A0A5K4EUM0_SCHMA Loading...

Putative clasp2 protein

AlphaFold DB , UniProt , Accession A0A5K4EUM0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,265 aa.

						>A0A5K4EUM0_SCHMA|A0A5K4EUM0
MSNSAADGIERKPGTLSKTSVSGGKSVRKRSTGDPQGAGAVDEDVFRQSFIPSMSITASSGKELTEIINRIKDALSGNPEEWEKRVDALKTLRAIVANGALQYDEFIPLLKTLENSIDLSLRDLRSSVVREACITVAFLSQEIRNRFDRFAESVLQTIIALLSNSAKVMATSGVVAMRFILENTCSSRLLPILISSLSSKSNVTRKCICEFLEIIFRTWPLNILEKNLSVLQDALRRGISDADQEARLFTRRSFPLFVAKFPEQANLFLQNLDSQKRKLIEKDLIAAGLSEGIGAGDTATTGSSRSQPGSQSNLTYQSTKRPNRPVLGTSSLANNTNRSRPPLTSQNEYNTVGRSYRQGSIASNYDSRPRQIGRKLVSQSQPTSREVSPSRLAYFTAYGTTTSNNNDGQKLQFNTTNPNRNGTIGLVDNNNTTTERTTRLLMNSRVPRSQGASRETSPTRSTASGYTMPSYQHNNSFQLTGTNQIGQMNYRRQQQQRPSLGTLSDCADLGDGPLYGRHYSTGNNRGPYGSDDNFSETSSQCSERSGRSVPGYRRQSSSKVTSNLKEIISQLQAVQWSDRKDGLTNLQNYMRSGYPLNPDDIHCLTEIFSKMFADSQSKVVSLFMDTLQFFIKEYNPLLRDWLYTLLIRLLYRQSHEALSSHQKAIQETLFVLRSHFPLNTQFNSCCHFIMDNAHTPNFRVKTCLLEYMKDLILMMSPDLIANPSNEVINAVGKIISWSAEPKSADVRRMASRVVIKLFDLNSTSFSNLLQSLPRGVQDRAHEVLKTYQKTATGGGLINLTDTNHNSPSWKSSSGSLRKYSLPVTTAGRSSMTRSVDQDHMIFSPPSSGRYGSISGPYYSSQRSHNSAGSDSGRVSPESMNRIIRETTDGLQSLSMGASGGGILTSVGITSPTRRVSADPSFTTNDYTYATNGNTGVLRTVQPNNFPNSQPTALQSPNIIPSNVNPSYASSQGTTASNDPTLQSTYGLRTNKALLNTLINYDPGDGPKLKKPVIGYQTLKKIREMPPEDIMSEILQELSNHNERDNVTYEQRKTCMLKLIKLLRDGVISNWDEYFKPTLLILLETLGDDGHETRALALRVLQELVRAKPELFHDFAYLFVIKVLEACRDSEKSVVRAAEDCANTVAQNLPQELCLNVLTPLINDSQLHINLPAIKMQMQVIQNSSPELVHEFINALIPGLVIACNHEESAIRKASVFCLVAIAMKLGDDIWSYLTELNAGKKRLLKLYIDRQQSSATSEDSITTRS
					

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	37.3	Very low	36.2	Very low	234 Å²	234	142.3 Å²	142.3	100%	1.153	82%	0.818	S	S	*	*				0	93.8	0	-68.9	163.6	145.7	0	0	106.3
2	S	35.1	Very low	35.8	Very low	102 Å²	102	147.3 Å²	147.3	71%	0.713	82%	0.823	S	S	*	*				82.5	127.6	68	64.1	0	0	0	0	112.3
3	N	35	Very low	36	Very low	166 Å²	166	145.6 Å²	145.6	89%	0.888	82%	0.823	S	S	*	*			cis	-158.4	175.3	-9	-131.9	17.4	0	0	0	110.8
4	S	32.5	Very low	36	Very low	112 Å²	112	140 Å²	140	78%	0.783	81%	0.813	S	S	*	*			trans	-90.1	169.8	-177.1	-51.9	0	0	0	0	115.3
5	A	37.5	Very low	36	Very low	101 Å²	101	139.5 Å²	139.5	84%	0.835	81%	0.813	S	S	*	*			trans	90.2	129.9	144.8	0	0	0	0	0	121.6
6	A	40.5	Very low	35.8	Very low	96 Å²	96	141 Å²	141	79%	0.793	82%	0.816	S	S	*	*			trans	164.2	102.6	153.1	0	0	0	0	0	105.6
7	D	35.4	Very low	35.7	Very low	174 Å²	174	139.8 Å²	139.8	93%	0.93	82%	0.817	S	S	*	*			cis	76.7	134.4	40.4	-157.6	13	0	0	0	114.4
8	G	37.7	Very low	35.2	Very low	56 Å²	56	143.7 Å²	143.7	58%	0.577	82%	0.823	S	S	*	*			trans	152.5	87.2	-178.7	0	0	0	0	0	118.4
9	I	39.4	Very low	35.1	Very low	166 Å²	166	144 Å²	144	85%	0.851	83%	0.827	S	S	*	*			trans	68.1	140.7	132.9	-61.6	160.3	0	0	0	119
10	E	32.8	Very low	34.7	Very low	137 Å²	137	142.4 Å²	142.4	64%	0.64	83%	0.825	S	S	*	*			cis	-171.6	166.5	-25.6	-163.7	-170.1	-157.1	0	0	108.7
11	R	35.5	Very low	34.5	Very low	221 Å²	221	141.4 Å²	141.4	83%	0.834	82%	0.821	S	S	*	*			trans	97.6	135.2	156.6	-55.9	178.4	-168	179.9	5.1	120.1
12	K	31.2	Very low	34.2	Very low	203 Å²	203	135.9 Å²	135.9	88%	0.883	81%	0.806	S	S	*	*			trans	-151.1	-178	-174.3	-103.9	-176.5	179.5	175.6	0	105.6
13	P	37.6	Very low	33.9	Very low	125 Å²	125	134.9 Å²	134.9	81%	0.812	81%	0.811	S	S	*	*			cis	-133.9	-178.5	-39.3	38.8	-22.9	0	0	0	112.4
14	G	36.7	Very low	33.6	Very low	67 Å²	67	130.6 Å²	130.6	69%	0.691	81%	0.806	S	S	*	*			trans	139.4	156.1	162.4	0	0	0	0	0	114.3
15	T	36.6	Very low	33.7	Very low	132 Å²	132	135.3 Å²	135.3	81%	0.81	81%	0.812	S	S	*	*			cis	-151.4	163.7	-11.4	-64.2	0	0	0	0	108.7
16	L	31.7	Very low	33.3	Very low	164 Å²	164	136 Å²	136	86%	0.859	81%	0.811	S	S	*	*			trans	-45.1	140	-172.1	-72.2	66.1	0	0	0	116.6
17	S	33.9	Very low	32.9	Very low	120 Å²	120	138.1 Å²	138.1	84%	0.839	81%	0.814	S	S	*	*				-156	140.5	125.2	48.2	0	0	0	0	111.4
18	K	28.2	Very low	32.7	Very low	211 Å²	211	140.5 Å²	140.5	92%	0.917	81%	0.81	S	S	*	*			trans	-108.3	117.3	174.5	-75.4	-179.9	178.6	175.7	0	109.6
19	T	32.8	Very low	32.5	Very low	149 Å²	149	147.7 Å²	147.7	91%	0.914	83%	0.825	S	S	*	*			trans	-139.4	144.5	153	43.7	0	0	0	0	109.1
20	S	26.9	Very low	32	Very low	111 Å²	111	150.3 Å²	150.3	78%	0.776	82%	0.824	S	S	*	*			trans	-122.3	176.5	-175.7	54	0	0	0	0	111
21	V	30.8	Very low	32	Very low	123 Å²	123	149.5 Å²	149.5	75%	0.745	83%	0.834	S	S	*	*			trans	93.6	104.3	166.1	-172.5	0	0	0	0	117.6
22	S	29.6	Very low	31.9	Very low	118 Å²	118	142.2 Å²	142.2	83%	0.825	81%	0.814	S	S	*	*			trans	58.2	144.3	152.7	72.1	0	0	0	0	120
23	G	29.8	Very low	31.7	Very low	80 Å²	80	135.1 Å²	135.1	83%	0.825	80%	0.799	S	S	*	*			cis	131	113	5.8	0	0	0	0	0	111.8
24	G	29	Very low	31.4	Very low	76 Å²	76	134.8 Å²	134.8	78%	0.784	79%	0.79	S	S	*	*			trans	118.3	152.9	178.7	0	0	0	0	0	113.2
25	K	34.1	Very low	31.2	Very low	211 Å²	211	135.3 Å²	135.3	92%	0.917	78%	0.781	S	S	*	*			cis	-135.8	138.6	15.5	-64.2	165.5	-175.9	167	0	111.3
26	S	29.3	Very low	31.2	Very low	115 Å²	115	134.2 Å²	134.2	80%	0.804	77%	0.767	S	S	*	*			trans	-88.9	144.8	167	176.3	0	0	0	0	111.1	R28	S26-R28 PolarHBondContact O-N 2.65Å
27	V	33.1	Very low	31.4	Very low	142 Å²	142	128.4 Å²	128.4	86%	0.861	75%	0.747	S	S	*	*			trans	-81.2	113.7	-179.3	176.5	0	0	0	0	110.2
28	R	30.6	Very low	31.9	Very low	223 Å²	223	128 Å²	128	84%	0.842	75%	0.751	S	S	*	*			trans	-80.7	132.7	175.9	-68.3	177.9	173.7	172.7	-3.7	111.4	S26	S26-R28 PolarHBondContact O-N 2.65Å
29	K	32.9	Very low	33.4	Very low	208 Å²	208	119.7 Å²	119.7	90%	0.904	73%	0.725	S	S	*	*			trans	-110.5	129.6	152.8	-153.8	168.2	-171.5	172.2	0	107.5
30	R	28.2	Very low	35.1	Very low	220 Å²	220	113.9 Å²	113.9	83%	0.83	69%	0.692	S	S	*	*			trans	-92.3	130.3	-177.5	-57.5	-177.8	-167.7	-179.7	3.4	109.8
31	S	34.7	Very low	37.6	Very low	121 Å²	121	109.1 Å²	109.1	85%	0.846	66%	0.658	S	S	*	*			trans	-105.9	128.6	148.8	40.6	0	0	0	0	107.4
32	T	31.5	Very low	40	Very low	68 Å²	68	106.2 Å²	106.2	42%	0.417	64%	0.639	S	S	.	*			trans	-90.1	136.4	-173.4	40.5	0	0	0	0	110.2	S384 R385	T32-S384 WeakPolarHBondContact CG2-O 3.35Å; T32-R385 PolarHBondContact OG1-N 3.28Å; T32-R385 PolarHBondContact OG1-O 2.98Å
33	G	27.3	Very low	42.7	Very low	54 Å²	54	103 Å²	103	56%	0.557	61%	0.61	S	S	*	*	S	Bend	trans	-164.8	-71.2	-177.8	0	0	0	0	0	113
34	D	32.5	Very low	45.3	Very low	118 Å²	118	104.1 Å²	104.1	63%	0.631	60%	0.598	S	S	*	*	S	Bend	trans	-149.6	160.2	-170.1	-149.5	26.9	0	0	0	110.1	Q36	D34-Q36 HydrophobicContact CB-CG 4.38Å; D34-Q36 PolarHBondContact O-N 3.07Å
35	P	32	Very low	48.1	Very low	78 Å²	78	102.7 Å²	102.7	51%	0.506	57%	0.574	S	S	.	*			trans	-80.1	44.3	-176.1	34.7	-32.8	0	0	0	112.4	G37 P382	P35-G37 PolarHBondContact O-N 3.06Å; P35-P382 HydrophobicContact CB-CB 4.14Å; P35-P382 HydrophobicContact CG-CB 4.18Å
36	Q	36.4	Very low	50.8	Low	108 Å²	108	92.7 Å²	92.7	51%	0.505	53%	0.53	S	S	.	.			trans	-73.2	76.6	174.5	-65.9	-165.7	25.2	0	0	110.7	D34 A40	D34-Q36 HydrophobicContact CB-CG 4.38Å; D34-Q36 PolarHBondContact O-N 3.07Å; Q36-A40 HydrophobicContact CB-CB 4Å
37	G	36.5	Very low	53.6	Low	43 Å²	43	92.2 Å²	92.2	44%	0.443	51%	0.511	S	S	.	.			trans	-54.6	151	174.3	0	0	0	0	0	112.5	P35 A40 K167	P35-G37 PolarHBondContact O-N 3.06Å; G37-A40 PolarHBondContact O-N 2.71Å; G37-K167 PolarHBondContact O-NZ 3.48Å
38	A	42.9	Very low	56.2	Low	112 Å²	112	92.7 Å²	92.7	93%	0.926	50%	0.504	S	S	*	.	S	Bend	trans	-44.6	138.1	-170.2	0	0	0	0	0	114.1
39	G	60.4	Low	58.8	Low	35 Å²	35	83.2 Å²	83.2	36%	0.361	47%	0.472	S	S	.	.	S	Bend	trans	86.2	14.7	-173.9	0	0	0	0	0	114.6	K167 V168	G39-K167 CarbonylContact O-C 3.44Å; G39-K167 WeakPolarHBondContact O-CG 3.18Å; G39-V168 WeakPolarHBondContact O-CG2 3.11Å; G39-V168 PolarHBondContact O-N 2.83Å
40	A	69	Low	61.3	Low	28 Å²	28	73.8 Å²	73.8	23%	0.231	43%	0.431	C	S	.	.			trans	-73.1	149.4	152.9	0	0	0	0	0	109.8	Q36 G37 T171	Q36-A40 HydrophobicContact CB-CB 4Å; G37-A40 PolarHBondContact O-N 2.71Å; A40-T171 HydrophobicContact CB-CG2 4.43Å
41	V	78.4	Confident	63.6	Low	11 Å²	11	67 Å²	67	7%	0.067	41%	0.41	C	S	.	.			trans	-120.1	133.5	164.9	-163.9	0	0	0	0	107.7	V45 F46 V168 T171	V41-V45 HydrophobicContact CG1-CB 4.06Å; V41-V45 HydrophobicContact CG1-CG1 3.66Å; V41-F46 HydrophobicContact CB-CE2 4.34Å; V41-F46 HydrophobicContact CG1-CD2 3.69Å; V41-F46 HydrophobicContact CG1-CE2 3.62Å; V41-V168 HydrophobicContact CG2-CG1 4.16Å; V41-T171 PolarHBondContact N-OG1 2.83Å
42	D	81.3	Confident	65.1	Low	62 Å²	62	62.1 Å²	62.1	33%	0.332	38%	0.376	S	S	.	.			trans	-111.8	175.2	179.4	54.7	41.3	0	0	0	111.4	D44 V45 F46	D42-D44 VanDerWaalsContact C-N 3.31Å; D42-D44 PolarHBondContact O-N 2.86Å; D42-D44 PolarHBondContact OD1-N 2.7Å; D42-V45 PolarHBondContact O-N 2.9Å; D42-V45 WeakPolarHBondContact OD1-CB 3.44Å; D42-V45 VanDerWaalsContact OD1-CG2 3.27Å; D42-V45 WeakPolarHBondContact OD1-CG2 3.41Å; D42-V45 PolarHBondContact OD1-N 2.83Å; D42-F46 WeakPolarHBondContact O-CD2 3.47Å; D42-F46 PolarHBondContact O-N 3.25Å
43	E	86.4	Confident	66.5	Low	49 Å²	49	65.2 Å²	65.2	23%	0.229	40%	0.4	C	S	.	.	H	α-helix	trans	-65.4	-32.3	178.6	-74.4	169.8	-143.5	0	0	112.6	F46 R47 V175 R178 F179	E43-F46 WeakPolarHBondContact O-CB 3.41Å; E43-F46 PolarHBondContact O-N 2.89Å; E43-R47 WeakPolarHBondContact O-CG 3.5Å; E43-R47 PolarHBondContact O-N 2.73Å; E43-V175 HydrophobicContact CG-CG1 3.86Å; E43-V175 HydrophobicContact CG-CG2 4.43Å; E43-R178 WeakPolarHBondContact OE1-CD 3.46Å; E43-R178 IonicContact OE1-CZ 2.72Å; E43-R178 IonicContact OE1-NE 3.62Å; E43-R178 IonicContact OE1-NH1 3.8Å; E43-R178 PolarHBondContact OE1-NH1 2.74Å; E43-F179 HydrophobicContact CB-CE2 4.46Å; E43-F179 HydrophobicContact CG-CE2 4.14Å
44	D	84.5	Confident	68.3	Low	105 Å²	105	65.5 Å²	65.5	56%	0.561	39%	0.388	S	S	*	.	H	α-helix	trans	-68	-40.8	178.6	-74.7	-41.2	0	0	0	111.3	D42 F46 R47 Q48	D42-D44 VanDerWaalsContact C-N 3.31Å; D42-D44 PolarHBondContact O-N 2.86Å; D42-D44 PolarHBondContact OD1-N 2.7Å; D44-F46 VanDerWaalsContact C-N 3.31Å; D44-F46 PolarHBondContact O-N 3.45Å; D44-R47 PolarHBondContact O-N 3.45Å; D44-Q48 WeakPolarHBondContact O-CB 3.35Å; D44-Q48 WeakPolarHBondContact O-CG 3.24Å; D44-Q48 PolarHBondContact O-N 3.1Å; D44-Q48 PolarHBondContact O-NE2 3.3Å
45	V	87.3	Confident	69.7	Low	46 Å²	46	64.6 Å²	64.6	28%	0.279	39%	0.39	S	S	.	.	H	α-helix	trans	-66.3	-32.4	173	168.7	0	0	0	0	111.6	V41 D42 S49 R130	V41-V45 HydrophobicContact CG1-CB 4.06Å; V41-V45 HydrophobicContact CG1-CG1 3.66Å; D42-V45 PolarHBondContact O-N 2.9Å; D42-V45 WeakPolarHBondContact OD1-CB 3.44Å; D42-V45 VanDerWaalsContact OD1-CG2 3.27Å; D42-V45 WeakPolarHBondContact OD1-CG2 3.41Å; D42-V45 PolarHBondContact OD1-N 2.83Å; V45-S49 WeakPolarHBondContact O-CB 3.36Å; V45-S49 PolarHBondContact O-N 3.5Å; V45-S49 PolarHBondContact O-OG 2.76Å; V45-R130 VanDerWaalsContact CG1-NH2 3.31Å
46	F	91.4	Very high	71.7	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-64.5	-53.4	169.6	-94	-125.1	0	0	0	110.9	V41 D42 E43 D44 Q48 S49 F50 C133 I134 A137 S172 V175 A176 F179	V41-F46 HydrophobicContact CB-CE2 4.34Å; V41-F46 HydrophobicContact CG1-CD2 3.69Å; V41-F46 HydrophobicContact CG1-CE2 3.62Å; D42-F46 WeakPolarHBondContact O-CD2 3.47Å; D42-F46 PolarHBondContact O-N 3.25Å; E43-F46 WeakPolarHBondContact O-CB 3.41Å; E43-F46 PolarHBondContact O-N 2.89Å; D44-F46 VanDerWaalsContact C-N 3.31Å; D44-F46 PolarHBondContact O-N 3.45Å; F46-Q48 VanDerWaalsContact C-N 3.32Å; F46-Q48 PolarHBondContact O-N 3.41Å; F46-S49 CarbonylContact O-C 3.5Å; F46-S49 WeakPolarHBondContact O-CA 2.98Å; F46-S49 WeakPolarHBondContact O-CB 3.39Å; F46-S49 PolarHBondContact O-N 3.18Å; F46-F50 HydrophobicContact CB-CE1 4.01Å; F46-F50 HydrophobicContact CB-CZ 4.36Å; F46-F50 HydrophobicContact CD1-CE1 4.13Å; F46-F50 WeakPolarHBondContact O-CD1 3.4Å; F46-F50 WeakPolarHBondContact O-CG 3.24Å; F46-F50 PolarHBondContact O-N 2.91Å; F46-C133 HydrophobicContact CE1-CB 4.23Å; F46-C133 HydrophobicContact CZ-CB 3.86Å; F46-I134 HydrophobicContact CD1-CB 4.38Å; F46-I134 HydrophobicContact CD1-CG1 3.79Å; F46-I134 HydrophobicContact CD2-CD1 4.42Å; F46-I134 HydrophobicContact CD2-CG1 3.8Å; F46-I134 HydrophobicContact CE1-CB 4.35Å; F46-I134 HydrophobicContact CE1-CG1 3.76Å; F46-I134 HydrophobicContact CE2-CD1 4.44Å; F46-I134 HydrophobicContact CE2-CG1 3.76Å; F46-I134 HydrophobicContact CG-CG1 3.82Å; F46-I134 HydrophobicContact CZ-CG1 3.74Å; F46-A137 HydrophobicContact CD1-CB 3.61Å; F46-A137 HydrophobicContact CE1-CB 3.73Å; F46-S172 WeakPolarHBondContact CZ-O 3.39Å; F46-V175 HydrophobicContact CB-CG1 4.09Å; F46-V175 HydrophobicContact CD1-CB 4.47Å; F46-V175 HydrophobicContact CD1-CG1 3.55Å; F46-V175 HydrophobicContact CD2-CB 4.2Å; F46-V175 HydrophobicContact CD2-CG1 3.6Å; F46-V175 HydrophobicContact CE1-CB 4.2Å; F46-V175 HydrophobicContact CE1-CG1 3.75Å; F46-V175 HydrophobicContact CE2-CB 3.92Å; F46-V175 HydrophobicContact CE2-CG1 3.81Å; F46-V175 HydrophobicContact CG-CB 4.47Å; F46-V175 HydrophobicContact CG-CG1 3.47Å; F46-V175 VanDerWaalsContact CG-CG1 3.47Å; F46-V175 HydrophobicContact CZ-CB 3.93Å; F46-V175 HydrophobicContact CZ-CG1 3.88Å; F46-A176 HydrophobicContact CE1-CB 4.33Å; F46-F179 HydrophobicContact CB-CE2 4.13Å; F46-F179 HydrophobicContact CD1-CD2 4.34Å; F46-F179 HydrophobicContact CD1-CE2 4.3Å
47	R	88.9	Confident	73.6	Confident	106 Å²	106	60.3 Å²	60.3	40%	0.4	37%	0.368	S	S	.	.	H	α-helix	trans	-59.1	-39.8	-179.8	-69.3	177.3	-170.9	-68.7	-2.7	112.5	E43 D44 S49 F50 F179	E43-R47 WeakPolarHBondContact O-CG 3.5Å; E43-R47 PolarHBondContact O-N 2.73Å; D44-R47 PolarHBondContact O-N 3.45Å; R47-S49 PolarHBondContact O-N 2.85Å; R47-F50 HydrophobicContact CG-CD2 4.39Å; R47-F50 HydrophobicContact CG-CE2 4.04Å; R47-F50 PolarHBondContact O-N 3.34Å; R47-F179 HydrophobicContact CG-CZ 4.06Å
48	Q	86.3	Confident	75.6	Confident	152 Å²	152	59 Å²	59	71%	0.71	35%	0.353	S	S	*	.	H	α-helix	trans	-66.4	-21.3	172.4	-71.8	165.8	48	0	0	113.8	D44 F46	D44-Q48 WeakPolarHBondContact O-CB 3.35Å; D44-Q48 WeakPolarHBondContact O-CG 3.24Å; D44-Q48 PolarHBondContact O-N 3.1Å; D44-Q48 PolarHBondContact O-NE2 3.3Å; F46-Q48 VanDerWaalsContact C-N 3.32Å; F46-Q48 PolarHBondContact O-N 3.41Å
49	S	85.5	Confident	77.3	Confident	24 Å²	24	58.1 Å²	58.1	17%	0.168	34%	0.34	C	S	.	.	H	α-helix	trans	-97.6	-8.2	179.3	-55.7	0	0	0	0	113.5	V45 F46 R47 I51 R93 R130	V45-S49 WeakPolarHBondContact O-CB 3.36Å; V45-S49 PolarHBondContact O-N 3.5Å; V45-S49 PolarHBondContact O-OG 2.76Å; F46-S49 CarbonylContact O-C 3.5Å; F46-S49 WeakPolarHBondContact O-CA 2.98Å; F46-S49 WeakPolarHBondContact O-CB 3.39Å; F46-S49 PolarHBondContact O-N 3.18Å; R47-S49 PolarHBondContact O-N 2.85Å; S49-I51 PolarHBondContact O-N 3.44Å; S49-R93 VanDerWaalsContact O-CZ 3.32Å; S49-R93 PolarHBondContact O-NE 2.82Å; S49-R93 VanDerWaalsContact O-NE 3.09Å; S49-R93 PolarHBondContact O-NH2 3.21Å; S49-R130 PolarHBondContact OG-NH2 2.8Å
50	F	85.6	Confident	78.5	Confident	10 Å²	10	58.9 Å²	58.9	4%	0.044	34%	0.34	C	S	.	.	S	Bend	trans	-62.7	-43.8	-173	-79.4	-8.5	0	0	0	113.5	F46 R47 P52 R93 I134 A137 F138 F179	F46-F50 HydrophobicContact CB-CE1 4.01Å; F46-F50 HydrophobicContact CB-CZ 4.36Å; F46-F50 HydrophobicContact CD1-CE1 4.13Å; F46-F50 WeakPolarHBondContact O-CD1 3.4Å; F46-F50 WeakPolarHBondContact O-CG 3.24Å; F46-F50 PolarHBondContact O-N 2.91Å; R47-F50 HydrophobicContact CG-CD2 4.39Å; R47-F50 HydrophobicContact CG-CE2 4.04Å; R47-F50 PolarHBondContact O-N 3.34Å; F50-P52 WeakPolarHBondContact O-CD 3.36Å; F50-R93 WeakPolarHBondContact O-CB 3.41Å; F50-R93 WeakPolarHBondContact O-CD 3.44Å; F50-R93 PolarHBondContact O-NE 3.04Å; F50-R93 VanDerWaalsContact O-NE 3.14Å; F50-I134 HydrophobicContact CD1-CG2 4.07Å; F50-I134 HydrophobicContact CE1-CG2 4.47Å; F50-A137 HydrophobicContact CE1-CB 3.97Å; F50-A137 HydrophobicContact CZ-CB 4.15Å; F50-F138 HydrophobicContact CB-CD2 3.62Å; F50-F138 HydrophobicContact CB-CE2 4.06Å; F50-F138 HydrophobicContact CB-CG 4.3Å; F50-F138 HydrophobicContact CD1-CB 3.81Å; F50-F138 HydrophobicContact CD1-CD2 4.19Å; F50-F138 HydrophobicContact CD1-CG 4.38Å; F50-F138 AromaticContact CD2-CD2 3.93Å; F50-F138 HydrophobicContact CD2-CD2 3.93Å; F50-F138 HydrophobicContact CE1-CB 4.07Å; F50-F138 HydrophobicContact CG-CB 4.2Å; F50-F138 AromaticContact CG-CD2 3.68Å; F50-F138 HydrophobicContact CG-CD2 3.68Å; F50-F138 HydrophobicContact CG-CG 4.29Å; F50-F179 HydrophobicContact CE2-CD1 4.44Å; F50-F179 AromaticContact CE2-CE1 3.67Å; F50-F179 HydrophobicContact CE2-CE1 3.67Å; F50-F179 AromaticContact CE2-CZ 3.85Å; F50-F179 HydrophobicContact CE2-CZ 3.85Å; F50-F179 AromaticContact CZ-CD1 3.99Å; F50-F179 HydrophobicContact CZ-CD1 3.99Å; F50-F179 HydrophobicContact CZ-CD2 4.42Å; F50-F179 AromaticContact CZ-CE1 3.48Å; F50-F179 HydrophobicContact CZ-CE1 3.48Å; F50-F179 VanDerWaalsContact CZ-CE1 3.48Å; F50-F179 AromaticContact CZ-CE2 3.97Å; F50-F179 HydrophobicContact CZ-CE2 3.97Å; F50-F179 HydrophobicContact CZ-CG 4.44Å; F50-F179 AromaticContact CZ-CZ 3.47Å; F50-F179 HydrophobicContact CZ-CZ 3.47Å; F50-F179 VanDerWaalsContact CZ-CZ 3.47Å
51	I	76.4	Confident	79.2	Confident	76 Å²	76	58 Å²	58	39%	0.39	33%	0.333	S	S	.	.	S	Bend	trans	-104.2	105.5	175.2	-55.1	177.5	0	0	0	108.3	S49 A97	S49-I51 PolarHBondContact O-N 3.44Å; I51-A97 HydrophobicContact CG1-CB 4.2Å; I51-A97 HydrophobicContact CG2-CB 4.43Å
52	P	67.5	Low	79.7	Confident	20 Å²	20	65.2 Å²	65.2	13%	0.13	36%	0.364	C	S	.	.			trans	-67.7	155.7	171	-18.8	34.5	0	0	0	110.7	F50 M54 K90 R93	F50-P52 WeakPolarHBondContact O-CD 3.36Å; P52-M54 PolarHBondContact O-N 3.33Å; P52-K90 HydrophobicContact CB-CB 4.11Å; P52-K90 HydrophobicContact CB-CG 4.47Å; P52-K90 HydrophobicContact CG-CB 3.79Å; P52-K90 HydrophobicContact CG-CG 4.23Å; P52-K90 WeakPolarHBondContact CG-O 3.31Å; P52-R93 HydrophobicContact CG-CB 4.25Å
53	S	60.5	Low	80	Confident	133 Å²	133	65.2 Å²	65.2	93%	0.93	36%	0.362	S	S	*	.	S	Bend	trans	-72.4	34.8	177.7	64.2	0	0	0	0	114.2
54	M	64.9	Low	80.2	Confident	60 Å²	60	62.9 Å²	62.9	30%	0.296	35%	0.351	S	S	.	.			trans	-119.7	113.7	-179.2	-58.6	-168.9	-52.7	0	0	109.4	P52 I56 K90 T91 A94	P52-M54 PolarHBondContact O-N 3.33Å; M54-I56 HydrophobicContact CB-CD1 4.24Å; M54-I56 HydrophobicContact CB-CG1 4.27Å; M54-I56 HydrophobicContact CE-CD1 4.18Å; M54-I56 PolarHBondContact O-N 3.25Å; M54-I56 VanDerWaalsContact O-N 3.13Å; M54-K90 HydrophobicContact CE-CB 3.63Å; M54-T91 WeakPolarHBondContact CE-OG1 3.3Å; M54-A94 HydrophobicContact CB-CB 4.44Å; M54-A94 WeakPolarHBondContact O-CB 3.47Å
55	S	61.1	Low	80.5	Confident	98 Å²	98	60 Å²	60	69%	0.685	34%	0.337	S	S	*	.			trans	-81.4	85.3	173.3	54.7	0	0	0	0	110.1
56	I	73.9	Confident	80.7	Confident	48 Å²	48	63.2 Å²	63.2	25%	0.246	35%	0.349	C	S	.	.			trans	-113	111.7	175.4	-58.4	174.7	0	0	0	108.2	M54 T91 A94 I95 N98	M54-I56 HydrophobicContact CB-CD1 4.24Å; M54-I56 HydrophobicContact CB-CG1 4.27Å; M54-I56 HydrophobicContact CE-CD1 4.18Å; M54-I56 PolarHBondContact O-N 3.25Å; M54-I56 VanDerWaalsContact O-N 3.13Å; I56-T91 HydrophobicContact CD1-CG2 3.65Å; I56-T91 HydrophobicContact CG2-CG2 4.48Å; I56-A94 HydrophobicContact CB-CB 4.32Å; I56-I95 HydrophobicContact CB-CG1 4.29Å; I56-I95 HydrophobicContact CG2-CD1 4.22Å; I56-I95 HydrophobicContact CG2-CG1 3.72Å; I56-N98 WeakPolarHBondContact O-CB 3.47Å; I56-N98 PolarHBondContact O-ND2 3.09Å
57	T	77.1	Confident	80.7	Confident	48 Å²	48	63.9 Å²	63.9	29%	0.294	35%	0.352	S	S	.	.			trans	-108.5	158.4	177.8	48.6	0	0	0	0	110.4	N98 N722	T57-N98 HydrophobicContact CG2-CB 3.82Å; T57-N722 VanDerWaalsContact CG2-ND2 3.3Å; T57-N722 WeakPolarHBondContact CG2-ND2 3.24Å
58	A	78.5	Confident	80.9	Confident	16 Å²	16	58.8 Å²	58.8	13%	0.132	33%	0.333	C	S	.	.			trans	-109.8	127.1	162	0	0	0	0	0	109.4	L64 I67 Y103	A58-L64 HydrophobicContact CB-CB 3.72Å; A58-L64 HydrophobicContact CB-CD1 4.13Å; A58-L64 HydrophobicContact CB-CG 4.49Å; A58-I67 HydrophobicContact CB-CD1 4.19Å; A58-Y103 HydrophobicContact CB-CE2 4.23Å; A58-Y103 PolarHBondContact O-OH 3.39Å
59	S	78.6	Confident	81.2	Confident	94 Å²	94	54.5 Å²	54.5	66%	0.657	32%	0.315	S	S	*	.	S	Bend	trans	-87.8	-12	-179.9	-31.5	0	0	0	0	112.5	E63 Y103	S59-E63 WeakPolarHBondContact CA-OE2 3.45Å; S59-E63 WeakPolarHBondContact CB-OE2 3.22Å; S59-E63 PolarHBondContact N-OE2 3.46Å; S59-E63 PolarHBondContact OG-OE2 3.21Å; S59-Y103 VanDerWaalsContact C-OH 3.27Å
60	S	85.5	Confident	81.5	Confident	50 Å²	50	60.4 Å²	60.4	35%	0.35	33%	0.334	S	S	.	.	S	Bend	trans	-157.2	161.6	175.3	66.8	0	0	0	0	111.3	K62 E63 L64 Y103	S60-K62 PolarHBondContact O-N 3.08Å; S60-E63 PolarHBondContact O-N 2.75Å; S60-E63 VanDerWaalsContact O-N 3.17Å; S60-E63 PolarHBondContact OG-N 2.7Å; S60-L64 PolarHBondContact O-N 2.82Å; S60-Y103 PolarHBondContact N-OH 2.8Å
61	G	84.9	Confident	81.8	Confident	9 Å²	9	60.1 Å²	60.1	9%	0.093	33%	0.333	C	S	.	.	H	α-helix	trans	-61.6	-28.7	174.4	0	0	0	0	0	114.3	T65 E105	G61-T65 WeakPolarHBondContact O-CB 3.5Å; G61-T65 PolarHBondContact O-N 3.35Å; G61-T65 PolarHBondContact O-OG1 3.12Å; G61-E105 WeakPolarHBondContact CA-OE1 3.25Å; G61-E105 VanDerWaalsContact CA-OE2 3.24Å; G61-E105 WeakPolarHBondContact CA-OE2 3.39Å
62	K	87.3	Confident	82.6	Confident	164 Å²	164	59.8 Å²	59.8	71%	0.713	33%	0.328	S	S	*	.	H	α-helix	trans	-66.8	-48.9	171	-67.7	-173.6	178.1	-176.7	0	111.7	S60 L64 T65 E66	S60-K62 PolarHBondContact O-N 3.08Å; K62-L64 VanDerWaalsContact C-N 3.31Å; K62-L64 PolarHBondContact O-N 2.7Å; K62-T65 WeakPolarHBondContact O-CB 3.29Å; K62-T65 PolarHBondContact O-N 3.16Å; K62-T65 VanDerWaalsContact O-N 3.15Å; K62-E66 WeakPolarHBondContact O-CG 3.18Å; K62-E66 PolarHBondContact O-N 3.3Å
63	E	88.6	Confident	83.8	Confident	62 Å²	62	63.7 Å²	63.7	29%	0.29	35%	0.348	S	S	.	.	H	α-helix	trans	-62	-41.1	175.7	-176	175.7	-155.8	0	0	111	S59 S60 T65 E66 I67	S59-E63 WeakPolarHBondContact CA-OE2 3.45Å; S59-E63 WeakPolarHBondContact CB-OE2 3.22Å; S59-E63 PolarHBondContact N-OE2 3.46Å; S59-E63 PolarHBondContact OG-OE2 3.21Å; S60-E63 PolarHBondContact O-N 2.75Å; S60-E63 VanDerWaalsContact O-N 3.17Å; S60-E63 PolarHBondContact OG-N 2.7Å; E63-T65 VanDerWaalsContact C-N 3.33Å; E63-T65 PolarHBondContact O-N 3.4Å; E63-E66 PolarHBondContact O-N 3.14Å; E63-I67 HydrophobicContact CG-CD1 3.91Å; E63-I67 HydrophobicContact CG-CG1 4.34Å; E63-I67 VanDerWaalsContact O-CG1 3.23Å; E63-I67 WeakPolarHBondContact O-CG1 3.41Å; E63-I67 PolarHBondContact O-N 3.21Å
64	L	90.1	Very high	85.3	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-57.2	-46.3	172.8	-179.8	62	0	0	0	111.6	A58 S60 K62 E66 I67 I68 I95 A100 Y103 F106 L109	A58-L64 HydrophobicContact CB-CB 3.72Å; A58-L64 HydrophobicContact CB-CD1 4.13Å; A58-L64 HydrophobicContact CB-CG 4.49Å; S60-L64 PolarHBondContact O-N 2.82Å; K62-L64 VanDerWaalsContact C-N 3.31Å; K62-L64 PolarHBondContact O-N 2.7Å; L64-E66 VanDerWaalsContact C-N 3.35Å; L64-E66 PolarHBondContact O-N 2.85Å; L64-I67 PolarHBondContact O-N 2.74Å; L64-I68 HydrophobicContact CD1-CG1 4.09Å; L64-I68 HydrophobicContact CG-CG1 4.41Å; L64-I68 VanDerWaalsContact O-CG1 3.31Å; L64-I68 WeakPolarHBondContact O-CG1 3.41Å; L64-I68 PolarHBondContact O-N 2.93Å; L64-I95 HydrophobicContact CD1-CG2 3.59Å; L64-A100 HydrophobicContact CD1-CB 3.85Å; L64-A100 HydrophobicContact CD2-CB 4.38Å; L64-Y103 HydrophobicContact CD2-CD2 3.8Å; L64-Y103 HydrophobicContact CD2-CG 3.81Å; L64-F106 HydrophobicContact CD1-CD2 4.37Å; L64-F106 HydrophobicContact CD2-CB 4.08Å; L64-F106 HydrophobicContact CD2-CD2 4.28Å; L64-L109 HydrophobicContact CD2-CD1 4.41Å; L64-L109 HydrophobicContact CG-CD1 4.17Å
65	T	91.1	Very high	86.6	Confident	43 Å²	43	56.3 Å²	56.3	26%	0.264	30%	0.304	S	S	.	.	H	α-helix	trans	-58.7	-44.6	175.7	-61.3	0	0	0	0	111.5	G61 K62 E63 I68 N69 L109	G61-T65 WeakPolarHBondContact O-CB 3.5Å; G61-T65 PolarHBondContact O-N 3.35Å; G61-T65 PolarHBondContact O-OG1 3.12Å; K62-T65 WeakPolarHBondContact O-CB 3.29Å; K62-T65 PolarHBondContact O-N 3.16Å; K62-T65 VanDerWaalsContact O-N 3.15Å; E63-T65 VanDerWaalsContact C-N 3.33Å; E63-T65 PolarHBondContact O-N 3.4Å; T65-I68 PolarHBondContact O-N 3.41Å; T65-N69 WeakPolarHBondContact O-CB 3.4Å; T65-N69 PolarHBondContact O-N 3.18Å; T65-N69 PolarHBondContact O-ND2 3.41Å; T65-N69 VanDerWaalsContact O-ND2 3.13Å; T65-L109 HydrophobicContact CG2-CD2 4.08Å
66	E	91.1	Very high	87.9	Confident	115 Å²	115	54.9 Å²	54.9	54%	0.537	29%	0.294	S	S	.	.	H	α-helix	trans	-66.9	-34.5	177.1	-71.8	173.4	-154.9	0	0	113.5	K62 E63 L64 R70	K62-E66 WeakPolarHBondContact O-CG 3.18Å; K62-E66 PolarHBondContact O-N 3.3Å; E63-E66 PolarHBondContact O-N 3.14Å; L64-E66 VanDerWaalsContact C-N 3.35Å; L64-E66 PolarHBondContact O-N 2.85Å; E66-R70 WeakPolarHBondContact O-CG 3.43Å; E66-R70 PolarHBondContact O-N 2.8Å; E66-R70 PolarHBondContact O-NE 2.94Å
67	I	91	Very high	88.3	Confident	13 Å²	13	54.1 Å²	54.1	7%	0.067	30%	0.298	C	S	.	.	H	α-helix	trans	-74.8	-41.4	175.4	-53.1	155.7	0	0	0	110.6	A58 E63 L64 N69 R70 I71 T91 I95	A58-I67 HydrophobicContact CB-CD1 4.19Å; E63-I67 HydrophobicContact CG-CD1 3.91Å; E63-I67 HydrophobicContact CG-CG1 4.34Å; E63-I67 VanDerWaalsContact O-CG1 3.23Å; E63-I67 WeakPolarHBondContact O-CG1 3.41Å; E63-I67 PolarHBondContact O-N 3.21Å; L64-I67 PolarHBondContact O-N 2.74Å; I67-N69 PolarHBondContact O-N 3.28Å; I67-R70 VanDerWaalsContact CG1-NH2 3.27Å; I67-R70 PolarHBondContact O-N 3.04Å; I67-I71 HydrophobicContact CG2-CD1 4.19Å; I67-I71 WeakPolarHBondContact O-CG1 3.44Å; I67-I71 PolarHBondContact O-N 3.2Å; I67-T91 HydrophobicContact CG2-CG2 4.29Å; I67-I95 HydrophobicContact CB-CD1 4.14Å; I67-I95 HydrophobicContact CG2-CD1 3.27Å; I67-I95 HydrophobicContact CG2-CG1 4.37Å
68	I	92.7	Very high	88.5	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.2	-39.8	176.6	-65.3	-69.4	0	0	0	111.3	L64 T65 I71 K72 L92 F106 L109 L113	L64-I68 HydrophobicContact CD1-CG1 4.09Å; L64-I68 HydrophobicContact CG-CG1 4.41Å; L64-I68 VanDerWaalsContact O-CG1 3.31Å; L64-I68 WeakPolarHBondContact O-CG1 3.41Å; L64-I68 PolarHBondContact O-N 2.93Å; T65-I68 PolarHBondContact O-N 3.41Å; I68-I71 HydrophobicContact CD1-CD1 4.17Å; I68-I71 WeakPolarHBondContact O-CB 3.49Å; I68-I71 PolarHBondContact O-N 3.23Å; I68-K72 WeakPolarHBondContact O-CB 3.33Å; I68-K72 PolarHBondContact O-N 2.83Å; I68-L92 HydrophobicContact CD1-CD1 3.67Å; I68-F106 HydrophobicContact CD1-CE2 4.18Å; I68-L109 HydrophobicContact CB-CB 4.49Å; I68-L109 HydrophobicContact CG1-CB 4.43Å; I68-L109 HydrophobicContact CG1-CD1 4.37Å; I68-L109 HydrophobicContact CG2-CB 4.05Å; I68-L109 HydrophobicContact CG2-CD2 4.43Å; I68-L113 HydrophobicContact CD1-CD1 4.23Å; I68-L113 HydrophobicContact CG2-CD1 4.03Å; I68-L113 HydrophobicContact CG2-CD2 4.14Å; I68-L113 HydrophobicContact CG2-CG 4.04Å
69	N	92.5	Very high	88.7	Confident	62 Å²	62	59 Å²	59	33%	0.332	32%	0.324	S	S	.	.	H	α-helix	trans	-63	-42.8	173.2	-74.9	-37.1	0	0	0	111.7	T65 I67 I71 K72 D73	T65-N69 WeakPolarHBondContact O-CB 3.4Å; T65-N69 PolarHBondContact O-N 3.18Å; T65-N69 PolarHBondContact O-ND2 3.41Å; T65-N69 VanDerWaalsContact O-ND2 3.13Å; I67-N69 PolarHBondContact O-N 3.28Å; N69-I71 VanDerWaalsContact C-N 3.33Å; N69-I71 PolarHBondContact O-N 3.17Å; N69-K72 WeakPolarHBondContact O-CB 3.49Å; N69-K72 PolarHBondContact O-N 3.16Å; N69-K72 VanDerWaalsContact O-N 3.12Å; N69-D73 VanDerWaalsContact O-CG 3.24Å; N69-D73 PolarHBondContact O-N 3.13Å
70	R	92	Very high	88.9	Confident	148 Å²	148	60.3 Å²	60.3	56%	0.558	32%	0.32	S	S	*	.	H	α-helix	trans	-61.3	-37.5	173.4	-77	178.3	-74.6	169.2	-9.4	113.4	E66 I67 A74	E66-R70 WeakPolarHBondContact O-CG 3.43Å; E66-R70 PolarHBondContact O-N 2.8Å; E66-R70 PolarHBondContact O-NE 2.94Å; I67-R70 VanDerWaalsContact CG1-NH2 3.27Å; I67-R70 PolarHBondContact O-N 3.04Å; R70-A74 WeakPolarHBondContact O-CB 3.37Å; R70-A74 PolarHBondContact O-N 3.45Å; R70-A74 VanDerWaalsContact O-N 3.1Å
71	I	93.1	Very high	89.1	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-63.3	-47.7	171.7	-71.6	159.9	0	0	0	110.1	I67 I68 N69 D73 A74 L75 A88 T91 L92 I95 L113	I67-I71 HydrophobicContact CG2-CD1 4.19Å; I67-I71 WeakPolarHBondContact O-CG1 3.44Å; I67-I71 PolarHBondContact O-N 3.2Å; I68-I71 HydrophobicContact CD1-CD1 4.17Å; I68-I71 WeakPolarHBondContact O-CB 3.49Å; I68-I71 PolarHBondContact O-N 3.23Å; N69-I71 VanDerWaalsContact C-N 3.33Å; N69-I71 PolarHBondContact O-N 3.17Å; I71-D73 PolarHBondContact O-N 2.88Å; I71-A74 PolarHBondContact O-N 3.02Å; I71-L75 HydrophobicContact CG2-CD1 3.7Å; I71-L75 HydrophobicContact CG2-CG 4.23Å; I71-L75 WeakPolarHBondContact O-CB 3.4Å; I71-L75 VanDerWaalsContact O-CG 3.26Å; I71-L75 WeakPolarHBondContact O-CG 3.41Å; I71-L75 PolarHBondContact O-N 3.02Å; I71-A88 HydrophobicContact CG2-CB 4.38Å; I71-T91 HydrophobicContact CD1-CG2 4.12Å; I71-T91 HydrophobicContact CG1-CG2 4.18Å; I71-L92 HydrophobicContact CD1-CB 4.06Å; I71-L92 HydrophobicContact CD1-CD1 4.25Å; I71-L92 HydrophobicContact CG2-CB 4.44Å; I71-I95 HydrophobicContact CD1-CD1 3.6Å; I71-L113 HydrophobicContact CG2-CD1 4.21Å; I71-L113 HydrophobicContact CG2-CD2 4.07Å
72	K	93.7	Very high	89.4	Confident	69 Å²	69	65 Å²	65	30%	0.3	33%	0.331	S	S	.	.	H	α-helix	trans	-56.1	-52.9	179.8	-170.8	-176.8	176.4	-171.2	0	111.1	I68 N69 A74 L75 S76 T112 L113	I68-K72 WeakPolarHBondContact O-CB 3.33Å; I68-K72 PolarHBondContact O-N 2.83Å; N69-K72 WeakPolarHBondContact O-CB 3.49Å; N69-K72 PolarHBondContact O-N 3.16Å; N69-K72 VanDerWaalsContact O-N 3.12Å; K72-A74 VanDerWaalsContact C-N 3.33Å; K72-A74 PolarHBondContact O-N 2.81Å; K72-L75 PolarHBondContact O-N 2.78Å; K72-L75 VanDerWaalsContact O-N 3.16Å; K72-S76 PolarHBondContact O-N 3.07Å; K72-S76 PolarHBondContact O-OG 3.39Å; K72-T112 WeakPolarHBondContact CE-O 3.37Å; K72-L113 HydrophobicContact CB-CD2 3.54Å; K72-L113 HydrophobicContact CG-CD2 4.01Å
73	D	92	Very high	89.6	Confident	102 Å²	102	63 Å²	63	55%	0.545	32%	0.323	S	S	.	.	H	α-helix	trans	-62.3	-38.7	-178.9	-64.8	-21.8	0	0	0	111.9	N69 I71 G77	N69-D73 VanDerWaalsContact O-CG 3.24Å; N69-D73 PolarHBondContact O-N 3.13Å; I71-D73 PolarHBondContact O-N 2.88Å; D73-G77 WeakPolarHBondContact O-CA 3.41Å; D73-G77 PolarHBondContact O-N 3.1Å
74	A	91.7	Very high	89.8	Confident	32 Å²	32	65.3 Å²	65.3	26%	0.264	33%	0.333	S	S	.	.	H	α-helix	trans	-64.8	-44.9	173.7	0	0	0	0	0	111.9	R70 I71 K72 G77 R85 A88	R70-A74 WeakPolarHBondContact O-CB 3.37Å; R70-A74 PolarHBondContact O-N 3.45Å; R70-A74 VanDerWaalsContact O-N 3.1Å; I71-A74 PolarHBondContact O-N 3.02Å; K72-A74 VanDerWaalsContact C-N 3.33Å; K72-A74 PolarHBondContact O-N 2.81Å; A74-G77 PolarHBondContact O-N 2.82Å; A74-R85 VanDerWaalsContact O-CG 3.24Å; A74-R85 WeakPolarHBondContact O-CG 3.35Å; A74-A88 HydrophobicContact CB-CB 3.8Å
75	L	92.3	Very high	89.9	Confident	6 Å²	6	65.8 Å²	65.8	3%	0.031	34%	0.335	C	S	.	.	H	α-helix	trans	-70.4	-35.2	-179.7	-65.5	176.9	0	0	0	113.4	I71 K72 G77 R85 A88 L89 I117	I71-L75 HydrophobicContact CG2-CD1 3.7Å; I71-L75 HydrophobicContact CG2-CG 4.23Å; I71-L75 WeakPolarHBondContact O-CB 3.4Å; I71-L75 VanDerWaalsContact O-CG 3.26Å; I71-L75 WeakPolarHBondContact O-CG 3.41Å; I71-L75 PolarHBondContact O-N 3.02Å; K72-L75 PolarHBondContact O-N 2.78Å; K72-L75 VanDerWaalsContact O-N 3.16Å; L75-G77 VanDerWaalsContact C-N 3.29Å; L75-R85 HydrophobicContact CD2-CB 4.1Å; L75-R85 HydrophobicContact CD2-CG 4.47Å; L75-R85 WeakPolarHBondContact CD2-O 3.38Å; L75-R85 WeakPolarHBondContact O-CD 3.35Å; L75-A88 HydrophobicContact CD2-CB 3.92Å; L75-A88 HydrophobicContact CG-CB 4.07Å; L75-L89 HydrophobicContact CD1-CD2 4.29Å; L75-L89 HydrophobicContact CD2-CD2 4.08Å; L75-L89 HydrophobicContact CD2-CG 3.84Å; L75-I117 HydrophobicContact CD1-CG1 4.18Å
76	S	89	Confident	90	Very high	68 Å²	68	64.5 Å²	64.5	48%	0.476	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	7	172.1	61.8	0	0	0	0	113.8	K72	K72-S76 PolarHBondContact O-N 3.07Å; K72-S76 PolarHBondContact O-OG 3.39Å
77	G	81.1	Confident	90	Very high	32 Å²	32	62.4 Å²	62.4	33%	0.33	32%	0.319	S	S	.	.	S	Bend	trans	-73.3	-167.7	179.6	0	0	0	0	0	113.4	D73 A74 L75	D73-G77 WeakPolarHBondContact O-CA 3.41Å; D73-G77 PolarHBondContact O-N 3.1Å; A74-G77 PolarHBondContact O-N 2.82Å; L75-G77 VanDerWaalsContact C-N 3.29Å
78	N	81.5	Confident	90.1	Very high	91 Å²	91	62.1 Å²	62.1	49%	0.487	32%	0.318	S	S	.	.			trans	-59.3	124.5	178.8	178.7	-9.8	0	0	0	110.5	E80 E81	N78-E80 PolarHBondContact O-N 3.04Å; N78-E80 VanDerWaalsContact O-N 3.07Å; N78-E80 PolarHBondContact OD1-N 3.15Å; N78-E81 HydrophobicContact CB-CG 4.2Å; N78-E81 PolarHBondContact O-N 3.18Å
79	P	82.1	Confident	90.2	Very high	76 Å²	76	62.1 Å²	62.1	49%	0.494	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.5	-178	24.3	-35	0	0	0	113.9	E81 R85 R125	P79-E81 VanDerWaalsContact C-N 3.3Å; P79-R85 PolarHBondContact O-NH2 2.72Å; P79-R125 PolarHBondContact O-NH1 3.28Å
80	E	83	Confident	90.2	Very high	120 Å²	120	62 Å²	62	56%	0.561	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-21.9	173	-61	-50.7	141.1	0	0	113.5	N78 W82 R125	N78-E80 PolarHBondContact O-N 3.04Å; N78-E80 VanDerWaalsContact O-N 3.07Å; N78-E80 PolarHBondContact OD1-N 3.15Å; E80-W82 PolarHBondContact O-N 2.98Å; E80-R125 IonicContact OE2-CZ 3.82Å; E80-R125 IonicContact OE2-NH1 2.73Å; E80-R125 IonicContact OE2-NH2 3.57Å; E80-R125 PolarHBondContact OE2-NH2 3.31Å
81	E	89.5	Confident	90.2	Very high	82 Å²	82	56.2 Å²	56.2	38%	0.383	30%	0.296	S	S	.	.			trans	-82	44.4	176.2	-57.1	-163.5	136.4	0	0	112	N78 P79 E83 K84 R85	N78-E81 HydrophobicContact CB-CG 4.2Å; N78-E81 PolarHBondContact O-N 3.18Å; P79-E81 VanDerWaalsContact C-N 3.3Å; E81-E83 PolarHBondContact O-N 3.29Å; E81-E83 VanDerWaalsContact O-N 3.16Å; E81-K84 HydrophobicContact CB-CB 4.41Å; E81-K84 HydrophobicContact CB-CD 4.15Å; E81-K84 HydrophobicContact CB-CG 4.28Å; E81-K84 VanDerWaalsContact CD-CE 3.48Å; E81-K84 WeakPolarHBondContact O-CB 3.26Å; E81-K84 PolarHBondContact O-N 3Å; E81-K84 WeakPolarHBondContact OE1-CE 3.42Å; E81-K84 IonicContact OE1-NZ 2.74Å; E81-K84 PolarHBondContact OE1-NZ 2.73Å; E81-K84 WeakPolarHBondContact OE2-CD 3.24Å; E81-K84 WeakPolarHBondContact OE2-CE 3.4Å; E81-K84 IonicContact OE2-NZ 2.79Å; E81-K84 PolarHBondContact OE2-NZ 3.21Å; E81-R85 PolarHBondContact O-N 3.16Å
82	W	91.2	Very high	90.2	Very high	77 Å²	77	56 Å²	56	29%	0.292	30%	0.295	S	S	.	.	H	α-helix	trans	-58.9	-28.8	-173.5	73.8	-86.2	0	0	0	113.7	E80 R85 V86 R125 S127 V128	E80-W82 PolarHBondContact O-N 2.98Å; W82-R85 PolarHBondContact O-N 3.06Å; W82-V86 HydrophobicContact CE3-CG2 4.12Å; W82-V86 HydrophobicContact CZ3-CG2 4.31Å; W82-V86 WeakPolarHBondContact O-CG2 3.47Å; W82-V86 PolarHBondContact O-N 3.26Å; W82-R125 VanDerWaalsContact CG-CD 3.47Å; W82-S127 VanDerWaalsContact CZ3-OG 3.23Å; W82-S127 WeakPolarHBondContact CZ3-OG 3.42Å; W82-V128 HydrophobicContact CB-CG2 3.89Å; W82-V128 HydrophobicContact CE3-CG2 4.15Å
83	E	93.2	Very high	90.1	Very high	120 Å²	120	53 Å²	53	56%	0.561	28%	0.282	S	S	*	.	H	α-helix	trans	-67.5	-45.1	175.3	-62.3	-176.6	147.4	0	0	111.3	E81 R85 V86 D87	E81-E83 PolarHBondContact O-N 3.29Å; E81-E83 VanDerWaalsContact O-N 3.16Å; E83-R85 PolarHBondContact O-N 3.05Å; E83-V86 WeakPolarHBondContact O-CB 3.48Å; E83-V86 PolarHBondContact O-N 3.38Å; E83-D87 PolarHBondContact O-N 3.42Å
84	K	91.4	Very high	90.1	Very high	112 Å²	112	48.1 Å²	48.1	49%	0.487	26%	0.256	S	S	.	.	H	α-helix	trans	-61.1	-35.6	174.1	-59	-171.6	-165.1	167.7	0	111.7	E81 D87 A88	E81-K84 HydrophobicContact CB-CB 4.41Å; E81-K84 HydrophobicContact CB-CD 4.15Å; E81-K84 HydrophobicContact CB-CG 4.28Å; E81-K84 VanDerWaalsContact CD-CE 3.48Å; E81-K84 WeakPolarHBondContact O-CB 3.26Å; E81-K84 PolarHBondContact O-N 3Å; E81-K84 WeakPolarHBondContact OE1-CE 3.42Å; E81-K84 IonicContact OE1-NZ 2.74Å; E81-K84 PolarHBondContact OE1-NZ 2.73Å; E81-K84 WeakPolarHBondContact OE2-CD 3.24Å; E81-K84 WeakPolarHBondContact OE2-CE 3.4Å; E81-K84 IonicContact OE2-NZ 2.79Å; E81-K84 PolarHBondContact OE2-NZ 3.21Å; K84-D87 PolarHBondContact O-N 3.19Å; K84-A88 WeakPolarHBondContact O-CB 3.49Å; K84-A88 PolarHBondContact O-N 3.37Å
85	R	93.1	Very high	90	Very high	10 Å²	10	46.7 Å²	46.7	4%	0.038	24%	0.244	C	C	.	.	H	α-helix	trans	-68.2	-42	175.8	-65.9	-168.7	-69.6	120	1.4	112	A74 L75 P79 E81 W82 E83 D87 A88 L89 D123	A74-R85 VanDerWaalsContact O-CG 3.24Å; A74-R85 WeakPolarHBondContact O-CG 3.35Å; L75-R85 HydrophobicContact CD2-CB 4.1Å; L75-R85 HydrophobicContact CD2-CG 4.47Å; L75-R85 WeakPolarHBondContact CD2-O 3.38Å; L75-R85 WeakPolarHBondContact O-CD 3.35Å; P79-R85 PolarHBondContact O-NH2 2.72Å; E81-R85 PolarHBondContact O-N 3.16Å; W82-R85 PolarHBondContact O-N 3.06Å; E83-R85 PolarHBondContact O-N 3.05Å; R85-D87 VanDerWaalsContact C-N 3.33Å; R85-D87 PolarHBondContact O-N 2.87Å; R85-A88 PolarHBondContact O-N 2.97Å; R85-L89 WeakPolarHBondContact O-CG 3.25Å; R85-L89 PolarHBondContact O-N 3.25Å; R85-D123 IonicContact CZ-OD2 3.61Å; R85-D123 IonicContact NH1-OD2 3.86Å; R85-D123 PolarHBondContact NH1-OD2 3.2Å; R85-D123 IonicContact NH2-OD2 2.68Å; R85-D123 PolarHBondContact NH2-OD2 2.82Å
86	V	92.9	Very high	89.9	Confident	15 Å²	15	46.7 Å²	46.7	9%	0.091	24%	0.244	C	C	.	.	H	α-helix	trans	-59.6	-42.3	171	159.6	0	0	0	0	111.4	W82 E83 L89 K90 V128 E131	W82-V86 HydrophobicContact CE3-CG2 4.12Å; W82-V86 HydrophobicContact CZ3-CG2 4.31Å; W82-V86 WeakPolarHBondContact O-CG2 3.47Å; W82-V86 PolarHBondContact O-N 3.26Å; E83-V86 WeakPolarHBondContact O-CB 3.48Å; E83-V86 PolarHBondContact O-N 3.38Å; V86-L89 PolarHBondContact O-N 2.89Å; V86-K90 WeakPolarHBondContact O-CG 3.35Å; V86-K90 PolarHBondContact O-N 3.4Å; V86-K90 VanDerWaalsContact O-N 3.11Å; V86-V128 HydrophobicContact CG2-CG2 4.12Å; V86-E131 HydrophobicContact CG1-CG 4.19Å; V86-E131 HydrophobicContact CG2-CB 4.3Å
87	D	91.6	Very high	89.9	Confident	72 Å²	72	45.4 Å²	45.4	39%	0.385	24%	0.237	S	C	.	.	H	α-helix	trans	-74.8	-30.2	178.9	-69.6	-23.2	0	0	0	113.3	E83 K84 R85 K90 T91	E83-D87 PolarHBondContact O-N 3.42Å; K84-D87 PolarHBondContact O-N 3.19Å; R85-D87 VanDerWaalsContact C-N 3.33Å; R85-D87 PolarHBondContact O-N 2.87Å; D87-K90 PolarHBondContact O-N 2.96Å; D87-K90 WeakPolarHBondContact OD1-CD 3.34Å; D87-K90 WeakPolarHBondContact OD1-CE 3.4Å; D87-K90 IonicContact OD1-NZ 2.75Å; D87-K90 PolarHBondContact OD1-NZ 2.71Å; D87-T91 VanDerWaalsContact O-CB 3.3Å; D87-T91 WeakPolarHBondContact O-CB 3.33Å; D87-T91 PolarHBondContact O-N 3.23Å; D87-T91 PolarHBondContact O-OG1 3.25Å
88	A	93	Very high	90.1	Very high	6 Å²	6	46.1 Å²	46.1	5%	0.05	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-39.8	169.9	0	0	0	0	0	112.1	I71 A74 L75 K84 R85 T91 L92	I71-A88 HydrophobicContact CG2-CB 4.38Å; A74-A88 HydrophobicContact CB-CB 3.8Å; L75-A88 HydrophobicContact CD2-CB 3.92Å; L75-A88 HydrophobicContact CG-CB 4.07Å; K84-A88 WeakPolarHBondContact O-CB 3.49Å; K84-A88 PolarHBondContact O-N 3.37Å; R85-A88 PolarHBondContact O-N 2.97Å; A88-T91 PolarHBondContact O-N 2.93Å; A88-L92 PolarHBondContact O-N 3.07Å
89	L	93.9	Very high	90.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.5	-42.9	173.2	-70.9	167.6	0	0	0	112.1	L75 R85 V86 T91 L92 R93 I117 E131 A132 T135	L75-L89 HydrophobicContact CD1-CD2 4.29Å; L75-L89 HydrophobicContact CD2-CD2 4.08Å; L75-L89 HydrophobicContact CD2-CG 3.84Å; R85-L89 WeakPolarHBondContact O-CG 3.25Å; R85-L89 PolarHBondContact O-N 3.25Å; V86-L89 PolarHBondContact O-N 2.89Å; L89-T91 VanDerWaalsContact C-N 3.34Å; L89-L92 PolarHBondContact O-N 3.32Å; L89-R93 PolarHBondContact O-N 3.37Å; L89-I117 HydrophobicContact CD2-CG1 4.48Å; L89-E131 HydrophobicContact CB-CG 3.93Å; L89-E131 HydrophobicContact CD1-CB 3.98Å; L89-E131 HydrophobicContact CD1-CG 4.16Å; L89-A132 HydrophobicContact CD1-CB 4.03Å; L89-T135 HydrophobicContact CD2-CG2 4.17Å
90	K	93	Very high	90.3	Very high	59 Å²	59	39 Å²	39	26%	0.257	20%	0.195	S	C	.	.	H	α-helix	trans	-61	-43.9	171.2	-65.8	169.9	-161.8	161.6	0	111.4	P52 M54 V86 D87 L92 R93 A94 E131	P52-K90 HydrophobicContact CB-CB 4.11Å; P52-K90 HydrophobicContact CB-CG 4.47Å; P52-K90 HydrophobicContact CG-CB 3.79Å; P52-K90 HydrophobicContact CG-CG 4.23Å; P52-K90 WeakPolarHBondContact CG-O 3.31Å; M54-K90 HydrophobicContact CE-CB 3.63Å; V86-K90 WeakPolarHBondContact O-CG 3.35Å; V86-K90 PolarHBondContact O-N 3.4Å; V86-K90 VanDerWaalsContact O-N 3.11Å; D87-K90 PolarHBondContact O-N 2.96Å; D87-K90 WeakPolarHBondContact OD1-CD 3.34Å; D87-K90 WeakPolarHBondContact OD1-CE 3.4Å; D87-K90 IonicContact OD1-NZ 2.75Å; D87-K90 PolarHBondContact OD1-NZ 2.71Å; K90-L92 VanDerWaalsContact C-N 3.32Å; K90-L92 PolarHBondContact O-N 2.94Å; K90-R93 PolarHBondContact O-N 3.48Å; K90-R93 VanDerWaalsContact O-N 3.13Å; K90-A94 PolarHBondContact O-N 2.8Å; K90-E131 VanDerWaalsContact CG-OE1 3.24Å; K90-E131 WeakPolarHBondContact CG-OE1 3.22Å
91	T	91.3	Very high	90.4	Very high	27 Å²	27	34.9 Å²	34.9	17%	0.166	18%	0.177	C	C	.	.	H	α-helix	trans	-61.1	-41.4	-179.3	-60.5	0	0	0	0	111.1	M54 I56 I67 I71 D87 A88 L89 R93 A94 I95	M54-T91 WeakPolarHBondContact CE-OG1 3.3Å; I56-T91 HydrophobicContact CD1-CG2 3.65Å; I56-T91 HydrophobicContact CG2-CG2 4.48Å; I67-T91 HydrophobicContact CG2-CG2 4.29Å; I71-T91 HydrophobicContact CD1-CG2 4.12Å; I71-T91 HydrophobicContact CG1-CG2 4.18Å; D87-T91 VanDerWaalsContact O-CB 3.3Å; D87-T91 WeakPolarHBondContact O-CB 3.33Å; D87-T91 PolarHBondContact O-N 3.23Å; D87-T91 PolarHBondContact O-OG1 3.25Å; A88-T91 PolarHBondContact O-N 2.93Å; L89-T91 VanDerWaalsContact C-N 3.34Å; T91-R93 PolarHBondContact O-N 2.9Å; T91-A94 PolarHBondContact O-N 3.26Å; T91-I95 HydrophobicContact CG2-CD1 3.8Å; T91-I95 WeakPolarHBondContact O-CD1 3.38Å; T91-I95 VanDerWaalsContact O-CG1 3.23Å; T91-I95 WeakPolarHBondContact O-CG1 3.37Å; T91-I95 PolarHBondContact O-N 3.45Å
92	L	92.9	Very high	90.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.3	-44.7	172.5	-176.7	60.1	0	0	0	112.6	I68 I71 A88 L89 K90 I95 V96 L113 I117 T135 L139	I68-L92 HydrophobicContact CD1-CD1 3.67Å; I71-L92 HydrophobicContact CD1-CB 4.06Å; I71-L92 HydrophobicContact CD1-CD1 4.25Å; I71-L92 HydrophobicContact CG2-CB 4.44Å; A88-L92 PolarHBondContact O-N 3.07Å; L89-L92 PolarHBondContact O-N 3.32Å; K90-L92 VanDerWaalsContact C-N 3.32Å; K90-L92 PolarHBondContact O-N 2.94Å; L92-I95 PolarHBondContact O-N 3.28Å; L92-V96 WeakPolarHBondContact O-CG2 3.01Å; L92-V96 PolarHBondContact O-N 3.27Å; L92-L113 HydrophobicContact CD1-CD1 3.8Å; L92-L113 HydrophobicContact CD2-CD1 3.83Å; L92-L113 HydrophobicContact CG-CD1 4.47Å; L92-I117 HydrophobicContact CD2-CD1 3.87Å; L92-T135 HydrophobicContact CD2-CG2 3.92Å; L92-T135 HydrophobicContact CG-CG2 4.43Å; L92-L139 HydrophobicContact CD2-CD1 4.29Å
93	R	93.1	Very high	90	Very high	6 Å²	6	38.1 Å²	38.1	2%	0.023	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-43.3	176	-62.6	-158.3	-57.6	-76.9	8.9	112.5	S49 F50 P52 L89 K90 T91 I95 V96 A97 E131 T135 F138	S49-R93 VanDerWaalsContact O-CZ 3.32Å; S49-R93 PolarHBondContact O-NE 2.82Å; S49-R93 VanDerWaalsContact O-NE 3.09Å; S49-R93 PolarHBondContact O-NH2 3.21Å; F50-R93 WeakPolarHBondContact O-CB 3.41Å; F50-R93 WeakPolarHBondContact O-CD 3.44Å; F50-R93 PolarHBondContact O-NE 3.04Å; F50-R93 VanDerWaalsContact O-NE 3.14Å; P52-R93 HydrophobicContact CG-CB 4.25Å; L89-R93 PolarHBondContact O-N 3.37Å; K90-R93 PolarHBondContact O-N 3.48Å; K90-R93 VanDerWaalsContact O-N 3.13Å; T91-R93 PolarHBondContact O-N 2.9Å; R93-I95 VanDerWaalsContact C-N 3.3Å; R93-I95 PolarHBondContact O-N 2.97Å; R93-V96 PolarHBondContact O-N 3.44Å; R93-A97 WeakPolarHBondContact O-CB 3.37Å; R93-A97 PolarHBondContact O-N 2.93Å; R93-E131 IonicContact CZ-OE1 2.84Å; R93-E131 IonicContact NH1-OE1 3.25Å; R93-E131 PolarHBondContact NH1-OE1 3.12Å; R93-E131 IonicContact NH2-OE1 3.1Å; R93-E131 PolarHBondContact NH2-OE1 2.83Å; R93-T135 HydrophobicContact CG-CG2 3.92Å; R93-T135 PolarHBondContact NH1-OG1 2.91Å; R93-F138 HydrophobicContact CB-CD1 3.78Å; R93-F138 HydrophobicContact CB-CE1 3.96Å; R93-F138 HydrophobicContact CG-CB 4.44Å; R93-F138 HydrophobicContact CG-CD1 3.7Å; R93-F138 HydrophobicContact CG-CE1 4.38Å; R93-F138 HydrophobicContact CG-CG 4.37Å; R93-F138 WeakPolarHBondContact O-CE1 3.22Å
94	A	90.6	Very high	89.6	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-57.3	-42.9	177.6	0	0	0	0	0	112.1	M54 I56 K90 T91 A97 N98	M54-A94 HydrophobicContact CB-CB 4.44Å; M54-A94 WeakPolarHBondContact O-CB 3.47Å; I56-A94 HydrophobicContact CB-CB 4.32Å; K90-A94 PolarHBondContact O-N 2.8Å; T91-A94 PolarHBondContact O-N 3.26Å; A94-A97 PolarHBondContact O-N 3Å; A94-N98 WeakPolarHBondContact O-CB 3.42Å; A94-N98 PolarHBondContact O-N 2.84Å; A94-N98 PolarHBondContact O-ND2 3.41Å
95	I	90	Very high	89.4	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-66.3	-42.7	179.2	-70	158.4	0	0	0	111.9	I56 L64 I67 I71 T91 L92 R93 N98 G99 A100	I56-I95 HydrophobicContact CB-CG1 4.29Å; I56-I95 HydrophobicContact CG2-CD1 4.22Å; I56-I95 HydrophobicContact CG2-CG1 3.72Å; L64-I95 HydrophobicContact CD1-CG2 3.59Å; I67-I95 HydrophobicContact CB-CD1 4.14Å; I67-I95 HydrophobicContact CG2-CD1 3.27Å; I67-I95 HydrophobicContact CG2-CG1 4.37Å; I71-I95 HydrophobicContact CD1-CD1 3.6Å; T91-I95 HydrophobicContact CG2-CD1 3.8Å; T91-I95 WeakPolarHBondContact O-CD1 3.38Å; T91-I95 VanDerWaalsContact O-CG1 3.23Å; T91-I95 WeakPolarHBondContact O-CG1 3.37Å; T91-I95 PolarHBondContact O-N 3.45Å; L92-I95 PolarHBondContact O-N 3.28Å; R93-I95 VanDerWaalsContact C-N 3.3Å; R93-I95 PolarHBondContact O-N 2.97Å; I95-N98 CarbonylContact O-C 3.4Å; I95-N98 PolarHBondContact O-N 3.37Å; I95-G99 PolarHBondContact O-N 3.08Å; I95-A100 HydrophobicContact CG2-CB 3.44Å; I95-A100 VanDerWaalsContact CG2-CB 3.44Å; I95-A100 VanDerWaalsContact O-CB 3.25Å; I95-A100 WeakPolarHBondContact O-CB 3.37Å; I95-A100 PolarHBondContact O-N 3.08Å; I95-A100 VanDerWaalsContact O-N 3.1Å
96	V	90.6	Very high	89.2	Confident	5 Å²	5	34.2 Å²	34.2	3%	0.03	18%	0.18	C	C	.	.	H	α-helix	trans	-65.7	-45.1	176.3	169.7	0	0	0	0	111.1	L92 R93 N98 G99 L101 F106 F138 L139 E142	L92-V96 WeakPolarHBondContact O-CG2 3.01Å; L92-V96 PolarHBondContact O-N 3.27Å; R93-V96 PolarHBondContact O-N 3.44Å; V96-N98 VanDerWaalsContact C-N 3.29Å; V96-N98 PolarHBondContact O-N 2.95Å; V96-G99 PolarHBondContact O-N 2.84Å; V96-L101 HydrophobicContact CG1-CD1 3.98Å; V96-L101 HydrophobicContact CG1-CG 4.26Å; V96-F106 HydrophobicContact CG2-CE1 4.18Å; V96-F106 HydrophobicContact CG2-CE2 3.78Å; V96-F106 HydrophobicContact CG2-CZ 3.36Å; V96-F138 HydrophobicContact CB-CE1 3.89Å; V96-F138 HydrophobicContact CG1-CD1 4.43Å; V96-F138 HydrophobicContact CG1-CE1 3.7Å; V96-F138 HydrophobicContact CG1-CZ 4.23Å; V96-L139 HydrophobicContact CG2-CD2 4.15Å; V96-E142 HydrophobicContact CG1-CB 4.12Å; V96-E142 HydrophobicContact CG1-CG 4.25Å
97	A	88.2	Confident	89	Confident	41 Å²	41	35 Å²	35	34%	0.339	18%	0.183	S	C	.	.	H	α-helix	trans	-60.8	-36.8	175.3	0	0	0	0	0	112.7	I51 R93 A94 G99 F138	I51-A97 HydrophobicContact CG1-CB 4.2Å; I51-A97 HydrophobicContact CG2-CB 4.43Å; R93-A97 WeakPolarHBondContact O-CB 3.37Å; R93-A97 PolarHBondContact O-N 2.93Å; A94-A97 PolarHBondContact O-N 3Å; A97-G99 PolarHBondContact O-N 3.01Å; A97-F138 HydrophobicContact CB-CE1 4.46Å; A97-F138 HydrophobicContact CB-CZ 3.97Å
98	N	85	Confident	89	Confident	47 Å²	47	35.2 Å²	35.2	25%	0.251	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	18	174.5	-75.1	-72.6	0	0	0	113.8	I56 T57 A94 I95 V96 N722	I56-N98 WeakPolarHBondContact O-CB 3.47Å; I56-N98 PolarHBondContact O-ND2 3.09Å; T57-N98 HydrophobicContact CG2-CB 3.82Å; A94-N98 WeakPolarHBondContact O-CB 3.42Å; A94-N98 PolarHBondContact O-N 2.84Å; A94-N98 PolarHBondContact O-ND2 3.41Å; I95-N98 CarbonylContact O-C 3.4Å; I95-N98 PolarHBondContact O-N 3.37Å; V96-N98 VanDerWaalsContact C-N 3.29Å; V96-N98 PolarHBondContact O-N 2.95Å; N98-N722 PolarHBondContact OD1-ND2 2.87Å
99	G	82.5	Confident	88.8	Confident	15 Å²	15	35.8 Å²	35.8	16%	0.155	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.3	14.5	164	0	0	0	0	0	116.6	I95 V96 A97 L101 Q102	I95-G99 PolarHBondContact O-N 3.08Å; V96-G99 PolarHBondContact O-N 2.84Å; A97-G99 PolarHBondContact O-N 3.01Å; G99-L101 PolarHBondContact O-N 3.35Å; G99-Q102 VanDerWaalsContact O-CB 3.3Å; G99-Q102 WeakPolarHBondContact O-CB 3.43Å; G99-Q102 VanDerWaalsContact O-CG 3.28Å; G99-Q102 WeakPolarHBondContact O-CG 3.44Å; G99-Q102 PolarHBondContact O-N 2.75Å
100	A	86.1	Confident	88.7	Confident	2 Å²	2	36.1 Å²	36.1	2%	0.017	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-57.3	-20.7	-179.4	0	0	0	0	0	115.2	L64 I95 Q102 Y103 F106	L64-A100 HydrophobicContact CD1-CB 3.85Å; L64-A100 HydrophobicContact CD2-CB 4.38Å; I95-A100 HydrophobicContact CG2-CB 3.44Å; I95-A100 VanDerWaalsContact CG2-CB 3.44Å; I95-A100 VanDerWaalsContact O-CB 3.25Å; I95-A100 WeakPolarHBondContact O-CB 3.37Å; I95-A100 PolarHBondContact O-N 3.08Å; I95-A100 VanDerWaalsContact O-N 3.1Å; A100-Q102 PolarHBondContact O-N 3.39Å; A100-Q102 VanDerWaalsContact O-N 3.11Å; A100-Y103 PolarHBondContact O-N 3.11Å; A100-Y103 VanDerWaalsContact O-N 3.07Å; A100-F106 HydrophobicContact CB-CD2 3.92Å; A100-F106 HydrophobicContact CB-CE2 4.26Å; A100-F106 HydrophobicContact CB-CG 4.5Å; A100-F106 WeakPolarHBondContact O-CB 3.19Å
101	L	86.2	Confident	88.6	Confident	35 Å²	35	38.8 Å²	38.8	18%	0.183	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-64.1	-7.6	172.6	-67.3	168.6	0	0	0	114.7	V96 G99 F106 I107 E142 I143	V96-L101 HydrophobicContact CG1-CD1 3.98Å; V96-L101 HydrophobicContact CG1-CG 4.26Å; G99-L101 PolarHBondContact O-N 3.35Å; L101-F106 HydrophobicContact CD2-CD1 3.6Å; L101-F106 HydrophobicContact CD2-CE1 3.59Å; L101-F106 HydrophobicContact CG-CD1 4.5Å; L101-F106 HydrophobicContact CG-CE1 4.49Å; L101-I107 HydrophobicContact CD2-CD1 4.44Å; L101-E142 HydrophobicContact CD1-CB 3.77Å; L101-I143 HydrophobicContact CD2-CD1 4.44Å; L101-I143 HydrophobicContact CD2-CG1 3.76Å
102	Q	85.7	Confident	88.6	Confident	163 Å²	163	40.2 Å²	40.2	76%	0.762	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-82.6	-14.5	172.6	-61.8	171.8	45.3	0	0	113	G99 A100	G99-Q102 VanDerWaalsContact O-CB 3.3Å; G99-Q102 WeakPolarHBondContact O-CB 3.43Å; G99-Q102 VanDerWaalsContact O-CG 3.28Å; G99-Q102 WeakPolarHBondContact O-CG 3.44Å; G99-Q102 PolarHBondContact O-N 2.75Å; A100-Q102 PolarHBondContact O-N 3.39Å; A100-Q102 VanDerWaalsContact O-N 3.11Å
103	Y	86.5	Confident	88.6	Confident	63 Å²	63	40.2 Å²	40.2	25%	0.247	21%	0.212	C	C	.	.	S	Bend	trans	-94.9	125.6	176.5	-66.1	-83.8	0	0	0	110.5	A58 S59 S60 L64 A100 E105 F106	A58-Y103 HydrophobicContact CB-CE2 4.23Å; A58-Y103 PolarHBondContact O-OH 3.39Å; S59-Y103 VanDerWaalsContact C-OH 3.27Å; S60-Y103 PolarHBondContact N-OH 2.8Å; L64-Y103 HydrophobicContact CD2-CD2 3.8Å; L64-Y103 HydrophobicContact CD2-CG 3.81Å; A100-Y103 PolarHBondContact O-N 3.11Å; A100-Y103 VanDerWaalsContact O-N 3.07Å; Y103-E105 PolarHBondContact O-N 3.29Å; Y103-F106 VanDerWaalsContact O-CB 3.27Å; Y103-F106 WeakPolarHBondContact O-CB 3.47Å; Y103-F106 PolarHBondContact O-N 2.93Å
104	D	84.1	Confident	88.6	Confident	79 Å²	79	42.3 Å²	42.3	42%	0.422	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-25.6	-178.7	-62.8	-39.4	0	0	0	112.7	F106 P108 I841	D104-F106 PolarHBondContact O-N 3.42Å; D104-P108 VanDerWaalsContact O-CD 3.25Å; D104-P108 WeakPolarHBondContact O-CD 3.41Å; D104-I841 HydrophobicContact CB-CD1 3.99Å; D104-I841 WeakPolarHBondContact OD1-CD1 3.36Å; D104-I841 VanDerWaalsContact OD1-CG1 3.26Å; D104-I841 WeakPolarHBondContact OD1-CG1 3.44Å; D104-I841 WeakPolarHBondContact OD1-CG2 2.88Å; D104-I841 WeakPolarHBondContact OD2-CG2 3.47Å
105	E	86.2	Confident	88.6	Confident	81 Å²	81	48.2 Å²	48.2	38%	0.379	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-21.6	174.7	-56.8	126.9	130.8	0	0	113	G61 Y103 I107 P108 L109	G61-E105 WeakPolarHBondContact CA-OE1 3.25Å; G61-E105 VanDerWaalsContact CA-OE2 3.24Å; G61-E105 WeakPolarHBondContact CA-OE2 3.39Å; Y103-E105 PolarHBondContact O-N 3.29Å; E105-I107 PolarHBondContact O-N 3.15Å; E105-P108 VanDerWaalsContact O-CD 3.29Å; E105-P108 WeakPolarHBondContact O-CD 3.38Å; E105-L109 HydrophobicContact CB-CD1 3.97Å; E105-L109 HydrophobicContact CB-CG 4.49Å; E105-L109 WeakPolarHBondContact O-CB 3.36Å; E105-L109 WeakPolarHBondContact O-CD1 3.41Å; E105-L109 WeakPolarHBondContact O-CG 3.34Å; E105-L109 PolarHBondContact O-N 2.96Å
106	F	90.2	Very high	88.8	Confident	1 Å²	1	48.5 Å²	48.5	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-62.8	-43.5	-170.8	-179.9	-98.3	0	0	0	113.7	L64 I68 V96 A100 L101 Y103 D104 L109 L110 L139 I143	L64-F106 HydrophobicContact CD1-CD2 4.37Å; L64-F106 HydrophobicContact CD2-CB 4.08Å; L64-F106 HydrophobicContact CD2-CD2 4.28Å; I68-F106 HydrophobicContact CD1-CE2 4.18Å; V96-F106 HydrophobicContact CG2-CE1 4.18Å; V96-F106 HydrophobicContact CG2-CE2 3.78Å; V96-F106 HydrophobicContact CG2-CZ 3.36Å; A100-F106 HydrophobicContact CB-CD2 3.92Å; A100-F106 HydrophobicContact CB-CE2 4.26Å; A100-F106 HydrophobicContact CB-CG 4.5Å; A100-F106 WeakPolarHBondContact O-CB 3.19Å; L101-F106 HydrophobicContact CD2-CD1 3.6Å; L101-F106 HydrophobicContact CD2-CE1 3.59Å; L101-F106 HydrophobicContact CG-CD1 4.5Å; L101-F106 HydrophobicContact CG-CE1 4.49Å; Y103-F106 VanDerWaalsContact O-CB 3.27Å; Y103-F106 WeakPolarHBondContact O-CB 3.47Å; Y103-F106 PolarHBondContact O-N 2.93Å; D104-F106 PolarHBondContact O-N 3.42Å; F106-L109 PolarHBondContact O-N 3.45Å; F106-L110 HydrophobicContact CE1-CB 4.39Å; F106-L110 HydrophobicContact CE1-CD2 4.09Å; F106-L110 HydrophobicContact CZ-CB 4.45Å; F106-L110 HydrophobicContact CZ-CD1 4.46Å; F106-L110 HydrophobicContact CZ-CD2 4.4Å; F106-L110 WeakPolarHBondContact O-CB 3.45Å; F106-L110 PolarHBondContact O-N 3.03Å; F106-L139 HydrophobicContact CZ-CD2 4.47Å; F106-I143 HydrophobicContact CE1-CD1 4.16Å
