrophobicContact CD1-CD1 3.71Å; I71-L92 HydrophobicContact CD1-CB 4.08Å; I71-L92 HydrophobicContact CD1-CD1 4.32Å; I71-L92 HydrophobicContact CG2-CB 4.41Å; A88-L92 PolarHBondContact O-N 3.15Å; K90-L92 VanDerWaalsContact C-N 3.29Å; K90-L92 PolarHBondContact O-N 2.8Å; L92-I95 HydrophobicContact CD1-CD1 4.16Å; L92-I95 HydrophobicContact CD1-CG1 4.49Å; L92-I95 VanDerWaalsContact O-CG1 3.32Å; L92-I95 WeakPolarHBondContact O-CG1 3.49Å; L92-V96 WeakPolarHBondContact O-CG2 3.37Å; L92-V96 PolarHBondContact O-N 2.85Å; L92-F106 HydrophobicContact CD1-CE2 4.43Å; L92-L110 HydrophobicContact CD2-CD1 4.4Å; L92-L113 HydrophobicContact CD1-CD1 3.99Å; L92-L113 HydrophobicContact CD2-CD1 3.72Å; L92-I117 HydrophobicContact CD2-CD1 3.8Å; L92-T135 HydrophobicContact CD2-CG2 3.88Å; L92-T135 HydrophobicContact CG-CG2 4.37Å; L92-L139 HydrophobicContact CD2-CD1 4.17Å
93	R	94.6	Very high	92.5	Very high	5 Å²	5	37 Å²	37	2%	0.019	19%	0.189	C	C	.	.	H	α-helix	trans	-67.8	-38.8	174	-58.7	-158.9	-58.5	-83.4	5.9	112	S49 F50 P52 L89 K90 T91 V96 A97 E131 T135 F138	S49-R93 PolarHBondContact O-NE 3.43Å; S49-R93 PolarHBondContact O-NH2 2.98Å; F50-R93 WeakPolarHBondContact O-CB 3.36Å; F50-R93 WeakPolarHBondContact O-CD 2.95Å; F50-R93 PolarHBondContact O-NE 2.96Å; P52-R93 HydrophobicContact CG-CB 4.45Å; L89-R93 PolarHBondContact O-N 2.87Å; K90-R93 PolarHBondContact O-N 3.35Å; K90-R93 VanDerWaalsContact O-N 3.09Å; T91-R93 PolarHBondContact O-N 2.92Å; R93-V96 PolarHBondContact O-N 3.04Å; R93-A97 WeakPolarHBondContact O-CB 3.25Å; R93-A97 PolarHBondContact O-N 3.25Å; R93-E131 IonicContact CZ-OE1 3.59Å; R93-E131 IonicContact NH1-OE1 2.75Å; R93-E131 PolarHBondContact NH1-OE1 3.28Å; R93-E131 IonicContact NH2-OE1 3.19Å; R93-E131 PolarHBondContact NH2-OE1 2.97Å; R93-T135 HydrophobicContact CG-CG2 4.15Å; R93-T135 WeakPolarHBondContact CG-OG1 3.4Å; R93-T135 PolarHBondContact NH1-OG1 2.7Å; R93-F138 HydrophobicContact CB-CD1 3.69Å; R93-F138 HydrophobicContact CB-CE1 3.87Å; R93-F138 HydrophobicContact CG-CB 4.46Å; R93-F138 HydrophobicContact CG-CD1 3.67Å; R93-F138 HydrophobicContact CG-CE1 4.36Å; R93-F138 HydrophobicContact CG-CG 4.39Å; R93-F138 WeakPolarHBondContact O-CE1 3.43Å
94	A	93	Very high	92.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.5	-48.6	178.9	0	0	0	0	0	112.3	P52 M54 I56 K90 T91 V96 A97 N98	P52-A94 HydrophobicContact CG-CB 4.29Å; M54-A94 HydrophobicContact CG-CB 3.72Å; M54-A94 WeakPolarHBondContact O-CB 3.39Å; I56-A94 HydrophobicContact CB-CB 4.36Å; K90-A94 PolarHBondContact O-N 3.49Å; T91-A94 WeakPolarHBondContact O-CB 3.26Å; T91-A94 PolarHBondContact O-N 2.81Å; A94-V96 PolarHBondContact O-N 3.3Å; A94-A97 PolarHBondContact O-N 3.45Å; A94-N98 WeakPolarHBondContact O-CB 3.49Å; A94-N98 PolarHBondContact O-N 3.46Å; A94-N98 PolarHBondContact O-ND2 2.97Å
95	I	92.4	Very high	92	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.9	-37.4	179.5	61.2	-176.3	0	0	0	112.5	I56 L64 I67 I68 I71 T91 L92 N98 G99 A100	I56-I95 HydrophobicContact CB-CG2 4.19Å; I56-I95 HydrophobicContact CG2-CG2 3.72Å; I56-I95 WeakPolarHBondContact O-CA 3.22Å; L64-I95 HydrophobicContact CD1-CD1 3.99Å; I67-I95 HydrophobicContact CD1-CG2 4.36Å; I67-I95 HydrophobicContact CG2-CD1 3.92Å; I67-I95 HydrophobicContact CG2-CG2 4.05Å; I68-I95 HydrophobicContact CD1-CD1 3.71Å; I68-I95 HydrophobicContact CG1-CD1 4.39Å; I71-I95 HydrophobicContact CD1-CD1 3.9Å; T91-I95 PolarHBondContact O-N 2.81Å; L92-I95 HydrophobicContact CD1-CD1 4.16Å; L92-I95 HydrophobicContact CD1-CG1 4.49Å; L92-I95 VanDerWaalsContact O-CG1 3.32Å; L92-I95 WeakPolarHBondContact O-CG1 3.49Å; I95-N98 CarbonylContact O-C 3.57Å; I95-N98 PolarHBondContact O-N 3.43Å; I95-G99 PolarHBondContact O-N 3.41Å; I95-A100 HydrophobicContact CB-CB 4.14Å; I95-A100 HydrophobicContact CG1-CB 4.27Å; I95-A100 WeakPolarHBondContact O-CB 3.43Å; I95-A100 PolarHBondContact O-N 3.29Å
96	V	92.8	Very high	91.9	Very high	7 Å²	7	39 Å²	39	4%	0.042	21%	0.205	C	C	.	.	H	α-helix	trans	-64.6	-46.8	175.7	168.9	0	0	0	0	111.1	L92 R93 A94 N98 G99 L101 F106 F138 L139 E142	L92-V96 WeakPolarHBondContact O-CG2 3.37Å; L92-V96 PolarHBondContact O-N 2.85Å; R93-V96 PolarHBondContact O-N 3.04Å; A94-V96 PolarHBondContact O-N 3.3Å; V96-N98 PolarHBondContact O-N 3.47Å; V96-G99 PolarHBondContact O-N 2.87Å; V96-G99 VanDerWaalsContact O-N 3.13Å; V96-L101 HydrophobicContact CG1-CD1 3.85Å; V96-L101 HydrophobicContact CG1-CG 4.23Å; V96-F106 HydrophobicContact CG2-CE1 4.12Å; V96-F106 HydrophobicContact CG2-CE2 3.69Å; V96-F106 HydrophobicContact CG2-CZ 3.3Å; V96-F138 HydrophobicContact CB-CE1 3.9Å; V96-F138 HydrophobicContact CG1-CD1 4.45Å; V96-F138 HydrophobicContact CG1-CE1 3.66Å; V96-F138 HydrophobicContact CG1-CZ 4.1Å; V96-L139 HydrophobicContact CG2-CD2 4.07Å; V96-E142 HydrophobicContact CG1-CB 3.98Å; V96-E142 HydrophobicContact CG1-CG 4.06Å
97	A	91.2	Very high	91.7	Very high	37 Å²	37	40.1 Å²	40.1	31%	0.306	21%	0.21	S	C	.	.	H	α-helix	trans	-61.2	-30.9	175.2	0	0	0	0	0	113.1	I51 R93 A94 G99 F138	I51-A97 HydrophobicContact CD1-CB 4.09Å; I51-A97 HydrophobicContact CG1-CB 3.96Å; I51-A97 HydrophobicContact CG2-CB 4.02Å; R93-A97 WeakPolarHBondContact O-CB 3.25Å; R93-A97 PolarHBondContact O-N 3.25Å; A94-A97 PolarHBondContact O-N 3.45Å; A97-G99 VanDerWaalsContact C-N 3.34Å; A97-F138 HydrophobicContact CB-CE1 4.5Å; A97-F138 HydrophobicContact CB-CZ 3.97Å
98	N	89.2	Confident	91.7	Very high	66 Å²	66	40 Å²	40	35%	0.353	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	24	177.4	-66	-60.5	0	0	0	113.3	I56 T57 A94 I95 V96	I56-N98 PolarHBondContact N-ND2 3.41Å; I56-N98 WeakPolarHBondContact O-CB 3.07Å; I56-N98 PolarHBondContact O-ND2 3.16Å; I56-N98 VanDerWaalsContact O-ND2 3.15Å; T57-N98 HydrophobicContact CG2-CB 3.82Å; A94-N98 WeakPolarHBondContact O-CB 3.49Å; A94-N98 PolarHBondContact O-N 3.46Å; A94-N98 PolarHBondContact O-ND2 2.97Å; I95-N98 CarbonylContact O-C 3.57Å; I95-N98 PolarHBondContact O-N 3.43Å; V96-N98 PolarHBondContact O-N 3.47Å
99	G	86.8	Confident	91.6	Very high	15 Å²	15	40.6 Å²	40.6	16%	0.155	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.4	11.5	165.5	0	0	0	0	0	117	I95 V96 A97 L101 Q102	I95-G99 PolarHBondContact O-N 3.41Å; V96-G99 PolarHBondContact O-N 2.87Å; V96-G99 VanDerWaalsContact O-N 3.13Å; A97-G99 VanDerWaalsContact C-N 3.34Å; G99-L101 PolarHBondContact O-N 3.02Å; G99-Q102 VanDerWaalsContact O-CB 3.32Å; G99-Q102 WeakPolarHBondContact O-CB 3.25Å; G99-Q102 WeakPolarHBondContact O-CG 3.36Å; G99-Q102 PolarHBondContact O-N 3.33Å
100	A	89.2	Confident	91.5	Very high	2 Å²	2	41 Å²	41	2%	0.017	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-55.3	-24.6	178.5	0	0	0	0	0	114.2	L64 I95 Q102 Y103 F106	L64-A100 HydrophobicContact CD1-CB 3.79Å; L64-A100 HydrophobicContact CD2-CB 4.44Å; I95-A100 HydrophobicContact CB-CB 4.14Å; I95-A100 HydrophobicContact CG1-CB 4.27Å; I95-A100 WeakPolarHBondContact O-CB 3.43Å; I95-A100 PolarHBondContact O-N 3.29Å; A100-Q102 PolarHBondContact O-N 2.87Å; A100-Y103 PolarHBondContact O-N 3.16Å; A100-F106 HydrophobicContact CB-CD2 3.83Å; A100-F106 HydrophobicContact CB-CE2 4.11Å; A100-F106 HydrophobicContact CB-CG 4.5Å; A100-F106 WeakPolarHBondContact O-CB 3.33Å
101	L	89.9	Confident	91.3	Very high	44 Å²	44	43 Å²	43	23%	0.23	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-66.8	-7.1	175	-70.2	167.7	0	0	0	115.1	V96 G99 Y103 F106 I107 E142 I143	V96-L101 HydrophobicContact CG1-CD1 3.85Å; V96-L101 HydrophobicContact CG1-CG 4.23Å; G99-L101 PolarHBondContact O-N 3.02Å; L101-Y103 VanDerWaalsContact C-N 3.35Å; L101-F106 HydrophobicContact CD2-CD1 3.52Å; L101-F106 HydrophobicContact CD2-CE1 3.58Å; L101-F106 HydrophobicContact CG-CD1 4.39Å; L101-F106 HydrophobicContact CG-CE1 4.41Å; L101-I107 HydrophobicContact CD2-CD1 4.39Å; L101-E142 HydrophobicContact CD1-CB 3.65Å; L101-I143 HydrophobicContact CD2-CD1 4.48Å; L101-I143 HydrophobicContact CD2-CG1 3.77Å
102	Q	88.9	Confident	91.3	Very high	166 Å²	166	44 Å²	44	78%	0.776	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-83.5	-11.9	174.5	-60.2	173.4	27.5	0	0	112.8	G99 A100	G99-Q102 VanDerWaalsContact O-CB 3.32Å; G99-Q102 WeakPolarHBondContact O-CB 3.25Å; G99-Q102 WeakPolarHBondContact O-CG 3.36Å; G99-Q102 PolarHBondContact O-N 3.33Å; A100-Q102 PolarHBondContact O-N 2.87Å
103	Y	90.4	Very high	91.3	Very high	62 Å²	62	44 Å²	44	24%	0.243	23%	0.232	C	C	.	.	S	Bend	trans	-95.8	125.6	176	-64.3	-78.3	0	0	0	109.9	A58 S60 L64 A100 L101 E105 F106	A58-Y103 HydrophobicContact CB-CE2 4.11Å; A58-Y103 PolarHBondContact O-OH 3.44Å; S60-Y103 PolarHBondContact N-OH 2.75Å; L64-Y103 HydrophobicContact CD2-CD2 3.8Å; L64-Y103 HydrophobicContact CD2-CG 3.88Å; A100-Y103 PolarHBondContact O-N 3.16Å; L101-Y103 VanDerWaalsContact C-N 3.35Å; Y103-E105 WeakPolarHBondContact CB-OE2 3.42Å; Y103-E105 PolarHBondContact O-N 3.41Å; Y103-F106 VanDerWaalsContact O-CB 3.3Å; Y103-F106 WeakPolarHBondContact O-CB 2.96Å; Y103-F106 PolarHBondContact O-N 2.89Å
104	D	87.6	Confident	91.3	Very high	150 Å²	150	44.4 Å²	44.4	80%	0.802	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-28.8	-179.1	-72.2	-49.6	0	0	0	112.3	F106 P108	D104-F106 PolarHBondContact O-N 3.17Å; D104-P108 VanDerWaalsContact O-CD 3.29Å; D104-P108 WeakPolarHBondContact O-CD 3.3Å
105	E	88.7	Confident	91.3	Very high	85 Å²	85	48.7 Å²	48.7	40%	0.397	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.5	176.3	-51	98	133.2	0	0	113.1	G61 Y103 I107 P108 L109	G61-E105 WeakPolarHBondContact CA-OE1 3.39Å; Y103-E105 WeakPolarHBondContact CB-OE2 3.42Å; Y103-E105 PolarHBondContact O-N 3.41Å; E105-I107 PolarHBondContact O-N 3.37Å; E105-P108 VanDerWaalsContact O-CD 3.31Å; E105-P108 WeakPolarHBondContact O-CD 3.32Å; E105-L109 HydrophobicContact CB-CD1 3.95Å; E105-L109 HydrophobicContact CB-CG 4.45Å; E105-L109 VanDerWaalsContact O-CB 3.28Å; E105-L109 WeakPolarHBondContact O-CB 3.33Å; E105-L109 WeakPolarHBondContact O-CD1 3.3Å; E105-L109 WeakPolarHBondContact O-CG 3.46Å; E105-L109 PolarHBondContact O-N 3.17Å
106	F	92.8	Very high	91.4	Very high	1 Å²	1	49.1 Å²	49.1	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-61.4	-41.7	-172.5	179.9	-96.7	0	0	0	113.6	L64 I68 L92 V96 A100 L101 Y103 D104 L109 L110 L139 I143	L64-F106 HydrophobicContact CD1-CD2 4.27Å; L64-F106 HydrophobicContact CD2-CB 4.01Å; L64-F106 HydrophobicContact CD2-CD2 4.18Å; I68-F106 HydrophobicContact CD1-CE2 4.18Å; L92-F106 HydrophobicContact CD1-CE2 4.43Å; V96-F106 HydrophobicContact CG2-CE1 4.12Å; V96-F106 HydrophobicContact CG2-CE2 3.69Å; V96-F106 HydrophobicContact CG2-CZ 3.3Å; A100-F106 HydrophobicContact CB-CD2 3.83Å; A100-F106 HydrophobicContact CB-CE2 4.11Å; A100-F106 HydrophobicContact CB-CG 4.5Å; A100-F106 WeakPolarHBondContact O-CB 3.33Å; L101-F106 HydrophobicContact CD2-CD1 3.52Å; L101-F106 HydrophobicContact CD2-CE1 3.58Å; L101-F106 HydrophobicContact CG-CD1 4.39Å; L101-F106 HydrophobicContact CG-CE1 4.41Å; Y103-F106 VanDerWaalsContact O-CB 3.3Å; Y103-F106 WeakPolarHBondContact O-CB 2.96Å; Y103-F106 PolarHBondContact O-N 2.89Å; D104-F106 PolarHBondContact O-N 3.17Å; F106-L109 PolarHBondContact O-N 3.26Å; F106-L110 HydrophobicContact CE1-CB 4.34Å; F106-L110 HydrophobicContact CE1-CD2 4.06Å; F106-L110 HydrophobicContact CZ-CB 4.43Å; F106-L110 HydrophobicContact CZ-CD2 4.36Å; F106-L110 WeakPolarHBondContact O-CB 3.38Å; F106-L110 PolarHBondContact O-N 3.14Å; F106-L139 HydrophobicContact CZ-CD2 4.4Å; F106-I143 HydrophobicContact CE1-CD1 4.06Å
107	I	91.3	Very high	91.6	Very high	36 Å²	36	48.8 Å²	48.8	19%	0.185	26%	0.258	C	S	.	.	H	α-helix	trans	-71.3	-44.1	-177.7	-61.6	-65.8	0	0	0	111.7	L101 E105 L110 K111 I143	L101-I107 HydrophobicContact CD2-CD1 4.39Å; E105-I107 PolarHBondContact O-N 3.37Å; I107-L110 PolarHBondContact O-N 2.94Å; I107-K111 PolarHBondContact O-N 3.31Å; I107-I143 HydrophobicContact CD1-CD1 4.38Å; I107-I143 HydrophobicContact CD1-CG1 4.48Å; I107-I143 HydrophobicContact CD1-CG2 3.92Å
108	P	92.1	Very high	91.8	Very high	76 Å²	76	48 Å²	48	49%	0.494	25%	0.249	S	C	.	.	H	α-helix	trans	-53.5	-49	164.9	-28.3	34.7	0	0	0	113.5	D104 E105 L110 K111	D104-P108 VanDerWaalsContact O-CD 3.29Å; D104-P108 WeakPolarHBondContact O-CD 3.3Å; E105-P108 VanDerWaalsContact O-CD 3.31Å; E105-P108 WeakPolarHBondContact O-CD 3.32Å; P108-L110 VanDerWaalsContact C-N 3.34Å; P108-L110 PolarHBondContact O-N 3.02Å; P108-K111 WeakPolarHBondContact O-CB 3.27Å; P108-K111 PolarHBondContact O-N 3.44Å
109	L	92.8	Very high	92	Very high	20 Å²	20	49.4 Å²	49.4	11%	0.105	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-40.1	-179.7	-75.9	170.4	0	0	0	112.3	L64 T65 I68 E105 F106 K111 T112	L64-L109 HydrophobicContact CD2-CD1 4.34Å; L64-L109 HydrophobicContact CG-CD1 4.14Å; T65-L109 HydrophobicContact CG2-CD2 4.06Å; I68-L109 HydrophobicContact CB-CB 4.37Å; I68-L109 HydrophobicContact CB-CD2 4.48Å; I68-L109 HydrophobicContact CG1-CB 4.19Å; I68-L109 HydrophobicContact CG1-CD1 4.29Å; I68-L109 HydrophobicContact CG2-CB 4.03Å; I68-L109 HydrophobicContact CG2-CD2 4.38Å; E105-L109 HydrophobicContact CB-CD1 3.95Å; E105-L109 HydrophobicContact CB-CG 4.45Å; E105-L109 VanDerWaalsContact O-CB 3.28Å; E105-L109 WeakPolarHBondContact O-CB 3.33Å; E105-L109 WeakPolarHBondContact O-CD1 3.3Å; E105-L109 WeakPolarHBondContact O-CG 3.46Å; E105-L109 PolarHBondContact O-N 3.17Å; F106-L109 PolarHBondContact O-N 3.26Å; L109-K111 VanDerWaalsContact C-N 3.31Å; L109-K111 PolarHBondContact O-N 2.91Å; L109-T112 WeakPolarHBondContact O-CB 3.37Å; L109-T112 PolarHBondContact O-N 3.13Å; L109-T112 VanDerWaalsContact O-N 3.12Å; L109-T112 PolarHBondContact O-OG1 3.17Å
110	L	93.5	Very high	92.4	Very high	7 Å²	7	48.7 Å²	48.7	4%	0.037	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-34	178.6	-178.8	62.3	0	0	0	112.9	L92 F106 I107 P108 T112 L113 L139 I143 F150	L92-L110 HydrophobicContact CD2-CD1 4.4Å; F106-L110 HydrophobicContact CE1-CB 4.34Å; F106-L110 HydrophobicContact CE1-CD2 4.06Å; F106-L110 HydrophobicContact CZ-CB 4.43Å; F106-L110 HydrophobicContact CZ-CD2 4.36Å; F106-L110 WeakPolarHBondContact O-CB 3.38Å; F106-L110 PolarHBondContact O-N 3.14Å; I107-L110 PolarHBondContact O-N 2.94Å; P108-L110 VanDerWaalsContact C-N 3.34Å; P108-L110 PolarHBondContact O-N 3.02Å; L110-T112 PolarHBondContact O-N 3.31Å; L110-L113 HydrophobicContact CD1-CD1 4.3Å; L110-L113 WeakPolarHBondContact O-CB 3.27Å; L110-L113 PolarHBondContact O-N 3.29Å; L110-L139 HydrophobicContact CD1-CD1 4.09Å; L110-L139 HydrophobicContact CD1-CD2 4.33Å; L110-L139 HydrophobicContact CD2-CD2 4.29Å; L110-I143 HydrophobicContact CD2-CD1 3.31Å; L110-F150 HydrophobicContact CD1-CE2 4.04Å; L110-F150 HydrophobicContact CD2-CD2 4.44Å; L110-F150 HydrophobicContact CG-CD2 4.05Å; L110-F150 HydrophobicContact CG-CE2 4.03Å
111	K	92.2	Very high	92.7	Very high	99 Å²	99	48.6 Å²	48.6	43%	0.43	25%	0.248	S	C	.	.	H	α-helix	trans	-59.3	-33.6	175.3	-64.9	177.5	-178.2	176.6	0	112.1	I107 P108 L109 L113 E114	I107-K111 PolarHBondContact O-N 3.31Å; P108-K111 WeakPolarHBondContact O-CB 3.27Å; P108-K111 PolarHBondContact O-N 3.44Å; L109-K111 VanDerWaalsContact C-N 3.31Å; L109-K111 PolarHBondContact O-N 2.91Å; K111-L113 PolarHBondContact O-N 3.02Å; K111-L113 VanDerWaalsContact O-N 3.12Å; K111-E114 WeakPolarHBondContact O-CB 3.47Å; K111-E114 WeakPolarHBondContact O-CG 3.44Å; K111-E114 PolarHBondContact O-N 2.91Å; K111-E114 VanDerWaalsContact O-N 3.13Å
112	T	93.5	Very high	93	Very high	46 Å²	46	53.7 Å²	53.7	28%	0.282	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-13.4	178.3	77.7	0	0	0	0	113.6	L109 L110	L109-T112 WeakPolarHBondContact O-CB 3.37Å; L109-T112 PolarHBondContact O-N 3.13Å; L109-T112 VanDerWaalsContact O-N 3.12Å; L109-T112 PolarHBondContact O-OG1 3.17Å; L110-T112 PolarHBondContact O-N 3.31Å
113	L	94.8	Very high	93.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-5.8	177.2	-56.2	-176.7	0	0	0	113.8	I68 I71 K72 L92 L110 K111 N115 S116 I117	I68-L113 HydrophobicContact CD1-CD1 4.24Å; I68-L113 HydrophobicContact CG2-CD1 4.15Å; I68-L113 HydrophobicContact CG2-CD2 4.17Å; I68-L113 HydrophobicContact CG2-CG 4.15Å; I71-L113 HydrophobicContact CG2-CD1 3.98Å; I71-L113 HydrophobicContact CG2-CD2 4.25Å; K72-L113 HydrophobicContact CB-CD2 3.54Å; K72-L113 HydrophobicContact CG-CD2 4.01Å; L92-L113 HydrophobicContact CD1-CD1 3.99Å; L92-L113 HydrophobicContact CD2-CD1 3.72Å; L110-L113 HydrophobicContact CD1-CD1 4.3Å; L110-L113 WeakPolarHBondContact O-CB 3.27Å; L110-L113 PolarHBondContact O-N 3.29Å; K111-L113 PolarHBondContact O-N 3.02Å; K111-L113 VanDerWaalsContact O-N 3.12Å; L113-N115 PolarHBondContact O-N 2.82Å; L113-S116 PolarHBondContact O-N 3.35Å; L113-I117 HydrophobicContact CB-CD1 3.82Å; L113-I117 HydrophobicContact CB-CG1 4.35Å; L113-I117 HydrophobicContact CD1-CD1 4.47Å; L113-I117 WeakPolarHBondContact O-CB 3.42Å; L113-I117 WeakPolarHBondContact O-CG1 3.45Å; L113-I117 PolarHBondContact O-N 3.03Å
114	E	94.1	Very high	93.3	Very high	13 Å²	13	51.6 Å²	51.6	6%	0.061	26%	0.261	C	S	.	.	H	α-helix	trans	-51.5	-54.5	-175.5	-78.3	-179.4	-137.2	0	0	111.6	K111 I117 D118 R149 F150 S153	K111-E114 WeakPolarHBondContact O-CB 3.47Å; K111-E114 WeakPolarHBondContact O-CG 3.44Å; K111-E114 PolarHBondContact O-N 2.91Å; K111-E114 VanDerWaalsContact O-N 3.13Å; E114-I117 PolarHBondContact O-N 3.31Å; E114-D118 PolarHBondContact O-N 3.04Å; E114-R149 IonicContact OE1-NE 3.58Å; E114-R149 IonicContact OE1-NH2 3.49Å; E114-F150 HydrophobicContact CB-CE2 4.26Å; E114-F150 HydrophobicContact CG-CD2 3.37Å; E114-F150 HydrophobicContact CG-CE2 3.48Å; E114-F150 VanDerWaalsContact CG-CE2 3.48Å; E114-F150 HydrophobicContact CG-CG 4.09Å; E114-F150 HydrophobicContact CG-CZ 4.26Å; E114-S153 PolarHBondContact OE2-OG 3.36Å
115	N	93.1	Very high	93.6	Very high	91 Å²	91	48 Å²	48	49%	0.487	24%	0.237	S	C	.	.	H	α-helix	trans	-62.8	-44.5	178.9	-70.1	-12	0	0	0	113	L113 I117 D118 L119 M895	L113-N115 PolarHBondContact O-N 2.82Å; N115-I117 VanDerWaalsContact C-N 3.28Å; N115-I117 PolarHBondContact O-N 3.5Å; N115-D118 PolarHBondContact O-N 3.08Å; N115-L119 WeakPolarHBondContact O-CB 3.23Å; N115-L119 WeakPolarHBondContact O-CG 3.45Å; N115-L119 PolarHBondContact O-N 3.41Å; N115-M895 WeakPolarHBondContact ND2-CE 3.46Å; N115-M895 WeakPolarHBondContact OD1-CE 3.39Å
116	S	94.5	Very high	93.8	Very high	8 Å²	8	46.6 Å²	46.6	6%	0.056	24%	0.236	C	C	.	.	H	α-helix	trans	-70.2	-26.2	-176.3	-45	0	0	0	0	112.7	L113 S120	L113-S116 PolarHBondContact O-N 3.35Å; S116-S120 PolarHBondContact O-N 2.88Å; S116-S120 PolarHBondContact O-OG 2.93Å
117	I	96.1	Very high	93.9	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-80.5	-39.5	173.1	-70.6	171.3	0	0	0	110.9	L75 L89 L92 L113 E114 N115 S120 L121 V136 F150	L75-I117 HydrophobicContact CD1-CG1 4.04Å; L89-I117 HydrophobicContact CD2-CG1 4.34Å; L92-I117 HydrophobicContact CD2-CD1 3.8Å; L113-I117 HydrophobicContact CB-CD1 3.82Å; L113-I117 HydrophobicContact CB-CG1 4.35Å; L113-I117 HydrophobicContact CD1-CD1 4.47Å; L113-I117 WeakPolarHBondContact O-CB 3.42Å; L113-I117 WeakPolarHBondContact O-CG1 3.45Å; L113-I117 PolarHBondContact O-N 3.03Å; E114-I117 PolarHBondContact O-N 3.31Å; N115-I117 VanDerWaalsContact C-N 3.28Å; N115-I117 PolarHBondContact O-N 3.5Å; I117-S120 CarbonylContact O-C 3.38Å; I117-S120 WeakPolarHBondContact O-CA 3.36Å; I117-S120 WeakPolarHBondContact O-CB 3.48Å; I117-S120 PolarHBondContact O-N 3.28Å; I117-L121 PolarHBondContact O-N 3.04Å; I117-V136 HydrophobicContact CG2-CG2 3.75Å; I117-F150 HydrophobicContact CB-CZ 4.07Å; I117-F150 HydrophobicContact CD1-CE2 4.42Å; I117-F150 HydrophobicContact CD1-CZ 3.74Å; I117-F150 HydrophobicContact CG1-CZ 4.47Å; I117-F150 HydrophobicContact CG2-CE1 4.17Å; I117-F150 HydrophobicContact CG2-CZ 4.04Å
118	D	95.3	Very high	94	Very high	20 Å²	20	47 Å²	47	11%	0.107	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-45.2	172.6	-179.3	67.8	0	0	0	112.3	E114 N115 S120 L121 R122 T157	E114-D118 PolarHBondContact O-N 3.04Å; N115-D118 PolarHBondContact O-N 3.08Å; D118-S120 PolarHBondContact O-N 3.13Å; D118-S120 VanDerWaalsContact O-N 3.13Å; D118-L121 PolarHBondContact O-N 3.17Å; D118-R122 WeakPolarHBondContact O-CG 3.26Å; D118-R122 PolarHBondContact O-N 3.05Å; D118-R122 IonicContact OD1-CZ 2.85Å; D118-R122 IonicContact OD1-NE 3.72Å; D118-R122 PolarHBondContact OD1-NE 3.45Å; D118-R122 IonicContact OD1-NH2 3.98Å; D118-R122 PolarHBondContact OD1-NH2 3.04Å; D118-R122 WeakPolarHBondContact OD2-CD 3.5Å; D118-R122 IonicContact OD2-CZ 2.72Å; D118-R122 IonicContact OD2-NE 3.25Å; D118-R122 PolarHBondContact OD2-NE 3.12Å; D118-R122 IonicContact OD2-NH1 3.02Å; D118-R122 PolarHBondContact OD2-NH1 2.93Å; D118-R122 VanDerWaalsContact OD2-NH1 3.14Å; D118-R122 IonicContact OD2-NH2 3.84Å; D118-R122 PolarHBondContact OD2-NH2 3.42Å; D118-R122 VanDerWaalsContact OD2-NH2 3.16Å; D118-T157 VanDerWaalsContact OD1-CB 3.24Å; D118-T157 WeakPolarHBondContact OD1-CB 3.12Å; D118-T157 PolarHBondContact OD1-OG1 3.12Å
119	L	93.7	Very high	94.2	Very high	96 Å²	96	43.3 Å²	43.3	50%	0.503	22%	0.218	S	C	.	.	H	α-helix	trans	-57.4	-26.7	171.6	-71.9	172.3	0	0	0	113	R85 N115	R85-L119 PolarHBondContact NH2-O 3Å; N115-L119 WeakPolarHBondContact O-CB 3.23Å; N115-L119 WeakPolarHBondContact O-CG 3.45Å; N115-L119 PolarHBondContact O-N 3.41Å
120	S	95.6	Very high	94.4	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-87.3	-23.3	177.4	-57.4	0	0	0	0	113.4	R85 S116 I117 D118	R85-S120 PolarHBondContact NH2-OG 2.83Å; S116-S120 PolarHBondContact O-N 2.88Å; S116-S120 PolarHBondContact O-OG 2.93Å; I117-S120 CarbonylContact O-C 3.38Å; I117-S120 WeakPolarHBondContact O-CA 3.36Å; I117-S120 WeakPolarHBondContact O-CB 3.48Å; I117-S120 PolarHBondContact O-N 3.28Å; D118-S120 PolarHBondContact O-N 3.13Å; D118-S120 VanDerWaalsContact O-N 3.13Å
121	L	96.7	Very high	94.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-76	-23.9	166.2	-67.8	168.5	0	0	0	112.5	I117 D118 A132 V136 V154 T157 I158 L161	I117-L121 PolarHBondContact O-N 3.04Å; D118-L121 PolarHBondContact O-N 3.17Å; L121-A132 HydrophobicContact CD2-CB 3.72Å; L121-A132 HydrophobicContact CG-CB 4.03Å; L121-V136 HydrophobicContact CD1-CG2 4.3Å; L121-V154 HydrophobicContact CD1-CB 3.75Å; L121-V154 HydrophobicContact CD1-CG1 3.94Å; L121-V154 HydrophobicContact CD1-CG2 4.48Å; L121-T157 HydrophobicContact CB-CG2 3.56Å; L121-T157 HydrophobicContact CD1-CG2 4.46Å; L121-I158 HydrophobicContact CD1-CD1 4.34Å; L121-I158 HydrophobicContact CD1-CG1 4.03Å; L121-I158 HydrophobicContact CD2-CG1 4.45Å; L121-L161 HydrophobicContact CD2-CD1 4.49Å
122	R	94.4	Very high	94.7	Very high	151 Å²	151	40.8 Å²	40.8	57%	0.57	21%	0.205	S	C	*	.	S	Bend	trans	-90	2.2	178.3	-67.8	180	-179.5	170.1	10.6	114.8	D118 T157	D118-R122 WeakPolarHBondContact O-CG 3.26Å; D118-R122 PolarHBondContact O-N 3.05Å; D118-R122 IonicContact OD1-CZ 2.85Å; D118-R122 IonicContact OD1-NE 3.72Å; D118-R122 PolarHBondContact OD1-NE 3.45Å; D118-R122 IonicContact OD1-NH2 3.98Å; D118-R122 PolarHBondContact OD1-NH2 3.04Å; D118-R122 WeakPolarHBondContact OD2-CD 3.5Å; D118-R122 IonicContact OD2-CZ 2.72Å; D118-R122 IonicContact OD2-NE 3.25Å; D118-R122 PolarHBondContact OD2-NE 3.12Å; D118-R122 IonicContact OD2-NH1 3.02Å; D118-R122 PolarHBondContact OD2-NH1 2.93Å; D118-R122 VanDerWaalsContact OD2-NH1 3.14Å; D118-R122 IonicContact OD2-NH2 3.84Å; D118-R122 PolarHBondContact OD2-NH2 3.42Å; D118-R122 VanDerWaalsContact OD2-NH2 3.16Å; R122-T157 HydrophobicContact CG-CG2 3.52Å; R122-T157 PolarHBondContact NE-OG1 3.35Å; R122-T157 PolarHBondContact NH2-OG1 2.87Å
123	D	94.2	Very high	94.8	Very high	20 Å²	20	38.6 Å²	38.6	11%	0.107	19%	0.191	C	C	.	.			trans	-66.3	150.4	-175.6	-156.2	-72	0	0	0	113.1	R85 R125 V128 V129 M169	R85-D123 IonicContact CZ-OD2 3.49Å; R85-D123 IonicContact NH1-OD2 2.72Å; R85-D123 PolarHBondContact NH1-OD2 2.99Å; R85-D123 IonicContact NH2-OD2 3.76Å; R85-D123 PolarHBondContact NH2-OD2 3.42Å; D123-R125 VanDerWaalsContact C-N 3.31Å; D123-R125 VanDerWaalsContact OD1-CB 3.26Å; D123-R125 WeakPolarHBondContact OD1-CB 3.44Å; D123-R125 WeakPolarHBondContact OD1-CG 3.34Å; D123-R125 PolarHBondContact OD1-N 2.82Å; D123-V128 HydrophobicContact CB-CB 3.87Å; D123-V128 HydrophobicContact CB-CG1 3.84Å; D123-V129 HydrophobicContact CB-CG2 3.95Å; D123-V129 WeakPolarHBondContact O-CG2 2.87Å; D123-M169 WeakPolarHBondContact O-CE 3.34Å
124	L	92.6	Very high	94.9	Very high	165 Å²	165	38.6 Å²	38.6	86%	0.864	19%	0.191	S	C	*	.	S	Bend	trans	-77.6	-17.4	175.9	-60.4	179.6	0	0	0	112.6	M169	L124-M169 VanDerWaalsContact O-CE 3.28Å; L124-M169 WeakPolarHBondContact O-CE 3.45Å
125	R	93.8	Very high	95	Very high	75 Å²	75	38 Å²	38	28%	0.283	19%	0.189	S	C	.	.	S	Bend	trans	-90.6	118.7	-178.4	-62.7	168.6	166.5	106.7	0.5	110.2	P79 E80 D123 S127 V128 V129	P79-R125 PolarHBondContact O-NH1 3.14Å; P79-R125 VanDerWaalsContact O-NH1 3.12Å; E80-R125 IonicContact OE1-CZ 3.16Å; E80-R125 IonicContact OE1-NH1 2.72Å; E80-R125 PolarHBondContact OE1-NH1 3.39Å; E80-R125 IonicContact OE1-NH2 3.85Å; E80-R125 PolarHBondContact OE1-NH2 3.43Å; E80-R125 IonicContact OE2-CZ 3.48Å; E80-R125 IonicContact OE2-NH1 2.71Å; E80-R125 IonicContact OE2-NH2 2.88Å; E80-R125 PolarHBondContact OE2-NH2 2.74Å; D123-R125 VanDerWaalsContact C-N 3.31Å; D123-R125 VanDerWaalsContact OD1-CB 3.26Å; D123-R125 WeakPolarHBondContact OD1-CB 3.44Å; D123-R125 WeakPolarHBondContact OD1-CG 3.34Å; D123-R125 PolarHBondContact OD1-N 2.82Å; R125-S127 PolarHBondContact O-N 2.69Å; R125-S127 VanDerWaalsContact O-N 3.15Å; R125-V128 HydrophobicContact CB-CG2 3.98Å; R125-V128 PolarHBondContact O-N 2.82Å; R125-V128 VanDerWaalsContact O-N 3.11Å; R125-V129 PolarHBondContact O-N 3.29Å
126	S	93.4	Very high	95.2	Very high	55 Å²	55	33.7 Å²	33.7	39%	0.385	17%	0.165	S	C	.	.	H	α-helix	trans	-64.7	-19.3	-177.7	56.9	0	0	0	0	114.2	R130	S126-R130 WeakPolarHBondContact O-CB 3.17Å; S126-R130 PolarHBondContact O-N 3.35Å; S126-R130 VanDerWaalsContact O-N 3.09Å
127	S	93.1	Very high	95.3	Very high	44 Å²	44	33.3 Å²	33.3	31%	0.308	16%	0.163	S	C	.	.	H	α-helix	trans	-64	-53.8	169	45.9	0	0	0	0	111.7	W82 R125 R130 E131	W82-S127 VanDerWaalsContact CE3-OG 3.29Å; W82-S127 VanDerWaalsContact CZ3-OG 3.24Å; W82-S127 WeakPolarHBondContact CZ3-OG 3.18Å; R125-S127 PolarHBondContact O-N 2.69Å; R125-S127 VanDerWaalsContact O-N 3.15Å; S127-R130 PolarHBondContact O-N 2.91Å; S127-E131 WeakPolarHBondContact O-CB 3.48Å; S127-E131 PolarHBondContact O-N 3.34Å
128	V	95.2	Very high	95.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-48.9	-179	-174.2	0	0	0	0	110.5	W82 V86 D123 R125 R130 E131 A132	W82-V128 HydrophobicContact CB-CG2 3.76Å; W82-V128 HydrophobicContact CE3-CG2 4.21Å; V86-V128 HydrophobicContact CG2-CG2 4.14Å; D123-V128 HydrophobicContact CB-CB 3.87Å; D123-V128 HydrophobicContact CB-CG1 3.84Å; R125-V128 HydrophobicContact CB-CG2 3.98Å; R125-V128 PolarHBondContact O-N 2.82Å; R125-V128 VanDerWaalsContact O-N 3.11Å; V128-R130 PolarHBondContact O-N 2.77Å; V128-E131 PolarHBondContact O-N 2.91Å; V128-A132 WeakPolarHBondContact O-CB 3.35Å; V128-A132 PolarHBondContact O-N 2.74Å
129	V	96.5	Very high	95.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.3	-42.7	-180	177.8	0	0	0	0	112	D123 R125 E131 A132 C133 L161 M169	D123-V129 HydrophobicContact CB-CG2 3.95Å; D123-V129 WeakPolarHBondContact O-CG2 2.87Å; R125-V129 PolarHBondContact O-N 3.29Å; V129-E131 VanDerWaalsContact C-N 3.34Å; V129-E131 PolarHBondContact O-N 2.91Å; V129-A132 PolarHBondContact O-N 3.37Å; V129-C133 WeakPolarHBondContact O-CB 3.12Å; V129-C133 PolarHBondContact O-N 2.89Å; V129-C133 PolarHBondContact O-SG 2.87Å; V129-L161 HydrophobicContact CG1-CD1 3.61Å; V129-L161 HydrophobicContact CG1-CD2 3.84Å; V129-L161 HydrophobicContact CG1-CG 4.39Å; V129-M169 HydrophobicContact CB-CE 4.24Å; V129-M169 HydrophobicContact CB-CG 4.07Å; V129-M169 HydrophobicContact CG1-CB 4.18Å; V129-M169 HydrophobicContact CG1-CG 3.97Å; V129-M169 HydrophobicContact CG2-CE 3.78Å; V129-M169 HydrophobicContact CG2-SD 4.47Å
130	R	95.1	Very high	95.4	Very high	55 Å²	55	28 Å²	28	21%	0.208	14%	0.135	C	C	.	.	H	α-helix	trans	-60.2	-45.9	174.8	175.8	175.7	-177.3	-77.8	-4.4	110.9	S49 S126 S127 V128 C133 I134 V168	S49-R130 PolarHBondContact OG-NH2 3.16Å; S126-R130 WeakPolarHBondContact O-CB 3.17Å; S126-R130 PolarHBondContact O-N 3.35Å; S126-R130 VanDerWaalsContact O-N 3.09Å; S127-R130 PolarHBondContact O-N 2.91Å; V128-R130 PolarHBondContact O-N 2.77Å; R130-C133 PolarHBondContact O-N 2.86Å; R130-I134 HydrophobicContact CG-CD1 3.78Å; R130-I134 VanDerWaalsContact CZ-CD1 3.47Å; R130-I134 VanDerWaalsContact NH1-CD1 3.27Å; R130-I134 WeakPolarHBondContact O-CD1 3.45Å; R130-I134 VanDerWaalsContact O-CG1 3.26Å; R130-I134 WeakPolarHBondContact O-CG1 3.1Å; R130-I134 PolarHBondContact O-N 3.4Å; R130-V168 HydrophobicContact CB-CG1 4.25Å
131	E	95.3	Very high	95.4	Very high	18 Å²	18	30.1 Å²	30.1	8%	0.084	15%	0.145	C	C	.	.	H	α-helix	trans	-65	-40.6	-178.6	-157.6	65.8	-149.4	0	0	111.7	V86 L89 K90 R93 S127 V128 V129 I134 T135	V86-E131 HydrophobicContact CG1-CG 4.13Å; V86-E131 HydrophobicContact CG2-CB 4.2Å; V86-E131 HydrophobicContact CG2-CG 4.47Å; L89-E131 HydrophobicContact CB-CG 3.87Å; L89-E131 HydrophobicContact CD1-CB 3.97Å; L89-E131 HydrophobicContact CD1-CG 4.12Å; K90-E131 VanDerWaalsContact CG-OE1 3.25Å; K90-E131 WeakPolarHBondContact CG-OE1 3.47Å; R93-E131 IonicContact CZ-OE1 3.59Å; R93-E131 IonicContact NH1-OE1 2.75Å; R93-E131 PolarHBondContact NH1-OE1 3.28Å; R93-E131 IonicContact NH2-OE1 3.19Å; R93-E131 PolarHBondContact NH2-OE1 2.97Å; S127-E131 WeakPolarHBondContact O-CB 3.48Å; S127-E131 PolarHBondContact O-N 3.34Å; V128-E131 PolarHBondContact O-N 2.91Å; V129-E131 VanDerWaalsContact C-N 3.34Å; V129-E131 PolarHBondContact O-N 2.91Å; E131-I134 PolarHBondContact O-N 2.95Å; E131-T135 PolarHBondContact O-N 3.48Å; E131-T135 PolarHBondContact O-OG1 3.36Å
132	A	96.8	Very high	95.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.6	-42.7	176.6	0	0	0	0	0	111.6	L89 L121 V128 V129 I134 T135 V136	L89-A132 HydrophobicContact CD1-CB 3.96Å; L121-A132 HydrophobicContact CD2-CB 3.72Å; L121-A132 HydrophobicContact CG-CB 4.03Å; V128-A132 WeakPolarHBondContact O-CB 3.35Å; V128-A132 PolarHBondContact O-N 2.74Å; V129-A132 PolarHBondContact O-N 3.37Å; A132-I134 VanDerWaalsContact C-N 3.32Å; A132-I134 PolarHBondContact O-N 3.11Å; A132-T135 PolarHBondContact O-N 3.35Å; A132-V136 WeakPolarHBondContact O-CG2 3.41Å; A132-V136 PolarHBondContact O-N 3.09Å
133	C	97.5	Very high	95.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.6	-41	172.2	-74.8	0	0	0	0	112.5	F46 V129 R130 A137 A176	F46-C133 HydrophobicContact CE2-CB 4.27Å; F46-C133 HydrophobicContact CZ-CB 4.25Å; V129-C133 WeakPolarHBondContact O-CB 3.12Å; V129-C133 PolarHBondContact O-N 2.89Å; V129-C133 PolarHBondContact O-SG 2.87Å; R130-C133 PolarHBondContact O-N 2.86Å; C133-A137 VanDerWaalsContact O-CB 3.26Å; C133-A137 WeakPolarHBondContact O-CB 3.28Å; C133-A137 PolarHBondContact O-N 2.96Å; C133-A176 HydrophobicContact CB-CB 3.94Å
134	I	96.4	Very high	95.1	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-67	-41.5	177.2	-66.8	160.7	0	0	0	110.8	F46 F50 R130 E131 A132 A137 F138	F46-I134 HydrophobicContact CD1-CG1 4.37Å; F46-I134 HydrophobicContact CD2-CD1 4.31Å; F46-I134 HydrophobicContact CD2-CG1 3.66Å; F46-I134 HydrophobicContact CE1-CG1 4.14Å; F46-I134 HydrophobicContact CE2-CB 4.47Å; F46-I134 HydrophobicContact CE2-CD1 4.36Å; F46-I134 HydrophobicContact CE2-CG1 3.39Å; F46-I134 HydrophobicContact CG-CG1 4.16Å; F46-I134 HydrophobicContact CZ-CB 4.31Å; F46-I134 HydrophobicContact CZ-CG1 3.67Å; F50-I134 HydrophobicContact CD1-CG2 3.91Å; F50-I134 HydrophobicContact CE1-CG2 4.33Å; R130-I134 HydrophobicContact CG-CD1 3.78Å; R130-I134 VanDerWaalsContact CZ-CD1 3.47Å; R130-I134 VanDerWaalsContact NH1-CD1 3.27Å; R130-I134 WeakPolarHBondContact O-CD1 3.45Å; R130-I134 VanDerWaalsContact O-CG1 3.26Å; R130-I134 WeakPolarHBondContact O-CG1 3.1Å; R130-I134 PolarHBondContact O-N 3.4Å; E131-I134 PolarHBondContact O-N 2.95Å; A132-I134 VanDerWaalsContact C-N 3.32Å; A132-I134 PolarHBondContact O-N 3.11Å; I134-A137 PolarHBondContact O-N 3.27Å; I134-F138 WeakPolarHBondContact O-CB 3.35Å; I134-F138 PolarHBondContact O-N 3.22Å
135	T	96.6	Very high	95.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.5	-45.2	175.8	-67.1	0	0	0	0	112.6	L89 L92 R93 E131 A132 A137 F138 L139	L89-T135 HydrophobicContact CD2-CG2 4.09Å; L89-T135 PolarHBondContact O-OG1 2.9Å; L89-T135 VanDerWaalsContact O-OG1 3.07Å; L92-T135 HydrophobicContact CD2-CG2 3.88Å; L92-T135 HydrophobicContact CG-CG2 4.37Å; R93-T135 HydrophobicContact CG-CG2 4.15Å; R93-T135 WeakPolarHBondContact CG-OG1 3.4Å; R93-T135 PolarHBondContact NH1-OG1 2.7Å; E131-T135 PolarHBondContact O-N 3.48Å; E131-T135 PolarHBondContact O-OG1 3.36Å; A132-T135 PolarHBondContact O-N 3.35Å; T135-A137 PolarHBondContact O-N 2.7Å; T135-F138 PolarHBondContact O-N 2.91Å; T135-L139 HydrophobicContact CG2-CD1 3.78Å; T135-L139 HydrophobicContact CG2-CG 4.34Å; T135-L139 WeakPolarHBondContact O-CB 3.31Å; T135-L139 WeakPolarHBondContact O-CD1 3.43Å; T135-L139 WeakPolarHBondContact O-CG 3.5Å; T135-L139 PolarHBondContact O-N 3.32Å
136	V	97.2	Very high	94.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.2	-42.3	175	169.9	0	0	0	0	111.9	I117 L121 A132 L139 S140 F147 F150 V154 I158 I180	I117-V136 HydrophobicContact CG2-CG2 3.75Å; L121-V136 HydrophobicContact CD1-CG2 4.3Å; A132-V136 WeakPolarHBondContact O-CG2 3.41Å; A132-V136 PolarHBondContact O-N 3.09Å; V136-L139 PolarHBondContact O-N 2.66Å; V136-S140 PolarHBondContact O-N 3.24Å; V136-F147 HydrophobicContact CG1-CE1 4.08Å; V136-F147 HydrophobicContact CG1-CZ 4.04Å; V136-F150 HydrophobicContact CG2-CE1 4.36Å; V136-V154 HydrophobicContact CG1-CG2 4.18Å; V136-I158 HydrophobicContact CG1-CD1 4Å; V136-I180 HydrophobicContact CG1-CD1 3.83Å; V136-I180 HydrophobicContact CG1-CG1 4.24Å
137	A	96.8	Very high	95	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62	-47.1	177.2	0	0	0	0	0	112.3	F46 F50 C133 I134 T135 S140 Q141 A176 F179	F46-A137 HydrophobicContact CE1-CB 3.55Å; F46-A137 HydrophobicContact CZ-CB 4Å; F50-A137 HydrophobicContact CE1-CB 4.06Å; F50-A137 HydrophobicContact CZ-CB 3.86Å; C133-A137 VanDerWaalsContact O-CB 3.26Å; C133-A137 WeakPolarHBondContact O-CB 3.28Å; C133-A137 PolarHBondContact O-N 2.96Å; I134-A137 PolarHBondContact O-N 3.27Å; T135-A137 PolarHBondContact O-N 2.7Å; A137-S140 PolarHBondContact O-N 3.04Å; A137-S140 PolarHBondContact O-OG 2.93Å; A137-Q141 PolarHBondContact O-N 3.43Å; A137-Q141 VanDerWaalsContact O-N 3.12Å; A137-A176 HydrophobicContact CB-CB 4.38Å; A137-F179 HydrophobicContact CB-CB 3.78Å; A137-F179 HydrophobicContact CB-CD2 3.97Å; A137-F179 HydrophobicContact CB-CG 3.84Å
138	F	96	Very high	94.9	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.018	13%	0.133	C	C	.	.	H	α-helix	trans	-62.9	-47	176.9	179.3	-117	0	0	0	112	F50 I51 R93 V96 A97 I134 T135 S140 Q141 E142	F50-F138 HydrophobicContact CB-CB 4.48Å; F50-F138 HydrophobicContact CB-CD2 3.76Å; F50-F138 HydrophobicContact CB-CE2 4.33Å; F50-F138 HydrophobicContact CB-CG 4.31Å; F50-F138 HydrophobicContact CD1-CB 4.38Å; F50-F138 HydrophobicContact CD2-CB 4.17Å; F50-F138 AromaticContact CD2-CD2 3.6Å; F50-F138 HydrophobicContact CD2-CD2 3.6Å; F50-F138 HydrophobicContact CD2-CG 4.34Å; F50-F138 HydrophobicContact CE2-CB 4.4Å; F50-F138 HydrophobicContact CE2-CD2 4.36Å; F50-F138 HydrophobicContact CG-CB 4.12Å; F50-F138 AromaticContact CG-CD2 3.89Å; F50-F138 HydrophobicContact CG-CD2 3.89Å; F50-F138 HydrophobicContact CG-CG 4.37Å; I51-F138 HydrophobicContact CG1-CE2 4.32Å; I51-F138 HydrophobicContact CG1-CZ 4.39Å; R93-F138 HydrophobicContact CB-CD1 3.69Å; R93-F138 HydrophobicContact CB-CE1 3.87Å; R93-F138 HydrophobicContact CG-CB 4.46Å; R93-F138 HydrophobicContact CG-CD1 3.67Å; R93-F138 HydrophobicContact CG-CE1 4.36Å; R93-F138 HydrophobicContact CG-CG 4.39Å; R93-F138 WeakPolarHBondContact O-CE1 3.43Å; V96-F138 HydrophobicContact CB-CE1 3.9Å; V96-F138 HydrophobicContact CG1-CD1 4.45Å; V96-F138 HydrophobicContact CG1-CE1 3.66Å; V96-F138 HydrophobicContact CG1-CZ 4.1Å; A97-F138 HydrophobicContact CB-CE1 4.5Å; A97-F138 HydrophobicContact CB-CZ 3.97Å; I134-F138 WeakPolarHBondContact O-CB 3.35Å; I134-F138 PolarHBondContact O-N 3.22Å; T135-F138 PolarHBondContact O-N 2.91Å; F138-S140 VanDerWaalsContact C-N 3.3Å; F138-S140 PolarHBondContact O-N 3.47Å; F138-Q141 WeakPolarHBondContact O-CB 3.02Å; F138-Q141 PolarHBondContact O-N 3.43Å; F138-E142 HydrophobicContact CD2-CG 3.94Å; F138-E142 HydrophobicContact CE1-CG 4.18Å; F138-E142 HydrophobicContact CE2-CG 3.47Å; F138-E142 VanDerWaalsContact CE2-CG 3.47Å; F138-E142 HydrophobicContact CG-CG 4.49Å; F138-E142 HydrophobicContact CZ-CG 3.62Å; F138-E142 PolarHBondContact O-N 2.89Å
139	L	95.7	Very high	94.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-57.2	-42.5	175.7	-71.6	167.6	0	0	0	111.5	L92 V96 F106 L110 T135 V136 Q141 E142 I143 F147	L92-L139 HydrophobicContact CD2-CD1 4.17Å; V96-L139 HydrophobicContact CG2-CD2 4.07Å; F106-L139 HydrophobicContact CZ-CD2 4.4Å; L110-L139 HydrophobicContact CD1-CD1 4.09Å; L110-L139 HydrophobicContact CD1-CD2 4.33Å; L110-L139 HydrophobicContact CD2-CD2 4.29Å; T135-L139 HydrophobicContact CG2-CD1 3.78Å; T135-L139 HydrophobicContact CG2-CG 4.34Å; T135-L139 WeakPolarHBondContact O-CB 3.31Å; T135-L139 WeakPolarHBondContact O-CD1 3.43Å; T135-L139 WeakPolarHBondContact O-CG 3.5Å; T135-L139 PolarHBondContact O-N 3.32Å; V136-L139 PolarHBondContact O-N 2.66Å; L139-Q141 VanDerWaalsContact C-N 3.3Å; L139-Q141 PolarHBondContact O-N 2.91Å; L139-E142 PolarHBondContact O-N 3.37Å; L139-I143 HydrophobicContact CB-CD1 4.12Å; L139-I143 HydrophobicContact CD2-CD1 3.84Å; L139-I143 WeakPolarHBondContact O-CB 3.4Å; L139-I143 VanDerWaalsContact O-CG1 3.27Å; L139-I143 WeakPolarHBondContact O-CG1 3.06Å; L139-I143 PolarHBondContact O-N 2.97Å; L139-F147 HydrophobicContact CB-CD2 4.24Å; L139-F147 HydrophobicContact CB-CE2 3.62Å; L139-F147 HydrophobicContact CB-CZ 4Å; L139-F147 HydrophobicContact CD1-CE2 4.4Å
140	S	95.6	Very high	94.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.1	-35.9	175.4	78	0	0	0	0	113	V136 A137 F138 R144 F179 N183	V136-S140 PolarHBondContact O-N 3.24Å; A137-S140 PolarHBondContact O-N 3.04Å; A137-S140 PolarHBondContact O-OG 2.93Å; F138-S140 VanDerWaalsContact C-N 3.3Å; F138-S140 PolarHBondContact O-N 3.47Å; S140-R144 WeakPolarHBondContact O-CA 3.43Å; S140-R144 PolarHBondContact O-N 2.97Å; S140-F179 PolarHBondContact OG-O 2.96Å; S140-N183 WeakPolarHBondContact O-CB 3.23Å
141	Q	94.3	Very high	94.6	Very high	45 Å²	45	31.2 Å²	31.2	21%	0.21	14%	0.137	C	C	.	.	H	α-helix	trans	-70.6	-40.4	178.1	-170	-173.6	-96.3	0	0	112.6	A137 F138 L139 R144 F179	A137-Q141 PolarHBondContact O-N 3.43Å; A137-Q141 VanDerWaalsContact O-N 3.12Å; F138-Q141 WeakPolarHBondContact O-CB 3.02Å; F138-Q141 PolarHBondContact O-N 3.43Å; L139-Q141 VanDerWaalsContact C-N 3.3Å; L139-Q141 PolarHBondContact O-N 2.91Å; Q141-R144 WeakPolarHBondContact O-CD 3.24Å; Q141-R144 PolarHBondContact O-NE 3.04Å; Q141-R144 PolarHBondContact O-NH2 2.74Å; Q141-F179 HydrophobicContact CB-CD1 4.47Å
142	E	93.7	Very high	94.6	Very high	77 Å²	77	32.4 Å²	32.4	36%	0.36	14%	0.142	S	C	.	.	H	α-helix	trans	-85.8	-30.1	-176.7	-54.8	-49.3	121	0	0	112.8	V96 L101 F138 L139	V96-E142 HydrophobicContact CG1-CB 3.98Å; V96-E142 HydrophobicContact CG1-CG 4.06Å; L101-E142 HydrophobicContact CD1-CB 3.65Å; F138-E142 HydrophobicContact CD2-CG 3.94Å; F138-E142 HydrophobicContact CE1-CG 4.18Å; F138-E142 HydrophobicContact CE2-CG 3.47Å; F138-E142 VanDerWaalsContact CE2-CG 3.47Å; F138-E142 HydrophobicContact CG-CG 4.49Å; F138-E142 HydrophobicContact CZ-CG 3.62Å; F138-E142 PolarHBondContact O-N 2.89Å; L139-E142 PolarHBondContact O-N 3.37Å
143	I	92.9	Very high	94.4	Very high	5 Å²	5	35 Å²	35	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-92.9	-22.2	-177.1	-58.6	171.4	0	0	0	112.3	L101 F106 I107 L110 L139 N145 R146 F147	L101-I143 HydrophobicContact CD2-CD1 4.48Å; L101-I143 HydrophobicContact CD2-CG1 3.77Å; F106-I143 HydrophobicContact CE1-CD1 4.06Å; I107-I143 HydrophobicContact CD1-CD1 4.38Å; I107-I143 HydrophobicContact CD1-CG1 4.48Å; I107-I143 HydrophobicContact CD1-CG2 3.92Å; L110-I143 HydrophobicContact CD2-CD1 3.31Å; L139-I143 HydrophobicContact CB-CD1 4.12Å; L139-I143 HydrophobicContact CD2-CD1 3.84Å; L139-I143 WeakPolarHBondContact O-CB 3.4Å; L139-I143 VanDerWaalsContact O-CG1 3.27Å; L139-I143 WeakPolarHBondContact O-CG1 3.06Å; L139-I143 PolarHBondContact O-N 2.97Å; I143-N145 PolarHBondContact O-N 3.41Å; I143-R146 HydrophobicContact CG2-CB 3.65Å; I143-R146 PolarHBondContact O-N 3.28Å; I143-F147 HydrophobicContact CB-CB 4.14Å; I143-F147 HydrophobicContact CB-CD2 4.44Å; I143-F147 HydrophobicContact CD1-CD2 4.04Å; I143-F147 HydrophobicContact CG2-CB 3.95Å; I143-F147 HydrophobicContact CG2-CD2 4.5Å
144	R	93.2	Very high	94.4	Very high	128 Å²	128	35 Å²	35	48%	0.483	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	56.9	-123.8	178	-57.2	-72.9	170.9	159.7	-5.3	112.5	S140 Q141 R146 F147 N183 T184	S140-R144 WeakPolarHBondContact O-CA 3.43Å; S140-R144 PolarHBondContact O-N 2.97Å; Q141-R144 WeakPolarHBondContact O-CD 3.24Å; Q141-R144 PolarHBondContact O-NE 3.04Å; Q141-R144 PolarHBondContact O-NH2 2.74Å; R144-R146 VanDerWaalsContact C-N 3.33Å; R144-R146 PolarHBondContact O-N 3.38Å; R144-F147 VanDerWaalsContact O-CB 3.31Å; R144-F147 WeakPolarHBondContact O-CB 3.5Å; R144-F147 PolarHBondContact O-N 3.28Å; R144-N183 CarbonylContact C-O 3.46Å; R144-N183 VanDerWaalsContact CA-O 3.32Å; R144-N183 WeakPolarHBondContact CA-O 3.43Å; R144-N183 VanDerWaalsContact CZ-OD1 3.28Å; R144-N183 PolarHBondContact NH1-OD1 3.18Å; R144-T184 WeakPolarHBondContact O-CA 3.4Å; R144-T184 PolarHBondContact O-OG1 2.96Å; R144-T184 VanDerWaalsContact O-OG1 3.14Å
145	N	91.5	Very high	94.3	Very high	117 Å²	117	35 Å²	35	63%	0.626	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-68	-26.8	-177.4	63.7	-23.4	0	0	0	113.5	I143 F147 D148	I143-N145 PolarHBondContact O-N 3.41Å; N145-F147 PolarHBondContact O-N 3.35Å; N145-F147 VanDerWaalsContact O-N 3.1Å; N145-D148 PolarHBondContact O-N 2.93Å
146	R	91	Very high	94.2	Very high	141 Å²	141	40 Å²	40	53%	0.532	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-70	-0.4	175.5	-61.5	-165.9	-63.1	173.9	-0.1	113.5	I143 R144	I143-R146 HydrophobicContact CG2-CB 3.65Å; I143-R146 PolarHBondContact O-N 3.28Å; R144-R146 VanDerWaalsContact C-N 3.33Å; R144-R146 PolarHBondContact O-N 3.38Å
147	F	93.9	Very high	94.2	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.009	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-92.9	2.5	175.9	-162.6	-113.4	0	0	0	112.6	V136 L139 I143 R144 N145 R149 F150 A151 I180 T184	V136-F147 HydrophobicContact CG1-CE1 4.08Å; V136-F147 HydrophobicContact CG1-CZ 4.04Å; L139-F147 HydrophobicContact CB-CD2 4.24Å; L139-F147 HydrophobicContact CB-CE2 3.62Å; L139-F147 HydrophobicContact CB-CZ 4Å; L139-F147 HydrophobicContact CD1-CE2 4.4Å; I143-F147 HydrophobicContact CB-CB 4.14Å; I143-F147 HydrophobicContact CB-CD2 4.44Å; I143-F147 HydrophobicContact CD1-CD2 4.04Å; I143-F147 HydrophobicContact CG2-CB 3.95Å; I143-F147 HydrophobicContact CG2-CD2 4.5Å; R144-F147 VanDerWaalsContact O-CB 3.31Å; R144-F147 WeakPolarHBondContact O-CB 3.5Å; R144-F147 PolarHBondContact O-N 3.28Å; N145-F147 PolarHBondContact O-N 3.35Å; N145-F147 VanDerWaalsContact O-N 3.1Å; F147-R149 PolarHBondContact O-N 3.4Å; F147-F150 HydrophobicContact CD2-CB 3.86Å; F147-F150 HydrophobicContact CD2-CD1 4.42Å; F147-F150 HydrophobicContact CD2-CG 4.19Å; F147-F150 HydrophobicContact CE1-CD1 4.22Å; F147-F150 HydrophobicContact CE2-CB 3.71Å; F147-F150 AromaticContact CE2-CD1 3.43Å; F147-F150 HydrophobicContact CE2-CD1 3.43Å; F147-F150 VanDerWaalsContact CE2-CD1 3.43Å; F147-F150 HydrophobicContact CE2-CD2 4.29Å; F147-F150 HydrophobicContact CE2-CE1 4.16Å; F147-F150 AromaticContact CE2-CG 3.54Å; F147-F150 HydrophobicContact CE2-CG 3.54Å; F147-F150 HydrophobicContact CG-CB 4.41Å; F147-F150 HydrophobicContact CZ-CB 4.15Å; F147-F150 AromaticContact CZ-CD1 3.31Å; F147-F150 HydrophobicContact CZ-CD1 3.31Å; F147-F150 AromaticContact CZ-CE1 3.97Å; F147-F150 HydrophobicContact CZ-CE1 3.97Å; F147-F150 AromaticContact CZ-CG 3.9Å; F147-F150 HydrophobicContact CZ-CG 3.9Å; F147-F150 PolarHBondContact O-N 3Å; F147-A151 HydrophobicContact CD1-CB 3.85Å; F147-A151 HydrophobicContact CE1-CB 4.11Å; F147-A151 VanDerWaalsContact O-CB 3.23Å; F147-A151 WeakPolarHBondContact O-CB 3.36Å; F147-A151 PolarHBondContact O-N 3.01Å; F147-I180 HydrophobicContact CE1-CG1 4.46Å; F147-T184 HydrophobicContact CB-CG2 4.16Å
148	D	92.3	Very high	94.2	Very high	45 Å²	45	40.3 Å²	40.3	24%	0.241	19%	0.186	C	C	.	.	H	α-helix	trans	-53.3	-48.8	-172	75.8	-48.1	0	0	0	114.4	N145 E152 T184 R188	N145-D148 PolarHBondContact O-N 2.93Å; D148-E152 PolarHBondContact O-N 3.01Å; D148-T184 VanDerWaalsContact CA-CG2 3.49Å; D148-T184 HydrophobicContact CB-CG2 4.17Å; D148-R188 VanDerWaalsContact OD2-CD 3.26Å; D148-R188 WeakPolarHBondContact OD2-CD 3.35Å; D148-R188 IonicContact OD2-CZ 3.77Å; D148-R188 IonicContact OD2-NE 3.34Å; D148-R188 IonicContact OD2-NH1 3.23Å; D148-R188 PolarHBondContact OD2-NH1 2.64Å
149	R	91.6	Very high	94.2	Very high	65 Å²	65	40.4 Å²	40.4	25%	0.245	19%	0.186	C	C	.	.	H	α-helix	trans	-69.8	-43.1	-178.4	174.9	-174.5	153	123.2	10.5	112.1	E114 F147 A151 E152 S153 M895 G896	E114-R149 IonicContact OE1-NE 3.58Å; E114-R149 IonicContact OE1-NH2 3.49Å; F147-R149 PolarHBondContact O-N 3.4Å; R149-A151 VanDerWaalsContact C-N 3.33Å; R149-E152 PolarHBondContact O-N 3.1Å; R149-S153 PolarHBondContact O-N 3.39Å; R149-S153 VanDerWaalsContact O-N 3.14Å; R149-M895 PolarHBondContact NH2-O 3.02Å; R149-G896 PolarHBondContact NH1-O 3.11Å
150	F	94.1	Very high	94.2	Very high	9 Å²	9	43.3 Å²	43.3	4%	0.039	21%	0.21	C	C	.	.	H	α-helix	trans	-65.8	-40.5	177.2	-163.8	-66.1	0	0	0	110.4	L110 E114 I117 V136 F147 E152 S153 V154	L110-F150 HydrophobicContact CD1-CE2 4.04Å; L110-F150 HydrophobicContact CD2-CD2 4.44Å; L110-F150 HydrophobicContact CG-CD2 4.05Å; L110-F150 HydrophobicContact CG-CE2 4.03Å; E114-F150 HydrophobicContact CB-CE2 4.26Å; E114-F150 HydrophobicContact CG-CD2 3.37Å; E114-F150 HydrophobicContact CG-CE2 3.48Å; E114-F150 VanDerWaalsContact CG-CE2 3.48Å; E114-F150 HydrophobicContact CG-CG 4.09Å; E114-F150 HydrophobicContact CG-CZ 4.26Å; I117-F150 HydrophobicContact CB-CZ 4.07Å; I117-F150 HydrophobicContact CD1-CE2 4.42Å; I117-F150 HydrophobicContact CD1-CZ 3.74Å; I117-F150 HydrophobicContact CG1-CZ 4.47Å; I117-F150 HydrophobicContact CG2-CE1 4.17Å; I117-F150 HydrophobicContact CG2-CZ 4.04Å; V136-F150 HydrophobicContact CG2-CE1 4.36Å; F147-F150 HydrophobicContact CD2-CB 3.86Å; F147-F150 HydrophobicContact CD2-CD1 4.42Å; F147-F150 HydrophobicContact CD2-CG 4.19Å; F147-F150 HydrophobicContact CE1-CD1 4.22Å; F147-F150 HydrophobicContact CE2-CB 3.71Å; F147-F150 AromaticContact CE2-CD1 3.43Å; F147-F150 HydrophobicContact CE2-CD1 3.43Å; F147-F150 VanDerWaalsContact CE2-CD1 3.43Å; F147-F150 HydrophobicContact CE2-CD2 4.29Å; F147-F150 HydrophobicContact CE2-CE1 4.16Å; F147-F150 AromaticContact CE2-CG 3.54Å; F147-F150 HydrophobicContact CE2-CG 3.54Å; F147-F150 HydrophobicContact CG-CB 4.41Å; F147-F150 HydrophobicContact CZ-CB 4.15Å; F147-F150 AromaticContact CZ-CD1 3.31Å; F147-F150 HydrophobicContact CZ-CD1 3.31Å; F147-F150 AromaticContact CZ-CE1 3.97Å; F147-F150 HydrophobicContact CZ-CE1 3.97Å; F147-F150 AromaticContact CZ-CG 3.9Å; F147-F150 HydrophobicContact CZ-CG 3.9Å; F147-F150 PolarHBondContact O-N 3Å; F150-E152 VanDerWaalsContact C-N 3.31Å; F150-E152 PolarHBondContact O-N 3.13Å; F150-S153 PolarHBondContact O-N 2.77Å; F150-S153 PolarHBondContact O-OG 2.79Å; F150-V154 HydrophobicContact CD1-CG1 4.16Å; F150-V154 HydrophobicContact CE1-CG1 3.79Å; F150-V154 WeakPolarHBondContact O-CG2 3.44Å; F150-V154 PolarHBondContact O-N 3.12Å
151	A	95.4	Very high	94.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.3	-39.7	174.6	0	0	0	0	0	112	F147 R149 L155 I180 T184 L189	F147-A151 HydrophobicContact CD1-CB 3.85Å; F147-A151 HydrophobicContact CE1-CB 4.11Å; F147-A151 VanDerWaalsContact O-CB 3.23Å; F147-A151 WeakPolarHBondContact O-CB 3.36Å; F147-A151 PolarHBondContact O-N 3.01Å; R149-A151 VanDerWaalsContact C-N 3.33Å; A151-L155 VanDerWaalsContact O-CB 3.26Å; A151-L155 WeakPolarHBondContact O-CB 3.42Å; A151-L155 PolarHBondContact O-N 3.21Å; A151-L155 VanDerWaalsContact O-N 3.1Å; A151-I180 HydrophobicContact CB-CG2 3.71Å; A151-T184 HydrophobicContact CB-CG2 4.24Å; A151-L189 HydrophobicContact CB-CD1 4.25Å; A151-L189 HydrophobicContact CB-CD2 4Å
152	E	94.3	Very high	94.3	Very high	43 Å²	43	41.7 Å²	41.7	20%	0.201	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-48.5	176.8	-172.7	175.1	-165.7	0	0	112.2	D148 R149 F150 V154 L155 R188 L189 I192	D148-E152 PolarHBondContact O-N 3.01Å; R149-E152 PolarHBondContact O-N 3.1Å; F150-E152 VanDerWaalsContact C-N 3.31Å; F150-E152 PolarHBondContact O-N 3.13Å; E152-V154 VanDerWaalsContact C-N 3.34Å; E152-V154 PolarHBondContact O-N 2.83Å; E152-L155 WeakPolarHBondContact O-CB 3.18Å; E152-L155 PolarHBondContact O-N 2.88Å; E152-L155 VanDerWaalsContact O-N 3.16Å; E152-R188 IonicContact OE2-CZ 3.7Å; E152-R188 IonicContact OE2-NE 3.81Å; E152-R188 PolarHBondContact OE2-NE 2.78Å; E152-R188 IonicContact OE2-NH2 2.82Å; E152-R188 PolarHBondContact OE2-NH2 2.94Å; E152-L189 HydrophobicContact CB-CD2 4.05Å; E152-I192 HydrophobicContact CG-CD1 3.82Å
153	S	93.7	Very high	94.2	Very high	54 Å²	54	40.7 Å²	40.7	38%	0.378	21%	0.205	S	C	.	.	H	α-helix	trans	-63.8	-35.2	-176.7	56.5	0	0	0	0	113.1	E114 R149 F150	E114-S153 PolarHBondContact OE2-OG 3.36Å; R149-S153 PolarHBondContact O-N 3.39Å; R149-S153 VanDerWaalsContact O-N 3.14Å; F150-S153 PolarHBondContact O-N 2.77Å; F150-S153 PolarHBondContact O-OG 2.79Å
154	V	95.5	Very high	94.2	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-86.9	-11.9	175.2	-55.1	0	0	0	0	114.8	L121 V136 F150 E152 Q156 T157 I158	L121-V154 HydrophobicContact CD1-CB 3.75Å; L121-V154 HydrophobicContact CD1-CG1 3.94Å; L121-V154 HydrophobicContact CD1-CG2 4.48Å; V136-V154 HydrophobicContact CG1-CG2 4.18Å; F150-V154 HydrophobicContact CD1-CG1 4.16Å; F150-V154 HydrophobicContact CE1-CG1 3.79Å; F150-V154 WeakPolarHBondContact O-CG2 3.44Å; F150-V154 PolarHBondContact O-N 3.12Å; E152-V154 VanDerWaalsContact C-N 3.34Å; E152-V154 PolarHBondContact O-N 2.83Å; V154-Q156 PolarHBondContact O-N 3.17Å; V154-T157 WeakPolarHBondContact O-CB 3.37Å; V154-T157 PolarHBondContact O-N 3.13Å; V154-T157 VanDerWaalsContact O-N 3.15Å; V154-I158 HydrophobicContact CB-CD1 4.38Å; V154-I158 HydrophobicContact CG2-CD1 3.77Å; V154-I158 PolarHBondContact O-N 2.99Å; V154-I158 VanDerWaalsContact O-N 3.08Å
155	L	95.4	Very high	94.1	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-45.2	-166.7	-149.4	72.8	0	0	0	112.6	A151 E152 T157 I158 I159 M177 I180 L189 I192 L193	A151-L155 VanDerWaalsContact O-CB 3.26Å; A151-L155 WeakPolarHBondContact O-CB 3.42Å; A151-L155 PolarHBondContact O-N 3.21Å; A151-L155 VanDerWaalsContact O-N 3.1Å; E152-L155 WeakPolarHBondContact O-CB 3.18Å; E152-L155 PolarHBondContact O-N 2.88Å; E152-L155 VanDerWaalsContact O-N 3.16Å; L155-T157 VanDerWaalsContact C-N 3.26Å; L155-T157 PolarHBondContact O-N 3.37Å; L155-I158 PolarHBondContact O-N 3.4Å; L155-I159 HydrophobicContact CD2-CD1 4.37Å; L155-I159 HydrophobicContact CG-CD1 4.2Å; L155-I159 VanDerWaalsContact O-CG1 3.27Å; L155-I159 WeakPolarHBondContact O-CG1 3.47Å; L155-I159 PolarHBondContact O-N 3.37Å; L155-M177 HydrophobicContact CD1-CE 3.71Å; L155-M177 HydrophobicContact CD1-SD 3.72Å; L155-M177 HydrophobicContact CG-CE 3.97Å; L155-M177 HydrophobicContact CG-SD 4.45Å; L155-I180 HydrophobicContact CD1-CD1 4.5Å; L155-I180 HydrophobicContact CD1-CG2 4.3Å; L155-L189 HydrophobicContact CD1-CD2 4.21Å; L155-L189 HydrophobicContact CD2-CB 3.87Å; L155-L189 HydrophobicContact CD2-CD2 3.98Å; L155-L189 HydrophobicContact CD2-CG 4.43Å; L155-I192 HydrophobicContact CB-CG2 4.44Å; L155-I192 HydrophobicContact CD2-CB 3.93Å; L155-I192 HydrophobicContact CD2-CD1 4.38Å; L155-I192 HydrophobicContact CD2-CG2 3.97Å; L155-L193 HydrophobicContact CD2-CD2 4.21Å; L155-L193 HydrophobicContact CD2-CG 3.98Å
156	Q	94.5	Very high	94.1	Very high	104 Å²	104	39.2 Å²	39.2	49%	0.486	22%	0.221	S	C	.	.	H	α-helix	trans	-65	-32.3	-177.5	-172.5	55.4	71.4	0	0	112.2	V154 A160	V154-Q156 PolarHBondContact O-N 3.17Å; Q156-A160 PolarHBondContact O-N 3.12Å
157	T	96.4	Very high	94.2	Very high	7 Å²	7	36.8 Å²	36.8	4%	0.043	22%	0.215	C	C	.	.	H	α-helix	trans	-70.1	-45.8	173.9	-62.2	0	0	0	0	111.1	D118 L121 R122 V154 L155 I159 A160 L161	D118-T157 VanDerWaalsContact OD1-CB 3.24Å; D118-T157 WeakPolarHBondContact OD1-CB 3.12Å; D118-T157 PolarHBondContact OD1-OG1 3.12Å; L121-T157 HydrophobicContact CB-CG2 3.56Å; L121-T157 HydrophobicContact CD1-CG2 4.46Å; R122-T157 HydrophobicContact CG-CG2 3.52Å; R122-T157 PolarHBondContact NE-OG1 3.35Å; R122-T157 PolarHBondContact NH2-OG1 2.87Å; V154-T157 WeakPolarHBondContact O-CB 3.37Å; V154-T157 PolarHBondContact O-N 3.13Å; V154-T157 VanDerWaalsContact O-N 3.15Å; L155-T157 VanDerWaalsContact C-N 3.26Å; L155-T157 PolarHBondContact O-N 3.37Å; T157-I159 VanDerWaalsContact C-N 3.3Å; T157-I159 PolarHBondContact O-N 3.2Å; T157-A160 WeakPolarHBondContact O-CB 3.4Å; T157-A160 PolarHBondContact O-N 3.05Å; T157-A160 VanDerWaalsContact O-N 3.12Å; T157-L161 PolarHBondContact O-N 3.37Å
158	I	97.2	Very high	94	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-65	-36.3	177.9	-59.3	174.3	0	0	0	111	L121 V136 V154 L155 A160 L161 L162 G173 M177 I180	L121-I158 HydrophobicContact CD1-CD1 4.34Å; L121-I158 HydrophobicContact CD1-CG1 4.03Å; L121-I158 HydrophobicContact CD2-CG1 4.45Å; V136-I158 HydrophobicContact CG1-CD1 4Å; V154-I158 HydrophobicContact CB-CD1 4.38Å; V154-I158 HydrophobicContact CG2-CD1 3.77Å; V154-I158 PolarHBondContact O-N 2.99Å; V154-I158 VanDerWaalsContact O-N 3.08Å; L155-I158 PolarHBondContact O-N 3.4Å; I158-A160 VanDerWaalsContact C-N 3.28Å; I158-A160 PolarHBondContact O-N 3.13Å; I158-L161 WeakPolarHBondContact O-CB 3.48Å; I158-L161 PolarHBondContact O-N 2.96Å; I158-L161 VanDerWaalsContact O-N 3.09Å; I158-L162 PolarHBondContact O-N 3.03Å; I158-G173 WeakPolarHBondContact CG2-O 3.36Å; I158-M177 HydrophobicContact CB-CE 3.98Å; I158-M177 HydrophobicContact CG2-CB 4.2Å; I158-M177 HydrophobicContact CG2-CE 3.78Å; I158-I180 HydrophobicContact CD1-CD1 3.6Å
159	I	96.8	Very high	94.1	Very high	6 Å²	6	37 Å²	37	3%	0.031	22%	0.218	C	C	.	.	H	α-helix	trans	-60.2	-36.7	173.6	-71.8	165.6	0	0	0	111.8	L155 T157 L161 L162 M177 I192 L193 T204	L155-I159 HydrophobicContact CD2-CD1 4.37Å; L155-I159 HydrophobicContact CG-CD1 4.2Å; L155-I159 VanDerWaalsContact O-CG1 3.27Å; L155-I159 WeakPolarHBondContact O-CG1 3.47Å; L155-I159 PolarHBondContact O-N 3.37Å; T157-I159 VanDerWaalsContact C-N 3.3Å; T157-I159 PolarHBondContact O-N 3.2Å; I159-L161 VanDerWaalsContact C-N 3.33Å; I159-L162 HydrophobicContact CG1-CD1 4.45Å; I159-L162 WeakPolarHBondContact O-CB 3.36Å; I159-L162 WeakPolarHBondContact O-CG 3.35Å; I159-L162 PolarHBondContact O-N 3.17Å; I159-M177 HydrophobicContact CD1-CE 4.46Å; I159-M177 HydrophobicContact CG1-CE 3.73Å; I159-I192 HydrophobicContact CD1-CG2 3.75Å; I159-L193 HydrophobicContact CD1-CD2 4.24Å; I159-T204 HydrophobicContact CG2-CG2 4.07Å
160	A	95.2	Very high	94.2	Very high	61 Å²	61	34.7 Å²	34.7	50%	0.504	21%	0.212	S	C	.	.	H	α-helix	trans	-67.5	-32.7	174.9	0	0	0	0	0	112.6	Q156 T157 I158 L162	Q156-A160 PolarHBondContact O-N 3.12Å; T157-A160 WeakPolarHBondContact O-CB 3.4Å; T157-A160 PolarHBondContact O-N 3.05Å; T157-A160 VanDerWaalsContact O-N 3.12Å; I158-A160 VanDerWaalsContact C-N 3.28Å; I158-A160 PolarHBondContact O-N 3.13Å; A160-L162 VanDerWaalsContact C-N 3.32Å; A160-L162 PolarHBondContact O-N 3.16Å
161	L	96.2	Very high	94.2	Very high	10 Å²	10	35.8 Å²	35.8	5%	0.052	22%	0.219	C	C	.	.	H	α-helix	trans	-65	-32.3	176	-62.4	178.9	0	0	0	112.8	L121 V129 T157 I158 I159 S163 N164 A170	L121-L161 HydrophobicContact CD2-CD1 4.49Å; V129-L161 HydrophobicContact CG1-CD1 3.61Å; V129-L161 HydrophobicContact CG1-CD2 3.84Å; V129-L161 HydrophobicContact CG1-CG 4.39Å; T157-L161 PolarHBondContact O-N 3.37Å; I158-L161 WeakPolarHBondContact O-CB 3.48Å; I158-L161 PolarHBondContact O-N 2.96Å; I158-L161 VanDerWaalsContact O-N 3.09Å; I159-L161 VanDerWaalsContact C-N 3.33Å; L161-S163 PolarHBondContact O-N 3.44Å; L161-N164 WeakPolarHBondContact O-CB 3.5Å; L161-N164 PolarHBondContact O-N 2.92Å; L161-A170 VanDerWaalsContact O-CA 3.25Å; L161-A170 WeakPolarHBondContact O-CA 3.14Å; L161-A170 WeakPolarHBondContact O-CB 3.31Å
162	L	95.6	Very high	94.2	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-28.8	-177.3	-56.2	176.3	0	0	0	113.6	I158 I159 A160 V174 V203 T204 C207 I208 F211	I158-L162 PolarHBondContact O-N 3.03Å; I159-L162 HydrophobicContact CG1-CD1 4.45Å; I159-L162 WeakPolarHBondContact O-CB 3.36Å; I159-L162 WeakPolarHBondContact O-CG 3.35Å; I159-L162 PolarHBondContact O-N 3.17Å; A160-L162 VanDerWaalsContact C-N 3.32Å; A160-L162 PolarHBondContact O-N 3.16Å; L162-V174 HydrophobicContact CD2-CB 4.3Å; L162-V174 HydrophobicContact CD2-CG2 3.63Å; L162-V203 WeakPolarHBondContact O-CG1 3.45Å; L162-T204 HydrophobicContact CD1-CG2 4.47Å; L162-C207 HydrophobicContact CD1-CB 4.2Å; L162-I208 HydrophobicContact CD1-CD1 4.46Å; L162-F211 HydrophobicContact CD1-CE2 3.99Å; L162-F211 HydrophobicContact CD2-CE2 4.24Å; L162-F211 HydrophobicContact CD2-CZ 4.14Å
163	S	92.8	Very high	94.3	Very high	56 Å²	56	33.7 Å²	33.7	39%	0.392	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	20	178.9	53	0	0	0	0	114.4	L161 S201 T204	L161-S163 PolarHBondContact O-N 3.44Å; S163-S201 WeakPolarHBondContact CB-OG 3.48Å; S163-T204 WeakPolarHBondContact CB-OG1 3.47Å; S163-T204 PolarHBondContact OG-OG1 3.22Å
164	N	92.8	Very high	94.4	Very high	53 Å²	53	32.3 Å²	32.3	28%	0.283	20%	0.199	S	C	.	.			trans	-71.5	138.8	177.2	-168.2	-46.1	0	0	0	111.1	L161 A166 M169 A170	L161-N164 WeakPolarHBondContact O-CB 3.5Å; L161-N164 PolarHBondContact O-N 2.92Å; N164-A166 VanDerWaalsContact C-N 3.27Å; N164-A166 PolarHBondContact O-N 3.31Å; N164-A166 WeakPolarHBondContact OD1-CB 3.22Å; N164-A166 PolarHBondContact OD1-N 3.39Å; N164-M169 HydrophobicContact CB-CB 4.35Å; N164-M169 PolarHBondContact ND2-SD 3.38Å; N164-A170 HydrophobicContact CB-CB 4.44Å
165	S	90.4	Very high	94.4	Very high	127 Å²	127	32.7 Å²	32.7	89%	0.888	20%	0.201	S	C	*	.	S	Bend	trans	-67.2	-23.7	177.9	48.2	0	0	0	0	113.9	K167	S165-K167 PolarHBondContact O-N 2.96Å
166	A	92	Very high	94.4	Very high	38 Å²	38	32.7 Å²	32.7	31%	0.314	20%	0.201	S	C	.	.	S	Bend	trans	-78.3	100.8	173.3	0	0	0	0	0	110	N164 V168 M169 A170	N164-A166 VanDerWaalsContact C-N 3.27Å; N164-A166 PolarHBondContact O-N 3.31Å; N164-A166 WeakPolarHBondContact OD1-CB 3.22Å; N164-A166 PolarHBondContact OD1-N 3.39Å; A166-V168 PolarHBondContact O-N 3.21Å; A166-M169 HydrophobicContact CB-CB 4.26Å; A166-M169 HydrophobicContact CB-CG 4.01Å; A166-M169 HydrophobicContact CB-SD 3.85Å; A166-M169 WeakPolarHBondContact O-CA 3.39Å; A166-M169 WeakPolarHBondContact O-CB 3.39Å; A166-M169 PolarHBondContact O-N 2.97Å; A166-A170 PolarHBondContact O-N 3.48Å; A166-A170 VanDerWaalsContact O-N 3.09Å
167	K	91.3	Very high	94.5	Very high	90 Å²	90	27.8 Å²	27.8	39%	0.391	18%	0.178	S	C	.	.	H	α-helix	trans	-50.9	-34.8	-174.5	-166.4	177.5	-175.4	-174.3	0	114.5	G37 G39 S165 A170 T171	G37-K167 PolarHBondContact O-NZ 3.32Å; G39-K167 CarbonylContact O-C 3.57Å; G39-K167 WeakPolarHBondContact O-CG 3.47Å; S165-K167 PolarHBondContact O-N 2.96Å; K167-A170 PolarHBondContact O-N 2.9Å; K167-T171 HydrophobicContact CG-CG2 4.33Å; K167-T171 WeakPolarHBondContact O-CB 3.36Å; K167-T171 PolarHBondContact O-N 2.83Å; K167-T171 PolarHBondContact O-OG1 3.4Å
168	V	91.4	Very high	94.5	Very high	43 Å²	43	31 Å²	31	26%	0.261	19%	0.189	S	C	.	.	H	α-helix	trans	-63.4	-44.7	175.4	176.2	0	0	0	0	111.6	G39 V41 R130 A166 T171 S172	G39-V168 WeakPolarHBondContact O-CG2 3.49Å; G39-V168 PolarHBondContact O-N 3.38Å; V41-V168 HydrophobicContact CG2-CB 4.45Å; V41-V168 HydrophobicContact CG2-CG1 3.9Å; R130-V168 HydrophobicContact CB-CG1 4.25Å; A166-V168 PolarHBondContact O-N 3.21Å; V168-T171 PolarHBondContact O-OG1 3.16Å; V168-S172 VanDerWaalsContact O-CB 3.23Å; V168-S172 WeakPolarHBondContact O-CB 3.44Å; V168-S172 PolarHBondContact O-N 3.03Å; V168-S172 PolarHBondContact O-OG 3.12Å
169	M	93.1	Very high	94.4	Very high	10 Å²	10	31 Å²	31	5%	0.049	19%	0.19	C	C	.	.	H	α-helix	trans	-65.8	-47.2	176.4	-65.9	177.9	165.8	0	0	110.9	D123 L124 V129 N164 A166 S172 G173	D123-M169 WeakPolarHBondContact O-CE 3.34Å; L124-M169 VanDerWaalsContact O-CE 3.28Å; L124-M169 WeakPolarHBondContact O-CE 3.45Å; V129-M169 HydrophobicContact CB-CE 4.24Å; V129-M169 HydrophobicContact CB-CG 4.07Å; V129-M169 HydrophobicContact CG1-CB 4.18Å; V129-M169 HydrophobicContact CG1-CG 3.97Å; V129-M169 HydrophobicContact CG2-CE 3.78Å; V129-M169 HydrophobicContact CG2-SD 4.47Å; N164-M169 HydrophobicContact CB-CB 4.35Å; N164-M169 PolarHBondContact ND2-SD 3.38Å; A166-M169 HydrophobicContact CB-CB 4.26Å; A166-M169 HydrophobicContact CB-CG 4.01Å; A166-M169 HydrophobicContact CB-SD 3.85Å; A166-M169 WeakPolarHBondContact O-CA 3.39Å; A166-M169 WeakPolarHBondContact O-CB 3.39Å; A166-M169 PolarHBondContact O-N 2.97Å; M169-S172 PolarHBondContact O-N 3.35Å; M169-G173 PolarHBondContact O-N 2.86Å
170	A	94.1	Very high	94.4	Very high	15 Å²	15	30.7 Å²	30.7	12%	0.124	19%	0.188	C	C	.	.	H	α-helix	trans	-63.8	-46.3	-178	0	0	0	0	0	113	L161 N164 A166 K167 S172 G173 V174	L161-A170 VanDerWaalsContact O-CA 3.25Å; L161-A170 WeakPolarHBondContact O-CA 3.14Å; L161-A170 WeakPolarHBondContact O-CB 3.31Å; N164-A170 HydrophobicContact CB-CB 4.44Å; A166-A170 PolarHBondContact O-N 3.48Å; A166-A170 VanDerWaalsContact O-N 3.09Å; K167-A170 PolarHBondContact O-N 2.9Å; A170-S172 PolarHBondContact O-N 3.33Å; A170-G173 PolarHBondContact O-N 3.35Å; A170-V174 WeakPolarHBondContact O-CG2 3.41Å; A170-V174 PolarHBondContact O-N 3.12Å
171	T	94	Very high	94.4	Very high	32 Å²	32	27.8 Å²	27.8	20%	0.196	16%	0.164	C	C	.	.	H	α-helix	trans	-66.9	-35.8	176.3	49.5	0	0	0	0	112.2	A40 V41 K167 V168 V174 V175	A40-T171 HydrophobicContact CB-CG2 4.37Å; V41-T171 PolarHBondContact N-OG1 2.71Å; K167-T171 HydrophobicContact CG-CG2 4.33Å; K167-T171 WeakPolarHBondContact O-CB 3.36Å; K167-T171 PolarHBondContact O-N 2.83Å; K167-T171 PolarHBondContact O-OG1 3.4Å; V168-T171 PolarHBondContact O-OG1 3.16Å; T171-V174 PolarHBondContact O-N 2.86Å; T171-V175 WeakPolarHBondContact O-CG2 3.43Å; T171-V175 PolarHBondContact O-N 2.89Å
172	S	95.2	Very high	94.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.9	-39.9	173.8	-56.8	0	0	0	0	112.2	V168 M169 A170 A176	V168-S172 VanDerWaalsContact O-CB 3.23Å; V168-S172 WeakPolarHBondContact O-CB 3.44Å; V168-S172 PolarHBondContact O-N 3.03Å; V168-S172 PolarHBondContact O-OG 3.12Å; M169-S172 PolarHBondContact O-N 3.35Å; A170-S172 PolarHBondContact O-N 3.33Å; S172-A176 VanDerWaalsContact O-CB 3.31Å; S172-A176 WeakPolarHBondContact O-CB 3.4Å; S172-A176 PolarHBondContact O-N 2.74Å
173	G	96.6	Very high	94.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.1	-42	174.7	0	0	0	0	0	113.1	I158 M169 A170 M177	I158-G173 WeakPolarHBondContact CG2-O 3.36Å; M169-G173 PolarHBondContact O-N 2.86Å; A170-G173 PolarHBondContact O-N 3.35Å; G173-M177 WeakPolarHBondContact O-CB 3.39Å; G173-M177 PolarHBondContact O-N 3.26Å
174	V	95.4	Very high	94.4	Very high	24 Å²	24	28 Å²	28	15%	0.145	16%	0.159	C	C	.	.	H	α-helix	trans	-59.4	-50.9	173.8	169.6	0	0	0	0	110.6	L162 A170 T171 M177 R178 F211	L162-V174 HydrophobicContact CD2-CB 4.3Å; L162-V174 HydrophobicContact CD2-CG2 3.63Å; A170-V174 WeakPolarHBondContact O-CG2 3.41Å; A170-V174 PolarHBondContact O-N 3.12Å; T171-V174 PolarHBondContact O-N 2.86Å; V174-M177 PolarHBondContact O-N 2.96Å; V174-R178 WeakPolarHBondContact O-CG 3.26Å; V174-R178 PolarHBondContact O-N 3.5Å; V174-F211 HydrophobicContact CG1-CE1 4.36Å; V174-F211 HydrophobicContact CG1-CZ 4.35Å
175	V	95.8	Very high	94.4	Very high	9 Å²	9	26.5 Å²	26.5	6%	0.055	15%	0.153	C	C	.	.	H	α-helix	trans	-64.3	-45.6	-179.5	177.2	0	0	0	0	111.1	E43 F46 T171 M177 R178 F179	E43-V175 HydrophobicContact CG-CG1 3.9Å; E43-V175 HydrophobicContact CG-CG2 4.37Å; F46-V175 HydrophobicContact CB-CG1 4.25Å; F46-V175 HydrophobicContact CD1-CB 4.32Å; F46-V175 HydrophobicContact CD1-CG1 3.35Å; F46-V175 HydrophobicContact CD2-CB 4.35Å; F46-V175 HydrophobicContact CD2-CG1 4.17Å; F46-V175 HydrophobicContact CE1-CB 4.28Å; F46-V175 HydrophobicContact CE1-CG1 3.51Å; F46-V175 HydrophobicContact CE2-CB 4.31Å; F46-V175 HydrophobicContact CE2-CG1 4.32Å; F46-V175 HydrophobicContact CG-CB 4.35Å; F46-V175 HydrophobicContact CG-CG1 3.7Å; F46-V175 HydrophobicContact CZ-CB 4.27Å; F46-V175 HydrophobicContact CZ-CG1 4.01Å; T171-V175 WeakPolarHBondContact O-CG2 3.43Å; T171-V175 PolarHBondContact O-N 2.89Å; V175-M177 VanDerWaalsContact C-N 3.3Å; V175-M177 PolarHBondContact O-N 3.39Å; V175-R178 WeakPolarHBondContact O-CB 3.47Å; V175-R178 PolarHBondContact O-N 2.92Å; V175-R178 VanDerWaalsContact O-N 3.08Å; V175-F179 HydrophobicContact CG1-CD2 3.9Å; V175-F179 HydrophobicContact CG1-CE2 3.79Å; V175-F179 WeakPolarHBondContact O-CD2 3.47Å; V175-F179 PolarHBondContact O-N 3.45Å; V175-F179 VanDerWaalsContact O-N 3.12Å
176	A	96.8	Very high	94.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.7	-40.4	176.8	0	0	0	0	0	112.7	F46 C133 A137 S172 F179 I180	F46-A176 HydrophobicContact CZ-CB 4.33Å; C133-A176 HydrophobicContact CB-CB 3.94Å; A137-A176 HydrophobicContact CB-CB 4.38Å; S172-A176 VanDerWaalsContact O-CB 3.31Å; S172-A176 WeakPolarHBondContact O-CB 3.4Å; S172-A176 PolarHBondContact O-N 2.74Å; A176-F179 PolarHBondContact O-N 2.68Å; A176-I180 WeakPolarHBondContact O-CG1 3.32Å; A176-I180 PolarHBondContact O-N 3.47Å; A176-I180 VanDerWaalsContact O-N 3.1Å
177	M	96.3	Very high	94.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.2	-40.4	174.5	-172.5	61.3	71.3	0	0	112.2	L155 I158 I159 G173 V174 V175 F179 I180 L181 L193 F211	L155-M177 HydrophobicContact CD1-CE 3.71Å; L155-M177 HydrophobicContact CD1-SD 3.72Å; L155-M177 HydrophobicContact CG-CE 3.97Å; L155-M177 HydrophobicContact CG-SD 4.45Å; I158-M177 HydrophobicContact CB-CE 3.98Å; I158-M177 HydrophobicContact CG2-CB 4.2Å; I158-M177 HydrophobicContact CG2-CE 3.78Å; I159-M177 HydrophobicContact CD1-CE 4.46Å; I159-M177 HydrophobicContact CG1-CE 3.73Å; G173-M177 WeakPolarHBondContact O-CB 3.39Å; G173-M177 PolarHBondContact O-N 3.26Å; V174-M177 PolarHBondContact O-N 2.96Å; V175-M177 VanDerWaalsContact C-N 3.3Å; V175-M177 PolarHBondContact O-N 3.39Å; M177-F179 VanDerWaalsContact C-N 3.31Å; M177-F179 PolarHBondContact O-N 3.42Å; M177-I180 PolarHBondContact O-N 2.86Å; M177-L181 HydrophobicContact CG-CD1 3.96Å; M177-L181 HydrophobicContact CG-CG 4.42Å; M177-L181 VanDerWaalsContact O-CG 3.3Å; M177-L181 WeakPolarHBondContact O-CG 3.28Å; M177-L181 PolarHBondContact O-N 3.26Å; M177-L181 VanDerWaalsContact O-N 3.11Å; M177-L181 HydrophobicContact SD-CD1 4.09Å; M177-L181 HydrophobicContact SD-CG 4.16Å; M177-L193 HydrophobicContact CE-CD2 4.36Å; M177-L193 HydrophobicContact SD-CD2 3.98Å; M177-F211 HydrophobicContact CB-CE1 4.31Å; M177-F211 HydrophobicContact CB-CE2 3.96Å; M177-F211 HydrophobicContact CB-CZ 3.73Å; M177-F211 HydrophobicContact CG-CD2 3.72Å; M177-F211 HydrophobicContact CG-CE1 4.21Å; M177-F211 HydrophobicContact CG-CE2 3.36Å; M177-F211 HydrophobicContact CG-CG 4.33Å; M177-F211 HydrophobicContact CG-CZ 3.63Å
178	R	95.3	Very high	94.6	Very high	74 Å²	74	22.6 Å²	22.6	28%	0.279	12%	0.118	S	C	.	.	H	α-helix	trans	-55.5	-47.7	172.7	-64.3	-170.1	173.6	170.2	-4.1	111	E43 V174 V175 I180 L181 E182 E210 F211 I214	E43-R178 IonicContact OE2-CZ 3.01Å; E43-R178 IonicContact OE2-NH1 2.75Å; E43-R178 PolarHBondContact OE2-NH1 3.16Å; V174-R178 WeakPolarHBondContact O-CG 3.26Å; V174-R178 PolarHBondContact O-N 3.5Å; V175-R178 WeakPolarHBondContact O-CB 3.47Å; V175-R178 PolarHBondContact O-N 2.92Å; V175-R178 VanDerWaalsContact O-N 3.08Å; R178-I180 PolarHBondContact O-N 3.29Å; R178-L181 PolarHBondContact O-N 3.04Å; R178-E182 WeakPolarHBondContact O-CB 3.48Å; R178-E182 WeakPolarHBondContact O-CG 3.45Å; R178-E182 PolarHBondContact O-N 3.48Å; R178-E210 IonicContact CZ-OE1 2.66Å; R178-E210 IonicContact NE-OE1 3.73Å; R178-E210 IonicContact NH2-OE1 2.9Å; R178-E210 PolarHBondContact NH2-OE1 3.24Å; R178-F211 HydrophobicContact CG-CD1 4.41Å; R178-F211 HydrophobicContact CG-CE1 3.94Å; R178-I214 HydrophobicContact CB-CD1 3.81Å; R178-I214 HydrophobicContact CG-CD1 3.61Å
179	F	95.5	Very high	94.7	Very high	1 Å²	1	20.5 Å²	20.5	0%	0.004	11%	0.106	C	C	.	.	H	α-helix	trans	-60.6	-46.2	-179.8	-88.4	-85	0	0	0	113.5	F46 R47 F50 A137 S140 Q141 V175 A176 M177 L181 E182 N183	F46-F179 HydrophobicContact CD1-CE2 4.24Å; F46-F179 HydrophobicContact CE1-CD2 4.31Å; F46-F179 HydrophobicContact CE1-CE2 4.34Å; R47-F179 HydrophobicContact CG-CE2 4.28Å; R47-F179 HydrophobicContact CG-CZ 3.66Å; F50-F179 HydrophobicContact CE1-CZ 4.38Å; F50-F179 HydrophobicContact CE2-CD1 4.08Å; F50-F179 AromaticContact CE2-CE1 3.5Å; F50-F179 HydrophobicContact CE2-CE1 3.5Å; F50-F179 VanDerWaalsContact CE2-CE1 3.5Å; F50-F179 AromaticContact CE2-CZ 3.8Å; F50-F179 HydrophobicContact CE2-CZ 3.8Å; F50-F179 AromaticContact CZ-CD1 3.85Å; F50-F179 HydrophobicContact CZ-CD1 3.85Å; F50-F179 HydrophobicContact CZ-CD2 4.15Å; F50-F179 AromaticContact CZ-CE1 3.44Å; F50-F179 HydrophobicContact CZ-CE1 3.44Å; F50-F179 VanDerWaalsContact CZ-CE1 3.44Å; F50-F179 AromaticContact CZ-CE2 3.78Å; F50-F179 HydrophobicContact CZ-CE2 3.78Å; F50-F179 HydrophobicContact CZ-CG 4.18Å; F50-F179 AromaticContact CZ-CZ 3.4Å; F50-F179 HydrophobicContact CZ-CZ 3.4Å; A137-F179 HydrophobicContact CB-CB 3.78Å; A137-F179 HydrophobicContact CB-CD2 3.97Å; A137-F179 HydrophobicContact CB-CG 3.84Å; S140-F179 PolarHBondContact OG-O 2.96Å; Q141-F179 HydrophobicContact CB-CD1 4.47Å; V175-F179 HydrophobicContact CG1-CD2 3.9Å; V175-F179 HydrophobicContact CG1-CE2 3.79Å; V175-F179 WeakPolarHBondContact O-CD2 3.47Å; V175-F179 PolarHBondContact O-N 3.45Å; V175-F179 VanDerWaalsContact O-N 3.12Å; A176-F179 PolarHBondContact O-N 2.68Å; M177-F179 VanDerWaalsContact C-N 3.31Å; M177-F179 PolarHBondContact O-N 3.42Å; F179-L181 VanDerWaalsContact C-N 3.3Å; F179-L181 PolarHBondContact O-N 3.05Å; F179-E182 PolarHBondContact O-N 2.86Å; F179-N183 WeakPolarHBondContact O-CB 3.48Å; F179-N183 PolarHBondContact O-N 3.42Å; F179-N183 PolarHBondContact O-ND2 2.9Å
180	I	96.7	Very high	94.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-57.7	-45.9	177	-65.5	165.1	0	0	0	110.3	V136 F147 A151 L155 I158 A176 M177 R178 N183 T184 L189	V136-I180 HydrophobicContact CG1-CD1 3.83Å; V136-I180 HydrophobicContact CG1-CG1 4.24Å; F147-I180 HydrophobicContact CE1-CG1 4.46Å; A151-I180 HydrophobicContact CB-CG2 3.71Å; L155-I180 HydrophobicContact CD1-CD1 4.5Å; L155-I180 HydrophobicContact CD1-CG2 4.3Å; I158-I180 HydrophobicContact CD1-CD1 3.6Å; A176-I180 WeakPolarHBondContact O-CG1 3.32Å; A176-I180 PolarHBondContact O-N 3.47Å; A176-I180 VanDerWaalsContact O-N 3.1Å; M177-I180 PolarHBondContact O-N 2.86Å; R178-I180 PolarHBondContact O-N 3.29Å; I180-N183 PolarHBondContact O-N 3.27Å; I180-T184 VanDerWaalsContact O-CB 3.31Å; I180-T184 WeakPolarHBondContact O-CB 3.1Å; I180-T184 PolarHBondContact O-N 3.39Å; I180-L189 HydrophobicContact CG2-CD1 3.77Å
181	L	96.2	Very high	94.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-76.6	-23.8	-177.1	-58.4	178.3	0	0	0	113.7	M177 R178 F179 L189 L193 F211 I214 T218 W219	M177-L181 HydrophobicContact CG-CD1 3.96Å; M177-L181 HydrophobicContact CG-CG 4.42Å; M177-L181 VanDerWaalsContact O-CG 3.3Å; M177-L181 WeakPolarHBondContact O-CG 3.28Å; M177-L181 PolarHBondContact O-N 3.26Å; M177-L181 VanDerWaalsContact O-N 3.11Å; M177-L181 HydrophobicContact SD-CD1 4.09Å; M177-L181 HydrophobicContact SD-CG 4.16Å; R178-L181 PolarHBondContact O-N 3.04Å; F179-L181 VanDerWaalsContact C-N 3.3Å; F179-L181 PolarHBondContact O-N 3.05Å; L181-L189 HydrophobicContact CD2-CD1 4.13Å; L181-L193 HydrophobicContact CD1-CD1 4.31Å; L181-L193 HydrophobicContact CD2-CD1 3.65Å; L181-F211 HydrophobicContact CD1-CB 3.64Å; L181-F211 HydrophobicContact CD1-CD1 4.45Å; L181-F211 HydrophobicContact CD1-CD2 4.23Å; L181-F211 HydrophobicContact CD1-CG 3.87Å; L181-I214 HydrophobicContact CB-CG2 4.08Å; L181-T218 PolarHBondContact O-OG1 3.1Å; L181-W219 HydrophobicContact CD2-CZ2 4.01Å; L181-W219 PolarHBondContact O-NE1 2.97Å
182	E	94.9	Very high	94.7	Very high	48 Å²	48	23.3 Å²	23.3	22%	0.224	12%	0.122	C	C	.	.	H	α-helix	trans	-77.9	-29.3	171.7	-75.2	-162.8	143	0	0	113.4	R47 R178 F179 I214 R217 T218	R47-E182 IonicContact NH2-OE2 2.71Å; R178-E182 WeakPolarHBondContact O-CB 3.48Å; R178-E182 WeakPolarHBondContact O-CG 3.45Å; R178-E182 PolarHBondContact O-N 3.48Å; F179-E182 PolarHBondContact O-N 2.86Å; E182-I214 HydrophobicContact CG-CG2 3.56Å; E182-R217 IonicContact OE1-CZ 3.55Å; E182-R217 VanDerWaalsContact OE1-CZ 3.23Å; E182-R217 IonicContact OE1-NH1 3.58Å; E182-R217 PolarHBondContact OE1-NH1 3.29Å; E182-R217 IonicContact OE1-NH2 2.77Å; E182-R217 PolarHBondContact OE1-NH2 3.31Å; E182-T218 HydrophobicContact CG-CG2 4.21Å
183	N	94.5	Very high	94.7	Very high	19 Å²	19	23.4 Å²	23.4	10%	0.102	12%	0.122	C	C	.	.	H	α-helix	trans	-114.8	-27.4	-167.3	-65	-79.3	0	0	0	115.7	S140 R144 F179 I180	S140-N183 WeakPolarHBondContact O-CB 3.23Å; R144-N183 CarbonylContact C-O 3.46Å; R144-N183 VanDerWaalsContact CA-O 3.32Å; R144-N183 WeakPolarHBondContact CA-O 3.43Å; R144-N183 VanDerWaalsContact CZ-OD1 3.28Å; R144-N183 PolarHBondContact NH1-OD1 3.18Å; F179-N183 WeakPolarHBondContact O-CB 3.48Å; F179-N183 PolarHBondContact O-N 3.42Å; F179-N183 PolarHBondContact O-ND2 2.9Å; I180-N183 PolarHBondContact O-N 3.27Å