107	I	88.9	Confident	89	Confident	30 Å²	30	48.3 Å²	48.3	15%	0.154	26%	0.255	C	S	.	.	H	α-helix	trans	-70	-41.5	-178.8	-60.9	-64.2	0	0	0	112.1	L101 E105 I143	L101-I107 HydrophobicContact CD2-CD1 4.44Å; E105-I107 PolarHBondContact O-N 3.15Å; I107-I143 HydrophobicContact CD1-CG2 4.15Å
108	P	90.3	Very high	89.2	Confident	77 Å²	77	47.4 Å²	47.4	50%	0.5	24%	0.244	S	C	.	.	H	α-helix	trans	-54.5	-47.1	163.9	-28.3	34.6	0	0	0	113.8	D104 E105 L110 K111	D104-P108 VanDerWaalsContact O-CD 3.25Å; D104-P108 WeakPolarHBondContact O-CD 3.41Å; E105-P108 VanDerWaalsContact O-CD 3.29Å; E105-P108 WeakPolarHBondContact O-CD 3.38Å; P108-L110 PolarHBondContact O-N 2.97Å; P108-K111 PolarHBondContact O-N 3.07Å
109	L	90.2	Very high	89.6	Confident	18 Å²	18	50 Å²	50	9%	0.094	26%	0.258	C	S	.	.	H	α-helix	trans	-63.8	-40.5	-179.2	-75.5	169.3	0	0	0	112.6	L64 T65 I68 E105 F106 K111 T112	L64-L109 HydrophobicContact CD2-CD1 4.41Å; L64-L109 HydrophobicContact CG-CD1 4.17Å; T65-L109 HydrophobicContact CG2-CD2 4.08Å; I68-L109 HydrophobicContact CB-CB 4.49Å; I68-L109 HydrophobicContact CG1-CB 4.43Å; I68-L109 HydrophobicContact CG1-CD1 4.37Å; I68-L109 HydrophobicContact CG2-CB 4.05Å; I68-L109 HydrophobicContact CG2-CD2 4.43Å; E105-L109 HydrophobicContact CB-CD1 3.97Å; E105-L109 HydrophobicContact CB-CG 4.49Å; E105-L109 WeakPolarHBondContact O-CB 3.36Å; E105-L109 WeakPolarHBondContact O-CD1 3.41Å; E105-L109 WeakPolarHBondContact O-CG 3.34Å; E105-L109 PolarHBondContact O-N 2.96Å; F106-L109 PolarHBondContact O-N 3.45Å; L109-K111 VanDerWaalsContact C-N 3.29Å; L109-K111 PolarHBondContact O-N 3.19Å; L109-T112 WeakPolarHBondContact O-CB 3.38Å; L109-T112 PolarHBondContact O-N 3.12Å; L109-T112 PolarHBondContact O-OG1 3.45Å
110	L	91.3	Very high	90.2	Very high	8 Å²	8	49.3 Å²	49.3	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-36	179.7	-178.5	62.3	0	0	0	112.6	F106 P108 T112 L113 L139 I143 F150	F106-L110 HydrophobicContact CE1-CB 4.39Å; F106-L110 HydrophobicContact CE1-CD2 4.09Å; F106-L110 HydrophobicContact CZ-CB 4.45Å; F106-L110 HydrophobicContact CZ-CD1 4.46Å; F106-L110 HydrophobicContact CZ-CD2 4.4Å; F106-L110 WeakPolarHBondContact O-CB 3.45Å; F106-L110 PolarHBondContact O-N 3.03Å; P108-L110 PolarHBondContact O-N 2.97Å; L110-T112 PolarHBondContact O-N 3.26Å; L110-L113 HydrophobicContact CD1-CD1 4.31Å; L110-L113 WeakPolarHBondContact O-CB 3.42Å; L110-L113 PolarHBondContact O-N 2.88Å; L110-L139 HydrophobicContact CD1-CD1 4.17Å; L110-L139 HydrophobicContact CD1-CD2 4.2Å; L110-L139 HydrophobicContact CD2-CD2 4.32Å; L110-I143 HydrophobicContact CD2-CD1 3.37Å; L110-F150 HydrophobicContact CD1-CE2 4.23Å; L110-F150 HydrophobicContact CG-CD2 4.23Å; L110-F150 HydrophobicContact CG-CE2 4.23Å
111	K	90.2	Very high	90.6	Very high	115 Å²	115	49.2 Å²	49.2	50%	0.5	25%	0.25	S	C	.	.	H	α-helix	trans	-61	-25.8	173.7	-65.4	170.5	-176.5	173.8	0	112.5	P108 L109 L113 E114	P108-K111 PolarHBondContact O-N 3.07Å; L109-K111 VanDerWaalsContact C-N 3.29Å; L109-K111 PolarHBondContact O-N 3.19Å; K111-L113 VanDerWaalsContact C-N 3.25Å; K111-L113 PolarHBondContact O-N 2.69Å; K111-E114 WeakPolarHBondContact O-CB 3.42Å; K111-E114 PolarHBondContact O-N 3.49Å
112	T	91.7	Very high	91	Very high	57 Å²	57	54.7 Å²	54.7	35%	0.35	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-13.7	176.4	79.8	0	0	0	0	113.6	K72 L109 L110	K72-T112 WeakPolarHBondContact CE-O 3.37Å; L109-T112 WeakPolarHBondContact O-CB 3.38Å; L109-T112 PolarHBondContact O-N 3.12Å; L109-T112 PolarHBondContact O-OG1 3.45Å; L110-T112 PolarHBondContact O-N 3.26Å
113	L	92.9	Very high	91.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-10.6	176.3	-61.8	-179.9	0	0	0	113.5	I68 I71 K72 L92 L110 K111 N115 S116 I117	I68-L113 HydrophobicContact CD1-CD1 4.23Å; I68-L113 HydrophobicContact CG2-CD1 4.03Å; I68-L113 HydrophobicContact CG2-CD2 4.14Å; I68-L113 HydrophobicContact CG2-CG 4.04Å; I71-L113 HydrophobicContact CG2-CD1 4.21Å; I71-L113 HydrophobicContact CG2-CD2 4.07Å; K72-L113 HydrophobicContact CB-CD2 3.54Å; K72-L113 HydrophobicContact CG-CD2 4.01Å; L92-L113 HydrophobicContact CD1-CD1 3.8Å; L92-L113 HydrophobicContact CD2-CD1 3.83Å; L92-L113 HydrophobicContact CG-CD1 4.47Å; L110-L113 HydrophobicContact CD1-CD1 4.31Å; L110-L113 WeakPolarHBondContact O-CB 3.42Å; L110-L113 PolarHBondContact O-N 2.88Å; K111-L113 VanDerWaalsContact C-N 3.25Å; K111-L113 PolarHBondContact O-N 2.69Å; L113-N115 PolarHBondContact O-N 2.86Å; L113-S116 PolarHBondContact O-N 3.34Å; L113-I117 HydrophobicContact CB-CD1 3.83Å; L113-I117 HydrophobicContact CB-CG1 4.4Å; L113-I117 WeakPolarHBondContact O-CG1 3.49Å; L113-I117 PolarHBondContact O-N 2.96Å
114	E	92.3	Very high	91.7	Very high	50 Å²	50	52.8 Å²	52.8	23%	0.234	27%	0.266	C	S	.	.	H	α-helix	trans	-51.5	-55.1	-171.5	-167	175.9	143	0	0	112.6	K111 S116 I117 D118 F150 S153	K111-E114 WeakPolarHBondContact O-CB 3.42Å; K111-E114 PolarHBondContact O-N 3.49Å; E114-S116 PolarHBondContact O-N 3.08Å; E114-I117 PolarHBondContact O-N 3.16Å; E114-D118 PolarHBondContact O-N 3.44Å; E114-F150 HydrophobicContact CB-CD2 4.28Å; E114-F150 HydrophobicContact CB-CE2 3.97Å; E114-F150 HydrophobicContact CG-CD2 4.13Å; E114-F150 HydrophobicContact CG-CE2 4.14Å; E114-S153 VanDerWaalsContact CD-OG 3.22Å; E114-S153 WeakPolarHBondContact CG-OG 3.36Å; E114-S153 WeakPolarHBondContact OE1-CB 3.27Å; E114-S153 PolarHBondContact OE1-OG 2.8Å
115	N	91.8	Very high	92.1	Very high	124 Å²	124	52.6 Å²	52.6	66%	0.663	26%	0.26	S	S	*	.	H	α-helix	trans	-61.5	-39.4	176.2	-68	-29.4	0	0	0	112.9	L113 I117 D118 L119	L113-N115 PolarHBondContact O-N 2.86Å; N115-I117 VanDerWaalsContact C-N 3.32Å; N115-I117 PolarHBondContact O-N 3.31Å; N115-D118 PolarHBondContact O-N 3.29Å; N115-L119 WeakPolarHBondContact O-CB 3.15Å; N115-L119 VanDerWaalsContact O-CG 3.29Å; N115-L119 WeakPolarHBondContact O-CG 3.36Å; N115-L119 PolarHBondContact O-N 2.92Å
116	S	93.3	Very high	92.4	Very high	8 Å²	8	50.6 Å²	50.6	6%	0.056	25%	0.254	C	S	.	.	H	α-helix	trans	-71	-28.8	-178.6	-52.3	0	0	0	0	112.5	L113 E114 S120	L113-S116 PolarHBondContact O-N 3.34Å; E114-S116 PolarHBondContact O-N 3.08Å; S116-S120 PolarHBondContact O-N 2.95Å; S116-S120 PolarHBondContact O-OG 3.29Å
117	I	94.6	Very high	92.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-80	-39.2	174.7	-69.7	168.8	0	0	0	110.7	L75 L89 L92 L113 E114 N115 S120 L121 V136 F150	L75-I117 HydrophobicContact CD1-CG1 4.18Å; L89-I117 HydrophobicContact CD2-CG1 4.48Å; L92-I117 HydrophobicContact CD2-CD1 3.87Å; L113-I117 HydrophobicContact CB-CD1 3.83Å; L113-I117 HydrophobicContact CB-CG1 4.4Å; L113-I117 WeakPolarHBondContact O-CG1 3.49Å; L113-I117 PolarHBondContact O-N 2.96Å; E114-I117 PolarHBondContact O-N 3.16Å; N115-I117 VanDerWaalsContact C-N 3.32Å; N115-I117 PolarHBondContact O-N 3.31Å; I117-S120 CarbonylContact O-C 3.56Å; I117-S120 WeakPolarHBondContact O-CA 3.35Å; I117-S120 WeakPolarHBondContact O-CB 3.5Å; I117-S120 PolarHBondContact O-N 3.43Å; I117-L121 HydrophobicContact CG2-CD1 4.47Å; I117-L121 WeakPolarHBondContact O-CG 3.43Å; I117-L121 PolarHBondContact O-N 3.14Å; I117-V136 HydrophobicContact CG2-CG2 3.94Å; I117-F150 HydrophobicContact CB-CZ 4Å; I117-F150 HydrophobicContact CD1-CE2 4.33Å; I117-F150 HydrophobicContact CD1-CZ 3.7Å; I117-F150 HydrophobicContact CG1-CZ 4.43Å; I117-F150 HydrophobicContact CG2-CE1 4.18Å; I117-F150 HydrophobicContact CG2-CZ 3.95Å
118	D	94	Very high	92.8	Very high	22 Å²	22	51.4 Å²	51.4	12%	0.118	26%	0.263	C	S	.	.	H	α-helix	trans	-59.8	-44.9	171.2	178.9	66.2	0	0	0	112.2	E114 N115 S120 L121 R122 T157	E114-D118 PolarHBondContact O-N 3.44Å; N115-D118 PolarHBondContact O-N 3.29Å; D118-S120 PolarHBondContact O-N 2.94Å; D118-L121 PolarHBondContact O-N 3.1Å; D118-L121 VanDerWaalsContact O-N 3.14Å; D118-R122 WeakPolarHBondContact O-CG 3.37Å; D118-R122 PolarHBondContact O-N 3.02Å; D118-R122 IonicContact OD1-CZ 2.67Å; D118-R122 IonicContact OD1-NE 3.71Å; D118-R122 PolarHBondContact OD1-NE 3.27Å; D118-R122 IonicContact OD1-NH2 3.89Å; D118-R122 PolarHBondContact OD1-NH2 2.69Å; D118-R122 WeakPolarHBondContact OD2-CD 3.32Å; D118-R122 IonicContact OD2-CZ 2.71Å; D118-R122 IonicContact OD2-NE 2.68Å; D118-R122 PolarHBondContact OD2-NE 2.82Å; D118-R122 VanDerWaalsContact OD2-NE 3.1Å; D118-R122 IonicContact OD2-NH1 2.69Å; D118-R122 PolarHBondContact OD2-NH1 3.29Å; D118-R122 IonicContact OD2-NH2 3.19Å; D118-R122 PolarHBondContact OD2-NH2 3.45Å; D118-T157 WeakPolarHBondContact OD1-CB 3.28Å; D118-T157 PolarHBondContact OD1-OG1 3.18Å
119	L	92.7	Very high	93	Very high	103 Å²	103	47.8 Å²	47.8	54%	0.539	24%	0.239	S	C	.	.	H	α-helix	trans	-58.1	-34.1	172.1	-72.8	170.9	0	0	0	112.6	N115 R122 D123	N115-L119 WeakPolarHBondContact O-CB 3.15Å; N115-L119 VanDerWaalsContact O-CG 3.29Å; N115-L119 WeakPolarHBondContact O-CG 3.36Å; N115-L119 PolarHBondContact O-N 2.92Å; L119-R122 PolarHBondContact O-N 3.25Å; L119-D123 PolarHBondContact O-N 2.79Å
120	S	94.2	Very high	93.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-76.4	-31.2	176.9	-59.5	0	0	0	0	113.2	S116 I117 D118 R122	S116-S120 PolarHBondContact O-N 2.95Å; S116-S120 PolarHBondContact O-OG 3.29Å; I117-S120 CarbonylContact O-C 3.56Å; I117-S120 WeakPolarHBondContact O-CA 3.35Å; I117-S120 WeakPolarHBondContact O-CB 3.5Å; I117-S120 PolarHBondContact O-N 3.43Å; D118-S120 PolarHBondContact O-N 2.94Å; S120-R122 VanDerWaalsContact C-N 3.29Å
121	L	95.8	Very high	93.3	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-70.6	-25	170.4	-69.7	168.5	0	0	0	112.5	I117 D118 A132 V136 V154 T157 I158 L161	I117-L121 HydrophobicContact CG2-CD1 4.47Å; I117-L121 WeakPolarHBondContact O-CG 3.43Å; I117-L121 PolarHBondContact O-N 3.14Å; D118-L121 PolarHBondContact O-N 3.1Å; D118-L121 VanDerWaalsContact O-N 3.14Å; L121-A132 HydrophobicContact CD2-CB 3.7Å; L121-A132 HydrophobicContact CG-CB 4.03Å; L121-V136 HydrophobicContact CD1-CG2 4.27Å; L121-V136 HydrophobicContact CD2-CG2 4.48Å; L121-V154 HydrophobicContact CD1-CB 3.8Å; L121-V154 HydrophobicContact CD1-CG1 3.91Å; L121-T157 HydrophobicContact CB-CG2 3.63Å; L121-T157 HydrophobicContact CD1-CG2 4.41Å; L121-I158 HydrophobicContact CD1-CG1 4.29Å; L121-L161 HydrophobicContact CD2-CD1 4.49Å
122	R	93.8	Very high	93.6	Very high	150 Å²	150	44.4 Å²	44.4	57%	0.566	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.1	4.7	178.4	-67.8	176	-179.9	173.9	7.9	114.3	D118 L119 S120 T157	D118-R122 WeakPolarHBondContact O-CG 3.37Å; D118-R122 PolarHBondContact O-N 3.02Å; D118-R122 IonicContact OD1-CZ 2.67Å; D118-R122 IonicContact OD1-NE 3.71Å; D118-R122 PolarHBondContact OD1-NE 3.27Å; D118-R122 IonicContact OD1-NH2 3.89Å; D118-R122 PolarHBondContact OD1-NH2 2.69Å; D118-R122 WeakPolarHBondContact OD2-CD 3.32Å; D118-R122 IonicContact OD2-CZ 2.71Å; D118-R122 IonicContact OD2-NE 2.68Å; D118-R122 PolarHBondContact OD2-NE 2.82Å; D118-R122 VanDerWaalsContact OD2-NE 3.1Å; D118-R122 IonicContact OD2-NH1 2.69Å; D118-R122 PolarHBondContact OD2-NH1 3.29Å; D118-R122 IonicContact OD2-NH2 3.19Å; D118-R122 PolarHBondContact OD2-NH2 3.45Å; L119-R122 PolarHBondContact O-N 3.25Å; S120-R122 VanDerWaalsContact C-N 3.29Å; R122-T157 HydrophobicContact CG-CG2 3.59Å; R122-T157 PolarHBondContact NE-OG1 3.18Å; R122-T157 PolarHBondContact NH2-OG1 2.98Å
123	D	94	Very high	93.8	Very high	20 Å²	20	41.7 Å²	41.7	11%	0.107	21%	0.206	C	C	.	.			trans	-66.4	148.1	-176.9	-158.3	-72.6	0	0	0	112.9	R85 L119 R125 V128 V129 M169	R85-D123 IonicContact CZ-OD2 3.61Å; R85-D123 IonicContact NH1-OD2 3.86Å; R85-D123 PolarHBondContact NH1-OD2 3.2Å; R85-D123 IonicContact NH2-OD2 2.68Å; R85-D123 PolarHBondContact NH2-OD2 2.82Å; L119-D123 PolarHBondContact O-N 2.79Å; D123-R125 VanDerWaalsContact C-N 3.29Å; D123-R125 PolarHBondContact O-N 2.92Å; D123-R125 VanDerWaalsContact OD1-CB 3.26Å; D123-R125 WeakPolarHBondContact OD1-CB 3.49Å; D123-R125 WeakPolarHBondContact OD1-CG 3.45Å; D123-R125 PolarHBondContact OD1-N 3.01Å; D123-V128 HydrophobicContact CB-CB 3.81Å; D123-V128 HydrophobicContact CB-CG1 3.77Å; D123-V128 HydrophobicContact CB-CG2 4.5Å; D123-V129 HydrophobicContact CB-CG2 4Å; D123-V129 WeakPolarHBondContact O-CG2 3.22Å; D123-M169 WeakPolarHBondContact O-CE 3.41Å
124	L	92.5	Very high	93.9	Very high	165 Å²	165	41.7 Å²	41.7	86%	0.864	21%	0.206	S	C	*	.	S	Bend	trans	-75.7	-17.3	177.2	-59.1	179.2	0	0	0	112.9	M169	L124-M169 VanDerWaalsContact C-CE 3.49Å; L124-M169 VanDerWaalsContact O-CE 3.27Å; L124-M169 WeakPolarHBondContact O-CE 3.27Å
125	R	93.5	Very high	94	Very high	76 Å²	76	39.3 Å²	39.3	29%	0.287	20%	0.195	S	C	.	.	S	Bend	trans	-92.3	117.1	-179.3	-61.2	172	169.3	98.6	-5.9	110.1	P79 E80 W82 D123 S127 V128 V129	P79-R125 PolarHBondContact O-NH1 3.28Å; E80-R125 IonicContact OE2-CZ 3.82Å; E80-R125 IonicContact OE2-NH1 2.73Å; E80-R125 IonicContact OE2-NH2 3.57Å; E80-R125 PolarHBondContact OE2-NH2 3.31Å; W82-R125 VanDerWaalsContact CG-CD 3.47Å; D123-R125 VanDerWaalsContact C-N 3.29Å; D123-R125 PolarHBondContact O-N 2.92Å; D123-R125 VanDerWaalsContact OD1-CB 3.26Å; D123-R125 WeakPolarHBondContact OD1-CB 3.49Å; D123-R125 WeakPolarHBondContact OD1-CG 3.45Å; D123-R125 PolarHBondContact OD1-N 3.01Å; R125-S127 PolarHBondContact O-N 3.02Å; R125-V128 HydrophobicContact CB-CG2 4.04Å; R125-V128 PolarHBondContact O-N 2.73Å; R125-V129 PolarHBondContact O-N 2.65Å
126	S	93	Very high	94.2	Very high	38 Å²	38	33.4 Å²	33.4	27%	0.266	16%	0.163	S	C	.	.	H	α-helix	trans	-62	-18.2	-178.8	-48	0	0	0	0	114.3	R130	S126-R130 WeakPolarHBondContact O-CB 3.4Å; S126-R130 PolarHBondContact O-N 3.18Å; S126-R130 VanDerWaalsContact O-N 3.07Å
127	S	91.8	Very high	94.3	Very high	49 Å²	49	33 Å²	33	34%	0.343	16%	0.16	S	C	.	.	H	α-helix	trans	-65	-50.7	170.5	45.4	0	0	0	0	111.9	W82 R125 E131	W82-S127 VanDerWaalsContact CZ3-OG 3.23Å; W82-S127 WeakPolarHBondContact CZ3-OG 3.42Å; R125-S127 PolarHBondContact O-N 3.02Å; S127-E131 WeakPolarHBondContact O-CB 3.29Å; S127-E131 PolarHBondContact O-N 3.18Å
128	V	94.2	Very high	94.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64	-48.5	179.5	-175.8	0	0	0	0	110.3	W82 V86 D123 R125 R130 E131 A132	W82-V128 HydrophobicContact CB-CG2 3.89Å; W82-V128 HydrophobicContact CE3-CG2 4.15Å; V86-V128 HydrophobicContact CG2-CG2 4.12Å; D123-V128 HydrophobicContact CB-CB 3.81Å; D123-V128 HydrophobicContact CB-CG1 3.77Å; D123-V128 HydrophobicContact CB-CG2 4.5Å; R125-V128 HydrophobicContact CB-CG2 4.04Å; R125-V128 PolarHBondContact O-N 2.73Å; V128-R130 PolarHBondContact O-N 3.04Å; V128-E131 PolarHBondContact O-N 2.95Å; V128-A132 WeakPolarHBondContact O-CB 3.22Å; V128-A132 PolarHBondContact O-N 3.43Å
129	V	95.5	Very high	94.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63	-42.4	-180	178.7	0	0	0	0	112.1	D123 R125 E131 A132 C133 L161 M169	D123-V129 HydrophobicContact CB-CG2 4Å; D123-V129 WeakPolarHBondContact O-CG2 3.22Å; R125-V129 PolarHBondContact O-N 2.65Å; V129-E131 VanDerWaalsContact C-N 3.33Å; V129-E131 PolarHBondContact O-N 3.38Å; V129-A132 PolarHBondContact O-N 3.29Å; V129-C133 WeakPolarHBondContact O-CB 3.26Å; V129-C133 PolarHBondContact O-N 3.4Å; V129-C133 PolarHBondContact O-SG 3.01Å; V129-C133 VanDerWaalsContact O-SG 3.37Å; V129-L161 HydrophobicContact CG1-CD1 3.68Å; V129-L161 HydrophobicContact CG1-CD2 3.94Å; V129-L161 HydrophobicContact CG1-CG 4.48Å; V129-M169 HydrophobicContact CB-CE 4.34Å; V129-M169 HydrophobicContact CB-CG 4.05Å; V129-M169 HydrophobicContact CG1-CB 4.21Å; V129-M169 HydrophobicContact CG1-CG 3.97Å; V129-M169 HydrophobicContact CG2-CE 3.79Å; V129-M169 HydrophobicContact CG2-CG 4.41Å; V129-M169 HydrophobicContact CG2-SD 4.45Å
130	R	94.2	Very high	94.4	Very high	58 Å²	58	27.4 Å²	27.4	22%	0.219	13%	0.131	C	C	.	.	H	α-helix	trans	-58.6	-46.7	174.1	176.9	-174.1	169.6	-76.5	-3.2	110.9	V45 S49 S126 V128 A132 C133 I134 V168	V45-R130 VanDerWaalsContact CG1-NH2 3.31Å; S49-R130 PolarHBondContact OG-NH2 2.8Å; S126-R130 WeakPolarHBondContact O-CB 3.4Å; S126-R130 PolarHBondContact O-N 3.18Å; S126-R130 VanDerWaalsContact O-N 3.07Å; V128-R130 PolarHBondContact O-N 3.04Å; R130-A132 VanDerWaalsContact C-N 3.34Å; R130-A132 PolarHBondContact O-N 3.29Å; R130-C133 PolarHBondContact O-N 3.44Å; R130-I134 HydrophobicContact CG-CD1 3.78Å; R130-I134 VanDerWaalsContact NH1-CD1 3.26Å; R130-I134 WeakPolarHBondContact O-CD1 3.41Å; R130-I134 VanDerWaalsContact O-CG1 3.28Å; R130-I134 WeakPolarHBondContact O-CG1 3.43Å; R130-I134 PolarHBondContact O-N 3.5Å; R130-V168 HydrophobicContact CB-CG1 4.1Å
131	E	94	Very high	94.3	Very high	13 Å²	13	29.6 Å²	29.6	6%	0.061	14%	0.141	C	C	.	.	H	α-helix	trans	-67.3	-35.8	-178.1	-157	65.3	-158.8	0	0	112.1	V86 L89 K90 R93 S127 V128 V129 T135	V86-E131 HydrophobicContact CG1-CG 4.19Å; V86-E131 HydrophobicContact CG2-CB 4.3Å; L89-E131 HydrophobicContact CB-CG 3.93Å; L89-E131 HydrophobicContact CD1-CB 3.98Å; L89-E131 HydrophobicContact CD1-CG 4.16Å; K90-E131 VanDerWaalsContact CG-OE1 3.24Å; K90-E131 WeakPolarHBondContact CG-OE1 3.22Å; R93-E131 IonicContact CZ-OE1 2.84Å; R93-E131 IonicContact NH1-OE1 3.25Å; R93-E131 PolarHBondContact NH1-OE1 3.12Å; R93-E131 IonicContact NH2-OE1 3.1Å; R93-E131 PolarHBondContact NH2-OE1 2.83Å; S127-E131 WeakPolarHBondContact O-CB 3.29Å; S127-E131 PolarHBondContact O-N 3.18Å; V128-E131 PolarHBondContact O-N 2.95Å; V129-E131 VanDerWaalsContact C-N 3.33Å; V129-E131 PolarHBondContact O-N 3.38Å; E131-T135 WeakPolarHBondContact O-CB 3.28Å; E131-T135 PolarHBondContact O-N 2.59Å; E131-T135 PolarHBondContact O-OG1 2.96Å
132	A	95.6	Very high	94.1	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-67.2	-45.8	174.3	0	0	0	0	0	111.2	L89 L121 V128 V129 R130 I134 T135 V136	L89-A132 HydrophobicContact CD1-CB 4.03Å; L121-A132 HydrophobicContact CD2-CB 3.7Å; L121-A132 HydrophobicContact CG-CB 4.03Å; V128-A132 WeakPolarHBondContact O-CB 3.22Å; V128-A132 PolarHBondContact O-N 3.43Å; V129-A132 PolarHBondContact O-N 3.29Å; R130-A132 VanDerWaalsContact C-N 3.34Å; R130-A132 PolarHBondContact O-N 3.29Å; A132-I134 PolarHBondContact O-N 3.48Å; A132-T135 PolarHBondContact O-N 3.49Å; A132-T135 VanDerWaalsContact O-N 3.15Å; A132-V136 WeakPolarHBondContact O-CG2 3.35Å; A132-V136 PolarHBondContact O-N 3.05Å
133	C	96.5	Very high	94	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.5	-43.7	173.7	-76.7	0	0	0	0	112.8	F46 V129 R130 T135 V136 A137 A176	F46-C133 HydrophobicContact CE1-CB 4.23Å; F46-C133 HydrophobicContact CZ-CB 3.86Å; V129-C133 WeakPolarHBondContact O-CB 3.26Å; V129-C133 PolarHBondContact O-N 3.4Å; V129-C133 PolarHBondContact O-SG 3.01Å; V129-C133 VanDerWaalsContact O-SG 3.37Å; R130-C133 PolarHBondContact O-N 3.44Å; C133-T135 VanDerWaalsContact C-N 3.28Å; C133-T135 PolarHBondContact O-N 2.73Å; C133-V136 PolarHBondContact O-N 3.43Å; C133-A137 WeakPolarHBondContact O-CB 3.46Å; C133-A137 PolarHBondContact O-N 2.86Å; C133-A176 HydrophobicContact CB-CB 3.99Å
134	I	95	Very high	93.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63	-38	176	-71.1	165.2	0	0	0	111	F46 F50 R130 A132 F138	F46-I134 HydrophobicContact CD1-CB 4.38Å; F46-I134 HydrophobicContact CD1-CG1 3.79Å; F46-I134 HydrophobicContact CD2-CD1 4.42Å; F46-I134 HydrophobicContact CD2-CG1 3.8Å; F46-I134 HydrophobicContact CE1-CB 4.35Å; F46-I134 HydrophobicContact CE1-CG1 3.76Å; F46-I134 HydrophobicContact CE2-CD1 4.44Å; F46-I134 HydrophobicContact CE2-CG1 3.76Å; F46-I134 HydrophobicContact CG-CG1 3.82Å; F46-I134 HydrophobicContact CZ-CG1 3.74Å; F50-I134 HydrophobicContact CD1-CG2 4.07Å; F50-I134 HydrophobicContact CE1-CG2 4.47Å; R130-I134 HydrophobicContact CG-CD1 3.78Å; R130-I134 VanDerWaalsContact NH1-CD1 3.26Å; R130-I134 WeakPolarHBondContact O-CD1 3.41Å; R130-I134 VanDerWaalsContact O-CG1 3.28Å; R130-I134 WeakPolarHBondContact O-CG1 3.43Å; R130-I134 PolarHBondContact O-N 3.5Å; A132-I134 PolarHBondContact O-N 3.48Å; I134-F138 WeakPolarHBondContact O-CB 3.42Å; I134-F138 PolarHBondContact O-N 3.35Å
135	T	94.7	Very high	93.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-69.7	-41.9	178	-55.1	0	0	0	0	111.9	L89 L92 R93 E131 A132 C133 F138 L139	L89-T135 HydrophobicContact CD2-CG2 4.17Å; L92-T135 HydrophobicContact CD2-CG2 3.92Å; L92-T135 HydrophobicContact CG-CG2 4.43Å; R93-T135 HydrophobicContact CG-CG2 3.92Å; R93-T135 PolarHBondContact NH1-OG1 2.91Å; E131-T135 WeakPolarHBondContact O-CB 3.28Å; E131-T135 PolarHBondContact O-N 2.59Å; E131-T135 PolarHBondContact O-OG1 2.96Å; A132-T135 PolarHBondContact O-N 3.49Å; A132-T135 VanDerWaalsContact O-N 3.15Å; C133-T135 VanDerWaalsContact C-N 3.28Å; C133-T135 PolarHBondContact O-N 2.73Å; T135-F138 PolarHBondContact O-N 3.34Å; T135-L139 HydrophobicContact CG2-CD1 4.11Å; T135-L139 WeakPolarHBondContact O-CB 3.2Å; T135-L139 WeakPolarHBondContact O-CD1 3.36Å; T135-L139 WeakPolarHBondContact O-CG 3.49Å; T135-L139 PolarHBondContact O-N 2.78Å
136	V	95.9	Very high	93.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.2	-43.9	172.7	167.2	0	0	0	0	112	I117 L121 A132 C133 L139 S140 F147 F150 V154 I158 I180	I117-V136 HydrophobicContact CG2-CG2 3.94Å; L121-V136 HydrophobicContact CD1-CG2 4.27Å; L121-V136 HydrophobicContact CD2-CG2 4.48Å; A132-V136 WeakPolarHBondContact O-CG2 3.35Å; A132-V136 PolarHBondContact O-N 3.05Å; C133-V136 PolarHBondContact O-N 3.43Å; V136-L139 PolarHBondContact O-N 3.32Å; V136-S140 WeakPolarHBondContact O-CB 3.46Å; V136-S140 PolarHBondContact O-N 3.23Å; V136-F147 HydrophobicContact CG1-CE1 4.17Å; V136-F147 HydrophobicContact CG1-CZ 4.06Å; V136-F150 HydrophobicContact CG2-CE1 4.47Å; V136-V154 HydrophobicContact CG1-CG2 4.38Å; V136-I158 HydrophobicContact CG1-CD1 4.02Å; V136-I180 HydrophobicContact CG1-CD1 3.93Å; V136-I180 HydrophobicContact CG1-CG1 4.36Å
137	A	95.4	Very high	93.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-62.7	-42.1	177.4	0	0	0	0	0	112.4	F46 F50 C133 S140 Q141 F179	F46-A137 HydrophobicContact CD1-CB 3.61Å; F46-A137 HydrophobicContact CE1-CB 3.73Å; F50-A137 HydrophobicContact CE1-CB 3.97Å; F50-A137 HydrophobicContact CZ-CB 4.15Å; C133-A137 WeakPolarHBondContact O-CB 3.46Å; C133-A137 PolarHBondContact O-N 2.86Å; A137-S140 PolarHBondContact O-N 3.33Å; A137-Q141 PolarHBondContact O-N 2.62Å; A137-Q141 VanDerWaalsContact O-N 3.11Å; A137-F179 HydrophobicContact CB-CB 3.72Å; A137-F179 HydrophobicContact CB-CD2 3.83Å; A137-F179 HydrophobicContact CB-CG 3.78Å
138	F	94.5	Very high	93.2	Very high	6 Å²	6	21.9 Å²	21.9	3%	0.026	9%	0.093	C	C	.	.	H	α-helix	trans	-65.7	-47	175.5	-177.3	-117.9	0	0	0	112	F50 R93 V96 A97 I134 T135 S140 Q141 E142	F50-F138 HydrophobicContact CB-CD2 3.62Å; F50-F138 HydrophobicContact CB-CE2 4.06Å; F50-F138 HydrophobicContact CB-CG 4.3Å; F50-F138 HydrophobicContact CD1-CB 3.81Å; F50-F138 HydrophobicContact CD1-CD2 4.19Å; F50-F138 HydrophobicContact CD1-CG 4.38Å; F50-F138 AromaticContact CD2-CD2 3.93Å; F50-F138 HydrophobicContact CD2-CD2 3.93Å; F50-F138 HydrophobicContact CE1-CB 4.07Å; F50-F138 HydrophobicContact CG-CB 4.2Å; F50-F138 AromaticContact CG-CD2 3.68Å; F50-F138 HydrophobicContact CG-CD2 3.68Å; F50-F138 HydrophobicContact CG-CG 4.29Å; R93-F138 HydrophobicContact CB-CD1 3.78Å; R93-F138 HydrophobicContact CB-CE1 3.96Å; R93-F138 HydrophobicContact CG-CB 4.44Å; R93-F138 HydrophobicContact CG-CD1 3.7Å; R93-F138 HydrophobicContact CG-CE1 4.38Å; R93-F138 HydrophobicContact CG-CG 4.37Å; R93-F138 WeakPolarHBondContact O-CE1 3.22Å; V96-F138 HydrophobicContact CB-CE1 3.89Å; V96-F138 HydrophobicContact CG1-CD1 4.43Å; V96-F138 HydrophobicContact CG1-CE1 3.7Å; V96-F138 HydrophobicContact CG1-CZ 4.23Å; A97-F138 HydrophobicContact CB-CE1 4.46Å; A97-F138 HydrophobicContact CB-CZ 3.97Å; I134-F138 WeakPolarHBondContact O-CB 3.42Å; I134-F138 PolarHBondContact O-N 3.35Å; T135-F138 PolarHBondContact O-N 3.34Å; F138-S140 VanDerWaalsContact C-N 3.31Å; F138-S140 PolarHBondContact O-N 3.17Å; F138-Q141 PolarHBondContact O-N 2.89Å; F138-Q141 VanDerWaalsContact O-N 3.17Å; F138-E142 HydrophobicContact CD2-CG 3.95Å; F138-E142 HydrophobicContact CE1-CG 4.24Å; F138-E142 HydrophobicContact CE2-CG 3.51Å; F138-E142 HydrophobicContact CG-CG 4.48Å; F138-E142 HydrophobicContact CZ-CG 3.68Å; F138-E142 WeakPolarHBondContact O-CG 3.28Å; F138-E142 PolarHBondContact O-N 2.99Å
139	L	94.1	Very high	93	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-57.1	-43.9	175.9	-73	166.8	0	0	0	111.3	L92 V96 F106 L110 T135 V136 Q141 E142 I143 F147	L92-L139 HydrophobicContact CD2-CD1 4.29Å; V96-L139 HydrophobicContact CG2-CD2 4.15Å; F106-L139 HydrophobicContact CZ-CD2 4.47Å; L110-L139 HydrophobicContact CD1-CD1 4.17Å; L110-L139 HydrophobicContact CD1-CD2 4.2Å; L110-L139 HydrophobicContact CD2-CD2 4.32Å; T135-L139 HydrophobicContact CG2-CD1 4.11Å; T135-L139 WeakPolarHBondContact O-CB 3.2Å; T135-L139 WeakPolarHBondContact O-CD1 3.36Å; T135-L139 WeakPolarHBondContact O-CG 3.49Å; T135-L139 PolarHBondContact O-N 2.78Å; V136-L139 PolarHBondContact O-N 3.32Å; L139-Q141 PolarHBondContact O-N 3.09Å; L139-E142 PolarHBondContact O-N 3.13Å; L139-I143 HydrophobicContact CB-CD1 4.13Å; L139-I143 HydrophobicContact CD2-CD1 3.76Å; L139-I143 WeakPolarHBondContact O-CB 3.34Å; L139-I143 WeakPolarHBondContact O-CG1 3.25Å; L139-I143 PolarHBondContact O-N 3.45Å; L139-F147 HydrophobicContact CB-CD2 4.26Å; L139-F147 HydrophobicContact CB-CE2 3.65Å; L139-F147 HydrophobicContact CB-CZ 4.08Å; L139-F147 HydrophobicContact CD1-CE2 4.39Å
140	S	94.2	Very high	92.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62.1	-42.1	176.2	-176.6	0	0	0	0	112.9	V136 A137 F138 R144 F179 I180 N183 T184	V136-S140 WeakPolarHBondContact O-CB 3.46Å; V136-S140 PolarHBondContact O-N 3.23Å; A137-S140 PolarHBondContact O-N 3.33Å; F138-S140 VanDerWaalsContact C-N 3.31Å; F138-S140 PolarHBondContact O-N 3.17Å; S140-R144 WeakPolarHBondContact O-CA 3.32Å; S140-R144 PolarHBondContact O-N 2.84Å; S140-F179 PolarHBondContact OG-O 2.8Å; S140-I180 WeakPolarHBondContact OG-CA 3.45Å; S140-N183 WeakPolarHBondContact O-CB 3.32Å; S140-T184 PolarHBondContact OG-OG1 3.07Å
141	Q	92.8	Very high	92.9	Very high	45 Å²	45	27.1 Å²	27.1	21%	0.21	11%	0.113	C	C	.	.	H	α-helix	trans	-63.7	-44.2	178.6	-168.3	-172.4	-100.8	0	0	112.5	A137 F138 L139	A137-Q141 PolarHBondContact O-N 2.62Å; A137-Q141 VanDerWaalsContact O-N 3.11Å; F138-Q141 PolarHBondContact O-N 2.89Å; F138-Q141 VanDerWaalsContact O-N 3.17Å; L139-Q141 PolarHBondContact O-N 3.09Å
142	E	91.5	Very high	92.8	Very high	75 Å²	75	29.2 Å²	29.2	35%	0.35	12%	0.122	S	C	.	.	H	α-helix	trans	-84.2	-29.4	-174.9	-56.9	-53	123.4	0	0	113.5	V96 L101 F138 L139	V96-E142 HydrophobicContact CG1-CB 4.12Å; V96-E142 HydrophobicContact CG1-CG 4.25Å; L101-E142 HydrophobicContact CD1-CB 3.77Å; F138-E142 HydrophobicContact CD2-CG 3.95Å; F138-E142 HydrophobicContact CE1-CG 4.24Å; F138-E142 HydrophobicContact CE2-CG 3.51Å; F138-E142 HydrophobicContact CG-CG 4.48Å; F138-E142 HydrophobicContact CZ-CG 3.68Å; F138-E142 WeakPolarHBondContact O-CG 3.28Å; F138-E142 PolarHBondContact O-N 2.99Å; L139-E142 PolarHBondContact O-N 3.13Å
143	I	90.5	Very high	92.7	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-92.3	-28.7	-177.3	-61.7	173.9	0	0	0	112.2	L101 F106 I107 L110 L139 R146 F147	L101-I143 HydrophobicContact CD2-CD1 4.44Å; L101-I143 HydrophobicContact CD2-CG1 3.76Å; F106-I143 HydrophobicContact CE1-CD1 4.16Å; I107-I143 HydrophobicContact CD1-CG2 4.15Å; L110-I143 HydrophobicContact CD2-CD1 3.37Å; L139-I143 HydrophobicContact CB-CD1 4.13Å; L139-I143 HydrophobicContact CD2-CD1 3.76Å; L139-I143 WeakPolarHBondContact O-CB 3.34Å; L139-I143 WeakPolarHBondContact O-CG1 3.25Å; L139-I143 PolarHBondContact O-N 3.45Å; I143-R146 HydrophobicContact CG2-CB 3.47Å; I143-R146 VanDerWaalsContact CG2-CB 3.47Å; I143-F147 HydrophobicContact CB-CB 4.29Å; I143-F147 HydrophobicContact CD1-CD2 4.22Å; I143-F147 HydrophobicContact CG2-CB 4Å
144	R	91	Very high	92.6	Very high	155 Å²	155	31.3 Å²	31.3	59%	0.585	14%	0.137	S	C	*	.	G	3₁₀ helix	trans	56.1	-128.3	-174.6	-55.3	-176.2	179.5	-157	-3.3	112.4	S140 R146 F147 N183 T184	S140-R144 WeakPolarHBondContact O-CA 3.32Å; S140-R144 PolarHBondContact O-N 2.84Å; R144-R146 VanDerWaalsContact C-N 3.32Å; R144-R146 PolarHBondContact O-N 3.19Å; R144-F147 WeakPolarHBondContact O-CB 3.4Å; R144-F147 PolarHBondContact O-N 2.76Å; R144-F147 VanDerWaalsContact O-N 3.07Å; R144-N183 CarbonylContact C-O 3.56Å; R144-N183 VanDerWaalsContact CA-O 3.23Å; R144-N183 WeakPolarHBondContact CA-O 3.43Å; R144-T184 PolarHBondContact O-OG1 3.13Å
145	N	88.2	Confident	92.5	Very high	14 Å²	14	31.3 Å²	31.3	8%	0.075	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-72.7	-22.4	-168.7	-51.6	-77.4	0	0	0	113.6	F147 D148 C185 D836 D838	N145-F147 PolarHBondContact O-N 2.96Å; N145-D148 WeakPolarHBondContact O-CB 3.27Å; N145-D148 PolarHBondContact O-N 3.01Å; N145-C185 PolarHBondContact OD1-N 3.41Å; N145-D836 VanDerWaalsContact ND2-CB 3.28Å; N145-D836 WeakPolarHBondContact ND2-CB 3.47Å; N145-D836 VanDerWaalsContact ND2-CG 3.33Å; N145-D836 PolarHBondContact ND2-OD1 3.37Å; N145-D836 PolarHBondContact OD1-OD1 3.46Å; N145-D838 WeakPolarHBondContact CA-OD1 3.49Å; N145-D838 WeakPolarHBondContact CB-OD1 3.39Å; N145-D838 VanDerWaalsContact CB-OD2 3.32Å; N145-D838 WeakPolarHBondContact CB-OD2 3.48Å; N145-D838 PolarHBondContact N-OD1 3.17Å
146	R	87.9	Confident	92.5	Very high	50 Å²	50	36.3 Å²	36.3	19%	0.189	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-58.1	-10.2	168	-73.6	-161.8	-63.2	176.7	2	113.2	I143 R144 D838 H839	I143-R146 HydrophobicContact CG2-CB 3.47Å; I143-R146 VanDerWaalsContact CG2-CB 3.47Å; R144-R146 VanDerWaalsContact C-N 3.32Å; R144-R146 PolarHBondContact O-N 3.19Å; R146-D838 HydrophobicContact CG-CB 3.6Å; R146-D838 WeakPolarHBondContact CG-OD1 3.38Å; R146-D838 PolarHBondContact N-OD1 3.29Å; R146-D838 PolarHBondContact N-OD2 2.88Å; R146-H839 PolarHBondContact NE-CD2 3.47Å; R146-H839 VanDerWaalsContact NE-CD2 3.29Å; R146-H839 PolarHBondContact NH2-CD2 2.87Å; R146-H839 VanDerWaalsContact NH2-CD2 3.3Å; R146-H839 PolarHBondContact NH2-CE1 2.96Å; R146-H839 VanDerWaalsContact NH2-CE1 3.29Å; R146-H839 PolarHBondContact NH2-ND1 3.44Å; R146-H839 PolarHBondContact NH2-NE2 3.37Å; R146-H839 VanDerWaalsContact NH2-NE2 3.14Å
147	F	92.1	Very high	92.4	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.009	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-83.5	-4.9	173.4	-160.2	-119.8	0	0	0	113.1	V136 L139 I143 R144 N145 R149 F150 A151 I180 T184	V136-F147 HydrophobicContact CG1-CE1 4.17Å; V136-F147 HydrophobicContact CG1-CZ 4.06Å; L139-F147 HydrophobicContact CB-CD2 4.26Å; L139-F147 HydrophobicContact CB-CE2 3.65Å; L139-F147 HydrophobicContact CB-CZ 4.08Å; L139-F147 HydrophobicContact CD1-CE2 4.39Å; I143-F147 HydrophobicContact CB-CB 4.29Å; I143-F147 HydrophobicContact CD1-CD2 4.22Å; I143-F147 HydrophobicContact CG2-CB 4Å; R144-F147 WeakPolarHBondContact O-CB 3.4Å; R144-F147 PolarHBondContact O-N 2.76Å; R144-F147 VanDerWaalsContact O-N 3.07Å; N145-F147 PolarHBondContact O-N 2.96Å; F147-R149 PolarHBondContact O-N 2.78Å; F147-F150 HydrophobicContact CD2-CB 3.87Å; F147-F150 HydrophobicContact CD2-CD1 4.26Å; F147-F150 HydrophobicContact CD2-CG 4.18Å; F147-F150 HydrophobicContact CE1-CD1 4.29Å; F147-F150 HydrophobicContact CE2-CB 3.79Å; F147-F150 AromaticContact CE2-CD1 3.33Å; F147-F150 HydrophobicContact CE2-CD1 3.33Å; F147-F150 HydrophobicContact CE2-CD2 4.47Å; F147-F150 HydrophobicContact CE2-CE1 4.01Å; F147-F150 AromaticContact CE2-CG 3.61Å; F147-F150 HydrophobicContact CE2-CG 3.61Å; F147-F150 HydrophobicContact CG-CB 4.44Å; F147-F150 HydrophobicContact CZ-CB 4.32Å; F147-F150 AromaticContact CZ-CD1 3.34Å; F147-F150 HydrophobicContact CZ-CD1 3.34Å; F147-F150 AromaticContact CZ-CE1 3.94Å; F147-F150 HydrophobicContact CZ-CE1 3.94Å; F147-F150 HydrophobicContact CZ-CG 4.08Å; F147-F150 PolarHBondContact O-N 2.92Å; F147-A151 HydrophobicContact CD1-CB 3.77Å; F147-A151 HydrophobicContact CE1-CB 4.05Å; F147-A151 WeakPolarHBondContact O-CB 3.23Å; F147-A151 PolarHBondContact O-N 3.03Å; F147-I180 HydrophobicContact CE1-CG1 4.39Å; F147-T184 HydrophobicContact CB-CG2 4.33Å
148	D	90.4	Very high	92.5	Very high	38 Å²	38	36.7 Å²	36.7	20%	0.203	16%	0.163	C	C	.	.	H	α-helix	trans	-49.4	-50.6	-170.1	83.6	-55.7	0	0	0	114.6	N145 A151 E152 T184 R188	N145-D148 WeakPolarHBondContact O-CB 3.27Å; N145-D148 PolarHBondContact O-N 3.01Å; D148-A151 PolarHBondContact O-N 3.26Å; D148-E152 VanDerWaalsContact O-CB 3.31Å; D148-E152 WeakPolarHBondContact O-CB 3.17Å; D148-E152 PolarHBondContact O-N 3.45Å; D148-T184 HydrophobicContact CB-CG2 4.5Å; D148-R188 IonicContact OD2-NH1 3.85Å; D148-R188 PolarHBondContact OD2-NH1 3.17Å; D148-R188 VanDerWaalsContact OD2-NH1 3.16Å
149	R	90.1	Very high	92.5	Very high	157 Å²	157	36.8 Å²	36.8	59%	0.592	16%	0.164	S	C	*	.	H	α-helix	trans	-68.7	-36	-178.8	-69.3	-179.6	-172.6	-133.8	1.7	112.4	F147 S153	F147-R149 PolarHBondContact O-N 2.78Å; R149-S153 PolarHBondContact O-N 3.09Å; R149-S153 PolarHBondContact O-OG 3.37Å
150	F	92.5	Very high	92.6	Very high	12 Å²	12	39.6 Å²	39.6	5%	0.053	19%	0.187	C	C	.	.	H	α-helix	trans	-73.5	-42.1	178.4	-164.3	-70.2	0	0	0	110.4	L110 E114 I117 V136 F147 E152 S153 V154	L110-F150 HydrophobicContact CD1-CE2 4.23Å; L110-F150 HydrophobicContact CG-CD2 4.23Å; L110-F150 HydrophobicContact CG-CE2 4.23Å; E114-F150 HydrophobicContact CB-CD2 4.28Å; E114-F150 HydrophobicContact CB-CE2 3.97Å; E114-F150 HydrophobicContact CG-CD2 4.13Å; E114-F150 HydrophobicContact CG-CE2 4.14Å; I117-F150 HydrophobicContact CB-CZ 4Å; I117-F150 HydrophobicContact CD1-CE2 4.33Å; I117-F150 HydrophobicContact CD1-CZ 3.7Å; I117-F150 HydrophobicContact CG1-CZ 4.43Å; I117-F150 HydrophobicContact CG2-CE1 4.18Å; I117-F150 HydrophobicContact CG2-CZ 3.95Å; V136-F150 HydrophobicContact CG2-CE1 4.47Å; F147-F150 HydrophobicContact CD2-CB 3.87Å; F147-F150 HydrophobicContact CD2-CD1 4.26Å; F147-F150 HydrophobicContact CD2-CG 4.18Å; F147-F150 HydrophobicContact CE1-CD1 4.29Å; F147-F150 HydrophobicContact CE2-CB 3.79Å; F147-F150 AromaticContact CE2-CD1 3.33Å; F147-F150 HydrophobicContact CE2-CD1 3.33Å; F147-F150 HydrophobicContact CE2-CD2 4.47Å; F147-F150 HydrophobicContact CE2-CE1 4.01Å; F147-F150 AromaticContact CE2-CG 3.61Å; F147-F150 HydrophobicContact CE2-CG 3.61Å; F147-F150 HydrophobicContact CG-CB 4.44Å; F147-F150 HydrophobicContact CZ-CB 4.32Å; F147-F150 AromaticContact CZ-CD1 3.34Å; F147-F150 HydrophobicContact CZ-CD1 3.34Å; F147-F150 AromaticContact CZ-CE1 3.94Å; F147-F150 HydrophobicContact CZ-CE1 3.94Å; F147-F150 HydrophobicContact CZ-CG 4.08Å; F147-F150 PolarHBondContact O-N 2.92Å; F150-E152 VanDerWaalsContact C-N 3.34Å; F150-E152 PolarHBondContact O-N 3.38Å; F150-S153 PolarHBondContact O-N 2.96Å; F150-S153 PolarHBondContact O-OG 3Å; F150-V154 HydrophobicContact CD1-CG1 4.09Å; F150-V154 HydrophobicContact CD1-CG2 4.49Å; F150-V154 HydrophobicContact CE1-CG1 3.74Å; F150-V154 WeakPolarHBondContact O-CG2 3.47Å; F150-V154 PolarHBondContact O-N 2.86Å
151	A	93.9	Very high	92.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-58.3	-46.7	174.3	0	0	0	0	0	111	F147 D148 L155 I180 T184 L189	F147-A151 HydrophobicContact CD1-CB 3.77Å; F147-A151 HydrophobicContact CE1-CB 4.05Å; F147-A151 WeakPolarHBondContact O-CB 3.23Å; F147-A151 PolarHBondContact O-N 3.03Å; D148-A151 PolarHBondContact O-N 3.26Å; A151-L155 WeakPolarHBondContact O-CA 3.43Å; A151-L155 VanDerWaalsContact O-CB 3.24Å; A151-L155 WeakPolarHBondContact O-CB 3.19Å; A151-L155 PolarHBondContact O-N 3.44Å; A151-I180 HydrophobicContact CB-CG2 4.04Å; A151-T184 HydrophobicContact CB-CG2 4.22Å; A151-L189 HydrophobicContact CB-CD2 4.17Å
152	E	92.7	Very high	92.7	Very high	56 Å²	56	38.1 Å²	38.1	26%	0.262	18%	0.18	S	C	.	.	H	α-helix	trans	-56	-47.6	176.8	176.2	-176.3	-135.4	0	0	112.8	D148 F150 L155 R188 L189 I192	D148-E152 VanDerWaalsContact O-CB 3.31Å; D148-E152 WeakPolarHBondContact O-CB 3.17Å; D148-E152 PolarHBondContact O-N 3.45Å; F150-E152 VanDerWaalsContact C-N 3.34Å; F150-E152 PolarHBondContact O-N 3.38Å; E152-L155 WeakPolarHBondContact O-CB 3.37Å; E152-L155 PolarHBondContact O-N 3.45Å; E152-R188 IonicContact OE1-CZ 3.54Å; E152-R188 IonicContact OE1-NE 2.82Å; E152-R188 IonicContact OE1-NH1 3.75Å; E152-R188 IonicContact OE1-NH2 3.94Å; E152-R188 PolarHBondContact OE1-NH2 3.08Å; E152-R188 IonicContact OE2-CZ 2.68Å; E152-R188 IonicContact OE2-NH1 3.58Å; E152-R188 PolarHBondContact OE2-NH1 2.84Å; E152-R188 IonicContact OE2-NH2 2.72Å; E152-R188 PolarHBondContact OE2-NH2 3.04Å; E152-L189 HydrophobicContact CB-CD2 4.19Å; E152-I192 HydrophobicContact CG-CD1 4.34Å
153	S	92.4	Very high	92.8	Very high	45 Å²	45	37.1 Å²	37.1	32%	0.315	18%	0.182	S	C	.	.	H	α-helix	trans	-72.7	-37.1	-176.5	61.9	0	0	0	0	113.5	E114 R149 F150 L155	E114-S153 VanDerWaalsContact CD-OG 3.22Å; E114-S153 WeakPolarHBondContact CG-OG 3.36Å; E114-S153 WeakPolarHBondContact OE1-CB 3.27Å; E114-S153 PolarHBondContact OE1-OG 2.8Å; R149-S153 PolarHBondContact O-N 3.09Å; R149-S153 PolarHBondContact O-OG 3.37Å; F150-S153 PolarHBondContact O-N 2.96Å; F150-S153 PolarHBondContact O-OG 3Å; S153-L155 VanDerWaalsContact C-N 3.34Å
154	V	94.4	Very high	92.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-79	-15.4	174.1	-55.4	0	0	0	0	113.6	L121 V136 F150 Q156 T157 I158	L121-V154 HydrophobicContact CD1-CB 3.8Å; L121-V154 HydrophobicContact CD1-CG1 3.91Å; V136-V154 HydrophobicContact CG1-CG2 4.38Å; F150-V154 HydrophobicContact CD1-CG1 4.09Å; F150-V154 HydrophobicContact CD1-CG2 4.49Å; F150-V154 HydrophobicContact CE1-CG1 3.74Å; F150-V154 WeakPolarHBondContact O-CG2 3.47Å; F150-V154 PolarHBondContact O-N 2.86Å; V154-Q156 VanDerWaalsContact C-N 3.33Å; V154-Q156 PolarHBondContact O-N 2.89Å; V154-T157 WeakPolarHBondContact O-CB 3.14Å; V154-T157 PolarHBondContact O-N 3Å; V154-I158 HydrophobicContact CB-CD1 4.33Å; V154-I158 HydrophobicContact CG2-CD1 3.7Å; V154-I158 HydrophobicContact CG2-CG1 4.46Å; V154-I158 WeakPolarHBondContact O-CG1 3.49Å; V154-I158 PolarHBondContact O-N 2.88Å
155	L	94.2	Very high	92.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-55.6	-46.4	-170.6	-153.9	70	0	0	0	112.4	A151 E152 S153 T157 I158 I159 M177 L189 I192 L193	A151-L155 WeakPolarHBondContact O-CA 3.43Å; A151-L155 VanDerWaalsContact O-CB 3.24Å; A151-L155 WeakPolarHBondContact O-CB 3.19Å; A151-L155 PolarHBondContact O-N 3.44Å; E152-L155 WeakPolarHBondContact O-CB 3.37Å; E152-L155 PolarHBondContact O-N 3.45Å; S153-L155 VanDerWaalsContact C-N 3.34Å; L155-T157 VanDerWaalsContact C-N 3.29Å; L155-T157 PolarHBondContact O-N 2.88Å; L155-I158 PolarHBondContact O-N 2.91Å; L155-I159 HydrophobicContact CG-CD1 4.13Å; L155-I159 WeakPolarHBondContact O-CB 3.35Å; L155-I159 VanDerWaalsContact O-CG1 3.26Å; L155-I159 WeakPolarHBondContact O-CG1 3.31Å; L155-I159 PolarHBondContact O-N 3.49Å; L155-M177 HydrophobicContact CD1-CE 3.73Å; L155-M177 HydrophobicContact CD1-SD 3.66Å; L155-M177 HydrophobicContact CG-CE 4.17Å; L155-L189 HydrophobicContact CD1-CD2 4.33Å; L155-L189 HydrophobicContact CD2-CB 4.09Å; L155-L189 HydrophobicContact CD2-CD2 3.92Å; L155-I192 HydrophobicContact CD2-CB 3.84Å; L155-I192 HydrophobicContact CD2-CD1 4.06Å; L155-I192 HydrophobicContact CD2-CG2 3.88Å; L155-L193 HydrophobicContact CD2-CD2 4.46Å; L155-L193 HydrophobicContact CD2-CG 4.2Å
156	Q	93.4	Very high	93.1	Very high	104 Å²	104	39 Å²	39	49%	0.486	22%	0.218	S	C	.	.	H	α-helix	trans	-66.1	-32.8	-177.9	-170.9	57	69	0	0	112.3	V154 A160	V154-Q156 VanDerWaalsContact C-N 3.33Å; V154-Q156 PolarHBondContact O-N 2.89Å; Q156-A160 PolarHBondContact O-N 2.88Å
157	T	95.3	Very high	93.3	Very high	8 Å²	8	40.7 Å²	40.7	5%	0.049	23%	0.227	C	C	.	.	H	α-helix	trans	-69.8	-44.6	173.5	-63.2	0	0	0	0	110.9	D118 L121 R122 V154 L155 I159 A160 L161	D118-T157 WeakPolarHBondContact OD1-CB 3.28Å; D118-T157 PolarHBondContact OD1-OG1 3.18Å; L121-T157 HydrophobicContact CB-CG2 3.63Å; L121-T157 HydrophobicContact CD1-CG2 4.41Å; R122-T157 HydrophobicContact CG-CG2 3.59Å; R122-T157 PolarHBondContact NE-OG1 3.18Å; R122-T157 PolarHBondContact NH2-OG1 2.98Å; V154-T157 WeakPolarHBondContact O-CB 3.14Å; V154-T157 PolarHBondContact O-N 3Å; L155-T157 VanDerWaalsContact C-N 3.29Å; L155-T157 PolarHBondContact O-N 2.88Å; T157-I159 VanDerWaalsContact C-N 3.34Å; T157-I159 PolarHBondContact O-N 3.44Å; T157-A160 WeakPolarHBondContact O-CB 3.35Å; T157-A160 PolarHBondContact O-N 3.08Å; T157-A160 VanDerWaalsContact O-N 3.15Å; T157-L161 PolarHBondContact O-N 3.26Å; T157-L161 VanDerWaalsContact O-N 3.16Å
158	I	96.4	Very high	93.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.8	-37.8	177.5	-59.5	173.1	0	0	0	110.9	L121 V136 V154 L155 A160 L161 L162 G173 M177 I180	L121-I158 HydrophobicContact CD1-CG1 4.29Å; V136-I158 HydrophobicContact CG1-CD1 4.02Å; V154-I158 HydrophobicContact CB-CD1 4.33Å; V154-I158 HydrophobicContact CG2-CD1 3.7Å; V154-I158 HydrophobicContact CG2-CG1 4.46Å; V154-I158 WeakPolarHBondContact O-CG1 3.49Å; V154-I158 PolarHBondContact O-N 2.88Å; L155-I158 PolarHBondContact O-N 2.91Å; I158-A160 VanDerWaalsContact C-N 3.27Å; I158-A160 PolarHBondContact O-N 2.77Å; I158-L161 WeakPolarHBondContact O-CA 3.34Å; I158-L161 WeakPolarHBondContact O-CB 3.48Å; I158-L161 PolarHBondContact O-N 3.36Å; I158-L162 PolarHBondContact O-N 3.42Å; I158-G173 WeakPolarHBondContact CG2-O 3.45Å; I158-M177 HydrophobicContact CB-CE 4.11Å; I158-M177 HydrophobicContact CG2-CB 4.19Å; I158-M177 HydrophobicContact CG2-CE 3.85Å; I158-I180 HydrophobicContact CD1-CD1 3.59Å
159	I	95.6	Very high	93.5	Very high	8 Å²	8	41.1 Å²	41.1	4%	0.041	23%	0.23	C	C	.	.	H	α-helix	trans	-58.9	-38	173.2	-71.8	164.7	0	0	0	111.5	L155 T157 L161 L162 M177 I192 L193 T204	L155-I159 HydrophobicContact CG-CD1 4.13Å; L155-I159 WeakPolarHBondContact O-CB 3.35Å; L155-I159 VanDerWaalsContact O-CG1 3.26Å; L155-I159 WeakPolarHBondContact O-CG1 3.31Å; L155-I159 PolarHBondContact O-N 3.49Å; T157-I159 VanDerWaalsContact C-N 3.34Å; T157-I159 PolarHBondContact O-N 3.44Å; I159-L161 VanDerWaalsContact C-N 3.33Å; I159-L162 HydrophobicContact CG1-CD1 4.47Å; I159-L162 WeakPolarHBondContact O-CB 3.17Å; I159-L162 PolarHBondContact O-N 2.8Å; I159-M177 HydrophobicContact CD1-CE 4.42Å; I159-M177 HydrophobicContact CG1-CE 3.67Å; I159-I192 HydrophobicContact CD1-CG2 3.83Å; I159-L193 HydrophobicContact CD1-CD2 4.3Å; I159-T204 HydrophobicContact CG2-CG2 4.11Å
160	A	94.6	Very high	93.6	Very high	60 Å²	60	34.3 Å²	34.3	50%	0.496	21%	0.208	S	C	.	.	H	α-helix	trans	-67.6	-31.3	174.1	0	0	0	0	0	112.9	Q156 T157 I158 L162	Q156-A160 PolarHBondContact O-N 2.88Å; T157-A160 WeakPolarHBondContact O-CB 3.35Å; T157-A160 PolarHBondContact O-N 3.08Å; T157-A160 VanDerWaalsContact O-N 3.15Å; I158-A160 VanDerWaalsContact C-N 3.27Å; I158-A160 PolarHBondContact O-N 2.77Å; A160-L162 VanDerWaalsContact C-N 3.35Å
161	L	95.4	Very high	93.7	Very high	11 Å²	11	35.2 Å²	35.2	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-66.4	-32.9	174.3	-62.2	179.9	0	0	0	112.7	L121 V129 T157 I158 I159 S163 N164 M169 A170	L121-L161 HydrophobicContact CD2-CD1 4.49Å; V129-L161 HydrophobicContact CG1-CD1 3.68Å; V129-L161 HydrophobicContact CG1-CD2 3.94Å; V129-L161 HydrophobicContact CG1-CG 4.48Å; T157-L161 PolarHBondContact O-N 3.26Å; T157-L161 VanDerWaalsContact O-N 3.16Å; I158-L161 WeakPolarHBondContact O-CA 3.34Å; I158-L161 WeakPolarHBondContact O-CB 3.48Å; I158-L161 PolarHBondContact O-N 3.36Å; I159-L161 VanDerWaalsContact C-N 3.33Å; L161-S163 PolarHBondContact O-N 2.97Å; L161-N164 WeakPolarHBondContact O-CB 3.5Å; L161-N164 PolarHBondContact O-N 3.06Å; L161-M169 HydrophobicContact CD2-CB 4.46Å; L161-A170 VanDerWaalsContact O-CA 3.27Å; L161-A170 WeakPolarHBondContact O-CA 3.29Å
162	L	94.8	Very high	93.8	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.016	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-32.3	-177.6	-57.3	176	0	0	0	113.5	I158 I159 A160 V174 V203 C207 F211	I158-L162 PolarHBondContact O-N 3.42Å; I159-L162 HydrophobicContact CG1-CD1 4.47Å; I159-L162 WeakPolarHBondContact O-CB 3.17Å; I159-L162 PolarHBondContact O-N 2.8Å; A160-L162 VanDerWaalsContact C-N 3.35Å; L162-V174 HydrophobicContact CD2-CB 4.34Å; L162-V174 HydrophobicContact CD2-CG2 3.68Å; L162-V203 WeakPolarHBondContact O-CG1 3.39Å; L162-C207 HydrophobicContact CD1-CB 4.1Å; L162-F211 HydrophobicContact CD1-CE2 4Å; L162-F211 HydrophobicContact CD2-CE2 4.29Å; L162-F211 HydrophobicContact CD2-CZ 4.13Å
163	S	92.8	Very high	93.9	Very high	55 Å²	55	32.6 Å²	32.6	39%	0.385	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	20.7	178.4	53.7	0	0	0	0	114.1	L161 S201 T204	L161-S163 PolarHBondContact O-N 2.97Å; S163-S201 VanDerWaalsContact CB-OG 3.26Å; S163-S201 WeakPolarHBondContact CB-OG 3.45Å; S163-T204 PolarHBondContact OG-OG1 2.7Å
164	N	93.2	Very high	94	Very high	51 Å²	51	31.8 Å²	31.8	27%	0.273	20%	0.195	S	C	.	.			trans	-71.1	142.6	177.5	-167.7	-50.5	0	0	0	111.2	L161 A166 M169 A170	L161-N164 WeakPolarHBondContact O-CB 3.5Å; L161-N164 PolarHBondContact O-N 3.06Å; N164-A166 VanDerWaalsContact C-N 3.34Å; N164-A166 WeakPolarHBondContact OD1-CB 3.49Å; N164-A166 PolarHBondContact OD1-N 2.81Å; N164-M169 HydrophobicContact CB-CB 4.26Å; N164-M169 PolarHBondContact ND2-SD 2.88Å; N164-A170 HydrophobicContact CB-CB 4.4Å
165	S	91	Very high	94.1	Very high	128 Å²	128	32.2 Å²	32.2	90%	0.895	20%	0.198	S	C	*	.	S	Bend	trans	-72.3	-24.5	179.5	56.5	0	0	0	0	113.6	K167	S165-K167 PolarHBondContact O-N 3.43Å
166	A	92.6	Very high	94.2	Very high	30 Å²	30	32.2 Å²	32.2	25%	0.248	20%	0.198	C	C	.	.	S	Bend	trans	-79.3	105.8	173.9	0	0	0	0	0	110.1	N164 V168 M169 A170	N164-A166 VanDerWaalsContact C-N 3.34Å; N164-A166 WeakPolarHBondContact OD1-CB 3.49Å; N164-A166 PolarHBondContact OD1-N 2.81Å; A166-V168 PolarHBondContact O-N 3.43Å; A166-M169 HydrophobicContact CB-CB 4.21Å; A166-M169 HydrophobicContact CB-CG 3.98Å; A166-M169 HydrophobicContact CB-SD 3.84Å; A166-M169 WeakPolarHBondContact O-CA 3.18Å; A166-M169 WeakPolarHBondContact O-CB 3.17Å; A166-M169 PolarHBondContact O-N 3.03Å; A166-A170 PolarHBondContact O-N 3.23Å
167	K	91.6	Very high	94.3	Very high	87 Å²	87	27.3 Å²	27.3	38%	0.378	17%	0.174	S	C	.	.	H	α-helix	trans	-50.7	-37.3	-176.1	-169.5	-179.9	-178.2	-176.9	0	114.1	G37 G39 S165 A170 T171	G37-K167 PolarHBondContact O-NZ 3.48Å; G39-K167 CarbonylContact O-C 3.44Å; G39-K167 WeakPolarHBondContact O-CG 3.18Å; S165-K167 PolarHBondContact O-N 3.43Å; K167-A170 PolarHBondContact O-N 3.16Å; K167-T171 HydrophobicContact CG-CG2 4.2Å; K167-T171 WeakPolarHBondContact O-CB 3.47Å; K167-T171 PolarHBondContact O-N 3.23Å; K167-T171 PolarHBondContact O-OG1 3.41Å
168	V	92.1	Very high	94.3	Very high	39 Å²	39	30.7 Å²	30.7	24%	0.236	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-44.5	176.8	175.7	0	0	0	0	111.1	G39 V41 R130 A166 S172	G39-V168 WeakPolarHBondContact O-CG2 3.11Å; G39-V168 PolarHBondContact O-N 2.83Å; V41-V168 HydrophobicContact CG2-CG1 4.16Å; R130-V168 HydrophobicContact CB-CG1 4.1Å; A166-V168 PolarHBondContact O-N 3.43Å; V168-S172 WeakPolarHBondContact O-CB 3.31Å; V168-S172 PolarHBondContact O-N 2.96Å; V168-S172 PolarHBondContact O-OG 3.03Å
169	M	93.8	Very high	94.2	Very high	9 Å²	9	30.8 Å²	30.8	4%	0.044	19%	0.187	C	C	.	.	H	α-helix	trans	-66.3	-46.6	176.6	-64.8	177.4	167.6	0	0	111.1	D123 L124 V129 L161 N164 A166 S172 G173	D123-M169 WeakPolarHBondContact O-CE 3.41Å; L124-M169 VanDerWaalsContact C-CE 3.49Å; L124-M169 VanDerWaalsContact O-CE 3.27Å; L124-M169 WeakPolarHBondContact O-CE 3.27Å; V129-M169 HydrophobicContact CB-CE 4.34Å; V129-M169 HydrophobicContact CB-CG 4.05Å; V129-M169 HydrophobicContact CG1-CB 4.21Å; V129-M169 HydrophobicContact CG1-CG 3.97Å; V129-M169 HydrophobicContact CG2-CE 3.79Å; V129-M169 HydrophobicContact CG2-CG 4.41Å; V129-M169 HydrophobicContact CG2-SD 4.45Å; L161-M169 HydrophobicContact CD2-CB 4.46Å; N164-M169 HydrophobicContact CB-CB 4.26Å; N164-M169 PolarHBondContact ND2-SD 2.88Å; A166-M169 HydrophobicContact CB-CB 4.21Å; A166-M169 HydrophobicContact CB-CG 3.98Å; A166-M169 HydrophobicContact CB-SD 3.84Å; A166-M169 WeakPolarHBondContact O-CA 3.18Å; A166-M169 WeakPolarHBondContact O-CB 3.17Å; A166-M169 PolarHBondContact O-N 3.03Å; M169-S172 PolarHBondContact O-N 3.14Å; M169-G173 PolarHBondContact O-N 2.92Å
170	A	93.8	Very high	94.2	Very high	15 Å²	15	30.4 Å²	30.4	12%	0.124	19%	0.185	C	C	.	.	H	α-helix	trans	-64.3	-46.4	-178.4	0	0	0	0	0	113.1	L161 N164 A166 K167 G173 V174	L161-A170 VanDerWaalsContact O-CA 3.27Å; L161-A170 WeakPolarHBondContact O-CA 3.29Å; N164-A170 HydrophobicContact CB-CB 4.4Å; A166-A170 PolarHBondContact O-N 3.23Å; K167-A170 PolarHBondContact O-N 3.16Å; A170-G173 PolarHBondContact O-N 3.22Å; A170-V174 WeakPolarHBondContact O-CG2 3.47Å; A170-V174 PolarHBondContact O-N 2.98Å
171	T	94.3	Very high	94.2	Very high	31 Å²	31	27.5 Å²	27.5	19%	0.19	16%	0.161	C	C	.	.	H	α-helix	trans	-67.3	-37.5	176.2	51.4	0	0	0	0	112.2	A40 V41 K167 G173 V174 V175	A40-T171 HydrophobicContact CB-CG2 4.43Å; V41-T171 PolarHBondContact N-OG1 2.83Å; K167-T171 HydrophobicContact CG-CG2 4.2Å; K167-T171 WeakPolarHBondContact O-CB 3.47Å; K167-T171 PolarHBondContact O-N 3.23Å; K167-T171 PolarHBondContact O-OG1 3.41Å; T171-G173 VanDerWaalsContact C-N 3.32Å; T171-G173 PolarHBondContact O-N 3.39Å; T171-V174 PolarHBondContact O-N 3.4Å; T171-V175 WeakPolarHBondContact O-CG2 3.46Å; T171-V175 PolarHBondContact O-N 3.11Å
172	S	94.9	Very high	94.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64	-35.2	172.4	-56.4	0	0	0	0	112.7	F46 V168 M169 A176	F46-S172 WeakPolarHBondContact CZ-O 3.39Å; V168-S172 WeakPolarHBondContact O-CB 3.31Å; V168-S172 PolarHBondContact O-N 2.96Å; V168-S172 PolarHBondContact O-OG 3.03Å; M169-S172 PolarHBondContact O-N 3.14Å; S172-A176 VanDerWaalsContact O-CB 3.24Å; S172-A176 WeakPolarHBondContact O-CB 3.41Å; S172-A176 PolarHBondContact O-N 3.1Å
173	G	95.8	Very high	94	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-67.6	-44.3	174	0	0	0	0	0	112.9	I158 M169 A170 T171 A176 M177	I158-G173 WeakPolarHBondContact CG2-O 3.45Å; M169-G173 PolarHBondContact O-N 2.92Å; A170-G173 PolarHBondContact O-N 3.22Å; T171-G173 VanDerWaalsContact C-N 3.32Å; T171-G173 PolarHBondContact O-N 3.39Å; G173-A176 PolarHBondContact O-N 3.36Å; G173-M177 WeakPolarHBondContact O-CB 3.3Å; G173-M177 PolarHBondContact O-N 3.23Å
174	V	95.1	Very high	94	Very high	29 Å²	29	28.3 Å²	28.3	18%	0.176	16%	0.16	C	C	.	.	H	α-helix	trans	-60.4	-50.1	175	171.7	0	0	0	0	110.7	L162 A170 T171 M177 R178 F211	L162-V174 HydrophobicContact CD2-CB 4.34Å; L162-V174 HydrophobicContact CD2-CG2 3.68Å; A170-V174 WeakPolarHBondContact O-CG2 3.47Å; A170-V174 PolarHBondContact O-N 2.98Å; T171-V174 PolarHBondContact O-N 3.4Å; V174-M177 PolarHBondContact O-N 2.94Å; V174-R178 WeakPolarHBondContact O-CG 3.26Å; V174-R178 PolarHBondContact O-N 2.81Å; V174-F211 HydrophobicContact CG1-CE1 4.44Å; V174-F211 HydrophobicContact CG1-CZ 4.47Å
175	V	95.4	Very high	93.9	Very high	9 Å²	9	26.4 Å²	26.4	6%	0.055	15%	0.15	C	C	.	.	H	α-helix	trans	-63.6	-44.5	-179.7	175.5	0	0	0	0	111.2	E43 F46 T171 M177 R178 F179	E43-V175 HydrophobicContact CG-CG1 3.86Å; E43-V175 HydrophobicContact CG-CG2 4.43Å; F46-V175 HydrophobicContact CB-CG1 4.09Å; F46-V175 HydrophobicContact CD1-CB 4.47Å; F46-V175 HydrophobicContact CD1-CG1 3.55Å; F46-V175 HydrophobicContact CD2-CB 4.2Å; F46-V175 HydrophobicContact CD2-CG1 3.6Å; F46-V175 HydrophobicContact CE1-CB 4.2Å; F46-V175 HydrophobicContact CE1-CG1 3.75Å; F46-V175 HydrophobicContact CE2-CB 3.92Å; F46-V175 HydrophobicContact CE2-CG1 3.81Å; F46-V175 HydrophobicContact CG-CB 4.47Å; F46-V175 HydrophobicContact CG-CG1 3.47Å; F46-V175 VanDerWaalsContact CG-CG1 3.47Å; F46-V175 HydrophobicContact CZ-CB 3.93Å; F46-V175 HydrophobicContact CZ-CG1 3.88Å; T171-V175 WeakPolarHBondContact O-CG2 3.46Å; T171-V175 PolarHBondContact O-N 3.11Å; V175-M177 VanDerWaalsContact C-N 3.33Å; V175-M177 PolarHBondContact O-N 3.34Å; V175-R178 WeakPolarHBondContact O-CB 3.27Å; V175-R178 PolarHBondContact O-N 3.37Å; V175-F179 HydrophobicContact CG1-CD2 3.91Å; V175-F179 HydrophobicContact CG1-CE2 3.85Å; V175-F179 WeakPolarHBondContact O-CD2 3.35Å; V175-F179 PolarHBondContact O-N 3.4Å; V175-F179 VanDerWaalsContact O-N 3.11Å
176	A	96.1	Very high	93.8	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60	-40.8	175.8	0	0	0	0	0	112.7	F46 C133 S172 G173 R178 F179 I180	F46-A176 HydrophobicContact CE1-CB 4.33Å; C133-A176 HydrophobicContact CB-CB 3.99Å; S172-A176 VanDerWaalsContact O-CB 3.24Å; S172-A176 WeakPolarHBondContact O-CB 3.41Å; S172-A176 PolarHBondContact O-N 3.1Å; G173-A176 PolarHBondContact O-N 3.36Å; A176-R178 PolarHBondContact O-N 3.05Å; A176-F179 PolarHBondContact O-N 3.24Å; A176-I180 WeakPolarHBondContact O-CG1 3.23Å; A176-I180 PolarHBondContact O-N 2.77Å