184	T	94.2	Very high	94.7	Very high	4 Å²	4	23.7 Å²	23.7	3%	0.025	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-31.4	-172.7	-57.3	0	0	0	0	113.6	R144 F147 D148 A151 I180 S186	R144-T184 WeakPolarHBondContact O-CA 3.4Å; R144-T184 PolarHBondContact O-OG1 2.96Å; R144-T184 VanDerWaalsContact O-OG1 3.14Å; F147-T184 HydrophobicContact CB-CG2 4.16Å; D148-T184 VanDerWaalsContact CA-CG2 3.49Å; D148-T184 HydrophobicContact CB-CG2 4.17Å; A151-T184 HydrophobicContact CB-CG2 4.24Å; I180-T184 VanDerWaalsContact O-CB 3.31Å; I180-T184 WeakPolarHBondContact O-CB 3.1Å; I180-T184 PolarHBondContact O-N 3.39Å; T184-S186 PolarHBondContact O-N 3.48Å
185	C	92.8	Very high	94.6	Very high	23 Å²	23	25.6 Å²	25.6	16%	0.155	14%	0.138	C	C	.	.			trans	50.1	30.5	168.9	-60.5	0	0	0	0	116.8	W219 I223	C185-W219 HydrophobicContact CB-CD2 4.42Å; C185-W219 HydrophobicContact CB-CG 4.3Å; C185-I223 VanDerWaalsContact O-CD1 3.32Å; C185-I223 WeakPolarHBondContact O-CD1 3.44Å
186	S	92.2	Very high	94.5	Very high	16 Å²	16	25.7 Å²	25.7	11%	0.112	14%	0.139	C	C	.	.			trans	-91.6	130.8	-176	-179.8	0	0	0	0	113.2	T184 R188 L189 W219	T184-S186 PolarHBondContact O-N 3.48Å; S186-R188 PolarHBondContact O-N 3.5Å; S186-R188 VanDerWaalsContact O-N 3.16Å; S186-R188 PolarHBondContact OG-N 2.97Å; S186-L189 WeakPolarHBondContact O-CG 3.3Å; S186-L189 PolarHBondContact O-N 3.24Å; S186-L189 VanDerWaalsContact O-N 3.16Å; S186-W219 WeakPolarHBondContact O-CH2 3.34Å
187	S	92.6	Very high	94.4	Very high	51 Å²	51	26.2 Å²	26.2	36%	0.357	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-59.7	-24	175.7	50	0	0	0	0	114	L189 L190 P191	S187-L189 PolarHBondContact O-N 3.44Å; S187-L189 VanDerWaalsContact O-N 3.13Å; S187-L190 WeakPolarHBondContact O-CB 3.39Å; S187-L190 PolarHBondContact O-N 2.82Å; S187-P191 WeakPolarHBondContact O-CD 3.33Å
188	R	92.8	Very high	94.2	Very high	105 Å²	105	30.2 Å²	30.2	40%	0.396	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-56.3	-27.4	176.3	-60.9	170.1	66.8	152.1	11	112.6	D148 E152 S186 P191	D148-R188 VanDerWaalsContact OD2-CD 3.26Å; D148-R188 WeakPolarHBondContact OD2-CD 3.35Å; D148-R188 IonicContact OD2-CZ 3.77Å; D148-R188 IonicContact OD2-NE 3.34Å; D148-R188 IonicContact OD2-NH1 3.23Å; D148-R188 PolarHBondContact OD2-NH1 2.64Å; E152-R188 IonicContact OE2-CZ 3.7Å; E152-R188 IonicContact OE2-NE 3.81Å; E152-R188 PolarHBondContact OE2-NE 2.78Å; E152-R188 IonicContact OE2-NH2 2.82Å; E152-R188 PolarHBondContact OE2-NH2 2.94Å; S186-R188 PolarHBondContact O-N 3.5Å; S186-R188 VanDerWaalsContact O-N 3.16Å; S186-R188 PolarHBondContact OG-N 2.97Å; R188-P191 WeakPolarHBondContact O-CD 3.2Å
189	L	94.9	Very high	94.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-78.4	-23.6	-179.5	-49.4	-178	0	0	0	112.9	A151 E152 L155 I180 L181 S186 S187 I192 L193	A151-L189 HydrophobicContact CB-CD1 4.25Å; A151-L189 HydrophobicContact CB-CD2 4Å; E152-L189 HydrophobicContact CB-CD2 4.05Å; L155-L189 HydrophobicContact CD1-CD2 4.21Å; L155-L189 HydrophobicContact CD2-CB 3.87Å; L155-L189 HydrophobicContact CD2-CD2 3.98Å; L155-L189 HydrophobicContact CD2-CG 4.43Å; I180-L189 HydrophobicContact CG2-CD1 3.77Å; L181-L189 HydrophobicContact CD2-CD1 4.13Å; S186-L189 WeakPolarHBondContact O-CG 3.3Å; S186-L189 PolarHBondContact O-N 3.24Å; S186-L189 VanDerWaalsContact O-N 3.16Å; S187-L189 PolarHBondContact O-N 3.44Å; S187-L189 VanDerWaalsContact O-N 3.13Å; L189-I192 PolarHBondContact O-N 3.19Å; L189-L193 HydrophobicContact CB-CD1 4.03Å; L189-L193 WeakPolarHBondContact O-CD1 3.32Å; L189-L193 VanDerWaalsContact O-CG 3.23Å; L189-L193 WeakPolarHBondContact O-CG 3.02Å; L189-L193 PolarHBondContact O-N 3Å; L189-L193 VanDerWaalsContact O-N 3.09Å
190	L	94.1	Very high	94	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-63.9	-43.9	-172.6	-67.6	176.9	0	0	0	114.3	S187 I192 L193 I194 I215 W219 N227 L231	S187-L190 WeakPolarHBondContact O-CB 3.39Å; S187-L190 PolarHBondContact O-N 2.82Å; L190-I192 VanDerWaalsContact C-N 3.32Å; L190-I192 PolarHBondContact O-N 3.27Å; L190-L193 PolarHBondContact O-N 3.2Å; L190-I194 HydrophobicContact CB-CD1 4.28Å; L190-I194 HydrophobicContact CD2-CD1 4.34Å; L190-I194 WeakPolarHBondContact O-CB 3.48Å; L190-I194 WeakPolarHBondContact O-CG1 3.29Å; L190-I194 PolarHBondContact O-N 3.23Å; L190-I215 HydrophobicContact CD2-CD1 4.01Å; L190-I215 HydrophobicContact CD2-CG2 4.48Å; L190-W219 HydrophobicContact CD1-CH2 4.43Å; L190-W219 HydrophobicContact CD1-CZ3 3.73Å; L190-W219 HydrophobicContact CD2-CH2 3.71Å; L190-W219 HydrophobicContact CD2-CZ3 3.71Å; L190-W219 HydrophobicContact CG-CH2 3.8Å; L190-W219 HydrophobicContact CG-CZ3 3.61Å; L190-N227 HydrophobicContact CD1-CB 3.51Å; L190-L231 HydrophobicContact CD2-CD2 4.23Å
191	P	92.3	Very high	93.9	Very high	80 Å²	80	40 Å²	40	52%	0.519	22%	0.223	S	C	.	.	H	α-helix	trans	-58.9	-40.7	177.5	-25.5	35.6	0	0	0	113	S187 R188 S195	S187-P191 WeakPolarHBondContact O-CD 3.33Å; R188-P191 WeakPolarHBondContact O-CD 3.2Å; P191-S195 WeakPolarHBondContact O-CB 3.49Å; P191-S195 PolarHBondContact O-N 2.89Å; P191-S195 PolarHBondContact O-OG 2.78Å
192	I	94.7	Very high	93.8	Very high	34 Å²	34	43.6 Å²	43.6	17%	0.174	24%	0.242	C	C	.	.	H	α-helix	trans	-71.5	-41.2	-178.4	-55.3	173.4	0	0	0	110.6	E152 L155 I159 L189 L190 S195 S196	E152-I192 HydrophobicContact CG-CD1 3.82Å; L155-I192 HydrophobicContact CB-CG2 4.44Å; L155-I192 HydrophobicContact CD2-CB 3.93Å; L155-I192 HydrophobicContact CD2-CD1 4.38Å; L155-I192 HydrophobicContact CD2-CG2 3.97Å; I159-I192 HydrophobicContact CD1-CG2 3.75Å; L189-I192 PolarHBondContact O-N 3.19Å; L190-I192 VanDerWaalsContact C-N 3.32Å; L190-I192 PolarHBondContact O-N 3.27Å; I192-S195 PolarHBondContact O-OG 2.91Å; I192-S195 VanDerWaalsContact O-OG 3.08Å; I192-S196 WeakPolarHBondContact O-CB 3.34Å; I192-S196 PolarHBondContact O-N 3.06Å; I192-S196 PolarHBondContact O-OG 2.95Å
193	L	95.1	Very high	93.8	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-66.5	-48.3	176	-66.4	162.2	0	0	0	111.7	L155 I159 M177 L181 L189 L190 S196 I208 I215	L155-L193 HydrophobicContact CD2-CD2 4.21Å; L155-L193 HydrophobicContact CD2-CG 3.98Å; I159-L193 HydrophobicContact CD1-CD2 4.24Å; M177-L193 HydrophobicContact CE-CD2 4.36Å; M177-L193 HydrophobicContact SD-CD2 3.98Å; L181-L193 HydrophobicContact CD1-CD1 4.31Å; L181-L193 HydrophobicContact CD2-CD1 3.65Å; L189-L193 HydrophobicContact CB-CD1 4.03Å; L189-L193 WeakPolarHBondContact O-CD1 3.32Å; L189-L193 VanDerWaalsContact O-CG 3.23Å; L189-L193 WeakPolarHBondContact O-CG 3.02Å; L189-L193 PolarHBondContact O-N 3Å; L189-L193 VanDerWaalsContact O-N 3.09Å; L190-L193 PolarHBondContact O-N 3.2Å; L193-S196 WeakPolarHBondContact O-CA 3.17Å; L193-S196 VanDerWaalsContact O-CB 3.27Å; L193-S196 WeakPolarHBondContact O-CB 3.18Å; L193-S196 PolarHBondContact O-N 3.12Å; L193-S196 VanDerWaalsContact O-N 3.09Å; L193-I208 HydrophobicContact CB-CD1 4.49Å; L193-I208 HydrophobicContact CD2-CD1 3.83Å; L193-I208 WeakPolarHBondContact O-CG2 3.47Å; L193-I215 HydrophobicContact CD1-CD1 4.41Å
194	I	94.7	Very high	93.9	Very high	6 Å²	6	43.5 Å²	43.5	3%	0.031	25%	0.245	C	C	.	.	H	α-helix	trans	-78.7	-29.5	-171.8	-62.7	170.7	0	0	0	111.7	L190 S196 L197 V230 L231 A234 R237	L190-I194 HydrophobicContact CB-CD1 4.28Å; L190-I194 HydrophobicContact CD2-CD1 4.34Å; L190-I194 WeakPolarHBondContact O-CB 3.48Å; L190-I194 WeakPolarHBondContact O-CG1 3.29Å; L190-I194 PolarHBondContact O-N 3.23Å; I194-S196 PolarHBondContact O-N 2.77Å; I194-L197 HydrophobicContact CG2-CD1 4.43Å; I194-L197 WeakPolarHBondContact O-CB 3.37Å; I194-L197 PolarHBondContact O-N 2.84Å; I194-V230 HydrophobicContact CB-CG1 4.27Å; I194-V230 HydrophobicContact CD1-CB 4.25Å; I194-V230 HydrophobicContact CD1-CG1 3.67Å; I194-V230 HydrophobicContact CG2-CG1 4.04Å; I194-L231 HydrophobicContact CD1-CD2 4.36Å; I194-A234 HydrophobicContact CD1-CB 4.07Å; I194-A234 HydrophobicContact CG1-CB 4.01Å; I194-A234 HydrophobicContact CG2-CB 3.95Å; I194-R237 PolarHBondContact O-NH1 3.3Å
195	S	93.8	Very high	94	Very high	63 Å²	63	45.2 Å²	45.2	44%	0.441	25%	0.251	S	S	.	.	H	α-helix	trans	-63.8	-29.2	165.1	60.5	0	0	0	0	112.3	P191 I192 L197 S198	P191-S195 WeakPolarHBondContact O-CB 3.49Å; P191-S195 PolarHBondContact O-N 2.89Å; P191-S195 PolarHBondContact O-OG 2.78Å; I192-S195 PolarHBondContact O-OG 2.91Å; I192-S195 VanDerWaalsContact O-OG 3.08Å; S195-L197 PolarHBondContact O-N 3.49Å; S195-S198 WeakPolarHBondContact O-CB 3.48Å; S195-S198 PolarHBondContact O-N 2.72Å; S195-S198 PolarHBondContact O-OG 3.09Å
196	S	94.2	Very high	94.1	Very high	12 Å²	12	46.1 Å²	46.1	8%	0.084	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-70.7	-12.6	176.2	-62.2	0	0	0	0	114.6	I192 L193 I194 S198 S199	I192-S196 WeakPolarHBondContact O-CB 3.34Å; I192-S196 PolarHBondContact O-N 3.06Å; I192-S196 PolarHBondContact O-OG 2.95Å; L193-S196 WeakPolarHBondContact O-CA 3.17Å; L193-S196 VanDerWaalsContact O-CB 3.27Å; L193-S196 WeakPolarHBondContact O-CB 3.18Å; L193-S196 PolarHBondContact O-N 3.12Å; L193-S196 VanDerWaalsContact O-N 3.09Å; I194-S196 PolarHBondContact O-N 2.77Å; S196-S198 PolarHBondContact O-N 3.27Å; S196-S198 VanDerWaalsContact O-N 3.12Å; S196-S199 VanDerWaalsContact O-CB 3.24Å; S196-S199 WeakPolarHBondContact O-CB 3.41Å; S196-S199 PolarHBondContact O-N 3.23Å
197	L	94.5	Very high	94.3	Very high	11 Å²	11	45.8 Å²	45.8	6%	0.058	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-65.8	-1.8	162.3	-68.2	173.6	0	0	0	113.2	I194 S195 R205 I208 A234 R237	I194-L197 HydrophobicContact CG2-CD1 4.43Å; I194-L197 WeakPolarHBondContact O-CB 3.37Å; I194-L197 PolarHBondContact O-N 2.84Å; S195-L197 PolarHBondContact O-N 3.49Å; L197-R205 HydrophobicContact CD2-CB 4.49Å; L197-R205 WeakPolarHBondContact O-CD 3.39Å; L197-I208 HydrophobicContact CD1-CG2 4.36Å; L197-I208 HydrophobicContact CD2-CB 3.77Å; L197-I208 HydrophobicContact CD2-CG2 3.64Å; L197-I208 HydrophobicContact CG-CB 4.29Å; L197-I208 HydrophobicContact CG-CG2 3.69Å; L197-A234 HydrophobicContact CD1-CB 3.75Å; L197-R237 PolarHBondContact O-NH2 3.38Å
198	S	93	Very high	94.4	Very high	83 Å²	83	43.5 Å²	43.5	58%	0.58	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-94.4	-1.7	172	-32.5	0	0	0	0	112.3	S195 S196 R237	S195-S198 WeakPolarHBondContact O-CB 3.48Å; S195-S198 PolarHBondContact O-N 2.72Å; S195-S198 PolarHBondContact O-OG 3.09Å; S196-S198 PolarHBondContact O-N 3.27Å; S196-S198 VanDerWaalsContact O-N 3.12Å; S198-R237 PolarHBondContact OG-NH2 3.44Å
199	S	93.5	Very high	94.6	Very high	38 Å²	38	38.5 Å²	38.5	27%	0.266	22%	0.215	S	C	.	.			trans	-63.1	138.2	-175.1	-176.5	0	0	0	0	112.5	S196 S201 R205	S196-S199 VanDerWaalsContact O-CB 3.24Å; S196-S199 WeakPolarHBondContact O-CB 3.41Å; S196-S199 PolarHBondContact O-N 3.23Å; S199-S201 PolarHBondContact O-N 2.99Å; S199-S201 PolarHBondContact OG-N 3.5Å; S199-R205 WeakPolarHBondContact O-CD 3.48Å; S199-R205 PolarHBondContact O-NH1 3.43Å
200	K	93.3	Very high	94.7	Very high	214 Å²	214	40 Å²	40	93%	0.93	22%	0.222	S	C	*	.	S	Bend	trans	-61.8	-26.9	172.8	-65	179	-179.9	175.9	0	112	N202	K200-N202 PolarHBondContact O-N 3.43Å
201	S	94.2	Very high	94.8	Very high	30 Å²	30	40 Å²	40	21%	0.21	22%	0.222	C	C	.	.			trans	-74.4	116.6	174.8	166.9	0	0	0	0	110.9	S163 S199 V203 T204 R205	S163-S201 WeakPolarHBondContact CB-OG 3.48Å; S199-S201 PolarHBondContact O-N 2.99Å; S199-S201 PolarHBondContact OG-N 3.5Å; S201-V203 VanDerWaalsContact C-N 3.28Å; S201-V203 PolarHBondContact O-N 3.02Å; S201-V203 PolarHBondContact OG-N 3.2Å; S201-T204 WeakPolarHBondContact CB-OG1 3.44Å; S201-T204 PolarHBondContact O-N 2.8Å; S201-T204 PolarHBondContact OG-N 3.09Å; S201-T204 PolarHBondContact OG-OG1 3.08Å; S201-R205 PolarHBondContact O-N 3.3Å
202	N	94.5	Very high	94.9	Very high	75 Å²	75	36.3 Å²	36.3	40%	0.401	20%	0.198	S	C	.	.	H	α-helix	trans	-65.1	-33.7	172.9	70.6	-53.3	0	0	0	111.6	K200 T204 R205 K206 D243	K200-N202 PolarHBondContact O-N 3.43Å; N202-T204 VanDerWaalsContact C-N 3.32Å; N202-T204 PolarHBondContact O-N 2.71Å; N202-R205 PolarHBondContact O-N 3.29Å; N202-K206 VanDerWaalsContact O-CB 3.3Å; N202-K206 WeakPolarHBondContact O-CB 3.27Å; N202-K206 PolarHBondContact O-N 3.18Å; N202-D243 HydrophobicContact CB-CB 4.39Å; N202-D243 PolarHBondContact ND2-OD1 2.95Å
203	V	94.6	Very high	94.8	Very high	62 Å²	62	36.7 Å²	36.7	38%	0.376	20%	0.199	S	C	.	.	H	α-helix	trans	-58.6	-44.2	174.9	-174.8	0	0	0	0	110.9	L162 S201 K206 C207	L162-V203 WeakPolarHBondContact O-CG1 3.45Å; S201-V203 VanDerWaalsContact C-N 3.28Å; S201-V203 PolarHBondContact O-N 3.02Å; S201-V203 PolarHBondContact OG-N 3.2Å; V203-K206 PolarHBondContact O-N 3.29Å; V203-C207 PolarHBondContact O-N 3.03Å; V203-C207 PolarHBondContact O-SG 2.81Å; V203-C207 VanDerWaalsContact O-SG 3.42Å
204	T	95.8	Very high	94.8	Very high	3 Å²	3	37 Å²	37	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-62.5	-48.9	176.4	-50.3	0	0	0	0	110.5	I159 L162 S163 S201 N202 K206 C207 I208	I159-T204 HydrophobicContact CG2-CG2 4.07Å; L162-T204 HydrophobicContact CD1-CG2 4.47Å; S163-T204 WeakPolarHBondContact CB-OG1 3.47Å; S163-T204 PolarHBondContact OG-OG1 3.22Å; S201-T204 WeakPolarHBondContact CB-OG1 3.44Å; S201-T204 PolarHBondContact O-N 2.8Å; S201-T204 PolarHBondContact OG-N 3.09Å; S201-T204 PolarHBondContact OG-OG1 3.08Å; N202-T204 VanDerWaalsContact C-N 3.32Å; N202-T204 PolarHBondContact O-N 2.71Å; T204-K206 PolarHBondContact O-N 3.44Å; T204-C207 PolarHBondContact O-N 3.4Å; T204-I208 WeakPolarHBondContact O-CG1 3.15Å; T204-I208 PolarHBondContact O-N 2.95Å
205	R	96	Very high	94.9	Very high	39 Å²	39	36.9 Å²	36.9	15%	0.147	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-39.5	-179.8	-59.1	-165.3	-48.7	-80.6	-4	112.6	L197 S199 S201 N202 I208 C209 D241	L197-R205 HydrophobicContact CD2-CB 4.49Å; L197-R205 WeakPolarHBondContact O-CD 3.39Å; S199-R205 WeakPolarHBondContact O-CD 3.48Å; S199-R205 PolarHBondContact O-NH1 3.43Å; S201-R205 PolarHBondContact O-N 3.3Å; N202-R205 PolarHBondContact O-N 3.29Å; R205-I208 PolarHBondContact O-N 2.9Å; R205-C209 WeakPolarHBondContact O-CB 3.45Å; R205-C209 PolarHBondContact O-N 3.45Å; R205-C209 PolarHBondContact O-SG 3.09Å; R205-D241 WeakPolarHBondContact CD-OD2 3.45Å; R205-D241 IonicContact CZ-OD1 3.89Å; R205-D241 IonicContact CZ-OD2 3.55Å; R205-D241 IonicContact NE-OD1 3.44Å; R205-D241 PolarHBondContact NE-OD1 3.41Å; R205-D241 IonicContact NE-OD2 2.89Å; R205-D241 PolarHBondContact NE-OD2 3.02Å; R205-D241 IonicContact NH2-OD1 3.72Å; R205-D241 PolarHBondContact NH2-OD1 3.13Å; R205-D241 IonicContact NH2-OD2 4Å
206	K	95.5	Very high	94.9	Very high	43 Å²	43	34 Å²	34	19%	0.187	18%	0.179	C	C	.	.	H	α-helix	trans	-54.6	-53.2	171.6	173.8	-171.1	174.4	175.6	0	111	N202 V203 T204 C209 E210 E245 A246 F249	N202-K206 VanDerWaalsContact O-CB 3.3Å; N202-K206 WeakPolarHBondContact O-CB 3.27Å; N202-K206 PolarHBondContact O-N 3.18Å; V203-K206 PolarHBondContact O-N 3.29Å; T204-K206 PolarHBondContact O-N 3.44Å; K206-C209 WeakPolarHBondContact O-CB 3.5Å; K206-C209 PolarHBondContact O-N 2.85Å; K206-E210 PolarHBondContact O-N 2.95Å; K206-E245 HydrophobicContact CD-CB 3.87Å; K206-E245 VanDerWaalsContact CE-OE1 3.25Å; K206-E245 WeakPolarHBondContact CE-OE1 3.09Å; K206-E245 WeakPolarHBondContact CE-OE2 3.05Å; K206-E245 HydrophobicContact CG-CB 4Å; K206-E245 IonicContact NZ-OE1 3.71Å; K206-E245 PolarHBondContact NZ-OE1 3.11Å; K206-E245 IonicContact NZ-OE2 2.63Å; K206-E245 PolarHBondContact NZ-OE2 3.49Å; K206-A246 HydrophobicContact CB-CB 4.47Å; K206-F249 HydrophobicContact CD-CE2 4.47Å; K206-F249 HydrophobicContact CG-CD2 4.09Å; K206-F249 HydrophobicContact CG-CE2 3.91Å
207	C	96	Very high	94.9	Very high	9 Å²	9	39.3 Å²	39.3	6%	0.061	20%	0.198	C	C	.	.	H	α-helix	trans	-65.1	-39.4	-179.8	-68.5	0	0	0	0	112.6	L162 V203 T204 C209 E210 F211	L162-C207 HydrophobicContact CD1-CB 4.2Å; V203-C207 PolarHBondContact O-N 3.03Å; V203-C207 PolarHBondContact O-SG 2.81Å; V203-C207 VanDerWaalsContact O-SG 3.42Å; T204-C207 PolarHBondContact O-N 3.4Å; C207-C209 VanDerWaalsContact C-N 3.32Å; C207-C209 PolarHBondContact O-N 3.02Å; C207-E210 WeakPolarHBondContact O-CB 3.48Å; C207-E210 PolarHBondContact O-N 3.48Å; C207-F211 HydrophobicContact CB-CE2 3.97Å; C207-F211 HydrophobicContact CB-CZ 4.09Å; C207-F211 WeakPolarHBondContact O-CD2 3.26Å; C207-F211 WeakPolarHBondContact O-CE2 3.33Å; C207-F211 WeakPolarHBondContact O-CG 3.38Å; C207-F211 PolarHBondContact O-N 3.24Å
208	I	96.3	Very high	94.9	Very high	3 Å²	3	41 Å²	41	2%	0.015	21%	0.208	C	C	.	.	H	α-helix	trans	-63	-39.6	173.6	-58.8	-63.5	0	0	0	111.2	L162 L193 L197 T204 R205 E210 F211 L212	L162-I208 HydrophobicContact CD1-CD1 4.46Å; L193-I208 HydrophobicContact CB-CD1 4.49Å; L193-I208 HydrophobicContact CD2-CD1 3.83Å; L193-I208 WeakPolarHBondContact O-CG2 3.47Å; L197-I208 HydrophobicContact CD1-CG2 4.36Å; L197-I208 HydrophobicContact CD2-CB 3.77Å; L197-I208 HydrophobicContact CD2-CG2 3.64Å; L197-I208 HydrophobicContact CG-CB 4.29Å; L197-I208 HydrophobicContact CG-CG2 3.69Å; T204-I208 WeakPolarHBondContact O-CG1 3.15Å; T204-I208 PolarHBondContact O-N 2.95Å; R205-I208 PolarHBondContact O-N 2.9Å; I208-E210 VanDerWaalsContact C-N 3.32Å; I208-E210 PolarHBondContact O-N 3.28Å; I208-F211 HydrophobicContact CD1-CD2 4.17Å; I208-F211 PolarHBondContact O-N 2.93Å; I208-L212 PolarHBondContact O-N 3.21Å
209	C	96.2	Very high	94.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-35.4	174.7	-68.4	0	0	0	0	112.8	R205 K206 C207 L212 A246 F249	R205-C209 WeakPolarHBondContact O-CB 3.45Å; R205-C209 PolarHBondContact O-N 3.45Å; R205-C209 PolarHBondContact O-SG 3.09Å; K206-C209 WeakPolarHBondContact O-CB 3.5Å; K206-C209 PolarHBondContact O-N 2.85Å; C207-C209 VanDerWaalsContact C-N 3.32Å; C207-C209 PolarHBondContact O-N 3.02Å; C209-L212 WeakPolarHBondContact O-CB 3.4Å; C209-L212 PolarHBondContact O-N 3.03Å; C209-A246 HydrophobicContact CB-CB 4.31Å; C209-F249 HydrophobicContact CB-CB 4.14Å
210	E	95.7	Very high	94.9	Very high	31 Å²	31	38 Å²	38	15%	0.145	19%	0.186	C	C	.	.	H	α-helix	trans	-64.7	-42.5	172	-174.5	-176	166.6	0	0	111.7	R178 K206 C207 I208 L212 E213 F249	R178-E210 IonicContact CZ-OE1 2.66Å; R178-E210 IonicContact NE-OE1 3.73Å; R178-E210 IonicContact NH2-OE1 2.9Å; R178-E210 PolarHBondContact NH2-OE1 3.24Å; K206-E210 PolarHBondContact O-N 2.95Å; C207-E210 WeakPolarHBondContact O-CB 3.48Å; C207-E210 PolarHBondContact O-N 3.48Å; I208-E210 VanDerWaalsContact C-N 3.32Å; I208-E210 PolarHBondContact O-N 3.28Å; E210-L212 PolarHBondContact O-N 3.39Å; E210-E213 VanDerWaalsContact O-CB 3.31Å; E210-E213 WeakPolarHBondContact O-CB 3.43Å; E210-E213 PolarHBondContact O-N 2.72Å; E210-F249 HydrophobicContact CB-CB 4.29Å; E210-F249 HydrophobicContact CB-CD1 3.94Å; E210-F249 HydrophobicContact CB-CD2 3.93Å; E210-F249 HydrophobicContact CB-CE1 4.22Å; E210-F249 HydrophobicContact CB-CE2 4.2Å; E210-F249 HydrophobicContact CB-CG 3.8Å; E210-F249 HydrophobicContact CB-CZ 4.34Å; E210-F249 HydrophobicContact CG-CD1 3.83Å; E210-F249 HydrophobicContact CG-CD2 4.48Å; E210-F249 HydrophobicContact CG-CE1 3.75Å; E210-F249 HydrophobicContact CG-CE2 4.41Å; E210-F249 HydrophobicContact CG-CG 4.22Å; E210-F249 HydrophobicContact CG-CZ 4.05Å
211	F	96.4	Very high	94.9	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.009	16%	0.161	C	C	.	.	H	α-helix	trans	-67	-18.8	178.8	-58.3	-34.5	0	0	0	114.1	L162 V174 M177 R178 L181 C207 I208 E213 I214 I215	L162-F211 HydrophobicContact CD1-CE2 3.99Å; L162-F211 HydrophobicContact CD2-CE2 4.24Å; L162-F211 HydrophobicContact CD2-CZ 4.14Å; V174-F211 HydrophobicContact CG1-CE1 4.36Å; V174-F211 HydrophobicContact CG1-CZ 4.35Å; M177-F211 HydrophobicContact CB-CE1 4.31Å; M177-F211 HydrophobicContact CB-CE2 3.96Å; M177-F211 HydrophobicContact CB-CZ 3.73Å; M177-F211 HydrophobicContact CG-CD2 3.72Å; M177-F211 HydrophobicContact CG-CE1 4.21Å; M177-F211 HydrophobicContact CG-CE2 3.36Å; M177-F211 HydrophobicContact CG-CG 4.33Å; M177-F211 HydrophobicContact CG-CZ 3.63Å; R178-F211 HydrophobicContact CG-CD1 4.41Å; R178-F211 HydrophobicContact CG-CE1 3.94Å; L181-F211 HydrophobicContact CD1-CB 3.64Å; L181-F211 HydrophobicContact CD1-CD1 4.45Å; L181-F211 HydrophobicContact CD1-CD2 4.23Å; L181-F211 HydrophobicContact CD1-CG 3.87Å; C207-F211 HydrophobicContact CB-CE2 3.97Å; C207-F211 HydrophobicContact CB-CZ 4.09Å; C207-F211 WeakPolarHBondContact O-CD2 3.26Å; C207-F211 WeakPolarHBondContact O-CE2 3.33Å; C207-F211 WeakPolarHBondContact O-CG 3.38Å; C207-F211 PolarHBondContact O-N 3.24Å; I208-F211 HydrophobicContact CD1-CD2 4.17Å; I208-F211 PolarHBondContact O-N 2.93Å; F211-E213 PolarHBondContact O-N 3.22Å; F211-I214 HydrophobicContact CD1-CD1 4.11Å; F211-I214 WeakPolarHBondContact O-CB 3.31Å; F211-I214 PolarHBondContact O-N 3.46Å; F211-I215 WeakPolarHBondContact O-CG1 3.19Å; F211-I215 PolarHBondContact O-N 3.27Å
212	L	95.5	Very high	94.8	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-60.9	-34	168.9	-62.5	177.1	0	0	0	112	I208 C209 E210 I214 I215 F216 A234 L235 T250	I208-L212 PolarHBondContact O-N 3.21Å; C209-L212 WeakPolarHBondContact O-CB 3.4Å; C209-L212 PolarHBondContact O-N 3.03Å; E210-L212 PolarHBondContact O-N 3.39Å; L212-I214 PolarHBondContact O-N 3.01Å; L212-I215 HydrophobicContact CD2-CD1 4.46Å; L212-I215 PolarHBondContact O-N 2.75Å; L212-F216 HydrophobicContact CB-CD2 4.3Å; L212-F216 HydrophobicContact CB-CE2 4.2Å; L212-F216 WeakPolarHBondContact O-CD2 3.46Å; L212-F216 PolarHBondContact O-N 3.16Å; L212-A234 HydrophobicContact CD1-CB 4.22Å; L212-A234 HydrophobicContact CD2-CB 4.07Å; L212-L235 HydrophobicContact CD1-CD2 4.39Å; L212-T250 HydrophobicContact CD1-CG2 4.19Å
213	E	93.1	Very high	94.7	Very high	42 Å²	42	32.8 Å²	32.8	20%	0.196	17%	0.165	C	C	.	.	H	α-helix	trans	-66.4	-26.1	174.7	-165.8	-179.1	127	0	0	111.9	E210 F211 R217 R252 L256	E210-E213 VanDerWaalsContact O-CB 3.31Å; E210-E213 WeakPolarHBondContact O-CB 3.43Å; E210-E213 PolarHBondContact O-N 2.72Å; F211-E213 PolarHBondContact O-N 3.22Å; E213-R217 WeakPolarHBondContact O-CB 3.23Å; E213-R217 PolarHBondContact O-N 2.82Å; E213-R252 VanDerWaalsContact CD-NH2 3.29Å; E213-R252 IonicContact OE1-CZ 2.71Å; E213-R252 IonicContact OE1-NE 3.05Å; E213-R252 IonicContact OE1-NH2 3.83Å; E213-R252 PolarHBondContact OE1-NH2 2.95Å; E213-R252 WeakPolarHBondContact OE2-CB 3.44Å; E213-R252 IonicContact OE2-CZ 3.79Å; E213-R252 VanDerWaalsContact OE2-CZ 3.25Å; E213-R252 IonicContact OE2-NE 2.74Å; E213-R252 PolarHBondContact OE2-NE 3.04Å; E213-R252 IonicContact OE2-NH2 3.8Å; E213-R252 PolarHBondContact OE2-NH2 3.47Å; E213-L256 HydrophobicContact CG-CD1 3.82Å; E213-L256 VanDerWaalsContact O-CD1 3.31Å; E213-L256 WeakPolarHBondContact O-CD1 3.37Å
214	I	94.6	Very high	94.7	Very high	8 Å²	8	29.8 Å²	29.8	4%	0.041	15%	0.147	C	C	.	.	H	α-helix	trans	-77.2	-52.2	172.5	-55.4	-173.5	0	0	0	109.8	R178 L181 E182 F211 L212 F216 R217 T218	R178-I214 HydrophobicContact CB-CD1 3.81Å; R178-I214 HydrophobicContact CG-CD1 3.61Å; L181-I214 HydrophobicContact CB-CG2 4.08Å; E182-I214 HydrophobicContact CG-CG2 3.56Å; F211-I214 HydrophobicContact CD1-CD1 4.11Å; F211-I214 WeakPolarHBondContact O-CB 3.31Å; F211-I214 PolarHBondContact O-N 3.46Å; L212-I214 PolarHBondContact O-N 3.01Å; I214-F216 PolarHBondContact O-N 2.91Å; I214-R217 WeakPolarHBondContact O-CA 3.36Å; I214-R217 WeakPolarHBondContact O-CB 3.42Å; I214-R217 PolarHBondContact O-N 3.22Å; I214-T218 HydrophobicContact CG2-CG2 4.48Å; I214-T218 PolarHBondContact O-N 2.82Å; I214-T218 PolarHBondContact O-OG1 2.71Å; I214-T218 VanDerWaalsContact O-OG1 3.07Å
215	I	96	Very high	94.7	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-55.5	-49.5	-178.5	-68.6	163.2	0	0	0	111.1	L190 L193 F211 L212 R217 W219 L224 L231	L190-I215 HydrophobicContact CD2-CD1 4.01Å; L190-I215 HydrophobicContact CD2-CG2 4.48Å; L193-I215 HydrophobicContact CD1-CD1 4.41Å; F211-I215 WeakPolarHBondContact O-CG1 3.19Å; F211-I215 PolarHBondContact O-N 3.27Å; L212-I215 HydrophobicContact CD2-CD1 4.46Å; L212-I215 PolarHBondContact O-N 2.75Å; I215-R217 VanDerWaalsContact C-N 3.25Å; I215-R217 PolarHBondContact O-N 2.89Å; I215-W219 HydrophobicContact CG1-CD2 4.46Å; I215-W219 HydrophobicContact CG1-CZ2 4.15Å; I215-W219 HydrophobicContact CG2-CD2 3.98Å; I215-W219 HydrophobicContact CG2-CE3 4.21Å; I215-W219 HydrophobicContact CG2-CG 4.18Å; I215-W219 VanDerWaalsContact O-CB 3.28Å; I215-W219 WeakPolarHBondContact O-CB 3.42Å; I215-W219 PolarHBondContact O-N 2.75Å; I215-W219 VanDerWaalsContact O-N 3.12Å; I215-L224 HydrophobicContact CG2-CD2 3.56Å; I215-L231 HydrophobicContact CG2-CD2 4.09Å
216	F	95.2	Very high	94.5	Very high	2 Å²	2	41 Å²	41	1%	0.009	20%	0.198	C	C	.	.	H	α-helix	trans	-73	-11.3	177	-63.5	-59.7	0	0	0	114.3	L212 I214 L224 L231 L235 L256 F257 K260	L212-F216 HydrophobicContact CB-CD2 4.3Å; L212-F216 HydrophobicContact CB-CE2 4.2Å; L212-F216 WeakPolarHBondContact O-CD2 3.46Å; L212-F216 PolarHBondContact O-N 3.16Å; I214-F216 PolarHBondContact O-N 2.91Å; F216-L224 HydrophobicContact CD1-CD2 4.48Å; F216-L231 HydrophobicContact CE1-CB 4.27Å; F216-L231 HydrophobicContact CE1-CD1 4.19Å; F216-L231 HydrophobicContact CE1-CD2 4.31Å; F216-L231 HydrophobicContact CZ-CB 4.08Å; F216-L231 HydrophobicContact CZ-CD2 4.2Å; F216-L235 HydrophobicContact CE2-CD1 4.16Å; F216-L235 HydrophobicContact CE2-CD2 3.91Å; F216-L235 HydrophobicContact CE2-CG 4.13Å; F216-L235 HydrophobicContact CZ-CD1 3.95Å; F216-L235 HydrophobicContact CZ-CD2 4.48Å; F216-L235 HydrophobicContact CZ-CG 4.22Å; F216-L256 HydrophobicContact CB-CB 3.56Å; F216-L256 HydrophobicContact CB-CD1 4.33Å; F216-F257 HydrophobicContact CD1-CB 4.46Å; F216-F257 HydrophobicContact CD1-CD2 4.26Å; F216-F257 HydrophobicContact CD2-CB 4.48Å; F216-F257 HydrophobicContact CE1-CB 4.42Å; F216-F257 AromaticContact CE1-CD2 3.61Å; F216-F257 HydrophobicContact CE1-CD2 3.61Å; F216-F257 HydrophobicContact CE1-CE2 4.38Å; F216-F257 HydrophobicContact CE1-CG 4.44Å; F216-F257 HydrophobicContact CE2-CB 4.44Å; F216-F257 HydrophobicContact CZ-CB 4.41Å; F216-F257 AromaticContact CZ-CD2 3.85Å; F216-F257 HydrophobicContact CZ-CD2 3.85Å; F216-F257 HydrophobicContact CZ-CG 4.42Å; F216-K260 WeakPolarHBondContact O-CE 3.27Å
217	R	94.2	Very high	94.5	Very high	124 Å²	124	40.4 Å²	40.4	47%	0.468	20%	0.197	S	C	.	.	H	α-helix	trans	-90.4	-46	174.3	175.9	170.9	53.1	92.2	0.7	112.6	E182 E213 I214 I215 L256	E182-R217 IonicContact OE1-CZ 3.55Å; E182-R217 VanDerWaalsContact OE1-CZ 3.23Å; E182-R217 IonicContact OE1-NH1 3.58Å; E182-R217 PolarHBondContact OE1-NH1 3.29Å; E182-R217 IonicContact OE1-NH2 2.77Å; E182-R217 PolarHBondContact OE1-NH2 3.31Å; E213-R217 WeakPolarHBondContact O-CB 3.23Å; E213-R217 PolarHBondContact O-N 2.82Å; I214-R217 WeakPolarHBondContact O-CA 3.36Å; I214-R217 WeakPolarHBondContact O-CB 3.42Å; I214-R217 PolarHBondContact O-N 3.22Å; I215-R217 VanDerWaalsContact C-N 3.25Å; I215-R217 PolarHBondContact O-N 2.89Å; R217-L256 HydrophobicContact CB-CD1 3.99Å
218	T	92.8	Very high	94.4	Very high	46 Å²	46	41.5 Å²	41.5	28%	0.282	20%	0.202	S	C	.	.	H	α-helix	trans	-103.7	-21.5	-168.3	58	0	0	0	0	114.7	L181 E182 I214	L181-T218 PolarHBondContact O-OG1 3.1Å; E182-T218 HydrophobicContact CG-CG2 4.21Å; I214-T218 HydrophobicContact CG2-CG2 4.48Å; I214-T218 PolarHBondContact O-N 2.82Å; I214-T218 PolarHBondContact O-OG1 2.71Å; I214-T218 VanDerWaalsContact O-OG1 3.07Å
219	W	94.7	Very high	94.2	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.008	23%	0.23	C	C	.	.	S	Bend	trans	-81.3	141	-171.2	-70.2	28.4	0	0	0	113	L181 C185 S186 L190 I215 I223 L224 K260	L181-W219 HydrophobicContact CD2-CZ2 4.01Å; L181-W219 PolarHBondContact O-NE1 2.97Å; C185-W219 HydrophobicContact CB-CD2 4.42Å; C185-W219 HydrophobicContact CB-CG 4.3Å; S186-W219 WeakPolarHBondContact O-CH2 3.34Å; L190-W219 HydrophobicContact CD1-CH2 4.43Å; L190-W219 HydrophobicContact CD1-CZ3 3.73Å; L190-W219 HydrophobicContact CD2-CH2 3.71Å; L190-W219 HydrophobicContact CD2-CZ3 3.71Å; L190-W219 HydrophobicContact CG-CH2 3.8Å; L190-W219 HydrophobicContact CG-CZ3 3.61Å; I215-W219 HydrophobicContact CG1-CD2 4.46Å; I215-W219 HydrophobicContact CG1-CZ2 4.15Å; I215-W219 HydrophobicContact CG2-CD2 3.98Å; I215-W219 HydrophobicContact CG2-CE3 4.21Å; I215-W219 HydrophobicContact CG2-CG 4.18Å; I215-W219 VanDerWaalsContact O-CB 3.28Å; I215-W219 WeakPolarHBondContact O-CB 3.42Å; I215-W219 PolarHBondContact O-N 2.75Å; I215-W219 VanDerWaalsContact O-N 3.12Å; W219-I223 HydrophobicContact CE3-CG2 3.8Å; W219-I223 HydrophobicContact CZ3-CG2 4.07Å; W219-L224 HydrophobicContact CB-CD1 4.08Å; W219-L224 HydrophobicContact CB-CD2 3.91Å; W219-L224 HydrophobicContact CB-CG 3.94Å; W219-L224 HydrophobicContact CE3-CD2 4.3Å; W219-L224 WeakPolarHBondContact O-CD1 3.23Å; W219-K260 PolarHBondContact O-NZ 2.92Å
220	P	92.7	Very high	94.1	Very high	57 Å²	57	48 Å²	48	37%	0.37	25%	0.245	S	C	.	.			trans	-55	141.7	171.8	-27.4	35.8	0	0	0	113.4	N222 I223 L224	P220-N222 WeakPolarHBondContact CB-OD1 3.46Å; P220-N222 PolarHBondContact O-N 3.06Å; P220-I223 HydrophobicContact CB-CD1 4.27Å; P220-I223 HydrophobicContact CB-CG1 4.23Å; P220-I223 HydrophobicContact CG-CD1 4.09Å; P220-I223 PolarHBondContact O-N 3.1Å; P220-I223 VanDerWaalsContact O-N 3.14Å; P220-L224 PolarHBondContact O-N 2.95Å
221	L	93.1	Very high	94.1	Very high	79 Å²	79	46.5 Å²	46.5	41%	0.414	24%	0.238	S	C	.	.	H	α-helix	trans	-55.2	-48.8	-177.8	-75.6	167.6	0	0	0	112.3	I223 L224 E225 K260 F261	L221-I223 PolarHBondContact O-N 2.75Å; L221-I223 VanDerWaalsContact O-N 3.09Å; L221-L224 PolarHBondContact O-N 3.39Å; L221-E225 VanDerWaalsContact O-CG 3.31Å; L221-E225 WeakPolarHBondContact O-CG 3.3Å; L221-E225 PolarHBondContact O-N 2.83Å; L221-K260 HydrophobicContact CD2-CB 3.72Å; L221-K260 HydrophobicContact CD2-CD 3.92Å; L221-K260 HydrophobicContact CD2-CG 3.67Å; L221-F261 HydrophobicContact CD2-CZ 4.35Å
222	N	92.7	Very high	94	Very high	91 Å²	91	47.9 Å²	47.9	49%	0.487	25%	0.245	S	C	.	.	H	α-helix	trans	-60.4	-18.8	179.6	67	-46.6	0	0	0	115.2	P220 E225 K226	P220-N222 WeakPolarHBondContact CB-OD1 3.46Å; P220-N222 PolarHBondContact O-N 3.06Å; N222-E225 WeakPolarHBondContact CA-OE2 3.36Å; N222-K226 WeakPolarHBondContact O-CD 3.42Å; N222-K226 WeakPolarHBondContact O-CG 3.3Å
223	I	92.6	Very high	93.9	Very high	39 Å²	39	50.7 Å²	50.7	20%	0.2	26%	0.26	C	S	.	.	H	α-helix	trans	-87.5	-39.2	173.6	-58.7	-177	0	0	0	109.9	C185 W219 P220 L221 N227	C185-I223 VanDerWaalsContact O-CD1 3.32Å; C185-I223 WeakPolarHBondContact O-CD1 3.44Å; W219-I223 HydrophobicContact CE3-CG2 3.8Å; W219-I223 HydrophobicContact CZ3-CG2 4.07Å; P220-I223 HydrophobicContact CB-CD1 4.27Å; P220-I223 HydrophobicContact CB-CG1 4.23Å; P220-I223 HydrophobicContact CG-CD1 4.09Å; P220-I223 PolarHBondContact O-N 3.1Å; P220-I223 VanDerWaalsContact O-N 3.14Å; L221-I223 PolarHBondContact O-N 2.75Å; L221-I223 VanDerWaalsContact O-N 3.09Å; I223-N227 PolarHBondContact O-ND2 2.87Å
224	L	94.7	Very high	94	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-69.7	-41	177.9	-63	170.5	0	0	0	111.9	I215 F216 W219 P220 L221 K226 N227 L228 L231 K260 F261	I215-L224 HydrophobicContact CG2-CD2 3.56Å; F216-L224 HydrophobicContact CD1-CD2 4.48Å; W219-L224 HydrophobicContact CB-CD1 4.08Å; W219-L224 HydrophobicContact CB-CD2 3.91Å; W219-L224 HydrophobicContact CB-CG 3.94Å; W219-L224 HydrophobicContact CE3-CD2 4.3Å; W219-L224 WeakPolarHBondContact O-CD1 3.23Å; P220-L224 PolarHBondContact O-N 2.95Å; L221-L224 PolarHBondContact O-N 3.39Å; L224-K226 PolarHBondContact O-N 3.3Å; L224-N227 CarbonylContact O-C 3.59Å; L224-N227 PolarHBondContact O-N 2.93Å; L224-N227 VanDerWaalsContact O-N 3.12Å; L224-L228 WeakPolarHBondContact O-CA 3.13Å; L224-L228 PolarHBondContact O-N 3.33Å; L224-L231 HydrophobicContact CB-CD1 4.07Å; L224-L231 HydrophobicContact CD2-CD1 3.61Å; L224-L231 HydrophobicContact CG-CD1 4.47Å; L224-L231 WeakPolarHBondContact O-CD1 3.11Å; L224-K260 HydrophobicContact CD1-CD 3.47Å; L224-K260 VanDerWaalsContact CD1-CD 3.47Å; L224-F261 HydrophobicContact CB-CE2 3.85Å; L224-F261 HydrophobicContact CB-CZ 3.75Å
225	E	94.2	Very high	94	Very high	102 Å²	102	48.3 Å²	48.3	48%	0.477	25%	0.248	S	C	.	.	H	α-helix	trans	-55	-50.9	175.2	-74.6	160.2	-168.6	0	0	111.9	L221 N222 N227 L228 F261	L221-E225 VanDerWaalsContact O-CG 3.31Å; L221-E225 WeakPolarHBondContact O-CG 3.3Å; L221-E225 PolarHBondContact O-N 2.83Å; N222-E225 WeakPolarHBondContact CA-OE2 3.36Å; E225-N227 PolarHBondContact O-N 3.4Å; E225-N227 VanDerWaalsContact O-N 3.12Å; E225-L228 VanDerWaalsContact O-CB 3.26Å; E225-L228 WeakPolarHBondContact O-CB 3.35Å; E225-L228 PolarHBondContact O-N 3.34Å; E225-F261 HydrophobicContact CG-CE1 3.55Å; E225-F261 HydrophobicContact CG-CZ 3.93Å
226	K	93.5	Very high	93.9	Very high	176 Å²	176	53 Å²	53	77%	0.765	27%	0.266	S	S	*	.	H	α-helix	trans	-62.5	-19.3	179.2	-70.7	-179.4	-179.9	-170.7	0	113.9	N222 L224	N222-K226 WeakPolarHBondContact O-CD 3.42Å; N222-K226 WeakPolarHBondContact O-CG 3.3Å; L224-K226 PolarHBondContact O-N 3.3Å
227	N	93.7	Very high	93.9	Very high	29 Å²	29	56.3 Å²	56.3	16%	0.155	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	14.6	-177.6	-65.7	-89.1	0	0	0	112.4	L190 I223 L224 E225 S229 V230 L231	L190-N227 HydrophobicContact CD1-CB 3.51Å; I223-N227 PolarHBondContact O-ND2 2.87Å; L224-N227 CarbonylContact O-C 3.59Å; L224-N227 PolarHBondContact O-N 2.93Å; L224-N227 VanDerWaalsContact O-N 3.12Å; E225-N227 PolarHBondContact O-N 3.4Å; E225-N227 VanDerWaalsContact O-N 3.12Å; N227-S229 VanDerWaalsContact C-N 3.3Å; N227-S229 PolarHBondContact O-N 3.26Å; N227-V230 PolarHBondContact O-N 2.72Å; N227-V230 VanDerWaalsContact O-N 3.07Å; N227-L231 HydrophobicContact CB-CD1 4.3Å; N227-L231 WeakPolarHBondContact O-CG 3.16Å; N227-L231 PolarHBondContact O-N 3.06Å
228	L	93.9	Very high	93.9	Very high	32 Å²	32	50.4 Å²	50.4	17%	0.168	26%	0.256	C	S	.	.	H	α-helix	trans	-60	-36	-168.7	-176.4	62.3	0	0	0	113.3	L224 E225 L231 Q232 F257 F261 Q264	L224-L228 WeakPolarHBondContact O-CA 3.13Å; L224-L228 PolarHBondContact O-N 3.33Å; E225-L228 VanDerWaalsContact O-CB 3.26Å; E225-L228 WeakPolarHBondContact O-CB 3.35Å; E225-L228 PolarHBondContact O-N 3.34Å; L228-L231 PolarHBondContact O-N 3.15Å; L228-Q232 HydrophobicContact CD1-CG 4.48Å; L228-Q232 WeakPolarHBondContact O-CB 3.39Å; L228-Q232 VanDerWaalsContact O-CG 3.3Å; L228-Q232 WeakPolarHBondContact O-CG 3.42Å; L228-Q232 PolarHBondContact O-N 3.22Å; L228-F257 HydrophobicContact CD1-CE2 3.68Å; L228-F257 HydrophobicContact CD1-CZ 4.22Å; L228-F261 HydrophobicContact CD1-CD2 3.95Å; L228-F261 HydrophobicContact CD1-CE2 4.18Å; L228-F261 HydrophobicContact CD1-CG 4.13Å; L228-Q264 HydrophobicContact CD2-CB 4.33Å; L228-Q264 HydrophobicContact CD2-CG 4.02Å
229	S	92.9	Very high	94	Very high	88 Å²	88	48.7 Å²	48.7	62%	0.615	25%	0.245	S	C	*	.	H	α-helix	trans	-60.8	-45.6	175.3	51.6	0	0	0	0	112.4	N227 Q232 D233	N227-S229 VanDerWaalsContact C-N 3.3Å; N227-S229 PolarHBondContact O-N 3.26Å; S229-Q232 PolarHBondContact O-N 2.87Å; S229-D233 PolarHBondContact O-N 2.95Å
230	V	93.8	Very high	93.9	Very high	51 Å²	51	51.6 Å²	51.6	31%	0.309	27%	0.265	S	S	.	.	H	α-helix	trans	-69.9	-40	-179.8	-156.8	0	0	0	0	110.8	I194 N227 D233 A234	I194-V230 HydrophobicContact CB-CG1 4.27Å; I194-V230 HydrophobicContact CD1-CB 4.25Å; I194-V230 HydrophobicContact CD1-CG1 3.67Å; I194-V230 HydrophobicContact CG2-CG1 4.04Å; N227-V230 PolarHBondContact O-N 2.72Å; N227-V230 VanDerWaalsContact O-N 3.07Å; V230-D233 PolarHBondContact O-N 3.45Å; V230-A234 PolarHBondContact O-N 3.31Å
231	L	95.1	Very high	94	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65.9	-37.9	174.9	-69.2	167.4	0	0	0	112.1	L190 I194 I215 F216 L224 N227 L228 A234 L235	L190-L231 HydrophobicContact CD2-CD2 4.23Å; I194-L231 HydrophobicContact CD1-CD2 4.36Å; I215-L231 HydrophobicContact CG2-CD2 4.09Å; F216-L231 HydrophobicContact CE1-CB 4.27Å; F216-L231 HydrophobicContact CE1-CD1 4.19Å; F216-L231 HydrophobicContact CE1-CD2 4.31Å; F216-L231 HydrophobicContact CZ-CB 4.08Å; F216-L231 HydrophobicContact CZ-CD2 4.2Å; L224-L231 HydrophobicContact CB-CD1 4.07Å; L224-L231 HydrophobicContact CD2-CD1 3.61Å; L224-L231 HydrophobicContact CG-CD1 4.47Å; L224-L231 WeakPolarHBondContact O-CD1 3.11Å; N227-L231 HydrophobicContact CB-CD1 4.3Å; N227-L231 WeakPolarHBondContact O-CG 3.16Å; N227-L231 PolarHBondContact O-N 3.06Å; L228-L231 PolarHBondContact O-N 3.15Å; L231-A234 PolarHBondContact O-N 2.87Å; L231-L235 WeakPolarHBondContact O-CG 3.31Å; L231-L235 PolarHBondContact O-N 2.71Å
232	Q	94.5	Very high	94.1	Very high	32 Å²	32	50.2 Å²	50.2	15%	0.15	27%	0.267	C	S	.	.	H	α-helix	trans	-67.2	-38.5	172	-74.9	-176	8.7	0	0	112.4	L228 S229 L235 R236 F257 F268	L228-Q232 HydrophobicContact CD1-CG 4.48Å; L228-Q232 WeakPolarHBondContact O-CB 3.39Å; L228-Q232 VanDerWaalsContact O-CG 3.3Å; L228-Q232 WeakPolarHBondContact O-CG 3.42Å; L228-Q232 PolarHBondContact O-N 3.22Å; S229-Q232 PolarHBondContact O-N 2.87Å; Q232-L235 PolarHBondContact O-N 2.81Å; Q232-R236 WeakPolarHBondContact O-CG 3.5Å; Q232-R236 PolarHBondContact O-N 2.81Å; Q232-F257 HydrophobicContact CG-CZ 4.01Å; Q232-F268 HydrophobicContact CB-CD2 4.22Å; Q232-F268 HydrophobicContact CB-CE2 4.09Å; Q232-F268 HydrophobicContact CG-CD2 4.01Å; Q232-F268 HydrophobicContact CG-CE2 4.32Å; Q232-F268 WeakPolarHBondContact O-CE2 3.44Å
233	D	93.5	Very high	94.1	Very high	60 Å²	60	46.9 Å²	46.9	32%	0.321	25%	0.25	S	C	.	.	H	α-helix	trans	-58.8	-47.7	172.1	179.9	59.1	0	0	0	111.3	S229 V230 L235 R236 R237	S229-D233 PolarHBondContact O-N 2.95Å; V230-D233 PolarHBondContact O-N 3.45Å; D233-L235 VanDerWaalsContact C-N 3.29Å; D233-L235 PolarHBondContact O-N 2.88Å; D233-R236 PolarHBondContact O-N 3.34Å; D233-R236 VanDerWaalsContact O-N 3.13Å; D233-R237 WeakPolarHBondContact O-CB 3.46Å; D233-R237 VanDerWaalsContact O-CG 3.32Å; D233-R237 WeakPolarHBondContact O-CG 3.32Å; D233-R237 PolarHBondContact O-N 3.4Å; D233-R237 VanDerWaalsContact OD1-CD 3.3Å; D233-R237 WeakPolarHBondContact OD1-CD 3.43Å; D233-R237 WeakPolarHBondContact OD2-CD 3.44Å; D233-R237 IonicContact OD2-CZ 3.34Å; D233-R237 IonicContact OD2-NE 2.77Å; D233-R237 IonicContact OD2-NH1 2.67Å; D233-R237 PolarHBondContact OD2-NH1 3.07Å
234	A	95.2	Very high	94.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-55.9	-42.7	176.1	0	0	0	0	0	112.5	I194 L197 L212 V230 L231 G238	I194-A234 HydrophobicContact CD1-CB 4.07Å; I194-A234 HydrophobicContact CG1-CB 4.01Å; I194-A234 HydrophobicContact CG2-CB 3.95Å; L197-A234 HydrophobicContact CD1-CB 3.75Å; L212-A234 HydrophobicContact CD1-CB 4.22Å; L212-A234 HydrophobicContact CD2-CB 4.07Å; V230-A234 PolarHBondContact O-N 3.31Å; L231-A234 PolarHBondContact O-N 2.87Å; A234-G238 PolarHBondContact O-N 2.98Å
235	L	95.4	Very high	94.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.4	-47	174	-72.4	173.3	0	0	0	112.5	L212 F216 L231 Q232 D233 R237 G238 I239 T250 F254 F257 F268	L212-L235 HydrophobicContact CD1-CD2 4.39Å; F216-L235 HydrophobicContact CE2-CD1 4.16Å; F216-L235 HydrophobicContact CE2-CD2 3.91Å; F216-L235 HydrophobicContact CE2-CG 4.13Å; F216-L235 HydrophobicContact CZ-CD1 3.95Å; F216-L235 HydrophobicContact CZ-CD2 4.48Å; F216-L235 HydrophobicContact CZ-CG 4.22Å; L231-L235 WeakPolarHBondContact O-CG 3.31Å; L231-L235 PolarHBondContact O-N 2.71Å; Q232-L235 PolarHBondContact O-N 2.81Å; D233-L235 VanDerWaalsContact C-N 3.29Å; D233-L235 PolarHBondContact O-N 2.88Å; L235-R237 VanDerWaalsContact C-N 3.29Å; L235-R237 PolarHBondContact O-N 2.91Å; L235-G238 PolarHBondContact O-N 3.5Å; L235-I239 WeakPolarHBondContact O-CB 3.43Å; L235-I239 WeakPolarHBondContact O-CD1 3.4Å; L235-I239 VanDerWaalsContact O-CG1 3.27Å; L235-I239 WeakPolarHBondContact O-CG1 3.24Å; L235-I239 PolarHBondContact O-N 2.87Å; L235-T250 HydrophobicContact CB-CG2 4.47Å; L235-T250 HydrophobicContact CD2-CG2 3.62Å; L235-F254 HydrophobicContact CD1-CD2 4.35Å; L235-F254 HydrophobicContact CD1-CE2 4.39Å; L235-F254 HydrophobicContact CD2-CD2 4.43Å; L235-F257 HydrophobicContact CD1-CB 4.24Å; L235-F257 HydrophobicContact CD1-CD1 3.64Å; L235-F257 HydrophobicContact CD1-CD2 3.88Å; L235-F257 HydrophobicContact CD1-CE1 3.87Å; L235-F257 HydrophobicContact CD1-CE2 4.11Å; L235-F257 HydrophobicContact CD1-CG 3.65Å; L235-F257 HydrophobicContact CD1-CZ 4.11Å; L235-F268 HydrophobicContact CB-CE1 4.38Å; L235-F268 HydrophobicContact CB-CE2 3.85Å; L235-F268 HydrophobicContact CB-CZ 3.5Å; L235-F268 VanDerWaalsContact CB-CZ 3.5Å
236	R	94.4	Very high	94.2	Very high	102 Å²	102	51.6 Å²	51.6	39%	0.385	27%	0.271	S	S	.	.	H	α-helix	trans	-58.4	-43.3	179.5	-72.7	177.4	-168.7	101.6	7.6	111.4	Q232 D233 S240 F268	Q232-R236 WeakPolarHBondContact O-CG 3.5Å; Q232-R236 PolarHBondContact O-N 2.81Å; D233-R236 PolarHBondContact O-N 3.34Å; D233-R236 VanDerWaalsContact O-N 3.13Å; R236-S240 WeakPolarHBondContact O-CB 3.45Å; R236-S240 PolarHBondContact O-N 2.97Å; R236-S240 PolarHBondContact O-OG 3.1Å; R236-F268 HydrophobicContact CB-CZ 4.49Å; R236-F268 HydrophobicContact CG-CE2 3.6Å; R236-F268 HydrophobicContact CG-CZ 3.73Å
237	R	94.2	Very high	94.3	Very high	73 Å²	73	47.8 Å²	47.8	28%	0.275	25%	0.252	S	S	.	.	H	α-helix	trans	-69.7	-49.1	-179.8	-69.5	167.1	65.8	-178.3	3.4	111.6	I194 L197 S198 D233 L235 I239 S240 D241	I194-R237 PolarHBondContact O-NH1 3.3Å; L197-R237 PolarHBondContact O-NH2 3.38Å; S198-R237 PolarHBondContact OG-NH2 3.44Å; D233-R237 WeakPolarHBondContact O-CB 3.46Å; D233-R237 VanDerWaalsContact O-CG 3.32Å; D233-R237 WeakPolarHBondContact O-CG 3.32Å; D233-R237 PolarHBondContact O-N 3.4Å; D233-R237 VanDerWaalsContact OD1-CD 3.3Å; D233-R237 WeakPolarHBondContact OD1-CD 3.43Å; D233-R237 WeakPolarHBondContact OD2-CD 3.44Å; D233-R237 IonicContact OD2-CZ 3.34Å; D233-R237 IonicContact OD2-NE 2.77Å; D233-R237 IonicContact OD2-NH1 2.67Å; D233-R237 PolarHBondContact OD2-NH1 3.07Å; L235-R237 VanDerWaalsContact C-N 3.29Å; L235-R237 PolarHBondContact O-N 2.91Å; R237-I239 PolarHBondContact O-N 2.72Å; R237-S240 CarbonylContact O-C 3.56Å; R237-S240 WeakPolarHBondContact O-CA 3.19Å; R237-S240 PolarHBondContact O-N 3.33Å; R237-D241 PolarHBondContact O-N 3.29Å
238	G	94.3	Very high	94.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-41	178.7	0	0	0	0	0	113.7	A234 L235 S240 D241 R247 T250	A234-G238 PolarHBondContact O-N 2.98Å; L235-G238 PolarHBondContact O-N 3.5Å; G238-S240 PolarHBondContact O-N 3.26Å; G238-D241 PolarHBondContact O-N 3.14Å; G238-R247 WeakPolarHBondContact O-CA 3.32Å; G238-R247 VanDerWaalsContact O-CG 3.23Å; G238-R247 WeakPolarHBondContact O-CG 3.31Å; G238-T250 VanDerWaalsContact C-OG1 3.23Å; G238-T250 VanDerWaalsContact CA-OG1 3.24Å; G238-T250 WeakPolarHBondContact CA-OG1 3.44Å
239	I	94.5	Very high	94.3	Very high	10 Å²	10	49.4 Å²	49.4	5%	0.051	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-23.4	173.8	-70.7	162.1	0	0	0	112.1	L235 R237 R247 T250 F254 F268 L272 K276 I280	L235-I239 WeakPolarHBondContact O-CB 3.43Å; L235-I239 WeakPolarHBondContact O-CD1 3.4Å; L235-I239 VanDerWaalsContact O-CG1 3.27Å; L235-I239 WeakPolarHBondContact O-CG1 3.24Å; L235-I239 PolarHBondContact O-N 2.87Å; R237-I239 PolarHBondContact O-N 2.72Å; I239-R247 WeakPolarHBondContact O-CG 3.46Å; I239-T250 HydrophobicContact CD1-CG2 4.41Å; I239-T250 HydrophobicContact CG1-CG2 3.81Å; I239-F254 HydrophobicContact CD1-CD2 4.43Å; I239-F268 HydrophobicContact CD1-CE1 3.72Å; I239-F268 HydrophobicContact CD1-CZ 4.08Å; I239-L272 HydrophobicContact CD1-CD1 4.37Å; I239-K276 HydrophobicContact CG2-CB 4.31Å; I239-K276 HydrophobicContact CG2-CD 4.01Å; I239-K276 HydrophobicContact CG2-CG 4.34Å; I239-I280 HydrophobicContact CD1-CD1 3.73Å; I239-I280 HydrophobicContact CG1-CD1 4.29Å; I239-I280 HydrophobicContact CG2-CD1 4.31Å
240	S	92.9	Very high	94.4	Very high	62 Å²	62	45.2 Å²	45.2	43%	0.434	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109	9.1	-177.3	-51.9	0	0	0	0	114.1	R236 R237 G238 K276	R236-S240 WeakPolarHBondContact O-CB 3.45Å; R236-S240 PolarHBondContact O-N 2.97Å; R236-S240 PolarHBondContact O-OG 3.1Å; R237-S240 CarbonylContact O-C 3.56Å; R237-S240 WeakPolarHBondContact O-CA 3.19Å; R237-S240 PolarHBondContact O-N 3.33Å; G238-S240 PolarHBondContact O-N 3.26Å; S240-K276 PolarHBondContact OG-NZ 2.81Å; S240-K276 VanDerWaalsContact OG-NZ 3.17Å
241	D	95.4	Very high	94.5	Very high	20 Å²	20	44.7 Å²	44.7	11%	0.107	22%	0.222	C	C	.	.			trans	-64.2	153.1	178.3	-156.2	-60.3	0	0	0	111.4	R205 R237 G238 D243 A246 R247	R205-D241 WeakPolarHBondContact CD-OD2 3.45Å; R205-D241 IonicContact CZ-OD1 3.89Å; R205-D241 IonicContact CZ-OD2 3.55Å; R205-D241 IonicContact NE-OD1 3.44Å; R205-D241 PolarHBondContact NE-OD1 3.41Å; R205-D241 IonicContact NE-OD2 2.89Å; R205-D241 PolarHBondContact NE-OD2 3.02Å; R205-D241 IonicContact NH2-OD1 3.72Å; R205-D241 PolarHBondContact NH2-OD1 3.13Å; R205-D241 IonicContact NH2-OD2 4Å; R237-D241 PolarHBondContact O-N 3.29Å; G238-D241 PolarHBondContact O-N 3.14Å; D241-D243 VanDerWaalsContact C-N 3.3Å; D241-D243 WeakPolarHBondContact OD1-CB 3.42Å; D241-D243 PolarHBondContact OD1-N 2.87Å; D241-A246 HydrophobicContact CB-CB 4.01Å; D241-R247 HydrophobicContact CB-CG 4.31Å; D241-R247 WeakPolarHBondContact O-CD 3.4Å; D241-R247 PolarHBondContact O-NE 3.45Å
242	A	94.8	Very high	94.3	Very high	87 Å²	87	50.8 Å²	50.8	72%	0.719	25%	0.245	S	C	*	.	S	Bend	trans	-67.1	-34.4	170.5	0	0	0	0	0	111.5	R247	A242-R247 PolarHBondContact O-NH2 3.27Å
243	D	93.8	Very high	94.3	Very high	22 Å²	22	49.3 Å²	49.3	12%	0.118	24%	0.238	C	C	.	.	S	Bend	trans	-67.8	138.2	-179.3	-168.4	102.3	0	0	0	111.6	N202 D241 E245 A246 R247	N202-D243 HydrophobicContact CB-CB 4.39Å; N202-D243 PolarHBondContact ND2-OD1 2.95Å; D241-D243 VanDerWaalsContact C-N 3.3Å; D241-D243 WeakPolarHBondContact OD1-CB 3.42Å; D241-D243 PolarHBondContact OD1-N 2.87Å; D243-E245 WeakPolarHBondContact OD2-CA 3.26Å; D243-E245 WeakPolarHBondContact OD2-CB 3.45Å; D243-E245 PolarHBondContact OD2-N 3.39Å; D243-A246 HydrophobicContact CB-CB 3.89Å; D243-A246 PolarHBondContact OD2-N 2.8Å; D243-R247 WeakPolarHBondContact O-CG 3.24Å; D243-R247 PolarHBondContact O-N 3.02Å; D243-R247 PolarHBondContact O-NE 3.39Å
244	Q	94.6	Very high	94.3	Very high	155 Å²	155	46.4 Å²	46.4	72%	0.724	22%	0.223	S	C	*	.	H	α-helix	trans	-78.2	-32.3	-177.8	-178.5	173.9	-8.5	0	0	112.3	L248	Q244-L248 WeakPolarHBondContact O-CB 3.3Å; Q244-L248 PolarHBondContact O-N 3.46Å; Q244-L248 VanDerWaalsContact O-N 3.09Å
245	E	92.9	Very high	94.2	Very high	84 Å²	84	47.4 Å²	47.4	39%	0.393	23%	0.229	S	C	.	.	H	α-helix	trans	-80.1	-40.1	-177.8	-58.4	-173.1	85.2	0	0	110.7	K206 D243 R247 L248 F249	K206-E245 HydrophobicContact CD-CB 3.87Å; K206-E245 VanDerWaalsContact CE-OE1 3.25Å; K206-E245 WeakPolarHBondContact CE-OE1 3.09Å; K206-E245 WeakPolarHBondContact CE-OE2 3.05Å; K206-E245 HydrophobicContact CG-CB 4Å; K206-E245 IonicContact NZ-OE1 3.71Å; K206-E245 PolarHBondContact NZ-OE1 3.11Å; K206-E245 IonicContact NZ-OE2 2.63Å; K206-E245 PolarHBondContact NZ-OE2 3.49Å; D243-E245 WeakPolarHBondContact OD2-CA 3.26Å; D243-E245 WeakPolarHBondContact OD2-CB 3.45Å; D243-E245 PolarHBondContact OD2-N 3.39Å; E245-R247 VanDerWaalsContact C-N 3.34Å; E245-R247 PolarHBondContact O-N 3.31Å; E245-L248 WeakPolarHBondContact O-CA 3.26Å; E245-L248 WeakPolarHBondContact O-CB 3.22Å; E245-L248 PolarHBondContact O-N 2.8Å; E245-F249 HydrophobicContact CB-CE2 4.42Å; E245-F249 WeakPolarHBondContact O-CD2 3.41Å; E245-F249 PolarHBondContact O-N 3.25Å
246	A	95.3	Very high	94.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-52.1	-53.5	169.9	0	0	0	0	0	110.8	K206 C209 D241 D243 L248 F249 T250	K206-A246 HydrophobicContact CB-CB 4.47Å; C209-A246 HydrophobicContact CB-CB 4.31Å; D241-A246 HydrophobicContact CB-CB 4.01Å; D243-A246 HydrophobicContact CB-CB 3.89Å; D243-A246 PolarHBondContact OD2-N 2.8Å; A246-L248 PolarHBondContact O-N 3.26Å; A246-F249 PolarHBondContact O-N 3.34Å; A246-T250 PolarHBondContact O-N 3.48Å; A246-T250 PolarHBondContact O-OG1 3.42Å
247	R	94.9	Very high	94.1	Very high	97 Å²	97	45 Å²	45	37%	0.366	22%	0.224	S	C	.	.	H	α-helix	trans	-59	-29.7	174.4	-77	-177.6	-73.7	175.5	-10	114.1	G238 I239 D241 A242 D243 E245 R251	G238-R247 WeakPolarHBondContact O-CA 3.32Å; G238-R247 VanDerWaalsContact O-CG 3.23Å; G238-R247 WeakPolarHBondContact O-CG 3.31Å; I239-R247 WeakPolarHBondContact O-CG 3.46Å; D241-R247 HydrophobicContact CB-CG 4.31Å; D241-R247 WeakPolarHBondContact O-CD 3.4Å; D241-R247 PolarHBondContact O-NE 3.45Å; A242-R247 PolarHBondContact O-NH2 3.27Å; D243-R247 WeakPolarHBondContact O-CG 3.24Å; D243-R247 PolarHBondContact O-N 3.02Å; D243-R247 PolarHBondContact O-NE 3.39Å; E245-R247 VanDerWaalsContact C-N 3.34Å; E245-R247 PolarHBondContact O-N 3.31Å; R247-R251 WeakPolarHBondContact O-CG 3.46Å; R247-R251 PolarHBondContact O-N 3.38Å; R247-R251 PolarHBondContact O-NH1 3.23Å
248	L	93.6	Very high	94.1	Very high	71 Å²	71	42.1 Å²	42.1	37%	0.372	21%	0.214	S	C	.	.	H	α-helix	trans	-74.5	-43.9	177.4	-177.7	144.5	0	0	0	111.2	Q244 E245 A246 R251 R252	Q244-L248 WeakPolarHBondContact O-CB 3.3Å; Q244-L248 PolarHBondContact O-N 3.46Å; Q244-L248 VanDerWaalsContact O-N 3.09Å; E245-L248 WeakPolarHBondContact O-CA 3.26Å; E245-L248 WeakPolarHBondContact O-CB 3.22Å; E245-L248 PolarHBondContact O-N 2.8Å; A246-L248 PolarHBondContact O-N 3.26Å; L248-R251 PolarHBondContact O-N 2.69Å; L248-R252 HydrophobicContact CD2-CG 4.3Å; L248-R252 WeakPolarHBondContact O-CG 3.3Å; L248-R252 PolarHBondContact O-N 3.44Å
249	F	94.8	Very high	94	Very high	23 Å²	23	45.6 Å²	45.6	10%	0.101	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-42	175.8	-71.8	-61	0	0	0	112.7	K206 C209 E210 E245 A246 R251 R252 S253	K206-F249 HydrophobicContact CD-CE2 4.47Å; K206-F249 HydrophobicContact CG-CD2 4.09Å; K206-F249 HydrophobicContact CG-CE2 3.91Å; C209-F249 HydrophobicContact CB-CB 4.14Å; E210-F249 HydrophobicContact CB-CB 4.29Å; E210-F249 HydrophobicContact CB-CD1 3.94Å; E210-F249 HydrophobicContact CB-CD2 3.93Å; E210-F249 HydrophobicContact CB-CE1 4.22Å; E210-F249 HydrophobicContact CB-CE2 4.2Å; E210-F249 HydrophobicContact CB-CG 3.8Å; E210-F249 HydrophobicContact CB-CZ 4.34Å; E210-F249 HydrophobicContact CG-CD1 3.83Å; E210-F249 HydrophobicContact CG-CD2 4.48Å; E210-F249 HydrophobicContact CG-CE1 3.75Å; E210-F249 HydrophobicContact CG-CE2 4.41Å; E210-F249 HydrophobicContact CG-CG 4.22Å; E210-F249 HydrophobicContact CG-CZ 4.05Å; E245-F249 HydrophobicContact CB-CE2 4.42Å; E245-F249 WeakPolarHBondContact O-CD2 3.41Å; E245-F249 PolarHBondContact O-N 3.25Å; A246-F249 PolarHBondContact O-N 3.34Å; F249-R251 PolarHBondContact O-N 2.68Å; F249-R252 WeakPolarHBondContact O-CB 3.33Å; F249-R252 PolarHBondContact O-N 3.42Å; F249-R252 VanDerWaalsContact O-N 3.1Å; F249-S253 PolarHBondContact O-N 3.48Å
250	T	95.3	Very high	93.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.3	-31.4	177.3	-37.3	0	0	0	0	112.6	L212 L235 G238 I239 A246 S253 F254	L212-T250 HydrophobicContact CD1-CG2 4.19Å; L235-T250 HydrophobicContact CB-CG2 4.47Å; L235-T250 HydrophobicContact CD2-CG2 3.62Å; G238-T250 VanDerWaalsContact C-OG1 3.23Å; G238-T250 VanDerWaalsContact CA-OG1 3.24Å; G238-T250 WeakPolarHBondContact CA-OG1 3.44Å; I239-T250 HydrophobicContact CD1-CG2 4.41Å; I239-T250 HydrophobicContact CG1-CG2 3.81Å; A246-T250 PolarHBondContact O-N 3.48Å; A246-T250 PolarHBondContact O-OG1 3.42Å; T250-S253 PolarHBondContact O-OG 2.82Å; T250-F254 PolarHBondContact O-N 3.24Å
251	R	94.3	Very high	93.9	Very high	41 Å²	41	45.1 Å²	45.1	16%	0.155	23%	0.233	C	C	.	.	H	α-helix	trans	-75.3	-36.7	172.2	-65.5	-166.6	-33	-75.6	-3.7	112.6	R247 L248 F249 S253 F254 P255 I280 D283	R247-R251 WeakPolarHBondContact O-CG 3.46Å; R247-R251 PolarHBondContact O-N 3.38Å; R247-R251 PolarHBondContact O-NH1 3.23Å; L248-R251 PolarHBondContact O-N 2.69Å; F249-R251 PolarHBondContact O-N 2.68Å; R251-S253 VanDerWaalsContact C-N 3.26Å; R251-S253 PolarHBondContact O-N 2.81Å; R251-F254 WeakPolarHBondContact O-CB 3.25Å; R251-F254 PolarHBondContact O-N 3.24Å; R251-F254 VanDerWaalsContact O-N 3.13Å; R251-P255 WeakPolarHBondContact O-CD 3.43Å; R251-I280 HydrophobicContact CG-CG1 3.88Å; R251-D283 IonicContact CZ-OD2 2.91Å; R251-D283 IonicContact NE-OD2 2.74Å; R251-D283 PolarHBondContact NE-OD2 2.97Å; R251-D283 IonicContact NH2-OD2 3.62Å; R251-D283 PolarHBondContact NH2-OD2 3.26Å
252	R	92.4	Very high	93.7	Very high	128 Å²	128	47.4 Å²	47.4	48%	0.483	25%	0.249	S	C	.	.	H	α-helix	trans	-61.8	-31.9	172.9	-74.3	172.4	48.7	151.4	0.3	113.1	E213 L248 F249 P255	E213-R252 VanDerWaalsContact CD-NH2 3.29Å; E213-R252 IonicContact OE1-CZ 2.71Å; E213-R252 IonicContact OE1-NE 3.05Å; E213-R252 IonicContact OE1-NH2 3.83Å; E213-R252 PolarHBondContact OE1-NH2 2.95Å; E213-R252 WeakPolarHBondContact OE2-CB 3.44Å; E213-R252 IonicContact OE2-CZ 3.79Å; E213-R252 VanDerWaalsContact OE2-CZ 3.25Å; E213-R252 IonicContact OE2-NE 2.74Å; E213-R252 PolarHBondContact OE2-NE 3.04Å; E213-R252 IonicContact OE2-NH2 3.8Å; E213-R252 PolarHBondContact OE2-NH2 3.47Å; L248-R252 HydrophobicContact CD2-CG 4.3Å; L248-R252 WeakPolarHBondContact O-CG 3.3Å; L248-R252 PolarHBondContact O-N 3.44Å; F249-R252 WeakPolarHBondContact O-CB 3.33Å; F249-R252 PolarHBondContact O-N 3.42Å; F249-R252 VanDerWaalsContact O-N 3.1Å; R252-P255 WeakPolarHBondContact O-CD 3.5Å
253	S	93.8	Very high	93.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-78.3	-18.1	175.3	74.3	0	0	0	0	113.5	F249 T250 R251 L256 F257	F249-S253 PolarHBondContact O-N 3.48Å; T250-S253 PolarHBondContact O-OG 2.82Å; R251-S253 VanDerWaalsContact C-N 3.26Å; R251-S253 PolarHBondContact O-N 2.81Å; S253-L256 WeakPolarHBondContact O-CB 3.46Å; S253-L256 PolarHBondContact O-N 3.3Å; S253-L256 VanDerWaalsContact O-N 3.12Å; S253-F257 PolarHBondContact O-N 3Å
254	F	94.2	Very high	93.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.6	-38.1	-176.2	-157.1	-90.6	0	0	0	115.1	L235 I239 T250 R251 L256 F257 V258 A265 F268 L269 I280 L284	L235-F254 HydrophobicContact CD1-CD2 4.35Å; L235-F254 HydrophobicContact CD1-CE2 4.39Å; L235-F254 HydrophobicContact CD2-CD2 4.43Å; I239-F254 HydrophobicContact CD1-CD2 4.43Å; T250-F254 PolarHBondContact O-N 3.24Å; R251-F254 WeakPolarHBondContact O-CB 3.25Å; R251-F254 PolarHBondContact O-N 3.24Å; R251-F254 VanDerWaalsContact O-N 3.13Å; F254-L256 PolarHBondContact O-N 3.28Å; F254-F257 HydrophobicContact CD2-CD1 4.09Å; F254-F257 AromaticContact CE2-CD1 3.65Å; F254-F257 HydrophobicContact CE2-CD1 3.65Å; F254-F257 HydrophobicContact CE2-CE1 4.11Å; F254-F257 AromaticContact CZ-CD1 3.95Å; F254-F257 HydrophobicContact CZ-CD1 3.95Å; F254-F257 HydrophobicContact CZ-CE1 4.33Å; F254-F257 WeakPolarHBondContact O-CB 3.42Å; F254-F257 PolarHBondContact O-N 2.73Å; F254-F257 VanDerWaalsContact O-N 3.13Å; F254-V258 HydrophobicContact CD1-CG2 3.74Å; F254-V258 HydrophobicContact CE1-CG2 3.52Å; F254-V258 HydrophobicContact CZ-CG2 4.46Å; F254-V258 PolarHBondContact O-N 3.33Å; F254-A265 HydrophobicContact CE1-CB 4.38Å; F254-A265 HydrophobicContact CZ-CB 4.19Å; F254-F268 AromaticContact CE2-CD1 3.49Å; F254-F268 HydrophobicContact CE2-CD1 3.49Å; F254-F268 VanDerWaalsContact CE2-CD1 3.49Å; F254-F268 AromaticContact CE2-CE1 3.65Å; F254-F268 HydrophobicContact CE2-CE1 3.65Å; F254-F268 HydrophobicContact CE2-CG 4.27Å; F254-F268 AromaticContact CZ-CD1 3.81Å; F254-F268 HydrophobicContact CZ-CD1 3.81Å; F254-F268 HydrophobicContact CZ-CE1 4.39Å; F254-L269 HydrophobicContact CE1-CD1 4.15Å; F254-L269 HydrophobicContact CE1-CD2 3.9Å; F254-L269 HydrophobicContact CE1-CG 3.96Å; F254-L269 HydrophobicContact CZ-CD2 3.98Å; F254-L269 HydrophobicContact CZ-CG 3.94Å; F254-I280 HydrophobicContact CB-CG2 4.2Å; F254-I280 HydrophobicContact CD1-CG2 3.28Å; F254-I280 HydrophobicContact CD2-CG2 4.48Å; F254-I280 HydrophobicContact CE1-CG2 3.7Å; F254-I280 HydrophobicContact CG-CG2 3.72Å; F254-I280 HydrophobicContact CZ-CG2 4.46Å; F254-L284 HydrophobicContact CD1-CD1 4.06Å; F254-L284 HydrophobicContact CD1-CD2 4.33Å; F254-L284 HydrophobicContact CD1-CG 4.42Å; F254-L284 HydrophobicContact CE1-CD1 4.16Å
255	P	93	Very high	93.5	Very high	21 Å²	21	43.9 Å²	43.9	14%	0.136	22%	0.216	C	C	.	.	H	α-helix	trans	-52.2	-37.9	167.6	-30.1	34.5	0	0	0	114.4	R251 R252 A259 L284 A287 L289	R251-P255 WeakPolarHBondContact O-CD 3.43Å; R252-P255 WeakPolarHBondContact O-CD 3.5Å; P255-A259 WeakPolarHBondContact O-CB 3.22Å; P255-A259 PolarHBondContact O-N 3.02Å; P255-L284 HydrophobicContact CB-CD2 4.16Å; P255-L284 HydrophobicContact CG-CD2 3.99Å; P255-A287 HydrophobicContact CB-CB 4.14Å; P255-A287 HydrophobicContact CG-CB 4.02Å; P255-L289 HydrophobicContact CB-CD1 3.76Å; P255-L289 VanDerWaalsContact O-CD1 3.26Å; P255-L289 WeakPolarHBondContact O-CD1 3.45Å
256	L	93.8	Very high	93.4	Very high	52 Å²	52	41.7 Å²	41.7	27%	0.272	21%	0.207	S	C	.	.	H	α-helix	trans	-74	-33.9	178.3	-58.5	168	0	0	0	111.8	E213 F216 R217 S253 F254 K260	E213-L256 HydrophobicContact CG-CD1 3.82Å; E213-L256 VanDerWaalsContact O-CD1 3.31Å; E213-L256 WeakPolarHBondContact O-CD1 3.37Å; F216-L256 HydrophobicContact CB-CB 3.56Å; F216-L256 HydrophobicContact CB-CD1 4.33Å; R217-L256 HydrophobicContact CB-CD1 3.99Å; S253-L256 WeakPolarHBondContact O-CB 3.46Å; S253-L256 PolarHBondContact O-N 3.3Å; S253-L256 VanDerWaalsContact O-N 3.12Å; F254-L256 PolarHBondContact O-N 3.28Å; L256-K260 PolarHBondContact O-N 3.06Å
257	F	94.5	Very high	93.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.8	-47.8	171.6	179.6	-115.8	0	0	0	111.5	F216 L228 Q232 L235 S253 F254 A259 K260 F261 A265 F268	F216-F257 HydrophobicContact CD1-CB 4.46Å; F216-F257 HydrophobicContact CD1-CD2 4.26Å; F216-F257 HydrophobicContact CD2-CB 4.48Å; F216-F257 HydrophobicContact CE1-CB 4.42Å; F216-F257 AromaticContact CE1-CD2 3.61Å; F216-F257 HydrophobicContact CE1-CD2 3.61Å; F216-F257 HydrophobicContact CE1-CE2 4.38Å; F216-F257 HydrophobicContact CE1-CG 4.44Å; F216-F257 HydrophobicContact CE2-CB 4.44Å; F216-F257 HydrophobicContact CZ-CB 4.41Å; F216-F257 AromaticContact CZ-CD2 3.85Å; F216-F257 HydrophobicContact CZ-CD2 3.85Å; F216-F257 HydrophobicContact CZ-CG 4.42Å; L228-F257 HydrophobicContact CD1-CE2 3.68Å; L228-F257 HydrophobicContact CD1-CZ 4.22Å; Q232-F257 HydrophobicContact CG-CZ 4.01Å; L235-F257 HydrophobicContact CD1-CB 4.24Å; L235-F257 HydrophobicContact CD1-CD1 3.64Å; L235-F257 HydrophobicContact CD1-CD2 3.88Å; L235-F257 HydrophobicContact CD1-CE1 3.87Å; L235-F257 HydrophobicContact CD1-CE2 4.11Å; L235-F257 HydrophobicContact CD1-CG 3.65Å; L235-F257 HydrophobicContact CD1-CZ 4.11Å; S253-F257 PolarHBondContact O-N 3Å; F254-F257 HydrophobicContact CD2-CD1 4.09Å; F254-F257 AromaticContact CE2-CD1 3.65Å; F254-F257 HydrophobicContact CE2-CD1 3.65Å; F254-F257 HydrophobicContact CE2-CE1 4.11Å; F254-F257 AromaticContact CZ-CD1 3.95Å; F254-F257 HydrophobicContact CZ-CD1 3.95Å; F254-F257 HydrophobicContact CZ-CE1 4.33Å; F254-F257 WeakPolarHBondContact O-CB 3.42Å; F254-F257 PolarHBondContact O-N 2.73Å; F254-F257 VanDerWaalsContact O-N 3.13Å; F257-A259 VanDerWaalsContact C-N 3.35Å; F257-A259 PolarHBondContact O-N 3.25Å; F257-K260 PolarHBondContact O-N 2.58Å; F257-K260 VanDerWaalsContact O-N 3.17Å; F257-F261 HydrophobicContact CD2-CB 4.46Å; F257-F261 AromaticContact CD2-CD2 3.79Å; F257-F261 HydrophobicContact CD2-CD2 3.79Å; F257-F261 HydrophobicContact CE2-CB 4.11Å; F257-F261 AromaticContact CE2-CD2 3.74Å; F257-F261 HydrophobicContact CE2-CD2 3.74Å; F257-F261 HydrophobicContact CE2-CG 4.29Å; F257-F261 HydrophobicContact CZ-CB 4.42Å; F257-F261 PolarHBondContact O-N 3.26Å; F257-A265 HydrophobicContact CD1-CB 3.86Å; F257-A265 HydrophobicContact CE1-CB 3.78Å; F257-F268 HydrophobicContact CE1-CB 4.39Å; F257-F268 HydrophobicContact CE1-CG 4.47Å
258	V	93.7	Very high	93.2	Very high	12 Å²	12	42 Å²	42	7%	0.073	22%	0.216	C	C	.	.	H	α-helix	trans	-55.8	-46.6	173.5	162.3	0	0	0	0	111.8	F254 K260 F261 A265 L284 L289 I293	F254-V258 HydrophobicContact CD1-CG2 3.74Å; F254-V258 HydrophobicContact CE1-CG2 3.52Å; F254-V258 HydrophobicContact CZ-CG2 4.46Å; F254-V258 PolarHBondContact O-N 3.33Å; V258-K260 PolarHBondContact O-N 3.17Å; V258-F261 PolarHBondContact O-N 3.31Å; V258-A265 HydrophobicContact CB-CB 4.44Å; V258-A265 HydrophobicContact CG2-CB 3.67Å; V258-L284 HydrophobicContact CB-CD2 4.14Å; V258-L284 HydrophobicContact CG1-CD2 4.35Å; V258-L284 HydrophobicContact CG2-CD1 4.13Å; V258-L284 HydrophobicContact CG2-CD2 3.8Å; V258-L289 HydrophobicContact CB-CD1 4.47Å; V258-L289 HydrophobicContact CG1-CB 4.46Å; V258-L289 HydrophobicContact CG1-CD1 4.12Å; V258-I293 HydrophobicContact CG1-CD1 3.84Å; V258-I293 HydrophobicContact CG2-CD1 4.34Å
259	A	91.3	Very high	93	Very high	72 Å²	72	39 Å²	39	60%	0.595	20%	0.2	S	C	*	.	H	α-helix	trans	-66.8	-15.1	-178.7	0	0	0	0	0	114.3	P255 F257	P255-A259 WeakPolarHBondContact O-CB 3.22Å; P255-A259 PolarHBondContact O-N 3.02Å; F257-A259 VanDerWaalsContact C-N 3.35Å; F257-A259 PolarHBondContact O-N 3.25Å
260	K	91.7	Very high	92.8	Very high	52 Å²	52	43.6 Å²	43.6	23%	0.226	22%	0.222	C	C	.	.	H	α-helix	trans	-104.4	-33	175	-69.7	-178.2	174.7	-87.9	0	113.2	F216 W219 L221 L224 L256 F257 V258	F216-K260 WeakPolarHBondContact O-CE 3.27Å; W219-K260 PolarHBondContact O-NZ 2.92Å; L221-K260 HydrophobicContact CD2-CB 3.72Å; L221-K260 HydrophobicContact CD2-CD 3.92Å; L221-K260 HydrophobicContact CD2-CG 3.67Å; L224-K260 HydrophobicContact CD1-CD 3.47Å; L224-K260 VanDerWaalsContact CD1-CD 3.47Å; L256-K260 PolarHBondContact O-N 3.06Å; F257-K260 PolarHBondContact O-N 2.58Å; F257-K260 VanDerWaalsContact O-N 3.17Å; V258-K260 PolarHBondContact O-N 3.17Å
261	F	94	Very high	92.6	Very high	10 Å²	10	50 Å²	50	4%	0.044	26%	0.256	C	S	.	.			trans	-138.1	64.4	-168.6	-59	-59.7	0	0	0	112	L221 L224 E225 L228 F257 V258 E263 Q264 A265	L221-F261 HydrophobicContact CD2-CZ 4.35Å; L224-F261 HydrophobicContact CB-CE2 3.85Å; L224-F261 HydrophobicContact CB-CZ 3.75Å; E225-F261 HydrophobicContact CG-CE1 3.55Å; E225-F261 HydrophobicContact CG-CZ 3.93Å; L228-F261 HydrophobicContact CD1-CD2 3.95Å; L228-F261 HydrophobicContact CD1-CE2 4.18Å; L228-F261 HydrophobicContact CD1-CG 4.13Å; F257-F261 HydrophobicContact CD2-CB 4.46Å; F257-F261 AromaticContact CD2-CD2 3.79Å; F257-F261 HydrophobicContact CD2-CD2 3.79Å; F257-F261 HydrophobicContact CE2-CB 4.11Å; F257-F261 AromaticContact CE2-CD2 3.74Å; F257-F261 HydrophobicContact CE2-CD2 3.74Å; F257-F261 HydrophobicContact CE2-CG 4.29Å; F257-F261 HydrophobicContact CZ-CB 4.42Å; F257-F261 PolarHBondContact O-N 3.26Å; V258-F261 PolarHBondContact O-N 3.31Å; F261-E263 PolarHBondContact O-N 3.22Å; F261-Q264 HydrophobicContact CB-CB 4.36Å; F261-Q264 PolarHBondContact O-N 2.68Å; F261-A265 WeakPolarHBondContact O-CB 3.08Å; F261-A265 PolarHBondContact O-N 2.69Å
262	P	92.1	Very high	92.4	Very high	69 Å²	69	48.9 Å²	48.9	45%	0.448	25%	0.253	S	S	.	.	H	α-helix	trans	-62.5	-45	-170.5	23.5	-33.7	0	0	0	113.1	A265 N266	P262-A265 PolarHBondContact O-N 2.91Å; P262-N266 PolarHBondContact O-N 3.04Å; P262-N266 PolarHBondContact O-ND2 3.33Å
263	E	91.9	Very high	92.2	Very high	136 Å²	136	47.3 Å²	47.3	64%	0.636	25%	0.254	S	S	*	.	H	α-helix	trans	-63	-46	178.7	-60.8	179.5	157	0	0	111.7	F261 A265 N266 L267	F261-E263 PolarHBondContact O-N 3.22Å; E263-A265 VanDerWaalsContact C-N 3.32Å; E263-A265 PolarHBondContact O-N 3.35Å; E263-N266 WeakPolarHBondContact O-CB 3.47Å; E263-N266 PolarHBondContact O-N 3.08Å; E263-L267 WeakPolarHBondContact O-CG 3.47Å; E263-L267 PolarHBondContact O-N 3.49Å
264	Q	93.1	Very high	92	Very high	53 Å²	53	50.5 Å²	50.5	25%	0.248	28%	0.276	C	S	.	.	H	α-helix	trans	-75.5	-25.4	-176.7	-54.4	79.1	13	0	0	111.1	L228 F261 F268	L228-Q264 HydrophobicContact CD2-CB 4.33Å; L228-Q264 HydrophobicContact CD2-CG 4.02Å; F261-Q264 HydrophobicContact CB-CB 4.36Å; F261-Q264 PolarHBondContact O-N 2.68Å; Q264-F268 WeakPolarHBondContact O-CB 3.41Å; Q264-F268 PolarHBondContact O-N 3.18Å
265	A	92.7	Very high	91.8	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-71.7	-37.9	167.7	0	0	0	0	0	112.6	F254 F257 V258 F261 P262 E263 F268 L269	F254-A265 HydrophobicContact CE1-CB 4.38Å; F254-A265 HydrophobicContact CZ-CB 4.19Å; F257-A265 HydrophobicContact CD1-CB 3.86Å; F257-A265 HydrophobicContact CE1-CB 3.78Å; V258-A265 HydrophobicContact CB-CB 4.44Å; V258-A265 HydrophobicContact CG2-CB 3.67Å; F261-A265 WeakPolarHBondContact O-CB 3.08Å; F261-A265 PolarHBondContact O-N 2.69Å; P262-A265 PolarHBondContact O-N 2.91Å; E263-A265 VanDerWaalsContact C-N 3.32Å; E263-A265 PolarHBondContact O-N 3.35Å; A265-F268 WeakPolarHBondContact O-CB 3.46Å; A265-F268 PolarHBondContact O-N 3.05Å; A265-L269 WeakPolarHBondContact O-CB 3.14Å; A265-L269 WeakPolarHBondContact O-CG 3.37Å; A265-L269 PolarHBondContact O-N 3Å
266	N	91.3	Very high	91.6	Very high	38 Å²	38	60.8 Å²	60.8	20%	0.203	32%	0.322	C	S	.	.	H	α-helix	trans	-61.7	-48.9	172.3	-71.2	-17	0	0	0	110.9	P262 E263 F268 L269 Q270	P262-N266 PolarHBondContact O-N 3.04Å; P262-N266 PolarHBondContact O-ND2 3.33Å; E263-N266 WeakPolarHBondContact O-CB 3.47Å; E263-N266 PolarHBondContact O-N 3.08Å; N266-F268 VanDerWaalsContact C-N 3.29Å; N266-F268 PolarHBondContact O-N 2.92Å; N266-L269 PolarHBondContact O-N 2.9Å; N266-Q270 WeakPolarHBondContact O-CB 3.26Å; N266-Q270 VanDerWaalsContact O-CG 3.29Å; N266-Q270 WeakPolarHBondContact O-CG 3.39Å; N266-Q270 PolarHBondContact O-N 3.3Å
267	L	92	Very high	91.5	Very high	100 Å²	100	61.7 Å²	61.7	52%	0.524	32%	0.322	S	S	.	.	H	α-helix	trans	-60.1	-37.7	173.4	-68.9	171.3	0	0	0	112.2	E263 N271	E263-L267 WeakPolarHBondContact O-CG 3.47Å; E263-L267 PolarHBondContact O-N 3.49Å; L267-N271 PolarHBondContact O-N 3.1Å; L267-N271 PolarHBondContact O-ND2 3.11Å
268	F	93.1	Very high	91.3	Very high	5 Å²	5	68 Å²	68	2%	0.022	35%	0.349	C	S	.	.	H	α-helix	trans	-65.1	-47.1	176.2	-171.8	-81.8	0	0	0	112	Q232 L235 R236 I239 F254 F257 Q264 A265 N266 Q270 N271 L272	Q232-F268 HydrophobicContact CB-CD2 4.22Å; Q232-F268 HydrophobicContact CB-CE2 4.09Å; Q232-F268 HydrophobicContact CG-CD2 4.01Å; Q232-F268 HydrophobicContact CG-CE2 4.32Å; Q232-F268 WeakPolarHBondContact O-CE2 3.44Å; L235-F268 HydrophobicContact CB-CE1 4.38Å; L235-F268 HydrophobicContact CB-CE2 3.85Å; L235-F268 HydrophobicContact CB-CZ 3.5Å; L235-F268 VanDerWaalsContact CB-CZ 3.5Å; R236-F268 HydrophobicContact CB-CZ 4.49Å; R236-F268 HydrophobicContact CG-CE2 3.6Å; R236-F268 HydrophobicContact CG-CZ 3.73Å; I239-F268 HydrophobicContact CD1-CE1 3.72Å; I239-F268 HydrophobicContact CD1-CZ 4.08Å; F254-F268 AromaticContact CE2-CD1 3.49Å; F254-F268 HydrophobicContact CE2-CD1 3.49Å; F254-F268 VanDerWaalsContact CE2-CD1 3.49Å; F254-F268 AromaticContact CE2-CE1 3.65Å; F254-F268 HydrophobicContact CE2-CE1 3.65Å; F254-F268 HydrophobicContact CE2-CG 4.27Å; F254-F268 AromaticContact CZ-CD1 3.81Å; F254-F268 HydrophobicContact CZ-CD1 3.81Å; F254-F268 HydrophobicContact CZ-CE1 4.39Å; F257-F268 HydrophobicContact CE1-CB 4.39Å; F257-F268 HydrophobicContact CE1-CG 4.47Å; Q264-F268 WeakPolarHBondContact O-CB 3.41Å; Q264-F268 PolarHBondContact O-N 3.18Å; A265-F268 WeakPolarHBondContact O-CB 3.46Å; A265-F268 PolarHBondContact O-N 3.05Å; N266-F268 VanDerWaalsContact C-N 3.29Å; N266-F268 PolarHBondContact O-N 2.92Å; F268-Q270 PolarHBondContact O-N 3.09Å; F268-N271 PolarHBondContact O-N 3.35Å; F268-L272 HydrophobicContact CD1-CD1 4.09Å; F268-L272 HydrophobicContact CD1-CG 4.3Å; F268-L272 HydrophobicContact CE1-CD1 3.85Å; F268-L272 HydrophobicContact CE1-CD2 4.34Å; F268-L272 HydrophobicContact CE1-CG 4.15Å; F268-L272 PolarHBondContact O-N 3.39Å
269	L	90.9	Very high	91.1	Very high	6 Å²	6	70.9 Å²	70.9	3%	0.031	36%	0.364	C	S	.	.	H	α-helix	trans	-61	-43.5	176.2	-73.6	172.3	0	0	0	111.3	F254 A265 N266 N271 L272 R277 I280 L284 I293	F254-L269 HydrophobicContact CE1-CD1 4.15Å; F254-L269 HydrophobicContact CE1-CD2 3.9Å; F254-L269 HydrophobicContact CE1-CG 3.96Å; F254-L269 HydrophobicContact CZ-CD2 3.98Å; F254-L269 HydrophobicContact CZ-CG 3.94Å; A265-L269 WeakPolarHBondContact O-CB 3.14Å; A265-L269 WeakPolarHBondContact O-CG 3.37Å; A265-L269 PolarHBondContact O-N 3Å; N266-L269 PolarHBondContact O-N 2.9Å; L269-N271 PolarHBondContact O-N 3.28Å; L269-L272 HydrophobicContact CD2-CD1 4.47Å; L269-L272 PolarHBondContact O-N 3.25Å; L269-R277 HydrophobicContact CB-CG 4.11Å; L269-R277 HydrophobicContact CD2-CG 4.05Å; L269-R277 WeakPolarHBondContact O-CD 3.48Å; L269-R277 PolarHBondContact O-NE 3.34Å; L269-R277 PolarHBondContact O-NH2 2.92Å; L269-I280 HydrophobicContact CD2-CB 4.13Å; L269-I280 HydrophobicContact CD2-CD1 4.44Å; L269-I280 HydrophobicContact CD2-CG2 3.83Å; L269-L284 HydrophobicContact CD1-CD1 4.32Å; L269-I293 HydrophobicContact CD1-CG2 4.32Å
270	Q	90	Very high	91.1	Very high	120 Å²	120	67.5 Å²	67.5	56%	0.561	34%	0.336	S	S	*	.	H	α-helix	trans	-57.8	-29.8	176.9	-75.3	174	5.1	0	0	113.3	N266 F268 R277	N266-Q270 WeakPolarHBondContact O-CB 3.26Å; N266-Q270 VanDerWaalsContact O-CG 3.29Å; N266-Q270 WeakPolarHBondContact O-CG 3.39Å; N266-Q270 PolarHBondContact O-N 3.3Å; F268-Q270 PolarHBondContact O-N 3.09Å; Q270-R277 PolarHBondContact O-NH2 3.16Å
271	N	90.9	Very high	91	Very high	134 Å²	134	68.3 Å²	68.3	72%	0.717	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	3.3	177.6	-74.9	-75.9	0	0	0	114.5	L267 F268 L269	L267-N271 PolarHBondContact O-N 3.1Å; L267-N271 PolarHBondContact O-ND2 3.11Å; F268-N271 PolarHBondContact O-N 3.35Å; L269-N271 PolarHBondContact O-N 3.28Å
272	L	89.6	Confident	90.8	Very high	18 Å²	18	74.5 Å²	74.5	9%	0.094	37%	0.367	C	S	.	.	S	Bend	trans	-95.4	147.4	173.7	-74.3	-179.2	0	0	0	113.3	I239 F268 L269 K276 R277 I280	I239-L272 HydrophobicContact CD1-CD1 4.37Å; F268-L272 HydrophobicContact CD1-CD1 4.09Å; F268-L272 HydrophobicContact CD1-CG 4.3Å; F268-L272 HydrophobicContact CE1-CD1 3.85Å; F268-L272 HydrophobicContact CE1-CD2 4.34Å; F268-L272 HydrophobicContact CE1-CG 4.15Å; F268-L272 PolarHBondContact O-N 3.39Å; L269-L272 HydrophobicContact CD2-CD1 4.47Å; L269-L272 PolarHBondContact O-N 3.25Å; L272-K276 HydrophobicContact CD2-CD 4.44Å; L272-R277 HydrophobicContact CB-CB 4.41Å; L272-R277 PolarHBondContact O-NE 3Å; L272-R277 PolarHBondContact O-NH2 2.97Å; L272-I280 HydrophobicContact CD1-CD1 3.49Å; L272-I280 VanDerWaalsContact CD1-CD1 3.49Å
273	D	89.6	Confident	90.6	Very high	95 Å²	95	73.4 Å²	73.4	51%	0.508	36%	0.358	S	S	.	.			trans	-46.6	135.9	168	-54	-59.1	0	0	0	111.6	Q275 K276 R277	D273-Q275 PolarHBondContact O-N 3.27Å; D273-K276 HydrophobicContact CB-CB 4.39Å; D273-K276 HydrophobicContact CB-CD 4.12Å; D273-K276 HydrophobicContact CB-CG 4.21Å; D273-K276 PolarHBondContact O-N 3.4Å; D273-K276 WeakPolarHBondContact OD2-CD 3.36Å; D273-K276 WeakPolarHBondContact OD2-CE 3.46Å; D273-K276 IonicContact OD2-NZ 2.7Å; D273-K276 PolarHBondContact OD2-NZ 3.05Å; D273-R277 PolarHBondContact O-N 3.08Å
274	S	88.2	Confident	90.4	Very high	67 Å²	67	67.2 Å²	67.2	47%	0.469	33%	0.329	S	S	.	.	H	α-helix	trans	-52.9	-35.6	-175.5	-171.3	0	0	0	0	113.5	K278	S274-K278 WeakPolarHBondContact O-CB 3.38Å; S274-K278 WeakPolarHBondContact O-CD 3.3Å; S274-K278 VanDerWaalsContact O-CG 3.28Å; S274-K278 WeakPolarHBondContact O-CG 3.36Å; S274-K278 PolarHBondContact O-N 3.45Å; S274-K278 WeakPolarHBondContact OG-CE 3.23Å; S274-K278 PolarHBondContact OG-NZ 3.42Å
275	Q	90	Very high	90.1	Very high	173 Å²	173	70 Å²	70	81%	0.808	34%	0.344	S	S	*	.	H	α-helix	trans	-69.6	-39.5	176.7	-177.8	177.7	-30.6	0	0	113.2	D273 L279	D273-Q275 PolarHBondContact O-N 3.27Å; Q275-L279 PolarHBondContact O-N 2.94Å
276	K	89.6	Confident	89.6	Confident	65 Å²	65	74.2 Å²	74.2	28%	0.283	38%	0.379	S	S	.	.	H	α-helix	trans	-69.3	-44.3	176.2	-67.6	174.6	-176.6	162.8	0	110.2	I239 S240 L272 D273 L279 I280	I239-K276 HydrophobicContact CG2-CB 4.31Å; I239-K276 HydrophobicContact CG2-CD 4.01Å; I239-K276 HydrophobicContact CG2-CG 4.34Å; S240-K276 PolarHBondContact OG-NZ 2.81Å; S240-K276 VanDerWaalsContact OG-NZ 3.17Å; L272-K276 HydrophobicContact CD2-CD 4.44Å; D273-K276 HydrophobicContact CB-CB 4.39Å; D273-K276 HydrophobicContact CB-CD 4.12Å; D273-K276 HydrophobicContact CB-CG 4.21Å; D273-K276 PolarHBondContact O-N 3.4Å; D273-K276 WeakPolarHBondContact OD2-CD 3.36Å; D273-K276 WeakPolarHBondContact OD2-CE 3.46Å; D273-K276 IonicContact OD2-NZ 2.7Å; D273-K276 PolarHBondContact OD2-NZ 3.05Å; K276-L279 PolarHBondContact O-N 3.38Å; K276-I280 WeakPolarHBondContact O-CG1 3.33Å; K276-I280 PolarHBondContact O-N 3.44Å
277	R	91.7	Very high	89	Confident	71 Å²	71	75 Å²	75	27%	0.268	39%	0.391	S	S	.	.	H	α-helix	trans	-56.5	-54.7	178	-159.7	-167.1	-54.9	-158.9	-6.8	111.7	L269 Q270 L272 D273 L279 I280 E281	L269-R277 HydrophobicContact CB-CG 4.11Å; L269-R277 HydrophobicContact CD2-CG 4.05Å; L269-R277 WeakPolarHBondContact O-CD 3.48Å; L269-R277 PolarHBondContact O-NE 3.34Å; L269-R277 PolarHBondContact O-NH2 2.92Å; Q270-R277 PolarHBondContact O-NH2 3.16Å; L272-R277 HydrophobicContact CB-CB 4.41Å; L272-R277 PolarHBondContact O-NE 3Å; L272-R277 PolarHBondContact O-NH2 2.97Å; D273-R277 PolarHBondContact O-N 3.08Å; R277-L279 PolarHBondContact O-N 3.1Å; R277-L279 VanDerWaalsContact O-N 3.17Å; R277-I280 CarbonylContact O-C 3.6Å; R277-I280 PolarHBondContact O-N 2.91Å; R277-E281 WeakPolarHBondContact CD-OE1 3.44Å; R277-E281 HydrophobicContact CG-CG 4.33Å; R277-E281 VanDerWaalsContact CG-OE1 3.24Å; R277-E281 WeakPolarHBondContact CG-OE1 3.4Å; R277-E281 WeakPolarHBondContact O-CG 3.4Å; R277-E281 PolarHBondContact O-N 3.36Å
278	K	90.1	Very high	88.4	Confident	131 Å²	131	73.1 Å²	73.1	57%	0.57	40%	0.395	S	S	*	.	H	α-helix	trans	-57.8	-30.9	178.2	-75.8	168.2	177.1	161.5	0	114.3	S274 E281 K282	S274-K278 WeakPolarHBondContact O-CB 3.38Å; S274-K278 WeakPolarHBondContact O-CD 3.3Å; S274-K278 VanDerWaalsContact O-CG 3.28Å; S274-K278 WeakPolarHBondContact O-CG 3.36Å; S274-K278 PolarHBondContact O-N 3.45Å; S274-K278 WeakPolarHBondContact OG-CE 3.23Å; S274-K278 PolarHBondContact OG-NZ 3.42Å; K278-E281 VanDerWaalsContact CA-OE2 3.27Å; K278-E281 WeakPolarHBondContact CA-OE2 3.41Å; K278-K282 VanDerWaalsContact O-CB 3.3Å; K278-K282 WeakPolarHBondContact O-CB 3.49Å; K278-K282 PolarHBondContact O-N 3.18Å; K278-K282 VanDerWaalsContact O-N 3.14Å
279	L	90.2	Very high	87.3	Confident	74 Å²	74	75.7 Å²	75.7	39%	0.387	41%	0.409	S	S	.	.	H	α-helix	trans	-73.3	-37	175.9	-172.1	62.6	0	0	0	111.8	Q275 K276 R277 D283	Q275-L279 PolarHBondContact O-N 2.94Å; K276-L279 PolarHBondContact O-N 3.38Å; R277-L279 PolarHBondContact O-N 3.1Å; R277-L279 VanDerWaalsContact O-N 3.17Å; L279-D283 VanDerWaalsContact O-CG 3.29Å; L279-D283 PolarHBondContact O-N 3.14Å