177	M	95.3	Very high	93.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.4	-38.1	176.2	-170.9	63.9	78.6	0	0	112.3	L155 I158 I159 G173 V174 V175 I180 L181 L193 F211	L155-M177 HydrophobicContact CD1-CE 3.73Å; L155-M177 HydrophobicContact CD1-SD 3.66Å; L155-M177 HydrophobicContact CG-CE 4.17Å; I158-M177 HydrophobicContact CB-CE 4.11Å; I158-M177 HydrophobicContact CG2-CB 4.19Å; I158-M177 HydrophobicContact CG2-CE 3.85Å; I159-M177 HydrophobicContact CD1-CE 4.42Å; I159-M177 HydrophobicContact CG1-CE 3.67Å; G173-M177 WeakPolarHBondContact O-CB 3.3Å; G173-M177 PolarHBondContact O-N 3.23Å; V174-M177 PolarHBondContact O-N 2.94Å; V175-M177 VanDerWaalsContact C-N 3.33Å; V175-M177 PolarHBondContact O-N 3.34Å; M177-I180 PolarHBondContact O-N 3.29Å; M177-L181 HydrophobicContact CG-CD1 4.07Å; M177-L181 HydrophobicContact CG-CG 4.49Å; M177-L181 WeakPolarHBondContact O-CG 3.18Å; M177-L181 PolarHBondContact O-N 3.41Å; M177-L181 HydrophobicContact SD-CD1 4.35Å; M177-L181 HydrophobicContact SD-CG 4.39Å; M177-L193 HydrophobicContact CE-CD2 4.18Å; M177-L193 HydrophobicContact SD-CD2 4.06Å; M177-F211 HydrophobicContact CB-CE1 4.29Å; M177-F211 HydrophobicContact CB-CE2 4.04Å; M177-F211 HydrophobicContact CB-CZ 3.73Å; M177-F211 HydrophobicContact CG-CD2 3.84Å; M177-F211 HydrophobicContact CG-CE1 4.18Å; M177-F211 HydrophobicContact CG-CE2 3.41Å; M177-F211 VanDerWaalsContact CG-CE2 3.41Å; M177-F211 HydrophobicContact CG-CG 4.43Å; M177-F211 HydrophobicContact CG-CZ 3.6Å
178	R	94.9	Very high	93.6	Very high	80 Å²	80	22.8 Å²	22.8	30%	0.302	12%	0.118	S	C	.	.	H	α-helix	trans	-59.1	-49.3	172.7	-67.7	-171.3	172.8	-171.8	-1.8	111.4	E43 V174 V175 A176 I180 L181 E182 E210 F211 I214	E43-R178 WeakPolarHBondContact OE1-CD 3.46Å; E43-R178 IonicContact OE1-CZ 2.72Å; E43-R178 IonicContact OE1-NE 3.62Å; E43-R178 IonicContact OE1-NH1 3.8Å; E43-R178 PolarHBondContact OE1-NH1 2.74Å; V174-R178 WeakPolarHBondContact O-CG 3.26Å; V174-R178 PolarHBondContact O-N 2.81Å; V175-R178 WeakPolarHBondContact O-CB 3.27Å; V175-R178 PolarHBondContact O-N 3.37Å; A176-R178 PolarHBondContact O-N 3.05Å; R178-I180 VanDerWaalsContact C-N 3.31Å; R178-I180 PolarHBondContact O-N 3.03Å; R178-L181 PolarHBondContact O-N 3.46Å; R178-E182 WeakPolarHBondContact O-CG 3.27Å; R178-E182 PolarHBondContact O-N 2.98Å; R178-E210 IonicContact CZ-OE1 3.81Å; R178-E210 IonicContact NE-OE1 2.66Å; R178-E210 PolarHBondContact NE-OE1 2.74Å; R178-E210 IonicContact NH2-OE1 2.69Å; R178-E210 PolarHBondContact NH2-OE1 2.77Å; R178-F211 HydrophobicContact CG-CD1 4.47Å; R178-F211 HydrophobicContact CG-CE1 4Å; R178-I214 HydrophobicContact CB-CD1 4.03Å; R178-I214 HydrophobicContact CG-CD1 3.69Å
179	F	94.9	Very high	93.7	Very high	1 Å²	1	20.9 Å²	20.9	0%	0.004	11%	0.107	C	C	.	.	H	α-helix	trans	-59.3	-39.7	178.1	-86.5	-82.4	0	0	0	112.8	E43 F46 R47 F50 A137 S140 V175 A176 N183	E43-F179 HydrophobicContact CB-CE2 4.46Å; E43-F179 HydrophobicContact CG-CE2 4.14Å; F46-F179 HydrophobicContact CB-CE2 4.13Å; F46-F179 HydrophobicContact CD1-CD2 4.34Å; F46-F179 HydrophobicContact CD1-CE2 4.3Å; R47-F179 HydrophobicContact CG-CZ 4.06Å; F50-F179 HydrophobicContact CE2-CD1 4.44Å; F50-F179 AromaticContact CE2-CE1 3.67Å; F50-F179 HydrophobicContact CE2-CE1 3.67Å; F50-F179 AromaticContact CE2-CZ 3.85Å; F50-F179 HydrophobicContact CE2-CZ 3.85Å; F50-F179 AromaticContact CZ-CD1 3.99Å; F50-F179 HydrophobicContact CZ-CD1 3.99Å; F50-F179 HydrophobicContact CZ-CD2 4.42Å; F50-F179 AromaticContact CZ-CE1 3.48Å; F50-F179 HydrophobicContact CZ-CE1 3.48Å; F50-F179 VanDerWaalsContact CZ-CE1 3.48Å; F50-F179 AromaticContact CZ-CE2 3.97Å; F50-F179 HydrophobicContact CZ-CE2 3.97Å; F50-F179 HydrophobicContact CZ-CG 4.44Å; F50-F179 AromaticContact CZ-CZ 3.47Å; F50-F179 HydrophobicContact CZ-CZ 3.47Å; F50-F179 VanDerWaalsContact CZ-CZ 3.47Å; A137-F179 HydrophobicContact CB-CB 3.72Å; A137-F179 HydrophobicContact CB-CD2 3.83Å; A137-F179 HydrophobicContact CB-CG 3.78Å; S140-F179 PolarHBondContact OG-O 2.8Å; V175-F179 HydrophobicContact CG1-CD2 3.91Å; V175-F179 HydrophobicContact CG1-CE2 3.85Å; V175-F179 WeakPolarHBondContact O-CD2 3.35Å; V175-F179 PolarHBondContact O-N 3.4Å; V175-F179 VanDerWaalsContact O-N 3.11Å; A176-F179 PolarHBondContact O-N 3.24Å; F179-N183 PolarHBondContact O-N 2.76Å; F179-N183 PolarHBondContact O-ND2 3.28Å
180	I	95.7	Very high	93.6	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60.4	-50	174.1	-67.4	167.5	0	0	0	111	V136 S140 F147 A151 I158 A176 M177 R178 E182 N183 T184 L189	V136-I180 HydrophobicContact CG1-CD1 3.93Å; V136-I180 HydrophobicContact CG1-CG1 4.36Å; S140-I180 WeakPolarHBondContact OG-CA 3.45Å; F147-I180 HydrophobicContact CE1-CG1 4.39Å; A151-I180 HydrophobicContact CB-CG2 4.04Å; I158-I180 HydrophobicContact CD1-CD1 3.59Å; A176-I180 WeakPolarHBondContact O-CG1 3.23Å; A176-I180 PolarHBondContact O-N 2.77Å; M177-I180 PolarHBondContact O-N 3.29Å; R178-I180 VanDerWaalsContact C-N 3.31Å; R178-I180 PolarHBondContact O-N 3.03Å; I180-E182 VanDerWaalsContact C-N 3.33Å; I180-E182 PolarHBondContact O-N 3.15Å; I180-N183 PolarHBondContact O-N 3.2Å; I180-T184 WeakPolarHBondContact O-CA 3.42Å; I180-T184 WeakPolarHBondContact O-CB 3.47Å; I180-T184 PolarHBondContact O-N 2.98Å; I180-L189 HydrophobicContact CG2-CD1 4.14Å
181	L	94.9	Very high	93.4	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-76	-17.8	-174.7	-61.8	177.1	0	0	0	114.4	M177 R178 L189 L193 F211 I214 T218 W219	M177-L181 HydrophobicContact CG-CD1 4.07Å; M177-L181 HydrophobicContact CG-CG 4.49Å; M177-L181 WeakPolarHBondContact O-CG 3.18Å; M177-L181 PolarHBondContact O-N 3.41Å; M177-L181 HydrophobicContact SD-CD1 4.35Å; M177-L181 HydrophobicContact SD-CG 4.39Å; R178-L181 PolarHBondContact O-N 3.46Å; L181-L189 HydrophobicContact CD2-CD1 4.47Å; L181-L193 HydrophobicContact CD1-CD1 4.43Å; L181-L193 HydrophobicContact CD2-CD1 3.73Å; L181-F211 HydrophobicContact CD1-CB 3.63Å; L181-F211 HydrophobicContact CD1-CD1 4.34Å; L181-F211 HydrophobicContact CD1-CD2 4.23Å; L181-F211 HydrophobicContact CD1-CG 3.82Å; L181-I214 HydrophobicContact CB-CG2 4.04Å; L181-T218 PolarHBondContact O-OG1 2.9Å; L181-W219 HydrophobicContact CD2-CZ2 4.03Å; L181-W219 PolarHBondContact O-NE1 2.85Å
182	E	94.1	Very high	93.4	Very high	52 Å²	52	23.9 Å²	23.9	24%	0.243	12%	0.124	C	C	.	.	H	α-helix	trans	-84.3	-23.3	171.3	-71.9	-162.1	140.8	0	0	114	R178 I180 I214 R217 T218	R178-E182 WeakPolarHBondContact O-CG 3.27Å; R178-E182 PolarHBondContact O-N 2.98Å; I180-E182 VanDerWaalsContact C-N 3.33Å; I180-E182 PolarHBondContact O-N 3.15Å; E182-I214 HydrophobicContact CG-CG2 3.66Å; E182-R217 IonicContact OE1-CZ 2.73Å; E182-R217 VanDerWaalsContact OE1-CZ 3.29Å; E182-R217 IonicContact OE1-NH1 3.97Å; E182-R217 PolarHBondContact OE1-NH1 3.01Å; E182-R217 IonicContact OE1-NH2 2.93Å; E182-R217 PolarHBondContact OE1-NH2 2.83Å; E182-T218 HydrophobicContact CG-CG2 4.28Å
183	N	92.4	Very high	93.3	Very high	34 Å²	34	24 Å²	24	18%	0.182	12%	0.124	C	C	.	.	H	α-helix	trans	-123.3	-9.8	-172.1	-59.4	-89.5	0	0	0	115.1	S140 R144 F179 I180	S140-N183 WeakPolarHBondContact O-CB 3.32Å; R144-N183 CarbonylContact C-O 3.56Å; R144-N183 VanDerWaalsContact CA-O 3.23Å; R144-N183 WeakPolarHBondContact CA-O 3.43Å; F179-N183 PolarHBondContact O-N 2.76Å; F179-N183 PolarHBondContact O-ND2 3.28Å; I180-N183 PolarHBondContact O-N 3.2Å
184	T	91.8	Very high	93.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.126	C	C	.	.			trans	-130	87.6	-176.3	-50.1	0	0	0	0	110.6	S140 R144 F147 D148 A151 I180 S186	S140-T184 PolarHBondContact OG-OG1 3.07Å; R144-T184 PolarHBondContact O-OG1 3.13Å; F147-T184 HydrophobicContact CB-CG2 4.33Å; D148-T184 HydrophobicContact CB-CG2 4.5Å; A151-T184 HydrophobicContact CB-CG2 4.22Å; I180-T184 WeakPolarHBondContact O-CA 3.42Å; I180-T184 WeakPolarHBondContact O-CB 3.47Å; I180-T184 PolarHBondContact O-N 2.98Å; T184-S186 VanDerWaalsContact C-N 3.3Å; T184-S186 PolarHBondContact O-N 3.13Å
185	C	90.7	Very high	93.1	Very high	10 Å²	10	26.2 Å²	26.2	7%	0.068	14%	0.14	C	C	.	.			trans	-82	57.3	-174.6	-69.4	0	0	0	0	113.1	N145 I223 D836	N145-C185 PolarHBondContact OD1-N 3.41Å; C185-I223 HydrophobicContact CB-CD1 4.33Å; C185-I223 WeakPolarHBondContact O-CD1 3.37Å; C185-D836 WeakPolarHBondContact CB-OD2 3.36Å; C185-D836 PolarHBondContact SG-OD2 2.98Å
186	S	89.2	Confident	93	Very high	15 Å²	15	26.3 Å²	26.3	11%	0.105	14%	0.142	C	C	.	.			trans	-99.2	123.8	-178.1	-177.6	0	0	0	0	113.3	T184 R188 L189 W219	T184-S186 VanDerWaalsContact C-N 3.3Å; T184-S186 PolarHBondContact O-N 3.13Å; S186-R188 PolarHBondContact O-N 2.93Å; S186-R188 VanDerWaalsContact O-N 3.1Å; S186-R188 PolarHBondContact OG-N 3.25Å; S186-L189 WeakPolarHBondContact O-CB 3.37Å; S186-L189 WeakPolarHBondContact O-CG 3.42Å; S186-L189 PolarHBondContact O-N 2.79Å; S186-L189 VanDerWaalsContact O-N 3.12Å; S186-W219 WeakPolarHBondContact O-CH2 3.45Å
187	S	90.2	Very high	92.8	Very high	54 Å²	54	26.9 Å²	26.9	38%	0.378	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-56.7	-26.6	175.7	55.3	0	0	0	0	113.5	L189 L190 P191	S187-L189 PolarHBondContact O-N 3.26Å; S187-L190 PolarHBondContact O-N 3.41Å; S187-L190 VanDerWaalsContact O-N 3.11Å; S187-P191 WeakPolarHBondContact O-CD 3.4Å
188	R	90.3	Very high	92.6	Very high	100 Å²	100	31.1 Å²	31.1	38%	0.377	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-63.1	-21.6	-179.8	-55.2	174.5	73.6	-133.1	-8.1	112.6	D148 E152 S186	D148-R188 IonicContact OD2-NH1 3.85Å; D148-R188 PolarHBondContact OD2-NH1 3.17Å; D148-R188 VanDerWaalsContact OD2-NH1 3.16Å; E152-R188 IonicContact OE1-CZ 3.54Å; E152-R188 IonicContact OE1-NE 2.82Å; E152-R188 IonicContact OE1-NH1 3.75Å; E152-R188 IonicContact OE1-NH2 3.94Å; E152-R188 PolarHBondContact OE1-NH2 3.08Å; E152-R188 IonicContact OE2-CZ 2.68Å; E152-R188 IonicContact OE2-NH1 3.58Å; E152-R188 PolarHBondContact OE2-NH1 2.84Å; E152-R188 IonicContact OE2-NH2 2.72Å; E152-R188 PolarHBondContact OE2-NH2 3.04Å; S186-R188 PolarHBondContact O-N 2.93Å; S186-R188 VanDerWaalsContact O-N 3.1Å; S186-R188 PolarHBondContact OG-N 3.25Å
189	L	93.2	Very high	92.6	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-78.2	-27.6	177	-50.1	176.9	0	0	0	112.6	A151 E152 L155 I180 L181 S186 S187 I192 L193	A151-L189 HydrophobicContact CB-CD2 4.17Å; E152-L189 HydrophobicContact CB-CD2 4.19Å; L155-L189 HydrophobicContact CD1-CD2 4.33Å; L155-L189 HydrophobicContact CD2-CB 4.09Å; L155-L189 HydrophobicContact CD2-CD2 3.92Å; I180-L189 HydrophobicContact CG2-CD1 4.14Å; L181-L189 HydrophobicContact CD2-CD1 4.47Å; S186-L189 WeakPolarHBondContact O-CB 3.37Å; S186-L189 WeakPolarHBondContact O-CG 3.42Å; S186-L189 PolarHBondContact O-N 2.79Å; S186-L189 VanDerWaalsContact O-N 3.12Å; S187-L189 PolarHBondContact O-N 3.26Å; L189-I192 PolarHBondContact O-N 3.33Å; L189-L193 HydrophobicContact CB-CD1 4.06Å; L189-L193 WeakPolarHBondContact O-CD1 3.35Å; L189-L193 VanDerWaalsContact O-CG 3.31Å; L189-L193 WeakPolarHBondContact O-CG 3.12Å; L189-L193 PolarHBondContact O-N 2.92Å; L189-L193 VanDerWaalsContact O-N 3.11Å
190	L	92.1	Very high	92.4	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-44.7	-173	-68.8	176	0	0	0	114	S187 I192 L193 I194 I215 W219 N227 L231	S187-L190 PolarHBondContact O-N 3.41Å; S187-L190 VanDerWaalsContact O-N 3.11Å; L190-I192 VanDerWaalsContact C-N 3.3Å; L190-I192 PolarHBondContact O-N 3.46Å; L190-L193 PolarHBondContact O-N 2.87Å; L190-I194 HydrophobicContact CB-CD1 4.28Å; L190-I194 HydrophobicContact CD2-CD1 4.35Å; L190-I194 WeakPolarHBondContact O-CB 3.35Å; L190-I194 WeakPolarHBondContact O-CG1 3.16Å; L190-I194 PolarHBondContact O-N 2.89Å; L190-I215 HydrophobicContact CD2-CD1 4.04Å; L190-I215 HydrophobicContact CD2-CG2 4.49Å; L190-W219 HydrophobicContact CD1-CE3 4.48Å; L190-W219 HydrophobicContact CD1-CZ3 3.73Å; L190-W219 HydrophobicContact CD2-CH2 3.85Å; L190-W219 HydrophobicContact CD2-CZ3 3.72Å; L190-W219 HydrophobicContact CG-CH2 3.87Å; L190-W219 HydrophobicContact CG-CZ3 3.59Å; L190-N227 HydrophobicContact CD1-CB 3.59Å; L190-L231 HydrophobicContact CD2-CD2 4.35Å
191	P	90.6	Very high	92.4	Very high	77 Å²	77	40.4 Å²	40.4	50%	0.5	23%	0.225	S	C	.	.	H	α-helix	trans	-60.1	-38	178.6	-25.9	36	0	0	0	113.4	S187 S195	S187-P191 WeakPolarHBondContact O-CD 3.4Å; P191-S195 WeakPolarHBondContact O-CB 3.45Å; P191-S195 PolarHBondContact O-N 3.02Å; P191-S195 PolarHBondContact O-OG 2.88Å
192	I	93	Very high	92.3	Very high	40 Å²	40	44 Å²	44	21%	0.205	24%	0.244	C	C	.	.	H	α-helix	trans	-72.8	-41.2	-178.5	-53.6	170.8	0	0	0	110.6	E152 L155 I159 L189 L190 S195 S196	E152-I192 HydrophobicContact CG-CD1 4.34Å; L155-I192 HydrophobicContact CD2-CB 3.84Å; L155-I192 HydrophobicContact CD2-CD1 4.06Å; L155-I192 HydrophobicContact CD2-CG2 3.88Å; I159-I192 HydrophobicContact CD1-CG2 3.83Å; L189-I192 PolarHBondContact O-N 3.33Å; L190-I192 VanDerWaalsContact C-N 3.3Å; L190-I192 PolarHBondContact O-N 3.46Å; I192-S195 PolarHBondContact O-OG 3.36Å; I192-S195 VanDerWaalsContact O-OG 3.12Å; I192-S196 PolarHBondContact O-N 2.69Å; I192-S196 PolarHBondContact O-OG 2.83Å
193	L	94.1	Very high	92.3	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-67.4	-47.1	176	-66.6	162.5	0	0	0	111.6	L155 I159 M177 L181 L189 L190 S196 I208	L155-L193 HydrophobicContact CD2-CD2 4.46Å; L155-L193 HydrophobicContact CD2-CG 4.2Å; I159-L193 HydrophobicContact CD1-CD2 4.3Å; M177-L193 HydrophobicContact CE-CD2 4.18Å; M177-L193 HydrophobicContact SD-CD2 4.06Å; L181-L193 HydrophobicContact CD1-CD1 4.43Å; L181-L193 HydrophobicContact CD2-CD1 3.73Å; L189-L193 HydrophobicContact CB-CD1 4.06Å; L189-L193 WeakPolarHBondContact O-CD1 3.35Å; L189-L193 VanDerWaalsContact O-CG 3.31Å; L189-L193 WeakPolarHBondContact O-CG 3.12Å; L189-L193 PolarHBondContact O-N 2.92Å; L189-L193 VanDerWaalsContact O-N 3.11Å; L190-L193 PolarHBondContact O-N 2.87Å; L193-S196 VanDerWaalsContact O-CB 3.28Å; L193-S196 WeakPolarHBondContact O-CB 3.08Å; L193-S196 PolarHBondContact O-N 2.89Å; L193-S196 VanDerWaalsContact O-N 3.16Å; L193-I208 HydrophobicContact CB-CD1 4.48Å; L193-I208 HydrophobicContact CD2-CD1 3.9Å; L193-I208 WeakPolarHBondContact O-CG2 3.33Å
194	I	93.3	Very high	92.4	Very high	7 Å²	7	43.1 Å²	43.1	4%	0.036	24%	0.243	C	C	.	.	H	α-helix	trans	-76.5	-33.6	-173.4	-64.7	170.5	0	0	0	111.5	L190 S196 L197 V230 L231 A234	L190-I194 HydrophobicContact CB-CD1 4.28Å; L190-I194 HydrophobicContact CD2-CD1 4.35Å; L190-I194 WeakPolarHBondContact O-CB 3.35Å; L190-I194 WeakPolarHBondContact O-CG1 3.16Å; L190-I194 PolarHBondContact O-N 2.89Å; I194-S196 PolarHBondContact O-N 3.42Å; I194-L197 HydrophobicContact CG2-CD1 4.37Å; I194-L197 VanDerWaalsContact O-CB 3.3Å; I194-L197 WeakPolarHBondContact O-CB 3.49Å; I194-L197 PolarHBondContact O-N 2.77Å; I194-L197 VanDerWaalsContact O-N 3.09Å; I194-V230 HydrophobicContact CB-CG1 4.31Å; I194-V230 HydrophobicContact CD1-CB 4.32Å; I194-V230 HydrophobicContact CD1-CG1 3.67Å; I194-V230 HydrophobicContact CG2-CG1 4.06Å; I194-L231 HydrophobicContact CD1-CD2 4.39Å; I194-A234 HydrophobicContact CD1-CB 4.05Å; I194-A234 HydrophobicContact CG1-CB 4.03Å; I194-A234 HydrophobicContact CG2-CB 3.91Å
195	S	92.5	Very high	92.6	Very high	68 Å²	68	45 Å²	45	48%	0.476	25%	0.25	S	S	.	.	H	α-helix	trans	-62.8	-27.9	168.1	58.7	0	0	0	0	112.6	P191 I192 L197 S198	P191-S195 WeakPolarHBondContact O-CB 3.45Å; P191-S195 PolarHBondContact O-N 3.02Å; P191-S195 PolarHBondContact O-OG 2.88Å; I192-S195 PolarHBondContact O-OG 3.36Å; I192-S195 VanDerWaalsContact O-OG 3.12Å; S195-L197 PolarHBondContact O-N 3.1Å; S195-S198 WeakPolarHBondContact O-CB 3.35Å; S195-S198 PolarHBondContact O-N 3.38Å
196	S	93.1	Very high	92.8	Very high	12 Å²	12	46.8 Å²	46.8	8%	0.084	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-68.5	-11.5	173.9	-61.4	0	0	0	0	114.1	I192 L193 I194 S198 S199	I192-S196 PolarHBondContact O-N 2.69Å; I192-S196 PolarHBondContact O-OG 2.83Å; L193-S196 VanDerWaalsContact O-CB 3.28Å; L193-S196 WeakPolarHBondContact O-CB 3.08Å; L193-S196 PolarHBondContact O-N 2.89Å; L193-S196 VanDerWaalsContact O-N 3.16Å; I194-S196 PolarHBondContact O-N 3.42Å; S196-S198 PolarHBondContact O-N 3.41Å; S196-S199 WeakPolarHBondContact O-CB 3.43Å; S196-S199 PolarHBondContact O-N 3.31Å; S196-S199 VanDerWaalsContact O-N 3.08Å
197	L	92.9	Very high	93.1	Very high	12 Å²	12	46.5 Å²	46.5	6%	0.063	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-66.7	-15.1	164.5	-67.6	173.8	0	0	0	112.9	I194 S195 S199 R205 I208 A234 R237	I194-L197 HydrophobicContact CG2-CD1 4.37Å; I194-L197 VanDerWaalsContact O-CB 3.3Å; I194-L197 WeakPolarHBondContact O-CB 3.49Å; I194-L197 PolarHBondContact O-N 2.77Å; I194-L197 VanDerWaalsContact O-N 3.09Å; S195-L197 PolarHBondContact O-N 3.1Å; L197-S199 VanDerWaalsContact C-N 3.27Å; L197-R205 WeakPolarHBondContact O-CD 3.46Å; L197-I208 HydrophobicContact CD1-CG2 4.43Å; L197-I208 HydrophobicContact CD2-CB 3.77Å; L197-I208 HydrophobicContact CD2-CG2 3.63Å; L197-I208 HydrophobicContact CG-CB 4.34Å; L197-I208 HydrophobicContact CG-CG2 3.76Å; L197-A234 HydrophobicContact CD1-CB 3.85Å; L197-R237 HydrophobicContact CD1-CB 4.34Å
198	S	91.6	Very high	93.3	Very high	88 Å²	88	44.1 Å²	44.1	62%	0.615	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-86.3	6	170.2	-63.9	0	0	0	0	113.1	S195 S196 R237	S195-S198 WeakPolarHBondContact O-CB 3.35Å; S195-S198 PolarHBondContact O-N 3.38Å; S196-S198 PolarHBondContact O-N 3.41Å; S198-R237 PolarHBondContact OG-NH1 3.11Å
199	S	92.9	Very high	93.5	Very high	37 Å²	37	39.3 Å²	39.3	26%	0.259	22%	0.22	S	C	.	.			trans	-66.1	138.4	179.3	-176.4	0	0	0	0	112.8	S196 L197 S201 R205	S196-S199 WeakPolarHBondContact O-CB 3.43Å; S196-S199 PolarHBondContact O-N 3.31Å; S196-S199 VanDerWaalsContact O-N 3.08Å; L197-S199 VanDerWaalsContact C-N 3.27Å; S199-S201 PolarHBondContact O-N 3.22Å; S199-S201 PolarHBondContact OG-N 3.42Å; S199-R205 WeakPolarHBondContact O-CD 3.43Å; S199-R205 PolarHBondContact O-NH1 3.47Å
200	K	92.6	Very high	93.6	Very high	210 Å²	210	40.7 Å²	40.7	91%	0.913	23%	0.226	S	C	*	.	S	Bend	trans	-60.4	-29.6	172.5	-64	-179.2	-179.6	178	0	112	N202 R205	K200-N202 PolarHBondContact O-N 3.03Å; K200-R205 PolarHBondContact O-NH1 3.29Å
201	S	93.9	Very high	93.8	Very high	29 Å²	29	40.8 Å²	40.8	20%	0.203	23%	0.227	C	C	.	.			trans	-73.5	113.9	177.4	167.8	0	0	0	0	111.1	S163 S199 V203 T204 R205	S163-S201 VanDerWaalsContact CB-OG 3.26Å; S163-S201 WeakPolarHBondContact CB-OG 3.45Å; S199-S201 PolarHBondContact O-N 3.22Å; S199-S201 PolarHBondContact OG-N 3.42Å; S201-V203 VanDerWaalsContact C-N 3.27Å; S201-V203 PolarHBondContact O-N 2.94Å; S201-T204 WeakPolarHBondContact CB-OG1 3.27Å; S201-T204 PolarHBondContact O-N 3.07Å; S201-T204 PolarHBondContact OG-N 2.91Å; S201-T204 VanDerWaalsContact OG-N 3.07Å; S201-T204 PolarHBondContact OG-OG1 3.32Å; S201-R205 PolarHBondContact O-N 3.17Å; S201-R205 VanDerWaalsContact O-N 3.16Å
202	N	93.8	Very high	94	Very high	75 Å²	75	37.2 Å²	37.2	40%	0.401	20%	0.203	S	C	.	.	H	α-helix	trans	-65.3	-32.3	173.8	73.3	-51.8	0	0	0	111.8	K200 T204 R205 K206 D243	K200-N202 PolarHBondContact O-N 3.03Å; N202-T204 VanDerWaalsContact C-N 3.31Å; N202-T204 PolarHBondContact O-N 3.35Å; N202-R205 PolarHBondContact O-N 3.45Å; N202-K206 VanDerWaalsContact O-CB 3.27Å; N202-K206 WeakPolarHBondContact O-CB 3.35Å; N202-K206 PolarHBondContact O-N 2.83Å; N202-D243 HydrophobicContact CB-CB 4.45Å; N202-D243 PolarHBondContact ND2-OD1 3.32Å
203	V	94.2	Very high	94	Very high	64 Å²	64	37.5 Å²	37.5	39%	0.388	20%	0.204	S	C	.	.	H	α-helix	trans	-58.9	-43.5	173.5	-177.1	0	0	0	0	110.8	L162 S201 C207	L162-V203 WeakPolarHBondContact O-CG1 3.39Å; S201-V203 VanDerWaalsContact C-N 3.27Å; S201-V203 PolarHBondContact O-N 2.94Å; V203-C207 PolarHBondContact O-N 3.1Å; V203-C207 VanDerWaalsContact O-N 3.08Å; V203-C207 PolarHBondContact O-SG 3.18Å
204	T	95	Very high	94	Very high	4 Å²	4	37.9 Å²	37.9	3%	0.025	21%	0.206	C	C	.	.	H	α-helix	trans	-64	-50.4	176.4	-51.8	0	0	0	0	110.5	I159 S163 S201 N202 K206 C207 I208	I159-T204 HydrophobicContact CG2-CG2 4.11Å; S163-T204 PolarHBondContact OG-OG1 2.7Å; S201-T204 WeakPolarHBondContact CB-OG1 3.27Å; S201-T204 PolarHBondContact O-N 3.07Å; S201-T204 PolarHBondContact OG-N 2.91Å; S201-T204 VanDerWaalsContact OG-N 3.07Å; S201-T204 PolarHBondContact OG-OG1 3.32Å; N202-T204 VanDerWaalsContact C-N 3.31Å; N202-T204 PolarHBondContact O-N 3.35Å; T204-K206 PolarHBondContact O-N 3.27Å; T204-C207 PolarHBondContact O-N 3.08Å; T204-C207 VanDerWaalsContact O-N 3.16Å; T204-I208 WeakPolarHBondContact O-CG1 3.35Å; T204-I208 PolarHBondContact O-N 3.46Å
205	R	95.2	Very high	94	Very high	39 Å²	39	37.8 Å²	37.8	15%	0.147	21%	0.205	C	C	.	.	H	α-helix	trans	-60	-43.6	179.5	-59.9	-164.3	-51	-83.1	0.6	112.5	L197 S199 K200 S201 N202 C207 I208 C209 D241	L197-R205 WeakPolarHBondContact O-CD 3.46Å; S199-R205 WeakPolarHBondContact O-CD 3.43Å; S199-R205 PolarHBondContact O-NH1 3.47Å; K200-R205 PolarHBondContact O-NH1 3.29Å; S201-R205 PolarHBondContact O-N 3.17Å; S201-R205 VanDerWaalsContact O-N 3.16Å; N202-R205 PolarHBondContact O-N 3.45Å; R205-C207 PolarHBondContact O-N 3.45Å; R205-I208 PolarHBondContact O-N 2.64Å; R205-C209 PolarHBondContact O-N 3.48Å; R205-C209 PolarHBondContact O-SG 2.78Å; R205-C209 VanDerWaalsContact O-SG 3.38Å; R205-D241 WeakPolarHBondContact CD-OD2 3.34Å; R205-D241 IonicContact CZ-OD1 3.71Å; R205-D241 IonicContact CZ-OD2 2.99Å; R205-D241 IonicContact NE-OD1 3.88Å; R205-D241 PolarHBondContact NE-OD1 2.94Å; R205-D241 IonicContact NE-OD2 3.21Å; R205-D241 PolarHBondContact NE-OD2 2.82Å; R205-D241 IonicContact NH2-OD1 3.29Å; R205-D241 PolarHBondContact NH2-OD1 3.31Å; R205-D241 IonicContact NH2-OD2 3.38Å
206	K	94.9	Very high	94.1	Very high	48 Å²	48	34.6 Å²	34.6	21%	0.209	18%	0.183	C	C	.	.	H	α-helix	trans	-52.4	-51.2	172.2	174.4	-169.6	174.8	174.9	0	111.5	N202 T204 C209 E210 E245 F249	N202-K206 VanDerWaalsContact O-CB 3.27Å; N202-K206 WeakPolarHBondContact O-CB 3.35Å; N202-K206 PolarHBondContact O-N 2.83Å; T204-K206 PolarHBondContact O-N 3.27Å; K206-C209 PolarHBondContact O-N 3.42Å; K206-E210 PolarHBondContact O-N 3.14Å; K206-E245 HydrophobicContact CD-CB 3.9Å; K206-E245 WeakPolarHBondContact CD-OE2 3.44Å; K206-E245 VanDerWaalsContact CE-OE1 3.29Å; K206-E245 WeakPolarHBondContact CE-OE1 3.17Å; K206-E245 VanDerWaalsContact CE-OE2 3.3Å; K206-E245 WeakPolarHBondContact CE-OE2 3.32Å; K206-E245 HydrophobicContact CG-CB 3.98Å; K206-E245 IonicContact NZ-OE1 2.74Å; K206-E245 PolarHBondContact NZ-OE1 3.41Å; K206-E245 IonicContact NZ-OE2 2.78Å; K206-E245 PolarHBondContact NZ-OE2 3.37Å; K206-F249 HydrophobicContact CD-CE2 4.48Å; K206-F249 HydrophobicContact CG-CD2 4.16Å; K206-F249 HydrophobicContact CG-CE2 3.9Å
207	C	95	Very high	94.1	Very high	9 Å²	9	40.2 Å²	40.2	6%	0.061	20%	0.202	C	C	.	.	H	α-helix	trans	-64	-41.3	-179.6	-63.6	0	0	0	0	111.9	L162 V203 T204 R205 C209 E210 F211	L162-C207 HydrophobicContact CD1-CB 4.1Å; V203-C207 PolarHBondContact O-N 3.1Å; V203-C207 VanDerWaalsContact O-N 3.08Å; V203-C207 PolarHBondContact O-SG 3.18Å; T204-C207 PolarHBondContact O-N 3.08Å; T204-C207 VanDerWaalsContact O-N 3.16Å; R205-C207 PolarHBondContact O-N 3.45Å; C207-C209 PolarHBondContact O-N 3.27Å; C207-E210 WeakPolarHBondContact O-CB 3.48Å; C207-E210 PolarHBondContact O-N 3.24Å; C207-F211 HydrophobicContact CB-CE2 3.92Å; C207-F211 HydrophobicContact CB-CZ 4.1Å; C207-F211 WeakPolarHBondContact O-CD2 3.42Å; C207-F211 WeakPolarHBondContact O-CE2 3.39Å; C207-F211 WeakPolarHBondContact O-CG 3.39Å; C207-F211 PolarHBondContact O-N 3.12Å
208	I	95.5	Very high	94	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-62.5	-42.2	175	-58	-59.8	0	0	0	111.3	L193 L197 T204 R205 E210 F211 L212	L193-I208 HydrophobicContact CB-CD1 4.48Å; L193-I208 HydrophobicContact CD2-CD1 3.9Å; L193-I208 WeakPolarHBondContact O-CG2 3.33Å; L197-I208 HydrophobicContact CD1-CG2 4.43Å; L197-I208 HydrophobicContact CD2-CB 3.77Å; L197-I208 HydrophobicContact CD2-CG2 3.63Å; L197-I208 HydrophobicContact CG-CB 4.34Å; L197-I208 HydrophobicContact CG-CG2 3.76Å; T204-I208 WeakPolarHBondContact O-CG1 3.35Å; T204-I208 PolarHBondContact O-N 3.46Å; R205-I208 PolarHBondContact O-N 2.64Å; I208-E210 VanDerWaalsContact C-N 3.31Å; I208-E210 PolarHBondContact O-N 2.9Å; I208-F211 HydrophobicContact CD1-CD2 4.16Å; I208-F211 HydrophobicContact CD1-CE2 4.5Å; I208-F211 PolarHBondContact O-N 3.23Å; I208-L212 PolarHBondContact O-N 2.83Å
209	C	95.2	Very high	94.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.6	-33.9	174.9	-67.8	0	0	0	0	113.1	R205 K206 C207 A246 F249 T250	R205-C209 PolarHBondContact O-N 3.48Å; R205-C209 PolarHBondContact O-SG 2.78Å; R205-C209 VanDerWaalsContact O-SG 3.38Å; K206-C209 PolarHBondContact O-N 3.42Å; C207-C209 PolarHBondContact O-N 3.27Å; C209-A246 HydrophobicContact CB-CB 4.36Å; C209-F249 HydrophobicContact CB-CB 4.13Å; C209-T250 PolarHBondContact SG-OG1 3.43Å
210	E	95.1	Very high	94	Very high	29 Å²	29	35.6 Å²	35.6	14%	0.136	17%	0.169	C	C	.	.	H	α-helix	trans	-64.8	-43.4	171.6	-174.3	-175.1	134.6	0	0	111.3	R178 K206 C207 I208 L212 E213 F249	R178-E210 IonicContact CZ-OE1 3.81Å; R178-E210 IonicContact NE-OE1 2.66Å; R178-E210 PolarHBondContact NE-OE1 2.74Å; R178-E210 IonicContact NH2-OE1 2.69Å; R178-E210 PolarHBondContact NH2-OE1 2.77Å; K206-E210 PolarHBondContact O-N 3.14Å; C207-E210 WeakPolarHBondContact O-CB 3.48Å; C207-E210 PolarHBondContact O-N 3.24Å; I208-E210 VanDerWaalsContact C-N 3.31Å; I208-E210 PolarHBondContact O-N 2.9Å; E210-L212 PolarHBondContact O-N 3.13Å; E210-E213 WeakPolarHBondContact O-CB 3.24Å; E210-E213 PolarHBondContact O-N 3.3Å; E210-F249 HydrophobicContact CB-CB 4.43Å; E210-F249 HydrophobicContact CB-CD1 3.98Å; E210-F249 HydrophobicContact CB-CD2 4.03Å; E210-F249 HydrophobicContact CB-CE1 4.21Å; E210-F249 HydrophobicContact CB-CE2 4.25Å; E210-F249 HydrophobicContact CB-CG 3.9Å; E210-F249 HydrophobicContact CB-CZ 4.34Å; E210-F249 HydrophobicContact CG-CD1 3.9Å; E210-F249 HydrophobicContact CG-CE1 3.78Å; E210-F249 HydrophobicContact CG-CG 4.34Å; E210-F249 HydrophobicContact CG-CZ 4.1Å
211	F	95.7	Very high	93.8	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.009	13%	0.127	C	C	.	.	H	α-helix	trans	-66.2	-20.5	179.1	-59.3	-34.5	0	0	0	114.2	L162 V174 M177 R178 L181 C207 I208 E213 I214 I215	L162-F211 HydrophobicContact CD1-CE2 4Å; L162-F211 HydrophobicContact CD2-CE2 4.29Å; L162-F211 HydrophobicContact CD2-CZ 4.13Å; V174-F211 HydrophobicContact CG1-CE1 4.44Å; V174-F211 HydrophobicContact CG1-CZ 4.47Å; M177-F211 HydrophobicContact CB-CE1 4.29Å; M177-F211 HydrophobicContact CB-CE2 4.04Å; M177-F211 HydrophobicContact CB-CZ 3.73Å; M177-F211 HydrophobicContact CG-CD2 3.84Å; M177-F211 HydrophobicContact CG-CE1 4.18Å; M177-F211 HydrophobicContact CG-CE2 3.41Å; M177-F211 VanDerWaalsContact CG-CE2 3.41Å; M177-F211 HydrophobicContact CG-CG 4.43Å; M177-F211 HydrophobicContact CG-CZ 3.6Å; R178-F211 HydrophobicContact CG-CD1 4.47Å; R178-F211 HydrophobicContact CG-CE1 4Å; L181-F211 HydrophobicContact CD1-CB 3.63Å; L181-F211 HydrophobicContact CD1-CD1 4.34Å; L181-F211 HydrophobicContact CD1-CD2 4.23Å; L181-F211 HydrophobicContact CD1-CG 3.82Å; C207-F211 HydrophobicContact CB-CE2 3.92Å; C207-F211 HydrophobicContact CB-CZ 4.1Å; C207-F211 WeakPolarHBondContact O-CD2 3.42Å; C207-F211 WeakPolarHBondContact O-CE2 3.39Å; C207-F211 WeakPolarHBondContact O-CG 3.39Å; C207-F211 PolarHBondContact O-N 3.12Å; I208-F211 HydrophobicContact CD1-CD2 4.16Å; I208-F211 HydrophobicContact CD1-CE2 4.5Å; I208-F211 PolarHBondContact O-N 3.23Å; F211-E213 PolarHBondContact O-N 2.79Å; F211-I214 HydrophobicContact CD1-CD1 4.18Å; F211-I214 WeakPolarHBondContact O-CB 3Å; F211-I214 PolarHBondContact O-N 3.39Å; F211-I215 WeakPolarHBondContact O-CG1 3.46Å; F211-I215 PolarHBondContact O-N 2.95Å
212	L	94.6	Very high	93.6	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-59.9	-32.7	169.5	-63.7	177.5	0	0	0	112.2	I208 E210 I214 I215 F216 A234 L235 T250	I208-L212 PolarHBondContact O-N 2.83Å; E210-L212 PolarHBondContact O-N 3.13Å; L212-I214 VanDerWaalsContact C-N 3.25Å; L212-I214 PolarHBondContact O-N 3.27Å; L212-I215 PolarHBondContact O-N 2.9Å; L212-F216 HydrophobicContact CB-CD2 4.34Å; L212-F216 HydrophobicContact CB-CE2 4.23Å; L212-F216 WeakPolarHBondContact O-CD2 3.4Å; L212-F216 PolarHBondContact O-N 3.17Å; L212-A234 HydrophobicContact CD1-CB 4.46Å; L212-A234 HydrophobicContact CD2-CB 4.29Å; L212-L235 HydrophobicContact CD1-CD2 4.48Å; L212-T250 HydrophobicContact CD1-CG2 4.36Å
213	E	92.6	Very high	93.4	Very high	47 Å²	47	25.6 Å²	25.6	22%	0.22	12%	0.123	C	C	.	.	H	α-helix	trans	-67.8	-26.7	175.4	-164.2	179.3	127.1	0	0	112.1	E210 F211 R217 R252 L256	E210-E213 WeakPolarHBondContact O-CB 3.24Å; E210-E213 PolarHBondContact O-N 3.3Å; F211-E213 PolarHBondContact O-N 2.79Å; E213-R217 WeakPolarHBondContact O-CB 3.39Å; E213-R217 PolarHBondContact O-N 3.34Å; E213-R252 VanDerWaalsContact CD-NH2 3.31Å; E213-R252 IonicContact OE1-CZ 2.7Å; E213-R252 IonicContact OE1-NE 3.22Å; E213-R252 IonicContact OE1-NH2 2.7Å; E213-R252 PolarHBondContact OE1-NH2 3.45Å; E213-R252 WeakPolarHBondContact OE2-CB 3.43Å; E213-R252 IonicContact OE2-CZ 2.98Å; E213-R252 VanDerWaalsContact OE2-CZ 3.31Å; E213-R252 IonicContact OE2-NE 2.67Å; E213-R252 PolarHBondContact OE2-NE 3.33Å; E213-R252 IonicContact OE2-NH2 3.12Å; E213-R252 PolarHBondContact OE2-NH2 3.39Å; E213-R252 VanDerWaalsContact OE2-NH2 3.08Å; E213-L256 HydrophobicContact CG-CD1 4Å; E213-L256 WeakPolarHBondContact O-CD1 3.36Å
214	I	93.7	Very high	93.3	Very high	11 Å²	11	22.5 Å²	22.5	6%	0.056	10%	0.104	C	C	.	.	H	α-helix	trans	-76.6	-52.8	172.3	-56	-177	0	0	0	109.6	R178 L181 E182 F211 L212 F216 R217 T218	R178-I214 HydrophobicContact CB-CD1 4.03Å; R178-I214 HydrophobicContact CG-CD1 3.69Å; L181-I214 HydrophobicContact CB-CG2 4.04Å; E182-I214 HydrophobicContact CG-CG2 3.66Å; F211-I214 HydrophobicContact CD1-CD1 4.18Å; F211-I214 WeakPolarHBondContact O-CB 3Å; F211-I214 PolarHBondContact O-N 3.39Å; L212-I214 VanDerWaalsContact C-N 3.25Å; L212-I214 PolarHBondContact O-N 3.27Å; I214-F216 PolarHBondContact O-N 3.12Å; I214-R217 CarbonylContact O-C 3.51Å; I214-R217 WeakPolarHBondContact O-CA 3.2Å; I214-R217 WeakPolarHBondContact O-CB 3.11Å; I214-R217 PolarHBondContact O-N 3.36Å; I214-T218 HydrophobicContact CG2-CG2 4.38Å; I214-T218 PolarHBondContact O-N 3.32Å; I214-T218 PolarHBondContact O-OG1 3.11Å
215	I	94.7	Very high	93.1	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-55.4	-48	-178	-68	163.4	0	0	0	111.4	L190 F211 L212 R217 W219 L224 L231	L190-I215 HydrophobicContact CD2-CD1 4.04Å; L190-I215 HydrophobicContact CD2-CG2 4.49Å; F211-I215 WeakPolarHBondContact O-CG1 3.46Å; F211-I215 PolarHBondContact O-N 2.95Å; L212-I215 PolarHBondContact O-N 2.9Å; I215-R217 PolarHBondContact O-N 2.88Å; I215-W219 HydrophobicContact CG1-CZ2 4.44Å; I215-W219 HydrophobicContact CG2-CD2 4.03Å; I215-W219 HydrophobicContact CG2-CE3 4.2Å; I215-W219 HydrophobicContact CG2-CG 4.2Å; I215-W219 WeakPolarHBondContact O-CB 3.19Å; I215-W219 PolarHBondContact O-N 2.93Å; I215-W219 VanDerWaalsContact O-N 3.11Å; I215-L224 HydrophobicContact CG2-CD2 3.69Å; I215-L231 HydrophobicContact CG2-CD2 4.35Å
216	F	94.1	Very high	92.9	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.009	15%	0.153	C	C	.	.	H	α-helix	trans	-73.8	-9.7	177	-63.7	-58.6	0	0	0	114.3	L212 I214 L231 L235 L256 F257 K260	L212-F216 HydrophobicContact CB-CD2 4.34Å; L212-F216 HydrophobicContact CB-CE2 4.23Å; L212-F216 WeakPolarHBondContact O-CD2 3.4Å; L212-F216 PolarHBondContact O-N 3.17Å; I214-F216 PolarHBondContact O-N 3.12Å; F216-L231 HydrophobicContact CE1-CB 4.42Å; F216-L231 HydrophobicContact CE1-CD1 4.27Å; F216-L231 HydrophobicContact CE1-CD2 4.28Å; F216-L231 HydrophobicContact CZ-CB 4.26Å; F216-L231 HydrophobicContact CZ-CD2 4.21Å; F216-L235 HydrophobicContact CE2-CD1 4.34Å; F216-L235 HydrophobicContact CE2-CD2 4.03Å; F216-L235 HydrophobicContact CE2-CG 4.31Å; F216-L235 HydrophobicContact CZ-CD1 4.08Å; F216-L235 HydrophobicContact CZ-CG 4.34Å; F216-L256 HydrophobicContact CB-CB 3.6Å; F216-L256 HydrophobicContact CB-CD1 4.21Å; F216-F257 HydrophobicContact CD1-CD2 4.41Å; F216-F257 AromaticContact CE1-CD2 3.76Å; F216-F257 HydrophobicContact CE1-CD2 3.76Å; F216-F257 HydrophobicContact CZ-CB 4.49Å; F216-F257 AromaticContact CZ-CD2 3.99Å; F216-F257 HydrophobicContact CZ-CD2 3.99Å; F216-K260 WeakPolarHBondContact O-CE 3.14Å
217	R	93.3	Very high	92.7	Very high	130 Å²	130	32.2 Å²	32.2	49%	0.491	15%	0.15	S	C	.	.	H	α-helix	trans	-91.4	-47.8	173.4	176.1	172.6	54	99.5	1.8	112.1	E182 E213 I214 I215 L256	E182-R217 IonicContact OE1-CZ 2.73Å; E182-R217 VanDerWaalsContact OE1-CZ 3.29Å; E182-R217 IonicContact OE1-NH1 3.97Å; E182-R217 PolarHBondContact OE1-NH1 3.01Å; E182-R217 IonicContact OE1-NH2 2.93Å; E182-R217 PolarHBondContact OE1-NH2 2.83Å; E213-R217 WeakPolarHBondContact O-CB 3.39Å; E213-R217 PolarHBondContact O-N 3.34Å; I214-R217 CarbonylContact O-C 3.51Å; I214-R217 WeakPolarHBondContact O-CA 3.2Å; I214-R217 WeakPolarHBondContact O-CB 3.11Å; I214-R217 PolarHBondContact O-N 3.36Å; I215-R217 PolarHBondContact O-N 2.88Å; R217-L256 HydrophobicContact CB-CD1 4.11Å
218	T	91.3	Very high	92.6	Very high	36 Å²	36	33.5 Å²	33.5	22%	0.221	16%	0.156	C	C	.	.	H	α-helix	trans	-96.7	-33	-169.5	53.7	0	0	0	0	114.2	L181 E182 I214	L181-T218 PolarHBondContact O-OG1 2.9Å; E182-T218 HydrophobicContact CG-CG2 4.28Å; I214-T218 HydrophobicContact CG2-CG2 4.38Å; I214-T218 PolarHBondContact O-N 3.32Å; I214-T218 PolarHBondContact O-OG1 3.11Å
219	W	93.5	Very high	92.4	Very high	1 Å²	1	37.4 Å²	37.4	0%	0.004	18%	0.184	C	C	.	.	S	Bend	trans	-77.3	145.5	-168.4	-71	24.1	0	0	0	113.3	L181 S186 L190 I215 I223 L224 K260	L181-W219 HydrophobicContact CD2-CZ2 4.03Å; L181-W219 PolarHBondContact O-NE1 2.85Å; S186-W219 WeakPolarHBondContact O-CH2 3.45Å; L190-W219 HydrophobicContact CD1-CE3 4.48Å; L190-W219 HydrophobicContact CD1-CZ3 3.73Å; L190-W219 HydrophobicContact CD2-CH2 3.85Å; L190-W219 HydrophobicContact CD2-CZ3 3.72Å; L190-W219 HydrophobicContact CG-CH2 3.87Å; L190-W219 HydrophobicContact CG-CZ3 3.59Å; I215-W219 HydrophobicContact CG1-CZ2 4.44Å; I215-W219 HydrophobicContact CG2-CD2 4.03Å; I215-W219 HydrophobicContact CG2-CE3 4.2Å; I215-W219 HydrophobicContact CG2-CG 4.2Å; I215-W219 WeakPolarHBondContact O-CB 3.19Å; I215-W219 PolarHBondContact O-N 2.93Å; I215-W219 VanDerWaalsContact O-N 3.11Å; W219-I223 HydrophobicContact CE3-CG2 3.82Å; W219-I223 HydrophobicContact CZ3-CG2 4.03Å; W219-L224 HydrophobicContact CB-CD1 4.23Å; W219-L224 HydrophobicContact CB-CD2 4.01Å; W219-L224 HydrophobicContact CB-CG 4.09Å; W219-L224 HydrophobicContact CE3-CD2 4.4Å; W219-L224 WeakPolarHBondContact O-CD1 3.43Å; W219-K260 PolarHBondContact O-NZ 3.23Å
220	P	89.9	Confident	92.3	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.013	20%	0.198	C	C	.	.			trans	-73.9	151.5	-179.7	31.9	-35.8	0	0	0	112.4	N222 I223 L224 S834	P220-N222 VanDerWaalsContact CB-OD1 3.32Å; P220-N222 WeakPolarHBondContact CB-OD1 3.42Å; P220-N222 PolarHBondContact O-N 3.35Å; P220-I223 HydrophobicContact CG-CB 4.22Å; P220-I223 HydrophobicContact CG-CD1 3.65Å; P220-I223 HydrophobicContact CG-CG1 3.86Å; P220-I223 PolarHBondContact O-N 3.33Å; P220-I223 VanDerWaalsContact O-N 3.16Å; P220-L224 PolarHBondContact O-N 2.93Å; P220-S834 WeakPolarHBondContact CB-O 3.21Å
221	L	89.3	Confident	92.2	Very high	6 Å²	6	38.4 Å²	38.4	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-57.7	-46	-173.1	-70.9	157	0	0	0	112.7	I223 L224 E225 K260 F261 M831	L221-I223 PolarHBondContact O-N 3.48Å; L221-I223 VanDerWaalsContact O-N 3.1Å; L221-L224 PolarHBondContact O-N 3.1Å; L221-E225 WeakPolarHBondContact CB-OE1 3.38Å; L221-E225 WeakPolarHBondContact O-CB 3.49Å; L221-E225 WeakPolarHBondContact O-CG 3.34Å; L221-E225 PolarHBondContact O-N 3.42Å; L221-K260 HydrophobicContact CD2-CB 3.8Å; L221-K260 HydrophobicContact CD2-CD 3.93Å; L221-K260 HydrophobicContact CD2-CG 3.81Å; L221-F261 HydrophobicContact CD2-CZ 4.42Å; L221-M831 HydrophobicContact CD1-CB 4.15Å; L221-M831 HydrophobicContact CD1-CE 3.86Å; L221-M831 HydrophobicContact CD1-CG 3.78Å; L221-M831 HydrophobicContact CD1-SD 3.58Å; L221-M831 VanDerWaalsContact CD1-SD 3.58Å; L221-M831 HydrophobicContact CD2-CE 4.01Å
222	N	89.6	Confident	92.1	Very high	66 Å²	66	40 Å²	40	35%	0.353	20%	0.199	S	C	.	.	H	α-helix	trans	-61.1	-18.8	179.2	66.4	-35.5	0	0	0	115.2	P220 E225 K226	P220-N222 VanDerWaalsContact CB-OD1 3.32Å; P220-N222 WeakPolarHBondContact CB-OD1 3.42Å; P220-N222 PolarHBondContact O-N 3.35Å; N222-E225 WeakPolarHBondContact CA-OE2 3.48Å; N222-K226 WeakPolarHBondContact O-CD 3.38Å; N222-K226 VanDerWaalsContact O-CG 3.32Å; N222-K226 WeakPolarHBondContact O-CG 3.42Å
223	I	89.4	Confident	92	Very high	32 Å²	32	42.2 Å²	42.2	16%	0.164	21%	0.211	C	C	.	.	H	α-helix	trans	-90.8	-38.8	173.4	-62	-176.4	0	0	0	110.2	C185 W219 P220 L221 N227	C185-I223 HydrophobicContact CB-CD1 4.33Å; C185-I223 WeakPolarHBondContact O-CD1 3.37Å; W219-I223 HydrophobicContact CE3-CG2 3.82Å; W219-I223 HydrophobicContact CZ3-CG2 4.03Å; P220-I223 HydrophobicContact CG-CB 4.22Å; P220-I223 HydrophobicContact CG-CD1 3.65Å; P220-I223 HydrophobicContact CG-CG1 3.86Å; P220-I223 PolarHBondContact O-N 3.33Å; P220-I223 VanDerWaalsContact O-N 3.16Å; L221-I223 PolarHBondContact O-N 3.48Å; L221-I223 VanDerWaalsContact O-N 3.1Å; I223-N227 PolarHBondContact O-ND2 2.73Å
224	L	92.3	Very high	92.1	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-69	-42.2	177.8	-63.3	171.2	0	0	0	112.1	I215 W219 P220 L221 K226 N227 L228 L231 K260 F261	I215-L224 HydrophobicContact CG2-CD2 3.69Å; W219-L224 HydrophobicContact CB-CD1 4.23Å; W219-L224 HydrophobicContact CB-CD2 4.01Å; W219-L224 HydrophobicContact CB-CG 4.09Å; W219-L224 HydrophobicContact CE3-CD2 4.4Å; W219-L224 WeakPolarHBondContact O-CD1 3.43Å; P220-L224 PolarHBondContact O-N 2.93Å; L221-L224 PolarHBondContact O-N 3.1Å; L224-K226 PolarHBondContact O-N 3.35Å; L224-N227 CarbonylContact O-C 3.56Å; L224-N227 PolarHBondContact O-N 3.45Å; L224-N227 VanDerWaalsContact O-N 3.1Å; L224-L228 PolarHBondContact O-N 3.37Å; L224-L231 HydrophobicContact CB-CD1 4.1Å; L224-L231 HydrophobicContact CD2-CD1 3.67Å; L224-L231 WeakPolarHBondContact O-CD1 3.41Å; L224-K260 HydrophobicContact CD1-CD 3.5Å; L224-F261 HydrophobicContact CB-CE2 3.89Å; L224-F261 HydrophobicContact CB-CZ 3.78Å
225	E	90.8	Very high	92.1	Very high	93 Å²	93	39.4 Å²	39.4	44%	0.435	20%	0.198	S	C	.	.	H	α-helix	trans	-53.9	-51.4	175	-74.3	156.7	-168	0	0	111.4	L221 N222 N227 L228 F261	L221-E225 WeakPolarHBondContact CB-OE1 3.38Å; L221-E225 WeakPolarHBondContact O-CB 3.49Å; L221-E225 WeakPolarHBondContact O-CG 3.34Å; L221-E225 PolarHBondContact O-N 3.42Å; N222-E225 WeakPolarHBondContact CA-OE2 3.48Å; E225-N227 PolarHBondContact O-N 2.8Å; E225-N227 VanDerWaalsContact O-N 3.1Å; E225-L228 VanDerWaalsContact O-CB 3.32Å; E225-L228 WeakPolarHBondContact O-CB 3.48Å; E225-L228 PolarHBondContact O-N 3.16Å; E225-F261 HydrophobicContact CG-CE1 3.65Å; E225-F261 HydrophobicContact CG-CZ 4Å
226	K	90.8	Very high	92	Very high	173 Å²	173	44.3 Å²	44.3	75%	0.752	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.5	179.4	-68.7	180	-176.7	-173.5	0	114.3	N222 L224	N222-K226 WeakPolarHBondContact O-CD 3.38Å; N222-K226 VanDerWaalsContact O-CG 3.32Å; N222-K226 WeakPolarHBondContact O-CG 3.42Å; L224-K226 PolarHBondContact O-N 3.35Å
227	N	90.8	Very high	92	Very high	28 Å²	28	48.8 Å²	48.8	15%	0.15	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.9	15.1	-178.6	-66.2	-89.7	0	0	0	112.4	L190 I223 L224 E225 S229 V230 L231	L190-N227 HydrophobicContact CD1-CB 3.59Å; I223-N227 PolarHBondContact O-ND2 2.73Å; L224-N227 CarbonylContact O-C 3.56Å; L224-N227 PolarHBondContact O-N 3.45Å; L224-N227 VanDerWaalsContact O-N 3.1Å; E225-N227 PolarHBondContact O-N 2.8Å; E225-N227 VanDerWaalsContact O-N 3.1Å; N227-S229 VanDerWaalsContact C-N 3.3Å; N227-S229 PolarHBondContact O-N 2.97Å; N227-V230 PolarHBondContact O-N 3.46Å; N227-V230 VanDerWaalsContact O-N 3.1Å; N227-L231 HydrophobicContact CB-CD1 4.31Å; N227-L231 WeakPolarHBondContact O-CG 3.28Å; N227-L231 PolarHBondContact O-N 3.39Å
228	L	92	Very high	92	Very high	37 Å²	37	42.6 Å²	42.6	19%	0.194	21%	0.209	C	C	.	.	H	α-helix	trans	-57.6	-38.5	-170.6	179.8	65.4	0	0	0	113.3	L224 E225 L231 Q232 F257 F261 Q264	L224-L228 PolarHBondContact O-N 3.37Å; E225-L228 VanDerWaalsContact O-CB 3.32Å; E225-L228 WeakPolarHBondContact O-CB 3.48Å; E225-L228 PolarHBondContact O-N 3.16Å; L228-L231 PolarHBondContact O-N 2.77Å; L228-Q232 HydrophobicContact CD1-CG 4.25Å; L228-Q232 HydrophobicContact CG-CG 4.43Å; L228-Q232 WeakPolarHBondContact O-CB 3.46Å; L228-Q232 WeakPolarHBondContact O-CG 3.31Å; L228-Q232 PolarHBondContact O-N 2.89Å; L228-F257 HydrophobicContact CD1-CE2 3.85Å; L228-F257 HydrophobicContact CD1-CZ 4.23Å; L228-F261 HydrophobicContact CD1-CD2 4.33Å; L228-F261 HydrophobicContact CD1-CG 4.42Å; L228-Q264 HydrophobicContact CD2-CB 4.39Å; L228-Q264 HydrophobicContact CD2-CG 4.02Å
229	S	91.3	Very high	92.1	Very high	85 Å²	85	41.4 Å²	41.4	59%	0.594	20%	0.202	S	C	*	.	H	α-helix	trans	-59.7	-46.9	176.8	51.6	0	0	0	0	112.1	N227 Q232 D233	N227-S229 VanDerWaalsContact C-N 3.3Å; N227-S229 PolarHBondContact O-N 2.97Å; S229-Q232 PolarHBondContact O-N 2.73Å; S229-D233 PolarHBondContact O-N 2.93Å
230	V	92.6	Very high	92	Very high	50 Å²	50	44.4 Å²	44.4	30%	0.303	22%	0.223	S	C	.	.	H	α-helix	trans	-68.4	-39.1	179.6	-158.2	0	0	0	0	111	I194 N227 D233 A234	I194-V230 HydrophobicContact CB-CG1 4.31Å; I194-V230 HydrophobicContact CD1-CB 4.32Å; I194-V230 HydrophobicContact CD1-CG1 3.67Å; I194-V230 HydrophobicContact CG2-CG1 4.06Å; N227-V230 PolarHBondContact O-N 3.46Å; N227-V230 VanDerWaalsContact O-N 3.1Å; V230-D233 PolarHBondContact O-N 2.77Å; V230-A234 PolarHBondContact O-N 2.97Å
231	L	93.9	Very high	92.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-67.9	-39.8	175.9	-68.9	167.5	0	0	0	112.3	L190 I194 I215 F216 L224 N227 L228 A234 L235	L190-L231 HydrophobicContact CD2-CD2 4.35Å; I194-L231 HydrophobicContact CD1-CD2 4.39Å; I215-L231 HydrophobicContact CG2-CD2 4.35Å; F216-L231 HydrophobicContact CE1-CB 4.42Å; F216-L231 HydrophobicContact CE1-CD1 4.27Å; F216-L231 HydrophobicContact CE1-CD2 4.28Å; F216-L231 HydrophobicContact CZ-CB 4.26Å; F216-L231 HydrophobicContact CZ-CD2 4.21Å; L224-L231 HydrophobicContact CB-CD1 4.1Å; L224-L231 HydrophobicContact CD2-CD1 3.67Å; L224-L231 WeakPolarHBondContact O-CD1 3.41Å; N227-L231 HydrophobicContact CB-CD1 4.31Å; N227-L231 WeakPolarHBondContact O-CG 3.28Å; N227-L231 PolarHBondContact O-N 3.39Å; L228-L231 PolarHBondContact O-N 2.77Å; L231-A234 PolarHBondContact O-N 2.62Å; L231-L235 WeakPolarHBondContact O-CG 3.45Å; L231-L235 PolarHBondContact O-N 3.23Å
232	Q	93.3	Very high	92.5	Very high	35 Å²	35	49.2 Å²	49.2	16%	0.164	26%	0.26	C	S	.	.	H	α-helix	trans	-65.1	-41	172.8	-74.8	-176.3	10.5	0	0	111.8	L228 S229 L235 R236 F257 F268	L228-Q232 HydrophobicContact CD1-CG 4.25Å; L228-Q232 HydrophobicContact CG-CG 4.43Å; L228-Q232 WeakPolarHBondContact O-CB 3.46Å; L228-Q232 WeakPolarHBondContact O-CG 3.31Å; L228-Q232 PolarHBondContact O-N 2.89Å; S229-Q232 PolarHBondContact O-N 2.73Å; Q232-L235 PolarHBondContact O-N 3.06Å; Q232-R236 WeakPolarHBondContact O-CG 3.38Å; Q232-R236 PolarHBondContact O-N 2.94Å; Q232-F257 HydrophobicContact CG-CZ 4.18Å; Q232-F268 HydrophobicContact CB-CD2 4.27Å; Q232-F268 HydrophobicContact CB-CE2 4.16Å; Q232-F268 HydrophobicContact CG-CD2 4.13Å; Q232-F268 HydrophobicContact CG-CE2 4.45Å; Q232-F268 WeakPolarHBondContact O-CE2 3.5Å
233	D	92.4	Very high	92.7	Very high	48 Å²	48	47.1 Å²	47.1	26%	0.257	25%	0.249	S	C	.	.	H	α-helix	trans	-61.1	-45.2	174.3	179.6	30.2	0	0	0	111.6	S229 V230 L235 R236 R237	S229-D233 PolarHBondContact O-N 2.93Å; V230-D233 PolarHBondContact O-N 2.77Å; D233-L235 VanDerWaalsContact C-N 3.31Å; D233-L235 PolarHBondContact O-N 3.2Å; D233-R236 PolarHBondContact O-N 2.83Å; D233-R236 VanDerWaalsContact O-N 3.12Å; D233-R237 VanDerWaalsContact O-CG 3.32Å; D233-R237 WeakPolarHBondContact O-CG 3.42Å; D233-R237 PolarHBondContact O-N 3.14Å; D233-R237 IonicContact OD1-CZ 3.58Å; D233-R237 IonicContact OD1-NE 3.43Å; D233-R237 PolarHBondContact OD1-NE 3.23Å; D233-R237 IonicContact OD1-NH2 3.24Å; D233-R237 IonicContact OD2-CZ 2.83Å; D233-R237 IonicContact OD2-NE 2.66Å; D233-R237 PolarHBondContact OD2-NE 3.3Å; D233-R237 IonicContact OD2-NH2 2.72Å; D233-R237 PolarHBondContact OD2-NH2 2.94Å
234	A	94.2	Very high	92.9	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-55.3	-43.3	172.8	0	0	0	0	0	112.7	I194 L197 L212 V230 L231 G238	I194-A234 HydrophobicContact CD1-CB 4.05Å; I194-A234 HydrophobicContact CG1-CB 4.03Å; I194-A234 HydrophobicContact CG2-CB 3.91Å; L197-A234 HydrophobicContact CD1-CB 3.85Å; L212-A234 HydrophobicContact CD1-CB 4.46Å; L212-A234 HydrophobicContact CD2-CB 4.29Å; V230-A234 PolarHBondContact O-N 2.97Å; L231-A234 PolarHBondContact O-N 2.62Å; A234-G238 PolarHBondContact O-N 2.97Å
235	L	94.4	Very high	93	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.4	-44.3	174.4	-71.7	172.1	0	0	0	112.5	L212 F216 L231 Q232 D233 R237 G238 I239 T250 F257 F268	L212-L235 HydrophobicContact CD1-CD2 4.48Å; F216-L235 HydrophobicContact CE2-CD1 4.34Å; F216-L235 HydrophobicContact CE2-CD2 4.03Å; F216-L235 HydrophobicContact CE2-CG 4.31Å; F216-L235 HydrophobicContact CZ-CD1 4.08Å; F216-L235 HydrophobicContact CZ-CG 4.34Å; L231-L235 WeakPolarHBondContact O-CG 3.45Å; L231-L235 PolarHBondContact O-N 3.23Å; Q232-L235 PolarHBondContact O-N 3.06Å; D233-L235 VanDerWaalsContact C-N 3.31Å; D233-L235 PolarHBondContact O-N 3.2Å; L235-R237 VanDerWaalsContact C-N 3.34Å; L235-R237 PolarHBondContact O-N 3.03Å; L235-G238 PolarHBondContact O-N 2.9Å; L235-I239 WeakPolarHBondContact O-CB 3.37Å; L235-I239 WeakPolarHBondContact O-CD1 3.37Å; L235-I239 VanDerWaalsContact O-CG1 3.25Å; L235-I239 WeakPolarHBondContact O-CG1 3.49Å; L235-I239 PolarHBondContact O-N 2.7Å; L235-T250 HydrophobicContact CD2-CG2 3.74Å; L235-F257 HydrophobicContact CD1-CB 4.37Å; L235-F257 HydrophobicContact CD1-CD1 3.73Å; L235-F257 HydrophobicContact CD1-CD2 3.99Å; L235-F257 HydrophobicContact CD1-CE1 3.92Å; L235-F257 HydrophobicContact CD1-CE2 4.2Å; L235-F257 HydrophobicContact CD1-CG 3.76Å; L235-F257 HydrophobicContact CD1-CZ 4.17Å; L235-F268 HydrophobicContact CB-CE1 4.41Å; L235-F268 HydrophobicContact CB-CE2 3.93Å; L235-F268 HydrophobicContact CB-CZ 3.55Å
236	R	93.1	Very high	93.1	Very high	106 Å²	106	53 Å²	53	40%	0.4	28%	0.276	S	S	.	.	H	α-helix	trans	-58.9	-44.9	177.5	-71.7	175.2	-169.2	107.7	6.5	111.4	Q232 D233 S240 F268	Q232-R236 WeakPolarHBondContact O-CG 3.38Å; Q232-R236 PolarHBondContact O-N 2.94Å; D233-R236 PolarHBondContact O-N 2.83Å; D233-R236 VanDerWaalsContact O-N 3.12Å; R236-S240 WeakPolarHBondContact O-CB 3.22Å; R236-S240 PolarHBondContact O-N 3.36Å; R236-S240 PolarHBondContact O-OG 3.25Å; R236-F268 HydrophobicContact CG-CE2 3.67Å; R236-F268 HydrophobicContact CG-CZ 3.85Å
237	R	93.2	Very high	93.3	Very high	96 Å²	96	49.3 Å²	49.3	36%	0.362	26%	0.258	S	S	.	.	H	α-helix	trans	-63.4	-53.6	176.5	-67	174.9	-168.7	-145	8.5	111.1	L197 S198 D233 L235 I239 S240 D241	L197-R237 HydrophobicContact CD1-CB 4.34Å; S198-R237 PolarHBondContact OG-NH1 3.11Å; D233-R237 VanDerWaalsContact O-CG 3.32Å; D233-R237 WeakPolarHBondContact O-CG 3.42Å; D233-R237 PolarHBondContact O-N 3.14Å; D233-R237 IonicContact OD1-CZ 3.58Å; D233-R237 IonicContact OD1-NE 3.43Å; D233-R237 PolarHBondContact OD1-NE 3.23Å; D233-R237 IonicContact OD1-NH2 3.24Å; D233-R237 IonicContact OD2-CZ 2.83Å; D233-R237 IonicContact OD2-NE 2.66Å; D233-R237 PolarHBondContact OD2-NE 3.3Å; D233-R237 IonicContact OD2-NH2 2.72Å; D233-R237 PolarHBondContact OD2-NH2 2.94Å; L235-R237 VanDerWaalsContact C-N 3.34Å; L235-R237 PolarHBondContact O-N 3.03Å; R237-I239 PolarHBondContact O-N 2.91Å; R237-S240 CarbonylContact O-C 3.53Å; R237-S240 PolarHBondContact O-N 3.34Å; R237-D241 PolarHBondContact O-N 3.5Å
238	G	93.6	Very high	93.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.1	-34.8	-176.4	0	0	0	0	0	114.6	A234 L235 S240 R247 T250	A234-G238 PolarHBondContact O-N 2.97Å; L235-G238 PolarHBondContact O-N 2.9Å; G238-S240 PolarHBondContact O-N 2.99Å; G238-R247 WeakPolarHBondContact O-CA 3.4Å; G238-R247 WeakPolarHBondContact O-CG 3.22Å; G238-T250 VanDerWaalsContact C-OG1 3.28Å; G238-T250 VanDerWaalsContact CA-OG1 3.31Å; G238-T250 WeakPolarHBondContact CA-OG1 3.31Å; G238-T250 PolarHBondContact O-OG1 3.3Å
239	I	93.7	Very high	93.5	Very high	12 Å²	12	51 Å²	51	6%	0.062	27%	0.265	C	S	.	.	H	α-helix	trans	-68.1	-24.9	172.9	-69.7	163.7	0	0	0	111.7	L235 R237 T250 F254 F268 L272 K276 I280	L235-I239 WeakPolarHBondContact O-CB 3.37Å; L235-I239 WeakPolarHBondContact O-CD1 3.37Å; L235-I239 VanDerWaalsContact O-CG1 3.25Å; L235-I239 WeakPolarHBondContact O-CG1 3.49Å; L235-I239 PolarHBondContact O-N 2.7Å; R237-I239 PolarHBondContact O-N 2.91Å; I239-T250 HydrophobicContact CG1-CG2 3.82Å; I239-F254 HydrophobicContact CD1-CD2 4.48Å; I239-F268 HydrophobicContact CD1-CE1 3.7Å; I239-F268 HydrophobicContact CD1-CZ 4.05Å; I239-L272 HydrophobicContact CD1-CD1 4.36Å; I239-K276 HydrophobicContact CG2-CB 4.33Å; I239-K276 HydrophobicContact CG2-CD 4.03Å; I239-K276 HydrophobicContact CG2-CG 4.37Å; I239-I280 HydrophobicContact CD1-CD1 3.8Å; I239-I280 HydrophobicContact CG1-CD1 4.35Å; I239-I280 HydrophobicContact CG2-CD1 4.35Å
240	S	91.8	Very high	93.7	Very high	64 Å²	64	47 Å²	47	45%	0.448	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108	7.8	-175.4	-51.9	0	0	0	0	114.4	R236 R237 G238 K276	R236-S240 WeakPolarHBondContact O-CB 3.22Å; R236-S240 PolarHBondContact O-N 3.36Å; R236-S240 PolarHBondContact O-OG 3.25Å; R237-S240 CarbonylContact O-C 3.53Å; R237-S240 PolarHBondContact O-N 3.34Å; G238-S240 PolarHBondContact O-N 2.99Å; S240-K276 PolarHBondContact OG-NZ 2.88Å
241	D	94.8	Very high	93.7	Very high	21 Å²	21	46.8 Å²	46.8	11%	0.112	23%	0.231	C	C	.	.			trans	-63	151.8	177.2	-156.7	-54.2	0	0	0	111.5	R205 R237 D243 A246 R247	R205-D241 WeakPolarHBondContact CD-OD2 3.34Å; R205-D241 IonicContact CZ-OD1 3.71Å; R205-D241 IonicContact CZ-OD2 2.99Å; R205-D241 IonicContact NE-OD1 3.88Å; R205-D241 PolarHBondContact NE-OD1 2.94Å; R205-D241 IonicContact NE-OD2 3.21Å; R205-D241 PolarHBondContact NE-OD2 2.82Å; R205-D241 IonicContact NH2-OD1 3.29Å; R205-D241 PolarHBondContact NH2-OD1 3.31Å; R205-D241 IonicContact NH2-OD2 3.38Å; R237-D241 PolarHBondContact O-N 3.5Å; D241-D243 VanDerWaalsContact C-N 3.3Å; D241-D243 PolarHBondContact OD1-N 3.05Å; D241-A246 HydrophobicContact CB-CB 4.09Å; D241-R247 HydrophobicContact CB-CG 4.36Å; D241-R247 WeakPolarHBondContact O-CD 3.47Å; D241-R247 WeakPolarHBondContact O-CG 3.37Å; D241-R247 PolarHBondContact O-NE 3.3Å
242	A	93.9	Very high	93.6	Very high	87 Å²	87	53.1 Å²	53.1	72%	0.719	26%	0.255	S	S	*	.	S	Bend	trans	-67.2	-33.7	170.2	0	0	0	0	0	111.7	R247	A242-R247 PolarHBondContact O-NH2 3.32Å
243	D	94.1	Very high	93.6	Very high	23 Å²	23	51.5 Å²	51.5	12%	0.123	25%	0.247	C	C	.	.			trans	-67.6	139.5	-178.3	-169.2	100.4	0	0	0	111.9	N202 D241 E245 A246 R247	N202-D243 HydrophobicContact CB-CB 4.45Å; N202-D243 PolarHBondContact ND2-OD1 3.32Å; D241-D243 VanDerWaalsContact C-N 3.3Å; D241-D243 PolarHBondContact OD1-N 3.05Å; D243-E245 WeakPolarHBondContact OD2-CA 3.5Å; D243-E245 WeakPolarHBondContact OD2-CB 3.39Å; D243-E245 PolarHBondContact OD2-N 3.26Å; D243-A246 HydrophobicContact CB-CB 3.91Å; D243-A246 PolarHBondContact OD2-N 2.74Å; D243-R247 WeakPolarHBondContact O-CG 3.32Å; D243-R247 PolarHBondContact O-N 2.8Å; D243-R247 PolarHBondContact O-NE 2.85Å
244	Q	94.2	Very high	93.6	Very high	154 Å²	154	49.2 Å²	49.2	72%	0.72	24%	0.235	S	C	*	.	H	α-helix	trans	-80	-32.8	-177.4	-175.5	175.7	-1.7	0	0	112.5	L248	Q244-L248 WeakPolarHBondContact O-CB 3.02Å; Q244-L248 PolarHBondContact O-N 3.48Å; Q244-L248 VanDerWaalsContact O-N 3.1Å
245	E	93.1	Very high	93.5	Very high	94 Å²	94	50.3 Å²	50.3	44%	0.439	24%	0.242	S	C	.	.	H	α-helix	trans	-76.9	-42.1	179.8	-60.1	-172.2	91.6	0	0	110.3	K206 D243 R247 L248 F249	K206-E245 HydrophobicContact CD-CB 3.9Å; K206-E245 WeakPolarHBondContact CD-OE2 3.44Å; K206-E245 VanDerWaalsContact CE-OE1 3.29Å; K206-E245 WeakPolarHBondContact CE-OE1 3.17Å; K206-E245 VanDerWaalsContact CE-OE2 3.3Å; K206-E245 WeakPolarHBondContact CE-OE2 3.32Å; K206-E245 HydrophobicContact CG-CB 3.98Å; K206-E245 IonicContact NZ-OE1 2.74Å; K206-E245 PolarHBondContact NZ-OE1 3.41Å; K206-E245 IonicContact NZ-OE2 2.78Å; K206-E245 PolarHBondContact NZ-OE2 3.37Å; D243-E245 WeakPolarHBondContact OD2-CA 3.5Å; D243-E245 WeakPolarHBondContact OD2-CB 3.39Å; D243-E245 PolarHBondContact OD2-N 3.26Å; E245-R247 VanDerWaalsContact C-N 3.31Å; E245-R247 PolarHBondContact O-N 2.92Å; E245-L248 WeakPolarHBondContact O-CA 3.14Å; E245-L248 WeakPolarHBondContact O-CB 3.48Å; E245-L248 PolarHBondContact O-N 3.25Å; E245-F249 HydrophobicContact CB-CE2 4.3Å; E245-F249 WeakPolarHBondContact O-CD2 3.23Å; E245-F249 PolarHBondContact O-N 3.07Å