280	I	91.1	Very high	85.6	Confident	1 Å²	1	79 Å²	79	1%	0.005	43%	0.433	C	S	.	.	H	α-helix	trans	-74.9	-43.6	176.3	-63.1	162.7	0	0	0	111	I239 R251 F254 L269 L272 K276 R277 K282 D283 L284	I239-I280 HydrophobicContact CD1-CD1 3.73Å; I239-I280 HydrophobicContact CG1-CD1 4.29Å; I239-I280 HydrophobicContact CG2-CD1 4.31Å; R251-I280 HydrophobicContact CG-CG1 3.88Å; F254-I280 HydrophobicContact CB-CG2 4.2Å; F254-I280 HydrophobicContact CD1-CG2 3.28Å; F254-I280 HydrophobicContact CD2-CG2 4.48Å; F254-I280 HydrophobicContact CE1-CG2 3.7Å; F254-I280 HydrophobicContact CG-CG2 3.72Å; F254-I280 HydrophobicContact CZ-CG2 4.46Å; L269-I280 HydrophobicContact CD2-CB 4.13Å; L269-I280 HydrophobicContact CD2-CD1 4.44Å; L269-I280 HydrophobicContact CD2-CG2 3.83Å; L272-I280 HydrophobicContact CD1-CD1 3.49Å; L272-I280 VanDerWaalsContact CD1-CD1 3.49Å; K276-I280 WeakPolarHBondContact O-CG1 3.33Å; K276-I280 PolarHBondContact O-N 3.44Å; R277-I280 CarbonylContact O-C 3.6Å; R277-I280 PolarHBondContact O-N 2.91Å; I280-K282 VanDerWaalsContact C-N 3.27Å; I280-K282 PolarHBondContact O-N 2.82Å; I280-D283 CarbonylContact O-C 3.34Å; I280-D283 PolarHBondContact O-N 3.1Å; I280-D283 VanDerWaalsContact O-N 3.08Å; I280-L284 HydrophobicContact CG2-CD1 4Å; I280-L284 HydrophobicContact CG2-CG 4.33Å; I280-L284 WeakPolarHBondContact O-CB 3.41Å; I280-L284 WeakPolarHBondContact O-CG 3.39Å; I280-L284 PolarHBondContact O-N 2.82Å
281	E	89.8	Confident	83.5	Confident	69 Å²	69	82.6 Å²	82.6	32%	0.322	45%	0.45	S	S	.	.	H	α-helix	trans	-54.8	-43.8	173.5	-70.9	164.1	168.5	0	0	111	R277 K278 L284 I285	R277-E281 WeakPolarHBondContact CD-OE1 3.44Å; R277-E281 HydrophobicContact CG-CG 4.33Å; R277-E281 VanDerWaalsContact CG-OE1 3.24Å; R277-E281 WeakPolarHBondContact CG-OE1 3.4Å; R277-E281 WeakPolarHBondContact O-CG 3.4Å; R277-E281 PolarHBondContact O-N 3.36Å; K278-E281 VanDerWaalsContact CA-OE2 3.27Å; K278-E281 WeakPolarHBondContact CA-OE2 3.41Å; E281-L284 PolarHBondContact O-N 3.04Å; E281-I285 WeakPolarHBondContact O-CD1 3.37Å; E281-I285 VanDerWaalsContact O-CG1 3.27Å; E281-I285 WeakPolarHBondContact O-CG1 3.45Å; E281-I285 PolarHBondContact O-N 3.28Å
282	K	89.4	Confident	81.3	Confident	139 Å²	139	79.2 Å²	79.2	60%	0.604	45%	0.447	S	S	*	.	H	α-helix	trans	-62	-45.1	173.7	179.4	-174.5	172.3	-172	0	112.8	K278 I280 L284 I285 A286	K278-K282 VanDerWaalsContact O-CB 3.3Å; K278-K282 WeakPolarHBondContact O-CB 3.49Å; K278-K282 PolarHBondContact O-N 3.18Å; K278-K282 VanDerWaalsContact O-N 3.14Å; I280-K282 VanDerWaalsContact C-N 3.27Å; I280-K282 PolarHBondContact O-N 2.82Å; K282-L284 VanDerWaalsContact C-N 3.3Å; K282-L284 PolarHBondContact O-N 3.48Å; K282-I285 PolarHBondContact O-N 3.39Å; K282-A286 PolarHBondContact O-N 3.28Å
283	D	87.1	Confident	79.3	Confident	47 Å²	47	80.9 Å²	80.9	25%	0.251	46%	0.455	S	S	.	.	H	α-helix	trans	-69.4	-29	-179.9	-69.8	-10.8	0	0	0	111	R251 L279 I280 A287	R251-D283 IonicContact CZ-OD2 2.91Å; R251-D283 IonicContact NE-OD2 2.74Å; R251-D283 PolarHBondContact NE-OD2 2.97Å; R251-D283 IonicContact NH2-OD2 3.62Å; R251-D283 PolarHBondContact NH2-OD2 3.26Å; L279-D283 VanDerWaalsContact O-CG 3.29Å; L279-D283 PolarHBondContact O-N 3.14Å; I280-D283 CarbonylContact O-C 3.34Å; I280-D283 PolarHBondContact O-N 3.1Å; I280-D283 VanDerWaalsContact O-N 3.08Å; D283-A287 PolarHBondContact O-N 3.5Å; D283-A287 VanDerWaalsContact O-N 3.13Å
284	L	88.8	Confident	76.7	Confident	6 Å²	6	80.1 Å²	80.1	3%	0.031	47%	0.47	C	S	.	.	H	α-helix	trans	-70.7	-42.4	171.1	-74.7	167.3	0	0	0	113.2	F254 P255 V258 L269 I280 E281 K282 A286 A287 G288 L289 I293	F254-L284 HydrophobicContact CD1-CD1 4.06Å; F254-L284 HydrophobicContact CD1-CD2 4.33Å; F254-L284 HydrophobicContact CD1-CG 4.42Å; F254-L284 HydrophobicContact CE1-CD1 4.16Å; P255-L284 HydrophobicContact CB-CD2 4.16Å; P255-L284 HydrophobicContact CG-CD2 3.99Å; V258-L284 HydrophobicContact CB-CD2 4.14Å; V258-L284 HydrophobicContact CG1-CD2 4.35Å; V258-L284 HydrophobicContact CG2-CD1 4.13Å; V258-L284 HydrophobicContact CG2-CD2 3.8Å; L269-L284 HydrophobicContact CD1-CD1 4.32Å; I280-L284 HydrophobicContact CG2-CD1 4Å; I280-L284 HydrophobicContact CG2-CG 4.33Å; I280-L284 WeakPolarHBondContact O-CB 3.41Å; I280-L284 WeakPolarHBondContact O-CG 3.39Å; I280-L284 PolarHBondContact O-N 2.82Å; E281-L284 PolarHBondContact O-N 3.04Å; K282-L284 VanDerWaalsContact C-N 3.3Å; K282-L284 PolarHBondContact O-N 3.48Å; L284-A286 VanDerWaalsContact C-N 3.27Å; L284-A286 PolarHBondContact O-N 3.24Å; L284-A287 CarbonylContact O-C 3.38Å; L284-A287 WeakPolarHBondContact O-CA 3.43Å; L284-A287 WeakPolarHBondContact O-CB 3.19Å; L284-A287 PolarHBondContact O-N 2.86Å; L284-G288 PolarHBondContact O-N 3.31Å; L284-L289 HydrophobicContact CD2-CB 4.35Å; L284-L289 HydrophobicContact CD2-CD1 4.21Å; L284-L289 PolarHBondContact O-N 3.01Å; L284-L289 VanDerWaalsContact O-N 3.17Å; L284-I293 HydrophobicContact CD1-CD1 4.15Å
285	I	85.9	Confident	74.1	Confident	110 Å²	110	81.7 Å²	81.7	56%	0.564	49%	0.487	S	S	*	.	H	α-helix	trans	-60.6	-40.9	172.9	-69.8	161.8	0	0	0	110	E281 K282 A287 G288	E281-I285 WeakPolarHBondContact O-CD1 3.37Å; E281-I285 VanDerWaalsContact O-CG1 3.27Å; E281-I285 WeakPolarHBondContact O-CG1 3.45Å; E281-I285 PolarHBondContact O-N 3.28Å; K282-I285 PolarHBondContact O-N 3.39Å; I285-A287 PolarHBondContact O-N 3.15Å; I285-G288 PolarHBondContact O-N 3.12Å; I285-G288 VanDerWaalsContact O-N 3.12Å
286	A	82.5	Confident	71.4	Confident	89 Å²	89	76.6 Å²	76.6	74%	0.736	48%	0.481	S	S	*	.	H	α-helix	trans	-66.6	-22.8	174.3	0	0	0	0	0	113.7	K282 L284	K282-A286 PolarHBondContact O-N 3.28Å; L284-A286 VanDerWaalsContact C-N 3.27Å; L284-A286 PolarHBondContact O-N 3.24Å
287	A	79.5	Confident	68.8	Low	55 Å²	55	81.3 Å²	81.3	46%	0.455	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-5.4	172.9	0	0	0	0	0	113.9	P255 D283 L284 I285	P255-A287 HydrophobicContact CB-CB 4.14Å; P255-A287 HydrophobicContact CG-CB 4.02Å; D283-A287 PolarHBondContact O-N 3.5Å; D283-A287 VanDerWaalsContact O-N 3.13Å; L284-A287 CarbonylContact O-C 3.38Å; L284-A287 WeakPolarHBondContact O-CA 3.43Å; L284-A287 WeakPolarHBondContact O-CB 3.19Å; L284-A287 PolarHBondContact O-N 2.86Å; I285-A287 PolarHBondContact O-N 3.15Å
288	G	78	Confident	66.2	Low	60 Å²	60	84.4 Å²	84.4	62%	0.619	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	4.6	179.5	0	0	0	0	0	115.8	L284 I285 S290	L284-G288 PolarHBondContact O-N 3.31Å; I285-G288 PolarHBondContact O-N 3.12Å; I285-G288 VanDerWaalsContact O-N 3.12Å; G288-S290 PolarHBondContact O-N 3.48Å; G288-S290 VanDerWaalsContact O-N 3.08Å
289	L	69.5	Low	63.4	Low	59 Å²	59	82.6 Å²	82.6	31%	0.309	55%	0.546	S	S	.	.			trans	-87.6	46.3	-176	-60.3	179.6	0	0	0	112.7	P255 V258 L284	P255-L289 HydrophobicContact CB-CD1 3.76Å; P255-L289 VanDerWaalsContact O-CD1 3.26Å; P255-L289 WeakPolarHBondContact O-CD1 3.45Å; V258-L289 HydrophobicContact CB-CD1 4.47Å; V258-L289 HydrophobicContact CG1-CB 4.46Å; V258-L289 HydrophobicContact CG1-CD1 4.12Å; L284-L289 HydrophobicContact CD2-CB 4.35Å; L284-L289 HydrophobicContact CD2-CD1 4.21Å; L284-L289 PolarHBondContact O-N 3.01Å; L284-L289 VanDerWaalsContact O-N 3.17Å
290	S	55.8	Low	60.9	Low	77 Å²	77	84.9 Å²	84.9	54%	0.538	56%	0.563	S	S	.	*			trans	-92.9	-8.1	-172.7	-164.1	0	0	0	0	114.8	G288	G288-S290 PolarHBondContact O-N 3.48Å; G288-S290 VanDerWaalsContact O-N 3.08Å
291	E	45.8	Very low	58.3	Low	194 Å²	194	91.3 Å²	91.3	91%	0.907	60%	0.603	S	S	*	*	S	Bend	trans	-95.6	114.3	178.9	-64.5	-176.4	167.9	0	0	109.8
292	G	45.6	Very low	55.7	Low	64 Å²	64	91.7 Å²	91.7	66%	0.66	63%	0.625	S	S	*	*	S	Bend	trans	117.3	-6.7	176.4	0	0	0	0	0	117
293	I	46.8	Very low	53.4	Low	53 Å²	53	90.5 Å²	90.5	27%	0.272	63%	0.634	S	S	.	*	S	Bend	trans	-99.3	-8.5	-175.9	-65.5	-178.9	0	0	0	113.3	V258 L269 L284	V258-I293 HydrophobicContact CG1-CD1 3.84Å; V258-I293 HydrophobicContact CG2-CD1 4.34Å; L269-I293 HydrophobicContact CD1-CG2 4.32Å; L284-I293 HydrophobicContact CD1-CD1 4.15Å
294	G	36.2	Very low	51.2	Low	78 Å²	78	93.8 Å²	93.8	80%	0.804	66%	0.661	S	S	*	*	S	Bend	trans	-141.7	72.5	-176.9	0	0	0	0	0	113.8
295	A	33.6	Very low	48.7	Very low	100 Å²	100	104.4 Å²	104.4	83%	0.826	70%	0.7	S	S	*	*			trans	-147.3	35.3	175.4	0	0	0	0	0	113.1
296	G	32.7	Very low	46.5	Very low	67 Å²	67	103.4 Å²	103.4	69%	0.691	70%	0.703	S	S	*	*			trans	-88.1	144.4	158.9	0	0	0	0	0	109.5
297	D	35.4	Very low	44.5	Very low	163 Å²	163	108.3 Å²	108.3	87%	0.872	71%	0.711	S	S	*	*	S	Bend	trans	58.3	71.2	174.5	-56.1	-20.9	0	0	0	117
298	T	35.3	Very low	42.3	Very low	136 Å²	136	111.8 Å²	111.8	83%	0.834	73%	0.729	S	S	*	*				-179.6	126.1	115.5	-67.5	0	0	0	0	109.4
299	A	31.7	Very low	40.3	Very low	94 Å²	94	112.7 Å²	112.7	78%	0.777	74%	0.738	S	S	*	*			trans	-102.5	123.5	179.5	0	0	0	0	0	112.3
300	T	37.3	Very low	38.7	Very low	121 Å²	121	115.4 Å²	115.4	74%	0.742	76%	0.762	S	S	*	*			trans	-170.4	121.2	148.1	28.1	0	0	0	0	112.9
301	T	38.1	Very low	37.9	Very low	137 Å²	137	120.8 Å²	120.8	84%	0.84	78%	0.779	S	S	*	*			trans	51.9	132.7	141.1	61.4	0	0	0	0	123.6
302	G	35.4	Very low	37.2	Very low	76 Å²	76	115.7 Å²	115.7	78%	0.784	76%	0.764	S	S	*	*			trans	97.2	90.4	151.3	0	0	0	0	0	115.5
303	S	40.4	Very low	36.7	Very low	115 Å²	115	119.1 Å²	119.1	80%	0.804	77%	0.768	S	S	*	*				81.2	127.5	61.1	-167.1	0	0	0	0	115.1
304	S	40.9	Very low	36.1	Very low	116 Å²	116	123.8 Å²	123.8	81%	0.811	79%	0.792	S	S	*	*			trans	71.8	149.7	169	80	0	0	0	0	118.4
305	R	35.4	Very low	36	Very low	229 Å²	229	126.5 Å²	126.5	86%	0.864	79%	0.793	S	S	*	*			cis	-167.5	152.7	-29.4	-166.3	-178.2	172.3	159.8	-3.9	110.1
306	S	40.2	Very low	36	Very low	89 Å²	89	130.7 Å²	130.7	62%	0.622	79%	0.789	S	S	*	*			trans	60.4	107	150.7	48.9	0	0	0	0	123.1
307	Q	40	Very low	36.3	Very low	192 Å²	192	137 Å²	137	90%	0.897	80%	0.801	S	S	*	*				77.3	148.6	124	-71.3	-171.8	-12.4	0	0	122.6
308	P	35	Very low	36.3	Very low	128 Å²	128	134.1 Å²	134.1	83%	0.831	79%	0.793	S	S	*	*			trans	-103.1	165.6	-176.4	40.9	-35.8	0	0	0	114.8
309	G	36.1	Very low	36.3	Very low	78 Å²	78	132.5 Å²	132.5	80%	0.804	78%	0.783	S	S	*	*			trans	-144	149.7	171.5	0	0	0	0	0	112.6
310	S	35	Very low	36.6	Very low	117 Å²	117	136.6 Å²	136.6	82%	0.818	78%	0.783	S	S	*	*			trans	-89.2	175.4	-172.1	-63.8	0	0	0	0	114.4
311	Q	38.2	Very low	36.5	Very low	190 Å²	190	142.2 Å²	142.2	89%	0.888	79%	0.791	S	S	*	*			trans	83.6	151.8	169.6	-49	176.9	18.8	0	0	116
312	S	31.3	Very low	36.6	Very low	87 Å²	87	141.5 Å²	141.5	61%	0.608	79%	0.788	S	S	*	*			cis	-165.3	166.5	-31.9	61.7	0	0	0	0	110.7
313	N	35.2	Very low	36.9	Very low	136 Å²	136	145.3 Å²	145.3	73%	0.727	79%	0.791	S	S	*	*			trans	68.6	121.1	155.5	-62.2	-28.9	0	0	0	122.3
314	L	35.3	Very low	36.8	Very low	151 Å²	151	151 Å²	151	79%	0.791	80%	0.795	S	S	*	*			trans	18.7	136.8	136	-66.5	72.8	0	0	0	120.1
315	T	33.6	Very low	36.8	Very low	134 Å²	134	150.5 Å²	150.5	82%	0.822	79%	0.788	S	S	*	*				-174.2	155.7	99.1	-75.5	0	0	0	0	112.6
316	Y	33.8	Very low	37	Very low	189 Å²	189	145.8 Å²	145.8	74%	0.741	79%	0.785	S	S	*	*			trans	-71.2	151.4	176.6	-75.7	-110.4	0	0	0	113.6
317	Q	40	Very low	36.9	Very low	200 Å²	200	149.6 Å²	149.6	94%	0.935	80%	0.797	S	S	*	*			trans	-158.1	177	130.2	-114.5	173.7	54.9	0	0	112.6
318	S	33.8	Very low	36.8	Very low	101 Å²	101	143.7 Å²	143.7	71%	0.706	79%	0.788	S	S	*	*			trans	-154.1	164.2	-157.9	-172.7	0	0	0	0	114.9
319	T	36.6	Very low	37.1	Very low	102 Å²	102	143.7 Å²	143.7	63%	0.626	79%	0.786	S	S	*	*			trans	93.6	136.6	157.4	78.7	0	0	0	0	121.4
320	K	37.2	Very low	37.1	Very low	180 Å²	180	145.4 Å²	145.4	78%	0.783	79%	0.786	S	S	*	*			trans	82	102.2	145.6	-67.1	149.8	-170.6	168.3	0	123.1
321	R	34.8	Very low	37.3	Very low	239 Å²	239	144.3 Å²	144.3	90%	0.902	78%	0.778	S	S	*	*				63.8	175.5	121.1	-85.2	-173.3	172.9	-159.2	-0.6	119.6
322	P	41.2	Very low	37.2	Very low	122 Å²	122	143.3 Å²	143.3	79%	0.792	78%	0.778	S	S	*	*			cis	-123.8	-154.7	-5.3	28.4	-4.2	0	0	0	115.1
323	N	40.7	Very low	37.5	Very low	156 Å²	156	142.4 Å²	142.4	83%	0.834	78%	0.776	S	S	*	*			trans	-112.6	174.8	-168	-66.4	-29.1	0	0	0	115.2
324	R	38.8	Very low	37.7	Very low	236 Å²	236	143 Å²	143	89%	0.891	78%	0.779	S	S	*	*			trans	78.5	164.6	150.9	-91.1	-168.5	164.9	-163	-3.3	118.6
325	P	39.9	Very low	37.8	Very low	104 Å²	104	142 Å²	142	68%	0.675	78%	0.775	S	S	*	*			cis	-140.8	162.2	-27.5	37.3	-19.3	0	0	0	117.3
326	V	41	Very low	38.1	Very low	131 Å²	131	140.4 Å²	140.4	79%	0.794	76%	0.764	S	S	*	*			trans	12.3	128.6	138.5	-176.2	0	0	0	0	121
327	L	38.2	Very low	38.4	Very low	168 Å²	168	138.1 Å²	138.1	88%	0.88	77%	0.765	S	S	*	*				174.6	149.7	108.9	-161.5	68	0	0	0	113.1
328	G	38	Very low	38.3	Very low	68 Å²	68	139.7 Å²	139.7	70%	0.701	76%	0.763	S	S	*	*			trans	160.6	137.2	170.3	0	0	0	0	0	112.9
329	T	40.2	Very low	38.6	Very low	128 Å²	128	140.1 Å²	140.1	79%	0.785	77%	0.765	S	S	*	*			trans	-146.8	174.5	-160.5	53.2	0	0	0	0	116.7
330	S	37	Very low	38.6	Very low	114 Å²	114	146.5 Å²	146.5	80%	0.797	78%	0.778	S	S	*	*			trans	87.8	148	174.4	85.5	0	0	0	0	116.3
331	S	37.6	Very low	38.7	Very low	94 Å²	94	142.9 Å²	142.9	66%	0.657	77%	0.773	S	S	*	*			cis	-154.1	146.2	3	24.6	0	0	0	0	114.4
332	L	38.2	Very low	39.1	Very low	169 Å²	169	136.4 Å²	136.4	89%	0.885	76%	0.762	S	S	*	*			trans	51.2	151.6	147.6	-76.3	77.5	0	0	0	121.9
333	A	37.3	Very low	38.9	Very low	69 Å²	69	138.1 Å²	138.1	57%	0.57	76%	0.764	S	S	*	*			cis	-171.6	160	-21.6	0	0	0	0	0	112.8
334	N	37.8	Very low	38.8	Very low	149 Å²	149	136.2 Å²	136.2	80%	0.797	76%	0.757	S	S	*	*			trans	70	145.9	148.3	-71.6	-11.9	0	0	0	122.1
335	N	38.6	Very low	38.6	Very low	130 Å²	130	129.6 Å²	129.6	70%	0.695	75%	0.747	S	S	*	*			cis	-167	173.8	-23.8	-152.8	-8.3	0	0	0	113.2
336	T	39.2	Very low	38.3	Very low	99 Å²	99	131.8 Å²	131.8	61%	0.607	75%	0.749	S	S	*	*			trans	81.4	107.9	149.7	51.6	0	0	0	0	124.5
337	N	40.4	Very low	37.8	Very low	141 Å²	141	129.7 Å²	129.7	75%	0.754	73%	0.733	S	S	*	*				80.2	104.2	115.4	-61.7	-11.5	0	0	0	124.7
338	R	38.4	Very low	37.4	Very low	234 Å²	234	127.6 Å²	127.6	88%	0.883	72%	0.719	S	S	*	*				150.3	120.8	121.2	-87.1	178.8	170.2	175.8	-2.5	110.9
339	S	39.1	Very low	37.1	Very low	109 Å²	109	132.5 Å²	132.5	76%	0.762	72%	0.717	S	S	*	*				71	135.4	81.1	-58.1	0	0	0	0	113.6
340	R	38.1	Very low	36.6	Very low	237 Å²	237	132.6 Å²	132.6	89%	0.894	71%	0.713	S	S	*	*			cis	-154.5	-172.8	4.7	-122.2	-153.8	155.8	-165.9	-3.6	109.1
341	P	37.9	Very low	36.4	Very low	104 Å²	104	132.6 Å²	132.6	68%	0.675	71%	0.708	S	S	*	*			trans	-130.3	-135.4	-149.5	39.8	-15.2	0	0	0	112.7
342	P	44.3	Very low	36.1	Very low	103 Å²	103	134.2 Å²	134.2	67%	0.669	71%	0.714	S	S	*	*				-117.3	-147.7	-67.4	30.5	-9.1	0	0	0	111.5
343	L	35.9	Very low	35.8	Very low	158 Å²	158	129.7 Å²	129.7	83%	0.827	71%	0.708	S	S	*	*			trans	87.5	132.9	166.5	-55.9	168	0	0	0	114.7
344	T	38.8	Very low	35.4	Very low	115 Å²	115	137.2 Å²	137.2	71%	0.706	72%	0.722	S	S	*	*			cis	-136.7	165	-3	49.5	0	0	0	0	111.9
345	S	34.8	Very low	35.1	Very low	97 Å²	97	135 Å²	135	68%	0.678	72%	0.718	S	S	*	*			trans	27.3	136	136.8	-54.1	0	0	0	0	120.7
346	Q	33.7	Very low	34.5	Very low	150 Å²	150	139.4 Å²	139.4	70%	0.701	73%	0.726	S	S	*	*			cis	-161.6	160.9	6	-124.5	-176.2	-50.4	0	0	111.8
347	N	30.3	Very low	34.1	Very low	87 Å²	87	144.6 Å²	144.6	47%	0.465	74%	0.735	S	S	.	*				22.4	152.1	123.4	-61.7	19.3	0	0	0	120.2
348	E	30.4	Very low	33.7	Very low	125 Å²	125	145.3 Å²	145.3	58%	0.584	73%	0.733	S	S	*	*			cis	-147.1	138.1	1.9	-128.8	126.7	-168.1	0	0	106.7
349	Y	31.2	Very low	33.2	Very low	171 Å²	171	137.4 Å²	137.4	67%	0.671	73%	0.725	S	S	*	*				53.9	139.3	98.2	-54.8	-177.6	0	0	0	113
350	N	30.3	Very low	32.8	Very low	129 Å²	129	137.9 Å²	137.9	69%	0.69	73%	0.728	S	S	*	*			cis	-171.3	-179.5	5.5	-117.9	-23.1	0	0	0	110.5
351	T	31.4	Very low	32.5	Very low	114 Å²	114	132.4 Å²	132.4	70%	0.699	72%	0.715	S	S	*	*				18.1	128.8	130	-35.6	0	0	0	0	117.2
352	V	32.1	Very low	32.1	Very low	129 Å²	129	131.5 Å²	131.5	78%	0.782	72%	0.716	S	S	*	*			cis	-138.4	129.6	40	-176	0	0	0	0	108
353	G	31.7	Very low	31.3	Very low	73 Å²	73	130.4 Å²	130.4	75%	0.753	71%	0.711	S	S	*	*				82.7	163.3	75.6	0	0	0	0	0	112
354	R	29.7	Very low	31	Very low	228 Å²	228	129.3 Å²	129.3	86%	0.86	71%	0.706	S	S	*	*			cis	-169.7	134.7	-3.7	178.6	-176	-169.4	174.7	5.2	108.4
355	S	31.6	Very low	30.6	Very low	102 Å²	102	134 Å²	134	71%	0.713	71%	0.713	S	S	*	*			trans	64.1	137.7	172.1	-72.7	0	0	0	0	115.8
356	Y	26.4	Very low	30.3	Very low	222 Å²	222	136.7 Å²	136.7	87%	0.871	72%	0.719	S	S	*	*			cis	52	80.5	18.5	-92.4	-70.6	0	0	0	114.6
357	R	29.3	Very low	30.4	Very low	209 Å²	209	134.3 Å²	134.3	79%	0.789	72%	0.719	S	S	*	*				178.5	150	127.4	-96.7	168	-176.1	-108.6	10	112.9
358	Q	31.8	Very low	30.4	Very low	155 Å²	155	141.8 Å²	141.8	72%	0.724	74%	0.741	S	S	*	*			trans	23	126.1	138.7	-54.5	163.8	-80	0	0	117.7
359	G	28.8	Very low	30.6	Very low	69 Å²	69	141.2 Å²	141.2	71%	0.711	75%	0.748	S	S	*	*			cis	105.2	126.2	6.8	0	0	0	0	0	112.8
360	S	29.7	Very low	30.6	Very low	118 Å²	118	143.7 Å²	143.7	83%	0.825	76%	0.756	S	S	*	*			trans	68.1	157.5	-166.4	-132.4	0	0	0	0	112.6
361	I	31.8	Very low	30.7	Very low	123 Å²	123	145.5 Å²	145.5	63%	0.631	76%	0.76	S	S	*	*			cis	-132.2	137.7	15	-59.4	174.9	0	0	0	106.3
362	A	29.4	Very low	31	Very low	84 Å²	84	147.9 Å²	147.9	69%	0.694	77%	0.767	S	S	*	*				41.7	148.4	96.3	0	0	0	0	0	116.1
363	S	29.1	Very low	31.1	Very low	81 Å²	81	144.8 Å²	144.8	57%	0.566	76%	0.762	S	S	*	*			cis	-175.8	169.6	-4.1	44.2	0	0	0	0	110.8
364	N	29.5	Very low	31.3	Very low	134 Å²	134	152.3 Å²	152.3	72%	0.717	77%	0.767	S	S	*	*			trans	83.5	158.7	161.1	-51.7	-27.7	0	0	0	118.9
365	Y	30.7	Very low	31.7	Very low	214 Å²	214	150.3 Å²	150.3	84%	0.839	77%	0.765	S	S	*	*			trans	54.8	138.7	161.7	61.5	-108.1	0	0	0	118.9
366	D	28	Very low	32	Very low	153 Å²	153	152.3 Å²	152.3	82%	0.818	77%	0.767	S	S	*	*			cis	-160.9	-168.2	-17.4	-159.1	-10.1	0	0	0	108.5
367	S	34.5	Very low	32.5	Very low	100 Å²	100	148 Å²	148	70%	0.699	76%	0.763	S	S	*	*			trans	67.3	81.4	153.1	-67.7	0	0	0	0	118.3
368	R	30.7	Very low	32.7	Very low	245 Å²	245	142 Å²	142	93%	0.925	75%	0.754	S	S	*	*				23.2	159.3	112.5	-86.2	-166.8	161	-169.4	-3.8	121.5
369	P	34.6	Very low	33	Very low	113 Å²	113	142.8 Å²	142.8	73%	0.734	76%	0.757	S	S	*	*			trans	-121.8	171.7	-133.4	43.9	-35.3	0	0	0	116.6
370	R	32.2	Very low	33.3	Very low	223 Å²	223	144 Å²	144	84%	0.842	75%	0.754	S	S	*	*			trans	-159.1	126.9	152.1	-101.4	153.7	-176	-150.7	-0.1	107.7
371	Q	32.2	Very low	33.3	Very low	166 Å²	166	147 Å²	147	78%	0.776	76%	0.756	S	S	*	*				95.5	156.1	61.5	-86.6	-166.7	-27.4	0	0	112.9
372	I	38	Very low	33.4	Very low	165 Å²	165	145.5 Å²	145.5	85%	0.846	75%	0.754	S	S	*	*			trans	73.4	117.3	173.9	-41.9	178.2	0	0	0	114.5
373	G	33.2	Very low	33.3	Very low	64 Å²	64	147.4 Å²	147.4	66%	0.66	76%	0.757	S	S	*	*			cis	139.4	168.9	-14.9	0	0	0	0	0	114.8
374	R	35.9	Very low	33.4	Very low	231 Å²	231	148.4 Å²	148.4	87%	0.872	76%	0.764	S	S	*	*			trans	72.3	149.9	175.5	-65.4	169.9	177.9	177.9	-1.5	114.1
375	K	37.5	Very low	33.2	Very low	185 Å²	185	152.4 Å²	152.4	80%	0.804	77%	0.769	S	S	*	*			cis	-157.9	159	3.5	-115.5	170	167.7	-167.3	0	105.7
376	L	38.2	Very low	33	Very low	145 Å²	145	148.9 Å²	148.9	76%	0.759	76%	0.76	S	S	*	*			cis	-174.2	179.8	-22.5	-153.2	103.1	0	0	0	107.9
377	V	37.1	Very low	33	Very low	130 Å²	130	147.6 Å²	147.6	79%	0.788	76%	0.758	S	S	*	*			trans	70.2	140.6	171.2	-177.5	0	0	0	0	113.8
378	S	34.8	Very low	33	Very low	85 Å²	85	147.9 Å²	147.9	59%	0.594	76%	0.759	S	S	*	*			cis	-171.3	157.1	-24.9	-160.6	0	0	0	0	105.2
379	Q	36.5	Very low	33.1	Very low	170 Å²	170	141.6 Å²	141.6	79%	0.794	75%	0.751	S	S	*	*			cis	-157.5	159.4	16.6	-144.6	149.9	-35.8	0	0	109.9
380	S	35.4	Very low	33	Very low	94 Å²	94	141.5 Å²	141.5	66%	0.657	75%	0.753	S	S	*	*			trans	4.2	157.2	149.2	63.3	0	0	0	0	122.7
381	Q	30.6	Very low	33	Very low	182 Å²	182	142 Å²	142	85%	0.85	76%	0.755	S	S	*	*			cis	-172.2	178.3	-12.9	-98.9	-121.7	18.7	0	0	107.6
382	P	33.6	Very low	33.1	Very low	92 Å²	92	141.5 Å²	141.5	60%	0.597	76%	0.756	S	S	*	*			trans	-111.4	-171.9	-166.7	37.8	-25.2	0	0	0	116
383	T	26.8	Very low	33	Very low	124 Å²	124	137.1 Å²	137.1	76%	0.761	75%	0.745	S	S	*	*			trans	93.3	136.5	163	78.4	0	0	0	0	119.4
384	S	30.8	Very low	33.1	Very low	102 Å²	102	143.4 Å²	143.4	71%	0.713	75%	0.75	S	S	*	*			trans	40	147.6	132.2	-51.3	0	0	0	0	122.9
385	R	26.9	Very low	33.1	Very low	218 Å²	218	140.4 Å²	140.4	82%	0.823	74%	0.744	S	S	*	*			trans	71.1	159.3	169.2	-44.5	176.6	99.9	149.2	4.8	112.9
386	E	26.2	Very low	32.8	Very low	139 Å²	139	136.8 Å²	136.8	65%	0.65	74%	0.737	S	S	*	*			cis	-160.4	167.2	-26.4	-108.9	166.4	-122.4	0	0	106.1
387	V	28.1	Very low	32.4	Very low	127 Å²	127	133.3 Å²	133.3	77%	0.77	73%	0.73	S	S	*	*			trans	36.5	117.5	149.4	-177.7	0	0	0	0	120.5
388	S	33.8	Very low	32	Very low	105 Å²	105	138.2 Å²	138.2	73%	0.734	74%	0.736	S	S	*	*			trans	-58.2	155.3	164	56.4	0	0	0	0	114.6
389	P	33.8	Very low	31.8	Very low	114 Å²	114	137.2 Å²	137.2	74%	0.74	74%	0.738	S	S	*	*				-154.8	151.2	96.9	39.3	-21.1	0	0	0	119.1
390	S	32.4	Very low	31.4	Very low	111 Å²	111	135.4 Å²	135.4	78%	0.776	74%	0.739	S	S	*	*			trans	36.2	138.4	130.2	-49.8	0	0	0	0	125.2
391	R	31.2	Very low	31.1	Very low	233 Å²	233	136.5 Å²	136.5	88%	0.879	74%	0.742	S	S	*	*				103.7	156.2	125.1	-105.7	-179.4	-177.9	-179.4	0.6	120.7
392	L	34.5	Very low	31	Very low	155 Å²	155	133.8 Å²	133.8	81%	0.812	74%	0.738	S	S	*	*			trans	71.3	142.3	180	-87.1	69.9	0	0	0	115.6
393	A	36.7	Very low	30.8	Very low	74 Å²	74	134.4 Å²	134.4	61%	0.612	74%	0.744	S	S	*	*			cis	-152.6	138.6	-1.5	0	0	0	0	0	113.9
394	Y	34.4	Very low	31.1	Very low	196 Å²	196	134.4 Å²	134.4	77%	0.769	74%	0.74	S	S	*	*			trans	65.2	144.4	139.9	-71.8	-132.6	0	0	0	118.5
395	F	35	Very low	31.2	Very low	168 Å²	168	135.9 Å²	135.9	74%	0.737	74%	0.74	S	S	*	*			cis	-153.6	176.2	-5.9	-135.5	-146.3	0	0	0	111.7
396	T	31.8	Very low	31.4	Very low	108 Å²	108	131.8 Å²	131.8	66%	0.663	73%	0.734	S	S	*	*			trans	-36.7	164.5	164.2	2.6	0	0	0	0	116.7
397	A	30.8	Very low	31.7	Very low	73 Å²	73	132.1 Å²	132.1	60%	0.603	74%	0.74	S	S	*	*			cis	-162	178.7	9	0	0	0	0	0	114.4
398	Y	28.4	Very low	31.9	Very low	233 Å²	233	129.6 Å²	129.6	91%	0.914	74%	0.74	S	S	*	*			trans	11.7	148.7	153.1	-53.3	-65	0	0	0	123.9
399	G	30.8	Very low	31.9	Very low	63 Å²	63	132.5 Å²	132.5	65%	0.649	74%	0.742	S	S	*	*			trans	118.9	98.6	159.4	0	0	0	0	0	112.8
400	T	28.1	Very low	32	Very low	132 Å²	132	135.2 Å²	135.2	81%	0.81	74%	0.742	S	S	*	*				73.2	134.8	74.5	61.6	0	0	0	0	116.3
401	T	29.1	Very low	32.1	Very low	117 Å²	117	138.3 Å²	138.3	72%	0.718	75%	0.749	S	S	*	*			trans	68.6	110.4	151.6	46.9	0	0	0	0	121.3
402	T	28.5	Very low	32.2	Very low	125 Å²	125	134.2 Å²	134.2	77%	0.767	74%	0.74	S	S	*	*				67.2	109.4	128.2	60	0	0	0	0	122.3
403	S	29.2	Very low	32.3	Very low	105 Å²	105	135 Å²	135	73%	0.734	74%	0.737	S	S	*	*				80.9	157.8	118.5	-142.5	0	0	0	0	121.3
404	N	32.3	Very low	32.1	Very low	125 Å²	125	137.8 Å²	137.8	67%	0.668	74%	0.742	S	S	*	*			trans	74.6	100	161.9	-63.9	8	0	0	0	118.8
405	N	32.8	Very low	31.9	Very low	132 Å²	132	133.5 Å²	133.5	71%	0.706	74%	0.736	S	S	*	*				62.4	114	116.2	-56.1	-1.6	0	0	0	120.1
406	N	32.3	Very low	31.9	Very low	132 Å²	132	131.4 Å²	131.4	71%	0.706	74%	0.737	S	S	*	*				78.8	146.1	126.7	-80.1	43	0	0	0	121.4
407	D	31.5	Very low	31.8	Very low	146 Å²	146	133.6 Å²	133.6	78%	0.781	75%	0.745	S	S	*	*			trans	51.9	105.2	150.3	-50.8	-31.8	0	0	0	116.9
408	G	31.9	Very low	32	Very low	74 Å²	74	135.6 Å²	135.6	76%	0.763	75%	0.752	S	S	*	*			cis	105.6	129.9	16.4	0	0	0	0	0	110.9
409	Q	34.6	Very low	32.1	Very low	167 Å²	167	132 Å²	132	78%	0.78	75%	0.748	S	S	*	*			trans	-157.9	134.7	-177.8	-121.7	-177.2	69.3	0	0	112.8
410	K	34.9	Very low	32	Very low	170 Å²	170	139.6 Å²	139.6	74%	0.739	76%	0.757	S	S	*	*			trans	70	135.2	170.5	-54.2	167.8	-173.2	173.8	0	113.8
411	L	34.6	Very low	32.1	Very low	176 Å²	176	140.2 Å²	140.2	92%	0.921	76%	0.756	S	S	*	*			cis	-110.9	169.1	10.9	-70.3	162.4	0	0	0	113.1
412	Q	34.9	Very low	32.4	Very low	147 Å²	147	138.5 Å²	138.5	69%	0.687	76%	0.761	S	S	*	*			trans	-121.1	172.8	-167.2	-68.3	174.4	-60.4	0	0	113
413	F	35.7	Very low	32.5	Very low	171 Å²	171	138.2 Å²	138.2	75%	0.75	76%	0.76	S	S	*	*			trans	78	153.7	161.2	-50.4	-65.1	0	0	0	118
414	N	31.4	Very low	32.8	Very low	134 Å²	134	141.4 Å²	141.4	72%	0.717	77%	0.767	S	S	*	*			cis	-170.2	144.2	-44.8	-128.4	11.3	0	0	0	109.2
415	T	30.8	Very low	32.8	Very low	105 Å²	105	138 Å²	138	64%	0.644	76%	0.76	S	S	*	*			trans	69	128	139	-47	0	0	0	0	121.8
416	T	35.1	Very low	33.1	Very low	125 Å²	125	138.6 Å²	138.6	77%	0.767	76%	0.763	S	S	*	*			trans	65.9	129.6	153.6	50.4	0	0	0	0	124
417	N	30.2	Very low	33.3	Very low	153 Å²	153	138.7 Å²	138.7	82%	0.818	77%	0.768	S	S	*	*				8.2	156.9	113.9	-93.6	-11.4	0	0	0	119.4
418	P	35.1	Very low	33.6	Very low	116 Å²	116	136.7 Å²	136.7	75%	0.753	76%	0.758	S	S	*	*			cis	-138.7	-162.6	16.5	41.8	-22	0	0	0	115.5
419	N	29.5	Very low	33.8	Very low	156 Å²	156	138.6 Å²	138.6	83%	0.834	75%	0.75	S	S	*	*			trans	-56.3	159.4	171.6	-79.6	-52.9	0	0	0	116.4
420	R	28.7	Very low	34	Very low	223 Å²	223	136.6 Å²	136.6	84%	0.842	75%	0.745	S	S	*	*			trans	112.3	132.2	146.7	-79.2	-172.8	173.2	171.1	-2.3	119.2
421	N	31.2	Very low	34.1	Very low	146 Å²	146	134.7 Å²	134.7	78%	0.781	74%	0.743	S	S	*	*			trans	71.8	120.5	147.2	-60.9	7.3	0	0	0	119.3
422	G	34.1	Very low	34.2	Very low	80 Å²	80	131.9 Å²	131.9	83%	0.825	73%	0.733	S	S	*	*			trans	-162.3	44.4	174	0	0	0	0	0	111.6
423	T	32.5	Very low	34.3	Very low	120 Å²	120	130.7 Å²	130.7	74%	0.736	74%	0.736	S	S	*	*			trans	-88.9	106.9	-167.3	-54.6	0	0	0	0	113.4
424	I	34.1	Very low	34.4	Very low	172 Å²	172	128.7 Å²	128.7	88%	0.882	74%	0.738	S	S	*	*			trans	-152	132	144.5	-54.3	-175.3	0	0	0	106.6
425	G	32.3	Very low	34.4	Very low	52 Å²	52	129.6 Å²	129.6	54%	0.536	74%	0.738	S	S	.	*			cis	-118.1	169.6	-12.5	0	0	0	0	0	110.9
426	L	39.3	Very low	34.5	Very low	146 Å²	146	135.5 Å²	135.5	76%	0.764	75%	0.748	S	S	*	*				54.7	111.3	56.6	-66.8	165.3	0	0	0	109.7
427	V	36.7	Very low	34.5	Very low	134 Å²	134	134.9 Å²	134.9	81%	0.812	74%	0.744	S	S	*	*			cis	-148.9	137.6	27.3	169	0	0	0	0	109.2
428	D	37.5	Very low	34.7	Very low	104 Å²	104	132.8 Å²	132.8	56%	0.556	74%	0.737	S	S	*	*			cis	-162.7	169.7	-5.3	-124.9	29.8	0	0	0	114.6
429	N	37.4	Very low	34.5	Very low	114 Å²	114	137.9 Å²	137.9	61%	0.61	74%	0.742	S	S	*	*			trans	10.8	151.3	134.4	-67.1	-38.9	0	0	0	121.4
430	N	37.4	Very low	34.8	Very low	124 Å²	124	137.6 Å²	137.6	66%	0.663	74%	0.739	S	S	*	*			cis	-174.6	173.1	2.5	-109.3	-24.2	0	0	0	109.3
431	N	37.5	Very low	35	Very low	130 Å²	130	133.7 Å²	133.7	70%	0.695	73%	0.734	S	S	*	*			cis	-167.3	-160.3	-25.4	-151.8	-76.7	0	0	0	108.6
432	T	36.5	Very low	35	Very low	118 Å²	118	134 Å²	134	72%	0.724	73%	0.733	S	S	*	*			trans	75.1	135	167	70.5	0	0	0	0	117.4
433	T	37.1	Very low	34.8	Very low	121 Å²	121	137 Å²	137	74%	0.742	73%	0.73	S	S	*	*			cis	-174.5	168.6	0.6	17.4	0	0	0	0	108
434	T	37.4	Very low	34.9	Very low	129 Å²	129	136.5 Å²	136.5	79%	0.791	73%	0.731	S	S	*	*			cis	177.8	152.4	-31.6	31.3	0	0	0	0	106.7
435	E	32.6	Very low	34.9	Very low	154 Å²	154	139.5 Å²	139.5	72%	0.72	73%	0.732	S	S	*	*			cis	-151.5	-145	-16.2	-161.6	-125	-144.6	0	0	109.4	T437	E435-T437 PolarHBondContact OE2-OG1 3.04Å
436	R	32	Very low	35.1	Very low	229 Å²	229	143.1 Å²	143.1	86%	0.864	74%	0.743	S	S	*	*			trans	-170.7	107.7	-166.2	176.3	-151.3	-164.2	-173.6	8.8	113.8
437	T	35.3	Very low	34.9	Very low	111 Å²	111	141.9 Å²	141.9	68%	0.681	74%	0.743	S	S	*	*			trans	-152.6	120.7	-176.7	8.6	0	0	0	0	119.8	E435	E435-T437 PolarHBondContact OE2-OG1 3.04Å
438	T	33.7	Very low	34.9	Very low	109 Å²	109	146.3 Å²	146.3	67%	0.669	75%	0.746	S	S	*	*			trans	49.7	125.5	132	55.1	0	0	0	0	128.2
439	R	32.1	Very low	35.2	Very low	224 Å²	224	146.4 Å²	146.4	85%	0.845	76%	0.755	S	S	*	*				76.6	151.9	122.9	-65.6	174.8	175.8	-172.3	-0.5	124.1
440	L	35.5	Very low	35.2	Very low	149 Å²	149	150.5 Å²	150.5	78%	0.78	77%	0.77	S	S	*	*			trans	96.2	110.5	152.6	-53.8	-168.2	0	0	0	122.5
441	L	32.9	Very low	35.1	Very low	142 Å²	142	148.4 Å²	148.4	74%	0.743	78%	0.778	S	S	*	*				48.3	130.1	128.1	-71.8	163.1	0	0	0	124.9
442	M	31.5	Very low	34.8	Very low	151 Å²	151	147.1 Å²	147.1	74%	0.744	79%	0.785	S	S	*	*			trans	82.5	129	139.4	-68.8	-71.8	-177.8	0	0	123.4
443	N	30.7	Very low	34.8	Very low	144 Å²	144	146.8 Å²	146.8	77%	0.77	79%	0.787	S	S	*	*			trans	73.5	105.9	142.5	-71.3	-8.5	0	0	0	124.2
444	S	33	Very low	34.7	Very low	109 Å²	109	150.9 Å²	150.9	76%	0.762	79%	0.79	S	S	*	*				120.8	140.8	112.8	-146.7	0	0	0	0	120.7
445	R	34.7	Very low	34.3	Very low	236 Å²	236	151.4 Å²	151.4	89%	0.891	78%	0.783	S	S	*	*			trans	71.4	89.2	158.4	-73.9	173.2	-179.4	-167.5	-1.1	123.6
446	V	35.6	Very low	34.3	Very low	128 Å²	128	150.9 Å²	150.9	78%	0.776	79%	0.791	S	S	*	*			trans	-27.7	152.2	131.8	154.6	0	0	0	0	115.4
447	P	36.9	Very low	34.5	Very low	119 Å²	119	145.4 Å²	145.4	77%	0.773	79%	0.787	S	S	*	*			cis	-146.6	174.7	43.9	30.4	-4.4	0	0	0	122.8
448	R	36.1	Very low	34.5	Very low	228 Å²	228	146.3 Å²	146.3	86%	0.86	80%	0.795	S	S	*	*			trans	-33.4	151.8	167.1	-62.4	171.4	156.4	102	-2.8	122.3
449	S	42.4	Very low	34.5	Very low	106 Å²	106	147.5 Å²	147.5	74%	0.741	80%	0.802	S	S	*	*				-175	123	121.6	45.3	0	0	0	0	111.3
450	Q	38.7	Very low	34.4	Very low	199 Å²	199	148.2 Å²	148.2	93%	0.93	81%	0.805	S	S	*	*				58.8	121.9	98.7	-88.2	-174.2	-26.6	0	0	117.8
451	G	35.7	Very low	34.2	Very low	81 Å²	81	145.8 Å²	145.8	84%	0.835	80%	0.8	S	S	*	*			trans	164.8	134.8	164.7	0	0	0	0	0	114.7
452	A	30.1	Very low	34.3	Very low	102 Å²	102	145.5 Å²	145.5	84%	0.843	81%	0.805	S	S	*	*			trans	-159	129.1	172.7	0	0	0	0	0	113
453	S	36.5	Very low	34.4	Very low	111 Å²	111	142.7 Å²	142.7	78%	0.776	81%	0.806	S	S	*	*			trans	-172.1	139.2	164.1	-84.3	0	0	0	0	107.8
454	R	35.1	Very low	34.6	Very low	208 Å²	208	141.7 Å²	141.7	79%	0.785	81%	0.81	S	S	*	*				74.3	118.2	62.3	-79.4	-176.2	98.1	149	4.5	114.3
455	E	29.1	Very low	34.7	Very low	139 Å²	139	139 Å²	139	65%	0.65	80%	0.799	S	S	*	*			trans	60.7	118.1	144.3	-63	166.3	-140	0	0	119.6
456	T	31.8	Very low	34.8	Very low	144 Å²	144	138.5 Å²	138.5	88%	0.883	80%	0.798	S	S	*	*				179.9	146.6	110.9	26.9	0	0	0	0	112.7
457	S	37.4	Very low	34.8	Very low	113 Å²	113	137.9 Å²	137.9	79%	0.79	80%	0.795	S	S	*	*			trans	-89	167.5	165.2	-50	0	0	0	0	110.4
458	P	35.1	Very low	35	Very low	131 Å²	131	140.1 Å²	140.1	85%	0.851	80%	0.797	S	S	*	*				-146.1	168.2	121.7	34	-17	0	0	0	117
459	T	32.9	Very low	35.1	Very low	133 Å²	133	134 Å²	134	82%	0.816	79%	0.787	S	S	*	*			trans	-92.3	161.6	-166.7	39.2	0	0	0	0	116.5
460	R	30	Very low	34.8	Very low	240 Å²	240	133.5 Å²	133.5	91%	0.906	78%	0.783	S	S	*	*			trans	-167.5	154.5	138.7	-110.6	-179.2	179.3	-164	-1.6	110.2
461	S	31.1	Very low	34.7	Very low	97 Å²	97	133.6 Å²	133.6	68%	0.678	78%	0.777	S	S	*	*			cis	-106.9	-120.4	-8.8	-61.6	0	0	0	0	110.1
462	T	35.1	Very low	34.7	Very low	137 Å²	137	137.4 Å²	137.4	84%	0.84	77%	0.773	S	S	*	*			cis	-143.4	173.1	0.7	28.4	0	0	0	0	109.8
463	A	35.2	Very low	34.9	Very low	92 Å²	92	139.5 Å²	139.5	76%	0.76	77%	0.765	S	S	*	*			trans	-75.8	161.9	169.9	0	0	0	0	0	111.7
464	S	34	Very low	34.9	Very low	123 Å²	123	140.2 Å²	140.2	86%	0.86	76%	0.76	S	S	*	*			cis	-157.3	-178.1	1.2	-128.2	0	0	0	0	108.7
465	G	34.6	Very low	34.9	Very low	51 Å²	51	137.2 Å²	137.2	53%	0.526	76%	0.759	S	S	.	*			cis	156	153.5	-0.9	0	0	0	0	0	111.4
466	Y	38.2	Very low	35.1	Very low	226 Å²	226	135.1 Å²	135.1	89%	0.886	76%	0.76	S	S	*	*			trans	65.2	142.4	-173.5	-46.8	-79.9	0	0	0	114.8
467	T	35.8	Very low	35.2	Very low	115 Å²	115	136.4 Å²	136.4	71%	0.706	75%	0.754	S	S	*	*			cis	-159.2	125.9	-10.2	11.3	0	0	0	0	111.3
468	M	40.3	Very low	34.9	Very low	167 Å²	167	137.6 Å²	137.6	82%	0.823	75%	0.747	S	S	*	*			trans	50.7	154	130.1	-60.6	-60.3	-90.3	0	0	122.9
469	P	38.1	Very low	34.8	Very low	98 Å²	98	137 Å²	137	64%	0.636	74%	0.736	S	S	*	*			cis	-145	-169.3	-30	40.6	-22.1	0	0	0	115.8
470	S	35.5	Very low	34.7	Very low	96 Å²	96	137.1 Å²	137.1	67%	0.671	74%	0.737	S	S	*	*			trans	93.9	133.8	157.5	84.4	0	0	0	0	117.4
471	Y	36.6	Very low	34.8	Very low	201 Å²	201	129.7 Å²	129.7	79%	0.788	74%	0.735	S	S	*	*			cis	-143	141.9	-5.9	-92.6	-64.6	0	0	0	111.4
472	Q	36.4	Very low	34.8	Very low	161 Å²	161	131 Å²	131	75%	0.752	74%	0.739	S	S	*	*			trans	60.3	147	152	-63.8	167.5	-77.9	0	0	118.9
473	H	35	Very low	34.6	Very low	147 Å²	147	131.4 Å²	131.4	68%	0.681	74%	0.736	S	S	*	*			cis	-157.4	144.7	-5.4	-138.8	53	0	0	0	110.6
474	N	36.3	Very low	34.6	Very low	126 Å²	126	135.1 Å²	135.1	67%	0.674	74%	0.738	S	S	*	*			trans	27.5	145.4	147.1	-56.6	-8.7	0	0	0	122
475	N	35.1	Very low	34.6	Very low	144 Å²	144	136.5 Å²	136.5	77%	0.77	73%	0.733	S	S	*	*			cis	-159.6	170.8	9.8	-143.2	-16.9	0	0	0	115.4
476	S	31.8	Very low	34.5	Very low	96 Å²	96	137.3 Å²	137.3	67%	0.671	74%	0.742	S	S	*	*			trans	-40.7	168.9	169.1	-60.2	0	0	0	0	118.3
477	F	34	Very low	34.3	Very low	170 Å²	170	134.8 Å²	134.8	75%	0.746	74%	0.739	S	S	*	*			cis	-143.1	-124.8	18	-156.2	-136.8	0	0	0	116.9
478	Q	32.5	Very low	34.2	Very low	139 Å²	139	136.3 Å²	136.3	65%	0.65	74%	0.739	S	S	*	*			trans	-163.7	169.8	-141.9	-147.3	-170.3	138.9	0	0	116.4
479	L	31.4	Very low	33.9	Very low	119 Å²	119	134.3 Å²	134.3	62%	0.623	73%	0.732	S	S	*	*			trans	97	103.8	153.2	-64.6	173.9	0	0	0	123.7
480	T	31.1	Very low	33.6	Very low	135 Å²	135	138.7 Å²	138.7	83%	0.828	74%	0.737	S	S	*	*				49.2	129.8	129.7	60	0	0	0	0	124.4
481	G	32.5	Very low	33.5	Very low	83 Å²	83	144.8 Å²	144.8	86%	0.856	75%	0.746	S	S	*	*			trans	-179.3	130.3	159.1	0	0	0	0	0	115.4
482	T	31	Very low	33.4	Very low	126 Å²	126	146.5 Å²	146.5	77%	0.773	75%	0.75	S	S	*	*			trans	-88.6	157.8	-168.9	53.2	0	0	0	0	117.4
483	N	30.5	Very low	33.2	Very low	144 Å²	144	146.5 Å²	146.5	77%	0.77	75%	0.75	S	S	*	*			trans	86.3	142.2	140.5	-77.3	-20.6	0	0	0	123.5
484	Q	35.7	Very low	33.2	Very low	171 Å²	171	148.1 Å²	148.1	80%	0.799	76%	0.759	S	S	*	*			trans	93.4	109.2	154.5	-71.4	177	110.6	0	0	123.8
485	I	33.4	Very low	33	Very low	151 Å²	151	149.9 Å²	149.9	77%	0.774	76%	0.763	S	S	*	*				53.5	103.9	123.1	-52.8	167.3	0	0	0	120.2
486	G	32.4	Very low	32.8	Very low	69 Å²	69	151.6 Å²	151.6	71%	0.711	77%	0.766	S	S	*	*				99.9	128.5	99.7	0	0	0	0	0	123.1
487	Q	35.1	Very low	32.7	Very low	173 Å²	173	158.7 Å²	158.7	81%	0.808	78%	0.778	S	S	*	*			trans	95.7	120.8	139.4	-65	-157.3	52.8	0	0	124.2
488	M	33.2	Very low	32.6	Very low	147 Å²	147	156.1 Å²	156.1	72%	0.724	78%	0.779	S	S	*	*			trans	101.5	144.1	130.7	-76	-71.6	-154.5	0	0	123.6
489	N	34	Very low	32.7	Very low	125 Å²	125	154.5 Å²	154.5	67%	0.668	78%	0.783	S	S	*	*			trans	-100.1	164.9	-163	-63.9	-78.4	0	0	0	114.8
490	Y	32.2	Very low	32.8	Very low	189 Å²	189	157.3 Å²	157.3	74%	0.741	80%	0.797	S	S	*	*				159.1	110.1	110.3	-88.8	-67.1	0	0	0	117.2
491	R	33.5	Very low	33.1	Very low	225 Å²	225	153.5 Å²	153.5	85%	0.849	79%	0.785	S	S	*	*				47.1	114.6	121.9	-168.4	-174.1	-160.7	175.7	7	121.5
492	R	33.5	Very low	33.2	Very low	236 Å²	236	156.1 Å²	156.1	89%	0.891	79%	0.785	S	S	*	*				-163.9	165.8	126.5	-115.1	-175.8	-168.5	-170.3	4.5	114.3
493	Q	33.7	Very low	33.5	Very low	161 Å²	161	157.6 Å²	157.6	75%	0.752	79%	0.787	S	S	*	*			trans	-76.7	148.8	-170.8	-51.5	128.7	-45.3	0	0	113.4
494	Q	34.6	Very low	33.8	Very low	182 Å²	182	155.2 Å²	155.2	85%	0.85	78%	0.781	S	S	*	*				-172.7	-170.2	103.5	-101	-173	13	0	0	112.8
495	Q	32.6	Very low	33.8	Very low	162 Å²	162	153.6 Å²	153.6	76%	0.757	78%	0.778	S	S	*	*			trans	-78.1	177	-158.4	-60	165.7	-15.8	0	0	115.7
496	Q	29.4	Very low	33.9	Very low	180 Å²	180	151.8 Å²	151.8	84%	0.841	78%	0.778	S	S	*	*			trans	90.7	140.1	160.8	-51.8	-174.7	38.5	0	0	118
497	R	29.9	Very low	34.1	Very low	246 Å²	246	153.2 Å²	153.2	93%	0.928	78%	0.783	S	S	*	*			trans	-79.8	149.8	168.4	-71.9	174.8	165.5	-175.4	-5.4	109.5
498	P	33.3	Very low	34.1	Very low	116 Å²	116	151.4 Å²	151.4	75%	0.753	78%	0.778	S	S	*	*				-135.9	131.5	120.7	40.4	-30.3	0	0	0	110.2
499	S	33.2	Very low	34.5	Very low	105 Å²	105	152 Å²	152	73%	0.734	78%	0.784	S	S	*	*				97.5	124.4	85.5	70.9	0	0	0	0	112.7
500	L	35	Very low	34.7	Very low	177 Å²	177	149.3 Å²	149.3	93%	0.927	79%	0.785	S	S	*	*			trans	-100.6	129.5	152.6	-96.2	95.2	0	0	0	108.2
501	G	35.8	Very low	34.9	Very low	56 Å²	56	148.9 Å²	148.9	58%	0.577	80%	0.796	S	S	*	*			trans	-86.9	175.9	138.3	0	0	0	0	0	108.9
502	T	35.5	Very low	35.1	Very low	138 Å²	138	141 Å²	141	85%	0.847	79%	0.786	S	S	*	*			cis	-153.6	-175.8	8.3	-40.2	0	0	0	0	107.9
503	L	38.1	Very low	35.6	Very low	156 Å²	156	135.7 Å²	135.7	82%	0.817	78%	0.781	S	S	*	*			trans	83.6	108.6	-170.2	-51.6	166.8	0	0	0	110.6
504	S	35.1	Very low	35.7	Very low	94 Å²	94	135.2 Å²	135.2	66%	0.657	78%	0.783	S	S	*	*				83.3	128.7	72.4	-77.7	0	0	0	0	111.8
505	D	35.8	Very low	35.9	Very low	138 Å²	138	137.4 Å²	137.4	74%	0.738	79%	0.785	S	S	*	*			cis	-155.3	167.3	-2.1	-108.7	-53.7	0	0	0	112.1
506	C	36.5	Very low	36.1	Very low	113 Å²	113	133.1 Å²	133.1	76%	0.764	78%	0.784	S	S	*	*			trans	41.4	136.3	159.9	67.6	0	0	0	0	124.1
507	A	36.8	Very low	36.3	Very low	98 Å²	98	134.5 Å²	134.5	81%	0.81	78%	0.782	S	S	*	*			trans	70.2	156.6	142.9	0	0	0	0	0	121.1
508	D	35.4	Very low	36.3	Very low	135 Å²	135	129.6 Å²	129.6	72%	0.722	77%	0.769	S	S	*	*			cis	-164.8	153.2	-36.2	-166	14.7	0	0	0	109.6
509	L	40.5	Very low	36.3	Very low	160 Å²	160	132.7 Å²	132.7	84%	0.838	77%	0.767	S	S	*	*			trans	57.9	156.7	173.9	-47.1	-177.6	0	0	0	117.2
510	G	37.7	Very low	36.3	Very low	68 Å²	68	132.3 Å²	132.3	70%	0.701	77%	0.765	S	S	*	*			cis	178.2	160.4	-8.1	0	0	0	0	0	111.6
511	D	36.8	Very low	36.1	Very low	180 Å²	180	130.5 Å²	130.5	96%	0.963	76%	0.761	S	S	*	*			trans	61.6	152.6	174.2	-114.5	8.9	0	0	0	118.7
512	G	38.7	Very low	36	Very low	61 Å²	61	131.5 Å²	131.5	63%	0.629	77%	0.771	S	S	*	*			cis	-174	117.7	-7	0	0	0	0	0	111.3
513	P	42.9	Very low	36	Very low	123 Å²	123	131.9 Å²	131.9	80%	0.799	77%	0.768	S	S	*	*			trans	-114.4	162.4	-170.5	40.4	-33.6	0	0	0	115.4
514	L	37	Very low	35.7	Very low	151 Å²	151	131 Å²	131	79%	0.791	76%	0.764	S	S	*	*			trans	-140.9	128.9	169.6	-71	179.4	0	0	0	113.9
515	Y	38.7	Very low	35.7	Very low	228 Å²	228	138.6 Å²	138.6	89%	0.894	78%	0.779	S	S	*	*			trans	36.8	137.4	159.4	-56.2	-69.3	0	0	0	121
516	G	35.4	Very low	35.5	Very low	72 Å²	72	135.3 Å²	135.3	74%	0.742	78%	0.777	S	S	*	*			cis	152	165	5.4	0	0	0	0	0	108.9
517	R	34	Very low	35.8	Very low	210 Å²	210	135.5 Å²	135.5	79%	0.792	78%	0.777	S	S	*	*			cis	-159.9	148.2	-6.2	-168	-177	-163.1	-161.5	6.2	108.3
518	H	30	Very low	35.8	Very low	142 Å²	142	142.6 Å²	142.6	66%	0.657	79%	0.785	S	S	*	*			trans	-8.7	157.3	164.7	-56.8	-104.5	0	0	0	120.2
519	Y	34.1	Very low	35.8	Very low	181 Å²	181	138.7 Å²	138.7	71%	0.71	78%	0.776	S	S	*	*			cis	-152.5	147.8	46.4	-64.8	-87.3	0	0	0	110.5
520	S	31.8	Very low	35.7	Very low	98 Å²	98	136.1 Å²	136.1	69%	0.685	77%	0.772	S	S	*	*				59.3	133.7	65.4	-66	0	0	0	0	114.7
521	T	32.3	Very low	35.8	Very low	138 Å²	138	139.9 Å²	139.9	85%	0.847	78%	0.776	S	S	*	*			cis	-165.3	150.8	-8	-70.2	0	0	0	0	108.3
522	G	34.1	Very low	36.1	Very low	77 Å²	77	138.5 Å²	138.5	79%	0.794	77%	0.769	S	S	*	*			trans	-174.7	104.9	176.1	0	0	0	0	0	118.4
523	N	35.1	Very low	36.4	Very low	146 Å²	146	142.9 Å²	142.9	78%	0.781	78%	0.777	S	S	*	*			trans	-67.7	140	-172.1	-102.9	-32.7	0	0	0	118.5
524	N	30.9	Very low	35.9	Very low	138 Å²	138	146.4 Å²	146.4	74%	0.738	78%	0.781	S	S	*	*			trans	35	122.2	130.3	-72.7	-51.7	0	0	0	122.2
525	R	34.7	Very low	36.1	Very low	254 Å²	254	144.7 Å²	144.7	96%	0.958	78%	0.781	S	S	*	*				179.1	154.7	110.6	-95.7	171.8	-163.9	-159.1	6.3	113.1
526	G	32.6	Very low	36	Very low	69 Å²	69	142.6 Å²	142.6	71%	0.711	78%	0.78	S	S	*	*			trans	-148.7	-156.3	162.8	0	0	0	0	0	108.3
527	P	42.5	Very low	35.8	Very low	117 Å²	117	145.3 Å²	145.3	76%	0.76	78%	0.782	S	S	*	*			cis	-136.5	147	-9.5	38.6	-21.5	0	0	0	115.7
528	Y	37.3	Very low	35.7	Very low	246 Å²	246	140.6 Å²	140.6	97%	0.965	78%	0.781	S	S	*	*			trans	-155.9	165.1	164.8	-82.9	-76.1	0	0	0	108.4
529	G	35.2	Very low	36	Very low	53 Å²	53	139.7 Å²	139.7	55%	0.546	79%	0.791	S	S	.	*			cis	153.8	146.4	-3.5	0	0	0	0	0	110.7
530	S	37.7	Very low	35.9	Very low	107 Å²	107	137.7 Å²	137.7	75%	0.748	79%	0.788	S	S	*	*			trans	57.9	121.3	-172.3	55.9	0	0	0	0	114.3
531	D	39.9	Very low	35.9	Very low	146 Å²	146	139.1 Å²	139.1	78%	0.781	80%	0.796	S	S	*	*				111	160.8	62.4	-75.9	-41.9	0	0	0	108.3
532	D	42.2	Very low	36	Very low	152 Å²	152	137.8 Å²	137.8	81%	0.813	79%	0.793	S	S	*	*			trans	30.7	122.8	165.1	-55.2	-27.1	0	0	0	119.1
533	N	44.8	Very low	35.9	Very low	152 Å²	152	141.7 Å²	141.7	81%	0.813	79%	0.79	S	S	*	*				-164.7	158.4	68.4	-147.3	-16.3	0	0	0	114.2
534	F	33.8	Very low	35.8	Very low	198 Å²	198	146.7 Å²	146.7	87%	0.868	80%	0.798	S	S	*	*			trans	-88.6	125.4	162	-95	-106.3	0	0	0	109.8
535	S	40.2	Very low	36.3	Very low	115 Å²	115	146 Å²	146	80%	0.804	81%	0.805	S	S	*	*			trans	-170.1	166.7	154.9	-88.6	0	0	0	0	112
536	E	37.1	Very low	36.3	Very low	183 Å²	183	137.8 Å²	137.8	86%	0.855	80%	0.799	S	S	*	*			trans	94.6	67.5	178.6	-59.4	-179.2	167.9	0	0	116.2
537	T	31.5	Very low	36.3	Very low	130 Å²	130	146.2 Å²	146.2	80%	0.798	81%	0.809	S	S	*	*			trans	-74.3	157.8	146.5	49.8	0	0	0	0	111.2
538	S	32.3	Very low	36.1	Very low	111 Å²	111	146.5 Å²	146.5	78%	0.776	81%	0.814	S	S	*	*			trans	56.2	96.5	160.3	56.5	0	0	0	0	118.5
539	S	35.8	Very low	36.2	Very low	122 Å²	122	141.4 Å²	141.4	85%	0.853	81%	0.808	S	S	*	*			trans	-162.7	170	148.5	-88.4	0	0	0	0	111.8
540	Q	32.1	Very low	36.4	Very low	139 Å²	139	144.8 Å²	144.8	65%	0.65	82%	0.821	S	S	*	*			trans	65.9	65	175	-65.5	-165.5	-37.3	0	0	118	E543	Q540-E543 PolarHBondContact NE2-OE1 3.5Å; Q540-E543 PolarHBondContact NE2-OE2 3.12Å
541	C	31	Very low	36.3	Very low	128 Å²	128	142.8 Å²	142.8	87%	0.865	82%	0.816	S	S	*	*	S	Bend		-77.6	154.8	120.7	-73.5	0	0	0	0	108.9
542	S	35.1	Very low	36.1	Very low	110 Å²	110	146.8 Å²	146.8	77%	0.769	82%	0.822	S	S	*	*			trans	69.7	97	176.6	178.6	0	0	0	0	117.3
543	E	32.5	Very low	35.6	Very low	160 Å²	160	150.9 Å²	150.9	75%	0.748	83%	0.826	S	S	*	*			trans	-157.4	97.5	148.9	-117.8	159.5	-118.2	0	0	110.6	Q540	Q540-E543 PolarHBondContact NE2-OE1 3.5Å; Q540-E543 PolarHBondContact NE2-OE2 3.12Å
544	R	33.2	Very low	35.1	Very low	250 Å²	250	154.4 Å²	154.4	94%	0.943	83%	0.828	S	S	*	*			trans	-147.1	45.9	174.8	-153	-178.2	-165.7	-105.5	4.2	113.5
545	S	40	Very low	35	Very low	125 Å²	125	153.6 Å²	153.6	87%	0.874	83%	0.827	S	S	*	*			trans	-146.5	135.5	176.4	-71.6	0	0	0	0	111.9
546	G	35.3	Very low	34.6	Very low	81 Å²	81	153.3 Å²	153.3	84%	0.835	83%	0.825	S	S	*	*			trans	83.9	99.1	151.1	0	0	0	0	0	118.9
547	R	33.9	Very low	34.4	Very low	245 Å²	245	150.1 Å²	150.1	93%	0.925	82%	0.823	S	S	*	*			trans	-19.7	130.6	156.9	-60.8	168.1	168.3	-171.3	-4.9	117.2
548	S	38	Very low	35	Very low	123 Å²	123	146.4 Å²	146.4	86%	0.86	80%	0.803	S	S	*	*				-176.3	166.6	124.6	-81.1	0	0	0	0	111.8
549	V	38.8	Very low	35.9	Very low	140 Å²	140	150 Å²	150	85%	0.848	80%	0.804	S	S	*	*			trans	-136.2	167.5	-165.2	-139.9	0	0	0	0	110.2
550	P	39.2	Very low	36.9	Very low	124 Å²	124	148.7 Å²	148.7	81%	0.805	79%	0.791	S	S	*	*				-115.7	165.3	-79.3	38.6	-27.2	0	0	0	114
551	G	35.7	Very low	38.4	Very low	64 Å²	64	143 Å²	143	66%	0.66	77%	0.765	S	S	*	*			trans	-159.7	119.5	170.5	0	0	0	0	0	115.2
552	Y	35.2	Very low	40.2	Very low	230 Å²	230	140.8 Å²	140.8	90%	0.902	75%	0.751	S	S	*	*	S	Bend	trans	55.8	106.6	160.1	-59.9	-79.7	0	0	0	120.9
553	R	32.1	Very low	42.7	Very low	238 Å²	238	139.5 Å²	139.5	90%	0.898	74%	0.736	S	S	*	*			trans	45.8	105.8	150	-64.9	-176.6	176.8	-175.4	0.8	118.8
554	R	34.1	Very low	45.4	Very low	227 Å²	227	132.6 Å²	132.6	86%	0.857	70%	0.704	S	S	*	*				-164.1	139.9	115.2	-104	165.9	-160.1	-142.1	6.7	112.4
555	Q	32.7	Very low	48.2	Very low	180 Å²	180	127.2 Å²	127.2	84%	0.841	69%	0.687	S	S	*	*			trans	29.9	119.8	156.9	-67	171.9	-13.6	0	0	121.3
556	S	31.6	Very low	50.7	Low	109 Å²	109	125.4 Å²	125.4	76%	0.762	67%	0.665	S	S	*	*			trans	32.9	95	151.3	-153.7	0	0	0	0	118.4	S558	S556-S558 PolarHBondContact O-N 2.88Å; S556-S558 VanDerWaalsContact O-N 3.09Å
557	S	32.8	Very low	53.5	Low	117 Å²	117	121.5 Å²	121.5	82%	0.818	63%	0.625	S	S	*	*			trans	-65	105.8	152	175.7	0	0	0	0	108	K559	S557-K559 PolarHBondContact O-N 2.89Å
558	S	44.8	Very low	56.4	Low	52 Å²	52	111 Å²	111	36%	0.364	59%	0.588	S	S	.	*			trans	-62.9	119.1	171	-175.4	0	0	0	0	108.7	S556 V560	S556-S558 PolarHBondContact O-N 2.88Å; S556-S558 VanDerWaalsContact O-N 3.09Å; S558-V560 PolarHBondContact O-N 3.34Å; S558-V560 VanDerWaalsContact O-N 3.09Å
559	K	49.3	Very low	59.1	Low	186 Å²	186	109 Å²	109	81%	0.809	57%	0.573	S	S	*	*			trans	-67.4	106.7	164.2	-73.7	-175.2	176.1	-176	0	106.8	S557 T561	S557-K559 PolarHBondContact O-N 2.89Å; K559-T561 VanDerWaalsContact C-N 3.34Å; K559-T561 PolarHBondContact O-N 3.12Å
560	V	57.5	Low	61.8	Low	94 Å²	94	104 Å²	104	57%	0.57	54%	0.541	S	S	*	.			trans	-63.7	100.2	169.6	-178.7	0	0	0	0	107.2	S558 N588	S558-V560 PolarHBondContact O-N 3.34Å; S558-V560 VanDerWaalsContact O-N 3.09Å; V560-N588 HydrophobicContact CG1-CB 3.92Å
561	T	63.4	Low	64.5	Low	19 Å²	19	98.3 Å²	98.3	12%	0.117	50%	0.503	C	S	.	.			trans	-80.9	131.5	177.6	-172.7	0	0	0	0	109.3	K559 N563 E566 I567 N585	K559-T561 VanDerWaalsContact C-N 3.34Å; K559-T561 PolarHBondContact O-N 3.12Å; T561-N563 VanDerWaalsContact C-N 3.29Å; T561-N563 WeakPolarHBondContact OG1-CB 3.45Å; T561-N563 PolarHBondContact OG1-N 2.7Å; T561-E566 WeakPolarHBondContact CB-OE2 3.4Å; T561-E566 HydrophobicContact CG2-CB 4.21Å; T561-E566 HydrophobicContact CG2-CG 4.3Å; T561-E566 PolarHBondContact OG1-OE2 2.7Å; T561-I567 HydrophobicContact CG2-CG1 3.83Å; T561-N585 HydrophobicContact CG2-CB 4.26Å
562	S	70.3	Confident	67.3	Low	82 Å²	82	101 Å²	101	57%	0.573	50%	0.499	S	S	*	.			trans	-88.6	1.7	168.5	52.7	0	0	0	0	112.1	L564 Y589	S562-L564 PolarHBondContact O-N 3.3Å; S562-Y589 WeakPolarHBondContact O-CE2 3.38Å
563	N	85.8	Confident	70	Confident	83 Å²	83	91.1 Å²	91.1	44%	0.444	47%	0.465	S	S	.	.			trans	-85.5	104.2	-179.6	-175.5	-5.6	0	0	0	110.9	T561 K565 E566 I567	T561-N563 VanDerWaalsContact C-N 3.29Å; T561-N563 WeakPolarHBondContact OG1-CB 3.45Å; T561-N563 PolarHBondContact OG1-N 2.7Å; N563-K565 VanDerWaalsContact C-N 3.27Å; N563-K565 PolarHBondContact O-N 3.04Å; N563-K565 WeakPolarHBondContact OD1-CB 3.21Å; N563-K565 PolarHBondContact OD1-N 2.9Å; N563-K565 VanDerWaalsContact OD1-N 3.13Å; N563-E566 HydrophobicContact CB-CB 4.06Å; N563-E566 WeakPolarHBondContact O-CB 3.44Å; N563-E566 PolarHBondContact O-N 3.45Å; N563-I567 PolarHBondContact O-N 2.78Å; N563-I567 VanDerWaalsContact O-N 3.09Å
564	L	90.5	Very high	72.9	Confident	16 Å²	16	86.4 Å²	86.4	8%	0.084	46%	0.462	C	S	.	.	H	α-helix	trans	-58.8	-32.9	-179.1	-172.7	59.9	0	0	0	113.6	S562 E566 I567 I568 L586 Y589 L596 D600	S562-L564 PolarHBondContact O-N 3.3Å; L564-E566 VanDerWaalsContact C-N 3.32Å; L564-E566 PolarHBondContact O-N 3.39Å; L564-I567 PolarHBondContact O-N 2.94Å; L564-I568 HydrophobicContact CG-CD1 4.11Å; L564-I568 WeakPolarHBondContact O-CB 3.29Å; L564-I568 WeakPolarHBondContact O-CG1 3.4Å; L564-I568 PolarHBondContact O-N 2.71Å; L564-L586 HydrophobicContact CD1-CD1 4.26Å; L564-Y589 HydrophobicContact CB-CE2 4.18Å; L564-L596 HydrophobicContact CD1-CD2 3.81Å; L564-L596 HydrophobicContact CD2-CD2 3.48Å; L564-L596 VanDerWaalsContact CD2-CD2 3.48Å; L564-L596 HydrophobicContact CG-CD2 4.32Å; L564-D600 HydrophobicContact CD2-CB 3.84Å; L564-D600 VanDerWaalsContact CD2-CG 3.4Å; L564-D600 WeakPolarHBondContact CD2-OD1 3.48Å
565	K	91.5	Very high	75.6	Confident	136 Å²	136	80.9 Å²	80.9	59%	0.591	45%	0.446	S	S	*	.	H	α-helix	trans	-62.3	-39.5	172.8	-72.8	-163.7	176.9	-161.8	0	112	N563 I568 S569 E1213	N563-K565 VanDerWaalsContact C-N 3.27Å; N563-K565 PolarHBondContact O-N 3.04Å; N563-K565 WeakPolarHBondContact OD1-CB 3.21Å; N563-K565 PolarHBondContact OD1-N 2.9Å; N563-K565 VanDerWaalsContact OD1-N 3.13Å; K565-I568 PolarHBondContact O-N 3.44Å; K565-S569 PolarHBondContact O-N 3.27Å; K565-E1213 IonicContact NZ-OE1 2.72Å; K565-E1213 PolarHBondContact NZ-OE1 2.77Å
566	E	92.2	Very high	78.5	Confident	87 Å²	87	76.8 Å²	76.8	41%	0.407	42%	0.423	S	S	.	.	H	α-helix	trans	-68.4	-41.7	177.9	-164.3	-169.8	162.4	0	0	110.6	T561 N563 L564 S569 Q570	T561-E566 WeakPolarHBondContact CB-OE2 3.4Å; T561-E566 HydrophobicContact CG2-CB 4.21Å; T561-E566 HydrophobicContact CG2-CG 4.3Å; T561-E566 PolarHBondContact OG1-OE2 2.7Å; N563-E566 HydrophobicContact CB-CB 4.06Å; N563-E566 WeakPolarHBondContact O-CB 3.44Å; N563-E566 PolarHBondContact O-N 3.45Å; L564-E566 VanDerWaalsContact C-N 3.32Å; L564-E566 PolarHBondContact O-N 3.39Å; E566-S569 PolarHBondContact O-N 2.89Å; E566-Q570 WeakPolarHBondContact O-CB 3.48Å; E566-Q570 VanDerWaalsContact O-CG 3.26Å; E566-Q570 WeakPolarHBondContact O-CG 3.39Å; E566-Q570 PolarHBondContact O-N 3.44Å; E566-Q570 PolarHBondContact OE1-NE2 3.1Å; E566-Q570 VanDerWaalsContact OE1-NE2 3.12Å
567	I	94.4	Very high	81.5	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-58.7	-48.1	174	-63.3	175.4	0	0	0	110.7	T561 N563 L564 S569 Q570 L571 N585 L586 Y589	T561-I567 HydrophobicContact CG2-CG1 3.83Å; N563-I567 PolarHBondContact O-N 2.78Å; N563-I567 VanDerWaalsContact O-N 3.09Å; L564-I567 PolarHBondContact O-N 2.94Å; I567-S569 VanDerWaalsContact C-N 3.35Å; I567-S569 PolarHBondContact O-N 3.07Å; I567-Q570 WeakPolarHBondContact O-CB 3.44Å; I567-Q570 PolarHBondContact O-N 3.39Å; I567-L571 HydrophobicContact CG2-CD1 3.97Å; I567-L571 HydrophobicContact CG2-CG 4.49Å; I567-L571 VanDerWaalsContact O-CG 3.26Å; I567-L571 WeakPolarHBondContact O-CG 3.31Å; I567-L571 PolarHBondContact O-N 3.28Å; I567-N585 HydrophobicContact CD1-CB 4.07Å; I567-N585 HydrophobicContact CG1-CB 3.85Å; I567-L586 HydrophobicContact CG2-CB 3.69Å; I567-L586 HydrophobicContact CG2-CD1 4.11Å; I567-L586 HydrophobicContact CG2-CG 4.42Å; I567-Y589 HydrophobicContact CD1-CD2 4.13Å; I567-Y589 HydrophobicContact CD1-CG 4.26Å
568	I	94.9	Very high	84.5	Confident	25 Å²	25	71.1 Å²	71.1	13%	0.128	38%	0.378	C	S	.	.	H	α-helix	trans	-58.7	-45.2	176	-75.6	167.2	0	0	0	111.1	L564 K565 Q570 L571 Q572 L604 I607	L564-I568 HydrophobicContact CG-CD1 4.11Å; L564-I568 WeakPolarHBondContact O-CB 3.29Å; L564-I568 WeakPolarHBondContact O-CG1 3.4Å; L564-I568 PolarHBondContact O-N 2.71Å; K565-I568 PolarHBondContact O-N 3.44Å; I568-Q570 PolarHBondContact O-N 3.38Å; I568-L571 PolarHBondContact O-N 3.23Å; I568-Q572 WeakPolarHBondContact O-CG 3.17Å; I568-Q572 PolarHBondContact O-N 3.36Å; I568-Q572 VanDerWaalsContact O-N 3.1Å; I568-L604 HydrophobicContact CG1-CD2 4.47Å; I568-I607 HydrophobicContact CB-CD1 4.48Å; I568-I607 HydrophobicContact CG1-CD1 4.35Å; I568-I607 HydrophobicContact CG2-CD1 3.94Å
569	S	94.3	Very high	86.9	Confident	80 Å²	80	70.4 Å²	70.4	56%	0.559	37%	0.367	S	S	*	.	H	α-helix	trans	-64.7	-35.9	176.4	-173.4	0	0	0	0	113.1	K565 E566 I567 A573	K565-S569 PolarHBondContact O-N 3.27Å; E566-S569 PolarHBondContact O-N 2.89Å; I567-S569 VanDerWaalsContact C-N 3.35Å; I567-S569 PolarHBondContact O-N 3.07Å; S569-A573 PolarHBondContact O-N 2.69Å
570	Q	94.6	Very high	89.1	Confident	36 Å²	36	65 Å²	65	17%	0.168	34%	0.344	C	S	.	.	H	α-helix	trans	-67	-41.7	175.3	-74.7	170.4	10.5	0	0	111	E566 I567 I568 Q572 A573 D578 R579 N585	E566-Q570 WeakPolarHBondContact O-CB 3.48Å; E566-Q570 VanDerWaalsContact O-CG 3.26Å; E566-Q570 WeakPolarHBondContact O-CG 3.39Å; E566-Q570 PolarHBondContact O-N 3.44Å; E566-Q570 PolarHBondContact OE1-NE2 3.1Å; E566-Q570 VanDerWaalsContact OE1-NE2 3.12Å; I567-Q570 WeakPolarHBondContact O-CB 3.44Å; I567-Q570 PolarHBondContact O-N 3.39Å; I568-Q570 PolarHBondContact O-N 3.38Å; Q570-Q572 VanDerWaalsContact C-N 3.33Å; Q570-Q572 PolarHBondContact O-N 3Å; Q570-A573 VanDerWaalsContact O-CB 3.31Å; Q570-A573 WeakPolarHBondContact O-CB 3.08Å; Q570-A573 PolarHBondContact O-N 3.26Å; Q570-D578 CarbonylContact O-C 3.46Å; Q570-D578 VanDerWaalsContact O-C 3.31Å; Q570-R579 WeakPolarHBondContact O-CA 3.37Å; Q570-R579 PolarHBondContact O-N 3.23Å; Q570-N585 PolarHBondContact OE1-ND2 3.15Å
571	L	96	Very high	90.9	Very high	3 Å²	3	62.7 Å²	62.7	2%	0.016	33%	0.328	C	S	.	.	H	α-helix	trans	-67.2	-29.6	177.7	-67.9	166.4	0	0	0	113.7	I567 I568 R579 L583 L586 L604 I607 M611	I567-L571 HydrophobicContact CG2-CD1 3.97Å; I567-L571 HydrophobicContact CG2-CG 4.49Å; I567-L571 VanDerWaalsContact O-CG 3.26Å; I567-L571 WeakPolarHBondContact O-CG 3.31Å; I567-L571 PolarHBondContact O-N 3.28Å; I568-L571 PolarHBondContact O-N 3.23Å; L571-R579 VanDerWaalsContact O-CD 3.27Å; L571-R579 WeakPolarHBondContact O-CD 3.49Å; L571-R579 WeakPolarHBondContact O-CG 3.39Å; L571-L583 HydrophobicContact CD2-CB 4.29Å; L571-L583 HydrophobicContact CD2-CD2 3.67Å; L571-L583 HydrophobicContact CD2-CG 3.59Å; L571-L586 HydrophobicContact CD1-CD2 4.04Å; L571-L604 HydrophobicContact CD1-CD2 3.81Å; L571-I607 HydrophobicContact CB-CG2 3.77Å; L571-I607 HydrophobicContact CD1-CG2 4.49Å; L571-M611 HydrophobicContact CD2-CE 3.73Å; L571-M611 HydrophobicContact CD2-SD 4.14Å
572	Q	94.4	Very high	92.4	Very high	122 Å²	122	61.8 Å²	61.8	57%	0.57	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-5.8	176.7	-67.6	-177.2	4.9	0	0	113.8	I568 Q570 I607	I568-Q572 WeakPolarHBondContact O-CG 3.17Å; I568-Q572 PolarHBondContact O-N 3.36Å; I568-Q572 VanDerWaalsContact O-N 3.1Å; Q570-Q572 VanDerWaalsContact C-N 3.33Å; Q570-Q572 PolarHBondContact O-N 3Å; Q572-I607 HydrophobicContact CG-CD1 4.01Å; Q572-I607 HydrophobicContact CG-CG1 3.93Å
573	A	93	Very high	93.7	Very high	22 Å²	22	57.9 Å²	57.9	18%	0.182	30%	0.295	C	S	.	.			trans	-66.5	145.3	-175.6	0	0	0	0	0	113.2	S569 Q570 Q575 D578 R579	S569-A573 PolarHBondContact O-N 2.69Å; Q570-A573 VanDerWaalsContact O-CB 3.31Å; Q570-A573 WeakPolarHBondContact O-CB 3.08Å; Q570-A573 PolarHBondContact O-N 3.26Å; A573-Q575 VanDerWaalsContact C-N 3.29Å; A573-Q575 PolarHBondContact O-N 3.48Å; A573-D578 HydrophobicContact CB-CB 3.59Å; A573-R579 WeakPolarHBondContact O-CD 3.45Å; A573-R579 VanDerWaalsContact O-CG 3.23Å; A573-R579 WeakPolarHBondContact O-CG 3.35Å; A573-R579 PolarHBondContact O-NH1 2.91Å
574	V	92	Very high	94.1	Very high	138 Å²	138	56 Å²	56	84%	0.836	29%	0.287	S	S	*	.	S	Bend	trans	-67	-30.7	177.8	-177.5	0	0	0	0	111.8	R579	V574-R579 VanDerWaalsContact C-NH1 3.25Å; V574-R579 PolarHBondContact O-NH1 3.31Å
575	Q	91.9	Very high	94.2	Very high	112 Å²	112	55.3 Å²	55.3	52%	0.523	28%	0.283	S	S	.	.	S	Bend	trans	-76.9	135.5	177.2	-64.8	-61.6	-16.2	0	0	112	A573 S577 D578 R579	A573-Q575 VanDerWaalsContact C-N 3.29Å; A573-Q575 PolarHBondContact O-N 3.48Å; Q575-S577 VanDerWaalsContact C-N 3.34Å; Q575-D578 HydrophobicContact CB-CB 4.32Å; Q575-D578 PolarHBondContact O-N 3.13Å; Q575-R579 PolarHBondContact O-N 3.41Å; Q575-R579 PolarHBondContact O-NH1 3.03Å
576	W	93.5	Very high	94.4	Very high	94 Å²	94	48.9 Å²	48.9	36%	0.356	26%	0.255	S	S	.	.	H	α-helix	trans	-74.1	-25.4	-177.6	71.4	-93.6	0	0	0	113.2	D578 K580 Q616 K618 V619	W576-D578 VanDerWaalsContact C-N 3.31Å; W576-K580 HydrophobicContact CZ3-CD 4.31Å; W576-K580 WeakPolarHBondContact O-CB 3.45Å; W576-K580 PolarHBondContact O-N 3.21Å; W576-Q616 HydrophobicContact CB-CB 4.1Å; W576-Q616 HydrophobicContact CB-CG 3.72Å; W576-Q616 HydrophobicContact CG-CG 4.05Å; W576-K618 HydrophobicContact CH2-CD 4.35Å; W576-K618 HydrophobicContact CZ3-CB 4.43Å; W576-K618 HydrophobicContact CZ3-CD 4.04Å; W576-V619 HydrophobicContact CB-CG2 4.05Å; W576-V619 HydrophobicContact CE3-CG2 4.46Å; W576-V619 WeakPolarHBondContact O-CG2 3.24Å
577	S	94.9	Very high	94.4	Very high	40 Å²	40	45.4 Å²	45.4	28%	0.28	24%	0.239	S	C	.	.	H	α-helix	trans	-57.3	-49.3	170.3	40	0	0	0	0	110.4	Q575 K580 D581	Q575-S577 VanDerWaalsContact C-N 3.34Å; S577-K580 WeakPolarHBondContact O-CB 3.13Å; S577-K580 PolarHBondContact O-N 3.42Å; S577-D581 PolarHBondContact O-N 3.15Å
578	D	95.4	Very high	94.2	Very high	67 Å²	67	47.6 Å²	47.6	36%	0.358	25%	0.251	S	S	.	.	H	α-helix	trans	-70.4	-40.4	-171.5	-51.9	12.1	0	0	0	109.1	Q570 A573 Q575 W576 D581 G582	Q570-D578 CarbonylContact O-C 3.46Å; Q570-D578 VanDerWaalsContact O-C 3.31Å; A573-D578 HydrophobicContact CB-CB 3.59Å; Q575-D578 HydrophobicContact CB-CB 4.32Å; Q575-D578 PolarHBondContact O-N 3.13Å; W576-D578 VanDerWaalsContact C-N 3.31Å; D578-D581 PolarHBondContact O-N 3.44Å; D578-G582 PolarHBondContact O-N 3.49Å
579	R	96.1	Very high	94	Very high	37 Å²	37	48 Å²	48	14%	0.14	25%	0.251	C	S	.	.	H	α-helix	trans	-64.4	-39.6	171.8	-63.5	-161.8	-59.7	-76.7	3.2	113.5	Q570 L571 A573 V574 Q575 L583 M611 D614 V619	Q570-R579 WeakPolarHBondContact O-CA 3.37Å; Q570-R579 PolarHBondContact O-N 3.23Å; L571-R579 VanDerWaalsContact O-CD 3.27Å; L571-R579 WeakPolarHBondContact O-CD 3.49Å; L571-R579 WeakPolarHBondContact O-CG 3.39Å; A573-R579 WeakPolarHBondContact O-CD 3.45Å; A573-R579 VanDerWaalsContact O-CG 3.23Å; A573-R579 WeakPolarHBondContact O-CG 3.35Å; A573-R579 PolarHBondContact O-NH1 2.91Å; V574-R579 VanDerWaalsContact C-NH1 3.25Å; V574-R579 PolarHBondContact O-NH1 3.31Å; Q575-R579 PolarHBondContact O-N 3.41Å; Q575-R579 PolarHBondContact O-NH1 3.03Å; R579-L583 WeakPolarHBondContact O-CG 3.31Å; R579-L583 PolarHBondContact O-N 3.16Å; R579-M611 HydrophobicContact CB-CE 3.95Å; R579-M611 HydrophobicContact CG-CE 4.37Å; R579-D614 IonicContact CZ-OD2 2.88Å; R579-D614 IonicContact NE-OD2 3.68Å; R579-D614 PolarHBondContact NE-OD2 3.08Å; R579-D614 VanDerWaalsContact NH2-CG 3.34Å; R579-D614 IonicContact NH2-OD1 2.68Å; R579-D614 PolarHBondContact NH2-OD1 3.08Å; R579-D614 IonicContact NH2-OD2 3.34Å; R579-D614 PolarHBondContact NH2-OD2 3.33Å; R579-V619 HydrophobicContact CB-CG1 4.12Å
580	K	95.6	Very high	93.8	Very high	73 Å²	73	44.6 Å²	44.6	32%	0.317	23%	0.226	S	C	.	.	H	α-helix	trans	-61.6	-45.6	173.5	171.1	-166.5	152.5	-75.9	0	110.6	W576 S577 L583 T584 V619 L622	W576-K580 HydrophobicContact CZ3-CD 4.31Å; W576-K580 WeakPolarHBondContact O-CB 3.45Å; W576-K580 PolarHBondContact O-N 3.21Å; S577-K580 WeakPolarHBondContact O-CB 3.13Å; S577-K580 PolarHBondContact O-N 3.42Å; K580-L583 PolarHBondContact O-N 3.44Å; K580-T584 PolarHBondContact O-N 2.91Å; K580-T584 PolarHBondContact O-OG1 2.85Å; K580-V619 HydrophobicContact CB-CG2 4.39Å; K580-L622 HydrophobicContact CG-CD2 3.95Å; K580-L622 VanDerWaalsContact O-CD2 3.29Å; K580-L622 WeakPolarHBondContact O-CD2 3.27Å
581	D	94.7	Very high	93.5	Very high	45 Å²	45	49.5 Å²	49.5	24%	0.241	24%	0.243	C	C	.	.	H	α-helix	trans	-72.9	-35.4	-176.4	-67.7	-11.4	0	0	0	110.6	S577 D578 T584 N585	S577-D581 PolarHBondContact O-N 3.15Å; D578-D581 PolarHBondContact O-N 3.44Å; D581-T584 WeakPolarHBondContact O-CB 3.4Å; D581-T584 PolarHBondContact O-N 3.14Å; D581-N585 WeakPolarHBondContact O-CB 3.38Å; D581-N585 VanDerWaalsContact O-CG 3.27Å; D581-N585 PolarHBondContact O-N 2.94Å; D581-N585 PolarHBondContact O-ND2 3.09Å
582	G	95.1	Very high	93	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.2	-46.5	167.5	0	0	0	0	0	113.4	D578 T584 N585 L586	D578-G582 PolarHBondContact O-N 3.49Å; G582-T584 VanDerWaalsContact C-N 3.32Å; G582-T584 PolarHBondContact O-N 3.02Å; G582-N585 PolarHBondContact O-N 3.44Å; G582-L586 WeakPolarHBondContact O-CB 3.33Å; G582-L586 PolarHBondContact O-N 3.24Å
583	L	96.2	Very high	92.2	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62	-40	173.3	-74.6	168.2	0	0	0	111.9	L571 R579 K580 L586 Q587 F608 M611 V619 L622 F623 T626	L571-L583 HydrophobicContact CD2-CB 4.29Å; L571-L583 HydrophobicContact CD2-CD2 3.67Å; L571-L583 HydrophobicContact CD2-CG 3.59Å; R579-L583 WeakPolarHBondContact O-CG 3.31Å; R579-L583 PolarHBondContact O-N 3.16Å; K580-L583 PolarHBondContact O-N 3.44Å; L583-L586 PolarHBondContact O-N 3.37Å; L583-Q587 WeakPolarHBondContact O-CG 3.46Å; L583-Q587 PolarHBondContact O-N 3.12Å; L583-F608 HydrophobicContact CD2-CE1 4.26Å; L583-M611 HydrophobicContact CD1-CE 3.95Å; L583-M611 HydrophobicContact CD2-CE 4.19Å; L583-M611 HydrophobicContact CD2-SD 3.99Å; L583-M611 HydrophobicContact CG-CE 3.97Å; L583-M611 HydrophobicContact CG-SD 4.43Å; L583-V619 HydrophobicContact CD1-CG1 3.7Å; L583-L622 HydrophobicContact CB-CD2 3.66Å; L583-L622 HydrophobicContact CB-CG 3.88Å; L583-L622 HydrophobicContact CD1-CB 4.32Å; L583-L622 HydrophobicContact CD1-CD2 4.39Å; L583-L622 HydrophobicContact CD1-CG 4.29Å; L583-F623 HydrophobicContact CD1-CB 3.92Å; L583-F623 HydrophobicContact CD2-CB 4.5Å; L583-F623 HydrophobicContact CD2-CD2 4.32Å; L583-T626 HydrophobicContact CD2-CG2 4.1Å
584	T	94.5	Very high	91.5	Very high	43 Å²	43	55 Å²	55	26%	0.264	29%	0.287	S	S	.	.	H	α-helix	trans	-63.2	-45	177.6	-52.3	0	0	0	0	110.7	K580 D581 G582 Q587 N588 L622	K580-T584 PolarHBondContact O-N 2.91Å; K580-T584 PolarHBondContact O-OG1 2.85Å; D581-T584 WeakPolarHBondContact O-CB 3.4Å; D581-T584 PolarHBondContact O-N 3.14Å; G582-T584 VanDerWaalsContact C-N 3.32Å; G582-T584 PolarHBondContact O-N 3.02Å; T584-Q587 PolarHBondContact O-N 3.41Å; T584-N588 VanDerWaalsContact O-CG 3.25Å; T584-N588 PolarHBondContact O-N 3.37Å; T584-N588 VanDerWaalsContact O-N 3.14Å; T584-N588 PolarHBondContact O-ND2 2.93Å; T584-L622 WeakPolarHBondContact OG1-CD2 3.37Å
585	N	93.8	Very high	91	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.011	28%	0.278	C	S	.	.	H	α-helix	trans	-68.6	-38.8	177.8	-69.3	-32.1	0	0	0	111.8	T561 I567 Q570 D581 G582 N588 Y589	T561-N585 HydrophobicContact CG2-CB 4.26Å; I567-N585 HydrophobicContact CD1-CB 4.07Å; I567-N585 HydrophobicContact CG1-CB 3.85Å; Q570-N585 PolarHBondContact OE1-ND2 3.15Å; D581-N585 WeakPolarHBondContact O-CB 3.38Å; D581-N585 VanDerWaalsContact O-CG 3.27Å; D581-N585 PolarHBondContact O-N 2.94Å; D581-N585 PolarHBondContact O-ND2 3.09Å; G582-N585 PolarHBondContact O-N 3.44Å; N585-N588 PolarHBondContact O-N 3Å; N585-N588 VanDerWaalsContact O-N 3.16Å; N585-Y589 WeakPolarHBondContact O-CB 3.26Å; N585-Y589 PolarHBondContact O-N 2.52Å
586	L	94.7	Very high	90.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-45	174.2	-175.2	62.3	0	0	0	111.9	L564 I567 L571 G582 L583 N588 Y589 M590 L604 F608 T626	L564-L586 HydrophobicContact CD1-CD1 4.26Å; I567-L586 HydrophobicContact CG2-CB 3.69Å; I567-L586 HydrophobicContact CG2-CD1 4.11Å; I567-L586 HydrophobicContact CG2-CG 4.42Å; L571-L586 HydrophobicContact CD1-CD2 4.04Å; G582-L586 WeakPolarHBondContact O-CB 3.33Å; G582-L586 PolarHBondContact O-N 3.24Å; L583-L586 PolarHBondContact O-N 3.37Å; L586-N588 VanDerWaalsContact C-N 3.27Å; L586-N588 PolarHBondContact O-N 3.08Å; L586-Y589 PolarHBondContact O-N 3.42Å; L586-M590 HydrophobicContact CD1-CG 4.44Å; L586-M590 HydrophobicContact CG-CE 4.12Å; L586-M590 HydrophobicContact CG-SD 4.41Å; L586-M590 WeakPolarHBondContact O-CG 3.42Å; L586-M590 PolarHBondContact O-N 2.91Å; L586-L604 HydrophobicContact CD1-CD1 3.99Å; L586-L604 HydrophobicContact CD1-CD2 4.19Å; L586-L604 HydrophobicContact CD2-CD1 4.46Å; L586-L604 HydrophobicContact CD2-CD2 3.78Å; L586-F608 HydrophobicContact CD2-CE1 3.91Å; L586-F608 HydrophobicContact CD2-CZ 3.61Å; L586-T626 HydrophobicContact CD2-CG2 4.1Å
587	Q	91.8	Very high	90.5	Very high	15 Å²	15	48.4 Å²	48.4	7%	0.07	26%	0.263	C	S	.	.	H	α-helix	trans	-58.9	-40.1	173.8	-73.4	-167.8	9.2	0	0	112.1	L583 T584 R591 T626	L583-Q587 WeakPolarHBondContact O-CG 3.46Å; L583-Q587 PolarHBondContact O-N 3.12Å; T584-Q587 PolarHBondContact O-N 3.41Å; Q587-R591 VanDerWaalsContact O-CB 3.29Å; Q587-R591 WeakPolarHBondContact O-CB 3.17Å; Q587-R591 WeakPolarHBondContact O-CG 3.4Å; Q587-R591 PolarHBondContact O-N 3.3Å; Q587-R591 VanDerWaalsContact OE1-CZ 3.23Å; Q587-T626 HydrophobicContact CG-CG2 3.94Å; Q587-T626 WeakPolarHBondContact CG-OG1 3.3Å; Q587-T626 PolarHBondContact NE2-OG1 2.91Å
588	N	90.9	Very high	90.1	Very high	46 Å²	46	50.5 Å²	50.5	25%	0.246	28%	0.276	C	S	.	.	H	α-helix	trans	-70.4	-38	178.8	-67.7	-22.3	0	0	0	112.2	V560 T584 N585 L586 S592	V560-N588 HydrophobicContact CG1-CB 3.92Å; T584-N588 VanDerWaalsContact O-CG 3.25Å; T584-N588 PolarHBondContact O-N 3.37Å; T584-N588 VanDerWaalsContact O-N 3.14Å; T584-N588 PolarHBondContact O-ND2 2.93Å; N585-N588 PolarHBondContact O-N 3Å; N585-N588 VanDerWaalsContact O-N 3.16Å; L586-N588 VanDerWaalsContact C-N 3.27Å; L586-N588 PolarHBondContact O-N 3.08Å; N588-S592 WeakPolarHBondContact O-CB 3.38Å; N588-S592 PolarHBondContact O-N 3.47Å; N588-S592 PolarHBondContact O-OG 3.26Å
589	Y	90.8	Very high	89.8	Confident	32 Å²	32	53.6 Å²	53.6	13%	0.125	29%	0.292	C	S	.	.	H	α-helix	trans	-59	-54.7	174.7	-175.4	-83.7	0	0	0	111	S562 L564 I567 N585 L586 R591 S592 Y594 P595 L596	S562-Y589 WeakPolarHBondContact O-CE2 3.38Å; L564-Y589 HydrophobicContact CB-CE2 4.18Å; I567-Y589 HydrophobicContact CD1-CD2 4.13Å; I567-Y589 HydrophobicContact CD1-CG 4.26Å; N585-Y589 WeakPolarHBondContact O-CB 3.26Å; N585-Y589 PolarHBondContact O-N 2.52Å; L586-Y589 PolarHBondContact O-N 3.42Å; Y589-R591 PolarHBondContact O-N 3.42Å; Y589-S592 WeakPolarHBondContact O-CB 3.47Å; Y589-S592 PolarHBondContact O-N 3.49Å; Y589-S592 VanDerWaalsContact O-N 3.1Å; Y589-Y594 HydrophobicContact CD2-CD2 4.21Å; Y589-Y594 HydrophobicContact CE2-CD2 4.21Å; Y589-Y594 HydrophobicContact CE2-CG 4.24Å; Y589-P595 PolarHBondContact OH-O 3.24Å; Y589-L596 HydrophobicContact CD1-CD2 3.98Å; Y589-L596 HydrophobicContact CE1-CD2 3.5Å; Y589-L596 HydrophobicContact CE1-CG 4.24Å
590	M	90.2	Very high	89.7	Confident	10 Å²	10	53.7 Å²	53.7	5%	0.049	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-42.6	179.3	-60.7	-179.1	-61.5	0	0	111.9	L586 S592 G593 L596 T626 F629 F630 Y634	L586-M590 HydrophobicContact CD1-CG 4.44Å; L586-M590 HydrophobicContact CG-CE 4.12Å; L586-M590 HydrophobicContact CG-SD 4.41Å; L586-M590 WeakPolarHBondContact O-CG 3.42Å; L586-M590 PolarHBondContact O-N 2.91Å; M590-S592 PolarHBondContact O-N 3.21Å; M590-G593 PolarHBondContact O-N 3.48Å; M590-G593 VanDerWaalsContact O-N 3.13Å; M590-L596 HydrophobicContact CG-CD1 4.28Å; M590-L596 HydrophobicContact SD-CD1 4.4Å; M590-T626 HydrophobicContact CE-CG2 4.02Å; M590-F629 HydrophobicContact CB-CD1 4.17Å; M590-F629 HydrophobicContact CB-CE1 3.65Å; M590-F629 HydrophobicContact CB-CZ 4.45Å; M590-F629 HydrophobicContact CE-CD1 3.65Å; M590-F629 HydrophobicContact CE-CE1 4.3Å; M590-F629 HydrophobicContact CE-CG 4.36Å; M590-F629 HydrophobicContact SD-CD1 4.04Å; M590-F629 HydrophobicContact SD-CE1 4.38Å; M590-F630 HydrophobicContact SD-CB 4.48Å; M590-F630 HydrophobicContact SD-CD2 3.93Å; M590-Y634 HydrophobicContact CG-CE2 4.37Å; M590-Y634 HydrophobicContact SD-CE2 3.95Å
591	R	87.6	Confident	89.6	Confident	139 Å²	139	50.5 Å²	50.5	53%	0.525	28%	0.282	S	S	.	.	H	α-helix	trans	-65.7	-16.7	175.9	-74.4	176.9	-171.9	130	8.7	114.3	Q587 Y589 G593 F629	Q587-R591 VanDerWaalsContact O-CB 3.29Å; Q587-R591 WeakPolarHBondContact O-CB 3.17Å; Q587-R591 WeakPolarHBondContact O-CG 3.4Å; Q587-R591 PolarHBondContact O-N 3.3Å; Q587-R591 VanDerWaalsContact OE1-CZ 3.23Å; Y589-R591 PolarHBondContact O-N 3.42Å; R591-G593 VanDerWaalsContact C-N 3.27Å; R591-F629 HydrophobicContact CG-CE2 3.99Å; R591-F629 HydrophobicContact CG-CZ 4.12Å
592	S	84.9	Confident	89.5	Confident	80 Å²	80	53.7 Å²	53.7	56%	0.559	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-2.8	176.1	-58.5	0	0	0	0	112.9	N588 Y589 M590 Y594	N588-S592 WeakPolarHBondContact O-CB 3.38Å; N588-S592 PolarHBondContact O-N 3.47Å; N588-S592 PolarHBondContact O-OG 3.26Å; Y589-S592 WeakPolarHBondContact O-CB 3.47Å; Y589-S592 PolarHBondContact O-N 3.49Å; Y589-S592 VanDerWaalsContact O-N 3.1Å; M590-S592 PolarHBondContact O-N 3.21Å; S592-Y594 VanDerWaalsContact C-N 3.34Å
593	G	77.9	Confident	89.4	Confident	64 Å²	64	55.7 Å²	55.7	66%	0.66	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	13.3	179.1	0	0	0	0	0	114.5	M590 R591	M590-G593 PolarHBondContact O-N 3.48Å; M590-G593 VanDerWaalsContact O-N 3.13Å; R591-G593 VanDerWaalsContact C-N 3.27Å
594	Y	79.9	Confident	89.4	Confident	118 Å²	118	55.7 Å²	55.7	46%	0.463	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-72	126	170.5	-65.8	-66.1	0	0	0	109.7	Y589 S592	Y589-Y594 HydrophobicContact CD2-CD2 4.21Å; Y589-Y594 HydrophobicContact CE2-CD2 4.21Å; Y589-Y594 HydrophobicContact CE2-CG 4.24Å; S592-Y594 VanDerWaalsContact C-N 3.34Å
595	P	79.8	Confident	89.5	Confident	99 Å²	99	54 Å²	54	64%	0.643	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-66.6	150.3	174.1	29	-34.3	0	0	0	110.7	Y589	Y589-P595 PolarHBondContact OH-O 3.24Å
596	L	87.9	Confident	89.5	Confident	12 Å²	12	57 Å²	57	6%	0.063	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-102.3	135.8	165.8	-66	172.6	0	0	0	107.8	L564 Y589 M590 D600 I601 L604 F630 Y634	L564-L596 HydrophobicContact CD1-CD2 3.81Å; L564-L596 HydrophobicContact CD2-CD2 3.48Å; L564-L596 VanDerWaalsContact CD2-CD2 3.48Å; L564-L596 HydrophobicContact CG-CD2 4.32Å; Y589-L596 HydrophobicContact CD1-CD2 3.98Å; Y589-L596 HydrophobicContact CE1-CD2 3.5Å; Y589-L596 HydrophobicContact CE1-CG 4.24Å; M590-L596 HydrophobicContact CG-CD1 4.28Å; M590-L596 HydrophobicContact SD-CD1 4.4Å; L596-D600 HydrophobicContact CB-CB 4.34Å; L596-D600 HydrophobicContact CD2-CB 4.32Å; L596-I601 HydrophobicContact CB-CD1 4.11Å; L596-I601 HydrophobicContact CB-CG1 3.72Å; L596-I601 HydrophobicContact CD1-CG1 4.35Å; L596-L604 HydrophobicContact CD1-CD1 3.72Å; L596-L604 HydrophobicContact CD2-CD1 4.28Å; L596-F630 HydrophobicContact CD1-CE2 4.06Å; L596-Y634 HydrophobicContact CB-CE1 4.19Å; L596-Y634 HydrophobicContact CD1-CD2 4.46Å; L596-Y634 HydrophobicContact CD1-CE1 4.4Å; L596-Y634 HydrophobicContact CD1-CE2 3.73Å
597	N	86.9	Confident	89.6	Confident	94 Å²	94	57.3 Å²	57.3	50%	0.503	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-75.2	161.9	175	-62.2	-40.7	0	0	0	110.6	D599 D600 I601	N597-D599 PolarHBondContact O-N 3.48Å; N597-D600 VanDerWaalsContact CB-OD2 3.32Å; N597-D600 WeakPolarHBondContact CB-OD2 3.26Å; N597-D600 PolarHBondContact N-OD2 2.92Å; N597-D600 VanDerWaalsContact N-OD2 3.1Å; N597-D600 PolarHBondContact ND2-OD2 3.12Å; N597-D600 WeakPolarHBondContact O-CB 3.36Å; N597-D600 PolarHBondContact O-N 3.33Å; N597-D600 VanDerWaalsContact O-N 3.1Å; N597-I601 WeakPolarHBondContact O-CG1 3.32Å; N597-I601 PolarHBondContact O-N 2.96Å
598	P	87.9	Confident	89.8	Confident	85 Å²	85	56.6 Å²	56.6	55%	0.552	31%	0.31	S	S	*	.	H	α-helix	trans	-53.5	-38.3	176.7	-27.9	36.8	0	0	0	113.5	I601 H602	P598-I601 PolarHBondContact O-N 2.7Å; P598-H602 WeakPolarHBondContact O-CB 3.38Å; P598-H602 PolarHBondContact O-N 3.48Å
599	D	89.5	Confident	90	Very high	132 Å²	132	54.6 Å²	54.6	71%	0.706	30%	0.3	S	S	*	.	H	α-helix	trans	-68.3	-39.2	178.2	-51.2	-60.2	0	0	0	112.6	N597 I601 H602 C603	N597-D599 PolarHBondContact O-N 3.48Å; D599-I601 VanDerWaalsContact C-N 3.35Å; D599-H602 PolarHBondContact O-N 2.96Å; D599-C603 WeakPolarHBondContact O-CB 3.35Å; D599-C603 PolarHBondContact O-N 3.33Å
600	D	92.6	Very high	90.1	Very high	38 Å²	38	59.3 Å²	59.3	20%	0.203	32%	0.321	C	S	.	.	H	α-helix	trans	-64.6	-42	174.4	-63	-54	0	0	0	110.7	L564 L596 N597 C603 L604	L564-D600 HydrophobicContact CD2-CB 3.84Å; L564-D600 VanDerWaalsContact CD2-CG 3.4Å; L564-D600 WeakPolarHBondContact CD2-OD1 3.48Å; L596-D600 HydrophobicContact CB-CB 4.34Å; L596-D600 HydrophobicContact CD2-CB 4.32Å; N597-D600 VanDerWaalsContact CB-OD2 3.32Å; N597-D600 WeakPolarHBondContact CB-OD2 3.26Å; N597-D600 PolarHBondContact N-OD2 2.92Å; N597-D600 VanDerWaalsContact N-OD2 3.1Å; N597-D600 PolarHBondContact ND2-OD2 3.12Å; N597-D600 WeakPolarHBondContact O-CB 3.36Å; N597-D600 PolarHBondContact O-N 3.33Å; N597-D600 VanDerWaalsContact O-N 3.1Å; D600-C603 PolarHBondContact O-N 3.09Å; D600-L604 WeakPolarHBondContact O-CB 3.43Å; D600-L604 VanDerWaalsContact O-CG 3.26Å; D600-L604 WeakPolarHBondContact O-CG 3.43Å; D600-L604 PolarHBondContact O-N 3.38Å
601	I	93.4	Very high	90.3	Very high	7 Å²	7	59.2 Å²	59.2	4%	0.036	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-43.5	176.1	-68.7	168.8	0	0	0	110	L596 N597 P598 D599 L604 T605 F630 Y634 L637 L638	L596-I601 HydrophobicContact CB-CD1 4.11Å; L596-I601 HydrophobicContact CB-CG1 3.72Å; L596-I601 HydrophobicContact CD1-CG1 4.35Å; N597-I601 WeakPolarHBondContact O-CG1 3.32Å; N597-I601 PolarHBondContact O-N 2.96Å; P598-I601 PolarHBondContact O-N 2.7Å; D599-I601 VanDerWaalsContact C-N 3.35Å; I601-L604 PolarHBondContact O-N 3.24Å; I601-T605 WeakPolarHBondContact O-CG2 3.18Å; I601-T605 PolarHBondContact O-N 3.3Å; I601-T605 PolarHBondContact O-OG1 3.37Å; I601-F630 HydrophobicContact CG2-CZ 4.01Å; I601-Y634 HydrophobicContact CD1-CD1 3.58Å; I601-Y634 HydrophobicContact CD1-CE1 4.11Å; I601-Y634 HydrophobicContact CD1-CG 4.11Å; I601-Y634 HydrophobicContact CG1-CD1 4.39Å; I601-L637 HydrophobicContact CD1-CD1 3.49Å; I601-L637 VanDerWaalsContact CD1-CD1 3.49Å; I601-L638 HydrophobicContact CG2-CD2 3.79Å
602	H	92.7	Very high	90.6	Very high	111 Å²	111	53.3 Å²	53.3	51%	0.514	30%	0.299	S	S	.	.	H	α-helix	trans	-65.2	-39.5	175.2	-171.5	-86.1	0	0	0	112.4	P598 D599 L604 T605 E606	P598-H602 WeakPolarHBondContact O-CB 3.38Å; P598-H602 PolarHBondContact O-N 3.48Å; D599-H602 PolarHBondContact O-N 2.96Å; H602-L604 VanDerWaalsContact C-N 3.34Å; H602-L604 PolarHBondContact O-N 2.94Å; H602-T605 WeakPolarHBondContact CA-OG1 3.24Å; H602-T605 PolarHBondContact O-N 3.32Å; H602-T605 PolarHBondContact O-OG1 3.47Å; H602-E606 PolarHBondContact O-N 3.33Å; H602-E606 VanDerWaalsContact O-N 3.14Å
603	C	94.5	Very high	90.9	Very high	42 Å²	42	53.1 Å²	53.1	28%	0.284	30%	0.302	S	S	.	.	H	α-helix	trans	-62	-43.2	173.2	-167.1	0	0	0	0	111.3	D599 D600 E606 I607	D599-C603 WeakPolarHBondContact O-CB 3.35Å; D599-C603 PolarHBondContact O-N 3.33Å; D600-C603 PolarHBondContact O-N 3.09Å; C603-E606 PolarHBondContact O-N 3.05Å; C603-I607 WeakPolarHBondContact O-CD1 3.25Å; C603-I607 VanDerWaalsContact O-CG1 3.25Å; C603-I607 WeakPolarHBondContact O-CG1 3.49Å; C603-I607 PolarHBondContact O-N 2.79Å
604	L	96	Very high	91.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-68.4	-38	178.5	-72.8	168.6	0	0	0	113	I568 L571 L586 L596 D600 I601 H602 E606 I607 F608 F630	I568-L604 HydrophobicContact CG1-CD2 4.47Å; L571-L604 HydrophobicContact CD1-CD2 3.81Å; L586-L604 HydrophobicContact CD1-CD1 3.99Å; L586-L604 HydrophobicContact CD1-CD2 4.19Å; L586-L604 HydrophobicContact CD2-CD1 4.46Å; L586-L604 HydrophobicContact CD2-CD2 3.78Å; L596-L604 HydrophobicContact CD1-CD1 3.72Å; L596-L604 HydrophobicContact CD2-CD1 4.28Å; D600-L604 WeakPolarHBondContact O-CB 3.43Å; D600-L604 VanDerWaalsContact O-CG 3.26Å; D600-L604 WeakPolarHBondContact O-CG 3.43Å; D600-L604 PolarHBondContact O-N 3.38Å; I601-L604 PolarHBondContact O-N 3.24Å; H602-L604 VanDerWaalsContact C-N 3.34Å; H602-L604 PolarHBondContact O-N 2.94Å; L604-E606 VanDerWaalsContact C-N 3.32Å; L604-E606 PolarHBondContact O-N 3.47Å; L604-I607 PolarHBondContact O-N 3.1Å; L604-F608 VanDerWaalsContact O-CB 3.3Å; L604-F608 WeakPolarHBondContact O-CB 3.42Å; L604-F608 WeakPolarHBondContact O-CG 3.43Å; L604-F608 PolarHBondContact O-N 2.86Å; L604-F630 HydrophobicContact CB-CE2 4.33Å; L604-F630 HydrophobicContact CB-CZ 4.05Å; L604-F630 HydrophobicContact CD1-CE2 4.08Å
605	T	96.1	Very high	92.1	Very high	7 Å²	7	50 Å²	50	4%	0.043	29%	0.286	C	S	.	.	H	α-helix	trans	-65.6	-35.9	174	55.3	0	0	0	0	111.9	I601 H602 S609 F630 L638 W641	I601-T605 WeakPolarHBondContact O-CG2 3.18Å; I601-T605 PolarHBondContact O-N 3.3Å; I601-T605 PolarHBondContact O-OG1 3.37Å; H602-T605 WeakPolarHBondContact CA-OG1 3.24Å; H602-T605 PolarHBondContact O-N 3.32Å; H602-T605 PolarHBondContact O-OG1 3.47Å; T605-S609 WeakPolarHBondContact O-CB 3.49Å; T605-S609 PolarHBondContact O-N 3.39Å; T605-S609 PolarHBondContact O-OG 2.99Å; T605-F630 HydrophobicContact CG2-CE1 4.01Å; T605-F630 HydrophobicContact CG2-CZ 4.35Å; T605-L638 HydrophobicContact CG2-CD2 3.49Å; T605-L638 VanDerWaalsContact CG2-CD2 3.49Å; T605-W641 HydrophobicContact CG2-CB 4.27Å; T605-W641 HydrophobicContact CG2-CD2 3.51Å; T605-W641 HydrophobicContact CG2-CE3 3.57Å; T605-W641 HydrophobicContact CG2-CG 3.85Å; T605-W641 HydrophobicContact CG2-CH2 4.45Å; T605-W641 HydrophobicContact CG2-CZ2 4.42Å; T605-W641 HydrophobicContact CG2-CZ3 4.05Å
606	E	94.5	Very high	92.8	Very high	66 Å²	66	49.1 Å²	49.1	31%	0.308	27%	0.274	S	S	.	.	H	α-helix	trans	-67.5	-32.2	173.2	-93.1	-58.5	114.5	0	0	113.9	H602 C603 L604 K610	H602-E606 PolarHBondContact O-N 3.33Å; H602-E606 VanDerWaalsContact O-N 3.14Å; C603-E606 PolarHBondContact O-N 3.05Å; L604-E606 VanDerWaalsContact C-N 3.32Å; L604-E606 PolarHBondContact O-N 3.47Å; E606-K610 WeakPolarHBondContact O-CD 3.45Å; E606-K610 PolarHBondContact O-NZ 3.23Å; E606-K610 IonicContact OE2-NZ 2.71Å; E606-K610 PolarHBondContact OE2-NZ 2.67Å
607	I	96	Very high	92.9	Very high	7 Å²	7	50.9 Å²	50.9	4%	0.036	29%	0.287	C	S	.	.	H	α-helix	trans	-75	-49.7	174.2	-69.1	163.5	0	0	0	110.1	I568 L571 Q572 C603 L604 S609 K610 M611	I568-I607 HydrophobicContact CB-CD1 4.48Å; I568-I607 HydrophobicContact CG1-CD1 4.35Å; I568-I607 HydrophobicContact CG2-CD1 3.94Å; L571-I607 HydrophobicContact CB-CG2 3.77Å; L571-I607 HydrophobicContact CD1-CG2 4.49Å; Q572-I607 HydrophobicContact CG-CD1 4.01Å; Q572-I607 HydrophobicContact CG-CG1 3.93Å; C603-I607 WeakPolarHBondContact O-CD1 3.25Å; C603-I607 VanDerWaalsContact O-CG1 3.25Å; C603-I607 WeakPolarHBondContact O-CG1 3.49Å; C603-I607 PolarHBondContact O-N 2.79Å; L604-I607 PolarHBondContact O-N 3.1Å; I607-S609 VanDerWaalsContact C-N 3.25Å; I607-S609 PolarHBondContact O-N 3.41Å; I607-K610 WeakPolarHBondContact O-CA 3.36Å; I607-K610 WeakPolarHBondContact O-CB 3.27Å; I607-K610 PolarHBondContact O-N 3.39Å; I607-M611 HydrophobicContact CG2-CG 4.36Å; I607-M611 HydrophobicContact CG2-SD 4.25Å; I607-M611 WeakPolarHBondContact O-CG 3.39Å; I607-M611 PolarHBondContact O-N 3.37Å
608	F	96.7	Very high	93.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.6	-36.9	178	-72.3	-3	0	0	0	112	L583 L586 L604 K610 M611 F612 F623 T626 L627 F630 W641	L583-F608 HydrophobicContact CD2-CE1 4.26Å; L586-F608 HydrophobicContact CD2-CE1 3.91Å; L586-F608 HydrophobicContact CD2-CZ 3.61Å; L604-F608 VanDerWaalsContact O-CB 3.3Å; L604-F608 WeakPolarHBondContact O-CB 3.42Å; L604-F608 WeakPolarHBondContact O-CG 3.43Å; L604-F608 PolarHBondContact O-N 2.86Å; F608-K610 PolarHBondContact O-N 2.98Å; F608-M611 HydrophobicContact CD1-SD 4.03Å; F608-M611 HydrophobicContact CE1-SD 4.4Å; F608-M611 PolarHBondContact O-N 2.99Å; F608-M611 VanDerWaalsContact O-N 3.1Å; F608-F612 WeakPolarHBondContact O-CD2 3.38Å; F608-F612 PolarHBondContact O-N 3.42Å; F608-F623 HydrophobicContact CB-CE2 3.74Å; F608-F623 HydrophobicContact CB-CZ 4.06Å; F608-F623 HydrophobicContact CD1-CD2 4.23Å; F608-F623 AromaticContact CD1-CE2 3.7Å; F608-F623 HydrophobicContact CD1-CE2 3.7Å; F608-F623 HydrophobicContact CD2-CE2 4.18Å; F608-F623 HydrophobicContact CE1-CD2 4.47Å; F608-F623 HydrophobicContact CE1-CE2 4.29Å; F608-F623 AromaticContact CG-CE2 3.62Å; F608-F623 HydrophobicContact CG-CE2 3.62Å; F608-F623 HydrophobicContact CG-CZ 4.41Å; F608-T626 HydrophobicContact CZ-CG2 4.08Å; F608-L627 HydrophobicContact CD2-CD1 4.15Å; F608-F630 HydrophobicContact CD2-CD1 4.01Å; F608-F630 HydrophobicContact CD2-CE1 4.09Å; F608-F630 HydrophobicContact CE2-CB 4.11Å; F608-F630 AromaticContact CE2-CD1 3.61Å; F608-F630 HydrophobicContact CE2-CD1 3.61Å; F608-F630 HydrophobicContact CE2-CD2 4.29Å; F608-F630 AromaticContact CE2-CE1 3.95Å; F608-F630 HydrophobicContact CE2-CE1 3.95Å; F608-F630 AromaticContact CE2-CG 3.78Å; F608-F630 HydrophobicContact CE2-CG 3.78Å; F608-F630 HydrophobicContact CE2-CZ 4.44Å; F608-W641 HydrophobicContact CB-CH2 3.8Å; F608-W641 HydrophobicContact CB-CZ2 3.92Å; F608-W641 HydrophobicContact CD2-CH2 4.11Å
609	S	94.4	Very high	93.5	Very high	4 Å²	4	49.2 Å²	49.2	3%	0.028	27%	0.266	C	S	.	.	H	α-helix	trans	-55.2	-31.6	172	-70.9	0	0	0	0	113.5	T605 I607 W641 R648	T605-S609 WeakPolarHBondContact O-CB 3.49Å; T605-S609 PolarHBondContact O-N 3.39Å; T605-S609 PolarHBondContact O-OG 2.99Å; I607-S609 VanDerWaalsContact C-N 3.25Å; I607-S609 PolarHBondContact O-N 3.41Å; S609-W641 PolarHBondContact OG-NE1 3.38Å; S609-R648 VanDerWaalsContact CB-NH1 3.33Å; S609-R648 WeakPolarHBondContact O-CD 3.19Å; S609-R648 PolarHBondContact O-NE 2.8Å; S609-R648 PolarHBondContact OG-NH1 3.21Å; S609-R648 VanDerWaalsContact OG-NH1 3.15Å
610	K	93.5	Very high	93.7	Very high	131 Å²	131	43 Å²	43	57%	0.57	23%	0.233	S	C	*	.	H	α-helix	trans	-86.8	-36.3	175.1	-65.1	158.7	-171	123.8	0	111.5	E606 I607 F608 F612 A613	E606-K610 WeakPolarHBondContact O-CD 3.45Å; E606-K610 PolarHBondContact O-NZ 3.23Å; E606-K610 IonicContact OE2-NZ 2.71Å; E606-K610 PolarHBondContact OE2-NZ 2.67Å; I607-K610 WeakPolarHBondContact O-CA 3.36Å; I607-K610 WeakPolarHBondContact O-CB 3.27Å; I607-K610 PolarHBondContact O-N 3.39Å; F608-K610 PolarHBondContact O-N 2.98Å; K610-F612 PolarHBondContact O-N 2.97Å; K610-A613 WeakPolarHBondContact O-CB 3.18Å; K610-A613 PolarHBondContact O-N 3.49Å
611	M	94.6	Very high	93.6	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.039	24%	0.239	C	C	.	.	H	α-helix	trans	-62	-23.4	177.5	-65.9	-169.9	121	0	0	114.3	L571 R579 L583 I607 F608 A613 D614 V619 F623	L571-M611 HydrophobicContact CD2-CE 3.73Å; L571-M611 HydrophobicContact CD2-SD 4.14Å; R579-M611 HydrophobicContact CB-CE 3.95Å; R579-M611 HydrophobicContact CG-CE 4.37Å; L583-M611 HydrophobicContact CD1-CE 3.95Å; L583-M611 HydrophobicContact CD2-CE 4.19Å; L583-M611 HydrophobicContact CD2-SD 3.99Å; L583-M611 HydrophobicContact CG-CE 3.97Å; L583-M611 HydrophobicContact CG-SD 4.43Å; I607-M611 HydrophobicContact CG2-CG 4.36Å; I607-M611 HydrophobicContact CG2-SD 4.25Å; I607-M611 WeakPolarHBondContact O-CG 3.39Å; I607-M611 PolarHBondContact O-N 3.37Å; F608-M611 HydrophobicContact CD1-SD 4.03Å; F608-M611 HydrophobicContact CE1-SD 4.4Å; F608-M611 PolarHBondContact O-N 2.99Å; F608-M611 VanDerWaalsContact O-N 3.1Å; M611-A613 PolarHBondContact O-N 2.71Å; M611-A613 VanDerWaalsContact O-N 3.13Å; M611-D614 WeakPolarHBondContact O-CB 3.35Å; M611-D614 PolarHBondContact O-N 2.73Å; M611-V619 HydrophobicContact CE-CG1 4.05Å; M611-F623 HydrophobicContact CB-CD1 4.23Å; M611-F623 HydrophobicContact CB-CD2 4.04Å; M611-F623 HydrophobicContact CB-CE1 4.13Å; M611-F623 HydrophobicContact CB-CE2 3.96Å; M611-F623 HydrophobicContact CB-CG 4.19Å; M611-F623 HydrophobicContact CB-CZ 4Å; M611-F623 HydrophobicContact SD-CD2 4.03Å; M611-F623 HydrophobicContact SD-CE2 4.42Å
612	F	93.5	Very high	93.7	Very high	14 Å²	14	44.4 Å²	44.4	6%	0.061	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-24.7	169.4	-82.6	-74.5	0	0	0	114.1	F608 K610 F623 M624 L627 W641 L645 R648 L649 R652	F608-F612 WeakPolarHBondContact O-CD2 3.38Å; F608-F612 PolarHBondContact O-N 3.42Å; K610-F612 PolarHBondContact O-N 2.97Å; F612-F623 HydrophobicContact CD1-CE1 4Å; F612-F623 HydrophobicContact CD2-CE1 4.18Å; F612-F623 AromaticContact CD2-CZ 4Å; F612-F623 HydrophobicContact CD2-CZ 4Å; F612-F623 HydrophobicContact CE1-CE1 4.08Å; F612-F623 HydrophobicContact CE1-CZ 4.44Å; F612-F623 HydrophobicContact CE2-CE1 4.27Å; F612-F623 AromaticContact CE2-CZ 3.88Å; F612-F623 HydrophobicContact CE2-CZ 3.88Å; F612-F623 HydrophobicContact CG-CE1 4.05Å; F612-F623 HydrophobicContact CG-CZ 4.34Å; F612-F623 HydrophobicContact CZ-CE1 4.22Å; F612-F623 HydrophobicContact CZ-CZ 4.11Å; F612-M624 HydrophobicContact CD1-CE 4.42Å; F612-M624 HydrophobicContact CE1-CE 4.23Å; F612-L627 HydrophobicContact CE1-CD2 4.23Å; F612-L627 HydrophobicContact CE2-CD2 4.38Å; F612-L627 HydrophobicContact CZ-CD2 3.6Å; F612-W641 HydrophobicContact CE2-CH2 4.5Å; F612-W641 HydrophobicContact CE2-CZ2 4.38Å; F612-L645 HydrophobicContact CE2-CD1 4.16Å; F612-L645 HydrophobicContact CZ-CD1 3.8Å; F612-R648 HydrophobicContact CB-CB 4.31Å; F612-R648 HydrophobicContact CD1-CB 4.05Å; F612-R648 HydrophobicContact CD2-CB 3.7Å; F612-R648 HydrophobicContact CD2-CG 4.28Å; F612-R648 HydrophobicContact CE1-CB 4.28Å; F612-R648 HydrophobicContact CE2-CB 3.94Å; F612-R648 HydrophobicContact CG-CB 3.76Å; F612-R648 HydrophobicContact CG-CG 4.47Å; F612-R648 HydrophobicContact CZ-CB 4.22Å; F612-L649 HydrophobicContact CE1-CD2 3.77Å; F612-L649 HydrophobicContact CE1-CG 3.86Å; F612-L649 HydrophobicContact CZ-CD2 4.18Å; F612-L649 HydrophobicContact CZ-CG 3.96Å; F612-R652 HydrophobicContact CD1-CB 4.49Å; F612-R652 PolarHBondContact O-NH1 3.45Å
613	A	91.4	Very high	93.8	Very high	76 Å²	76	39.2 Å²	39.2	63%	0.628	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-0.8	176.4	0	0	0	0	0	114	K610 M611 S615	K610-A613 WeakPolarHBondContact O-CB 3.18Å; K610-A613 PolarHBondContact O-N 3.49Å; M611-A613 PolarHBondContact O-N 2.71Å; M611-A613 VanDerWaalsContact O-N 3.13Å; A613-S615 PolarHBondContact O-N 3.06Å
614	D	92.3	Very high	93.9	Very high	14 Å²	14	37.3 Å²	37.3	8%	0.075	21%	0.207	C	C	.	.			trans	-65.1	136.3	-176.3	-157.3	-36.9	0	0	0	111.7	R579 M611 Q616 V619 V620 R652	R579-D614 IonicContact CZ-OD2 2.88Å; R579-D614 IonicContact NE-OD2 3.68Å; R579-D614 PolarHBondContact NE-OD2 3.08Å; R579-D614 VanDerWaalsContact NH2-CG 3.34Å; R579-D614 IonicContact NH2-OD1 2.68Å; R579-D614 PolarHBondContact NH2-OD1 3.08Å; R579-D614 IonicContact NH2-OD2 3.34Å; R579-D614 PolarHBondContact NH2-OD2 3.33Å; M611-D614 WeakPolarHBondContact O-CB 3.35Å; M611-D614 PolarHBondContact O-N 2.73Å; D614-Q616 WeakPolarHBondContact OD1-CB 3.25Å; D614-Q616 PolarHBondContact OD1-N 2.89Å; D614-V619 WeakPolarHBondContact OD2-CG1 3.5Å; D614-V620 HydrophobicContact CB-CG2 4.11Å; D614-V620 VanDerWaalsContact O-CG2 3.25Å; D614-V620 WeakPolarHBondContact O-CG2 3.5Å; D614-R652 PolarHBondContact O-NH1 2.92Å; D614-R652 PolarHBondContact O-NH2 2.95Å
615	S	90.1	Very high	93.8	Very high	103 Å²	103	41.4 Å²	41.4	72%	0.72	23%	0.229	S	C	*	.			trans	-89.6	-16.4	-179.7	57.4	0	0	0	0	113.1	A613 S617	A613-S615 PolarHBondContact O-N 3.06Å; S615-S617 PolarHBondContact O-N 3.06Å
616	Q	93.3	Very high	93.8	Very high	81 Å²	81	41 Å²	41	38%	0.379	23%	0.227	S	C	.	.			trans	-88.4	105.5	-171.4	-68.9	-69.6	-9.7	0	0	111.8	W576 D614 K618 V619 V620	W576-Q616 HydrophobicContact CB-CB 4.1Å; W576-Q616 HydrophobicContact CB-CG 3.72Å; W576-Q616 HydrophobicContact CG-CG 4.05Å; D614-Q616 WeakPolarHBondContact OD1-CB 3.25Å; D614-Q616 PolarHBondContact OD1-N 2.89Å; Q616-K618 PolarHBondContact O-N 3.46Å; Q616-V619 HydrophobicContact CB-CB 4.37Å; Q616-V619 HydrophobicContact CB-CG2 3.95Å; Q616-V619 WeakPolarHBondContact O-CA 3.48Å; Q616-V619 WeakPolarHBondContact O-CB 3.41Å; Q616-V619 PolarHBondContact O-N 2.93Å; Q616-V620 PolarHBondContact O-N 3.38Å
617	S	90.6	Very high	93.9	Very high	48 Å²	48	37.9 Å²	37.9	34%	0.336	21%	0.212	S	C	.	.	H	α-helix	trans	-51.9	-31.5	-175.3	170.5	0	0	0	0	115.3	S615 V620 S621 H661	S615-S617 PolarHBondContact O-N 3.06Å; S617-V620 WeakPolarHBondContact O-CA 3.47Å; S617-V620 PolarHBondContact O-N 3.48Å; S617-S621 PolarHBondContact O-N 2.95Å; S617-S621 PolarHBondContact O-OG 3.25Å; S617-H661 PolarHBondContact OG-CE1 3Å; S617-H661 PolarHBondContact OG-NE2 3.48Å
618	K	92.1	Very high	93.8	Very high	143 Å²	143	38.7 Å²	38.7	62%	0.622	22%	0.216	S	C	*	.	H	α-helix	trans	-68	-37.6	174.5	-69.1	-176.6	177.9	179.7	0	112.9	W576 Q616 L622	W576-K618 HydrophobicContact CH2-CD 4.35Å; W576-K618 HydrophobicContact CZ3-CB 4.43Å; W576-K618 HydrophobicContact CZ3-CD 4.04Å; Q616-K618 PolarHBondContact O-N 3.46Å; K618-L622 PolarHBondContact O-N 3.12Å
619	V	95.2	Very high	93.7	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-73.5	-46.2	172.2	-169.9	0	0	0	0	109	W576 R579 K580 L583 M611 D614 Q616 S621 L622 F623	W576-V619 HydrophobicContact CB-CG2 4.05Å; W576-V619 HydrophobicContact CE3-CG2 4.46Å; W576-V619 WeakPolarHBondContact O-CG2 3.24Å; R579-V619 HydrophobicContact CB-CG1 4.12Å; K580-V619 HydrophobicContact CB-CG2 4.39Å; L583-V619 HydrophobicContact CD1-CG1 3.7Å; M611-V619 HydrophobicContact CE-CG1 4.05Å; D614-V619 WeakPolarHBondContact OD2-CG1 3.5Å; Q616-V619 HydrophobicContact CB-CB 4.37Å; Q616-V619 HydrophobicContact CB-CG2 3.95Å; Q616-V619 WeakPolarHBondContact O-CA 3.48Å; Q616-V619 WeakPolarHBondContact O-CB 3.41Å; Q616-V619 PolarHBondContact O-N 2.93Å; V619-S621 PolarHBondContact O-N 3.49Å; V619-L622 PolarHBondContact O-N 3.13Å; V619-F623 WeakPolarHBondContact O-CB 3.36Å; V619-F623 PolarHBondContact O-N 3.12Å
620	V	93.2	Very high	93.7	Very high	1 Å²	1	41 Å²	41	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-22.1	-75.2	160	169.6	0	0	0	0	114.4	D614 Q616 S617 F623 M624	D614-V620 HydrophobicContact CB-CG2 4.11Å; D614-V620 VanDerWaalsContact O-CG2 3.25Å; D614-V620 WeakPolarHBondContact O-CG2 3.5Å; Q616-V620 PolarHBondContact O-N 3.38Å; S617-V620 WeakPolarHBondContact O-CA 3.47Å; S617-V620 PolarHBondContact O-N 3.48Å; V620-F623 PolarHBondContact O-N 3.04Å; V620-M624 HydrophobicContact CG1-CE 4.34Å; V620-M624 PolarHBondContact O-N 3.28Å
621	S	91.8	Very high	93.8	Very high	46 Å²	46	34.8 Å²	34.8	32%	0.322	20%	0.199	S	C	.	.	H	α-helix	trans	-64.6	-49.4	-172.1	-53.6	0	0	0	0	111.1	S617 V619 F623 M624 D625	S617-S621 PolarHBondContact O-N 2.95Å; S617-S621 PolarHBondContact O-OG 3.25Å; V619-S621 PolarHBondContact O-N 3.49Å; S621-F623 VanDerWaalsContact C-N 3.28Å; S621-F623 PolarHBondContact O-N 3.38Å; S621-M624 PolarHBondContact O-N 3.34Å; S621-D625 PolarHBondContact O-N 2.97Å
622	L	94.4	Very high	93.8	Very high	30 Å²	30	38.9 Å²	38.9	16%	0.157	22%	0.216	C	C	.	.	H	α-helix	trans	-65.3	-32	-179.5	-174.5	63.9	0	0	0	112.3	K580 L583 T584 K618 V619 T626	K580-L622 HydrophobicContact CG-CD2 3.95Å; K580-L622 VanDerWaalsContact O-CD2 3.29Å; K580-L622 WeakPolarHBondContact O-CD2 3.27Å; L583-L622 HydrophobicContact CB-CD2 3.66Å; L583-L622 HydrophobicContact CB-CG 3.88Å; L583-L622 HydrophobicContact CD1-CB 4.32Å; L583-L622 HydrophobicContact CD1-CD2 4.39Å; L583-L622 HydrophobicContact CD1-CG 4.29Å; T584-L622 WeakPolarHBondContact OG1-CD2 3.37Å; K618-L622 PolarHBondContact O-N 3.12Å; V619-L622 PolarHBondContact O-N 3.13Å; L622-T626 WeakPolarHBondContact O-CB 3.17Å; L622-T626 PolarHBondContact O-N 3.38Å; L622-T626 PolarHBondContact O-OG1 3.01Å
623	F	96.6	Very high	93.7	Very high	1 Å²	1	43.8 Å²	43.8	0%	0.004	24%	0.239	C	C	.	.	H	α-helix	trans	-65.1	-45.4	174.7	169.9	-123.3	0	0	0	111.2	L583 F608 M611 F612 V619 V620 S621 D625 T626 L627	L583-F623 HydrophobicContact CD1-CB 3.92Å; L583-F623 HydrophobicContact CD2-CB 4.5Å; L583-F623 HydrophobicContact CD2-CD2 4.32Å; F608-F623 HydrophobicContact CB-CE2 3.74Å; F608-F623 HydrophobicContact CB-CZ 4.06Å; F608-F623 HydrophobicContact CD1-CD2 4.23Å; F608-F623 AromaticContact CD1-CE2 3.7Å; F608-F623 HydrophobicContact CD1-CE2 3.7Å; F608-F623 HydrophobicContact CD2-CE2 4.18Å; F608-F623 HydrophobicContact CE1-CD2 4.47Å; F608-F623 HydrophobicContact CE1-CE2 4.29Å; F608-F623 AromaticContact CG-CE2 3.62Å; F608-F623 HydrophobicContact CG-CE2 3.62Å; F608-F623 HydrophobicContact CG-CZ 4.41Å; M611-F623 HydrophobicContact CB-CD1 4.23Å; M611-F623 HydrophobicContact CB-CD2 4.04Å; M611-F623 HydrophobicContact CB-CE1 4.13Å; M611-F623 HydrophobicContact CB-CE2 3.96Å; M611-F623 HydrophobicContact CB-CG 4.19Å; M611-F623 HydrophobicContact CB-CZ 4Å; M611-F623 HydrophobicContact SD-CD2 4.03Å; M611-F623 HydrophobicContact SD-CE2 4.42Å; F612-F623 HydrophobicContact CD1-CE1 4Å; F612-F623 HydrophobicContact CD2-CE1 4.18Å; F612-F623 AromaticContact CD2-CZ 4Å; F612-F623 HydrophobicContact CD2-CZ 4Å; F612-F623 HydrophobicContact CE1-CE1 4.08Å; F612-F623 HydrophobicContact CE1-CZ 4.44Å; F612-F623 HydrophobicContact CE2-CE1 4.27Å; F612-F623 AromaticContact CE2-CZ 3.88Å; F612-F623 HydrophobicContact CE2-CZ 3.88Å; F612-F623 HydrophobicContact CG-CE1 4.05Å; F612-F623 HydrophobicContact CG-CZ 4.34Å; F612-F623 HydrophobicContact CZ-CE1 4.22Å; F612-F623 HydrophobicContact CZ-CZ 4.11Å; V619-F623 WeakPolarHBondContact O-CB 3.36Å; V619-F623 PolarHBondContact O-N 3.12Å; V620-F623 PolarHBondContact O-N 3.04Å; S621-F623 VanDerWaalsContact C-N 3.28Å; S621-F623 PolarHBondContact O-N 3.38Å; F623-D625 PolarHBondContact O-N 3.03Å; F623-T626 PolarHBondContact O-N 3.12Å; F623-L627 HydrophobicContact CE1-CD2 4.43Å; F623-L627 HydrophobicContact CE2-CB 4.34Å; F623-L627 HydrophobicContact CZ-CD2 4.07Å; F623-L627 WeakPolarHBondContact O-CB 3.49Å; F623-L627 PolarHBondContact O-N 3.34Å
624	M	95.1	Very high	93.7	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-40.4	177.4	-65.6	-67	163.7	0	0	112.1	F612 V620 S621 L627 Q628 L649 R652 A664 I665	F612-M624 HydrophobicContact CD1-CE 4.42Å; F612-M624 HydrophobicContact CE1-CE 4.23Å; V620-M624 HydrophobicContact CG1-CE 4.34Å; V620-M624 PolarHBondContact O-N 3.28Å; S621-M624 PolarHBondContact O-N 3.34Å; M624-L627 PolarHBondContact O-N 2.93Å; M624-Q628 WeakPolarHBondContact O-CG 3.48Å; M624-Q628 PolarHBondContact O-N 3.48Å; M624-L649 HydrophobicContact SD-CD2 4.4Å; M624-R652 HydrophobicContact CE-CG 4.4Å; M624-A664 HydrophobicContact CB-CB 3.97Å; M624-A664 HydrophobicContact CG-CB 4.29Å; M624-I665 HydrophobicContact CE-CD1 4.33Å; M624-I665 HydrophobicContact CE-CG1 3.79Å; M624-I665 HydrophobicContact SD-CG1 3.9Å
625	D	94.1	Very high	93.7	Very high	86 Å²	86	42.8 Å²	42.8	46%	0.46	22%	0.221	S	C	.	.	H	α-helix	trans	-64.8	-41	174.5	-66.9	-22.7	0	0	0	112.2	S621 F623 F629	S621-D625 PolarHBondContact O-N 2.97Å; F623-D625 PolarHBondContact O-N 3.03Å; D625-F629 PolarHBondContact O-N 3.17Å
626	T	95.7	Very high	93.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.7	-42.7	177.7	-52.2	0	0	0	0	111.3	L583 L586 Q587 M590 F608 L622 F623 F629 F630	L583-T626 HydrophobicContact CD2-CG2 4.1Å; L586-T626 HydrophobicContact CD2-CG2 4.1Å; Q587-T626 HydrophobicContact CG-CG2 3.94Å; Q587-T626 WeakPolarHBondContact CG-OG1 3.3Å; Q587-T626 PolarHBondContact NE2-OG1 2.91Å; M590-T626 HydrophobicContact CE-CG2 4.02Å; F608-T626 HydrophobicContact CZ-CG2 4.08Å; L622-T626 WeakPolarHBondContact O-CB 3.17Å; L622-T626 PolarHBondContact O-N 3.38Å; L622-T626 PolarHBondContact O-OG1 3.01Å; F623-T626 PolarHBondContact O-N 3.12Å; T626-F629 WeakPolarHBondContact O-CB 3.28Å; T626-F629 PolarHBondContact O-N 2.91Å; T626-F630 WeakPolarHBondContact O-CB 3.32Å; T626-F630 PolarHBondContact O-N 3.48Å
627	L	96.7	Very high	93.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.5	-41	177.9	179	61.4	0	0	0	111.4	F608 F612 F623 M624 F629 F630 I631 W641 L645 L649 T668	F608-L627 HydrophobicContact CD2-CD1 4.15Å; F612-L627 HydrophobicContact CE1-CD2 4.23Å; F612-L627 HydrophobicContact CE2-CD2 4.38Å; F612-L627 HydrophobicContact CZ-CD2 3.6Å; F623-L627 HydrophobicContact CE1-CD2 4.43Å; F623-L627 HydrophobicContact CE2-CB 4.34Å; F623-L627 HydrophobicContact CZ-CD2 4.07Å; F623-L627 WeakPolarHBondContact O-CB 3.49Å; F623-L627 PolarHBondContact O-N 3.34Å; M624-L627 PolarHBondContact O-N 2.93Å; L627-F629 VanDerWaalsContact C-N 3.3Å; L627-F629 PolarHBondContact O-N 3.43Å; L627-F630 PolarHBondContact O-N 3.29Å; L627-I631 HydrophobicContact CD1-CD1 3.91Å; L627-I631 HydrophobicContact CD1-CG1 4.1Å; L627-I631 HydrophobicContact CG-CD1 3.85Å; L627-I631 HydrophobicContact CG-CG1 4.46Å; L627-I631 WeakPolarHBondContact O-CB 3.36Å; L627-I631 WeakPolarHBondContact O-CD1 3.47Å; L627-I631 VanDerWaalsContact O-CG1 3.24Å; L627-I631 WeakPolarHBondContact O-CG1 3.49Å; L627-I631 PolarHBondContact O-N 3.06Å; L627-W641 HydrophobicContact CD1-CH2 3.86Å; L627-W641 HydrophobicContact CD1-CZ3 3.94Å; L627-L645 HydrophobicContact CD1-CD1 4.08Å; L627-L645 HydrophobicContact CD2-CD1 4.1Å; L627-L649 HydrophobicContact CD2-CD2 4.49Å; L627-T668 HydrophobicContact CD2-CG2 3.95Å; L627-T668 HydrophobicContact CG-CG2 4.16Å
628	Q	95.2	Very high	93.8	Very high	24 Å²	24	40 Å²	40	11%	0.112	20%	0.201	C	C	.	.	H	α-helix	trans	-61.4	-35.6	172.6	-78.8	-175	72.3	0	0	113.1	M624 K632 T668 V671	M624-Q628 WeakPolarHBondContact O-CG 3.48Å; M624-Q628 PolarHBondContact O-N 3.48Å; Q628-K632 VanDerWaalsContact O-CD 3.24Å; Q628-K632 WeakPolarHBondContact O-CD 3.44Å; Q628-K632 WeakPolarHBondContact O-CE 3.23Å; Q628-K632 WeakPolarHBondContact O-CG 3.48Å; Q628-K632 PolarHBondContact O-N 3.1Å; Q628-T668 HydrophobicContact CG-CG2 4.2Å; Q628-T668 WeakPolarHBondContact CG-OG1 3.43Å; Q628-V671 HydrophobicContact CG-CG2 4.2Å
629	F	93.5	Very high	93.7	Very high	53 Å²	53	40.3 Å²	40.3	23%	0.232	20%	0.198	C	C	.	.	H	α-helix	trans	-69.9	-50.7	174.1	-171.1	-77.2	0	0	0	110.9	M590 R591 D625 T626 L627 I631 K632 E633	M590-F629 HydrophobicContact CB-CD1 4.17Å; M590-F629 HydrophobicContact CB-CE1 3.65Å; M590-F629 HydrophobicContact CB-CZ 4.45Å; M590-F629 HydrophobicContact CE-CD1 3.65Å; M590-F629 HydrophobicContact CE-CE1 4.3Å; M590-F629 HydrophobicContact CE-CG 4.36Å; M590-F629 HydrophobicContact SD-CD1 4.04Å; M590-F629 HydrophobicContact SD-CE1 4.38Å; R591-F629 HydrophobicContact CG-CE2 3.99Å; R591-F629 HydrophobicContact CG-CZ 4.12Å; D625-F629 PolarHBondContact O-N 3.17Å; T626-F629 WeakPolarHBondContact O-CB 3.28Å; T626-F629 PolarHBondContact O-N 2.91Å; L627-F629 VanDerWaalsContact C-N 3.3Å; L627-F629 PolarHBondContact O-N 3.43Å; F629-I631 VanDerWaalsContact C-N 3.34Å; F629-I631 PolarHBondContact O-N 3.34Å; F629-K632 WeakPolarHBondContact O-CB 3.32Å; F629-K632 PolarHBondContact O-N 3.25Å; F629-E633 HydrophobicContact CE1-CB 4.38Å; F629-E633 PolarHBondContact O-N 2.76Å; F629-E633 VanDerWaalsContact O-N 3.14Å
630	F	95	Very high	93.5	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-39.6	-178	-175.2	-108.2	0	0	0	112.9	M590 L596 I601 L604 T605 F608 T626 L627 Y634 L638 W641	M590-F630 HydrophobicContact SD-CB 4.48Å; M590-F630 HydrophobicContact SD-CD2 3.93Å; L596-F630 HydrophobicContact CD1-CE2 4.06Å; I601-F630 HydrophobicContact CG2-CZ 4.01Å; L604-F630 HydrophobicContact CB-CE2 4.33Å; L604-F630 HydrophobicContact CB-CZ 4.05Å; L604-F630 HydrophobicContact CD1-CE2 4.08Å; T605-F630 HydrophobicContact CG2-CE1 4.01Å; T605-F630 HydrophobicContact CG2-CZ 4.35Å; F608-F630 HydrophobicContact CD2-CD1 4.01Å; F608-F630 HydrophobicContact CD2-CE1 4.09Å; F608-F630 HydrophobicContact CE2-CB 4.11Å; F608-F630 AromaticContact CE2-CD1 3.61Å; F608-F630 HydrophobicContact CE2-CD1 3.61Å; F608-F630 HydrophobicContact CE2-CD2 4.29Å; F608-F630 AromaticContact CE2-CE1 3.95Å; F608-F630 HydrophobicContact CE2-CE1 3.95Å; F608-F630 AromaticContact CE2-CG 3.78Å; F608-F630 HydrophobicContact CE2-CG 3.78Å; F608-F630 HydrophobicContact CE2-CZ 4.44Å; T626-F630 WeakPolarHBondContact O-CB 3.32Å; T626-F630 PolarHBondContact O-N 3.48Å; L627-F630 PolarHBondContact O-N 3.29Å; F630-Y634 AromaticContact CD2-CD2 3.51Å; F630-Y634 HydrophobicContact CD2-CD2 3.51Å; F630-Y634 AromaticContact CD2-CE2 3.98Å; F630-Y634 HydrophobicContact CD2-CE2 3.98Å; F630-Y634 HydrophobicContact CD2-CG 4.49Å; F630-Y634 AromaticContact CE2-CD2 3.82Å; F630-Y634 HydrophobicContact CE2-CD2 3.82Å; F630-Y634 HydrophobicContact CE2-CE2 4.32Å; F630-Y634 HydrophobicContact CE2-CG 4.46Å; F630-Y634 HydrophobicContact CG-CD2 4.24Å; F630-Y634 PolarHBondContact O-N 3.09Å; F630-L638 HydrophobicContact CD1-CD1 3.85Å; F630-L638 HydrophobicContact CD1-CD2 4.36Å; F630-L638 HydrophobicContact CE1-CD1 3.88Å; F630-L638 HydrophobicContact CE1-CD2 3.54Å; F630-L638 HydrophobicContact CE1-CG 4.34Å; F630-L638 HydrophobicContact CZ-CD2 4.01Å; F630-W641 HydrophobicContact CE1-CZ3 4.47Å
631	I	95.8	Very high	93.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.1	-42.9	173.7	-69.2	164	0	0	0	111.3	L627 F629 N635 L645 T668 V671 H675 F676	L627-I631 HydrophobicContact CD1-CD1 3.91Å; L627-I631 HydrophobicContact CD1-CG1 4.1Å; L627-I631 HydrophobicContact CG-CD1 3.85Å; L627-I631 HydrophobicContact CG-CG1 4.46Å; L627-I631 WeakPolarHBondContact O-CB 3.36Å; L627-I631 WeakPolarHBondContact O-CD1 3.47Å; L627-I631 VanDerWaalsContact O-CG1 3.24Å; L627-I631 WeakPolarHBondContact O-CG1 3.49Å; L627-I631 PolarHBondContact O-N 3.06Å; F629-I631 VanDerWaalsContact C-N 3.34Å; F629-I631 PolarHBondContact O-N 3.34Å; I631-N635 VanDerWaalsContact O-CB 3.28Å; I631-N635 WeakPolarHBondContact O-CB 3.34Å; I631-N635 PolarHBondContact O-N 2.71Å; I631-L645 HydrophobicContact CD1-CD2 3.88Å; I631-L645 HydrophobicContact CG1-CD2 4.1Å; I631-T668 HydrophobicContact CD1-CG2 4.04Å; I631-V671 HydrophobicContact CB-CG1 4.21Å; I631-V671 HydrophobicContact CG2-CG1 3.86Å; I631-H675 HydrophobicContact CG2-CB 4.35Å; I631-F676 HydrophobicContact CG2-CE2 3.83Å
632	K	94	Very high	93.7	Very high	94 Å²	94	43.4 Å²	43.4	41%	0.409	21%	0.21	S	C	.	.	H	α-helix	trans	-61.5	-51.3	-178.4	-72.1	165	-173	170.4	0	110.7	Q628 F629 N635 V671	Q628-K632 VanDerWaalsContact O-CD 3.24Å; Q628-K632 WeakPolarHBondContact O-CD 3.44Å; Q628-K632 WeakPolarHBondContact O-CE 3.23Å; Q628-K632 WeakPolarHBondContact O-CG 3.48Å; Q628-K632 PolarHBondContact O-N 3.1Å; F629-K632 WeakPolarHBondContact O-CB 3.32Å; F629-K632 PolarHBondContact O-N 3.25Å; K632-N635 PolarHBondContact O-ND2 3.03Å; K632-V671 HydrophobicContact CD-CG1 4.41Å; K632-V671 HydrophobicContact CG-CG1 3.82Å
633	E	91	Very high	93.7	Very high	117 Å²	117	43.7 Å²	43.7	55%	0.547	21%	0.21	S	C	.	.	H	α-helix	trans	-70.7	-49	-174.6	-157.7	67.3	-164.7	0	0	112.6	F629	F629-E633 HydrophobicContact CE1-CB 4.38Å; F629-E633 PolarHBondContact O-N 2.76Å; F629-E633 VanDerWaalsContact O-N 3.14Å
634	Y	92.3	Very high	93.6	Very high	26 Å²	26	44.1 Å²	44.1	10%	0.102	21%	0.212	C	C	.	.	H	α-helix	trans	-103.4	12.4	-167.8	-57.1	-75.3	0	0	0	114.8	M590 L596 I601 F630 P636 L637 L638	M590-Y634 HydrophobicContact CG-CE2 4.37Å; M590-Y634 HydrophobicContact SD-CE2 3.95Å; L596-Y634 HydrophobicContact CB-CE1 4.19Å; L596-Y634 HydrophobicContact CD1-CD2 4.46Å; L596-Y634 HydrophobicContact CD1-CE1 4.4Å; L596-Y634 HydrophobicContact CD1-CE2 3.73Å; I601-Y634 HydrophobicContact CD1-CD1 3.58Å; I601-Y634 HydrophobicContact CD1-CE1 4.11Å; I601-Y634 HydrophobicContact CD1-CG 4.11Å; I601-Y634 HydrophobicContact CG1-CD1 4.39Å; F630-Y634 AromaticContact CD2-CD2 3.51Å; F630-Y634 HydrophobicContact CD2-CD2 3.51Å; F630-Y634 AromaticContact CD2-CE2 3.98Å; F630-Y634 HydrophobicContact CD2-CE2 3.98Å; F630-Y634 HydrophobicContact CD2-CG 4.49Å; F630-Y634 AromaticContact CE2-CD2 3.82Å; F630-Y634 HydrophobicContact CE2-CD2 3.82Å; F630-Y634 HydrophobicContact CE2-CE2 4.32Å; F630-Y634 HydrophobicContact CE2-CG 4.46Å; F630-Y634 HydrophobicContact CG-CD2 4.24Å; F630-Y634 PolarHBondContact O-N 3.09Å; Y634-P636 VanDerWaalsContact C-N 3.28Å; Y634-P636 VanDerWaalsContact O-CD 3.28Å; Y634-P636 WeakPolarHBondContact O-CD 3.25Å; Y634-L637 PolarHBondContact O-N 3.07Å; Y634-L638 WeakPolarHBondContact O-CG 3.45Å; Y634-L638 PolarHBondContact O-N 2.65Å
635	N	92	Very high	93.6	Very high	42 Å²	42	44 Å²	44	23%	0.225	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.1	-34.1	-178.9	68.8	83	0	0	0	116.9	I631 K632 L637 L638 H675 F676	I631-N635 VanDerWaalsContact O-CB 3.28Å; I631-N635 WeakPolarHBondContact O-CB 3.34Å; I631-N635 PolarHBondContact O-N 2.71Å; K632-N635 PolarHBondContact O-ND2 3.03Å; N635-L637 VanDerWaalsContact C-N 3.28Å; N635-L637 PolarHBondContact O-N 3.05Å; N635-L638 PolarHBondContact O-N 3.36Å; N635-H675 HydrophobicContact CB-CB 3.98Å; N635-F676 HydrophobicContact CB-CE1 4.49Å; N635-F676 WeakPolarHBondContact O-CE1 3.43Å
636	P	90.4	Very high	93.6	Very high	75 Å²	75	40.1 Å²	40.1	49%	0.487	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-30.8	-179.9	-20.4	35.1	0	0	0	113	Y634 R639	Y634-P636 VanDerWaalsContact C-N 3.28Å; Y634-P636 VanDerWaalsContact O-CD 3.28Å; Y634-P636 WeakPolarHBondContact O-CD 3.25Å; P636-R639 WeakPolarHBondContact O-CD 3.21Å; P636-R639 WeakPolarHBondContact O-CG 3.46Å
637	L	91.3	Very high	93.5	Very high	98 Å²	98	40.9 Å²	40.9	51%	0.513	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-16.7	-176.4	-59	175	0	0	0	112.5	I601 Y634 N635 R639	I601-L637 HydrophobicContact CD1-CD1 3.49Å; I601-L637 VanDerWaalsContact CD1-CD1 3.49Å; Y634-L637 PolarHBondContact O-N 3.07Å; N635-L637 VanDerWaalsContact C-N 3.28Å; N635-L637 PolarHBondContact O-N 3.05Å; L637-R639 VanDerWaalsContact C-N 3.3Å; L637-R639 PolarHBondContact O-N 3.13Å
638	L	93.6	Very high	93.3	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.01	20%	0.2	C	C	.	.			trans	-88.6	12.5	-178.2	-63.1	175.4	0	0	0	114	I601 T605 F630 Y634 N635 D640 W641 L642 F676	I601-L638 HydrophobicContact CG2-CD2 3.79Å; T605-L638 HydrophobicContact CG2-CD2 3.49Å; T605-L638 VanDerWaalsContact CG2-CD2 3.49Å; F630-L638 HydrophobicContact CD1-CD1 3.85Å; F630-L638 HydrophobicContact CD1-CD2 4.36Å; F630-L638 HydrophobicContact CE1-CD1 3.88Å; F630-L638 HydrophobicContact CE1-CD2 3.54Å; F630-L638 HydrophobicContact CE1-CG 4.34Å; F630-L638 HydrophobicContact CZ-CD2 4.01Å; Y634-L638 WeakPolarHBondContact O-CG 3.45Å; Y634-L638 PolarHBondContact O-N 2.65Å; N635-L638 PolarHBondContact O-N 3.36Å; L638-D640 PolarHBondContact O-N 3.22Å; L638-W641 HydrophobicContact CD2-CE3 4.17Å; L638-W641 PolarHBondContact O-N 3.39Å; L638-L642 PolarHBondContact O-N 3.29Å; L638-F676 HydrophobicContact CB-CE1 3.96Å; L638-F676 HydrophobicContact CB-CZ 3.74Å
639	R	91	Very high	93.3	Very high	149 Å²	149	41.1 Å²	41.1	56%	0.562	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-42.1	-173.7	-72.3	179.9	176.9	-158.2	0.7	113.2	P636 L637 W641 L642	P636-R639 WeakPolarHBondContact O-CD 3.21Å; P636-R639 WeakPolarHBondContact O-CG 3.46Å; L637-R639 VanDerWaalsContact C-N 3.3Å; L637-R639 PolarHBondContact O-N 3.13Å; R639-W641 VanDerWaalsContact C-N 3.3Å; R639-W641 PolarHBondContact O-N 2.86Å; R639-L642 WeakPolarHBondContact O-CB 3.32Å; R639-L642 PolarHBondContact O-N 3.05Å
640	D	90.6	Very high	93.4	Very high	100 Å²	100	38.6 Å²	38.6	54%	0.535	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-25.7	-176.8	-51.9	-34.4	0	0	0	111.3	L638 L642	L638-D640 PolarHBondContact O-N 3.22Å; D640-L642 VanDerWaalsContact C-N 3.32Å
641	W	94.2	Very high	93.2	Very high	9 Å²	9	41 Å²	41	3%	0.034	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-9.6	172.3	-165.9	57.2	0	0	0	113.5	T605 F608 S609 F612 L627 F630 L638 R639 Y643 T644 L645	T605-W641 HydrophobicContact CG2-CB 4.27Å; T605-W641 HydrophobicContact CG2-CD2 3.51Å; T605-W641 HydrophobicContact CG2-CE3 3.57Å; T605-W641 HydrophobicContact CG2-CG 3.85Å; T605-W641 HydrophobicContact CG2-CH2 4.45Å; T605-W641 HydrophobicContact CG2-CZ2 4.42Å; T605-W641 HydrophobicContact CG2-CZ3 4.05Å; F608-W641 HydrophobicContact CB-CH2 3.8Å; F608-W641 HydrophobicContact CB-CZ2 3.92Å; F608-W641 HydrophobicContact CD2-CH2 4.11Å; S609-W641 PolarHBondContact OG-NE1 3.38Å; F612-W641 HydrophobicContact CE2-CH2 4.5Å; F612-W641 HydrophobicContact CE2-CZ2 4.38Å; L627-W641 HydrophobicContact CD1-CH2 3.86Å; L627-W641 HydrophobicContact CD1-CZ3 3.94Å; F630-W641 HydrophobicContact CE1-CZ3 4.47Å; L638-W641 HydrophobicContact CD2-CE3 4.17Å; L638-W641 PolarHBondContact O-N 3.39Å; R639-W641 VanDerWaalsContact C-N 3.3Å; R639-W641 PolarHBondContact O-N 2.86Å; W641-Y643 PolarHBondContact O-N 2.67Å; W641-T644 WeakPolarHBondContact O-CB 3.48Å; W641-T644 PolarHBondContact O-N 2.92Å; W641-L645 HydrophobicContact CD2-CB 4.03Å; W641-L645 HydrophobicContact CE3-CB 3.94Å; W641-L645 HydrophobicContact CE3-CD1 4.43Å; W641-L645 HydrophobicContact CE3-CD2 3.96Å; W641-L645 HydrophobicContact CE3-CG 4.32Å; W641-L645 HydrophobicContact CH2-CD1 3.89Å; W641-L645 HydrophobicContact CZ2-CD1 4.48Å; W641-L645 HydrophobicContact CZ3-CB 4.22Å; W641-L645 HydrophobicContact CZ3-CD1 3.85Å; W641-L645 HydrophobicContact CZ3-CD2 3.92Å; W641-L645 HydrophobicContact CZ3-CG 4.2Å; W641-L645 VanDerWaalsContact O-CB 3.26Å; W641-L645 WeakPolarHBondContact O-CB 3.46Å; W641-L645 PolarHBondContact O-N 3.21Å
642	L	95.2	Very high	93.1	Very high	3 Å²	3	43.1 Å²	43.1	2%	0.016	20%	0.201	C	C	.	.	H	α-helix	trans	-57	-48	-172.7	176.5	57.6	0	0	0	113.8	L638 R639 D640 T644 L646 L672 F676 T680 Q681	L638-L642 PolarHBondContact O-N 3.29Å; R639-L642 WeakPolarHBondContact O-CB 3.32Å; R639-L642 PolarHBondContact O-N 3.05Å; D640-L642 VanDerWaalsContact C-N 3.32Å; L642-T644 VanDerWaalsContact C-N 3.35Å; L642-L646 VanDerWaalsContact O-CB 3.24Å; L642-L646 WeakPolarHBondContact O-CB 3.44Å; L642-L646 PolarHBondContact O-N 3.17Å; L642-L672 HydrophobicContact CD1-CD1 4.49Å; L642-L672 HydrophobicContact CD1-CD2 3.68Å; L642-L672 HydrophobicContact CD1-CG 4.19Å; L642-F676 HydrophobicContact CB-CD1 4.45Å; L642-F676 HydrophobicContact CB-CE1 4.43Å; L642-F676 HydrophobicContact CD1-CB 3.99Å; L642-F676 HydrophobicContact CD1-CD1 3.9Å; L642-F676 HydrophobicContact CD1-CD2 3.55Å; L642-F676 HydrophobicContact CD1-CE1 4.23Å; L642-F676 HydrophobicContact CD1-CE2 3.9Å; L642-F676 HydrophobicContact CD1-CG 3.53Å; L642-F676 HydrophobicContact CD1-CZ 4.22Å; L642-F676 HydrophobicContact CD2-CB 3.93Å; L642-F676 HydrophobicContact CD2-CD1 3.95Å; L642-F676 HydrophobicContact CD2-CG 4.01Å; L642-F676 HydrophobicContact CG-CD1 4.33Å; L642-F676 HydrophobicContact CG-CG 4.33Å; L642-T680 HydrophobicContact CD2-CG2 3.87Å; L642-Q681 HydrophobicContact CD2-CG 4.28Å
643	Y	94.1	Very high	93	Very high	37 Å²	37	39.9 Å²	39.9	15%	0.145	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-48.5	178.2	170.8	-99.1	0	0	0	110.8	W641 L646 I647 H687 F688	W641-Y643 PolarHBondContact O-N 2.67Å; Y643-L646 PolarHBondContact O-N 3.24Å; Y643-I647 HydrophobicContact CD1-CD1 3.99Å; Y643-I647 HydrophobicContact CD2-CD1 3.93Å; Y643-I647 HydrophobicContact CE1-CD1 3.52Å; Y643-I647 HydrophobicContact CE2-CD1 3.45Å; Y643-I647 VanDerWaalsContact CE2-CD1 3.45Å; Y643-I647 HydrophobicContact CG-CD1 4.18Å; Y643-I647 WeakPolarHBondContact O-CG1 3.38Å; Y643-I647 PolarHBondContact O-N 3.42Å; Y643-H687 HydrophobicContact CE2-CB 4.16Å; Y643-H687 AromaticContact CE2-CD2 3.41Å; Y643-H687 VanDerWaalsContact CE2-CD2 3.41Å; Y643-H687 WeakPolarHBondContact CE2-CD2 3.36Å; Y643-H687 AromaticContact CZ-CD2 3.7Å; Y643-F688 HydrophobicContact CE2-CB 4.17Å
644	T	93.8	Very high	93	Very high	9 Å²	9	34.6 Å²	34.6	6%	0.055	16%	0.163	C	C	.	.	H	α-helix	trans	-62.6	-43.3	-179.4	-63.3	0	0	0	0	112.4	W641 L642 R648 N933	W641-T644 WeakPolarHBondContact O-CB 3.48Å; W641-T644 PolarHBondContact O-N 2.92Å; L642-T644 VanDerWaalsContact C-N 3.35Å; T644-R648 WeakPolarHBondContact O-CB 3.44Å; T644-R648 WeakPolarHBondContact O-CG 3.43Å; T644-R648 PolarHBondContact O-N 3.19Å; T644-R648 VanDerWaalsContact O-N 3.15Å; T644-N933 PolarHBondContact OG1-OD1 3Å
645	L	95.8	Very high	92.9	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64	-48.9	173.9	169.8	60.5	0	0	0	112.1	F612 L627 I631 W641 I647 R648 L649 L672 F676	F612-L645 HydrophobicContact CE2-CD1 4.16Å; F612-L645 HydrophobicContact CZ-CD1 3.8Å; L627-L645 HydrophobicContact CD1-CD1 4.08Å; L627-L645 HydrophobicContact CD2-CD1 4.1Å; I631-L645 HydrophobicContact CD1-CD2 3.88Å; I631-L645 HydrophobicContact CG1-CD2 4.1Å; W641-L645 HydrophobicContact CD2-CB 4.03Å; W641-L645 HydrophobicContact CE3-CB 3.94Å; W641-L645 HydrophobicContact CE3-CD1 4.43Å; W641-L645 HydrophobicContact CE3-CD2 3.96Å; W641-L645 HydrophobicContact CE3-CG 4.32Å; W641-L645 HydrophobicContact CH2-CD1 3.89Å; W641-L645 HydrophobicContact CZ2-CD1 4.48Å; W641-L645 HydrophobicContact CZ3-CB 4.22Å; W641-L645 HydrophobicContact CZ3-CD1 3.85Å; W641-L645 HydrophobicContact CZ3-CD2 3.92Å; W641-L645 HydrophobicContact CZ3-CG 4.2Å; W641-L645 VanDerWaalsContact O-CB 3.26Å; W641-L645 WeakPolarHBondContact O-CB 3.46Å; W641-L645 PolarHBondContact O-N 3.21Å; L645-I647 PolarHBondContact O-N 2.72Å; L645-R648 PolarHBondContact O-N 2.95Å; L645-L649 HydrophobicContact CD1-CD1 3.76Å; L645-L649 HydrophobicContact CD1-CG 4.24Å; L645-L649 HydrophobicContact CG-CD1 4.07Å; L645-L649 WeakPolarHBondContact O-CG 3.45Å; L645-L649 PolarHBondContact O-N 3.38Å; L645-L672 HydrophobicContact CD2-CD1 3.76Å; L645-L672 HydrophobicContact CD2-CG 4.39Å; L645-L672 HydrophobicContact CG-CD1 3.75Å; L645-F676 HydrophobicContact CD2-CE2 4.31Å
646	L	94.7	Very high	92.7	Very high	4 Å²	4	36 Å²	36	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-44.4	-178.5	178.5	59.9	0	0	0	111.6	L642 Y643 L649 L650 L669 Y707	L642-L646 VanDerWaalsContact O-CB 3.24Å; L642-L646 WeakPolarHBondContact O-CB 3.44Å; L642-L646 PolarHBondContact O-N 3.17Å; Y643-L646 PolarHBondContact O-N 3.24Å; L646-L649 PolarHBondContact O-N 3.34Å; L646-L650 HydrophobicContact CD1-CD1 4.23Å; L646-L650 HydrophobicContact CD1-CG 4.42Å; L646-L650 HydrophobicContact CG-CD1 4.2Å; L646-L650 VanDerWaalsContact O-CG 3.31Å; L646-L650 WeakPolarHBondContact O-CG 3.4Å; L646-L650 PolarHBondContact O-N 2.95Å; L646-L669 HydrophobicContact CD1-CD2 3.99Å; L646-Y707 HydrophobicContact CD1-CD1 4.26Å; L646-Y707 HydrophobicContact CD1-CD2 4.38Å; L646-Y707 HydrophobicContact CD1-CE1 3.81Å; L646-Y707 HydrophobicContact CD1-CE2 3.92Å; L646-Y707 HydrophobicContact CD2-CE1 4.3Å
647	I	92.4	Very high	92.5	Very high	17 Å²	17	36.7 Å²	36.7	9%	0.087	18%	0.182	C	C	.	.	H	α-helix	trans	-65.6	-46.3	177.7	-70.5	172.1	0	0	0	111.2	Y643 L645 L649 L650 Y651 F688	Y643-I647 HydrophobicContact CD1-CD1 3.99Å; Y643-I647 HydrophobicContact CD2-CD1 3.93Å; Y643-I647 HydrophobicContact CE1-CD1 3.52Å; Y643-I647 HydrophobicContact CE2-CD1 3.45Å; Y643-I647 VanDerWaalsContact CE2-CD1 3.45Å; Y643-I647 HydrophobicContact CG-CD1 4.18Å; Y643-I647 WeakPolarHBondContact O-CG1 3.38Å; Y643-I647 PolarHBondContact O-N 3.42Å; L645-I647 PolarHBondContact O-N 2.72Å; I647-L649 VanDerWaalsContact C-N 3.31Å; I647-L649 PolarHBondContact O-N 3.49Å; I647-L650 PolarHBondContact O-N 3.34Å; I647-Y651 HydrophobicContact CG2-CD2 3.64Å; I647-Y651 HydrophobicContact CG2-CE2 3.79Å; I647-Y651 WeakPolarHBondContact O-CD2 3.39Å; I647-Y651 PolarHBondContact O-N 3.37Å; I647-F688 HydrophobicContact CD1-CB 4.05Å; I647-F688 HydrophobicContact CD1-CD2 3.36Å; I647-F688 HydrophobicContact CD1-CE2 3.96Å; I647-F688 HydrophobicContact CD1-CG 3.83Å; I647-F688 HydrophobicContact CG1-CB 4.3Å; I647-F688 HydrophobicContact CG1-CD1 4.29Å; I647-F688 HydrophobicContact CG1-CD2 3.67Å; I647-F688 HydrophobicContact CG1-CE2 3.99Å; I647-F688 HydrophobicContact CG1-CG 3.83Å; I647-F688 HydrophobicContact CG1-CZ 4.44Å; I647-F688 HydrophobicContact CG2-CD2 4.46Å; I647-F688 HydrophobicContact CG2-CE2 3.98Å; I647-F688 HydrophobicContact CG2-CZ 4.34Å
648	R	94.1	Very high	92.5	Very high	28 Å²	28	35.9 Å²	35.9	11%	0.106	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-37.4	178.7	-76.9	-176.1	167	108.5	2.3	112.1	S609 F612 T644 L645 R652 T930 N931	S609-R648 VanDerWaalsContact CB-NH1 3.33Å; S609-R648 WeakPolarHBondContact O-CD 3.19Å; S609-R648 PolarHBondContact O-NE 2.8Å; S609-R648 PolarHBondContact OG-NH1 3.21Å; S609-R648 VanDerWaalsContact OG-NH1 3.15Å; F612-R648 HydrophobicContact CB-CB 4.31Å; F612-R648 HydrophobicContact CD1-CB 4.05Å; F612-R648 HydrophobicContact CD2-CB 3.7Å; F612-R648 HydrophobicContact CD2-CG 4.28Å; F612-R648 HydrophobicContact CE1-CB 4.28Å; F612-R648 HydrophobicContact CE2-CB 3.94Å; F612-R648 HydrophobicContact CG-CB 3.76Å; F612-R648 HydrophobicContact CG-CG 4.47Å; F612-R648 HydrophobicContact CZ-CB 4.22Å; T644-R648 WeakPolarHBondContact O-CB 3.44Å; T644-R648 WeakPolarHBondContact O-CG 3.43Å; T644-R648 PolarHBondContact O-N 3.19Å; T644-R648 VanDerWaalsContact O-N 3.15Å; L645-R648 PolarHBondContact O-N 2.95Å; R648-R652 WeakPolarHBondContact O-CB 3.36Å; R648-R652 PolarHBondContact O-N 3.35Å; R648-T930 PolarHBondContact NH2-OG1 2.82Å; R648-N931 PolarHBondContact NH2-O 3.28Å
649	L	95.2	Very high	92.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.3	-47.8	171.6	-77.5	163.4	0	0	0	112.7	F612 M624 L627 L645 L646 I647 R652 Q653 I665 T668 L669 L672	F612-L649 HydrophobicContact CE1-CD2 3.77Å; F612-L649 HydrophobicContact CE1-CG 3.86Å; F612-L649 HydrophobicContact CZ-CD2 4.18Å; F612-L649 HydrophobicContact CZ-CG 3.96Å; M624-L649 HydrophobicContact SD-CD2 4.4Å; L627-L649 HydrophobicContact CD2-CD2 4.49Å; L645-L649 HydrophobicContact CD1-CD1 3.76Å; L645-L649 HydrophobicContact CD1-CG 4.24Å; L645-L649 HydrophobicContact CG-CD1 4.07Å; L645-L649 WeakPolarHBondContact O-CG 3.45Å; L645-L649 PolarHBondContact O-N 3.38Å; L646-L649 PolarHBondContact O-N 3.34Å; I647-L649 VanDerWaalsContact C-N 3.31Å; I647-L649 PolarHBondContact O-N 3.49Å; L649-R652 PolarHBondContact O-N 2.87Å; L649-Q653 WeakPolarHBondContact O-CB 3.5Å; L649-Q653 PolarHBondContact O-N 3.22Å; L649-I665 HydrophobicContact CD2-CG2 4.14Å; L649-T668 HydrophobicContact CD1-CG2 4.03Å; L649-T668 HydrophobicContact CD2-CG2 3.84Å; L649-L669 HydrophobicContact CB-CD2 3.83Å; L649-L669 HydrophobicContact CB-CG 4.28Å; L649-L669 HydrophobicContact CD1-CD2 3.93Å; L649-L669 HydrophobicContact CD1-CG 4.41Å; L649-L669 HydrophobicContact CG-CD2 4.44Å; L649-L672 HydrophobicContact CD1-CD1 3.65Å
650	L	93.9	Very high	92.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.9	-41.3	179.9	-72.2	171.3	0	0	0	112.6	L646 I647 S654 F688 C703 L704	L646-L650 HydrophobicContact CD1-CD1 4.23Å; L646-L650 HydrophobicContact CD1-CG 4.42Å; L646-L650 HydrophobicContact CG-CD1 4.2Å; L646-L650 VanDerWaalsContact O-CG 3.31Å; L646-L650 WeakPolarHBondContact O-CG 3.4Å; L646-L650 PolarHBondContact O-N 2.95Å; I647-L650 PolarHBondContact O-N 3.34Å; L650-S654 PolarHBondContact O-N 2.98Å; L650-S654 VanDerWaalsContact O-N 3.16Å; L650-F688 HydrophobicContact CD1-CE1 4.5Å; L650-C703 HydrophobicContact CD2-CB 3.97Å; L650-L704 HydrophobicContact CD1-CB 4.3Å; L650-L704 HydrophobicContact CD1-CD1 3.82Å
651	Y	92.5	Very high	92.3	Very high	51 Å²	51	32 Å²	32	20%	0.2	18%	0.18	C	C	.	.	H	α-helix	trans	-63.2	-48.6	173	-91.1	-86	0	0	0	111.1	I647 Q653 S654 H655 F688 V700	I647-Y651 HydrophobicContact CG2-CD2 3.64Å; I647-Y651 HydrophobicContact CG2-CE2 3.79Å; I647-Y651 WeakPolarHBondContact O-CD2 3.39Å; I647-Y651 PolarHBondContact O-N 3.37Å; Y651-Q653 VanDerWaalsContact C-N 3.34Å; Y651-Q653 PolarHBondContact O-N 2.91Å; Y651-S654 PolarHBondContact O-N 3.01Å; Y651-S654 VanDerWaalsContact O-N 3.12Å; Y651-S654 PolarHBondContact O-OG 2.94Å; Y651-H655 PolarHBondContact O-CD2 2.89Å; Y651-H655 VanDerWaalsContact O-CD2 3.3Å; Y651-H655 PolarHBondContact O-N 3.23Å; Y651-F688 HydrophobicContact CD2-CZ 4.41Å; Y651-F688 AromaticContact CE2-CE2 3.97Å; Y651-F688 HydrophobicContact CE2-CE2 3.97Å; Y651-F688 AromaticContact CE2-CZ 3.69Å; Y651-F688 HydrophobicContact CE2-CZ 3.69Å; Y651-V700 HydrophobicContact CD1-CG2 3.84Å; Y651-V700 HydrophobicContact CE1-CG2 3.9Å; Y651-V700 HydrophobicContact CE2-CG1 4.37Å; Y651-V700 HydrophobicContact CG-CG2 4.28Å
652	R	92.2	Very high	92.2	Very high	44 Å²	44	35.2 Å²	35.2	17%	0.166	20%	0.195	C	C	.	.	H	α-helix	trans	-57.5	-46.6	177.6	-170.9	71.1	-170.6	-146.6	6.8	111.2	F612 D614 M624 R648 L649 S654 H655 E656 I665	F612-R652 HydrophobicContact CD1-CB 4.49Å; F612-R652 PolarHBondContact O-NH1 3.45Å; D614-R652 PolarHBondContact O-NH1 2.92Å; D614-R652 PolarHBondContact O-NH2 2.95Å; M624-R652 HydrophobicContact CE-CG 4.4Å; R648-R652 WeakPolarHBondContact O-CB 3.36Å; R648-R652 PolarHBondContact O-N 3.35Å; L649-R652 PolarHBondContact O-N 2.87Å; R652-S654 VanDerWaalsContact C-N 3.25Å; R652-S654 PolarHBondContact O-N 3.07Å; R652-H655 PolarHBondContact O-N 3.07Å; R652-E656 IonicContact CZ-OE2 3.61Å; R652-E656 IonicContact NE-OE2 3.87Å; R652-E656 PolarHBondContact NE-OE2 3.02Å; R652-E656 VanDerWaalsContact NE-OE2 3.16Å; R652-E656 IonicContact NH2-OE2 3.72Å; R652-E656 PolarHBondContact NH2-OE2 3.32Å; R652-E656 WeakPolarHBondContact O-CB 3.22Å; R652-E656 PolarHBondContact O-N 2.76Å; R652-I665 HydrophobicContact CB-CD1 4.29Å; R652-I665 HydrophobicContact CG-CD1 3.65Å
653	Q	93.4	Very high	92.1	Very high	27 Å²	27	40.5 Å²	40.5	13%	0.126	22%	0.218	C	C	.	.	H	α-helix	trans	-56	-38.9	177.5	-162.3	-173.2	1.3	0	0	112.7	L649 Y651 H655 I665	L649-Q653 WeakPolarHBondContact O-CB 3.5Å; L649-Q653 PolarHBondContact O-N 3.22Å; Y651-Q653 VanDerWaalsContact C-N 3.34Å; Y651-Q653 PolarHBondContact O-N 2.91Å; Q653-H655 VanDerWaalsContact C-N 3.3Å; Q653-H655 PolarHBondContact O-N 3.49Å; Q653-I665 HydrophobicContact CB-CG2 3.84Å; Q653-I665 HydrophobicContact CG-CG2 4.09Å
654	S	90.6	Very high	92.1	Very high	6 Å²	6	39.3 Å²	39.3	4%	0.042	22%	0.216	C	C	.	.	H	α-helix	trans	-73.5	-18.2	-177	78.5	0	0	0	0	114.8	L650 Y651 R652 R699 V700	L650-S654 PolarHBondContact O-N 2.98Å; L650-S654 VanDerWaalsContact O-N 3.16Å; Y651-S654 PolarHBondContact O-N 3.01Å; Y651-S654 VanDerWaalsContact O-N 3.12Å; Y651-S654 PolarHBondContact O-OG 2.94Å; R652-S654 VanDerWaalsContact C-N 3.25Å; R652-S654 PolarHBondContact O-N 3.07Å; S654-R699 WeakPolarHBondContact O-CD 3.36Å; S654-R699 PolarHBondContact O-NH1 3.33Å; S654-V700 WeakPolarHBondContact OG-CG2 3.34Å
655	H	89.1	Confident	92.1	Very high	75 Å²	75	38.9 Å²	38.9	35%	0.347	21%	0.214	S	C	.	.	H	α-helix	trans	-114.7	-16.7	-177.5	-69.1	-70.7	0	0	0	113.8	Y651 R652 Q653 N697 Y928	Y651-H655 PolarHBondContact O-CD2 2.89Å; Y651-H655 VanDerWaalsContact O-CD2 3.3Å; Y651-H655 PolarHBondContact O-N 3.23Å; R652-H655 PolarHBondContact O-N 3.07Å; Q653-H655 VanDerWaalsContact C-N 3.3Å; Q653-H655 PolarHBondContact O-N 3.49Å; H655-N697 PolarHBondContact NE2-ND2 3.37Å; H655-Y928 PolarHBondContact CD2-OH 3.42Å; H655-Y928 VanDerWaalsContact CD2-OH 3.3Å; H655-Y928 PolarHBondContact CE1-OH 2.89Å; H655-Y928 VanDerWaalsContact CG-OH 3.28Å; H655-Y928 PolarHBondContact ND1-OH 3.08Å; H655-Y928 PolarHBondContact NE2-OH 3.14Å
656	E	89.3	Confident	92	Very high	22 Å²	22	43.6 Å²	43.6	10%	0.103	24%	0.236	C	C	.	.			trans	-71.3	134.6	-179.6	-174	54.3	-98.8	0	0	112.4	R652 L658 H661 Q662 I665	R652-E656 IonicContact CZ-OE2 3.61Å; R652-E656 IonicContact NE-OE2 3.87Å; R652-E656 PolarHBondContact NE-OE2 3.02Å; R652-E656 VanDerWaalsContact NE-OE2 3.16Å; R652-E656 IonicContact NH2-OE2 3.72Å; R652-E656 PolarHBondContact NH2-OE2 3.32Å; R652-E656 WeakPolarHBondContact O-CB 3.22Å; R652-E656 PolarHBondContact O-N 2.76Å; E656-L658 PolarHBondContact OE1-N 3.38Å; E656-L658 VanDerWaalsContact OE1-N 3.1Å; E656-H661 VanDerWaalsContact CD-CB 3.49Å; E656-H661 HydrophobicContact CG-CB 3.41Å; E656-H661 VanDerWaalsContact CG-CB 3.41Å; E656-H661 IonicContact OE1-ND1 3.02Å; E656-H661 PolarHBondContact OE1-ND1 3.5Å; E656-H661 IonicContact OE2-CE1 3.44Å; E656-H661 IonicContact OE2-CG 3.44Å; E656-H661 IonicContact OE2-ND1 3.14Å; E656-H661 PolarHBondContact OE2-ND1 3.49Å; E656-Q662 HydrophobicContact CB-CG 4.38Å; E656-Q662 HydrophobicContact CG-CG 4.19Å; E656-Q662 PolarHBondContact O-NE2 3.2Å; E656-I665 HydrophobicContact CB-CD1 4.14Å; E656-I665 HydrophobicContact CG-CD1 4.08Å
657	A	86.3	Confident	92	Very high	90 Å²	90	47.2 Å²	47.2	74%	0.744	25%	0.252	S	S	*	.			trans	-110.4	-20.9	-174.6	0	0	0	0	0	113.2
658	L	90.2	Very high	92.2	Very high	81 Å²	81	46.4 Å²	46.4	42%	0.424	25%	0.248	S	C	.	.			trans	-80.4	120.3	178.6	-73.3	162.2	0	0	0	110.2	E656 S660 H661 Q662	E656-L658 PolarHBondContact OE1-N 3.38Å; E656-L658 VanDerWaalsContact OE1-N 3.1Å; L658-S660 PolarHBondContact O-N 2.87Å; L658-H661 HydrophobicContact CB-CB 4.13Å; L658-H661 WeakPolarHBondContact CD1-CE1 3.4Å; L658-H661 PolarHBondContact O-N 3.39Å; L658-Q662 WeakPolarHBondContact O-CG 3.4Å; L658-Q662 PolarHBondContact O-N 2.97Å
659	S	89.3	Confident	92.3	Very high	95 Å²	95	45.4 Å²	45.4	66%	0.664	25%	0.245	S	C	*	.	H	α-helix	trans	-60.4	-30.9	-179.3	54.1	0	0	0	0	113.3	K663	S659-K663 WeakPolarHBondContact O-CB 3.33Å; S659-K663 PolarHBondContact O-N 3.31Å
660	S	89.9	Confident	92.3	Very high	68 Å²	68	51 Å²	51	48%	0.476	27%	0.269	S	S	.	.	H	α-helix	trans	-63	-48.3	171.3	50.6	0	0	0	0	112.2	L658 K663 A664	L658-S660 PolarHBondContact O-N 2.87Å; S660-K663 PolarHBondContact O-N 3.05Å; S660-A664 PolarHBondContact O-N 3Å
661	H	91.8	Very high	92.4	Very high	5 Å²	5	51.4 Å²	51.4	2%	0.023	27%	0.272	C	S	.	.	H	α-helix	trans	-66.3	-41.8	175.6	-64.9	-179.5	0	0	0	111.5	S617 E656 L658 K663 A664 I665	S617-H661 PolarHBondContact OG-CE1 3Å; S617-H661 PolarHBondContact OG-NE2 3.48Å; E656-H661 VanDerWaalsContact CD-CB 3.49Å; E656-H661 HydrophobicContact CG-CB 3.41Å; E656-H661 VanDerWaalsContact CG-CB 3.41Å; E656-H661 IonicContact OE1-ND1 3.02Å; E656-H661 PolarHBondContact OE1-ND1 3.5Å; E656-H661 IonicContact OE2-CE1 3.44Å; E656-H661 IonicContact OE2-CG 3.44Å; E656-H661 IonicContact OE2-ND1 3.14Å; E656-H661 PolarHBondContact OE2-ND1 3.49Å; L658-H661 HydrophobicContact CB-CB 4.13Å; L658-H661 WeakPolarHBondContact CD1-CE1 3.4Å; L658-H661 PolarHBondContact O-N 3.39Å; H661-K663 VanDerWaalsContact C-N 3.3Å; H661-K663 PolarHBondContact O-N 3.47Å; H661-A664 PolarHBondContact O-N 3.32Å; H661-I665 WeakPolarHBondContact O-CB 3.5Å; H661-I665 WeakPolarHBondContact O-CD1 3.45Å; H661-I665 VanDerWaalsContact O-CG1 3.24Å; H661-I665 WeakPolarHBondContact O-CG1 3.35Å; H661-I665 PolarHBondContact O-N 3.48Å
662	Q	91.5	Very high	92.5	Very high	77 Å²	77	49 Å²	49	36%	0.36	26%	0.262	S	S	.	.	H	α-helix	trans	-57.4	-43.8	175.9	-72.7	-179	-6.6	0	0	111.4	E656 L658 I665 Q666	E656-Q662 HydrophobicContact CB-CG 4.38Å; E656-Q662 HydrophobicContact CG-CG 4.19Å; E656-Q662 PolarHBondContact O-NE2 3.2Å; L658-Q662 WeakPolarHBondContact O-CG 3.4Å; L658-Q662 PolarHBondContact O-N 2.97Å; Q662-I665 PolarHBondContact O-N 3Å; Q662-Q666 WeakPolarHBondContact O-CG 3.3Å; Q662-Q666 PolarHBondContact O-N 2.87Å
663	K	93.3	Very high	92.7	Very high	114 Å²	114	48.5 Å²	48.5	50%	0.496	26%	0.261	S	S	.	.	H	α-helix	trans	-61.5	-49.7	173.6	-178.1	-173.7	163.3	-172.5	0	111.5	S659 S660 H661 I665 Q666 E667	S659-K663 WeakPolarHBondContact O-CB 3.33Å; S659-K663 PolarHBondContact O-N 3.31Å; S660-K663 PolarHBondContact O-N 3.05Å; H661-K663 VanDerWaalsContact C-N 3.3Å; H661-K663 PolarHBondContact O-N 3.47Å; K663-I665 VanDerWaalsContact C-N 3.27Å; K663-I665 PolarHBondContact O-N 2.92Å; K663-Q666 WeakPolarHBondContact O-CB 3.23Å; K663-Q666 PolarHBondContact O-N 3.12Å; K663-Q666 VanDerWaalsContact O-N 3.07Å; K663-E667 WeakPolarHBondContact CE-OE1 3.45Å; K663-E667 WeakPolarHBondContact CE-OE2 3.27Å; K663-E667 HydrophobicContact CG-CG 4.49Å; K663-E667 IonicContact NZ-OE1 3.79Å; K663-E667 PolarHBondContact NZ-OE1 2.69Å; K663-E667 WeakPolarHBondContact O-CG 3.46Å; K663-E667 PolarHBondContact O-N 3.15Å
664	A	94.2	Very high	92.7	Very high	12 Å²	12	50.7 Å²	50.7	10%	0.099	28%	0.279	C	S	.	.	H	α-helix	trans	-60.6	-35.1	179.2	0	0	0	0	0	112.7	M624 S660 H661 T668	M624-A664 HydrophobicContact CB-CB 3.97Å; M624-A664 HydrophobicContact CG-CB 4.29Å; S660-A664 PolarHBondContact O-N 3Å; H661-A664 PolarHBondContact O-N 3.32Å; A664-T668 WeakPolarHBondContact O-CB 3.44Å; A664-T668 PolarHBondContact O-N 2.93Å; A664-T668 PolarHBondContact O-OG1 3.28Å
665	I	94.7	Very high	92.9	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-69.3	-40.9	173.8	-65.8	160.1	0	0	0	110.9	M624 L649 R652 Q653 E656 H661 Q662 K663 T668 L669	M624-I665 HydrophobicContact CE-CD1 4.33Å; M624-I665 HydrophobicContact CE-CG1 3.79Å; M624-I665 HydrophobicContact SD-CG1 3.9Å; L649-I665 HydrophobicContact CD2-CG2 4.14Å; R652-I665 HydrophobicContact CB-CD1 4.29Å; R652-I665 HydrophobicContact CG-CD1 3.65Å; Q653-I665 HydrophobicContact CB-CG2 3.84Å; Q653-I665 HydrophobicContact CG-CG2 4.09Å; E656-I665 HydrophobicContact CB-CD1 4.14Å; E656-I665 HydrophobicContact CG-CD1 4.08Å; H661-I665 WeakPolarHBondContact O-CB 3.5Å; H661-I665 WeakPolarHBondContact O-CD1 3.45Å; H661-I665 VanDerWaalsContact O-CG1 3.24Å; H661-I665 WeakPolarHBondContact O-CG1 3.35Å; H661-I665 PolarHBondContact O-N 3.48Å; Q662-I665 PolarHBondContact O-N 3Å; K663-I665 VanDerWaalsContact C-N 3.27Å; K663-I665 PolarHBondContact O-N 2.92Å; I665-T668 PolarHBondContact O-N 3.38Å; I665-L669 HydrophobicContact CG2-CD1 4.03Å; I665-L669 WeakPolarHBondContact O-CB 3.41Å; I665-L669 WeakPolarHBondContact O-CG 3.36Å; I665-L669 PolarHBondContact O-N 3.02Å
666	Q	93.2	Very high	93.1	Very high	100 Å²	100	50.3 Å²	50.3	47%	0.467	28%	0.276	S	S	.	.	H	α-helix	trans	-63.3	-40.2	173.6	-75.5	175.6	-23.5	0	0	112.4	Q662 K663 L669 F670	Q662-Q666 WeakPolarHBondContact O-CG 3.3Å; Q662-Q666 PolarHBondContact O-N 2.87Å; K663-Q666 WeakPolarHBondContact O-CB 3.23Å; K663-Q666 PolarHBondContact O-N 3.12Å; K663-Q666 VanDerWaalsContact O-N 3.07Å; Q666-L669 PolarHBondContact O-N 3.02Å; Q666-F670 PolarHBondContact O-N 2.99Å
667	E	95.1	Very high	93.2	Very high	79 Å²	79	51.8 Å²	51.8	37%	0.369	29%	0.288	S	S	.	.	H	α-helix	trans	-66.2	-39.9	174.3	-71.9	173	151.8	0	0	111.1	K663 F670 V671	K663-E667 WeakPolarHBondContact CE-OE1 3.45Å; K663-E667 WeakPolarHBondContact CE-OE2 3.27Å; K663-E667 HydrophobicContact CG-CG 4.49Å; K663-E667 IonicContact NZ-OE1 3.79Å; K663-E667 PolarHBondContact NZ-OE1 2.69Å; K663-E667 WeakPolarHBondContact O-CG 3.46Å; K663-E667 PolarHBondContact O-N 3.15Å; E667-F670 WeakPolarHBondContact O-CB 3.37Å; E667-F670 PolarHBondContact O-N 3.45Å; E667-F670 VanDerWaalsContact O-N 3.13Å; E667-V671 WeakPolarHBondContact O-CG2 3.44Å; E667-V671 PolarHBondContact O-N 3.07Å
668	T	96.3	Very high	93.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.2	-41.1	173.2	-53	0	0	0	0	112.1	L627 Q628 I631 L649 A664 I665 F670 V671 L672	L627-T668 HydrophobicContact CD2-CG2 3.95Å; L627-T668 HydrophobicContact CG-CG2 4.16Å; Q628-T668 HydrophobicContact CG-CG2 4.2Å; Q628-T668 WeakPolarHBondContact CG-OG1 3.43Å; I631-T668 HydrophobicContact CD1-CG2 4.04Å; L649-T668 HydrophobicContact CD1-CG2 4.03Å; L649-T668 HydrophobicContact CD2-CG2 3.84Å; A664-T668 WeakPolarHBondContact O-CB 3.44Å; A664-T668 PolarHBondContact O-N 2.93Å; A664-T668 PolarHBondContact O-OG1 3.28Å; I665-T668 PolarHBondContact O-N 3.38Å; T668-F670 VanDerWaalsContact C-N 3.27Å; T668-F670 PolarHBondContact O-N 3.01Å; T668-V671 PolarHBondContact O-N 3.03Å; T668-L672 WeakPolarHBondContact O-CB 3.37Å; T668-L672 PolarHBondContact O-N 3.25Å
669	L	95.9	Very high	93.5	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-69.9	-19.2	173.2	-73.4	168.2	0	0	0	113.2	L646 L649 I665 Q666 R673 Y707	L646-L669 HydrophobicContact CD1-CD2 3.99Å; L649-L669 HydrophobicContact CB-CD2 3.83Å; L649-L669 HydrophobicContact CB-CG 4.28Å; L649-L669 HydrophobicContact CD1-CD2 3.93Å; L649-L669 HydrophobicContact CD1-CG 4.41Å; L649-L669 HydrophobicContact CG-CD2 4.44Å; I665-L669 HydrophobicContact CG2-CD1 4.03Å; I665-L669 WeakPolarHBondContact O-CB 3.41Å; I665-L669 WeakPolarHBondContact O-CG 3.36Å; I665-L669 PolarHBondContact O-N 3.02Å; Q666-L669 PolarHBondContact O-N 3.02Å; L669-R673 VanDerWaalsContact O-CG 3.31Å; L669-R673 WeakPolarHBondContact O-CG 3.41Å; L669-R673 PolarHBondContact O-N 3.25Å; L669-R673 PolarHBondContact O-NE 3.13Å; L669-Y707 HydrophobicContact CB-CD2 4.27Å; L669-Y707 HydrophobicContact CB-CE2 4.15Å; L669-Y707 HydrophobicContact CD2-CD2 3.86Å; L669-Y707 HydrophobicContact CD2-CE2 3.7Å; L669-Y707 HydrophobicContact CG-CD2 4.47Å; L669-Y707 HydrophobicContact CG-CE2 4.48Å
670	F	95.4	Very high	93.6	Very high	116 Å²	116	48.2 Å²	48.2	51%	0.509	25%	0.252	S	S	.	.	H	α-helix	trans	-77.4	-47.9	167.4	177.4	-90.6	0	0	0	110.8	Q666 E667 T668 L672 R673 S674	Q666-F670 PolarHBondContact O-N 2.99Å; E667-F670 WeakPolarHBondContact O-CB 3.37Å; E667-F670 PolarHBondContact O-N 3.45Å; E667-F670 VanDerWaalsContact O-N 3.13Å; T668-F670 VanDerWaalsContact C-N 3.27Å; T668-F670 PolarHBondContact O-N 3.01Å; F670-L672 PolarHBondContact O-N 2.95Å; F670-R673 WeakPolarHBondContact O-CB 3.45Å; F670-R673 PolarHBondContact O-N 2.93Å; F670-R673 VanDerWaalsContact O-N 3.15Å; F670-S674 PolarHBondContact O-N 3.01Å; F670-S674 VanDerWaalsContact O-N 3.12Å; F670-S674 PolarHBondContact O-OG 3.41Å
671	V	96.1	Very high	93.9	Very high	9 Å²	9	45 Å²	45	6%	0.055	23%	0.229	C	C	.	.	H	α-helix	trans	-56.6	-47.7	176	171	0	0	0	0	111.2	Q628 I631 K632 E667 T668 R673 S674 H675	Q628-V671 HydrophobicContact CG-CG2 4.2Å; I631-V671 HydrophobicContact CB-CG1 4.21Å; I631-V671 HydrophobicContact CG2-CG1 3.86Å; K632-V671 HydrophobicContact CD-CG1 4.41Å; K632-V671 HydrophobicContact CG-CG1 3.82Å; E667-V671 WeakPolarHBondContact O-CG2 3.44Å; E667-V671 PolarHBondContact O-N 3.07Å; T668-V671 PolarHBondContact O-N 3.03Å; V671-R673 VanDerWaalsContact C-N 3.32Å; V671-R673 PolarHBondContact O-N 3.05Å; V671-S674 PolarHBondContact O-N 3.42Å; V671-S674 VanDerWaalsContact O-N 3.15Å; V671-H675 PolarHBondContact O-N 2.94Å; V671-H675 PolarHBondContact O-ND1 3.47Å
672	L	95.5	Very high	94	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.1	-45.2	176.9	-168.5	165.6	0	0	0	111.2	L642 L645 L649 T668 F670 S674 H675 F676 Q681 Y707	L642-L672 HydrophobicContact CD1-CD1 4.49Å; L642-L672 HydrophobicContact CD1-CD2 3.68Å; L642-L672 HydrophobicContact CD1-CG 4.19Å; L645-L672 HydrophobicContact CD2-CD1 3.76Å; L645-L672 HydrophobicContact CD2-CG 4.39Å; L645-L672 HydrophobicContact CG-CD1 3.75Å; L649-L672 HydrophobicContact CD1-CD1 3.65Å; T668-L672 WeakPolarHBondContact O-CB 3.37Å; T668-L672 PolarHBondContact O-N 3.25Å; F670-L672 PolarHBondContact O-N 2.95Å; L672-S674 VanDerWaalsContact C-N 3.3Å; L672-S674 PolarHBondContact O-N 2.98Å; L672-H675 PolarHBondContact O-N 3.04Å; L672-F676 HydrophobicContact CD2-CD2 3.99Å; L672-F676 HydrophobicContact CG-CD2 3.84Å; L672-F676 HydrophobicContact CG-CE2 4.04Å; L672-F676 WeakPolarHBondContact O-CD2 3.43Å; L672-F676 PolarHBondContact O-N 3.29Å; L672-Q681 HydrophobicContact CD2-CG 4.36Å; L672-Y707 WeakPolarHBondContact CD2-OH 3.35Å
673	R	95	Very high	94	Very high	34 Å²	34	44.6 Å²	44.6	13%	0.128	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-37.9	176.9	-81.1	-177.9	-62.6	134.8	-7.8	113.7	L669 F670 V671 L678 Q681 Y707 L711 M714	L669-R673 VanDerWaalsContact O-CG 3.31Å; L669-R673 WeakPolarHBondContact O-CG 3.41Å; L669-R673 PolarHBondContact O-N 3.25Å; L669-R673 PolarHBondContact O-NE 3.13Å; F670-R673 WeakPolarHBondContact O-CB 3.45Å; F670-R673 PolarHBondContact O-N 2.93Å; F670-R673 VanDerWaalsContact O-N 3.15Å; V671-R673 VanDerWaalsContact C-N 3.32Å; V671-R673 PolarHBondContact O-N 3.05Å; R673-L678 WeakPolarHBondContact O-CD2 3.44Å; R673-Q681 PolarHBondContact O-NE2 3.24Å; R673-Y707 HydrophobicContact CG-CE1 4.44Å; R673-Y707 HydrophobicContact CG-CE2 3.61Å; R673-Y707 WeakPolarHBondContact CG-OH 3.34Å; R673-L711 HydrophobicContact CG-CD1 4.2Å; R673-M714 HydrophobicContact CB-CE 4.01Å; R673-M714 HydrophobicContact CG-CE 4.29Å
674	S	93.6	Very high	94.1	Very high	73 Å²	73	39.9 Å²	39.9	51%	0.51	21%	0.211	S	C	.	.	H	α-helix	trans	-79.4	-19.4	-177.6	-59.5	0	0	0	0	115.2	F670 V671 L672	F670-S674 PolarHBondContact O-N 3.01Å; F670-S674 VanDerWaalsContact O-N 3.12Å; F670-S674 PolarHBondContact O-OG 3.41Å; V671-S674 PolarHBondContact O-N 3.42Å; V671-S674 VanDerWaalsContact O-N 3.15Å; L672-S674 VanDerWaalsContact C-N 3.3Å; L672-S674 PolarHBondContact O-N 2.98Å
675	H	94.3	Very high	94.1	Very high	66 Å²	66	39.3 Å²	39.3	31%	0.306	21%	0.206	S	C	.	.	H	α-helix	trans	-110	-23.8	-171.4	-65.5	76.3	0	0	0	114.5	I631 N635 V671 L672	I631-H675 HydrophobicContact CG2-CB 4.35Å; N635-H675 HydrophobicContact CB-CB 3.98Å; V671-H675 PolarHBondContact O-N 2.94Å; V671-H675 PolarHBondContact O-ND1 3.47Å; L672-H675 PolarHBondContact O-N 3.04Å
676	F	94.1	Very high	94.1	Very high	7 Å²	7	39.3 Å²	39.3	3%	0.031	21%	0.206	C	C	.	.	S	Bend	trans	-97.4	153.7	176	-68.5	-79.7	0	0	0	112.1	I631 N635 L638 L642 L645 L672 L678 Q681	I631-F676 HydrophobicContact CG2-CE2 3.83Å; N635-F676 HydrophobicContact CB-CE1 4.49Å; N635-F676 WeakPolarHBondContact O-CE1 3.43Å; L638-F676 HydrophobicContact CB-CE1 3.96Å; L638-F676 HydrophobicContact CB-CZ 3.74Å; L642-F676 HydrophobicContact CB-CD1 4.45Å; L642-F676 HydrophobicContact CB-CE1 4.43Å; L642-F676 HydrophobicContact CD1-CB 3.99Å; L642-F676 HydrophobicContact CD1-CD1 3.9Å; L642-F676 HydrophobicContact CD1-CD2 3.55Å; L642-F676 HydrophobicContact CD1-CE1 4.23Å; L642-F676 HydrophobicContact CD1-CE2 3.9Å; L642-F676 HydrophobicContact CD1-CG 3.53Å; L642-F676 HydrophobicContact CD1-CZ 4.22Å; L642-F676 HydrophobicContact CD2-CB 3.93Å; L642-F676 HydrophobicContact CD2-CD1 3.95Å; L642-F676 HydrophobicContact CD2-CG 4.01Å; L642-F676 HydrophobicContact CG-CD1 4.33Å; L642-F676 HydrophobicContact CG-CG 4.33Å; L645-F676 HydrophobicContact CD2-CE2 4.31Å; L672-F676 HydrophobicContact CD2-CD2 3.99Å; L672-F676 HydrophobicContact CG-CD2 3.84Å; L672-F676 HydrophobicContact CG-CE2 4.04Å; L672-F676 WeakPolarHBondContact O-CD2 3.43Å; L672-F676 PolarHBondContact O-N 3.29Å; F676-L678 PolarHBondContact O-N 3.41Å; F676-L678 VanDerWaalsContact O-N 3.16Å; F676-Q681 HydrophobicContact CB-CG 4.02Å; F676-Q681 PolarHBondContact O-NE2 2.91Å
677	P	92.1	Very high	94.1	Very high	53 Å²	53	38.5 Å²	38.5	34%	0.344	20%	0.203	S	C	.	.			trans	-59.8	120.9	175.5	-22.1	33.2	0	0	0	111.7	N679 T680 Q681	P677-N679 PolarHBondContact O-N 2.89Å; P677-N679 VanDerWaalsContact O-N 3.12Å; P677-T680 WeakPolarHBondContact O-CB 3.29Å; P677-T680 PolarHBondContact O-N 3.09Å; P677-Q681 PolarHBondContact O-N 2.97Å; P677-Q681 VanDerWaalsContact O-N 3.12Å
678	L	92.7	Very high	94	Very high	41 Å²	41	34.9 Å²	34.9	22%	0.215	19%	0.185	C	C	.	.	H	α-helix	trans	-53.2	-37.3	-176	-58.5	175.8	0	0	0	112.6	R673 F676 Q681 F682 L711 M714 M715	R673-L678 WeakPolarHBondContact O-CD2 3.44Å; F676-L678 PolarHBondContact O-N 3.41Å; F676-L678 VanDerWaalsContact O-N 3.16Å; L678-Q681 PolarHBondContact O-N 3.47Å; L678-F682 PolarHBondContact O-N 3.09Å; L678-L711 HydrophobicContact CB-CD1 4.41Å; L678-L711 HydrophobicContact CD2-CD1 3.76Å; L678-M714 HydrophobicContact CD1-CB 3.85Å; L678-M714 WeakPolarHBondContact CD1-O 3.26Å; L678-M714 HydrophobicContact CD2-CE 4.05Å; L678-M715 HydrophobicContact CB-CG 4.13Å
679	N	89.8	Confident	93.9	Very high	84 Å²	84	35 Å²	35	45%	0.449	19%	0.186	S	C	.	.	H	α-helix	trans	-62.1	-44	178.6	-55.4	6.7	0	0	0	111.5	P677 F682 N683 L719	P677-N679 PolarHBondContact O-N 2.89Å; P677-N679 VanDerWaalsContact O-N 3.12Å; N679-F682 PolarHBondContact O-N 3.26Å; N679-N683 WeakPolarHBondContact O-CB 3.48Å; N679-N683 VanDerWaalsContact O-CG 3.26Å; N679-N683 PolarHBondContact O-N 3.31Å; N679-N683 PolarHBondContact O-ND2 3.39Å; N679-L719 HydrophobicContact CB-CD1 3.67Å; N679-L719 VanDerWaalsContact CG-CD1 3.47Å; N679-L719 WeakPolarHBondContact OD1-CD1 3.49Å
680	T	92	Very high	93.7	Very high	67 Å²	67	37.3 Å²	37.3	41%	0.411	20%	0.197	S	C	.	.	H	α-helix	trans	-66.7	-42.4	177.5	-48.4	0	0	0	0	110.5	L642 P677 F682 N683 S684	L642-T680 HydrophobicContact CD2-CG2 3.87Å; P677-T680 WeakPolarHBondContact O-CB 3.29Å; P677-T680 PolarHBondContact O-N 3.09Å; T680-F682 VanDerWaalsContact C-N 3.35Å; T680-F682 PolarHBondContact O-N 2.79Å; T680-N683 PolarHBondContact O-N 2.93Å; T680-S684 PolarHBondContact O-N 3.26Å; T680-S684 PolarHBondContact O-OG 3.01Å
681	Q	94.5	Very high	93.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.9	-43.5	175.4	-58.3	175.7	41.7	0	0	112.1	L642 L672 R673 F676 P677 L678 S684 C685 Y707 L711	L642-Q681 HydrophobicContact CD2-CG 4.28Å; L672-Q681 HydrophobicContact CD2-CG 4.36Å; R673-Q681 PolarHBondContact O-NE2 3.24Å; F676-Q681 HydrophobicContact CB-CG 4.02Å; F676-Q681 PolarHBondContact O-NE2 2.91Å; P677-Q681 PolarHBondContact O-N 2.97Å; P677-Q681 VanDerWaalsContact O-N 3.12Å; L678-Q681 PolarHBondContact O-N 3.47Å; Q681-S684 WeakPolarHBondContact O-CB 3.35Å; Q681-S684 PolarHBondContact O-N 3.42Å; Q681-C685 PolarHBondContact O-N 3.46Å; Q681-C685 PolarHBondContact O-SG 2.86Å; Q681-Y707 PolarHBondContact OE1-OH 3.07Å; Q681-L711 HydrophobicContact CB-CD1 4.15Å; Q681-L711 HydrophobicContact CB-CD2 4Å; Q681-L711 VanDerWaalsContact OE1-CD1 3.28Å
682	F	94	Very high	92.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.7	-44.6	178.8	179.9	-94.8	0	0	0	111.2	L678 N679 T680 S684 C685 C686 M708 L711 I712 M715 L719 V727 L757	L678-F682 PolarHBondContact O-N 3.09Å; N679-F682 PolarHBondContact O-N 3.26Å; T680-F682 VanDerWaalsContact C-N 3.35Å; T680-F682 PolarHBondContact O-N 2.79Å; F682-S684 VanDerWaalsContact C-N 3.32Å; F682-S684 PolarHBondContact O-N 2.96Å; F682-C685 WeakPolarHBondContact O-CB 3.32Å; F682-C685 PolarHBondContact O-N 3.43Å; F682-C685 VanDerWaalsContact O-N 3.15Å; F682-C686 PolarHBondContact O-N 3.22Å; F682-M708 HydrophobicContact CD2-CE 4.01Å; F682-M708 HydrophobicContact CE2-CE 3.62Å; F682-M708 HydrophobicContact CZ-CE 4.28Å; F682-L711 HydrophobicContact CB-CD2 3.78Å; F682-L711 HydrophobicContact CD2-CD2 4.34Å; F682-I712 HydrophobicContact CD2-CG1 4.38Å; F682-I712 HydrophobicContact CE2-CD1 4.31Å; F682-I712 HydrophobicContact CE2-CG1 4.12Å; F682-M715 HydrophobicContact CB-CE 3.66Å; F682-M715 HydrophobicContact CB-SD 4.03Å; F682-M715 HydrophobicContact CD1-CE 3.91Å; F682-M715 HydrophobicContact CD2-CE 3.39Å; F682-M715 HydrophobicContact CD2-SD 3.71Å; F682-M715 HydrophobicContact CE1-CE 4.4Å; F682-M715 HydrophobicContact CE2-CE 3.95Å; F682-M715 HydrophobicContact CE2-SD 4.48Å; F682-M715 HydrophobicContact CG-CE 3.36Å; F682-M715 HydrophobicContact CG-SD 4.06Å; F682-M715 HydrophobicContact CZ-CE 4.42Å; F682-L719 HydrophobicContact CD1-CD2 3.75Å; F682-L719 HydrophobicContact CE1-CD2 3.82Å; F682-L719 HydrophobicContact CG-CD2 4.45Å; F682-V727 HydrophobicContact CE1-CG1 3.92Å; F682-V727 HydrophobicContact CE1-CG2 4.26Å; F682-V727 HydrophobicContact CZ-CG1 4.5Å; F682-L757 HydrophobicContact CE2-CD2 4.15Å; F682-L757 HydrophobicContact CZ-CD2 4.15Å
683	N	92.8	Very high	91.3	Very high	74 Å²	74	39.9 Å²	39.9	40%	0.396	22%	0.22	S	C	.	.	H	α-helix	trans	-62.7	-38.6	174.8	-68.4	-11.8	0	0	0	111.5	N679 T680 C685 C686 H687	N679-N683 WeakPolarHBondContact O-CB 3.48Å; N679-N683 VanDerWaalsContact O-CG 3.26Å; N679-N683 PolarHBondContact O-N 3.31Å; N679-N683 PolarHBondContact O-ND2 3.39Å; T680-N683 PolarHBondContact O-N 2.93Å; N683-C685 VanDerWaalsContact C-N 3.35Å; N683-C685 PolarHBondContact O-N 3.38Å; N683-C686 PolarHBondContact O-N 2.94Å; N683-H687 WeakPolarHBondContact O-CB 3.44Å; N683-H687 PolarHBondContact O-N 2.89Å
684	S	94	Very high	90.2	Very high	14 Å²	14	39.6 Å²	39.6	10%	0.098	22%	0.22	C	C	.	.	H	α-helix	trans	-61.3	-39.6	172.1	-60.2	0	0	0	0	112.6	T680 Q681 F682 H687 F688	T680-S684 PolarHBondContact O-N 3.26Å; T680-S684 PolarHBondContact O-OG 3.01Å; Q681-S684 WeakPolarHBondContact O-CB 3.35Å; Q681-S684 PolarHBondContact O-N 3.42Å; F682-S684 VanDerWaalsContact C-N 3.32Å; F682-S684 PolarHBondContact O-N 2.96Å; S684-H687 PolarHBondContact O-N 3.03Å; S684-F688 WeakPolarHBondContact O-CB 3.16Å; S684-F688 PolarHBondContact O-N 3.27Å
685	C	94.9	Very high	89.3	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.007	23%	0.229	C	C	.	.	H	α-helix	trans	-63.5	-44	171.7	-68.7	0	0	0	0	112	Q681 F682 N683 F688 I689 L704 M708	Q681-C685 PolarHBondContact O-N 3.46Å; Q681-C685 PolarHBondContact O-SG 2.86Å; F682-C685 WeakPolarHBondContact O-CB 3.32Å; F682-C685 PolarHBondContact O-N 3.43Å; F682-C685 VanDerWaalsContact O-N 3.15Å; N683-C685 VanDerWaalsContact C-N 3.35Å; N683-C685 PolarHBondContact O-N 3.38Å; C685-F688 PolarHBondContact O-N 3.16Å; C685-I689 VanDerWaalsContact O-CG1 3.28Å; C685-I689 WeakPolarHBondContact O-CG1 3.44Å; C685-I689 PolarHBondContact O-N 3.34Å; C685-L704 HydrophobicContact CB-CD1 4.06Å; C685-M708 HydrophobicContact CB-CE 4.01Å; C685-M708 HydrophobicContact CB-CG 3.78Å; C685-M708 HydrophobicContact CB-SD 3.81Å
686	C	94.4	Very high	88.8	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63	-41.9	176.1	-72	0	0	0	0	112.2	F682 N683 I689 M690 V727 A730	F682-C686 PolarHBondContact O-N 3.22Å; N683-C686 PolarHBondContact O-N 2.94Å; C686-I689 WeakPolarHBondContact O-CB 3.47Å; C686-I689 PolarHBondContact O-N 2.95Å; C686-M690 WeakPolarHBondContact O-CG 3.37Å; C686-M690 PolarHBondContact O-N 3.33Å; C686-V727 HydrophobicContact CB-CG2 4.25Å; C686-A730 HydrophobicContact CB-CB 3.67Å
687	H	93.5	Very high	88.5	Confident	83 Å²	83	41.7 Å²	41.7	38%	0.384	23%	0.234	S	C	.	.	H	α-helix	trans	-61.9	-44.8	175.2	-167.3	55	0	0	0	111.4	Y643 N683 S684 I689 M690 D691 E726	Y643-H687 HydrophobicContact CE2-CB 4.16Å; Y643-H687 AromaticContact CE2-CD2 3.41Å; Y643-H687 VanDerWaalsContact CE2-CD2 3.41Å; Y643-H687 WeakPolarHBondContact CE2-CD2 3.36Å; Y643-H687 AromaticContact CZ-CD2 3.7Å; N683-H687 WeakPolarHBondContact O-CB 3.44Å; N683-H687 PolarHBondContact O-N 2.89Å; S684-H687 PolarHBondContact O-N 3.03Å; H687-I689 VanDerWaalsContact C-N 3.28Å; H687-I689 PolarHBondContact O-N 3.2Å; H687-M690 CarbonylContact O-C 3.31Å; H687-M690 PolarHBondContact O-N 3.32Å; H687-D691 PolarHBondContact O-N 2.84Å; H687-E726 IonicContact CE1-OE1 2.68Å; H687-E726 IonicContact CG-OE1 3.93Å; H687-E726 IonicContact ND1-OE1 2.58Å; H687-E726 PolarHBondContact ND1-OE1 2.86Å
688	F	93.9	Very high	88.6	Confident	2 Å²	2	43 Å²	43	1%	0.009	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-27.9	174.4	-178.9	-126.3	0	0	0	113.7	Y643 I647 L650 Y651 S684 C685 H694 P696 V700 L704	Y643-F688 HydrophobicContact CE2-CB 4.17Å; I647-F688 HydrophobicContact CD1-CB 4.05Å; I647-F688 HydrophobicContact CD1-CD2 3.36Å; I647-F688 HydrophobicContact CD1-CE2 3.96Å; I647-F688 HydrophobicContact CD1-CG 3.83Å; I647-F688 HydrophobicContact CG1-CB 4.3Å; I647-F688 HydrophobicContact CG1-CD1 4.29Å; I647-F688 HydrophobicContact CG1-CD2 3.67Å; I647-F688 HydrophobicContact CG1-CE2 3.99Å; I647-F688 HydrophobicContact CG1-CG 3.83Å; I647-F688 HydrophobicContact CG1-CZ 4.44Å; I647-F688 HydrophobicContact CG2-CD2 4.46Å; I647-F688 HydrophobicContact CG2-CE2 3.98Å; I647-F688 HydrophobicContact CG2-CZ 4.34Å; L650-F688 HydrophobicContact CD1-CE1 4.5Å; Y651-F688 HydrophobicContact CD2-CZ 4.41Å; Y651-F688 AromaticContact CE2-CE2 3.97Å; Y651-F688 HydrophobicContact CE2-CE2 3.97Å; Y651-F688 AromaticContact CE2-CZ 3.69Å; Y651-F688 HydrophobicContact CE2-CZ 3.69Å; S684-F688 WeakPolarHBondContact O-CB 3.16Å; S684-F688 PolarHBondContact O-N 3.27Å; C685-F688 PolarHBondContact O-N 3.16Å; F688-H694 HydrophobicContact CD2-CB 4.33Å; F688-H694 HydrophobicContact CE2-CB 3.71Å; F688-P696 HydrophobicContact CZ-CB 4.33Å; F688-V700 HydrophobicContact CE1-CG1 3.91Å; F688-V700 HydrophobicContact CZ-CG1 3.85Å; F688-L704 HydrophobicContact CD1-CD1 4.02Å; F688-L704 HydrophobicContact CD1-CD2 3.65Å; F688-L704 HydrophobicContact CD1-CG 4.4Å; F688-L704 HydrophobicContact CE1-CD2 3.88Å
689	I	94.1	Very high	88.6	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-72.9	-31.3	172	-72	171.2	0	0	0	111.2	C685 C686 H687 L704 M708 A730 K733 I734 W737	C685-I689 VanDerWaalsContact O-CG1 3.28Å; C685-I689 WeakPolarHBondContact O-CG1 3.44Å; C685-I689 PolarHBondContact O-N 3.34Å; C686-I689 WeakPolarHBondContact O-CB 3.47Å; C686-I689 PolarHBondContact O-N 2.95Å; H687-I689 VanDerWaalsContact C-N 3.28Å; H687-I689 PolarHBondContact O-N 3.2Å; I689-L704 HydrophobicContact CD1-CD2 4.11Å; I689-L704 HydrophobicContact CG1-CD2 3.64Å; I689-M708 HydrophobicContact CD1-CE 4.36Å; I689-M708 HydrophobicContact CD1-SD 3.63Å; I689-A730 HydrophobicContact CB-CB 4.25Å; I689-A730 HydrophobicContact CG2-CB 3.97Å; I689-K733 HydrophobicContact CG2-CB 3.87Å; I689-K733 HydrophobicContact CG2-CD 3.85Å; I689-K733 HydrophobicContact CG2-CG 4.04Å; I689-K733 VanDerWaalsContact O-CD 3.31Å; I689-K733 WeakPolarHBondContact O-CD 3.29Å; I689-K733 WeakPolarHBondContact O-CE 3.24Å; I689-K733 PolarHBondContact O-NZ 2.7Å; I689-I734 HydrophobicContact CD1-CD1 3.69Å; I689-I734 HydrophobicContact CD1-CG1 3.75Å; I689-W737 HydrophobicContact CD1-CZ3 4.46Å; I689-W737 HydrophobicContact CG1-CH2 4.12Å; I689-W737 HydrophobicContact CG1-CZ3 4.33Å; I689-W737 HydrophobicContact CG2-CH2 4.35Å
690	M	91.2	Very high	88.8	Confident	57 Å²	57	44.7 Å²	44.7	28%	0.281	23%	0.231	S	C	.	.	H	α-helix	trans	-93.1	-18.7	-177.5	-69.2	-56.1	-59.5	0	0	114.5	C686 H687 E726 N729 A730 K733	C686-M690 WeakPolarHBondContact O-CG 3.37Å; C686-M690 PolarHBondContact O-N 3.33Å; H687-M690 CarbonylContact O-C 3.31Å; H687-M690 PolarHBondContact O-N 3.32Å; M690-E726 HydrophobicContact CB-CG 4.41Å; M690-E726 HydrophobicContact CG-CG 4.12Å; M690-N729 HydrophobicContact CE-CB 3.67Å; M690-N729 HydrophobicContact SD-CB 3.77Å; M690-A730 HydrophobicContact CG-CB 3.99Å; M690-A730 HydrophobicContact SD-CB 4.43Å; M690-K733 HydrophobicContact SD-CD 4.21Å
691	D	87.4	Confident	88.9	Confident	34 Å²	34	42.5 Å²	42.5	18%	0.182	22%	0.216	C	C	.	.			trans	-57.2	138.8	171.5	-178.3	30	0	0	0	111.3	H687 A693 H694	H687-D691 PolarHBondContact O-N 2.84Å; D691-A693 WeakPolarHBondContact OD1-CB 3.22Å; D691-A693 PolarHBondContact OD1-N 2.67Å; D691-A693 WeakPolarHBondContact OD2-CB 3.18Å; D691-H694 WeakPolarHBondContact OD2-CB 3.36Å; D691-H694 IonicContact OD2-CE1 2.81Å; D691-H694 IonicContact OD2-CG 2.68Å; D691-H694 PolarHBondContact OD2-N 3.01Å; D691-H694 IonicContact OD2-ND1 2.69Å; D691-H694 PolarHBondContact OD2-ND1 3.45Å