246	A	94.7	Very high	93.4	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-55.4	-45.6	172.7	0	0	0	0	0	112	C209 D241 D243 L248 T250	C209-A246 HydrophobicContact CB-CB 4.36Å; D241-A246 HydrophobicContact CB-CB 4.09Å; D243-A246 HydrophobicContact CB-CB 3.91Å; D243-A246 PolarHBondContact OD2-N 2.74Å; A246-L248 VanDerWaalsContact C-N 3.3Å; A246-L248 PolarHBondContact O-N 2.76Å; A246-T250 PolarHBondContact O-N 2.95Å; A246-T250 VanDerWaalsContact O-N 3.09Å; A246-T250 PolarHBondContact O-OG1 2.84Å
247	R	94.5	Very high	93.4	Very high	96 Å²	96	48 Å²	48	36%	0.362	24%	0.237	S	C	.	.	H	α-helix	trans	-65.2	-28.1	173.1	-77.9	-177.3	-73.3	171	-10.1	113.8	G238 D241 A242 D243 E245 R251	G238-R247 WeakPolarHBondContact O-CA 3.4Å; G238-R247 WeakPolarHBondContact O-CG 3.22Å; D241-R247 HydrophobicContact CB-CG 4.36Å; D241-R247 WeakPolarHBondContact O-CD 3.47Å; D241-R247 WeakPolarHBondContact O-CG 3.37Å; D241-R247 PolarHBondContact O-NE 3.3Å; A242-R247 PolarHBondContact O-NH2 3.32Å; D243-R247 WeakPolarHBondContact O-CG 3.32Å; D243-R247 PolarHBondContact O-N 2.8Å; D243-R247 PolarHBondContact O-NE 2.85Å; E245-R247 VanDerWaalsContact C-N 3.31Å; E245-R247 PolarHBondContact O-N 2.92Å; R247-R251 WeakPolarHBondContact O-CG 3.44Å; R247-R251 PolarHBondContact O-N 3.32Å; R247-R251 PolarHBondContact O-NH1 3.38Å
248	L	93.1	Very high	93.3	Very high	75 Å²	75	44.1 Å²	44.1	39%	0.393	22%	0.224	S	C	.	.	H	α-helix	trans	-75.6	-45.6	177.9	-177	144.4	0	0	0	111.5	Q244 E245 A246 R251 R252	Q244-L248 WeakPolarHBondContact O-CB 3.02Å; Q244-L248 PolarHBondContact O-N 3.48Å; Q244-L248 VanDerWaalsContact O-N 3.1Å; E245-L248 WeakPolarHBondContact O-CA 3.14Å; E245-L248 WeakPolarHBondContact O-CB 3.48Å; E245-L248 PolarHBondContact O-N 3.25Å; A246-L248 VanDerWaalsContact C-N 3.3Å; A246-L248 PolarHBondContact O-N 2.76Å; L248-R251 PolarHBondContact O-N 3.07Å; L248-R252 HydrophobicContact CD2-CG 4.3Å; L248-R252 WeakPolarHBondContact O-CG 3.35Å; L248-R252 PolarHBondContact O-N 2.98Å
249	F	94.2	Very high	93.1	Very high	26 Å²	26	46 Å²	46	11%	0.114	24%	0.24	C	C	.	.	H	α-helix	trans	-63.2	-41.9	175.3	-69.2	-64.3	0	0	0	112.3	K206 C209 E210 E245 R251 R252 S253	K206-F249 HydrophobicContact CD-CE2 4.48Å; K206-F249 HydrophobicContact CG-CD2 4.16Å; K206-F249 HydrophobicContact CG-CE2 3.9Å; C209-F249 HydrophobicContact CB-CB 4.13Å; E210-F249 HydrophobicContact CB-CB 4.43Å; E210-F249 HydrophobicContact CB-CD1 3.98Å; E210-F249 HydrophobicContact CB-CD2 4.03Å; E210-F249 HydrophobicContact CB-CE1 4.21Å; E210-F249 HydrophobicContact CB-CE2 4.25Å; E210-F249 HydrophobicContact CB-CG 3.9Å; E210-F249 HydrophobicContact CB-CZ 4.34Å; E210-F249 HydrophobicContact CG-CD1 3.9Å; E210-F249 HydrophobicContact CG-CE1 3.78Å; E210-F249 HydrophobicContact CG-CG 4.34Å; E210-F249 HydrophobicContact CG-CZ 4.1Å; E245-F249 HydrophobicContact CB-CE2 4.3Å; E245-F249 WeakPolarHBondContact O-CD2 3.23Å; E245-F249 PolarHBondContact O-N 3.07Å; F249-R251 PolarHBondContact O-N 2.9Å; F249-R252 WeakPolarHBondContact O-CB 3.42Å; F249-R252 PolarHBondContact O-N 3.39Å; F249-S253 PolarHBondContact O-N 3.15Å; F249-S253 PolarHBondContact O-OG 3.45Å
250	T	94.5	Very high	92.8	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.3	-25.6	178.7	-40.1	0	0	0	0	112.9	C209 L212 L235 G238 I239 A246 S253	C209-T250 PolarHBondContact SG-OG1 3.43Å; L212-T250 HydrophobicContact CD1-CG2 4.36Å; L235-T250 HydrophobicContact CD2-CG2 3.74Å; G238-T250 VanDerWaalsContact C-OG1 3.28Å; G238-T250 VanDerWaalsContact CA-OG1 3.31Å; G238-T250 WeakPolarHBondContact CA-OG1 3.31Å; G238-T250 PolarHBondContact O-OG1 3.3Å; I239-T250 HydrophobicContact CG1-CG2 3.82Å; A246-T250 PolarHBondContact O-N 2.95Å; A246-T250 VanDerWaalsContact O-N 3.09Å; A246-T250 PolarHBondContact O-OG1 2.84Å; T250-S253 PolarHBondContact O-OG 3.3Å
251	R	93.3	Very high	92.8	Very high	46 Å²	46	44.5 Å²	44.5	17%	0.174	23%	0.225	C	C	.	.	H	α-helix	trans	-82	-33.1	170.6	-65.5	-167.5	-33.7	-75.6	-3.9	113	R247 L248 F249 S253 F254 P255 I280 D283	R247-R251 WeakPolarHBondContact O-CG 3.44Å; R247-R251 PolarHBondContact O-N 3.32Å; R247-R251 PolarHBondContact O-NH1 3.38Å; L248-R251 PolarHBondContact O-N 3.07Å; F249-R251 PolarHBondContact O-N 2.9Å; R251-S253 VanDerWaalsContact C-N 3.3Å; R251-S253 PolarHBondContact O-N 2.88Å; R251-F254 WeakPolarHBondContact O-CB 3.31Å; R251-F254 PolarHBondContact O-N 3.12Å; R251-P255 WeakPolarHBondContact O-CD 3.06Å; R251-I280 HydrophobicContact CG-CG1 4.03Å; R251-D283 IonicContact CZ-OD2 2.81Å; R251-D283 IonicContact NE-OD2 3.62Å; R251-D283 PolarHBondContact NE-OD2 2.88Å; R251-D283 IonicContact NH2-OD2 3.63Å; R251-D283 PolarHBondContact NH2-OD2 2.95Å
252	R	91.4	Very high	92.6	Very high	133 Å²	133	46.9 Å²	46.9	50%	0.502	24%	0.241	S	C	.	.	H	α-helix	trans	-64	-32.7	173.7	-74.9	172.9	49.4	140.2	1.6	113	E213 L248 F249 P255	E213-R252 VanDerWaalsContact CD-NH2 3.31Å; E213-R252 IonicContact OE1-CZ 2.7Å; E213-R252 IonicContact OE1-NE 3.22Å; E213-R252 IonicContact OE1-NH2 2.7Å; E213-R252 PolarHBondContact OE1-NH2 3.45Å; E213-R252 WeakPolarHBondContact OE2-CB 3.43Å; E213-R252 IonicContact OE2-CZ 2.98Å; E213-R252 VanDerWaalsContact OE2-CZ 3.31Å; E213-R252 IonicContact OE2-NE 2.67Å; E213-R252 PolarHBondContact OE2-NE 3.33Å; E213-R252 IonicContact OE2-NH2 3.12Å; E213-R252 PolarHBondContact OE2-NH2 3.39Å; E213-R252 VanDerWaalsContact OE2-NH2 3.08Å; L248-R252 HydrophobicContact CD2-CG 4.3Å; L248-R252 WeakPolarHBondContact O-CG 3.35Å; L248-R252 PolarHBondContact O-N 2.98Å; F249-R252 WeakPolarHBondContact O-CB 3.42Å; F249-R252 PolarHBondContact O-N 3.39Å; R252-P255 WeakPolarHBondContact O-CD 3.38Å
253	S	92.7	Very high	92.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	-81.3	-17.3	177	64.1	0	0	0	0	113.8	F249 T250 R251 L256 F257	F249-S253 PolarHBondContact O-N 3.15Å; F249-S253 PolarHBondContact O-OG 3.45Å; T250-S253 PolarHBondContact O-OG 3.3Å; R251-S253 VanDerWaalsContact C-N 3.3Å; R251-S253 PolarHBondContact O-N 2.88Å; S253-L256 WeakPolarHBondContact O-CB 3.28Å; S253-L256 PolarHBondContact O-N 3.41Å; S253-L256 VanDerWaalsContact O-N 3.11Å; S253-F257 PolarHBondContact O-N 3.37Å
254	F	92.8	Very high	92.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.5	-39.1	-178.1	-158	-91.1	0	0	0	115	I239 R251 L256 F257 V258 A265 F268 L269 I280 L284	I239-F254 HydrophobicContact CD1-CD2 4.48Å; R251-F254 WeakPolarHBondContact O-CB 3.31Å; R251-F254 PolarHBondContact O-N 3.12Å; F254-L256 PolarHBondContact O-N 2.93Å; F254-F257 HydrophobicContact CD2-CD1 4.28Å; F254-F257 AromaticContact CE2-CD1 3.85Å; F254-F257 HydrophobicContact CE2-CD1 3.85Å; F254-F257 HydrophobicContact CE2-CE1 4.34Å; F254-F257 HydrophobicContact CZ-CD1 4.14Å; F254-F257 WeakPolarHBondContact O-CB 3.11Å; F254-F257 PolarHBondContact O-N 3.33Å; F254-F257 VanDerWaalsContact O-N 3.11Å; F254-V258 HydrophobicContact CD1-CG2 3.72Å; F254-V258 HydrophobicContact CE1-CG2 3.5Å; F254-V258 VanDerWaalsContact CE1-CG2 3.5Å; F254-V258 HydrophobicContact CZ-CG2 4.42Å; F254-V258 WeakPolarHBondContact O-CG2 3.5Å; F254-V258 PolarHBondContact O-N 3.26Å; F254-A265 HydrophobicContact CZ-CB 4.36Å; F254-F268 AromaticContact CE2-CD1 3.59Å; F254-F268 HydrophobicContact CE2-CD1 3.59Å; F254-F268 AromaticContact CE2-CE1 3.7Å; F254-F268 HydrophobicContact CE2-CE1 3.7Å; F254-F268 HydrophobicContact CE2-CG 4.45Å; F254-F268 AromaticContact CZ-CD1 3.9Å; F254-F268 HydrophobicContact CZ-CD1 3.9Å; F254-F268 HydrophobicContact CZ-CE1 4.42Å; F254-L269 HydrophobicContact CE1-CD1 4.21Å; F254-L269 HydrophobicContact CE1-CD2 3.91Å; F254-L269 HydrophobicContact CE1-CG 4.05Å; F254-L269 HydrophobicContact CZ-CD2 3.9Å; F254-L269 HydrophobicContact CZ-CG 3.95Å; F254-I280 HydrophobicContact CB-CG2 4.37Å; F254-I280 HydrophobicContact CD1-CG2 3.35Å; F254-I280 HydrophobicContact CE1-CG2 3.69Å; F254-I280 HydrophobicContact CG-CG2 3.83Å; F254-I280 HydrophobicContact CZ-CG2 4.42Å; F254-L284 HydrophobicContact CD1-CD1 4.09Å; F254-L284 HydrophobicContact CD1-CD2 4.33Å; F254-L284 HydrophobicContact CD1-CG 4.43Å; F254-L284 HydrophobicContact CE1-CD1 4.14Å
255	P	91.4	Very high	92	Very high	24 Å²	24	43.3 Å²	43.3	16%	0.156	21%	0.209	C	C	.	.	H	α-helix	trans	-53.8	-36.5	169.7	-28.8	34.7	0	0	0	114.4	R251 R252 A259 L284 A287 L289	R251-P255 WeakPolarHBondContact O-CD 3.06Å; R252-P255 WeakPolarHBondContact O-CD 3.38Å; P255-A259 WeakPolarHBondContact O-CB 3.49Å; P255-A259 PolarHBondContact O-N 2.98Å; P255-L284 HydrophobicContact CB-CD2 4.21Å; P255-L284 HydrophobicContact CG-CD2 4.03Å; P255-A287 HydrophobicContact CB-CB 4.29Å; P255-A287 HydrophobicContact CG-CB 4.16Å; P255-L289 HydrophobicContact CB-CD1 3.82Å
256	L	92.3	Very high	91.7	Very high	56 Å²	56	41.2 Å²	41.2	29%	0.293	20%	0.201	S	C	.	.	H	α-helix	trans	-72.3	-34.9	177.7	-57.1	172.1	0	0	0	111.6	E213 F216 R217 S253 F254 A259 K260	E213-L256 HydrophobicContact CG-CD1 4Å; E213-L256 WeakPolarHBondContact O-CD1 3.36Å; F216-L256 HydrophobicContact CB-CB 3.6Å; F216-L256 HydrophobicContact CB-CD1 4.21Å; R217-L256 HydrophobicContact CB-CD1 4.11Å; S253-L256 WeakPolarHBondContact O-CB 3.28Å; S253-L256 PolarHBondContact O-N 3.41Å; S253-L256 VanDerWaalsContact O-N 3.11Å; F254-L256 PolarHBondContact O-N 2.93Å; L256-A259 PolarHBondContact O-N 3.5Å; L256-K260 PolarHBondContact O-N 3.5Å
257	F	93.1	Very high	91.5	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-46.9	172.4	-179.5	-115	0	0	0	111.5	F216 L228 Q232 L235 S253 F254 A259 K260 F261 A265 F268	F216-F257 HydrophobicContact CD1-CD2 4.41Å; F216-F257 AromaticContact CE1-CD2 3.76Å; F216-F257 HydrophobicContact CE1-CD2 3.76Å; F216-F257 HydrophobicContact CZ-CB 4.49Å; F216-F257 AromaticContact CZ-CD2 3.99Å; F216-F257 HydrophobicContact CZ-CD2 3.99Å; L228-F257 HydrophobicContact CD1-CE2 3.85Å; L228-F257 HydrophobicContact CD1-CZ 4.23Å; Q232-F257 HydrophobicContact CG-CZ 4.18Å; L235-F257 HydrophobicContact CD1-CB 4.37Å; L235-F257 HydrophobicContact CD1-CD1 3.73Å; L235-F257 HydrophobicContact CD1-CD2 3.99Å; L235-F257 HydrophobicContact CD1-CE1 3.92Å; L235-F257 HydrophobicContact CD1-CE2 4.2Å; L235-F257 HydrophobicContact CD1-CG 3.76Å; L235-F257 HydrophobicContact CD1-CZ 4.17Å; S253-F257 PolarHBondContact O-N 3.37Å; F254-F257 HydrophobicContact CD2-CD1 4.28Å; F254-F257 AromaticContact CE2-CD1 3.85Å; F254-F257 HydrophobicContact CE2-CD1 3.85Å; F254-F257 HydrophobicContact CE2-CE1 4.34Å; F254-F257 HydrophobicContact CZ-CD1 4.14Å; F254-F257 WeakPolarHBondContact O-CB 3.11Å; F254-F257 PolarHBondContact O-N 3.33Å; F254-F257 VanDerWaalsContact O-N 3.11Å; F257-A259 VanDerWaalsContact C-N 3.31Å; F257-A259 PolarHBondContact O-N 2.64Å; F257-K260 PolarHBondContact O-N 2.89Å; F257-F261 HydrophobicContact CD2-CB 4.45Å; F257-F261 AromaticContact CD2-CD2 3.79Å; F257-F261 HydrophobicContact CD2-CD2 3.79Å; F257-F261 HydrophobicContact CE2-CB 4.09Å; F257-F261 AromaticContact CE2-CD2 3.71Å; F257-F261 HydrophobicContact CE2-CD2 3.71Å; F257-F261 HydrophobicContact CE2-CG 4.25Å; F257-F261 HydrophobicContact CZ-CB 4.4Å; F257-F261 PolarHBondContact O-N 3.47Å; F257-A265 HydrophobicContact CD1-CB 3.87Å; F257-A265 HydrophobicContact CE1-CB 3.77Å; F257-F268 HydrophobicContact CE1-CB 4.49Å
258	V	91.6	Very high	91.3	Very high	16 Å²	16	41.7 Å²	41.7	10%	0.097	21%	0.21	C	C	.	.	H	α-helix	trans	-58.6	-40.8	174.3	173.2	0	0	0	0	111.8	F254 K260 A265 L284 L289 I293	F254-V258 HydrophobicContact CD1-CG2 3.72Å; F254-V258 HydrophobicContact CE1-CG2 3.5Å; F254-V258 VanDerWaalsContact CE1-CG2 3.5Å; F254-V258 HydrophobicContact CZ-CG2 4.42Å; F254-V258 WeakPolarHBondContact O-CG2 3.5Å; F254-V258 PolarHBondContact O-N 3.26Å; V258-K260 VanDerWaalsContact C-N 3.29Å; V258-K260 PolarHBondContact O-N 2.95Å; V258-A265 HydrophobicContact CB-CB 4.44Å; V258-A265 HydrophobicContact CG2-CB 3.78Å; V258-L284 HydrophobicContact CB-CD2 4.36Å; V258-L284 HydrophobicContact CG2-CD1 4.23Å; V258-L284 HydrophobicContact CG2-CD2 3.91Å; V258-L289 HydrophobicContact CG1-CD1 4.48Å; V258-I293 HydrophobicContact CG1-CD1 4.34Å
259	A	89.1	Confident	91.1	Very high	39 Å²	39	38.4 Å²	38.4	32%	0.322	19%	0.192	S	C	.	.	H	α-helix	trans	-67.8	-23.3	-179.9	0	0	0	0	0	114.3	P255 L256 F257	P255-A259 WeakPolarHBondContact O-CB 3.49Å; P255-A259 PolarHBondContact O-N 2.98Å; L256-A259 PolarHBondContact O-N 3.5Å; F257-A259 VanDerWaalsContact C-N 3.31Å; F257-A259 PolarHBondContact O-N 2.64Å
260	K	89.1	Confident	90.8	Very high	33 Å²	33	42.9 Å²	42.9	14%	0.143	21%	0.214	C	C	.	.	H	α-helix	trans	-97.7	-34.1	175.4	-69.2	-174.9	-173	-99.4	0	113.5	F216 W219 L221 L224 L256 F257 V258	F216-K260 WeakPolarHBondContact O-CE 3.14Å; W219-K260 PolarHBondContact O-NZ 3.23Å; L221-K260 HydrophobicContact CD2-CB 3.8Å; L221-K260 HydrophobicContact CD2-CD 3.93Å; L221-K260 HydrophobicContact CD2-CG 3.81Å; L224-K260 HydrophobicContact CD1-CD 3.5Å; L256-K260 PolarHBondContact O-N 3.5Å; F257-K260 PolarHBondContact O-N 2.89Å; V258-K260 VanDerWaalsContact C-N 3.29Å; V258-K260 PolarHBondContact O-N 2.95Å
261	F	91.7	Very high	90.6	Very high	12 Å²	12	49.4 Å²	49.4	5%	0.053	25%	0.249	C	C	.	.			trans	-136.3	66.5	-168.7	-60.4	-62.8	0	0	0	112.3	L221 L224 E225 L228 F257 E263 Q264 A265	L221-F261 HydrophobicContact CD2-CZ 4.42Å; L224-F261 HydrophobicContact CB-CE2 3.89Å; L224-F261 HydrophobicContact CB-CZ 3.78Å; E225-F261 HydrophobicContact CG-CE1 3.65Å; E225-F261 HydrophobicContact CG-CZ 4Å; L228-F261 HydrophobicContact CD1-CD2 4.33Å; L228-F261 HydrophobicContact CD1-CG 4.42Å; F257-F261 HydrophobicContact CD2-CB 4.45Å; F257-F261 AromaticContact CD2-CD2 3.79Å; F257-F261 HydrophobicContact CD2-CD2 3.79Å; F257-F261 HydrophobicContact CE2-CB 4.09Å; F257-F261 AromaticContact CE2-CD2 3.71Å; F257-F261 HydrophobicContact CE2-CD2 3.71Å; F257-F261 HydrophobicContact CE2-CG 4.25Å; F257-F261 HydrophobicContact CZ-CB 4.4Å; F257-F261 PolarHBondContact O-N 3.47Å; F261-E263 PolarHBondContact O-N 2.84Å; F261-Q264 HydrophobicContact CB-CB 4.3Å; F261-Q264 PolarHBondContact O-N 2.84Å; F261-A265 WeakPolarHBondContact O-CB 3.26Å; F261-A265 PolarHBondContact O-N 3.03Å
262	P	89.6	Confident	90.3	Very high	71 Å²	71	48 Å²	48	46%	0.461	25%	0.245	S	C	.	.	H	α-helix	trans	-63.8	-44.1	-169.6	24	-33.9	0	0	0	113.5	A265 N266	P262-A265 PolarHBondContact O-N 3.44Å; P262-N266 VanDerWaalsContact O-CG 3.31Å; P262-N266 PolarHBondContact O-N 3.21Å; P262-N266 PolarHBondContact O-ND2 2.91Å
263	E	87.4	Confident	90.2	Very high	134 Å²	134	46.2 Å²	46.2	63%	0.626	25%	0.245	S	C	*	.	H	α-helix	trans	-67	-45.1	-179.8	-59.6	179.8	151.7	0	0	111.6	F261 A265 N266 L267	F261-E263 PolarHBondContact O-N 2.84Å; E263-A265 VanDerWaalsContact C-N 3.29Å; E263-A265 PolarHBondContact O-N 2.87Å; E263-N266 WeakPolarHBondContact O-CB 3.49Å; E263-N266 PolarHBondContact O-N 3.45Å; E263-N266 VanDerWaalsContact O-N 3.17Å; E263-L267 WeakPolarHBondContact O-CG 3.24Å; E263-L267 PolarHBondContact O-N 3.42Å
264	Q	90.8	Very high	89.9	Confident	55 Å²	55	49.4 Å²	49.4	26%	0.257	27%	0.267	S	S	.	.	H	α-helix	trans	-71.8	-28.7	-178	-54.8	76.1	16	0	0	110.6	L228 F261 F268	L228-Q264 HydrophobicContact CD2-CB 4.39Å; L228-Q264 HydrophobicContact CD2-CG 4.02Å; F261-Q264 HydrophobicContact CB-CB 4.3Å; F261-Q264 PolarHBondContact O-N 2.84Å; Q264-F268 VanDerWaalsContact O-CB 3.24Å; Q264-F268 WeakPolarHBondContact O-CB 3.37Å; Q264-F268 PolarHBondContact O-N 3.29Å
265	A	90.7	Very high	89.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-70.9	-37	169	0	0	0	0	0	112.9	F254 F257 V258 F261 P262 E263 F268 L269	F254-A265 HydrophobicContact CZ-CB 4.36Å; F257-A265 HydrophobicContact CD1-CB 3.87Å; F257-A265 HydrophobicContact CE1-CB 3.77Å; V258-A265 HydrophobicContact CB-CB 4.44Å; V258-A265 HydrophobicContact CG2-CB 3.78Å; F261-A265 WeakPolarHBondContact O-CB 3.26Å; F261-A265 PolarHBondContact O-N 3.03Å; P262-A265 PolarHBondContact O-N 3.44Å; E263-A265 VanDerWaalsContact C-N 3.29Å; E263-A265 PolarHBondContact O-N 2.87Å; A265-F268 WeakPolarHBondContact O-CB 3.26Å; A265-F268 PolarHBondContact O-N 2.87Å; A265-L269 WeakPolarHBondContact O-CG 3.35Å; A265-L269 PolarHBondContact O-N 3.35Å
266	N	88.7	Confident	89.6	Confident	50 Å²	50	59.7 Å²	59.7	27%	0.267	31%	0.312	S	S	.	.	H	α-helix	trans	-63.1	-48.1	172.4	-74.4	-24	0	0	0	111.3	P262 E263 F268 L269 Q270	P262-N266 VanDerWaalsContact O-CG 3.31Å; P262-N266 PolarHBondContact O-N 3.21Å; P262-N266 PolarHBondContact O-ND2 2.91Å; E263-N266 WeakPolarHBondContact O-CB 3.49Å; E263-N266 PolarHBondContact O-N 3.45Å; E263-N266 VanDerWaalsContact O-N 3.17Å; N266-F268 VanDerWaalsContact C-N 3.27Å; N266-F268 PolarHBondContact O-N 2.89Å; N266-L269 PolarHBondContact O-N 2.69Å; N266-Q270 VanDerWaalsContact O-CG 3.32Å; N266-Q270 WeakPolarHBondContact O-CG 3.43Å; N266-Q270 PolarHBondContact O-N 3.44Å
267	L	89.2	Confident	89.5	Confident	99 Å²	99	60.4 Å²	60.4	52%	0.518	31%	0.311	S	S	.	.	H	α-helix	trans	-59.6	-37.5	173.3	-68.5	171.8	0	0	0	111.9	E263 N271	E263-L267 WeakPolarHBondContact O-CG 3.24Å; E263-L267 PolarHBondContact O-N 3.42Å; L267-N271 PolarHBondContact O-N 3.05Å; L267-N271 PolarHBondContact O-ND2 3.14Å
268	F	91.4	Very high	89.3	Confident	7 Å²	7	66.7 Å²	66.7	3%	0.031	34%	0.338	C	S	.	.	H	α-helix	trans	-64.7	-47.4	175.4	-171.6	-84.2	0	0	0	112.1	Q232 L235 R236 I239 F254 F257 Q264 A265 N266 Q270 N271 L272	Q232-F268 HydrophobicContact CB-CD2 4.27Å; Q232-F268 HydrophobicContact CB-CE2 4.16Å; Q232-F268 HydrophobicContact CG-CD2 4.13Å; Q232-F268 HydrophobicContact CG-CE2 4.45Å; Q232-F268 WeakPolarHBondContact O-CE2 3.5Å; L235-F268 HydrophobicContact CB-CE1 4.41Å; L235-F268 HydrophobicContact CB-CE2 3.93Å; L235-F268 HydrophobicContact CB-CZ 3.55Å; R236-F268 HydrophobicContact CG-CE2 3.67Å; R236-F268 HydrophobicContact CG-CZ 3.85Å; I239-F268 HydrophobicContact CD1-CE1 3.7Å; I239-F268 HydrophobicContact CD1-CZ 4.05Å; F254-F268 AromaticContact CE2-CD1 3.59Å; F254-F268 HydrophobicContact CE2-CD1 3.59Å; F254-F268 AromaticContact CE2-CE1 3.7Å; F254-F268 HydrophobicContact CE2-CE1 3.7Å; F254-F268 HydrophobicContact CE2-CG 4.45Å; F254-F268 AromaticContact CZ-CD1 3.9Å; F254-F268 HydrophobicContact CZ-CD1 3.9Å; F254-F268 HydrophobicContact CZ-CE1 4.42Å; F257-F268 HydrophobicContact CE1-CB 4.49Å; Q264-F268 VanDerWaalsContact O-CB 3.24Å; Q264-F268 WeakPolarHBondContact O-CB 3.37Å; Q264-F268 PolarHBondContact O-N 3.29Å; A265-F268 WeakPolarHBondContact O-CB 3.26Å; A265-F268 PolarHBondContact O-N 2.87Å; N266-F268 VanDerWaalsContact C-N 3.27Å; N266-F268 PolarHBondContact O-N 2.89Å; F268-Q270 PolarHBondContact O-N 3.42Å; F268-N271 PolarHBondContact O-N 2.9Å; F268-L272 HydrophobicContact CD1-CD1 4.12Å; F268-L272 HydrophobicContact CD1-CG 4.33Å; F268-L272 HydrophobicContact CE1-CD1 3.87Å; F268-L272 HydrophobicContact CE1-CD2 4.3Å; F268-L272 HydrophobicContact CE1-CG 4.18Å; F268-L272 PolarHBondContact O-N 3.32Å
269	L	89	Confident	89.1	Confident	5 Å²	5	69.4 Å²	69.4	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-61.6	-42	177.2	-73.4	172.4	0	0	0	111.8	F254 A265 N266 N271 L272 R277 I280 L284 I293	F254-L269 HydrophobicContact CE1-CD1 4.21Å; F254-L269 HydrophobicContact CE1-CD2 3.91Å; F254-L269 HydrophobicContact CE1-CG 4.05Å; F254-L269 HydrophobicContact CZ-CD2 3.9Å; F254-L269 HydrophobicContact CZ-CG 3.95Å; A265-L269 WeakPolarHBondContact O-CG 3.35Å; A265-L269 PolarHBondContact O-N 3.35Å; N266-L269 PolarHBondContact O-N 2.69Å; L269-N271 PolarHBondContact O-N 2.95Å; L269-L272 HydrophobicContact CD2-CD1 4.4Å; L269-L272 PolarHBondContact O-N 3.49Å; L269-R277 HydrophobicContact CB-CG 4.25Å; L269-R277 HydrophobicContact CD2-CG 4.16Å; L269-R277 WeakPolarHBondContact O-CD 3.5Å; L269-R277 PolarHBondContact O-NE 3.35Å; L269-R277 PolarHBondContact O-NH2 2.91Å; L269-I280 HydrophobicContact CD2-CB 4.27Å; L269-I280 HydrophobicContact CD2-CG2 3.9Å; L269-L284 HydrophobicContact CD1-CD1 4.4Å; L269-I293 HydrophobicContact CD1-CG2 4Å
270	Q	87.6	Confident	89.2	Confident	121 Å²	121	67.7 Å²	67.7	57%	0.565	34%	0.337	S	S	*	.	H	α-helix	trans	-58.3	-30.3	176.8	-74.7	173.4	2.9	0	0	113.2	N266 F268 R277	N266-Q270 VanDerWaalsContact O-CG 3.32Å; N266-Q270 WeakPolarHBondContact O-CG 3.43Å; N266-Q270 PolarHBondContact O-N 3.44Å; F268-Q270 PolarHBondContact O-N 3.42Å; Q270-R277 PolarHBondContact O-NH2 2.91Å
271	N	89.1	Confident	89.1	Confident	136 Å²	136	69.1 Å²	69.1	73%	0.727	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	2.8	178.4	-75.1	-74.2	0	0	0	114.5	L267 F268 L269	L267-N271 PolarHBondContact O-N 3.05Å; L267-N271 PolarHBondContact O-ND2 3.14Å; F268-N271 PolarHBondContact O-N 2.9Å; L269-N271 PolarHBondContact O-N 2.95Å
272	L	88.5	Confident	88.9	Confident	17 Å²	17	73.8 Å²	73.8	9%	0.089	37%	0.365	C	S	.	.	S	Bend	trans	-94.7	147.9	175	-73.2	-178.8	0	0	0	113.4	I239 F268 L269 R277 I280	I239-L272 HydrophobicContact CD1-CD1 4.36Å; F268-L272 HydrophobicContact CD1-CD1 4.12Å; F268-L272 HydrophobicContact CD1-CG 4.33Å; F268-L272 HydrophobicContact CE1-CD1 3.87Å; F268-L272 HydrophobicContact CE1-CD2 4.3Å; F268-L272 HydrophobicContact CE1-CG 4.18Å; F268-L272 PolarHBondContact O-N 3.32Å; L269-L272 HydrophobicContact CD2-CD1 4.4Å; L269-L272 PolarHBondContact O-N 3.49Å; L272-R277 HydrophobicContact CB-CB 4.41Å; L272-R277 PolarHBondContact O-NE 2.78Å; L272-R277 PolarHBondContact O-NH2 2.97Å; L272-I280 HydrophobicContact CD1-CD1 3.6Å
273	D	88.7	Confident	88.7	Confident	95 Å²	95	72.2 Å²	72.2	51%	0.508	35%	0.353	S	S	.	.			trans	-47.4	136.1	168.3	-55.3	-61.3	0	0	0	111.8	Q275 K276 R277	D273-Q275 PolarHBondContact O-N 2.72Å; D273-K276 HydrophobicContact CB-CB 4.38Å; D273-K276 HydrophobicContact CB-CD 4.1Å; D273-K276 HydrophobicContact CB-CG 4.19Å; D273-K276 PolarHBondContact O-N 3.31Å; D273-K276 WeakPolarHBondContact OD2-CD 3.5Å; D273-K276 WeakPolarHBondContact OD2-CE 3.44Å; D273-K276 IonicContact OD2-NZ 3.23Å; D273-K276 PolarHBondContact OD2-NZ 3.25Å; D273-R277 PolarHBondContact O-N 3.26Å
274	S	86	Confident	88.7	Confident	67 Å²	67	66.1 Å²	66.1	47%	0.469	32%	0.324	S	S	.	.	H	α-helix	trans	-53.6	-34.4	-176.1	-171.8	0	0	0	0	113.7	K278	S274-K278 WeakPolarHBondContact O-CB 3.25Å; S274-K278 WeakPolarHBondContact O-CD 3.46Å; S274-K278 VanDerWaalsContact O-CG 3.27Å; S274-K278 WeakPolarHBondContact O-CG 3.21Å; S274-K278 PolarHBondContact O-N 3.1Å; S274-K278 VanDerWaalsContact O-N 3.08Å; S274-K278 PolarHBondContact OG-NZ 3.35Å
275	Q	88.9	Confident	88.3	Confident	176 Å²	176	68.8 Å²	68.8	82%	0.822	34%	0.339	S	S	*	.	H	α-helix	trans	-68.5	-42.9	175.8	-69.8	-176.2	-21.2	0	0	113.1	D273 L279	D273-Q275 PolarHBondContact O-N 2.72Å; Q275-L279 PolarHBondContact O-N 2.94Å
276	K	89	Confident	87.7	Confident	65 Å²	65	73 Å²	73	28%	0.283	37%	0.374	S	S	.	.	H	α-helix	trans	-67.9	-44.1	177.8	-66.3	174.6	-176.1	163.5	0	110.4	I239 S240 D273 L279 I280	I239-K276 HydrophobicContact CG2-CB 4.33Å; I239-K276 HydrophobicContact CG2-CD 4.03Å; I239-K276 HydrophobicContact CG2-CG 4.37Å; S240-K276 PolarHBondContact OG-NZ 2.88Å; D273-K276 HydrophobicContact CB-CB 4.38Å; D273-K276 HydrophobicContact CB-CD 4.1Å; D273-K276 HydrophobicContact CB-CG 4.19Å; D273-K276 PolarHBondContact O-N 3.31Å; D273-K276 WeakPolarHBondContact OD2-CD 3.5Å; D273-K276 WeakPolarHBondContact OD2-CE 3.44Å; D273-K276 IonicContact OD2-NZ 3.23Å; D273-K276 PolarHBondContact OD2-NZ 3.25Å; K276-L279 PolarHBondContact O-N 3.45Å; K276-I280 WeakPolarHBondContact O-CG1 3.23Å; K276-I280 PolarHBondContact O-N 3.36Å
277	R	90.3	Very high	87.1	Confident	71 Å²	71	73.1 Å²	73.1	27%	0.268	38%	0.382	S	S	.	.	H	α-helix	trans	-56.4	-54.5	177.9	-158.6	-167.1	-56.2	-158.8	-6.9	111.5	L269 Q270 L272 D273 L279 I280 E281	L269-R277 HydrophobicContact CB-CG 4.25Å; L269-R277 HydrophobicContact CD2-CG 4.16Å; L269-R277 WeakPolarHBondContact O-CD 3.5Å; L269-R277 PolarHBondContact O-NE 3.35Å; L269-R277 PolarHBondContact O-NH2 2.91Å; Q270-R277 PolarHBondContact O-NH2 2.91Å; L272-R277 HydrophobicContact CB-CB 4.41Å; L272-R277 PolarHBondContact O-NE 2.78Å; L272-R277 PolarHBondContact O-NH2 2.97Å; D273-R277 PolarHBondContact O-N 3.26Å; R277-L279 VanDerWaalsContact C-N 3.26Å; R277-L279 PolarHBondContact O-N 3.45Å; R277-I280 PolarHBondContact O-N 3.02Å; R277-E281 WeakPolarHBondContact CD-OE1 3.49Å; R277-E281 HydrophobicContact CG-CG 4.39Å; R277-E281 VanDerWaalsContact CG-OE1 3.23Å; R277-E281 WeakPolarHBondContact CG-OE1 3.17Å; R277-E281 WeakPolarHBondContact O-CG 3.35Å; R277-E281 PolarHBondContact O-N 2.98Å
278	K	88.2	Confident	86.3	Confident	131 Å²	131	70.4 Å²	70.4	57%	0.57	38%	0.378	S	S	*	.	H	α-helix	trans	-57.7	-33.6	178.2	-75.8	169.7	177.8	166.8	0	114.1	S274 E281 K282	S274-K278 WeakPolarHBondContact O-CB 3.25Å; S274-K278 WeakPolarHBondContact O-CD 3.46Å; S274-K278 VanDerWaalsContact O-CG 3.27Å; S274-K278 WeakPolarHBondContact O-CG 3.21Å; S274-K278 PolarHBondContact O-N 3.1Å; S274-K278 VanDerWaalsContact O-N 3.08Å; S274-K278 PolarHBondContact OG-NZ 3.35Å; K278-E281 VanDerWaalsContact CA-OE2 3.29Å; K278-E281 WeakPolarHBondContact CA-OE2 3.48Å; K278-K282 VanDerWaalsContact O-CB 3.23Å; K278-K282 WeakPolarHBondContact O-CB 3.26Å; K278-K282 PolarHBondContact O-N 3.42Å; K278-K282 VanDerWaalsContact O-N 3.09Å
279	L	89.2	Confident	84.9	Confident	74 Å²	74	73 Å²	73	39%	0.387	39%	0.391	S	S	.	.	H	α-helix	trans	-69.7	-38.9	176.3	-175.6	60.8	0	0	0	111.8	Q275 K276 R277 D283	Q275-L279 PolarHBondContact O-N 2.94Å; K276-L279 PolarHBondContact O-N 3.45Å; R277-L279 VanDerWaalsContact C-N 3.26Å; R277-L279 PolarHBondContact O-N 3.45Å; L279-D283 PolarHBondContact O-N 3.2Å; L279-D283 VanDerWaalsContact O-N 3.15Å
280	I	89.9	Confident	83.1	Confident	3 Å²	3	75.9 Å²	75.9	2%	0.015	41%	0.412	C	S	.	.	H	α-helix	trans	-73.6	-44.9	177.3	-63.5	164.1	0	0	0	110.8	I239 R251 F254 L269 L272 K276 R277 K282 D283 L284	I239-I280 HydrophobicContact CD1-CD1 3.8Å; I239-I280 HydrophobicContact CG1-CD1 4.35Å; I239-I280 HydrophobicContact CG2-CD1 4.35Å; R251-I280 HydrophobicContact CG-CG1 4.03Å; F254-I280 HydrophobicContact CB-CG2 4.37Å; F254-I280 HydrophobicContact CD1-CG2 3.35Å; F254-I280 HydrophobicContact CE1-CG2 3.69Å; F254-I280 HydrophobicContact CG-CG2 3.83Å; F254-I280 HydrophobicContact CZ-CG2 4.42Å; L269-I280 HydrophobicContact CD2-CB 4.27Å; L269-I280 HydrophobicContact CD2-CG2 3.9Å; L272-I280 HydrophobicContact CD1-CD1 3.6Å; K276-I280 WeakPolarHBondContact O-CG1 3.23Å; K276-I280 PolarHBondContact O-N 3.36Å; R277-I280 PolarHBondContact O-N 3.02Å; I280-K282 VanDerWaalsContact C-N 3.29Å; I280-K282 PolarHBondContact O-N 2.91Å; I280-D283 CarbonylContact O-C 3.53Å; I280-D283 PolarHBondContact O-N 3.38Å; I280-L284 HydrophobicContact CG2-CD1 4Å; I280-L284 HydrophobicContact CG2-CG 4.33Å; I280-L284 WeakPolarHBondContact O-CG 3.38Å; I280-L284 PolarHBondContact O-N 3.02Å
281	E	88	Confident	80.9	Confident	62 Å²	62	76.1 Å²	76.1	29%	0.29	41%	0.413	S	S	.	.	H	α-helix	trans	-53.6	-45.7	173.7	-71	163.5	172.4	0	0	111.1	R277 K278 D283 L284 I285	R277-E281 WeakPolarHBondContact CD-OE1 3.49Å; R277-E281 HydrophobicContact CG-CG 4.39Å; R277-E281 VanDerWaalsContact CG-OE1 3.23Å; R277-E281 WeakPolarHBondContact CG-OE1 3.17Å; R277-E281 WeakPolarHBondContact O-CG 3.35Å; R277-E281 PolarHBondContact O-N 2.98Å; K278-E281 VanDerWaalsContact CA-OE2 3.29Å; K278-E281 WeakPolarHBondContact CA-OE2 3.48Å; E281-D283 PolarHBondContact O-N 3.13Å; E281-L284 PolarHBondContact O-N 3.32Å; E281-I285 VanDerWaalsContact O-CG1 3.28Å; E281-I285 WeakPolarHBondContact O-CG1 3.46Å; E281-I285 PolarHBondContact O-N 2.81Å
282	K	88	Confident	78.6	Confident	111 Å²	111	72.8 Å²	72.8	48%	0.483	41%	0.411	S	S	.	.	H	α-helix	trans	-67.6	-32.7	177.2	-174	-120.9	63.7	-172.2	0	113	K278 I280 A286	K278-K282 VanDerWaalsContact O-CB 3.23Å; K278-K282 WeakPolarHBondContact O-CB 3.26Å; K278-K282 PolarHBondContact O-N 3.42Å; K278-K282 VanDerWaalsContact O-N 3.09Å; I280-K282 VanDerWaalsContact C-N 3.29Å; I280-K282 PolarHBondContact O-N 2.91Å; K282-A286 PolarHBondContact O-N 3.24Å
283	D	85.3	Confident	76.4	Confident	38 Å²	38	75 Å²	75	20%	0.203	42%	0.422	C	S	.	.	H	α-helix	trans	-75.2	-31.1	173.5	-72.5	-12.5	0	0	0	111.4	R251 L279 I280 E281 A286 A287	R251-D283 IonicContact CZ-OD2 2.81Å; R251-D283 IonicContact NE-OD2 3.62Å; R251-D283 PolarHBondContact NE-OD2 2.88Å; R251-D283 IonicContact NH2-OD2 3.63Å; R251-D283 PolarHBondContact NH2-OD2 2.95Å; L279-D283 PolarHBondContact O-N 3.2Å; L279-D283 VanDerWaalsContact O-N 3.15Å; I280-D283 CarbonylContact O-C 3.53Å; I280-D283 PolarHBondContact O-N 3.38Å; E281-D283 PolarHBondContact O-N 3.13Å; D283-A286 PolarHBondContact O-N 3.44Å; D283-A287 PolarHBondContact O-N 2.97Å
284	L	85.7	Confident	73.7	Confident	5 Å²	5	74 Å²	74	3%	0.026	44%	0.435	C	S	.	.	H	α-helix	trans	-70.8	-39	172.8	-75.4	167.9	0	0	0	113.2	F254 P255 V258 L269 I280 E281 A286 A287 G288 L289 I293	F254-L284 HydrophobicContact CD1-CD1 4.09Å; F254-L284 HydrophobicContact CD1-CD2 4.33Å; F254-L284 HydrophobicContact CD1-CG 4.43Å; F254-L284 HydrophobicContact CE1-CD1 4.14Å; P255-L284 HydrophobicContact CB-CD2 4.21Å; P255-L284 HydrophobicContact CG-CD2 4.03Å; V258-L284 HydrophobicContact CB-CD2 4.36Å; V258-L284 HydrophobicContact CG2-CD1 4.23Å; V258-L284 HydrophobicContact CG2-CD2 3.91Å; L269-L284 HydrophobicContact CD1-CD1 4.4Å; I280-L284 HydrophobicContact CG2-CD1 4Å; I280-L284 HydrophobicContact CG2-CG 4.33Å; I280-L284 WeakPolarHBondContact O-CG 3.38Å; I280-L284 PolarHBondContact O-N 3.02Å; E281-L284 PolarHBondContact O-N 3.32Å; L284-A286 VanDerWaalsContact C-N 3.28Å; L284-A286 PolarHBondContact O-N 2.89Å; L284-A287 CarbonylContact O-C 3.5Å; L284-A287 WeakPolarHBondContact O-CA 3.38Å; L284-A287 WeakPolarHBondContact O-CB 3.4Å; L284-A287 PolarHBondContact O-N 3.39Å; L284-G288 PolarHBondContact O-N 2.64Å; L284-G288 VanDerWaalsContact O-N 3.09Å; L284-L289 HydrophobicContact CD2-CB 4.4Å; L284-L289 HydrophobicContact CD2-CD1 4.08Å; L284-L289 PolarHBondContact O-N 2.93Å; L284-L289 VanDerWaalsContact O-N 3.16Å; L284-I293 HydrophobicContact CD1-CD1 4.36Å
285	I	82.4	Confident	71.2	Confident	111 Å²	111	76 Å²	76	57%	0.569	46%	0.456	S	S	*	.	H	α-helix	trans	-61.1	-40.7	172.2	-70.5	162.3	0	0	0	110.1	E281 A287 G288	E281-I285 VanDerWaalsContact O-CG1 3.28Å; E281-I285 WeakPolarHBondContact O-CG1 3.46Å; E281-I285 PolarHBondContact O-N 2.81Å; I285-A287 PolarHBondContact O-N 3.29Å; I285-G288 PolarHBondContact O-N 3.23Å; I285-G288 VanDerWaalsContact O-N 3.09Å
286	A	79.6	Confident	68.4	Low	88 Å²	88	70.9 Å²	70.9	73%	0.727	45%	0.45	S	S	*	.	H	α-helix	trans	-66.5	-24	174.2	0	0	0	0	0	113.4	K282 D283 L284	K282-A286 PolarHBondContact O-N 3.24Å; D283-A286 PolarHBondContact O-N 3.44Å; L284-A286 VanDerWaalsContact C-N 3.28Å; L284-A286 PolarHBondContact O-N 2.89Å
287	A	75.6	Confident	65.8	Low	53 Å²	53	75.4 Å²	75.4	44%	0.438	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-4.2	172.3	0	0	0	0	0	114	P255 D283 L284 I285 L289	P255-A287 HydrophobicContact CB-CB 4.29Å; P255-A287 HydrophobicContact CG-CB 4.16Å; D283-A287 PolarHBondContact O-N 2.97Å; L284-A287 CarbonylContact O-C 3.5Å; L284-A287 WeakPolarHBondContact O-CA 3.38Å; L284-A287 WeakPolarHBondContact O-CB 3.4Å; L284-A287 PolarHBondContact O-N 3.39Å; I285-A287 PolarHBondContact O-N 3.29Å; A287-L289 HydrophobicContact CB-CG 4.49Å
288	G	72.3	Confident	63.2	Low	42 Å²	42	78.6 Å²	78.6	43%	0.433	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	10.6	178.8	0	0	0	0	0	115.8	L284 I285 S290	L284-G288 PolarHBondContact O-N 2.64Å; L284-G288 VanDerWaalsContact O-N 3.09Å; I285-G288 PolarHBondContact O-N 3.23Å; I285-G288 VanDerWaalsContact O-N 3.09Å; G288-S290 VanDerWaalsContact C-N 3.31Å; G288-S290 PolarHBondContact O-N 2.59Å
289	L	62.5	Low	60.6	Low	61 Å²	61	76.2 Å²	76.2	32%	0.319	51%	0.509	S	S	.	.			trans	-92.1	36.2	-175.3	-60.9	178.7	0	0	0	113.3	P255 V258 L284 A287	P255-L289 HydrophobicContact CB-CD1 3.82Å; V258-L289 HydrophobicContact CG1-CD1 4.48Å; L284-L289 HydrophobicContact CD2-CB 4.4Å; L284-L289 HydrophobicContact CD2-CD1 4.08Å; L284-L289 PolarHBondContact O-N 2.93Å; L284-L289 VanDerWaalsContact O-N 3.16Å; A287-L289 HydrophobicContact CB-CG 4.49Å
290	S	50.4	Low	57.9	Low	67 Å²	67	78.5 Å²	78.5	47%	0.469	53%	0.527	S	S	.	.			trans	-87.2	0.6	-170.2	54.2	0	0	0	0	115.7	G288 G292	G288-S290 VanDerWaalsContact C-N 3.31Å; G288-S290 PolarHBondContact O-N 2.59Å; S290-G292 PolarHBondContact O-N 3.4Å
291	E	40.7	Very low	55.3	Low	125 Å²	125	85.3 Å²	85.3	58%	0.584	57%	0.568	S	S	*	*	S	Bend	trans	-89.4	87.8	-177.5	-66.9	177.6	149.2	0	0	111	G827	E291-G827 PolarHBondContact OE2-N 3.29Å
292	G	41.4	Very low	52.7	Low	66 Å²	66	85.9 Å²	85.9	68%	0.68	59%	0.591	S	S	*	*	S	Bend	trans	141.2	-10.8	169	0	0	0	0	0	117.1	S290	S290-G292 PolarHBondContact O-N 3.4Å
293	I	42	Very low	50.3	Low	63 Å²	63	85.9 Å²	85.9	32%	0.323	61%	0.605	S	S	.	*	S	Bend	trans	-104.8	36.9	-166.8	-43.2	-177.9	0	0	0	112	V258 L269 L284	V258-I293 HydrophobicContact CG1-CD1 4.34Å; L269-I293 HydrophobicContact CD1-CG2 4Å; L284-I293 HydrophobicContact CD1-CD1 4.36Å
294	G	32.8	Very low	48	Very low	76 Å²	76	89.1 Å²	89.1	78%	0.784	63%	0.631	S	S	*	*			trans	-173.4	57.6	-171.3	0	0	0	0	0	117.8
295	A	33.4	Very low	45.5	Very low	109 Å²	109	99.7 Å²	99.7	90%	0.901	67%	0.67	S	S	*	*			trans	-149.3	37	171.3	0	0	0	0	0	113.4
296	G	30.2	Very low	43.3	Very low	68 Å²	68	98.9 Å²	98.9	70%	0.701	67%	0.674	S	S	*	*			trans	-103.7	134.6	171	0	0	0	0	0	111.2
297	D	34.3	Very low	41.4	Very low	160 Å²	160	103.2 Å²	103.2	86%	0.856	68%	0.68	S	S	*	*			trans	54.3	109.4	169.7	-54.2	-31.6	0	0	0	118.7
298	T	35.9	Very low	39.4	Very low	138 Å²	138	106.7 Å²	106.7	85%	0.847	70%	0.698	S	S	*	*				176	133	113.4	-70.7	0	0	0	0	112.1
299	A	33.8	Very low	37.6	Very low	80 Å²	80	108.2 Å²	108.2	66%	0.661	71%	0.714	S	S	*	*			trans	54.5	92	158.5	0	0	0	0	0	120.6
300	T	31.5	Very low	36.2	Very low	122 Å²	122	111 Å²	111	75%	0.748	74%	0.738	S	S	*	*				0.3	148.2	123.8	57.4	0	0	0	0	120.9
301	T	35.6	Very low	35.5	Very low	146 Å²	146	116.5 Å²	116.5	90%	0.896	76%	0.756	S	S	*	*			trans	78.1	163.1	161.6	79.4	0	0	0	0	118.2
302	G	33.2	Very low	35	Very low	74 Å²	74	115.3 Å²	115.3	76%	0.763	76%	0.762	S	S	*	*			trans	128.8	31.2	150	0	0	0	0	0	120.3
303	S	36.7	Very low	34.5	Very low	112 Å²	112	119.4 Å²	119.4	78%	0.783	77%	0.768	S	S	*	*			trans	-14.1	137.7	166.9	-167.1	0	0	0	0	120.1
304	S	38.4	Very low	34.1	Very low	106 Å²	106	123.4 Å²	123.4	74%	0.741	79%	0.789	S	S	*	*			trans	105.1	135.9	139.8	82.9	0	0	0	0	122.4
305	R	33	Very low	34	Very low	227 Å²	227	124.7 Å²	124.7	86%	0.857	78%	0.782	S	S	*	*			trans	89	91.9	139	-133.5	166.6	-169.9	162.6	1.7	121.4
306	S	37.1	Very low	34.1	Very low	93 Å²	93	130.3 Å²	130.3	65%	0.65	78%	0.782	S	S	*	*				-3.3	144.9	128.7	62.9	0	0	0	0	117.9
307	Q	38.5	Very low	34.4	Very low	179 Å²	179	135.4 Å²	135.4	84%	0.836	79%	0.787	S	S	*	*				-158.6	169.5	53.3	-87.7	-169.6	-9.4	0	0	113.4
308	P	34.1	Very low	34.4	Very low	127 Å²	127	132.2 Å²	132.2	83%	0.825	78%	0.778	S	S	*	*			trans	-87.7	156.9	171.5	36.6	-35.2	0	0	0	113.7
309	G	34.7	Very low	34.5	Very low	74 Å²	74	131.2 Å²	131.2	76%	0.763	77%	0.772	S	S	*	*			trans	-168.4	164.1	174.7	0	0	0	0	0	112.3
310	S	32.4	Very low	34.8	Very low	119 Å²	119	137 Å²	137	83%	0.832	78%	0.782	S	S	*	*			trans	-134.6	164.5	-175.8	-70.4	0	0	0	0	112.9
311	Q	35.3	Very low	34.9	Very low	182 Å²	182	142.6 Å²	142.6	85%	0.85	79%	0.789	S	S	*	*			trans	88.8	143.7	162.9	-54.4	-174	-6.6	0	0	120.3
312	S	31.2	Very low	35.5	Very low	101 Å²	101	140.9 Å²	140.9	71%	0.706	78%	0.781	S	S	*	*			trans	61.6	102.2	147.2	56.2	0	0	0	0	122.8
313	N	29.7	Very low	35.9	Very low	152 Å²	152	144 Å²	144	81%	0.813	78%	0.78	S	S	*	*				62.6	140.1	111.6	-85	-3.5	0	0	0	124.4
314	L	34.8	Very low	36.3	Very low	146 Å²	146	147.8 Å²	147.8	76%	0.764	78%	0.777	S	S	*	*			trans	77.8	105	153.5	-91.3	75.5	0	0	0	121.1
315	T	30.8	Very low	36.6	Very low	104 Å²	104	148.1 Å²	148.1	64%	0.638	78%	0.777	S	S	*	*				53.9	124.9	113.3	-54	0	0	0	0	121.1
316	Y	35.2	Very low	37.1	Very low	226 Å²	226	142.3 Å²	142.3	89%	0.886	77%	0.766	S	S	*	*				-160.5	179.2	122.4	-105.9	-66.3	0	0	0	113.6
317	Q	36.2	Very low	37.3	Very low	175 Å²	175	146.4 Å²	146.4	82%	0.818	78%	0.78	S	S	*	*			trans	-116.4	171.2	-161.3	-82.8	-179.1	11.8	0	0	111.3
318	S	34.4	Very low	37.3	Very low	94 Å²	94	140.3 Å²	140.3	66%	0.657	77%	0.766	S	S	*	*			cis	-176.3	-176.2	-12	173.9	0	0	0	0	109.6
319	T	38	Very low	37.4	Very low	117 Å²	117	140 Å²	140	72%	0.718	76%	0.761	S	S	*	*			trans	83.4	143	163	87.1	0	0	0	0	117.1
320	K	39.4	Very low	37.5	Very low	202 Å²	202	141.5 Å²	141.5	88%	0.878	76%	0.76	S	S	*	*			cis	-131.2	175.5	6.2	-72.2	-177.7	-179.1	174.2	0	113.4
321	R	34.4	Very low	37.6	Very low	238 Å²	238	140.2 Å²	140.2	90%	0.898	75%	0.751	S	S	*	*			trans	-96.5	179.8	-172.5	-102.4	-175.1	176.2	-173	1.1	113.3
322	P	47.2	Very low	37.6	Very low	111 Å²	111	139.6 Å²	139.6	72%	0.721	75%	0.753	S	S	*	*			cis	-111.1	-158.4	7.3	42.9	-30.8	0	0	0	112.4
323	N	42.7	Very low	37.9	Very low	139 Å²	139	138.4 Å²	138.4	74%	0.743	75%	0.749	S	S	*	*			cis	-150.3	170.2	1.6	-138.3	16.3	0	0	0	107.2
324	R	45.1	Very low	38.2	Very low	191 Å²	191	138.4 Å²	138.4	72%	0.721	75%	0.749	S	S	*	*			cis	71.4	137.7	23	-131.6	-110.8	167	171.8	-2.4	114.4
325	P	44.3	Very low	38.2	Very low	113 Å²	113	138.1 Å²	138.1	73%	0.734	75%	0.748	S	S	*	*			cis	-78.3	174	8.5	33.9	-38	0	0	0	116.4
326	V	44.6	Very low	38.4	Very low	105 Å²	105	138 Å²	138	64%	0.636	75%	0.748	S	S	*	*			trans	-157.8	143.7	-179.4	168.8	0	0	0	0	109.1
327	L	40.2	Very low	38.6	Very low	179 Å²	179	133.6 Å²	133.6	94%	0.937	74%	0.74	S	S	*	*			trans	-160.1	130.8	160	-108.6	154.3	0	0	0	111.6
328	G	38.9	Very low	38.4	Very low	52 Å²	52	135.9 Å²	135.9	54%	0.536	74%	0.741	S	S	.	*			cis	-171.7	135	-10.5	0	0	0	0	0	110
329	T	36.3	Very low	38.4	Very low	120 Å²	120	136.5 Å²	136.5	74%	0.736	75%	0.745	S	S	*	*				71.4	151	67.9	63.8	0	0	0	0	113
330	S	36.1	Very low	38.1	Very low	105 Å²	105	142.6 Å²	142.6	73%	0.734	76%	0.755	S	S	*	*			cis	-173.1	167.3	8.6	17.7	0	0	0	0	109.2
331	S	34.5	Very low	37.9	Very low	93 Å²	93	138 Å²	138	65%	0.65	75%	0.746	S	S	*	*			cis	172.7	165.2	-26.1	58.3	0	0	0	0	110
332	L	36	Very low	38	Very low	168 Å²	168	131.4 Å²	131.4	88%	0.88	73%	0.734	S	S	*	*			trans	70.5	162.1	163.5	-88.6	68.9	0	0	0	116.8
333	A	36.2	Very low	37.1	Very low	76 Å²	76	133.2 Å²	133.2	63%	0.628	74%	0.736	S	S	*	*			cis	-162.8	160.9	-11.7	0	0	0	0	0	114.4
334	N	36.4	Very low	36.5	Very low	152 Å²	152	132 Å²	132	81%	0.813	73%	0.734	S	S	*	*			trans	59.6	104.3	141	-69.7	-2.8	0	0	0	125.3
335	N	35	Very low	35.8	Very low	140 Å²	140	127.5 Å²	127.5	75%	0.749	73%	0.732	S	S	*	*				85.4	147.2	99.7	-154	17.3	0	0	0	122.6
336	T	36.1	Very low	35.2	Very low	103 Å²	103	129.7 Å²	129.7	63%	0.632	73%	0.732	S	S	*	*			trans	87.1	143.7	161.7	76	0	0	0	0	121.2
337	N	39.5	Very low	34.4	Very low	133 Å²	133	129.6 Å²	129.6	71%	0.711	73%	0.728	S	S	*	*			trans	79.8	102.5	153.5	-66.8	-42.6	0	0	0	122.4
338	R	32.3	Very low	33.8	Very low	222 Å²	222	126.6 Å²	126.6	84%	0.838	71%	0.71	S	S	*	*				61.2	112.5	121.9	-74.9	-177.6	168.3	-178	-2.5	121
339	S	34.2	Very low	33.4	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	72%	0.717	S	S	*	*				66.3	112.9	115.6	-53.3	0	0	0	0	121.8
340	R	30.9	Very low	33	Very low	246 Å²	246	133.6 Å²	133.6	93%	0.928	72%	0.718	S	S	*	*			trans	74.7	164.5	145	-89.8	-159.5	161.3	-158.5	-4	118.4
341	P	35.8	Very low	32.7	Very low	106 Å²	106	133.8 Å²	133.8	69%	0.688	72%	0.715	S	S	*	*			trans	-117.6	-150	-161.6	48.8	-35.9	0	0	0	109.6
342	P	36.9	Very low	32.6	Very low	99 Å²	99	136 Å²	136	64%	0.643	73%	0.725	S	S	*	*			cis	-128.5	-143	-13.2	38.2	-16.4	0	0	0	111.1
343	L	27.3	Very low	32.4	Very low	148 Å²	148	131.4 Å²	131.4	78%	0.775	72%	0.718	S	S	*	*			trans	30.1	127.1	149.3	-60.8	170.5	0	0	0	116.9
344	T	30.7	Very low	32.2	Very low	114 Å²	114	138.4 Å²	138.4	70%	0.699	73%	0.728	S	S	*	*			cis	-176.8	-162.1	40.1	-10.7	0	0	0	0	108.6
345	S	29.5	Very low	31.9	Very low	96 Å²	96	134.7 Å²	134.7	67%	0.671	71%	0.713	S	S	*	*			trans	24.2	131.9	137.4	-55	0	0	0	0	119
346	Q	31.8	Very low	31.8	Very low	159 Å²	159	137.4 Å²	137.4	74%	0.743	72%	0.715	S	S	*	*			cis	-167.8	179.4	23	-133.7	173.6	-20.9	0	0	111.4
347	N	28.7	Very low	31.4	Very low	103 Å²	103	142.6 Å²	142.6	55%	0.551	72%	0.723	S	S	*	*				11.3	143.4	124.8	-66.1	27	0	0	0	118
348	E	27.6	Very low	31	Very low	117 Å²	117	145.1 Å²	145.1	55%	0.547	73%	0.73	S	S	.	*			cis	-171	175.3	10	-116.9	159.7	164.8	0	0	111.8
349	Y	29.1	Very low	30.8	Very low	175 Å²	175	137.8 Å²	137.8	69%	0.686	72%	0.724	S	S	*	*			trans	31.1	137.5	150.2	-49.8	-43.8	0	0	0	123.5
350	N	28.7	Very low	30.5	Very low	143 Å²	143	137.8 Å²	137.8	77%	0.765	72%	0.724	S	S	*	*			trans	75.9	149.1	137.7	-76.7	-28.5	0	0	0	119
351	T	29.8	Very low	30.3	Very low	110 Å²	110	133.5 Å²	133.5	68%	0.675	72%	0.718	S	S	*	*			cis	147.6	154.6	-8.3	-84.8	0	0	0	0	104.4
352	V	32.2	Very low	29.8	Very low	140 Å²	140	133 Å²	133	85%	0.848	72%	0.723	S	S	*	*			trans	71.5	140.1	-172.6	-161.8	0	0	0	0	112
353	G	32.4	Very low	29.4	Very low	71 Å²	71	132.7 Å²	132.7	73%	0.732	72%	0.722	S	S	*	*			cis	-171	-179.8	-5.2	0	0	0	0	0	108.5
354	R	31.5	Very low	29.5	Very low	223 Å²	223	132.8 Å²	132.8	84%	0.842	72%	0.724	S	S	*	*			cis	-156.7	148.8	21.8	-132.9	177.2	175.2	174.7	-2	108.4
355	S	31.1	Very low	29.6	Very low	73 Å²	73	137.7 Å²	137.7	51%	0.51	73%	0.731	S	S	.	*				46.7	139.3	127.4	-71.8	0	0	0	0	121.3
356	Y	32.1	Very low	29.6	Very low	198 Å²	198	139.9 Å²	139.9	78%	0.776	74%	0.736	S	S	*	*			cis	-152.3	179.2	7.4	-98.4	-48.9	0	0	0	111.2
357	R	28.1	Very low	29.8	Very low	211 Å²	211	136 Å²	136	80%	0.796	73%	0.726	S	S	*	*			trans	-18	154.8	154.5	-55.8	167.8	-179.3	-174.5	-1.8	114.6
358	Q	29.9	Very low	30.1	Very low	186 Å²	186	142.3 Å²	142.3	87%	0.869	74%	0.742	S	S	*	*				177.8	164	61.7	-155.6	157.2	-49.8	0	0	111.5
359	G	28.4	Very low	30.4	Very low	68 Å²	68	141.9 Å²	141.9	70%	0.701	75%	0.75	S	S	*	*			trans	78.1	140.4	168.3	0	0	0	0	0	115
360	S	27.3	Very low	30.5	Very low	108 Å²	108	144.8 Å²	144.8	76%	0.755	76%	0.759	S	S	*	*			cis	75.8	120.6	8.3	-144.8	0	0	0	0	117.8
361	I	26.5	Very low	30.8	Very low	156 Å²	156	146 Å²	146	80%	0.8	76%	0.761	S	S	*	*			trans	74	104	158.5	-58.9	156.2	0	0	0	118.7
362	A	26.5	Very low	31	Very low	96 Å²	96	148.2 Å²	148.2	79%	0.793	77%	0.766	S	S	*	*			trans	59.8	175.6	143.5	0	0	0	0	0	118.6
363	S	28.3	Very low	30.9	Very low	91 Å²	91	145 Å²	145	64%	0.636	76%	0.762	S	S	*	*			cis	-151.1	154.6	-1.7	58.2	0	0	0	0	111.6
364	N	29.7	Very low	31	Very low	151 Å²	151	153.4 Å²	153.4	81%	0.807	77%	0.771	S	S	*	*			trans	64.7	150.3	164.8	-53.6	-24.3	0	0	0	116.3
365	Y	33.3	Very low	31.1	Very low	216 Å²	216	151.6 Å²	151.6	85%	0.847	77%	0.769	S	S	*	*			cis	-131.7	136.8	20.9	44.6	-88.8	0	0	0	113.5
366	D	29.6	Very low	31.3	Very low	143 Å²	143	155 Å²	155	77%	0.765	78%	0.782	S	S	*	*				58.5	131.1	126.1	-141	41.8	0	0	0	121.2
367	S	35.7	Very low	31.4	Very low	78 Å²	78	152 Å²	152	55%	0.545	78%	0.783	S	S	.	*			cis	-149	129.3	3.7	-143.8	0	0	0	0	116.1
368	R	34.1	Very low	31.8	Very low	234 Å²	234	147.4 Å²	147.4	88%	0.883	78%	0.783	S	S	*	*			trans	67.8	156.2	138.1	-73.3	-179.1	173.1	-139	-4.5	122.3
369	P	34.3	Very low	32	Very low	109 Å²	109	146.8 Å²	146.8	71%	0.708	78%	0.78	S	S	*	*			trans	-145.9	-177.8	-136.9	46.2	-27.1	0	0	0	119.2
370	R	31.7	Very low	32.4	Very low	236 Å²	236	148.3 Å²	148.3	89%	0.891	78%	0.78	S	S	*	*			trans	60.7	118.4	156	-72.1	-179.7	172.7	-171.8	-1.8	119.8
371	Q	33.4	Very low	32.5	Very low	169 Å²	169	151.3 Å²	151.3	79%	0.79	78%	0.783	S	S	*	*				177.6	137.5	102.5	-93.6	-170.9	8.6	0	0	114.6
372	I	34.1	Very low	33	Very low	156 Å²	156	147.7 Å²	147.7	80%	0.8	77%	0.769	S	S	*	*			trans	49.9	119.7	141.3	-51	166.6	0	0	0	121.2
373	G	31.2	Very low	33.3	Very low	73 Å²	73	147.9 Å²	147.9	75%	0.753	76%	0.76	S	S	*	*			trans	145.6	88.3	144.9	0	0	0	0	0	123.6
374	R	33.9	Very low	33.6	Very low	247 Å²	247	146.4 Å²	146.4	93%	0.932	75%	0.75	S	S	*	*			trans	35	129.1	144.4	-68.1	179	170.7	175.5	-2.2	125.4
375	K	33	Very low	33.7	Very low	184 Å²	184	147.8 Å²	147.8	80%	0.8	74%	0.744	S	S	*	*			trans	101.5	117.9	133.5	-88.6	-169.6	170.5	-172.6	0	124.7
376	L	35.7	Very low	33.7	Very low	146 Å²	146	144 Å²	144	76%	0.764	73%	0.734	S	S	*	*			trans	77.9	175.2	143.6	-61.1	173.2	0	0	0	120.7
377	V	34.9	Very low	33.9	Very low	133 Å²	133	142.8 Å²	142.8	81%	0.806	73%	0.732	S	S	*	*				166.8	147.7	-53.8	130.8	0	0	0	0	110
378	S	35.6	Very low	34	Very low	115 Å²	115	144.9 Å²	144.9	80%	0.804	75%	0.746	S	S	*	*			cis	-160.8	-155	-13.3	-171.5	0	0	0	0	110.4
379	Q	34.8	Very low	34.1	Very low	173 Å²	173	139.2 Å²	139.2	81%	0.808	74%	0.74	S	S	*	*			trans	-154.3	163.9	-158.5	-151.6	-157.2	72	0	0	119.5
380	S	35.8	Very low	34.1	Very low	100 Å²	100	139.5 Å²	139.5	70%	0.699	74%	0.744	S	S	*	*			trans	81.7	176.1	143.7	46.2	0	0	0	0	125.1
381	Q	31	Very low	34.2	Very low	172 Å²	172	139.2 Å²	139.2	80%	0.804	74%	0.743	S	S	*	*			trans	-121	-123	-147.9	-67.4	-175.6	-6	0	0	119.9
382	P	36.8	Very low	34.3	Very low	79 Å²	79	138.7 Å²	138.7	51%	0.513	75%	0.745	S	S	.	*				-138.5	-171.7	-122.1	44.5	-22.8	0	0	0	120.6	P35	P35-P382 HydrophobicContact CB-CB 4.14Å; P35-P382 HydrophobicContact CG-CB 4.18Å
383	T	31.9	Very low	34.4	Very low	100 Å²	100	135 Å²	135	61%	0.613	74%	0.738	S	S	*	*			trans	99.7	136.7	140.1	-136.9	0	0	0	0	126.9
384	S	34.7	Very low	34.9	Very low	60 Å²	60	142 Å²	142	42%	0.42	74%	0.743	S	S	.	*			trans	52.8	156	136.3	-58.7	0	0	0	0	129.2	T32	T32-S384 WeakPolarHBondContact CG2-O 3.35Å
385	R	33.1	Very low	35.1	Very low	181 Å²	181	137.2 Å²	137.2	68%	0.683	73%	0.729	S	S	*	*			trans	87.2	153.5	158	-50	-148.2	88.1	153.6	1.3	119.5	T32	T32-R385 PolarHBondContact OG1-N 3.28Å; T32-R385 PolarHBondContact OG1-O 2.98Å
386	E	32.3	Very low	35.1	Very low	137 Å²	137	134.1 Å²	134.1	64%	0.64	73%	0.726	S	S	*	*			cis	-174.4	176.7	-35.3	-136.4	153.9	-72.6	0	0	116.4
387	V	33.4	Very low	34.8	Very low	117 Å²	117	130.3 Å²	130.3	71%	0.709	72%	0.715	S	S	*	*			trans	66.3	131	158.1	173.4	0	0	0	0	123.1
388	S	39	Very low	34.6	Very low	121 Å²	121	135.3 Å²	135.3	85%	0.846	72%	0.722	S	S	*	*			trans	-171.6	130.9	161.3	-77.6	0	0	0	0	114.8
389	P	35.9	Very low	34.5	Very low	116 Å²	116	132.7 Å²	132.7	75%	0.753	71%	0.712	S	S	*	*			trans	-146.3	165.6	179.3	42.5	-25.7	0	0	0	120.7
390	S	34.1	Very low	34.3	Very low	114 Å²	114	130.7 Å²	130.7	80%	0.797	71%	0.712	S	S	*	*			trans	104.3	144.9	135.4	-85.7	0	0	0	0	126.5
391	R	34.5	Very low	34	Very low	231 Å²	231	131.6 Å²	131.6	87%	0.872	71%	0.714	S	S	*	*			trans	78.4	157.9	167.6	-70	-168.1	174.1	-156.8	-1.5	118.4
392	L	34.8	Very low	34.2	Very low	158 Å²	158	130 Å²	130	83%	0.827	72%	0.716	S	S	*	*			cis	174.1	162.2	-42.4	-122.9	70.8	0	0	0	107.2
393	A	36.6	Very low	33.9	Very low	79 Å²	79	130.8 Å²	130.8	65%	0.653	72%	0.723	S	S	*	*			cis	-159.1	155.8	-10.6	0	0	0	0	0	109.1
394	Y	41.4	Very low	34.1	Very low	218 Å²	218	132.3 Å²	132.3	86%	0.855	73%	0.728	S	S	*	*			trans	-162.7	145.5	174.4	-131.9	-114.8	0	0	0	109.5
395	F	37.2	Very low	33.9	Very low	147 Å²	147	135.6 Å²	135.6	65%	0.645	74%	0.74	S	S	*	*			cis	-164	140.2	-22.2	-164.7	-109.2	0	0	0	110.1
396	T	32.6	Very low	33.9	Very low	119 Å²	119	132.8 Å²	132.8	73%	0.73	74%	0.739	S	S	*	*			trans	51.9	134.1	169.8	46.8	0	0	0	0	120.5
397	A	30.5	Very low	33.7	Very low	66 Å²	66	133 Å²	133	55%	0.545	75%	0.745	S	S	.	*			cis	-161.3	-174.1	-3.4	0	0	0	0	0	107.8
398	Y	30.2	Very low	33.5	Very low	239 Å²	239	130.1 Å²	130.1	94%	0.937	74%	0.739	S	S	*	*			cis	-143.3	-179.1	12.7	-69.3	-91.7	0	0	0	110.7
399	G	33.2	Very low	33.2	Very low	59 Å²	59	132.1 Å²	132.1	61%	0.608	74%	0.735	S	S	*	*			trans	95.1	91.2	169.1	0	0	0	0	0	113.7
400	T	31.2	Very low	32.9	Very low	132 Å²	132	134.1 Å²	134.1	81%	0.81	73%	0.732	S	S	*	*				61	125.8	82.3	66	0	0	0	0	113.9
401	T	30.8	Very low	32.8	Very low	118 Å²	118	135.4 Å²	135.4	72%	0.724	73%	0.729	S	S	*	*			cis	-166.5	175.1	6	6.4	0	0	0	0	110.9
402	T	33.8	Very low	32.5	Very low	139 Å²	139	131.4 Å²	131.4	85%	0.853	72%	0.72	S	S	*	*			trans	71.6	151.2	168.2	70.6	0	0	0	0	118
403	S	31.1	Very low	32.3	Very low	95 Å²	95	132 Å²	132	66%	0.664	72%	0.716	S	S	*	*			cis	-165.1	165.3	-33.6	-160.2	0	0	0	0	109.9
404	N	35.2	Very low	32	Very low	133 Å²	133	134.7 Å²	134.7	71%	0.711	72%	0.72	S	S	*	*			trans	70.4	154.2	161.7	-60.7	5.9	0	0	0	118.1
405	N	31.3	Very low	31.4	Very low	128 Å²	128	129.3 Å²	129.3	68%	0.684	71%	0.709	S	S	*	*			cis	-173.7	143.2	-39	-105.5	2	0	0	0	108.3
406	N	32.1	Very low	31.1	Very low	123 Å²	123	129 Å²	129	66%	0.658	72%	0.72	S	S	*	*			trans	58.1	174.9	151.8	-65.1	51.1	0	0	0	116.6
407	D	29.8	Very low	31.1	Very low	141 Å²	141	130.8 Å²	130.8	75%	0.754	73%	0.725	S	S	*	*			cis	-142.3	161.8	-39.7	-97.1	-36.1	0	0	0	104.2
408	G	29.5	Very low	31.4	Very low	57 Å²	57	132.6 Å²	132.6	59%	0.588	73%	0.731	S	S	*	*			cis	137.7	158.6	13.9	0	0	0	0	0	108.6
409	Q	31.6	Very low	31.4	Very low	162 Å²	162	128.6 Å²	128.6	76%	0.757	73%	0.726	S	S	*	*			trans	71.7	153.3	173.5	-47	-174.6	46.4	0	0	115
410	K	29	Very low	31.4	Very low	159 Å²	159	136.2 Å²	136.2	69%	0.691	74%	0.736	S	S	*	*			cis	-163.2	163.6	-2.2	-129.3	169.1	-170.8	155.1	0	111.7
411	L	32.7	Very low	31.3	Very low	140 Å²	140	138 Å²	138	73%	0.733	74%	0.741	S	S	*	*			trans	63.8	122.1	158.6	-59.2	163.5	0	0	0	117.2
412	Q	28.2	Very low	31.3	Very low	147 Å²	147	135.7 Å²	135.7	69%	0.687	74%	0.741	S	S	*	*			cis	94.6	131.9	12.4	-150.9	-177.7	17	0	0	116.4
413	F	31.6	Very low	31.4	Very low	170 Å²	170	135.2 Å²	135.2	75%	0.746	74%	0.738	S	S	*	*			trans	75.2	150.9	173.1	-51.9	-67.6	0	0	0	118.5
414	N	28.4	Very low	31.8	Very low	137 Å²	137	138 Å²	138	73%	0.733	74%	0.744	S	S	*	*			cis	-165.4	159.3	-35.8	-162.4	24	0	0	0	111.3
415	T	28.7	Very low	32.2	Very low	104 Å²	104	134.6 Å²	134.6	64%	0.638	74%	0.74	S	S	*	*			trans	78	148.5	155.2	-9.7	0	0	0	0	121
416	T	32.7	Very low	32.4	Very low	141 Å²	141	136.2 Å²	136.2	87%	0.865	75%	0.748	S	S	*	*			trans	85.7	136.2	163.4	62	0	0	0	0	120.4
417	N	32.7	Very low	32.7	Very low	157 Å²	157	135.5 Å²	135.5	84%	0.84	75%	0.748	S	S	*	*			trans	-88.7	178.1	-173.3	-121.7	-8.4	0	0	0	111.1
418	P	35.3	Very low	33.1	Very low	104 Å²	104	134.9 Å²	134.9	68%	0.675	75%	0.745	S	S	*	*			cis	-133.3	-171	-11.3	38.1	-20	0	0	0	114
419	N	31.2	Very low	33.6	Very low	154 Å²	154	137.8 Å²	137.8	82%	0.824	75%	0.747	S	S	*	*			trans	82	157.2	161.6	-153.8	-4.4	0	0	0	116.7
420	R	31.9	Very low	34.1	Very low	219 Å²	219	137 Å²	137	83%	0.826	75%	0.748	S	S	*	*	S	Bend	trans	68.2	110.2	-174.4	-69.8	-173.3	170.8	-178	-1.1	118.1	G422	R420-G422 PolarHBondContact O-N 2.66Å
421	N	29.5	Very low	34.3	Very low	169 Å²	169	136.1 Å²	136.1	90%	0.904	75%	0.751	S	S	*	*				37	78.5	125.2	-58.9	13.8	0	0	0	116.6
422	G	31.1	Very low	34.3	Very low	70 Å²	70	135.2 Å²	135.2	72%	0.722	75%	0.751	S	S	*	*			trans	-151	92.2	171.6	0	0	0	0	0	109.5	R420	R420-G422 PolarHBondContact O-N 2.66Å
423	T	36.9	Very low	34.6	Very low	130 Å²	130	133.9 Å²	133.9	80%	0.798	75%	0.753	S	S	*	*			trans	-49.8	158.3	179.6	-36.1	0	0	0	0	113.2
424	I	37.7	Very low	34.8	Very low	153 Å²	153	131.6 Å²	131.6	79%	0.785	75%	0.753	S	S	*	*			trans	68.1	79.9	174.4	-41.2	177.9	0	0	0	110.7
425	G	44.2	Very low	36	Very low	62 Å²	62	131.5 Å²	131.5	64%	0.639	75%	0.748	S	S	*	*			cis	105.7	-111.9	46	0	0	0	0	0	107.4
426	L	36.6	Very low	36.9	Very low	161 Å²	161	136 Å²	136	84%	0.843	75%	0.753	S	S	*	*			trans	66	174.3	-157.1	-44.6	162	0	0	0	108.5
427	V	37	Very low	37.6	Very low	108 Å²	108	134.1 Å²	134.1	66%	0.655	74%	0.742	S	S	*	*			cis	-149.8	164.4	16.9	-134.3	0	0	0	0	109.5
428	D	39.1	Very low	37.8	Very low	129 Å²	129	132.2 Å²	132.2	69%	0.69	74%	0.736	S	S	*	*			trans	65.2	159.9	143.3	-66.3	-24.8	0	0	0	122.2
429	N	39.2	Very low	37.5	Very low	118 Å²	118	137.3 Å²	137.3	63%	0.631	74%	0.742	S	S	*	*			cis	-169	135.2	-47	-126.8	-49.4	0	0	0	109.8
430	N	42.7	Very low	37.6	Very low	145 Å²	145	137 Å²	137	78%	0.775	74%	0.739	S	S	*	*			trans	49.3	168.6	149.1	-77.9	-41.8	0	0	0	124
431	N	33.3	Very low	37.5	Very low	141 Å²	141	132.4 Å²	132.4	75%	0.754	73%	0.731	S	S	*	*			trans	88.5	121.1	154.3	-94.6	-0	0	0	0	124
432	T	33.1	Very low	38	Very low	120 Å²	120	130.9 Å²	130.9	74%	0.736	72%	0.72	S	S	*	*			trans	68.3	133.1	143.8	58.8	0	0	0	0	119.1
433	T	32.8	Very low	38.1	Very low	119 Å²	119	133.6 Å²	133.6	73%	0.73	72%	0.718	S	S	*	*			cis	-147.3	156.6	36	39.3	0	0	0	0	113.9
434	T	37.2	Very low	37.5	Very low	123 Å²	123	132.1 Å²	132.1	76%	0.755	71%	0.713	S	S	*	*			trans	36.5	124.1	148.2	54.6	0	0	0	0	119.7
435	E	53.2	Low	37	Very low	135 Å²	135	135.2 Å²	135.2	63%	0.631	72%	0.715	S	S	*	*			cis	-161.5	-179.9	20	-77	-138.3	118.2	0	0	108.6
436	R	47	Very low	36.4	Very low	197 Å²	197	137.8 Å²	137.8	74%	0.743	72%	0.718	S	S	*	*			cis	-164.1	156.7	-12.5	-118.5	-178.4	178.5	133.5	-3.8	105
437	T	48.9	Very low	36.3	Very low	103 Å²	103	135.8 Å²	135.8	63%	0.632	71%	0.714	S	S	*	*			cis	-146.2	163.3	-10.1	-39.7	0	0	0	0	106.7
438	T	36.7	Very low	36.4	Very low	116 Å²	116	140.5 Å²	140.5	71%	0.712	72%	0.72	S	S	*	*			trans	69.3	154.1	165.1	74.5	0	0	0	0	117.3
439	R	29.2	Very low	36.4	Very low	211 Å²	211	138.8 Å²	138.8	80%	0.796	72%	0.718	S	S	*	*			cis	-167.1	148.2	-27.9	-104.7	176.9	-175	177.5	1.9	105
440	L	31.5	Very low	36.4	Very low	147 Å²	147	142 Å²	142	77%	0.77	73%	0.73	S	S	*	*			trans	67.8	151.6	169	-23.3	-175.3	0	0	0	114.2
441	L	31.3	Very low	36	Very low	124 Å²	124	138.5 Å²	138.5	65%	0.649	73%	0.728	S	S	*	*			cis	-168.6	169.9	-18	-135.4	53.8	0	0	0	110.8
442	M	39.8	Very low	36	Very low	137 Å²	137	136.3 Å²	136.3	68%	0.675	73%	0.729	S	S	*	*			trans	66.3	135.5	153.6	-66.1	-51.7	155.9	0	0	116.4
443	N	32.9	Very low	36.1	Very low	127 Å²	127	135.2 Å²	135.2	68%	0.679	73%	0.726	S	S	*	*				57.3	128.1	67.8	-64.4	-25.3	0	0	0	111.1
444	S	23.7	Very low	36.1	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	73%	0.725	S	S	*	*				56.9	131.1	62.5	-173.1	0	0	0	0	111.8
445	R	27.5	Very low	35.7	Very low	217 Å²	217	139.1 Å²	139.1	82%	0.819	72%	0.72	S	S	*	*			trans	68.6	127.8	-164.2	-45.6	173.5	178.3	178.5	-2.4	110.4
446	V	32.5	Very low	34.7	Very low	117 Å²	117	138.3 Å²	138.3	71%	0.709	72%	0.724	S	S	*	*				53.6	68.5	50.6	-166.5	0	0	0	0	109.7
447	P	33	Very low	34.5	Very low	118 Å²	118	134.6 Å²	134.6	77%	0.766	73%	0.729	S	S	*	*				-111.5	130.9	101.6	-8.4	26.9	0	0	0	110.6
448	R	39.6	Very low	33.7	Very low	207 Å²	207	134.6 Å²	134.6	78%	0.781	73%	0.73	S	S	*	*				64.4	120.3	60.4	-83.3	-171.1	153.6	86	-2.2	114.1
449	S	39.3	Very low	33.3	Very low	93 Å²	93	135.1 Å²	135.1	65%	0.65	73%	0.734	S	S	*	*			trans	68.9	148.8	138.5	60.3	0	0	0	0	120.3
450	Q	39.2	Very low	33.1	Very low	187 Å²	187	136.2 Å²	136.2	87%	0.874	74%	0.738	S	S	*	*			trans	60.7	94.3	160.6	-65.8	159.1	-0.6	0	0	113.6
451	G	35.1	Very low	32.9	Very low	71 Å²	71	133.3 Å²	133.3	73%	0.732	73%	0.73	S	S	*	*			cis	97.3	-174.8	22.9	0	0	0	0	0	110.9
452	A	31.9	Very low	32.8	Very low	95 Å²	95	133.7 Å²	133.7	79%	0.785	74%	0.738	S	S	*	*			trans	67.2	116.7	-164.9	0	0	0	0	0	111.6
453	S	34.8	Very low	32.3	Very low	96 Å²	96	131.9 Å²	131.9	67%	0.671	74%	0.744	S	S	*	*				93.2	143.9	81.2	-70	0	0	0	0	111.4
454	R	33.8	Very low	32.2	Very low	186 Å²	186	131.3 Å²	131.3	70%	0.702	75%	0.75	S	S	*	*			cis	-155.5	166.1	-4.1	-118.8	176.6	161.2	134.9	-3.3	109.3
455	E	29.9	Very low	32.8	Very low	138 Å²	138	128.9 Å²	128.9	65%	0.645	74%	0.741	S	S	*	*				25.8	124.4	103	-46.8	156.7	-145	0	0	112.2
456	T	30.6	Very low	33.3	Very low	118 Å²	118	128.9 Å²	128.9	72%	0.724	74%	0.742	S	S	*	*				-172	147.7	57.3	40.8	0	0	0	0	111.6
457	S	43	Very low	33.6	Very low	120 Å²	120	129.7 Å²	129.7	84%	0.839	75%	0.748	S	S	*	*			trans	-67.4	143.1	146.1	-44.3	0	0	0	0	108.8
458	P	32.5	Very low	33.5	Very low	102 Å²	102	132 Å²	132	66%	0.662	75%	0.75	S	S	*	*				-154.8	151.2	112.7	37.2	-19	0	0	0	118
459	T	28.7	Very low	33.4	Very low	128 Å²	128	126.9 Å²	126.9	79%	0.785	74%	0.744	S	S	*	*			trans	20	147.2	136.4	73.4	0	0	0	0	124
460	R	25.1	Very low	32.9	Very low	233 Å²	233	126.5 Å²	126.5	88%	0.879	74%	0.741	S	S	*	*			trans	91.3	153.6	133.9	-139.8	-179.2	-176	-153.4	0.1	119.3
461	S	27.7	Very low	32.6	Very low	87 Å²	87	126.9 Å²	126.9	61%	0.608	74%	0.736	S	S	*	*			trans	70.2	111.7	165.1	-52.9	0	0	0	0	115.7
462	T	27.8	Very low	32.3	Very low	132 Å²	132	130.7 Å²	130.7	81%	0.81	74%	0.735	S	S	*	*				69.8	150.2	60.7	70.1	0	0	0	0	114.7
463	A	30.1	Very low	32.3	Very low	99 Å²	99	133.8 Å²	133.8	82%	0.818	73%	0.732	S	S	*	*			trans	77.9	147.5	179.3	0	0	0	0	0	116.4
464	S	31.2	Very low	32	Very low	114 Å²	114	136 Å²	136	80%	0.797	74%	0.737	S	S	*	*			cis	-167	163	-21.2	-172.6	0	0	0	0	111.1
465	G	34.5	Very low	31.9	Very low	48 Å²	48	134.8 Å²	134.8	50%	0.495	74%	0.744	S	S	.	*			trans	91.1	135.2	164.6	0	0	0	0	0	115.3
466	Y	39.9	Very low	31.8	Very low	217 Å²	217	132.7 Å²	132.7	85%	0.851	75%	0.745	S	S	*	*			cis	-153.1	161.6	-3.3	-55.3	-86.9	0	0	0	107.8
467	T	37.3	Very low	31.9	Very low	135 Å²	135	135.1 Å²	135.1	83%	0.828	75%	0.746	S	S	*	*			cis	-149.9	177.3	8.9	-22.8	0	0	0	0	110.4
468	M	32.5	Very low	31.5	Very low	166 Å²	166	135.8 Å²	135.8	82%	0.818	74%	0.735	S	S	*	*			trans	-104.6	-179.4	166.8	-66.7	-78.2	-78.8	0	0	108.9
469	P	36.2	Very low	31.5	Very low	100 Å²	100	137.3 Å²	137.3	65%	0.649	74%	0.738	S	S	*	*			cis	-144	155.4	8.3	42.6	-23.1	0	0	0	119.1
470	S	28.5	Very low	31.7	Very low	84 Å²	84	137.6 Å²	137.6	59%	0.587	74%	0.739	S	S	*	*				73.8	156	130	72.6	0	0	0	0	125.4
471	Y	32.9	Very low	32.2	Very low	195 Å²	195	129.5 Å²	129.5	77%	0.765	73%	0.729	S	S	*	*			trans	67.1	111.6	153.2	-59.4	-57.2	0	0	0	123.6
472	Q	29.8	Very low	32.7	Very low	152 Å²	152	131 Å²	131	71%	0.71	73%	0.734	S	S	*	*				67	151.4	126.2	-68.3	174	-84.4	0	0	122.7
473	H	31.7	Very low	33.1	Very low	159 Å²	159	131.9 Å²	131.9	74%	0.736	73%	0.734	S	S	*	*			trans	60.1	129.9	169.6	-68.5	96.5	0	0	0	116.6
474	N	29.1	Very low	33.5	Very low	144 Å²	144	135.6 Å²	135.6	77%	0.77	73%	0.734	S	S	*	*			cis	68.5	75.4	19.8	-153.9	44.3	0	0	0	115.1
475	N	32	Very low	33.7	Very low	159 Å²	159	137.6 Å²	137.6	85%	0.85	73%	0.734	S	S	*	*			trans	-157.2	161.8	134.1	-137.3	-19.1	0	0	0	114.6
476	S	27.3	Very low	33.8	Very low	94 Å²	94	138.2 Å²	138.2	66%	0.657	74%	0.741	S	S	*	*			trans	-91.5	157	170.5	-59.9	0	0	0	0	111.8
477	F	32.6	Very low	33.7	Very low	169 Å²	169	136 Å²	136	74%	0.741	74%	0.739	S	S	*	*			trans	167.5	159.8	135.2	-107.3	-127.9	0	0	0	109.1	L479	F477-L479 HydrophobicContact CD1-CD1 4.43Å
478	Q	33.5	Very low	33.7	Very low	134 Å²	134	136.3 Å²	136.3	63%	0.626	73%	0.732	S	S	*	*			cis	174.2	177.1	-35	-113.1	-167	40.5	0	0	106.9
479	L	32.1	Very low	33.9	Very low	135 Å²	135	133.2 Å²	133.2	71%	0.707	72%	0.719	S	S	*	*			trans	71	149.1	166.5	-51.5	127.9	0	0	0	114.8	F477	F477-L479 HydrophobicContact CD1-CD1 4.43Å
480	T	34	Very low	33.9	Very low	133 Å²	133	137 Å²	137	82%	0.816	72%	0.722	S	S	*	*			cis	-160.1	162.7	-7.4	8.6	0	0	0	0	110.7
481	G	36.3	Very low	34.1	Very low	64 Å²	64	142 Å²	142	66%	0.66	73%	0.728	S	S	*	*			trans	124.3	82.2	164.2	0	0	0	0	0	114.5
482	T	37.2	Very low	34.1	Very low	119 Å²	119	142.1 Å²	142.1	73%	0.73	73%	0.727	S	S	*	*				82	105	72.4	63.9	0	0	0	0	117.1
483	N	36.8	Very low	34.4	Very low	149 Å²	149	141.5 Å²	141.5	80%	0.797	72%	0.724	S	S	*	*			trans	86	139.5	137.7	-56.9	-12.8	0	0	0	122.4
484	Q	39	Very low	34.6	Very low	177 Å²	177	140.9 Å²	140.9	83%	0.827	72%	0.721	S	S	*	*			trans	76.6	142.5	161.3	-46.1	-154.7	74.5	0	0	118.5
485	I	35.1	Very low	34.7	Very low	156 Å²	156	142 Å²	142	80%	0.8	72%	0.722	S	S	*	*			cis	-163.9	148.7	-38.9	-115	156.4	0	0	0	107.9
486	G	36.6	Very low	34.7	Very low	62 Å²	62	143.9 Å²	143.9	64%	0.639	73%	0.725	S	S	*	*			trans	121.7	103.5	174.8	0	0	0	0	0	112.4
487	Q	36.9	Very low	34.8	Very low	171 Å²	171	150.8 Å²	150.8	80%	0.799	74%	0.737	S	S	*	*				70.8	123.6	64.8	-66.6	-160.6	34.9	0	0	113.2
488	M	37.1	Very low	34.9	Very low	140 Å²	140	147.9 Å²	147.9	69%	0.69	74%	0.735	S	S	*	*			cis	-150.3	148.7	3	-85.4	-135.5	-100.5	0	0	113.5
489	N	37.2	Very low	34.9	Very low	101 Å²	101	146.1 Å²	146.1	54%	0.54	74%	0.738	S	S	.	*			trans	64	149	141.5	-66.6	-16	0	0	0	121.4
490	Y	35.8	Very low	35	Very low	180 Å²	180	148.2 Å²	148.2	71%	0.706	75%	0.749	S	S	*	*			cis	-140.8	148.2	-0.2	-101.9	-48.9	0	0	0	112.9
491	R	33.5	Very low	35	Very low	190 Å²	190	144.9 Å²	144.9	72%	0.717	74%	0.74	S	S	*	*			trans	30.6	121.9	150	-78.9	-178.3	158.2	115.4	-6.2	120.3
492	R	33.1	Very low	34.9	Very low	196 Å²	196	148.3 Å²	148.3	74%	0.74	75%	0.749	S	S	*	*				68	142.5	77.5	-68.4	-169.9	-162.6	-169.7	3.5	113.6
493	Q	36.1	Very low	34.8	Very low	139 Å²	139	150 Å²	150	65%	0.65	75%	0.752	S	S	*	*			cis	-156.9	155.6	8.1	-130.6	169.4	-45.4	0	0	115.8
494	Q	34.3	Very low	34.6	Very low	146 Å²	146	147.1 Å²	147.1	68%	0.682	74%	0.744	S	S	*	*			trans	-12.6	135.5	160.6	-66.2	155.4	-53.5	0	0	122.3
495	Q	33.1	Very low	34.4	Very low	167 Å²	167	143.2 Å²	143.2	78%	0.78	73%	0.729	S	S	*	*				24.4	121	126.1	-60.4	171.4	-13.7	0	0	120.4
496	Q	32	Very low	34.4	Very low	199 Å²	199	138 Å²	138	93%	0.93	71%	0.706	S	S	*	*				-175.6	166.8	125.7	-101.9	154.1	108.4	0	0	114.2
497	R	27.5	Very low	34.4	Very low	240 Å²	240	139 Å²	139	91%	0.906	71%	0.708	S	S	*	*			trans	-92.5	-179.5	166.4	-88.7	-177	168.5	-171	-1.7	109.4
498	P	35	Very low	34.3	Very low	108 Å²	108	137.9 Å²	137.9	70%	0.701	71%	0.708	S	S	*	*			cis	-136.3	177.5	3	39.7	-20.2	0	0	0	117.1
499	S	33.5	Very low	34.2	Very low	97 Å²	97	138.6 Å²	138.6	68%	0.678	71%	0.713	S	S	*	*			trans	43.9	144.8	141.2	64.2	0	0	0	0	125.9
500	L	35.1	Very low	33.8	Very low	179 Å²	179	137.4 Å²	137.4	94%	0.937	73%	0.725	S	S	*	*			trans	74.1	140.1	155.4	-78.9	156.2	0	0	0	118.5
501	G	34.2	Very low	33.8	Very low	62 Å²	62	136.7 Å²	136.7	64%	0.639	73%	0.733	S	S	*	*			trans	163.5	22	172.3	0	0	0	0	0	125.2
502	T	34	Very low	33.7	Very low	136 Å²	136	130.2 Å²	130.2	83%	0.834	73%	0.726	S	S	*	*			trans	61.5	164	157.3	48.1	0	0	0	0	122.4
503	L	35.6	Very low	33.8	Very low	154 Å²	154	126.6 Å²	126.6	81%	0.806	73%	0.727	S	S	*	*			trans	69.6	93.3	174	-47.4	-179.4	0	0	0	114.6
504	S	32.7	Very low	33.6	Very low	89 Å²	89	127.2 Å²	127.2	62%	0.622	74%	0.735	S	S	*	*				71.8	129.8	61.3	-47.3	0	0	0	0	112.4
505	D	33.1	Very low	33.5	Very low	96 Å²	96	131.3 Å²	131.3	51%	0.513	75%	0.745	S	S	.	*				-171.7	167.5	85.9	-82.5	-15.9	0	0	0	113.6	Y519	D505-Y519 HydrophobicContact CB-CD1 3.93Å; D505-Y519 HydrophobicContact CB-CE1 3.35Å; D505-Y519 HydrophobicContact CB-CE2 4.29Å; D505-Y519 VanDerWaalsContact CG-CE1 3.42Å; D505-Y519 WeakPolarHBondContact OD1-CD2 3.44Å; D505-Y519 WeakPolarHBondContact OD1-CE2 3.14Å; D505-Y519 WeakPolarHBondContact OD2-CE2 3.3Å; D505-Y519 PolarHBondContact OD2-OH 3.31Å
506	C	35.9	Very low	33.6	Very low	46 Å²	46	127.1 Å²	127.1	31%	0.311	75%	0.747	S	S	.	*			trans	-81.9	177.4	-164.5	80	0	0	0	0	117.6	Y519	C506-Y519 HydrophobicContact CB-CD1 3.68Å; C506-Y519 HydrophobicContact CB-CE1 4.37Å; C506-Y519 VanDerWaalsContact N-CD1 3.33Å; C506-Y519 WeakPolarHBondContact SG-CD1 3.39Å; C506-Y519 PolarHBondContact SG-N 2.85Å
507	A	36.1	Very low	33.7	Very low	83 Å²	83	128.2 Å²	128.2	69%	0.686	74%	0.742	S	S	*	*			cis	88.7	122.1	8.6	0	0	0	0	0	120.9
508	D	36	Very low	33.9	Very low	148 Å²	148	122.1 Å²	122.1	79%	0.791	72%	0.724	S	S	*	*			trans	83.2	149.3	149.5	-138.5	7.2	0	0	0	123.6
509	L	35.2	Very low	33.8	Very low	155 Å²	155	122.4 Å²	122.4	81%	0.812	71%	0.712	S	S	*	*			trans	53.7	132.7	172.9	-58.7	-175.5	0	0	0	121.1
510	G	28.4	Very low	33.9	Very low	76 Å²	76	120.9 Å²	120.9	78%	0.784	70%	0.701	S	S	*	*			trans	-162.9	43	176.2	0	0	0	0	0	111.6
511	D	34.4	Very low	33.9	Very low	165 Å²	165	118.9 Å²	118.9	88%	0.882	70%	0.697	S	S	*	*			trans	-82.5	139.5	162.7	-179.6	31.4	0	0	0	109
512	G	32	Very low	34	Very low	54 Å²	54	119.5 Å²	119.5	56%	0.557	70%	0.703	S	S	*	*	S	Bend	trans	66.6	166.7	-172.6	0	0	0	0	0	115.2
513	P	35.4	Very low	34.1	Very low	119 Å²	119	120 Å²	120	77%	0.773	70%	0.701	S	S	*	*	S	Bend	trans	-86.3	166.9	178.5	35.4	-35.5	0	0	0	113.2
514	L	31.3	Very low	34	Very low	153 Å²	153	118.4 Å²	118.4	80%	0.801	69%	0.693	S	S	*	*			trans	91.2	97.1	165	-48.5	170.2	0	0	0	118.7
515	Y	33.7	Very low	34	Very low	232 Å²	232	124.9 Å²	124.9	91%	0.91	70%	0.704	S	S	*	*			trans	46.9	84.1	142.1	-68	-90.2	0	0	0	122.4
516	G	35.4	Very low	34	Very low	79 Å²	79	123.6 Å²	123.6	81%	0.814	71%	0.713	S	S	*	*				109.4	129	121	0	0	0	0	0	124.7
517	R	33	Very low	34.5	Very low	221 Å²	221	126.9 Å²	126.9	83%	0.834	73%	0.734	S	S	*	*			trans	97.2	94.6	131.2	-151	177.6	-155.3	-153.8	8	124.2
518	H	32.1	Very low	34.5	Very low	113 Å²	113	134 Å²	134	52%	0.523	74%	0.744	S	S	.	*			trans	80.2	123.6	131.8	-63.9	-24.9	0	0	0	126.9
519	Y	33.5	Very low	34.5	Very low	113 Å²	113	130.4 Å²	130.4	44%	0.443	74%	0.743	S	S	.	*				108.4	74.7	127.8	-55	-11.9	0	0	0	128.1	D505 C506	D505-Y519 HydrophobicContact CB-CD1 3.93Å; D505-Y519 HydrophobicContact CB-CE1 3.35Å; D505-Y519 HydrophobicContact CB-CE2 4.29Å; D505-Y519 VanDerWaalsContact CG-CE1 3.42Å; D505-Y519 WeakPolarHBondContact OD1-CD2 3.44Å; D505-Y519 WeakPolarHBondContact OD1-CE2 3.14Å; D505-Y519 WeakPolarHBondContact OD2-CE2 3.3Å; D505-Y519 PolarHBondContact OD2-OH 3.31Å; C506-Y519 HydrophobicContact CB-CD1 3.68Å; C506-Y519 HydrophobicContact CB-CE1 4.37Å; C506-Y519 VanDerWaalsContact N-CD1 3.33Å; C506-Y519 WeakPolarHBondContact SG-CD1 3.39Å; C506-Y519 PolarHBondContact SG-N 2.85Å
520	S	34.6	Very low	34.8	Very low	65 Å²	65	128.1 Å²	128.1	46%	0.455	74%	0.74	S	S	.	*				81	136.8	116.2	-155.8	0	0	0	0	128.5
521	T	35.9	Very low	35.5	Very low	137 Å²	137	132 Å²	132	84%	0.84	74%	0.743	S	S	*	*			trans	97.1	140	146.1	-16.5	0	0	0	0	122.5
522	G	35.8	Very low	36.1	Very low	75 Å²	75	128.2 Å²	128.2	77%	0.773	72%	0.722	S	S	*	*			trans	-159.1	-55.1	-176.4	0	0	0	0	0	124.5
523	N	36.5	Very low	36.6	Very low	147 Å²	147	131.9 Å²	131.9	79%	0.786	73%	0.729	S	S	*	*			trans	59	121	165.9	-145.6	14.8	0	0	0	125
524	N	32.3	Very low	36.6	Very low	120 Å²	120	134 Å²	134	64%	0.642	73%	0.726	S	S	*	*			trans	93.8	135.1	131.2	-112.2	-32.6	0	0	0	127.5
525	R	32.8	Very low	37.1	Very low	226 Å²	226	131.2 Å²	131.2	85%	0.853	72%	0.72	S	S	*	*			trans	85.4	133.2	147	-65.5	-176.9	-172.8	-173.9	2.3	125.7
526	G	33.9	Very low	37.3	Very low	68 Å²	68	128.1 Å²	128.1	70%	0.701	71%	0.714	S	S	*	*			trans	-105.6	-146.7	147.5	0	0	0	0	0	111
527	P	45.5	Very low	37.1	Very low	116 Å²	116	129.8 Å²	129.8	75%	0.753	71%	0.708	S	S	*	*			cis	-139.5	-125.9	8.4	43.7	-20.6	0	0	0	114
528	Y	36.5	Very low	37	Very low	231 Å²	231	124.5 Å²	124.5	91%	0.906	71%	0.706	S	S	*	*			trans	96.7	142.8	-177.8	-66.5	-75.6	0	0	0	115.8
529	G	37.2	Very low	37.2	Very low	74 Å²	74	124.4 Å²	124.4	76%	0.763	72%	0.718	S	S	*	*			cis	-123.7	-136.5	-4.4	0	0	0	0	0	112.6
530	S	40.5	Very low	37	Very low	106 Å²	106	127.1 Å²	127.1	74%	0.741	73%	0.734	S	S	*	*			cis	-164.1	179.1	-6.5	63.6	0	0	0	0	111.9
531	D	43.3	Very low	36.8	Very low	159 Å²	159	129.5 Å²	129.5	85%	0.85	75%	0.749	S	S	*	*			trans	-83.6	162.4	-174.2	-48.5	-56.3	0	0	0	116.1
532	D	46.2	Very low	36.7	Very low	84 Å²	84	127.1 Å²	127.1	45%	0.449	74%	0.739	S	S	.	*			cis	-144.2	-91.3	-36.8	-178.6	36.7	0	0	0	111.4	R554	D532-R554 IonicContact OD1-CZ 2.71Å; D532-R554 IonicContact OD1-NH1 3.51Å; D532-R554 IonicContact OD1-NH2 3.42Å; D532-R554 PolarHBondContact OD1-NH2 3.14Å; D532-R554 IonicContact OD2-CZ 3.61Å; D532-R554 IonicContact OD2-NH2 3.76Å; D532-R554 PolarHBondContact OD2-NH2 2.81Å
533	N	44.4	Very low	36.4	Very low	131 Å²	131	131 Å²	131	70%	0.701	74%	0.737	S	S	*	*			cis	-145.9	167.2	-12.6	-173.1	15	0	0	0	109.7	R554	N533-R554 VanDerWaalsContact O-CZ 3.27Å; N533-R554 PolarHBondContact O-NE 3.3Å; N533-R554 PolarHBondContact O-NH2 2.7Å
534	F	34.5	Very low	36.2	Very low	163 Å²	163	135 Å²	135	72%	0.715	74%	0.741	S	S	*	*			trans	-88.1	-176.2	-175	-106.2	-101.9	0	0	0	114.1
535	S	42.5	Very low	36.3	Very low	96 Å²	96	134.8 Å²	134.8	67%	0.671	75%	0.749	S	S	*	*			trans	73.3	151.7	177.4	-85.4	0	0	0	0	116.2
536	E	36.2	Very low	36.3	Very low	167 Å²	167	127.9 Å²	127.9	78%	0.78	75%	0.747	S	S	*	*			cis	-153.1	-173.3	-9.4	-130.5	159	133.7	0	0	113.5
537	T	31.2	Very low	36.3	Very low	113 Å²	113	136.1 Å²	136.1	69%	0.693	76%	0.757	S	S	*	*			trans	-60.4	153.1	-175.3	56.2	0	0	0	0	116.9
538	S	32	Very low	35.8	Very low	111 Å²	111	135.6 Å²	135.6	78%	0.776	76%	0.757	S	S	*	*			trans	58.9	99.7	141.4	-60.6	0	0	0	0	119.5
539	S	36.4	Very low	35.9	Very low	111 Å²	111	131.4 Å²	131.4	78%	0.776	76%	0.755	S	S	*	*			trans	-153.9	129.8	146.2	-86.3	0	0	0	0	113.6
540	Q	29.3	Very low	35.9	Very low	170 Å²	170	134.1 Å²	134.1	79%	0.794	76%	0.759	S	S	*	*			trans	38.5	129.1	135.9	-52.4	178.1	3.6	0	0	118.8
541	C	29.5	Very low	35.6	Very low	114 Å²	114	131.9 Å²	131.9	77%	0.77	75%	0.753	S	S	*	*				59.1	59.3	51.3	-56.8	0	0	0	0	115.4
542	S	33.4	Very low	35.2	Very low	88 Å²	88	135.2 Å²	135.2	62%	0.615	76%	0.755	S	S	*	*			trans	-159.2	178	145.3	-136	0	0	0	0	115
543	E	31.2	Very low	34.6	Very low	157 Å²	157	139.7 Å²	139.7	73%	0.734	77%	0.766	S	S	*	*			trans	22.4	121.2	157.8	-65.9	117.7	-131	0	0	118
544	R	32.4	Very low	34.1	Very low	230 Å²	230	138.1 Å²	138.1	87%	0.868	75%	0.75	S	S	*	*	S	Bend	cis	46	94.7	35.8	-146	-179.1	-154	-100.5	3.7	114.3
545	S	32.5	Very low	33.9	Very low	116 Å²	116	137.6 Å²	137.6	81%	0.811	75%	0.75	S	S	*	*			trans	90.4	111.9	172.5	-31.1	0	0	0	0	115.5
546	G	33.6	Very low	33.3	Very low	80 Å²	80	138.5 Å²	138.5	83%	0.825	76%	0.756	S	S	*	*			trans	171.7	139.3	172.8	0	0	0	0	0	111.6
547	R	32.9	Very low	33.1	Very low	242 Å²	242	136.6 Å²	136.6	91%	0.913	76%	0.761	S	S	*	*			trans	-93.4	163.8	172.9	-78.3	-179.3	166.7	-167.4	-3.6	110.7
548	S	36.4	Very low	33.6	Very low	105 Å²	105	134.6 Å²	134.6	73%	0.734	75%	0.751	S	S	*	*			trans	103.2	101.5	148.5	-52.5	0	0	0	0	118.3
549	V	38.5	Very low	34.3	Very low	143 Å²	143	132.7 Å²	132.7	87%	0.867	73%	0.729	S	S	*	*			trans	30.3	151.3	132.2	-81	0	0	0	0	122.4
550	P	36.4	Very low	35.1	Very low	130 Å²	130	130.7 Å²	130.7	84%	0.844	71%	0.712	S	S	*	*				-124	172.2	-128.5	43	-32.3	0	0	0	116.3
551	G	34.3	Very low	36.6	Very low	60 Å²	60	123 Å²	123	62%	0.619	68%	0.677	S	S	*	*			trans	-169.7	151	167.2	0	0	0	0	0	115.8
552	Y	35.1	Very low	38.3	Very low	228 Å²	228	118.9 Å²	118.9	89%	0.894	65%	0.649	S	S	*	*			trans	69.2	65.3	156.5	-56	-75.1	0	0	0	121
553	R	33.4	Very low	40.6	Very low	179 Å²	179	114.8 Å²	114.8	68%	0.675	62%	0.621	S	S	*	*				47.3	112.3	109.8	-170.6	-160.4	-118.3	-165.9	3.6	119.5
554	R	33.7	Very low	43.3	Very low	98 Å²	98	107.6 Å²	107.6	37%	0.37	59%	0.587	S	S	.	*				-172.4	103.7	127.8	-100.9	-179	-158.1	-78.2	-5.5	108.7	D532 N533	D532-R554 IonicContact OD1-CZ 2.71Å; D532-R554 IonicContact OD1-NH1 3.51Å; D532-R554 IonicContact OD1-NH2 3.42Å; D532-R554 PolarHBondContact OD1-NH2 3.14Å; D532-R554 IonicContact OD2-CZ 3.61Å; D532-R554 IonicContact OD2-NH2 3.76Å; D532-R554 PolarHBondContact OD2-NH2 2.81Å; N533-R554 VanDerWaalsContact O-CZ 3.27Å; N533-R554 PolarHBondContact O-NE 3.3Å; N533-R554 PolarHBondContact O-NH2 2.7Å
555	Q	30.2	Very low	46.1	Very low	152 Å²	152	99.9 Å²	99.9	71%	0.71	56%	0.56	S	S	*	*				97.1	145.3	81.7	-93.9	-175.5	-23.1	0	0	113.1
556	S	30.6	Very low	48.8	Very low	115 Å²	115	96.7 Å²	96.7	80%	0.804	53%	0.532	S	S	*	.			trans	68.2	52.3	175.6	-164.7	0	0	0	0	117.6	S558	S556-S558 PolarHBondContact O-N 2.87Å; S556-S558 VanDerWaalsContact O-N 3.1Å
557	S	31.7	Very low	51.6	Low	126 Å²	126	92.9 Å²	92.9	88%	0.881	49%	0.493	S	S	*	.			trans	-67.8	101.5	150.5	-171.5	0	0	0	0	108.2
558	S	42.1	Very low	54.4	Low	71 Å²	71	82 Å²	82	50%	0.497	45%	0.453	S	S	.	.			trans	-69.9	136.1	169.3	-175.6	0	0	0	0	108.4	S556 V560	S556-S558 PolarHBondContact O-N 2.87Å; S556-S558 VanDerWaalsContact O-N 3.1Å; S558-V560 PolarHBondContact O-N 3.5Å
559	K	46.7	Very low	57.1	Low	71 Å²	71	77.6 Å²	77.6	31%	0.309	42%	0.422	S	S	.	.			trans	-56.1	127.2	168.4	-57.7	179.8	-152.7	167.8	0	108.1	T561 S1231 Y1232 T1234	K559-T561 PolarHBondContact O-N 3.21Å; K559-S1231 WeakPolarHBondContact CE-O 3.14Å; K559-S1231 PolarHBondContact NZ-O 2.85Å; K559-Y1232 HydrophobicContact CD-CD1 4.11Å; K559-Y1232 PolarHBondContact NZ-O 3.27Å; K559-T1234 PolarHBondContact NZ-OG1 3.35Å
560	V	53.5	Low	59.7	Low	70 Å²	70	72.3 Å²	72.3	42%	0.424	39%	0.388	S	S	.	.			trans	-81.7	105.7	167.3	177.6	0	0	0	0	106.1	S558 N588 N1193	S558-V560 PolarHBondContact O-N 3.5Å; V560-N588 HydrophobicContact CG1-CB 3.53Å; V560-N588 WeakPolarHBondContact CG2-ND2 3.43Å; V560-N1193 PolarHBondContact O-ND2 3.03Å
561	T	60.2	Low	62.4	Low	7 Å²	7	66.3 Å²	66.3	4%	0.043	35%	0.348	C	S	.	.			trans	-78	126.3	172.9	-173.5	0	0	0	0	109.7	K559 N563 E566 I567 N585	K559-T561 PolarHBondContact O-N 3.21Å; T561-N563 PolarHBondContact O-N 3.18Å; T561-N563 WeakPolarHBondContact OG1-CB 3.37Å; T561-N563 PolarHBondContact OG1-N 3.14Å; T561-E566 VanDerWaalsContact CB-OE2 3.28Å; T561-E566 WeakPolarHBondContact CB-OE2 3.27Å; T561-E566 HydrophobicContact CG2-CB 4.43Å; T561-E566 HydrophobicContact CG2-CG 4.25Å; T561-E566 WeakPolarHBondContact CG2-OE2 3.11Å; T561-E566 PolarHBondContact OG1-OE2 2.99Å; T561-I567 HydrophobicContact CG2-CG1 4.38Å; T561-N585 HydrophobicContact CG2-CB 3.9Å; T561-N585 PolarHBondContact N-OD1 3.38Å
562	S	65.6	Low	65.2	Low	28 Å²	28	68.5 Å²	68.5	20%	0.196	34%	0.343	C	S	.	.			trans	-83.7	14.2	170.3	44.8	0	0	0	0	112.2	Y589 S871 N1193	S562-Y589 WeakPolarHBondContact O-CE2 3.42Å; S562-S871 PolarHBondContact O-OG 3.26Å; S562-N1193 PolarHBondContact OG-ND2 2.71Å
563	N	82.4	Confident	67.9	Low	3 Å²	3	58.4 Å²	58.4	2%	0.016	31%	0.306	C	S	.	.			trans	-92.6	101.7	-175.1	-171.9	-41.8	0	0	0	111.2	T561 K565 E566 I567 D870 S871	T561-N563 PolarHBondContact O-N 3.18Å; T561-N563 WeakPolarHBondContact OG1-CB 3.37Å; T561-N563 PolarHBondContact OG1-N 3.14Å; N563-K565 PolarHBondContact O-N 3.28Å; N563-E566 HydrophobicContact CB-CB 3.64Å; N563-E566 WeakPolarHBondContact O-CA 3.43Å; N563-E566 WeakPolarHBondContact O-CB 3.4Å; N563-E566 PolarHBondContact O-N 3.42Å; N563-E566 WeakPolarHBondContact OD1-CB 3.41Å; N563-E566 PolarHBondContact OD1-N 2.97Å; N563-I567 WeakPolarHBondContact O-CG1 3.46Å; N563-I567 PolarHBondContact O-N 2.82Å; N563-D870 PolarHBondContact ND2-N 3.16Å; N563-D870 VanDerWaalsContact OD1-C 3.3Å; N563-D870 VanDerWaalsContact OD1-CA 3.23Å; N563-D870 WeakPolarHBondContact OD1-CA 3.45Å; N563-D870 PolarHBondContact OD1-N 3.35Å; N563-S871 WeakPolarHBondContact CA-OG 3.48Å; N563-S871 VanDerWaalsContact CG-N 3.31Å; N563-S871 PolarHBondContact OD1-N 2.88Å
564	L	88.1	Confident	70.6	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-64.5	-39.2	-173.6	-179.8	59.2	0	0	0	113.2	E566 I567 I568 L586 Y589 L596 D600 S871	L564-E566 VanDerWaalsContact C-N 3.31Å; L564-I567 HydrophobicContact CD1-CG2 4.49Å; L564-I567 WeakPolarHBondContact O-CB 3.29Å; L564-I567 PolarHBondContact O-N 3.23Å; L564-I568 HydrophobicContact CG-CD1 4.35Å; L564-I568 WeakPolarHBondContact O-CG1 3.27Å; L564-I568 PolarHBondContact O-N 2.9Å; L564-L586 HydrophobicContact CD1-CD1 4.22Å; L564-Y589 HydrophobicContact CB-CD2 4.39Å; L564-Y589 HydrophobicContact CB-CE1 4.45Å; L564-Y589 HydrophobicContact CB-CE2 3.91Å; L564-Y589 HydrophobicContact CD1-CD1 4.17Å; L564-Y589 HydrophobicContact CD1-CE1 4.16Å; L564-Y589 HydrophobicContact CD2-CE1 4.12Å; L564-Y589 HydrophobicContact CG-CE1 4.48Å; L564-L596 HydrophobicContact CD1-CD2 3.53Å; L564-L596 HydrophobicContact CD2-CD2 3.48Å; L564-L596 VanDerWaalsContact CD2-CD2 3.48Å; L564-L596 HydrophobicContact CG-CD2 4.16Å; L564-D600 HydrophobicContact CD2-CB 3.9Å; L564-D600 VanDerWaalsContact CD2-CG 3.49Å; L564-S871 PolarHBondContact N-OG 2.73Å
565	K	89.2	Confident	73.4	Confident	67 Å²	67	57.1 Å²	57.1	29%	0.291	32%	0.321	S	S	.	.	H	α-helix	trans	-71	-28.3	172.3	-64.2	-166.6	-155.7	109.2	0	111.8	N563 I568 S569 G868 S869 D870 R873	N563-K565 PolarHBondContact O-N 3.28Å; K565-I568 PolarHBondContact O-N 2.68Å; K565-S569 VanDerWaalsContact O-CB 3.28Å; K565-S569 WeakPolarHBondContact O-CB 3.4Å; K565-S569 PolarHBondContact O-N 3.4Å; K565-G868 CarbonylContact O-C 3.52Å; K565-S869 PolarHBondContact O-N 3.28Å; K565-D870 VanDerWaalsContact CD-O 3.27Å; K565-D870 WeakPolarHBondContact CD-O 3.18Å; K565-D870 WeakPolarHBondContact CE-O 3.48Å; K565-D870 VanDerWaalsContact CG-O 3.26Å; K565-D870 WeakPolarHBondContact CG-O 3.36Å; K565-D870 PolarHBondContact NZ-O 2.9Å; K565-R873 PolarHBondContact NZ-O 3.44Å
566	E	89.3	Confident	76.3	Confident	49 Å²	49	53.7 Å²	53.7	23%	0.229	30%	0.302	C	S	.	.	H	α-helix	trans	-68.5	-40.2	173.7	-172.7	-174.6	174.2	0	0	110.4	T561 N563 L564 S569 Q570 S869	T561-E566 VanDerWaalsContact CB-OE2 3.28Å; T561-E566 WeakPolarHBondContact CB-OE2 3.27Å; T561-E566 HydrophobicContact CG2-CB 4.43Å; T561-E566 HydrophobicContact CG2-CG 4.25Å; T561-E566 WeakPolarHBondContact CG2-OE2 3.11Å; T561-E566 PolarHBondContact OG1-OE2 2.99Å; N563-E566 HydrophobicContact CB-CB 3.64Å; N563-E566 WeakPolarHBondContact O-CA 3.43Å; N563-E566 WeakPolarHBondContact O-CB 3.4Å; N563-E566 PolarHBondContact O-N 3.42Å; N563-E566 WeakPolarHBondContact OD1-CB 3.41Å; N563-E566 PolarHBondContact OD1-N 2.97Å; L564-E566 VanDerWaalsContact C-N 3.31Å; E566-S569 VanDerWaalsContact O-CB 3.32Å; E566-S569 WeakPolarHBondContact O-CB 3.01Å; E566-S569 PolarHBondContact O-N 3.37Å; E566-Q570 HydrophobicContact CG-CG 4.29Å; E566-Q570 VanDerWaalsContact O-CB 3.26Å; E566-Q570 WeakPolarHBondContact O-CB 3.28Å; E566-Q570 WeakPolarHBondContact O-CG 3.31Å; E566-Q570 PolarHBondContact O-N 3.05Å; E566-Q570 PolarHBondContact OE1-NE2 2.92Å; E566-S869 VanDerWaalsContact CA-CA 3.49Å
567	I	92.5	Very high	79.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-54.6	-53	167.4	-77	156.1	0	0	0	110.3	T561 N563 L564 S569 Q570 L571 N585 L586 Y589	T561-I567 HydrophobicContact CG2-CG1 4.38Å; N563-I567 WeakPolarHBondContact O-CG1 3.46Å; N563-I567 PolarHBondContact O-N 2.82Å; L564-I567 HydrophobicContact CD1-CG2 4.49Å; L564-I567 WeakPolarHBondContact O-CB 3.29Å; L564-I567 PolarHBondContact O-N 3.23Å; I567-S569 VanDerWaalsContact C-N 3.3Å; I567-S569 PolarHBondContact O-N 3.33Å; I567-Q570 PolarHBondContact O-N 2.8Å; I567-L571 HydrophobicContact CG2-CD1 3.7Å; I567-L571 HydrophobicContact CG2-CG 4.45Å; I567-L571 WeakPolarHBondContact O-CB 3.35Å; I567-L571 WeakPolarHBondContact O-CD1 3.25Å; I567-L571 WeakPolarHBondContact O-CG 3.37Å; I567-L571 PolarHBondContact O-N 2.83Å; I567-N585 HydrophobicContact CD1-CB 3.96Å; I567-N585 WeakPolarHBondContact CD1-O 3.48Å; I567-N585 HydrophobicContact CG1-CB 3.48Å; I567-N585 VanDerWaalsContact CG1-CB 3.48Å; I567-L586 HydrophobicContact CG2-CB 3.52Å; I567-L586 HydrophobicContact CG2-CD1 3.85Å; I567-L586 HydrophobicContact CG2-CD2 4.38Å; I567-L586 HydrophobicContact CG2-CG 4.08Å; I567-Y589 HydrophobicContact CD1-CD2 4.24Å; I567-Y589 HydrophobicContact CD1-CG 4.18Å
568	I	93.3	Very high	82.2	Confident	14 Å²	14	47.2 Å²	47.2	7%	0.072	25%	0.251	C	S	.	.	H	α-helix	trans	-56.3	-41.6	175.3	-77.3	161.8	0	0	0	112.3	L564 K565 L571 Q572 C603 L604 I607	L564-I568 HydrophobicContact CG-CD1 4.35Å; L564-I568 WeakPolarHBondContact O-CG1 3.27Å; L564-I568 PolarHBondContact O-N 2.9Å; K565-I568 PolarHBondContact O-N 2.68Å; I568-L571 PolarHBondContact O-N 3.39Å; I568-Q572 WeakPolarHBondContact O-CB 3.36Å; I568-Q572 VanDerWaalsContact O-CG 3.3Å; I568-Q572 WeakPolarHBondContact O-CG 3.38Å; I568-Q572 PolarHBondContact O-N 3.41Å; I568-C603 HydrophobicContact CD1-CB 4.45Å; I568-L604 HydrophobicContact CG1-CD2 4.04Å; I568-L604 HydrophobicContact CG1-CG 4.49Å; I568-I607 HydrophobicContact CB-CD1 4.13Å; I568-I607 HydrophobicContact CG1-CD1 3.96Å; I568-I607 HydrophobicContact CG2-CD1 3.72Å
569	S	92.6	Very high	84.7	Confident	13 Å²	13	45.4 Å²	45.4	9%	0.091	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-53.2	176.4	172.9	0	0	0	0	112.3	K565 E566 I567 L571 Q572 A573 A867 G868	K565-S569 VanDerWaalsContact O-CB 3.28Å; K565-S569 WeakPolarHBondContact O-CB 3.4Å; K565-S569 PolarHBondContact O-N 3.4Å; E566-S569 VanDerWaalsContact O-CB 3.32Å; E566-S569 WeakPolarHBondContact O-CB 3.01Å; E566-S569 PolarHBondContact O-N 3.37Å; I567-S569 VanDerWaalsContact C-N 3.3Å; I567-S569 PolarHBondContact O-N 3.33Å; S569-L571 VanDerWaalsContact C-N 3.27Å; S569-L571 PolarHBondContact O-N 2.83Å; S569-Q572 CarbonylContact O-C 3.6Å; S569-Q572 PolarHBondContact O-N 3.49Å; S569-A573 PolarHBondContact O-N 3.01Å; S569-A867 WeakPolarHBondContact OG-CB 3.4Å; S569-G868 VanDerWaalsContact CB-N 3.34Å; S569-G868 PolarHBondContact OG-N 3.11Å; S569-G868 VanDerWaalsContact OG-N 3.12Å
570	Q	92.5	Very high	86.9	Confident	32 Å²	32	45.4 Å²	45.4	15%	0.15	23%	0.234	C	C	.	.	H	α-helix	trans	-57.6	-40.4	175.9	-74.4	175.2	6.3	0	0	110.7	E566 I567 A573 D578 R579 G582 N585	E566-Q570 HydrophobicContact CG-CG 4.29Å; E566-Q570 VanDerWaalsContact O-CB 3.26Å; E566-Q570 WeakPolarHBondContact O-CB 3.28Å; E566-Q570 WeakPolarHBondContact O-CG 3.31Å; E566-Q570 PolarHBondContact O-N 3.05Å; E566-Q570 PolarHBondContact OE1-NE2 2.92Å; I567-Q570 PolarHBondContact O-N 2.8Å; Q570-A573 WeakPolarHBondContact O-CB 3.35Å; Q570-A573 PolarHBondContact O-N 2.99Å; Q570-D578 WeakPolarHBondContact CB-O 3.25Å; Q570-D578 CarbonylContact O-C 3.56Å; Q570-D578 VanDerWaalsContact O-C 3.26Å; Q570-R579 VanDerWaalsContact O-CA 3.22Å; Q570-R579 WeakPolarHBondContact O-CA 3.29Å; Q570-R579 VanDerWaalsContact O-CG 3.29Å; Q570-R579 WeakPolarHBondContact O-CG 3.34Å; Q570-R579 PolarHBondContact O-N 3.48Å; Q570-R579 VanDerWaalsContact O-N 3.17Å; Q570-G582 VanDerWaalsContact CB-CA 3.48Å; Q570-N585 PolarHBondContact OE1-ND2 3.3Å
571	L	94.3	Very high	88.8	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-69.5	-28.2	175.2	-66.3	166.2	0	0	0	114.2	I567 I568 S569 R579 L583 L586 L604 I607 M611	I567-L571 HydrophobicContact CG2-CD1 3.7Å; I567-L571 HydrophobicContact CG2-CG 4.45Å; I567-L571 WeakPolarHBondContact O-CB 3.35Å; I567-L571 WeakPolarHBondContact O-CD1 3.25Å; I567-L571 WeakPolarHBondContact O-CG 3.37Å; I567-L571 PolarHBondContact O-N 2.83Å; I568-L571 PolarHBondContact O-N 3.39Å; S569-L571 VanDerWaalsContact C-N 3.27Å; S569-L571 PolarHBondContact O-N 2.83Å; L571-R579 VanDerWaalsContact O-CD 3.22Å; L571-R579 WeakPolarHBondContact O-CD 3.17Å; L571-R579 WeakPolarHBondContact O-CG 3.49Å; L571-L583 HydrophobicContact CD2-CB 4.22Å; L571-L583 HydrophobicContact CD2-CD2 3.53Å; L571-L583 HydrophobicContact CD2-CG 3.47Å; L571-L583 VanDerWaalsContact CD2-CG 3.47Å; L571-L586 HydrophobicContact CD1-CD2 3.9Å; L571-L604 HydrophobicContact CD1-CD2 3.8Å; L571-I607 HydrophobicContact CB-CG2 3.7Å; L571-M611 HydrophobicContact CD2-CE 3.78Å; L571-M611 HydrophobicContact CD2-SD 3.76Å
572	Q	92.6	Very high	90.4	Very high	107 Å²	107	44 Å²	44	50%	0.5	22%	0.224	S	C	.	.	H	α-helix	trans	-87.9	-10.8	174.3	-72.1	-179.2	8.6	0	0	113.5	I568 S569 I607	I568-Q572 WeakPolarHBondContact O-CB 3.36Å; I568-Q572 VanDerWaalsContact O-CG 3.3Å; I568-Q572 WeakPolarHBondContact O-CG 3.38Å; I568-Q572 PolarHBondContact O-N 3.41Å; S569-Q572 CarbonylContact O-C 3.6Å; S569-Q572 PolarHBondContact O-N 3.49Å; Q572-I607 HydrophobicContact CG-CD1 4.02Å; Q572-I607 HydrophobicContact CG-CG1 3.86Å
573	A	91.7	Very high	91.8	Very high	15 Å²	15	42.7 Å²	42.7	12%	0.124	21%	0.214	C	C	.	.			trans	-64.3	147.8	-176.2	0	0	0	0	0	112.8	S569 Q570 Q575 D578 R579	S569-A573 PolarHBondContact O-N 3.01Å; Q570-A573 WeakPolarHBondContact O-CB 3.35Å; Q570-A573 PolarHBondContact O-N 2.99Å; A573-Q575 VanDerWaalsContact C-N 3.31Å; A573-Q575 PolarHBondContact O-N 3.35Å; A573-D578 HydrophobicContact CB-CB 3.62Å; A573-R579 WeakPolarHBondContact O-CD 3.2Å; A573-R579 VanDerWaalsContact O-CG 3.31Å; A573-R579 WeakPolarHBondContact O-CG 3.19Å; A573-R579 PolarHBondContact O-NH1 3.34Å
574	V	90.4	Very high	92.3	Very high	140 Å²	140	44.8 Å²	44.8	85%	0.848	23%	0.227	S	C	*	.	S	Bend	trans	-70.3	-29.6	-179.3	-176.8	0	0	0	0	111.7	R579	V574-R579 PolarHBondContact O-NH1 2.98Å
575	Q	91.2	Very high	92.4	Very high	111 Å²	111	44.8 Å²	44.8	52%	0.519	23%	0.227	S	C	.	.	S	Bend	trans	-77.6	142.9	177.2	-67.9	-63.9	-5.1	0	0	112.5	A573 D578 R579	A573-Q575 VanDerWaalsContact C-N 3.31Å; A573-Q575 PolarHBondContact O-N 3.35Å; Q575-D578 HydrophobicContact CB-CB 4.26Å; Q575-D578 WeakPolarHBondContact CB-OD1 3.42Å; Q575-R579 PolarHBondContact O-N 3.26Å; Q575-R579 PolarHBondContact O-NH1 2.97Å
576	W	91.2	Very high	92.6	Very high	80 Å²	80	41.6 Å²	41.6	30%	0.303	21%	0.213	S	C	.	.	H	α-helix	trans	-81.6	-25.6	-176.7	74.4	-93.6	0	0	0	113	D578 K580 Q616 K618 V619	W576-D578 VanDerWaalsContact C-N 3.32Å; W576-K580 HydrophobicContact CZ3-CD 4.21Å; W576-K580 WeakPolarHBondContact O-CB 3.24Å; W576-K580 PolarHBondContact O-N 3.49Å; W576-Q616 HydrophobicContact CB-CB 3.78Å; W576-Q616 HydrophobicContact CB-CG 3.54Å; W576-Q616 HydrophobicContact CG-CB 4.32Å; W576-Q616 HydrophobicContact CG-CG 3.97Å; W576-K618 HydrophobicContact CE3-CB 4.32Å; W576-K618 HydrophobicContact CE3-CD 4.47Å; W576-K618 HydrophobicContact CH2-CD 3.82Å; W576-K618 HydrophobicContact CZ3-CB 4.03Å; W576-K618 HydrophobicContact CZ3-CD 3.56Å; W576-K618 HydrophobicContact CZ3-CG 4.41Å; W576-V619 HydrophobicContact CB-CG2 3.91Å; W576-V619 HydrophobicContact CE3-CG2 4.34Å; W576-V619 VanDerWaalsContact O-CG2 3.22Å; W576-V619 WeakPolarHBondContact O-CG2 3.49Å
577	S	92.3	Very high	92.7	Very high	39 Å²	39	40 Å²	40	27%	0.273	21%	0.206	S	C	.	.	H	α-helix	trans	-54.9	-54.3	167.4	35.8	0	0	0	0	109.4	R579 K580 D581	S577-R579 PolarHBondContact O-N 2.89Å; S577-K580 WeakPolarHBondContact O-CB 3.49Å; S577-K580 PolarHBondContact O-N 2.99Å; S577-K580 VanDerWaalsContact O-N 3.08Å; S577-D581 VanDerWaalsContact O-CG 3.27Å; S577-D581 PolarHBondContact O-N 2.88Å
578	D	93.6	Very high	92.5	Very high	65 Å²	65	42.1 Å²	42.1	35%	0.348	22%	0.217	S	C	.	.	H	α-helix	trans	-63.2	-45.1	-173.5	-49.4	17.2	0	0	0	109.2	Q570 A573 Q575 W576 K580 D581 G582	Q570-D578 WeakPolarHBondContact CB-O 3.25Å; Q570-D578 CarbonylContact O-C 3.56Å; Q570-D578 VanDerWaalsContact O-C 3.26Å; A573-D578 HydrophobicContact CB-CB 3.62Å; Q575-D578 HydrophobicContact CB-CB 4.26Å; Q575-D578 WeakPolarHBondContact CB-OD1 3.42Å; W576-D578 VanDerWaalsContact C-N 3.32Å; D578-K580 PolarHBondContact O-N 3.38Å; D578-D581 PolarHBondContact O-N 3.18Å; D578-G582 PolarHBondContact O-N 3.47Å
579	R	94.8	Very high	92.2	Very high	34 Å²	34	42.6 Å²	42.6	13%	0.128	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-37.6	174.2	-65.5	-164.8	-55.5	-77.4	1	114	Q570 L571 A573 V574 Q575 S577 D581 L583 M611 D614 V619	Q570-R579 VanDerWaalsContact O-CA 3.22Å; Q570-R579 WeakPolarHBondContact O-CA 3.29Å; Q570-R579 VanDerWaalsContact O-CG 3.29Å; Q570-R579 WeakPolarHBondContact O-CG 3.34Å; Q570-R579 PolarHBondContact O-N 3.48Å; Q570-R579 VanDerWaalsContact O-N 3.17Å; L571-R579 VanDerWaalsContact O-CD 3.22Å; L571-R579 WeakPolarHBondContact O-CD 3.17Å; L571-R579 WeakPolarHBondContact O-CG 3.49Å; A573-R579 WeakPolarHBondContact O-CD 3.2Å; A573-R579 VanDerWaalsContact O-CG 3.31Å; A573-R579 WeakPolarHBondContact O-CG 3.19Å; A573-R579 PolarHBondContact O-NH1 3.34Å; V574-R579 PolarHBondContact O-NH1 2.98Å; Q575-R579 PolarHBondContact O-N 3.26Å; Q575-R579 PolarHBondContact O-NH1 2.97Å; S577-R579 PolarHBondContact O-N 2.89Å; R579-D581 VanDerWaalsContact C-N 3.34Å; R579-L583 VanDerWaalsContact O-CG 3.27Å; R579-L583 WeakPolarHBondContact O-CG 3.39Å; R579-L583 PolarHBondContact O-N 2.88Å; R579-M611 HydrophobicContact CB-CE 4.09Å; R579-D614 IonicContact CZ-OD2 3.76Å; R579-D614 IonicContact NE-OD2 2.75Å; R579-D614 PolarHBondContact NE-OD2 2.82Å; R579-D614 VanDerWaalsContact NH2-CG 3.26Å; R579-D614 IonicContact NH2-OD1 2.77Å; R579-D614 PolarHBondContact NH2-OD1 3.15Å; R579-D614 IonicContact NH2-OD2 3.86Å; R579-D614 PolarHBondContact NH2-OD2 2.83Å; R579-V619 HydrophobicContact CB-CG1 3.79Å; R579-V619 HydrophobicContact CB-CG2 4.31Å
580	K	93.9	Very high	92	Very high	70 Å²	70	42.4 Å²	42.4	30%	0.304	22%	0.216	S	C	.	.	H	α-helix	trans	-62.6	-43.8	172.5	168.4	-166.2	154.5	-76	0	110.5	W576 S577 D578 L583 T584 V619 L622	W576-K580 HydrophobicContact CZ3-CD 4.21Å; W576-K580 WeakPolarHBondContact O-CB 3.24Å; W576-K580 PolarHBondContact O-N 3.49Å; S577-K580 WeakPolarHBondContact O-CB 3.49Å; S577-K580 PolarHBondContact O-N 2.99Å; S577-K580 VanDerWaalsContact O-N 3.08Å; D578-K580 PolarHBondContact O-N 3.38Å; K580-L583 PolarHBondContact O-N 3.39Å; K580-T584 PolarHBondContact O-N 2.72Å; K580-T584 PolarHBondContact O-OG1 3.07Å; K580-V619 HydrophobicContact CB-CG2 4.28Å; K580-L622 HydrophobicContact CG-CD2 3.95Å; K580-L622 WeakPolarHBondContact O-CD2 3.24Å
581	D	92.4	Very high	91.7	Very high	48 Å²	48	47.5 Å²	47.5	26%	0.257	23%	0.234	S	C	.	.	H	α-helix	trans	-73.9	-38.4	-175.2	-63.7	-23.4	0	0	0	110.2	S577 D578 R579 L583 T584 N585	S577-D581 VanDerWaalsContact O-CG 3.27Å; S577-D581 PolarHBondContact O-N 2.88Å; D578-D581 PolarHBondContact O-N 3.18Å; R579-D581 VanDerWaalsContact C-N 3.34Å; D581-L583 PolarHBondContact O-N 3.08Å; D581-T584 WeakPolarHBondContact O-CA 3.29Å; D581-T584 WeakPolarHBondContact O-CB 3.39Å; D581-T584 PolarHBondContact O-N 3.21Å; D581-N585 WeakPolarHBondContact O-CB 3.22Å; D581-N585 VanDerWaalsContact O-CG 3.23Å; D581-N585 PolarHBondContact O-N 3.33Å; D581-N585 PolarHBondContact O-ND2 3.09Å
582	G	93.7	Very high	91	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-57.6	-41.6	167.9	0	0	0	0	0	113.6	Q570 D578 L586	Q570-G582 VanDerWaalsContact CB-CA 3.48Å; D578-G582 PolarHBondContact O-N 3.47Å; G582-L586 WeakPolarHBondContact O-CB 3.25Å; G582-L586 PolarHBondContact O-N 3.04Å
583	L	95	Very high	90.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-65.1	-39.8	172	-74.7	167.7	0	0	0	112.3	L571 R579 K580 D581 L586 Q587 F608 M611 V619 L622 F623 T626	L571-L583 HydrophobicContact CD2-CB 4.22Å; L571-L583 HydrophobicContact CD2-CD2 3.53Å; L571-L583 HydrophobicContact CD2-CG 3.47Å; L571-L583 VanDerWaalsContact CD2-CG 3.47Å; R579-L583 VanDerWaalsContact O-CG 3.27Å; R579-L583 WeakPolarHBondContact O-CG 3.39Å; R579-L583 PolarHBondContact O-N 2.88Å; K580-L583 PolarHBondContact O-N 3.39Å; D581-L583 PolarHBondContact O-N 3.08Å; L583-L586 PolarHBondContact O-N 3.15Å; L583-Q587 WeakPolarHBondContact O-CG 3.43Å; L583-Q587 PolarHBondContact O-N 3.39Å; L583-F608 HydrophobicContact CD2-CE1 4.37Å; L583-M611 HydrophobicContact CD1-CE 3.78Å; L583-M611 HydrophobicContact CD2-CE 4.02Å; L583-M611 HydrophobicContact CD2-SD 4.11Å; L583-M611 HydrophobicContact CG-CE 3.87Å; L583-V619 HydrophobicContact CD1-CG1 3.6Å; L583-V619 WeakPolarHBondContact CD1-O 3.38Å; L583-L622 HydrophobicContact CB-CD2 3.61Å; L583-L622 HydrophobicContact CB-CG 3.86Å; L583-L622 HydrophobicContact CD1-CB 4.18Å; L583-L622 HydrophobicContact CD1-CD2 4.36Å; L583-L622 HydrophobicContact CD1-CG 4.28Å; L583-F623 HydrophobicContact CD1-CB 3.81Å; L583-F623 HydrophobicContact CD2-CB 4.27Å; L583-F623 HydrophobicContact CD2-CD2 4.15Å; L583-T626 HydrophobicContact CD2-CG2 4.04Å
584	T	92.7	Very high	89.4	Confident	47 Å²	47	51.2 Å²	51.2	29%	0.288	27%	0.27	S	S	.	.	H	α-helix	trans	-63.4	-46.8	178.3	-52.7	0	0	0	0	109.9	K580 D581 Q587 N588 L622	K580-T584 PolarHBondContact O-N 2.72Å; K580-T584 PolarHBondContact O-OG1 3.07Å; D581-T584 WeakPolarHBondContact O-CA 3.29Å; D581-T584 WeakPolarHBondContact O-CB 3.39Å; D581-T584 PolarHBondContact O-N 3.21Å; T584-Q587 PolarHBondContact O-N 2.69Å; T584-N588 VanDerWaalsContact O-CG 3.25Å; T584-N588 PolarHBondContact O-N 3.23Å; T584-N588 VanDerWaalsContact O-N 3.12Å; T584-N588 PolarHBondContact O-ND2 3.01Å; T584-L622 VanDerWaalsContact OG1-CD2 3.31Å; T584-L622 WeakPolarHBondContact OG1-CD2 3.44Å
585	N	91.6	Very high	88.8	Confident	6 Å²	6	49.4 Å²	49.4	3%	0.032	26%	0.261	C	S	.	.	H	α-helix	trans	-66.3	-38.6	177.7	-67.2	-38.7	0	0	0	111.4	T561 I567 Q570 D581 N588 Y589	T561-N585 HydrophobicContact CG2-CB 3.9Å; T561-N585 PolarHBondContact N-OD1 3.38Å; I567-N585 HydrophobicContact CD1-CB 3.96Å; I567-N585 WeakPolarHBondContact CD1-O 3.48Å; I567-N585 HydrophobicContact CG1-CB 3.48Å; I567-N585 VanDerWaalsContact CG1-CB 3.48Å; Q570-N585 PolarHBondContact OE1-ND2 3.3Å; D581-N585 WeakPolarHBondContact O-CB 3.22Å; D581-N585 VanDerWaalsContact O-CG 3.23Å; D581-N585 PolarHBondContact O-N 3.33Å; D581-N585 PolarHBondContact O-ND2 3.09Å; N585-N588 PolarHBondContact O-N 2.91Å; N585-N588 VanDerWaalsContact O-N 3.17Å; N585-Y589 WeakPolarHBondContact O-CB 3.43Å; N585-Y589 PolarHBondContact O-N 3.25Å
586	L	93.3	Very high	88.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-45.1	173	-173.7	52.5	0	0	0	112.3	L564 I567 L571 G582 L583 N588 Y589 M590 L604 F608 T626	L564-L586 HydrophobicContact CD1-CD1 4.22Å; I567-L586 HydrophobicContact CG2-CB 3.52Å; I567-L586 HydrophobicContact CG2-CD1 3.85Å; I567-L586 HydrophobicContact CG2-CD2 4.38Å; I567-L586 HydrophobicContact CG2-CG 4.08Å; L571-L586 HydrophobicContact CD1-CD2 3.9Å; G582-L586 WeakPolarHBondContact O-CB 3.25Å; G582-L586 PolarHBondContact O-N 3.04Å; L583-L586 PolarHBondContact O-N 3.15Å; L586-N588 PolarHBondContact O-N 3.23Å; L586-Y589 PolarHBondContact O-N 2.81Å; L586-M590 HydrophobicContact CD1-CG 4.07Å; L586-M590 HydrophobicContact CD1-SD 4.24Å; L586-M590 HydrophobicContact CG-CE 4.05Å; L586-M590 HydrophobicContact CG-CG 4.47Å; L586-M590 HydrophobicContact CG-SD 4.23Å; L586-M590 WeakPolarHBondContact O-CG 3.29Å; L586-M590 PolarHBondContact O-N 3.36Å; L586-L604 HydrophobicContact CD1-CD1 4.02Å; L586-L604 HydrophobicContact CD1-CD2 4.43Å; L586-L604 HydrophobicContact CD2-CD1 4.31Å; L586-L604 HydrophobicContact CD2-CD2 3.71Å; L586-F608 HydrophobicContact CD2-CE1 3.86Å; L586-F608 HydrophobicContact CD2-CZ 3.56Å; L586-T626 HydrophobicContact CB-CG2 4.34Å; L586-T626 HydrophobicContact CD2-CG2 3.89Å; L586-T626 HydrophobicContact CG-CG2 4.1Å
587	Q	90.5	Very high	88.2	Confident	15 Å²	15	45.2 Å²	45.2	7%	0.07	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-37.1	175.4	-68.9	-171.5	10.7	0	0	111.8	L583 T584 R591 T626	L583-Q587 WeakPolarHBondContact O-CG 3.43Å; L583-Q587 PolarHBondContact O-N 3.39Å; T584-Q587 PolarHBondContact O-N 2.69Å; Q587-R591 VanDerWaalsContact O-CB 3.3Å; Q587-R591 WeakPolarHBondContact O-CB 3.43Å; Q587-R591 WeakPolarHBondContact O-CD 3.38Å; Q587-R591 WeakPolarHBondContact O-CG 3.35Å; Q587-R591 PolarHBondContact O-N 3Å; Q587-T626 HydrophobicContact CG-CG2 3.95Å; Q587-T626 WeakPolarHBondContact CG-OG1 3.47Å; Q587-T626 PolarHBondContact NE2-OG1 2.66Å
588	N	88.3	Confident	87.9	Confident	45 Å²	45	47.4 Å²	47.4	24%	0.241	26%	0.261	C	S	.	.	H	α-helix	trans	-73.7	-37.9	179.3	-64.5	-19.2	0	0	0	112	V560 T584 N585 L586 R591 S592	V560-N588 HydrophobicContact CG1-CB 3.53Å; V560-N588 WeakPolarHBondContact CG2-ND2 3.43Å; T584-N588 VanDerWaalsContact O-CG 3.25Å; T584-N588 PolarHBondContact O-N 3.23Å; T584-N588 VanDerWaalsContact O-N 3.12Å; T584-N588 PolarHBondContact O-ND2 3.01Å; N585-N588 PolarHBondContact O-N 2.91Å; N585-N588 VanDerWaalsContact O-N 3.17Å; L586-N588 PolarHBondContact O-N 3.23Å; N588-R591 PolarHBondContact O-N 2.78Å; N588-S592 PolarHBondContact O-N 3.28Å; N588-S592 PolarHBondContact O-OG 3.49Å
589	Y	88.7	Confident	87.6	Confident	25 Å²	25	50.6 Å²	50.6	10%	0.098	28%	0.278	C	S	.	.	H	α-helix	trans	-60.6	-48.7	172.8	-173.5	-83.7	0	0	0	111.6	S562 L564 I567 N585 L586 R591 S592 Y594 L596	S562-Y589 WeakPolarHBondContact O-CE2 3.42Å; L564-Y589 HydrophobicContact CB-CD2 4.39Å; L564-Y589 HydrophobicContact CB-CE1 4.45Å; L564-Y589 HydrophobicContact CB-CE2 3.91Å; L564-Y589 HydrophobicContact CD1-CD1 4.17Å; L564-Y589 HydrophobicContact CD1-CE1 4.16Å; L564-Y589 HydrophobicContact CD2-CE1 4.12Å; L564-Y589 HydrophobicContact CG-CE1 4.48Å; I567-Y589 HydrophobicContact CD1-CD2 4.24Å; I567-Y589 HydrophobicContact CD1-CG 4.18Å; N585-Y589 WeakPolarHBondContact O-CB 3.43Å; N585-Y589 PolarHBondContact O-N 3.25Å; L586-Y589 PolarHBondContact O-N 2.81Å; Y589-R591 VanDerWaalsContact C-N 3.3Å; Y589-R591 PolarHBondContact O-N 3.39Å; Y589-S592 WeakPolarHBondContact CA-OG 3.39Å; Y589-S592 PolarHBondContact O-N 2.91Å; Y589-S592 PolarHBondContact O-OG 2.78Å; Y589-Y594 HydrophobicContact CD2-CD2 4.39Å; Y589-Y594 HydrophobicContact CE2-CD2 4.14Å; Y589-L596 HydrophobicContact CD1-CD2 3.93Å; Y589-L596 HydrophobicContact CE1-CD2 3.58Å; Y589-L596 HydrophobicContact CE1-CG 4.46Å
590	M	88.3	Confident	87.4	Confident	8 Å²	8	50.4 Å²	50.4	4%	0.039	28%	0.28	C	S	.	.	H	α-helix	trans	-66.2	-31.8	176.4	-62.2	-177.9	-57.5	0	0	112.4	L586 G593 L596 T626 F629 F630 Y634	L586-M590 HydrophobicContact CD1-CG 4.07Å; L586-M590 HydrophobicContact CD1-SD 4.24Å; L586-M590 HydrophobicContact CG-CE 4.05Å; L586-M590 HydrophobicContact CG-CG 4.47Å; L586-M590 HydrophobicContact CG-SD 4.23Å; L586-M590 WeakPolarHBondContact O-CG 3.29Å; L586-M590 PolarHBondContact O-N 3.36Å; M590-G593 PolarHBondContact O-N 3.02Å; M590-L596 HydrophobicContact CG-CD1 4.3Å; M590-L596 HydrophobicContact SD-CD1 4.4Å; M590-T626 HydrophobicContact CE-CG2 3.81Å; M590-F629 HydrophobicContact CB-CD1 3.86Å; M590-F629 HydrophobicContact CB-CE1 3.55Å; M590-F629 HydrophobicContact CB-CZ 4.37Å; M590-F629 HydrophobicContact CE-CB 4.08Å; M590-F629 HydrophobicContact CE-CD1 3.64Å; M590-F629 HydrophobicContact CE-CE1 4.47Å; M590-F629 HydrophobicContact CE-CG 4.08Å; M590-F629 HydrophobicContact SD-CD1 4Å; M590-F630 HydrophobicContact SD-CB 4.22Å; M590-F630 HydrophobicContact SD-CD2 3.93Å; M590-Y634 HydrophobicContact CG-CE2 4.3Å; M590-Y634 HydrophobicContact SD-CE2 3.97Å
591	R	85.5	Confident	87.3	Confident	139 Å²	139	47.3 Å²	47.3	53%	0.525	27%	0.267	S	S	.	.	H	α-helix	trans	-75.2	-20.2	175.1	-76.6	172.1	-170.9	131.8	8.7	114.5	Q587 N588 Y589 G593 F629	Q587-R591 VanDerWaalsContact O-CB 3.3Å; Q587-R591 WeakPolarHBondContact O-CB 3.43Å; Q587-R591 WeakPolarHBondContact O-CD 3.38Å; Q587-R591 WeakPolarHBondContact O-CG 3.35Å; Q587-R591 PolarHBondContact O-N 3Å; N588-R591 PolarHBondContact O-N 2.78Å; Y589-R591 VanDerWaalsContact C-N 3.3Å; Y589-R591 PolarHBondContact O-N 3.39Å; R591-G593 PolarHBondContact O-N 3.48Å; R591-F629 HydrophobicContact CG-CE2 3.83Å; R591-F629 HydrophobicContact CG-CZ 4.03Å
592	S	80.3	Confident	87.3	Confident	63 Å²	63	51.1 Å²	51.1	44%	0.441	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-5.6	175.3	25.7	0	0	0	0	112.8	N588 Y589 Y594	N588-S592 PolarHBondContact O-N 3.28Å; N588-S592 PolarHBondContact O-OG 3.49Å; Y589-S592 WeakPolarHBondContact CA-OG 3.39Å; Y589-S592 PolarHBondContact O-N 2.91Å; Y589-S592 PolarHBondContact O-OG 2.78Å; S592-Y594 VanDerWaalsContact C-N 3.33Å; S592-Y594 PolarHBondContact O-N 3.03Å
593	G	73.6	Confident	87.3	Confident	63 Å²	63	53.2 Å²	53.2	65%	0.649	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	3.2	172.9	0	0	0	0	0	114.8	M590 R591	M590-G593 PolarHBondContact O-N 3.02Å; R591-G593 PolarHBondContact O-N 3.48Å
594	Y	76.5	Confident	87.3	Confident	78 Å²	78	53.2 Å²	53.2	31%	0.306	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-65.3	125.7	170.2	-56.2	-65.5	0	0	0	109.7	Y589 S592 E1190	Y589-Y594 HydrophobicContact CD2-CD2 4.39Å; Y589-Y594 HydrophobicContact CE2-CD2 4.14Å; S592-Y594 VanDerWaalsContact C-N 3.33Å; S592-Y594 PolarHBondContact O-N 3.03Å; Y594-E1190 PolarHBondContact OH-OE1 3.21Å
595	P	77.3	Confident	87.4	Confident	101 Å²	101	51.5 Å²	51.5	66%	0.656	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-71.4	136.1	178.5	29.1	-33.9	0	0	0	110.8
596	L	85.1	Confident	87.5	Confident	11 Å²	11	55.1 Å²	55.1	6%	0.058	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-78	136.6	167.3	-63.4	173.7	0	0	0	109.5	L564 Y589 M590 D600 I601 L604 F630 Y634	L564-L596 HydrophobicContact CD1-CD2 3.53Å; L564-L596 HydrophobicContact CD2-CD2 3.48Å; L564-L596 VanDerWaalsContact CD2-CD2 3.48Å; L564-L596 HydrophobicContact CG-CD2 4.16Å; Y589-L596 HydrophobicContact CD1-CD2 3.93Å; Y589-L596 HydrophobicContact CE1-CD2 3.58Å; Y589-L596 HydrophobicContact CE1-CG 4.46Å; M590-L596 HydrophobicContact CG-CD1 4.3Å; M590-L596 HydrophobicContact SD-CD1 4.4Å; L596-D600 HydrophobicContact CB-CB 4.49Å; L596-D600 HydrophobicContact CD2-CB 4.49Å; L596-I601 HydrophobicContact CB-CD1 4.05Å; L596-I601 HydrophobicContact CB-CG1 3.67Å; L596-I601 HydrophobicContact CD1-CG1 4.24Å; L596-L604 HydrophobicContact CD1-CD1 3.71Å; L596-L604 HydrophobicContact CD2-CD1 4.23Å; L596-F630 HydrophobicContact CD1-CD2 4.2Å; L596-F630 HydrophobicContact CD1-CE2 3.86Å; L596-Y634 HydrophobicContact CB-CE1 4.13Å; L596-Y634 HydrophobicContact CD1-CD2 4.17Å; L596-Y634 HydrophobicContact CD1-CE1 4.38Å; L596-Y634 HydrophobicContact CD1-CE2 3.53Å; L596-Y634 HydrophobicContact CG-CE1 4.4Å; L596-Y634 HydrophobicContact CG-CE2 4.25Å
597	N	84.4	Confident	87.5	Confident	93 Å²	93	55.3 Å²	55.3	50%	0.497	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-72.2	158	173.5	-55.7	-70.2	0	0	0	110.6	D599 D600 I601	N597-D599 PolarHBondContact O-N 2.95Å; N597-D600 WeakPolarHBondContact CB-OD2 3.47Å; N597-D600 PolarHBondContact N-OD2 3.39Å; N597-D600 PolarHBondContact ND2-OD2 2.99Å; N597-D600 PolarHBondContact O-N 3.19Å; N597-D600 VanDerWaalsContact O-N 3.08Å; N597-I601 WeakPolarHBondContact O-CG1 3.42Å; N597-I601 PolarHBondContact O-N 2.84Å
598	P	85.9	Confident	87.8	Confident	85 Å²	85	54.6 Å²	54.6	55%	0.552	30%	0.301	S	S	*	.	H	α-helix	trans	-53.7	-37.6	174.8	-27.6	36.5	0	0	0	113.5	I601 H602	P598-I601 PolarHBondContact O-N 3.45Å; P598-H602 WeakPolarHBondContact O-CB 3.49Å; P598-H602 PolarHBondContact O-N 3.41Å
599	D	87.9	Confident	88	Confident	132 Å²	132	52.8 Å²	52.8	71%	0.706	29%	0.291	S	S	*	.	H	α-helix	trans	-68.8	-39.2	177	-58.9	-45	0	0	0	112.6	N597 I601 H602 C603	N597-D599 PolarHBondContact O-N 2.95Å; D599-I601 VanDerWaalsContact C-N 3.35Å; D599-H602 PolarHBondContact O-N 3.11Å; D599-C603 WeakPolarHBondContact O-CB 3.17Å; D599-C603 PolarHBondContact O-N 3.3Å
600	D	91.2	Very high	88.2	Confident	29 Å²	29	57.7 Å²	57.7	16%	0.155	31%	0.313	C	S	.	.	H	α-helix	trans	-66.3	-39.4	174.2	-66.5	-57.6	0	0	0	110.9	L564 L596 N597 C603 L604	L564-D600 HydrophobicContact CD2-CB 3.9Å; L564-D600 VanDerWaalsContact CD2-CG 3.49Å; L596-D600 HydrophobicContact CB-CB 4.49Å; L596-D600 HydrophobicContact CD2-CB 4.49Å; N597-D600 WeakPolarHBondContact CB-OD2 3.47Å; N597-D600 PolarHBondContact N-OD2 3.39Å; N597-D600 PolarHBondContact ND2-OD2 2.99Å; N597-D600 PolarHBondContact O-N 3.19Å; N597-D600 VanDerWaalsContact O-N 3.08Å; D600-C603 PolarHBondContact O-N 3.34Å; D600-L604 WeakPolarHBondContact O-CB 3.27Å; D600-L604 VanDerWaalsContact O-CG 3.26Å; D600-L604 WeakPolarHBondContact O-CG 3.37Å; D600-L604 PolarHBondContact O-N 3.45Å
601	I	92.2	Very high	88.4	Confident	6 Å²	6	57.7 Å²	57.7	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-62.6	-44.4	173.8	-68.8	168.2	0	0	0	110.2	L596 N597 P598 D599 L604 T605 F630 Y634 L637 L638	L596-I601 HydrophobicContact CB-CD1 4.05Å; L596-I601 HydrophobicContact CB-CG1 3.67Å; L596-I601 HydrophobicContact CD1-CG1 4.24Å; N597-I601 WeakPolarHBondContact O-CG1 3.42Å; N597-I601 PolarHBondContact O-N 2.84Å; P598-I601 PolarHBondContact O-N 3.45Å; D599-I601 VanDerWaalsContact C-N 3.35Å; I601-L604 PolarHBondContact O-N 3.48Å; I601-T605 WeakPolarHBondContact O-CG2 3.34Å; I601-T605 PolarHBondContact O-N 2.88Å; I601-T605 PolarHBondContact O-OG1 3.34Å; I601-F630 HydrophobicContact CB-CZ 4.47Å; I601-F630 HydrophobicContact CG1-CE2 4.39Å; I601-F630 HydrophobicContact CG2-CZ 3.93Å; I601-Y634 HydrophobicContact CD1-CD1 3.62Å; I601-Y634 HydrophobicContact CD1-CE1 4.24Å; I601-Y634 HydrophobicContact CD1-CG 4Å; I601-Y634 HydrophobicContact CG1-CD1 4.43Å; I601-Y634 HydrophobicContact CG1-CG 4.48Å; I601-L637 HydrophobicContact CD1-CD1 3.5Å; I601-L638 HydrophobicContact CG2-CD2 3.77Å
602	H	91.5	Very high	88.8	Confident	128 Å²	128	51.7 Å²	51.7	59%	0.593	29%	0.291	S	S	*	.	H	α-helix	trans	-65.8	-36.6	175.7	-169.5	-62.7	0	0	0	112.3	P598 D599 T605 E606	P598-H602 WeakPolarHBondContact O-CB 3.49Å; P598-H602 PolarHBondContact O-N 3.41Å; D599-H602 PolarHBondContact O-N 3.11Å; H602-T605 WeakPolarHBondContact CA-OG1 3.42Å; H602-T605 PolarHBondContact O-OG1 3.29Å; H602-E606 WeakPolarHBondContact O-CB 3.27Å; H602-E606 PolarHBondContact O-N 3.1Å; H602-E606 VanDerWaalsContact O-N 3.15Å
603	C	93.4	Very high	89.3	Confident	43 Å²	43	52.8 Å²	52.8	29%	0.291	30%	0.304	S	S	.	.	H	α-helix	trans	-64.3	-44.9	173	-170.8	0	0	0	0	110.9	I568 D599 D600 E606 I607	I568-C603 HydrophobicContact CD1-CB 4.45Å; D599-C603 WeakPolarHBondContact O-CB 3.17Å; D599-C603 PolarHBondContact O-N 3.3Å; D600-C603 PolarHBondContact O-N 3.34Å; C603-E606 PolarHBondContact O-N 3.02Å; C603-I607 WeakPolarHBondContact O-CD1 3.33Å; C603-I607 VanDerWaalsContact O-CG1 3.22Å; C603-I607 WeakPolarHBondContact O-CG1 3.49Å; C603-I607 PolarHBondContact O-N 2.95Å
604	L	95.1	Very high	90.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-67.6	-38.7	178.5	-73.9	169.1	0	0	0	113	I568 L571 L586 L596 D600 I601 E606 I607 F608 F630	I568-L604 HydrophobicContact CG1-CD2 4.04Å; I568-L604 HydrophobicContact CG1-CG 4.49Å; L571-L604 HydrophobicContact CD1-CD2 3.8Å; L586-L604 HydrophobicContact CD1-CD1 4.02Å; L586-L604 HydrophobicContact CD1-CD2 4.43Å; L586-L604 HydrophobicContact CD2-CD1 4.31Å; L586-L604 HydrophobicContact CD2-CD2 3.71Å; L596-L604 HydrophobicContact CD1-CD1 3.71Å; L596-L604 HydrophobicContact CD2-CD1 4.23Å; D600-L604 WeakPolarHBondContact O-CB 3.27Å; D600-L604 VanDerWaalsContact O-CG 3.26Å; D600-L604 WeakPolarHBondContact O-CG 3.37Å; D600-L604 PolarHBondContact O-N 3.45Å; I601-L604 PolarHBondContact O-N 3.48Å; L604-E606 VanDerWaalsContact C-N 3.32Å; L604-E606 PolarHBondContact O-N 3.5Å; L604-I607 HydrophobicContact CD2-CD1 4.49Å; L604-I607 PolarHBondContact O-N 2.92Å; L604-F608 HydrophobicContact CD2-CE1 4.46Å; L604-F608 VanDerWaalsContact O-CB 3.26Å; L604-F608 WeakPolarHBondContact O-CB 3.42Å; L604-F608 WeakPolarHBondContact O-CD1 3.4Å; L604-F608 WeakPolarHBondContact O-CG 3.22Å; L604-F608 PolarHBondContact O-N 2.88Å; L604-F630 HydrophobicContact CB-CE2 4.14Å; L604-F630 HydrophobicContact CB-CZ 3.95Å; L604-F630 HydrophobicContact CD1-CE2 3.99Å
605	T	94.6	Very high	90.7	Very high	11 Å²	11	51.5 Å²	51.5	7%	0.067	30%	0.295	C	S	.	.	H	α-helix	trans	-64.3	-37.4	173.1	54.4	0	0	0	0	111.6	I601 H602 S609 F630 L638 W641	I601-T605 WeakPolarHBondContact O-CG2 3.34Å; I601-T605 PolarHBondContact O-N 2.88Å; I601-T605 PolarHBondContact O-OG1 3.34Å; H602-T605 WeakPolarHBondContact CA-OG1 3.42Å; H602-T605 PolarHBondContact O-OG1 3.29Å; T605-S609 WeakPolarHBondContact O-CB 3.24Å; T605-S609 PolarHBondContact O-N 3.37Å; T605-S609 PolarHBondContact O-OG 3.24Å; T605-F630 HydrophobicContact CG2-CE1 3.9Å; T605-F630 HydrophobicContact CG2-CZ 4.19Å; T605-L638 HydrophobicContact CG2-CD2 3.42Å; T605-L638 VanDerWaalsContact CG2-CD2 3.42Å; T605-W641 HydrophobicContact CG2-CB 4.19Å; T605-W641 HydrophobicContact CG2-CD2 3.5Å; T605-W641 VanDerWaalsContact CG2-CD2 3.5Å; T605-W641 HydrophobicContact CG2-CE3 3.6Å; T605-W641 HydrophobicContact CG2-CG 3.77Å; T605-W641 HydrophobicContact CG2-CZ2 4.45Å; T605-W641 HydrophobicContact CG2-CZ3 4.11Å; T605-W641 WeakPolarHBondContact O-CZ2 3.42Å