692	N	75.3	Confident	88.9	Confident	116 Å²	116	43.8 Å²	43.8	62%	0.62	22%	0.224	S	C	*	.	S	Bend	trans	-110.4	-4.5	176.6	-62.7	-48.9	0	0	0	112.1
693	A	73.3	Confident	88.9	Confident	30 Å²	30	44.6 Å²	44.6	25%	0.248	23%	0.229	C	C	.	.	S	Bend	trans	-73.3	-40	166.3	0	0	0	0	0	110.9	K84 D691	K84-A693 VanDerWaalsContact NZ-CB 3.33Å; D691-A693 WeakPolarHBondContact OD1-CB 3.22Å; D691-A693 PolarHBondContact OD1-N 2.67Å; D691-A693 WeakPolarHBondContact OD2-CB 3.18Å
694	H	71.4	Confident	89.1	Confident	28 Å²	28	41 Å²	41	13%	0.13	21%	0.21	C	C	.	.			trans	-103.8	102.5	177.6	-62.8	71.9	0	0	0	110.9	F688 D691 P696 N931	F688-H694 HydrophobicContact CD2-CB 4.33Å; F688-H694 HydrophobicContact CE2-CB 3.71Å; D691-H694 WeakPolarHBondContact OD2-CB 3.36Å; D691-H694 IonicContact OD2-CE1 2.81Å; D691-H694 IonicContact OD2-CG 2.68Å; D691-H694 PolarHBondContact OD2-N 3.01Å; D691-H694 IonicContact OD2-ND1 2.69Å; D691-H694 PolarHBondContact OD2-ND1 3.45Å; H694-P696 WeakPolarHBondContact O-CD 3.24Å; H694-N931 PolarHBondContact CE1-ND2 2.66Å
695	T	75.1	Confident	89.2	Confident	114 Å²	114	40.4 Å²	40.4	70%	0.699	21%	0.206	S	C	*	.			trans	-86.3	101	167.8	51.3	0	0	0	0	110	N697	T695-N697 PolarHBondContact O-N 3.42Å
696	P	83.5	Confident	89.2	Confident	19 Å²	19	43.3 Å²	43.3	12%	0.123	22%	0.219	C	C	.	.			trans	-66.9	126.3	-176.5	26.7	-36.1	0	0	0	111.5	F688 H694 V700 K701 W737	F688-P696 HydrophobicContact CZ-CB 4.33Å; H694-P696 WeakPolarHBondContact O-CD 3.24Å; P696-V700 HydrophobicContact CB-CB 3.89Å; P696-V700 HydrophobicContact CB-CG1 3.61Å; P696-K701 HydrophobicContact CB-CG 4.09Å; P696-K701 HydrophobicContact CG-CG 4.05Å; P696-W737 HydrophobicContact CG-CH2 4.28Å
697	N	89.6	Confident	89.3	Confident	56 Å²	56	43.8 Å²	43.8	30%	0.299	22%	0.221	S	C	.	.			trans	-65.1	166.3	171.3	74.6	53.2	0	0	0	111	H655 T695 R699 V700 K701	H655-N697 PolarHBondContact NE2-ND2 3.37Å; T695-N697 PolarHBondContact O-N 3.42Å; N697-R699 PolarHBondContact O-N 3.29Å; N697-R699 VanDerWaalsContact O-N 3.1Å; N697-R699 WeakPolarHBondContact OD1-CA 3.37Å; N697-R699 WeakPolarHBondContact OD1-CB 3.31Å; N697-R699 PolarHBondContact OD1-N 3.04Å; N697-V700 PolarHBondContact O-N 2.82Å; N697-V700 VanDerWaalsContact O-N 3.09Å; N697-V700 PolarHBondContact OD1-N 3.17Å; N697-V700 VanDerWaalsContact OD1-N 3.07Å; N697-K701 PolarHBondContact O-N 2.85Å
698	F	92.7	Very high	89.4	Confident	80 Å²	80	39.9 Å²	39.9	35%	0.351	20%	0.203	S	C	.	.	H	α-helix	trans	-59.7	-27	-174.4	-52.9	-60	0	0	0	114.5	T702 E740 K742 V746	F698-T702 PolarHBondContact O-N 2.66Å; F698-T702 PolarHBondContact O-OG1 3.07Å; F698-E740 HydrophobicContact CD1-CG 4.35Å; F698-E740 HydrophobicContact CE1-CG 4.29Å; F698-E740 WeakPolarHBondContact CE1-OE2 3.19Å; F698-K742 HydrophobicContact CE1-CB 3.92Å; F698-K742 HydrophobicContact CE1-CD 4.37Å; F698-K742 HydrophobicContact CE2-CB 3.94Å; F698-K742 HydrophobicContact CE2-CD 4.2Å; F698-K742 HydrophobicContact CZ-CB 3.54Å; F698-K742 HydrophobicContact CZ-CD 3.54Å; F698-K742 HydrophobicContact CZ-CG 4.18Å; F698-V746 HydrophobicContact CB-CG2 4.17Å; F698-V746 HydrophobicContact CD1-CG2 4.47Å; F698-V746 WeakPolarHBondContact O-CG2 3.22Å
699	R	92.8	Very high	89.5	Confident	161 Å²	161	41.1 Å²	41.1	61%	0.608	21%	0.209	S	C	*	.	H	α-helix	trans	-74.1	-47.4	174.8	-60.2	-174.5	-179.7	-176.8	-1.1	110.8	S654 N697 K701 T702 C703	S654-R699 WeakPolarHBondContact O-CD 3.36Å; S654-R699 PolarHBondContact O-NH1 3.33Å; N697-R699 PolarHBondContact O-N 3.29Å; N697-R699 VanDerWaalsContact O-N 3.1Å; N697-R699 WeakPolarHBondContact OD1-CA 3.37Å; N697-R699 WeakPolarHBondContact OD1-CB 3.31Å; N697-R699 PolarHBondContact OD1-N 3.04Å; R699-K701 VanDerWaalsContact C-N 3.32Å; R699-K701 PolarHBondContact O-N 2.89Å; R699-T702 PolarHBondContact O-N 3.07Å; R699-T702 VanDerWaalsContact O-N 3.08Å; R699-C703 PolarHBondContact O-N 3.16Å; R699-C703 PolarHBondContact O-SG 2.57Å; R699-C703 VanDerWaalsContact O-SG 3.39Å
700	V	94.1	Very high	89.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58	-43.7	174.8	179.8	0	0	0	0	110.9	Y651 S654 F688 P696 N697 T702 C703 L704	Y651-V700 HydrophobicContact CD1-CG2 3.84Å; Y651-V700 HydrophobicContact CE1-CG2 3.9Å; Y651-V700 HydrophobicContact CE2-CG1 4.37Å; Y651-V700 HydrophobicContact CG-CG2 4.28Å; S654-V700 WeakPolarHBondContact OG-CG2 3.34Å; F688-V700 HydrophobicContact CE1-CG1 3.91Å; F688-V700 HydrophobicContact CZ-CG1 3.85Å; P696-V700 HydrophobicContact CB-CB 3.89Å; P696-V700 HydrophobicContact CB-CG1 3.61Å; N697-V700 PolarHBondContact O-N 2.82Å; N697-V700 VanDerWaalsContact O-N 3.09Å; N697-V700 PolarHBondContact OD1-N 3.17Å; N697-V700 VanDerWaalsContact OD1-N 3.07Å; V700-T702 VanDerWaalsContact C-N 3.35Å; V700-T702 PolarHBondContact O-N 2.83Å; V700-C703 PolarHBondContact O-N 3.47Å; V700-L704 VanDerWaalsContact O-CB 3.25Å; V700-L704 WeakPolarHBondContact O-CB 3.37Å; V700-L704 PolarHBondContact O-N 3.39Å
701	K	94.5	Very high	89.7	Confident	22 Å²	22	40.8 Å²	40.8	10%	0.096	21%	0.208	C	C	.	.	H	α-helix	trans	-55.5	-47	172.8	-71.2	-170.3	-173.7	-171.4	0	111.8	P696 N697 R699 L704 L705 W737 E740 V746	P696-K701 HydrophobicContact CB-CG 4.09Å; P696-K701 HydrophobicContact CG-CG 4.05Å; N697-K701 PolarHBondContact O-N 2.85Å; R699-K701 VanDerWaalsContact C-N 3.32Å; R699-K701 PolarHBondContact O-N 2.89Å; K701-L704 PolarHBondContact O-N 2.83Å; K701-L705 WeakPolarHBondContact O-CB 3.14Å; K701-L705 WeakPolarHBondContact O-CD1 3.25Å; K701-L705 WeakPolarHBondContact O-CG 3.36Å; K701-L705 PolarHBondContact O-N 3.49Å; K701-W737 HydrophobicContact CB-CZ3 4.46Å; K701-W737 HydrophobicContact CD-CD2 4.01Å; K701-W737 HydrophobicContact CD-CE3 4.22Å; K701-W737 HydrophobicContact CD-CH2 4.25Å; K701-W737 HydrophobicContact CD-CZ2 4.06Å; K701-W737 HydrophobicContact CD-CZ3 4.33Å; K701-W737 HydrophobicContact CG-CE3 4.45Å; K701-W737 HydrophobicContact CG-CH2 4.03Å; K701-W737 HydrophobicContact CG-CZ2 4.28Å; K701-W737 HydrophobicContact CG-CZ3 4.13Å; K701-E740 IonicContact NZ-OE2 3.59Å; K701-E740 PolarHBondContact NZ-OE2 3.22Å; K701-V746 HydrophobicContact CB-CG1 4.37Å; K701-V746 HydrophobicContact CB-CG2 3.8Å; K701-V746 HydrophobicContact CD-CG1 4Å; K701-V746 HydrophobicContact CD-CG2 4.26Å
702	T	94.8	Very high	90	Very high	27 Å²	27	39.4 Å²	39.4	17%	0.166	20%	0.2	C	C	.	.	H	α-helix	trans	-64.2	-45.9	179.9	-62.2	0	0	0	0	112	F698 R699 V700 L704 L705 E706 D745 V746	F698-T702 PolarHBondContact O-N 2.66Å; F698-T702 PolarHBondContact O-OG1 3.07Å; R699-T702 PolarHBondContact O-N 3.07Å; R699-T702 VanDerWaalsContact O-N 3.08Å; V700-T702 VanDerWaalsContact C-N 3.35Å; V700-T702 PolarHBondContact O-N 2.83Å; T702-L704 PolarHBondContact O-N 3.13Å; T702-L705 PolarHBondContact O-N 3.42Å; T702-E706 WeakPolarHBondContact O-CB 3.06Å; T702-E706 PolarHBondContact O-N 2.81Å; T702-D745 HydrophobicContact CG2-CB 4.19Å; T702-V746 WeakPolarHBondContact OG1-CG2 3.18Å
703	C	94.8	Very high	90.8	Very high	16 Å²	16	38.8 Å²	38.8	11%	0.108	20%	0.196	C	C	.	.	H	α-helix	trans	-61.2	-43.7	176.5	-62.8	0	0	0	0	112.1	L650 R699 V700 E706 Y707	L650-C703 HydrophobicContact CD2-CB 3.97Å; R699-C703 PolarHBondContact O-N 3.16Å; R699-C703 PolarHBondContact O-SG 2.57Å; R699-C703 VanDerWaalsContact O-SG 3.39Å; V700-C703 PolarHBondContact O-N 3.47Å; C703-E706 PolarHBondContact O-N 2.91Å; C703-Y707 WeakPolarHBondContact O-CB 3.27Å; C703-Y707 PolarHBondContact O-N 3.47Å
704	L	95.9	Very high	91.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.9	-47.2	176.7	173.7	62.3	0	0	0	112.2	L650 C685 F688 I689 V700 K701 T702 E706 Y707 M708 W737	L650-L704 HydrophobicContact CD1-CB 4.3Å; L650-L704 HydrophobicContact CD1-CD1 3.82Å; C685-L704 HydrophobicContact CB-CD1 4.06Å; F688-L704 HydrophobicContact CD1-CD1 4.02Å; F688-L704 HydrophobicContact CD1-CD2 3.65Å; F688-L704 HydrophobicContact CD1-CG 4.4Å; F688-L704 HydrophobicContact CE1-CD2 3.88Å; I689-L704 HydrophobicContact CD1-CD2 4.11Å; I689-L704 HydrophobicContact CG1-CD2 3.64Å; V700-L704 VanDerWaalsContact O-CB 3.25Å; V700-L704 WeakPolarHBondContact O-CB 3.37Å; V700-L704 PolarHBondContact O-N 3.39Å; K701-L704 PolarHBondContact O-N 2.83Å; T702-L704 PolarHBondContact O-N 3.13Å; L704-E706 VanDerWaalsContact C-N 3.32Å; L704-E706 PolarHBondContact O-N 2.97Å; L704-Y707 PolarHBondContact O-N 3.3Å; L704-M708 HydrophobicContact CD1-CG 4.38Å; L704-M708 HydrophobicContact CD1-SD 4.44Å; L704-M708 WeakPolarHBondContact O-CG 3.3Å; L704-M708 PolarHBondContact O-N 2.72Å; L704-W737 HydrophobicContact CD2-CZ3 4.49Å
705	L	96.5	Very high	92.4	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.4	-34	178.6	-68.9	166	0	0	0	111.9	K701 T702 K709 I734 W737 V746 M749 A750 V753	K701-L705 WeakPolarHBondContact O-CB 3.14Å; K701-L705 WeakPolarHBondContact O-CD1 3.25Å; K701-L705 WeakPolarHBondContact O-CG 3.36Å; K701-L705 PolarHBondContact O-N 3.49Å; T702-L705 PolarHBondContact O-N 3.42Å; L705-K709 WeakPolarHBondContact O-CB 3.39Å; L705-K709 PolarHBondContact O-N 3.31Å; L705-I734 HydrophobicContact CD2-CG1 4.21Å; L705-I734 HydrophobicContact CD2-CG2 3.95Å; L705-W737 HydrophobicContact CD1-CE3 4.02Å; L705-W737 HydrophobicContact CD2-CE3 4.15Å; L705-W737 HydrophobicContact CD2-CZ3 4.39Å; L705-W737 HydrophobicContact CG-CE3 4.3Å; L705-W737 HydrophobicContact CG-CZ3 4.44Å; L705-V746 HydrophobicContact CD1-CG1 4.2Å; L705-M749 HydrophobicContact CB-CB 3.8Å; L705-M749 HydrophobicContact CB-CG 3.53Å; L705-M749 HydrophobicContact CD1-CB 4.27Å; L705-A750 HydrophobicContact CD1-CB 4Å; L705-A750 HydrophobicContact CD2-CB 4.47Å; L705-V753 HydrophobicContact CB-CG2 4.15Å; L705-V753 HydrophobicContact CD2-CB 4.38Å; L705-V753 HydrophobicContact CD2-CG2 3.94Å; L705-V753 WeakPolarHBondContact O-CG2 3.38Å
706	E	95.5	Very high	92.9	Very high	63 Å²	63	37.6 Å²	37.6	29%	0.294	19%	0.185	S	C	.	.	H	α-helix	trans	-64.3	-47.6	172.4	179.9	139.1	-109.4	0	0	111.3	T702 C703 L704 K709 D710 M749	T702-E706 WeakPolarHBondContact O-CB 3.06Å; T702-E706 PolarHBondContact O-N 2.81Å; C703-E706 PolarHBondContact O-N 2.91Å; L704-E706 VanDerWaalsContact C-N 3.32Å; L704-E706 PolarHBondContact O-N 2.97Å; E706-K709 WeakPolarHBondContact O-CB 3.38Å; E706-K709 WeakPolarHBondContact O-CE 3.32Å; E706-K709 PolarHBondContact O-N 3.36Å; E706-K709 IonicContact OE1-NZ 2.66Å; E706-D710 PolarHBondContact O-N 2.93Å; E706-D710 VanDerWaalsContact O-N 3.12Å; E706-M749 HydrophobicContact CB-CE 4.03Å; E706-M749 HydrophobicContact CB-CG 4.4Å; E706-M749 HydrophobicContact CB-SD 4.39Å; E706-M749 HydrophobicContact CG-CE 4.36Å; E706-M749 WeakPolarHBondContact OE1-CE 3.48Å
707	Y	96.4	Very high	92.6	Very high	10 Å²	10	39.5 Å²	39.5	4%	0.039	20%	0.197	C	C	.	.	H	α-helix	trans	-58.6	-48.9	175.6	-175.8	-89.5	0	0	0	111.9	L646 L669 L672 R673 Q681 C703 L704 K709 D710 L711	L646-Y707 HydrophobicContact CD1-CD1 4.26Å; L646-Y707 HydrophobicContact CD1-CD2 4.38Å; L646-Y707 HydrophobicContact CD1-CE1 3.81Å; L646-Y707 HydrophobicContact CD1-CE2 3.92Å; L646-Y707 HydrophobicContact CD2-CE1 4.3Å; L669-Y707 HydrophobicContact CB-CD2 4.27Å; L669-Y707 HydrophobicContact CB-CE2 4.15Å; L669-Y707 HydrophobicContact CD2-CD2 3.86Å; L669-Y707 HydrophobicContact CD2-CE2 3.7Å; L669-Y707 HydrophobicContact CG-CD2 4.47Å; L669-Y707 HydrophobicContact CG-CE2 4.48Å; L672-Y707 WeakPolarHBondContact CD2-OH 3.35Å; R673-Y707 HydrophobicContact CG-CE1 4.44Å; R673-Y707 HydrophobicContact CG-CE2 3.61Å; R673-Y707 WeakPolarHBondContact CG-OH 3.34Å; Q681-Y707 PolarHBondContact OE1-OH 3.07Å; C703-Y707 WeakPolarHBondContact O-CB 3.27Å; C703-Y707 PolarHBondContact O-N 3.47Å; L704-Y707 PolarHBondContact O-N 3.3Å; Y707-K709 VanDerWaalsContact C-N 3.33Å; Y707-K709 PolarHBondContact O-N 3.42Å; Y707-D710 PolarHBondContact O-N 3.09Å; Y707-L711 HydrophobicContact CE1-CD2 4.19Å; Y707-L711 WeakPolarHBondContact O-CB 3.46Å; Y707-L711 PolarHBondContact O-N 2.79Å
708	M	95.8	Very high	92	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.6	-40.5	176.5	-71.2	-174	82.2	0	0	112.2	F682 C685 I689 L704 D710 L711 I712 I734 V753	F682-M708 HydrophobicContact CD2-CE 4.01Å; F682-M708 HydrophobicContact CE2-CE 3.62Å; F682-M708 HydrophobicContact CZ-CE 4.28Å; C685-M708 HydrophobicContact CB-CE 4.01Å; C685-M708 HydrophobicContact CB-CG 3.78Å; C685-M708 HydrophobicContact CB-SD 3.81Å; I689-M708 HydrophobicContact CD1-CE 4.36Å; I689-M708 HydrophobicContact CD1-SD 3.63Å; L704-M708 HydrophobicContact CD1-CG 4.38Å; L704-M708 HydrophobicContact CD1-SD 4.44Å; L704-M708 WeakPolarHBondContact O-CG 3.3Å; L704-M708 PolarHBondContact O-N 2.72Å; M708-D710 VanDerWaalsContact C-N 3.3Å; M708-D710 PolarHBondContact O-N 2.86Å; M708-L711 PolarHBondContact O-N 3.33Å; M708-I712 WeakPolarHBondContact O-CB 3.33Å; M708-I712 VanDerWaalsContact O-CD1 3.31Å; M708-I712 WeakPolarHBondContact O-CD1 3.28Å; M708-I712 WeakPolarHBondContact O-CG1 3.44Å; M708-I712 PolarHBondContact O-N 2.69Å; M708-I734 HydrophobicContact CE-CD1 3.87Å; M708-I734 HydrophobicContact SD-CD1 4.01Å; M708-V753 HydrophobicContact CB-CG2 4.23Å
709	K	94.8	Very high	90.9	Very high	29 Å²	29	40 Å²	40	13%	0.126	20%	0.204	C	C	.	.	H	α-helix	trans	-60.1	-37.2	176.7	165.7	-120.4	62.6	-175.3	0	112.1	L705 E706 Y707 L713 M749 R752 V753	L705-K709 WeakPolarHBondContact O-CB 3.39Å; L705-K709 PolarHBondContact O-N 3.31Å; E706-K709 WeakPolarHBondContact O-CB 3.38Å; E706-K709 WeakPolarHBondContact O-CE 3.32Å; E706-K709 PolarHBondContact O-N 3.36Å; E706-K709 IonicContact OE1-NZ 2.66Å; Y707-K709 VanDerWaalsContact C-N 3.33Å; Y707-K709 PolarHBondContact O-N 3.42Å; K709-L713 WeakPolarHBondContact O-CG 3.38Å; K709-M749 HydrophobicContact CD-SD 4.1Å; K709-R752 HydrophobicContact CG-CB 4.43Å; K709-V753 HydrophobicContact CB-CG2 3.98Å
710	D	94.7	Very high	90.3	Very high	52 Å²	52	32.4 Å²	32.4	28%	0.278	18%	0.175	S	C	.	.	H	α-helix	trans	-81.9	-27.3	174.3	-70.2	-41.5	0	0	0	113.4	E706 Y707 M708	E706-D710 PolarHBondContact O-N 2.93Å; E706-D710 VanDerWaalsContact O-N 3.12Å; Y707-D710 PolarHBondContact O-N 3.09Å; M708-D710 VanDerWaalsContact C-N 3.3Å; M708-D710 PolarHBondContact O-N 2.86Å
711	L	94.8	Very high	89.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-67.9	-47.1	175.9	-172.5	69.1	0	0	0	111.6	R673 L678 Q681 F682 Y707 M708 L713 M714 M715	R673-L711 HydrophobicContact CG-CD1 4.2Å; L678-L711 HydrophobicContact CB-CD1 4.41Å; L678-L711 HydrophobicContact CD2-CD1 3.76Å; Q681-L711 HydrophobicContact CB-CD1 4.15Å; Q681-L711 HydrophobicContact CB-CD2 4Å; Q681-L711 VanDerWaalsContact OE1-CD1 3.28Å; F682-L711 HydrophobicContact CB-CD2 3.78Å; F682-L711 HydrophobicContact CD2-CD2 4.34Å; Y707-L711 HydrophobicContact CE1-CD2 4.19Å; Y707-L711 WeakPolarHBondContact O-CB 3.46Å; Y707-L711 PolarHBondContact O-N 2.79Å; M708-L711 PolarHBondContact O-N 3.33Å; L711-L713 PolarHBondContact O-N 3.42Å; L711-M714 HydrophobicContact CD1-CE 4.43Å; L711-M714 PolarHBondContact O-N 3.48Å; L711-M715 HydrophobicContact CD2-SD 4.28Å; L711-M715 HydrophobicContact CG-CG 4.48Å; L711-M715 HydrophobicContact CG-SD 3.89Å; L711-M715 WeakPolarHBondContact O-CG 3.39Å; L711-M715 PolarHBondContact O-N 2.94Å
712	I	94.1	Very high	89.1	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-59.8	-31.6	-178.7	-68.2	159.7	0	0	0	112.1	F682 M708 M714 M715 V753 K756 L757 L760	F682-I712 HydrophobicContact CD2-CG1 4.38Å; F682-I712 HydrophobicContact CE2-CD1 4.31Å; F682-I712 HydrophobicContact CE2-CG1 4.12Å; M708-I712 WeakPolarHBondContact O-CB 3.33Å; M708-I712 VanDerWaalsContact O-CD1 3.31Å; M708-I712 WeakPolarHBondContact O-CD1 3.28Å; M708-I712 WeakPolarHBondContact O-CG1 3.44Å; M708-I712 PolarHBondContact O-N 2.69Å; I712-M714 PolarHBondContact O-N 3.15Å; I712-M714 VanDerWaalsContact O-N 3.13Å; I712-M715 HydrophobicContact CB-SD 4.41Å; I712-M715 HydrophobicContact CG1-SD 4.03Å; I712-M715 PolarHBondContact O-N 2.86Å; I712-V753 HydrophobicContact CD1-CG1 3.84Å; I712-K756 HydrophobicContact CB-CB 4.34Å; I712-K756 HydrophobicContact CG2-CB 3.8Å; I712-K756 VanDerWaalsContact CG2-O 3.31Å; I712-K756 WeakPolarHBondContact CG2-O 3.18Å; I712-L757 HydrophobicContact CD1-CD2 3.67Å; I712-L757 HydrophobicContact CD1-CG 3.91Å; I712-L757 HydrophobicContact CG1-CD2 4.1Å; I712-L760 HydrophobicContact CG2-CB 4.24Å; I712-L760 HydrophobicContact CG2-CD2 4.19Å
713	L	91.9	Very high	88.7	Confident	103 Å²	103	41.1 Å²	41.1	54%	0.539	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-7.9	176.3	-71.9	172.3	0	0	0	114.5	K709 L711 K756	K709-L713 WeakPolarHBondContact O-CG 3.38Å; L711-L713 PolarHBondContact O-N 3.42Å; L713-K756 HydrophobicContact CD2-CD 3.99Å
714	M	90.4	Very high	88.5	Confident	83 Å²	83	43.1 Å²	43.1	41%	0.409	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.5	-5.9	-179.2	-55.6	-178.9	-58.7	0	0	113.2	R673 L678 L711 I712	R673-M714 HydrophobicContact CB-CE 4.01Å; R673-M714 HydrophobicContact CG-CE 4.29Å; L678-M714 HydrophobicContact CD1-CB 3.85Å; L678-M714 WeakPolarHBondContact CD1-O 3.26Å; L678-M714 HydrophobicContact CD2-CE 4.05Å; L711-M714 HydrophobicContact CD1-CE 4.43Å; L711-M714 PolarHBondContact O-N 3.48Å; I712-M714 PolarHBondContact O-N 3.15Å; I712-M714 VanDerWaalsContact O-N 3.13Å
715	M	88.4	Confident	88.2	Confident	12 Å²	12	49.3 Å²	49.3	6%	0.059	28%	0.276	C	S	.	.	S	Bend	trans	-82.3	155.9	-174.9	-72.3	161.1	63.7	0	0	112.5	L678 F682 L711 I712 L719 L760	L678-M715 HydrophobicContact CB-CG 4.13Å; F682-M715 HydrophobicContact CB-CE 3.66Å; F682-M715 HydrophobicContact CB-SD 4.03Å; F682-M715 HydrophobicContact CD1-CE 3.91Å; F682-M715 HydrophobicContact CD2-CE 3.39Å; F682-M715 HydrophobicContact CD2-SD 3.71Å; F682-M715 HydrophobicContact CE1-CE 4.4Å; F682-M715 HydrophobicContact CE2-CE 3.95Å; F682-M715 HydrophobicContact CE2-SD 4.48Å; F682-M715 HydrophobicContact CG-CE 3.36Å; F682-M715 HydrophobicContact CG-SD 4.06Å; F682-M715 HydrophobicContact CZ-CE 4.42Å; L711-M715 HydrophobicContact CD2-SD 4.28Å; L711-M715 HydrophobicContact CG-CG 4.48Å; L711-M715 HydrophobicContact CG-SD 3.89Å; L711-M715 WeakPolarHBondContact O-CG 3.39Å; L711-M715 PolarHBondContact O-N 2.94Å; I712-M715 HydrophobicContact CB-SD 4.41Å; I712-M715 HydrophobicContact CG1-SD 4.03Å; I712-M715 PolarHBondContact O-N 2.86Å; M715-L719 HydrophobicContact CE-CB 4.43Å; M715-L719 HydrophobicContact CE-CD1 3.63Å; M715-L719 HydrophobicContact CE-CD2 3.51Å; M715-L719 HydrophobicContact CE-CG 4.04Å; M715-L760 HydrophobicContact CB-CD2 4.49Å; M715-L760 WeakPolarHBondContact O-CD1 3.47Å
716	S	84.8	Confident	87.9	Confident	52 Å²	52	52.7 Å²	52.7	36%	0.364	29%	0.292	S	S	.	.			trans	-70	140.9	171.5	-168.2	0	0	0	0	111.3	D718 L719	S716-D718 PolarHBondContact O-N 3.2Å; S716-D718 VanDerWaalsContact O-N 3.09Å; S716-D718 PolarHBondContact OG-OD2 2.91Å; S716-L719 PolarHBondContact O-N 3.46Å
717	P	77	Confident	87.8	Confident	59 Å²	59	50 Å²	50	38%	0.383	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-17.9	172	24.7	-37	0	0	0	114.5	L719 L760 N761	P717-L719 VanDerWaalsContact C-N 3.33Å; P717-L719 PolarHBondContact O-N 3.25Å; P717-L760 HydrophobicContact CB-CD1 4.35Å; P717-L760 WeakPolarHBondContact CB-O 3.35Å; P717-N761 HydrophobicContact CB-CB 4.15Å; P717-N761 WeakPolarHBondContact O-CB 3.2Å; P717-N761 PolarHBondContact O-ND2 3.49Å
718	D	77.8	Confident	87.6	Confident	114 Å²	114	50.2 Å²	50.2	61%	0.61	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.4	179.6	-47.2	-57.4	0	0	0	113.4	S716 I720 A721	S716-D718 PolarHBondContact O-N 3.2Å; S716-D718 VanDerWaalsContact O-N 3.09Å; S716-D718 PolarHBondContact OG-OD2 2.91Å; D718-I720 VanDerWaalsContact C-N 3.31Å; D718-I720 PolarHBondContact O-N 3.28Å; D718-A721 WeakPolarHBondContact O-CB 3.47Å; D718-A721 PolarHBondContact O-N 3.3Å
719	L	70.4	Confident	87.5	Confident	34 Å²	34	54.2 Å²	54.2	18%	0.178	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-38.1	-167.5	179.9	143.9	0	0	0	113	N679 F682 M715 S716 P717 A721	N679-L719 HydrophobicContact CB-CD1 3.67Å; N679-L719 VanDerWaalsContact CG-CD1 3.47Å; N679-L719 WeakPolarHBondContact OD1-CD1 3.49Å; F682-L719 HydrophobicContact CD1-CD2 3.75Å; F682-L719 HydrophobicContact CE1-CD2 3.82Å; F682-L719 HydrophobicContact CG-CD2 4.45Å; M715-L719 HydrophobicContact CE-CB 4.43Å; M715-L719 HydrophobicContact CE-CD1 3.63Å; M715-L719 HydrophobicContact CE-CD2 3.51Å; M715-L719 HydrophobicContact CE-CG 4.04Å; S716-L719 PolarHBondContact O-N 3.46Å; P717-L719 VanDerWaalsContact C-N 3.33Å; P717-L719 PolarHBondContact O-N 3.25Å; L719-A721 VanDerWaalsContact C-N 3.3Å
720	I	79.8	Confident	87.5	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	4.9	178.9	58.1	166.4	0	0	0	113.4	D718 P723 L757 L760 N761 S764 F765	D718-I720 VanDerWaalsContact C-N 3.31Å; D718-I720 PolarHBondContact O-N 3.28Å; I720-P723 WeakPolarHBondContact O-CD 3.41Å; I720-L757 WeakPolarHBondContact CD1-O 3.16Å; I720-L757 HydrophobicContact CG2-CD2 4.45Å; I720-L760 HydrophobicContact CD1-CD2 4.48Å; I720-L760 HydrophobicContact CG1-CD2 4.45Å; I720-N761 HydrophobicContact CD1-CB 4.05Å; I720-N761 HydrophobicContact CG1-CB 4.12Å; I720-S764 WeakPolarHBondContact O-CB 3.2Å; I720-F765 HydrophobicContact CD1-CB 4.16Å
721	A	80	Confident	87.5	Confident	42 Å²	42	50.3 Å²	50.3	35%	0.347	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-33.7	178.6	0	0	0	0	0	113.2	D718 L719 S764	D718-A721 WeakPolarHBondContact O-CB 3.47Å; D718-A721 PolarHBondContact O-N 3.3Å; L719-A721 VanDerWaalsContact C-N 3.3Å; A721-S764 WeakPolarHBondContact CA-OG 3.33Å
722	N	83.6	Confident	87.5	Confident	154 Å²	154	50.7 Å²	50.7	82%	0.824	29%	0.288	S	S	*	.	S	Bend	trans	-129.3	69.9	176.2	-66.4	-63.2	0	0	0	110.2
723	P	85.3	Confident	87.6	Confident	36 Å²	36	53.6 Å²	53.6	23%	0.234	30%	0.3	C	S	.	.			trans	-73.8	142.3	-174.7	31.8	-34	0	0	0	111.3	I720 V727 I728 L768	I720-P723 WeakPolarHBondContact O-CD 3.41Å; P723-V727 HydrophobicContact CB-CB 4.22Å; P723-V727 HydrophobicContact CB-CG1 3.9Å; P723-I728 HydrophobicContact CB-CG1 4.04Å; P723-I728 HydrophobicContact CG-CD1 4.21Å; P723-I728 HydrophobicContact CG-CG1 3.89Å; P723-L768 HydrophobicContact CB-CD1 4.08Å; P723-L768 HydrophobicContact CG-CB 4.49Å; P723-L768 HydrophobicContact CG-CD1 4.13Å; P723-L768 HydrophobicContact CG-CG 4.34Å
724	S	90.1	Very high	87.7	Confident	58 Å²	58	48.7 Å²	48.7	41%	0.406	27%	0.274	S	S	.	.			trans	-70	157.6	171	71.9	0	0	0	0	111.1	E726 V727 I728	S724-E726 PolarHBondContact O-N 3.39Å; S724-E726 VanDerWaalsContact O-N 3.11Å; S724-V727 PolarHBondContact O-N 3.26Å; S724-V727 WeakPolarHBondContact OG-CG2 3.41Å; S724-V727 PolarHBondContact OG-N 2.91Å; S724-I728 WeakPolarHBondContact O-CG1 3.49Å; S724-I728 PolarHBondContact O-N 3.4Å
725	N	90.1	Very high	88	Confident	129 Å²	129	44.7 Å²	44.7	69%	0.69	26%	0.255	S	S	*	.	H	α-helix	trans	-54.5	-31	173.9	-73.1	-39.2	0	0	0	112.7	N729	N725-N729 WeakPolarHBondContact O-CB 3.41Å; N725-N729 VanDerWaalsContact O-CG 3.32Å; N725-N729 PolarHBondContact O-N 2.99Å; N725-N729 PolarHBondContact O-ND2 3.2Å
726	E	90.4	Very high	88.3	Confident	72 Å²	72	47 Å²	47	34%	0.336	27%	0.272	S	S	.	.	H	α-helix	trans	-67.5	-45.7	173.4	-179.9	170.5	-131	0	0	112.4	H687 M690 S724 N729 A730	H687-E726 IonicContact CE1-OE1 2.68Å; H687-E726 IonicContact CG-OE1 3.93Å; H687-E726 IonicContact ND1-OE1 2.58Å; H687-E726 PolarHBondContact ND1-OE1 2.86Å; M690-E726 HydrophobicContact CB-CG 4.41Å; M690-E726 HydrophobicContact CG-CG 4.12Å; S724-E726 PolarHBondContact O-N 3.39Å; S724-E726 VanDerWaalsContact O-N 3.11Å; E726-N729 PolarHBondContact O-N 3.13Å; E726-A730 VanDerWaalsContact O-CB 3.26Å; E726-A730 WeakPolarHBondContact O-CB 3.32Å; E726-A730 PolarHBondContact O-N 3.23Å
727	V	92.5	Very high	88.8	Confident	6 Å²	6	45.3 Å²	45.3	4%	0.036	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-43	175.3	170	0	0	0	0	111	F682 C686 P723 S724 N729 A730 V731	F682-V727 HydrophobicContact CE1-CG1 3.92Å; F682-V727 HydrophobicContact CE1-CG2 4.26Å; F682-V727 HydrophobicContact CZ-CG1 4.5Å; C686-V727 HydrophobicContact CB-CG2 4.25Å; P723-V727 HydrophobicContact CB-CB 4.22Å; P723-V727 HydrophobicContact CB-CG1 3.9Å; S724-V727 PolarHBondContact O-N 3.26Å; S724-V727 WeakPolarHBondContact OG-CG2 3.41Å; S724-V727 PolarHBondContact OG-N 2.91Å; V727-N729 PolarHBondContact O-N 3.17Å; V727-A730 PolarHBondContact O-N 3.14Å; V727-V731 HydrophobicContact CG1-CG2 4.42Å; V727-V731 WeakPolarHBondContact O-CB 3.45Å; V727-V731 VanDerWaalsContact O-CG2 3.31Å; V727-V731 WeakPolarHBondContact O-CG2 3.27Å; V727-V731 PolarHBondContact O-N 3.42Å
728	I	93.7	Very high	89.6	Confident	15 Å²	15	42.6 Å²	42.6	8%	0.077	24%	0.24	C	C	.	.	H	α-helix	trans	-56.7	-52.5	175.6	-63.1	169.6	0	0	0	109.9	P723 S724 V731 G732 L768 L772	P723-I728 HydrophobicContact CB-CG1 4.04Å; P723-I728 HydrophobicContact CG-CD1 4.21Å; P723-I728 HydrophobicContact CG-CG1 3.89Å; S724-I728 WeakPolarHBondContact O-CG1 3.49Å; S724-I728 PolarHBondContact O-N 3.4Å; I728-V731 PolarHBondContact O-N 3.39Å; I728-G732 PolarHBondContact O-N 3.23Å; I728-L768 HydrophobicContact CG1-CG 4.28Å; I728-L772 HydrophobicContact CG2-CD2 3.87Å; I728-L772 HydrophobicContact CG2-CG 3.99Å
729	N	93.6	Very high	90.3	Very high	83 Å²	83	39.4 Å²	39.4	44%	0.444	23%	0.23	S	C	.	.	H	α-helix	trans	-65.6	-39.7	-179.4	-75.1	-47	0	0	0	112.9	M690 N725 E726 V727 G732 K733	M690-N729 HydrophobicContact CE-CB 3.67Å; M690-N729 HydrophobicContact SD-CB 3.77Å; N725-N729 WeakPolarHBondContact O-CB 3.41Å; N725-N729 VanDerWaalsContact O-CG 3.32Å; N725-N729 PolarHBondContact O-N 2.99Å; N725-N729 PolarHBondContact O-ND2 3.2Å; E726-N729 PolarHBondContact O-N 3.13Å; V727-N729 PolarHBondContact O-N 3.17Å; N729-G732 PolarHBondContact O-N 2.73Å; N729-K733 PolarHBondContact O-N 3.36Å
730	A	94.9	Very high	91.4	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-44.1	175.8	0	0	0	0	0	111.6	C686 I689 M690 E726 V727 G732 K733 I734	C686-A730 HydrophobicContact CB-CB 3.67Å; I689-A730 HydrophobicContact CB-CB 4.25Å; I689-A730 HydrophobicContact CG2-CB 3.97Å; M690-A730 HydrophobicContact CG-CB 3.99Å; M690-A730 HydrophobicContact SD-CB 4.43Å; E726-A730 VanDerWaalsContact O-CB 3.26Å; E726-A730 WeakPolarHBondContact O-CB 3.32Å; E726-A730 PolarHBondContact O-N 3.23Å; V727-A730 PolarHBondContact O-N 3.14Å; A730-G732 VanDerWaalsContact C-N 3.34Å; A730-G732 PolarHBondContact O-N 3.02Å; A730-K733 WeakPolarHBondContact O-CB 3.43Å; A730-K733 PolarHBondContact O-N 3.22Å; A730-I734 WeakPolarHBondContact O-CG1 3.37Å; A730-I734 PolarHBondContact O-N 3.07Å
731	V	94.8	Very high	91.7	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-39.3	174.2	171.9	0	0	0	0	111	V727 I728 K733 I734 I735 L757 F765 L768	V727-V731 HydrophobicContact CG1-CG2 4.42Å; V727-V731 WeakPolarHBondContact O-CB 3.45Å; V727-V731 VanDerWaalsContact O-CG2 3.31Å; V727-V731 WeakPolarHBondContact O-CG2 3.27Å; V727-V731 PolarHBondContact O-N 3.42Å; I728-V731 PolarHBondContact O-N 3.39Å; V731-K733 PolarHBondContact O-N 3.43Å; V731-I734 PolarHBondContact O-N 2.7Å; V731-I735 HydrophobicContact CG1-CD1 3.84Å; V731-I735 HydrophobicContact CG1-CG1 4.43Å; V731-I735 WeakPolarHBondContact O-CD1 3.44Å; V731-I735 VanDerWaalsContact O-CG1 3.27Å; V731-I735 WeakPolarHBondContact O-CG1 3.4Å; V731-I735 PolarHBondContact O-N 3.22Å; V731-L757 HydrophobicContact CG1-CD1 4.01Å; V731-L757 HydrophobicContact CG2-CD1 3.78Å; V731-F765 HydrophobicContact CG1-CE2 4.15Å; V731-L768 HydrophobicContact CB-CD1 4.48Å; V731-L768 HydrophobicContact CB-CD2 3.98Å; V731-L768 HydrophobicContact CG1-CD2 3.62Å; V731-L768 HydrophobicContact CG2-CD1 4.28Å
732	G	95	Very high	92.1	Very high	8 Å²	8	49.8 Å²	49.8	8%	0.082	28%	0.277	C	S	.	.	H	α-helix	trans	-58.4	-43.2	171	0	0	0	0	0	113.4	I728 N729 A730 I735 S736	I728-G732 PolarHBondContact O-N 3.23Å; N729-G732 PolarHBondContact O-N 2.73Å; A730-G732 VanDerWaalsContact C-N 3.34Å; A730-G732 PolarHBondContact O-N 3.02Å; G732-I735 PolarHBondContact O-N 2.87Å; G732-S736 PolarHBondContact O-N 3.09Å
733	K	94.5	Very high	92.6	Very high	64 Å²	64	43.2 Å²	43.2	28%	0.278	24%	0.243	S	C	.	.	H	α-helix	trans	-64.9	-41.3	175.9	-159.6	161.7	174.7	-176.1	0	111.1	I689 M690 N729 A730 V731 S736 W737	I689-K733 HydrophobicContact CG2-CB 3.87Å; I689-K733 HydrophobicContact CG2-CD 3.85Å; I689-K733 HydrophobicContact CG2-CG 4.04Å; I689-K733 VanDerWaalsContact O-CD 3.31Å; I689-K733 WeakPolarHBondContact O-CD 3.29Å; I689-K733 WeakPolarHBondContact O-CE 3.24Å; I689-K733 PolarHBondContact O-NZ 2.7Å; M690-K733 HydrophobicContact SD-CD 4.21Å; N729-K733 PolarHBondContact O-N 3.36Å; A730-K733 WeakPolarHBondContact O-CB 3.43Å; A730-K733 PolarHBondContact O-N 3.22Å; V731-K733 PolarHBondContact O-N 3.43Å; K733-S736 PolarHBondContact O-N 3.19Å; K733-S736 PolarHBondContact O-OG 2.81Å; K733-W737 HydrophobicContact CG-CZ2 4.23Å; K733-W737 PolarHBondContact O-N 2.98Å; K733-W737 VanDerWaalsContact O-N 3.12Å
734	I	95.8	Very high	93	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.1	-46	171.6	-64.8	163.6	0	0	0	111.4	I689 L705 M708 A730 V731 S736 W737 S738 A750 V753 V754	I689-I734 HydrophobicContact CD1-CD1 3.69Å; I689-I734 HydrophobicContact CD1-CG1 3.75Å; L705-I734 HydrophobicContact CD2-CG1 4.21Å; L705-I734 HydrophobicContact CD2-CG2 3.95Å; M708-I734 HydrophobicContact CE-CD1 3.87Å; M708-I734 HydrophobicContact SD-CD1 4.01Å; A730-I734 WeakPolarHBondContact O-CG1 3.37Å; A730-I734 PolarHBondContact O-N 3.07Å; V731-I734 PolarHBondContact O-N 2.7Å; I734-S736 VanDerWaalsContact C-N 3.28Å; I734-S736 PolarHBondContact O-N 3.03Å; I734-W737 WeakPolarHBondContact O-CB 3.23Å; I734-W737 PolarHBondContact O-N 2.96Å; I734-S738 PolarHBondContact O-N 2.98Å; I734-A750 HydrophobicContact CG2-CB 4.38Å; I734-V753 HydrophobicContact CD1-CG1 4.18Å; I734-V753 HydrophobicContact CG2-CB 4.15Å; I734-V753 HydrophobicContact CG2-CG1 3.98Å; I734-V754 HydrophobicContact CG2-CG2 4.2Å
735	I	96.3	Very high	93.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.9	-40.8	177.9	-67.7	157.9	0	0	0	110.4	V731 G732 W737 S738 V754 L769 L772 V776 R779 A780	V731-I735 HydrophobicContact CG1-CD1 3.84Å; V731-I735 HydrophobicContact CG1-CG1 4.43Å; V731-I735 WeakPolarHBondContact O-CD1 3.44Å; V731-I735 VanDerWaalsContact O-CG1 3.27Å; V731-I735 WeakPolarHBondContact O-CG1 3.4Å; V731-I735 PolarHBondContact O-N 3.22Å; G732-I735 PolarHBondContact O-N 2.87Å; I735-W737 VanDerWaalsContact C-N 3.3Å; I735-W737 PolarHBondContact O-N 3.27Å; I735-S738 VanDerWaalsContact O-CB 3.29Å; I735-S738 WeakPolarHBondContact O-CB 3.43Å; I735-S738 PolarHBondContact O-N 2.95Å; I735-S738 PolarHBondContact O-OG 3.38Å; I735-V754 HydrophobicContact CB-CG2 4.48Å; I735-V754 HydrophobicContact CG1-CG2 3.66Å; I735-L769 HydrophobicContact CD1-CD2 3.69Å; I735-L772 HydrophobicContact CD1-CD1 4.01Å; I735-V776 HydrophobicContact CB-CG1 3.81Å; I735-V776 HydrophobicContact CD1-CG1 4.04Å; I735-V776 HydrophobicContact CG2-CG1 3.65Å; I735-V776 WeakPolarHBondContact CG2-O 3.12Å; I735-R779 HydrophobicContact CG2-CB 4.01Å; I735-R779 HydrophobicContact CG2-CG 4.1Å; I735-A780 HydrophobicContact CD1-CB 4.07Å; I735-A780 HydrophobicContact CG1-CB 4.34Å; I735-A780 HydrophobicContact CG2-CB 4.08Å
736	S	93.9	Very high	93.5	Very high	60 Å²	60	39.8 Å²	39.8	42%	0.42	23%	0.226	S	C	.	.	H	α-helix	trans	-61.2	-36.3	173.8	83.8	0	0	0	0	112.9	G732 K733 I734 S738 A739	G732-S736 PolarHBondContact O-N 3.09Å; K733-S736 PolarHBondContact O-N 3.19Å; K733-S736 PolarHBondContact O-OG 2.81Å; I734-S736 VanDerWaalsContact C-N 3.28Å; I734-S736 PolarHBondContact O-N 3.03Å; S736-S738 PolarHBondContact O-N 2.74Å; S736-A739 WeakPolarHBondContact O-CB 3.28Å; S736-A739 PolarHBondContact O-N 3.4Å
737	W	94.8	Very high	93.8	Very high	17 Å²	17	40.5 Å²	40.5	6%	0.064	23%	0.225	C	C	.	.	H	α-helix	trans	-68.6	-17.1	178.9	-67.2	-6.3	0	0	0	113.1	I689 P696 K701 L704 L705 K733 I734 I735 A739 E740 V746 A750	I689-W737 HydrophobicContact CD1-CZ3 4.46Å; I689-W737 HydrophobicContact CG1-CH2 4.12Å; I689-W737 HydrophobicContact CG1-CZ3 4.33Å; I689-W737 HydrophobicContact CG2-CH2 4.35Å; P696-W737 HydrophobicContact CG-CH2 4.28Å; K701-W737 HydrophobicContact CB-CZ3 4.46Å; K701-W737 HydrophobicContact CD-CD2 4.01Å; K701-W737 HydrophobicContact CD-CE3 4.22Å; K701-W737 HydrophobicContact CD-CH2 4.25Å; K701-W737 HydrophobicContact CD-CZ2 4.06Å; K701-W737 HydrophobicContact CD-CZ3 4.33Å; K701-W737 HydrophobicContact CG-CE3 4.45Å; K701-W737 HydrophobicContact CG-CH2 4.03Å; K701-W737 HydrophobicContact CG-CZ2 4.28Å; K701-W737 HydrophobicContact CG-CZ3 4.13Å; L704-W737 HydrophobicContact CD2-CZ3 4.49Å; L705-W737 HydrophobicContact CD1-CE3 4.02Å; L705-W737 HydrophobicContact CD2-CE3 4.15Å; L705-W737 HydrophobicContact CD2-CZ3 4.39Å; L705-W737 HydrophobicContact CG-CE3 4.3Å; L705-W737 HydrophobicContact CG-CZ3 4.44Å; K733-W737 HydrophobicContact CG-CZ2 4.23Å; K733-W737 PolarHBondContact O-N 2.98Å; K733-W737 VanDerWaalsContact O-N 3.12Å; I734-W737 WeakPolarHBondContact O-CB 3.23Å; I734-W737 PolarHBondContact O-N 2.96Å; I735-W737 VanDerWaalsContact C-N 3.3Å; I735-W737 PolarHBondContact O-N 3.27Å; W737-A739 PolarHBondContact O-N 3.46Å; W737-A739 VanDerWaalsContact O-N 3.14Å; W737-E740 VanDerWaalsContact O-CB 3.23Å; W737-E740 WeakPolarHBondContact O-CB 3.43Å; W737-E740 PolarHBondContact O-N 2.7Å; W737-E740 VanDerWaalsContact O-N 3.09Å; W737-V746 HydrophobicContact CB-CG1 3.94Å; W737-V746 HydrophobicContact CG-CG1 4.4Å; W737-A750 HydrophobicContact CB-CB 3.91Å
738	S	95.1	Very high	93.9	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.007	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-17.4	167.2	77.7	0	0	0	0	113.1	I734 I735 S736 R747 R779	I734-S738 PolarHBondContact O-N 2.98Å; I735-S738 VanDerWaalsContact O-CB 3.29Å; I735-S738 WeakPolarHBondContact O-CB 3.43Å; I735-S738 PolarHBondContact O-N 2.95Å; I735-S738 PolarHBondContact O-OG 3.38Å; S736-S738 PolarHBondContact O-N 2.74Å; S738-R747 WeakPolarHBondContact O-CG 3.42Å; S738-R779 PolarHBondContact O-NH2 3.12Å; S738-R779 WeakPolarHBondContact OG-CG 3.32Å; S738-R779 PolarHBondContact OG-NE 3.26Å
739	A	92.8	Very high	94	Very high	48 Å²	48	47.9 Å²	47.9	40%	0.397	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	3.1	176	0	0	0	0	0	113.9	S736 W737 P741	S736-A739 WeakPolarHBondContact O-CB 3.28Å; S736-A739 PolarHBondContact O-N 3.4Å; W737-A739 PolarHBondContact O-N 3.46Å; W737-A739 VanDerWaalsContact O-N 3.14Å; A739-P741 VanDerWaalsContact O-CD 3.26Å; A739-P741 WeakPolarHBondContact O-CD 3.41Å
740	E	91.8	Very high	94.2	Very high	24 Å²	24	44 Å²	44	11%	0.112	23%	0.231	C	C	.	.			trans	-48.1	108.1	-178.5	172.2	64.4	-97.1	0	0	111.6	F698 K701 W737 K742 V746 R747	F698-E740 HydrophobicContact CD1-CG 4.35Å; F698-E740 HydrophobicContact CE1-CG 4.29Å; F698-E740 WeakPolarHBondContact CE1-OE2 3.19Å; K701-E740 IonicContact NZ-OE2 3.59Å; K701-E740 PolarHBondContact NZ-OE2 3.22Å; W737-E740 VanDerWaalsContact O-CB 3.23Å; W737-E740 WeakPolarHBondContact O-CB 3.43Å; W737-E740 PolarHBondContact O-N 2.7Å; W737-E740 VanDerWaalsContact O-N 3.09Å; E740-K742 VanDerWaalsContact C-N 3.3Å; E740-K742 PolarHBondContact O-N 3.12Å; E740-K742 PolarHBondContact OE1-N 3.41Å; E740-V746 HydrophobicContact CB-CB 4.38Å; E740-V746 HydrophobicContact CB-CG1 3.9Å; E740-V746 HydrophobicContact CG-CB 4.09Å; E740-V746 HydrophobicContact CG-CG1 3.87Å; E740-R747 HydrophobicContact CB-CG 4.1Å; E740-R747 WeakPolarHBondContact O-CD 3.37Å; E740-R747 WeakPolarHBondContact O-CG 3.41Å; E740-R747 PolarHBondContact O-NH1 3.5Å
741	P	86.9	Confident	94.3	Very high	106 Å²	106	45.2 Å²	45.2	69%	0.688	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-32.6	-173.1	23.8	-32.6	0	0	0	112.2	A739 R747	A739-P741 VanDerWaalsContact O-CD 3.26Å; A739-P741 WeakPolarHBondContact O-CD 3.41Å; P741-R747 PolarHBondContact O-NH1 3.11Å
742	K	89.3	Confident	94.3	Very high	165 Å²	165	50.3 Å²	50.3	72%	0.717	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-13.6	-168	-67.4	172.6	178.6	177.4	0	115.2	F698 E740	F698-K742 HydrophobicContact CE1-CB 3.92Å; F698-K742 HydrophobicContact CE1-CD 4.37Å; F698-K742 HydrophobicContact CE2-CB 3.94Å; F698-K742 HydrophobicContact CE2-CD 4.2Å; F698-K742 HydrophobicContact CZ-CB 3.54Å; F698-K742 HydrophobicContact CZ-CD 3.54Å; F698-K742 HydrophobicContact CZ-CG 4.18Å; E740-K742 VanDerWaalsContact C-N 3.3Å; E740-K742 PolarHBondContact O-N 3.12Å; E740-K742 PolarHBondContact OE1-N 3.41Å
743	S	93.2	Very high	94.4	Very high	15 Å²	15	49.9 Å²	49.9	11%	0.105	26%	0.255	C	S	.	.			trans	-143.6	125.1	179.1	174.1	0	0	0	0	112.3	D745 V746 R747	S743-D745 PolarHBondContact OG-N 3.11Å; S743-V746 WeakPolarHBondContact OG-CG2 3.35Å; S743-V746 PolarHBondContact OG-N 3.15Å; S743-R747 WeakPolarHBondContact O-CG 3.36Å; S743-R747 PolarHBondContact O-N 3.41Å; S743-R747 PolarHBondContact O-NH1 2.95Å
744	A	93.6	Very high	94.4	Very high	56 Å²	56	46.9 Å²	46.9	46%	0.463	24%	0.242	S	C	.	.	H	α-helix	trans	-70	-35.4	174.7	0	0	0	0	0	112.4	R747 R748	A744-R747 PolarHBondContact O-N 2.87Å; A744-R748 WeakPolarHBondContact O-CB 3.43Å; A744-R748 PolarHBondContact O-N 3.49Å
745	D	94.5	Very high	94.4	Very high	95 Å²	95	48.1 Å²	48.1	51%	0.508	25%	0.249	S	C	.	.	H	α-helix	trans	-69.2	-41.2	-179	-52.7	-68.3	0	0	0	111.8	T702 S743 R747 R748 M749	T702-D745 HydrophobicContact CG2-CB 4.19Å; S743-D745 PolarHBondContact OG-N 3.11Å; D745-R747 PolarHBondContact O-N 3.32Å; D745-R748 PolarHBondContact O-N 2.8Å; D745-M749 WeakPolarHBondContact O-CB 3.4Å; D745-M749 PolarHBondContact O-N 3.2Å
746	V	96	Very high	94.3	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-46.4	172.8	174.8	0	0	0	0	110.5	F698 K701 T702 L705 W737 E740 S743 R748 M749 A750	F698-V746 HydrophobicContact CB-CG2 4.17Å; F698-V746 HydrophobicContact CD1-CG2 4.47Å; F698-V746 WeakPolarHBondContact O-CG2 3.22Å; K701-V746 HydrophobicContact CB-CG1 4.37Å; K701-V746 HydrophobicContact CB-CG2 3.8Å; K701-V746 HydrophobicContact CD-CG1 4Å; K701-V746 HydrophobicContact CD-CG2 4.26Å; T702-V746 WeakPolarHBondContact OG1-CG2 3.18Å; L705-V746 HydrophobicContact CD1-CG1 4.2Å; W737-V746 HydrophobicContact CB-CG1 3.94Å; W737-V746 HydrophobicContact CG-CG1 4.4Å; E740-V746 HydrophobicContact CB-CB 4.38Å; E740-V746 HydrophobicContact CB-CG1 3.9Å; E740-V746 HydrophobicContact CG-CB 4.09Å; E740-V746 HydrophobicContact CG-CG1 3.87Å; S743-V746 WeakPolarHBondContact OG-CG2 3.35Å; S743-V746 PolarHBondContact OG-N 3.15Å; V746-R748 PolarHBondContact O-N 2.63Å; V746-M749 PolarHBondContact O-N 3.4Å; V746-A750 WeakPolarHBondContact O-CB 3.41Å; V746-A750 PolarHBondContact O-N 3.36Å
747	R	95.9	Very high	94.3	Very high	88 Å²	88	48.2 Å²	48.2	33%	0.332	24%	0.242	S	C	.	.	H	α-helix	trans	-58.3	-46.1	174.6	-67.3	-170.2	-60.8	-96.4	10.5	112	S738 E740 P741 S743 A744 D745 S751	S738-R747 WeakPolarHBondContact O-CG 3.42Å; E740-R747 HydrophobicContact CB-CG 4.1Å; E740-R747 WeakPolarHBondContact O-CD 3.37Å; E740-R747 WeakPolarHBondContact O-CG 3.41Å; E740-R747 PolarHBondContact O-NH1 3.5Å; P741-R747 PolarHBondContact O-NH1 3.11Å; S743-R747 WeakPolarHBondContact O-CG 3.36Å; S743-R747 PolarHBondContact O-N 3.41Å; S743-R747 PolarHBondContact O-NH1 2.95Å; A744-R747 PolarHBondContact O-N 2.87Å; D745-R747 PolarHBondContact O-N 3.32Å; R747-S751 WeakPolarHBondContact O-CB 3.46Å; R747-S751 PolarHBondContact O-N 2.68Å; R747-S751 VanDerWaalsContact O-N 3.1Å; R747-S751 PolarHBondContact O-OG 2.98Å; R747-S751 VanDerWaalsContact O-OG 3.1Å
748	R	95.8	Very high	94.2	Very high	160 Å²	160	49.7 Å²	49.7	60%	0.604	25%	0.249	S	C	*	.	H	α-helix	trans	-64.6	-43	-177.8	-171	-177.3	-172	-166.9	4.1	111.9	A744 D745 V746 R752	A744-R748 WeakPolarHBondContact O-CB 3.43Å; A744-R748 PolarHBondContact O-N 3.49Å; D745-R748 PolarHBondContact O-N 2.8Å; V746-R748 PolarHBondContact O-N 2.63Å; R748-R752 WeakPolarHBondContact O-CG 3.41Å; R748-R752 PolarHBondContact O-N 2.96Å
749	M	96.6	Very high	94.1	Very high	16 Å²	16	52.9 Å²	52.9	8%	0.079	27%	0.266	C	S	.	.	H	α-helix	trans	-79.7	-35.4	-178.2	-152.2	67	78	0	0	112.1	L705 E706 K709 D745 V746 S751 R752 V753	L705-M749 HydrophobicContact CB-CB 3.8Å; L705-M749 HydrophobicContact CB-CG 3.53Å; L705-M749 HydrophobicContact CD1-CB 4.27Å; E706-M749 HydrophobicContact CB-CE 4.03Å; E706-M749 HydrophobicContact CB-CG 4.4Å; E706-M749 HydrophobicContact CB-SD 4.39Å; E706-M749 HydrophobicContact CG-CE 4.36Å; E706-M749 WeakPolarHBondContact OE1-CE 3.48Å; K709-M749 HydrophobicContact CD-SD 4.1Å; D745-M749 WeakPolarHBondContact O-CB 3.4Å; D745-M749 PolarHBondContact O-N 3.2Å; V746-M749 PolarHBondContact O-N 3.4Å; M749-S751 PolarHBondContact O-N 2.89Å; M749-R752 WeakPolarHBondContact O-CB 3.25Å; M749-R752 PolarHBondContact O-N 3.05Å; M749-R752 VanDerWaalsContact O-N 3.13Å; M749-R752 HydrophobicContact SD-CB 4.47Å; M749-V753 WeakPolarHBondContact O-CG2 3.33Å; M749-V753 PolarHBondContact O-N 3.35Å
750	A	97.1	Very high	93.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.1	-46	173.3	0	0	0	0	0	111.4	L705 I734 W737 V746 R752 V753 V754	L705-A750 HydrophobicContact CD1-CB 4Å; L705-A750 HydrophobicContact CD2-CB 4.47Å; I734-A750 HydrophobicContact CG2-CB 4.38Å; W737-A750 HydrophobicContact CB-CB 3.91Å; V746-A750 WeakPolarHBondContact O-CB 3.41Å; V746-A750 PolarHBondContact O-N 3.36Å; A750-R752 VanDerWaalsContact C-N 3.29Å; A750-R752 PolarHBondContact O-N 3Å; A750-V753 PolarHBondContact O-N 3.47Å; A750-V754 WeakPolarHBondContact O-CG2 3.49Å; A750-V754 PolarHBondContact O-N 2.95Å
751	S	96	Very high	93.9	Very high	27 Å²	27	52.9 Å²	52.9	19%	0.189	26%	0.259	C	S	.	.	H	α-helix	trans	-59.2	-37.8	172.9	-66.5	0	0	0	0	112.6	R747 M749 V754 I755	R747-S751 WeakPolarHBondContact O-CB 3.46Å; R747-S751 PolarHBondContact O-N 2.68Å; R747-S751 VanDerWaalsContact O-N 3.1Å; R747-S751 PolarHBondContact O-OG 2.98Å; R747-S751 VanDerWaalsContact O-OG 3.1Å; M749-S751 PolarHBondContact O-N 2.89Å; S751-V754 PolarHBondContact O-N 3.21Å; S751-I755 WeakPolarHBondContact O-CB 3.4Å; S751-I755 VanDerWaalsContact O-CD1 3.31Å; S751-I755 WeakPolarHBondContact O-CD1 3.47Å; S751-I755 WeakPolarHBondContact O-CG1 3.49Å; S751-I755 PolarHBondContact O-N 3.46Å
752	R	95.8	Very high	94	Very high	106 Å²	106	50.4 Å²	50.4	40%	0.4	24%	0.244	S	C	.	.	H	α-helix	trans	-65	-41	174.3	-79.1	173.9	161.5	-171.9	-7.5	112.9	K709 R748 M749 A750 I755 K756	K709-R752 HydrophobicContact CG-CB 4.43Å; R748-R752 WeakPolarHBondContact O-CG 3.41Å; R748-R752 PolarHBondContact O-N 2.96Å; M749-R752 WeakPolarHBondContact O-CB 3.25Å; M749-R752 PolarHBondContact O-N 3.05Å; M749-R752 VanDerWaalsContact O-N 3.13Å; M749-R752 HydrophobicContact SD-CB 4.47Å; A750-R752 VanDerWaalsContact C-N 3.29Å; A750-R752 PolarHBondContact O-N 3Å; R752-I755 PolarHBondContact O-N 2.87Å; R752-K756 WeakPolarHBondContact O-CG 3.06Å; R752-K756 PolarHBondContact O-N 3.22Å
753	V	96.6	Very high	94	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.8	-44.5	175.8	174.1	0	0	0	0	110.9	L705 M708 K709 I712 I734 M749 A750 I755 K756 L757	L705-V753 HydrophobicContact CB-CG2 4.15Å; L705-V753 HydrophobicContact CD2-CB 4.38Å; L705-V753 HydrophobicContact CD2-CG2 3.94Å; L705-V753 WeakPolarHBondContact O-CG2 3.38Å; M708-V753 HydrophobicContact CB-CG2 4.23Å; K709-V753 HydrophobicContact CB-CG2 3.98Å; I712-V753 HydrophobicContact CD1-CG1 3.84Å; I734-V753 HydrophobicContact CD1-CG1 4.18Å; I734-V753 HydrophobicContact CG2-CB 4.15Å; I734-V753 HydrophobicContact CG2-CG1 3.98Å; M749-V753 WeakPolarHBondContact O-CG2 3.33Å; M749-V753 PolarHBondContact O-N 3.35Å; A750-V753 PolarHBondContact O-N 3.47Å; V753-I755 VanDerWaalsContact C-N 3.34Å; V753-I755 PolarHBondContact O-N 3Å; V753-K756 PolarHBondContact O-N 3.44Å; V753-K756 VanDerWaalsContact O-N 3.12Å; V753-L757 HydrophobicContact CG1-CD1 4.29Å; V753-L757 WeakPolarHBondContact O-CG 3.35Å; V753-L757 PolarHBondContact O-N 3.09Å
754	V	95.7	Very high	93.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-57.6	-45.7	174.3	170	0	0	0	0	111.5	I734 I735 A750 S751 K756 L757 F758 F765 V783	I734-V754 HydrophobicContact CG2-CG2 4.2Å; I735-V754 HydrophobicContact CB-CG2 4.48Å; I735-V754 HydrophobicContact CG1-CG2 3.66Å; A750-V754 WeakPolarHBondContact O-CG2 3.49Å; A750-V754 PolarHBondContact O-N 2.95Å; S751-V754 PolarHBondContact O-N 3.21Å; V754-K756 VanDerWaalsContact C-N 3.34Å; V754-K756 PolarHBondContact O-N 3.34Å; V754-L757 PolarHBondContact O-N 3.44Å; V754-F758 PolarHBondContact O-N 3.39Å; V754-F758 VanDerWaalsContact O-N 3.14Å; V754-F765 HydrophobicContact CG1-CZ 4.07Å; V754-V783 HydrophobicContact CB-CG1 4.22Å; V754-V783 HydrophobicContact CG1-CB 4.36Å; V754-V783 HydrophobicContact CG1-CG1 3.92Å
755	I	94.8	Very high	93.8	Very high	27 Å²	27	44.1 Å²	44.1	14%	0.138	21%	0.214	C	C	.	.	H	α-helix	trans	-60.2	-42.5	175.1	-71.5	161.3	0	0	0	111.2	S751 R752 V753 F758 D759 V783 Y787	S751-I755 WeakPolarHBondContact O-CB 3.4Å; S751-I755 VanDerWaalsContact O-CD1 3.31Å; S751-I755 WeakPolarHBondContact O-CD1 3.47Å; S751-I755 WeakPolarHBondContact O-CG1 3.49Å; S751-I755 PolarHBondContact O-N 3.46Å; R752-I755 PolarHBondContact O-N 2.87Å; V753-I755 VanDerWaalsContact C-N 3.34Å; V753-I755 PolarHBondContact O-N 3Å; I755-F758 PolarHBondContact O-N 3.15Å; I755-D759 WeakPolarHBondContact O-CB 3.21Å; I755-D759 VanDerWaalsContact O-CG 3.31Å; I755-D759 PolarHBondContact O-N 3.16Å; I755-V783 HydrophobicContact CD1-CG1 4.48Å; I755-V783 HydrophobicContact CG1-CG1 4.23Å; I755-Y787 HydrophobicContact CB-CD1 4.46Å; I755-Y787 HydrophobicContact CD1-CD1 4.48Å; I755-Y787 HydrophobicContact CD1-CD2 3.9Å; I755-Y787 HydrophobicContact CD1-CG 3.8Å; I755-Y787 HydrophobicContact CG1-CD1 3.97Å; I755-Y787 HydrophobicContact CG1-CD2 4.26Å; I755-Y787 HydrophobicContact CG1-CG 3.79Å; I755-Y787 HydrophobicContact CG2-CD1 3.82Å; I755-Y787 HydrophobicContact CG2-CD2 4.02Å; I755-Y787 HydrophobicContact CG2-CE1 3.51Å; I755-Y787 HydrophobicContact CG2-CE2 3.73Å; I755-Y787 HydrophobicContact CG2-CG 4.04Å; I755-Y787 VanDerWaalsContact CG2-CZ 3.43Å
756	K	94.5	Very high	93.7	Very high	61 Å²	61	42 Å²	42	27%	0.265	21%	0.207	S	C	.	.	H	α-helix	trans	-73.6	-28.3	-179.7	-68.4	-48.2	-176.5	-174.9	0	114.7	I712 L713 R752 V753 V754 F758 D759 L760	I712-K756 HydrophobicContact CB-CB 4.34Å; I712-K756 HydrophobicContact CG2-CB 3.8Å; I712-K756 VanDerWaalsContact CG2-O 3.31Å; I712-K756 WeakPolarHBondContact CG2-O 3.18Å; L713-K756 HydrophobicContact CD2-CD 3.99Å; R752-K756 WeakPolarHBondContact O-CG 3.06Å; R752-K756 PolarHBondContact O-N 3.22Å; V753-K756 PolarHBondContact O-N 3.44Å; V753-K756 VanDerWaalsContact O-N 3.12Å; V754-K756 VanDerWaalsContact C-N 3.34Å; V754-K756 PolarHBondContact O-N 3.34Å; K756-F758 VanDerWaalsContact C-N 3.35Å; K756-D759 HydrophobicContact CD-CB 4.25Å; K756-D759 VanDerWaalsContact CD-OD2 3.27Å; K756-D759 WeakPolarHBondContact CD-OD2 3.35Å; K756-D759 WeakPolarHBondContact CE-OD2 3.49Å; K756-D759 IonicContact NZ-OD2 3.38Å; K756-D759 PolarHBondContact NZ-OD2 3.34Å; K756-L760 VanDerWaalsContact O-CB 3.27Å; K756-L760 WeakPolarHBondContact O-CB 3.36Å; K756-L760 PolarHBondContact O-N 3.42Å
757	L	93.6	Very high	93.4	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-67.1	-36.7	168.3	-67.1	171.7	0	0	0	111.9	F682 I712 I720 V731 V753 V754 N761 F765	F682-L757 HydrophobicContact CE2-CD2 4.15Å; F682-L757 HydrophobicContact CZ-CD2 4.15Å; I712-L757 HydrophobicContact CD1-CD2 3.67Å; I712-L757 HydrophobicContact CD1-CG 3.91Å; I712-L757 HydrophobicContact CG1-CD2 4.1Å; I720-L757 WeakPolarHBondContact CD1-O 3.16Å; I720-L757 HydrophobicContact CG2-CD2 4.45Å; V731-L757 HydrophobicContact CG1-CD1 4.01Å; V731-L757 HydrophobicContact CG2-CD1 3.78Å; V753-L757 HydrophobicContact CG1-CD1 4.29Å; V753-L757 WeakPolarHBondContact O-CG 3.35Å; V753-L757 PolarHBondContact O-N 3.09Å; V754-L757 PolarHBondContact O-N 3.44Å; L757-N761 PolarHBondContact O-N 2.89Å; L757-F765 HydrophobicContact CB-CD2 3.62Å; L757-F765 HydrophobicContact CB-CE2 3.73Å; L757-F765 HydrophobicContact CD1-CE2 4.23Å
758	F	93.4	Very high	93.2	Very high	48 Å²	48	42.2 Å²	42.2	21%	0.211	21%	0.214	C	C	.	.	H	α-helix	trans	-71.5	-44.3	174.6	176.1	-93.4	0	0	0	112.9	V754 I755 K756 L760 S762 F765 L784	V754-F758 PolarHBondContact O-N 3.39Å; V754-F758 VanDerWaalsContact O-N 3.14Å; I755-F758 PolarHBondContact O-N 3.15Å; K756-F758 VanDerWaalsContact C-N 3.35Å; F758-L760 PolarHBondContact O-N 3.45Å; F758-S762 WeakPolarHBondContact O-CA 3.45Å; F758-S762 PolarHBondContact O-N 3.13Å; F758-F765 HydrophobicContact CB-CD1 4.05Å; F758-F765 HydrophobicContact CB-CE1 4.36Å; F758-F765 HydrophobicContact CB-CG 4.41Å; F758-F765 HydrophobicContact CD2-CD1 4Å; F758-L784 HydrophobicContact CB-CD1 4.31Å; F758-L784 HydrophobicContact CB-CD2 3.65Å; F758-L784 HydrophobicContact CD1-CD2 3.92Å; F758-L784 HydrophobicContact CD2-CD1 3.57Å; F758-L784 HydrophobicContact CD2-CD2 4.15Å; F758-L784 HydrophobicContact CE2-CD1 4.04Å; F758-L784 HydrophobicContact CG-CD1 3.95Å; F758-L784 HydrophobicContact CG-CD2 3.63Å; F758-L784 HydrophobicContact CG-CG 4.46Å
759	D	91.8	Very high	93.1	Very high	68 Å²	68	34.9 Å²	34.9	36%	0.364	19%	0.187	S	C	.	.	H	α-helix	trans	-61.4	-31.3	175.4	-72.2	-14.9	0	0	0	111.7	I755 K756 Y787	I755-D759 WeakPolarHBondContact O-CB 3.21Å; I755-D759 VanDerWaalsContact O-CG 3.31Å; I755-D759 PolarHBondContact O-N 3.16Å; K756-D759 HydrophobicContact CD-CB 4.25Å; K756-D759 VanDerWaalsContact CD-OD2 3.27Å; K756-D759 WeakPolarHBondContact CD-OD2 3.35Å; K756-D759 WeakPolarHBondContact CE-OD2 3.49Å; K756-D759 IonicContact NZ-OD2 3.38Å; K756-D759 PolarHBondContact NZ-OD2 3.34Å; D759-Y787 WeakPolarHBondContact OD1-CE1 3.4Å; D759-Y787 PolarHBondContact OD1-OH 2.96Å; D759-Y787 PolarHBondContact OD2-OH 2.95Å; D759-Y787 VanDerWaalsContact OD2-OH 3.12Å
760	L	90.1	Very high	92.8	Very high	34 Å²	34	40.6 Å²	40.6	18%	0.178	21%	0.214	C	C	.	.	H	α-helix	trans	-68.7	-53.3	-179.9	176.8	65.6	0	0	0	112.4	I712 M715 P717 I720 K756 F758	I712-L760 HydrophobicContact CG2-CB 4.24Å; I712-L760 HydrophobicContact CG2-CD2 4.19Å; M715-L760 HydrophobicContact CB-CD2 4.49Å; M715-L760 WeakPolarHBondContact O-CD1 3.47Å; P717-L760 HydrophobicContact CB-CD1 4.35Å; P717-L760 WeakPolarHBondContact CB-O 3.35Å; I720-L760 HydrophobicContact CD1-CD2 4.48Å; I720-L760 HydrophobicContact CG1-CD2 4.45Å; K756-L760 VanDerWaalsContact O-CB 3.27Å; K756-L760 WeakPolarHBondContact O-CB 3.36Å; K756-L760 PolarHBondContact O-N 3.42Å; F758-L760 PolarHBondContact O-N 3.45Å
761	N	90.2	Very high	92.4	Very high	37 Å²	37	44.4 Å²	44.4	20%	0.198	24%	0.24	C	C	.	.			trans	-157.1	93.9	176.4	-174.9	-21.6	0	0	0	110.1	P717 I720 L757 T763 S764 F765	P717-N761 HydrophobicContact CB-CB 4.15Å; P717-N761 WeakPolarHBondContact O-CB 3.2Å; P717-N761 PolarHBondContact O-ND2 3.49Å; I720-N761 HydrophobicContact CD1-CB 4.05Å; I720-N761 HydrophobicContact CG1-CB 4.12Å; L757-N761 PolarHBondContact O-N 2.89Å; N761-T763 VanDerWaalsContact C-N 3.33Å; N761-T763 PolarHBondContact O-N 3.42Å; N761-T763 PolarHBondContact OD1-N 2.7Å; N761-S764 VanDerWaalsContact CG-CB 3.5Å; N761-S764 VanDerWaalsContact CG-OG 3.23Å; N761-S764 PolarHBondContact ND2-OG 3.25Å; N761-S764 PolarHBondContact O-N 3.03Å; N761-S764 PolarHBondContact OD1-N 2.75Å; N761-S764 VanDerWaalsContact OD1-N 3.1Å; N761-S764 PolarHBondContact OD1-OG 2.89Å; N761-F765 WeakPolarHBondContact O-CB 3.38Å; N761-F765 PolarHBondContact O-N 3.35Å
762	S	90.2	Very high	92.3	Very high	54 Å²	54	43.6 Å²	43.6	38%	0.378	23%	0.234	S	C	.	.	H	α-helix	trans	-61.8	-35.1	-174.8	57.6	0	0	0	0	113.7	F758 S766	F758-S762 WeakPolarHBondContact O-CA 3.45Å; F758-S762 PolarHBondContact O-N 3.13Å; S762-S766 VanDerWaalsContact O-CB 3.31Å; S762-S766 WeakPolarHBondContact O-CB 3.4Å; S762-S766 PolarHBondContact O-N 3.45Å; S762-S766 PolarHBondContact O-OG 3.06Å
763	T	89.3	Confident	92.1	Very high	93 Å²	93	42.8 Å²	42.8	57%	0.571	24%	0.242	S	C	*	.	H	α-helix	trans	-65.4	-52.6	176	-54.6	0	0	0	0	110.8	N761 F765 S766 N767	N761-T763 VanDerWaalsContact C-N 3.33Å; N761-T763 PolarHBondContact O-N 3.42Å; N761-T763 PolarHBondContact OD1-N 2.7Å; T763-F765 PolarHBondContact O-N 3.17Å; T763-S766 WeakPolarHBondContact O-CB 3.38Å; T763-S766 PolarHBondContact O-N 3.47Å; T763-S766 VanDerWaalsContact O-N 3.15Å; T763-N767 PolarHBondContact O-N 2.99Å
764	S	89.9	Confident	91.8	Very high	11 Å²	11	52.6 Å²	52.6	8%	0.077	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-37.7	-179.9	-63.5	0	0	0	0	112.3	I720 A721 N761 S766 N767 L768	I720-S764 WeakPolarHBondContact O-CB 3.2Å; A721-S764 WeakPolarHBondContact CA-OG 3.33Å; N761-S764 VanDerWaalsContact CG-CB 3.5Å; N761-S764 VanDerWaalsContact CG-OG 3.23Å; N761-S764 PolarHBondContact ND2-OG 3.25Å; N761-S764 PolarHBondContact O-N 3.03Å; N761-S764 PolarHBondContact OD1-N 2.75Å; N761-S764 VanDerWaalsContact OD1-N 3.1Å; N761-S764 PolarHBondContact OD1-OG 2.89Å; S764-S766 VanDerWaalsContact C-N 3.34Å; S764-S766 PolarHBondContact O-N 3.02Å; S764-N767 PolarHBondContact O-N 2.79Å; S764-L768 WeakPolarHBondContact O-CB 3.41Å; S764-L768 PolarHBondContact O-N 2.92Å
765	F	92.6	Very high	91.5	Very high	1 Å²	1	55.3 Å²	55.3	0%	0.004	31%	0.307	C	S	.	.	H	α-helix	trans	-62.9	-39.9	171.8	-174.2	-100.6	0	0	0	112.1	I720 V731 V754 L757 F758 N761 T763 N767 L768 L769 L784	I720-F765 HydrophobicContact CD1-CB 4.16Å; V731-F765 HydrophobicContact CG1-CE2 4.15Å; V754-F765 HydrophobicContact CG1-CZ 4.07Å; L757-F765 HydrophobicContact CB-CD2 3.62Å; L757-F765 HydrophobicContact CB-CE2 3.73Å; L757-F765 HydrophobicContact CD1-CE2 4.23Å; F758-F765 HydrophobicContact CB-CD1 4.05Å; F758-F765 HydrophobicContact CB-CE1 4.36Å; F758-F765 HydrophobicContact CB-CG 4.41Å; F758-F765 HydrophobicContact CD2-CD1 4Å; N761-F765 WeakPolarHBondContact O-CB 3.38Å; N761-F765 PolarHBondContact O-N 3.35Å; T763-F765 PolarHBondContact O-N 3.17Å; F765-N767 VanDerWaalsContact C-N 3.34Å; F765-N767 PolarHBondContact O-N 3.03Å; F765-L768 PolarHBondContact O-N 3.41Å; F765-L769 HydrophobicContact CD1-CD1 4.13Å; F765-L769 HydrophobicContact CD1-CG 4.23Å; F765-L769 HydrophobicContact CE1-CD1 3.66Å; F765-L769 HydrophobicContact CE1-CD2 4.14Å; F765-L769 HydrophobicContact CE1-CG 3.85Å; F765-L769 HydrophobicContact CZ-CD1 4.36Å; F765-L769 HydrophobicContact CZ-CD2 4.01Å; F765-L769 HydrophobicContact CZ-CG 4.18Å; F765-L769 WeakPolarHBondContact O-CG 3.35Å; F765-L769 PolarHBondContact O-N 2.8Å; F765-L784 HydrophobicContact CD1-CD1 4.47Å; F765-L784 HydrophobicContact CE1-CD1 3.98Å
766	S	91.4	Very high	91.5	Very high	51 Å²	51	55.6 Å²	55.6	36%	0.357	31%	0.31	S	S	.	.	H	α-helix	trans	-65.8	-35.5	176	-59.1	0	0	0	0	112.4	S762 T763 S764 Q770	S762-S766 VanDerWaalsContact O-CB 3.31Å; S762-S766 WeakPolarHBondContact O-CB 3.4Å; S762-S766 PolarHBondContact O-N 3.45Å; S762-S766 PolarHBondContact O-OG 3.06Å; T763-S766 WeakPolarHBondContact O-CB 3.38Å; T763-S766 PolarHBondContact O-N 3.47Å; T763-S766 VanDerWaalsContact O-N 3.15Å; S764-S766 VanDerWaalsContact C-N 3.34Å; S764-S766 PolarHBondContact O-N 3.02Å; S766-Q770 WeakPolarHBondContact O-CG 3.47Å; S766-Q770 PolarHBondContact O-N 2.95Å; S766-Q770 PolarHBondContact O-NE2 2.98Å
767	N	90.4	Very high	91.4	Very high	87 Å²	87	54.9 Å²	54.9	47%	0.465	31%	0.307	S	S	.	.	H	α-helix	trans	-67.8	-44.2	173.1	-66.4	-12.5	0	0	0	111.2	T763 S764 F765 L769 Q770	T763-N767 PolarHBondContact O-N 2.99Å; S764-N767 PolarHBondContact O-N 2.79Å; F765-N767 VanDerWaalsContact C-N 3.34Å; F765-N767 PolarHBondContact O-N 3.03Å; N767-L769 VanDerWaalsContact C-N 3.32Å; N767-L769 PolarHBondContact O-N 3.4Å; N767-Q770 WeakPolarHBondContact O-CB 3.5Å; N767-Q770 PolarHBondContact O-N 3.44Å; N767-Q770 VanDerWaalsContact O-N 3.12Å
768	L	91.6	Very high	91.4	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.021	33%	0.334	C	S	.	.	H	α-helix	trans	-58.1	-42.1	175	-174.3	160.1	0	0	0	111.7	P723 I728 V731 S764 F765 Q770 S771 L772	P723-L768 HydrophobicContact CB-CD1 4.08Å; P723-L768 HydrophobicContact CG-CB 4.49Å; P723-L768 HydrophobicContact CG-CD1 4.13Å; P723-L768 HydrophobicContact CG-CG 4.34Å; I728-L768 HydrophobicContact CG1-CG 4.28Å; V731-L768 HydrophobicContact CB-CD1 4.48Å; V731-L768 HydrophobicContact CB-CD2 3.98Å; V731-L768 HydrophobicContact CG1-CD2 3.62Å; V731-L768 HydrophobicContact CG2-CD1 4.28Å; S764-L768 WeakPolarHBondContact O-CB 3.41Å; S764-L768 PolarHBondContact O-N 2.92Å; F765-L768 PolarHBondContact O-N 3.41Å; L768-Q770 VanDerWaalsContact C-N 3.29Å; L768-Q770 PolarHBondContact O-N 3.07Å; L768-S771 PolarHBondContact O-N 3.21Å; L768-L772 HydrophobicContact CD2-CD1 3.94Å
769	L	92.6	Very high	91.4	Very high	6 Å²	6	60.6 Å²	60.6	3%	0.031	34%	0.335	C	S	.	.	H	α-helix	trans	-60.7	-35.6	176.2	-74	-174.1	0	0	0	112.9	I735 F765 N767 S771 L772 Q777 A780	I735-L769 HydrophobicContact CD1-CD2 3.69Å; F765-L769 HydrophobicContact CD1-CD1 4.13Å; F765-L769 HydrophobicContact CD1-CG 4.23Å; F765-L769 HydrophobicContact CE1-CD1 3.66Å; F765-L769 HydrophobicContact CE1-CD2 4.14Å; F765-L769 HydrophobicContact CE1-CG 3.85Å; F765-L769 HydrophobicContact CZ-CD1 4.36Å; F765-L769 HydrophobicContact CZ-CD2 4.01Å; F765-L769 HydrophobicContact CZ-CG 4.18Å; F765-L769 WeakPolarHBondContact O-CG 3.35Å; F765-L769 PolarHBondContact O-N 2.8Å; N767-L769 VanDerWaalsContact C-N 3.32Å; N767-L769 PolarHBondContact O-N 3.4Å; L769-S771 PolarHBondContact O-N 3.45Å; L769-L772 HydrophobicContact CD2-CD1 4.26Å; L769-L772 PolarHBondContact O-N 3.4Å; L769-Q777 VanDerWaalsContact O-CG 3.25Å; L769-Q777 WeakPolarHBondContact O-CG 3.42Å; L769-Q777 PolarHBondContact O-NE2 3.36Å; L769-A780 HydrophobicContact CD1-CB 3.89Å; L769-A780 HydrophobicContact CD2-CB 3.64Å; L769-A780 HydrophobicContact CG-CB 4.45Å
770	Q	91.3	Very high	91.5	Very high	136 Å²	136	57.3 Å²	57.3	64%	0.636	32%	0.318	S	S	*	.	H	α-helix	trans	-62.5	-27.2	179.8	-69.6	168.2	46.7	0	0	112.6	S766 N767 L768 L772	S766-Q770 WeakPolarHBondContact O-CG 3.47Å; S766-Q770 PolarHBondContact O-N 2.95Å; S766-Q770 PolarHBondContact O-NE2 2.98Å; N767-Q770 WeakPolarHBondContact O-CB 3.5Å; N767-Q770 PolarHBondContact O-N 3.44Å; N767-Q770 VanDerWaalsContact O-N 3.12Å; L768-Q770 VanDerWaalsContact C-N 3.29Å; L768-Q770 PolarHBondContact O-N 3.07Å; Q770-L772 VanDerWaalsContact C-N 3.31Å; Q770-L772 PolarHBondContact O-N 3.15Å
771	S	89.6	Confident	91.7	Very high	80 Å²	80	60.7 Å²	60.7	56%	0.559	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-10.3	174.8	-52.5	0	0	0	0	114.4	L768 L769	L768-S771 PolarHBondContact O-N 3.21Å; L769-S771 PolarHBondContact O-N 3.45Å
772	L	92.2	Very high	91.9	Very high	11 Å²	11	63.4 Å²	63.4	6%	0.058	34%	0.344	C	S	.	.	S	Bend	trans	-98.2	156.2	-176.6	-74	170.6	0	0	0	113.1	I728 I735 L768 L769 Q770 V776 Q777	I728-L772 HydrophobicContact CG2-CD2 3.87Å; I728-L772 HydrophobicContact CG2-CG 3.99Å; I735-L772 HydrophobicContact CD1-CD1 4.01Å; L768-L772 HydrophobicContact CD2-CD1 3.94Å; L769-L772 HydrophobicContact CD2-CD1 4.26Å; L769-L772 PolarHBondContact O-N 3.4Å; Q770-L772 VanDerWaalsContact C-N 3.31Å; Q770-L772 PolarHBondContact O-N 3.15Å; L772-V776 HydrophobicContact CB-CB 4.43Å; L772-V776 HydrophobicContact CB-CG1 4.45Å; L772-V776 HydrophobicContact CD1-CG1 4.13Å; L772-Q777 PolarHBondContact O-NE2 3.35Å
773	P	92.5	Very high	92.1	Very high	88 Å²	88	61.3 Å²	61.3	57%	0.571	33%	0.329	S	S	*	.			trans	-59.9	144.7	176.1	-23.4	34.1	0	0	0	112.9	G775 V776 Q777	P773-G775 PolarHBondContact O-N 3.47Å; P773-V776 HydrophobicContact CB-CG2 4.37Å; P773-V776 WeakPolarHBondContact O-CA 3.46Å; P773-V776 VanDerWaalsContact O-CB 3.31Å; P773-V776 WeakPolarHBondContact O-CB 3.31Å; P773-V776 PolarHBondContact O-N 3.37Å; P773-Q777 PolarHBondContact O-N 2.8Å; P773-Q777 VanDerWaalsContact O-N 3.14Å
774	R	90.1	Very high	92.3	Very high	207 Å²	207	57.4 Å²	57.4	78%	0.781	31%	0.305	S	S	*	.	H	α-helix	trans	-51.5	-45.8	-172.7	-63.9	-176.9	-171.2	-133.6	-1.6	114.1	V776 Q777 D778	R774-V776 PolarHBondContact O-N 3.29Å; R774-V776 VanDerWaalsContact O-N 3.13Å; R774-Q777 CarbonylContact O-C 3.53Å; R774-Q777 WeakPolarHBondContact O-CA 3.43Å; R774-Q777 VanDerWaalsContact O-CB 3.3Å; R774-Q777 WeakPolarHBondContact O-CB 3.41Å; R774-Q777 PolarHBondContact O-N 2.89Å; R774-D778 VanDerWaalsContact O-CG 3.26Å; R774-D778 PolarHBondContact O-N 3.1Å; R774-D778 VanDerWaalsContact O-OD2 3.12Å
775	G	90.3	Very high	92.3	Very high	56 Å²	56	63.2 Å²	63.2	58%	0.577	33%	0.329	S	S	*	.	H	α-helix	trans	-62.2	-22	177.7	0	0	0	0	0	114.9	P773 R779	P773-G775 PolarHBondContact O-N 3.47Å; G775-R779 PolarHBondContact O-N 2.78Å
776	V	93.3	Very high	92.1	Very high	33 Å²	33	67 Å²	67	20%	0.2	35%	0.352	C	S	.	.	H	α-helix	trans	-80.1	-41.8	170.6	-173.5	0	0	0	0	110.1	I735 L772 P773 R774 R779 A780	I735-V776 HydrophobicContact CB-CG1 3.81Å; I735-V776 HydrophobicContact CD1-CG1 4.04Å; I735-V776 HydrophobicContact CG2-CG1 3.65Å; I735-V776 WeakPolarHBondContact CG2-O 3.12Å; L772-V776 HydrophobicContact CB-CB 4.43Å; L772-V776 HydrophobicContact CB-CG1 4.45Å; L772-V776 HydrophobicContact CD1-CG1 4.13Å; P773-V776 HydrophobicContact CB-CG2 4.37Å; P773-V776 WeakPolarHBondContact O-CA 3.46Å; P773-V776 VanDerWaalsContact O-CB 3.31Å; P773-V776 WeakPolarHBondContact O-CB 3.31Å; P773-V776 PolarHBondContact O-N 3.37Å; R774-V776 PolarHBondContact O-N 3.29Å; R774-V776 VanDerWaalsContact O-N 3.13Å; V776-R779 PolarHBondContact O-N 2.9Å; V776-A780 PolarHBondContact O-N 2.97Å
777	Q	94.3	Very high	92	Very high	46 Å²	46	67.8 Å²	67.8	22%	0.215	35%	0.348	C	S	.	.	H	α-helix	trans	-57.9	-48.8	172.3	-55.4	-178.1	10.6	0	0	111.2	L769 L772 P773 R774 R779 A780 H781	L769-Q777 VanDerWaalsContact O-CG 3.25Å; L769-Q777 WeakPolarHBondContact O-CG 3.42Å; L769-Q777 PolarHBondContact O-NE2 3.36Å; L772-Q777 PolarHBondContact O-NE2 3.35Å; P773-Q777 PolarHBondContact O-N 2.8Å; P773-Q777 VanDerWaalsContact O-N 3.14Å; R774-Q777 CarbonylContact O-C 3.53Å; R774-Q777 WeakPolarHBondContact O-CA 3.43Å; R774-Q777 VanDerWaalsContact O-CB 3.3Å; R774-Q777 WeakPolarHBondContact O-CB 3.41Å; R774-Q777 PolarHBondContact O-N 2.89Å; Q777-R779 VanDerWaalsContact C-N 3.27Å; Q777-R779 PolarHBondContact O-N 3.04Å; Q777-A780 WeakPolarHBondContact O-CB 3.44Å; Q777-A780 PolarHBondContact O-N 3.47Å; Q777-A780 VanDerWaalsContact O-N 3.12Å; Q777-H781 PolarHBondContact O-N 3.48Å; Q777-H781 PolarHBondContact O-ND1 3.48Å
778	D	93.1	Very high	91.7	Very high	106 Å²	106	68.3 Å²	68.3	57%	0.567	35%	0.347	S	S	*	.	H	α-helix	trans	-56.2	-42.7	178.8	-65.2	-39.8	0	0	0	111	R774 H781 E782	R774-D778 VanDerWaalsContact O-CG 3.26Å; R774-D778 PolarHBondContact O-N 3.1Å; R774-D778 VanDerWaalsContact O-OD2 3.12Å; D778-H781 PolarHBondContact O-N 2.92Å; D778-E782 PolarHBondContact O-N 2.81Å
779	R	92.8	Very high	91.1	Very high	63 Å²	63	75.2 Å²	75.2	24%	0.238	38%	0.377	C	S	.	.	H	α-helix	trans	-68.5	-37.6	177.2	-173	60.9	-177.7	-176.6	6.4	112.9	I735 S738 G775 V776 Q777 E782 V783	I735-R779 HydrophobicContact CG2-CB 4.01Å; I735-R779 HydrophobicContact CG2-CG 4.1Å; S738-R779 PolarHBondContact O-NH2 3.12Å; S738-R779 WeakPolarHBondContact OG-CG 3.32Å; S738-R779 PolarHBondContact OG-NE 3.26Å; G775-R779 PolarHBondContact O-N 2.78Å; V776-R779 PolarHBondContact O-N 2.9Å; Q777-R779 VanDerWaalsContact C-N 3.27Å; Q777-R779 PolarHBondContact O-N 3.04Å; R779-E782 WeakPolarHBondContact CD-OE2 3.09Å; R779-E782 IonicContact CZ-OE1 3.5Å; R779-E782 IonicContact CZ-OE2 2.82Å; R779-E782 IonicContact NE-OE2 3.99Å; R779-E782 IonicContact NH1-OE1 3.62Å; R779-E782 PolarHBondContact NH1-OE1 2.88Å; R779-E782 IonicContact NH1-OE2 3.16Å; R779-E782 PolarHBondContact NH1-OE2 3.32Å; R779-E782 WeakPolarHBondContact O-CB 3.37Å; R779-E782 PolarHBondContact O-N 3.39Å; R779-V783 WeakPolarHBondContact O-CG2 3.26Å; R779-V783 PolarHBondContact O-N 2.86Å; R779-V783 VanDerWaalsContact O-N 3.08Å
780	A	94.9	Very high	90.3	Very high	0 Å²	0	80.3 Å²	80.3	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-63	-44.4	172.8	0	0	0	0	0	111.3	I735 L769 V776 Q777 E782 V783 L784	I735-A780 HydrophobicContact CD1-CB 4.07Å; I735-A780 HydrophobicContact CG1-CB 4.34Å; I735-A780 HydrophobicContact CG2-CB 4.08Å; L769-A780 HydrophobicContact CD1-CB 3.89Å; L769-A780 HydrophobicContact CD2-CB 3.64Å; L769-A780 HydrophobicContact CG-CB 4.45Å; V776-A780 PolarHBondContact O-N 2.97Å; Q777-A780 WeakPolarHBondContact O-CB 3.44Å; Q777-A780 PolarHBondContact O-N 3.47Å; Q777-A780 VanDerWaalsContact O-N 3.12Å; A780-E782 VanDerWaalsContact C-N 3.33Å; A780-E782 PolarHBondContact O-N 3.31Å; A780-V783 PolarHBondContact O-N 3.03Å; A780-L784 WeakPolarHBondContact O-CG 3.35Å; A780-L784 PolarHBondContact O-N 3.33Å
781	H	94.1	Very high	89.1	Confident	105 Å²	105	76.8 Å²	76.8	49%	0.486	40%	0.402	S	S	.	.	H	α-helix	trans	-64.1	-34.8	174.8	-68	102.6	0	0	0	112.5	Q777 D778 K785	Q777-H781 PolarHBondContact O-N 3.48Å; Q777-H781 PolarHBondContact O-ND1 3.48Å; D778-H781 PolarHBondContact O-N 2.92Å; H781-K785 WeakPolarHBondContact O-CB 3.45Å; H781-K785 PolarHBondContact O-N 2.83Å
782	E	93.2	Very high	87.4	Confident	94 Å²	94	77.5 Å²	77.5	44%	0.439	40%	0.404	S	S	.	.	H	α-helix	trans	-62.5	-45.5	173.3	-168.7	-164.2	145.5	0	0	111.9	D778 R779 A780 T786	D778-E782 PolarHBondContact O-N 2.81Å; R779-E782 WeakPolarHBondContact CD-OE2 3.09Å; R779-E782 IonicContact CZ-OE1 3.5Å; R779-E782 IonicContact CZ-OE2 2.82Å; R779-E782 IonicContact NE-OE2 3.99Å; R779-E782 IonicContact NH1-OE1 3.62Å; R779-E782 PolarHBondContact NH1-OE1 2.88Å; R779-E782 IonicContact NH1-OE2 3.16Å; R779-E782 PolarHBondContact NH1-OE2 3.32Å; R779-E782 WeakPolarHBondContact O-CB 3.37Å; R779-E782 PolarHBondContact O-N 3.39Å; A780-E782 VanDerWaalsContact C-N 3.33Å; A780-E782 PolarHBondContact O-N 3.31Å; E782-T786 WeakPolarHBondContact O-CB 3.39Å; E782-T786 PolarHBondContact O-N 3.09Å; E782-T786 PolarHBondContact O-OG1 3.38Å
783	V	93.8	Very high	84.8	Confident	10 Å²	10	80.3 Å²	80.3	6%	0.061	44%	0.435	C	S	.	.	H	α-helix	trans	-62.3	-49.2	175.9	171.1	0	0	0	0	110.9	V754 I755 R779 A780 T786 Y787	V754-V783 HydrophobicContact CB-CG1 4.22Å; V754-V783 HydrophobicContact CG1-CB 4.36Å; V754-V783 HydrophobicContact CG1-CG1 3.92Å; I755-V783 HydrophobicContact CD1-CG1 4.48Å; I755-V783 HydrophobicContact CG1-CG1 4.23Å; R779-V783 WeakPolarHBondContact O-CG2 3.26Å; R779-V783 PolarHBondContact O-N 2.86Å; R779-V783 VanDerWaalsContact O-N 3.08Å; A780-V783 PolarHBondContact O-N 3.03Å; V783-T786 WeakPolarHBondContact O-CB 3.41Å; V783-T786 PolarHBondContact O-N 3.21Å; V783-Y787 PolarHBondContact O-N 2.86Å
784	L	94	Very high	82	Confident	11 Å²	11	79.9 Å²	79.9	6%	0.058	45%	0.447	C	S	.	.	H	α-helix	trans	-66.4	-39.2	179.9	-67.7	179.3	0	0	0	112.6	F758 F765 A780 T786 Y787 Q788	F758-L784 HydrophobicContact CB-CD1 4.31Å; F758-L784 HydrophobicContact CB-CD2 3.65Å; F758-L784 HydrophobicContact CD1-CD2 3.92Å; F758-L784 HydrophobicContact CD2-CD1 3.57Å; F758-L784 HydrophobicContact CD2-CD2 4.15Å; F758-L784 HydrophobicContact CE2-CD1 4.04Å; F758-L784 HydrophobicContact CG-CD1 3.95Å; F758-L784 HydrophobicContact CG-CD2 3.63Å; F758-L784 HydrophobicContact CG-CG 4.46Å; F765-L784 HydrophobicContact CD1-CD1 4.47Å; F765-L784 HydrophobicContact CE1-CD1 3.98Å; A780-L784 WeakPolarHBondContact O-CG 3.35Å; A780-L784 PolarHBondContact O-N 3.33Å; L784-T786 VanDerWaalsContact C-N 3.27Å; L784-T786 PolarHBondContact O-N 2.63Å; L784-Y787 PolarHBondContact O-N 2.84Å; L784-Q788 WeakPolarHBondContact O-CB 3.42Å; L784-Q788 VanDerWaalsContact O-CG 3.3Å; L784-Q788 WeakPolarHBondContact O-CG 3.36Å; L784-Q788 PolarHBondContact O-N 3.15Å
785	K	89.4	Confident	79.1	Confident	133 Å²	133	72.4 Å²	72.4	58%	0.578	43%	0.434	S	S	*	.	H	α-helix	trans	-64.9	-32.1	174.5	-174.2	172.8	-171.5	169.6	0	112	H781 K789	H781-K785 WeakPolarHBondContact O-CB 3.45Å; H781-K785 PolarHBondContact O-N 2.83Å; K785-K789 WeakPolarHBondContact O-CB 3.39Å; K785-K789 VanDerWaalsContact O-CG 3.23Å; K785-K789 WeakPolarHBondContact O-CG 3.42Å; K785-K789 PolarHBondContact O-N 3.46Å; K785-K789 VanDerWaalsContact O-N 3.13Å
786	T	88.8	Confident	76.2	Confident	80 Å²	80	77.1 Å²	77.1	49%	0.491	45%	0.445	S	S	.	.	H	α-helix	trans	-72.7	-43.9	174.1	-58	0	0	0	0	111.4	E782 V783 L784 K789 T790	E782-T786 WeakPolarHBondContact O-CB 3.39Å; E782-T786 PolarHBondContact O-N 3.09Å; E782-T786 PolarHBondContact O-OG1 3.38Å; V783-T786 WeakPolarHBondContact O-CB 3.41Å; V783-T786 PolarHBondContact O-N 3.21Å; L784-T786 VanDerWaalsContact C-N 3.27Å; L784-T786 PolarHBondContact O-N 2.63Å; T786-K789 PolarHBondContact O-N 3.06Å; T786-T790 PolarHBondContact O-N 3.23Å; T786-T790 VanDerWaalsContact O-N 3.14Å; T786-T790 PolarHBondContact O-OG1 2.89Å
787	Y	88.9	Confident	73.4	Confident	68 Å²	68	82.2 Å²	82.2	27%	0.267	47%	0.47	S	S	.	.	H	α-helix	trans	-59.2	-52	172.9	171.8	-130.4	0	0	0	111.9	I755 D759 V783 L784 K789 T790 A791	I755-Y787 HydrophobicContact CB-CD1 4.46Å; I755-Y787 HydrophobicContact CD1-CD1 4.48Å; I755-Y787 HydrophobicContact CD1-CD2 3.9Å; I755-Y787 HydrophobicContact CD1-CG 3.8Å; I755-Y787 HydrophobicContact CG1-CD1 3.97Å; I755-Y787 HydrophobicContact CG1-CD2 4.26Å; I755-Y787 HydrophobicContact CG1-CG 3.79Å; I755-Y787 HydrophobicContact CG2-CD1 3.82Å; I755-Y787 HydrophobicContact CG2-CD2 4.02Å; I755-Y787 HydrophobicContact CG2-CE1 3.51Å; I755-Y787 HydrophobicContact CG2-CE2 3.73Å; I755-Y787 HydrophobicContact CG2-CG 4.04Å; I755-Y787 VanDerWaalsContact CG2-CZ 3.43Å; D759-Y787 WeakPolarHBondContact OD1-CE1 3.4Å; D759-Y787 PolarHBondContact OD1-OH 2.96Å; D759-Y787 PolarHBondContact OD2-OH 2.95Å; D759-Y787 VanDerWaalsContact OD2-OH 3.12Å; V783-Y787 PolarHBondContact O-N 2.86Å; L784-Y787 PolarHBondContact O-N 2.84Å; Y787-K789 PolarHBondContact O-N 3.29Å; Y787-T790 CarbonylContact O-C 3.53Å; Y787-T790 WeakPolarHBondContact O-CA 3.47Å; Y787-T790 WeakPolarHBondContact O-CB 3.26Å; Y787-T790 PolarHBondContact O-N 3.36Å; Y787-A791 HydrophobicContact CE2-CB 4.44Å; Y787-A791 WeakPolarHBondContact O-CB 3.36Å; Y787-A791 PolarHBondContact O-N 2.75Å
788	Q	84.9	Confident	70.4	Confident	98 Å²	98	86.7 Å²	86.7	46%	0.458	50%	0.495	S	S	.	.	H	α-helix	trans	-54.9	-49.8	176.9	-76.2	173.6	-20.9	0	0	111.3	L784 T790 A791 T792	L784-Q788 WeakPolarHBondContact O-CB 3.42Å; L784-Q788 VanDerWaalsContact O-CG 3.3Å; L784-Q788 WeakPolarHBondContact O-CG 3.36Å; L784-Q788 PolarHBondContact O-N 3.15Å; Q788-T790 PolarHBondContact O-N 3.18Å; Q788-T790 VanDerWaalsContact O-N 3.15Å; Q788-A791 PolarHBondContact O-N 2.67Å; Q788-T792 PolarHBondContact O-N 3.44Å; Q788-T792 PolarHBondContact O-OG1 2.77Å
789	K	79.2	Confident	67.4	Low	149 Å²	149	89 Å²	89	65%	0.648	51%	0.506	S	S	*	.	H	α-helix	trans	-56.7	-30	175	-78.2	174.6	174.7	-171.4	0	114.1	K785 T786 Y787	K785-K789 WeakPolarHBondContact O-CB 3.39Å; K785-K789 VanDerWaalsContact O-CG 3.23Å; K785-K789 WeakPolarHBondContact O-CG 3.42Å; K785-K789 PolarHBondContact O-N 3.46Å; K785-K789 VanDerWaalsContact O-N 3.13Å; T786-K789 PolarHBondContact O-N 3.06Å; Y787-K789 PolarHBondContact O-N 3.29Å
790	T	75.3	Confident	64.4	Low	113 Å²	113	91 Å²	91	69%	0.693	53%	0.526	S	S	*	.	H	α-helix	trans	-84.6	-29.6	178.1	-55.9	0	0	0	0	112	T786 Y787 Q788	T786-T790 PolarHBondContact O-N 3.23Å; T786-T790 VanDerWaalsContact O-N 3.14Å; T786-T790 PolarHBondContact O-OG1 2.89Å; Y787-T790 CarbonylContact O-C 3.53Å; Y787-T790 WeakPolarHBondContact O-CA 3.47Å; Y787-T790 WeakPolarHBondContact O-CB 3.26Å; Y787-T790 PolarHBondContact O-N 3.36Å; Q788-T790 PolarHBondContact O-N 3.18Å; Q788-T790 VanDerWaalsContact O-N 3.15Å
791	A	66	Low	61.2	Low	61 Å²	61	97.6 Å²	97.6	50%	0.504	56%	0.561	S	S	.	*	H	α-helix	trans	-85.6	-46.9	179.9	0	0	0	0	0	113.2	Y787 Q788 G793	Y787-A791 HydrophobicContact CE2-CB 4.44Å; Y787-A791 WeakPolarHBondContact O-CB 3.36Å; Y787-A791 PolarHBondContact O-N 2.75Å; Q788-A791 PolarHBondContact O-N 2.67Å; A791-G793 PolarHBondContact O-N 3.33Å
792	T	54.4	Low	58.1	Low	96 Å²	96	98.6 Å²	98.6	59%	0.589	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-77.5	-5.6	177.5	64.8	0	0	0	0	113.2	Q788 G794 G795	Q788-T792 PolarHBondContact O-N 3.44Å; Q788-T792 PolarHBondContact O-OG1 2.77Å; T792-G794 PolarHBondContact O-N 2.82Å; T792-G795 PolarHBondContact O-N 3.28Å
793	G	37.8	Very low	54.9	Low	70 Å²	70	100.6 Å²	100.6	72%	0.722	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-59.1	-7.8	167.4	0	0	0	0	0	114.6	A791	A791-G793 PolarHBondContact O-N 3.33Å
794	G	33	Very low	51.8	Low	79 Å²	79	107.9 Å²	107.9	81%	0.814	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-100.2	2.9	172.2	0	0	0	0	0	116.5	T792	T792-G794 PolarHBondContact O-N 2.82Å
795	G	29	Very low	48.6	Very low	49 Å²	49	114.6 Å²	114.6	51%	0.505	66%	0.658	S	S	.	*	S	Bend	trans	-164.4	103	-174.1	0	0	0	0	0	118	T792	T792-G795 PolarHBondContact O-N 3.28Å
796	L	30.7	Very low	46	Very low	155 Å²	155	113.8 Å²	113.8	81%	0.812	67%	0.669	S	S	*	*			trans	47.1	97.2	140.6	-79.4	152.1	0	0	0	121.4
797	I	33.8	Very low	43.1	Very low	140 Å²	140	115 Å²	115	72%	0.718	68%	0.678	S	S	*	*			trans	60.7	121.8	133	65	172.3	0	0	0	124
798	N	31	Very low	40.2	Very low	141 Å²	141	116.6 Å²	116.6	75%	0.754	70%	0.699	S	S	*	*				21.6	137.8	127.4	-48.3	-8.5	0	0	0	119.4
799	L	29.8	Very low	37.5	Very low	153 Å²	153	123.7 Å²	123.7	80%	0.801	72%	0.722	S	S	*	*				-171	132.5	80.9	-92.4	168.7	0	0	0	114.9
800	T	30.6	Very low	35.1	Very low	106 Å²	106	125.5 Å²	125.5	65%	0.65	73%	0.73	S	S	*	*			trans	43.9	115.4	138.3	58.3	0	0	0	0	124.6
801	D	28.6	Very low	32.8	Very low	139 Å²	139	125.3 Å²	125.3	74%	0.743	73%	0.733	S	S	*	*				82.8	147.9	118.3	-67.1	-50.6	0	0	0	126.4
802	T	27.4	Very low	30.9	Very low	125 Å²	125	128.5 Å²	128.5	77%	0.767	75%	0.752	S	S	*	*			trans	74.4	112.6	155.4	40.1	0	0	0	0	123.3
803	N	26.8	Very low	29.7	Very low	136 Å²	136	130 Å²	130	73%	0.727	77%	0.766	S	S	*	*			trans	65.8	120.8	134	-80.3	-1.7	0	0	0	123.7
804	H	28.4	Very low	29.2	Very low	164 Å²	164	130.3 Å²	130.3	76%	0.759	77%	0.769	S	S	*	*			trans	64	147.4	138.8	-75.4	-76.2	0	0	0	121.7
805	N	26.2	Very low	29.1	Very low	152 Å²	152	132.2 Å²	132.2	81%	0.813	77%	0.77	S	S	*	*			trans	67.9	135.6	170.5	-63	-10.1	0	0	0	117.9
806	S	34.8	Very low	28.9	Very low	116 Å²	116	136.6 Å²	136.6	81%	0.811	78%	0.781	S	S	*	*			trans	-57.4	142.6	155.1	-42.6	0	0	0	0	108.9
807	P	29.9	Very low	28.7	Very low	104 Å²	104	138.5 Å²	138.5	68%	0.675	78%	0.778	S	S	*	*				-147.8	-169.6	80.1	41.2	-23.9	0	0	0	115
808	S	26.9	Very low	28.3	Very low	103 Å²	103	140.3 Å²	140.3	72%	0.72	78%	0.78	S	S	*	*			trans	-47.4	144.3	172.3	54.7	0	0	0	0	115.7
809	W	28.9	Very low	28.2	Very low	246 Å²	246	144.8 Å²	144.8	93%	0.932	79%	0.789	S	S	*	*			trans	-118.9	115.5	155.4	-78	83.4	0	0	0	110.4
810	K	27.7	Very low	28	Very low	187 Å²	187	142.7 Å²	142.7	81%	0.813	79%	0.787	S	S	*	*			trans	-96.9	155.9	167.8	-92	-171.2	175.5	-178.1	0	109.5
811	S	27.5	Very low	28.1	Very low	109 Å²	109	145.5 Å²	145.5	76%	0.762	80%	0.797	S	S	*	*			trans	60.3	117	154.2	-57.7	0	0	0	0	118.7
812	S	25.2	Very low	28.1	Very low	128 Å²	128	144.6 Å²	144.6	90%	0.895	80%	0.799	S	S	*	*				-147.7	139.7	108.5	-83.3	0	0	0	0	111.3
813	S	29.8	Very low	28.1	Very low	127 Å²	127	144.5 Å²	144.5	89%	0.888	80%	0.798	S	S	*	*			trans	-75.9	138.5	177.2	49.4	0	0	0	0	111.3
814	G	27.6	Very low	28.3	Very low	77 Å²	77	145 Å²	145	79%	0.794	81%	0.805	S	S	*	*			trans	-160	69.1	-179.3	0	0	0	0	0	113.5
815	S	30.4	Very low	28.2	Very low	120 Å²	120	143.1 Å²	143.1	84%	0.839	81%	0.806	S	S	*	*			trans	-68	128.5	165.1	174.7	0	0	0	0	109.4
816	L	26	Very low	28.5	Very low	140 Å²	140	141.1 Å²	141.1	73%	0.733	81%	0.81	S	S	*	*			trans	-171.1	106.9	150.7	-102.9	161.7	0	0	0	113.1
817	R	24.7	Very low	28.4	Very low	196 Å²	196	138.7 Å²	138.7	74%	0.74	80%	0.804	S	S	*	*			trans	48.1	127.2	135.5	-69.1	177.1	-167.3	-179.1	1.5	121.8
818	K	26.4	Very low	28.4	Very low	177 Å²	177	145.5 Å²	145.5	77%	0.77	82%	0.816	S	S	*	*				59.7	107	129.2	-59.5	178.5	178.9	-169.5	0	118.6
819	Y	29.1	Very low	28.7	Very low	236 Å²	236	144.8 Å²	144.8	93%	0.925	81%	0.811	S	S	*	*			trans	-123.8	107.1	138.8	-79.7	-77.4	0	0	0	110.6
820	S	25.5	Very low	29	Very low	109 Å²	109	138 Å²	138	76%	0.762	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-74.3	139.7	171.7	46	0	0	0	0	110.8
821	L	31.5	Very low	29.2	Very low	164 Å²	164	137.1 Å²	137.1	86%	0.859	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-63.2	140.5	165.4	-70.1	170.1	0	0	0	110.1
822	P	29.3	Very low	29.5	Very low	121 Å²	121	137.2 Å²	137.2	79%	0.786	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-72.9	142.3	-179.5	29.7	-34.5	0	0	0	111.9
823	V	26.7	Very low	29.8	Very low	123 Å²	123	142.3 Å²	142.3	75%	0.745	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-80	131.6	175.3	171.7	0	0	0	0	110.7	T825	V823-T825 WeakPolarHBondContact CG1-OG1 3.47Å
824	T	31.5	Very low	29.8	Very low	145 Å²	145	140.7 Å²	140.7	89%	0.89	79%	0.786	S	S	*	*			trans	-135.5	112.8	149	38.4	0	0	0	0	109.4
825	T	27.5	Very low	30	Very low	126 Å²	126	142.5 Å²	142.5	77%	0.773	78%	0.782	S	S	*	*			trans	-115.4	113.5	-175.4	-58.9	0	0	0	0	111	V823	V823-T825 WeakPolarHBondContact CG1-OG1 3.47Å
826	A	31.5	Very low	30	Very low	109 Å²	109	143 Å²	143	90%	0.901	78%	0.775	S	S	*	*			trans	-158.5	116.2	162.6	0	0	0	0	0	109.7
827	G	33.5	Very low	30.1	Very low	66 Å²	66	143.4 Å²	143.4	68%	0.68	77%	0.773	S	S	*	*			cis	162	167.2	-11.5	0	0	0	0	0	112
828	R	29.8	Very low	30.2	Very low	247 Å²	247	139.7 Å²	139.7	93%	0.932	77%	0.768	S	S	*	*			trans	65.1	138.2	165.3	-85.6	179.9	160.9	-178.4	-7.3	117.3
829	S	33.6	Very low	30.5	Very low	88 Å²	88	139 Å²	139	62%	0.615	77%	0.767	S	S	*	*			cis	-155.5	157.7	4.7	-72.9	0	0	0	0	112.3
830	S	34.3	Very low	30.5	Very low	102 Å²	102	134.5 Å²	134.5	71%	0.713	76%	0.756	S	S	*	*			trans	59.9	145.9	145.8	51.1	0	0	0	0	120.8
831	M	32.5	Very low	30.6	Very low	170 Å²	170	134.8 Å²	134.8	84%	0.837	75%	0.748	S	S	*	*			cis	-174.5	160	-6.5	-106.9	159.8	170.1	0	0	107.8
832	T	33.3	Very low	30.6	Very low	111 Å²	111	135.6 Å²	135.6	68%	0.681	75%	0.745	S	S	*	*			cis	-173.2	147.9	-27.5	21.8	0	0	0	0	109.2
833	R	32	Very low	30.7	Very low	234 Å²	234	134.4 Å²	134.4	88%	0.883	74%	0.74	S	S	*	*			trans	69.2	155.2	162.1	-69.6	176.8	177.8	-177.6	-2.9	117.5
834	S	29.5	Very low	30.9	Very low	94 Å²	94	133.8 Å²	133.8	66%	0.657	74%	0.738	S	S	*	*			cis	-146.1	143.2	-10.1	-102.2	0	0	0	0	107.3
835	V	30.9	Very low	31	Very low	114 Å²	114	133.1 Å²	133.1	69%	0.691	74%	0.736	S	S	*	*				80.8	104	55.5	176.7	0	0	0	0	113.4
836	D	29.9	Very low	31.3	Very low	131 Å²	131	132.1 Å²	132.1	70%	0.701	73%	0.734	S	S	*	*			trans	48.8	138.4	145.2	-45.7	-19.8	0	0	0	122.7
837	Q	28.7	Very low	31.5	Very low	149 Å²	149	133.1 Å²	133.1	70%	0.696	74%	0.735	S	S	*	*				159.5	125.8	93.3	-157.7	80.1	56.7	0	0	113.2
838	D	27.1	Very low	31.4	Very low	118 Å²	118	133.7 Å²	133.7	63%	0.631	74%	0.741	S	S	*	*			trans	30	166.4	152.6	-64.1	-51.1	0	0	0	126.3
839	H	32.9	Very low	31.4	Very low	161 Å²	161	132 Å²	132	75%	0.745	73%	0.734	S	S	*	*			trans	90.1	144.2	159.4	-56.6	-61.2	0	0	0	120.4
840	M	29	Very low	31.3	Very low	142 Å²	142	137.5 Å²	137.5	70%	0.7	74%	0.743	S	S	*	*			cis	-168.5	136.4	-36.6	-120.6	-148	-48.4	0	0	113.1
841	I	28.2	Very low	31.1	Very low	115 Å²	115	136 Å²	136	59%	0.59	74%	0.743	S	S	*	*			trans	67.4	157	155.1	-30.5	145.6	0	0	0	119.9
842	F	30.2	Very low	31	Very low	181 Å²	181	133.4 Å²	133.4	79%	0.794	74%	0.742	S	S	*	*			trans	77.1	133.5	161.9	-62.9	-62	0	0	0	117.9
843	S	32.3	Very low	30.9	Very low	97 Å²	97	135.2 Å²	135.2	68%	0.678	75%	0.746	S	S	*	*			cis	-151.7	154.2	-2	-84.9	0	0	0	0	111.9
844	P	31.4	Very low	30.7	Very low	109 Å²	109	129.5 Å²	129.5	71%	0.708	74%	0.742	S	S	*	*			trans	-86.5	156.7	172.2	35.9	-34.9	0	0	0	113.2
845	P	33.9	Very low	30.7	Very low	131 Å²	131	128.4 Å²	128.4	85%	0.851	75%	0.746	S	S	*	*			trans	-85.2	128.7	176.1	33	-32.7	0	0	0	112.5
846	S	31.8	Very low	30.9	Very low	105 Å²	105	128.1 Å²	128.1	73%	0.734	75%	0.746	S	S	*	*			trans	-143.2	153.7	178.7	-71	0	0	0	0	111.9
847	S	35.7	Very low	30.8	Very low	131 Å²	131	131.6 Å²	131.6	92%	0.916	75%	0.751	S	S	*	*			trans	75.6	85.6	170.1	-53.7	0	0	0	0	117.1
848	G	32	Very low	30.7	Very low	78 Å²	78	134.3 Å²	134.3	80%	0.804	76%	0.756	S	S	*	*			trans	-156.9	34.8	-176.3	0	0	0	0	0	118
849	R	30.8	Very low	30.6	Very low	211 Å²	211	133.3 Å²	133.3	80%	0.796	76%	0.758	S	S	*	*	S	Bend	trans	72	133.7	177.5	-71.2	-176.6	170.1	-153.3	-3.6	118.4
850	Y	31.5	Very low	30.4	Very low	203 Å²	203	130.7 Å²	130.7	80%	0.796	76%	0.758	S	S	*	*			trans	44.6	107.6	162	-48.3	-61.4	0	0	0	119.1
851	G	29.7	Very low	30.2	Very low	70 Å²	70	132.3 Å²	132.3	72%	0.722	76%	0.764	S	S	*	*			cis	123.9	127.8	-12.9	0	0	0	0	0	115.5
852	S	30.1	Very low	30.2	Very low	116 Å²	116	138.5 Å²	138.5	81%	0.811	78%	0.78	S	S	*	*			trans	70.2	149	162.6	-63.1	0	0	0	0	118.1
853	I	30.7	Very low	30.1	Very low	150 Å²	150	134 Å²	134	77%	0.769	77%	0.771	S	S	*	*			cis	-148.3	146.7	-10.1	-120.3	162.6	0	0	0	111.6
854	S	29.3	Very low	30	Very low	114 Å²	114	138.5 Å²	138.5	80%	0.797	78%	0.781	S	S	*	*			trans	-0.9	147.8	156.4	-41.2	0	0	0	0	122.3
855	G	28.1	Very low	29.8	Very low	71 Å²	71	140.8 Å²	140.8	73%	0.732	79%	0.787	S	S	*	*			trans	131.3	144.9	135.2	0	0	0	0	0	116.6
856	P	35.8	Very low	29.6	Very low	107 Å²	107	140.5 Å²	140.5	70%	0.695	79%	0.788	S	S	*	*			trans	-93.3	-172.1	173.3	38.6	-34.6	0	0	0	112.6
857	Y	26.8	Very low	29.4	Very low	204 Å²	204	140.5 Å²	140.5	80%	0.8	80%	0.795	S	S	*	*			trans	105.8	131.6	166.8	-61.7	-66.2	0	0	0	118.2
858	Y	27.1	Very low	29.1	Very low	207 Å²	207	137.8 Å²	137.8	81%	0.812	79%	0.788	S	S	*	*			trans	49.4	99.7	150.4	-81.7	-87.1	0	0	0	121.6
859	S	24.9	Very low	28.8	Very low	96 Å²	96	140.3 Å²	140.3	67%	0.671	79%	0.793	S	S	*	*				62.6	147.3	120.7	66.4	0	0	0	0	123.1
860	S	28.1	Very low	28.7	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	80%	0.798	S	S	*	*			trans	94.6	100.3	152.1	-57.1	0	0	0	0	119.2
861	Q	26	Very low	28.5	Very low	175 Å²	175	134.5 Å²	134.5	82%	0.818	80%	0.801	S	S	*	*			trans	19.3	115.2	135.4	-60.9	177.1	-10.9	0	0	119
862	R	28.7	Very low	28.5	Very low	245 Å²	245	133.2 Å²	133.2	93%	0.925	79%	0.788	S	S	*	*				-157.8	153.9	110.2	-133.3	174.1	179.6	177.8	-2	112.3
863	S	27	Very low	28.6	Very low	88 Å²	88	137.3 Å²	137.3	62%	0.615	79%	0.786	S	S	*	*			trans	-73.9	148.8	172.4	172.6	0	0	0	0	111.5
864	H	31.6	Very low	29	Very low	190 Å²	190	134.2 Å²	134.2	88%	0.88	77%	0.774	S	S	*	*			trans	-158.8	143.4	131.4	-101.2	-71.7	0	0	0	110.6
865	N	27.3	Very low	29.4	Very low	157 Å²	157	130.6 Å²	130.6	84%	0.84	75%	0.748	S	S	*	*			trans	-78.9	150.6	-180	-66.8	-12.1	0	0	0	112.6
866	S	29.4	Very low	29.9	Very low	125 Å²	125	131.4 Å²	131.4	87%	0.874	74%	0.741	S	S	*	*			trans	-146.9	147.2	141.2	-167.2	0	0	0	0	109.1
867	A	27.5	Very low	30.1	Very low	105 Å²	105	133.1 Å²	133.1	87%	0.868	74%	0.739	S	S	*	*			trans	-87.3	145.1	-173.6	0	0	0	0	0	112.4
868	G	28.4	Very low	30.8	Very low	75 Å²	75	126.1 Å²	126.1	77%	0.773	72%	0.72	S	S	*	*			trans	-148.9	119.8	170.2	0	0	0	0	0	108.4	D870	G868-D870 PolarHBondContact O-N 3.2Å
869	S	26.8	Very low	31.4	Very low	130 Å²	130	117.5 Å²	117.5	91%	0.909	69%	0.687	S	S	*	*			trans	-73.1	113.4	-169.2	51.2	0	0	0	0	113.2
870	D	28.9	Very low	32.1	Very low	167 Å²	167	116.8 Å²	116.8	89%	0.893	68%	0.676	S	S	*	*			trans	-150.1	116.5	157	-158.8	-2.1	0	0	0	108.2	G868	G868-D870 PolarHBondContact O-N 3.2Å
871	S	27.1	Very low	32.8	Very low	125 Å²	125	118.9 Å²	118.9	87%	0.874	67%	0.668	S	S	*	*			trans	-159.8	140.8	-170	-172.4	0	0	0	0	111.4
872	G	29.5	Very low	33.7	Very low	43 Å²	43	114 Å²	114	44%	0.443	65%	0.646	S	S	.	*			trans	139.7	-52.5	168.9	0	0	0	0	0	115.1	V874	G872-V874 PolarHBondContact O-N 3.07Å; G872-V874 VanDerWaalsContact O-N 3.09Å
873	R	32.1	Very low	34.4	Very low	202 Å²	202	103.6 Å²	103.6	76%	0.762	61%	0.609	S	S	*	*			trans	-82.3	93.3	-164.6	-72.4	-175.6	171.2	-167.2	-0.7	114.9	E1168	R873-E1168 IonicContact CZ-OE1 3.25Å; R873-E1168 IonicContact NH2-OE1 2.79Å; R873-E1168 PolarHBondContact NH2-OE1 3.5Å
874	V	39.3	Very low	35.1	Very low	86 Å²	86	107.8 Å²	107.8	52%	0.521	61%	0.611	S	S	.	*			trans	-76.7	129.5	165.1	-179.5	0	0	0	0	110.2	G872	G872-V874 PolarHBondContact O-N 3.07Å; G872-V874 VanDerWaalsContact O-N 3.09Å
875	S	36.9	Very low	35.6	Very low	37 Å²	37	103.5 Å²	103.5	26%	0.259	59%	0.592	S	S	.	*			trans	-62.3	145	177.8	168	0	0	0	0	112.4	E877 S878 M879	S875-E877 PolarHBondContact O-N 2.91Å; S875-E877 PolarHBondContact OG-N 2.81Å; S875-E877 PolarHBondContact OG-OE2 2.73Å; S875-S878 WeakPolarHBondContact O-CB 3.34Å; S875-S878 PolarHBondContact O-N 2.7Å; S875-M879 PolarHBondContact O-N 3.15Å
876	P	39.3	Very low	36.1	Very low	88 Å²	88	98 Å²	98	57%	0.571	56%	0.564	S	S	*	*	H	α-helix	trans	-51.5	-32	165.1	-27.1	36.2	0	0	0	114.9	N880	P876-N880 WeakPolarHBondContact O-CB 3.48Å; P876-N880 PolarHBondContact O-N 3.45Å; P876-N880 PolarHBondContact O-ND2 2.98Å
877	E	38.5	Very low	36.7	Very low	144 Å²	144	94.9 Å²	94.9	67%	0.673	54%	0.54	S	S	*	.	H	α-helix	trans	-70.1	-43.8	173.4	-56.9	88.6	-133.9	0	0	111.5	S875 M879 N880 R881	S875-E877 PolarHBondContact O-N 2.91Å; S875-E877 PolarHBondContact OG-N 2.81Å; S875-E877 PolarHBondContact OG-OE2 2.73Å; E877-M879 VanDerWaalsContact C-N 3.29Å; E877-M879 PolarHBondContact O-N 2.85Å; E877-N880 PolarHBondContact O-N 3.28Å; E877-R881 WeakPolarHBondContact O-CB 3.38Å; E877-R881 PolarHBondContact O-N 2.81Å
878	S	43.4	Very low	37	Very low	56 Å²	56	94 Å²	94	39%	0.392	52%	0.52	S	S	.	.	H	α-helix	trans	-61.4	-40.6	175.7	-60.1	0	0	0	0	111	S875 R881 I882	S875-S878 WeakPolarHBondContact O-CB 3.34Å; S875-S878 PolarHBondContact O-N 2.7Å; S878-R881 WeakPolarHBondContact O-CB 3.24Å; S878-R881 PolarHBondContact O-N 3.31Å; S878-I882 WeakPolarHBondContact O-CG1 3.28Å; S878-I882 PolarHBondContact O-N 2.9Å
879	M	38.8	Very low	37.3	Very low	26 Å²	26	91.8 Å²	91.8	13%	0.128	50%	0.497	C	S	.	.	H	α-helix	trans	-60.2	-57.6	171.1	-167.5	178.7	-68.1	0	0	110	S875 E877 R881 I882 I883 Y1094 N1133 P1137	S875-M879 PolarHBondContact O-N 3.15Å; E877-M879 VanDerWaalsContact C-N 3.29Å; E877-M879 PolarHBondContact O-N 2.85Å; M879-R881 PolarHBondContact O-N 2.81Å; M879-I882 CarbonylContact O-C 3.54Å; M879-I882 WeakPolarHBondContact O-CA 3.5Å; M879-I882 WeakPolarHBondContact O-CB 3.03Å; M879-I882 PolarHBondContact O-N 2.92Å; M879-I883 HydrophobicContact CG-CD1 4.29Å; M879-I883 HydrophobicContact CG-CG1 4.32Å; M879-I883 VanDerWaalsContact O-CG1 3.3Å; M879-I883 WeakPolarHBondContact O-CG1 3.28Å; M879-I883 PolarHBondContact O-N 3.05Å; M879-Y1094 HydrophobicContact CG-CD2 4.24Å; M879-Y1094 HydrophobicContact SD-CD2 4.04Å; M879-Y1094 HydrophobicContact SD-CE2 4.46Å; M879-N1133 HydrophobicContact CE-CB 4.2Å; M879-P1137 HydrophobicContact SD-CG 4.48Å
880	N	40	Very low	37.5	Very low	81 Å²	81	86.9 Å²	86.9	43%	0.433	46%	0.461	S	S	.	.	H	α-helix	trans	-55.1	-28.6	178.8	-84.7	-80.7	0	0	0	114.5	P876 E877 R884	P876-N880 WeakPolarHBondContact O-CB 3.48Å; P876-N880 PolarHBondContact O-N 3.45Å; P876-N880 PolarHBondContact O-ND2 2.98Å; E877-N880 PolarHBondContact O-N 3.28Å; N880-R884 PolarHBondContact O-N 3.12Å
881	R	42.9	Very low	37.8	Very low	151 Å²	151	84.5 Å²	84.5	57%	0.57	45%	0.445	S	S	*	.	H	α-helix	trans	-67.6	-49.8	171.4	-164.7	177	-176.7	-61	-26.4	111.4	E877 S878 M879 I883 R884 E885	E877-R881 WeakPolarHBondContact O-CB 3.38Å; E877-R881 PolarHBondContact O-N 2.81Å; S878-R881 WeakPolarHBondContact O-CB 3.24Å; S878-R881 PolarHBondContact O-N 3.31Å; M879-R881 PolarHBondContact O-N 2.81Å; R881-I883 VanDerWaalsContact C-N 3.34Å; R881-I883 PolarHBondContact O-N 3.12Å; R881-R884 PolarHBondContact O-N 3.34Å; R881-E885 IonicContact CZ-OE1 2.67Å; R881-E885 IonicContact CZ-OE2 2.7Å; R881-E885 IonicContact NH1-OE1 3.96Å; R881-E885 PolarHBondContact NH1-OE1 3.27Å; R881-E885 IonicContact NH1-OE2 2.9Å; R881-E885 PolarHBondContact NH1-OE2 2.96Å; R881-E885 IonicContact NH2-OE1 2.77Å; R881-E885 PolarHBondContact NH2-OE1 3.35Å; R881-E885 IonicContact NH2-OE2 2.66Å; R881-E885 WeakPolarHBondContact O-CG 3.5Å; R881-E885 PolarHBondContact O-N 3.12Å
882	I	44.3	Very low	37.9	Very low	72 Å²	72	82.3 Å²	82.3	37%	0.369	43%	0.429	S	S	.	.	H	α-helix	trans	-60.7	-39.7	173.4	-64.4	161.5	0	0	0	111.4	S878 M879 R884 E885 T886	S878-I882 WeakPolarHBondContact O-CG1 3.28Å; S878-I882 PolarHBondContact O-N 2.9Å; M879-I882 CarbonylContact O-C 3.54Å; M879-I882 WeakPolarHBondContact O-CA 3.5Å; M879-I882 WeakPolarHBondContact O-CB 3.03Å; M879-I882 PolarHBondContact O-N 2.92Å; I882-R884 VanDerWaalsContact C-N 3.33Å; I882-R884 PolarHBondContact O-N 3.12Å; I882-E885 PolarHBondContact O-N 2.79Å; I882-T886 VanDerWaalsContact O-CB 3.25Å; I882-T886 WeakPolarHBondContact O-CB 3.08Å; I882-T886 PolarHBondContact O-N 2.75Å; I882-T886 PolarHBondContact O-OG1 2.91Å
883	I	44.6	Very low	38	Very low	27 Å²	27	84.9 Å²	84.9	14%	0.138	43%	0.432	C	S	.	.	H	α-helix	trans	-53.8	-51	176.5	-61.4	177.1	0	0	0	109.8	M879 R881 T887 Y1094	M879-I883 HydrophobicContact CG-CD1 4.29Å; M879-I883 HydrophobicContact CG-CG1 4.32Å; M879-I883 VanDerWaalsContact O-CG1 3.3Å; M879-I883 WeakPolarHBondContact O-CG1 3.28Å; M879-I883 PolarHBondContact O-N 3.05Å; R881-I883 VanDerWaalsContact C-N 3.34Å; R881-I883 PolarHBondContact O-N 3.12Å; I883-T887 WeakPolarHBondContact O-CB 3.49Å; I883-T887 PolarHBondContact O-N 3.41Å; I883-T887 PolarHBondContact O-OG1 3.05Å; I883-Y1094 HydrophobicContact CB-CE1 4.07Å; I883-Y1094 HydrophobicContact CD1-CD2 4.33Å; I883-Y1094 HydrophobicContact CD1-CE1 4.15Å; I883-Y1094 HydrophobicContact CD1-CE2 3.56Å; I883-Y1094 VanDerWaalsContact CD1-CZ 3.45Å; I883-Y1094 WeakPolarHBondContact CD1-OH 3.27Å; I883-Y1094 HydrophobicContact CG1-CD1 3.95Å; I883-Y1094 HydrophobicContact CG1-CD2 4.13Å; I883-Y1094 HydrophobicContact CG1-CE1 3.53Å; I883-Y1094 HydrophobicContact CG1-CE2 3.71Å; I883-Y1094 HydrophobicContact CG1-CG 4.26Å; I883-Y1094 HydrophobicContact CG2-CE1 3.83Å
884	R	41.2	Very low	38	Very low	177 Å²	177	78.6 Å²	78.6	67%	0.668	42%	0.419	S	S	*	.	H	α-helix	trans	-68.2	-55.1	179.5	-68.8	179.9	-176.8	165.9	3.5	111.6	N880 R881 I882 T886 T887 D888	N880-R884 PolarHBondContact O-N 3.12Å; R881-R884 PolarHBondContact O-N 3.34Å; I882-R884 VanDerWaalsContact C-N 3.33Å; I882-R884 PolarHBondContact O-N 3.12Å; R884-T886 PolarHBondContact O-N 3.23Å; R884-T886 VanDerWaalsContact O-N 3.13Å; R884-T887 PolarHBondContact O-N 3.29Å; R884-D888 WeakPolarHBondContact O-CB 3.12Å; R884-D888 PolarHBondContact O-N 3.04Å
885	E	41.8	Very low	37.5	Very low	100 Å²	100	78.6 Å²	78.6	47%	0.467	42%	0.415	S	S	.	.	H	α-helix	trans	-57.1	-34.5	-176.6	-70.8	179	147.1	0	0	112.8	R881 I882 G889	R881-E885 IonicContact CZ-OE1 2.67Å; R881-E885 IonicContact CZ-OE2 2.7Å; R881-E885 IonicContact NH1-OE1 3.96Å; R881-E885 PolarHBondContact NH1-OE1 3.27Å; R881-E885 IonicContact NH1-OE2 2.9Å; R881-E885 PolarHBondContact NH1-OE2 2.96Å; R881-E885 IonicContact NH2-OE1 2.77Å; R881-E885 PolarHBondContact NH2-OE1 3.35Å; R881-E885 IonicContact NH2-OE2 2.66Å; R881-E885 WeakPolarHBondContact O-CG 3.5Å; R881-E885 PolarHBondContact O-N 3.12Å; I882-E885 PolarHBondContact O-N 2.79Å; E885-G889 PolarHBondContact O-N 3.22Å; E885-G889 VanDerWaalsContact O-N 3.13Å
886	T	37.7	Very low	37.1	Very low	42 Å²	42	78.6 Å²	78.6	26%	0.258	42%	0.42	S	S	.	.	H	α-helix	trans	-81.7	-35.8	177.5	-42	0	0	0	0	112.9	I882 R884 L890 L1095	I882-T886 VanDerWaalsContact O-CB 3.25Å; I882-T886 WeakPolarHBondContact O-CB 3.08Å; I882-T886 PolarHBondContact O-N 2.75Å; I882-T886 PolarHBondContact O-OG1 2.91Å; R884-T886 PolarHBondContact O-N 3.23Å; R884-T886 VanDerWaalsContact O-N 3.13Å; T886-L890 PolarHBondContact O-N 2.93Å; T886-L1095 HydrophobicContact CG2-CB 4.02Å; T886-L1095 HydrophobicContact CG2-CD1 4.3Å; T886-L1095 HydrophobicContact CG2-CD2 3.7Å; T886-L1095 HydrophobicContact CG2-CG 4.19Å
887	T	41.9	Very low	36.7	Very low	59 Å²	59	77.4 Å²	77.4	36%	0.362	42%	0.418	S	S	.	.	H	α-helix	trans	-70.1	-46.1	177.4	-58.7	0	0	0	0	111.3	I883 R884 G889 L890 Q891	I883-T887 WeakPolarHBondContact O-CB 3.49Å; I883-T887 PolarHBondContact O-N 3.41Å; I883-T887 PolarHBondContact O-OG1 3.05Å; R884-T887 PolarHBondContact O-N 3.29Å; T887-G889 VanDerWaalsContact C-N 3.3Å; T887-G889 PolarHBondContact O-N 3.47Å; T887-L890 PolarHBondContact O-N 3.46Å; T887-Q891 WeakPolarHBondContact O-CB 3.42Å; T887-Q891 WeakPolarHBondContact O-CG 3.5Å; T887-Q891 PolarHBondContact O-N 3.2Å
888	D	34	Very low	36.2	Very low	85 Å²	85	76.4 Å²	76.4	46%	0.455	43%	0.427	S	S	.	.	H	α-helix	trans	-62.9	-39	174.4	-71.2	-46.9	0	0	0	110.9	R884 Q891 S892	R884-D888 WeakPolarHBondContact O-CB 3.12Å; R884-D888 PolarHBondContact O-N 3.04Å; D888-Q891 PolarHBondContact O-N 3.33Å; D888-S892 WeakPolarHBondContact O-CB 3.5Å; D888-S892 PolarHBondContact O-N 2.98Å
889	G	33.5	Very low	35.3	Very low	29 Å²	29	76.6 Å²	76.6	30%	0.299	44%	0.437	S	S	.	.	H	α-helix	trans	-56.2	-52.9	173.1	0	0	0	0	0	112.8	E885 T887 S892	E885-G889 PolarHBondContact O-N 3.22Å; E885-G889 VanDerWaalsContact O-N 3.13Å; T887-G889 VanDerWaalsContact C-N 3.3Å; T887-G889 PolarHBondContact O-N 3.47Å; G889-S892 WeakPolarHBondContact O-CB 3.26Å; G889-S892 PolarHBondContact O-N 3.25Å; G889-S892 PolarHBondContact O-OG 3.01Å
890	L	32.7	Very low	34.7	Very low	28 Å²	28	79.3 Å²	79.3	15%	0.147	47%	0.472	C	S	.	.	H	α-helix	trans	-70.6	-35.3	179.4	-74.4	179.9	0	0	0	113.9	T886 T887 S892 L893 S894 L1057 L1095	T886-L890 PolarHBondContact O-N 2.93Å; T887-L890 PolarHBondContact O-N 3.46Å; L890-S892 PolarHBondContact O-N 3.47Å; L890-L893 PolarHBondContact O-N 3.1Å; L890-L893 VanDerWaalsContact O-N 3.12Å; L890-S894 WeakPolarHBondContact O-CB 3.44Å; L890-S894 PolarHBondContact O-N 3.45Å; L890-L1057 HydrophobicContact CD2-CD2 3.95Å; L890-L1095 HydrophobicContact CD1-CD1 3.3Å; L890-L1095 HydrophobicContact CD1-CD2 3.91Å; L890-L1095 HydrophobicContact CD1-CG 4.22Å
891	Q	34.1	Very low	34	Very low	117 Å²	117	79.3 Å²	79.3	55%	0.547	49%	0.491	S	S	.	.	H	α-helix	trans	-65.1	-26.8	173.4	-71.4	-174.8	23.1	0	0	112.1	T887 D888 L893 M895	T887-Q891 WeakPolarHBondContact O-CB 3.42Å; T887-Q891 WeakPolarHBondContact O-CG 3.5Å; T887-Q891 PolarHBondContact O-N 3.2Å; D888-Q891 PolarHBondContact O-N 3.33Å; Q891-L893 VanDerWaalsContact C-N 3.29Å; Q891-L893 PolarHBondContact O-N 3.35Å; Q891-M895 VanDerWaalsContact O-CG 3.25Å; Q891-M895 WeakPolarHBondContact O-CG 3.18Å
892	S	30	Very low	33.2	Very low	78 Å²	78	79.8 Å²	79.8	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-71.4	-21.1	173.6	82.2	0	0	0	0	114.2	D888 G889 L890	D888-S892 WeakPolarHBondContact O-CB 3.5Å; D888-S892 PolarHBondContact O-N 2.98Å; G889-S892 WeakPolarHBondContact O-CB 3.26Å; G889-S892 PolarHBondContact O-N 3.25Å; G889-S892 PolarHBondContact O-OG 3.01Å; L890-S892 PolarHBondContact O-N 3.47Å
893	L	30.8	Very low	32.4	Very low	98 Å²	98	83.6 Å²	83.6	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-98.2	-51.5	179.4	-62.9	173.9	0	0	0	111.9	L890 Q891 M895 G896	L890-L893 PolarHBondContact O-N 3.1Å; L890-L893 VanDerWaalsContact O-N 3.12Å; Q891-L893 VanDerWaalsContact C-N 3.29Å; Q891-L893 PolarHBondContact O-N 3.35Å; L893-M895 PolarHBondContact O-N 2.95Å; L893-M895 VanDerWaalsContact O-N 3.12Å; L893-G896 WeakPolarHBondContact O-CA 3.4Å; L893-G896 PolarHBondContact O-N 3.4Å
894	S	32.7	Very low	31.5	Very low	70 Å²	70	87.9 Å²	87.9	49%	0.49	55%	0.551	S	S	.	*	H	α-helix	trans	-63.1	-21.1	-175.8	176.2	0	0	0	0	114.1	L890 G896	L890-S894 WeakPolarHBondContact O-CB 3.44Å; L890-S894 PolarHBondContact O-N 3.45Å; S894-G896 PolarHBondContact O-N 3.25Å
895	M	29.5	Very low	30.7	Very low	86 Å²	86	84.4 Å²	84.4	42%	0.424	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.4	8.7	165.9	-76.5	-65.9	-56.8	0	0	113.5	N115 R149 Q891 L893	N115-M895 WeakPolarHBondContact ND2-CE 3.46Å; N115-M895 WeakPolarHBondContact OD1-CE 3.39Å; R149-M895 PolarHBondContact NH2-O 3.02Å; Q891-M895 VanDerWaalsContact O-CG 3.25Å; Q891-M895 WeakPolarHBondContact O-CG 3.18Å; L893-M895 PolarHBondContact O-N 2.95Å; L893-M895 VanDerWaalsContact O-N 3.12Å
896	G	27.5	Very low	30	Very low	37 Å²	37	86.4 Å²	86.4	38%	0.381	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78	-39.3	-173.8	0	0	0	0	0	116.8	R149 L893 S894	R149-G896 PolarHBondContact NH1-O 3.11Å; L893-G896 WeakPolarHBondContact O-CA 3.4Å; L893-G896 PolarHBondContact O-N 3.4Å; S894-G896 PolarHBondContact O-N 3.25Å
897	A	30.8	Very low	29.4	Very low	62 Å²	62	87.2 Å²	87.2	51%	0.512	59%	0.59	S	S	.	*	S	Bend	trans	-119.5	-31.9	-154.5	0	0	0	0	0	117.8	G899	A897-G899 PolarHBondContact O-N 3.06Å
898	S	27.9	Very low	28.8	Very low	124 Å²	124	92.1 Å²	92.1	87%	0.867	61%	0.612	S	S	*	*			trans	-79.9	80.8	-164.5	-48	0	0	0	0	114.4
899	G	24.9	Very low	28.6	Very low	59 Å²	59	94 Å²	94	61%	0.608	63%	0.627	S	S	*	*			trans	-152.3	95.6	176.8	0	0	0	0	0	114.2	A897	A897-G899 PolarHBondContact O-N 3.06Å
900	G	25.4	Very low	28.3	Very low	84 Å²	84	97.7 Å²	97.7	87%	0.866	65%	0.648	S	S	*	*			trans	132.4	79.9	169.5	0	0	0	0	0	115.2
901	G	26.9	Very low	28.2	Very low	81 Å²	81	102.3 Å²	102.3	84%	0.835	68%	0.68	S	S	*	*			trans	-158.6	128.6	173.7	0	0	0	0	0	111.6
902	I	25.2	Very low	27.8	Very low	160 Å²	160	102.1 Å²	102.1	82%	0.821	69%	0.687	S	S	*	*			trans	-113.5	157.3	-179.5	-62	173.6	0	0	0	108.6
903	L	26.5	Very low	27.8	Very low	153 Å²	153	110 Å²	110	80%	0.801	71%	0.705	S	S	*	*			trans	106.6	137.7	171.2	-60.3	169.9	0	0	0	113.5
904	T	27.7	Very low	27.6	Very low	116 Å²	116	116 Å²	116	71%	0.712	72%	0.72	S	S	*	*			cis	-167.2	155.5	-24.5	8.7	0	0	0	0	107.8
905	S	23.6	Very low	27.2	Very low	104 Å²	104	118.9 Å²	118.9	73%	0.727	74%	0.735	S	S	*	*			trans	19.9	132.7	157.7	58.6	0	0	0	0	120.4
906	V	27.1	Very low	27.2	Very low	142 Å²	142	120.3 Å²	120.3	86%	0.861	75%	0.753	S	S	*	*				-155.6	151.3	58.4	175.1	0	0	0	0	109.8
907	G	25	Very low	27.2	Very low	60 Å²	60	122.6 Å²	122.6	62%	0.619	77%	0.769	S	S	*	*			cis	138.5	69.1	-6.1	0	0	0	0	0	116.6
908	I	29.9	Very low	27	Very low	161 Å²	161	127 Å²	127	83%	0.826	78%	0.784	S	S	*	*			trans	-140.8	80.4	164	-55.9	-178.2	0	0	0	108.6
909	T	29.5	Very low	27.2	Very low	125 Å²	125	126.3 Å²	126.3	77%	0.767	78%	0.776	S	S	*	*				67	112.9	92.6	63.4	0	0	0	0	117
910	S	26.2	Very low	27.2	Very low	106 Å²	106	128.7 Å²	128.7	74%	0.741	78%	0.784	S	S	*	*			trans	-81	-177	171.8	-40.3	0	0	0	0	113
911	P	30.2	Very low	27.4	Very low	125 Å²	125	133.2 Å²	133.2	81%	0.812	78%	0.78	S	S	*	*				-154.8	125.4	88.1	37.3	-16.1	0	0	0	119
912	T	27.1	Very low	27.4	Very low	113 Å²	113	134.6 Å²	134.6	69%	0.693	77%	0.772	S	S	*	*			trans	16.4	119.5	130.1	-43.2	0	0	0	0	122.5
913	R	29.1	Very low	27.6	Very low	245 Å²	245	133.1 Å²	133.1	93%	0.925	77%	0.771	S	S	*	*			trans	-146.1	121.5	131.3	-80.7	-168.3	176.9	-165	-0.3	107.6
914	R	26.2	Very low	27.6	Very low	222 Å²	222	132 Å²	132	84%	0.838	77%	0.765	S	S	*	*				68.2	99.6	64.1	-83.5	-157.5	176.4	-164	1	116.2
915	V	25.9	Very low	27.7	Very low	131 Å²	131	134.1 Å²	134.1	79%	0.794	77%	0.773	S	S	*	*			trans	61.2	111.9	135.9	-170.9	0	0	0	0	119.1
916	S	28.8	Very low	28	Very low	116 Å²	116	138.8 Å²	138.8	81%	0.811	78%	0.776	S	S	*	*				-173.1	163.3	112.9	-98.9	0	0	0	0	112.1
917	A	27.2	Very low	27.8	Very low	86 Å²	86	137.2 Å²	137.2	71%	0.711	77%	0.767	S	S	*	*			trans	-75	176.5	166.2	0	0	0	0	0	110.1
918	D	27.2	Very low	27.9	Very low	155 Å²	155	141.2 Å²	141.2	83%	0.829	76%	0.764	S	S	*	*			cis	-151	-172.9	32.7	-119.8	-14.4	0	0	0	111
919	P	32.2	Very low	27.7	Very low	108 Å²	108	137.9 Å²	137.9	70%	0.701	76%	0.76	S	S	*	*			trans	-111	-175.6	-145.9	43.9	-40.6	0	0	0	117
920	S	25	Very low	27.6	Very low	110 Å²	110	136.1 Å²	136.1	77%	0.769	75%	0.75	S	S	*	*			trans	107.6	157.5	152.1	81.2	0	0	0	0	118.6
921	F	28.6	Very low	27.7	Very low	179 Å²	179	135.2 Å²	135.2	79%	0.785	74%	0.736	S	S	*	*			trans	72.1	80.7	175.5	-92.1	-98.8	0	0	0	120.3
922	T	26.9	Very low	27.5	Very low	109 Å²	109	131.1 Å²	131.1	67%	0.669	72%	0.717	S	S	*	*				48.3	125.3	124.3	60.7	0	0	0	0	120.6
923	T	29.3	Very low	27.7	Very low	130 Å²	130	129.1 Å²	129.1	80%	0.798	70%	0.702	S	S	*	*				-154.1	153.6	104.4	-74.3	0	0	0	0	109.3
924	N	26.5	Very low	27.7	Very low	128 Å²	128	122 Å²	122	68%	0.684	69%	0.686	S	S	*	*			trans	-49.7	143.7	-175.7	-45.3	-35	0	0	0	114.2
925	D	29.8	Very low	27.8	Very low	162 Å²	162	114.1 Å²	114.1	87%	0.866	67%	0.673	S	S	*	*				-148.4	159.7	123.8	-121.3	-33.5	0	0	0	111.2
926	Y	29.8	Very low	28	Very low	201 Å²	201	113.8 Å²	113.8	79%	0.788	67%	0.672	S	S	*	*			trans	-89.6	135.3	-160.4	-82.7	-102.2	0	0	0	115.2
927	T	24.1	Very low	28	Very low	110 Å²	110	116.5 Å²	116.5	68%	0.675	68%	0.676	S	S	*	*			trans	-67.4	136.9	158.6	53.7	0	0	0	0	111.1
928	Y	27	Very low	27.9	Very low	144 Å²	144	123.1 Å²	123.1	57%	0.565	68%	0.683	S	S	*	*				-168.1	132.1	127.6	-92.2	-60.5	0	0	0	110.5	H655	H655-Y928 PolarHBondContact CD2-OH 3.42Å; H655-Y928 VanDerWaalsContact CD2-OH 3.3Å; H655-Y928 PolarHBondContact CE1-OH 2.89Å; H655-Y928 VanDerWaalsContact CG-OH 3.28Å; H655-Y928 PolarHBondContact ND1-OH 3.08Å; H655-Y928 PolarHBondContact NE2-OH 3.14Å
929	A	24.4	Very low	27.9	Very low	90 Å²	90	122.4 Å²	122.4	74%	0.744	68%	0.684	S	S	*	*			trans	-88.4	148.2	165.8	0	0	0	0	0	109.8
930	T	28.6	Very low	27.8	Very low	89 Å²	89	123.3 Å²	123.3	55%	0.546	69%	0.687	S	S	.	*			trans	-142.1	131.6	165.8	66.2	0	0	0	0	111.9	R648	R648-T930 PolarHBondContact NH2-OG1 2.82Å
931	N	27.3	Very low	28	Very low	86 Å²	86	125.5 Å²	125.5	46%	0.46	69%	0.685	S	S	.	*			trans	-68.3	163.7	175.4	-117.3	20.7	0	0	0	113.9	R648 H694	R648-N931 PolarHBondContact NH2-O 3.28Å; H694-N931 PolarHBondContact CE1-ND2 2.66Å
932	G	27.5	Very low	28	Very low	39 Å²	39	123 Å²	123	40%	0.402	69%	0.687	S	S	.	*				109.7	120.2	105.1	0	0	0	0	0	118.8
933	N	30.8	Very low	28	Very low	72 Å²	72	123.7 Å²	123.7	39%	0.385	69%	0.687	S	S	.	*			trans	-170.8	137.1	135.3	-93.3	-1.2	0	0	0	106.2	T644	T644-N933 PolarHBondContact OG1-OD1 3Å
934	T	29.4	Very low	27.9	Very low	96 Å²	96	123.8 Å²	123.8	59%	0.589	68%	0.682	S	S	*	*			cis	64.1	133.1	24.9	72.8	0	0	0	0	115.3
935	G	28.1	Very low	27.9	Very low	55 Å²	55	127 Å²	127	57%	0.567	69%	0.69	S	S	*	*			cis	151.7	130.8	-10.7	0	0	0	0	0	114.2
936	V	28.8	Very low	28	Very low	125 Å²	125	124 Å²	124	76%	0.758	68%	0.679	S	S	*	*			trans	71.7	113.5	166	-171.3	0	0	0	0	118.4
937	L	29	Very low	27.9	Very low	173 Å²	173	121.7 Å²	121.7	91%	0.906	68%	0.681	S	S	*	*			trans	-133.9	157.5	135.6	-87.8	-176.9	0	0	0	110.7
938	R	25.9	Very low	28.2	Very low	225 Å²	225	122.3 Å²	122.3	85%	0.849	69%	0.69	S	S	*	*			trans	-123.4	128.5	-176.7	-68.4	174.9	172.7	174.8	-3.8	111.6
939	T	27.4	Very low	28.3	Very low	139 Å²	139	124.2 Å²	124.2	85%	0.853	70%	0.704	S	S	*	*			trans	-162.2	150.3	151.1	42.4	0	0	0	0	107.9
940	V	29	Very low	28.7	Very low	128 Å²	128	124.4 Å²	124.4	78%	0.776	70%	0.697	S	S	*	*			cis	-150.9	149.5	-20.9	132.4	0	0	0	0	106.3
941	Q	29.7	Very low	28.5	Very low	156 Å²	156	126.2 Å²	126.2	73%	0.729	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-91.2	155.3	172.5	-81	-166.7	-5.6	0	0	112.7
942	P	27.9	Very low	28.4	Very low	126 Å²	126	126.7 Å²	126.7	82%	0.818	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-98.7	137.9	140.2	-9.8	28.7	0	0	0	111.8
943	N	27.4	Very low	28.6	Very low	124 Å²	124	132.9 Å²	132.9	66%	0.663	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-81.6	159.9	-175.3	-76.3	-43	0	0	0	114.6
944	N	26.9	Very low	28.4	Very low	132 Å²	132	138 Å²	138	71%	0.706	77%	0.769	S	S	*	*			trans	51.3	127.2	143.4	-64.7	-13.4	0	0	0	120.8
945	F	28	Very low	28.2	Very low	195 Å²	195	138.9 Å²	138.9	86%	0.855	78%	0.779	S	S	*	*				-147	148.5	98.1	-95.2	-76.5	0	0	0	110.2
946	P	31.5	Very low	28.2	Very low	98 Å²	98	142.3 Å²	142.3	64%	0.636	79%	0.791	S	S	*	*			trans	-110.7	170.1	-169.8	40.8	-33.4	0	0	0	115.3
947	N	27.5	Very low	28	Very low	153 Å²	153	143.7 Å²	143.7	82%	0.818	79%	0.794	S	S	*	*			trans	60.8	121.7	166.4	-66.5	-9.1	0	0	0	116.9
948	S	30.6	Very low	28.1	Very low	123 Å²	123	143.6 Å²	143.6	86%	0.86	79%	0.793	S	S	*	*				-162.5	150.2	71.4	21.7	0	0	0	0	114.9
949	Q	28.2	Very low	28.2	Very low	184 Å²	184	140.2 Å²	140.2	86%	0.86	79%	0.79	S	S	*	*			trans	-87.3	-177.3	164	-122.7	-168.7	-6.4	0	0	109
950	P	32.6	Very low	28.3	Very low	94 Å²	94	139.5 Å²	139.5	61%	0.61	79%	0.788	S	S	*	*			cis	-141.9	-174.1	-1.7	30.9	-5.9	0	0	0	117
951	T	26	Very low	28.3	Very low	127 Å²	127	139 Å²	139	78%	0.779	79%	0.79	S	S	*	*			trans	62.7	104.7	146	40.9	0	0	0	0	121.8
952	A	25.3	Very low	28.2	Very low	96 Å²	96	138.3 Å²	138.3	79%	0.793	79%	0.791	S	S	*	*				14	135.4	124.1	0	0	0	0	0	121.2
953	L	29.9	Very low	28.3	Very low	170 Å²	170	139.1 Å²	139.1	89%	0.89	79%	0.794	S	S	*	*			trans	-149.5	171.7	142	-111.6	172.4	0	0	0	110.5
954	Q	28.1	Very low	28.4	Very low	180 Å²	180	140 Å²	140	84%	0.841	80%	0.799	S	S	*	*			trans	-96	165.3	-168.2	-68.4	163.4	-72.2	0	0	114.1
955	S	24.3	Very low	28.8	Very low	114 Å²	114	138.9 Å²	138.9	80%	0.797	80%	0.798	S	S	*	*			trans	-57.3	162.5	175.7	-33.9	0	0	0	0	113.9
956	P	29	Very low	28.8	Very low	126 Å²	126	134 Å²	134	82%	0.818	79%	0.788	S	S	*	*				-147	170.7	99.6	39.3	-24.6	0	0	0	116.4
957	N	24.5	Very low	28.8	Very low	154 Å²	154	140 Å²	140	82%	0.824	80%	0.8	S	S	*	*			trans	-66.4	144.1	174.6	-55.3	-35.5	0	0	0	113.5
958	I	30.1	Very low	29	Very low	172 Å²	172	136.9 Å²	136.9	88%	0.882	80%	0.795	S	S	*	*			trans	-139.5	149.2	141.8	-62.7	-171.1	0	0	0	108.4
959	I	27.8	Very low	28.9	Very low	153 Å²	153	136.1 Å²	136.1	79%	0.785	79%	0.79	S	S	*	*			trans	-102.2	151.6	-172.8	-76.1	173.4	0	0	0	110.5
960	P	30.3	Very low	29	Very low	125 Å²	125	133.4 Å²	133.4	81%	0.812	79%	0.791	S	S	*	*			trans	-97.2	173.2	-156.7	38.4	-37.2	0	0	0	116
961	S	29.5	Very low	28.8	Very low	116 Å²	116	138.2 Å²	138.2	81%	0.811	81%	0.806	S	S	*	*			trans	-139.2	108.8	174.7	61.3	0	0	0	0	114
962	N	26.1	Very low	29	Very low	142 Å²	142	135.9 Å²	135.9	76%	0.759	81%	0.807	S	S	*	*			trans	-44.9	136.7	170.1	168.5	19.1	0	0	0	116.8
963	V	30.9	Very low	29.1	Very low	143 Å²	143	137.4 Å²	137.4	87%	0.867	81%	0.806	S	S	*	*			trans	-144.1	142.4	142.6	-169.1	0	0	0	0	109.6
964	N	28.8	Very low	29.1	Very low	144 Å²	144	136.1 Å²	136.1	77%	0.77	81%	0.806	S	S	*	*			trans	-99.5	173.2	-171.9	-122.2	6.3	0	0	0	114.3
965	P	36.8	Very low	29.1	Very low	107 Å²	107	132.3 Å²	132.3	70%	0.695	81%	0.805	S	S	*	*			trans	-103.6	-171.3	-163.8	42.6	-39.9	0	0	0	114.6
966	S	27.7	Very low	29.3	Very low	93 Å²	93	132.5 Å²	132.5	65%	0.65	81%	0.806	S	S	*	*			trans	-176	157.7	144.8	-79.1	0	0	0	0	114.7
967	Y	31.6	Very low	29.3	Very low	224 Å²	224	134.2 Å²	134.2	88%	0.878	81%	0.809	S	S	*	*			trans	69.6	143.5	160.7	-58.6	-58.3	0	0	0	119.5
968	A	30.5	Very low	29.4	Very low	87 Å²	87	133.3 Å²	133.3	72%	0.719	80%	0.804	S	S	*	*			cis	-157.7	159	-12.4	0	0	0	0	0	113.9
969	S	28.2	Very low	29.3	Very low	107 Å²	107	130.6 Å²	130.6	75%	0.748	80%	0.798	S	S	*	*			trans	-38.6	155.8	173.1	55	0	0	0	0	120.8
970	S	31.4	Very low	29.3	Very low	127 Å²	127	128.4 Å²	128.4	89%	0.888	79%	0.791	S	S	*	*			trans	-151.2	147.9	139.5	-79.2	0	0	0	0	111.1
971	Q	27.4	Very low	29.2	Very low	196 Å²	196	130.6 Å²	130.6	92%	0.916	80%	0.795	S	S	*	*			trans	-108.9	158.2	-172.9	-67.5	175.4	-21.2	0	0	112.6
972	G	30.2	Very low	29	Very low	77 Å²	77	134.4 Å²	134.4	79%	0.794	80%	0.8	S	S	*	*			trans	-162.5	124.1	165.8	0	0	0	0	0	111.2
973	T	27	Very low	29	Very low	129 Å²	129	132.3 Å²	132.3	79%	0.791	80%	0.797	S	S	*	*			trans	-133.2	130.9	-170.1	53.2	0	0	0	0	113.2
974	T	30.3	Very low	28.8	Very low	142 Å²	142	130.4 Å²	130.4	87%	0.871	79%	0.785	S	S	*	*			trans	-169.1	124.4	153.6	28.4	0	0	0	0	106.4
975	A	27.9	Very low	28.9	Very low	100 Å²	100	134.2 Å²	134.2	83%	0.826	79%	0.791	S	S	*	*			cis	91.7	87.1	26.7	0	0	0	0	0	115.2
976	S	30.1	Very low	28.4	Very low	118 Å²	118	132.9 Å²	132.9	83%	0.825	80%	0.796	S	S	*	*			trans	-155.8	140.6	151.7	54.4	0	0	0	0	109.2
977	N	28.5	Very low	28.5	Very low	163 Å²	163	133.2 Å²	133.2	87%	0.872	79%	0.79	S	S	*	*			trans	-100.3	150	-178.1	-53.7	-67.2	0	0	0	111.2
978	D	25.9	Very low	28.3	Very low	134 Å²	134	134.8 Å²	134.8	72%	0.717	80%	0.795	S	S	*	*			trans	-145.8	112.4	144	-160.5	-11.7	0	0	0	111	T980	D978-T980 PolarHBondContact OD1-OG1 2.73Å
979	P	27.3	Very low	28.4	Very low	116 Å²	116	135 Å²	135	75%	0.753	79%	0.787	S	S	*	*			trans	-99.2	31	-172.8	39.1	-35.5	0	0	0	114.7
980	T	28.3	Very low	28.5	Very low	107 Å²	107	134.6 Å²	134.6	66%	0.656	78%	0.776	S	S	*	*			trans	-111	87.4	179.3	61.8	0	0	0	0	114.4	D978	D978-T980 PolarHBondContact OD1-OG1 2.73Å
981	L	29.2	Very low	28.6	Very low	170 Å²	170	136.7 Å²	136.7	89%	0.89	77%	0.77	S	S	*	*			trans	-170	46.2	146.6	-104.7	179.1	0	0	0	112.1
982	Q	25.9	Very low	28.9	Very low	197 Å²	197	130.2 Å²	130.2	92%	0.921	75%	0.75	S	S	*	*			trans	-106.1	77.4	172.3	-72.1	-168.5	10.2	0	0	112
983	S	25.9	Very low	29.1	Very low	98 Å²	98	131.1 Å²	131.1	69%	0.685	74%	0.736	S	S	*	*			trans	-156.8	140.2	164.6	-176.4	0	0	0	0	110.4
984	T	26.6	Very low	29.4	Very low	102 Å²	102	128.4 Å²	128.4	63%	0.626	72%	0.716	S	S	*	*			trans	58.6	105.6	170.2	-47.4	0	0	0	0	113.7
985	Y	30.6	Very low	29.6	Very low	224 Å²	224	127 Å²	127	88%	0.878	70%	0.703	S	S	*	*				-133.2	154.5	51	-70.1	-91.9	0	0	0	113.7
986	G	26.7	Very low	30.2	Very low	79 Å²	79	126.8 Å²	126.8	81%	0.814	69%	0.692	S	S	*	*			trans	-94.4	104.3	-165.9	0	0	0	0	0	116.2
987	L	29.5	Very low	30.4	Very low	100 Å²	100	125.9 Å²	125.9	52%	0.524	68%	0.677	S	S	.	*			trans	-110.7	89.1	151.6	-81.8	105.8	0	0	0	110.9	T989	L987-T989 HydrophobicContact CD2-CG2 4.3Å; L987-T989 PolarHBondContact O-N 2.88Å
988	R	26.6	Very low	31	Very low	257 Å²	257	121.9 Å²	121.9	97%	0.97	66%	0.655	S	S	*	*			trans	-74.7	60.9	163.1	-81.8	-168	173.2	-162.4	0.5	111
989	T	33.3	Very low	31.3	Very low	91 Å²	91	122.5 Å²	122.5	56%	0.558	66%	0.659	S	S	*	*			trans	-100.3	84.1	171.8	46.9	0	0	0	0	110.4	L987 K991	L987-T989 HydrophobicContact CD2-CG2 4.3Å; L987-T989 PolarHBondContact O-N 2.88Å; T989-K991 PolarHBondContact O-N 2.79Å
990	N	29.8	Very low	31.8	Very low	99 Å²	99	126.8 Å²	126.8	53%	0.529	66%	0.661	S	S	.	*			trans	26	84.2	165.2	-78.2	-23.1	0	0	0	117.3	A992 L993	N990-A992 PolarHBondContact O-N 3.4Å; N990-A992 VanDerWaalsContact O-N 3.16Å; N990-L993 HydrophobicContact CB-CB 3.89Å; N990-L993 HydrophobicContact CB-CD1 3.89Å; N990-L993 HydrophobicContact CB-CG 3.89Å; N990-L993 PolarHBondContact O-N 3.47Å
991	K	34.7	Very low	32	Very low	171 Å²	171	128 Å²	128	74%	0.743	66%	0.664	S	S	*	*	H	α-helix	trans	-52.7	-29.9	158.4	-169.6	172.7	-177.7	176.8	0	111.5	T989 L994 N995	T989-K991 PolarHBondContact O-N 2.79Å; K991-L994 PolarHBondContact O-N 2.61Å; K991-N995 PolarHBondContact O-N 3Å; K991-N995 PolarHBondContact O-OD1 3.27Å
992	A	33.6	Very low	32.2	Very low	61 Å²	61	126.2 Å²	126.2	50%	0.504	66%	0.662	S	S	.	*	H	α-helix	trans	-58.1	-42.8	170.3	0	0	0	0	0	113.6	N990 N995 T996	N990-A992 PolarHBondContact O-N 3.4Å; N990-A992 VanDerWaalsContact O-N 3.16Å; A992-N995 PolarHBondContact O-N 3Å; A992-T996 WeakPolarHBondContact O-CB 3.42Å; A992-T996 PolarHBondContact O-N 3.06Å; A992-T996 PolarHBondContact O-OG1 3.05Å
993	L	33.5	Very low	32.8	Very low	96 Å²	96	119.5 Å²	119.5	50%	0.503	65%	0.645	S	S	.	*	H	α-helix	trans	-67.2	-40.2	-179.5	-85.7	171.8	0	0	0	111.9	N990 N995 T996 L997	N990-L993 HydrophobicContact CB-CB 3.89Å; N990-L993 HydrophobicContact CB-CD1 3.89Å; N990-L993 HydrophobicContact CB-CG 3.89Å; N990-L993 PolarHBondContact O-N 3.47Å; L993-N995 VanDerWaalsContact C-N 3.31Å; L993-N995 PolarHBondContact O-N 2.89Å; L993-T996 PolarHBondContact O-N 2.84Å; L993-L997 HydrophobicContact CB-CD1 4.44Å; L993-L997 HydrophobicContact CD2-CD1 3.75Å; L993-L997 VanDerWaalsContact O-CD1 3.23Å; L993-L997 WeakPolarHBondContact O-CD1 3.38Å; L993-L997 PolarHBondContact O-N 3.35Å
994	L	32.3	Very low	33.4	Very low	72 Å²	72	122.6 Å²	122.6	38%	0.377	65%	0.654	S	S	.	*	H	α-helix	trans	-60.4	-41.5	174.1	-72.9	174	0	0	0	111.7	K991 I998 L1034	K991-L994 PolarHBondContact O-N 2.61Å; L994-I998 VanDerWaalsContact O-CG1 3.29Å; L994-I998 WeakPolarHBondContact O-CG1 3.48Å; L994-I998 PolarHBondContact O-N 3.45Å; L994-L1034 HydrophobicContact CD2-CD2 3.74Å
995	N	35.8	Very low	34.7	Very low	111 Å²	111	127.3 Å²	127.3	59%	0.594	67%	0.669	S	S	*	*	H	α-helix	trans	-73.9	-27.4	176.1	-78.6	50.6	0	0	0	113.7	K991 A992 L993	K991-N995 PolarHBondContact O-N 3Å; K991-N995 PolarHBondContact O-OD1 3.27Å; A992-N995 PolarHBondContact O-N 3Å; L993-N995 VanDerWaalsContact C-N 3.31Å; L993-N995 PolarHBondContact O-N 2.89Å
996	T	39.6	Very low	36.3	Very low	96 Å²	96	120.8 Å²	120.8	59%	0.589	65%	0.648	S	S	*	*	H	α-helix	trans	-84.2	-30.5	-179.5	-54.5	0	0	0	0	113.3	A992 L993	A992-T996 WeakPolarHBondContact O-CB 3.42Å; A992-T996 PolarHBondContact O-N 3.06Å; A992-T996 PolarHBondContact O-OG1 3.05Å; L993-T996 PolarHBondContact O-N 2.84Å
997	L	35.8	Very low	38.6	Very low	100 Å²	100	120 Å²	120	52%	0.524	63%	0.628	S	S	.	*	H	α-helix	trans	-81.3	-15	175.4	-84.5	82.1	0	0	0	113.4	L993	L993-L997 HydrophobicContact CB-CD1 4.44Å; L993-L997 HydrophobicContact CD2-CD1 3.75Å; L993-L997 VanDerWaalsContact O-CD1 3.23Å; L993-L997 WeakPolarHBondContact O-CD1 3.38Å; L993-L997 PolarHBondContact O-N 3.35Å
998	I	40.5	Very low	40.6	Very low	79 Å²	79	117.2 Å²	117.2	41%	0.405	62%	0.616	S	S	.	*			trans	-109.7	52.3	-179.9	-47.4	174.2	0	0	0	110.1	L994 Y1000	L994-I998 VanDerWaalsContact O-CG1 3.29Å; L994-I998 WeakPolarHBondContact O-CG1 3.48Å; L994-I998 PolarHBondContact O-N 3.45Å; I998-Y1000 PolarHBondContact O-N 2.71Å
999	N	32.5	Very low	43	Very low	147 Å²	147	107.8 Å²	107.8	79%	0.786	58%	0.583	S	S	*	*			trans	-85.7	83.7	157.1	-83.8	-12.2	0	0	0	108
1000	Y	36.2	Very low	45.3	Very low	205 Å²	205	107.5 Å²	107.5	80%	0.804	58%	0.578	S	S	*	*			trans	-119.7	139.7	166.8	-150.6	-89.2	0	0	0	109	I998	I998-Y1000 PolarHBondContact O-N 2.71Å
1001	D	34.3	Very low	47.8	Very low	134 Å²	134	104.7 Å²	104.7	72%	0.717	56%	0.563	S	S	*	*			trans	-71.6	126.3	-168.2	-161.6	13.8	0	0	0	111.1	G1003	D1001-G1003 PolarHBondContact O-N 3.05Å
1002	P	33	Very low	50.3	Low	132 Å²	132	96.6 Å²	96.6	86%	0.857	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	60.8	175.2	33.6	-36.4	0	0	0	111
1003	G	37.2	Very low	52.7	Low	55 Å²	55	96.3 Å²	96.3	57%	0.567	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-34	-171.1	0	0	0	0	0	116	D1001	D1001-G1003 PolarHBondContact O-N 3.05Å
1004	D	39.5	Very low	55.2	Low	163 Å²	163	95.4 Å²	95.4	87%	0.872	52%	0.515	S	S	*	.			trans	-140.1	118.2	178.2	-89.1	-53.6	0	0	0	109.8	M1006	D1004-M1006 PolarHBondContact O-N 2.98Å; D1004-M1006 VanDerWaalsContact O-N 3.14Å
1005	E	54.4	Low	57.8	Low	202 Å²	202	92 Å²	92	94%	0.944	50%	0.497	S	S	*	.			trans	-81	89	174.1	-72.4	-166.7	136.3	0	0	110.7
1006	M	64.2	Low	60.3	Low	86 Å²	86	87.8 Å²	87.8	42%	0.424	48%	0.475	S	S	.	.			trans	-63.8	137.3	167	-171.6	161.1	77.1	0	0	110	D1004 D1010 I1011 E1014	D1004-M1006 PolarHBondContact O-N 2.98Å; D1004-M1006 VanDerWaalsContact O-N 3.14Å; M1006-D1010 HydrophobicContact CE-CB 4.48Å; M1006-D1010 HydrophobicContact CG-CB 3.63Å; M1006-D1010 HydrophobicContact SD-CB 4.07Å; M1006-I1011 HydrophobicContact CB-CD1 4.41Å; M1006-I1011 HydrophobicContact CB-CG1 4.04Å; M1006-I1011 HydrophobicContact CE-CB 4.32Å; M1006-I1011 HydrophobicContact CE-CG1 3.67Å; M1006-I1011 HydrophobicContact CG-CG1 4.18Å; M1006-I1011 WeakPolarHBondContact O-CD1 3.48Å; M1006-E1014 HydrophobicContact CE-CB 4.35Å
1007	P	73.6	Confident	62.5	Low	62 Å²	62	89.9 Å²	89.9	40%	0.403	48%	0.478	S	S	.	.			trans	-54.5	146.8	-179.4	-29.6	36.3	0	0	0	113.6	E1009 D1010 I1011	P1007-E1009 PolarHBondContact O-N 2.69Å; P1007-E1009 VanDerWaalsContact O-N 3.16Å; P1007-D1010 HydrophobicContact CB-CB 4.41Å; P1007-D1010 WeakPolarHBondContact CD-OD2 3.41Å; P1007-D1010 WeakPolarHBondContact CG-OD2 3.44Å; P1007-D1010 PolarHBondContact O-N 2.92Å; P1007-I1011 WeakPolarHBondContact O-CG1 3.44Å; P1007-I1011 PolarHBondContact O-N 3.04Å
1008	P	72.5	Confident	64.8	Low	42 Å²	42	86.4 Å²	86.4	27%	0.273	46%	0.459	S	S	.	.	H	α-helix	trans	-55	-35.8	178.3	-26.6	35.7	0	0	0	113.3	I1011 M1012 V1044 I1045	P1008-I1011 PolarHBondContact O-N 3.19Å; P1008-M1012 WeakPolarHBondContact O-CB 2.79Å; P1008-M1012 PolarHBondContact O-N 2.96Å; P1008-V1044 HydrophobicContact CB-CG1 4Å; P1008-V1044 HydrophobicContact CG-CG1 3.64Å; P1008-I1045 HydrophobicContact CB-CG1 4.35Å
1009	E	77.3	Confident	67	Low	60 Å²	60	82.7 Å²	82.7	28%	0.28	44%	0.44	S	S	.	.	H	α-helix	trans	-60	-45.1	175.6	-42.9	-51.4	129.3	0	0	112.5	P1007 M1012 S1013 N1047 Y1051	P1007-E1009 PolarHBondContact O-N 2.69Å; P1007-E1009 VanDerWaalsContact O-N 3.16Å; E1009-M1012 PolarHBondContact O-N 3.34Å; E1009-S1013 WeakPolarHBondContact O-CB 3.34Å; E1009-S1013 PolarHBondContact O-N 3.37Å; E1009-S1013 PolarHBondContact O-OG 3.08Å; E1009-N1047 PolarHBondContact OE2-ND2 2.66Å; E1009-N1047 PolarHBondContact OE2-OD1 3.39Å; E1009-Y1051 WeakPolarHBondContact CA-OH 3.09Å; E1009-Y1051 PolarHBondContact O-OH 2.7Å; E1009-Y1051 WeakPolarHBondContact OE2-CE2 3.33Å; E1009-Y1051 PolarHBondContact OE2-OH 2.9Å
1010	D	80.4	Confident	69.4	Low	84 Å²	84	78.4 Å²	78.4	45%	0.449	42%	0.422	S	S	.	.	H	α-helix	trans	-74	-38	179.9	-70.6	-38.4	0	0	0	110.8	M1006 P1007 M1012 S1013 E1014	M1006-D1010 HydrophobicContact CE-CB 4.48Å; M1006-D1010 HydrophobicContact CG-CB 3.63Å; M1006-D1010 HydrophobicContact SD-CB 4.07Å; P1007-D1010 HydrophobicContact CB-CB 4.41Å; P1007-D1010 WeakPolarHBondContact CD-OD2 3.41Å; P1007-D1010 WeakPolarHBondContact CG-OD2 3.44Å; P1007-D1010 PolarHBondContact O-N 2.92Å; D1010-M1012 VanDerWaalsContact C-N 3.35Å; D1010-S1013 PolarHBondContact O-N 2.67Å; D1010-E1014 PolarHBondContact O-N 2.77Å
1011	I	83.2	Confident	71.4	Confident	41 Å²	41	71.6 Å²	71.6	21%	0.21	40%	0.399	C	S	.	.	H	α-helix	trans	-62.8	-42.5	172.3	-61.9	169	0	0	0	110.4	M1006 P1007 P1008 S1013 E1014 I1015 L1039	M1006-I1011 HydrophobicContact CB-CD1 4.41Å; M1006-I1011 HydrophobicContact CB-CG1 4.04Å; M1006-I1011 HydrophobicContact CE-CB 4.32Å; M1006-I1011 HydrophobicContact CE-CG1 3.67Å; M1006-I1011 HydrophobicContact CG-CG1 4.18Å; M1006-I1011 WeakPolarHBondContact O-CD1 3.48Å; P1007-I1011 WeakPolarHBondContact O-CG1 3.44Å; P1007-I1011 PolarHBondContact O-N 3.04Å; P1008-I1011 PolarHBondContact O-N 3.19Å; I1011-S1013 VanDerWaalsContact C-N 3.3Å; I1011-S1013 PolarHBondContact O-N 3.19Å; I1011-E1014 PolarHBondContact O-N 2.85Å; I1011-I1015 HydrophobicContact CG2-CD1 3.85Å; I1011-I1015 HydrophobicContact CG2-CG1 4.48Å; I1011-I1015 WeakPolarHBondContact O-CB 3.37Å; I1011-I1015 VanDerWaalsContact O-CG1 3.25Å; I1011-I1015 WeakPolarHBondContact O-CG1 3.42Å; I1011-I1015 PolarHBondContact O-N 2.83Å; I1011-L1039 HydrophobicContact CG2-CD1 3.78Å
1012	M	86.2	Confident	73	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-66.4	-35.9	177.4	-167.8	55.9	178.2	0	0	111.6	P1008 E1009 D1010 I1015 L1016 L1036 I1045 W1048 Y1051 T1055	P1008-M1012 WeakPolarHBondContact O-CB 2.79Å; P1008-M1012 PolarHBondContact O-N 2.96Å; E1009-M1012 PolarHBondContact O-N 3.34Å; D1010-M1012 VanDerWaalsContact C-N 3.35Å; M1012-I1015 PolarHBondContact O-N 3.21Å; M1012-L1016 HydrophobicContact CE-CD1 4.23Å; M1012-L1016 HydrophobicContact CE-CD2 4.38Å; M1012-L1016 HydrophobicContact CE-CG 4.21Å; M1012-L1016 HydrophobicContact CG-CD1 4.27Å; M1012-L1016 WeakPolarHBondContact O-CB 3.35Å; M1012-L1016 WeakPolarHBondContact O-CG 3.48Å; M1012-L1016 PolarHBondContact O-N 2.81Å; M1012-L1036 HydrophobicContact CE-CD1 3.84Å; M1012-L1036 HydrophobicContact SD-CD1 3.67Å; M1012-I1045 HydrophobicContact CB-CD1 3.89Å; M1012-I1045 HydrophobicContact CG-CD1 3.82Å; M1012-I1045 HydrophobicContact SD-CD1 3.61Å; M1012-W1048 HydrophobicContact CE-CH2 3.85Å; M1012-W1048 HydrophobicContact CE-CZ3 3.75Å; M1012-Y1051 HydrophobicContact CB-CD1 4.41Å; M1012-Y1051 HydrophobicContact CB-CD2 4.41Å; M1012-Y1051 HydrophobicContact CB-CE1 4.26Å; M1012-Y1051 HydrophobicContact CB-CE2 4.25Å; M1012-Y1051 HydrophobicContact CB-CG 4.48Å; M1012-Y1051 HydrophobicContact CE-CG 4.36Å; M1012-Y1051 HydrophobicContact CG-CD1 3.67Å; M1012-Y1051 HydrophobicContact CG-CD2 3.83Å; M1012-Y1051 HydrophobicContact CG-CE1 4.02Å; M1012-Y1051 HydrophobicContact CG-CE2 4.15Å; M1012-Y1051 HydrophobicContact CG-CG 3.56Å; M1012-T1055 HydrophobicContact CE-CG2 4.27Å; M1012-T1055 WeakPolarHBondContact CE-OG1 3.45Å
1013	S	85.3	Confident	74.1	Confident	55 Å²	55	67.1 Å²	67.1	39%	0.385	37%	0.367	S	S	.	.	H	α-helix	trans	-67.1	-42.8	174.8	-58.8	0	0	0	0	112.5	E1009 D1010 I1011 L1016 Q1017	E1009-S1013 WeakPolarHBondContact O-CB 3.34Å; E1009-S1013 PolarHBondContact O-N 3.37Å; E1009-S1013 PolarHBondContact O-OG 3.08Å; D1010-S1013 PolarHBondContact O-N 2.67Å; I1011-S1013 VanDerWaalsContact C-N 3.3Å; I1011-S1013 PolarHBondContact O-N 3.19Å; S1013-L1016 PolarHBondContact O-N 2.72Å; S1013-Q1017 VanDerWaalsContact O-CB 3.31Å; S1013-Q1017 WeakPolarHBondContact O-CB 3.39Å; S1013-Q1017 PolarHBondContact O-N 2.86Å
1014	E	85.6	Confident	75.4	Confident	78 Å²	78	73.7 Å²	73.7	36%	0.364	38%	0.382	S	S	.	.	H	α-helix	trans	-58.3	-47.9	171.5	-173.1	-150.9	-175.7	0	0	110.9	M1006 D1010 I1011 Q1017 E1018 K1035	M1006-E1014 HydrophobicContact CE-CB 4.35Å; D1010-E1014 PolarHBondContact O-N 2.77Å; I1011-E1014 PolarHBondContact O-N 2.85Å; E1014-Q1017 PolarHBondContact O-N 2.8Å; E1014-E1018 PolarHBondContact O-N 2.94Å; E1014-K1035 VanDerWaalsContact CD-NZ 3.25Å; E1014-K1035 IonicContact OE1-NZ 3.08Å; E1014-K1035 PolarHBondContact OE1-NZ 3.21Å; E1014-K1035 VanDerWaalsContact OE1-NZ 3.08Å; E1014-K1035 IonicContact OE2-NZ 2.66Å; E1014-K1035 PolarHBondContact OE2-NZ 3.38Å
1015	I	87.4	Confident	77.1	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-60.5	-49.9	179.2	-74.7	169.4	0	0	0	110.8	I1011 M1012 E1018 L1019 C1032 K1035 L1036 L1039	I1011-I1015 HydrophobicContact CG2-CD1 3.85Å; I1011-I1015 HydrophobicContact CG2-CG1 4.48Å; I1011-I1015 WeakPolarHBondContact O-CB 3.37Å; I1011-I1015 VanDerWaalsContact O-CG1 3.25Å; I1011-I1015 WeakPolarHBondContact O-CG1 3.42Å; I1011-I1015 PolarHBondContact O-N 2.83Å; M1012-I1015 PolarHBondContact O-N 3.21Å; I1015-E1018 PolarHBondContact O-N 3.11Å; I1015-L1019 HydrophobicContact CG2-CD1 3.63Å; I1015-L1019 HydrophobicContact CG2-CG 4.21Å; I1015-L1019 VanDerWaalsContact O-CB 3.28Å; I1015-L1019 WeakPolarHBondContact O-CB 3.49Å; I1015-L1019 WeakPolarHBondContact O-CG 3.41Å; I1015-L1019 PolarHBondContact O-N 2.97Å; I1015-C1032 HydrophobicContact CG1-CB 4.23Å; I1015-C1032 HydrophobicContact CG2-CB 4.32Å; I1015-K1035 HydrophobicContact CD1-CB 3.71Å; I1015-K1035 HydrophobicContact CD1-CD 4.26Å; I1015-K1035 HydrophobicContact CG1-CB 4.32Å; I1015-K1035 HydrophobicContact CG1-CD 4.21Å; I1015-L1036 HydrophobicContact CD1-CB 4.44Å; I1015-L1036 HydrophobicContact CG2-CB 4.2Å; I1015-L1036 HydrophobicContact CG2-CD1 4.47Å; I1015-L1036 HydrophobicContact CG2-CD2 4.02Å; I1015-L1036 HydrophobicContact CG2-CG 4.48Å; I1015-L1039 HydrophobicContact CD1-CD1 3.54Å
1016	L	87.6	Confident	78.2	Confident	22 Å²	22	69 Å²	69	12%	0.115	35%	0.345	C	S	.	.	H	α-helix	trans	-64.8	-40.5	-179.9	-74.6	172.3	0	0	0	112.2	M1012 S1013 S1020 Y1051 P1054 I1058	M1012-L1016 HydrophobicContact CE-CD1 4.23Å; M1012-L1016 HydrophobicContact CE-CD2 4.38Å; M1012-L1016 HydrophobicContact CE-CG 4.21Å; M1012-L1016 HydrophobicContact CG-CD1 4.27Å; M1012-L1016 WeakPolarHBondContact O-CB 3.35Å; M1012-L1016 WeakPolarHBondContact O-CG 3.48Å; M1012-L1016 PolarHBondContact O-N 2.81Å; S1013-L1016 PolarHBondContact O-N 2.72Å; L1016-S1020 PolarHBondContact O-N 3.45Å; L1016-S1020 VanDerWaalsContact O-N 3.11Å; L1016-Y1051 HydrophobicContact CD1-CD1 3.64Å; L1016-Y1051 HydrophobicContact CD1-CE1 4.41Å; L1016-Y1051 HydrophobicContact CD1-CG 4.44Å; L1016-P1054 HydrophobicContact CD1-CB 4.27Å; L1016-P1054 HydrophobicContact CD2-CB 4.22Å; L1016-I1058 HydrophobicContact CD2-CD1 4.1Å
1017	Q	86.1	Confident	79.1	Confident	141 Å²	141	68.2 Å²	68.2	66%	0.659	34%	0.34	S	S	*	.	H	α-helix	trans	-60.3	-49.3	175.9	-175.9	171.4	54.6	0	0	111	S1013 E1014 S1020	S1013-Q1017 VanDerWaalsContact O-CB 3.31Å; S1013-Q1017 WeakPolarHBondContact O-CB 3.39Å; S1013-Q1017 PolarHBondContact O-N 2.86Å; E1014-Q1017 PolarHBondContact O-N 2.8Å; Q1017-S1020 PolarHBondContact O-N 2.97Å; Q1017-S1020 PolarHBondContact O-OG 3.45Å
1018	E	84.5	Confident	79.6	Confident	26 Å²	26	69.8 Å²	69.8	12%	0.121	34%	0.342	C	S	.	.	H	α-helix	trans	-74.2	-33.5	-177.8	-169.5	66	166.9	0	0	112.9	E1014 I1015 S1020 N1021 R1025 Q1028 R1029	E1014-E1018 PolarHBondContact O-N 2.94Å; I1015-E1018 PolarHBondContact O-N 3.11Å; E1018-S1020 PolarHBondContact O-N 3.05Å; E1018-N1021 WeakPolarHBondContact O-CB 3.45Å; E1018-N1021 PolarHBondContact O-N 3.32Å; E1018-N1021 VanDerWaalsContact O-N 3.16Å; E1018-N1021 PolarHBondContact OE2-ND2 3.27Å; E1018-R1025 WeakPolarHBondContact OE1-CD 3.44Å; E1018-R1025 IonicContact OE1-CZ 3.89Å; E1018-R1025 IonicContact OE1-NE 2.81Å; E1018-R1025 IonicContact OE1-NH1 2.81Å; E1018-R1025 PolarHBondContact OE1-NH1 3.25Å; E1018-R1025 IonicContact OE2-CZ 2.72Å; E1018-R1025 IonicContact OE2-NH1 3.69Å; E1018-R1025 PolarHBondContact OE2-NH1 2.89Å; E1018-Q1028 HydrophobicContact CG-CB 3.97Å; E1018-Q1028 VanDerWaalsContact OE1-CB 3.25Å; E1018-Q1028 WeakPolarHBondContact OE1-CB 3.46Å; E1018-R1029 WeakPolarHBondContact O-CD 3.45Å; E1018-R1029 WeakPolarHBondContact O-CG 3.35Å
1019	L	85.4	Confident	80.4	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-62.1	-31.7	172.8	-72.3	178	0	0	0	112.6	I1015 N1021 R1029 C1032 M1033 L1036 I1058	I1015-L1019 HydrophobicContact CG2-CD1 3.63Å; I1015-L1019 HydrophobicContact CG2-CG 4.21Å; I1015-L1019 VanDerWaalsContact O-CB 3.28Å; I1015-L1019 WeakPolarHBondContact O-CB 3.49Å; I1015-L1019 WeakPolarHBondContact O-CG 3.41Å; I1015-L1019 PolarHBondContact O-N 2.97Å; L1019-N1021 VanDerWaalsContact C-N 3.25Å; L1019-N1021 PolarHBondContact O-N 3.25Å; L1019-R1029 HydrophobicContact CD2-CB 4.17Å; L1019-R1029 HydrophobicContact CD2-CG 4.42Å; L1019-R1029 WeakPolarHBondContact CD2-O 3.48Å; L1019-R1029 PolarHBondContact O-NE 3.01Å; L1019-C1032 HydrophobicContact CD2-CB 4.12Å; L1019-C1032 HydrophobicContact CG-CB 4.18Å; L1019-M1033 HydrophobicContact CD2-CE 4.07Å; L1019-M1033 HydrophobicContact CD2-CG 3.69Å; L1019-L1036 HydrophobicContact CD1-CD2 4.04Å; L1019-I1058 HydrophobicContact CB-CG2 3.78Å
1020	S	83.7	Confident	80.9	Confident	58 Å²	58	67.1 Å²	67.1	41%	0.406	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-11.9	176.3	78.1	0	0	0	0	114.7	L1016 Q1017 E1018 H1022	L1016-S1020 PolarHBondContact O-N 3.45Å; L1016-S1020 VanDerWaalsContact O-N 3.11Å; Q1017-S1020 PolarHBondContact O-N 2.97Å; Q1017-S1020 PolarHBondContact O-OG 3.45Å; E1018-S1020 PolarHBondContact O-N 3.05Å; S1020-H1022 PolarHBondContact O-CD2 3.31Å; S1020-H1022 PolarHBondContact O-N 3.46Å
1021	N	77.5	Confident	81.4	Confident	62 Å²	62	66.4 Å²	66.4	33%	0.332	32%	0.324	S	S	.	.			trans	-82	75.3	179.7	-75.1	-41.8	0	0	0	112.1	E1018 L1019 N1023 R1029	E1018-N1021 WeakPolarHBondContact O-CB 3.45Å; E1018-N1021 PolarHBondContact O-N 3.32Å; E1018-N1021 VanDerWaalsContact O-N 3.16Å; E1018-N1021 PolarHBondContact OE2-ND2 3.27Å; L1019-N1021 VanDerWaalsContact C-N 3.25Å; L1019-N1021 PolarHBondContact O-N 3.25Å; N1021-N1023 PolarHBondContact O-N 3.1Å; N1021-R1029 WeakPolarHBondContact O-CD 3.43Å
1022	H	68.1	Low	81.8	Confident	44 Å²	44	64.8 Å²	64.8	20%	0.204	32%	0.316	C	S	.	.			trans	-67.3	26	179.4	-72.2	-96.7	0	0	0	115.8	S1020 R1029 T1062 D1065	S1020-H1022 PolarHBondContact O-CD2 3.31Å; S1020-H1022 PolarHBondContact O-N 3.46Å; H1022-R1029 PolarHBondContact CE1-NH2 3.1Å; H1022-R1029 VanDerWaalsContact CE1-NH2 3.29Å; H1022-R1029 PolarHBondContact ND1-NH2 3.32Å; H1022-T1062 PolarHBondContact CE1-OG1 3.25Å; H1022-D1065 IonicContact CE1-OD1 2.69Å; H1022-D1065 IonicContact ND1-OD1 2.86Å; H1022-D1065 PolarHBondContact ND1-OD1 3.09Å; H1022-D1065 IonicContact ND1-OD2 2.72Å
1023	N	57.5	Low	82.1	Confident	128 Å²	128	64.8 Å²	64.8	68%	0.684	32%	0.316	S	S	*	.	S	Bend	trans	-126.9	121	177.8	-73.5	-51.7	0	0	0	111.7	N1021 R1025	N1021-N1023 PolarHBondContact O-N 3.1Å; N1023-R1025 PolarHBondContact O-N 3.48Å
1024	E	63	Low	82.4	Confident	193 Å²	193	63.6 Å²	63.6	90%	0.902	31%	0.305	S	S	*	.	S	Bend	trans	54.4	-21.5	167.9	-61	-171.4	155.4	0	0	119.4	Y1026	E1024-Y1026 VanDerWaalsContact C-N 3.28Å; E1024-Y1026 WeakPolarHBondContact O-CD1 3.39Å; E1024-Y1026 PolarHBondContact O-N 3.37Å
1025	R	75	Confident	82.7	Confident	123 Å²	123	63.1 Å²	63.1	46%	0.464	30%	0.302	S	S	.	.			trans	-85	49.6	-175	-62.7	-164.2	-173.7	178.9	2.6	114.2	E1018 N1023 E1027 Q1028 R1029	E1018-R1025 WeakPolarHBondContact OE1-CD 3.44Å; E1018-R1025 IonicContact OE1-CZ 3.89Å; E1018-R1025 IonicContact OE1-NE 2.81Å; E1018-R1025 IonicContact OE1-NH1 2.81Å; E1018-R1025 PolarHBondContact OE1-NH1 3.25Å; E1018-R1025 IonicContact OE2-CZ 2.72Å; E1018-R1025 IonicContact OE2-NH1 3.69Å; E1018-R1025 PolarHBondContact OE2-NH1 2.89Å; N1023-R1025 PolarHBondContact O-N 3.48Å; R1025-E1027 PolarHBondContact O-N 3.26Å; R1025-Q1028 VanDerWaalsContact CA-OE1 3.29Å; R1025-Q1028 HydrophobicContact CB-CB 4.2Å; R1025-Q1028 HydrophobicContact CB-CG 4.45Å; R1025-Q1028 PolarHBondContact O-N 3.21Å; R1025-Q1028 PolarHBondContact O-OE1 2.94Å; R1025-R1029 PolarHBondContact O-N 3.13Å
1026	Y	77.3	Confident	82.9	Confident	144 Å²	144	63.1 Å²	63.1	57%	0.565	30%	0.302	S	S	*	.	H	α-helix	trans	-64.4	-39.2	-173	65.7	-84.9	0	0	0	113.2	E1024 K1030	E1024-Y1026 VanDerWaalsContact C-N 3.28Å; E1024-Y1026 WeakPolarHBondContact O-CD1 3.39Å; E1024-Y1026 PolarHBondContact O-N 3.37Å; Y1026-K1030 WeakPolarHBondContact O-CB 3.25Å; Y1026-K1030 PolarHBondContact O-N 3.05Å
1027	E	83.6	Confident	83.1	Confident	68 Å²	68	62.9 Å²	62.9	32%	0.318	30%	0.301	S	S	.	.	H	α-helix	trans	-70.1	-34.5	176.6	-72.6	-57.2	151.3	0	0	113.1	R1025 K1030 T1031	R1025-E1027 PolarHBondContact O-N 3.26Å; E1027-K1030 VanDerWaalsContact CD-NZ 3.34Å; E1027-K1030 IonicContact OE1-NZ 3.14Å; E1027-K1030 PolarHBondContact OE1-NZ 2.87Å; E1027-K1030 VanDerWaalsContact OE2-CD 3.29Å; E1027-K1030 WeakPolarHBondContact OE2-CD 3.17Å; E1027-K1030 WeakPolarHBondContact OE2-CE 3.32Å; E1027-K1030 IonicContact OE2-NZ 2.7Å; E1027-K1030 PolarHBondContact OE2-NZ 3.49Å; E1027-K1030 VanDerWaalsContact OE2-NZ 3.14Å; E1027-T1031 WeakPolarHBondContact O-CB 3.42Å; E1027-T1031 PolarHBondContact O-N 3.38Å; E1027-T1031 PolarHBondContact O-OG1 2.96Å
1028	Q	85.2	Confident	83.3	Confident	95 Å²	95	61.6 Å²	61.6	44%	0.444	29%	0.293	S	S	.	.	H	α-helix	trans	-66.4	-48.1	174.7	-66.5	73.1	12.8	0	0	110.3	E1018 R1025 K1030 T1031 C1032	E1018-Q1028 HydrophobicContact CG-CB 3.97Å; E1018-Q1028 VanDerWaalsContact OE1-CB 3.25Å; E1018-Q1028 WeakPolarHBondContact OE1-CB 3.46Å; R1025-Q1028 VanDerWaalsContact CA-OE1 3.29Å; R1025-Q1028 HydrophobicContact CB-CB 4.2Å; R1025-Q1028 HydrophobicContact CB-CG 4.45Å; R1025-Q1028 PolarHBondContact O-N 3.21Å; R1025-Q1028 PolarHBondContact O-OE1 2.94Å; Q1028-K1030 VanDerWaalsContact C-N 3.34Å; Q1028-K1030 PolarHBondContact O-N 3.47Å; Q1028-T1031 CarbonylContact O-C 3.55Å; Q1028-T1031 WeakPolarHBondContact O-CA 3.42Å; Q1028-T1031 WeakPolarHBondContact O-CB 3.46Å; Q1028-T1031 PolarHBondContact O-N 2.89Å; Q1028-T1031 VanDerWaalsContact O-N 3.09Å; Q1028-C1032 PolarHBondContact O-N 2.65Å; Q1028-C1032 PolarHBondContact O-SG 2.97Å
1029	R	87.6	Confident	83.6	Confident	9 Å²	9	61.3 Å²	61.3	3%	0.034	29%	0.292	C	S	.	.	H	α-helix	trans	-61.7	-41.2	176.8	-72.8	178.1	56.9	-119.9	1.1	111.8	E1018 L1019 N1021 H1022 R1025 T1031 C1032 M1033 T1062 D1065	E1018-R1029 WeakPolarHBondContact O-CD 3.45Å; E1018-R1029 WeakPolarHBondContact O-CG 3.35Å; L1019-R1029 HydrophobicContact CD2-CB 4.17Å; L1019-R1029 HydrophobicContact CD2-CG 4.42Å; L1019-R1029 WeakPolarHBondContact CD2-O 3.48Å; L1019-R1029 PolarHBondContact O-NE 3.01Å; N1021-R1029 WeakPolarHBondContact O-CD 3.43Å; H1022-R1029 PolarHBondContact CE1-NH2 3.1Å; H1022-R1029 VanDerWaalsContact CE1-NH2 3.29Å; H1022-R1029 PolarHBondContact ND1-NH2 3.32Å; R1025-R1029 PolarHBondContact O-N 3.13Å; R1029-T1031 PolarHBondContact O-N 3.14Å; R1029-C1032 PolarHBondContact O-N 3.47Å; R1029-M1033 WeakPolarHBondContact O-CG 3.43Å; R1029-M1033 PolarHBondContact O-N 3.21Å; R1029-T1062 VanDerWaalsContact NH2-CG2 3.3Å; R1029-T1062 PolarHBondContact NH2-OG1 3.48Å; R1029-D1065 IonicContact CZ-OD2 3.58Å; R1029-D1065 VanDerWaalsContact CZ-OD2 3.23Å; R1029-D1065 IonicContact NH1-OD2 3.77Å; R1029-D1065 PolarHBondContact NH1-OD2 2.85Å; R1029-D1065 IonicContact NH2-OD1 3.06Å; R1029-D1065 IonicContact NH2-OD2 3.97Å; R1029-D1065 PolarHBondContact NH2-OD2 2.99Å
1030	K	89.6	Confident	83.7	Confident	37 Å²	37	61.8 Å²	61.8	16%	0.161	29%	0.294	C	S	.	.	H	α-helix	trans	-59.5	-41.2	171	172	170.1	155.3	-171.1	0	112.6	Y1026 E1027 Q1028 M1033 L1034 E1069 L1073	Y1026-K1030 WeakPolarHBondContact O-CB 3.25Å; Y1026-K1030 PolarHBondContact O-N 3.05Å; E1027-K1030 VanDerWaalsContact CD-NZ 3.34Å; E1027-K1030 IonicContact OE1-NZ 3.14Å; E1027-K1030 PolarHBondContact OE1-NZ 2.87Å; E1027-K1030 VanDerWaalsContact OE2-CD 3.29Å; E1027-K1030 WeakPolarHBondContact OE2-CD 3.17Å; E1027-K1030 WeakPolarHBondContact OE2-CE 3.32Å; E1027-K1030 IonicContact OE2-NZ 2.7Å; E1027-K1030 PolarHBondContact OE2-NZ 3.49Å; E1027-K1030 VanDerWaalsContact OE2-NZ 3.14Å; Q1028-K1030 VanDerWaalsContact C-N 3.34Å; Q1028-K1030 PolarHBondContact O-N 3.47Å; K1030-M1033 PolarHBondContact O-N 3.1Å; K1030-L1034 WeakPolarHBondContact O-CG 3.26Å; K1030-L1034 PolarHBondContact O-N 3.3Å; K1030-L1034 VanDerWaalsContact O-N 3.08Å; K1030-E1069 IonicContact NZ-OE2 2.72Å; K1030-E1069 PolarHBondContact NZ-OE2 3.3Å; K1030-L1073 HydrophobicContact CB-CD2 4.22Å; K1030-L1073 HydrophobicContact CG-CD2 3.87Å; K1030-L1073 WeakPolarHBondContact O-CD2 3.47Å
1031	T	89.6	Confident	84	Confident	69 Å²	69	65.7 Å²	65.7	42%	0.423	30%	0.3	S	S	.	.	H	α-helix	trans	-66	-43.8	174.4	-57.2	0	0	0	0	111.7	E1027 Q1028 R1029 M1033 L1034 K1035	E1027-T1031 WeakPolarHBondContact O-CB 3.42Å; E1027-T1031 PolarHBondContact O-N 3.38Å; E1027-T1031 PolarHBondContact O-OG1 2.96Å; Q1028-T1031 CarbonylContact O-C 3.55Å; Q1028-T1031 WeakPolarHBondContact O-CA 3.42Å; Q1028-T1031 WeakPolarHBondContact O-CB 3.46Å; Q1028-T1031 PolarHBondContact O-N 2.89Å; Q1028-T1031 VanDerWaalsContact O-N 3.09Å; R1029-T1031 PolarHBondContact O-N 3.14Å; T1031-M1033 PolarHBondContact O-N 3.48Å; T1031-L1034 PolarHBondContact O-N 2.91Å; T1031-L1034 VanDerWaalsContact O-N 3.15Å; T1031-K1035 PolarHBondContact O-N 3.2Å
1032	C	91.1	Very high	84.4	Confident	7 Å²	7	67.3 Å²	67.3	5%	0.047	31%	0.309	C	S	.	.	H	α-helix	trans	-65.6	-36	176.6	-68.6	0	0	0	0	112.6	I1015 L1019 Q1028 R1029 K1035 L1036	I1015-C1032 HydrophobicContact CG1-CB 4.23Å; I1015-C1032 HydrophobicContact CG2-CB 4.32Å; L1019-C1032 HydrophobicContact CD2-CB 4.12Å; L1019-C1032 HydrophobicContact CG-CB 4.18Å; Q1028-C1032 PolarHBondContact O-N 2.65Å; Q1028-C1032 PolarHBondContact O-SG 2.97Å; R1029-C1032 PolarHBondContact O-N 3.47Å; C1032-K1035 PolarHBondContact O-N 3.21Å; C1032-L1036 VanDerWaalsContact O-CB 3.26Å; C1032-L1036 WeakPolarHBondContact O-CB 3.49Å; C1032-L1036 PolarHBondContact O-N 3.15Å
1033	M	92.8	Very high	85.1	Confident	0 Å²	0	68 Å²	68	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64	-37.4	170.2	-71.1	-177.1	-175	0	0	112.8	L1019 R1029 K1030 T1031 L1036 I1037 L1059 T1062 T1070 L1073 A1074 V1077	L1019-M1033 HydrophobicContact CD2-CE 4.07Å; L1019-M1033 HydrophobicContact CD2-CG 3.69Å; R1029-M1033 WeakPolarHBondContact O-CG 3.43Å; R1029-M1033 PolarHBondContact O-N 3.21Å; K1030-M1033 PolarHBondContact O-N 3.1Å; T1031-M1033 PolarHBondContact O-N 3.48Å; M1033-L1036 PolarHBondContact O-N 2.97Å; M1033-I1037 WeakPolarHBondContact O-CG1 3.39Å; M1033-I1037 PolarHBondContact O-N 3.33Å; M1033-L1059 HydrophobicContact CE-CD2 4.19Å; M1033-T1062 HydrophobicContact CE-CG2 3.54Å; M1033-T1070 HydrophobicContact CE-CG2 3.89Å; M1033-L1073 HydrophobicContact CB-CD2 3.62Å; M1033-L1073 HydrophobicContact CB-CG 3.76Å; M1033-L1073 HydrophobicContact CG-CD2 4.39Å; M1033-L1073 HydrophobicContact CG-CG 4.4Å; M1033-L1073 HydrophobicContact SD-CB 3.83Å; M1033-L1073 HydrophobicContact SD-CD2 3.94Å; M1033-L1073 HydrophobicContact SD-CG 3.71Å; M1033-A1074 HydrophobicContact CE-CB 3.83Å; M1033-A1074 HydrophobicContact SD-CB 4.25Å; M1033-V1077 HydrophobicContact CB-CG2 3.65Å; M1033-V1077 HydrophobicContact CG-CG2 3.83Å; M1033-V1077 HydrophobicContact SD-CG2 4.32Å
1034	L	92.5	Very high	86.3	Confident	30 Å²	30	65.1 Å²	65.1	16%	0.157	32%	0.315	C	S	.	.	H	α-helix	trans	-69.8	-40.3	174.9	-70	174	0	0	0	112.1	L994 K1030 T1031 L1036 K1038 L1073	L994-L1034 HydrophobicContact CD2-CD2 3.74Å; K1030-L1034 WeakPolarHBondContact O-CG 3.26Å; K1030-L1034 PolarHBondContact O-N 3.3Å; K1030-L1034 VanDerWaalsContact O-N 3.08Å; T1031-L1034 PolarHBondContact O-N 2.91Å; T1031-L1034 VanDerWaalsContact O-N 3.15Å; L1034-L1036 VanDerWaalsContact C-N 3.32Å; L1034-L1036 PolarHBondContact O-N 3.36Å; L1034-K1038 PolarHBondContact O-N 3.49Å; L1034-K1038 VanDerWaalsContact O-N 3.12Å; L1034-L1073 HydrophobicContact CD2-CD1 4Å; L1034-L1073 HydrophobicContact CD2-CD2 4.41Å; L1034-L1073 HydrophobicContact CG-CD2 4.18Å
1035	K	90.7	Very high	87.1	Confident	69 Å²	69	56.2 Å²	56.2	30%	0.3	27%	0.273	S	S	.	.	H	α-helix	trans	-55.1	-48.3	167.9	-73.8	-179.7	170.2	178.5	0	110.1	E1014 I1015 T1031 C1032 K1038 L1039	E1014-K1035 VanDerWaalsContact CD-NZ 3.25Å; E1014-K1035 IonicContact OE1-NZ 3.08Å; E1014-K1035 PolarHBondContact OE1-NZ 3.21Å; E1014-K1035 VanDerWaalsContact OE1-NZ 3.08Å; E1014-K1035 IonicContact OE2-NZ 2.66Å; E1014-K1035 PolarHBondContact OE2-NZ 3.38Å; I1015-K1035 HydrophobicContact CD1-CB 3.71Å; I1015-K1035 HydrophobicContact CD1-CD 4.26Å; I1015-K1035 HydrophobicContact CG1-CB 4.32Å; I1015-K1035 HydrophobicContact CG1-CD 4.21Å; T1031-K1035 PolarHBondContact O-N 3.2Å; C1032-K1035 PolarHBondContact O-N 3.21Å; K1035-K1038 WeakPolarHBondContact O-CA 3.44Å; K1035-K1038 WeakPolarHBondContact O-CB 3.05Å; K1035-K1038 PolarHBondContact O-N 3.48Å; K1035-K1038 VanDerWaalsContact O-N 3.1Å; K1035-L1039 WeakPolarHBondContact O-CG 3.26Å; K1035-L1039 PolarHBondContact O-N 3.34Å
1036	L	92	Very high	87.2	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66	-40.5	-176.8	-172.4	52.9	0	0	0	113.2	M1012 I1015 L1019 C1032 M1033 L1034 K1038 L1039 L1040 W1048 T1055 V1077	M1012-L1036 HydrophobicContact CE-CD1 3.84Å; M1012-L1036 HydrophobicContact SD-CD1 3.67Å; I1015-L1036 HydrophobicContact CD1-CB 4.44Å; I1015-L1036 HydrophobicContact CG2-CB 4.2Å; I1015-L1036 HydrophobicContact CG2-CD1 4.47Å; I1015-L1036 HydrophobicContact CG2-CD2 4.02Å; I1015-L1036 HydrophobicContact CG2-CG 4.48Å; L1019-L1036 HydrophobicContact CD1-CD2 4.04Å; C1032-L1036 VanDerWaalsContact O-CB 3.26Å; C1032-L1036 WeakPolarHBondContact O-CB 3.49Å; C1032-L1036 PolarHBondContact O-N 3.15Å; M1033-L1036 PolarHBondContact O-N 2.97Å; L1034-L1036 VanDerWaalsContact C-N 3.32Å; L1034-L1036 PolarHBondContact O-N 3.36Å; L1036-K1038 VanDerWaalsContact C-N 3.27Å; L1036-K1038 PolarHBondContact O-N 2.96Å; L1036-L1039 PolarHBondContact O-N 2.97Å; L1036-L1040 HydrophobicContact CG-CD1 4.37Å; L1036-L1040 WeakPolarHBondContact O-CB 3.43Å; L1036-L1040 WeakPolarHBondContact O-CG 3.19Å; L1036-L1040 PolarHBondContact O-N 3.17Å; L1036-W1048 HydrophobicContact CD1-CH2 3.99Å; L1036-T1055 HydrophobicContact CD2-CG2 3.95Å; L1036-V1077 HydrophobicContact CB-CG1 4.45Å; L1036-V1077 HydrophobicContact CD2-CG1 3.65Å; L1036-V1077 HydrophobicContact CG-CG1 3.82Å
1037	I	92.4	Very high	87.4	Confident	17 Å²	17	50.5 Å²	50.5	9%	0.087	27%	0.27	C	S	.	.	H	α-helix	trans	-60.1	-37.2	170.7	-78.8	162.6	0	0	0	111.5	M1033 R1041 L1073 R1076 V1077 E1080	M1033-I1037 WeakPolarHBondContact O-CG1 3.39Å; M1033-I1037 PolarHBondContact O-N 3.33Å; I1037-R1041 WeakPolarHBondContact O-CG 3.31Å; I1037-R1041 PolarHBondContact O-N 3.38Å; I1037-L1073 HydrophobicContact CD1-CD1 3.78Å; I1037-R1076 HydrophobicContact CD1-CB 4.08Å; I1037-V1077 HydrophobicContact CD1-CG2 3.9Å; I1037-V1077 HydrophobicContact CG1-CB 4.36Å; I1037-V1077 HydrophobicContact CG1-CG2 3.95Å; I1037-E1080 HydrophobicContact CG1-CG 4.16Å; I1037-E1080 HydrophobicContact CG2-CG 4.21Å
1038	K	90.9	Very high	87.6	Confident	114 Å²	114	47.7 Å²	47.7	50%	0.496	26%	0.256	S	S	.	.	H	α-helix	trans	-67.1	-52.5	174.7	-176.5	-177.1	171.8	-168.8	0	110.8	L1034 K1035 L1036 L1040 R1041 D1042	L1034-K1038 PolarHBondContact O-N 3.49Å; L1034-K1038 VanDerWaalsContact O-N 3.12Å; K1035-K1038 WeakPolarHBondContact O-CA 3.44Å; K1035-K1038 WeakPolarHBondContact O-CB 3.05Å; K1035-K1038 PolarHBondContact O-N 3.48Å; K1035-K1038 VanDerWaalsContact O-N 3.1Å; L1036-K1038 VanDerWaalsContact C-N 3.27Å; L1036-K1038 PolarHBondContact O-N 2.96Å; K1038-L1040 VanDerWaalsContact C-N 3.26Å; K1038-L1040 PolarHBondContact O-N 3.05Å; K1038-R1041 PolarHBondContact O-N 3.01Å; K1038-D1042 WeakPolarHBondContact CE-OD2 3.39Å; K1038-D1042 WeakPolarHBondContact CG-OD2 3.11Å; K1038-D1042 WeakPolarHBondContact O-CB 3.5Å; K1038-D1042 PolarHBondContact O-N 3.41Å
1039	L	89	Confident	87.4	Confident	19 Å²	19	49.8 Å²	49.8	10%	0.099	27%	0.27	C	S	.	.	H	α-helix	trans	-57.3	-37.1	180	-67.6	167.7	0	0	0	113.1	I1011 I1015 K1035 L1036 G1043 V1044 I1045	I1011-L1039 HydrophobicContact CG2-CD1 3.78Å; I1015-L1039 HydrophobicContact CD1-CD1 3.54Å; K1035-L1039 WeakPolarHBondContact O-CG 3.26Å; K1035-L1039 PolarHBondContact O-N 3.34Å; L1036-L1039 PolarHBondContact O-N 2.97Å; L1039-G1043 PolarHBondContact O-N 3.2Å; L1039-G1043 VanDerWaalsContact O-N 3.09Å; L1039-V1044 HydrophobicContact CD2-CB 4.16Å; L1039-V1044 HydrophobicContact CD2-CG2 4.14Å; L1039-V1044 PolarHBondContact O-N 2.82Å; L1039-I1045 HydrophobicContact CB-CD1 4.32Å; L1039-I1045 HydrophobicContact CD1-CD1 4.27Å
1040	L	89.4	Confident	87.3	Confident	11 Å²	11	56 Å²	56	6%	0.058	30%	0.3	C	S	.	.	H	α-helix	trans	-66	-38.8	174.9	-83.9	165.8	0	0	0	113.4	L1036 K1038 W1048 V1077 E1080 L1081 A1084	L1036-L1040 HydrophobicContact CG-CD1 4.37Å; L1036-L1040 WeakPolarHBondContact O-CB 3.43Å; L1036-L1040 WeakPolarHBondContact O-CG 3.19Å; L1036-L1040 PolarHBondContact O-N 3.17Å; K1038-L1040 VanDerWaalsContact C-N 3.26Å; K1038-L1040 PolarHBondContact O-N 3.05Å; L1040-W1048 HydrophobicContact CD2-CH2 3.63Å; L1040-W1048 HydrophobicContact CD2-CZ2 3.33Å; L1040-W1048 HydrophobicContact CD2-CZ3 4.49Å; L1040-W1048 HydrophobicContact CG-CH2 3.98Å; L1040-W1048 HydrophobicContact CG-CZ2 3.88Å; L1040-V1077 HydrophobicContact CD1-CG1 4.19Å; L1040-E1080 HydrophobicContact CD1-CB 4.31Å; L1040-L1081 HydrophobicContact CD1-CB 4.03Å; L1040-L1081 HydrophobicContact CD1-CD1 4.3Å; L1040-L1081 HydrophobicContact CD2-CB 4.49Å; L1040-L1081 HydrophobicContact CD2-CD1 3.63Å; L1040-A1084 HydrophobicContact CD2-CB 4.23Å
1041	R	89.6	Confident	87.3	Confident	141 Å²	141	55.4 Å²	55.4	53%	0.532	30%	0.297	S	S	.	.	H	α-helix	trans	-80.2	-34.4	179.7	-73.3	174.1	172.8	175.8	0.6	113.1	I1037 K1038 G1043 E1080	I1037-R1041 WeakPolarHBondContact O-CG 3.31Å; I1037-R1041 PolarHBondContact O-N 3.38Å; K1038-R1041 PolarHBondContact O-N 3.01Å; R1041-G1043 VanDerWaalsContact C-N 3.25Å; R1041-E1080 IonicContact CZ-OE1 2.91Å; R1041-E1080 IonicContact CZ-OE2 3.78Å; R1041-E1080 VanDerWaalsContact NE-CD 3.27Å; R1041-E1080 IonicContact NE-OE1 3.47Å; R1041-E1080 IonicContact NE-OE2 2.71Å; R1041-E1080 PolarHBondContact NE-OE2 3.37Å; R1041-E1080 IonicContact NH2-OE1 2.69Å; R1041-E1080 PolarHBondContact NH2-OE1 2.7Å; R1041-E1080 IonicContact NH2-OE2 3.31Å; R1041-E1080 PolarHBondContact NH2-OE2 2.94Å
1042	D	85.4	Confident	87.4	Confident	96 Å²	96	52.6 Å²	52.6	51%	0.513	28%	0.279	S	S	.	.	H	α-helix	trans	-80.1	-10	178	-65.7	-1	0	0	0	111.5	K1038 V1044	K1038-D1042 WeakPolarHBondContact CE-OD2 3.39Å; K1038-D1042 WeakPolarHBondContact CG-OD2 3.11Å; K1038-D1042 WeakPolarHBondContact O-CB 3.5Å; K1038-D1042 PolarHBondContact O-N 3.41Å; D1042-V1044 VanDerWaalsContact C-N 3.34Å; D1042-V1044 HydrophobicContact CB-CG2 3.68Å; D1042-V1044 PolarHBondContact O-N 3.47Å
1043	G	83.2	Confident	87.3	Confident	58 Å²	58	57.8 Å²	57.8	60%	0.598	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	19.7	171.7	0	0	0	0	0	115.2	L1039 R1041	L1039-G1043 PolarHBondContact O-N 3.2Å; L1039-G1043 VanDerWaalsContact O-N 3.09Å; R1041-G1043 VanDerWaalsContact C-N 3.25Å
1044	V	81.5	Confident	87.2	Confident	68 Å²	68	60.4 Å²	60.4	41%	0.412	32%	0.317	S	S	.	.			trans	-73.6	-36.4	-163.5	-165.9	0	0	0	0	113.3	P1008 L1039 D1042	P1008-V1044 HydrophobicContact CB-CG1 4Å; P1008-V1044 HydrophobicContact CG-CG1 3.64Å; L1039-V1044 HydrophobicContact CD2-CB 4.16Å; L1039-V1044 HydrophobicContact CD2-CG2 4.14Å; L1039-V1044 PolarHBondContact O-N 2.82Å; D1042-V1044 VanDerWaalsContact C-N 3.34Å; D1042-V1044 HydrophobicContact CB-CG2 3.68Å; D1042-V1044 PolarHBondContact O-N 3.47Å
1045	I	80.2	Confident	87.2	Confident	5 Å²	5	59 Å²	59	3%	0.026	31%	0.31	C	S	.	.			trans	-85.2	124.4	-179.7	-62.1	166.8	0	0	0	108.7	P1008 M1012 L1039 W1048 Y1051	P1008-I1045 HydrophobicContact CB-CG1 4.35Å; M1012-I1045 HydrophobicContact CB-CD1 3.89Å; M1012-I1045 HydrophobicContact CG-CD1 3.82Å; M1012-I1045 HydrophobicContact SD-CD1 3.61Å; L1039-I1045 HydrophobicContact CB-CD1 4.32Å; L1039-I1045 HydrophobicContact CD1-CD1 4.27Å; I1045-W1048 HydrophobicContact CB-CZ2 4.04Å; I1045-W1048 HydrophobicContact CD1-CH2 4.33Å; I1045-W1048 HydrophobicContact CD1-CZ2 3.94Å; I1045-W1048 HydrophobicContact CG2-CD2 4.2Å; I1045-W1048 HydrophobicContact CG2-CG 4.27Å; I1045-W1048 HydrophobicContact CG2-CZ2 4.25Å; I1045-W1048 PolarHBondContact O-NE1 2.89Å; I1045-Y1051 HydrophobicContact CG2-CD2 4.07Å
1046	S	77.3	Confident	87.3	Confident	102 Å²	102	55.7 Å²	55.7	71%	0.713	30%	0.296	S	S	*	.			trans	-102	-37.7	-175.7	61.4	0	0	0	0	113.5	W1048	S1046-W1048 VanDerWaalsContact C-N 3.33Å; S1046-W1048 PolarHBondContact O-N 2.83Å
1047	N	82.1	Confident	87.3	Confident	46 Å²	46	58.1 Å²	58.1	25%	0.246	31%	0.308	C	S	.	.			trans	-87.7	48.2	-176.7	61.5	-25	0	0	0	113.5	E1009 D1049 E1050	E1009-N1047 PolarHBondContact OE2-ND2 2.66Å; E1009-N1047 PolarHBondContact OE2-OD1 3.39Å; N1047-D1049 PolarHBondContact O-N 3.21Å; N1047-E1050 PolarHBondContact O-N 3.49Å
1048	W	87	Confident	87.2	Confident	9 Å²	9	58.5 Å²	58.5	3%	0.034	31%	0.311	C	S	.	.	H	α-helix	trans	-57.8	-21.2	-176.4	-84.5	92.9	0	0	0	114.9	M1012 L1036 L1040 I1045 S1046 E1050 Y1051 F1052 T1055 L1081 K1085 L1088	M1012-W1048 HydrophobicContact CE-CH2 3.85Å; M1012-W1048 HydrophobicContact CE-CZ3 3.75Å; L1036-W1048 HydrophobicContact CD1-CH2 3.99Å; L1040-W1048 HydrophobicContact CD2-CH2 3.63Å; L1040-W1048 HydrophobicContact CD2-CZ2 3.33Å; L1040-W1048 HydrophobicContact CD2-CZ3 4.49Å; L1040-W1048 HydrophobicContact CG-CH2 3.98Å; L1040-W1048 HydrophobicContact CG-CZ2 3.88Å; I1045-W1048 HydrophobicContact CB-CZ2 4.04Å; I1045-W1048 HydrophobicContact CD1-CH2 4.33Å; I1045-W1048 HydrophobicContact CD1-CZ2 3.94Å; I1045-W1048 HydrophobicContact CG2-CD2 4.2Å; I1045-W1048 HydrophobicContact CG2-CG 4.27Å; I1045-W1048 HydrophobicContact CG2-CZ2 4.25Å; I1045-W1048 PolarHBondContact O-NE1 2.89Å; S1046-W1048 VanDerWaalsContact C-N 3.33Å; S1046-W1048 PolarHBondContact O-N 2.83Å; W1048-E1050 PolarHBondContact O-N 3.21Å; W1048-Y1051 PolarHBondContact O-N 3.37Å; W1048-F1052 HydrophobicContact CE3-CB 4.43Å; W1048-F1052 WeakPolarHBondContact O-CA 3.45Å; W1048-F1052 WeakPolarHBondContact O-CB 3.26Å; W1048-F1052 PolarHBondContact O-N 3.49Å; W1048-T1055 HydrophobicContact CZ3-CG2 4.45Å; W1048-L1081 HydrophobicContact CE3-CD1 4.03Å; W1048-L1081 HydrophobicContact CH2-CD1 4.13Å; W1048-L1081 HydrophobicContact CZ3-CD1 3.78Å; W1048-K1085 HydrophobicContact CG-CG 4.4Å; W1048-L1088 HydrophobicContact CB-CD1 3.59Å; W1048-L1088 HydrophobicContact CG-CD1 4.24Å
1049	D	82.7	Confident	87.3	Confident	139 Å²	139	53.1 Å²	53.1	74%	0.743	29%	0.287	S	S	*	.	H	α-helix	trans	-56.4	-32.5	179.2	-57.8	-51.2	0	0	0	113.5	N1047	N1047-D1049 PolarHBondContact O-N 3.21Å
1050	E	84.7	Confident	87.5	Confident	140 Å²	140	52.6 Å²	52.6	65%	0.654	28%	0.284	S	S	*	.	H	α-helix	trans	-79.8	-44.4	177.9	-174.6	161.1	-169.8	0	0	111.9	N1047 W1048 P1054	N1047-E1050 PolarHBondContact O-N 3.49Å; W1048-E1050 PolarHBondContact O-N 3.21Å; E1050-P1054 WeakPolarHBondContact O-CD 3.5Å
1051	Y	89.2	Confident	87.6	Confident	24 Å²	24	55 Å²	55	9%	0.094	30%	0.295	C	S	.	.	H	α-helix	trans	-87.1	-24.2	-173.7	-61.4	-60	0	0	0	115	E1009 M1012 L1016 I1045 W1048 K1053 P1054 T1055	E1009-Y1051 WeakPolarHBondContact CA-OH 3.09Å; E1009-Y1051 PolarHBondContact O-OH 2.7Å; E1009-Y1051 WeakPolarHBondContact OE2-CE2 3.33Å; E1009-Y1051 PolarHBondContact OE2-OH 2.9Å; M1012-Y1051 HydrophobicContact CB-CD1 4.41Å; M1012-Y1051 HydrophobicContact CB-CD2 4.41Å; M1012-Y1051 HydrophobicContact CB-CE1 4.26Å; M1012-Y1051 HydrophobicContact CB-CE2 4.25Å; M1012-Y1051 HydrophobicContact CB-CG 4.48Å; M1012-Y1051 HydrophobicContact CE-CG 4.36Å; M1012-Y1051 HydrophobicContact CG-CD1 3.67Å; M1012-Y1051 HydrophobicContact CG-CD2 3.83Å; M1012-Y1051 HydrophobicContact CG-CE1 4.02Å; M1012-Y1051 HydrophobicContact CG-CE2 4.15Å; M1012-Y1051 HydrophobicContact CG-CG 3.56Å; L1016-Y1051 HydrophobicContact CD1-CD1 3.64Å; L1016-Y1051 HydrophobicContact CD1-CE1 4.41Å; L1016-Y1051 HydrophobicContact CD1-CG 4.44Å; I1045-Y1051 HydrophobicContact CG2-CD2 4.07Å; W1048-Y1051 PolarHBondContact O-N 3.37Å; Y1051-K1053 PolarHBondContact O-N 2.97Å; Y1051-P1054 WeakPolarHBondContact O-CD 3.42Å; Y1051-T1055 VanDerWaalsContact O-CB 3.29Å; Y1051-T1055 WeakPolarHBondContact O-CB 3.31Å; Y1051-T1055 PolarHBondContact O-N 3.14Å; Y1051-T1055 PolarHBondContact O-OG1 3.5Å