606	E	93.3	Very high	91.5	Very high	83 Å²	83	50.3 Å²	50.3	39%	0.388	28%	0.281	S	S	.	.	H	α-helix	trans	-69.4	-29.4	173.7	-96	-59.3	111.6	0	0	113.8	H602 C603 L604 K610	H602-E606 WeakPolarHBondContact O-CB 3.27Å; H602-E606 PolarHBondContact O-N 3.1Å; H602-E606 VanDerWaalsContact O-N 3.15Å; C603-E606 PolarHBondContact O-N 3.02Å; L604-E606 VanDerWaalsContact C-N 3.32Å; L604-E606 PolarHBondContact O-N 3.5Å; E606-K610 WeakPolarHBondContact O-CG 3.47Å; E606-K610 PolarHBondContact O-NZ 3.47Å; E606-K610 IonicContact OE2-NZ 2.65Å; E606-K610 PolarHBondContact OE2-NZ 3.38Å
607	I	94.9	Very high	91.7	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-75.6	-51.2	173.2	-68.8	161.2	0	0	0	110.2	I568 L571 Q572 C603 L604 S609 K610 M611	I568-I607 HydrophobicContact CB-CD1 4.13Å; I568-I607 HydrophobicContact CG1-CD1 3.96Å; I568-I607 HydrophobicContact CG2-CD1 3.72Å; L571-I607 HydrophobicContact CB-CG2 3.7Å; Q572-I607 HydrophobicContact CG-CD1 4.02Å; Q572-I607 HydrophobicContact CG-CG1 3.86Å; C603-I607 WeakPolarHBondContact O-CD1 3.33Å; C603-I607 VanDerWaalsContact O-CG1 3.22Å; C603-I607 WeakPolarHBondContact O-CG1 3.49Å; C603-I607 PolarHBondContact O-N 2.95Å; L604-I607 HydrophobicContact CD2-CD1 4.49Å; L604-I607 PolarHBondContact O-N 2.92Å; I607-S609 PolarHBondContact O-N 3.33Å; I607-K610 CarbonylContact O-C 3.57Å; I607-K610 WeakPolarHBondContact O-CA 3.44Å; I607-K610 WeakPolarHBondContact O-CB 3.43Å; I607-K610 PolarHBondContact O-N 3.06Å; I607-M611 HydrophobicContact CG2-CG 4.2Å; I607-M611 HydrophobicContact CG2-SD 4.09Å; I607-M611 WeakPolarHBondContact O-CG 3.44Å; I607-M611 PolarHBondContact O-N 2.7Å
608	F	95.8	Very high	92	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-57.1	-38.1	177.2	-70.9	-4.3	0	0	0	111.9	L583 L586 L604 K610 M611 F612 F623 T626 L627 F630 W641	L583-F608 HydrophobicContact CD2-CE1 4.37Å; L586-F608 HydrophobicContact CD2-CE1 3.86Å; L586-F608 HydrophobicContact CD2-CZ 3.56Å; L604-F608 HydrophobicContact CD2-CE1 4.46Å; L604-F608 VanDerWaalsContact O-CB 3.26Å; L604-F608 WeakPolarHBondContact O-CB 3.42Å; L604-F608 WeakPolarHBondContact O-CD1 3.4Å; L604-F608 WeakPolarHBondContact O-CG 3.22Å; L604-F608 PolarHBondContact O-N 2.88Å; F608-K610 PolarHBondContact O-N 3.5Å; F608-K610 VanDerWaalsContact O-N 3.17Å; F608-M611 HydrophobicContact CD1-SD 3.96Å; F608-M611 HydrophobicContact CE1-SD 4.35Å; F608-M611 PolarHBondContact O-N 3.08Å; F608-F612 WeakPolarHBondContact O-CD2 3.29Å; F608-F612 PolarHBondContact O-N 3.37Å; F608-F623 HydrophobicContact CB-CE2 3.7Å; F608-F623 HydrophobicContact CB-CZ 3.94Å; F608-F623 HydrophobicContact CD1-CD2 4.2Å; F608-F623 AromaticContact CD1-CE2 3.64Å; F608-F623 HydrophobicContact CD1-CE2 3.64Å; F608-F623 HydrophobicContact CD2-CE2 4.11Å; F608-F623 HydrophobicContact CE1-CD2 4.43Å; F608-F623 HydrophobicContact CE1-CE2 4.22Å; F608-F623 AromaticContact CG-CE2 3.56Å; F608-F623 HydrophobicContact CG-CE2 3.56Å; F608-F623 HydrophobicContact CG-CZ 4.31Å; F608-T626 HydrophobicContact CZ-CG2 4.08Å; F608-L627 HydrophobicContact CD2-CD1 4.07Å; F608-L627 HydrophobicContact CE2-CD1 4.43Å; F608-F630 AromaticContact CD2-CD1 3.96Å; F608-F630 HydrophobicContact CD2-CD1 3.96Å; F608-F630 HydrophobicContact CD2-CE1 4.02Å; F608-F630 HydrophobicContact CE2-CB 4.04Å; F608-F630 AromaticContact CE2-CD1 3.55Å; F608-F630 HydrophobicContact CE2-CD1 3.55Å; F608-F630 HydrophobicContact CE2-CD2 4.21Å; F608-F630 AromaticContact CE2-CE1 3.89Å; F608-F630 HydrophobicContact CE2-CE1 3.89Å; F608-F630 AromaticContact CE2-CG 3.71Å; F608-F630 HydrophobicContact CE2-CG 3.71Å; F608-F630 HydrophobicContact CE2-CZ 4.36Å; F608-W641 HydrophobicContact CB-CH2 3.74Å; F608-W641 HydrophobicContact CB-CZ2 3.84Å; F608-W641 HydrophobicContact CD2-CH2 4.02Å; F608-W641 HydrophobicContact CG-CH2 4.43Å
609	S	93	Very high	92.4	Very high	6 Å²	6	50.1 Å²	50.1	4%	0.042	27%	0.273	C	S	.	.	H	α-helix	trans	-52.9	-30.6	170.3	-74.8	0	0	0	0	114.3	T605 I607 W641 R648	T605-S609 WeakPolarHBondContact O-CB 3.24Å; T605-S609 PolarHBondContact O-N 3.37Å; T605-S609 PolarHBondContact O-OG 3.24Å; I607-S609 PolarHBondContact O-N 3.33Å; S609-W641 PolarHBondContact OG-NE1 2.97Å; S609-R648 PolarHBondContact O-NE 3.06Å; S609-R648 VanDerWaalsContact O-NE 3.08Å; S609-R648 PolarHBondContact OG-NH1 3.45Å
610	K	92.1	Very high	92.6	Very high	129 Å²	129	44 Å²	44	56%	0.561	24%	0.24	S	C	*	.	H	α-helix	trans	-89.9	-37	175.1	-58.6	170.9	-176.2	88.4	0	111	E606 I607 F608 F612 A613	E606-K610 WeakPolarHBondContact O-CG 3.47Å; E606-K610 PolarHBondContact O-NZ 3.47Å; E606-K610 IonicContact OE2-NZ 2.65Å; E606-K610 PolarHBondContact OE2-NZ 3.38Å; I607-K610 CarbonylContact O-C 3.57Å; I607-K610 WeakPolarHBondContact O-CA 3.44Å; I607-K610 WeakPolarHBondContact O-CB 3.43Å; I607-K610 PolarHBondContact O-N 3.06Å; F608-K610 PolarHBondContact O-N 3.5Å; F608-K610 VanDerWaalsContact O-N 3.17Å; K610-F612 PolarHBondContact O-N 3.5Å; K610-A613 WeakPolarHBondContact O-CB 3.48Å; K610-A613 PolarHBondContact O-N 2.85Å
611	M	93.8	Very high	92.6	Very high	7 Å²	7	44.6 Å²	44.6	3%	0.034	25%	0.247	C	C	.	.	H	α-helix	trans	-62.9	-24.1	176.9	-59.3	-169.5	88.6	0	0	114.1	L571 R579 L583 I607 F608 A613 D614 V619 F623	L571-M611 HydrophobicContact CD2-CE 3.78Å; L571-M611 HydrophobicContact CD2-SD 3.76Å; R579-M611 HydrophobicContact CB-CE 4.09Å; L583-M611 HydrophobicContact CD1-CE 3.78Å; L583-M611 HydrophobicContact CD2-CE 4.02Å; L583-M611 HydrophobicContact CD2-SD 4.11Å; L583-M611 HydrophobicContact CG-CE 3.87Å; I607-M611 HydrophobicContact CG2-CG 4.2Å; I607-M611 HydrophobicContact CG2-SD 4.09Å; I607-M611 WeakPolarHBondContact O-CG 3.44Å; I607-M611 PolarHBondContact O-N 2.7Å; F608-M611 HydrophobicContact CD1-SD 3.96Å; F608-M611 HydrophobicContact CE1-SD 4.35Å; F608-M611 PolarHBondContact O-N 3.08Å; M611-A613 PolarHBondContact O-N 2.93Å; M611-A613 VanDerWaalsContact O-N 3.13Å; M611-D614 VanDerWaalsContact O-CB 3.25Å; M611-D614 WeakPolarHBondContact O-CB 3.5Å; M611-D614 PolarHBondContact O-N 3.46Å; M611-V619 HydrophobicContact CE-CG1 3.6Å; M611-F623 HydrophobicContact CB-CD1 4.21Å; M611-F623 HydrophobicContact CB-CD2 4.17Å; M611-F623 HydrophobicContact CB-CE1 4.11Å; M611-F623 HydrophobicContact CB-CE2 4.09Å; M611-F623 HydrophobicContact CB-CG 4.25Å; M611-F623 HydrophobicContact CB-CZ 4.05Å; M611-F623 HydrophobicContact SD-CD2 4.18Å
612	F	92.5	Very high	92.6	Very high	14 Å²	14	45.9 Å²	45.9	6%	0.061	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-24.9	168.4	-82.7	-70.3	0	0	0	114	F608 K610 F623 M624 L627 W641 L645 R648 L649 R652	F608-F612 WeakPolarHBondContact O-CD2 3.29Å; F608-F612 PolarHBondContact O-N 3.37Å; K610-F612 PolarHBondContact O-N 3.5Å; F612-F623 AromaticContact CD1-CE1 3.87Å; F612-F623 HydrophobicContact CD1-CE1 3.87Å; F612-F623 HydrophobicContact CD1-CZ 4.42Å; F612-F623 HydrophobicContact CD2-CE1 4.18Å; F612-F623 AromaticContact CD2-CZ 4Å; F612-F623 HydrophobicContact CD2-CZ 4Å; F612-F623 AromaticContact CE1-CE1 3.94Å; F612-F623 HydrophobicContact CE1-CE1 3.94Å; F612-F623 HydrophobicContact CE1-CZ 4.29Å; F612-F623 HydrophobicContact CE2-CE1 4.27Å; F612-F623 AromaticContact CE2-CZ 3.87Å; F612-F623 HydrophobicContact CE2-CZ 3.87Å; F612-F623 AromaticContact CG-CE1 3.98Å; F612-F623 HydrophobicContact CG-CE1 3.98Å; F612-F623 HydrophobicContact CG-CZ 4.28Å; F612-F623 HydrophobicContact CZ-CE1 4.15Å; F612-F623 HydrophobicContact CZ-CZ 4.01Å; F612-M624 HydrophobicContact CD1-CE 4.37Å; F612-M624 HydrophobicContact CE1-CE 4.15Å; F612-L627 HydrophobicContact CE1-CD2 4.12Å; F612-L627 HydrophobicContact CE2-CD2 4.36Å; F612-L627 HydrophobicContact CZ-CD2 3.53Å; F612-W641 HydrophobicContact CE2-CH2 4.25Å; F612-W641 HydrophobicContact CE2-CZ2 4.17Å; F612-L645 HydrophobicContact CE2-CD1 4.14Å; F612-L645 HydrophobicContact CZ-CD1 3.76Å; F612-R648 HydrophobicContact CB-CB 4.21Å; F612-R648 HydrophobicContact CD1-CB 4.09Å; F612-R648 HydrophobicContact CD2-CB 3.62Å; F612-R648 HydrophobicContact CD2-CG 4.27Å; F612-R648 HydrophobicContact CE1-CB 4.38Å; F612-R648 HydrophobicContact CE2-CB 3.93Å; F612-R648 HydrophobicContact CG-CB 3.71Å; F612-R648 HydrophobicContact CG-CG 4.49Å; F612-R648 HydrophobicContact CZ-CB 4.3Å; F612-L649 HydrophobicContact CE1-CD2 3.7Å; F612-L649 HydrophobicContact CE1-CG 3.75Å; F612-L649 HydrophobicContact CZ-CD2 4.15Å; F612-L649 HydrophobicContact CZ-CG 3.88Å; F612-R652 HydrophobicContact CD1-CB 4.36Å; F612-R652 PolarHBondContact O-NH1 3.28Å
613	A	91	Very high	92.8	Very high	86 Å²	86	39.9 Å²	39.9	71%	0.711	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.2	4	175.9	0	0	0	0	0	114	K610 M611 S615	K610-A613 WeakPolarHBondContact O-CB 3.48Å; K610-A613 PolarHBondContact O-N 2.85Å; M611-A613 PolarHBondContact O-N 2.93Å; M611-A613 VanDerWaalsContact O-N 3.13Å; A613-S615 PolarHBondContact O-N 3.11Å
614	D	91.3	Very high	92.9	Very high	13 Å²	13	37.9 Å²	37.9	7%	0.07	21%	0.212	C	C	.	.			trans	-66.2	134.2	-176.9	-159.5	-29.2	0	0	0	111.9	R579 M611 Q616 V619 V620 R652	R579-D614 IonicContact CZ-OD2 3.76Å; R579-D614 IonicContact NE-OD2 2.75Å; R579-D614 PolarHBondContact NE-OD2 2.82Å; R579-D614 VanDerWaalsContact NH2-CG 3.26Å; R579-D614 IonicContact NH2-OD1 2.77Å; R579-D614 PolarHBondContact NH2-OD1 3.15Å; R579-D614 IonicContact NH2-OD2 3.86Å; R579-D614 PolarHBondContact NH2-OD2 2.83Å; M611-D614 VanDerWaalsContact O-CB 3.25Å; M611-D614 WeakPolarHBondContact O-CB 3.5Å; M611-D614 PolarHBondContact O-N 3.46Å; D614-Q616 WeakPolarHBondContact OD1-CB 3.36Å; D614-Q616 PolarHBondContact OD1-N 2.92Å; D614-V619 WeakPolarHBondContact OD2-CG1 3.38Å; D614-V620 HydrophobicContact CB-CG2 4.09Å; D614-V620 WeakPolarHBondContact O-CG2 3.5Å; D614-R652 PolarHBondContact O-NH1 3.33Å; D614-R652 PolarHBondContact O-NH2 3.35Å; D614-R652 VanDerWaalsContact O-NH2 3.13Å
615	S	89.4	Confident	92.8	Very high	100 Å²	100	41.8 Å²	41.8	70%	0.699	23%	0.233	S	C	*	.			trans	-83.8	-12.7	179	55.6	0	0	0	0	113.5	A613	A613-S615 PolarHBondContact O-N 3.11Å
616	Q	92.6	Very high	92.8	Very high	76 Å²	76	41.3 Å²	41.3	36%	0.355	23%	0.23	S	C	.	.			trans	-99.1	106.7	-165.3	-69.7	-80.3	4.2	0	0	112.5	W576 D614 K618 V619 V620	W576-Q616 HydrophobicContact CB-CB 3.78Å; W576-Q616 HydrophobicContact CB-CG 3.54Å; W576-Q616 HydrophobicContact CG-CB 4.32Å; W576-Q616 HydrophobicContact CG-CG 3.97Å; D614-Q616 WeakPolarHBondContact OD1-CB 3.36Å; D614-Q616 PolarHBondContact OD1-N 2.92Å; Q616-K618 VanDerWaalsContact C-N 3.26Å; Q616-K618 PolarHBondContact O-N 2.96Å; Q616-V619 HydrophobicContact CB-CB 4.39Å; Q616-V619 HydrophobicContact CB-CG2 3.89Å; Q616-V619 WeakPolarHBondContact O-CA 3.48Å; Q616-V619 WeakPolarHBondContact O-CB 3.35Å; Q616-V619 PolarHBondContact O-N 3.11Å; Q616-V620 PolarHBondContact O-N 3.29Å
617	S	89.8	Confident	93	Very high	50 Å²	50	37.3 Å²	37.3	35%	0.35	21%	0.211	S	C	.	.	H	α-helix	trans	-56.4	-31.9	-168.9	-51.4	0	0	0	0	115.7	V620 S621 L658 H661	S617-V620 PolarHBondContact O-N 2.97Å; S617-S621 WeakPolarHBondContact O-CB 3.31Å; S617-S621 PolarHBondContact O-N 3.39Å; S617-S621 PolarHBondContact O-OG 2.93Å; S617-L658 WeakPolarHBondContact OG-CD1 3.11Å; S617-H661 VanDerWaalsContact CA-CE1 3.47Å; S617-H661 WeakPolarHBondContact CA-CE1 3.41Å; S617-H661 VanDerWaalsContact CB-CE1 3.43Å; S617-H661 WeakPolarHBondContact CB-CE1 3.49Å; S617-H661 WeakPolarHBondContact CB-NE2 3.16Å; S617-H661 PolarHBondContact O-NE2 3.44Å
618	K	91	Very high	93	Very high	135 Å²	135	38.2 Å²	38.2	59%	0.587	22%	0.215	S	C	*	.	H	α-helix	trans	-67.6	-37.4	175.3	-68.9	177	178.4	176.3	0	112.1	W576 Q616 L622	W576-K618 HydrophobicContact CE3-CB 4.32Å; W576-K618 HydrophobicContact CE3-CD 4.47Å; W576-K618 HydrophobicContact CH2-CD 3.82Å; W576-K618 HydrophobicContact CZ3-CB 4.03Å; W576-K618 HydrophobicContact CZ3-CD 3.56Å; W576-K618 HydrophobicContact CZ3-CG 4.41Å; Q616-K618 VanDerWaalsContact C-N 3.26Å; Q616-K618 PolarHBondContact O-N 2.96Å; K618-L622 WeakPolarHBondContact O-CB 3.34Å; K618-L622 PolarHBondContact O-N 2.85Å
619	V	94.4	Very high	92.8	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-71.3	-47	174.2	-168.6	0	0	0	0	109.5	W576 R579 K580 L583 M611 D614 Q616 S621 L622 F623	W576-V619 HydrophobicContact CB-CG2 3.91Å; W576-V619 HydrophobicContact CE3-CG2 4.34Å; W576-V619 VanDerWaalsContact O-CG2 3.22Å; W576-V619 WeakPolarHBondContact O-CG2 3.49Å; R579-V619 HydrophobicContact CB-CG1 3.79Å; R579-V619 HydrophobicContact CB-CG2 4.31Å; K580-V619 HydrophobicContact CB-CG2 4.28Å; L583-V619 HydrophobicContact CD1-CG1 3.6Å; L583-V619 WeakPolarHBondContact CD1-O 3.38Å; M611-V619 HydrophobicContact CE-CG1 3.6Å; D614-V619 WeakPolarHBondContact OD2-CG1 3.38Å; Q616-V619 HydrophobicContact CB-CB 4.39Å; Q616-V619 HydrophobicContact CB-CG2 3.89Å; Q616-V619 WeakPolarHBondContact O-CA 3.48Å; Q616-V619 WeakPolarHBondContact O-CB 3.35Å; Q616-V619 PolarHBondContact O-N 3.11Å; V619-S621 PolarHBondContact O-N 3.43Å; V619-L622 PolarHBondContact O-N 3.31Å; V619-F623 WeakPolarHBondContact O-CB 3.32Å; V619-F623 PolarHBondContact O-N 2.92Å
620	V	92.3	Very high	92.9	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-61.4	-43.4	-178.8	177	0	0	0	0	112.4	D614 Q616 S617 F623 M624	D614-V620 HydrophobicContact CB-CG2 4.09Å; D614-V620 WeakPolarHBondContact O-CG2 3.5Å; Q616-V620 PolarHBondContact O-N 3.29Å; S617-V620 PolarHBondContact O-N 2.97Å; V620-F623 PolarHBondContact O-N 3.32Å; V620-M624 HydrophobicContact CG1-CE 4.48Å; V620-M624 WeakPolarHBondContact O-CG 3.36Å; V620-M624 PolarHBondContact O-N 3.08Å; V620-M624 VanDerWaalsContact O-N 3.13Å
621	S	90.3	Very high	93	Very high	43 Å²	43	34.3 Å²	34.3	30%	0.301	20%	0.198	S	C	.	.	H	α-helix	trans	-60.1	-52.8	176.9	-62.9	0	0	0	0	111	S617 V619 F623 M624 D625 H661	S617-S621 WeakPolarHBondContact O-CB 3.31Å; S617-S621 PolarHBondContact O-N 3.39Å; S617-S621 PolarHBondContact O-OG 2.93Å; V619-S621 PolarHBondContact O-N 3.43Å; S621-F623 VanDerWaalsContact C-N 3.29Å; S621-F623 PolarHBondContact O-N 3.17Å; S621-M624 PolarHBondContact O-N 2.78Å; S621-D625 PolarHBondContact O-N 2.74Å; S621-H661 PolarHBondContact OG-CD2 3.42Å; S621-H661 VanDerWaalsContact OG-CD2 3.23Å; S621-H661 PolarHBondContact OG-NE2 3.16Å; S621-H661 VanDerWaalsContact OG-NE2 3.16Å
622	L	93.2	Very high	93	Very high	33 Å²	33	38.3 Å²	38.3	17%	0.173	22%	0.215	C	C	.	.	H	α-helix	trans	-66.6	-32.1	-179.9	-173.9	65.1	0	0	0	112.2	K580 L583 T584 K618 V619 D625 T626	K580-L622 HydrophobicContact CG-CD2 3.95Å; K580-L622 WeakPolarHBondContact O-CD2 3.24Å; L583-L622 HydrophobicContact CB-CD2 3.61Å; L583-L622 HydrophobicContact CB-CG 3.86Å; L583-L622 HydrophobicContact CD1-CB 4.18Å; L583-L622 HydrophobicContact CD1-CD2 4.36Å; L583-L622 HydrophobicContact CD1-CG 4.28Å; T584-L622 VanDerWaalsContact OG1-CD2 3.31Å; T584-L622 WeakPolarHBondContact OG1-CD2 3.44Å; K618-L622 WeakPolarHBondContact O-CB 3.34Å; K618-L622 PolarHBondContact O-N 2.85Å; V619-L622 PolarHBondContact O-N 3.31Å; L622-D625 PolarHBondContact O-N 3.15Å; L622-T626 PolarHBondContact O-N 2.81Å; L622-T626 PolarHBondContact O-OG1 3.43Å
623	F	95.9	Very high	92.9	Very high	1 Å²	1	42.5 Å²	42.5	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-62.7	-42.6	176.3	169.8	-127	0	0	0	111.3	L583 F608 M611 F612 V619 V620 S621 D625 T626 L627	L583-F623 HydrophobicContact CD1-CB 3.81Å; L583-F623 HydrophobicContact CD2-CB 4.27Å; L583-F623 HydrophobicContact CD2-CD2 4.15Å; F608-F623 HydrophobicContact CB-CE2 3.7Å; F608-F623 HydrophobicContact CB-CZ 3.94Å; F608-F623 HydrophobicContact CD1-CD2 4.2Å; F608-F623 AromaticContact CD1-CE2 3.64Å; F608-F623 HydrophobicContact CD1-CE2 3.64Å; F608-F623 HydrophobicContact CD2-CE2 4.11Å; F608-F623 HydrophobicContact CE1-CD2 4.43Å; F608-F623 HydrophobicContact CE1-CE2 4.22Å; F608-F623 AromaticContact CG-CE2 3.56Å; F608-F623 HydrophobicContact CG-CE2 3.56Å; F608-F623 HydrophobicContact CG-CZ 4.31Å; M611-F623 HydrophobicContact CB-CD1 4.21Å; M611-F623 HydrophobicContact CB-CD2 4.17Å; M611-F623 HydrophobicContact CB-CE1 4.11Å; M611-F623 HydrophobicContact CB-CE2 4.09Å; M611-F623 HydrophobicContact CB-CG 4.25Å; M611-F623 HydrophobicContact CB-CZ 4.05Å; M611-F623 HydrophobicContact SD-CD2 4.18Å; F612-F623 AromaticContact CD1-CE1 3.87Å; F612-F623 HydrophobicContact CD1-CE1 3.87Å; F612-F623 HydrophobicContact CD1-CZ 4.42Å; F612-F623 HydrophobicContact CD2-CE1 4.18Å; F612-F623 AromaticContact CD2-CZ 4Å; F612-F623 HydrophobicContact CD2-CZ 4Å; F612-F623 AromaticContact CE1-CE1 3.94Å; F612-F623 HydrophobicContact CE1-CE1 3.94Å; F612-F623 HydrophobicContact CE1-CZ 4.29Å; F612-F623 HydrophobicContact CE2-CE1 4.27Å; F612-F623 AromaticContact CE2-CZ 3.87Å; F612-F623 HydrophobicContact CE2-CZ 3.87Å; F612-F623 AromaticContact CG-CE1 3.98Å; F612-F623 HydrophobicContact CG-CE1 3.98Å; F612-F623 HydrophobicContact CG-CZ 4.28Å; F612-F623 HydrophobicContact CZ-CE1 4.15Å; F612-F623 HydrophobicContact CZ-CZ 4.01Å; V619-F623 WeakPolarHBondContact O-CB 3.32Å; V619-F623 PolarHBondContact O-N 2.92Å; V620-F623 PolarHBondContact O-N 3.32Å; S621-F623 VanDerWaalsContact C-N 3.29Å; S621-F623 PolarHBondContact O-N 3.17Å; F623-D625 VanDerWaalsContact C-N 3.32Å; F623-D625 PolarHBondContact O-N 3.06Å; F623-T626 PolarHBondContact O-N 2.86Å; F623-L627 HydrophobicContact CD2-CB 4.48Å; F623-L627 HydrophobicContact CE1-CD2 4.42Å; F623-L627 HydrophobicContact CE2-CB 4.21Å; F623-L627 HydrophobicContact CE2-CD2 4.38Å; F623-L627 HydrophobicContact CZ-CD2 4Å; F623-L627 WeakPolarHBondContact O-CB 3.43Å; F623-L627 PolarHBondContact O-N 3.29Å
624	M	94.6	Very high	92.9	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-64.6	-36	176.3	-64.5	-66.4	160.6	0	0	112	F612 V620 S621 Q628 L649 R652 A664 I665	F612-M624 HydrophobicContact CD1-CE 4.37Å; F612-M624 HydrophobicContact CE1-CE 4.15Å; V620-M624 HydrophobicContact CG1-CE 4.48Å; V620-M624 WeakPolarHBondContact O-CG 3.36Å; V620-M624 PolarHBondContact O-N 3.08Å; V620-M624 VanDerWaalsContact O-N 3.13Å; S621-M624 PolarHBondContact O-N 2.78Å; M624-Q628 WeakPolarHBondContact O-CB 3.35Å; M624-Q628 VanDerWaalsContact O-CG 3.29Å; M624-Q628 WeakPolarHBondContact O-CG 3.49Å; M624-Q628 PolarHBondContact O-N 2.79Å; M624-Q628 PolarHBondContact O-NE2 2.7Å; M624-L649 HydrophobicContact SD-CD2 4.14Å; M624-R652 HydrophobicContact CE-CG 4.37Å; M624-A664 HydrophobicContact CB-CB 3.77Å; M624-A664 HydrophobicContact CG-CB 4.1Å; M624-I665 HydrophobicContact CE-CD1 4.23Å; M624-I665 HydrophobicContact CE-CG1 3.64Å; M624-I665 HydrophobicContact CG-CG1 4.34Å; M624-I665 HydrophobicContact SD-CG1 3.72Å
625	D	93.4	Very high	92.8	Very high	83 Å²	83	41 Å²	41	44%	0.444	21%	0.213	S	C	.	.	H	α-helix	trans	-68.9	-43.3	174.3	-67.5	-23.6	0	0	0	112	S621 L622 F623 Q628 F629	S621-D625 PolarHBondContact O-N 2.74Å; L622-D625 PolarHBondContact O-N 3.15Å; F623-D625 VanDerWaalsContact C-N 3.32Å; F623-D625 PolarHBondContact O-N 3.06Å; D625-Q628 PolarHBondContact O-N 2.73Å; D625-F629 PolarHBondContact O-N 3.06Å; D625-F629 VanDerWaalsContact O-N 3.13Å
626	T	95.1	Very high	92.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-42	176.1	-54.6	0	0	0	0	111.4	L583 L586 Q587 M590 F608 L622 F623 F629 F630	L583-T626 HydrophobicContact CD2-CG2 4.04Å; L586-T626 HydrophobicContact CB-CG2 4.34Å; L586-T626 HydrophobicContact CD2-CG2 3.89Å; L586-T626 HydrophobicContact CG-CG2 4.1Å; Q587-T626 HydrophobicContact CG-CG2 3.95Å; Q587-T626 WeakPolarHBondContact CG-OG1 3.47Å; Q587-T626 PolarHBondContact NE2-OG1 2.66Å; M590-T626 HydrophobicContact CE-CG2 3.81Å; F608-T626 HydrophobicContact CZ-CG2 4.08Å; L622-T626 PolarHBondContact O-N 2.81Å; L622-T626 PolarHBondContact O-OG1 3.43Å; F623-T626 PolarHBondContact O-N 2.86Å; T626-F629 WeakPolarHBondContact O-CB 3.21Å; T626-F629 PolarHBondContact O-N 2.84Å; T626-F630 WeakPolarHBondContact O-CB 3.44Å; T626-F630 PolarHBondContact O-N 3.22Å
627	L	96.1	Very high	92.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.5	-40	177.7	177.9	60.7	0	0	0	111.5	F608 F612 F623 F629 F630 I631 W641 L645 L649 T668	F608-L627 HydrophobicContact CD2-CD1 4.07Å; F608-L627 HydrophobicContact CE2-CD1 4.43Å; F612-L627 HydrophobicContact CE1-CD2 4.12Å; F612-L627 HydrophobicContact CE2-CD2 4.36Å; F612-L627 HydrophobicContact CZ-CD2 3.53Å; F623-L627 HydrophobicContact CD2-CB 4.48Å; F623-L627 HydrophobicContact CE1-CD2 4.42Å; F623-L627 HydrophobicContact CE2-CB 4.21Å; F623-L627 HydrophobicContact CE2-CD2 4.38Å; F623-L627 HydrophobicContact CZ-CD2 4Å; F623-L627 WeakPolarHBondContact O-CB 3.43Å; F623-L627 PolarHBondContact O-N 3.29Å; L627-F629 VanDerWaalsContact C-N 3.3Å; L627-F629 PolarHBondContact O-N 3.12Å; L627-F630 PolarHBondContact O-N 2.74Å; L627-I631 HydrophobicContact CD1-CD1 3.92Å; L627-I631 HydrophobicContact CD1-CG1 4.09Å; L627-I631 HydrophobicContact CG-CD1 3.87Å; L627-I631 HydrophobicContact CG-CG1 4.47Å; L627-I631 WeakPolarHBondContact O-CB 3.41Å; L627-I631 WeakPolarHBondContact O-CD1 3.24Å; L627-I631 VanDerWaalsContact O-CG1 3.24Å; L627-I631 WeakPolarHBondContact O-CG1 3.44Å; L627-I631 PolarHBondContact O-N 2.91Å; L627-W641 HydrophobicContact CD1-CH2 3.81Å; L627-W641 HydrophobicContact CD1-CZ3 3.83Å; L627-L645 HydrophobicContact CD1-CD1 4.07Å; L627-L645 HydrophobicContact CD2-CD1 4.06Å; L627-L649 HydrophobicContact CD2-CD2 4.47Å; L627-T668 HydrophobicContact CD2-CG2 3.82Å; L627-T668 HydrophobicContact CG-CG2 4.02Å
628	Q	94.7	Very high	92.7	Very high	23 Å²	23	38.5 Å²	38.5	11%	0.107	19%	0.194	C	C	.	.	H	α-helix	trans	-61.1	-37.6	171.6	-80.5	177.2	79.7	0	0	112.7	M624 D625 K632 T668 V671	M624-Q628 WeakPolarHBondContact O-CB 3.35Å; M624-Q628 VanDerWaalsContact O-CG 3.29Å; M624-Q628 WeakPolarHBondContact O-CG 3.49Å; M624-Q628 PolarHBondContact O-N 2.79Å; M624-Q628 PolarHBondContact O-NE2 2.7Å; D625-Q628 PolarHBondContact O-N 2.73Å; Q628-K632 VanDerWaalsContact O-CD 3.24Å; Q628-K632 WeakPolarHBondContact O-CD 3.2Å; Q628-K632 WeakPolarHBondContact O-CG 3.11Å; Q628-K632 PolarHBondContact O-N 2.94Å; Q628-T668 HydrophobicContact CG-CG2 4.21Å; Q628-T668 WeakPolarHBondContact CG-OG1 3.44Å; Q628-V671 HydrophobicContact CB-CG2 4.48Å; Q628-V671 HydrophobicContact CG-CB 4.34Å; Q628-V671 HydrophobicContact CG-CG2 4.05Å
629	F	92.8	Very high	92.7	Very high	53 Å²	53	39.5 Å²	39.5	23%	0.232	19%	0.194	C	C	.	.	H	α-helix	trans	-67.6	-49.8	174.3	-165.6	-72.6	0	0	0	111	M590 R591 D625 T626 L627 I631 K632 E633	M590-F629 HydrophobicContact CB-CD1 3.86Å; M590-F629 HydrophobicContact CB-CE1 3.55Å; M590-F629 HydrophobicContact CB-CZ 4.37Å; M590-F629 HydrophobicContact CE-CB 4.08Å; M590-F629 HydrophobicContact CE-CD1 3.64Å; M590-F629 HydrophobicContact CE-CE1 4.47Å; M590-F629 HydrophobicContact CE-CG 4.08Å; M590-F629 HydrophobicContact SD-CD1 4Å; R591-F629 HydrophobicContact CG-CE2 3.83Å; R591-F629 HydrophobicContact CG-CZ 4.03Å; D625-F629 PolarHBondContact O-N 3.06Å; D625-F629 VanDerWaalsContact O-N 3.13Å; T626-F629 WeakPolarHBondContact O-CB 3.21Å; T626-F629 PolarHBondContact O-N 2.84Å; L627-F629 VanDerWaalsContact C-N 3.3Å; L627-F629 PolarHBondContact O-N 3.12Å; F629-I631 VanDerWaalsContact C-N 3.34Å; F629-I631 PolarHBondContact O-N 3.22Å; F629-K632 WeakPolarHBondContact O-CB 3.3Å; F629-K632 PolarHBondContact O-N 2.98Å; F629-E633 HydrophobicContact CE1-CB 4.39Å; F629-E633 PolarHBondContact O-N 2.64Å
630	F	94.2	Very high	92.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.5	-39.2	-178.7	-175.5	-107.2	0	0	0	112.8	M590 L596 I601 L604 T605 F608 T626 L627 Y634 L638 W641	M590-F630 HydrophobicContact SD-CB 4.22Å; M590-F630 HydrophobicContact SD-CD2 3.93Å; L596-F630 HydrophobicContact CD1-CD2 4.2Å; L596-F630 HydrophobicContact CD1-CE2 3.86Å; I601-F630 HydrophobicContact CB-CZ 4.47Å; I601-F630 HydrophobicContact CG1-CE2 4.39Å; I601-F630 HydrophobicContact CG2-CZ 3.93Å; L604-F630 HydrophobicContact CB-CE2 4.14Å; L604-F630 HydrophobicContact CB-CZ 3.95Å; L604-F630 HydrophobicContact CD1-CE2 3.99Å; T605-F630 HydrophobicContact CG2-CE1 3.9Å; T605-F630 HydrophobicContact CG2-CZ 4.19Å; F608-F630 AromaticContact CD2-CD1 3.96Å; F608-F630 HydrophobicContact CD2-CD1 3.96Å; F608-F630 HydrophobicContact CD2-CE1 4.02Å; F608-F630 HydrophobicContact CE2-CB 4.04Å; F608-F630 AromaticContact CE2-CD1 3.55Å; F608-F630 HydrophobicContact CE2-CD1 3.55Å; F608-F630 HydrophobicContact CE2-CD2 4.21Å; F608-F630 AromaticContact CE2-CE1 3.89Å; F608-F630 HydrophobicContact CE2-CE1 3.89Å; F608-F630 AromaticContact CE2-CG 3.71Å; F608-F630 HydrophobicContact CE2-CG 3.71Å; F608-F630 HydrophobicContact CE2-CZ 4.36Å; T626-F630 WeakPolarHBondContact O-CB 3.44Å; T626-F630 PolarHBondContact O-N 3.22Å; L627-F630 PolarHBondContact O-N 2.74Å; F630-Y634 AromaticContact CD2-CD2 3.52Å; F630-Y634 HydrophobicContact CD2-CD2 3.52Å; F630-Y634 HydrophobicContact CD2-CE2 4.01Å; F630-Y634 AromaticContact CE2-CD2 3.91Å; F630-Y634 HydrophobicContact CE2-CD2 3.91Å; F630-Y634 HydrophobicContact CE2-CE2 4.46Å; F630-Y634 HydrophobicContact CG-CD2 4.2Å; F630-Y634 WeakPolarHBondContact O-CB 3.19Å; F630-Y634 WeakPolarHBondContact O-CD2 3.42Å; F630-Y634 PolarHBondContact O-N 2.9Å; F630-L638 HydrophobicContact CD1-CD1 3.82Å; F630-L638 HydrophobicContact CD1-CD2 4.32Å; F630-L638 HydrophobicContact CE1-CD1 3.88Å; F630-L638 HydrophobicContact CE1-CD2 3.52Å; F630-L638 HydrophobicContact CE1-CG 4.33Å; F630-L638 HydrophobicContact CZ-CD2 3.99Å; F630-W641 HydrophobicContact CE1-CZ3 4.4Å
631	I	95	Very high	92.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.4	-45.1	172	-67.8	163.4	0	0	0	110.9	L627 F629 E633 N635 L645 T668 V671 H675 F676	L627-I631 HydrophobicContact CD1-CD1 3.92Å; L627-I631 HydrophobicContact CD1-CG1 4.09Å; L627-I631 HydrophobicContact CG-CD1 3.87Å; L627-I631 HydrophobicContact CG-CG1 4.47Å; L627-I631 WeakPolarHBondContact O-CB 3.41Å; L627-I631 WeakPolarHBondContact O-CD1 3.24Å; L627-I631 VanDerWaalsContact O-CG1 3.24Å; L627-I631 WeakPolarHBondContact O-CG1 3.44Å; L627-I631 PolarHBondContact O-N 2.91Å; F629-I631 VanDerWaalsContact C-N 3.34Å; F629-I631 PolarHBondContact O-N 3.22Å; I631-E633 PolarHBondContact O-N 3.2Å; I631-N635 VanDerWaalsContact O-CB 3.24Å; I631-N635 WeakPolarHBondContact O-CB 3.17Å; I631-N635 PolarHBondContact O-N 2.83Å; I631-N635 VanDerWaalsContact O-N 3.14Å; I631-L645 HydrophobicContact CD1-CD1 4.44Å; I631-L645 HydrophobicContact CD1-CD2 3.86Å; I631-L645 HydrophobicContact CG1-CD2 4.08Å; I631-T668 HydrophobicContact CD1-CG2 4.03Å; I631-V671 HydrophobicContact CB-CG1 4.16Å; I631-V671 HydrophobicContact CG2-CG1 3.85Å; I631-H675 HydrophobicContact CG2-CB 4.07Å; I631-F676 HydrophobicContact CG2-CD2 4.44Å; I631-F676 HydrophobicContact CG2-CE2 3.77Å
632	K	93.3	Very high	92.7	Very high	91 Å²	91	45.9 Å²	45.9	40%	0.396	22%	0.223	S	C	.	.	H	α-helix	trans	-57.5	-49.5	-178.8	-77.3	162.6	-173.1	166.8	0	111.4	Q628 F629 N635 V671	Q628-K632 VanDerWaalsContact O-CD 3.24Å; Q628-K632 WeakPolarHBondContact O-CD 3.2Å; Q628-K632 WeakPolarHBondContact O-CG 3.11Å; Q628-K632 PolarHBondContact O-N 2.94Å; F629-K632 WeakPolarHBondContact O-CB 3.3Å; F629-K632 PolarHBondContact O-N 2.98Å; K632-N635 PolarHBondContact O-ND2 3.11Å; K632-V671 HydrophobicContact CD-CG1 4.4Å; K632-V671 HydrophobicContact CG-CG1 3.85Å
633	E	89.9	Confident	92.8	Very high	102 Å²	102	46.8 Å²	46.8	48%	0.477	22%	0.224	S	C	.	.	H	α-helix	trans	-76.3	-49.4	-174.8	-157	63.3	-156.5	0	0	112.5	F629 I631	F629-E633 HydrophobicContact CE1-CB 4.39Å; F629-E633 PolarHBondContact O-N 2.64Å; I631-E633 PolarHBondContact O-N 3.2Å
634	Y	90.9	Very high	92.7	Very high	25 Å²	25	48.8 Å²	48.8	10%	0.098	24%	0.237	C	C	.	.	H	α-helix	trans	-102.6	11.3	-167.6	-53.5	-72.7	0	0	0	114.9	M590 L596 I601 F630 P636 L637 L638	M590-Y634 HydrophobicContact CG-CE2 4.3Å; M590-Y634 HydrophobicContact SD-CE2 3.97Å; L596-Y634 HydrophobicContact CB-CE1 4.13Å; L596-Y634 HydrophobicContact CD1-CD2 4.17Å; L596-Y634 HydrophobicContact CD1-CE1 4.38Å; L596-Y634 HydrophobicContact CD1-CE2 3.53Å; L596-Y634 HydrophobicContact CG-CE1 4.4Å; L596-Y634 HydrophobicContact CG-CE2 4.25Å; I601-Y634 HydrophobicContact CD1-CD1 3.62Å; I601-Y634 HydrophobicContact CD1-CE1 4.24Å; I601-Y634 HydrophobicContact CD1-CG 4Å; I601-Y634 HydrophobicContact CG1-CD1 4.43Å; I601-Y634 HydrophobicContact CG1-CG 4.48Å; F630-Y634 AromaticContact CD2-CD2 3.52Å; F630-Y634 HydrophobicContact CD2-CD2 3.52Å; F630-Y634 HydrophobicContact CD2-CE2 4.01Å; F630-Y634 AromaticContact CE2-CD2 3.91Å; F630-Y634 HydrophobicContact CE2-CD2 3.91Å; F630-Y634 HydrophobicContact CE2-CE2 4.46Å; F630-Y634 HydrophobicContact CG-CD2 4.2Å; F630-Y634 WeakPolarHBondContact O-CB 3.19Å; F630-Y634 WeakPolarHBondContact O-CD2 3.42Å; F630-Y634 PolarHBondContact O-N 2.9Å; Y634-P636 VanDerWaalsContact C-N 3.34Å; Y634-P636 WeakPolarHBondContact O-CD 3.14Å; Y634-L637 PolarHBondContact O-N 2.68Å; Y634-L638 WeakPolarHBondContact O-CG 3.34Å; Y634-L638 PolarHBondContact O-N 2.67Å
635	N	90.7	Very high	92.7	Very high	43 Å²	43	48.8 Å²	48.8	23%	0.23	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-43.2	-38.7	179.3	65.8	88.5	0	0	0	117.4	I631 K632 L637 L638 H675 F676	I631-N635 VanDerWaalsContact O-CB 3.24Å; I631-N635 WeakPolarHBondContact O-CB 3.17Å; I631-N635 PolarHBondContact O-N 2.83Å; I631-N635 VanDerWaalsContact O-N 3.14Å; K632-N635 PolarHBondContact O-ND2 3.11Å; N635-L637 VanDerWaalsContact C-N 3.25Å; N635-L637 PolarHBondContact O-N 3.05Å; N635-L638 PolarHBondContact O-N 2.91Å; N635-H675 HydrophobicContact CB-CB 3.97Å; N635-F676 HydrophobicContact CB-CE1 4.5Å; N635-F676 WeakPolarHBondContact O-CE1 3.34Å
636	P	88.3	Confident	92.8	Very high	74 Å²	74	44.8 Å²	44.8	48%	0.481	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-64	-30.2	178.5	25.4	-35.9	0	0	0	113.4	Y634	Y634-P636 VanDerWaalsContact C-N 3.34Å; Y634-P636 WeakPolarHBondContact O-CD 3.14Å
637	L	88.9	Confident	92.7	Very high	96 Å²	96	45.2 Å²	45.2	50%	0.503	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-90.7	-11.6	-178	-60.3	175	0	0	0	113.1	I601 Y634 N635	I601-L637 HydrophobicContact CD1-CD1 3.5Å; Y634-L637 PolarHBondContact O-N 2.68Å; N635-L637 VanDerWaalsContact C-N 3.25Å; N635-L637 PolarHBondContact O-N 3.05Å
638	L	92.4	Very high	92.6	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.01	23%	0.234	C	C	.	.			trans	-94.2	12.4	-176.3	-64.3	175.6	0	0	0	113.8	I601 T605 F630 Y634 N635 W641 L642 F676	I601-L638 HydrophobicContact CG2-CD2 3.77Å; T605-L638 HydrophobicContact CG2-CD2 3.42Å; T605-L638 VanDerWaalsContact CG2-CD2 3.42Å; F630-L638 HydrophobicContact CD1-CD1 3.82Å; F630-L638 HydrophobicContact CD1-CD2 4.32Å; F630-L638 HydrophobicContact CE1-CD1 3.88Å; F630-L638 HydrophobicContact CE1-CD2 3.52Å; F630-L638 HydrophobicContact CE1-CG 4.33Å; F630-L638 HydrophobicContact CZ-CD2 3.99Å; Y634-L638 WeakPolarHBondContact O-CG 3.34Å; Y634-L638 PolarHBondContact O-N 2.67Å; N635-L638 PolarHBondContact O-N 2.91Å; L638-W641 HydrophobicContact CD2-CE3 4.16Å; L638-W641 PolarHBondContact O-N 2.9Å; L638-L642 PolarHBondContact O-N 3.27Å; L638-L642 VanDerWaalsContact O-N 3.14Å; L638-F676 HydrophobicContact CB-CE1 3.9Å; L638-F676 HydrophobicContact CB-CZ 3.68Å
639	R	90	Very high	92.6	Very high	156 Å²	156	48.6 Å²	48.6	59%	0.589	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-45.3	-174	-70.9	-177.6	177.6	-153.8	1.2	113.1	W641 L642	R639-W641 PolarHBondContact O-N 3.09Å; R639-L642 WeakPolarHBondContact O-CB 3.24Å; R639-L642 PolarHBondContact O-N 2.98Å
640	D	89.8	Confident	92.6	Very high	156 Å²	156	46 Å²	46	83%	0.834	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-24.3	-179.5	-52.8	-45.9	0	0	0	111.8	L642	D640-L642 VanDerWaalsContact C-N 3.33Å
641	W	93.6	Very high	92.6	Very high	22 Å²	22	49 Å²	49	8%	0.083	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-9.9	172.1	-163.8	58.2	0	0	0	113.3	T605 F608 S609 F612 L627 F630 L638 R639 Y643 T644 L645	T605-W641 HydrophobicContact CG2-CB 4.19Å; T605-W641 HydrophobicContact CG2-CD2 3.5Å; T605-W641 VanDerWaalsContact CG2-CD2 3.5Å; T605-W641 HydrophobicContact CG2-CE3 3.6Å; T605-W641 HydrophobicContact CG2-CG 3.77Å; T605-W641 HydrophobicContact CG2-CZ2 4.45Å; T605-W641 HydrophobicContact CG2-CZ3 4.11Å; T605-W641 WeakPolarHBondContact O-CZ2 3.42Å; F608-W641 HydrophobicContact CB-CH2 3.74Å; F608-W641 HydrophobicContact CB-CZ2 3.84Å; F608-W641 HydrophobicContact CD2-CH2 4.02Å; F608-W641 HydrophobicContact CG-CH2 4.43Å; S609-W641 PolarHBondContact OG-NE1 2.97Å; F612-W641 HydrophobicContact CE2-CH2 4.25Å; F612-W641 HydrophobicContact CE2-CZ2 4.17Å; L627-W641 HydrophobicContact CD1-CH2 3.81Å; L627-W641 HydrophobicContact CD1-CZ3 3.83Å; F630-W641 HydrophobicContact CE1-CZ3 4.4Å; L638-W641 HydrophobicContact CD2-CE3 4.16Å; L638-W641 PolarHBondContact O-N 2.9Å; R639-W641 PolarHBondContact O-N 3.09Å; W641-Y643 PolarHBondContact O-N 2.92Å; W641-T644 WeakPolarHBondContact O-CB 3.5Å; W641-T644 PolarHBondContact O-N 3.14Å; W641-L645 HydrophobicContact CD2-CB 3.99Å; W641-L645 HydrophobicContact CE3-CB 3.85Å; W641-L645 HydrophobicContact CE3-CD1 4.35Å; W641-L645 HydrophobicContact CE3-CD2 3.94Å; W641-L645 HydrophobicContact CE3-CG 4.25Å; W641-L645 HydrophobicContact CH2-CD1 3.88Å; W641-L645 HydrophobicContact CZ3-CB 4.14Å; W641-L645 HydrophobicContact CZ3-CD1 3.77Å; W641-L645 HydrophobicContact CZ3-CD2 3.94Å; W641-L645 HydrophobicContact CZ3-CG 4.15Å; W641-L645 WeakPolarHBondContact O-CB 3.33Å; W641-L645 PolarHBondContact O-N 3.34Å
642	L	94.9	Very high	92.4	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-59.3	-46	-172.3	178.3	57.5	0	0	0	113.6	L638 R639 D640 L646 L672 F676 T680 Q681	L638-L642 PolarHBondContact O-N 3.27Å; L638-L642 VanDerWaalsContact O-N 3.14Å; R639-L642 WeakPolarHBondContact O-CB 3.24Å; R639-L642 PolarHBondContact O-N 2.98Å; D640-L642 VanDerWaalsContact C-N 3.33Å; L642-L646 VanDerWaalsContact O-CB 3.24Å; L642-L646 WeakPolarHBondContact O-CB 3.27Å; L642-L646 PolarHBondContact O-N 3.26Å; L642-L672 HydrophobicContact CD1-CD1 4.39Å; L642-L672 HydrophobicContact CD1-CD2 3.62Å; L642-L672 HydrophobicContact CD1-CG 4.09Å; L642-F676 HydrophobicContact CB-CD1 4.45Å; L642-F676 HydrophobicContact CB-CE1 4.4Å; L642-F676 HydrophobicContact CD1-CB 4.05Å; L642-F676 HydrophobicContact CD1-CD1 3.91Å; L642-F676 HydrophobicContact CD1-CD2 3.62Å; L642-F676 HydrophobicContact CD1-CE1 4.21Å; L642-F676 HydrophobicContact CD1-CE2 3.93Å; L642-F676 HydrophobicContact CD1-CG 3.58Å; L642-F676 HydrophobicContact CD1-CZ 4.21Å; L642-F676 HydrophobicContact CD2-CB 3.96Å; L642-F676 HydrophobicContact CD2-CD1 3.94Å; L642-F676 HydrophobicContact CD2-CG 4.03Å; L642-F676 HydrophobicContact CG-CD1 4.32Å; L642-F676 HydrophobicContact CG-CG 4.37Å; L642-T680 HydrophobicContact CD2-CG2 3.84Å; L642-Q681 HydrophobicContact CD1-CG 4.46Å; L642-Q681 HydrophobicContact CD2-CG 4.24Å
643	Y	93.9	Very high	92.4	Very high	51 Å²	51	47.5 Å²	47.5	20%	0.2	22%	0.223	C	C	.	.	H	α-helix	trans	-58.5	-54.7	175.9	178.7	-108.3	0	0	0	110	W641 L645 L646 I647 H687 F688 D691	W641-Y643 PolarHBondContact O-N 2.92Å; Y643-L645 PolarHBondContact O-N 3.43Å; Y643-L646 PolarHBondContact O-N 3.01Å; Y643-I647 HydrophobicContact CD2-CG1 4.15Å; Y643-I647 HydrophobicContact CE1-CG1 4.42Å; Y643-I647 HydrophobicContact CE2-CD1 4.42Å; Y643-I647 HydrophobicContact CE2-CG1 3.92Å; Y643-I647 HydrophobicContact CG-CG1 4.49Å; Y643-I647 WeakPolarHBondContact O-CG1 3.46Å; Y643-I647 PolarHBondContact O-N 3.15Å; Y643-H687 HydrophobicContact CE2-CB 4.29Å; Y643-H687 AromaticContact CE2-CD2 3.63Å; Y643-H687 AromaticContact CZ-CD2 3.75Å; Y643-F688 HydrophobicContact CE2-CB 3.86Å; Y643-D691 PolarHBondContact OH-OD2 2.89Å; Y643-D691 VanDerWaalsContact OH-OD2 3.07Å
644	T	93.5	Very high	92.5	Very high	44 Å²	44	42.9 Å²	42.9	27%	0.27	20%	0.202	S	C	.	.	H	α-helix	trans	-55.3	-45.6	179.5	-61.4	0	0	0	0	113.2	W641 R648	W641-T644 WeakPolarHBondContact O-CB 3.5Å; W641-T644 PolarHBondContact O-N 3.14Å; T644-R648 VanDerWaalsContact O-CB 3.27Å; T644-R648 WeakPolarHBondContact O-CB 3.2Å; T644-R648 VanDerWaalsContact O-CG 3.28Å; T644-R648 WeakPolarHBondContact O-CG 3.42Å; T644-R648 PolarHBondContact O-N 2.92Å
645	L	95.6	Very high	92.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.8	-50.6	176.3	168.8	59	0	0	0	111.5	F612 L627 I631 W641 Y643 R648 L649 L672 F676	F612-L645 HydrophobicContact CE2-CD1 4.14Å; F612-L645 HydrophobicContact CZ-CD1 3.76Å; L627-L645 HydrophobicContact CD1-CD1 4.07Å; L627-L645 HydrophobicContact CD2-CD1 4.06Å; I631-L645 HydrophobicContact CD1-CD1 4.44Å; I631-L645 HydrophobicContact CD1-CD2 3.86Å; I631-L645 HydrophobicContact CG1-CD2 4.08Å; W641-L645 HydrophobicContact CD2-CB 3.99Å; W641-L645 HydrophobicContact CE3-CB 3.85Å; W641-L645 HydrophobicContact CE3-CD1 4.35Å; W641-L645 HydrophobicContact CE3-CD2 3.94Å; W641-L645 HydrophobicContact CE3-CG 4.25Å; W641-L645 HydrophobicContact CH2-CD1 3.88Å; W641-L645 HydrophobicContact CZ3-CB 4.14Å; W641-L645 HydrophobicContact CZ3-CD1 3.77Å; W641-L645 HydrophobicContact CZ3-CD2 3.94Å; W641-L645 HydrophobicContact CZ3-CG 4.15Å; W641-L645 WeakPolarHBondContact O-CB 3.33Å; W641-L645 PolarHBondContact O-N 3.34Å; Y643-L645 PolarHBondContact O-N 3.43Å; L645-R648 PolarHBondContact O-N 3.05Å; L645-L649 HydrophobicContact CD1-CD1 3.66Å; L645-L649 HydrophobicContact CD1-CG 4.18Å; L645-L649 HydrophobicContact CG-CD1 4.04Å; L645-L649 WeakPolarHBondContact O-CB 3.34Å; L645-L649 WeakPolarHBondContact O-CG 3.32Å; L645-L649 PolarHBondContact O-N 3.36Å; L645-L672 HydrophobicContact CD2-CD1 3.96Å; L645-L672 HydrophobicContact CD2-CG 4.34Å; L645-L672 HydrophobicContact CG-CD1 3.88Å; L645-F676 HydrophobicContact CD2-CE2 4.11Å; L645-F676 HydrophobicContact CD2-CZ 4.37Å
646	L	94.8	Very high	92.4	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.7	-46.5	-179.2	177.5	57.9	0	0	0	111.2	L642 Y643 L649 L650 L669 L672 Y707	L642-L646 VanDerWaalsContact O-CB 3.24Å; L642-L646 WeakPolarHBondContact O-CB 3.27Å; L642-L646 PolarHBondContact O-N 3.26Å; Y643-L646 PolarHBondContact O-N 3.01Å; L646-L649 PolarHBondContact O-N 2.86Å; L646-L650 HydrophobicContact CD1-CD1 4.04Å; L646-L650 HydrophobicContact CD1-CG 4.2Å; L646-L650 HydrophobicContact CG-CD1 4.11Å; L646-L650 WeakPolarHBondContact O-CB 3.42Å; L646-L650 VanDerWaalsContact O-CG 3.29Å; L646-L650 WeakPolarHBondContact O-CG 3.11Å; L646-L650 PolarHBondContact O-N 2.71Å; L646-L669 HydrophobicContact CD1-CD2 3.89Å; L646-L672 HydrophobicContact CB-CD1 4.32Å; L646-L672 HydrophobicContact CD1-CD1 4.3Å; L646-Y707 HydrophobicContact CD1-CD1 4.09Å; L646-Y707 HydrophobicContact CD1-CD2 4.42Å; L646-Y707 HydrophobicContact CD1-CE1 3.57Å; L646-Y707 HydrophobicContact CD1-CE2 3.93Å; L646-Y707 HydrophobicContact CD1-CG 4.47Å; L646-Y707 VanDerWaalsContact CD1-CZ 3.45Å; L646-Y707 HydrophobicContact CD2-CE1 3.98Å; L646-Y707 HydrophobicContact CG-CE1 4.42Å
647	I	92.6	Very high	92.4	Very high	8 Å²	8	46.8 Å²	46.8	4%	0.041	23%	0.228	C	C	.	.	H	α-helix	trans	-68.2	-40.3	-179.3	-61	-35	0	0	0	111	Y643 L649 L650 Y651 F688	Y643-I647 HydrophobicContact CD2-CG1 4.15Å; Y643-I647 HydrophobicContact CE1-CG1 4.42Å; Y643-I647 HydrophobicContact CE2-CD1 4.42Å; Y643-I647 HydrophobicContact CE2-CG1 3.92Å; Y643-I647 HydrophobicContact CG-CG1 4.49Å; Y643-I647 WeakPolarHBondContact O-CG1 3.46Å; Y643-I647 PolarHBondContact O-N 3.15Å; I647-L649 PolarHBondContact O-N 2.73Å; I647-L650 HydrophobicContact CD1-CD1 4.17Å; I647-L650 PolarHBondContact O-N 3.42Å; I647-Y651 HydrophobicContact CG2-CD2 3.64Å; I647-Y651 HydrophobicContact CG2-CE2 3.72Å; I647-Y651 WeakPolarHBondContact O-CD2 3.19Å; I647-Y651 PolarHBondContact O-N 2.77Å; I647-F688 HydrophobicContact CD1-CB 3.56Å; I647-F688 HydrophobicContact CD1-CD1 3.58Å; I647-F688 HydrophobicContact CD1-CD2 3.64Å; I647-F688 HydrophobicContact CD1-CE1 4.13Å; I647-F688 HydrophobicContact CD1-CE2 4.18Å; I647-F688 HydrophobicContact CD1-CG 3.3Å; I647-F688 HydrophobicContact CD1-CZ 4.4Å; I647-F688 HydrophobicContact CG1-CB 4.2Å; I647-F688 HydrophobicContact CG1-CD2 3.75Å; I647-F688 HydrophobicContact CG1-CE2 4.23Å; I647-F688 HydrophobicContact CG1-CG 3.94Å; I647-F688 HydrophobicContact CG2-CD2 3.9Å; I647-F688 HydrophobicContact CG2-CE2 3.52Å; I647-F688 HydrophobicContact CG2-CZ 4.03Å
648	R	94	Very high	92.4	Very high	94 Å²	94	45.8 Å²	45.8	36%	0.355	22%	0.223	S	C	.	.	H	α-helix	trans	-64.5	-38.3	174.1	-75.9	178.3	160.4	126.1	5.1	113	S609 F612 T644 L645 R652	S609-R648 PolarHBondContact O-NE 3.06Å; S609-R648 VanDerWaalsContact O-NE 3.08Å; S609-R648 PolarHBondContact OG-NH1 3.45Å; F612-R648 HydrophobicContact CB-CB 4.21Å; F612-R648 HydrophobicContact CD1-CB 4.09Å; F612-R648 HydrophobicContact CD2-CB 3.62Å; F612-R648 HydrophobicContact CD2-CG 4.27Å; F612-R648 HydrophobicContact CE1-CB 4.38Å; F612-R648 HydrophobicContact CE2-CB 3.93Å; F612-R648 HydrophobicContact CG-CB 3.71Å; F612-R648 HydrophobicContact CG-CG 4.49Å; F612-R648 HydrophobicContact CZ-CB 4.3Å; T644-R648 VanDerWaalsContact O-CB 3.27Å; T644-R648 WeakPolarHBondContact O-CB 3.2Å; T644-R648 VanDerWaalsContact O-CG 3.28Å; T644-R648 WeakPolarHBondContact O-CG 3.42Å; T644-R648 PolarHBondContact O-N 2.92Å; L645-R648 PolarHBondContact O-N 3.05Å; R648-R652 WeakPolarHBondContact O-CB 3.26Å; R648-R652 PolarHBondContact O-N 3.29Å
649	L	95.1	Very high	92.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.7	-46.6	171.9	-79.8	162.6	0	0	0	112.1	F612 M624 L627 L645 L646 I647 R652 Q653 I665 T668 L669 L672	F612-L649 HydrophobicContact CE1-CD2 3.7Å; F612-L649 HydrophobicContact CE1-CG 3.75Å; F612-L649 HydrophobicContact CZ-CD2 4.15Å; F612-L649 HydrophobicContact CZ-CG 3.88Å; M624-L649 HydrophobicContact SD-CD2 4.14Å; L627-L649 HydrophobicContact CD2-CD2 4.47Å; L645-L649 HydrophobicContact CD1-CD1 3.66Å; L645-L649 HydrophobicContact CD1-CG 4.18Å; L645-L649 HydrophobicContact CG-CD1 4.04Å; L645-L649 WeakPolarHBondContact O-CB 3.34Å; L645-L649 WeakPolarHBondContact O-CG 3.32Å; L645-L649 PolarHBondContact O-N 3.36Å; L646-L649 PolarHBondContact O-N 2.86Å; I647-L649 PolarHBondContact O-N 2.73Å; L649-R652 PolarHBondContact O-N 2.93Å; L649-Q653 WeakPolarHBondContact O-CB 3.45Å; L649-Q653 PolarHBondContact O-N 3.31Å; L649-I665 HydrophobicContact CD2-CG2 4.07Å; L649-T668 HydrophobicContact CD1-CG2 4.02Å; 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 3.88Å; L649-L669 HydrophobicContact CD1-CG 4.35Å; L649-L669 HydrophobicContact CG-CD2 4.41Å; L649-L672 HydrophobicContact CD1-CD1 3.71Å
650	L	93.8	Very high	92.3	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.9	-42.4	-179.7	-70.7	173.5	0	0	0	112.6	L646 I647 S654 C703 L704	L646-L650 HydrophobicContact CD1-CD1 4.04Å; L646-L650 HydrophobicContact CD1-CG 4.2Å; L646-L650 HydrophobicContact CG-CD1 4.11Å; L646-L650 WeakPolarHBondContact O-CB 3.42Å; L646-L650 VanDerWaalsContact O-CG 3.29Å; L646-L650 WeakPolarHBondContact O-CG 3.11Å; L646-L650 PolarHBondContact O-N 2.71Å; I647-L650 HydrophobicContact CD1-CD1 4.17Å; I647-L650 PolarHBondContact O-N 3.42Å; L650-S654 WeakPolarHBondContact O-CB 3.35Å; L650-S654 PolarHBondContact O-N 3.45Å; L650-S654 VanDerWaalsContact O-N 3.12Å; L650-C703 HydrophobicContact CD2-CB 3.98Å; L650-L704 HydrophobicContact CD1-CB 4.17Å; L650-L704 HydrophobicContact CD1-CD1 3.66Å
651	Y	92.7	Very high	92.3	Very high	61 Å²	61	38.7 Å²	38.7	24%	0.239	21%	0.209	C	C	.	.	H	α-helix	trans	-61.6	-46.8	171.3	-90.3	-81.5	0	0	0	111	I647 Q653 S654 H655 F688 V700	I647-Y651 HydrophobicContact CG2-CD2 3.64Å; I647-Y651 HydrophobicContact CG2-CE2 3.72Å; I647-Y651 WeakPolarHBondContact O-CD2 3.19Å; I647-Y651 PolarHBondContact O-N 2.77Å; Y651-Q653 PolarHBondContact O-N 2.76Å; Y651-S654 PolarHBondContact O-N 2.74Å; Y651-S654 VanDerWaalsContact O-N 3.17Å; Y651-S654 PolarHBondContact O-OG 2.93Å; Y651-H655 PolarHBondContact O-CD2 3.17Å; Y651-H655 VanDerWaalsContact O-CD2 3.27Å; Y651-H655 PolarHBondContact O-N 2.78Å; Y651-F688 HydrophobicContact CD2-CZ 4.38Å; Y651-F688 AromaticContact CE2-CE2 3.8Å; Y651-F688 HydrophobicContact CE2-CE2 3.8Å; Y651-F688 AromaticContact CE2-CZ 3.59Å; Y651-F688 HydrophobicContact CE2-CZ 3.59Å; Y651-V700 HydrophobicContact CD1-CG2 3.65Å; Y651-V700 HydrophobicContact CE1-CG2 3.75Å; Y651-V700 HydrophobicContact CE2-CG1 4.43Å; Y651-V700 HydrophobicContact CG-CG2 4.21Å
652	R	92.1	Very high	92.2	Very high	41 Å²	41	41.2 Å²	41.2	16%	0.155	22%	0.222	C	C	.	.	H	α-helix	trans	-60.8	-46.7	178.9	-174.1	57.4	-178.1	-132.3	14.3	111.6	F612 D614 M624 R648 L649 S654 H655 E656 I665	F612-R652 HydrophobicContact CD1-CB 4.36Å; F612-R652 PolarHBondContact O-NH1 3.28Å; D614-R652 PolarHBondContact O-NH1 3.33Å; D614-R652 PolarHBondContact O-NH2 3.35Å; D614-R652 VanDerWaalsContact O-NH2 3.13Å; M624-R652 HydrophobicContact CE-CG 4.37Å; R648-R652 WeakPolarHBondContact O-CB 3.26Å; R648-R652 PolarHBondContact O-N 3.29Å; L649-R652 PolarHBondContact O-N 2.93Å; R652-S654 PolarHBondContact O-N 3Å; R652-H655 PolarHBondContact O-N 3.09Å; R652-H655 VanDerWaalsContact O-N 3.14Å; R652-E656 IonicContact CZ-OE2 3.2Å; R652-E656 IonicContact NE-OE2 3.95Å; R652-E656 PolarHBondContact NE-OE2 2.8Å; R652-E656 IonicContact NH2-OE2 3.76Å; R652-E656 PolarHBondContact NH2-OE2 3.07Å; R652-E656 WeakPolarHBondContact O-CB 3.5Å; R652-E656 PolarHBondContact O-N 3.06Å; R652-I665 HydrophobicContact CB-CD1 4.47Å; R652-I665 HydrophobicContact CG-CD1 3.81Å
653	Q	93.8	Very high	92.1	Very high	20 Å²	20	46.5 Å²	46.5	9%	0.093	25%	0.245	C	C	.	.	H	α-helix	trans	-55	-39	176.3	-161.2	-173.4	-4.2	0	0	112.3	L649 Y651 H655 I665 C703	L649-Q653 WeakPolarHBondContact O-CB 3.45Å; L649-Q653 PolarHBondContact O-N 3.31Å; Y651-Q653 PolarHBondContact O-N 2.76Å; Q653-H655 VanDerWaalsContact C-N 3.32Å; Q653-H655 PolarHBondContact O-N 3.22Å; Q653-I665 HydrophobicContact CB-CG2 3.82Å; Q653-I665 HydrophobicContact CG-CG2 4Å; Q653-C703 HydrophobicContact CB-CB 4.43Å
654	S	91.1	Very high	92.1	Very high	5 Å²	5	44.6 Å²	44.6	4%	0.035	24%	0.239	C	C	.	.	H	α-helix	trans	-71	-23.6	-177.9	82	0	0	0	0	114.7	L650 Y651 R652 R699 V700	L650-S654 WeakPolarHBondContact O-CB 3.35Å; L650-S654 PolarHBondContact O-N 3.45Å; L650-S654 VanDerWaalsContact O-N 3.12Å; Y651-S654 PolarHBondContact O-N 2.74Å; Y651-S654 VanDerWaalsContact O-N 3.17Å; Y651-S654 PolarHBondContact O-OG 2.93Å; R652-S654 PolarHBondContact O-N 3Å; S654-R699 WeakPolarHBondContact O-CD 3.29Å; S654-R699 PolarHBondContact O-NH1 3.44Å; S654-V700 WeakPolarHBondContact OG-CG2 3.41Å
655	H	90.1	Very high	92.1	Very high	113 Å²	113	42.5 Å²	42.5	52%	0.523	23%	0.227	S	C	.	.	H	α-helix	trans	-106.8	-18	-178.1	-71.2	-70.6	0	0	0	113.2	Y651 R652 Q653 N697	Y651-H655 PolarHBondContact O-CD2 3.17Å; Y651-H655 VanDerWaalsContact O-CD2 3.27Å; Y651-H655 PolarHBondContact O-N 2.78Å; R652-H655 PolarHBondContact O-N 3.09Å; R652-H655 VanDerWaalsContact O-N 3.14Å; Q653-H655 VanDerWaalsContact C-N 3.32Å; Q653-H655 PolarHBondContact O-N 3.22Å; H655-N697 PolarHBondContact NE2-ND2 3.08Å
656	E	89.6	Confident	92	Very high	20 Å²	20	47.2 Å²	47.2	9%	0.093	25%	0.249	C	C	.	.			trans	-72.6	131.7	-177.1	-173.4	54	-100.6	0	0	112.6	R652 L658 H661 Q662 I665	R652-E656 IonicContact CZ-OE2 3.2Å; R652-E656 IonicContact NE-OE2 3.95Å; R652-E656 PolarHBondContact NE-OE2 2.8Å; R652-E656 IonicContact NH2-OE2 3.76Å; R652-E656 PolarHBondContact NH2-OE2 3.07Å; R652-E656 WeakPolarHBondContact O-CB 3.5Å; R652-E656 PolarHBondContact O-N 3.06Å; E656-L658 PolarHBondContact OE1-N 3.07Å; E656-L658 VanDerWaalsContact OE1-N 3.08Å; E656-H661 HydrophobicContact CG-CB 3.39Å; E656-H661 IonicContact OE1-ND1 3.82Å; E656-H661 PolarHBondContact OE1-ND1 3.39Å; E656-H661 IonicContact OE2-CE1 3Å; E656-H661 IonicContact OE2-CG 2.74Å; E656-H661 IonicContact OE2-ND1 3.63Å; E656-H661 PolarHBondContact OE2-ND1 3.14Å; E656-Q662 HydrophobicContact CB-CG 4.44Å; E656-Q662 HydrophobicContact CG-CG 4.25Å; E656-Q662 PolarHBondContact O-NE2 3.25Å; E656-I665 HydrophobicContact CB-CD1 4.12Å; E656-I665 HydrophobicContact CG-CD1 4.04Å
657	A	87.8	Confident	91.9	Very high	91 Å²	91	50.9 Å²	50.9	75%	0.752	27%	0.266	S	S	*	.			trans	-108.9	-19.1	-175.3	0	0	0	0	0	113.1
658	L	90	Very high	92.1	Very high	75 Å²	75	50.5 Å²	50.5	39%	0.393	26%	0.264	S	S	.	.			trans	-81.5	119.3	178.8	-74.1	160.8	0	0	0	110.3	S617 E656 S660 H661 Q662	S617-L658 WeakPolarHBondContact OG-CD1 3.11Å; E656-L658 PolarHBondContact OE1-N 3.07Å; E656-L658 VanDerWaalsContact OE1-N 3.08Å; L658-S660 PolarHBondContact O-N 3.38Å; L658-H661 HydrophobicContact CB-CB 4.19Å; L658-H661 WeakPolarHBondContact CD1-CE1 3.43Å; L658-H661 WeakPolarHBondContact O-CB 3.48Å; L658-H661 PolarHBondContact O-N 3.31Å; L658-Q662 PolarHBondContact O-N 3.26Å
659	S	89.5	Confident	92.2	Very high	95 Å²	95	46.3 Å²	46.3	66%	0.664	25%	0.249	S	C	*	.	H	α-helix	trans	-60.3	-30.2	-179.5	54.3	0	0	0	0	113.3	K663	S659-K663 WeakPolarHBondContact O-CB 3.43Å; S659-K663 PolarHBondContact O-N 3.49Å
660	S	89.2	Confident	92.2	Very high	67 Å²	67	52 Å²	52	47%	0.469	27%	0.274	S	S	.	.	H	α-helix	trans	-62.3	-46.9	170.9	51.2	0	0	0	0	112.2	L658 K663 A664	L658-S660 PolarHBondContact O-N 3.38Å; S660-K663 PolarHBondContact O-N 2.67Å; S660-A664 PolarHBondContact O-N 3.04Å
661	H	91	Very high	92.2	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.009	28%	0.276	C	S	.	.	H	α-helix	trans	-68.5	-41.1	175.7	-62.8	176.9	0	0	0	111.5	S617 S621 E656 L658 K663 A664 I665	S617-H661 VanDerWaalsContact CA-CE1 3.47Å; S617-H661 WeakPolarHBondContact CA-CE1 3.41Å; S617-H661 VanDerWaalsContact CB-CE1 3.43Å; S617-H661 WeakPolarHBondContact CB-CE1 3.49Å; S617-H661 WeakPolarHBondContact CB-NE2 3.16Å; S617-H661 PolarHBondContact O-NE2 3.44Å; S621-H661 PolarHBondContact OG-CD2 3.42Å; S621-H661 VanDerWaalsContact OG-CD2 3.23Å; S621-H661 PolarHBondContact OG-NE2 3.16Å; S621-H661 VanDerWaalsContact OG-NE2 3.16Å; E656-H661 HydrophobicContact CG-CB 3.39Å; E656-H661 IonicContact OE1-ND1 3.82Å; E656-H661 PolarHBondContact OE1-ND1 3.39Å; E656-H661 IonicContact OE2-CE1 3Å; E656-H661 IonicContact OE2-CG 2.74Å; E656-H661 IonicContact OE2-ND1 3.63Å; E656-H661 PolarHBondContact OE2-ND1 3.14Å; L658-H661 HydrophobicContact CB-CB 4.19Å; L658-H661 WeakPolarHBondContact CD1-CE1 3.43Å; L658-H661 WeakPolarHBondContact O-CB 3.48Å; L658-H661 PolarHBondContact O-N 3.31Å; H661-K663 VanDerWaalsContact C-N 3.28Å; H661-K663 PolarHBondContact O-N 2.95Å; H661-A664 PolarHBondContact O-N 3.39Å; H661-A664 VanDerWaalsContact O-N 3.16Å; H661-I665 WeakPolarHBondContact O-CB 3.35Å; H661-I665 WeakPolarHBondContact O-CD1 3.45Å; H661-I665 WeakPolarHBondContact O-CG1 3.42Å; H661-I665 PolarHBondContact O-N 3.07Å
662	Q	91.5	Very high	92.4	Very high	76 Å²	76	49.4 Å²	49.4	36%	0.355	26%	0.264	S	S	.	.	H	α-helix	trans	-57.6	-43	175.7	-71.5	-177.5	-7.8	0	0	111.2	E656 L658 I665 Q666	E656-Q662 HydrophobicContact CB-CG 4.44Å; E656-Q662 HydrophobicContact CG-CG 4.25Å; E656-Q662 PolarHBondContact O-NE2 3.25Å; L658-Q662 PolarHBondContact O-N 3.26Å; Q662-I665 PolarHBondContact O-N 3.34Å; Q662-Q666 WeakPolarHBondContact O-CB 3.31Å; Q662-Q666 WeakPolarHBondContact O-CG 3.36Å; Q662-Q666 PolarHBondContact O-N 2.85Å
663	K	92.2	Very high	92.5	Very high	113 Å²	113	49 Å²	49	49%	0.491	26%	0.263	S	S	.	.	H	α-helix	trans	-62.1	-48.6	172.7	-179.2	179.7	173.9	-69.4	0	111.9	S659 S660 H661 I665 Q666 E667	S659-K663 WeakPolarHBondContact O-CB 3.43Å; S659-K663 PolarHBondContact O-N 3.49Å; S660-K663 PolarHBondContact O-N 2.67Å; H661-K663 VanDerWaalsContact C-N 3.28Å; H661-K663 PolarHBondContact O-N 2.95Å; K663-I665 VanDerWaalsContact C-N 3.29Å; K663-I665 PolarHBondContact O-N 3.39Å; K663-Q666 WeakPolarHBondContact O-CB 3.49Å; K663-Q666 PolarHBondContact O-N 3.06Å; K663-Q666 VanDerWaalsContact O-N 3.14Å; K663-E667 WeakPolarHBondContact CE-OE1 3.49Å; K663-E667 IonicContact NZ-OE1 2.73Å; K663-E667 PolarHBondContact NZ-OE1 3.12Å; K663-E667 IonicContact NZ-OE2 2.59Å; K663-E667 PolarHBondContact NZ-OE2 2.97Å; K663-E667 WeakPolarHBondContact O-CG 3.5Å; K663-E667 PolarHBondContact O-N 3.31Å
664	A	93.2	Very high	92.4	Very high	11 Å²	11	51.6 Å²	51.6	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-34.7	178.7	0	0	0	0	0	112.8	M624 S660 H661 E667 T668	M624-A664 HydrophobicContact CB-CB 3.77Å; M624-A664 HydrophobicContact CG-CB 4.1Å; S660-A664 PolarHBondContact O-N 3.04Å; H661-A664 PolarHBondContact O-N 3.39Å; H661-A664 VanDerWaalsContact O-N 3.16Å; A664-E667 PolarHBondContact O-N 2.94Å; A664-T668 WeakPolarHBondContact O-CB 3.44Å; A664-T668 PolarHBondContact O-N 3.14Å; A664-T668 PolarHBondContact O-OG1 2.98Å
665	I	94.4	Very high	92.5	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-69.9	-41.3	173.5	-66.6	159.4	0	0	0	110.7	M624 L649 R652 Q653 E656 H661 Q662 K663 E667 T668 L669	M624-I665 HydrophobicContact CE-CD1 4.23Å; M624-I665 HydrophobicContact CE-CG1 3.64Å; M624-I665 HydrophobicContact CG-CG1 4.34Å; M624-I665 HydrophobicContact SD-CG1 3.72Å; L649-I665 HydrophobicContact CD2-CG2 4.07Å; R652-I665 HydrophobicContact CB-CD1 4.47Å; R652-I665 HydrophobicContact CG-CD1 3.81Å; Q653-I665 HydrophobicContact CB-CG2 3.82Å; Q653-I665 HydrophobicContact CG-CG2 4Å; E656-I665 HydrophobicContact CB-CD1 4.12Å; E656-I665 HydrophobicContact CG-CD1 4.04Å; H661-I665 WeakPolarHBondContact O-CB 3.35Å; H661-I665 WeakPolarHBondContact O-CD1 3.45Å; H661-I665 WeakPolarHBondContact O-CG1 3.42Å; H661-I665 PolarHBondContact O-N 3.07Å; Q662-I665 PolarHBondContact O-N 3.34Å; K663-I665 VanDerWaalsContact C-N 3.29Å; K663-I665 PolarHBondContact O-N 3.39Å; I665-E667 VanDerWaalsContact C-N 3.35Å; I665-T668 PolarHBondContact O-N 3.18Å; I665-L669 HydrophobicContact CG2-CD1 3.96Å; I665-L669 HydrophobicContact CG2-CG 4.44Å; I665-L669 WeakPolarHBondContact O-CB 3.46Å; I665-L669 WeakPolarHBondContact O-CG 3.3Å; I665-L669 PolarHBondContact O-N 3.2Å