1052	F	91.3	Very high	87.6	Confident	9 Å²	9	48.3 Å²	48.3	4%	0.039	27%	0.27	C	S	.	.	H	α-helix	trans	-60.7	-48.7	-170	172.6	-101.9	0	0	0	112.8	W1048 T1055 L1056 L1081 L1088 F1089 F1092	W1048-F1052 HydrophobicContact CE3-CB 4.43Å; W1048-F1052 WeakPolarHBondContact O-CA 3.45Å; W1048-F1052 WeakPolarHBondContact O-CB 3.26Å; W1048-F1052 PolarHBondContact O-N 3.49Å; F1052-T1055 WeakPolarHBondContact O-CB 3.45Å; F1052-T1055 PolarHBondContact O-N 3.19Å; F1052-L1056 HydrophobicContact CE1-CD2 3.88Å; F1052-L1056 HydrophobicContact CZ-CB 4.45Å; F1052-L1056 HydrophobicContact CZ-CD2 3.77Å; F1052-L1056 VanDerWaalsContact O-CB 3.3Å; F1052-L1056 WeakPolarHBondContact O-CB 3.39Å; F1052-L1056 PolarHBondContact O-N 3.04Å; F1052-L1081 HydrophobicContact CD2-CD1 4.22Å; F1052-L1081 HydrophobicContact CD2-CD2 4.01Å; F1052-L1081 HydrophobicContact CD2-CG 4.34Å; F1052-L1081 HydrophobicContact CE2-CD1 4.47Å; F1052-L1081 HydrophobicContact CE2-CD2 3.84Å; F1052-L1081 HydrophobicContact CE2-CG 4.13Å; F1052-L1088 HydrophobicContact CB-CD1 3.96Å; F1052-L1088 HydrophobicContact CD1-CB 3.86Å; F1052-L1088 HydrophobicContact CD2-CB 3.66Å; F1052-L1088 HydrophobicContact CD2-CD1 3.56Å; F1052-L1088 HydrophobicContact CD2-CG 4.26Å; F1052-L1088 HydrophobicContact CE1-CB 3.78Å; F1052-L1088 WeakPolarHBondContact CE1-O 3.39Å; F1052-L1088 HydrophobicContact CE2-CB 3.57Å; F1052-L1088 HydrophobicContact CE2-CD1 4.2Å; F1052-L1088 HydrophobicContact CG-CB 3.8Å; F1052-L1088 HydrophobicContact CG-CD1 3.8Å; F1052-L1088 HydrophobicContact CG-CG 4.37Å; F1052-L1088 HydrophobicContact CZ-CB 3.62Å; F1052-L1088 WeakPolarHBondContact CZ-O 3.5Å; F1052-F1089 HydrophobicContact CE2-CD1 4.45Å; F1052-F1089 AromaticContact CE2-CD2 3.98Å; F1052-F1089 HydrophobicContact CE2-CD2 3.98Å; F1052-F1089 HydrophobicContact CE2-CE1 4.18Å; F1052-F1089 AromaticContact CE2-CE2 3.64Å; F1052-F1089 HydrophobicContact CE2-CE2 3.64Å; F1052-F1089 HydrophobicContact CE2-CG 4.38Å; F1052-F1089 AromaticContact CE2-CZ 3.78Å; F1052-F1089 HydrophobicContact CE2-CZ 3.78Å; F1052-F1089 AromaticContact CZ-CD1 3.96Å; F1052-F1089 HydrophobicContact CZ-CD1 3.96Å; F1052-F1089 AromaticContact CZ-CD2 3.97Å; F1052-F1089 HydrophobicContact CZ-CD2 3.97Å; F1052-F1089 HydrophobicContact CZ-CE1 4.06Å; F1052-F1089 HydrophobicContact CZ-CE2 4.05Å; F1052-F1089 AromaticContact CZ-CG 3.95Å; F1052-F1089 HydrophobicContact CZ-CG 3.95Å; F1052-F1089 HydrophobicContact CZ-CZ 4.12Å; F1052-F1092 AromaticContact CE1-CD2 3.79Å; F1052-F1092 HydrophobicContact CE1-CD2 3.79Å; F1052-F1092 HydrophobicContact CE1-CE2 4.07Å
1053	K	89.9	Confident	87.9	Confident	116 Å²	116	45 Å²	45	50%	0.504	25%	0.252	S	S	.	.	H	α-helix	trans	-65.8	-46.1	-176.7	-176.4	177.4	-174.9	173.4	0	112.5	Y1051 L1057 F1092	Y1051-K1053 PolarHBondContact O-N 2.97Å; K1053-L1057 HydrophobicContact CG-CD1 4Å; K1053-L1057 WeakPolarHBondContact O-CB 3.47Å; K1053-L1057 VanDerWaalsContact O-CG 3.26Å; K1053-L1057 WeakPolarHBondContact O-CG 3.23Å; K1053-L1057 PolarHBondContact O-N 3.23Å; K1053-L1057 VanDerWaalsContact O-N 3.11Å; K1053-F1092 HydrophobicContact CD-CE1 4.46Å; K1053-F1092 HydrophobicContact CD-CZ 3.95Å; K1053-F1092 HydrophobicContact CG-CE1 4.3Å; K1053-F1092 HydrophobicContact CG-CZ 4Å
1054	P	90.6	Very high	88	Confident	55 Å²	55	45.1 Å²	45.1	36%	0.357	25%	0.254	S	S	.	.	H	α-helix	trans	-55.3	-48	167.5	-27.3	34.6	0	0	0	113.3	L1016 E1050 Y1051 L1056 L1057 I1058	L1016-P1054 HydrophobicContact CD1-CB 4.27Å; L1016-P1054 HydrophobicContact CD2-CB 4.22Å; E1050-P1054 WeakPolarHBondContact O-CD 3.5Å; Y1051-P1054 WeakPolarHBondContact O-CD 3.42Å; P1054-L1056 PolarHBondContact O-N 3.23Å; P1054-L1057 PolarHBondContact O-N 3.41Å; P1054-I1058 WeakPolarHBondContact O-CG1 3.36Å; P1054-I1058 PolarHBondContact O-N 2.92Å
1055	T	92.2	Very high	88.2	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-58.2	-51.9	-179	-56	0	0	0	0	111.6	M1012 L1036 W1048 Y1051 F1052 L1057 I1058 L1059 L1081	M1012-T1055 HydrophobicContact CE-CG2 4.27Å; M1012-T1055 WeakPolarHBondContact CE-OG1 3.45Å; L1036-T1055 HydrophobicContact CD2-CG2 3.95Å; W1048-T1055 HydrophobicContact CZ3-CG2 4.45Å; Y1051-T1055 VanDerWaalsContact O-CB 3.29Å; Y1051-T1055 WeakPolarHBondContact O-CB 3.31Å; Y1051-T1055 PolarHBondContact O-N 3.14Å; Y1051-T1055 PolarHBondContact O-OG1 3.5Å; F1052-T1055 WeakPolarHBondContact O-CB 3.45Å; F1052-T1055 PolarHBondContact O-N 3.19Å; T1055-L1057 PolarHBondContact O-N 2.79Å; T1055-I1058 PolarHBondContact O-N 3Å; T1055-L1059 HydrophobicContact CG2-CD1 3.68Å; T1055-L1059 HydrophobicContact CG2-CG 4.39Å; T1055-L1059 WeakPolarHBondContact O-CB 3.34Å; T1055-L1059 WeakPolarHBondContact O-CG 3.31Å; T1055-L1059 PolarHBondContact O-N 3.36Å; T1055-L1081 HydrophobicContact CG2-CD2 4.34Å
1056	L	93.6	Very high	88.4	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.1	-47.6	-179.3	179	61.8	0	0	0	111.1	F1052 P1054 L1059 L1060 L1078 F1089 F1092 F1096	F1052-L1056 HydrophobicContact CE1-CD2 3.88Å; F1052-L1056 HydrophobicContact CZ-CB 4.45Å; F1052-L1056 HydrophobicContact CZ-CD2 3.77Å; F1052-L1056 VanDerWaalsContact O-CB 3.3Å; F1052-L1056 WeakPolarHBondContact O-CB 3.39Å; F1052-L1056 PolarHBondContact O-N 3.04Å; P1054-L1056 PolarHBondContact O-N 3.23Å; L1056-L1059 PolarHBondContact O-N 3.4Å; L1056-L1060 HydrophobicContact CD1-CD1 3.82Å; L1056-L1060 HydrophobicContact CD1-CG 3.98Å; L1056-L1060 HydrophobicContact CG-CD1 3.91Å; L1056-L1060 HydrophobicContact CG-CG 4.39Å; L1056-L1060 VanDerWaalsContact O-CB 3.32Å; L1056-L1060 WeakPolarHBondContact O-CB 3.39Å; L1056-L1060 WeakPolarHBondContact O-CG 3.44Å; L1056-L1060 PolarHBondContact O-N 3.44Å; L1056-L1078 HydrophobicContact CD1-CD2 3.6Å; L1056-F1089 HydrophobicContact CD1-CE1 3.81Å; L1056-F1092 HydrophobicContact CD2-CB 3.65Å; L1056-F1092 HydrophobicContact CD2-CD1 3.97Å; L1056-F1092 HydrophobicContact CD2-CD2 4.34Å; L1056-F1092 HydrophobicContact CD2-CG 3.72Å; L1056-F1096 HydrophobicContact CD1-CD2 4.5Å
1057	L	91.3	Very high	88.8	Confident	50 Å²	50	47.6 Å²	47.6	26%	0.262	26%	0.264	S	S	.	.	H	α-helix	trans	-64.8	-45.2	-178	-69	171.5	0	0	0	112.1	L890 K1053 P1054 T1055 L1059 L1060 E1061	L890-L1057 HydrophobicContact CD2-CD2 3.95Å; K1053-L1057 HydrophobicContact CG-CD1 4Å; K1053-L1057 WeakPolarHBondContact O-CB 3.47Å; K1053-L1057 VanDerWaalsContact O-CG 3.26Å; K1053-L1057 WeakPolarHBondContact O-CG 3.23Å; K1053-L1057 PolarHBondContact O-N 3.23Å; K1053-L1057 VanDerWaalsContact O-N 3.11Å; P1054-L1057 PolarHBondContact O-N 3.41Å; T1055-L1057 PolarHBondContact O-N 2.79Å; L1057-L1059 PolarHBondContact O-N 2.8Å; L1057-L1060 PolarHBondContact O-N 2.75Å; L1057-E1061 WeakPolarHBondContact O-CB 3.27Å; L1057-E1061 PolarHBondContact O-N 2.79Å
1058	I	90.9	Very high	89.2	Confident	26 Å²	26	49.1 Å²	49.1	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-65.8	-39.9	178.5	-64.3	166.3	0	0	0	111.1	L1016 L1019 P1054 T1055 E1061 T1062	L1016-I1058 HydrophobicContact CD2-CD1 4.1Å; L1019-I1058 HydrophobicContact CB-CG2 3.78Å; P1054-I1058 WeakPolarHBondContact O-CG1 3.36Å; P1054-I1058 PolarHBondContact O-N 2.92Å; T1055-I1058 PolarHBondContact O-N 3Å; I1058-E1061 PolarHBondContact O-N 2.83Å; I1058-T1062 WeakPolarHBondContact O-CB 3.21Å; I1058-T1062 PolarHBondContact O-N 3.28Å; I1058-T1062 PolarHBondContact O-OG1 3.12Å
1059	L	93.3	Very high	89.4	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-66.1	-39	175.7	-70.8	171.4	0	0	0	112.2	M1033 T1055 L1056 L1057 T1062 L1063 A1074 V1077 L1078	M1033-L1059 HydrophobicContact CE-CD2 4.19Å; T1055-L1059 HydrophobicContact CG2-CD1 3.68Å; T1055-L1059 HydrophobicContact CG2-CG 4.39Å; T1055-L1059 WeakPolarHBondContact O-CB 3.34Å; T1055-L1059 WeakPolarHBondContact O-CG 3.31Å; T1055-L1059 PolarHBondContact O-N 3.36Å; L1056-L1059 PolarHBondContact O-N 3.4Å; L1057-L1059 PolarHBondContact O-N 2.8Å; L1059-T1062 PolarHBondContact O-N 3.3Å; L1059-L1063 PolarHBondContact O-N 2.62Å; L1059-A1074 HydrophobicContact CD2-CB 4.15Å; L1059-V1077 HydrophobicContact CD1-CB 3.88Å; L1059-V1077 HydrophobicContact CD1-CG1 3.48Å; L1059-V1077 VanDerWaalsContact CD1-CG1 3.48Å; L1059-V1077 HydrophobicContact CD2-CB 3.89Å; L1059-V1077 HydrophobicContact CD2-CG1 4.07Å; L1059-V1077 HydrophobicContact CD2-CG2 4.08Å; L1059-V1077 HydrophobicContact CG-CG1 4.43Å; L1059-L1078 HydrophobicContact CB-CD1 4.24Å; L1059-L1078 HydrophobicContact CB-CD2 3.86Å; L1059-L1078 HydrophobicContact CB-CG 3.99Å; L1059-L1078 HydrophobicContact CD1-CD2 3.84Å; L1059-L1078 HydrophobicContact CD1-CG 4.09Å
1060	L	93.4	Very high	89.8	Confident	8 Å²	8	47.1 Å²	47.1	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-70.4	-35.9	176.3	-72	-179.4	0	0	0	112.8	L1056 L1057 T1062 L1063 L1078 L1095 F1096 K1099	L1056-L1060 HydrophobicContact CD1-CD1 3.82Å; L1056-L1060 HydrophobicContact CD1-CG 3.98Å; L1056-L1060 HydrophobicContact CG-CD1 3.91Å; L1056-L1060 HydrophobicContact CG-CG 4.39Å; L1056-L1060 VanDerWaalsContact O-CB 3.32Å; L1056-L1060 WeakPolarHBondContact O-CB 3.39Å; L1056-L1060 WeakPolarHBondContact O-CG 3.44Å; L1056-L1060 PolarHBondContact O-N 3.44Å; L1057-L1060 PolarHBondContact O-N 2.75Å; L1060-T1062 VanDerWaalsContact C-N 3.34Å; L1060-L1063 HydrophobicContact CD2-CD1 3.9Å; L1060-L1063 WeakPolarHBondContact O-CB 3.36Å; L1060-L1063 PolarHBondContact O-N 3.21Å; L1060-L1078 HydrophobicContact CD2-CD1 3.95Å; L1060-L1095 HydrophobicContact CD1-CD1 4.47Å; L1060-L1095 HydrophobicContact CD1-CD2 3.72Å; L1060-L1095 HydrophobicContact CD1-CG 3.87Å; L1060-F1096 HydrophobicContact CD2-CD2 4.33Å; L1060-K1099 HydrophobicContact CD2-CB 3.56Å; L1060-K1099 HydrophobicContact CD2-CG 3.96Å
1061	E	89.9	Confident	90.2	Very high	61 Å²	61	41.5 Å²	41.5	29%	0.285	23%	0.23	S	C	.	.	H	α-helix	trans	-67.2	-37.3	171.3	-175	162	-163.1	0	0	111.2	L1057 I1058 L1063 G1064	L1057-E1061 WeakPolarHBondContact O-CB 3.27Å; L1057-E1061 PolarHBondContact O-N 2.79Å; I1058-E1061 PolarHBondContact O-N 2.83Å; E1061-L1063 PolarHBondContact O-N 3.2Å; E1061-L1063 VanDerWaalsContact O-N 3.15Å; E1061-G1064 PolarHBondContact O-N 2.86Å
1062	T	90	Very high	90.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.4	-16.3	175.1	-56.7	0	0	0	0	113.4	H1022 R1029 M1033 I1058 L1059 L1060 G1064 D1065 T1070 A1074	H1022-T1062 PolarHBondContact CE1-OG1 3.25Å; R1029-T1062 VanDerWaalsContact NH2-CG2 3.3Å; R1029-T1062 PolarHBondContact NH2-OG1 3.48Å; M1033-T1062 HydrophobicContact CE-CG2 3.54Å; I1058-T1062 WeakPolarHBondContact O-CB 3.21Å; I1058-T1062 PolarHBondContact O-N 3.28Å; I1058-T1062 PolarHBondContact O-OG1 3.12Å; L1059-T1062 PolarHBondContact O-N 3.3Å; L1060-T1062 VanDerWaalsContact C-N 3.34Å; T1062-G1064 PolarHBondContact O-N 2.94Å; T1062-D1065 WeakPolarHBondContact O-CB 3.47Å; T1062-D1065 PolarHBondContact O-N 3.32Å; T1062-T1070 HydrophobicContact CG2-CG2 3.61Å; T1062-A1074 HydrophobicContact CG2-CB 4.09Å
1063	L	91.3	Very high	90.7	Very high	27 Å²	27	41 Å²	41	14%	0.141	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-9.3	168.1	-55.2	-177.3	0	0	0	113.1	L1059 L1060 E1061 R1071 A1074 L1075 L1078 K1099	L1059-L1063 PolarHBondContact O-N 2.62Å; L1060-L1063 HydrophobicContact CD2-CD1 3.9Å; L1060-L1063 WeakPolarHBondContact O-CB 3.36Å; L1060-L1063 PolarHBondContact O-N 3.21Å; E1061-L1063 PolarHBondContact O-N 3.2Å; E1061-L1063 VanDerWaalsContact O-N 3.15Å; L1063-R1071 WeakPolarHBondContact O-CD 3.33Å; L1063-A1074 HydrophobicContact CD2-CB 3.92Å; L1063-L1075 HydrophobicContact CD1-CD2 4.12Å; L1063-L1075 HydrophobicContact CD2-CD1 4.45Å; L1063-L1075 HydrophobicContact CD2-CD2 3.8Å; L1063-L1075 HydrophobicContact CD2-CG 3.65Å; L1063-L1078 HydrophobicContact CD1-CD1 4.33Å; L1063-K1099 HydrophobicContact CD1-CB 4.15Å
1064	G	85.9	Confident	90.9	Very high	61 Å²	61	35.5 Å²	35.5	63%	0.629	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-7.9	171.3	0	0	0	0	0	115.2	E1061 T1062	E1061-G1064 PolarHBondContact O-N 2.86Å; T1062-G1064 PolarHBondContact O-N 2.94Å
1065	D	86.1	Confident	91.2	Very high	28 Å²	28	32.9 Å²	32.9	15%	0.15	19%	0.189	C	C	.	.	S	Bend	trans	-65.7	141.7	-179.2	-78	12.5	0	0	0	111.8	H1022 R1029 T1062 G1067 R1071	H1022-D1065 IonicContact CE1-OD1 2.69Å; H1022-D1065 IonicContact ND1-OD1 2.86Å; H1022-D1065 PolarHBondContact ND1-OD1 3.09Å; H1022-D1065 IonicContact ND1-OD2 2.72Å; R1029-D1065 IonicContact CZ-OD2 3.58Å; R1029-D1065 VanDerWaalsContact CZ-OD2 3.23Å; R1029-D1065 IonicContact NH1-OD2 3.77Å; R1029-D1065 PolarHBondContact NH1-OD2 2.85Å; R1029-D1065 IonicContact NH2-OD1 3.06Å; R1029-D1065 IonicContact NH2-OD2 3.97Å; R1029-D1065 PolarHBondContact NH2-OD2 2.99Å; T1062-D1065 WeakPolarHBondContact O-CB 3.47Å; T1062-D1065 PolarHBondContact O-N 3.32Å; D1065-G1067 PolarHBondContact O-N 3.21Å; D1065-G1067 VanDerWaalsContact O-N 3.17Å; D1065-R1071 VanDerWaalsContact O-CD 3.23Å; D1065-R1071 WeakPolarHBondContact O-CD 3.47Å; D1065-R1071 VanDerWaalsContact O-CG 3.3Å; D1065-R1071 WeakPolarHBondContact O-CG 3.48Å; D1065-R1071 PolarHBondContact O-NH1 3.22Å
1066	D	84.6	Confident	91.4	Very high	164 Å²	164	37.3 Å²	37.3	88%	0.877	21%	0.206	S	C	*	.	S	Bend	trans	-58.2	-30.4	176.1	-68.1	-57.7	0	0	0	113.4	H1068 R1071	D1066-H1068 PolarHBondContact O-N 3.13Å; D1066-R1071 PolarHBondContact O-NH1 3Å
1067	G	85.2	Confident	91.5	Very high	34 Å²	34	37.3 Å²	37.3	35%	0.351	21%	0.206	S	C	.	.			trans	-72.5	104.7	-176.5	0	0	0	0	0	113.6	D1065 E1069 T1070 R1071	D1065-G1067 PolarHBondContact O-N 3.21Å; D1065-G1067 VanDerWaalsContact O-N 3.17Å; G1067-E1069 PolarHBondContact O-N 3.19Å; G1067-T1070 WeakPolarHBondContact O-CB 3.26Å; G1067-T1070 PolarHBondContact O-N 2.85Å; G1067-R1071 PolarHBondContact O-N 3.3Å
1068	H	90.6	Very high	91.8	Very high	78 Å²	78	35 Å²	35	36%	0.361	19%	0.193	S	C	.	.	H	α-helix	trans	-61.4	-28.3	-178.2	68.9	62.3	0	0	0	114	D1066 A1072 E1108 V1111	D1066-H1068 PolarHBondContact O-N 3.13Å; H1068-A1072 VanDerWaalsContact O-CB 3.22Å; H1068-A1072 WeakPolarHBondContact O-CB 3.32Å; H1068-A1072 PolarHBondContact O-N 3.21Å; H1068-E1108 HydrophobicContact CB-CB 3.96Å; H1068-E1108 HydrophobicContact CB-CG 3.81Å; H1068-V1111 HydrophobicContact CB-CG2 3.96Å; H1068-V1111 WeakPolarHBondContact O-CG2 3.5Å
1069	E	91.2	Very high	92	Very high	100 Å²	100	34.9 Å²	34.9	47%	0.467	19%	0.193	S	C	.	.	H	α-helix	trans	-68.4	-42.4	174	-63	-155.8	156.2	0	0	111.1	K1030 G1067 A1072 L1073	K1030-E1069 IonicContact NZ-OE2 2.72Å; K1030-E1069 PolarHBondContact NZ-OE2 3.3Å; G1067-E1069 PolarHBondContact O-N 3.19Å; E1069-A1072 PolarHBondContact O-N 3.1Å; E1069-L1073 VanDerWaalsContact O-CB 3.23Å; E1069-L1073 WeakPolarHBondContact O-CB 3.45Å; E1069-L1073 PolarHBondContact O-N 2.97Å
1070	T	90.8	Very high	92.1	Very high	6 Å²	6	35.7 Å²	35.7	4%	0.037	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-45.2	177.1	-34	0	0	0	0	110.8	M1033 T1062 G1067 L1073 A1074	M1033-T1070 HydrophobicContact CE-CG2 3.89Å; T1062-T1070 HydrophobicContact CG2-CG2 3.61Å; G1067-T1070 WeakPolarHBondContact O-CB 3.26Å; G1067-T1070 PolarHBondContact O-N 2.85Å; T1070-L1073 PolarHBondContact O-N 3.3Å; T1070-A1074 WeakPolarHBondContact O-CB 3.3Å; T1070-A1074 PolarHBondContact O-N 2.82Å
1071	R	93.1	Very high	92.1	Very high	23 Å²	23	35.3 Å²	35.3	9%	0.087	19%	0.194	C	C	.	.	H	α-helix	trans	-60.8	-49.7	174	-62.2	-158.7	-59.9	-77.1	6	112.3	L1063 D1065 D1066 G1067 L1073 A1074 L1075 D1106 V1111	L1063-R1071 WeakPolarHBondContact O-CD 3.33Å; D1065-R1071 VanDerWaalsContact O-CD 3.23Å; D1065-R1071 WeakPolarHBondContact O-CD 3.47Å; D1065-R1071 VanDerWaalsContact O-CG 3.3Å; D1065-R1071 WeakPolarHBondContact O-CG 3.48Å; D1065-R1071 PolarHBondContact O-NH1 3.22Å; D1066-R1071 PolarHBondContact O-NH1 3Å; G1067-R1071 PolarHBondContact O-N 3.3Å; R1071-L1073 VanDerWaalsContact C-N 3.25Å; R1071-L1073 PolarHBondContact O-N 3.35Å; R1071-A1074 PolarHBondContact O-N 3.3Å; R1071-L1075 WeakPolarHBondContact O-CG 3.26Å; R1071-L1075 PolarHBondContact O-N 2.89Å; R1071-L1075 VanDerWaalsContact O-N 3.12Å; R1071-D1106 IonicContact CZ-OD1 2.68Å; R1071-D1106 IonicContact CZ-OD2 2.7Å; R1071-D1106 VanDerWaalsContact CZ-OD2 3.27Å; R1071-D1106 IonicContact NE-OD1 3.19Å; R1071-D1106 IonicContact NE-OD2 2.75Å; R1071-D1106 PolarHBondContact NE-OD2 3.25Å; R1071-D1106 VanDerWaalsContact NH2-CG 3.35Å; R1071-D1106 IonicContact NH2-OD1 3.35Å; R1071-D1106 PolarHBondContact NH2-OD1 2.79Å; R1071-D1106 IonicContact NH2-OD2 3.09Å; R1071-D1106 PolarHBondContact NH2-OD2 3.3Å; R1071-V1111 HydrophobicContact CB-CG1 4.01Å; R1071-V1111 HydrophobicContact CB-CG2 4.01Å
1072	A	95.6	Very high	92.3	Very high	8 Å²	8	32.4 Å²	32.4	7%	0.066	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-28.9	179.5	0	0	0	0	0	113	H1068 E1069 R1076 V1111 A1114	H1068-A1072 VanDerWaalsContact O-CB 3.22Å; H1068-A1072 WeakPolarHBondContact O-CB 3.32Å; H1068-A1072 PolarHBondContact O-N 3.21Å; E1069-A1072 PolarHBondContact O-N 3.1Å; A1072-R1076 WeakPolarHBondContact O-CG 3.46Å; A1072-R1076 PolarHBondContact O-N 3.1Å; A1072-V1111 HydrophobicContact CB-CG2 4.15Å; A1072-A1114 HydrophobicContact CB-CB 4.25Å; A1072-A1114 WeakPolarHBondContact O-CB 3.46Å
1073	L	94.6	Very high	92.5	Very high	14 Å²	14	37 Å²	37	7%	0.073	20%	0.198	C	C	.	.	H	α-helix	trans	-81.9	-38.3	176.3	-171	60.6	0	0	0	112.2	K1030 M1033 L1034 I1037 E1069 T1070 R1071 L1075 R1076 V1077	K1030-L1073 HydrophobicContact CB-CD2 4.22Å; K1030-L1073 HydrophobicContact CG-CD2 3.87Å; K1030-L1073 WeakPolarHBondContact O-CD2 3.47Å; M1033-L1073 HydrophobicContact CB-CD2 3.62Å; M1033-L1073 HydrophobicContact CB-CG 3.76Å; M1033-L1073 HydrophobicContact CG-CD2 4.39Å; M1033-L1073 HydrophobicContact CG-CG 4.4Å; M1033-L1073 HydrophobicContact SD-CB 3.83Å; M1033-L1073 HydrophobicContact SD-CD2 3.94Å; M1033-L1073 HydrophobicContact SD-CG 3.71Å; L1034-L1073 HydrophobicContact CD2-CD1 4Å; L1034-L1073 HydrophobicContact CD2-CD2 4.41Å; L1034-L1073 HydrophobicContact CG-CD2 4.18Å; I1037-L1073 HydrophobicContact CD1-CD1 3.78Å; E1069-L1073 VanDerWaalsContact O-CB 3.23Å; E1069-L1073 WeakPolarHBondContact O-CB 3.45Å; E1069-L1073 PolarHBondContact O-N 2.97Å; T1070-L1073 PolarHBondContact O-N 3.3Å; R1071-L1073 VanDerWaalsContact C-N 3.25Å; R1071-L1073 PolarHBondContact O-N 3.35Å; L1073-L1075 VanDerWaalsContact C-N 3.3Å; L1073-L1075 PolarHBondContact O-N 3.01Å; L1073-R1076 HydrophobicContact CD1-CB 4.4Å; L1073-R1076 CarbonylContact O-C 3.6Å; L1073-R1076 WeakPolarHBondContact O-CA 3.39Å; L1073-R1076 WeakPolarHBondContact O-CB 3.49Å; L1073-R1076 PolarHBondContact O-N 2.89Å; L1073-V1077 WeakPolarHBondContact O-CG2 3.21Å; L1073-V1077 PolarHBondContact O-N 3.36Å
1074	A	95.1	Very high	92.5	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.4	-43.2	172.5	0	0	0	0	0	111.6	M1033 L1059 T1062 L1063 T1070 R1071 R1076 V1077 L1078	M1033-A1074 HydrophobicContact CE-CB 3.83Å; M1033-A1074 HydrophobicContact SD-CB 4.25Å; L1059-A1074 HydrophobicContact CD2-CB 4.15Å; T1062-A1074 HydrophobicContact CG2-CB 4.09Å; L1063-A1074 HydrophobicContact CD2-CB 3.92Å; T1070-A1074 WeakPolarHBondContact O-CB 3.3Å; T1070-A1074 PolarHBondContact O-N 2.82Å; R1071-A1074 PolarHBondContact O-N 3.3Å; A1074-R1076 VanDerWaalsContact C-N 3.26Å; A1074-R1076 PolarHBondContact O-N 3.09Å; A1074-V1077 PolarHBondContact O-N 3.47Å; A1074-V1077 VanDerWaalsContact O-N 3.16Å; A1074-L1078 WeakPolarHBondContact O-CG 3.16Å; A1074-L1078 PolarHBondContact O-N 3.37Å
1075	L	96.9	Very high	92.7	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-58.6	-35.4	172.4	-70.3	164.7	0	0	0	112.9	L1063 R1071 L1073 Q1079 V1100 A1103 V1111 A1114 A1115	L1063-L1075 HydrophobicContact CD1-CD2 4.12Å; L1063-L1075 HydrophobicContact CD2-CD1 4.45Å; L1063-L1075 HydrophobicContact CD2-CD2 3.8Å; L1063-L1075 HydrophobicContact CD2-CG 3.65Å; R1071-L1075 WeakPolarHBondContact O-CG 3.26Å; R1071-L1075 PolarHBondContact O-N 2.89Å; R1071-L1075 VanDerWaalsContact O-N 3.12Å; L1073-L1075 VanDerWaalsContact C-N 3.3Å; L1073-L1075 PolarHBondContact O-N 3.01Å; L1075-Q1079 VanDerWaalsContact O-CB 3.24Å; L1075-Q1079 WeakPolarHBondContact O-CB 3.45Å; L1075-Q1079 PolarHBondContact O-N 2.91Å; L1075-V1100 HydrophobicContact CD2-CG2 4.5Å; L1075-A1103 HydrophobicContact CD1-CB 4.07Å; L1075-A1103 HydrophobicContact CD2-CB 3.97Å; L1075-V1111 HydrophobicContact CD1-CG1 3.55Å; L1075-A1114 HydrophobicContact CB-CB 3.97Å; L1075-A1114 HydrophobicContact CD1-CB 4.03Å; L1075-A1115 HydrophobicContact CD1-CB 3.89Å; L1075-A1115 HydrophobicContact CD2-CB 4.36Å
1076	R	96.5	Very high	93	Very high	95 Å²	95	38.2 Å²	38.2	36%	0.358	20%	0.196	S	C	.	.	H	α-helix	trans	-72.6	-38.7	174.4	-71.5	168.8	174.2	170.8	-1.5	112.3	I1037 A1072 L1073 A1074 L1078 Q1079 E1080	I1037-R1076 HydrophobicContact CD1-CB 4.08Å; A1072-R1076 WeakPolarHBondContact O-CG 3.46Å; A1072-R1076 PolarHBondContact O-N 3.1Å; L1073-R1076 HydrophobicContact CD1-CB 4.4Å; L1073-R1076 CarbonylContact O-C 3.6Å; L1073-R1076 WeakPolarHBondContact O-CA 3.39Å; L1073-R1076 WeakPolarHBondContact O-CB 3.49Å; L1073-R1076 PolarHBondContact O-N 2.89Å; A1074-R1076 VanDerWaalsContact C-N 3.26Å; A1074-R1076 PolarHBondContact O-N 3.09Å; R1076-L1078 VanDerWaalsContact C-N 3.32Å; R1076-L1078 PolarHBondContact O-N 3.4Å; R1076-Q1079 WeakPolarHBondContact O-CB 3.42Å; R1076-Q1079 PolarHBondContact O-N 3.49Å; R1076-E1080 WeakPolarHBondContact O-CG 3.48Å; R1076-E1080 PolarHBondContact O-N 3.2Å
1077	V	96	Very high	93.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.1	-46.8	172.3	-173.2	0	0	0	0	109.8	M1033 L1036 I1037 L1040 L1059 L1073 A1074 Q1079 E1080 L1081	M1033-V1077 HydrophobicContact CB-CG2 3.65Å; M1033-V1077 HydrophobicContact CG-CG2 3.83Å; M1033-V1077 HydrophobicContact SD-CG2 4.32Å; L1036-V1077 HydrophobicContact CB-CG1 4.45Å; L1036-V1077 HydrophobicContact CD2-CG1 3.65Å; L1036-V1077 HydrophobicContact CG-CG1 3.82Å; I1037-V1077 HydrophobicContact CD1-CG2 3.9Å; I1037-V1077 HydrophobicContact CG1-CB 4.36Å; I1037-V1077 HydrophobicContact CG1-CG2 3.95Å; L1040-V1077 HydrophobicContact CD1-CG1 4.19Å; L1059-V1077 HydrophobicContact CD1-CB 3.88Å; L1059-V1077 HydrophobicContact CD1-CG1 3.48Å; L1059-V1077 VanDerWaalsContact CD1-CG1 3.48Å; L1059-V1077 HydrophobicContact CD2-CB 3.89Å; L1059-V1077 HydrophobicContact CD2-CG1 4.07Å; L1059-V1077 HydrophobicContact CD2-CG2 4.08Å; L1059-V1077 HydrophobicContact CG-CG1 4.43Å; L1073-V1077 WeakPolarHBondContact O-CG2 3.21Å; L1073-V1077 PolarHBondContact O-N 3.36Å; A1074-V1077 PolarHBondContact O-N 3.47Å; A1074-V1077 VanDerWaalsContact O-N 3.16Å; V1077-Q1079 VanDerWaalsContact C-N 3.32Å; V1077-Q1079 PolarHBondContact O-N 2.99Å; V1077-E1080 PolarHBondContact O-N 2.74Å; V1077-L1081 VanDerWaalsContact O-CB 3.3Å; V1077-L1081 WeakPolarHBondContact O-CB 3.2Å; V1077-L1081 PolarHBondContact O-N 3.38Å
1078	L	96.5	Very high	93.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.5	-38.1	176.2	-68.5	167.9	0	0	0	112.5	L1056 L1059 L1060 L1063 A1074 R1076 L1081 V1082 F1096	L1056-L1078 HydrophobicContact CD1-CD2 3.6Å; L1059-L1078 HydrophobicContact CB-CD1 4.24Å; L1059-L1078 HydrophobicContact CB-CD2 3.86Å; L1059-L1078 HydrophobicContact CB-CG 3.99Å; L1059-L1078 HydrophobicContact CD1-CD2 3.84Å; L1059-L1078 HydrophobicContact CD1-CG 4.09Å; L1060-L1078 HydrophobicContact CD2-CD1 3.95Å; L1063-L1078 HydrophobicContact CD1-CD1 4.33Å; A1074-L1078 WeakPolarHBondContact O-CG 3.16Å; A1074-L1078 PolarHBondContact O-N 3.37Å; R1076-L1078 VanDerWaalsContact C-N 3.32Å; R1076-L1078 PolarHBondContact O-N 3.4Å; L1078-L1081 PolarHBondContact O-N 3.15Å; L1078-V1082 WeakPolarHBondContact O-CG1 3.4Å; L1078-V1082 PolarHBondContact O-N 3.47Å; L1078-F1096 HydrophobicContact CB-CE2 3.87Å; L1078-F1096 HydrophobicContact CB-CZ 4.24Å; L1078-F1096 HydrophobicContact CD1-CE2 4.21Å; L1078-F1096 HydrophobicContact CD2-CE2 4.18Å; L1078-F1096 HydrophobicContact CG-CE2 4.31Å
1079	Q	96.1	Very high	93.6	Very high	25 Å²	25	30.5 Å²	30.5	12%	0.117	15%	0.147	C	C	.	.	H	α-helix	trans	-64.4	-40.4	175.2	-175.5	-173.3	16.4	0	0	112.8	L1075 R1076 V1077 R1083 D1117 C1118 T1121	L1075-Q1079 VanDerWaalsContact O-CB 3.24Å; L1075-Q1079 WeakPolarHBondContact O-CB 3.45Å; L1075-Q1079 PolarHBondContact O-N 2.91Å; R1076-Q1079 WeakPolarHBondContact O-CB 3.42Å; R1076-Q1079 PolarHBondContact O-N 3.49Å; V1077-Q1079 VanDerWaalsContact C-N 3.32Å; V1077-Q1079 PolarHBondContact O-N 2.99Å; Q1079-R1083 WeakPolarHBondContact O-CB 3.24Å; Q1079-R1083 PolarHBondContact O-N 3.04Å; Q1079-D1117 PolarHBondContact NE2-O 3.02Å; Q1079-C1118 HydrophobicContact CB-CB 4.23Å; Q1079-T1121 HydrophobicContact CG-CG2 3.99Å; Q1079-T1121 WeakPolarHBondContact CG-OG1 3.31Å; Q1079-T1121 PolarHBondContact NE2-OG1 2.8Å
1080	E	95	Very high	93.4	Very high	17 Å²	17	30.1 Å²	30.1	8%	0.079	14%	0.144	C	C	.	.	H	α-helix	trans	-73.1	-38.3	174	-59.5	-58.8	139.4	0	0	111.2	I1037 L1040 R1041 R1076 V1077 R1083 A1084	I1037-E1080 HydrophobicContact CG1-CG 4.16Å; I1037-E1080 HydrophobicContact CG2-CG 4.21Å; L1040-E1080 HydrophobicContact CD1-CB 4.31Å; R1041-E1080 IonicContact CZ-OE1 2.91Å; R1041-E1080 IonicContact CZ-OE2 3.78Å; R1041-E1080 VanDerWaalsContact NE-CD 3.27Å; R1041-E1080 IonicContact NE-OE1 3.47Å; R1041-E1080 IonicContact NE-OE2 2.71Å; R1041-E1080 PolarHBondContact NE-OE2 3.37Å; R1041-E1080 IonicContact NH2-OE1 2.69Å; R1041-E1080 PolarHBondContact NH2-OE1 2.7Å; R1041-E1080 IonicContact NH2-OE2 3.31Å; R1041-E1080 PolarHBondContact NH2-OE2 2.94Å; R1076-E1080 WeakPolarHBondContact O-CG 3.48Å; R1076-E1080 PolarHBondContact O-N 3.2Å; V1077-E1080 PolarHBondContact O-N 2.74Å; E1080-R1083 PolarHBondContact O-N 3.46Å; E1080-R1083 IonicContact OE1-CZ 3.04Å; E1080-R1083 IonicContact OE1-NH1 2.74Å; E1080-R1083 PolarHBondContact OE1-NH1 3.39Å; E1080-R1083 IonicContact OE2-NH1 3.06Å; E1080-R1083 PolarHBondContact OE2-NH1 3.44Å; E1080-A1084 WeakPolarHBondContact O-CB 3.28Å; E1080-A1084 PolarHBondContact O-N 2.69Å
1081	L	93.9	Very high	93.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.9	-45.8	179	-175.5	62.4	0	0	0	111.8	L1040 W1048 F1052 T1055 V1077 L1078 R1083 A1084 K1085 F1089	L1040-L1081 HydrophobicContact CD1-CB 4.03Å; L1040-L1081 HydrophobicContact CD1-CD1 4.3Å; L1040-L1081 HydrophobicContact CD2-CB 4.49Å; L1040-L1081 HydrophobicContact CD2-CD1 3.63Å; W1048-L1081 HydrophobicContact CE3-CD1 4.03Å; W1048-L1081 HydrophobicContact CH2-CD1 4.13Å; W1048-L1081 HydrophobicContact CZ3-CD1 3.78Å; F1052-L1081 HydrophobicContact CD2-CD1 4.22Å; F1052-L1081 HydrophobicContact CD2-CD2 4.01Å; F1052-L1081 HydrophobicContact CD2-CG 4.34Å; F1052-L1081 HydrophobicContact CE2-CD1 4.47Å; F1052-L1081 HydrophobicContact CE2-CD2 3.84Å; F1052-L1081 HydrophobicContact CE2-CG 4.13Å; T1055-L1081 HydrophobicContact CG2-CD2 4.34Å; V1077-L1081 VanDerWaalsContact O-CB 3.3Å; V1077-L1081 WeakPolarHBondContact O-CB 3.2Å; V1077-L1081 PolarHBondContact O-N 3.38Å; L1078-L1081 PolarHBondContact O-N 3.15Å; L1081-R1083 VanDerWaalsContact C-N 3.28Å; L1081-R1083 PolarHBondContact O-N 3.03Å; L1081-A1084 PolarHBondContact O-N 3.31Å; L1081-K1085 CarbonylContact O-C 3.35Å; L1081-K1085 WeakPolarHBondContact O-CA 3.41Å; L1081-K1085 PolarHBondContact O-N 3.12Å; L1081-F1089 HydrophobicContact CB-CE2 4.46Å; L1081-F1089 HydrophobicContact CB-CZ 4.22Å; L1081-F1089 HydrophobicContact CD2-CE2 4.41Å; L1081-F1089 HydrophobicContact CD2-CZ 3.88Å; L1081-F1089 HydrophobicContact CG-CE2 3.89Å; L1081-F1089 HydrophobicContact CG-CZ 3.77Å
1082	V	94.3	Very high	93.1	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-70.5	-22.7	176.1	74.8	0	0	0	0	113.3	L1078 P1086 F1089 F1096 T1121 V1122 L1126	L1078-V1082 WeakPolarHBondContact O-CG1 3.4Å; L1078-V1082 PolarHBondContact O-N 3.47Å; V1082-P1086 WeakPolarHBondContact O-CB 3.49Å; V1082-P1086 WeakPolarHBondContact O-CD 3.26Å; V1082-F1089 VanDerWaalsContact CA-CE2 3.43Å; V1082-F1089 HydrophobicContact CB-CD2 4.2Å; V1082-F1089 HydrophobicContact CB-CE2 3.73Å; V1082-F1089 HydrophobicContact CB-CZ 3.94Å; V1082-F1089 HydrophobicContact CG2-CD2 3.97Å; V1082-F1089 HydrophobicContact CG2-CE2 4.04Å; V1082-F1089 HydrophobicContact CG2-CG 4.36Å; V1082-F1089 HydrophobicContact CG2-CZ 4.46Å; V1082-F1096 HydrophobicContact CB-CE1 3.99Å; V1082-F1096 HydrophobicContact CB-CZ 4.28Å; V1082-F1096 HydrophobicContact CG1-CE1 4.44Å; V1082-F1096 HydrophobicContact CG1-CZ 4.42Å; V1082-F1096 HydrophobicContact CG2-CE1 3.93Å; V1082-T1121 HydrophobicContact CG1-CG2 4.11Å; V1082-V1122 HydrophobicContact CG1-CG2 3.98Å; V1082-V1122 HydrophobicContact CG2-CG2 4.33Å; V1082-L1126 HydrophobicContact CG2-CD1 4.48Å; V1082-L1126 HydrophobicContact CG2-CD2 3.58Å; V1082-L1126 HydrophobicContact CG2-CG 3.83Å
1083	R	94.2	Very high	92.9	Very high	97 Å²	97	37.5 Å²	37.5	37%	0.366	18%	0.182	S	C	.	.	H	α-helix	trans	-80.5	-38.7	175.3	-170.5	-175.4	-60.4	127	3.9	112.3	Q1079 E1080 L1081 T1121	Q1079-R1083 WeakPolarHBondContact O-CB 3.24Å; Q1079-R1083 PolarHBondContact O-N 3.04Å; E1080-R1083 PolarHBondContact O-N 3.46Å; E1080-R1083 IonicContact OE1-CZ 3.04Å; E1080-R1083 IonicContact OE1-NH1 2.74Å; E1080-R1083 PolarHBondContact OE1-NH1 3.39Å; E1080-R1083 IonicContact OE2-NH1 3.06Å; E1080-R1083 PolarHBondContact OE2-NH1 3.44Å; L1081-R1083 VanDerWaalsContact C-N 3.28Å; L1081-R1083 PolarHBondContact O-N 3.03Å; R1083-T1121 HydrophobicContact CB-CG2 4.1Å; R1083-T1121 PolarHBondContact NH2-OG1 3.38Å
1084	A	91.4	Very high	92.6	Very high	49 Å²	49	38.3 Å²	38.3	41%	0.405	19%	0.185	S	C	.	.	H	α-helix	trans	-81.3	-31.7	179.7	0	0	0	0	0	112.7	L1040 E1080 L1081	L1040-A1084 HydrophobicContact CD2-CB 4.23Å; E1080-A1084 WeakPolarHBondContact O-CB 3.28Å; E1080-A1084 PolarHBondContact O-N 2.69Å; L1081-A1084 PolarHBondContact O-N 3.31Å
1085	K	90	Very high	92.3	Very high	60 Å²	60	39.1 Å²	39.1	26%	0.261	19%	0.189	S	C	.	.			trans	-143	57.1	-169.7	-71.6	-61.3	-169.1	179.3	0	113.4	W1048 L1081 E1087 L1088 F1089	W1048-K1085 HydrophobicContact CG-CG 4.4Å; L1081-K1085 CarbonylContact O-C 3.35Å; L1081-K1085 WeakPolarHBondContact O-CA 3.41Å; L1081-K1085 PolarHBondContact O-N 3.12Å; K1085-E1087 VanDerWaalsContact CA-OE2 3.26Å; K1085-E1087 WeakPolarHBondContact CA-OE2 3.5Å; K1085-E1087 WeakPolarHBondContact CD-OE1 3.48Å; K1085-E1087 IonicContact NZ-OE1 2.83Å; K1085-E1087 PolarHBondContact NZ-OE1 2.97Å; K1085-E1087 PolarHBondContact O-N 3.25Å; K1085-L1088 HydrophobicContact CB-CD1 3.65Å; K1085-L1088 HydrophobicContact CB-CG 4.08Å; K1085-L1088 HydrophobicContact CD-CD1 4.31Å; K1085-L1088 HydrophobicContact CG-CD1 4.01Å; K1085-L1088 PolarHBondContact O-N 3.36Å; K1085-F1089 WeakPolarHBondContact O-CD2 3.47Å
1086	P	91.3	Very high	92.2	Very high	32 Å²	32	39.1 Å²	39.1	21%	0.208	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-60.2	-27.9	178.9	26.1	-34.5	0	0	0	113.2	V1082 L1088 F1089 N1125 L1126	V1082-P1086 WeakPolarHBondContact O-CB 3.49Å; V1082-P1086 WeakPolarHBondContact O-CD 3.26Å; P1086-L1088 VanDerWaalsContact C-N 3.25Å; P1086-L1088 PolarHBondContact O-N 2.99Å; P1086-F1089 PolarHBondContact O-N 3.46Å; P1086-N1125 HydrophobicContact CB-CB 4.46Å; P1086-N1125 WeakPolarHBondContact CB-O 3.28Å; P1086-L1126 HydrophobicContact CB-CD2 3.86Å; P1086-L1126 WeakPolarHBondContact O-CD2 3.36Å
1087	E	90.2	Very high	92	Very high	88 Å²	88	34.7 Å²	34.7	41%	0.411	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-62.7	-29.2	-177	71.1	-83.3	-159.4	0	0	113.6	K1085 F1089 H1090	K1085-E1087 VanDerWaalsContact CA-OE2 3.26Å; K1085-E1087 WeakPolarHBondContact CA-OE2 3.5Å; K1085-E1087 WeakPolarHBondContact CD-OE1 3.48Å; K1085-E1087 IonicContact NZ-OE1 2.83Å; K1085-E1087 PolarHBondContact NZ-OE1 2.97Å; K1085-E1087 PolarHBondContact O-N 3.25Å; E1087-F1089 VanDerWaalsContact C-N 3.27Å; E1087-F1089 PolarHBondContact O-N 3.29Å; E1087-H1090 PolarHBondContact O-ND1 3.12Å
1088	L	91	Very high	91.9	Very high	27 Å²	27	36 Å²	36	14%	0.141	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-74.4	-19.3	-177.7	-56	177.5	0	0	0	112.7	W1048 F1052 K1085 P1086	W1048-L1088 HydrophobicContact CB-CD1 3.59Å; W1048-L1088 HydrophobicContact CG-CD1 4.24Å; F1052-L1088 HydrophobicContact CB-CD1 3.96Å; F1052-L1088 HydrophobicContact CD1-CB 3.86Å; F1052-L1088 HydrophobicContact CD2-CB 3.66Å; F1052-L1088 HydrophobicContact CD2-CD1 3.56Å; F1052-L1088 HydrophobicContact CD2-CG 4.26Å; F1052-L1088 HydrophobicContact CE1-CB 3.78Å; F1052-L1088 WeakPolarHBondContact CE1-O 3.39Å; F1052-L1088 HydrophobicContact CE2-CB 3.57Å; F1052-L1088 HydrophobicContact CE2-CD1 4.2Å; F1052-L1088 HydrophobicContact CG-CB 3.8Å; F1052-L1088 HydrophobicContact CG-CD1 3.8Å; F1052-L1088 HydrophobicContact CG-CG 4.37Å; F1052-L1088 HydrophobicContact CZ-CB 3.62Å; F1052-L1088 WeakPolarHBondContact CZ-O 3.5Å; K1085-L1088 HydrophobicContact CB-CD1 3.65Å; K1085-L1088 HydrophobicContact CB-CG 4.08Å; K1085-L1088 HydrophobicContact CD-CD1 4.31Å; K1085-L1088 HydrophobicContact CG-CD1 4.01Å; K1085-L1088 PolarHBondContact O-N 3.36Å; P1086-L1088 VanDerWaalsContact C-N 3.25Å; P1086-L1088 PolarHBondContact O-N 2.99Å
1089	F	91.7	Very high	91.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-83.7	-8.8	-174.1	-74.4	-92.7	0	0	0	114.6	F1052 L1056 L1081 V1082 K1085 P1086 E1087 D1091 F1092 A1093 F1096 L1126	F1052-F1089 HydrophobicContact CE2-CD1 4.45Å; F1052-F1089 AromaticContact CE2-CD2 3.98Å; F1052-F1089 HydrophobicContact CE2-CD2 3.98Å; F1052-F1089 HydrophobicContact CE2-CE1 4.18Å; F1052-F1089 AromaticContact CE2-CE2 3.64Å; F1052-F1089 HydrophobicContact CE2-CE2 3.64Å; F1052-F1089 HydrophobicContact CE2-CG 4.38Å; F1052-F1089 AromaticContact CE2-CZ 3.78Å; F1052-F1089 HydrophobicContact CE2-CZ 3.78Å; F1052-F1089 AromaticContact CZ-CD1 3.96Å; F1052-F1089 HydrophobicContact CZ-CD1 3.96Å; F1052-F1089 AromaticContact CZ-CD2 3.97Å; F1052-F1089 HydrophobicContact CZ-CD2 3.97Å; F1052-F1089 HydrophobicContact CZ-CE1 4.06Å; F1052-F1089 HydrophobicContact CZ-CE2 4.05Å; F1052-F1089 AromaticContact CZ-CG 3.95Å; F1052-F1089 HydrophobicContact CZ-CG 3.95Å; F1052-F1089 HydrophobicContact CZ-CZ 4.12Å; L1056-F1089 HydrophobicContact CD1-CE1 3.81Å; L1081-F1089 HydrophobicContact CB-CE2 4.46Å; L1081-F1089 HydrophobicContact CB-CZ 4.22Å; L1081-F1089 HydrophobicContact CD2-CE2 4.41Å; L1081-F1089 HydrophobicContact CD2-CZ 3.88Å; L1081-F1089 HydrophobicContact CG-CE2 3.89Å; L1081-F1089 HydrophobicContact CG-CZ 3.77Å; V1082-F1089 VanDerWaalsContact CA-CE2 3.43Å; V1082-F1089 HydrophobicContact CB-CD2 4.2Å; V1082-F1089 HydrophobicContact CB-CE2 3.73Å; V1082-F1089 HydrophobicContact CB-CZ 3.94Å; V1082-F1089 HydrophobicContact CG2-CD2 3.97Å; V1082-F1089 HydrophobicContact CG2-CE2 4.04Å; V1082-F1089 HydrophobicContact CG2-CG 4.36Å; V1082-F1089 HydrophobicContact CG2-CZ 4.46Å; K1085-F1089 WeakPolarHBondContact O-CD2 3.47Å; P1086-F1089 PolarHBondContact O-N 3.46Å; E1087-F1089 VanDerWaalsContact C-N 3.27Å; E1087-F1089 PolarHBondContact O-N 3.29Å; F1089-D1091 PolarHBondContact O-N 3.37Å; F1089-F1092 CarbonylContact O-C 3.52Å; F1089-F1092 WeakPolarHBondContact O-CA 3.47Å; F1089-F1092 PolarHBondContact O-N 2.98Å; F1089-A1093 WeakPolarHBondContact O-CA 3.39Å; F1089-A1093 WeakPolarHBondContact O-CB 3.34Å; F1089-A1093 PolarHBondContact O-N 3.33Å; F1089-F1096 HydrophobicContact CD1-CB 4.21Å; F1089-F1096 AromaticContact CD1-CD1 3.21Å; F1089-F1096 HydrophobicContact CD1-CD1 3.21Å; F1089-F1096 AromaticContact CD1-CE1 3.6Å; F1089-F1096 HydrophobicContact CD1-CE1 3.6Å; F1089-F1096 AromaticContact CD1-CG 3.8Å; F1089-F1096 HydrophobicContact CD1-CG 3.8Å; F1089-F1096 HydrophobicContact CD1-CZ 4.48Å; F1089-F1096 HydrophobicContact CE1-CB 4.49Å; F1089-F1096 AromaticContact CE1-CD1 3.36Å; F1089-F1096 HydrophobicContact CE1-CD1 3.36Å; F1089-F1096 HydrophobicContact CE1-CD2 4.16Å; F1089-F1096 AromaticContact CE1-CE1 3.38Å; F1089-F1096 HydrophobicContact CE1-CE1 3.38Å; F1089-F1096 HydrophobicContact CE1-CE2 4.21Å; F1089-F1096 AromaticContact CE1-CG 3.76Å; F1089-F1096 HydrophobicContact CE1-CG 3.76Å; F1089-F1096 AromaticContact CE1-CZ 3.84Å; F1089-F1096 HydrophobicContact CE1-CZ 3.84Å; F1089-F1096 HydrophobicContact CG-CD1 4.17Å; F1089-F1096 HydrophobicContact CG-CE1 4.38Å; F1089-F1096 HydrophobicContact CZ-CD1 4.42Å; F1089-F1096 HydrophobicContact CZ-CE1 4.04Å; F1089-F1096 HydrophobicContact CZ-CZ 4.32Å; F1089-L1126 HydrophobicContact CB-CD1 4.42Å; F1089-L1126 HydrophobicContact CB-CD2 3.88Å; F1089-L1126 HydrophobicContact CG-CD2 4.47Å
1090	H	87.6	Confident	91.7	Very high	91 Å²	91	37.5 Å²	37.5	42%	0.421	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-50.5	-53.4	-172.6	-74.5	92.2	0	0	0	113.5	E1087 F1092 P1127	E1087-H1090 PolarHBondContact O-ND1 3.12Å; H1090-F1092 PolarHBondContact O-N 2.99Å; H1090-P1127 WeakPolarHBondContact NE2-CG 3.45Å
1091	D	86.5	Confident	91.7	Very high	146 Å²	146	36.7 Å²	36.7	78%	0.781	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-71.3	-16.1	-179.8	-66.9	-26.3	0	0	0	113.8	F1089	F1089-D1091 PolarHBondContact O-N 3.37Å
1092	F	90.3	Very high	91.7	Very high	44 Å²	44	40.8 Å²	40.8	19%	0.193	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-112.1	-2.1	-175.1	-60.4	-87.1	0	0	0	113.4	F1052 K1053 L1056 F1089 H1090 Y1094 L1095 F1096	F1052-F1092 AromaticContact CE1-CD2 3.79Å; F1052-F1092 HydrophobicContact CE1-CD2 3.79Å; F1052-F1092 HydrophobicContact CE1-CE2 4.07Å; K1053-F1092 HydrophobicContact CD-CE1 4.46Å; K1053-F1092 HydrophobicContact CD-CZ 3.95Å; K1053-F1092 HydrophobicContact CG-CE1 4.3Å; K1053-F1092 HydrophobicContact CG-CZ 4Å; L1056-F1092 HydrophobicContact CD2-CB 3.65Å; L1056-F1092 HydrophobicContact CD2-CD1 3.97Å; L1056-F1092 HydrophobicContact CD2-CD2 4.34Å; L1056-F1092 HydrophobicContact CD2-CG 3.72Å; F1089-F1092 CarbonylContact O-C 3.52Å; F1089-F1092 WeakPolarHBondContact O-CA 3.47Å; F1089-F1092 PolarHBondContact O-N 2.98Å; H1090-F1092 PolarHBondContact O-N 2.99Å; F1092-Y1094 VanDerWaalsContact C-N 3.32Å; F1092-Y1094 PolarHBondContact O-N 3.15Å; F1092-L1095 WeakPolarHBondContact O-CB 3.45Å; F1092-L1095 PolarHBondContact O-N 2.96Å; F1092-L1095 VanDerWaalsContact O-N 3.1Å; F1092-F1096 WeakPolarHBondContact O-CB 3.31Å; F1092-F1096 PolarHBondContact O-N 3.45Å
1093	A	90.7	Very high	91.7	Very high	2 Å²	2	41.3 Å²	41.3	2%	0.017	21%	0.205	C	C	.	.	H	α-helix	trans	-60.8	-39.6	-167	0	0	0	0	0	112.5	F1089 F1096 V1097 L1126 L1130	F1089-A1093 WeakPolarHBondContact O-CA 3.39Å; F1089-A1093 WeakPolarHBondContact O-CB 3.34Å; F1089-A1093 PolarHBondContact O-N 3.33Å; A1093-F1096 PolarHBondContact O-N 3.29Å; A1093-V1097 VanDerWaalsContact O-CB 3.24Å; A1093-V1097 WeakPolarHBondContact O-CB 3.42Å; A1093-V1097 WeakPolarHBondContact O-CG2 3.36Å; A1093-V1097 PolarHBondContact O-N 2.93Å; A1093-L1126 HydrophobicContact CB-CD1 4.31Å; A1093-L1130 HydrophobicContact CB-CD1 4.17Å; A1093-L1130 HydrophobicContact CB-CD2 3.65Å; A1093-L1130 HydrophobicContact CB-CG 3.9Å
1094	Y	88.8	Confident	91.8	Very high	32 Å²	32	37.4 Å²	37.4	13%	0.125	19%	0.193	C	C	.	.	H	α-helix	trans	-58.5	-50.9	175.6	-177.7	-82.3	0	0	0	111.9	M879 I883 F1092 I1098 V1134 L1138	M879-Y1094 HydrophobicContact CG-CD2 4.24Å; M879-Y1094 HydrophobicContact SD-CD2 4.04Å; M879-Y1094 HydrophobicContact SD-CE2 4.46Å; I883-Y1094 HydrophobicContact CB-CE1 4.07Å; I883-Y1094 HydrophobicContact CD1-CD2 4.33Å; I883-Y1094 HydrophobicContact CD1-CE1 4.15Å; I883-Y1094 HydrophobicContact CD1-CE2 3.56Å; I883-Y1094 VanDerWaalsContact CD1-CZ 3.45Å; I883-Y1094 WeakPolarHBondContact CD1-OH 3.27Å; I883-Y1094 HydrophobicContact CG1-CD1 3.95Å; I883-Y1094 HydrophobicContact CG1-CD2 4.13Å; I883-Y1094 HydrophobicContact CG1-CE1 3.53Å; I883-Y1094 HydrophobicContact CG1-CE2 3.71Å; I883-Y1094 HydrophobicContact CG1-CG 4.26Å; I883-Y1094 HydrophobicContact CG2-CE1 3.83Å; F1092-Y1094 VanDerWaalsContact C-N 3.32Å; F1092-Y1094 PolarHBondContact O-N 3.15Å; Y1094-I1098 HydrophobicContact CE1-CD1 3.53Å; Y1094-I1098 HydrophobicContact CE1-CG1 4.01Å; Y1094-I1098 PolarHBondContact O-N 3.44Å; Y1094-I1098 WeakPolarHBondContact OH-CD1 3.46Å; Y1094-V1134 HydrophobicContact CD2-CB 4.5Å; Y1094-V1134 HydrophobicContact CD2-CG1 3.91Å; Y1094-V1134 HydrophobicContact CD2-CG2 4.26Å; Y1094-V1134 HydrophobicContact CG-CG1 4.49Å; Y1094-L1138 HydrophobicContact CE2-CD2 4.13Å; Y1094-L1138 WeakPolarHBondContact OH-CD2 3.48Å
1095	L	89.7	Confident	91.8	Very high	16 Å²	16	41.1 Å²	41.1	8%	0.084	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-50.8	179	164.6	63.3	0	0	0	110.8	T886 L890 L1060 F1092 I1098 K1099	T886-L1095 HydrophobicContact CG2-CB 4.02Å; T886-L1095 HydrophobicContact CG2-CD1 4.3Å; T886-L1095 HydrophobicContact CG2-CD2 3.7Å; T886-L1095 HydrophobicContact CG2-CG 4.19Å; L890-L1095 HydrophobicContact CD1-CD1 3.3Å; L890-L1095 HydrophobicContact CD1-CD2 3.91Å; L890-L1095 HydrophobicContact CD1-CG 4.22Å; L1060-L1095 HydrophobicContact CD1-CD1 4.47Å; L1060-L1095 HydrophobicContact CD1-CD2 3.72Å; L1060-L1095 HydrophobicContact CD1-CG 3.87Å; F1092-L1095 WeakPolarHBondContact O-CB 3.45Å; F1092-L1095 PolarHBondContact O-N 2.96Å; F1092-L1095 VanDerWaalsContact O-N 3.1Å; L1095-I1098 PolarHBondContact O-N 2.92Å; L1095-K1099 HydrophobicContact CD1-CG 3.87Å; L1095-K1099 WeakPolarHBondContact O-CG 3.25Å; L1095-K1099 PolarHBondContact O-N 3.41Å
1096	F	93.9	Very high	92	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-46.6	-175.2	172.5	-136.2	0	0	0	111.4	L1056 L1060 L1078 V1082 F1089 F1092 A1093 I1098 K1099 V1100 V1122	L1056-F1096 HydrophobicContact CD1-CD2 4.5Å; L1060-F1096 HydrophobicContact CD2-CD2 4.33Å; L1078-F1096 HydrophobicContact CB-CE2 3.87Å; L1078-F1096 HydrophobicContact CB-CZ 4.24Å; L1078-F1096 HydrophobicContact CD1-CE2 4.21Å; L1078-F1096 HydrophobicContact CD2-CE2 4.18Å; L1078-F1096 HydrophobicContact CG-CE2 4.31Å; V1082-F1096 HydrophobicContact CB-CE1 3.99Å; V1082-F1096 HydrophobicContact CB-CZ 4.28Å; V1082-F1096 HydrophobicContact CG1-CE1 4.44Å; V1082-F1096 HydrophobicContact CG1-CZ 4.42Å; V1082-F1096 HydrophobicContact CG2-CE1 3.93Å; F1089-F1096 HydrophobicContact CD1-CB 4.21Å; F1089-F1096 AromaticContact CD1-CD1 3.21Å; F1089-F1096 HydrophobicContact CD1-CD1 3.21Å; F1089-F1096 AromaticContact CD1-CE1 3.6Å; F1089-F1096 HydrophobicContact CD1-CE1 3.6Å; F1089-F1096 AromaticContact CD1-CG 3.8Å; F1089-F1096 HydrophobicContact CD1-CG 3.8Å; F1089-F1096 HydrophobicContact CD1-CZ 4.48Å; F1089-F1096 HydrophobicContact CE1-CB 4.49Å; F1089-F1096 AromaticContact CE1-CD1 3.36Å; F1089-F1096 HydrophobicContact CE1-CD1 3.36Å; F1089-F1096 HydrophobicContact CE1-CD2 4.16Å; F1089-F1096 AromaticContact CE1-CE1 3.38Å; F1089-F1096 HydrophobicContact CE1-CE1 3.38Å; F1089-F1096 HydrophobicContact CE1-CE2 4.21Å; F1089-F1096 AromaticContact CE1-CG 3.76Å; F1089-F1096 HydrophobicContact CE1-CG 3.76Å; F1089-F1096 AromaticContact CE1-CZ 3.84Å; F1089-F1096 HydrophobicContact CE1-CZ 3.84Å; F1089-F1096 HydrophobicContact CG-CD1 4.17Å; F1089-F1096 HydrophobicContact CG-CE1 4.38Å; F1089-F1096 HydrophobicContact CZ-CD1 4.42Å; F1089-F1096 HydrophobicContact CZ-CE1 4.04Å; F1089-F1096 HydrophobicContact CZ-CZ 4.32Å; F1092-F1096 WeakPolarHBondContact O-CB 3.31Å; F1092-F1096 PolarHBondContact O-N 3.45Å; A1093-F1096 PolarHBondContact O-N 3.29Å; F1096-I1098 PolarHBondContact O-N 2.85Å; F1096-K1099 PolarHBondContact O-N 3.34Å; F1096-V1100 HydrophobicContact CD2-CG2 3.84Å; F1096-V1100 HydrophobicContact CE2-CG2 3.45Å; F1096-V1100 VanDerWaalsContact CE2-CG2 3.45Å; F1096-V1100 HydrophobicContact CZ-CG2 4.13Å; F1096-V1100 WeakPolarHBondContact O-CG2 3.39Å; F1096-V1100 PolarHBondContact O-N 3.37Å; F1096-V1122 HydrophobicContact CD1-CG2 4.44Å; F1096-V1122 HydrophobicContact CE1-CG1 4.41Å; F1096-V1122 HydrophobicContact CE1-CG2 3.5Å; F1096-V1122 VanDerWaalsContact CE1-CG2 3.5Å; F1096-V1122 HydrophobicContact CZ-CG2 3.67Å
1097	V	93.6	Very high	92	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.012	22%	0.218	C	C	.	.	H	α-helix	trans	-60.5	-46.5	176.1	169.9	0	0	0	0	110.7	A1093 K1099 V1100 L1101 V1122 V1134 L1135 M1153	A1093-V1097 VanDerWaalsContact O-CB 3.24Å; A1093-V1097 WeakPolarHBondContact O-CB 3.42Å; A1093-V1097 WeakPolarHBondContact O-CG2 3.36Å; A1093-V1097 PolarHBondContact O-N 2.93Å; V1097-K1099 PolarHBondContact O-N 2.93Å; V1097-V1100 PolarHBondContact O-N 2.9Å; V1097-L1101 HydrophobicContact CG1-CD1 3.63Å; V1097-L1101 HydrophobicContact CG1-CG 4.14Å; V1097-L1101 WeakPolarHBondContact O-CB 3.3Å; V1097-L1101 WeakPolarHBondContact O-CG 3.44Å; V1097-L1101 PolarHBondContact O-N 3.49Å; V1097-V1122 HydrophobicContact CG2-CG1 4.12Å; V1097-V1134 HydrophobicContact CB-CG1 3.87Å; V1097-V1134 HydrophobicContact CG1-CG1 3.76Å; V1097-V1134 HydrophobicContact CG2-CG1 4.36Å; V1097-L1135 HydrophobicContact CG1-CD2 3.93Å; V1097-L1135 HydrophobicContact CG1-CG 4.49Å; V1097-M1153 HydrophobicContact CG1-CE 4.39Å; V1097-M1153 HydrophobicContact CG1-SD 4.1Å; V1097-M1153 HydrophobicContact CG2-CE 4.18Å
1098	I	92	Very high	92.2	Very high	27 Å²	27	43.2 Å²	43.2	14%	0.138	22%	0.217	C	C	.	.	H	α-helix	trans	-56.7	-48.1	174.8	-83.1	-156.7	0	0	0	111.7	Y1094 L1095 F1096 V1100 L1101 E1102 L1138 I1146	Y1094-I1098 HydrophobicContact CE1-CD1 3.53Å; Y1094-I1098 HydrophobicContact CE1-CG1 4.01Å; Y1094-I1098 PolarHBondContact O-N 3.44Å; Y1094-I1098 WeakPolarHBondContact OH-CD1 3.46Å; L1095-I1098 PolarHBondContact O-N 2.92Å; F1096-I1098 PolarHBondContact O-N 2.85Å; I1098-V1100 VanDerWaalsContact C-N 3.31Å; I1098-V1100 PolarHBondContact O-N 3.19Å; I1098-L1101 CarbonylContact O-C 3.38Å; I1098-L1101 PolarHBondContact O-N 3.31Å; I1098-L1101 VanDerWaalsContact O-N 3.1Å; I1098-E1102 HydrophobicContact CG2-CG 4.16Å; I1098-E1102 WeakPolarHBondContact O-CG 3.48Å; I1098-E1102 PolarHBondContact O-N 2.87Å; I1098-L1138 HydrophobicContact CD1-CD2 3.83Å; I1098-L1138 HydrophobicContact CG1-CD1 4.02Å; I1098-L1138 HydrophobicContact CG1-CD2 4.2Å; I1098-I1146 HydrophobicContact CD1-CD1 4.27Å; I1098-I1146 HydrophobicContact CG1-CD1 4.08Å
1099	K	93.5	Very high	92.3	Very high	56 Å²	56	49.3 Å²	49.3	24%	0.243	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-35.4	-176.3	-73.1	-75.6	155.3	-149.8	0	112.7	L1060 L1063 L1095 F1096 V1097 E1102 A1103	L1060-K1099 HydrophobicContact CD2-CB 3.56Å; L1060-K1099 HydrophobicContact CD2-CG 3.96Å; L1063-K1099 HydrophobicContact CD1-CB 4.15Å; L1095-K1099 HydrophobicContact CD1-CG 3.87Å; L1095-K1099 WeakPolarHBondContact O-CG 3.25Å; L1095-K1099 PolarHBondContact O-N 3.41Å; F1096-K1099 PolarHBondContact O-N 3.34Å; V1097-K1099 PolarHBondContact O-N 2.93Å; K1099-E1102 WeakPolarHBondContact CD-OE2 3.44Å; K1099-E1102 VanDerWaalsContact CE-OE2 3.32Å; K1099-E1102 WeakPolarHBondContact CE-OE2 3.48Å; K1099-E1102 IonicContact NZ-OE1 3.05Å; K1099-E1102 IonicContact NZ-OE2 3.46Å; K1099-E1102 PolarHBondContact NZ-OE2 3.28Å; K1099-A1103 WeakPolarHBondContact O-CB 3.44Å; K1099-A1103 PolarHBondContact O-N 3.45Å; K1099-A1103 VanDerWaalsContact O-N 3.09Å
1100	V	95.6	Very high	92.4	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-68.8	-40.9	172	175	0	0	0	0	111.4	L1075 F1096 V1097 I1098 A1103 C1104 A1115 C1118 A1119	L1075-V1100 HydrophobicContact CD2-CG2 4.5Å; F1096-V1100 HydrophobicContact CD2-CG2 3.84Å; F1096-V1100 HydrophobicContact CE2-CG2 3.45Å; F1096-V1100 VanDerWaalsContact CE2-CG2 3.45Å; F1096-V1100 HydrophobicContact CZ-CG2 4.13Å; F1096-V1100 WeakPolarHBondContact O-CG2 3.39Å; F1096-V1100 PolarHBondContact O-N 3.37Å; V1097-V1100 PolarHBondContact O-N 2.9Å; I1098-V1100 VanDerWaalsContact C-N 3.31Å; I1098-V1100 PolarHBondContact O-N 3.19Å; V1100-A1103 PolarHBondContact O-N 2.96Å; V1100-C1104 PolarHBondContact O-N 3.13Å; V1100-C1104 PolarHBondContact O-SG 3.39Å; V1100-A1115 WeakPolarHBondContact CG1-O 3.44Å; V1100-C1118 HydrophobicContact CG1-CB 4.09Å; V1100-A1119 HydrophobicContact CG1-CB 3.85Å
1101	L	95.5	Very high	92.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-69	-31.8	177.6	-68.1	174.7	0	0	0	113.4	V1097 I1098 C1104 L1135 L1138 I1146 P1149 A1150 M1153	V1097-L1101 HydrophobicContact CG1-CD1 3.63Å; V1097-L1101 HydrophobicContact CG1-CG 4.14Å; V1097-L1101 WeakPolarHBondContact O-CB 3.3Å; V1097-L1101 WeakPolarHBondContact O-CG 3.44Å; V1097-L1101 PolarHBondContact O-N 3.49Å; I1098-L1101 CarbonylContact O-C 3.38Å; I1098-L1101 PolarHBondContact O-N 3.31Å; I1098-L1101 VanDerWaalsContact O-N 3.1Å; L1101-C1104 WeakPolarHBondContact O-CB 3.46Å; L1101-L1135 HydrophobicContact CD1-CD2 3.81Å; L1101-L1138 HydrophobicContact CD1-CD1 3.95Å; L1101-I1146 HydrophobicContact CB-CB 4.19Å; L1101-I1146 HydrophobicContact CB-CD1 4.25Å; L1101-I1146 HydrophobicContact CB-CG2 4.35Å; L1101-I1146 HydrophobicContact CD1-CD1 4.31Å; L1101-P1149 HydrophobicContact CB-CG 4.49Å; L1101-P1149 VanDerWaalsContact CD2-C 3.49Å; L1101-P1149 HydrophobicContact CD2-CB 3.79Å; L1101-P1149 HydrophobicContact CD2-CG 4.31Å; L1101-P1149 WeakPolarHBondContact O-CG 3.13Å; L1101-A1150 HydrophobicContact CD1-CB 4.05Å; L1101-M1153 HydrophobicContact CD2-CB 4.27Å; L1101-M1153 HydrophobicContact CD2-SD 4.08Å
1102	E	93.7	Very high	93.3	Very high	86 Å²	86	41.7 Å²	41.7	40%	0.402	21%	0.21	S	C	.	.	H	α-helix	trans	-65.4	-47.8	169.2	-73.7	176	153.6	0	0	110.6	I1098 K1099 C1104 R1105 I1146	I1098-E1102 HydrophobicContact CG2-CG 4.16Å; I1098-E1102 WeakPolarHBondContact O-CG 3.48Å; I1098-E1102 PolarHBondContact O-N 2.87Å; K1099-E1102 WeakPolarHBondContact CD-OE2 3.44Å; K1099-E1102 VanDerWaalsContact CE-OE2 3.32Å; K1099-E1102 WeakPolarHBondContact CE-OE2 3.48Å; K1099-E1102 IonicContact NZ-OE1 3.05Å; K1099-E1102 IonicContact NZ-OE2 3.46Å; K1099-E1102 PolarHBondContact NZ-OE2 3.28Å; E1102-C1104 PolarHBondContact O-N 2.85Å; E1102-R1105 PolarHBondContact O-N 2.97Å; E1102-I1146 HydrophobicContact CG-CG2 3.96Å
1103	A	95.1	Very high	93.6	Very high	11 Å²	11	46.8 Å²	46.8	9%	0.091	23%	0.227	C	C	.	.	H	α-helix	trans	-63.8	-24	177.4	0	0	0	0	0	113.6	L1075 K1099 V1100 R1105 D1106 A1115	L1075-A1103 HydrophobicContact CD1-CB 4.07Å; L1075-A1103 HydrophobicContact CD2-CB 3.97Å; K1099-A1103 WeakPolarHBondContact O-CB 3.44Å; K1099-A1103 PolarHBondContact O-N 3.45Å; K1099-A1103 VanDerWaalsContact O-N 3.09Å; V1100-A1103 PolarHBondContact O-N 2.96Å; A1103-R1105 PolarHBondContact O-N 3.12Å; A1103-D1106 WeakPolarHBondContact O-CB 3.16Å; A1103-D1106 PolarHBondContact O-N 2.95Å; A1103-D1106 VanDerWaalsContact O-N 3.17Å; A1103-A1115 VanDerWaalsContact C-CB 3.44Å; A1103-A1115 HydrophobicContact CB-CB 3.75Å
1104	C	95	Very high	93.9	Very high	16 Å²	16	46.8 Å²	46.8	11%	0.108	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-3.7	168.7	-67.4	0	0	0	0	113.8	V1100 L1101 E1102 A1115 P1149	V1100-C1104 PolarHBondContact O-N 3.13Å; V1100-C1104 PolarHBondContact O-SG 3.39Å; L1101-C1104 WeakPolarHBondContact O-CB 3.46Å; E1102-C1104 PolarHBondContact O-N 2.85Å; C1104-A1115 HydrophobicContact CB-CB 4.37Å; C1104-P1149 HydrophobicContact CB-CB 3.51Å; C1104-P1149 HydrophobicContact CB-CG 3.91Å
1105	R	91.8	Very high	94.3	Very high	126 Å²	126	45.2 Å²	45.2	48%	0.475	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.3	18.7	175.8	-55.8	-178	74.3	-104	11	113.2	E1102 A1103 H1145 P1149	E1102-R1105 PolarHBondContact O-N 2.97Å; A1103-R1105 PolarHBondContact O-N 3.12Å; R1105-H1145 WeakPolarHBondContact CD-O 3.46Å; R1105-H1145 PolarHBondContact NE-O 3.02Å; R1105-P1149 HydrophobicContact CG-CG 4.26Å
1106	D	93.8	Very high	94.6	Very high	35 Å²	35	47.3 Å²	47.3	19%	0.187	23%	0.23	C	C	.	.			trans	-56.8	154.2	171.4	-162.9	-71.1	0	0	0	111.5	R1071 A1103 E1108 V1111 V1112	R1071-D1106 IonicContact CZ-OD1 2.68Å; R1071-D1106 IonicContact CZ-OD2 2.7Å; R1071-D1106 VanDerWaalsContact CZ-OD2 3.27Å; R1071-D1106 IonicContact NE-OD1 3.19Å; R1071-D1106 IonicContact NE-OD2 2.75Å; R1071-D1106 PolarHBondContact NE-OD2 3.25Å; R1071-D1106 VanDerWaalsContact NH2-CG 3.35Å; R1071-D1106 IonicContact NH2-OD1 3.35Å; R1071-D1106 PolarHBondContact NH2-OD1 2.79Å; R1071-D1106 IonicContact NH2-OD2 3.09Å; R1071-D1106 PolarHBondContact NH2-OD2 3.3Å; A1103-D1106 WeakPolarHBondContact O-CB 3.16Å; A1103-D1106 PolarHBondContact O-N 2.95Å; A1103-D1106 VanDerWaalsContact O-N 3.17Å; D1106-E1108 VanDerWaalsContact C-N 3.25Å; D1106-E1108 PolarHBondContact O-N 3.39Å; D1106-E1108 PolarHBondContact OD1-N 2.95Å; D1106-V1111 HydrophobicContact CB-CB 3.87Å; D1106-V1111 HydrophobicContact CB-CG1 3.82Å; D1106-V1111 WeakPolarHBondContact OD2-CG1 3.44Å; D1106-V1112 HydrophobicContact CB-CG2 4Å; D1106-V1112 WeakPolarHBondContact O-CG2 3.4Å
1107	S	91.4	Very high	94.7	Very high	106 Å²	106	49.5 Å²	49.5	74%	0.741	24%	0.242	S	C	*	.	S	Bend	trans	-64.7	-30.5	173.2	45.5	0	0	0	0	112.5
1108	E	94.2	Very high	94.8	Very high	84 Å²	84	49.4 Å²	49.4	39%	0.393	24%	0.242	S	C	.	.	S	Bend	trans	-96.3	125.7	-172.8	-81.4	-56.2	150.4	0	0	114.5	H1068 D1106 S1110 V1111 V1112	H1068-E1108 HydrophobicContact CB-CB 3.96Å; H1068-E1108 HydrophobicContact CB-CG 3.81Å; D1106-E1108 VanDerWaalsContact C-N 3.25Å; D1106-E1108 PolarHBondContact O-N 3.39Å; D1106-E1108 PolarHBondContact OD1-N 2.95Å; E1108-S1110 PolarHBondContact O-N 3.37Å; E1108-S1110 VanDerWaalsContact O-N 3.12Å; E1108-V1111 HydrophobicContact CB-CG2 3.99Å; E1108-V1111 PolarHBondContact O-N 3.31Å; E1108-V1112 PolarHBondContact O-N 3.12Å
1109	K	93.7	Very high	95	Very high	155 Å²	155	48.4 Å²	48.4	67%	0.674	24%	0.238	S	C	*	.	H	α-helix	trans	-69.5	-13.1	-174.4	-63.7	175.6	-177.1	170	0	113.4	R1113	K1109-R1113 WeakPolarHBondContact O-CG 3.43Å; K1109-R1113 PolarHBondContact O-NH1 3.3Å
1110	S	94.3	Very high	95.1	Very high	46 Å²	46	48.5 Å²	48.5	32%	0.322	24%	0.241	S	C	.	.	H	α-helix	trans	-75.7	-45.3	169.9	47.7	0	0	0	0	110.9	E1108 A1114	E1108-S1110 PolarHBondContact O-N 3.37Å; E1108-S1110 VanDerWaalsContact O-N 3.12Å; S1110-A1114 PolarHBondContact O-N 2.93Å; S1110-A1114 VanDerWaalsContact O-N 3.12Å
1111	V	95.9	Very high	95.1	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-67.2	-48.2	176.8	-170.2	0	0	0	0	110.4	H1068 R1071 A1072 L1075 D1106 E1108 R1113 A1114 A1115	H1068-V1111 HydrophobicContact CB-CG2 3.96Å; H1068-V1111 WeakPolarHBondContact O-CG2 3.5Å; R1071-V1111 HydrophobicContact CB-CG1 4.01Å; R1071-V1111 HydrophobicContact CB-CG2 4.01Å; A1072-V1111 HydrophobicContact CB-CG2 4.15Å; L1075-V1111 HydrophobicContact CD1-CG1 3.55Å; D1106-V1111 HydrophobicContact CB-CB 3.87Å; D1106-V1111 HydrophobicContact CB-CG1 3.82Å; D1106-V1111 WeakPolarHBondContact OD2-CG1 3.44Å; E1108-V1111 HydrophobicContact CB-CG2 3.99Å; E1108-V1111 PolarHBondContact O-N 3.31Å; V1111-R1113 VanDerWaalsContact C-N 3.31Å; V1111-R1113 PolarHBondContact O-N 3.5Å; V1111-A1114 CarbonylContact O-C 3.54Å; V1111-A1114 PolarHBondContact O-N 3.38Å; V1111-A1114 VanDerWaalsContact O-N 3.1Å; V1111-A1115 WeakPolarHBondContact O-CB 3.47Å; V1111-A1115 PolarHBondContact O-N 3.36Å
1112	V	95.7	Very high	95.1	Very high	30 Å²	30	48.7 Å²	48.7	18%	0.182	24%	0.242	C	C	.	.	H	α-helix	trans	-56.5	-43	178.2	174.8	0	0	0	0	111.8	D1106 E1108 A1115 E1116	D1106-V1112 HydrophobicContact CB-CG2 4Å; D1106-V1112 WeakPolarHBondContact O-CG2 3.4Å; E1108-V1112 PolarHBondContact O-N 3.12Å; V1112-A1115 PolarHBondContact O-N 2.98Å; V1112-E1116 HydrophobicContact CG1-CG 4.5Å; V1112-E1116 WeakPolarHBondContact O-CG 3.41Å; V1112-E1116 PolarHBondContact O-N 3.31Å
1113	R	96.8	Very high	95.1	Very high	150 Å²	150	44.7 Å²	44.7	57%	0.566	22%	0.224	S	C	*	.	H	α-helix	trans	-64.8	-46.3	175.4	-75	-176	-166	100.4	-16.9	112.1	K1109 V1111 A1115 E1116 D1117	K1109-R1113 WeakPolarHBondContact O-CG 3.43Å; K1109-R1113 PolarHBondContact O-NH1 3.3Å; V1111-R1113 VanDerWaalsContact C-N 3.31Å; V1111-R1113 PolarHBondContact O-N 3.5Å; R1113-A1115 PolarHBondContact O-N 2.98Å; R1113-E1116 PolarHBondContact O-N 2.89Å; R1113-D1117 WeakPolarHBondContact O-CB 3.43Å; R1113-D1117 PolarHBondContact O-N 3.03Å
1114	A	97	Very high	95	Very high	2 Å²	2	50 Å²	50	2%	0.017	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-31.9	176.7	0	0	0	0	0	112.2	A1072 L1075 S1110 V1111 C1118	A1072-A1114 HydrophobicContact CB-CB 4.25Å; A1072-A1114 WeakPolarHBondContact O-CB 3.46Å; L1075-A1114 HydrophobicContact CB-CB 3.97Å; L1075-A1114 HydrophobicContact CD1-CB 4.03Å; S1110-A1114 PolarHBondContact O-N 2.93Å; S1110-A1114 VanDerWaalsContact O-N 3.12Å; V1111-A1114 CarbonylContact O-C 3.54Å; V1111-A1114 PolarHBondContact O-N 3.38Å; V1111-A1114 VanDerWaalsContact O-N 3.1Å; A1114-C1118 WeakPolarHBondContact O-CB 3.4Å; A1114-C1118 PolarHBondContact O-N 2.83Å
1115	A	97.1	Very high	94.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-73.7	-41.7	175.4	0	0	0	0	0	112.1	L1075 V1100 A1103 C1104 V1111 V1112 R1113 C1118 A1119	L1075-A1115 HydrophobicContact CD1-CB 3.89Å; L1075-A1115 HydrophobicContact CD2-CB 4.36Å; V1100-A1115 WeakPolarHBondContact CG1-O 3.44Å; A1103-A1115 VanDerWaalsContact C-CB 3.44Å; A1103-A1115 HydrophobicContact CB-CB 3.75Å; C1104-A1115 HydrophobicContact CB-CB 4.37Å; V1111-A1115 WeakPolarHBondContact O-CB 3.47Å; V1111-A1115 PolarHBondContact O-N 3.36Å; V1112-A1115 PolarHBondContact O-N 2.98Å; R1113-A1115 PolarHBondContact O-N 2.98Å; A1115-C1118 PolarHBondContact O-N 2.91Å; A1115-A1119 WeakPolarHBondContact O-CB 3.2Å; A1115-A1119 PolarHBondContact O-N 2.8Å
1116	E	95.9	Very high	95	Very high	59 Å²	59	46.1 Å²	46.1	28%	0.276	23%	0.234	S	C	.	.	H	α-helix	trans	-65.3	-42.6	173.2	-70.8	-172.2	124.4	0	0	111.6	V1112 R1113 C1118 A1119 N1120 K1152	V1112-E1116 HydrophobicContact CG1-CG 4.5Å; V1112-E1116 WeakPolarHBondContact O-CG 3.41Å; V1112-E1116 PolarHBondContact O-N 3.31Å; R1113-E1116 PolarHBondContact O-N 2.89Å; E1116-C1118 VanDerWaalsContact C-N 3.34Å; E1116-C1118 PolarHBondContact O-N 2.81Å; E1116-A1119 PolarHBondContact O-N 3.2Å; E1116-N1120 WeakPolarHBondContact O-CB 3.25Å; E1116-N1120 PolarHBondContact O-N 3.02Å; E1116-N1120 PolarHBondContact O-ND2 3.45Å; E1116-N1120 VanDerWaalsContact O-ND2 3.08Å; E1116-K1152 IonicContact OE1-NZ 3.88Å; E1116-K1152 PolarHBondContact OE1-NZ 2.86Å
1117	D	96.6	Very high	94.9	Very high	47 Å²	47	47.1 Å²	47.1	25%	0.251	24%	0.242	S	C	.	.	H	α-helix	trans	-63	-39.2	174.5	-69.2	-27.8	0	0	0	111.6	Q1079 R1113 T1121	Q1079-D1117 PolarHBondContact NE2-O 3.02Å; R1113-D1117 WeakPolarHBondContact O-CB 3.43Å; R1113-D1117 PolarHBondContact O-N 3.03Å; D1117-T1121 PolarHBondContact O-N 2.96Å; D1117-T1121 VanDerWaalsContact O-N 3.1Å; D1117-T1121 PolarHBondContact O-OG1 2.96Å
1118	C	97	Very high	94.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64	-52.5	172.1	-168.8	0	0	0	0	110.8	Q1079 V1100 A1114 A1115 E1116 N1120 T1121 V1122	Q1079-C1118 HydrophobicContact CB-CB 4.23Å; V1100-C1118 HydrophobicContact CG1-CB 4.09Å; A1114-C1118 WeakPolarHBondContact O-CB 3.4Å; A1114-C1118 PolarHBondContact O-N 2.83Å; A1115-C1118 PolarHBondContact O-N 2.91Å; E1116-C1118 VanDerWaalsContact C-N 3.34Å; E1116-C1118 PolarHBondContact O-N 2.81Å; C1118-N1120 VanDerWaalsContact C-N 3.31Å; C1118-N1120 PolarHBondContact O-N 3.39Å; C1118-T1121 CarbonylContact O-C 3.58Å; C1118-T1121 WeakPolarHBondContact O-CA 3.37Å; C1118-T1121 WeakPolarHBondContact O-CB 3.29Å; C1118-T1121 PolarHBondContact O-N 2.82Å; C1118-V1122 WeakPolarHBondContact O-CG2 3.16Å; C1118-V1122 PolarHBondContact O-N 3.39Å
1119	A	96.1	Very high	94.8	Very high	6 Å²	6	43.7 Å²	43.7	5%	0.05	22%	0.215	C	C	.	.	H	α-helix	trans	-56.7	-41.7	179.1	0	0	0	0	0	112.7	V1100 A1115 E1116 T1121 V1122 A1123 M1153	V1100-A1119 HydrophobicContact CG1-CB 3.85Å; A1115-A1119 WeakPolarHBondContact O-CB 3.2Å; A1115-A1119 PolarHBondContact O-N 2.8Å; E1116-A1119 PolarHBondContact O-N 3.2Å; A1119-T1121 VanDerWaalsContact C-N 3.34Å; A1119-V1122 PolarHBondContact O-N 3.22Å; A1119-A1123 WeakPolarHBondContact O-CB 3.38Å; A1119-A1123 PolarHBondContact O-N 2.9Å; A1119-M1153 HydrophobicContact CB-CG 4.41Å; A1119-M1153 HydrophobicContact CB-SD 4.12Å
1120	N	95.2	Very high	94.8	Very high	57 Å²	57	38.1 Å²	38.1	31%	0.305	19%	0.192	S	C	.	.	H	α-helix	trans	-61.8	-41.1	173.5	-69	-30.1	0	0	0	111.6	E1116 C1118 A1123 Q1124	E1116-N1120 WeakPolarHBondContact O-CB 3.25Å; E1116-N1120 PolarHBondContact O-N 3.02Å; E1116-N1120 PolarHBondContact O-ND2 3.45Å; E1116-N1120 VanDerWaalsContact O-ND2 3.08Å; C1118-N1120 VanDerWaalsContact C-N 3.31Å; C1118-N1120 PolarHBondContact O-N 3.39Å; N1120-A1123 PolarHBondContact O-N 2.89Å; N1120-Q1124 VanDerWaalsContact O-CG 3.3Å; N1120-Q1124 WeakPolarHBondContact O-CG 3.07Å; N1120-Q1124 PolarHBondContact O-N 3.19Å
1121	T	95.2	Very high	94.7	Very high	5 Å²	5	36 Å²	36	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-68	-41.7	177.2	-52.5	0	0	0	0	111.2	Q1079 V1082 R1083 D1117 C1118 A1119 A1123 Q1124 N1125	Q1079-T1121 HydrophobicContact CG-CG2 3.99Å; Q1079-T1121 WeakPolarHBondContact CG-OG1 3.31Å; Q1079-T1121 PolarHBondContact NE2-OG1 2.8Å; V1082-T1121 HydrophobicContact CG1-CG2 4.11Å; R1083-T1121 HydrophobicContact CB-CG2 4.1Å; R1083-T1121 PolarHBondContact NH2-OG1 3.38Å; D1117-T1121 PolarHBondContact O-N 2.96Å; D1117-T1121 VanDerWaalsContact O-N 3.1Å; D1117-T1121 PolarHBondContact O-OG1 2.96Å; C1118-T1121 CarbonylContact O-C 3.58Å; C1118-T1121 WeakPolarHBondContact O-CA 3.37Å; C1118-T1121 WeakPolarHBondContact O-CB 3.29Å; C1118-T1121 PolarHBondContact O-N 2.82Å; A1119-T1121 VanDerWaalsContact C-N 3.34Å; T1121-A1123 PolarHBondContact O-N 3.35Å; T1121-Q1124 PolarHBondContact O-N 2.79Å; T1121-Q1124 VanDerWaalsContact O-N 3.12Å; T1121-N1125 WeakPolarHBondContact CG2-ND2 3.46Å; T1121-N1125 PolarHBondContact O-N 2.88Å; T1121-N1125 PolarHBondContact O-ND2 3.17Å
1122	V	94.9	Very high	94.6	Very high	1 Å²	1	36 Å²	36	1%	0.006	18%	0.177	C	C	.	.	H	α-helix	trans	-60	-45.4	174.9	178.9	0	0	0	0	110.6	V1082 F1096 V1097 C1118 A1119 Q1124 N1125 L1126 M1153	V1082-V1122 HydrophobicContact CG1-CG2 3.98Å; V1082-V1122 HydrophobicContact CG2-CG2 4.33Å; F1096-V1122 HydrophobicContact CD1-CG2 4.44Å; F1096-V1122 HydrophobicContact CE1-CG1 4.41Å; F1096-V1122 HydrophobicContact CE1-CG2 3.5Å; F1096-V1122 VanDerWaalsContact CE1-CG2 3.5Å; F1096-V1122 HydrophobicContact CZ-CG2 3.67Å; V1097-V1122 HydrophobicContact CG2-CG1 4.12Å; C1118-V1122 WeakPolarHBondContact O-CG2 3.16Å; C1118-V1122 PolarHBondContact O-N 3.39Å; A1119-V1122 PolarHBondContact O-N 3.22Å; V1122-Q1124 PolarHBondContact O-N 3.38Å; V1122-Q1124 VanDerWaalsContact O-N 3.15Å; V1122-N1125 PolarHBondContact O-N 3.16Å; V1122-L1126 HydrophobicContact CG1-CB 4.48Å; V1122-L1126 HydrophobicContact CG1-CD1 3.57Å; V1122-L1126 HydrophobicContact CG1-CG 3.89Å; V1122-L1126 PolarHBondContact O-N 2.77Å; V1122-M1153 HydrophobicContact CB-CE 3.7Å; V1122-M1153 HydrophobicContact CG1-CE 3.44Å; V1122-M1153 VanDerWaalsContact CG1-CE 3.44Å
1123	A	94.1	Very high	94.5	Very high	2 Å²	2	36.8 Å²	36.8	2%	0.017	18%	0.181	C	C	.	.	H	α-helix	trans	-67.2	-8.3	177.1	0	0	0	0	0	114.9	A1119 N1120 T1121 M1153 Q1156 V1157 N1160	A1119-A1123 WeakPolarHBondContact O-CB 3.38Å; A1119-A1123 PolarHBondContact O-N 2.9Å; N1120-A1123 PolarHBondContact O-N 2.89Å; T1121-A1123 PolarHBondContact O-N 3.35Å; A1123-M1153 HydrophobicContact CB-CE 4.34Å; A1123-M1153 HydrophobicContact CB-CG 4.21Å; A1123-Q1156 HydrophobicContact CB-CB 3.99Å; A1123-V1157 HydrophobicContact CB-CG2 3.63Å; A1123-N1160 PolarHBondContact O-ND2 2.78Å
1124	Q	93.4	Very high	94.3	Very high	123 Å²	123	29.8 Å²	29.8	58%	0.575	15%	0.154	S	C	*	.	H	α-helix	trans	-105.5	-27.8	175.7	-74.4	171.6	-11.3	0	0	113.4	N1120 T1121 V1122	N1120-Q1124 VanDerWaalsContact O-CG 3.3Å; N1120-Q1124 WeakPolarHBondContact O-CG 3.07Å; N1120-Q1124 PolarHBondContact O-N 3.19Å; T1121-Q1124 PolarHBondContact O-N 2.79Å; T1121-Q1124 VanDerWaalsContact O-N 3.12Å; V1122-Q1124 PolarHBondContact O-N 3.38Å; V1122-Q1124 VanDerWaalsContact O-N 3.15Å
1125	N	93.4	Very high	94.2	Very high	52 Å²	52	29.7 Å²	29.7	28%	0.278	15%	0.154	S	C	.	.	H	α-helix	trans	-113	-24.7	-168.6	-66.6	-99.2	0	0	0	114	P1086 T1121 V1122	P1086-N1125 HydrophobicContact CB-CB 4.46Å; P1086-N1125 WeakPolarHBondContact CB-O 3.28Å; T1121-N1125 WeakPolarHBondContact CG2-ND2 3.46Å; T1121-N1125 PolarHBondContact O-N 2.88Å; T1121-N1125 PolarHBondContact O-ND2 3.17Å; V1122-N1125 PolarHBondContact O-N 3.16Å
1126	L	92.4	Very high	94	Very high	7 Å²	7	30.1 Å²	30.1	4%	0.037	16%	0.156	C	C	.	.	S	Bend	trans	-83.1	155	171.1	-67	-166.6	0	0	0	111.6	V1082 P1086 F1089 A1093 V1122 Q1128	V1082-L1126 HydrophobicContact CG2-CD1 4.48Å; V1082-L1126 HydrophobicContact CG2-CD2 3.58Å; V1082-L1126 HydrophobicContact CG2-CG 3.83Å; P1086-L1126 HydrophobicContact CB-CD2 3.86Å; P1086-L1126 WeakPolarHBondContact O-CD2 3.36Å; F1089-L1126 HydrophobicContact CB-CD1 4.42Å; F1089-L1126 HydrophobicContact CB-CD2 3.88Å; F1089-L1126 HydrophobicContact CG-CD2 4.47Å; A1093-L1126 HydrophobicContact CB-CD1 4.31Å; V1122-L1126 HydrophobicContact CG1-CB 4.48Å; V1122-L1126 HydrophobicContact CG1-CD1 3.57Å; V1122-L1126 HydrophobicContact CG1-CG 3.89Å; V1122-L1126 PolarHBondContact O-N 2.77Å; L1126-Q1128 PolarHBondContact O-N 2.88Å
1127	P	91.9	Very high	93.7	Very high	56 Å²	56	30.1 Å²	30.1	36%	0.364	16%	0.161	S	C	.	.			trans	-55.6	129.7	172.4	-24.8	34.3	0	0	0	111.4	H1090 E1129 L1130 C1131	H1090-P1127 WeakPolarHBondContact NE2-CG 3.45Å; P1127-E1129 VanDerWaalsContact C-N 3.31Å; P1127-E1129 PolarHBondContact O-N 3.41Å; P1127-L1130 HydrophobicContact CB-CB 4.16Å; P1127-L1130 WeakPolarHBondContact O-CB 3.43Å; P1127-L1130 PolarHBondContact O-N 3.37Å; P1127-L1130 VanDerWaalsContact O-N 3.09Å; P1127-C1131 PolarHBondContact O-N 3.33Å
1128	Q	92.2	Very high	93.5	Very high	57 Å²	57	28 Å²	28	27%	0.266	15%	0.15	S	C	.	.	H	α-helix	trans	-63.3	-39.1	-173.4	-63.1	162.5	-0.3	0	0	111.7	L1126 L1130 C1131 L1132 V1157 N1160 S1161 L1165	L1126-Q1128 PolarHBondContact O-N 2.88Å; Q1128-L1130 VanDerWaalsContact C-N 3.32Å; Q1128-L1130 PolarHBondContact O-N 3.25Å; Q1128-C1131 PolarHBondContact O-N 3.47Å; Q1128-L1132 WeakPolarHBondContact O-CG 3.42Å; Q1128-L1132 PolarHBondContact O-N 3.16Å; Q1128-V1157 HydrophobicContact CB-CG1 3.93Å; Q1128-V1157 HydrophobicContact CG-CG1 4.29Å; Q1128-N1160 PolarHBondContact NE2-O 3.04Å; Q1128-S1161 WeakPolarHBondContact CB-OG 3.31Å; Q1128-S1161 VanDerWaalsContact CD-OG 3.29Å; Q1128-S1161 PolarHBondContact OE1-OG 3.12Å; Q1128-L1165 HydrophobicContact CB-CD2 3.73Å
1129	E	92.2	Very high	93.3	Very high	61 Å²	61	28.4 Å²	28.4	29%	0.285	15%	0.152	S	C	.	.	H	α-helix	trans	-56.3	-45.6	173.9	-163.9	-159.6	151.7	0	0	111.5	P1127 C1131 L1132 N1133 L1165 F1169	P1127-E1129 VanDerWaalsContact C-N 3.31Å; P1127-E1129 PolarHBondContact O-N 3.41Å; E1129-C1131 PolarHBondContact O-N 2.99Å; E1129-L1132 PolarHBondContact O-N 2.83Å; E1129-N1133 VanDerWaalsContact O-CB 3.27Å; E1129-N1133 WeakPolarHBondContact O-CB 3.22Å; E1129-N1133 PolarHBondContact O-N 2.88Å; E1129-N1133 PolarHBondContact O-ND2 3.12Å; E1129-L1165 HydrophobicContact CB-CD1 4.34Å; E1129-L1165 HydrophobicContact CG-CD1 4.34Å; E1129-F1169 HydrophobicContact CG-CE2 3.74Å; E1129-F1169 HydrophobicContact CG-CZ 3.63Å
1130	L	92.5	Very high	92.9	Very high	38 Å²	38	31.3 Å²	31.3	20%	0.199	17%	0.167	C	C	.	.	H	α-helix	trans	-62	-43.5	176.5	-178.8	64.5	0	0	0	111.3	A1093 P1127 Q1128 N1133 V1134	A1093-L1130 HydrophobicContact CB-CD1 4.17Å; A1093-L1130 HydrophobicContact CB-CD2 3.65Å; A1093-L1130 HydrophobicContact CB-CG 3.9Å; P1127-L1130 HydrophobicContact CB-CB 4.16Å; P1127-L1130 WeakPolarHBondContact O-CB 3.43Å; P1127-L1130 PolarHBondContact O-N 3.37Å; P1127-L1130 VanDerWaalsContact O-N 3.09Å; Q1128-L1130 VanDerWaalsContact C-N 3.32Å; Q1128-L1130 PolarHBondContact O-N 3.25Å; L1130-N1133 PolarHBondContact O-N 3.32Å; L1130-V1134 WeakPolarHBondContact O-CG2 3.41Å; L1130-V1134 PolarHBondContact O-N 3.16Å
1131	C	93.8	Very high	92.5	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.014	17%	0.17	C	C	.	.	H	α-helix	trans	-65	-41.2	174.9	-68.7	0	0	0	0	112.9	P1127 Q1128 E1129 V1134 L1135 V1157	P1127-C1131 PolarHBondContact O-N 3.33Å; Q1128-C1131 PolarHBondContact O-N 3.47Å; E1129-C1131 PolarHBondContact O-N 2.99Å; C1131-V1134 PolarHBondContact O-N 2.83Å; C1131-L1135 HydrophobicContact CB-CD1 4.34Å; C1131-L1135 VanDerWaalsContact O-CB 3.24Å; C1131-L1135 WeakPolarHBondContact O-CB 3.36Å; C1131-L1135 WeakPolarHBondContact O-CD1 3.38Å; C1131-L1135 WeakPolarHBondContact O-CG 3.46Å; C1131-L1135 PolarHBondContact O-N 3.42Å; C1131-V1157 HydrophobicContact CB-CG1 4.08Å; C1131-V1157 HydrophobicContact CB-CG2 3.72Å
1132	L	94.2	Very high	91.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67.3	-40.7	176.8	-66.4	-176.4	0	0	0	111.6	Q1128 E1129 V1134 L1135 T1136 Q1154 V1157 I1158 F1169 L1173	Q1128-L1132 WeakPolarHBondContact O-CG 3.42Å; Q1128-L1132 PolarHBondContact O-N 3.16Å; E1129-L1132 PolarHBondContact O-N 2.83Å; L1132-V1134 VanDerWaalsContact C-N 3.3Å; L1132-V1134 PolarHBondContact O-N 3.34Å; L1132-L1135 PolarHBondContact O-N 3.22Å; L1132-T1136 WeakPolarHBondContact O-CB 3.38Å; L1132-T1136 PolarHBondContact O-N 3.45Å; L1132-T1136 PolarHBondContact O-OG1 2.8Å; L1132-Q1154 HydrophobicContact CD2-CG 3.99Å; L1132-V1157 HydrophobicContact CD2-CB 4.2Å; L1132-V1157 HydrophobicContact CD2-CG1 3.69Å; L1132-V1157 HydrophobicContact CG-CG1 3.85Å; L1132-I1158 HydrophobicContact CD2-CG1 4.15Å; L1132-F1169 HydrophobicContact CB-CD1 3.75Å; L1132-F1169 HydrophobicContact CB-CE1 3.81Å; L1132-F1169 HydrophobicContact CB-CG 4.34Å; L1132-F1169 HydrophobicContact CB-CZ 4.47Å; L1132-F1169 HydrophobicContact CD1-CB 4.12Å; L1132-F1169 HydrophobicContact CD1-CD1 4.15Å; L1132-F1169 HydrophobicContact CD1-CD2 4.25Å; L1132-F1169 HydrophobicContact CD1-CG 3.89Å; L1132-L1173 HydrophobicContact CD2-CD2 4.16Å
1133	N	92.8	Very high	90.7	Very high	48 Å²	48	41 Å²	41	26%	0.257	22%	0.218	S	C	.	.	H	α-helix	trans	-59.9	-37.4	173.9	-81.9	-37	0	0	0	112.2	M879 E1129 L1130 P1137 F1169	M879-N1133 HydrophobicContact CE-CB 4.2Å; E1129-N1133 VanDerWaalsContact O-CB 3.27Å; E1129-N1133 WeakPolarHBondContact O-CB 3.22Å; E1129-N1133 PolarHBondContact O-N 2.88Å; E1129-N1133 PolarHBondContact O-ND2 3.12Å; L1130-N1133 PolarHBondContact O-N 3.32Å; N1133-P1137 WeakPolarHBondContact O-CD 3.44Å; N1133-P1137 WeakPolarHBondContact O-CG 3.24Å; N1133-F1169 WeakPolarHBondContact OD1-CE1 3.49Å
1134	V	92.8	Very high	89.9	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.018	23%	0.231	C	C	.	.	H	α-helix	trans	-77.8	-45.3	175.7	170.6	0	0	0	0	112.6	Y1094 V1097 L1130 C1131 L1132 L1138	Y1094-V1134 HydrophobicContact CD2-CB 4.5Å; Y1094-V1134 HydrophobicContact CD2-CG1 3.91Å; Y1094-V1134 HydrophobicContact CD2-CG2 4.26Å; Y1094-V1134 HydrophobicContact CG-CG1 4.49Å; V1097-V1134 HydrophobicContact CB-CG1 3.87Å; V1097-V1134 HydrophobicContact CG1-CG1 3.76Å; V1097-V1134 HydrophobicContact CG2-CG1 4.36Å; L1130-V1134 WeakPolarHBondContact O-CG2 3.41Å; L1130-V1134 PolarHBondContact O-N 3.16Å; C1131-V1134 PolarHBondContact O-N 2.83Å; L1132-V1134 VanDerWaalsContact C-N 3.3Å; L1132-V1134 PolarHBondContact O-N 3.34Å; V1134-L1138 HydrophobicContact CG1-CD1 4.39Å; V1134-L1138 WeakPolarHBondContact O-CG 3.49Å
1135	L	94.4	Very high	89.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-76.2	-33.3	-171.2	-70.8	165.7	0	0	0	113.5	V1097 L1101 C1131 L1132 L1138 I1139 A1150 M1153 Q1154 V1157	V1097-L1135 HydrophobicContact CG1-CD2 3.93Å; V1097-L1135 HydrophobicContact CG1-CG 4.49Å; L1101-L1135 HydrophobicContact CD1-CD2 3.81Å; C1131-L1135 HydrophobicContact CB-CD1 4.34Å; C1131-L1135 VanDerWaalsContact O-CB 3.24Å; C1131-L1135 WeakPolarHBondContact O-CB 3.36Å; C1131-L1135 WeakPolarHBondContact O-CD1 3.38Å; C1131-L1135 WeakPolarHBondContact O-CG 3.46Å; C1131-L1135 PolarHBondContact O-N 3.42Å; L1132-L1135 PolarHBondContact O-N 3.22Å; L1135-L1138 PolarHBondContact O-N 3.38Å; L1135-I1139 HydrophobicContact CB-CD1 4.47Å; L1135-I1139 WeakPolarHBondContact O-CG1 3.25Å; L1135-I1139 PolarHBondContact O-N 2.72Å; L1135-I1139 VanDerWaalsContact O-N 3.09Å; L1135-A1150 HydrophobicContact CD2-CB 4.29Å; L1135-M1153 HydrophobicContact CD1-CB 4.23Å; L1135-M1153 HydrophobicContact CD1-CG 3.93Å; L1135-M1153 HydrophobicContact CD1-SD 4.25Å; L1135-M1153 HydrophobicContact CD2-CB 4.25Å; L1135-M1153 HydrophobicContact CD2-CG 4.38Å; L1135-M1153 HydrophobicContact CD2-SD 4.03Å; L1135-Q1154 HydrophobicContact CB-CB 4.34Å; L1135-Q1154 HydrophobicContact CB-CG 4.46Å; L1135-Q1154 HydrophobicContact CD1-CB 4.13Å; L1135-V1157 HydrophobicContact CD1-CG2 4.1Å
1136	T	93.1	Very high	89.4	Confident	8 Å²	8	43 Å²	43	5%	0.049	23%	0.227	C	C	.	.	H	α-helix	trans	-67.7	-43.7	-173.2	-52.7	0	0	0	0	113	L1132 L1138 I1139 N1140 Q1154 A1172 L1173	L1132-T1136 WeakPolarHBondContact O-CB 3.38Å; L1132-T1136 PolarHBondContact O-N 3.45Å; L1132-T1136 PolarHBondContact O-OG1 2.8Å; T1136-L1138 VanDerWaalsContact C-N 3.3Å; T1136-L1138 PolarHBondContact O-N 3.39Å; T1136-I1139 PolarHBondContact O-N 2.96Å; T1136-N1140 PolarHBondContact O-N 3.08Å; T1136-N1140 VanDerWaalsContact O-N 3.16Å; T1136-N1140 PolarHBondContact O-ND2 3.07Å; T1136-N1140 VanDerWaalsContact O-ND2 3.15Å; T1136-Q1154 PolarHBondContact OG1-NE2 3.36Å; T1136-A1172 HydrophobicContact CG2-CB 3.96Å; T1136-A1172 WeakPolarHBondContact CG2-O 3.44Å; T1136-L1173 HydrophobicContact CG2-CD2 4.39Å; T1136-L1173 WeakPolarHBondContact OG1-CD2 3.38Å
1137	P	90.3	Very high	89.3	Confident	60 Å²	60	43.1 Å²	43.1	39%	0.39	23%	0.227	S	C	.	.	H	α-helix	trans	-57.9	-39.3	170.7	-26	35.7	0	0	0	113.4	M879 N1133 N1140 D1141	M879-P1137 HydrophobicContact SD-CG 4.48Å; N1133-P1137 WeakPolarHBondContact O-CD 3.44Å; N1133-P1137 WeakPolarHBondContact O-CG 3.24Å; P1137-N1140 PolarHBondContact O-N 3.4Å; P1137-D1141 PolarHBondContact O-N 3.02Å
1138	L	91.2	Very high	89.4	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-63.8	-48.6	-179.5	-57.6	175.3	0	0	0	111.2	Y1094 I1098 L1101 V1134 L1135 T1136 N1140 D1141 L1144 I1146 N1147	Y1094-L1138 HydrophobicContact CE2-CD2 4.13Å; Y1094-L1138 WeakPolarHBondContact OH-CD2 3.48Å; I1098-L1138 HydrophobicContact CD1-CD2 3.83Å; I1098-L1138 HydrophobicContact CG1-CD1 4.02Å; I1098-L1138 HydrophobicContact CG1-CD2 4.2Å; L1101-L1138 HydrophobicContact CD1-CD1 3.95Å; V1134-L1138 HydrophobicContact CG1-CD1 4.39Å; V1134-L1138 WeakPolarHBondContact O-CG 3.49Å; L1135-L1138 PolarHBondContact O-N 3.38Å; T1136-L1138 VanDerWaalsContact C-N 3.3Å; T1136-L1138 PolarHBondContact O-N 3.39Å; L1138-N1140 VanDerWaalsContact C-N 3.26Å; L1138-N1140 PolarHBondContact O-N 2.92Å; L1138-D1141 PolarHBondContact O-N 3.18Å; L1138-D1141 VanDerWaalsContact O-N 3.13Å; L1138-L1144 HydrophobicContact CB-CD1 4.16Å; L1138-L1144 HydrophobicContact CD2-CD1 3.73Å; L1138-I1146 HydrophobicContact CD1-CD1 4.18Å; L1138-I1146 HydrophobicContact CD2-CD1 4.44Å; L1138-N1147 PolarHBondContact O-OD1 2.89Å
1139	I	92.8	Very high	89.5	Confident	8 Å²	8	40 Å²	40	4%	0.041	21%	0.21	C	C	.	.	H	α-helix	trans	-67.8	-26.8	-177.9	-64.8	166.2	0	0	0	112.2	L1135 T1136 A1150 I1151 Q1154 L1177	L1135-I1139 HydrophobicContact CB-CD1 4.47Å; L1135-I1139 WeakPolarHBondContact O-CG1 3.25Å; L1135-I1139 PolarHBondContact O-N 2.72Å; L1135-I1139 VanDerWaalsContact O-N 3.09Å; T1136-I1139 PolarHBondContact O-N 2.96Å; I1139-A1150 HydrophobicContact CD1-CB 4.15Å; I1139-A1150 HydrophobicContact CG1-CB 3.65Å; I1139-I1151 HydrophobicContact CB-CG1 4.44Å; I1139-I1151 HydrophobicContact CD1-CB 4.49Å; I1139-I1151 HydrophobicContact CD1-CG1 3.94Å; I1139-I1151 HydrophobicContact CG1-CG1 3.88Å; I1139-I1151 HydrophobicContact CG2-CD1 4.24Å; I1139-I1151 HydrophobicContact CG2-CG1 3.73Å; I1139-Q1154 HydrophobicContact CD1-CB 3.7Å; I1139-Q1154 VanDerWaalsContact CD1-CD 3.4Å; I1139-Q1154 HydrophobicContact CD1-CG 4.1Å; I1139-L1177 HydrophobicContact CG2-CD2 4.45Å
1140	N	88.9	Confident	89.7	Confident	67 Å²	67	37.1 Å²	37.1	36%	0.358	20%	0.196	S	C	.	.	H	α-helix	trans	-72.2	-28.2	174.2	-75.6	-31.6	0	0	0	112.6	T1136 P1137 L1138 S1142 G1176	T1136-N1140 PolarHBondContact O-N 3.08Å; T1136-N1140 VanDerWaalsContact O-N 3.16Å; T1136-N1140 PolarHBondContact O-ND2 3.07Å; T1136-N1140 VanDerWaalsContact O-ND2 3.15Å; P1137-N1140 PolarHBondContact O-N 3.4Å; L1138-N1140 VanDerWaalsContact C-N 3.26Å; L1138-N1140 PolarHBondContact O-N 2.92Å; N1140-S1142 PolarHBondContact O-N 2.97Å; N1140-G1176 WeakPolarHBondContact OD1-CA 3.24Å; N1140-G1176 PolarHBondContact OD1-N 2.87Å
1141	D	85.6	Confident	89.8	Confident	69 Å²	69	35.4 Å²	35.4	37%	0.369	19%	0.187	S	C	.	.			trans	-83.9	93.4	172.8	-173.8	-0.6	0	0	0	111.8	P1137 L1138 Q1143 L1144 N1147	P1137-D1141 PolarHBondContact O-N 3.02Å; L1138-D1141 PolarHBondContact O-N 3.18Å; L1138-D1141 VanDerWaalsContact O-N 3.13Å; D1141-Q1143 PolarHBondContact O-N 3.1Å; D1141-Q1143 WeakPolarHBondContact OD1-CB 3.42Å; D1141-Q1143 PolarHBondContact OD1-N 3.46Å; D1141-L1144 HydrophobicContact CB-CD1 4.02Å; D1141-L1144 HydrophobicContact CB-CG 3.95Å; D1141-L1144 PolarHBondContact O-N 3.33Å; D1141-N1147 PolarHBondContact O-ND2 3.48Å
1142	S	76.1	Confident	89.9	Confident	53 Å²	53	39.3 Å²	39.3	37%	0.371	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49	-23.1	173.8	64.5	0	0	0	0	116	N1140 N1147	N1140-S1142 PolarHBondContact O-N 2.97Å; S1142-N1147 PolarHBondContact O-ND2 3.19Å
1143	Q	76.1	Confident	90	Very high	144 Å²	144	39.4 Å²	39.4	67%	0.673	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-19.3	-178.1	-54.4	-56	-75	0	0	112.9	D1141 H1145	D1141-Q1143 PolarHBondContact O-N 3.1Å; D1141-Q1143 WeakPolarHBondContact OD1-CB 3.42Å; D1141-Q1143 PolarHBondContact OD1-N 3.46Å; Q1143-H1145 PolarHBondContact O-N 3.05Å
1144	L	78.4	Confident	90.1	Very high	57 Å²	57	37.2 Å²	37.2	30%	0.298	19%	0.193	S	C	.	.			trans	-70.1	117	-178.7	-67.7	-178.4	0	0	0	111.9	L1138 D1141 I1146 N1147	L1138-L1144 HydrophobicContact CB-CD1 4.16Å; L1138-L1144 HydrophobicContact CD2-CD1 3.73Å; D1141-L1144 HydrophobicContact CB-CD1 4.02Å; D1141-L1144 HydrophobicContact CB-CG 3.95Å; D1141-L1144 PolarHBondContact O-N 3.33Å; L1144-I1146 HydrophobicContact CB-CG1 4.1Å; L1144-I1146 PolarHBondContact O-N 2.91Å; L1144-N1147 WeakPolarHBondContact O-CB 3.16Å; L1144-N1147 PolarHBondContact O-N 3.37Å; L1144-N1147 VanDerWaalsContact O-N 3.07Å; L1144-N1147 PolarHBondContact O-ND2 3.3Å
1145	H	83.8	Confident	90.3	Very high	148 Å²	148	38.8 Å²	38.8	69%	0.685	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-16.4	177.5	-61.5	-31.9	0	0	0	113.8	R1105 Q1143 N1147	R1105-H1145 WeakPolarHBondContact CD-O 3.46Å; R1105-H1145 PolarHBondContact NE-O 3.02Å; Q1143-H1145 PolarHBondContact O-N 3.05Å; H1145-N1147 VanDerWaalsContact C-N 3.3Å; H1145-N1147 PolarHBondContact O-N 3.42Å
1146	I	91.9	Very high	90.3	Very high	15 Å²	15	41.5 Å²	41.5	8%	0.077	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	4.3	175.4	59.9	169.2	0	0	0	114.7	I1098 L1101 E1102 L1138 L1144 L1148 P1149 A1150	I1098-I1146 HydrophobicContact CD1-CD1 4.27Å; I1098-I1146 HydrophobicContact CG1-CD1 4.08Å; L1101-I1146 HydrophobicContact CB-CB 4.19Å; L1101-I1146 HydrophobicContact CB-CD1 4.25Å; L1101-I1146 HydrophobicContact CB-CG2 4.35Å; L1101-I1146 HydrophobicContact CD1-CD1 4.31Å; E1102-I1146 HydrophobicContact CG-CG2 3.96Å; L1138-I1146 HydrophobicContact CD1-CD1 4.18Å; L1138-I1146 HydrophobicContact CD2-CD1 4.44Å; L1144-I1146 HydrophobicContact CB-CG1 4.1Å; L1144-I1146 PolarHBondContact O-N 2.91Å; I1146-L1148 VanDerWaalsContact C-N 3.32Å; I1146-L1148 PolarHBondContact O-N 2.91Å; I1146-P1149 HydrophobicContact CB-CG 4.43Å; I1146-P1149 WeakPolarHBondContact O-CD 3.17Å; I1146-P1149 VanDerWaalsContact O-CG 3.27Å; I1146-P1149 WeakPolarHBondContact O-CG 3.23Å; I1146-A1150 VanDerWaalsContact O-CB 3.3Å; I1146-A1150 WeakPolarHBondContact O-CB 3.4Å; I1146-A1150 PolarHBondContact O-N 3.46Å
1147	N	90.5	Very high	90.4	Very high	8 Å²	8	41.1 Å²	41.1	4%	0.043	21%	0.211	C	C	.	.	H	α-helix	trans	-57.7	-36.5	-178.7	-79.3	-23.9	0	0	0	114.7	L1138 D1141 S1142 L1144 H1145 A1150 I1151 I1188	L1138-N1147 PolarHBondContact O-OD1 2.89Å; D1141-N1147 PolarHBondContact O-ND2 3.48Å; S1142-N1147 PolarHBondContact O-ND2 3.19Å; L1144-N1147 WeakPolarHBondContact O-CB 3.16Å; L1144-N1147 PolarHBondContact O-N 3.37Å; L1144-N1147 VanDerWaalsContact O-N 3.07Å; L1144-N1147 PolarHBondContact O-ND2 3.3Å; H1145-N1147 VanDerWaalsContact C-N 3.3Å; H1145-N1147 PolarHBondContact O-N 3.42Å; N1147-A1150 PolarHBondContact O-N 2.92Å; N1147-I1151 WeakPolarHBondContact O-CD1 3.36Å; N1147-I1151 WeakPolarHBondContact O-CG1 3.47Å; N1147-I1151 PolarHBondContact O-N 3.37Å; N1147-I1188 HydrophobicContact CB-CD1 4.29Å
1148	L	93.8	Very high	90.6	Very high	39 Å²	39	38.2 Å²	38.2	20%	0.204	19%	0.192	C	C	.	.	H	α-helix	trans	-63.3	-55.1	177.8	179.7	59.7	0	0	0	113.3	I1146 A1150 K1152 A1187 I1188 A1191	I1146-L1148 VanDerWaalsContact C-N 3.32Å; I1146-L1148 PolarHBondContact O-N 2.91Å; L1148-A1150 VanDerWaalsContact C-N 3.33Å; L1148-K1152 PolarHBondContact O-N 3.42Å; L1148-A1187 HydrophobicContact CD1-CB 3.91Å; L1148-A1187 HydrophobicContact CD2-CB 3.7Å; L1148-A1187 HydrophobicContact CG-CB 4.48Å; L1148-I1188 HydrophobicContact CB-CD1 4.23Å; L1148-I1188 HydrophobicContact CB-CG1 3.74Å; L1148-I1188 HydrophobicContact CD1-CG1 4.04Å; L1148-I1188 HydrophobicContact CG-CG1 4.41Å; L1148-A1191 HydrophobicContact CD1-CB 3.88Å
1149	P	95	Very high	90.7	Very high	10 Å²	10	42.2 Å²	42.2	7%	0.065	21%	0.21	C	C	.	.	H	α-helix	trans	-67	-31.3	175.1	26.1	-34.3	0	0	0	112.8	L1101 C1104 R1105 I1146 I1151 K1152 M1153	L1101-P1149 HydrophobicContact CB-CG 4.49Å; L1101-P1149 VanDerWaalsContact CD2-C 3.49Å; L1101-P1149 HydrophobicContact CD2-CB 3.79Å; L1101-P1149 HydrophobicContact CD2-CG 4.31Å; L1101-P1149 WeakPolarHBondContact O-CG 3.13Å; C1104-P1149 HydrophobicContact CB-CB 3.51Å; C1104-P1149 HydrophobicContact CB-CG 3.91Å; R1105-P1149 HydrophobicContact CG-CG 4.26Å; I1146-P1149 HydrophobicContact CB-CG 4.43Å; I1146-P1149 WeakPolarHBondContact O-CD 3.17Å; I1146-P1149 VanDerWaalsContact O-CG 3.27Å; I1146-P1149 WeakPolarHBondContact O-CG 3.23Å; P1149-I1151 PolarHBondContact O-N 3.49Å; P1149-K1152 WeakPolarHBondContact O-CB 3.46Å; P1149-K1152 PolarHBondContact O-N 2.94Å; P1149-M1153 WeakPolarHBondContact O-CB 3.49Å; P1149-M1153 PolarHBondContact O-N 3.44Å
1150	A	95.7	Very high	90.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.8	-47	176.3	0	0	0	0	0	111.6	L1101 L1135 I1139 I1146 N1147 L1148 K1152 M1153 Q1154	L1101-A1150 HydrophobicContact CD1-CB 4.05Å; L1135-A1150 HydrophobicContact CD2-CB 4.29Å; I1139-A1150 HydrophobicContact CD1-CB 4.15Å; I1139-A1150 HydrophobicContact CG1-CB 3.65Å; I1146-A1150 VanDerWaalsContact O-CB 3.3Å; I1146-A1150 WeakPolarHBondContact O-CB 3.4Å; I1146-A1150 PolarHBondContact O-N 3.46Å; N1147-A1150 PolarHBondContact O-N 2.92Å; L1148-A1150 VanDerWaalsContact C-N 3.33Å; A1150-K1152 PolarHBondContact O-N 3.43Å; A1150-M1153 PolarHBondContact O-N 3.09Å; A1150-Q1154 WeakPolarHBondContact O-CB 3.34Å; A1150-Q1154 PolarHBondContact O-N 3.06Å
1151	I	95.5	Very high	90.9	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-64.4	-39	176.5	-63.9	162.7	0	0	0	111.5	I1139 N1147 P1149 M1153 M1155 L1177 A1180 I1188 A1191 C1195	I1139-I1151 HydrophobicContact CB-CG1 4.44Å; I1139-I1151 HydrophobicContact CD1-CB 4.49Å; I1139-I1151 HydrophobicContact CD1-CG1 3.94Å; I1139-I1151 HydrophobicContact CG1-CG1 3.88Å; I1139-I1151 HydrophobicContact CG2-CD1 4.24Å; I1139-I1151 HydrophobicContact CG2-CG1 3.73Å; N1147-I1151 WeakPolarHBondContact O-CD1 3.36Å; N1147-I1151 WeakPolarHBondContact O-CG1 3.47Å; N1147-I1151 PolarHBondContact O-N 3.37Å; P1149-I1151 PolarHBondContact O-N 3.49Å; I1151-M1153 VanDerWaalsContact C-N 3.34Å; I1151-M1153 PolarHBondContact O-N 3.14Å; I1151-M1155 WeakPolarHBondContact O-CB 3.13Å; I1151-M1155 PolarHBondContact O-N 3.37Å; I1151-L1177 HydrophobicContact CG1-CD2 4.41Å; I1151-L1177 HydrophobicContact CG2-CD2 4.04Å; I1151-A1180 HydrophobicContact CD1-CB 3.65Å; I1151-I1188 HydrophobicContact CD1-CG2 3.95Å; I1151-A1191 HydrophobicContact CB-CB 4.29Å; I1151-A1191 VanDerWaalsContact CG2-C 3.5Å; I1151-A1191 HydrophobicContact CG2-CB 3.78Å; I1151-C1195 HydrophobicContact CG2-CB 3.99Å
1152	K	95.3	Very high	91.2	Very high	84 Å²	84	40.8 Å²	40.8	37%	0.365	21%	0.207	S	C	.	.	H	α-helix	trans	-59.1	-45.2	173.5	-75.6	178.1	173.3	178.5	0	111.6	E1116 L1148 P1149 A1150 M1155 Q1156	E1116-K1152 IonicContact OE1-NZ 3.88Å; E1116-K1152 PolarHBondContact OE1-NZ 2.86Å; L1148-K1152 PolarHBondContact O-N 3.42Å; P1149-K1152 WeakPolarHBondContact O-CB 3.46Å; P1149-K1152 PolarHBondContact O-N 2.94Å; A1150-K1152 PolarHBondContact O-N 3.43Å; K1152-M1155 WeakPolarHBondContact O-CB 3.21Å; K1152-Q1156 PolarHBondContact O-N 2.86Å
1153	M	95.6	Very high	91.9	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.015	21%	0.207	C	C	.	.	H	α-helix	trans	-70.2	-42.2	-178.7	-170.3	178.2	173	0	0	111.4	V1097 L1101 A1119 V1122 A1123 L1135 P1149 A1150 I1151 M1155 Q1156 V1157	V1097-M1153 HydrophobicContact CG1-CE 4.39Å; V1097-M1153 HydrophobicContact CG1-SD 4.1Å; V1097-M1153 HydrophobicContact CG2-CE 4.18Å; L1101-M1153 HydrophobicContact CD2-CB 4.27Å; L1101-M1153 HydrophobicContact CD2-SD 4.08Å; A1119-M1153 HydrophobicContact CB-CG 4.41Å; A1119-M1153 HydrophobicContact CB-SD 4.12Å; V1122-M1153 HydrophobicContact CB-CE 3.7Å; V1122-M1153 HydrophobicContact CG1-CE 3.44Å; V1122-M1153 VanDerWaalsContact CG1-CE 3.44Å; A1123-M1153 HydrophobicContact CB-CE 4.34Å; A1123-M1153 HydrophobicContact CB-CG 4.21Å; L1135-M1153 HydrophobicContact CD1-CB 4.23Å; L1135-M1153 HydrophobicContact CD1-CG 3.93Å; L1135-M1153 HydrophobicContact CD1-SD 4.25Å; L1135-M1153 HydrophobicContact CD2-CB 4.25Å; L1135-M1153 HydrophobicContact CD2-CG 4.38Å; L1135-M1153 HydrophobicContact CD2-SD 4.03Å; P1149-M1153 WeakPolarHBondContact O-CB 3.49Å; P1149-M1153 PolarHBondContact O-N 3.44Å; A1150-M1153 PolarHBondContact O-N 3.09Å; I1151-M1153 VanDerWaalsContact C-N 3.34Å; I1151-M1153 PolarHBondContact O-N 3.14Å; M1153-M1155 VanDerWaalsContact C-N 3.3Å; M1153-M1155 PolarHBondContact O-N 3.48Å; M1153-Q1156 WeakPolarHBondContact O-CB 3.37Å; M1153-Q1156 PolarHBondContact O-N 2.7Å; M1153-Q1156 VanDerWaalsContact O-N 3.1Å; M1153-V1157 WeakPolarHBondContact O-CG2 3.38Å; M1153-V1157 PolarHBondContact O-N 3.34Å
1154	Q	95.9	Very high	92.7	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-61.6	-38.8	176.6	-167.2	-169.5	56.4	0	0	111.5	L1132 L1135 T1136 I1139 A1150 Q1156 V1157 I1158 L1173	L1132-Q1154 HydrophobicContact CD2-CG 3.99Å; L1135-Q1154 HydrophobicContact CB-CB 4.34Å; L1135-Q1154 HydrophobicContact CB-CG 4.46Å; L1135-Q1154 HydrophobicContact CD1-CB 4.13Å; T1136-Q1154 PolarHBondContact OG1-NE2 3.36Å; I1139-Q1154 HydrophobicContact CD1-CB 3.7Å; I1139-Q1154 VanDerWaalsContact CD1-CD 3.4Å; I1139-Q1154 HydrophobicContact CD1-CG 4.1Å; A1150-Q1154 WeakPolarHBondContact O-CB 3.34Å; A1150-Q1154 PolarHBondContact O-N 3.06Å; Q1154-Q1156 PolarHBondContact O-N 2.9Å; Q1154-V1157 PolarHBondContact O-N 3.18Å; Q1154-I1158 HydrophobicContact CG-CD1 3.88Å; Q1154-I1158 WeakPolarHBondContact O-CB 3.44Å; Q1154-I1158 WeakPolarHBondContact O-CD1 3.29Å; Q1154-I1158 VanDerWaalsContact O-CG1 3.27Å; Q1154-I1158 WeakPolarHBondContact O-CG1 3.35Å; Q1154-I1158 PolarHBondContact O-N 2.83Å; Q1154-L1173 HydrophobicContact CG-CD2 4.33Å
1155	M	95.6	Very high	93.3	Very high	37 Å²	37	38.9 Å²	38.9	18%	0.182	20%	0.196	C	C	.	.	H	α-helix	trans	-58.1	-44.4	172.5	-179.6	-172.2	76.2	0	0	111.9	I1151 K1152 M1153 I1158 Q1159 F1194 C1195 A1198	I1151-M1155 WeakPolarHBondContact O-CB 3.13Å; I1151-M1155 PolarHBondContact O-N 3.37Å; K1152-M1155 WeakPolarHBondContact O-CB 3.21Å; M1153-M1155 VanDerWaalsContact C-N 3.3Å; M1153-M1155 PolarHBondContact O-N 3.48Å; M1155-I1158 PolarHBondContact O-N 3.01Å; M1155-Q1159 VanDerWaalsContact O-CG 3.26Å; M1155-Q1159 WeakPolarHBondContact O-CG 3.48Å; M1155-Q1159 PolarHBondContact O-N 2.63Å; M1155-Q1159 PolarHBondContact O-OE1 3.22Å; M1155-F1194 HydrophobicContact SD-CB 3.67Å; M1155-C1195 HydrophobicContact CB-CB 4.07Å; M1155-C1195 HydrophobicContact CG-CB 4.46Å; M1155-A1198 HydrophobicContact CG-CB 4.08Å
1156	Q	94.9	Very high	93.8	Very high	56 Å²	56	31.9 Å²	31.9	26%	0.262	16%	0.164	S	C	.	.	H	α-helix	trans	-64.6	-43.5	176.5	-67.1	-70.2	-14.1	0	0	112.2	A1123 K1152 M1153 Q1154 I1158 Q1159 N1160	A1123-Q1156 HydrophobicContact CB-CB 3.99Å; K1152-Q1156 PolarHBondContact O-N 2.86Å; M1153-Q1156 WeakPolarHBondContact O-CB 3.37Å; M1153-Q1156 PolarHBondContact O-N 2.7Å; M1153-Q1156 VanDerWaalsContact O-N 3.1Å; Q1154-Q1156 PolarHBondContact O-N 2.9Å; Q1156-I1158 PolarHBondContact O-N 3.33Å; Q1156-Q1159 PolarHBondContact O-N 2.72Å; Q1156-N1160 PolarHBondContact O-N 3.27Å; Q1156-N1160 PolarHBondContact O-ND2 3.49Å
1157	V	95.6	Very high	93.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.5	-48.7	175.2	178.4	0	0	0	0	110.3	A1123 Q1128 C1131 L1132 L1135 M1153 Q1154 Q1159 N1160 S1161	A1123-V1157 HydrophobicContact CB-CG2 3.63Å; Q1128-V1157 HydrophobicContact CB-CG1 3.93Å; Q1128-V1157 HydrophobicContact CG-CG1 4.29Å; C1131-V1157 HydrophobicContact CB-CG1 4.08Å; C1131-V1157 HydrophobicContact CB-CG2 3.72Å; L1132-V1157 HydrophobicContact CD2-CB 4.2Å; L1132-V1157 HydrophobicContact CD2-CG1 3.69Å; L1132-V1157 HydrophobicContact CG-CG1 3.85Å; L1135-V1157 HydrophobicContact CD1-CG2 4.1Å; M1153-V1157 WeakPolarHBondContact O-CG2 3.38Å; M1153-V1157 PolarHBondContact O-N 3.34Å; Q1154-V1157 PolarHBondContact O-N 3.18Å; V1157-Q1159 VanDerWaalsContact C-N 3.32Å; V1157-Q1159 PolarHBondContact O-N 2.68Å; V1157-N1160 CarbonylContact O-C 3.52Å; V1157-N1160 PolarHBondContact O-N 3.34Å; V1157-N1160 VanDerWaalsContact O-N 3.09Å; V1157-S1161 PolarHBondContact O-N 2.98Å; V1157-S1161 PolarHBondContact O-OG 3.14Å; V1157-S1161 VanDerWaalsContact O-OG 3.08Å
1158	I	95.3	Very high	93.9	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.4	-38	178.1	-70.6	163	0	0	0	111.9	L1132 Q1154 M1155 Q1156 N1160 S1161 V1166 L1173 A1198 I1199 K1202	L1132-I1158 HydrophobicContact CD2-CG1 4.15Å; Q1154-I1158 HydrophobicContact CG-CD1 3.88Å; Q1154-I1158 WeakPolarHBondContact O-CB 3.44Å; Q1154-I1158 WeakPolarHBondContact O-CD1 3.29Å; Q1154-I1158 VanDerWaalsContact O-CG1 3.27Å; Q1154-I1158 WeakPolarHBondContact O-CG1 3.35Å; Q1154-I1158 PolarHBondContact O-N 2.83Å; M1155-I1158 PolarHBondContact O-N 3.01Å; Q1156-I1158 PolarHBondContact O-N 3.33Å; I1158-N1160 VanDerWaalsContact C-N 3.32Å; I1158-N1160 PolarHBondContact O-N 3.33Å; I1158-S1161 PolarHBondContact O-N 2.94Å; I1158-V1166 HydrophobicContact CG2-CG2 4.15Å; I1158-L1173 HydrophobicContact CD1-CD1 4.12Å; I1158-L1173 HydrophobicContact CD1-CD2 4.44Å; I1158-L1173 HydrophobicContact CG1-CD1 4.49Å; I1158-A1198 HydrophobicContact CG2-CB 4.06Å; I1158-I1199 HydrophobicContact CD1-CD1 4.05Å; I1158-I1199 HydrophobicContact CD1-CG1 3.84Å; I1158-I1199 HydrophobicContact CG2-CG1 3.88Å; I1158-K1202 VanDerWaalsContact O-CE 3.23Å; I1158-K1202 WeakPolarHBondContact O-CE 3.37Å
1159	Q	93.5	Very high	93.8	Very high	86 Å²	86	39.1 Å²	39.1	40%	0.402	20%	0.196	S	C	.	.	H	α-helix	trans	-63.1	-38.3	174.9	-74.2	174.8	-72.5	0	0	111.8	M1155 Q1156 V1157 A1198 K1202	M1155-Q1159 VanDerWaalsContact O-CG 3.26Å; M1155-Q1159 WeakPolarHBondContact O-CG 3.48Å; M1155-Q1159 PolarHBondContact O-N 2.63Å; M1155-Q1159 PolarHBondContact O-OE1 3.22Å; Q1156-Q1159 PolarHBondContact O-N 2.72Å; V1157-Q1159 VanDerWaalsContact C-N 3.32Å; V1157-Q1159 PolarHBondContact O-N 2.68Å; Q1159-A1198 HydrophobicContact CG-CB 3.88Å; Q1159-K1202 WeakPolarHBondContact O-CE 3.28Å; Q1159-K1202 PolarHBondContact O-NZ 2.92Å
1160	N	91.6	Very high	93.7	Very high	63 Å²	63	38.6 Å²	38.6	34%	0.337	19%	0.192	S	C	.	.	H	α-helix	trans	-76.8	-19.9	175.7	-62.5	-24	0	0	0	113.3	A1123 Q1128 Q1156 V1157 I1158	A1123-N1160 PolarHBondContact O-ND2 2.78Å; Q1128-N1160 PolarHBondContact NE2-O 3.04Å; Q1156-N1160 PolarHBondContact O-N 3.27Å; Q1156-N1160 PolarHBondContact O-ND2 3.49Å; V1157-N1160 CarbonylContact O-C 3.52Å; V1157-N1160 PolarHBondContact O-N 3.34Å; V1157-N1160 VanDerWaalsContact O-N 3.09Å; I1158-N1160 VanDerWaalsContact C-N 3.32Å; I1158-N1160 PolarHBondContact O-N 3.33Å
1161	S	92.9	Very high	93.4	Very high	1 Å²	1	44 Å²	44	1%	0.007	22%	0.221	C	C	.	.	S	Bend	trans	-77.5	152	-172.6	-74.7	0	0	0	0	116.1	Q1128 V1157 I1158 K1202	Q1128-S1161 WeakPolarHBondContact CB-OG 3.31Å; Q1128-S1161 VanDerWaalsContact CD-OG 3.29Å; Q1128-S1161 PolarHBondContact OE1-OG 3.12Å; V1157-S1161 PolarHBondContact O-N 2.98Å; V1157-S1161 PolarHBondContact O-OG 3.14Å; V1157-S1161 VanDerWaalsContact O-OG 3.08Å; I1158-S1161 PolarHBondContact O-N 2.94Å; S1161-K1202 WeakPolarHBondContact O-CE 3.48Å; S1161-K1202 PolarHBondContact O-NZ 3.3Å
1162	S	92.3	Very high	93.3	Very high	50 Å²	50	46.1 Å²	46.1	35%	0.35	24%	0.239	S	C	.	.			trans	-66.9	149.7	168.7	95.8	0	0	0	0	110.4	E1164 L1165 V1166	S1162-E1164 WeakPolarHBondContact CB-OE2 3.45Å; S1162-E1164 PolarHBondContact O-N 3.08Å; S1162-E1164 PolarHBondContact OG-OE2 3.16Å; S1162-L1165 PolarHBondContact O-N 3.33Å; S1162-L1165 PolarHBondContact OG-N 3.3Å; S1162-V1166 WeakPolarHBondContact O-CG2 3.35Å; S1162-V1166 PolarHBondContact O-N 3.32Å
1163	P	91.3	Very high	93.2	Very high	56 Å²	56	42.1 Å²	42.1	36%	0.364	22%	0.222	S	C	.	.	H	α-helix	trans	-63.8	-29	-179.8	27.1	-34.1	0	0	0	112.3	V1166 H1167 K1202	P1163-V1166 PolarHBondContact O-N 3.36Å; P1163-H1167 WeakPolarHBondContact O-CB 3.41Å; P1163-H1167 PolarHBondContact O-N 3.45Å; P1163-K1202 WeakPolarHBondContact CB-O 3.42Å
1164	E	92.1	Very high	93	Very high	130 Å²	130	42.6 Å²	42.6	61%	0.607	22%	0.224	S	C	*	.	H	α-helix	trans	-64.6	-46.7	176.4	-52.6	75.1	-163.1	0	0	111.4	S1162 V1166 H1167 E1168	S1162-E1164 WeakPolarHBondContact CB-OE2 3.45Å; S1162-E1164 PolarHBondContact O-N 3.08Å; S1162-E1164 PolarHBondContact OG-OE2 3.16Å; E1164-V1166 VanDerWaalsContact C-N 3.34Å; E1164-V1166 PolarHBondContact O-N 2.93Å; E1164-H1167 WeakPolarHBondContact O-CB 3.4Å; E1164-H1167 PolarHBondContact O-N 2.78Å; E1164-H1167 VanDerWaalsContact O-N 3.17Å; E1164-E1168 PolarHBondContact O-N 2.89Å
1165	L	92.4	Very high	92.8	Very high	29 Å²	29	45.5 Å²	45.5	15%	0.152	24%	0.243	C	C	.	.	H	α-helix	trans	-65.3	-38.6	177.8	-176	65.4	0	0	0	111.5	Q1128 E1129 S1162 H1167 E1168 F1169	Q1128-L1165 HydrophobicContact CB-CD2 3.73Å; E1129-L1165 HydrophobicContact CB-CD1 4.34Å; E1129-L1165 HydrophobicContact CG-CD1 4.34Å; S1162-L1165 PolarHBondContact O-N 3.33Å; S1162-L1165 PolarHBondContact OG-N 3.3Å; L1165-H1167 VanDerWaalsContact C-N 3.32Å; L1165-E1168 PolarHBondContact O-N 3.23Å; L1165-F1169 HydrophobicContact CD1-CD2 3.9Å; L1165-F1169 HydrophobicContact CD1-CE2 3.82Å; L1165-F1169 HydrophobicContact CG-CD2 4.44Å; L1165-F1169 WeakPolarHBondContact O-CD2 3.34Å; L1165-F1169 PolarHBondContact O-N 3.09Å; L1165-F1169 VanDerWaalsContact O-N 3.1Å
1166	V	93.3	Very high	92.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.3	-36.8	174	176.8	0	0	0	0	111.1	I1158 S1162 P1163 E1164 I1170 I1199 K1202 L1203	I1158-V1166 HydrophobicContact CG2-CG2 4.15Å; S1162-V1166 WeakPolarHBondContact O-CG2 3.35Å; S1162-V1166 PolarHBondContact O-N 3.32Å; P1163-V1166 PolarHBondContact O-N 3.36Å; E1164-V1166 VanDerWaalsContact C-N 3.34Å; E1164-V1166 PolarHBondContact O-N 2.93Å; V1166-I1170 WeakPolarHBondContact O-CB 3.49Å; V1166-I1170 PolarHBondContact O-N 2.93Å; V1166-I1199 HydrophobicContact CG1-CG1 4.48Å; V1166-I1199 HydrophobicContact CG1-CG2 4.12Å; V1166-K1202 HydrophobicContact CB-CB 4.38Å; V1166-K1202 HydrophobicContact CG1-CB 4.23Å; V1166-K1202 HydrophobicContact CG2-CB 4.41Å; V1166-K1202 HydrophobicContact CG2-CG 4.33Å; V1166-L1203 HydrophobicContact CG1-CD1 4.46Å; V1166-L1203 HydrophobicContact CG1-CD2 4.36Å; V1166-L1203 HydrophobicContact CG1-CG 4.25Å
1167	H	92.2	Very high	92.5	Very high	91 Å²	91	41.1 Å²	41.1	42%	0.421	22%	0.222	S	C	.	.	H	α-helix	trans	-70.1	-35.1	175.5	-170.2	-63.5	0	0	0	112.4	P1163 E1164 L1165 I1170 L1203	P1163-H1167 WeakPolarHBondContact O-CB 3.41Å; P1163-H1167 PolarHBondContact O-N 3.45Å; E1164-H1167 WeakPolarHBondContact O-CB 3.4Å; E1164-H1167 PolarHBondContact O-N 2.78Å; E1164-H1167 VanDerWaalsContact O-N 3.17Å; L1165-H1167 VanDerWaalsContact C-N 3.32Å; H1167-I1170 WeakPolarHBondContact O-CG2 3.45Å; H1167-L1203 HydrophobicContact CB-CD2 3.83Å
1168	E	91.7	Very high	92.3	Very high	102 Å²	102	41.8 Å²	41.8	48%	0.477	23%	0.226	S	C	.	.	H	α-helix	trans	-64.3	-47.1	173.2	-175.4	176.4	169.2	0	0	111.1	R873 E1164 L1165 I1170	R873-E1168 IonicContact CZ-OE1 3.25Å; R873-E1168 IonicContact NH2-OE1 2.79Å; R873-E1168 PolarHBondContact NH2-OE1 3.5Å; E1164-E1168 PolarHBondContact O-N 2.89Å; L1165-E1168 PolarHBondContact O-N 3.23Å; E1168-I1170 VanDerWaalsContact C-N 3.34Å; E1168-I1170 PolarHBondContact O-N 2.88Å
1169	F	92.3	Very high	92	Very high	21 Å²	21	46.2 Å²	46.2	9%	0.092	25%	0.249	C	C	.	.	H	α-helix	trans	-79.1	-9.7	-177	-84.7	-102.6	0	0	0	114.6	E1129 L1132 N1133 L1165 N1171 A1172 L1173	E1129-F1169 HydrophobicContact CG-CE2 3.74Å; E1129-F1169 HydrophobicContact CG-CZ 3.63Å; L1132-F1169 HydrophobicContact CB-CD1 3.75Å; L1132-F1169 HydrophobicContact CB-CE1 3.81Å; L1132-F1169 HydrophobicContact CB-CG 4.34Å; L1132-F1169 HydrophobicContact CB-CZ 4.47Å; L1132-F1169 HydrophobicContact CD1-CB 4.12Å; L1132-F1169 HydrophobicContact CD1-CD1 4.15Å; L1132-F1169 HydrophobicContact CD1-CD2 4.25Å; L1132-F1169 HydrophobicContact CD1-CG 3.89Å; N1133-F1169 WeakPolarHBondContact OD1-CE1 3.49Å; L1165-F1169 HydrophobicContact CD1-CD2 3.9Å; L1165-F1169 HydrophobicContact CD1-CE2 3.82Å; L1165-F1169 HydrophobicContact CG-CD2 4.44Å; L1165-F1169 WeakPolarHBondContact O-CD2 3.34Å; L1165-F1169 PolarHBondContact O-N 3.09Å; L1165-F1169 VanDerWaalsContact O-N 3.1Å; F1169-N1171 VanDerWaalsContact C-N 3.27Å; F1169-N1171 PolarHBondContact O-N 3.49Å; F1169-A1172 WeakPolarHBondContact O-CB 3.48Å; F1169-A1172 PolarHBondContact O-N 3.33Å; F1169-L1173 HydrophobicContact CB-CD1 3.88Å; F1169-L1173 HydrophobicContact CB-CG 4.03Å; F1169-L1173 WeakPolarHBondContact O-CG 3.31Å; F1169-L1173 PolarHBondContact O-N 3.35Å; F1169-L1173 VanDerWaalsContact O-N 3.08Å
1170	I	92.5	Very high	91.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-51.9	-40.9	-167.5	-165.7	58.3	0	0	0	114.2	V1166 H1167 E1168 A1172 L1173 I1174 I1199 L1203 Y1210	V1166-I1170 WeakPolarHBondContact O-CB 3.49Å; V1166-I1170 PolarHBondContact O-N 2.93Å; H1167-I1170 WeakPolarHBondContact O-CG2 3.45Å; E1168-I1170 VanDerWaalsContact C-N 3.34Å; E1168-I1170 PolarHBondContact O-N 2.88Å; I1170-A1172 VanDerWaalsContact C-N 3.27Å; I1170-A1172 PolarHBondContact O-N 3.15Å; I1170-L1173 PolarHBondContact O-N 2.95Å; I1170-I1174 HydrophobicContact CD1-CD1 3.87Å; I1170-I1174 HydrophobicContact CD1-CG1 3.6Å; I1170-I1174 HydrophobicContact CG1-CG1 3.98Å; I1170-I1174 VanDerWaalsContact O-CG1 3.28Å; I1170-I1174 WeakPolarHBondContact O-CG1 3.38Å; I1170-I1174 PolarHBondContact O-N 3.47Å; I1170-I1174 VanDerWaalsContact O-N 3.1Å; I1170-I1199 HydrophobicContact CD1-CG2 3.47Å; I1170-I1199 VanDerWaalsContact CD1-CG2 3.47Å; I1170-L1203 HydrophobicContact CB-CD1 4.38Å; I1170-L1203 HydrophobicContact CD1-CD1 3.5Å; I1170-L1203 VanDerWaalsContact CD1-CD1 3.5Å; I1170-L1203 HydrophobicContact CG1-CD1 3.76Å; I1170-Y1210 HydrophobicContact CG1-CD1 4.05Å; I1170-Y1210 HydrophobicContact CG1-CD2 3.87Å; I1170-Y1210 HydrophobicContact CG1-CE1 4.25Å; I1170-Y1210 HydrophobicContact CG1-CE2 4.07Å; I1170-Y1210 HydrophobicContact CG1-CG 3.86Å; I1170-Y1210 HydrophobicContact CG2-CD1 4.06Å; I1170-Y1210 HydrophobicContact CG2-CE1 3.54Å; I1170-Y1210 HydrophobicContact CG2-CE2 4.26Å
1171	N	90.8	Very high	91.9	Very high	113 Å²	113	39.7 Å²	39.7	60%	0.604	22%	0.218	S	C	*	.	H	α-helix	trans	-68.6	-25.3	-178.6	-65.9	-60.8	0	0	0	113.1	F1169 P1175	F1169-N1171 VanDerWaalsContact C-N 3.27Å; F1169-N1171 PolarHBondContact O-N 3.49Å; N1171-P1175 VanDerWaalsContact O-CD 3.28Å; N1171-P1175 WeakPolarHBondContact O-CD 3.43Å; N1171-P1175 WeakPolarHBondContact O-CG 3.4Å
1172	A	91.7	Very high	91.7	Very high	45 Å²	45	44.4 Å²	44.4	37%	0.372	24%	0.243	S	C	.	.	H	α-helix	trans	-87.6	-33.9	175.3	0	0	0	0	0	112.2	T1136 F1169 I1170	T1136-A1172 HydrophobicContact CG2-CB 3.96Å; T1136-A1172 WeakPolarHBondContact CG2-O 3.44Å; F1169-A1172 WeakPolarHBondContact O-CB 3.48Å; F1169-A1172 PolarHBondContact O-N 3.33Å; I1170-A1172 VanDerWaalsContact C-N 3.27Å; I1170-A1172 PolarHBondContact O-N 3.15Å
1173	L	93.5	Very high	91.6	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-72.2	-45	-178.4	-62.1	173.1	0	0	0	113.1	L1132 T1136 Q1154 I1158 F1169 I1170 L1177 I1199	L1132-L1173 HydrophobicContact CD2-CD2 4.16Å; T1136-L1173 HydrophobicContact CG2-CD2 4.39Å; T1136-L1173 WeakPolarHBondContact OG1-CD2 3.38Å; Q1154-L1173 HydrophobicContact CG-CD2 4.33Å; I1158-L1173 HydrophobicContact CD1-CD1 4.12Å; I1158-L1173 HydrophobicContact CD1-CD2 4.44Å; I1158-L1173 HydrophobicContact CG1-CD1 4.49Å; F1169-L1173 HydrophobicContact CB-CD1 3.88Å; F1169-L1173 HydrophobicContact CB-CG 4.03Å; F1169-L1173 WeakPolarHBondContact O-CG 3.31Å; F1169-L1173 PolarHBondContact O-N 3.35Å; F1169-L1173 VanDerWaalsContact O-N 3.08Å; I1170-L1173 PolarHBondContact O-N 2.95Å; L1173-L1177 WeakPolarHBondContact O-CG 3.5Å; L1173-L1177 PolarHBondContact O-N 3.3Å; L1173-I1199 HydrophobicContact CB-CD1 4.22Å; L1173-I1199 HydrophobicContact CD1-CD1 4.28Å
1174	I	92.8	Very high	91.5	Very high	12 Å²	12	50.7 Å²	50.7	6%	0.062	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-43.1	-169.7	-68.6	-70.5	0	0	0	114.1	I1170 G1176 L1177 V1178 L1196 I1199 I1207 L1211	I1170-I1174 HydrophobicContact CD1-CD1 3.87Å; I1170-I1174 HydrophobicContact CD1-CG1 3.6Å; I1170-I1174 HydrophobicContact CG1-CG1 3.98Å; I1170-I1174 VanDerWaalsContact O-CG1 3.28Å; I1170-I1174 WeakPolarHBondContact O-CG1 3.38Å; I1170-I1174 PolarHBondContact O-N 3.47Å; I1170-I1174 VanDerWaalsContact O-N 3.1Å; I1174-G1176 PolarHBondContact O-N 2.64Å; I1174-L1177 PolarHBondContact O-N 2.92Å; I1174-V1178 HydrophobicContact CG2-CG2 3.89Å; I1174-V1178 WeakPolarHBondContact O-CB 3.5Å; I1174-V1178 WeakPolarHBondContact O-CG2 3.43Å; I1174-V1178 PolarHBondContact O-N 3.4Å; I1174-L1196 HydrophobicContact CD1-CD2 3.65Å; I1174-I1199 HydrophobicContact CD1-CD1 4.36Å; I1174-I1207 HydrophobicContact CD1-CG1 4.45Å; I1174-L1211 HydrophobicContact CD1-CD2 4.01Å; I1174-L1211 HydrophobicContact CD1-CG 4.42Å; I1174-L1211 HydrophobicContact CG2-CD2 4.12Å
1175	P	90.3	Very high	91.3	Very high	63 Å²	63	48.9 Å²	48.9	41%	0.409	25%	0.254	S	S	.	.	H	α-helix	trans	-56	-52.8	-176.9	-28.2	36.4	0	0	0	113.8	N1171 L1177 V1178 I1179	N1171-P1175 VanDerWaalsContact O-CD 3.28Å; N1171-P1175 WeakPolarHBondContact O-CD 3.43Å; N1171-P1175 WeakPolarHBondContact O-CG 3.4Å; P1175-L1177 VanDerWaalsContact C-N 3.34Å; P1175-L1177 PolarHBondContact O-N 3.1Å; P1175-V1178 PolarHBondContact O-N 2.67Å; P1175-I1179 WeakPolarHBondContact O-CG1 3.42Å; P1175-I1179 PolarHBondContact O-N 3.09Å
1176	G	90.7	Very high	91.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62	-39.5	179.2	0	0	0	0	0	112.8	N1140 I1174 I1179 A1180	N1140-G1176 WeakPolarHBondContact OD1-CA 3.24Å; N1140-G1176 PolarHBondContact OD1-N 2.87Å; I1174-G1176 PolarHBondContact O-N 2.64Å; G1176-I1179 PolarHBondContact O-N 2.85Å; G1176-A1180 VanDerWaalsContact O-CB 3.24Å; G1176-A1180 WeakPolarHBondContact O-CB 3.2Å; G1176-A1180 PolarHBondContact O-N 3.39Å
1177	L	93.7	Very high	91.3	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-68.8	-34.7	176.9	-65.1	176.5	0	0	0	112.8	I1139 I1151 L1173 I1174 P1175 C1181 C1195 L1196 I1199	I1139-L1177 HydrophobicContact CG2-CD2 4.45Å; I1151-L1177 HydrophobicContact CG1-CD2 4.41Å; I1151-L1177 HydrophobicContact CG2-CD2 4.04Å; L1173-L1177 WeakPolarHBondContact O-CG 3.5Å; L1173-L1177 PolarHBondContact O-N 3.3Å; I1174-L1177 PolarHBondContact O-N 2.92Å; P1175-L1177 VanDerWaalsContact C-N 3.34Å; P1175-L1177 PolarHBondContact O-N 3.1Å; L1177-C1181 WeakPolarHBondContact O-CB 3.38Å; L1177-C1181 PolarHBondContact O-N 3.46Å; L1177-C1181 PolarHBondContact O-SG 3.5Å; L1177-C1195 HydrophobicContact CD1-CB 4.16Å; L1177-C1195 HydrophobicContact CD2-CB 3.83Å; L1177-L1196 HydrophobicContact CB-CD2 3.83Å; L1177-L1196 HydrophobicContact CB-CG 4.1Å; L1177-L1196 HydrophobicContact CD1-CD2 3.88Å; L1177-L1196 HydrophobicContact CD1-CG 4.41Å; L1177-I1199 HydrophobicContact CD1-CD1 3.59Å
1178	V	91.6	Very high	91.3	Very high	14 Å²	14	49.5 Å²	49.5	9%	0.085	27%	0.272	C	S	.	.	H	α-helix	trans	-69.8	-37.8	173.6	170.9	0	0	0	0	111.3	I1174 P1175 N1182 L1211	I1174-V1178 HydrophobicContact CG2-CG2 3.89Å; I1174-V1178 WeakPolarHBondContact O-CB 3.5Å; I1174-V1178 WeakPolarHBondContact O-CG2 3.43Å; I1174-V1178 PolarHBondContact O-N 3.4Å; P1175-V1178 PolarHBondContact O-N 2.67Å; V1178-N1182 PolarHBondContact O-ND2 3.21Å; V1178-L1211 HydrophobicContact CG2-CD2 3.8Å
1179	I	89.8	Confident	91.4	Very high	93 Å²	93	49.1 Å²	49.1	48%	0.477	27%	0.266	S	S	.	.	H	α-helix	trans	-64.9	-49.6	171.9	-67	166.3	0	0	0	110.2	P1175 G1176 C1181 N1182 H1183	P1175-I1179 WeakPolarHBondContact O-CG1 3.42Å; P1175-I1179 PolarHBondContact O-N 3.09Å; G1176-I1179 PolarHBondContact O-N 2.85Å; I1179-C1181 VanDerWaalsContact C-N 3.27Å; I1179-C1181 PolarHBondContact O-N 3.09Å; I1179-N1182 WeakPolarHBondContact O-CA 3.37Å; I1179-N1182 WeakPolarHBondContact O-CB 3.39Å; I1179-N1182 PolarHBondContact O-N 3.19Å; I1179-H1183 PolarHBondContact O-N 3.4Å
1180	A	91.2	Very high	91.4	Very high	8 Å²	8	54.6 Å²	54.6	7%	0.066	29%	0.29	C	S	.	.	H	α-helix	trans	-60.7	-32.9	178.7	0	0	0	0	0	113.1	I1151 G1176 N1182 H1183 I1188 S1192	I1151-A1180 HydrophobicContact CD1-CB 3.65Å; G1176-A1180 VanDerWaalsContact O-CB 3.24Å; G1176-A1180 WeakPolarHBondContact O-CB 3.2Å; G1176-A1180 PolarHBondContact O-N 3.39Å; A1180-N1182 PolarHBondContact O-N 2.91Å; A1180-N1182 VanDerWaalsContact O-N 3.11Å; A1180-H1183 VanDerWaalsContact O-CB 3.29Å; A1180-H1183 WeakPolarHBondContact O-CB 3.29Å; A1180-H1183 PolarHBondContact O-N 2.89Å; A1180-H1183 VanDerWaalsContact O-N 3.12Å; A1180-I1188 HydrophobicContact CB-CG2 3.87Å; A1180-S1192 VanDerWaalsContact C-OG 3.27Å; A1180-S1192 PolarHBondContact O-OG 3.43Å
1181	C	90.6	Very high	91.6	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.034	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-18.6	170.8	-79.7	0	0	0	0	113.3	L1177 I1179 R1189 S1192 L1214 K1218	L1177-C1181 WeakPolarHBondContact O-CB 3.38Å; L1177-C1181 PolarHBondContact O-N 3.46Å; L1177-C1181 PolarHBondContact O-SG 3.5Å; I1179-C1181 VanDerWaalsContact C-N 3.27Å; I1179-C1181 PolarHBondContact O-N 3.09Å; C1181-R1189 WeakPolarHBondContact O-CD 3.37Å; C1181-S1192 WeakPolarHBondContact CA-OG 3.4Å; C1181-S1192 PolarHBondContact N-OG 2.68Å; C1181-L1214 HydrophobicContact CB-CD1 4.2Å; C1181-K1218 PolarHBondContact O-NZ 3.19Å
1182	N	88.4	Confident	91.7	Very high	99 Å²	99	49.9 Å²	49.9	53%	0.529	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-5.3	177.7	-66.2	-70.3	0	0	0	114.2	V1178 I1179 A1180 K1218	V1178-N1182 PolarHBondContact O-ND2 3.21Å; I1179-N1182 WeakPolarHBondContact O-CA 3.37Å; I1179-N1182 WeakPolarHBondContact O-CB 3.39Å; I1179-N1182 PolarHBondContact O-N 3.19Å; A1180-N1182 PolarHBondContact O-N 2.91Å; A1180-N1182 VanDerWaalsContact O-N 3.11Å; N1182-K1218 PolarHBondContact OD1-NZ 3.2Å
1183	H	90.1	Very high	91.8	Very high	54 Å²	54	48.9 Å²	48.9	25%	0.25	26%	0.256	C	S	.	.			trans	-56.5	156.4	-176.9	-166.2	-100.2	0	0	0	114	I1179 A1180 E1185 I1188 R1189	I1179-H1183 PolarHBondContact O-N 3.4Å; A1180-H1183 VanDerWaalsContact O-CB 3.29Å; A1180-H1183 WeakPolarHBondContact O-CB 3.29Å; A1180-H1183 PolarHBondContact O-N 2.89Å; A1180-H1183 VanDerWaalsContact O-N 3.12Å; H1183-E1185 PolarHBondContact ND1-N 2.88Å; H1183-I1188 HydrophobicContact CB-CB 4.19Å; H1183-I1188 HydrophobicContact CB-CG2 3.6Å; H1183-I1188 VanDerWaalsContact CE1-CD1 3.45Å; H1183-I1188 WeakPolarHBondContact CE1-CD1 3.42Å; H1183-I1188 WeakPolarHBondContact ND1-CD1 3.34Å; H1183-R1189 HydrophobicContact CB-CG 4.49Å; H1183-R1189 WeakPolarHBondContact O-CD 3.47Å; H1183-R1189 WeakPolarHBondContact O-CG 3.44Å; H1183-R1189 PolarHBondContact O-NH1 2.87Å
1184	E	89.5	Confident	91.8	Very high	185 Å²	185	52 Å²	52	86%	0.864	27%	0.27	S	S	*	.	S	Bend	trans	-70.3	-38.6	-176.9	-61	-163.5	158.5	0	0	113.6	S1186 R1189	E1184-S1186 PolarHBondContact O-N 3.34Å; E1184-R1189 PolarHBondContact O-NH1 2.63Å
1185	E	88.5	Confident	92	Very high	92 Å²	92	51.4 Å²	51.4	43%	0.43	27%	0.267	S	S	.	.	S	Bend	trans	-69.3	129.3	174.3	-67.4	-168.8	177.3	0	0	112.4	H1183 A1187 I1188 R1189	H1183-E1185 PolarHBondContact ND1-N 2.88Å; E1185-A1187 VanDerWaalsContact C-N 3.26Å; E1185-A1187 PolarHBondContact O-N 3.1Å; E1185-I1188 HydrophobicContact CB-CB 4.37Å; E1185-I1188 HydrophobicContact CB-CD1 4.31Å; E1185-I1188 HydrophobicContact CB-CG1 4.4Å; E1185-I1188 PolarHBondContact O-N 2.83Å; E1185-R1189 PolarHBondContact O-N 3.27Å
1186	S	91.7	Very high	92.2	Very high	85 Å²	85	48.4 Å²	48.4	59%	0.594	25%	0.248	S	C	*	.	H	α-helix	trans	-64.2	-28.9	175	56.7	0	0	0	0	113.4	E1184 K1190	E1184-S1186 PolarHBondContact O-N 3.34Å; S1186-K1190 WeakPolarHBondContact O-CB 3.48Å; S1186-K1190 PolarHBondContact O-N 2.97Å
1187	A	92.9	Very high	92.3	Very high	39 Å²	39	48.6 Å²	48.6	32%	0.322	25%	0.249	S	C	.	.	H	α-helix	trans	-65.5	-46.5	177.1	0	0	0	0	0	111.7	L1148 E1185 K1190 A1191	L1148-A1187 HydrophobicContact CD1-CB 3.91Å; L1148-A1187 HydrophobicContact CD2-CB 3.7Å; L1148-A1187 HydrophobicContact CG-CB 4.48Å; E1185-A1187 VanDerWaalsContact C-N 3.26Å; E1185-A1187 PolarHBondContact O-N 3.1Å; A1187-K1190 PolarHBondContact O-N 3.19Å; A1187-A1191 WeakPolarHBondContact O-CB 3.24Å; A1187-A1191 PolarHBondContact O-N 3.43Å
1188	I	93.1	Very high	92.3	Very high	9 Å²	9	49.1 Å²	49.1	5%	0.046	25%	0.253	C	S	.	.	H	α-helix	trans	-66.7	-42.1	177.8	-70.5	170.1	0	0	0	110.9	N1147 L1148 I1151 A1180 H1183 E1185 K1190 A1191 S1192	N1147-I1188 HydrophobicContact CB-CD1 4.29Å; L1148-I1188 HydrophobicContact CB-CD1 4.23Å; L1148-I1188 HydrophobicContact CB-CG1 3.74Å; L1148-I1188 HydrophobicContact CD1-CG1 4.04Å; L1148-I1188 HydrophobicContact CG-CG1 4.41Å; I1151-I1188 HydrophobicContact CD1-CG2 3.95Å; A1180-I1188 HydrophobicContact CB-CG2 3.87Å; H1183-I1188 HydrophobicContact CB-CB 4.19Å; H1183-I1188 HydrophobicContact CB-CG2 3.6Å; H1183-I1188 VanDerWaalsContact CE1-CD1 3.45Å; H1183-I1188 WeakPolarHBondContact CE1-CD1 3.42Å; H1183-I1188 WeakPolarHBondContact ND1-CD1 3.34Å; E1185-I1188 HydrophobicContact CB-CB 4.37Å; E1185-I1188 HydrophobicContact CB-CD1 4.31Å; E1185-I1188 HydrophobicContact CB-CG1 4.4Å; E1185-I1188 PolarHBondContact O-N 2.83Å; I1188-K1190 VanDerWaalsContact C-N 3.27Å; I1188-K1190 PolarHBondContact O-N 3.21Å; I1188-A1191 PolarHBondContact O-N 3.3Å; I1188-S1192 WeakPolarHBondContact O-CB 3.22Å; I1188-S1192 PolarHBondContact O-N 3.26Å; I1188-S1192 PolarHBondContact O-OG 3.06Å
1189	R	93.5	Very high	92.5	Very high	93 Å²	93	48.4 Å²	48.4	35%	0.351	25%	0.249	S	C	.	.	H	α-helix	trans	-61.1	-34	172.2	-66.7	-163.9	-58.7	-87.1	-1	113.2	C1181 H1183 E1184 E1185 S1192 V1193	C1181-R1189 WeakPolarHBondContact O-CD 3.37Å; H1183-R1189 HydrophobicContact CB-CG 4.49Å; H1183-R1189 WeakPolarHBondContact O-CD 3.47Å; H1183-R1189 WeakPolarHBondContact O-CG 3.44Å; H1183-R1189 PolarHBondContact O-NH1 2.87Å; E1184-R1189 PolarHBondContact O-NH1 2.63Å; E1185-R1189 PolarHBondContact O-N 3.27Å; R1189-S1192 WeakPolarHBondContact CA-OG 3.35Å; R1189-S1192 PolarHBondContact O-OG 3.14Å; R1189-V1193 WeakPolarHBondContact O-CG2 3.46Å; R1189-V1193 PolarHBondContact O-N 3.38Å
1190	K	93.8	Very high	92.6	Very high	136 Å²	136	44.1 Å²	44.1	59%	0.591	23%	0.227	S	C	*	.	H	α-helix	trans	-71.5	-52.6	176	-173.5	-179.3	177.9	-172.4	0	110.2	S1186 A1187 I1188 S1192 V1193 F1194	S1186-K1190 WeakPolarHBondContact O-CB 3.48Å; S1186-K1190 PolarHBondContact O-N 2.97Å; A1187-K1190 PolarHBondContact O-N 3.19Å; I1188-K1190 VanDerWaalsContact C-N 3.27Å; I1188-K1190 PolarHBondContact O-N 3.21Å; K1190-S1192 VanDerWaalsContact C-N 3.33Å; K1190-S1192 PolarHBondContact O-N 3.34Å; K1190-V1193 PolarHBondContact O-N 2.87Å; K1190-F1194 HydrophobicContact CD-CE2 4.29Å; K1190-F1194 HydrophobicContact CG-CD2 3.84Å; K1190-F1194 HydrophobicContact CG-CE2 3.72Å; K1190-F1194 VanDerWaalsContact O-CD2 3.32Å; K1190-F1194 WeakPolarHBondContact O-CD2 3.31Å; K1190-F1194 PolarHBondContact O-N 2.98Å
1191	A	94.7	Very high	92.7	Very high	14 Å²	14	47.6 Å²	47.6	12%	0.116	24%	0.243	C	C	.	.	H	α-helix	trans	-58.5	-42.9	-178	0	0	0	0	0	112.4	L1148 I1151 A1187 I1188 V1193 F1194 C1195	L1148-A1191 HydrophobicContact CD1-CB 3.88Å; I1151-A1191 HydrophobicContact CB-CB 4.29Å; I1151-A1191 VanDerWaalsContact CG2-C 3.5Å; I1151-A1191 HydrophobicContact CG2-CB 3.78Å; A1187-A1191 WeakPolarHBondContact O-CB 3.24Å; A1187-A1191 PolarHBondContact O-N 3.43Å; I1188-A1191 PolarHBondContact O-N 3.3Å; A1191-V1193 PolarHBondContact O-N 3.19Å; A1191-F1194 PolarHBondContact O-N 2.71Å; A1191-C1195 PolarHBondContact O-N 3.39Å
1192	S	93.9	Very high	92.8	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.2	-38.6	177.2	47.5	0	0	0	0	113.2	A1180 C1181 I1188 R1189 K1190 C1195 L1196	A1180-S1192 VanDerWaalsContact C-OG 3.27Å; A1180-S1192 PolarHBondContact O-OG 3.43Å; C1181-S1192 WeakPolarHBondContact CA-OG 3.4Å; C1181-S1192 PolarHBondContact N-OG 2.68Å; I1188-S1192 WeakPolarHBondContact O-CB 3.22Å; I1188-S1192 PolarHBondContact O-N 3.26Å; I1188-S1192 PolarHBondContact O-OG 3.06Å; R1189-S1192 WeakPolarHBondContact CA-OG 3.35Å; R1189-S1192 PolarHBondContact O-OG 3.14Å; K1190-S1192 VanDerWaalsContact C-N 3.33Å; K1190-S1192 PolarHBondContact O-N 3.34Å; S1192-C1195 PolarHBondContact O-N 3.42Å; S1192-L1196 WeakPolarHBondContact O-CG 3.45Å; S1192-L1196 PolarHBondContact O-N 2.73Å
1193	V	93.6	Very high	92.9	Very high	25 Å²	25	46.7 Å²	46.7	15%	0.152	23%	0.234	C	C	.	.	H	α-helix	trans	-62.9	-44.9	171.8	169.9	0	0	0	0	111.3	R1189 K1190 A1191 C1195 L1196 V1197 L1222 Y1225	R1189-V1193 WeakPolarHBondContact O-CG2 3.46Å; R1189-V1193 PolarHBondContact O-N 3.38Å; K1190-V1193 PolarHBondContact O-N 2.87Å; A1191-V1193 PolarHBondContact O-N 3.19Å; V1193-C1195 VanDerWaalsContact C-N 3.34Å; V1193-C1195 PolarHBondContact O-N 3.21Å; V1193-L1196 PolarHBondContact O-N 3.03Å; V1193-V1197 VanDerWaalsContact O-CG2 3.32Å; V1193-V1197 WeakPolarHBondContact O-CG2 3.21Å; V1193-V1197 PolarHBondContact O-N 3.19Å; V1193-L1222 HydrophobicContact CG1-CD1 4.22Å; V1193-Y1225 HydrophobicContact CG1-CD2 3.72Å; V1193-Y1225 HydrophobicContact CG1-CE2 4.09Å; V1193-Y1225 HydrophobicContact CG1-CG 4.44Å
1194	F	94.5	Very high	92.8	Very high	65 Å²	65	45.8 Å²	45.8	29%	0.285	24%	0.24	S	C	.	.	H	α-helix	trans	-65.5	-34.8	176.9	-80.4	-81.8	0	0	0	113	M1155 K1190 A1191 V1197 A1198 Y1225	M1155-F1194 HydrophobicContact SD-CB 3.67Å; K1190-F1194 HydrophobicContact CD-CE2 4.29Å; K1190-F1194 HydrophobicContact CG-CD2 3.84Å; K1190-F1194 HydrophobicContact CG-CE2 3.72Å; K1190-F1194 VanDerWaalsContact O-CD2 3.32Å; K1190-F1194 WeakPolarHBondContact O-CD2 3.31Å; K1190-F1194 PolarHBondContact O-N 2.98Å; A1191-F1194 PolarHBondContact O-N 2.71Å; F1194-V1197 PolarHBondContact O-N 2.9Å; F1194-A1198 PolarHBondContact O-N 3.22Å; F1194-Y1225 HydrophobicContact CZ-CD1 4.23Å; F1194-Y1225 AromaticContact CZ-CE1 4Å; F1194-Y1225 HydrophobicContact CZ-CE1 4Å
1195	C	95.2	Very high	92.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.2	-43.6	172.2	-164.6	0	0	0	0	111.9	I1151 M1155 L1177 A1191 S1192 V1193 V1197 A1198 I1199	I1151-C1195 HydrophobicContact CG2-CB 3.99Å; M1155-C1195 HydrophobicContact CB-CB 4.07Å; M1155-C1195 HydrophobicContact CG-CB 4.46Å; L1177-C1195 HydrophobicContact CD1-CB 4.16Å; L1177-C1195 HydrophobicContact CD2-CB 3.83Å; A1191-C1195 PolarHBondContact O-N 3.39Å; S1192-C1195 PolarHBondContact O-N 3.42Å; V1193-C1195 VanDerWaalsContact C-N 3.34Å; V1193-C1195 PolarHBondContact O-N 3.21Å; C1195-V1197 VanDerWaalsContact C-N 3.3Å; C1195-V1197 PolarHBondContact O-N 3.32Å; C1195-A1198 WeakPolarHBondContact O-CB 3.16Å; C1195-A1198 PolarHBondContact O-N 2.92Å; C1195-A1198 VanDerWaalsContact O-N 3.12Å; C1195-I1199 PolarHBondContact O-N 2.85Å
1196	L	94.5	Very high	92.6	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-33.2	173.2	-71.2	178.9	0	0	0	113.1	I1174 L1177 S1192 V1193 I1199 A1200 I1207 L1211 L1222	I1174-L1196 HydrophobicContact CD1-CD2 3.65Å; L1177-L1196 HydrophobicContact CB-CD2 3.83Å; L1177-L1196 HydrophobicContact CB-CG 4.1Å; L1177-L1196 HydrophobicContact CD1-CD2 3.88Å; L1177-L1196 HydrophobicContact CD1-CG 4.41Å; S1192-L1196 WeakPolarHBondContact O-CG 3.45Å; S1192-L1196 PolarHBondContact O-N 2.73Å; V1193-L1196 PolarHBondContact O-N 3.03Å; L1196-I1199 HydrophobicContact CD2-CD1 4.41Å; L1196-I1199 PolarHBondContact O-N 3.39Å; L1196-A1200 WeakPolarHBondContact O-CB 3.49Å; L1196-A1200 PolarHBondContact O-N 3.49Å; L1196-I1207 WeakPolarHBondContact O-CD1 3.21Å; L1196-L1211 HydrophobicContact CD1-CD2 4.07Å; L1196-L1211 HydrophobicContact CD2-CD2 3.98Å; L1196-L1222 HydrophobicContact CB-CD1 3.82Å; L1196-L1222 HydrophobicContact CB-CD2 4.14Å; L1196-L1222 HydrophobicContact CD1-CD2 4.3Å
1197	V	94	Very high	92.5	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.024	21%	0.206	C	C	.	.	H	α-helix	trans	-66.9	-41.2	172	179	0	0	0	0	110.8	V1193 F1194 C1195 I1199 A1200 M1201 L1222 I1226 Q1229	V1193-V1197 VanDerWaalsContact O-CG2 3.32Å; V1193-V1197 WeakPolarHBondContact O-CG2 3.21Å; V1193-V1197 PolarHBondContact O-N 3.19Å; F1194-V1197 PolarHBondContact O-N 2.9Å; C1195-V1197 VanDerWaalsContact C-N 3.3Å; C1195-V1197 PolarHBondContact O-N 3.32Å; V1197-I1199 VanDerWaalsContact C-N 3.34Å; V1197-I1199 PolarHBondContact O-N 3.07Å; V1197-A1200 WeakPolarHBondContact O-CB 3.48Å; V1197-A1200 PolarHBondContact O-N 2.91Å; V1197-A1200 VanDerWaalsContact O-N 3.15Å; V1197-M1201 HydrophobicContact CG1-CG 4.44Å; V1197-M1201 WeakPolarHBondContact O-CG 3.44Å; V1197-M1201 PolarHBondContact O-N 3.4Å; V1197-L1222 HydrophobicContact CG2-CD1 3.56Å; V1197-I1226 HydrophobicContact CB-CG1 4.49Å; V1197-I1226 HydrophobicContact CG1-CG1 4.18Å; V1197-I1226 HydrophobicContact CG2-CG1 4.19Å; V1197-Q1229 HydrophobicContact CG1-CB 4.1Å; V1197-Q1229 HydrophobicContact CG1-CG 3.73Å
1198	A	94.1	Very high	92.4	Very high	10 Å²	10	40.4 Å²	40.4	8%	0.083	20%	0.203	C	C	.	.	H	α-helix	trans	-61.3	-40.5	175.7	0	0	0	0	0	112.3	M1155 I1158 Q1159 F1194 C1195 M1201 K1202	M1155-A1198 HydrophobicContact CG-CB 4.08Å; I1158-A1198 HydrophobicContact CG2-CB 4.06Å; Q1159-A1198 HydrophobicContact CG-CB 3.88Å; F1194-A1198 PolarHBondContact O-N 3.22Å; C1195-A1198 WeakPolarHBondContact O-CB 3.16Å; C1195-A1198 PolarHBondContact O-N 2.92Å; C1195-A1198 VanDerWaalsContact O-N 3.12Å; A1198-M1201 PolarHBondContact O-N 2.83Å; A1198-K1202 WeakPolarHBondContact O-CG 3.44Å; A1198-K1202 PolarHBondContact O-N 2.88Å
1199	I	94.8	Very high	92.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-43.9	172	-64	174.6	0	0	0	110.9	I1158 V1166 I1170 L1173 I1174 L1177 C1195 L1196 V1197 M1201 K1202 L1203 I1207	I1158-I1199 HydrophobicContact CD1-CD1 4.05Å; I1158-I1199 HydrophobicContact CD1-CG1 3.84Å; I1158-I1199 HydrophobicContact CG2-CG1 3.88Å; V1166-I1199 HydrophobicContact CG1-CG1 4.48Å; V1166-I1199 HydrophobicContact CG1-CG2 4.12Å; I1170-I1199 HydrophobicContact CD1-CG2 3.47Å; I1170-I1199 VanDerWaalsContact CD1-CG2 3.47Å; L1173-I1199 HydrophobicContact CB-CD1 4.22Å; L1173-I1199 HydrophobicContact CD1-CD1 4.28Å; I1174-I1199 HydrophobicContact CD1-CD1 4.36Å; L1177-I1199 HydrophobicContact CD1-CD1 3.59Å; C1195-I1199 PolarHBondContact O-N 2.85Å; L1196-I1199 HydrophobicContact CD2-CD1 4.41Å; L1196-I1199 PolarHBondContact O-N 3.39Å; V1197-I1199 VanDerWaalsContact C-N 3.34Å; V1197-I1199 PolarHBondContact O-N 3.07Å; I1199-M1201 VanDerWaalsContact C-N 3.28Å; I1199-M1201 PolarHBondContact O-N 3.13Å; I1199-K1202 PolarHBondContact O-N 3.41Å; I1199-L1203 HydrophobicContact CG2-CD1 3.91Å; I1199-L1203 HydrophobicContact CG2-CG 4.3Å; I1199-L1203 PolarHBondContact O-N 2.9Å; I1199-I1207 HydrophobicContact CB-CD1 3.98Å; I1199-I1207 HydrophobicContact CG2-CD1 3.7Å; I1199-I1207 HydrophobicContact CG2-CG1 4.14Å
1200	A	93	Very high	91.8	Very high	2 Å²	2	42 Å²	42	2%	0.017	22%	0.22	C	C	.	.	H	α-helix	trans	-64.1	-32.8	179.5	0	0	0	0	0	112.7	L1196 V1197 K1202 G1204 I1207 I1226	L1196-A1200 WeakPolarHBondContact O-CB 3.49Å; L1196-A1200 PolarHBondContact O-N 3.49Å; V1197-A1200 WeakPolarHBondContact O-CB 3.48Å; V1197-A1200 PolarHBondContact O-N 2.91Å; V1197-A1200 VanDerWaalsContact O-N 3.15Å; A1200-K1202 PolarHBondContact O-N 3.37Å; A1200-G1204 VanDerWaalsContact O-CA 3.32Å; A1200-G1204 WeakPolarHBondContact O-CA 3.41Å; A1200-G1204 PolarHBondContact O-N 3.39Å; A1200-I1207 HydrophobicContact CB-CD1 3.84Å; A1200-I1207 HydrophobicContact CB-CG2 3.98Å; A1200-I1226 HydrophobicContact CB-CD1 3.43Å; A1200-I1226 VanDerWaalsContact CB-CD1 3.43Å; A1200-I1226 HydrophobicContact CB-CG1 3.73Å
1201	M	92.8	Very high	91.5	Very high	81 Å²	81	35.6 Å²	35.6	40%	0.399	19%	0.192	S	C	.	.	H	α-helix	trans	-70.9	-11.3	173	-67.1	-57.8	-61.1	0	0	113.6	V1197 A1198 I1199 Q1229 Q1230	V1197-M1201 HydrophobicContact CG1-CG 4.44Å; V1197-M1201 WeakPolarHBondContact O-CG 3.44Å; V1197-M1201 PolarHBondContact O-N 3.4Å; A1198-M1201 PolarHBondContact O-N 2.83Å; I1199-M1201 VanDerWaalsContact C-N 3.28Å; I1199-M1201 PolarHBondContact O-N 3.13Å; M1201-Q1229 HydrophobicContact SD-CB 4.19Å; M1201-Q1230 HydrophobicContact CE-CG 3.96Å; M1201-Q1230 HydrophobicContact SD-CG 3.61Å
1202	K	91.6	Very high	91	Very high	65 Å²	65	39.5 Å²	39.5	28%	0.283	22%	0.215	S	C	.	.	H	α-helix	trans	-102.5	-34.5	175.6	-63	-75.3	175	166.3	0	112.9	I1158 Q1159 S1161 P1163 V1166 A1198 I1199 A1200	I1158-K1202 VanDerWaalsContact O-CE 3.23Å; I1158-K1202 WeakPolarHBondContact O-CE 3.37Å; Q1159-K1202 WeakPolarHBondContact O-CE 3.28Å; Q1159-K1202 PolarHBondContact O-NZ 2.92Å; S1161-K1202 WeakPolarHBondContact O-CE 3.48Å; S1161-K1202 PolarHBondContact O-NZ 3.3Å; P1163-K1202 WeakPolarHBondContact CB-O 3.42Å; V1166-K1202 HydrophobicContact CB-CB 4.38Å; V1166-K1202 HydrophobicContact CG1-CB 4.23Å; V1166-K1202 HydrophobicContact CG2-CB 4.41Å; V1166-K1202 HydrophobicContact CG2-CG 4.33Å; A1198-K1202 WeakPolarHBondContact O-CG 3.44Å; A1198-K1202 PolarHBondContact O-N 2.88Å; I1199-K1202 PolarHBondContact O-N 3.41Å; A1200-K1202 PolarHBondContact O-N 3.37Å
1203	L	90.1	Very high	90.4	Very high	20 Å²	20	45.6 Å²	45.6	11%	0.105	24%	0.243	C	C	.	.	H	α-helix	trans	-103.9	-7.8	-177.5	-58.7	-174.1	0	0	0	114.8	V1166 H1167 I1170 I1199 D1206	V1166-L1203 HydrophobicContact CG1-CD1 4.46Å; V1166-L1203 HydrophobicContact CG1-CD2 4.36Å; V1166-L1203 HydrophobicContact CG1-CG 4.25Å; H1167-L1203 HydrophobicContact CB-CD2 3.83Å; I1170-L1203 HydrophobicContact CB-CD1 4.38Å; I1170-L1203 HydrophobicContact CD1-CD1 3.5Å; I1170-L1203 VanDerWaalsContact CD1-CD1 3.5Å; I1170-L1203 HydrophobicContact CG1-CD1 3.76Å; I1199-L1203 HydrophobicContact CG2-CD1 3.91Å; I1199-L1203 HydrophobicContact CG2-CG 4.3Å; I1199-L1203 PolarHBondContact O-N 2.9Å; L1203-D1206 PolarHBondContact O-N 3.46Å
1204	G	88.9	Confident	89.9	Confident	36 Å²	36	44.7 Å²	44.7	37%	0.371	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	61.6	-141.3	-173.1	0	0	0	0	0	112.4	A1200 D1206 I1207	A1200-G1204 VanDerWaalsContact O-CA 3.32Å; A1200-G1204 WeakPolarHBondContact O-CA 3.41Å; A1200-G1204 PolarHBondContact O-N 3.39Å; G1204-D1206 VanDerWaalsContact C-N 3.26Å; G1204-D1206 PolarHBondContact O-N 3.41Å; G1204-I1207 WeakPolarHBondContact O-CG2 3.47Å
1205	D	86.4	Confident	89.4	Confident	114 Å²	114	46.9 Å²	46.9	61%	0.61	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-71.7	-13.1	-178.4	-81.8	-46.9	0	0	0	114	I1207 W1208	D1205-I1207 PolarHBondContact O-N 3.13Å; D1205-I1207 VanDerWaalsContact O-N 3.12Å; D1205-W1208 WeakPolarHBondContact O-CB 3.38Å; D1205-W1208 PolarHBondContact O-N 3.5Å; D1205-W1208 VanDerWaalsContact OD1-CD1 3.25Å; D1205-W1208 PolarHBondContact OD1-NE1 3.01Å
1206	D	87.4	Confident	88.9	Confident	107 Å²	107	49.9 Å²	49.9	57%	0.572	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-62.4	-23.6	179.4	-72.3	-26.8	0	0	0	112.5	L1203 G1204 W1208 S1209 Y1210	L1203-D1206 PolarHBondContact O-N 3.46Å; G1204-D1206 VanDerWaalsContact C-N 3.26Å; G1204-D1206 PolarHBondContact O-N 3.41Å; D1206-W1208 PolarHBondContact O-N 3.1Å; D1206-W1208 VanDerWaalsContact O-N 3.12Å; D1206-S1209 WeakPolarHBondContact O-CB 3.19Å; D1206-S1209 PolarHBondContact O-N 3.12Å; D1206-S1209 VanDerWaalsContact O-N 3.08Å; D1206-S1209 PolarHBondContact O-OG 3.25Å; D1206-Y1210 WeakPolarHBondContact O-CD2 3.48Å
1207	I	89.8	Confident	88.4	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-55.7	-28.6	173.6	-160.6	-178.7	0	0	0	113.1	I1174 L1196 I1199 A1200 G1204 D1205 S1209 Y1210 L1211	I1174-I1207 HydrophobicContact CD1-CG1 4.45Å; L1196-I1207 WeakPolarHBondContact O-CD1 3.21Å; I1199-I1207 HydrophobicContact CB-CD1 3.98Å; I1199-I1207 HydrophobicContact CG2-CD1 3.7Å; I1199-I1207 HydrophobicContact CG2-CG1 4.14Å; A1200-I1207 HydrophobicContact CB-CD1 3.84Å; A1200-I1207 HydrophobicContact CB-CG2 3.98Å; G1204-I1207 WeakPolarHBondContact O-CG2 3.47Å; D1205-I1207 PolarHBondContact O-N 3.13Å; D1205-I1207 VanDerWaalsContact O-N 3.12Å; I1207-S1209 PolarHBondContact O-N 2.97Å; I1207-Y1210 PolarHBondContact O-N 2.94Å; I1207-L1211 HydrophobicContact CD1-CD1 3.92Å; I1207-L1211 HydrophobicContact CG1-CD1 3.83Å; I1207-L1211 HydrophobicContact CG1-CG 4.17Å; I1207-L1211 WeakPolarHBondContact O-CG 3.45Å; I1207-L1211 PolarHBondContact O-N 3.13Å; I1207-L1211 VanDerWaalsContact O-N 3.12Å
1208	W	90.5	Very high	88.1	Confident	66 Å²	66	54.9 Å²	54.9	25%	0.25	31%	0.312	C	S	.	.	H	α-helix	trans	-66.8	-23.4	-179.4	-59	121.5	0	0	0	113	D1205 D1206 L1211 K1219 L1222 K1223 I1226	D1205-W1208 WeakPolarHBondContact O-CB 3.38Å; D1205-W1208 PolarHBondContact O-N 3.5Å; D1205-W1208 VanDerWaalsContact OD1-CD1 3.25Å; D1205-W1208 PolarHBondContact OD1-NE1 3.01Å; D1206-W1208 PolarHBondContact O-N 3.1Å; D1206-W1208 VanDerWaalsContact O-N 3.12Å; W1208-L1211 HydrophobicContact CE3-CD1 4.34Å; W1208-L1211 HydrophobicContact CZ3-CD1 4.37Å; W1208-K1219 HydrophobicContact CZ3-CB 4.41Å; W1208-K1219 HydrophobicContact CZ3-CG 4.49Å; W1208-L1222 HydrophobicContact CH2-CB 4.46Å; W1208-L1222 HydrophobicContact CH2-CD2 4.24Å; W1208-L1222 HydrophobicContact CH2-CG 4.21Å; W1208-L1222 HydrophobicContact CZ3-CD2 4.02Å; W1208-L1222 HydrophobicContact CZ3-CG 4.44Å; W1208-K1223 HydrophobicContact CH2-CB 3.8Å; W1208-K1223 HydrophobicContact CZ2-CB 3.99Å; W1208-K1223 HydrophobicContact CZ2-CD 4.4Å; W1208-K1223 HydrophobicContact CZ2-CG 4.44Å; W1208-I1226 HydrophobicContact CH2-CD1 3.78Å; W1208-I1226 HydrophobicContact CZ2-CD1 3.71Å
1209	S	88	Confident	87.8	Confident	73 Å²	73	57 Å²	57	51%	0.51	32%	0.319	S	S	.	.	H	α-helix	trans	-69.9	-38.7	174.7	72.7	0	0	0	0	112.3	D1206 I1207 T1212	D1206-S1209 WeakPolarHBondContact O-CB 3.19Å; D1206-S1209 PolarHBondContact O-N 3.12Å; D1206-S1209 VanDerWaalsContact O-N 3.08Å; D1206-S1209 PolarHBondContact O-OG 3.25Å; I1207-S1209 PolarHBondContact O-N 2.97Å; S1209-T1212 WeakPolarHBondContact O-CG2 3.49Å
1210	Y	86.7	Confident	87.5	Confident	63 Å²	63	66.2 Å²	66.2	25%	0.247	35%	0.354	C	S	.	.	H	α-helix	trans	-77.4	-34.9	178.7	-59.5	-81.8	0	0	0	112.4	I1170 D1206 I1207 T1212	I1170-Y1210 HydrophobicContact CG1-CD1 4.05Å; I1170-Y1210 HydrophobicContact CG1-CD2 3.87Å; I1170-Y1210 HydrophobicContact CG1-CE1 4.25Å; I1170-Y1210 HydrophobicContact CG1-CE2 4.07Å; I1170-Y1210 HydrophobicContact CG1-CG 3.86Å; I1170-Y1210 HydrophobicContact CG2-CD1 4.06Å; I1170-Y1210 HydrophobicContact CG2-CE1 3.54Å; I1170-Y1210 HydrophobicContact CG2-CE2 4.26Å; D1206-Y1210 WeakPolarHBondContact O-CD2 3.48Å; I1207-Y1210 PolarHBondContact O-N 2.94Å; Y1210-T1212 PolarHBondContact O-N 3.1Å
1211	L	87.8	Confident	87.3	Confident	1 Å²	1	70 Å²	70	1%	0.005	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	22.1	-176.6	-71.1	174.7	0	0	0	114.8	I1174 V1178 L1196 I1207 W1208 E1213 L1214 K1219 L1222	I1174-L1211 HydrophobicContact CD1-CD2 4.01Å; I1174-L1211 HydrophobicContact CD1-CG 4.42Å; I1174-L1211 HydrophobicContact CG2-CD2 4.12Å; V1178-L1211 HydrophobicContact CG2-CD2 3.8Å; L1196-L1211 HydrophobicContact CD1-CD2 4.07Å; L1196-L1211 HydrophobicContact CD2-CD2 3.98Å; I1207-L1211 HydrophobicContact CD1-CD1 3.92Å; I1207-L1211 HydrophobicContact CG1-CD1 3.83Å; I1207-L1211 HydrophobicContact CG1-CG 4.17Å; I1207-L1211 WeakPolarHBondContact O-CG 3.45Å; I1207-L1211 PolarHBondContact O-N 3.13Å; I1207-L1211 VanDerWaalsContact O-N 3.12Å; W1208-L1211 HydrophobicContact CE3-CD1 4.34Å; W1208-L1211 HydrophobicContact CZ3-CD1 4.37Å; L1211-E1213 VanDerWaalsContact C-N 3.31Å; L1211-E1213 PolarHBondContact O-N 3.26Å; L1211-L1214 HydrophobicContact CB-CB 4.48Å; L1211-L1214 HydrophobicContact CD2-CD2 4.43Å; L1211-L1214 WeakPolarHBondContact O-CB 3.18Å; L1211-L1214 PolarHBondContact O-N 3.25Å; L1211-K1219 WeakPolarHBondContact O-CE 3.11Å; L1211-K1219 PolarHBondContact O-NZ 2.92Å; L1211-L1222 HydrophobicContact CD1-CD2 3.42Å; L1211-L1222 VanDerWaalsContact CD1-CD2 3.42Å
1212	T	83.1	Confident	87.2	Confident	96 Å²	96	66.2 Å²	66.2	59%	0.589	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	-48.2	-176.9	42.9	0	0	0	0	113.5	S1209 Y1210 L1214 K1219	S1209-T1212 WeakPolarHBondContact O-CG2 3.49Å; Y1210-T1212 PolarHBondContact O-N 3.1Å; T1212-L1214 VanDerWaalsContact C-N 3.27Å; T1212-L1214 PolarHBondContact O-N 3.35Å; T1212-K1219 PolarHBondContact O-NZ 3.12Å
1213	E	80.8	Confident	87.2	Confident	128 Å²	128	67.7 Å²	67.7	60%	0.598	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-14.5	-176.5	-61.5	176.2	-167.1	0	0	114.3	K565 L1211 N1215	K565-E1213 IonicContact NZ-OE1 2.72Å; K565-E1213 PolarHBondContact NZ-OE1 2.77Å; L1211-E1213 VanDerWaalsContact C-N 3.31Å; L1211-E1213 PolarHBondContact O-N 3.26Å; E1213-N1215 PolarHBondContact O-N 3.15Å
1214	L	83.7	Confident	87.2	Confident	7 Å²	7	72.3 Å²	72.3	4%	0.037	39%	0.385	C	S	.	.	S	Bend	trans	-75.3	124.4	-179.4	-170.1	70.7	0	0	0	111.8	C1181 L1211 T1212 A1216 K1218 K1219 L1222	C1181-L1214 HydrophobicContact CB-CD1 4.2Å; L1211-L1214 HydrophobicContact CB-CB 4.48Å; L1211-L1214 HydrophobicContact CD2-CD2 4.43Å; L1211-L1214 WeakPolarHBondContact O-CB 3.18Å; L1211-L1214 PolarHBondContact O-N 3.25Å; T1212-L1214 VanDerWaalsContact C-N 3.27Å; T1212-L1214 PolarHBondContact O-N 3.35Å; L1214-A1216 PolarHBondContact O-N 3.12Å; L1214-K1218 HydrophobicContact CD1-CB 3.89Å; L1214-K1218 HydrophobicContact CD1-CD 4.01Å; L1214-K1218 HydrophobicContact CD2-CB 4.13Å; L1214-K1218 HydrophobicContact CG-CB 3.86Å; L1214-K1219 HydrophobicContact CB-CG 4.24Å; L1214-K1219 HydrophobicContact CD2-CG 4.09Å; L1214-K1219 HydrophobicContact CG-CG 4.28Å; L1214-K1219 WeakPolarHBondContact O-CD 3.37Å; L1214-K1219 WeakPolarHBondContact O-CE 3.31Å; L1214-K1219 PolarHBondContact O-NZ 3.43Å; L1214-L1222 HydrophobicContact CD2-CD2 4.33Å
1215	N	83.8	Confident	87.4	Confident	111 Å²	111	74.3 Å²	74.3	59%	0.594	38%	0.382	S	S	*	.			trans	-50.7	135.2	178.9	-179.7	-33.8	0	0	0	112.2	E1213 G1217 K1218 K1219	E1213-N1215 PolarHBondContact O-N 3.15Å; N1215-G1217 PolarHBondContact O-N 3.39Å; N1215-G1217 PolarHBondContact OD1-N 3.15Å; N1215-K1218 WeakPolarHBondContact O-CA 3.31Å; N1215-K1218 WeakPolarHBondContact O-CB 3.45Å; N1215-K1218 PolarHBondContact O-N 2.88Å; N1215-K1219 PolarHBondContact O-N 3.41Å
1216	A	85.2	Confident	87.6	Confident	63 Å²	63	69.3 Å²	69.3	52%	0.521	36%	0.356	S	S	.	.	H	α-helix	trans	-50.3	-34.1	-178.5	0	0	0	0	0	114.8	L1214 K1219 R1220	L1214-A1216 PolarHBondContact O-N 3.12Å; A1216-K1219 PolarHBondContact O-N 3.39Å; A1216-R1220 WeakPolarHBondContact O-CG 3.27Å; A1216-R1220 PolarHBondContact O-N 3.18Å; A1216-R1220 VanDerWaalsContact O-N 3.07Å
1217	G	84.9	Confident	87.7	Confident	47 Å²	47	67.1 Å²	67.1	49%	0.485	34%	0.344	S	S	.	.	H	α-helix	trans	-65.2	-36.9	174.1	0	0	0	0	0	113.1	N1215 L1221	N1215-G1217 PolarHBondContact O-N 3.39Å; N1215-G1217 PolarHBondContact OD1-N 3.15Å; G1217-L1221 PolarHBondContact O-N 3.4Å
1218	K	86.4	Confident	87.7	Confident	62 Å²	62	75.7 Å²	75.7	27%	0.27	38%	0.376	S	S	.	.	H	α-helix	trans	-77.2	-33.9	175.5	-65.3	-174.1	-179.2	-177.7	0	112.1	C1181 N1182 L1214 N1215 L1221 L1222	C1181-K1218 PolarHBondContact O-NZ 3.19Å; N1182-K1218 PolarHBondContact OD1-NZ 3.2Å; L1214-K1218 HydrophobicContact CD1-CB 3.89Å; L1214-K1218 HydrophobicContact CD1-CD 4.01Å; L1214-K1218 HydrophobicContact CD2-CB 4.13Å; L1214-K1218 HydrophobicContact CG-CB 3.86Å; N1215-K1218 WeakPolarHBondContact O-CA 3.31Å; N1215-K1218 WeakPolarHBondContact O-CB 3.45Å; N1215-K1218 PolarHBondContact O-N 2.88Å; K1218-L1221 PolarHBondContact O-N 3.48Å; K1218-L1222 WeakPolarHBondContact O-CB 3.48Å; K1218-L1222 PolarHBondContact O-N 2.97Å
1219	K	88.2	Confident	87.5	Confident	54 Å²	54	76.4 Å²	76.4	24%	0.235	38%	0.382	C	S	.	.	H	α-helix	trans	-59.1	-45.9	170.4	-74.7	178.2	168.9	162.8	0	112.3	W1208 L1211 T1212 L1214 N1215 A1216 L1222 K1223	W1208-K1219 HydrophobicContact CZ3-CB 4.41Å; W1208-K1219 HydrophobicContact CZ3-CG 4.49Å; L1211-K1219 WeakPolarHBondContact O-CE 3.11Å; L1211-K1219 PolarHBondContact O-NZ 2.92Å; T1212-K1219 PolarHBondContact O-NZ 3.12Å; L1214-K1219 HydrophobicContact CB-CG 4.24Å; L1214-K1219 HydrophobicContact CD2-CG 4.09Å; L1214-K1219 HydrophobicContact CG-CG 4.28Å; L1214-K1219 WeakPolarHBondContact O-CD 3.37Å; L1214-K1219 WeakPolarHBondContact O-CE 3.31Å; L1214-K1219 PolarHBondContact O-NZ 3.43Å; N1215-K1219 PolarHBondContact O-N 3.41Å; A1216-K1219 PolarHBondContact O-N 3.39Å; K1219-L1222 PolarHBondContact O-N 3.36Å; K1219-K1223 PolarHBondContact O-N 2.93Å
1220	R	88.5	Confident	87.3	Confident	194 Å²	194	77.1 Å²	77.1	73%	0.732	38%	0.377	S	S	*	.	H	α-helix	trans	-61.4	-43	174.4	-70.7	176.7	-175.9	-172.1	-0	112.2	A1216 K1223 L1224	A1216-R1220 WeakPolarHBondContact O-CG 3.27Å; A1216-R1220 PolarHBondContact O-N 3.18Å; A1216-R1220 VanDerWaalsContact O-N 3.07Å; R1220-K1223 PolarHBondContact O-N 2.95Å; R1220-L1224 WeakPolarHBondContact O-CG 3.48Å; R1220-L1224 PolarHBondContact O-N 2.97Å; R1220-L1224 VanDerWaalsContact O-N 3.07Å
1221	L	89.1	Confident	87	Confident	82 Å²	82	77 Å²	77	43%	0.429	39%	0.386	S	S	.	.	H	α-helix	trans	-63.8	-42.6	176.4	-177.1	62.6	0	0	0	112	G1217 K1218 L1224 Y1225	G1217-L1221 PolarHBondContact O-N 3.4Å; K1218-L1221 PolarHBondContact O-N 3.48Å; L1221-L1224 PolarHBondContact O-N 2.91Å; L1221-Y1225 HydrophobicContact CD1-CD2 4.22Å; L1221-Y1225 HydrophobicContact CD1-CE2 3.69Å; L1221-Y1225 HydrophobicContact CD2-CE2 4.42Å; L1221-Y1225 HydrophobicContact CG-CD2 4.14Å; L1221-Y1225 HydrophobicContact CG-CE2 3.82Å; L1221-Y1225 WeakPolarHBondContact O-CD2 3.04Å; L1221-Y1225 PolarHBondContact O-N 3.29Å
1222	L	91	Very high	86.4	Confident	2 Å²	2	79.2 Å²	79.2	1%	0.01	40%	0.401	C	S	.	.	H	α-helix	trans	-62.4	-46	176.4	179.7	62.6	0	0	0	111.1	V1193 L1196 V1197 W1208 L1211 L1214 K1218 K1219 L1224 Y1225 I1226	V1193-L1222 HydrophobicContact CG1-CD1 4.22Å; L1196-L1222 HydrophobicContact CB-CD1 3.82Å; L1196-L1222 HydrophobicContact CB-CD2 4.14Å; L1196-L1222 HydrophobicContact CD1-CD2 4.3Å; V1197-L1222 HydrophobicContact CG2-CD1 3.56Å; W1208-L1222 HydrophobicContact CH2-CB 4.46Å; W1208-L1222 HydrophobicContact CH2-CD2 4.24Å; W1208-L1222 HydrophobicContact CH2-CG 4.21Å; W1208-L1222 HydrophobicContact CZ3-CD2 4.02Å; W1208-L1222 HydrophobicContact CZ3-CG 4.44Å; L1211-L1222 HydrophobicContact CD1-CD2 3.42Å; L1211-L1222 VanDerWaalsContact CD1-CD2 3.42Å; L1214-L1222 HydrophobicContact CD2-CD2 4.33Å; K1218-L1222 WeakPolarHBondContact O-CB 3.48Å; K1218-L1222 PolarHBondContact O-N 2.97Å; K1219-L1222 PolarHBondContact O-N 3.36Å; L1222-L1224 PolarHBondContact O-N 3.23Å; L1222-Y1225 PolarHBondContact O-N 2.75Å; L1222-I1226 HydrophobicContact CD1-CD1 4.33Å; L1222-I1226 HydrophobicContact CG-CD1 3.9Å; L1222-I1226 WeakPolarHBondContact O-CG1 3.49Å; L1222-I1226 PolarHBondContact O-N 3.48Å
1223	K	91	Very high	85.6	Confident	95 Å²	95	76.5 Å²	76.5	41%	0.413	39%	0.389	S	S	.	.	H	α-helix	trans	-56.9	-47	175.5	178.1	151.4	-178.9	132.6	0	111.6	W1208 K1219 R1220 Y1225 I1226 D1227	W1208-K1223 HydrophobicContact CH2-CB 3.8Å; W1208-K1223 HydrophobicContact CZ2-CB 3.99Å; W1208-K1223 HydrophobicContact CZ2-CD 4.4Å; W1208-K1223 HydrophobicContact CZ2-CG 4.44Å; K1219-K1223 PolarHBondContact O-N 2.93Å; R1220-K1223 PolarHBondContact O-N 2.95Å; K1223-Y1225 PolarHBondContact O-N 3.01Å; K1223-Y1225 VanDerWaalsContact O-N 3.14Å; K1223-I1226 PolarHBondContact O-N 3.38Å; K1223-D1227 VanDerWaalsContact CE-OD1 3.27Å; K1223-D1227 WeakPolarHBondContact CE-OD1 3.4Å; K1223-D1227 WeakPolarHBondContact CG-OD1 3.49Å; K1223-D1227 VanDerWaalsContact CG-OD2 3.28Å; K1223-D1227 WeakPolarHBondContact CG-OD2 3.39Å; K1223-D1227 IonicContact NZ-OD1 2.8Å; K1223-D1227 WeakPolarHBondContact O-CB 3.45Å; K1223-D1227 PolarHBondContact O-N 3Å
1224	L	91	Very high	84.9	Confident	117 Å²	117	74.7 Å²	74.7	61%	0.613	39%	0.387	S	S	*	.	H	α-helix	trans	-58.9	-27.4	175.4	-70.5	169.9	0	0	0	114.2	R1220 L1221 L1222 R1228	R1220-L1224 WeakPolarHBondContact O-CG 3.48Å; R1220-L1224 PolarHBondContact O-N 2.97Å; R1220-L1224 VanDerWaalsContact O-N 3.07Å; L1221-L1224 PolarHBondContact O-N 2.91Å; L1222-L1224 PolarHBondContact O-N 3.23Å; L1224-R1228 VanDerWaalsContact O-CB 3.23Å; L1224-R1228 WeakPolarHBondContact O-CB 3.48Å; L1224-R1228 PolarHBondContact O-N 3.13Å
1225	Y	92.2	Very high	83.8	Confident	78 Å²	78	77.2 Å²	77.2	31%	0.306	41%	0.405	S	S	.	.	H	α-helix	trans	-81.6	-31.9	172.4	-77.4	-69.1	0	0	0	113.2	V1193 F1194 L1221 L1222 K1223 Q1229	V1193-Y1225 HydrophobicContact CG1-CD2 3.72Å; V1193-Y1225 HydrophobicContact CG1-CE2 4.09Å; V1193-Y1225 HydrophobicContact CG1-CG 4.44Å; F1194-Y1225 HydrophobicContact CZ-CD1 4.23Å; F1194-Y1225 AromaticContact CZ-CE1 4Å; F1194-Y1225 HydrophobicContact CZ-CE1 4Å; L1221-Y1225 HydrophobicContact CD1-CD2 4.22Å; L1221-Y1225 HydrophobicContact CD1-CE2 3.69Å; L1221-Y1225 HydrophobicContact CD2-CE2 4.42Å; L1221-Y1225 HydrophobicContact CG-CD2 4.14Å; L1221-Y1225 HydrophobicContact CG-CE2 3.82Å; L1221-Y1225 WeakPolarHBondContact O-CD2 3.04Å; L1221-Y1225 PolarHBondContact O-N 3.29Å; L1222-Y1225 PolarHBondContact O-N 2.75Å; K1223-Y1225 PolarHBondContact O-N 3.01Å; K1223-Y1225 VanDerWaalsContact O-N 3.14Å; Y1225-Q1229 PolarHBondContact O-N 3.27Å
1226	I	90.6	Very high	82.5	Confident	10 Å²	10	78.6 Å²	78.6	5%	0.051	41%	0.408	C	S	.	.	H	α-helix	trans	-68.2	-54	173.4	-64.5	162.8	0	0	0	109.9	V1197 A1200 W1208 L1222 K1223 R1228 Q1229 Q1230	V1197-I1226 HydrophobicContact CB-CG1 4.49Å; V1197-I1226 HydrophobicContact CG1-CG1 4.18Å; V1197-I1226 HydrophobicContact CG2-CG1 4.19Å; A1200-I1226 HydrophobicContact CB-CD1 3.43Å; A1200-I1226 VanDerWaalsContact CB-CD1 3.43Å; A1200-I1226 HydrophobicContact CB-CG1 3.73Å; W1208-I1226 HydrophobicContact CH2-CD1 3.78Å; W1208-I1226 HydrophobicContact CZ2-CD1 3.71Å; L1222-I1226 HydrophobicContact CD1-CD1 4.33Å; L1222-I1226 HydrophobicContact CG-CD1 3.9Å; L1222-I1226 WeakPolarHBondContact O-CG1 3.49Å; L1222-I1226 PolarHBondContact O-N 3.48Å; K1223-I1226 PolarHBondContact O-N 3.38Å; I1226-R1228 PolarHBondContact O-N 3.22Å; I1226-Q1229 PolarHBondContact O-N 3.14Å; I1226-Q1230 HydrophobicContact CG2-CG 4.36Å; I1226-Q1230 WeakPolarHBondContact O-CG 3.46Å; I1226-Q1230 PolarHBondContact O-N 3.05Å
1227	D	89.3	Confident	80.9	Confident	61 Å²	61	80.5 Å²	80.5	33%	0.326	41%	0.409	S	S	.	.	H	α-helix	trans	-52.5	-41.9	177	-57.5	-20.6	0	0	0	110.2	K1223 S1231	K1223-D1227 VanDerWaalsContact CE-OD1 3.27Å; K1223-D1227 WeakPolarHBondContact CE-OD1 3.4Å; K1223-D1227 WeakPolarHBondContact CG-OD1 3.49Å; K1223-D1227 VanDerWaalsContact CG-OD2 3.28Å; K1223-D1227 WeakPolarHBondContact CG-OD2 3.39Å; K1223-D1227 IonicContact NZ-OD1 2.8Å; K1223-D1227 WeakPolarHBondContact O-CB 3.45Å; K1223-D1227 PolarHBondContact O-N 3Å; D1227-S1231 WeakPolarHBondContact O-CB 3.49Å; D1227-S1231 PolarHBondContact O-N 3.46Å; D1227-S1231 PolarHBondContact O-OG 2.82Å
1228	R	90.2	Very high	79.3	Confident	180 Å²	180	81.4 Å²	81.4	68%	0.679	41%	0.408	S	S	*	.	H	α-helix	trans	-65.8	-44.6	175.7	-175.3	173.2	-180	161.2	3.7	112.9	L1224 I1226 S1231 S1232	L1224-R1228 VanDerWaalsContact O-CB 3.23Å; L1224-R1228 WeakPolarHBondContact O-CB 3.48Å; L1224-R1228 PolarHBondContact O-N 3.13Å; I1226-R1228 PolarHBondContact O-N 3.22Å; R1228-S1231 WeakPolarHBondContact CA-OG 3.44Å; R1228-S1231 PolarHBondContact O-N 2.83Å; R1228-S1231 PolarHBondContact O-OG 3.46Å; R1228-S1232 PolarHBondContact O-N 3.35Å; R1228-S1232 VanDerWaalsContact O-N 3.08Å; R1228-S1232 PolarHBondContact O-OG 3.24Å
1229	Q	86	Confident	77.7	Confident	80 Å²	80	83.3 Å²	83.3	37%	0.374	42%	0.42	S	S	.	.	H	α-helix	trans	-64	-42.3	177.6	-90.2	-70.2	8.7	0	0	112.4	V1197 M1201 Y1225 I1226 S1231 S1232 A1233	V1197-Q1229 HydrophobicContact CG1-CB 4.1Å; V1197-Q1229 HydrophobicContact CG1-CG 3.73Å; M1201-Q1229 HydrophobicContact SD-CB 4.19Å; Y1225-Q1229 PolarHBondContact O-N 3.27Å; I1226-Q1229 PolarHBondContact O-N 3.14Å; Q1229-S1231 VanDerWaalsContact C-N 3.32Å; Q1229-S1231 PolarHBondContact O-N 3.41Å; Q1229-S1232 WeakPolarHBondContact CA-OG 3.45Å; Q1229-S1232 PolarHBondContact O-N 3.2Å; Q1229-S1232 PolarHBondContact O-OG 2.87Å; Q1229-S1232 PolarHBondContact OE1-OG 3Å; Q1229-A1233 PolarHBondContact O-N 3.42Å
1230	Q	83.9	Confident	75.9	Confident	88 Å²	88	85.2 Å²	85.2	41%	0.411	44%	0.436	S	S	.	.	H	α-helix	trans	-61.9	-39.6	175	-68.1	176.1	-12.2	0	0	111.6	M1201 I1226 S1232 A1233 T1234	M1201-Q1230 HydrophobicContact CE-CG 3.96Å; M1201-Q1230 HydrophobicContact SD-CG 3.61Å; I1226-Q1230 HydrophobicContact CG2-CG 4.36Å; I1226-Q1230 WeakPolarHBondContact O-CG 3.46Å; I1226-Q1230 PolarHBondContact O-N 3.05Å; Q1230-S1232 PolarHBondContact O-N 3.06Å; Q1230-A1233 PolarHBondContact O-N 2.98Å; Q1230-T1234 PolarHBondContact O-N 2.98Å; Q1230-T1234 VanDerWaalsContact O-N 3.13Å; Q1230-T1234 PolarHBondContact O-OG1 2.93Å
1231	S	79.4	Confident	74.1	Confident	61 Å²	61	81.4 Å²	81.4	43%	0.427	44%	0.435	S	S	.	.	H	α-helix	trans	-67.8	-30.4	175.5	73.1	0	0	0	0	113.8	D1227 R1228 Q1229 T1234 S1235	D1227-S1231 WeakPolarHBondContact O-CB 3.49Å; D1227-S1231 PolarHBondContact O-N 3.46Å; D1227-S1231 PolarHBondContact O-OG 2.82Å; R1228-S1231 WeakPolarHBondContact CA-OG 3.44Å; R1228-S1231 PolarHBondContact O-N 2.83Å; R1228-S1231 PolarHBondContact O-OG 3.46Å; Q1229-S1231 VanDerWaalsContact C-N 3.32Å; Q1229-S1231 PolarHBondContact O-N 3.41Å; S1231-T1234 PolarHBondContact O-OG1 3.29Å; S1231-S1235 WeakPolarHBondContact O-CB 3.27Å; S1231-S1235 PolarHBondContact O-N 2.97Å; S1231-S1235 PolarHBondContact O-OG 2.66Å
1232	S	75.9	Confident	72	Confident	47 Å²	47	88.2 Å²	88.2	33%	0.329	46%	0.455	S	S	.	.	H	α-helix	trans	-72.8	-42.5	171.7	34	0	0	0	0	112.6	R1228 Q1229 Q1230 T1234 S1235 E1236	R1228-S1232 PolarHBondContact O-N 3.35Å; R1228-S1232 VanDerWaalsContact O-N 3.08Å; R1228-S1232 PolarHBondContact O-OG 3.24Å; Q1229-S1232 WeakPolarHBondContact CA-OG 3.45Å; Q1229-S1232 PolarHBondContact O-N 3.2Å; Q1229-S1232 PolarHBondContact O-OG 2.87Å; Q1229-S1232 PolarHBondContact OE1-OG 3Å; Q1230-S1232 PolarHBondContact O-N 3.06Å; S1232-T1234 PolarHBondContact O-N 2.86Å; S1232-S1235 WeakPolarHBondContact O-CB 3.36Å; S1232-S1235 PolarHBondContact O-N 3.14Å; S1232-S1235 VanDerWaalsContact O-N 3.1Å; S1232-E1236 PolarHBondContact O-N 3.12Å
1233	A	67.5	Low	69.3	Low	40 Å²	40	95.1 Å²	95.1	33%	0.331	50%	0.504	S	S	.	.	H	α-helix	trans	-59	-50.2	178.2	0	0	0	0	0	111.9	Q1229 Q1230 S1235 E1236 D1237	Q1229-A1233 PolarHBondContact O-N 3.42Å; Q1230-A1233 PolarHBondContact O-N 2.98Å; A1233-S1235 PolarHBondContact O-N 3.48Å; A1233-E1236 PolarHBondContact O-N 2.86Å; A1233-D1237 PolarHBondContact O-N 2.8Å
1234	T	64.7	Low	68.2	Low	89 Å²	89	95.2 Å²	95.2	55%	0.546	51%	0.508	S	S	.	.	H	α-helix	trans	-65.5	-21.4	176.3	50.9	0	0	0	0	113.9	Q1230 S1231 S1232 S1238	Q1230-T1234 PolarHBondContact O-N 2.98Å; Q1230-T1234 VanDerWaalsContact O-N 3.13Å; Q1230-T1234 PolarHBondContact O-OG1 2.93Å; S1231-T1234 PolarHBondContact O-OG1 3.29Å; S1232-T1234 PolarHBondContact O-N 2.86Å; T1234-S1238 WeakPolarHBondContact O-CB 3.3Å; T1234-S1238 PolarHBondContact O-N 3.4Å; T1234-S1238 PolarHBondContact O-OG 3.38Å
1235	S	61	Low	67	Low	61 Å²	61	94 Å²	94	43%	0.427	50%	0.503	S	S	.	.	H	α-helix	trans	-76	-35.7	171	-61.7	0	0	0	0	112.4	S1231 S1232 A1233 S1238 I1239	S1231-S1235 WeakPolarHBondContact O-CB 3.27Å; S1231-S1235 PolarHBondContact O-N 2.97Å; S1231-S1235 PolarHBondContact O-OG 2.66Å; S1232-S1235 WeakPolarHBondContact O-CB 3.36Å; S1232-S1235 PolarHBondContact O-N 3.14Å; S1232-S1235 VanDerWaalsContact O-N 3.1Å; A1233-S1235 PolarHBondContact O-N 3.48Å; S1235-S1238 PolarHBondContact O-OG 2.79Å; S1235-I1239 WeakPolarHBondContact O-CD1 3.43Å; S1235-I1239 VanDerWaalsContact O-CG1 3.26Å; S1235-I1239 WeakPolarHBondContact O-CG1 3.23Å; S1235-I1239 PolarHBondContact O-N 3.06Å
1236	E	56.1	Low	65.6	Low	139 Å²	139	94.9 Å²	94.9	65%	0.65	51%	0.514	S	S	*	.	H	α-helix	trans	-72.1	-43.6	176.1	-69.4	-174	158.5	0	0	111.1	S1232 A1233 S1238 I1239 T1240	S1232-E1236 PolarHBondContact O-N 3.12Å; A1233-E1236 PolarHBondContact O-N 2.86Å; E1236-S1238 PolarHBondContact O-N 3.13Å; E1236-I1239 PolarHBondContact O-N 2.84Å; E1236-T1240 PolarHBondContact O-N 3.4Å; E1236-T1240 PolarHBondContact O-OG1 2.93Å
1237	D	51.3	Low	64.2	Low	104 Å²	104	99.9 Å²	99.9	56%	0.556	54%	0.541	S	S	*	.	H	α-helix	trans	-58.6	-33.3	174.4	-71.6	-31.1	0	0	0	113.2	A1233 I1239 T1240 T1241	A1233-D1237 PolarHBondContact O-N 2.8Å; D1237-I1239 VanDerWaalsContact C-N 3.35Å; D1237-T1240 WeakPolarHBondContact CA-OG1 2.8Å; D1237-T1240 PolarHBondContact O-OG1 2.8Å; D1237-T1241 WeakPolarHBondContact O-CB 3.46Å; D1237-T1241 WeakPolarHBondContact O-CG2 3.44Å; D1237-T1241 PolarHBondContact O-N 3Å; D1237-T1241 PolarHBondContact O-OG1 3.34Å
1238	S	52	Low	62.6	Low	65 Å²	65	102.3 Å²	102.3	46%	0.455	55%	0.554	S	S	.	*	H	α-helix	trans	-85.9	-3.3	177.3	55.4	0	0	0	0	114.4	T1234 S1235 E1236 T1241	T1234-S1238 WeakPolarHBondContact O-CB 3.3Å; T1234-S1238 PolarHBondContact O-N 3.4Å; T1234-S1238 PolarHBondContact O-OG 3.38Å; S1235-S1238 PolarHBondContact O-OG 2.79Å; E1236-S1238 PolarHBondContact O-N 3.13Å; S1238-T1241 WeakPolarHBondContact CA-OG1 3.36Å
1239	I	52.8	Low	60.8	Low	103 Å²	103	97.1 Å²	97.1	53%	0.528	55%	0.546	S	S	.	.	H	α-helix	trans	-98.9	-39.7	169.1	-70.6	167.4	0	0	0	110.5	S1235 E1236 D1237 T1241 R1242 S1243	S1235-I1239 WeakPolarHBondContact O-CD1 3.43Å; S1235-I1239 VanDerWaalsContact O-CG1 3.26Å; S1235-I1239 WeakPolarHBondContact O-CG1 3.23Å; S1235-I1239 PolarHBondContact O-N 3.06Å; E1236-I1239 PolarHBondContact O-N 2.84Å; D1237-I1239 VanDerWaalsContact C-N 3.35Å; I1239-T1241 VanDerWaalsContact C-N 3.28Å; I1239-T1241 PolarHBondContact O-N 3.15Å; I1239-R1242 CarbonylContact O-C 3.57Å; I1239-R1242 WeakPolarHBondContact O-CA 3.47Å; I1239-R1242 PolarHBondContact O-N 2.96Å; I1239-S1243 WeakPolarHBondContact O-CB 3.46Å; I1239-S1243 PolarHBondContact O-N 2.98Å; I1239-S1243 VanDerWaalsContact O-N 3.13Å; I1239-S1243 PolarHBondContact O-OG 3.05Å
1240	T	50.2	Low	58.9	Low	93 Å²	93	98.4 Å²	98.4	57%	0.571	56%	0.558	S	S	*	*	H	α-helix	trans	-71.4	-19.5	175.1	55.1	0	0	0	0	113.5	E1236 D1237 R1242	E1236-T1240 PolarHBondContact O-N 3.4Å; E1236-T1240 PolarHBondContact O-OG1 2.93Å; D1237-T1240 WeakPolarHBondContact CA-OG1 2.8Å; D1237-T1240 PolarHBondContact O-OG1 2.8Å; T1240-R1242 VanDerWaalsContact C-N 3.32Å
1241	T	51.7	Low	57	Low	115 Å²	115	99.2 Å²	99.2	71%	0.706	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	7.4	167.1	51.9	0	0	0	0	113.8	D1237 S1238 I1239	D1237-T1241 WeakPolarHBondContact O-CB 3.46Å; D1237-T1241 WeakPolarHBondContact O-CG2 3.44Å; D1237-T1241 PolarHBondContact O-N 3Å; D1237-T1241 PolarHBondContact O-OG1 3.34Å; S1238-T1241 WeakPolarHBondContact CA-OG1 3.36Å; I1239-T1241 VanDerWaalsContact C-N 3.28Å; I1239-T1241 PolarHBondContact O-N 3.15Å
1242	R	43.7	Very low	55.2	Low	224 Å²	224	102.3 Å²	102.3	85%	0.845	58%	0.581	S	S	*	*			trans	-129.1	6.9	177.6	-94.7	-175	164.6	-168.3	-3.5	114.2	I1239 T1240	I1239-R1242 CarbonylContact O-C 3.57Å; I1239-R1242 WeakPolarHBondContact O-CA 3.47Å; I1239-R1242 PolarHBondContact O-N 2.96Å; T1240-R1242 VanDerWaalsContact C-N 3.32Å
1243	S	35.3	Very low	53.3	Low	148 Å²	148	107.4 Å²	107.4	100%	1.035	60%	0.604	S	S	*	*			trans	-124.8	0	-179.3	-50.8	0	0	0	0	110.3	I1239	I1239-S1243 WeakPolarHBondContact O-CB 3.46Å; I1239-S1243 PolarHBondContact O-N 2.98Å; I1239-S1243 VanDerWaalsContact O-N 3.13Å; I1239-S1243 PolarHBondContact O-OG 3.05Å

Retrieved 1,243 of 1,243 residues in 646.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).