666	Q	92.8	Very high	92.6	Very high	99 Å²	99	49.4 Å²	49.4	46%	0.463	27%	0.272	S	S	.	.	H	α-helix	trans	-63.1	-38.9	173.4	-76.6	174.4	-22.1	0	0	112.3	Q662 K663 L669 F670	Q662-Q666 WeakPolarHBondContact O-CB 3.31Å; Q662-Q666 WeakPolarHBondContact O-CG 3.36Å; Q662-Q666 PolarHBondContact O-N 2.85Å; K663-Q666 WeakPolarHBondContact O-CB 3.49Å; K663-Q666 PolarHBondContact O-N 3.06Å; K663-Q666 VanDerWaalsContact O-N 3.14Å; Q666-L669 PolarHBondContact O-N 3.33Å; Q666-F670 PolarHBondContact O-N 3.35Å
667	E	94.4	Very high	92.7	Very high	77 Å²	77	51 Å²	51	36%	0.36	28%	0.284	S	S	.	.	H	α-helix	trans	-67.8	-40.2	174.1	-72.4	172.2	147.5	0	0	111.1	K663 A664 I665 F670 V671	K663-E667 WeakPolarHBondContact CE-OE1 3.49Å; K663-E667 IonicContact NZ-OE1 2.73Å; K663-E667 PolarHBondContact NZ-OE1 3.12Å; K663-E667 IonicContact NZ-OE2 2.59Å; K663-E667 PolarHBondContact NZ-OE2 2.97Å; K663-E667 WeakPolarHBondContact O-CG 3.5Å; K663-E667 PolarHBondContact O-N 3.31Å; A664-E667 PolarHBondContact O-N 2.94Å; I665-E667 VanDerWaalsContact C-N 3.35Å; E667-F670 WeakPolarHBondContact O-CB 3.4Å; E667-F670 PolarHBondContact O-N 3.17Å; E667-F670 VanDerWaalsContact O-N 3.15Å; E667-V671 WeakPolarHBondContact O-CG2 3.31Å; E667-V671 PolarHBondContact O-N 3.41Å
668	T	95.9	Very high	92.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.1	-40.9	172.6	-53	0	0	0	0	112.2	L627 Q628 I631 L649 A664 I665 F670 V671 L672	L627-T668 HydrophobicContact CD2-CG2 3.82Å; L627-T668 HydrophobicContact CG-CG2 4.02Å; Q628-T668 HydrophobicContact CG-CG2 4.21Å; Q628-T668 WeakPolarHBondContact CG-OG1 3.44Å; I631-T668 HydrophobicContact CD1-CG2 4.03Å; L649-T668 HydrophobicContact CD1-CG2 4.02Å; L649-T668 HydrophobicContact CD2-CG2 3.84Å; A664-T668 WeakPolarHBondContact O-CB 3.44Å; A664-T668 PolarHBondContact O-N 3.14Å; A664-T668 PolarHBondContact O-OG1 2.98Å; I665-T668 PolarHBondContact O-N 3.18Å; T668-F670 VanDerWaalsContact C-N 3.27Å; T668-F670 PolarHBondContact O-N 3.41Å; T668-V671 PolarHBondContact O-N 3.42Å; T668-L672 WeakPolarHBondContact O-CB 3.5Å; T668-L672 PolarHBondContact O-N 2.7Å
669	L	95.5	Very high	92.9	Very high	7 Å²	7	49.2 Å²	49.2	4%	0.037	26%	0.262	C	S	.	.	H	α-helix	trans	-70.6	-19.6	173.6	-73.9	168.3	0	0	0	113.1	L646 L649 I665 Q666 L672 R673 Y707	L646-L669 HydrophobicContact CD1-CD2 3.89Å; L649-L669 HydrophobicContact CB-CD2 3.83Å; L649-L669 HydrophobicContact CB-CG 4.28Å; L649-L669 HydrophobicContact CD1-CD2 3.88Å; L649-L669 HydrophobicContact CD1-CG 4.35Å; L649-L669 HydrophobicContact CG-CD2 4.41Å; I665-L669 HydrophobicContact CG2-CD1 3.96Å; I665-L669 HydrophobicContact CG2-CG 4.44Å; I665-L669 WeakPolarHBondContact O-CB 3.46Å; I665-L669 WeakPolarHBondContact O-CG 3.3Å; I665-L669 PolarHBondContact O-N 3.2Å; Q666-L669 PolarHBondContact O-N 3.33Å; L669-L672 HydrophobicContact CD2-CD1 4.48Å; L669-R673 VanDerWaalsContact O-CG 3.3Å; L669-R673 WeakPolarHBondContact O-CG 3.09Å; L669-R673 PolarHBondContact O-N 2.63Å; L669-R673 PolarHBondContact O-NE 2.73Å; L669-Y707 HydrophobicContact CB-CD2 4.14Å; L669-Y707 HydrophobicContact CB-CE2 4.19Å; L669-Y707 HydrophobicContact CD2-CD2 3.82Å; L669-Y707 HydrophobicContact CD2-CE2 3.72Å; L669-Y707 HydrophobicContact CG-CD2 4.38Å
670	F	95.1	Very high	93	Very high	119 Å²	119	47.9 Å²	47.9	52%	0.522	25%	0.25	S	C	.	.	H	α-helix	trans	-77.1	-45.5	168	177.4	-92.2	0	0	0	111.1	Q666 E667 T668 R673 S674	Q666-F670 PolarHBondContact O-N 3.35Å; E667-F670 WeakPolarHBondContact O-CB 3.4Å; E667-F670 PolarHBondContact O-N 3.17Å; E667-F670 VanDerWaalsContact O-N 3.15Å; T668-F670 VanDerWaalsContact C-N 3.27Å; T668-F670 PolarHBondContact O-N 3.41Å; F670-R673 WeakPolarHBondContact O-CB 3.33Å; F670-R673 PolarHBondContact O-N 3.5Å; F670-R673 VanDerWaalsContact O-N 3.13Å; F670-S674 PolarHBondContact O-N 3.4Å
671	V	95.4	Very high	93.2	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.042	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-44.5	175.3	171.3	0	0	0	0	111.6	Q628 I631 K632 E667 T668 R673 S674 H675	Q628-V671 HydrophobicContact CB-CG2 4.48Å; Q628-V671 HydrophobicContact CG-CB 4.34Å; Q628-V671 HydrophobicContact CG-CG2 4.05Å; I631-V671 HydrophobicContact CB-CG1 4.16Å; I631-V671 HydrophobicContact CG2-CG1 3.85Å; K632-V671 HydrophobicContact CD-CG1 4.4Å; K632-V671 HydrophobicContact CG-CG1 3.85Å; E667-V671 WeakPolarHBondContact O-CG2 3.31Å; E667-V671 PolarHBondContact O-N 3.41Å; T668-V671 PolarHBondContact O-N 3.42Å; V671-R673 VanDerWaalsContact C-N 3.26Å; V671-R673 PolarHBondContact O-N 2.93Å; V671-S674 PolarHBondContact O-N 2.95Å; V671-S674 PolarHBondContact O-OG 2.91Å; V671-H675 PolarHBondContact O-CD2 2.67Å; V671-H675 VanDerWaalsContact O-CD2 3.25Å; V671-H675 PolarHBondContact O-N 3.4Å; V671-H675 VanDerWaalsContact O-N 3.11Å
672	L	95.1	Very high	93.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-56.2	-44.4	173.4	-169.7	172.4	0	0	0	110.4	L642 L645 L646 L649 T668 L669 S674 H675 F676 Q681 Y707	L642-L672 HydrophobicContact CD1-CD1 4.39Å; L642-L672 HydrophobicContact CD1-CD2 3.62Å; L642-L672 HydrophobicContact CD1-CG 4.09Å; L645-L672 HydrophobicContact CD2-CD1 3.96Å; L645-L672 HydrophobicContact CD2-CG 4.34Å; L645-L672 HydrophobicContact CG-CD1 3.88Å; L646-L672 HydrophobicContact CB-CD1 4.32Å; L646-L672 HydrophobicContact CD1-CD1 4.3Å; L649-L672 HydrophobicContact CD1-CD1 3.71Å; T668-L672 WeakPolarHBondContact O-CB 3.5Å; T668-L672 PolarHBondContact O-N 2.7Å; L669-L672 HydrophobicContact CD2-CD1 4.48Å; L672-S674 PolarHBondContact O-N 3.44Å; L672-H675 PolarHBondContact O-N 2.97Å; L672-F676 HydrophobicContact CD2-CD2 3.88Å; L672-F676 HydrophobicContact CG-CD2 3.82Å; L672-F676 HydrophobicContact CG-CE2 4.06Å; L672-F676 WeakPolarHBondContact O-CD2 3.27Å; L672-F676 PolarHBondContact O-N 3.2Å; L672-F676 VanDerWaalsContact O-N 3.17Å; L672-Q681 HydrophobicContact CD2-CG 3.99Å; L672-Y707 WeakPolarHBondContact CD2-OH 3.25Å
673	R	94.5	Very high	93.4	Very high	32 Å²	32	44.5 Å²	44.5	12%	0.121	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-36.1	177.4	-80.2	-179.9	-60.2	134	-5.3	114.5	L669 F670 V671 L678 Q681 Y707 D710 L711 M714	L669-R673 VanDerWaalsContact O-CG 3.3Å; L669-R673 WeakPolarHBondContact O-CG 3.09Å; L669-R673 PolarHBondContact O-N 2.63Å; L669-R673 PolarHBondContact O-NE 2.73Å; F670-R673 WeakPolarHBondContact O-CB 3.33Å; F670-R673 PolarHBondContact O-N 3.5Å; F670-R673 VanDerWaalsContact O-N 3.13Å; V671-R673 VanDerWaalsContact C-N 3.26Å; V671-R673 PolarHBondContact O-N 2.93Å; R673-L678 WeakPolarHBondContact O-CD2 3.49Å; R673-Q681 VanDerWaalsContact CA-OE1 3.26Å; R673-Q681 VanDerWaalsContact CG-OE1 3.24Å; R673-Q681 PolarHBondContact O-NE2 3.01Å; R673-Y707 HydrophobicContact CG-CD2 4.48Å; R673-Y707 HydrophobicContact CG-CE2 3.56Å; R673-D710 PolarHBondContact NH1-O 3.49Å; R673-L711 HydrophobicContact CG-CD1 3.89Å; R673-M714 HydrophobicContact CB-CE 3.87Å; R673-M714 HydrophobicContact CG-CE 4.23Å
674	S	92.8	Very high	93.4	Very high	74 Å²	74	39.9 Å²	39.9	52%	0.517	21%	0.211	S	C	.	.	H	α-helix	trans	-85.8	-12.1	-178.7	68	0	0	0	0	114.8	F670 V671 L672	F670-S674 PolarHBondContact O-N 3.4Å; V671-S674 PolarHBondContact O-N 2.95Å; V671-S674 PolarHBondContact O-OG 2.91Å; L672-S674 PolarHBondContact O-N 3.44Å
675	H	92.6	Very high	93.5	Very high	61 Å²	61	39.3 Å²	39.3	28%	0.282	21%	0.207	S	C	.	.	H	α-helix	trans	-110.5	-26.5	-176.6	-77.3	-90.4	0	0	0	115.2	I631 N635 V671 L672	I631-H675 HydrophobicContact CG2-CB 4.07Å; N635-H675 HydrophobicContact CB-CB 3.97Å; V671-H675 PolarHBondContact O-CD2 2.67Å; V671-H675 VanDerWaalsContact O-CD2 3.25Å; V671-H675 PolarHBondContact O-N 3.4Å; V671-H675 VanDerWaalsContact O-N 3.11Å; L672-H675 PolarHBondContact O-N 2.97Å
676	F	93.1	Very high	93.5	Very high	11 Å²	11	39.3 Å²	39.3	5%	0.048	21%	0.207	C	C	.	.	S	Bend	trans	-97.8	157.6	176.1	-68.1	-81.8	0	0	0	112	I631 N635 L638 L642 L645 L672 L678 Q681	I631-F676 HydrophobicContact CG2-CD2 4.44Å; I631-F676 HydrophobicContact CG2-CE2 3.77Å; N635-F676 HydrophobicContact CB-CE1 4.5Å; N635-F676 WeakPolarHBondContact O-CE1 3.34Å; L638-F676 HydrophobicContact CB-CE1 3.9Å; L638-F676 HydrophobicContact CB-CZ 3.68Å; L642-F676 HydrophobicContact CB-CD1 4.45Å; L642-F676 HydrophobicContact CB-CE1 4.4Å; L642-F676 HydrophobicContact CD1-CB 4.05Å; L642-F676 HydrophobicContact CD1-CD1 3.91Å; L642-F676 HydrophobicContact CD1-CD2 3.62Å; L642-F676 HydrophobicContact CD1-CE1 4.21Å; L642-F676 HydrophobicContact CD1-CE2 3.93Å; L642-F676 HydrophobicContact CD1-CG 3.58Å; L642-F676 HydrophobicContact CD1-CZ 4.21Å; L642-F676 HydrophobicContact CD2-CB 3.96Å; L642-F676 HydrophobicContact CD2-CD1 3.94Å; L642-F676 HydrophobicContact CD2-CG 4.03Å; L642-F676 HydrophobicContact CG-CD1 4.32Å; L642-F676 HydrophobicContact CG-CG 4.37Å; L645-F676 HydrophobicContact CD2-CE2 4.11Å; L645-F676 HydrophobicContact CD2-CZ 4.37Å; L672-F676 HydrophobicContact CD2-CD2 3.88Å; L672-F676 HydrophobicContact CG-CD2 3.82Å; L672-F676 HydrophobicContact CG-CE2 4.06Å; L672-F676 WeakPolarHBondContact O-CD2 3.27Å; L672-F676 PolarHBondContact O-N 3.2Å; L672-F676 VanDerWaalsContact O-N 3.17Å; F676-L678 PolarHBondContact O-N 2.86Å; F676-Q681 HydrophobicContact CB-CG 4.06Å; F676-Q681 PolarHBondContact O-NE2 3.34Å
677	P	91.3	Very high	93.5	Very high	55 Å²	55	38.5 Å²	38.5	36%	0.357	20%	0.203	S	C	.	.			trans	-61.8	123.5	174.2	-20.8	32.7	0	0	0	111.6	N679 T680 Q681	P677-N679 PolarHBondContact O-N 3.14Å; P677-T680 PolarHBondContact O-N 3.37Å; P677-T680 VanDerWaalsContact O-N 3.09Å; P677-Q681 WeakPolarHBondContact O-CG 3.38Å; P677-Q681 PolarHBondContact O-N 2.9Å; P677-Q681 VanDerWaalsContact O-N 3.14Å
678	L	92.4	Very high	93.5	Very high	40 Å²	40	34.9 Å²	34.9	21%	0.209	19%	0.186	C	C	.	.	H	α-helix	trans	-55.5	-36.8	-176.3	-60.6	172.9	0	0	0	112.4	R673 F676 Q681 F682 L711 M714 M715	R673-L678 WeakPolarHBondContact O-CD2 3.49Å; F676-L678 PolarHBondContact O-N 2.86Å; L678-Q681 WeakPolarHBondContact O-CB 3.41Å; L678-Q681 PolarHBondContact O-N 3.11Å; L678-F682 PolarHBondContact O-N 3.13Å; L678-L711 HydrophobicContact CB-CD1 4.39Å; L678-L711 HydrophobicContact CD2-CD1 3.65Å; L678-M714 HydrophobicContact CD1-CB 3.91Å; L678-M714 WeakPolarHBondContact CD1-O 3.4Å; L678-M714 HydrophobicContact CD2-CE 4.04Å; L678-M715 HydrophobicContact CB-CG 4.13Å
679	N	88.7	Confident	93.4	Very high	88 Å²	88	35 Å²	35	47%	0.471	19%	0.187	S	C	.	.	H	α-helix	trans	-63.1	-44.4	180	-51.6	13.3	0	0	0	111.2	P677 F682 N683 L719	P677-N679 PolarHBondContact O-N 3.14Å; N679-F682 PolarHBondContact O-N 3.47Å; N679-N683 VanDerWaalsContact O-CG 3.32Å; N679-N683 PolarHBondContact O-N 3.25Å; N679-L719 HydrophobicContact CB-CD1 3.8Å; N679-L719 VanDerWaalsContact CG-CD1 3.46Å; N679-L719 WeakPolarHBondContact OD1-CD1 3.43Å
680	T	91.7	Very high	93.2	Very high	66 Å²	66	37.2 Å²	37.2	41%	0.405	20%	0.197	S	C	.	.	H	α-helix	trans	-65.7	-40.2	176.5	-46.6	0	0	0	0	110.9	L642 P677 F682 N683 S684	L642-T680 HydrophobicContact CD2-CG2 3.84Å; P677-T680 PolarHBondContact O-N 3.37Å; P677-T680 VanDerWaalsContact O-N 3.09Å; T680-F682 VanDerWaalsContact C-N 3.34Å; T680-F682 PolarHBondContact O-N 3.17Å; T680-N683 PolarHBondContact O-N 3.26Å; T680-S684 WeakPolarHBondContact O-CB 3.5Å; T680-S684 PolarHBondContact O-N 2.77Å; T680-S684 PolarHBondContact O-OG 2.76Å; T680-S684 VanDerWaalsContact O-OG 3.06Å
681	Q	94	Very high	92.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.6	-39.7	175.5	-61.2	173	55.3	0	0	112.4	L642 L672 R673 F676 P677 L678 C685 Y707 L711	L642-Q681 HydrophobicContact CD1-CG 4.46Å; L642-Q681 HydrophobicContact CD2-CG 4.24Å; L672-Q681 HydrophobicContact CD2-CG 3.99Å; R673-Q681 VanDerWaalsContact CA-OE1 3.26Å; R673-Q681 VanDerWaalsContact CG-OE1 3.24Å; R673-Q681 PolarHBondContact O-NE2 3.01Å; F676-Q681 HydrophobicContact CB-CG 4.06Å; F676-Q681 PolarHBondContact O-NE2 3.34Å; P677-Q681 WeakPolarHBondContact O-CG 3.38Å; P677-Q681 PolarHBondContact O-N 2.9Å; P677-Q681 VanDerWaalsContact O-N 3.14Å; L678-Q681 WeakPolarHBondContact O-CB 3.41Å; L678-Q681 PolarHBondContact O-N 3.11Å; Q681-C685 PolarHBondContact O-N 3.17Å; Q681-C685 PolarHBondContact O-SG 3.18Å; Q681-Y707 PolarHBondContact OE1-OH 2.95Å; Q681-L711 HydrophobicContact CB-CD1 4.05Å; Q681-L711 HydrophobicContact CB-CD2 3.99Å
682	F	93.7	Very high	92.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-69.3	-42.5	178.4	-179.4	-97.8	0	0	0	111.3	L678 N679 T680 C685 C686 M708 L711 I712 M715 L719 V727 L757	L678-F682 PolarHBondContact O-N 3.13Å; N679-F682 PolarHBondContact O-N 3.47Å; T680-F682 VanDerWaalsContact C-N 3.34Å; T680-F682 PolarHBondContact O-N 3.17Å; F682-C685 WeakPolarHBondContact O-CB 3.35Å; F682-C685 PolarHBondContact O-N 3.19Å; F682-C686 PolarHBondContact O-N 3.29Å; F682-C686 PolarHBondContact O-SG 3.3Å; F682-M708 HydrophobicContact CD2-CE 3.95Å; F682-M708 HydrophobicContact CE2-CE 3.56Å; F682-M708 HydrophobicContact CZ-CE 4.25Å; F682-L711 HydrophobicContact CB-CD2 3.75Å; F682-L711 HydrophobicContact CD2-CD2 4.31Å; F682-I712 HydrophobicContact CD2-CG1 4.45Å; F682-I712 HydrophobicContact CE2-CD1 4.33Å; F682-I712 HydrophobicContact CE2-CG1 4.17Å; F682-M715 HydrophobicContact CB-CE 3.76Å; F682-M715 HydrophobicContact CB-SD 4.04Å; F682-M715 HydrophobicContact CD1-CE 3.89Å; F682-M715 HydrophobicContact CD2-CE 3.41Å; F682-M715 VanDerWaalsContact CD2-CE 3.41Å; F682-M715 HydrophobicContact CD2-SD 3.77Å; F682-M715 HydrophobicContact CE1-CE 4.32Å; F682-M715 HydrophobicContact CE2-CE 3.9Å; F682-M715 HydrophobicContact CG-CE 3.4Å; F682-M715 HydrophobicContact CG-SD 4.07Å; F682-M715 HydrophobicContact CZ-CE 4.33Å; F682-L719 HydrophobicContact CD1-CD2 3.81Å; F682-L719 HydrophobicContact CE1-CD2 3.96Å; F682-V727 HydrophobicContact CE1-CG1 3.85Å; F682-V727 HydrophobicContact CE1-CG2 4.26Å; F682-V727 HydrophobicContact CZ-CG1 4.42Å; F682-L757 HydrophobicContact CE2-CD2 4.25Å; F682-L757 HydrophobicContact CZ-CD2 4.22Å
683	N	92.3	Very high	91.4	Very high	74 Å²	74	43.8 Å²	43.8	40%	0.396	25%	0.25	S	C	.	.	H	α-helix	trans	-64.8	-40.6	175.5	-69.4	-6.5	0	0	0	111.4	N679 T680 C685 C686 H687	N679-N683 VanDerWaalsContact O-CG 3.32Å; N679-N683 PolarHBondContact O-N 3.25Å; T680-N683 PolarHBondContact O-N 3.26Å; N683-C685 VanDerWaalsContact C-N 3.31Å; N683-C685 PolarHBondContact O-N 2.96Å; N683-C686 PolarHBondContact O-N 3.35Å; N683-C686 VanDerWaalsContact O-N 3.12Å; N683-H687 WeakPolarHBondContact O-CB 3.27Å; N683-H687 PolarHBondContact O-N 3.22Å
684	S	93.3	Very high	90.7	Very high	16 Å²	16	45.4 Å²	45.4	11%	0.112	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-38.1	170.9	-68.5	0	0	0	0	113.1	T680 F688	T680-S684 WeakPolarHBondContact O-CB 3.5Å; T680-S684 PolarHBondContact O-N 2.77Å; T680-S684 PolarHBondContact O-OG 2.76Å; T680-S684 VanDerWaalsContact O-OG 3.06Å; S684-F688 WeakPolarHBondContact O-CB 3.32Å; S684-F688 PolarHBondContact O-N 3.06Å; S684-F688 VanDerWaalsContact O-N 3.07Å
685	C	94.9	Very high	90.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-46.2	171.6	-66.2	0	0	0	0	111.8	Q681 F682 N683 F688 I689 L704 M708	Q681-C685 PolarHBondContact O-N 3.17Å; Q681-C685 PolarHBondContact O-SG 3.18Å; F682-C685 WeakPolarHBondContact O-CB 3.35Å; F682-C685 PolarHBondContact O-N 3.19Å; N683-C685 VanDerWaalsContact C-N 3.31Å; N683-C685 PolarHBondContact O-N 2.96Å; C685-F688 PolarHBondContact O-N 3.03Å; C685-I689 VanDerWaalsContact O-CG1 3.27Å; C685-I689 WeakPolarHBondContact O-CG1 3.48Å; C685-I689 PolarHBondContact O-N 3.35Å; C685-L704 HydrophobicContact CB-CD1 4.01Å; C685-M708 HydrophobicContact CB-CE 3.94Å; C685-M708 HydrophobicContact CB-CG 3.76Å; C685-M708 HydrophobicContact CB-SD 3.75Å
686	C	94.2	Very high	89.8	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.1	-40.7	178.7	-68.6	0	0	0	0	112.1	F682 N683 I689 M690 V727 A730	F682-C686 PolarHBondContact O-N 3.29Å; F682-C686 PolarHBondContact O-SG 3.3Å; N683-C686 PolarHBondContact O-N 3.35Å; N683-C686 VanDerWaalsContact O-N 3.12Å; C686-I689 WeakPolarHBondContact O-CB 3.26Å; C686-I689 PolarHBondContact O-N 2.87Å; C686-I689 VanDerWaalsContact O-N 3.17Å; C686-M690 WeakPolarHBondContact O-CG 3.45Å; C686-M690 PolarHBondContact O-N 3.32Å; C686-M690 VanDerWaalsContact O-N 3.09Å; C686-V727 HydrophobicContact CB-CG2 4.18Å; C686-A730 HydrophobicContact CB-CB 3.65Å
687	H	93.1	Very high	89.6	Confident	82 Å²	82	48 Å²	48	38%	0.38	28%	0.275	S	S	.	.	H	α-helix	trans	-59.4	-49.3	174.5	-169.2	59.6	0	0	0	111.1	Y643 N683 I689 M690 D691 E726	Y643-H687 HydrophobicContact CE2-CB 4.29Å; Y643-H687 AromaticContact CE2-CD2 3.63Å; Y643-H687 AromaticContact CZ-CD2 3.75Å; N683-H687 WeakPolarHBondContact O-CB 3.27Å; N683-H687 PolarHBondContact O-N 3.22Å; H687-I689 PolarHBondContact O-N 3.39Å; H687-M690 CarbonylContact O-C 3.4Å; H687-M690 WeakPolarHBondContact O-CA 3.48Å; H687-M690 PolarHBondContact O-N 3.13Å; H687-D691 WeakPolarHBondContact O-CB 3.24Å; H687-D691 PolarHBondContact O-N 3.41Å; H687-E726 IonicContact CE1-OE1 3.17Å; H687-E726 IonicContact CG-OE1 2.62Å; H687-E726 IonicContact ND1-OE1 2.74Å; H687-E726 PolarHBondContact ND1-OE1 3.06Å; H687-E726 IonicContact ND1-OE2 3.4Å
688	F	93.9	Very high	89.7	Confident	1 Å²	1	49 Å²	49	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-25.4	176	179.1	-116	0	0	0	114.2	Y643 I647 Y651 S684 C685 H694 P696 V700 L704	Y643-F688 HydrophobicContact CE2-CB 3.86Å; I647-F688 HydrophobicContact CD1-CB 3.56Å; I647-F688 HydrophobicContact CD1-CD1 3.58Å; I647-F688 HydrophobicContact CD1-CD2 3.64Å; I647-F688 HydrophobicContact CD1-CE1 4.13Å; I647-F688 HydrophobicContact CD1-CE2 4.18Å; I647-F688 HydrophobicContact CD1-CG 3.3Å; I647-F688 HydrophobicContact CD1-CZ 4.4Å; I647-F688 HydrophobicContact CG1-CB 4.2Å; I647-F688 HydrophobicContact CG1-CD2 3.75Å; I647-F688 HydrophobicContact CG1-CE2 4.23Å; I647-F688 HydrophobicContact CG1-CG 3.94Å; I647-F688 HydrophobicContact CG2-CD2 3.9Å; I647-F688 HydrophobicContact CG2-CE2 3.52Å; I647-F688 HydrophobicContact CG2-CZ 4.03Å; Y651-F688 HydrophobicContact CD2-CZ 4.38Å; Y651-F688 AromaticContact CE2-CE2 3.8Å; Y651-F688 HydrophobicContact CE2-CE2 3.8Å; Y651-F688 AromaticContact CE2-CZ 3.59Å; Y651-F688 HydrophobicContact CE2-CZ 3.59Å; S684-F688 WeakPolarHBondContact O-CB 3.32Å; S684-F688 PolarHBondContact O-N 3.06Å; S684-F688 VanDerWaalsContact O-N 3.07Å; C685-F688 PolarHBondContact O-N 3.03Å; F688-H694 HydrophobicContact CD2-CB 4.11Å; F688-H694 HydrophobicContact CE2-CB 3.57Å; F688-H694 AromaticContact CE2-CG 3.72Å; F688-H694 HydrophobicContact CZ-CB 4.48Å; F688-P696 HydrophobicContact CE1-CB 4.21Å; F688-P696 HydrophobicContact CZ-CB 4.05Å; F688-V700 HydrophobicContact CE1-CG1 3.85Å; F688-V700 HydrophobicContact CZ-CG1 3.86Å; F688-L704 HydrophobicContact CD1-CD1 4.15Å; F688-L704 HydrophobicContact CD1-CD2 3.73Å; F688-L704 HydrophobicContact CE1-CD2 3.99Å
689	I	94	Very high	89.7	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-73.4	-31	172.2	-70.3	167.1	0	0	0	110.9	C685 C686 H687 L704 M708 A730 K733 I734 W737	C685-I689 VanDerWaalsContact O-CG1 3.27Å; C685-I689 WeakPolarHBondContact O-CG1 3.48Å; C685-I689 PolarHBondContact O-N 3.35Å; C686-I689 WeakPolarHBondContact O-CB 3.26Å; C686-I689 PolarHBondContact O-N 2.87Å; C686-I689 VanDerWaalsContact O-N 3.17Å; H687-I689 PolarHBondContact O-N 3.39Å; I689-L704 HydrophobicContact CD1-CD2 4.03Å; I689-L704 HydrophobicContact CG1-CD2 3.64Å; I689-M708 HydrophobicContact CD1-CE 4.34Å; I689-M708 HydrophobicContact CD1-SD 3.75Å; I689-A730 HydrophobicContact CB-CB 4.13Å; I689-A730 HydrophobicContact CG2-CB 3.92Å; I689-K733 HydrophobicContact CG2-CB 3.81Å; I689-K733 HydrophobicContact CG2-CD 3.81Å; I689-K733 HydrophobicContact CG2-CG 3.94Å; I689-K733 VanDerWaalsContact O-CD 3.31Å; I689-K733 WeakPolarHBondContact O-CD 3.26Å; I689-K733 WeakPolarHBondContact O-CE 3.3Å; I689-K733 PolarHBondContact O-NZ 3.33Å; I689-I734 HydrophobicContact CD1-CD1 3.72Å; I689-I734 HydrophobicContact CD1-CG1 3.81Å; I689-W737 HydrophobicContact CD1-CZ3 4.48Å; I689-W737 HydrophobicContact CG1-CH2 4.01Å; I689-W737 HydrophobicContact CG1-CZ3 4.26Å; I689-W737 HydrophobicContact CG2-CH2 4.25Å
690	M	91.4	Very high	90	Very high	53 Å²	53	50.4 Å²	50.4	26%	0.261	27%	0.27	S	S	.	.	H	α-helix	trans	-95.4	-23.1	-177.2	-68.5	-55.1	-59.6	0	0	114.4	C686 H687 N692 E726 N729 A730 K733	C686-M690 WeakPolarHBondContact O-CG 3.45Å; C686-M690 PolarHBondContact O-N 3.32Å; C686-M690 VanDerWaalsContact O-N 3.09Å; H687-M690 CarbonylContact O-C 3.4Å; H687-M690 WeakPolarHBondContact O-CA 3.48Å; H687-M690 PolarHBondContact O-N 3.13Å; M690-N692 PolarHBondContact O-N 3.04Å; M690-E726 HydrophobicContact CB-CG 4.27Å; M690-E726 HydrophobicContact CG-CG 4.03Å; M690-N729 HydrophobicContact CE-CB 3.59Å; M690-N729 HydrophobicContact SD-CB 3.67Å; M690-A730 HydrophobicContact CG-CB 4.06Å; M690-K733 HydrophobicContact SD-CD 4.25Å
691	D	88.5	Confident	90.1	Very high	36 Å²	36	48.3 Å²	48.3	19%	0.193	26%	0.255	C	S	.	.			trans	-58.3	124.1	175.6	-177.3	2.8	0	0	0	111.1	Y643 H687 A693 H694	Y643-D691 PolarHBondContact OH-OD2 2.89Å; Y643-D691 VanDerWaalsContact OH-OD2 3.07Å; H687-D691 WeakPolarHBondContact O-CB 3.24Å; H687-D691 PolarHBondContact O-N 3.41Å; D691-A693 VanDerWaalsContact OD1-CB 3.29Å; D691-A693 WeakPolarHBondContact OD1-CB 3.45Å; D691-A693 PolarHBondContact OD1-N 3.39Å; D691-H694 IonicContact OD2-CE1 2.88Å; D691-H694 IonicContact OD2-CG 3.38Å; D691-H694 IonicContact OD2-ND1 3Å; D691-H694 PolarHBondContact OD2-ND1 3.02Å
692	N	79.5	Confident	90.1	Very high	142 Å²	142	49.6 Å²	49.6	76%	0.759	26%	0.263	S	S	*	.	S	Bend	trans	-91.4	-10.2	-179.8	-64	-64.6	0	0	0	113	M690 H694	M690-N692 PolarHBondContact O-N 3.04Å; N692-H694 VanDerWaalsContact C-N 3.27Å
693	A	80.1	Confident	90.2	Very high	86 Å²	86	50.3 Å²	50.3	71%	0.711	27%	0.268	S	S	*	.	S	Bend	trans	-71.9	-25.5	172.5	0	0	0	0	0	111.9	D691	D691-A693 VanDerWaalsContact OD1-CB 3.29Å; D691-A693 WeakPolarHBondContact OD1-CB 3.45Å; D691-A693 PolarHBondContact OD1-N 3.39Å
694	H	79.8	Confident	90.3	Very high	65 Å²	65	46.8 Å²	46.8	30%	0.301	25%	0.249	S	C	.	.			trans	-105.1	123.1	178.2	-68	95	0	0	0	111.7	F688 D691 N692 P696	F688-H694 HydrophobicContact CD2-CB 4.11Å; F688-H694 HydrophobicContact CE2-CB 3.57Å; F688-H694 AromaticContact CE2-CG 3.72Å; F688-H694 HydrophobicContact CZ-CB 4.48Å; D691-H694 IonicContact OD2-CE1 2.88Å; D691-H694 IonicContact OD2-CG 3.38Å; D691-H694 IonicContact OD2-ND1 3Å; D691-H694 PolarHBondContact OD2-ND1 3.02Å; N692-H694 VanDerWaalsContact C-N 3.27Å; H694-P696 VanDerWaalsContact C-CD 3.48Å; H694-P696 WeakPolarHBondContact O-CD 3.33Å
695	T	81	Confident	90.5	Very high	126 Å²	126	46 Å²	46	77%	0.773	24%	0.244	S	C	*	.			trans	-104.4	83.8	171	57.3	0	0	0	0	110.2	N697	T695-N697 PolarHBondContact O-N 3.23Å
696	P	84.7	Confident	90.5	Very high	22 Å²	22	48.9 Å²	48.9	14%	0.143	26%	0.257	C	S	.	.			trans	-64.8	122.9	-175.7	24.5	-34.2	0	0	0	111.8	F688 H694 V700 K701	F688-P696 HydrophobicContact CE1-CB 4.21Å; F688-P696 HydrophobicContact CZ-CB 4.05Å; H694-P696 VanDerWaalsContact C-CD 3.48Å; H694-P696 WeakPolarHBondContact O-CD 3.33Å; P696-V700 HydrophobicContact CB-CB 3.92Å; P696-V700 HydrophobicContact CB-CG1 3.65Å; P696-K701 HydrophobicContact CB-CG 4.29Å; P696-K701 HydrophobicContact CG-CG 4.43Å
697	N	89.9	Confident	90.6	Very high	54 Å²	54	49.2 Å²	49.2	29%	0.289	26%	0.258	S	S	.	.			trans	-67	167	173.5	74	56.2	0	0	0	111.1	H655 T695 R699 V700 K701	H655-N697 PolarHBondContact NE2-ND2 3.08Å; T695-N697 PolarHBondContact O-N 3.23Å; N697-R699 PolarHBondContact O-N 3.1Å; N697-R699 VanDerWaalsContact O-N 3.14Å; N697-R699 WeakPolarHBondContact OD1-CA 3.44Å; N697-R699 WeakPolarHBondContact OD1-CB 3.47Å; N697-R699 PolarHBondContact OD1-N 2.95Å; N697-V700 WeakPolarHBondContact O-CB 3.36Å; N697-V700 PolarHBondContact O-N 3.48Å; N697-V700 PolarHBondContact OD1-N 3.4Å; N697-V700 VanDerWaalsContact OD1-N 3.07Å; N697-K701 PolarHBondContact O-N 3.02Å
698	F	92.5	Very high	90.7	Very high	74 Å²	74	45.3 Å²	45.3	33%	0.325	24%	0.24	S	C	.	.	H	α-helix	trans	-61.2	-26.8	-174.4	-49.4	-61.4	0	0	0	114.6	K701 T702 E740 K742 V746	F698-K701 HydrophobicContact CD1-CD 4.49Å; F698-T702 WeakPolarHBondContact O-CB 3.18Å; F698-T702 PolarHBondContact O-N 2.89Å; F698-T702 VanDerWaalsContact O-N 3.1Å; F698-T702 PolarHBondContact O-OG1 3.42Å; F698-E740 HydrophobicContact CD1-CG 4.11Å; F698-E740 VanDerWaalsContact CE1-CD 3.44Å; F698-E740 HydrophobicContact CE1-CG 4.23Å; F698-E740 WeakPolarHBondContact CE1-OE1 3.3Å; F698-E740 WeakPolarHBondContact CE1-OE2 3.43Å; F698-K742 HydrophobicContact CD1-CB 4.45Å; F698-K742 HydrophobicContact CD2-CB 4.4Å; F698-K742 HydrophobicContact CE1-CB 3.84Å; F698-K742 HydrophobicContact CE1-CD 4.29Å; F698-K742 HydrophobicContact CE2-CB 3.77Å; F698-K742 HydrophobicContact CE2-CD 4.12Å; F698-K742 HydrophobicContact CZ-CB 3.48Å; F698-K742 VanDerWaalsContact CZ-CB 3.48Å; F698-K742 HydrophobicContact CZ-CD 3.48Å; F698-K742 VanDerWaalsContact CZ-CD 3.48Å; F698-K742 HydrophobicContact CZ-CG 4.11Å; F698-V746 HydrophobicContact CB-CG2 3.96Å; F698-V746 WeakPolarHBondContact O-CG2 3.3Å
699	R	92.8	Very high	90.7	Very high	158 Å²	158	46.6 Å²	46.6	60%	0.596	25%	0.246	S	C	*	.	H	α-helix	trans	-73	-45.3	173.3	-59.4	-175.6	-177.9	-179	-0.6	110.9	S654 N697 K701 T702 C703	S654-R699 WeakPolarHBondContact O-CD 3.29Å; S654-R699 PolarHBondContact O-NH1 3.44Å; N697-R699 PolarHBondContact O-N 3.1Å; N697-R699 VanDerWaalsContact O-N 3.14Å; N697-R699 WeakPolarHBondContact OD1-CA 3.44Å; N697-R699 WeakPolarHBondContact OD1-CB 3.47Å; N697-R699 PolarHBondContact OD1-N 2.95Å; R699-K701 VanDerWaalsContact C-N 3.33Å; R699-K701 PolarHBondContact O-N 3.3Å; R699-T702 WeakPolarHBondContact O-CB 3.19Å; R699-T702 PolarHBondContact O-N 2.88Å; R699-C703 PolarHBondContact O-N 2.73Å; R699-C703 PolarHBondContact O-SG 2.69Å; R699-C703 VanDerWaalsContact O-SG 3.38Å
700	V	94.1	Very high	90.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.7	-46.2	174.5	-179.9	0	0	0	0	110.6	Y651 S654 F688 P696 N697 T702 C703 L704	Y651-V700 HydrophobicContact CD1-CG2 3.65Å; Y651-V700 HydrophobicContact CE1-CG2 3.75Å; Y651-V700 HydrophobicContact CE2-CG1 4.43Å; Y651-V700 HydrophobicContact CG-CG2 4.21Å; S654-V700 WeakPolarHBondContact OG-CG2 3.41Å; F688-V700 HydrophobicContact CE1-CG1 3.85Å; F688-V700 HydrophobicContact CZ-CG1 3.86Å; P696-V700 HydrophobicContact CB-CB 3.92Å; P696-V700 HydrophobicContact CB-CG1 3.65Å; N697-V700 WeakPolarHBondContact O-CB 3.36Å; N697-V700 PolarHBondContact O-N 3.48Å; N697-V700 PolarHBondContact OD1-N 3.4Å; N697-V700 VanDerWaalsContact OD1-N 3.07Å; V700-T702 VanDerWaalsContact C-N 3.3Å; V700-T702 PolarHBondContact O-N 3.1Å; V700-C703 PolarHBondContact O-N 3.04Å; V700-L704 VanDerWaalsContact O-CB 3.26Å; V700-L704 WeakPolarHBondContact O-CB 3.31Å; V700-L704 PolarHBondContact O-N 3.47Å
701	K	94.3	Very high	90.8	Very high	22 Å²	22	46.4 Å²	46.4	10%	0.096	25%	0.246	C	C	.	.	H	α-helix	trans	-55.2	-44.3	172.9	-69	-171.7	-176.6	-169.7	0	111.7	P696 N697 F698 R699 L704 L705 W737 E740 V746	P696-K701 HydrophobicContact CB-CG 4.29Å; P696-K701 HydrophobicContact CG-CG 4.43Å; N697-K701 PolarHBondContact O-N 3.02Å; F698-K701 HydrophobicContact CD1-CD 4.49Å; R699-K701 VanDerWaalsContact C-N 3.33Å; R699-K701 PolarHBondContact O-N 3.3Å; K701-L704 PolarHBondContact O-N 2.97Å; K701-L705 WeakPolarHBondContact O-CB 3.45Å; K701-L705 VanDerWaalsContact O-CD1 3.31Å; K701-L705 WeakPolarHBondContact O-CD1 3.49Å; K701-L705 WeakPolarHBondContact O-CG 3.42Å; K701-L705 PolarHBondContact O-N 3.24Å; K701-W737 HydrophobicContact CB-CZ3 4.34Å; K701-W737 HydrophobicContact CD-CD2 3.89Å; K701-W737 HydrophobicContact CD-CE3 4.13Å; K701-W737 HydrophobicContact CD-CG 4.43Å; K701-W737 HydrophobicContact CD-CH2 4.21Å; K701-W737 HydrophobicContact CD-CZ2 4.01Å; K701-W737 HydrophobicContact CD-CZ3 4.28Å; K701-W737 HydrophobicContact CG-CE3 4.33Å; K701-W737 HydrophobicContact CG-CH2 3.98Å; K701-W737 HydrophobicContact CG-CZ2 4.23Å; K701-W737 HydrophobicContact CG-CZ3 4.04Å; K701-W737 VanDerWaalsContact NZ-NE1 3.17Å; K701-E740 IonicContact NZ-OE2 3.89Å; K701-E740 PolarHBondContact NZ-OE2 2.83Å; K701-V746 HydrophobicContact CB-CG1 4.29Å; K701-V746 HydrophobicContact CB-CG2 3.8Å; K701-V746 HydrophobicContact CD-CG1 4.07Å; K701-V746 HydrophobicContact CD-CG2 4.36Å
702	T	94.6	Very high	91.1	Very high	28 Å²	28	44.8 Å²	44.8	17%	0.172	24%	0.237	C	C	.	.	H	α-helix	trans	-66.3	-45.4	-178.8	-57.8	0	0	0	0	111.6	F698 R699 V700 L705 E706 D745 V746	F698-T702 WeakPolarHBondContact O-CB 3.18Å; F698-T702 PolarHBondContact O-N 2.89Å; F698-T702 VanDerWaalsContact O-N 3.1Å; F698-T702 PolarHBondContact O-OG1 3.42Å; R699-T702 WeakPolarHBondContact O-CB 3.19Å; R699-T702 PolarHBondContact O-N 2.88Å; V700-T702 VanDerWaalsContact C-N 3.3Å; V700-T702 PolarHBondContact O-N 3.1Å; T702-L705 PolarHBondContact O-N 3.48Å; T702-E706 WeakPolarHBondContact O-CB 3.45Å; T702-E706 PolarHBondContact O-N 3.46Å; T702-D745 HydrophobicContact CG2-CB 4.23Å; T702-V746 WeakPolarHBondContact OG1-CG2 3.42Å
703	C	94.9	Very high	91.6	Very high	15 Å²	15	43.1 Å²	43.1	10%	0.101	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-44.6	175.6	-62.6	0	0	0	0	112.3	L650 Q653 R699 V700 E706 Y707	L650-C703 HydrophobicContact CD2-CB 3.98Å; Q653-C703 HydrophobicContact CB-CB 4.43Å; R699-C703 PolarHBondContact O-N 2.73Å; R699-C703 PolarHBondContact O-SG 2.69Å; R699-C703 VanDerWaalsContact O-SG 3.38Å; V700-C703 PolarHBondContact O-N 3.04Å; C703-E706 PolarHBondContact O-N 3.35Å; C703-Y707 WeakPolarHBondContact O-CB 3.39Å; C703-Y707 PolarHBondContact O-N 3.24Å
704	L	95.8	Very high	92	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-48.8	176.4	173.8	66.3	0	0	0	111.8	L650 C685 F688 I689 V700 K701 E706 Y707 M708 W737	L650-L704 HydrophobicContact CD1-CB 4.17Å; L650-L704 HydrophobicContact CD1-CD1 3.66Å; C685-L704 HydrophobicContact CB-CD1 4.01Å; F688-L704 HydrophobicContact CD1-CD1 4.15Å; F688-L704 HydrophobicContact CD1-CD2 3.73Å; F688-L704 HydrophobicContact CE1-CD2 3.99Å; I689-L704 HydrophobicContact CD1-CD2 4.03Å; I689-L704 HydrophobicContact CG1-CD2 3.64Å; V700-L704 VanDerWaalsContact O-CB 3.26Å; V700-L704 WeakPolarHBondContact O-CB 3.31Å; V700-L704 PolarHBondContact O-N 3.47Å; K701-L704 PolarHBondContact O-N 2.97Å; L704-E706 VanDerWaalsContact C-N 3.33Å; L704-E706 PolarHBondContact O-N 3.41Å; L704-Y707 PolarHBondContact O-N 3.2Å; L704-M708 HydrophobicContact CD1-CG 4.44Å; L704-M708 HydrophobicContact CD1-SD 4.4Å; L704-M708 HydrophobicContact CG-SD 4.41Å; L704-M708 WeakPolarHBondContact O-CG 3.44Å; L704-M708 PolarHBondContact O-N 3.43Å; L704-W737 HydrophobicContact CD2-CH2 4.42Å; L704-W737 HydrophobicContact CD2-CZ3 4.26Å
705	L	96.4	Very high	92.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67	-34.6	179	-67.6	165.1	0	0	0	111.9	K701 T702 K709 I734 W737 V746 M749 A750 V753	K701-L705 WeakPolarHBondContact O-CB 3.45Å; K701-L705 VanDerWaalsContact O-CD1 3.31Å; K701-L705 WeakPolarHBondContact O-CD1 3.49Å; K701-L705 WeakPolarHBondContact O-CG 3.42Å; K701-L705 PolarHBondContact O-N 3.24Å; T702-L705 PolarHBondContact O-N 3.48Å; L705-K709 WeakPolarHBondContact O-CB 3.4Å; L705-K709 PolarHBondContact O-N 3.09Å; L705-I734 HydrophobicContact CD2-CG1 4.06Å; L705-I734 HydrophobicContact CD2-CG2 3.84Å; L705-W737 HydrophobicContact CD1-CE3 4.03Å; L705-W737 HydrophobicContact CD2-CE3 4.18Å; L705-W737 HydrophobicContact CD2-CZ3 4.44Å; L705-W737 HydrophobicContact CG-CE3 4.31Å; L705-W737 HydrophobicContact CG-CZ3 4.48Å; L705-V746 HydrophobicContact CD1-CG1 4.17Å; L705-M749 HydrophobicContact CB-CB 3.85Å; L705-M749 HydrophobicContact CB-CG 3.52Å; L705-M749 HydrophobicContact CD1-CB 4.31Å; L705-A750 HydrophobicContact CD1-CB 3.91Å; L705-A750 HydrophobicContact CD2-CB 4.42Å; L705-V753 HydrophobicContact CB-CG2 4.05Å; L705-V753 HydrophobicContact CD2-CB 4.35Å; L705-V753 HydrophobicContact CD2-CG2 3.91Å; L705-V753 WeakPolarHBondContact O-CG2 3.45Å
706	E	95.1	Very high	92.4	Very high	59 Å²	59	37.1 Å²	37.1	28%	0.276	18%	0.183	S	C	.	.	H	α-helix	trans	-64.5	-46.7	173.5	180	150.2	-111.3	0	0	111.4	T702 C703 L704 K709 D710 M749	T702-E706 WeakPolarHBondContact O-CB 3.45Å; T702-E706 PolarHBondContact O-N 3.46Å; C703-E706 PolarHBondContact O-N 3.35Å; L704-E706 VanDerWaalsContact C-N 3.33Å; L704-E706 PolarHBondContact O-N 3.41Å; E706-K709 WeakPolarHBondContact O-CB 3.44Å; E706-K709 WeakPolarHBondContact O-CE 2.74Å; E706-K709 PolarHBondContact O-N 3.34Å; E706-K709 IonicContact OE1-NZ 2.69Å; E706-D710 PolarHBondContact O-N 2.84Å; E706-D710 VanDerWaalsContact O-N 3.11Å; E706-M749 HydrophobicContact CB-CE 3.96Å; E706-M749 HydrophobicContact CB-CG 4.29Å; E706-M749 HydrophobicContact CB-SD 4.22Å; E706-M749 HydrophobicContact CG-CE 4.27Å
707	Y	96.1	Very high	92	Very high	8 Å²	8	38.9 Å²	38.9	3%	0.031	20%	0.195	C	C	.	.	H	α-helix	trans	-61.3	-47.6	176	177	-94.2	0	0	0	111.9	L646 L669 L672 R673 Q681 C703 L704 K709 D710 L711	L646-Y707 HydrophobicContact CD1-CD1 4.09Å; L646-Y707 HydrophobicContact CD1-CD2 4.42Å; L646-Y707 HydrophobicContact CD1-CE1 3.57Å; L646-Y707 HydrophobicContact CD1-CE2 3.93Å; L646-Y707 HydrophobicContact CD1-CG 4.47Å; L646-Y707 VanDerWaalsContact CD1-CZ 3.45Å; L646-Y707 HydrophobicContact CD2-CE1 3.98Å; L646-Y707 HydrophobicContact CG-CE1 4.42Å; L669-Y707 HydrophobicContact CB-CD2 4.14Å; L669-Y707 HydrophobicContact CB-CE2 4.19Å; L669-Y707 HydrophobicContact CD2-CD2 3.82Å; L669-Y707 HydrophobicContact CD2-CE2 3.72Å; L669-Y707 HydrophobicContact CG-CD2 4.38Å; L672-Y707 WeakPolarHBondContact CD2-OH 3.25Å; R673-Y707 HydrophobicContact CG-CD2 4.48Å; R673-Y707 HydrophobicContact CG-CE2 3.56Å; Q681-Y707 PolarHBondContact OE1-OH 2.95Å; C703-Y707 WeakPolarHBondContact O-CB 3.39Å; C703-Y707 PolarHBondContact O-N 3.24Å; L704-Y707 PolarHBondContact O-N 3.2Å; Y707-K709 VanDerWaalsContact C-N 3.33Å; Y707-K709 PolarHBondContact O-N 3.33Å; Y707-D710 PolarHBondContact O-N 3.27Å; Y707-L711 HydrophobicContact CE1-CD2 4.28Å; Y707-L711 WeakPolarHBondContact O-CB 3.33Å; Y707-L711 PolarHBondContact O-N 3.26Å
708	M	95.3	Very high	91.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.2	-42	175	-71.3	-176.8	83.6	0	0	111.9	F682 C685 I689 L704 D710 L711 I712 I734 V753	F682-M708 HydrophobicContact CD2-CE 3.95Å; F682-M708 HydrophobicContact CE2-CE 3.56Å; F682-M708 HydrophobicContact CZ-CE 4.25Å; C685-M708 HydrophobicContact CB-CE 3.94Å; C685-M708 HydrophobicContact CB-CG 3.76Å; C685-M708 HydrophobicContact CB-SD 3.75Å; I689-M708 HydrophobicContact CD1-CE 4.34Å; I689-M708 HydrophobicContact CD1-SD 3.75Å; L704-M708 HydrophobicContact CD1-CG 4.44Å; L704-M708 HydrophobicContact CD1-SD 4.4Å; L704-M708 HydrophobicContact CG-SD 4.41Å; L704-M708 WeakPolarHBondContact O-CG 3.44Å; L704-M708 PolarHBondContact O-N 3.43Å; M708-D710 VanDerWaalsContact C-N 3.3Å; M708-D710 PolarHBondContact O-N 3.16Å; M708-L711 PolarHBondContact O-N 3.25Å; M708-L711 VanDerWaalsContact O-N 3.14Å; M708-I712 HydrophobicContact CB-CD1 4.5Å; M708-I712 WeakPolarHBondContact O-CB 3.37Å; M708-I712 VanDerWaalsContact O-CD1 3.31Å; M708-I712 WeakPolarHBondContact O-CD1 3.5Å; M708-I712 WeakPolarHBondContact O-CG1 3.25Å; M708-I712 PolarHBondContact O-N 3.29Å; M708-I734 HydrophobicContact CE-CD1 3.81Å; M708-I734 HydrophobicContact SD-CD1 3.99Å; M708-V753 HydrophobicContact CB-CG2 4.26Å
709	K	94.2	Very high	90.1	Very high	28 Å²	28	37.4 Å²	37.4	12%	0.122	19%	0.19	C	C	.	.	H	α-helix	trans	-59.8	-36.2	176.6	167.1	-121.2	63.7	-174.6	0	112.5	L705 E706 Y707 M749 R752 V753 K756	L705-K709 WeakPolarHBondContact O-CB 3.4Å; L705-K709 PolarHBondContact O-N 3.09Å; E706-K709 WeakPolarHBondContact O-CB 3.44Å; E706-K709 WeakPolarHBondContact O-CE 2.74Å; E706-K709 PolarHBondContact O-N 3.34Å; E706-K709 IonicContact OE1-NZ 2.69Å; Y707-K709 VanDerWaalsContact C-N 3.33Å; Y707-K709 PolarHBondContact O-N 3.33Å; K709-M749 HydrophobicContact CD-SD 4.1Å; K709-R752 HydrophobicContact CG-CB 4.39Å; K709-V753 HydrophobicContact CB-CG2 3.95Å; K709-K756 HydrophobicContact CG-CG 4.45Å
710	D	94	Very high	89.4	Confident	51 Å²	51	30 Å²	30	27%	0.273	16%	0.162	S	C	.	.	H	α-helix	trans	-85.5	-19.3	174.4	-69.2	-41.3	0	0	0	114	R673 E706 Y707 M708	R673-D710 PolarHBondContact NH1-O 3.49Å; E706-D710 PolarHBondContact O-N 2.84Å; E706-D710 VanDerWaalsContact O-N 3.11Å; Y707-D710 PolarHBondContact O-N 3.27Å; M708-D710 VanDerWaalsContact C-N 3.3Å; M708-D710 PolarHBondContact O-N 3.16Å
711	L	94.2	Very high	88.6	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-74.4	-46.6	173.5	-172.6	72.7	0	0	0	110.9	R673 L678 Q681 F682 Y707 M708 L713 M714 M715	R673-L711 HydrophobicContact CG-CD1 3.89Å; L678-L711 HydrophobicContact CB-CD1 4.39Å; L678-L711 HydrophobicContact CD2-CD1 3.65Å; Q681-L711 HydrophobicContact CB-CD1 4.05Å; Q681-L711 HydrophobicContact CB-CD2 3.99Å; F682-L711 HydrophobicContact CB-CD2 3.75Å; F682-L711 HydrophobicContact CD2-CD2 4.31Å; Y707-L711 HydrophobicContact CE1-CD2 4.28Å; Y707-L711 WeakPolarHBondContact O-CB 3.33Å; Y707-L711 PolarHBondContact O-N 3.26Å; M708-L711 PolarHBondContact O-N 3.25Å; M708-L711 VanDerWaalsContact O-N 3.14Å; L711-L713 PolarHBondContact O-N 3.39Å; L711-M714 PolarHBondContact O-N 3.23Å; L711-M715 HydrophobicContact CB-SD 4.46Å; L711-M715 HydrophobicContact CD2-SD 4.16Å; L711-M715 HydrophobicContact CG-CG 4.44Å; L711-M715 HydrophobicContact CG-SD 3.82Å; L711-M715 WeakPolarHBondContact O-CG 3.49Å; L711-M715 PolarHBondContact O-N 2.84Å
712	I	93.5	Very high	88	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.015	19%	0.194	C	C	.	.	H	α-helix	trans	-58.2	-33	179.2	-69.2	159.5	0	0	0	112	F682 M708 M714 M715 V753 K756 L757 L760	F682-I712 HydrophobicContact CD2-CG1 4.45Å; F682-I712 HydrophobicContact CE2-CD1 4.33Å; F682-I712 HydrophobicContact CE2-CG1 4.17Å; M708-I712 HydrophobicContact CB-CD1 4.5Å; M708-I712 WeakPolarHBondContact O-CB 3.37Å; M708-I712 VanDerWaalsContact O-CD1 3.31Å; M708-I712 WeakPolarHBondContact O-CD1 3.5Å; M708-I712 WeakPolarHBondContact O-CG1 3.25Å; M708-I712 PolarHBondContact O-N 3.29Å; I712-M714 PolarHBondContact O-N 3.45Å; I712-M714 VanDerWaalsContact O-N 3.13Å; I712-M715 VanDerWaalsContact CA-SD 3.58Å; I712-M715 HydrophobicContact CB-SD 4.4Å; I712-M715 HydrophobicContact CG1-SD 3.99Å; I712-M715 PolarHBondContact O-N 2.88Å; I712-V753 HydrophobicContact CD1-CG1 3.88Å; I712-K756 HydrophobicContact CB-CB 4.45Å; I712-K756 HydrophobicContact CG2-CB 3.87Å; I712-K756 WeakPolarHBondContact CG2-O 3.45Å; I712-L757 HydrophobicContact CD1-CD2 3.61Å; I712-L757 HydrophobicContact CD1-CG 3.88Å; I712-L757 HydrophobicContact CG1-CD2 4.02Å; I712-L757 HydrophobicContact CG2-CD2 4.48Å; I712-L760 HydrophobicContact CG2-CB 4.17Å; I712-L760 HydrophobicContact CG2-CD2 4.14Å
713	L	90.7	Very high	87.5	Confident	107 Å²	107	35 Å²	35	56%	0.56	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-7.7	175.2	-76.2	172.2	0	0	0	114.7	L711 K756	L711-L713 PolarHBondContact O-N 3.39Å; L713-K756 HydrophobicContact CD2-CD 3.77Å; L713-K756 HydrophobicContact CG-CD 4.21Å
714	M	87.6	Confident	87.2	Confident	84 Å²	84	37.1 Å²	37.1	41%	0.414	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.6	-6.9	-179.6	-55.5	-177.3	-56.9	0	0	113.1	R673 L678 L711 I712	R673-M714 HydrophobicContact CB-CE 3.87Å; R673-M714 HydrophobicContact CG-CE 4.23Å; L678-M714 HydrophobicContact CD1-CB 3.91Å; L678-M714 WeakPolarHBondContact CD1-O 3.4Å; L678-M714 HydrophobicContact CD2-CE 4.04Å; L711-M714 PolarHBondContact O-N 3.23Å; I712-M714 PolarHBondContact O-N 3.45Å; I712-M714 VanDerWaalsContact O-N 3.13Å
715	M	86.5	Confident	86.9	Confident	12 Å²	12	43.1 Å²	43.1	6%	0.059	24%	0.243	C	C	.	.	S	Bend	trans	-79.4	154.4	-179	-72.4	157.8	61.7	0	0	111.6	L678 F682 L711 I712 L719 L760	L678-M715 HydrophobicContact CB-CG 4.13Å; F682-M715 HydrophobicContact CB-CE 3.76Å; F682-M715 HydrophobicContact CB-SD 4.04Å; F682-M715 HydrophobicContact CD1-CE 3.89Å; F682-M715 HydrophobicContact CD2-CE 3.41Å; F682-M715 VanDerWaalsContact CD2-CE 3.41Å; F682-M715 HydrophobicContact CD2-SD 3.77Å; F682-M715 HydrophobicContact CE1-CE 4.32Å; F682-M715 HydrophobicContact CE2-CE 3.9Å; F682-M715 HydrophobicContact CG-CE 3.4Å; F682-M715 HydrophobicContact CG-SD 4.07Å; F682-M715 HydrophobicContact CZ-CE 4.33Å; L711-M715 HydrophobicContact CB-SD 4.46Å; L711-M715 HydrophobicContact CD2-SD 4.16Å; L711-M715 HydrophobicContact CG-CG 4.44Å; L711-M715 HydrophobicContact CG-SD 3.82Å; L711-M715 WeakPolarHBondContact O-CG 3.49Å; L711-M715 PolarHBondContact O-N 2.84Å; I712-M715 VanDerWaalsContact CA-SD 3.58Å; I712-M715 HydrophobicContact CB-SD 4.4Å; I712-M715 HydrophobicContact CG1-SD 3.99Å; I712-M715 PolarHBondContact O-N 2.88Å; M715-L719 HydrophobicContact CE-CB 4.49Å; M715-L719 HydrophobicContact CE-CD1 3.61Å; M715-L719 HydrophobicContact CE-CD2 3.46Å; M715-L719 VanDerWaalsContact CE-CD2 3.46Å; M715-L719 HydrophobicContact CE-CG 4.05Å; M715-L760 HydrophobicContact CB-CD2 4.49Å; M715-L760 WeakPolarHBondContact O-CD1 3.48Å
716	S	82.3	Confident	86.6	Confident	54 Å²	54	46.6 Å²	46.6	38%	0.378	26%	0.259	S	S	.	.			trans	-69.7	142.2	173.3	-149.4	0	0	0	0	111.1	D718 L719	S716-D718 WeakPolarHBondContact CB-OD2 3.48Å; S716-D718 PolarHBondContact O-N 3.46Å; S716-D718 VanDerWaalsContact O-N 3.09Å; S716-D718 PolarHBondContact OG-OD2 3.39Å; S716-L719 WeakPolarHBondContact O-CB 3.42Å; S716-L719 PolarHBondContact O-N 2.83Å
717	P	76.7	Confident	86.5	Confident	59 Å²	59	44.1 Å²	44.1	38%	0.383	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.4	176.6	25.6	-36.5	0	0	0	114.3	L719 L760 N761	P717-L719 VanDerWaalsContact C-N 3.34Å; P717-L760 HydrophobicContact CB-CD1 4.25Å; P717-L760 WeakPolarHBondContact CB-O 3.37Å; P717-N761 HydrophobicContact CB-CB 4.32Å; P717-N761 WeakPolarHBondContact O-CB 3.21Å; P717-N761 PolarHBondContact O-ND2 3.16Å
718	D	74.6	Confident	86.4	Confident	62 Å²	62	44.8 Å²	44.8	33%	0.332	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-23.3	179.4	-37.6	-75	0	0	0	112.7	S716 I720 A721	S716-D718 WeakPolarHBondContact CB-OD2 3.48Å; S716-D718 PolarHBondContact O-N 3.46Å; S716-D718 VanDerWaalsContact O-N 3.09Å; S716-D718 PolarHBondContact OG-OD2 3.39Å; D718-I720 VanDerWaalsContact C-N 3.3Å; D718-I720 PolarHBondContact O-N 2.77Å; D718-A721 WeakPolarHBondContact O-CB 3.37Å; D718-A721 PolarHBondContact O-N 3.28Å
719	L	68	Low	86.3	Confident	35 Å²	35	48.7 Å²	48.7	18%	0.183	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-36.7	-168.4	-174.3	149.7	0	0	0	113.2	N679 F682 M715 S716 P717 A721	N679-L719 HydrophobicContact CB-CD1 3.8Å; N679-L719 VanDerWaalsContact CG-CD1 3.46Å; N679-L719 WeakPolarHBondContact OD1-CD1 3.43Å; F682-L719 HydrophobicContact CD1-CD2 3.81Å; F682-L719 HydrophobicContact CE1-CD2 3.96Å; M715-L719 HydrophobicContact CE-CB 4.49Å; M715-L719 HydrophobicContact CE-CD1 3.61Å; M715-L719 HydrophobicContact CE-CD2 3.46Å; M715-L719 VanDerWaalsContact CE-CD2 3.46Å; M715-L719 HydrophobicContact CE-CG 4.05Å; S716-L719 WeakPolarHBondContact O-CB 3.42Å; S716-L719 PolarHBondContact O-N 2.83Å; P717-L719 VanDerWaalsContact C-N 3.34Å; L719-A721 VanDerWaalsContact C-N 3.33Å
720	I	78	Confident	86.3	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.015	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	5.7	178.1	61.4	167	0	0	0	113.5	D718 L757 L760 N761 S764 F765	D718-I720 VanDerWaalsContact C-N 3.3Å; D718-I720 PolarHBondContact O-N 2.77Å; I720-L757 WeakPolarHBondContact CD1-O 3.28Å; I720-L757 HydrophobicContact CG2-CD2 4.27Å; I720-L760 HydrophobicContact CD1-CD2 4.46Å; I720-L760 HydrophobicContact CG1-CD2 4.42Å; I720-N761 HydrophobicContact CD1-CB 4.06Å; I720-N761 HydrophobicContact CG1-CB 4.1Å; I720-S764 WeakPolarHBondContact O-CB 3.41Å; I720-F765 HydrophobicContact CD1-CB 4.2Å
721	A	78.1	Confident	86.3	Confident	34 Å²	34	45 Å²	45	28%	0.281	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-35.6	175.7	0	0	0	0	0	112.5	D718 L719 S764	D718-A721 WeakPolarHBondContact O-CB 3.37Å; D718-A721 PolarHBondContact O-N 3.28Å; L719-A721 VanDerWaalsContact C-N 3.33Å; A721-S764 WeakPolarHBondContact CA-OG 3.32Å
722	N	81.4	Confident	86.3	Confident	89 Å²	89	45.4 Å²	45.4	48%	0.476	26%	0.258	S	S	.	.	S	Bend	trans	-128.4	67.5	-179.2	-61.9	-64.9	0	0	0	110.9	T57 N98	T57-N722 VanDerWaalsContact CG2-ND2 3.3Å; T57-N722 WeakPolarHBondContact CG2-ND2 3.24Å; N98-N722 PolarHBondContact OD1-ND2 2.87Å
723	P	84.4	Confident	86.4	Confident	33 Å²	33	48.4 Å²	48.4	21%	0.214	27%	0.271	C	S	.	.			trans	-74	140.2	-175.6	31.9	-34.4	0	0	0	111.4	V727 I728 L768	P723-V727 HydrophobicContact CB-CB 4.15Å; P723-V727 HydrophobicContact CB-CG1 3.8Å; P723-I728 HydrophobicContact CB-CG1 4.09Å; P723-I728 HydrophobicContact CG-CD1 4.25Å; P723-I728 HydrophobicContact CG-CG1 3.92Å; P723-L768 HydrophobicContact CB-CD1 4.18Å; P723-L768 HydrophobicContact CG-CD1 4.12Å; P723-L768 HydrophobicContact CG-CG 4.25Å
724	S	88.8	Confident	86.6	Confident	58 Å²	58	43.3 Å²	43.3	41%	0.406	24%	0.244	S	C	.	.			trans	-68.3	159.3	171.9	74.8	0	0	0	0	111.4	E726 V727 I728	S724-E726 PolarHBondContact O-N 3.38Å; S724-E726 VanDerWaalsContact O-N 3.12Å; S724-E726 PolarHBondContact OG-N 2.8Å; S724-V727 PolarHBondContact O-N 3.18Å; S724-V727 PolarHBondContact OG-N 2.81Å; S724-I728 WeakPolarHBondContact O-CG1 3.35Å; S724-I728 PolarHBondContact O-N 3.08Å
725	N	89.8	Confident	87	Confident	127 Å²	127	39.3 Å²	39.3	68%	0.679	23%	0.225	S	C	*	.	H	α-helix	trans	-54.8	-30.4	173.3	-75.7	-55.2	0	0	0	112.8	N729	N725-N729 WeakPolarHBondContact O-CB 3.12Å; N725-N729 PolarHBondContact O-N 2.89Å; N725-N729 VanDerWaalsContact O-N 3.08Å; N725-N729 PolarHBondContact O-ND2 3.18Å
726	E	90.2	Very high	87.3	Confident	73 Å²	73	41.5 Å²	41.5	34%	0.341	24%	0.241	S	C	.	.	H	α-helix	trans	-69.6	-45	174.1	-176.6	171.7	-128.6	0	0	112	H687 M690 S724 N729 A730	H687-E726 IonicContact CE1-OE1 3.17Å; H687-E726 IonicContact CG-OE1 2.62Å; H687-E726 IonicContact ND1-OE1 2.74Å; H687-E726 PolarHBondContact ND1-OE1 3.06Å; H687-E726 IonicContact ND1-OE2 3.4Å; M690-E726 HydrophobicContact CB-CG 4.27Å; M690-E726 HydrophobicContact CG-CG 4.03Å; S724-E726 PolarHBondContact O-N 3.38Å; S724-E726 VanDerWaalsContact O-N 3.12Å; S724-E726 PolarHBondContact OG-N 2.8Å; E726-N729 PolarHBondContact O-N 3.08Å; E726-A730 VanDerWaalsContact O-CB 3.24Å; E726-A730 WeakPolarHBondContact O-CB 3.21Å; E726-A730 PolarHBondContact O-N 2.92Å
727	V	92.2	Very high	87.9	Confident	6 Å²	6	39.6 Å²	39.6	4%	0.036	23%	0.226	C	C	.	.	H	α-helix	trans	-62.5	-42.6	174.8	171.3	0	0	0	0	111.2	F682 C686 P723 S724 A730 V731	F682-V727 HydrophobicContact CE1-CG1 3.85Å; F682-V727 HydrophobicContact CE1-CG2 4.26Å; F682-V727 HydrophobicContact CZ-CG1 4.42Å; C686-V727 HydrophobicContact CB-CG2 4.18Å; P723-V727 HydrophobicContact CB-CB 4.15Å; P723-V727 HydrophobicContact CB-CG1 3.8Å; S724-V727 PolarHBondContact O-N 3.18Å; S724-V727 PolarHBondContact OG-N 2.81Å; V727-A730 PolarHBondContact O-N 2.86Å; V727-V731 HydrophobicContact CG1-CG2 4.38Å; V727-V731 WeakPolarHBondContact O-CB 3.36Å; V727-V731 VanDerWaalsContact O-CG2 3.3Å; V727-V731 WeakPolarHBondContact O-CG2 3.36Å; V727-V731 PolarHBondContact O-N 3.42Å
728	I	93	Very high	88.8	Confident	22 Å²	22	36.9 Å²	36.9	11%	0.113	21%	0.208	C	C	.	.	H	α-helix	trans	-56.3	-54.4	175.1	-68.7	168.2	0	0	0	110.2	P723 S724 A730 V731 G732 L768 S771 L772	P723-I728 HydrophobicContact CB-CG1 4.09Å; P723-I728 HydrophobicContact CG-CD1 4.25Å; P723-I728 HydrophobicContact CG-CG1 3.92Å; S724-I728 WeakPolarHBondContact O-CG1 3.35Å; S724-I728 PolarHBondContact O-N 3.08Å; I728-A730 PolarHBondContact O-N 3.31Å; I728-V731 PolarHBondContact O-N 2.88Å; I728-G732 PolarHBondContact O-N 2.98Å; I728-L768 HydrophobicContact CG1-CG 4.33Å; I728-S771 WeakPolarHBondContact CG2-OG 3.35Å; I728-L772 HydrophobicContact CG2-CD2 3.82Å; I728-L772 HydrophobicContact CG2-CG 4.22Å
729	N	93.3	Very high	89.6	Confident	83 Å²	83	36.1 Å²	36.1	44%	0.444	21%	0.21	S	C	.	.	H	α-helix	trans	-65.6	-37.6	-178.9	-76.5	-63.3	0	0	0	112.6	M690 N725 E726 G732 K733	M690-N729 HydrophobicContact CE-CB 3.59Å; M690-N729 HydrophobicContact SD-CB 3.67Å; N725-N729 WeakPolarHBondContact O-CB 3.12Å; N725-N729 PolarHBondContact O-N 2.89Å; N725-N729 VanDerWaalsContact O-N 3.08Å; N725-N729 PolarHBondContact O-ND2 3.18Å; E726-N729 PolarHBondContact O-N 3.08Å; N729-G732 PolarHBondContact O-N 2.84Å; N729-K733 WeakPolarHBondContact O-CB 3.44Å; N729-K733 PolarHBondContact O-N 3.44Å
730	A	94.7	Very high	90.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-44.6	174.8	0	0	0	0	0	111.8	C686 I689 M690 E726 V727 I728 G732 K733 I734	C686-A730 HydrophobicContact CB-CB 3.65Å; I689-A730 HydrophobicContact CB-CB 4.13Å; I689-A730 HydrophobicContact CG2-CB 3.92Å; M690-A730 HydrophobicContact CG-CB 4.06Å; E726-A730 VanDerWaalsContact O-CB 3.24Å; E726-A730 WeakPolarHBondContact O-CB 3.21Å; E726-A730 PolarHBondContact O-N 2.92Å; V727-A730 PolarHBondContact O-N 2.86Å; I728-A730 PolarHBondContact O-N 3.31Å; A730-G732 VanDerWaalsContact C-N 3.35Å; A730-G732 PolarHBondContact O-N 2.89Å; A730-K733 CarbonylContact O-C 3.57Å; A730-K733 PolarHBondContact O-N 3.14Å; A730-K733 VanDerWaalsContact O-N 3.16Å; A730-I734 WeakPolarHBondContact O-CG1 3.47Å; A730-I734 PolarHBondContact O-N 3.06Å
731	V	94.5	Very high	91.2	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-63	-40.4	174	170.9	0	0	0	0	111	V727 I728 K733 I734 I735 L757 F765 L768	V727-V731 HydrophobicContact CG1-CG2 4.38Å; V727-V731 WeakPolarHBondContact O-CB 3.36Å; V727-V731 VanDerWaalsContact O-CG2 3.3Å; V727-V731 WeakPolarHBondContact O-CG2 3.36Å; V727-V731 PolarHBondContact O-N 3.42Å; I728-V731 PolarHBondContact O-N 2.88Å; V731-K733 VanDerWaalsContact C-N 3.33Å; V731-K733 PolarHBondContact O-N 3.46Å; V731-I734 PolarHBondContact O-N 2.99Å; V731-I735 HydrophobicContact CG1-CD1 3.86Å; V731-I735 HydrophobicContact CG1-CG1 4.46Å; V731-I735 WeakPolarHBondContact O-CD1 3.42Å; V731-I735 VanDerWaalsContact O-CG1 3.27Å; V731-I735 WeakPolarHBondContact O-CG1 3.37Å; V731-I735 PolarHBondContact O-N 3.41Å; V731-L757 HydrophobicContact CG1-CD1 4.15Å; V731-L757 HydrophobicContact CG2-CD1 3.87Å; V731-F765 HydrophobicContact CG1-CE2 4.1Å; V731-L768 HydrophobicContact CB-CD1 4.41Å; V731-L768 HydrophobicContact CB-CD2 4.04Å; V731-L768 HydrophobicContact CG1-CD1 4.35Å; V731-L768 HydrophobicContact CG1-CD2 3.66Å; V731-L768 HydrophobicContact CG2-CD1 4.24Å
732	G	94.7	Very high	91.7	Very high	8 Å²	8	46.4 Å²	46.4	8%	0.082	26%	0.258	C	S	.	.	H	α-helix	trans	-58.5	-41.6	171.1	0	0	0	0	0	113.3	I728 N729 A730 I735 S736	I728-G732 PolarHBondContact O-N 2.98Å; N729-G732 PolarHBondContact O-N 2.84Å; A730-G732 VanDerWaalsContact C-N 3.35Å; A730-G732 PolarHBondContact O-N 2.89Å; G732-I735 PolarHBondContact O-N 3.27Å; G732-S736 PolarHBondContact O-N 3.27Å
733	K	94.2	Very high	92.3	Very high	66 Å²	66	43 Å²	43	29%	0.287	24%	0.241	S	C	.	.	H	α-helix	trans	-68.1	-38.3	176.3	-162.9	160.8	174	-175.8	0	111.5	I689 M690 N729 A730 V731 S736 W737	I689-K733 HydrophobicContact CG2-CB 3.81Å; I689-K733 HydrophobicContact CG2-CD 3.81Å; I689-K733 HydrophobicContact CG2-CG 3.94Å; I689-K733 VanDerWaalsContact O-CD 3.31Å; I689-K733 WeakPolarHBondContact O-CD 3.26Å; I689-K733 WeakPolarHBondContact O-CE 3.3Å; I689-K733 PolarHBondContact O-NZ 3.33Å; M690-K733 HydrophobicContact SD-CD 4.25Å; N729-K733 WeakPolarHBondContact O-CB 3.44Å; N729-K733 PolarHBondContact O-N 3.44Å; A730-K733 CarbonylContact O-C 3.57Å; A730-K733 PolarHBondContact O-N 3.14Å; A730-K733 VanDerWaalsContact O-N 3.16Å; V731-K733 VanDerWaalsContact C-N 3.33Å; V731-K733 PolarHBondContact O-N 3.46Å; K733-S736 WeakPolarHBondContact O-CB 3.45Å; K733-S736 PolarHBondContact O-N 3.3Å; K733-S736 PolarHBondContact O-OG 3.36Å; K733-W737 HydrophobicContact CG-CZ2 4.14Å; K733-W737 VanDerWaalsContact O-CD1 3.27Å; K733-W737 VanDerWaalsContact O-CG 3.29Å; K733-W737 PolarHBondContact O-N 3.09Å
734	I	95.5	Very high	92.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-62.1	-45.7	170.7	-66.4	163.8	0	0	0	111.1	I689 L705 M708 A730 V731 S736 W737 S738 A750 V753 V754	I689-I734 HydrophobicContact CD1-CD1 3.72Å; I689-I734 HydrophobicContact CD1-CG1 3.81Å; L705-I734 HydrophobicContact CD2-CG1 4.06Å; L705-I734 HydrophobicContact CD2-CG2 3.84Å; M708-I734 HydrophobicContact CE-CD1 3.81Å; M708-I734 HydrophobicContact SD-CD1 3.99Å; A730-I734 WeakPolarHBondContact O-CG1 3.47Å; A730-I734 PolarHBondContact O-N 3.06Å; V731-I734 PolarHBondContact O-N 2.99Å; I734-S736 VanDerWaalsContact C-N 3.29Å; I734-S736 PolarHBondContact O-N 2.9Å; I734-W737 WeakPolarHBondContact O-CA 3.45Å; I734-W737 WeakPolarHBondContact O-CB 3.24Å; I734-W737 PolarHBondContact O-N 2.98Å; I734-S738 PolarHBondContact O-N 2.94Å; I734-A750 HydrophobicContact CG2-CB 4.32Å; I734-V753 HydrophobicContact CD1-CG1 4.23Å; I734-V753 HydrophobicContact CG2-CB 4.16Å; I734-V753 HydrophobicContact CG2-CG1 4Å; I734-V754 HydrophobicContact CG2-CG2 4.24Å
735	I	95.8	Very high	92.9	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-60.5	-41	176.9	-66.6	157.7	0	0	0	110.2	V731 G732 W737 S738 V754 L769 L772 V776 R779 A780	V731-I735 HydrophobicContact CG1-CD1 3.86Å; V731-I735 HydrophobicContact CG1-CG1 4.46Å; V731-I735 WeakPolarHBondContact O-CD1 3.42Å; V731-I735 VanDerWaalsContact O-CG1 3.27Å; V731-I735 WeakPolarHBondContact O-CG1 3.37Å; V731-I735 PolarHBondContact O-N 3.41Å; G732-I735 PolarHBondContact O-N 3.27Å; I735-W737 VanDerWaalsContact C-N 3.27Å; I735-W737 PolarHBondContact O-N 2.88Å; I735-S738 VanDerWaalsContact O-CB 3.27Å; I735-S738 WeakPolarHBondContact O-CB 3.36Å; I735-S738 PolarHBondContact O-N 3.24Å; I735-S738 VanDerWaalsContact O-N 3.1Å; I735-S738 PolarHBondContact O-OG 3.28Å; I735-V754 HydrophobicContact CG1-CG2 3.63Å; I735-L769 HydrophobicContact CD1-CD2 3.63Å; I735-L772 HydrophobicContact CD1-CD1 3.88Å; I735-V776 HydrophobicContact CB-CG1 3.78Å; I735-V776 HydrophobicContact CD1-CG1 4.08Å; I735-V776 HydrophobicContact CG2-CG1 3.63Å; I735-V776 VanDerWaalsContact CG2-O 3.3Å; I735-V776 WeakPolarHBondContact CG2-O 3.06Å; I735-R779 HydrophobicContact CG2-CB 4.07Å; I735-R779 HydrophobicContact CG2-CG 4.19Å; I735-A780 HydrophobicContact CD1-CB 4.09Å; I735-A780 HydrophobicContact CG1-CB 4.32Å; I735-A780 HydrophobicContact CG2-CB 4.03Å
736	S	93.5	Very high	93.2	Very high	57 Å²	57	38.6 Å²	38.6	40%	0.399	22%	0.218	S	C	.	.	H	α-helix	trans	-60.4	-35.5	173.6	86.2	0	0	0	0	112.6	G732 K733 I734 S738 A739	G732-S736 PolarHBondContact O-N 3.27Å; K733-S736 WeakPolarHBondContact O-CB 3.45Å; K733-S736 PolarHBondContact O-N 3.3Å; K733-S736 PolarHBondContact O-OG 3.36Å; I734-S736 VanDerWaalsContact C-N 3.29Å; I734-S736 PolarHBondContact O-N 2.9Å; S736-S738 PolarHBondContact O-N 3.17Å; S736-A739 WeakPolarHBondContact O-CB 3.27Å; S736-A739 PolarHBondContact O-N 3.29Å
737	W	94.6	Very high	93.5	Very high	15 Å²	15	39.1 Å²	39.1	6%	0.057	22%	0.217	C	C	.	.	H	α-helix	trans	-70.1	-15.7	177.5	-65	-6.6	0	0	0	113.5	I689 K701 L704 L705 K733 I734 I735 A739 E740 V746 R747 A750	I689-W737 HydrophobicContact CD1-CZ3 4.48Å; I689-W737 HydrophobicContact CG1-CH2 4.01Å; I689-W737 HydrophobicContact CG1-CZ3 4.26Å; I689-W737 HydrophobicContact CG2-CH2 4.25Å; K701-W737 HydrophobicContact CB-CZ3 4.34Å; K701-W737 HydrophobicContact CD-CD2 3.89Å; K701-W737 HydrophobicContact CD-CE3 4.13Å; K701-W737 HydrophobicContact CD-CG 4.43Å; K701-W737 HydrophobicContact CD-CH2 4.21Å; K701-W737 HydrophobicContact CD-CZ2 4.01Å; K701-W737 HydrophobicContact CD-CZ3 4.28Å; K701-W737 HydrophobicContact CG-CE3 4.33Å; K701-W737 HydrophobicContact CG-CH2 3.98Å; K701-W737 HydrophobicContact CG-CZ2 4.23Å; K701-W737 HydrophobicContact CG-CZ3 4.04Å; K701-W737 VanDerWaalsContact NZ-NE1 3.17Å; L704-W737 HydrophobicContact CD2-CH2 4.42Å; L704-W737 HydrophobicContact CD2-CZ3 4.26Å; L705-W737 HydrophobicContact CD1-CE3 4.03Å; L705-W737 HydrophobicContact CD2-CE3 4.18Å; L705-W737 HydrophobicContact CD2-CZ3 4.44Å; L705-W737 HydrophobicContact CG-CE3 4.31Å; L705-W737 HydrophobicContact CG-CZ3 4.48Å; K733-W737 HydrophobicContact CG-CZ2 4.14Å; K733-W737 VanDerWaalsContact O-CD1 3.27Å; K733-W737 VanDerWaalsContact O-CG 3.29Å; K733-W737 PolarHBondContact O-N 3.09Å; I734-W737 WeakPolarHBondContact O-CA 3.45Å; I734-W737 WeakPolarHBondContact O-CB 3.24Å; I734-W737 PolarHBondContact O-N 2.98Å; I735-W737 VanDerWaalsContact C-N 3.27Å; I735-W737 PolarHBondContact O-N 2.88Å; W737-A739 PolarHBondContact O-N 3.12Å; W737-E740 VanDerWaalsContact O-CB 3.23Å; W737-E740 WeakPolarHBondContact O-CB 3.43Å; W737-E740 PolarHBondContact O-N 3.46Å; W737-E740 VanDerWaalsContact O-N 3.11Å; W737-V746 HydrophobicContact CB-CG1 3.88Å; W737-V746 HydrophobicContact CG-CG1 4.4Å; W737-R747 WeakPolarHBondContact O-CA 3.27Å; W737-A750 HydrophobicContact CB-CB 3.96Å
738	S	94.7	Very high	93.6	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.007	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-18.2	166.4	77.9	0	0	0	0	113	I734 I735 S736 R747 R779	I734-S738 PolarHBondContact O-N 2.94Å; I735-S738 VanDerWaalsContact O-CB 3.27Å; I735-S738 WeakPolarHBondContact O-CB 3.36Å; I735-S738 PolarHBondContact O-N 3.24Å; I735-S738 VanDerWaalsContact O-N 3.1Å; I735-S738 PolarHBondContact O-OG 3.28Å; S736-S738 PolarHBondContact O-N 3.17Å; S738-R747 WeakPolarHBondContact O-CB 3.31Å; S738-R747 WeakPolarHBondContact O-CD 3.46Å; S738-R747 WeakPolarHBondContact O-CG 3.42Å; S738-R779 PolarHBondContact O-NH2 2.77Å; S738-R779 VanDerWaalsContact OG-CG 3.26Å; S738-R779 WeakPolarHBondContact OG-CG 2.92Å; S738-R779 PolarHBondContact OG-NE 3.35Å
739	A	92.9	Very high	93.8	Very high	47 Å²	47	45.2 Å²	45.2	39%	0.388	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	2	175.2	0	0	0	0	0	113.7	S736 W737 P741	S736-A739 WeakPolarHBondContact O-CB 3.27Å; S736-A739 PolarHBondContact O-N 3.29Å; W737-A739 PolarHBondContact O-N 3.12Å; A739-P741 VanDerWaalsContact O-CD 3.24Å; A739-P741 WeakPolarHBondContact O-CD 3.07Å
740	E	90.9	Very high	93.9	Very high	23 Å²	23	41.3 Å²	41.3	11%	0.107	22%	0.218	C	C	.	.			trans	-46.9	106.9	-178.3	172.5	63.9	-98	0	0	111.6	F698 K701 W737 K742 V746 R747	F698-E740 HydrophobicContact CD1-CG 4.11Å; F698-E740 VanDerWaalsContact CE1-CD 3.44Å; F698-E740 HydrophobicContact CE1-CG 4.23Å; F698-E740 WeakPolarHBondContact CE1-OE1 3.3Å; F698-E740 WeakPolarHBondContact CE1-OE2 3.43Å; K701-E740 IonicContact NZ-OE2 3.89Å; K701-E740 PolarHBondContact NZ-OE2 2.83Å; W737-E740 VanDerWaalsContact O-CB 3.23Å; W737-E740 WeakPolarHBondContact O-CB 3.43Å; W737-E740 PolarHBondContact O-N 3.46Å; W737-E740 VanDerWaalsContact O-N 3.11Å; E740-K742 VanDerWaalsContact C-N 3.28Å; E740-K742 PolarHBondContact O-N 2.93Å; E740-K742 PolarHBondContact OE1-N 3.4Å; E740-V746 HydrophobicContact CB-CB 4.33Å; E740-V746 HydrophobicContact CB-CG1 3.85Å; E740-V746 HydrophobicContact CG-CB 4.06Å; E740-V746 HydrophobicContact CG-CG1 3.85Å; E740-R747 HydrophobicContact CB-CG 4.11Å; E740-R747 VanDerWaalsContact O-CD 3.25Å; E740-R747 WeakPolarHBondContact O-CD 3.44Å; E740-R747 WeakPolarHBondContact O-CG 3.3Å; E740-R747 PolarHBondContact O-NH1 2.95Å
741	P	87.5	Confident	94	Very high	105 Å²	105	42.6 Å²	42.6	68%	0.682	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-34	-171.7	23.1	-32.4	0	0	0	111.9	A739 S743 R747	A739-P741 VanDerWaalsContact O-CD 3.24Å; A739-P741 WeakPolarHBondContact O-CD 3.07Å; P741-S743 PolarHBondContact O-N 3.46Å; P741-R747 PolarHBondContact O-NH1 3.23Å
742	K	89.6	Confident	94	Very high	159 Å²	159	48.6 Å²	48.6	69%	0.691	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-10.3	-168.9	-67.2	172	179.4	177.4	0	115.1	F698 E740	F698-K742 HydrophobicContact CD1-CB 4.45Å; F698-K742 HydrophobicContact CD2-CB 4.4Å; F698-K742 HydrophobicContact CE1-CB 3.84Å; F698-K742 HydrophobicContact CE1-CD 4.29Å; F698-K742 HydrophobicContact CE2-CB 3.77Å; F698-K742 HydrophobicContact CE2-CD 4.12Å; F698-K742 HydrophobicContact CZ-CB 3.48Å; F698-K742 VanDerWaalsContact CZ-CB 3.48Å; F698-K742 HydrophobicContact CZ-CD 3.48Å; F698-K742 VanDerWaalsContact CZ-CD 3.48Å; F698-K742 HydrophobicContact CZ-CG 4.11Å; E740-K742 VanDerWaalsContact C-N 3.28Å; E740-K742 PolarHBondContact O-N 2.93Å; E740-K742 PolarHBondContact OE1-N 3.4Å
743	S	92.8	Very high	94.1	Very high	18 Å²	18	48.2 Å²	48.2	13%	0.126	25%	0.245	C	C	.	.			trans	-148.5	120.1	177.4	175.5	0	0	0	0	113.1	P741 D745 V746 R747	P741-S743 PolarHBondContact O-N 3.46Å; S743-D745 VanDerWaalsContact C-N 3.34Å; S743-D745 PolarHBondContact OG-N 2.92Å; S743-V746 PolarHBondContact OG-N 3.44Å; S743-R747 WeakPolarHBondContact O-CG 3.4Å; S743-R747 PolarHBondContact O-N 3.41Å
744	A	93.2	Very high	94.1	Very high	47 Å²	47	45 Å²	45	39%	0.388	23%	0.232	S	C	.	.	H	α-helix	trans	-68.4	-31.4	175.3	0	0	0	0	0	112.9	R747 R748	A744-R747 PolarHBondContact O-N 3.12Å; A744-R748 WeakPolarHBondContact O-CB 3.43Å; A744-R748 PolarHBondContact O-N 3.42Å
745	D	94.4	Very high	94.1	Very high	78 Å²	78	46.1 Å²	46.1	42%	0.417	24%	0.237	S	C	.	.	H	α-helix	trans	-73.6	-36.9	179.9	-56	-60.9	0	0	0	111.7	T702 S743 R748 M749	T702-D745 HydrophobicContact CG2-CB 4.23Å; S743-D745 VanDerWaalsContact C-N 3.34Å; S743-D745 PolarHBondContact OG-N 2.92Å; D745-R748 PolarHBondContact O-N 3.1Å; D745-R748 IonicContact OD1-CZ 2.6Å; D745-R748 IonicContact OD1-NH1 2.69Å; D745-R748 PolarHBondContact OD1-NH1 3.38Å; D745-R748 IonicContact OD1-NH2 3.29Å; D745-M749 WeakPolarHBondContact O-CB 3.34Å; D745-M749 PolarHBondContact O-N 3.02Å
746	V	95.7	Very high	94	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.2	-47.7	168.9	174.5	0	0	0	0	110.4	F698 K701 T702 L705 W737 E740 S743 R748 M749 A750	F698-V746 HydrophobicContact CB-CG2 3.96Å; F698-V746 WeakPolarHBondContact O-CG2 3.3Å; K701-V746 HydrophobicContact CB-CG1 4.29Å; K701-V746 HydrophobicContact CB-CG2 3.8Å; K701-V746 HydrophobicContact CD-CG1 4.07Å; K701-V746 HydrophobicContact CD-CG2 4.36Å; T702-V746 WeakPolarHBondContact OG1-CG2 3.42Å; L705-V746 HydrophobicContact CD1-CG1 4.17Å; W737-V746 HydrophobicContact CB-CG1 3.88Å; W737-V746 HydrophobicContact CG-CG1 4.4Å; E740-V746 HydrophobicContact CB-CB 4.33Å; E740-V746 HydrophobicContact CB-CG1 3.85Å; E740-V746 HydrophobicContact CG-CB 4.06Å; E740-V746 HydrophobicContact CG-CG1 3.85Å; S743-V746 PolarHBondContact OG-N 3.44Å; V746-R748 VanDerWaalsContact C-N 3.33Å; V746-R748 PolarHBondContact O-N 3.21Å; V746-M749 PolarHBondContact O-N 3.4Å; V746-A750 WeakPolarHBondContact O-CB 3.44Å; V746-A750 PolarHBondContact O-N 2.66Å
747	R	95.6	Very high	94	Very high	84 Å²	84	46.4 Å²	46.4	32%	0.317	23%	0.231	S	C	.	.	H	α-helix	trans	-57.1	-45.5	175.7	-66.1	-167.6	-61	-94.9	12.2	112.1	W737 S738 E740 P741 S743 A744 S751	W737-R747 WeakPolarHBondContact O-CA 3.27Å; S738-R747 WeakPolarHBondContact O-CB 3.31Å; S738-R747 WeakPolarHBondContact O-CD 3.46Å; S738-R747 WeakPolarHBondContact O-CG 3.42Å; E740-R747 HydrophobicContact CB-CG 4.11Å; E740-R747 VanDerWaalsContact O-CD 3.25Å; E740-R747 WeakPolarHBondContact O-CD 3.44Å; E740-R747 WeakPolarHBondContact O-CG 3.3Å; E740-R747 PolarHBondContact O-NH1 2.95Å; P741-R747 PolarHBondContact O-NH1 3.23Å; S743-R747 WeakPolarHBondContact O-CG 3.4Å; S743-R747 PolarHBondContact O-N 3.41Å; A744-R747 PolarHBondContact O-N 3.12Å; R747-S751 WeakPolarHBondContact O-CB 3.35Å; R747-S751 PolarHBondContact O-N 3.13Å; R747-S751 VanDerWaalsContact O-N 3.08Å; R747-S751 PolarHBondContact O-OG 3.33Å
748	R	95	Very high	93.9	Very high	140 Å²	140	47.9 Å²	47.9	53%	0.528	24%	0.238	S	C	.	.	H	α-helix	trans	-64.9	-44.8	-179.8	-166.4	-170.1	-61.9	118.6	2.1	111.9	A744 D745 V746 R752	A744-R748 WeakPolarHBondContact O-CB 3.43Å; A744-R748 PolarHBondContact O-N 3.42Å; D745-R748 PolarHBondContact O-N 3.1Å; D745-R748 IonicContact OD1-CZ 2.6Å; D745-R748 IonicContact OD1-NH1 2.69Å; D745-R748 PolarHBondContact OD1-NH1 3.38Å; D745-R748 IonicContact OD1-NH2 3.29Å; V746-R748 VanDerWaalsContact C-N 3.33Å; V746-R748 PolarHBondContact O-N 3.21Å; R748-R752 WeakPolarHBondContact O-CG 3.13Å; R748-R752 PolarHBondContact O-N 2.88Å; R748-R752 VanDerWaalsContact O-N 3.15Å
749	M	96.2	Very high	93.7	Very high	17 Å²	17	50.9 Å²	50.9	8%	0.084	25%	0.254	C	S	.	.	H	α-helix	trans	-76.9	-36.7	-177.1	-154.8	66.7	75.7	0	0	112.1	L705 E706 K709 D745 V746 S751 R752 V753	L705-M749 HydrophobicContact CB-CB 3.85Å; L705-M749 HydrophobicContact CB-CG 3.52Å; L705-M749 HydrophobicContact CD1-CB 4.31Å; E706-M749 HydrophobicContact CB-CE 3.96Å; E706-M749 HydrophobicContact CB-CG 4.29Å; E706-M749 HydrophobicContact CB-SD 4.22Å; E706-M749 HydrophobicContact CG-CE 4.27Å; K709-M749 HydrophobicContact CD-SD 4.1Å; D745-M749 WeakPolarHBondContact O-CB 3.34Å; D745-M749 PolarHBondContact O-N 3.02Å; V746-M749 PolarHBondContact O-N 3.4Å; M749-S751 VanDerWaalsContact C-N 3.32Å; M749-S751 PolarHBondContact O-N 3.27Å; M749-R752 WeakPolarHBondContact O-CB 3.32Å; M749-R752 PolarHBondContact O-N 3.03Å; M749-R752 VanDerWaalsContact O-N 3.11Å; M749-R752 HydrophobicContact SD-CB 4.5Å; M749-V753 PolarHBondContact O-N 2.82Å
750	A	96.8	Very high	93.5	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.8	-43.7	172.9	0	0	0	0	0	111.2	L705 I734 W737 V746 R752 V753 V754	L705-A750 HydrophobicContact CD1-CB 3.91Å; L705-A750 HydrophobicContact CD2-CB 4.42Å; I734-A750 HydrophobicContact CG2-CB 4.32Å; W737-A750 HydrophobicContact CB-CB 3.96Å; V746-A750 WeakPolarHBondContact O-CB 3.44Å; V746-A750 PolarHBondContact O-N 2.66Å; A750-R752 VanDerWaalsContact C-N 3.31Å; A750-R752 PolarHBondContact O-N 3.36Å; A750-V753 PolarHBondContact O-N 3.27Å; A750-V754 WeakPolarHBondContact O-CG2 3.47Å; A750-V754 PolarHBondContact O-N 3.04Å
751	S	95.7	Very high	93.4	Very high	27 Å²	27	50.9 Å²	50.9	19%	0.189	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-40.6	173.3	-56.6	0	0	0	0	112	R747 M749 V754 I755	R747-S751 WeakPolarHBondContact O-CB 3.35Å; R747-S751 PolarHBondContact O-N 3.13Å; R747-S751 VanDerWaalsContact O-N 3.08Å; R747-S751 PolarHBondContact O-OG 3.33Å; M749-S751 VanDerWaalsContact C-N 3.32Å; M749-S751 PolarHBondContact O-N 3.27Å; S751-V754 PolarHBondContact O-N 2.96Å; S751-I755 WeakPolarHBondContact O-CB 3.49Å; S751-I755 VanDerWaalsContact O-CD1 3.29Å; S751-I755 WeakPolarHBondContact O-CD1 3.5Å; S751-I755 WeakPolarHBondContact O-CG1 3.4Å; S751-I755 PolarHBondContact O-N 2.82Å
752	R	95.1	Very high	93.5	Very high	127 Å²	127	48.5 Å²	48.5	48%	0.479	23%	0.234	S	C	.	.	H	α-helix	trans	-65.4	-38.2	175	-76.3	177.1	169.1	-173.6	-4.5	113.2	K709 R748 M749 A750 I755 K756	K709-R752 HydrophobicContact CG-CB 4.39Å; R748-R752 WeakPolarHBondContact O-CG 3.13Å; R748-R752 PolarHBondContact O-N 2.88Å; R748-R752 VanDerWaalsContact O-N 3.15Å; M749-R752 WeakPolarHBondContact O-CB 3.32Å; M749-R752 PolarHBondContact O-N 3.03Å; M749-R752 VanDerWaalsContact O-N 3.11Å; M749-R752 HydrophobicContact SD-CB 4.5Å; A750-R752 VanDerWaalsContact C-N 3.31Å; A750-R752 PolarHBondContact O-N 3.36Å; R752-I755 PolarHBondContact O-N 3.47Å; R752-K756 WeakPolarHBondContact O-CB 3.39Å; R752-K756 WeakPolarHBondContact O-CG 3.3Å; R752-K756 PolarHBondContact O-N 3.41Å
753	V	96.2	Very high	93.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.6	-45.6	174.9	173.9	0	0	0	0	110.7	L705 M708 K709 I712 I734 M749 A750 I755 K756 L757	L705-V753 HydrophobicContact CB-CG2 4.05Å; L705-V753 HydrophobicContact CD2-CB 4.35Å; L705-V753 HydrophobicContact CD2-CG2 3.91Å; L705-V753 WeakPolarHBondContact O-CG2 3.45Å; M708-V753 HydrophobicContact CB-CG2 4.26Å; K709-V753 HydrophobicContact CB-CG2 3.95Å; I712-V753 HydrophobicContact CD1-CG1 3.88Å; I734-V753 HydrophobicContact CD1-CG1 4.23Å; I734-V753 HydrophobicContact CG2-CB 4.16Å; I734-V753 HydrophobicContact CG2-CG1 4Å; M749-V753 PolarHBondContact O-N 2.82Å; A750-V753 PolarHBondContact O-N 3.27Å; V753-I755 VanDerWaalsContact C-N 3.35Å; V753-I755 PolarHBondContact O-N 3.22Å; V753-K756 PolarHBondContact O-N 3.41Å; V753-K756 VanDerWaalsContact O-N 3.1Å; V753-L757 HydrophobicContact CG1-CD1 4.23Å; V753-L757 HydrophobicContact CG1-CG 4.48Å; V753-L757 WeakPolarHBondContact O-CG 3.5Å; V753-L757 PolarHBondContact O-N 3.46Å
754	V	95.5	Very high	93.3	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-56.9	-47.3	174.6	167.6	0	0	0	0	111.5	I734 I735 A750 S751 K756 L757 F758 F765 V783	I734-V754 HydrophobicContact CG2-CG2 4.24Å; I735-V754 HydrophobicContact CG1-CG2 3.63Å; A750-V754 WeakPolarHBondContact O-CG2 3.47Å; A750-V754 PolarHBondContact O-N 3.04Å; S751-V754 PolarHBondContact O-N 2.96Å; V754-K756 VanDerWaalsContact C-N 3.32Å; V754-K756 PolarHBondContact O-N 3.19Å; V754-L757 PolarHBondContact O-N 3.09Å; V754-F758 PolarHBondContact O-N 2.8Å; V754-F758 VanDerWaalsContact O-N 3.12Å; V754-F765 HydrophobicContact CG1-CE1 4.47Å; V754-F765 HydrophobicContact CG1-CZ 4Å; V754-V783 HydrophobicContact CB-CG1 4.24Å; V754-V783 HydrophobicContact CG1-CB 4.4Å; V754-V783 HydrophobicContact CG1-CG1 3.91Å
755	I	94.3	Very high	93.2	Very high	23 Å²	23	42.8 Å²	42.8	12%	0.118	21%	0.208	C	C	.	.	H	α-helix	trans	-59.4	-42.5	175	-69.5	160.1	0	0	0	110.9	S751 R752 V753 F758 D759 V783 L784 Y787	S751-I755 WeakPolarHBondContact O-CB 3.49Å; S751-I755 VanDerWaalsContact O-CD1 3.29Å; S751-I755 WeakPolarHBondContact O-CD1 3.5Å; S751-I755 WeakPolarHBondContact O-CG1 3.4Å; S751-I755 PolarHBondContact O-N 2.82Å; R752-I755 PolarHBondContact O-N 3.47Å; V753-I755 VanDerWaalsContact C-N 3.35Å; V753-I755 PolarHBondContact O-N 3.22Å; I755-F758 WeakPolarHBondContact O-CB 3.43Å; I755-F758 PolarHBondContact O-N 3.17Å; I755-D759 WeakPolarHBondContact O-CB 3.44Å; I755-D759 PolarHBondContact O-N 3.41Å; I755-V783 HydrophobicContact CD1-CG1 4.43Å; I755-V783 HydrophobicContact CG1-CG1 4.2Å; I755-L784 HydrophobicContact CG1-CD2 4.47Å; I755-Y787 HydrophobicContact CB-CD1 4.45Å; I755-Y787 HydrophobicContact CB-CG 4.48Å; I755-Y787 HydrophobicContact CD1-CD2 3.81Å; I755-Y787 HydrophobicContact CD1-CG 3.75Å; I755-Y787 HydrophobicContact CG1-CD1 4.03Å; I755-Y787 HydrophobicContact CG1-CD2 4.21Å; I755-Y787 HydrophobicContact CG1-CG 3.74Å; I755-Y787 HydrophobicContact CG2-CD1 3.7Å; I755-Y787 HydrophobicContact CG2-CD2 3.94Å; I755-Y787 HydrophobicContact CG2-CE1 3.56Å; I755-Y787 HydrophobicContact CG2-CE2 3.82Å; I755-Y787 HydrophobicContact CG2-CG 3.89Å
756	K	93.6	Very high	93.1	Very high	61 Å²	61	41.5 Å²	41.5	27%	0.265	20%	0.204	S	C	.	.	H	α-helix	trans	-73.3	-29.6	-177.9	-72.9	-71.7	158.2	-148.3	0	114.2	K709 I712 L713 R752 V753 V754 D759 L760	K709-K756 HydrophobicContact CG-CG 4.45Å; I712-K756 HydrophobicContact CB-CB 4.45Å; I712-K756 HydrophobicContact CG2-CB 3.87Å; I712-K756 WeakPolarHBondContact CG2-O 3.45Å; L713-K756 HydrophobicContact CD2-CD 3.77Å; L713-K756 HydrophobicContact CG-CD 4.21Å; R752-K756 WeakPolarHBondContact O-CB 3.39Å; R752-K756 WeakPolarHBondContact O-CG 3.3Å; R752-K756 PolarHBondContact O-N 3.41Å; V753-K756 PolarHBondContact O-N 3.41Å; V753-K756 VanDerWaalsContact O-N 3.1Å; V754-K756 VanDerWaalsContact C-N 3.32Å; V754-K756 PolarHBondContact O-N 3.19Å; K756-D759 WeakPolarHBondContact CE-OD2 3.49Å; K756-D759 IonicContact NZ-OD2 3.69Å; K756-D759 PolarHBondContact NZ-OD2 3.07Å; K756-L760 VanDerWaalsContact O-CB 3.3Å; K756-L760 WeakPolarHBondContact O-CB 3.48Å; K756-L760 PolarHBondContact O-N 3.45Å
757	L	92.9	Very high	92.8	Very high	2 Å²	2	46 Å²	46	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-66.8	-38.8	168.9	-66.9	171.1	0	0	0	111.4	F682 I712 I720 V731 V753 V754 N761 F765	F682-L757 HydrophobicContact CE2-CD2 4.25Å; F682-L757 HydrophobicContact CZ-CD2 4.22Å; I712-L757 HydrophobicContact CD1-CD2 3.61Å; I712-L757 HydrophobicContact CD1-CG 3.88Å; I712-L757 HydrophobicContact CG1-CD2 4.02Å; I712-L757 HydrophobicContact CG2-CD2 4.48Å; I720-L757 WeakPolarHBondContact CD1-O 3.28Å; I720-L757 HydrophobicContact CG2-CD2 4.27Å; V731-L757 HydrophobicContact CG1-CD1 4.15Å; V731-L757 HydrophobicContact CG2-CD1 3.87Å; V753-L757 HydrophobicContact CG1-CD1 4.23Å; V753-L757 HydrophobicContact CG1-CG 4.48Å; V753-L757 WeakPolarHBondContact O-CG 3.5Å; V753-L757 PolarHBondContact O-N 3.46Å; V754-L757 PolarHBondContact O-N 3.09Å; L757-N761 PolarHBondContact O-N 3.09Å; L757-F765 HydrophobicContact CB-CD2 3.56Å; L757-F765 HydrophobicContact CB-CE2 3.71Å; L757-F765 HydrophobicContact CB-CG 4.46Å; L757-F765 HydrophobicContact CD1-CE2 4.08Å
758	F	92.8	Very high	92.6	Very high	47 Å²	47	42.3 Å²	42.3	21%	0.206	22%	0.215	C	C	.	.	H	α-helix	trans	-68	-42.4	173.9	177.1	-93	0	0	0	112.8	V754 I755 L760 N761 S762 F765 L784	V754-F758 PolarHBondContact O-N 2.8Å; V754-F758 VanDerWaalsContact O-N 3.12Å; I755-F758 WeakPolarHBondContact O-CB 3.43Å; I755-F758 PolarHBondContact O-N 3.17Å; F758-L760 VanDerWaalsContact C-N 3.29Å; F758-L760 PolarHBondContact O-N 3.36Å; F758-N761 CarbonylContact O-C 3.4Å; F758-S762 VanDerWaalsContact O-CA 3.32Å; F758-S762 WeakPolarHBondContact O-CA 3.45Å; F758-S762 WeakPolarHBondContact O-CB 3.36Å; F758-S762 PolarHBondContact O-N 3.47Å; F758-S762 VanDerWaalsContact O-N 3.09Å; F758-F765 HydrophobicContact CB-CD1 3.98Å; F758-F765 HydrophobicContact CB-CE1 4.38Å; F758-F765 HydrophobicContact CB-CG 4.36Å; F758-F765 HydrophobicContact CD2-CD1 4.04Å; F758-L784 HydrophobicContact CB-CD1 4.46Å; F758-L784 HydrophobicContact CB-CD2 3.74Å; F758-L784 HydrophobicContact CD1-CD2 3.99Å; F758-L784 HydrophobicContact CD2-CD1 3.7Å; F758-L784 HydrophobicContact CD2-CD2 4.17Å; F758-L784 HydrophobicContact CE2-CD1 4.14Å; F758-L784 HydrophobicContact CG-CD1 4.1Å; F758-L784 HydrophobicContact CG-CD2 3.69Å
759	D	91	Very high	92.5	Very high	64 Å²	64	35.9 Å²	35.9	34%	0.342	19%	0.191	S	C	.	.	H	α-helix	trans	-64	-33.2	175.7	-69.1	-17.9	0	0	0	112.3	I755 K756	I755-D759 WeakPolarHBondContact O-CB 3.44Å; I755-D759 PolarHBondContact O-N 3.41Å; K756-D759 WeakPolarHBondContact CE-OD2 3.49Å; K756-D759 IonicContact NZ-OD2 3.69Å; K756-D759 PolarHBondContact NZ-OD2 3.07Å
760	L	88.5	Confident	92.2	Very high	32 Å²	32	41.8 Å²	41.8	17%	0.168	22%	0.219	C	C	.	.	H	α-helix	trans	-67.3	-52.3	179.8	176.9	65.3	0	0	0	111.5	I712 M715 P717 I720 K756 F758	I712-L760 HydrophobicContact CG2-CB 4.17Å; I712-L760 HydrophobicContact CG2-CD2 4.14Å; M715-L760 HydrophobicContact CB-CD2 4.49Å; M715-L760 WeakPolarHBondContact O-CD1 3.48Å; P717-L760 HydrophobicContact CB-CD1 4.25Å; P717-L760 WeakPolarHBondContact CB-O 3.37Å; I720-L760 HydrophobicContact CD1-CD2 4.46Å; I720-L760 HydrophobicContact CG1-CD2 4.42Å; K756-L760 VanDerWaalsContact O-CB 3.3Å; K756-L760 WeakPolarHBondContact O-CB 3.48Å; K756-L760 PolarHBondContact O-N 3.45Å; F758-L760 VanDerWaalsContact C-N 3.29Å; F758-L760 PolarHBondContact O-N 3.36Å
761	N	88.5	Confident	91.9	Very high	37 Å²	37	45 Å²	45	20%	0.198	24%	0.241	C	C	.	.			trans	-156.7	94.6	175.8	-173.2	-23.6	0	0	0	110.3	P717 I720 L757 F758 T763 S764 F765	P717-N761 HydrophobicContact CB-CB 4.32Å; P717-N761 WeakPolarHBondContact O-CB 3.21Å; P717-N761 PolarHBondContact O-ND2 3.16Å; I720-N761 HydrophobicContact CD1-CB 4.06Å; I720-N761 HydrophobicContact CG1-CB 4.1Å; L757-N761 PolarHBondContact O-N 3.09Å; F758-N761 CarbonylContact O-C 3.4Å; N761-T763 VanDerWaalsContact C-N 3.32Å; N761-T763 PolarHBondContact O-N 3.5Å; N761-T763 PolarHBondContact OD1-N 3.28Å; N761-S764 VanDerWaalsContact CG-OG 3.28Å; N761-S764 PolarHBondContact ND2-OG 2.97Å; N761-S764 PolarHBondContact O-N 3.32Å; N761-S764 PolarHBondContact OD1-N 2.75Å; N761-S764 VanDerWaalsContact OD1-N 3.09Å; N761-S764 PolarHBondContact OD1-OG 3.27Å; N761-F765 WeakPolarHBondContact O-CB 3.17Å; N761-F765 PolarHBondContact O-N 2.94Å
762	S	89.7	Confident	91.7	Very high	55 Å²	55	44.2 Å²	44.2	39%	0.385	24%	0.235	S	C	.	.	H	α-helix	trans	-63.5	-33.3	-174.7	56.2	0	0	0	0	113.6	F758 S766	F758-S762 VanDerWaalsContact O-CA 3.32Å; F758-S762 WeakPolarHBondContact O-CA 3.45Å; F758-S762 WeakPolarHBondContact O-CB 3.36Å; F758-S762 PolarHBondContact O-N 3.47Å; F758-S762 VanDerWaalsContact O-N 3.09Å; S762-S766 WeakPolarHBondContact O-CB 3.42Å; S762-S766 PolarHBondContact O-N 3.49Å; S762-S766 PolarHBondContact O-OG 3.13Å
763	T	88.8	Confident	91.6	Very high	92 Å²	92	42.4 Å²	42.4	56%	0.564	24%	0.24	S	C	*	.	H	α-helix	trans	-66	-53.9	175.4	-52.8	0	0	0	0	110.7	N761 F765 S766 N767	N761-T763 VanDerWaalsContact C-N 3.32Å; N761-T763 PolarHBondContact O-N 3.5Å; N761-T763 PolarHBondContact OD1-N 3.28Å; T763-F765 VanDerWaalsContact C-N 3.34Å; T763-F765 PolarHBondContact O-N 3.33Å; T763-S766 WeakPolarHBondContact O-CB 3.32Å; T763-S766 PolarHBondContact O-N 3.39Å; T763-S766 VanDerWaalsContact O-N 3.12Å; T763-N767 PolarHBondContact O-N 3.12Å
764	S	89	Confident	91.4	Very high	13 Å²	13	52.2 Å²	52.2	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-36.9	-179.8	-62.5	0	0	0	0	112.5	I720 A721 N761 S766 N767 L768	I720-S764 WeakPolarHBondContact O-CB 3.41Å; A721-S764 WeakPolarHBondContact CA-OG 3.32Å; N761-S764 VanDerWaalsContact CG-OG 3.28Å; N761-S764 PolarHBondContact ND2-OG 2.97Å; N761-S764 PolarHBondContact O-N 3.32Å; N761-S764 PolarHBondContact OD1-N 2.75Å; N761-S764 VanDerWaalsContact OD1-N 3.09Å; N761-S764 PolarHBondContact OD1-OG 3.27Å; S764-S766 VanDerWaalsContact C-N 3.34Å; S764-S766 PolarHBondContact O-N 3.2Å; S764-N767 PolarHBondContact O-N 3.45Å; S764-L768 WeakPolarHBondContact O-CB 3.49Å; S764-L768 PolarHBondContact O-N 3.03Å
765	F	92.2	Very high	91.2	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.7	-38.7	172.2	-172.9	-101.4	0	0	0	112.3	I720 V731 V754 L757 F758 N761 T763 L768 L769 L784	I720-F765 HydrophobicContact CD1-CB 4.2Å; V731-F765 HydrophobicContact CG1-CE2 4.1Å; V754-F765 HydrophobicContact CG1-CE1 4.47Å; V754-F765 HydrophobicContact CG1-CZ 4Å; L757-F765 HydrophobicContact CB-CD2 3.56Å; L757-F765 HydrophobicContact CB-CE2 3.71Å; L757-F765 HydrophobicContact CB-CG 4.46Å; L757-F765 HydrophobicContact CD1-CE2 4.08Å; F758-F765 HydrophobicContact CB-CD1 3.98Å; F758-F765 HydrophobicContact CB-CE1 4.38Å; F758-F765 HydrophobicContact CB-CG 4.36Å; F758-F765 HydrophobicContact CD2-CD1 4.04Å; N761-F765 WeakPolarHBondContact O-CB 3.17Å; N761-F765 PolarHBondContact O-N 2.94Å; T763-F765 VanDerWaalsContact C-N 3.34Å; T763-F765 PolarHBondContact O-N 3.33Å; F765-L768 WeakPolarHBondContact O-CB 3.48Å; F765-L768 PolarHBondContact O-N 3.35Å; F765-L769 HydrophobicContact CD1-CD1 4.16Å; F765-L769 HydrophobicContact CD1-CG 4.21Å; F765-L769 HydrophobicContact CE1-CD1 3.69Å; F765-L769 HydrophobicContact CE1-CD2 4.05Å; F765-L769 HydrophobicContact CE1-CG 3.82Å; F765-L769 HydrophobicContact CZ-CD1 4.42Å; F765-L769 HydrophobicContact CZ-CD2 3.94Å; F765-L769 HydrophobicContact CZ-CG 4.17Å; F765-L769 WeakPolarHBondContact O-CG 3.43Å; F765-L769 PolarHBondContact O-N 3.3Å; F765-L784 HydrophobicContact CE1-CD1 4.09Å
766	S	91.2	Very high	91.1	Very high	50 Å²	50	55.2 Å²	55.2	35%	0.35	31%	0.307	S	S	.	.	H	α-helix	trans	-65.3	-39.2	175.6	-59.1	0	0	0	0	112	S762 T763 S764 L769 Q770	S762-S766 WeakPolarHBondContact O-CB 3.42Å; S762-S766 PolarHBondContact O-N 3.49Å; S762-S766 PolarHBondContact O-OG 3.13Å; T763-S766 WeakPolarHBondContact O-CB 3.32Å; T763-S766 PolarHBondContact O-N 3.39Å; T763-S766 VanDerWaalsContact O-N 3.12Å; S764-S766 VanDerWaalsContact C-N 3.34Å; S764-S766 PolarHBondContact O-N 3.2Å; S766-L769 PolarHBondContact O-N 3.43Å; S766-Q770 WeakPolarHBondContact O-CG 3.01Å; S766-Q770 PolarHBondContact O-N 2.83Å
767	N	90.3	Very high	91.1	Very high	95 Å²	95	54.5 Å²	54.5	51%	0.508	30%	0.304	S	S	.	.	H	α-helix	trans	-65.8	-41	174	-66.2	-7.9	0	0	0	111.5	T763 S764 L769 Q770	T763-N767 PolarHBondContact O-N 3.12Å; S764-N767 PolarHBondContact O-N 3.45Å; N767-L769 PolarHBondContact O-N 3.47Å; N767-Q770 PolarHBondContact O-N 3.09Å
768	L	91	Very high	91.2	Very high	6 Å²	6	59.1 Å²	59.1	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-58.7	-47.3	173.7	-169.5	164.7	0	0	0	110.8	P723 I728 V731 S764 F765 Q770 S771 L772	P723-L768 HydrophobicContact CB-CD1 4.18Å; P723-L768 HydrophobicContact CG-CD1 4.12Å; P723-L768 HydrophobicContact CG-CG 4.25Å; I728-L768 HydrophobicContact CG1-CG 4.33Å; V731-L768 HydrophobicContact CB-CD1 4.41Å; V731-L768 HydrophobicContact CB-CD2 4.04Å; V731-L768 HydrophobicContact CG1-CD1 4.35Å; V731-L768 HydrophobicContact CG1-CD2 3.66Å; V731-L768 HydrophobicContact CG2-CD1 4.24Å; S764-L768 WeakPolarHBondContact O-CB 3.49Å; S764-L768 PolarHBondContact O-N 3.03Å; F765-L768 WeakPolarHBondContact O-CB 3.48Å; F765-L768 PolarHBondContact O-N 3.35Å; L768-Q770 VanDerWaalsContact C-N 3.27Å; L768-Q770 PolarHBondContact O-N 2.94Å; L768-S771 PolarHBondContact O-N 3Å; L768-S771 VanDerWaalsContact O-N 3.1Å; L768-S771 PolarHBondContact O-OG 3.16Å; L768-L772 HydrophobicContact CD2-CD1 3.92Å
769	L	92.3	Very high	91.2	Very high	6 Å²	6	60 Å²	60	3%	0.031	33%	0.331	C	S	.	.	H	α-helix	trans	-57	-37.5	178.4	-72.9	-174.8	0	0	0	113.1	I735 F765 S766 N767 S771 L772 Q777 A780	I735-L769 HydrophobicContact CD1-CD2 3.63Å; F765-L769 HydrophobicContact CD1-CD1 4.16Å; F765-L769 HydrophobicContact CD1-CG 4.21Å; F765-L769 HydrophobicContact CE1-CD1 3.69Å; F765-L769 HydrophobicContact CE1-CD2 4.05Å; F765-L769 HydrophobicContact CE1-CG 3.82Å; F765-L769 HydrophobicContact CZ-CD1 4.42Å; F765-L769 HydrophobicContact CZ-CD2 3.94Å; F765-L769 HydrophobicContact CZ-CG 4.17Å; F765-L769 WeakPolarHBondContact O-CG 3.43Å; F765-L769 PolarHBondContact O-N 3.3Å; S766-L769 PolarHBondContact O-N 3.43Å; N767-L769 PolarHBondContact O-N 3.47Å; L769-S771 PolarHBondContact O-N 3.45Å; L769-S771 VanDerWaalsContact O-N 3.14Å; L769-L772 HydrophobicContact CD2-CD1 4.28Å; L769-L772 PolarHBondContact O-N 2.99Å; L769-Q777 VanDerWaalsContact O-CG 3.29Å; L769-Q777 WeakPolarHBondContact O-CG 3.31Å; L769-Q777 PolarHBondContact O-NE2 2.98Å; L769-Q777 VanDerWaalsContact O-NE2 3.11Å; L769-A780 HydrophobicContact CD1-CB 3.87Å; L769-A780 HydrophobicContact CD2-CB 3.6Å; L769-A780 HydrophobicContact CG-CB 4.42Å
770	Q	91.4	Very high	91.3	Very high	141 Å²	141	56.9 Å²	56.9	66%	0.659	31%	0.314	S	S	*	.	H	α-helix	trans	-60.4	-25.2	180	-69.1	172.8	28.3	0	0	113.3	S766 N767 L768	S766-Q770 WeakPolarHBondContact O-CG 3.01Å; S766-Q770 PolarHBondContact O-N 2.83Å; N767-Q770 PolarHBondContact O-N 3.09Å; L768-Q770 VanDerWaalsContact C-N 3.27Å; L768-Q770 PolarHBondContact O-N 2.94Å
771	S	89.7	Confident	91.6	Very high	66 Å²	66	60 Å²	60	46%	0.462	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-11.2	176.4	71.7	0	0	0	0	114.7	I728 L768 L769	I728-S771 WeakPolarHBondContact CG2-OG 3.35Å; L768-S771 PolarHBondContact O-N 3Å; L768-S771 VanDerWaalsContact O-N 3.1Å; L768-S771 PolarHBondContact O-OG 3.16Å; L769-S771 PolarHBondContact O-N 3.45Å; L769-S771 VanDerWaalsContact O-N 3.14Å
772	L	92	Very high	91.8	Very high	11 Å²	11	62.7 Å²	62.7	6%	0.058	34%	0.339	C	S	.	.	S	Bend	trans	-94.9	156.5	-176.7	-70.8	171.8	0	0	0	112.8	I728 I735 L768 L769 V776 Q777	I728-L772 HydrophobicContact CG2-CD2 3.82Å; I728-L772 HydrophobicContact CG2-CG 4.22Å; I735-L772 HydrophobicContact CD1-CD1 3.88Å; L768-L772 HydrophobicContact CD2-CD1 3.92Å; L769-L772 HydrophobicContact CD2-CD1 4.28Å; L769-L772 PolarHBondContact O-N 2.99Å; L772-V776 HydrophobicContact CB-CB 4.4Å; L772-V776 HydrophobicContact CB-CG1 4.42Å; L772-V776 HydrophobicContact CD1-CG1 4.12Å; L772-Q777 PolarHBondContact O-NE2 2.65Å
773	P	92.6	Very high	92	Very high	90 Å²	90	60.5 Å²	60.5	58%	0.584	32%	0.324	S	S	*	.			trans	-59.6	144	176.3	-23.3	34	0	0	0	112.9	G775 V776 Q777	P773-G775 PolarHBondContact O-N 2.88Å; P773-V776 HydrophobicContact CB-CG2 4.36Å; P773-V776 WeakPolarHBondContact O-CA 3.5Å; P773-V776 VanDerWaalsContact O-CB 3.31Å; P773-V776 WeakPolarHBondContact O-CB 3.39Å; P773-V776 PolarHBondContact O-N 2.87Å; P773-Q777 PolarHBondContact O-N 3.26Å
774	R	91	Very high	92.2	Very high	206 Å²	206	56.8 Å²	56.8	78%	0.777	30%	0.3	S	S	*	.	H	α-helix	trans	-47.7	-50.1	-173	-59.3	-176.8	-160.6	-110	2.5	113.9	V776 Q777 D778	R774-V776 PolarHBondContact O-N 3.31Å; R774-V776 VanDerWaalsContact O-N 3.08Å; R774-Q777 CarbonylContact O-C 3.57Å; R774-Q777 WeakPolarHBondContact O-CA 3.32Å; R774-Q777 VanDerWaalsContact O-CB 3.27Å; R774-Q777 WeakPolarHBondContact O-CB 3.45Å; R774-Q777 PolarHBondContact O-N 3.06Å; R774-D778 VanDerWaalsContact O-CG 3.26Å; R774-D778 PolarHBondContact O-N 2.68Å; R774-D778 VanDerWaalsContact O-OD2 3.09Å
775	G	91.4	Very high	92.3	Very high	54 Å²	54	62.5 Å²	62.5	56%	0.557	32%	0.323	S	S	*	.	H	α-helix	trans	-62.2	-19.4	179.2	0	0	0	0	0	115.2	P773 R779	P773-G775 PolarHBondContact O-N 2.88Å; G775-R779 PolarHBondContact O-N 3.27Å
776	V	93.6	Very high	92.1	Very high	32 Å²	32	66.4 Å²	66.4	19%	0.194	35%	0.347	C	S	.	.	H	α-helix	trans	-81	-42	169.6	-173.4	0	0	0	0	110.1	I735 L772 P773 R774 R779 A780	I735-V776 HydrophobicContact CB-CG1 3.78Å; I735-V776 HydrophobicContact CD1-CG1 4.08Å; I735-V776 HydrophobicContact CG2-CG1 3.63Å; I735-V776 VanDerWaalsContact CG2-O 3.3Å; I735-V776 WeakPolarHBondContact CG2-O 3.06Å; L772-V776 HydrophobicContact CB-CB 4.4Å; L772-V776 HydrophobicContact CB-CG1 4.42Å; L772-V776 HydrophobicContact CD1-CG1 4.12Å; P773-V776 HydrophobicContact CB-CG2 4.36Å; P773-V776 WeakPolarHBondContact O-CA 3.5Å; P773-V776 VanDerWaalsContact O-CB 3.31Å; P773-V776 WeakPolarHBondContact O-CB 3.39Å; P773-V776 PolarHBondContact O-N 2.87Å; R774-V776 PolarHBondContact O-N 3.31Å; R774-V776 VanDerWaalsContact O-N 3.08Å; V776-R779 PolarHBondContact O-N 3.13Å; V776-A780 PolarHBondContact O-N 2.96Å
777	Q	93.9	Very high	92	Very high	45 Å²	45	67.5 Å²	67.5	21%	0.21	34%	0.344	C	S	.	.	H	α-helix	trans	-57.9	-49.7	172.5	-52.8	-177.1	7.1	0	0	111.2	L769 L772 P773 R774 R779 A780 H781	L769-Q777 VanDerWaalsContact O-CG 3.29Å; L769-Q777 WeakPolarHBondContact O-CG 3.31Å; L769-Q777 PolarHBondContact O-NE2 2.98Å; L769-Q777 VanDerWaalsContact O-NE2 3.11Å; L772-Q777 PolarHBondContact O-NE2 2.65Å; P773-Q777 PolarHBondContact O-N 3.26Å; R774-Q777 CarbonylContact O-C 3.57Å; R774-Q777 WeakPolarHBondContact O-CA 3.32Å; R774-Q777 VanDerWaalsContact O-CB 3.27Å; R774-Q777 WeakPolarHBondContact O-CB 3.45Å; R774-Q777 PolarHBondContact O-N 3.06Å; Q777-R779 PolarHBondContact O-N 2.79Å; Q777-A780 WeakPolarHBondContact O-CB 3.47Å; Q777-A780 PolarHBondContact O-N 3.2Å; Q777-H781 PolarHBondContact O-N 3.34Å; Q777-H781 PolarHBondContact O-ND1 3.29Å
778	D	93.8	Very high	91.8	Very high	100 Å²	100	67.8 Å²	67.8	54%	0.535	34%	0.343	S	S	.	.	H	α-helix	trans	-55	-41.9	178.4	-63.3	-39.5	0	0	0	111.4	R774 H781 E782	R774-D778 VanDerWaalsContact O-CG 3.26Å; R774-D778 PolarHBondContact O-N 2.68Å; R774-D778 VanDerWaalsContact O-OD2 3.09Å; D778-H781 PolarHBondContact O-N 3.45Å; D778-E782 PolarHBondContact O-N 2.89Å
779	R	93	Very high	91.3	Very high	64 Å²	64	74.8 Å²	74.8	24%	0.242	37%	0.373	C	S	.	.	H	α-helix	trans	-69.9	-36.4	177.1	-172.4	62	-176.6	-177.3	6.5	112.9	I735 S738 G775 V776 Q777 E782 V783	I735-R779 HydrophobicContact CG2-CB 4.07Å; I735-R779 HydrophobicContact CG2-CG 4.19Å; S738-R779 PolarHBondContact O-NH2 2.77Å; S738-R779 VanDerWaalsContact OG-CG 3.26Å; S738-R779 WeakPolarHBondContact OG-CG 2.92Å; S738-R779 PolarHBondContact OG-NE 3.35Å; G775-R779 PolarHBondContact O-N 3.27Å; V776-R779 PolarHBondContact O-N 3.13Å; Q777-R779 PolarHBondContact O-N 2.79Å; R779-E782 WeakPolarHBondContact CD-OE2 3.06Å; R779-E782 IonicContact CZ-OE1 2.66Å; R779-E782 IonicContact CZ-OE2 3.16Å; R779-E782 IonicContact NE-OE2 2.89Å; R779-E782 IonicContact NH1-OE1 3.17Å; R779-E782 PolarHBondContact NH1-OE1 3.41Å; R779-E782 IonicContact NH1-OE2 3.58Å; R779-E782 PolarHBondContact NH1-OE2 3.24Å; R779-E782 IonicContact NH2-OE1 3.71Å; R779-E782 PolarHBondContact O-N 3.35Å; R779-V783 WeakPolarHBondContact O-CG2 3.47Å; R779-V783 PolarHBondContact O-N 3.21Å; R779-V783 VanDerWaalsContact O-N 3.12Å
780	A	94	Very high	90.5	Very high	0 Å²	0	79.4 Å²	79.4	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-64.2	-43.1	171.7	0	0	0	0	0	111.3	I735 L769 V776 Q777 E782 V783 L784	I735-A780 HydrophobicContact CD1-CB 4.09Å; I735-A780 HydrophobicContact CG1-CB 4.32Å; I735-A780 HydrophobicContact CG2-CB 4.03Å; L769-A780 HydrophobicContact CD1-CB 3.87Å; L769-A780 HydrophobicContact CD2-CB 3.6Å; L769-A780 HydrophobicContact CG-CB 4.42Å; V776-A780 PolarHBondContact O-N 2.96Å; Q777-A780 WeakPolarHBondContact O-CB 3.47Å; Q777-A780 PolarHBondContact O-N 3.2Å; A780-E782 VanDerWaalsContact C-N 3.34Å; A780-E782 PolarHBondContact O-N 3.12Å; A780-V783 PolarHBondContact O-N 3Å; A780-L784 WeakPolarHBondContact O-CG 3.2Å; A780-L784 PolarHBondContact O-N 2.82Å
781	H	94	Very high	89.2	Confident	97 Å²	97	75 Å²	75	45%	0.449	39%	0.389	S	S	.	.	H	α-helix	trans	-62.9	-37.4	174.7	-64.5	127	0	0	0	112.5	Q777 D778 L784 K785	Q777-H781 PolarHBondContact O-N 3.34Å; Q777-H781 PolarHBondContact O-ND1 3.29Å; D778-H781 PolarHBondContact O-N 3.45Å; H781-L784 PolarHBondContact O-N 3.19Å; H781-K785 WeakPolarHBondContact O-CB 3.42Å; H781-K785 PolarHBondContact O-N 3.03Å
782	E	93.2	Very high	87.3	Confident	94 Å²	94	77.1 Å²	77.1	44%	0.439	40%	0.399	S	S	.	.	H	α-helix	trans	-61.4	-45.4	173.7	-169.1	-164.7	144.3	0	0	112.1	D778 R779 A780 T786	D778-E782 PolarHBondContact O-N 2.89Å; R779-E782 WeakPolarHBondContact CD-OE2 3.06Å; R779-E782 IonicContact CZ-OE1 2.66Å; R779-E782 IonicContact CZ-OE2 3.16Å; R779-E782 IonicContact NE-OE2 2.89Å; R779-E782 IonicContact NH1-OE1 3.17Å; R779-E782 PolarHBondContact NH1-OE1 3.41Å; R779-E782 IonicContact NH1-OE2 3.58Å; R779-E782 PolarHBondContact NH1-OE2 3.24Å; R779-E782 IonicContact NH2-OE1 3.71Å; R779-E782 PolarHBondContact O-N 3.35Å; A780-E782 VanDerWaalsContact C-N 3.34Å; A780-E782 PolarHBondContact O-N 3.12Å; E782-T786 WeakPolarHBondContact O-CB 3.37Å; E782-T786 PolarHBondContact O-N 3.12Å; E782-T786 PolarHBondContact O-OG1 2.79Å
783	V	93.5	Very high	84.9	Confident	9 Å²	9	80 Å²	80	6%	0.055	43%	0.432	C	S	.	.	H	α-helix	trans	-62	-49.1	175.6	169.2	0	0	0	0	110.9	V754 I755 R779 A780 T786 Y787	V754-V783 HydrophobicContact CB-CG1 4.24Å; V754-V783 HydrophobicContact CG1-CB 4.4Å; V754-V783 HydrophobicContact CG1-CG1 3.91Å; I755-V783 HydrophobicContact CD1-CG1 4.43Å; I755-V783 HydrophobicContact CG1-CG1 4.2Å; R779-V783 WeakPolarHBondContact O-CG2 3.47Å; R779-V783 PolarHBondContact O-N 3.21Å; R779-V783 VanDerWaalsContact O-N 3.12Å; A780-V783 PolarHBondContact O-N 3Å; V783-T786 PolarHBondContact O-N 2.89Å; V783-Y787 PolarHBondContact O-N 3.11Å
784	L	93.3	Very high	82	Confident	13 Å²	13	78.6 Å²	78.6	7%	0.068	43%	0.434	C	S	.	.	H	α-helix	trans	-67.2	-39.3	-179.1	-68.3	178	0	0	0	112.5	I755 F758 F765 A780 H781 T786 Y787 Q788	I755-L784 HydrophobicContact CG1-CD2 4.47Å; F758-L784 HydrophobicContact CB-CD1 4.46Å; F758-L784 HydrophobicContact CB-CD2 3.74Å; F758-L784 HydrophobicContact CD1-CD2 3.99Å; F758-L784 HydrophobicContact CD2-CD1 3.7Å; F758-L784 HydrophobicContact CD2-CD2 4.17Å; F758-L784 HydrophobicContact CE2-CD1 4.14Å; F758-L784 HydrophobicContact CG-CD1 4.1Å; F758-L784 HydrophobicContact CG-CD2 3.69Å; F765-L784 HydrophobicContact CE1-CD1 4.09Å; A780-L784 WeakPolarHBondContact O-CG 3.2Å; A780-L784 PolarHBondContact O-N 2.82Å; H781-L784 PolarHBondContact O-N 3.19Å; L784-T786 VanDerWaalsContact C-N 3.28Å; L784-T786 PolarHBondContact O-N 2.69Å; L784-Y787 WeakPolarHBondContact O-CB 3.29Å; L784-Y787 PolarHBondContact O-N 3Å; L784-Q788 WeakPolarHBondContact O-CB 3.47Å; L784-Q788 WeakPolarHBondContact O-CG 3.32Å; L784-Q788 PolarHBondContact O-N 3.45Å
785	K	90.6	Very high	78.9	Confident	134 Å²	134	72.1 Å²	72.1	58%	0.583	43%	0.431	S	S	*	.	H	α-helix	trans	-63	-34.8	174.3	-174.7	174.8	-173.7	173.5	0	112	H781 K789	H781-K785 WeakPolarHBondContact O-CB 3.42Å; H781-K785 PolarHBondContact O-N 3.03Å; K785-K789 WeakPolarHBondContact O-CB 3.49Å; K785-K789 VanDerWaalsContact O-CG 3.3Å; K785-K789 WeakPolarHBondContact O-CG 3.49Å; K785-K789 PolarHBondContact O-N 3.47Å
786	T	89.2	Confident	76	Confident	81 Å²	81	77.7 Å²	77.7	50%	0.497	45%	0.447	S	S	.	.	H	α-helix	trans	-72.2	-41.6	173.7	-56.1	0	0	0	0	111.3	E782 V783 L784 T790	E782-T786 WeakPolarHBondContact O-CB 3.37Å; E782-T786 PolarHBondContact O-N 3.12Å; E782-T786 PolarHBondContact O-OG1 2.79Å; V783-T786 PolarHBondContact O-N 2.89Å; L784-T786 VanDerWaalsContact C-N 3.28Å; L784-T786 PolarHBondContact O-N 2.69Å; T786-T790 PolarHBondContact O-N 3.35Å; T786-T790 PolarHBondContact O-OG1 2.7Å
787	Y	88.3	Confident	72.9	Confident	73 Å²	73	82.7 Å²	82.7	29%	0.286	47%	0.471	S	S	.	.	H	α-helix	trans	-61	-51.4	174.5	173.9	-125.9	0	0	0	112.1	I755 V783 L784 K789 T790 A791	I755-Y787 HydrophobicContact CB-CD1 4.45Å; I755-Y787 HydrophobicContact CB-CG 4.48Å; I755-Y787 HydrophobicContact CD1-CD2 3.81Å; I755-Y787 HydrophobicContact CD1-CG 3.75Å; I755-Y787 HydrophobicContact CG1-CD1 4.03Å; I755-Y787 HydrophobicContact CG1-CD2 4.21Å; I755-Y787 HydrophobicContact CG1-CG 3.74Å; I755-Y787 HydrophobicContact CG2-CD1 3.7Å; I755-Y787 HydrophobicContact CG2-CD2 3.94Å; I755-Y787 HydrophobicContact CG2-CE1 3.56Å; I755-Y787 HydrophobicContact CG2-CE2 3.82Å; I755-Y787 HydrophobicContact CG2-CG 3.89Å; V783-Y787 PolarHBondContact O-N 3.11Å; L784-Y787 WeakPolarHBondContact O-CB 3.29Å; L784-Y787 PolarHBondContact O-N 3Å; Y787-K789 PolarHBondContact O-N 2.98Å; Y787-T790 CarbonylContact O-C 3.48Å; Y787-T790 WeakPolarHBondContact O-CA 3.42Å; Y787-T790 WeakPolarHBondContact O-CB 3.49Å; Y787-T790 PolarHBondContact O-N 2.96Å; Y787-A791 HydrophobicContact CE2-CB 4.14Å; Y787-A791 WeakPolarHBondContact O-CB 3.18Å; Y787-A791 PolarHBondContact O-N 2.66Å
788	Q	85.4	Confident	69.8	Low	102 Å²	102	87.4 Å²	87.4	48%	0.477	50%	0.498	S	S	.	.	H	α-helix	trans	-55.9	-49.7	179.4	-74.6	171.2	-20.2	0	0	111.5	L784 T790 A791 T792	L784-Q788 WeakPolarHBondContact O-CB 3.47Å; L784-Q788 WeakPolarHBondContact O-CG 3.32Å; L784-Q788 PolarHBondContact O-N 3.45Å; Q788-T790 PolarHBondContact O-N 3.4Å; Q788-A791 PolarHBondContact O-N 3.14Å; Q788-T792 WeakPolarHBondContact O-CG2 3.47Å; Q788-T792 PolarHBondContact O-N 3.1Å; Q788-T792 PolarHBondContact O-OG1 3.25Å
789	K	81.2	Confident	66.7	Low	153 Å²	153	91.1 Å²	91.1	67%	0.665	52%	0.517	S	S	*	.	H	α-helix	trans	-55.5	-32.7	173.9	-78.1	179.5	172.1	-165.4	0	113.9	K785 Y787 T792	K785-K789 WeakPolarHBondContact O-CB 3.49Å; K785-K789 VanDerWaalsContact O-CG 3.3Å; K785-K789 WeakPolarHBondContact O-CG 3.49Å; K785-K789 PolarHBondContact O-N 3.47Å; Y787-K789 PolarHBondContact O-N 2.98Å; K789-T792 PolarHBondContact O-OG1 3.02Å
790	T	74.6	Confident	63.6	Low	102 Å²	102	93.3 Å²	93.3	63%	0.626	54%	0.538	S	S	*	.	H	α-helix	trans	-82	-39.3	179.7	-50.9	0	0	0	0	111.3	T786 Y787 Q788 G793	T786-T790 PolarHBondContact O-N 3.35Å; T786-T790 PolarHBondContact O-OG1 2.7Å; Y787-T790 CarbonylContact O-C 3.48Å; Y787-T790 WeakPolarHBondContact O-CA 3.42Å; Y787-T790 WeakPolarHBondContact O-CB 3.49Å; Y787-T790 PolarHBondContact O-N 2.96Å; Q788-T790 PolarHBondContact O-N 3.4Å; T790-G793 PolarHBondContact O-N 3.32Å
791	A	63.9	Low	60.4	Low	50 Å²	50	99.6 Å²	99.6	41%	0.413	57%	0.571	S	S	.	*	H	α-helix	trans	-70.2	-36.1	-179.8	0	0	0	0	0	112.6	Y787 Q788 G793 G794	Y787-A791 HydrophobicContact CE2-CB 4.14Å; Y787-A791 WeakPolarHBondContact O-CB 3.18Å; Y787-A791 PolarHBondContact O-N 2.66Å; Q788-A791 PolarHBondContact O-N 3.14Å; A791-G793 PolarHBondContact O-N 3.1Å; A791-G794 PolarHBondContact O-N 3.33Å
792	T	51.6	Low	57.1	Low	109 Å²	109	101.5 Å²	101.5	67%	0.669	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-7.7	175.8	52.9	0	0	0	0	114	Q788 K789 G794	Q788-T792 WeakPolarHBondContact O-CG2 3.47Å; Q788-T792 PolarHBondContact O-N 3.1Å; Q788-T792 PolarHBondContact O-OG1 3.25Å; K789-T792 PolarHBondContact O-OG1 3.02Å; T792-G794 VanDerWaalsContact C-N 3.3Å; T792-G794 PolarHBondContact O-N 3.39Å
793	G	39.7	Very low	54	Low	72 Å²	72	103.9 Å²	103.9	74%	0.742	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-8.8	175.8	0	0	0	0	0	115	T790 A791	T790-G793 PolarHBondContact O-N 3.32Å; A791-G793 PolarHBondContact O-N 3.1Å
794	G	32.2	Very low	50.9	Low	61 Å²	61	112.3 Å²	112.3	63%	0.629	64%	0.644	S	S	*	*	S	Bend	trans	-104.6	105.7	174.8	0	0	0	0	0	111	A791 T792 L796	A791-G794 PolarHBondContact O-N 3.33Å; T792-G794 VanDerWaalsContact C-N 3.3Å; T792-G794 PolarHBondContact O-N 3.39Å; G794-L796 PolarHBondContact O-N 2.8Å
795	G	27.5	Very low	48	Very low	70 Å²	70	119.1 Å²	119.1	72%	0.722	68%	0.681	S	S	*	*			trans	-70.1	116.3	-164.4	0	0	0	0	0	116.1
796	L	29.2	Very low	45.1	Very low	170 Å²	170	118.1 Å²	118.1	89%	0.89	69%	0.691	S	S	*	*				-146.8	105.1	119	-141.7	80.3	0	0	0	110.3	G794	G794-L796 PolarHBondContact O-N 2.8Å
797	I	29.2	Very low	42.2	Very low	137 Å²	137	119.6 Å²	119.6	70%	0.703	70%	0.701	S	S	*	*			trans	-98.6	164.3	170.8	55.4	171.9	0	0	0	110.3
798	N	28.5	Very low	39.4	Very low	145 Å²	145	121.6 Å²	121.6	78%	0.775	73%	0.726	S	S	*	*			trans	68.9	94.3	172.1	-52.1	-15.6	0	0	0	115.9
799	L	29.1	Very low	36.7	Very low	177 Å²	177	128.3 Å²	128.3	93%	0.927	75%	0.747	S	S	*	*				-145.5	154.4	107.9	-101.2	167	0	0	0	108.7
800	T	27.3	Very low	34.1	Very low	110 Å²	110	129.8 Å²	129.8	68%	0.675	75%	0.754	S	S	*	*			trans	-90.2	175.7	-171.1	47.5	0	0	0	0	112.8
801	D	26.5	Very low	31.8	Very low	132 Å²	132	131 Å²	131	71%	0.706	77%	0.766	S	S	*	*			trans	81	110.7	157.3	-50.6	-55.5	0	0	0	119.4
802	T	25.5	Very low	30	Very low	137 Å²	137	134.4 Å²	134.4	84%	0.84	79%	0.787	S	S	*	*			trans	75.5	133.2	155.4	67	0	0	0	0	120.9
803	N	28.3	Very low	28.9	Very low	144 Å²	144	134.8 Å²	134.8	77%	0.77	79%	0.794	S	S	*	*			trans	51.2	109.6	160.3	-75.9	-8.1	0	0	0	120.8	N805	N803-N805 PolarHBondContact O-N 3.25Å
804	H	27.6	Very low	28.2	Very low	186 Å²	186	135.4 Å²	135.4	86%	0.861	80%	0.8	S	S	*	*			trans	12.6	94.9	136.2	-61.8	-81.9	0	0	0	117.2
805	N	32.3	Very low	27.9	Very low	157 Å²	157	136.9 Å²	136.9	84%	0.84	80%	0.801	S	S	*	*			trans	-154	123.5	153.7	-123.9	-36.9	0	0	0	110.8	N803	N803-N805 PolarHBondContact O-N 3.25Å
806	S	30.6	Very low	27.9	Very low	113 Å²	113	141.9 Å²	141.9	79%	0.79	81%	0.81	S	S	*	*			trans	-70.2	132.3	-177.5	-58.7	0	0	0	0	110.9	S808	S806-S808 PolarHBondContact O-N 3.09Å
807	P	28.6	Very low	27.7	Very low	111 Å²	111	145 Å²	145	72%	0.721	81%	0.81	S	S	*	*			trans	-66.8	125.4	-173.7	-23.4	34.4	0	0	0	113.6	W809	P807-W809 PolarHBondContact O-N 3.34Å; P807-W809 VanDerWaalsContact O-N 3.16Å
808	S	28.9	Very low	27.6	Very low	115 Å²	115	147.1 Å²	147.1	80%	0.804	82%	0.815	S	S	*	*			trans	-71.7	105.5	175.3	47.1	0	0	0	0	111.9	S806 K810	S806-S808 PolarHBondContact O-N 3.09Å; S808-K810 PolarHBondContact O-N 2.83Å
809	W	28.6	Very low	27.6	Very low	244 Å²	244	150.7 Å²	150.7	92%	0.924	82%	0.819	S	S	*	*			trans	-79.4	109	168	-83.1	79	0	0	0	110.3	P807	P807-W809 PolarHBondContact O-N 3.34Å; P807-W809 VanDerWaalsContact O-N 3.16Å
810	K	27.2	Very low	27.4	Very low	184 Å²	184	147.8 Å²	147.8	80%	0.8	81%	0.813	S	S	*	*			trans	-64.9	143	173.7	-69	-178.7	177.5	180	0	111	S808 S812	S808-K810 PolarHBondContact O-N 2.83Å; K810-S812 PolarHBondContact O-N 2.85Å
811	S	26.3	Very low	27.4	Very low	127 Å²	127	150 Å²	150	89%	0.888	82%	0.82	S	S	*	*			trans	-49.7	134.4	173	-39.5	0	0	0	0	112
812	S	25.9	Very low	27.3	Very low	122 Å²	122	148.6 Å²	148.6	85%	0.853	82%	0.818	S	S	*	*			trans	-125.9	132.4	165.3	-72.4	0	0	0	0	109.1	K810	K810-S812 PolarHBondContact O-N 2.85Å
813	S	28.8	Very low	27.4	Very low	116 Å²	116	149.3 Å²	149.3	81%	0.811	82%	0.822	S	S	*	*			trans	-98	123.9	-161.9	42.3	0	0	0	0	113.6	S815	S813-S815 PolarHBondContact O-N 3.48Å
814	G	24.7	Very low	27.3	Very low	85 Å²	85	147.3 Å²	147.3	88%	0.876	82%	0.815	S	S	*	*			trans	-75.7	108.9	153.7	0	0	0	0	0	108.8
815	S	26.5	Very low	27.3	Very low	93 Å²	93	143.5 Å²	143.5	65%	0.65	81%	0.805	S	S	*	*			trans	-87.3	124	-174.2	-175.4	0	0	0	0	112.8	S813 R817	S813-S815 PolarHBondContact O-N 3.48Å; S815-R817 PolarHBondContact OG-N 3.44Å
816	L	26.3	Very low	27	Very low	174 Å²	174	139.8 Å²	139.8	91%	0.911	80%	0.796	S	S	*	*			trans	-122.9	40.7	154.9	-95.3	170.4	0	0	0	112	K818	L816-K818 PolarHBondContact O-N 3.25Å
817	R	24.3	Very low	26.8	Very low	236 Å²	236	136.8 Å²	136.8	89%	0.891	78%	0.783	S	S	*	*			trans	-82.2	83.2	160.5	-80	-161.1	-175.3	-160.8	4.2	110.8	S815	S815-R817 PolarHBondContact OG-N 3.44Å
818	K	28.4	Very low	26.8	Very low	182 Å²	182	143.3 Å²	143.3	79%	0.791	79%	0.793	S	S	*	*			trans	-146.5	84.1	155.8	-79.2	-162.7	178.3	-176.6	0	110.3	L816	L816-K818 PolarHBondContact O-N 3.25Å
819	Y	28.4	Very low	26.6	Very low	220 Å²	220	141.6 Å²	141.6	86%	0.863	78%	0.781	S	S	*	*			trans	179.8	77.8	136.3	-90.4	-59	0	0	0	108.1
820	S	24.7	Very low	26.7	Very low	115 Å²	115	135.4 Å²	135.4	80%	0.804	78%	0.775	S	S	*	*			trans	-95.3	110.1	170.7	52.2	0	0	0	0	109.3
821	L	27.8	Very low	26.6	Very low	157 Å²	157	132.5 Å²	132.5	82%	0.822	77%	0.766	S	S	*	*			trans	-128	152.2	161.2	-75.8	178.1	0	0	0	108.7
822	P	23.9	Very low	26.8	Very low	103 Å²	103	131.9 Å²	131.9	67%	0.669	76%	0.757	S	S	*	*			trans	-86.2	134.1	-156.5	32.2	-35.2	0	0	0	113.3	T824	P822-T824 PolarHBondContact O-N 3.11Å
823	V	28.3	Very low	27	Very low	151 Å²	151	134.5 Å²	134.5	92%	0.915	75%	0.748	S	S	*	*			trans	-79.8	92.3	161.7	-179.7	0	0	0	0	108.1
824	T	26.5	Very low	26.9	Very low	103 Å²	103	131.3 Å²	131.3	63%	0.632	73%	0.726	S	S	*	*			trans	-99	117.1	161.6	51.5	0	0	0	0	109.1	P822	P822-T824 PolarHBondContact O-N 3.11Å
825	T	26	Very low	27.3	Very low	106 Å²	106	133 Å²	133	65%	0.65	72%	0.719	S	S	*	*	S	Bend	trans	57.9	102.8	154.6	-44.8	0	0	0	0	118.2
826	A	26.1	Very low	27.5	Very low	78 Å²	78	131 Å²	131	65%	0.645	70%	0.701	S	S	*	*			trans	176.6	151.1	130.7	0	0	0	0	0	110.8
827	G	27	Very low	27.8	Very low	51 Å²	51	130.7 Å²	130.7	53%	0.526	70%	0.695	S	S	.	*			trans	80.9	105	141.4	0	0	0	0	0	120.8	E291	E291-G827 PolarHBondContact OE2-N 3.29Å
828	R	28	Very low	28	Very low	248 Å²	248	122.2 Å²	122.2	94%	0.936	67%	0.667	S	S	*	*			trans	64.6	103.6	135.9	-70	-178.1	161.4	-160.1	-7.7	121.4
829	S	25.9	Very low	28.1	Very low	79 Å²	79	118.7 Å²	118.7	55%	0.552	65%	0.653	S	S	*	*			trans	-13.8	136.2	133.5	-39.8	0	0	0	0	119.2
830	S	29.1	Very low	28.1	Very low	113 Å²	113	116.9 Å²	116.9	79%	0.79	66%	0.655	S	S	*	*			trans	-162	104.8	142	-86.5	0	0	0	0	107.3
831	M	26.3	Very low	28.2	Very low	124 Å²	124	115.8 Å²	115.8	61%	0.611	64%	0.639	S	S	*	*				59.2	76.7	86.8	-69.2	-149.5	167.9	0	0	115	L221	L221-M831 HydrophobicContact CD1-CB 4.15Å; L221-M831 HydrophobicContact CD1-CE 3.86Å; L221-M831 HydrophobicContact CD1-CG 3.78Å; L221-M831 HydrophobicContact CD1-SD 3.58Å; L221-M831 VanDerWaalsContact CD1-SD 3.58Å; L221-M831 HydrophobicContact CD2-CE 4.01Å
832	T	30.1	Very low	28.4	Very low	114 Å²	114	118.2 Å²	118.2	70%	0.699	64%	0.643	S	S	*	*			trans	-105.2	131.3	153.7	50.3	0	0	0	0	109.7
833	R	29.4	Very low	28.7	Very low	177 Å²	177	117.3 Å²	117.3	67%	0.668	64%	0.639	S	S	*	*			trans	-82.5	127.4	172.4	-72.5	173.9	169.4	167.8	-4.9	108.5	V835	R833-V835 PolarHBondContact O-N 3.38Å
834	S	27.7	Very low	29	Very low	48 Å²	48	115.6 Å²	115.6	34%	0.336	63%	0.631	S	S	.	*			trans	-62.1	125.3	159.8	-168.6	0	0	0	0	108.8	P220 D836	P220-S834 WeakPolarHBondContact CB-O 3.21Å; S834-D836 WeakPolarHBondContact CB-OD2 3.39Å; S834-D836 PolarHBondContact O-N 2.94Å; S834-D836 VanDerWaalsContact OG-CG 3.25Å; S834-D836 PolarHBondContact OG-OD1 3.48Å; S834-D836 PolarHBondContact OG-OD2 3.21Å
835	V	33.4	Very low	29.3	Very low	121 Å²	121	116.6 Å²	116.6	73%	0.733	64%	0.639	S	S	*	*			trans	-97.1	84.9	173.3	178.3	0	0	0	0	107.2	R833 Q837	R833-V835 PolarHBondContact O-N 3.38Å; V835-Q837 HydrophobicContact CG1-CB 4.18Å; V835-Q837 PolarHBondContact O-N 3.02Å
836	D	29.4	Very low	29.7	Very low	51 Å²	51	117.4 Å²	117.4	27%	0.273	65%	0.65	S	S	.	*			trans	-82.1	64.4	-179.9	-74.8	-55.3	0	0	0	110.6	N145 C185 S834	N145-D836 VanDerWaalsContact ND2-CB 3.28Å; N145-D836 WeakPolarHBondContact ND2-CB 3.47Å; N145-D836 VanDerWaalsContact ND2-CG 3.33Å; N145-D836 PolarHBondContact ND2-OD1 3.37Å; N145-D836 PolarHBondContact OD1-OD1 3.46Å; C185-D836 WeakPolarHBondContact CB-OD2 3.36Å; C185-D836 PolarHBondContact SG-OD2 2.98Å; S834-D836 WeakPolarHBondContact CB-OD2 3.39Å; S834-D836 PolarHBondContact O-N 2.94Å; S834-D836 VanDerWaalsContact OG-CG 3.25Å; S834-D836 PolarHBondContact OG-OD1 3.48Å; S834-D836 PolarHBondContact OG-OD2 3.21Å
837	Q	32.4	Very low	30.1	Very low	167 Å²	167	119.8 Å²	119.8	78%	0.78	66%	0.661	S	S	*	*			trans	-91.7	109.6	177.2	-165.1	79.5	35	0	0	110.1	V835	V835-Q837 HydrophobicContact CG1-CB 4.18Å; V835-Q837 PolarHBondContact O-N 3.02Å
838	D	30	Very low	30.3	Very low	58 Å²	58	120.6 Å²	120.6	31%	0.31	67%	0.67	S	S	.	*			trans	-74.7	158.7	176.3	-82.4	-36.8	0	0	0	113.8	N145 R146 M840	N145-D838 WeakPolarHBondContact CA-OD1 3.49Å; N145-D838 WeakPolarHBondContact CB-OD1 3.39Å; N145-D838 VanDerWaalsContact CB-OD2 3.32Å; N145-D838 WeakPolarHBondContact CB-OD2 3.48Å; N145-D838 PolarHBondContact N-OD1 3.17Å; R146-D838 HydrophobicContact CG-CB 3.6Å; R146-D838 WeakPolarHBondContact CG-OD1 3.38Å; R146-D838 PolarHBondContact N-OD1 3.29Å; R146-D838 PolarHBondContact N-OD2 2.88Å; D838-M840 PolarHBondContact O-N 2.97Å
839	H	28.8	Very low	30.5	Very low	108 Å²	108	119.3 Å²	119.3	50%	0.5	67%	0.665	S	S	.	*			trans	-59.9	124.8	179.4	-60.8	-131.5	0	0	0	111.8	R146	R146-H839 PolarHBondContact NE-CD2 3.47Å; R146-H839 VanDerWaalsContact NE-CD2 3.29Å; R146-H839 PolarHBondContact NH2-CD2 2.87Å; R146-H839 VanDerWaalsContact NH2-CD2 3.3Å; R146-H839 PolarHBondContact NH2-CE1 2.96Å; R146-H839 VanDerWaalsContact NH2-CE1 3.29Å; R146-H839 PolarHBondContact NH2-ND1 3.44Å; R146-H839 PolarHBondContact NH2-NE2 3.37Å; R146-H839 VanDerWaalsContact NH2-NE2 3.14Å
840	M	29.8	Very low	30.7	Very low	183 Å²	183	125.6 Å²	125.6	90%	0.901	68%	0.678	S	S	*	*			trans	-110.3	102.5	141.2	-74.4	-157.6	173.2	0	0	109.7	D838	D838-M840 PolarHBondContact O-N 2.97Å
841	I	27.4	Very low	30.8	Very low	91 Å²	91	123.3 Å²	123.3	47%	0.467	67%	0.672	S	S	.	*			trans	7	114.7	140.7	-49.5	178.6	0	0	0	114.7	D104	D104-I841 HydrophobicContact CB-CD1 3.99Å; D104-I841 WeakPolarHBondContact OD1-CD1 3.36Å; D104-I841 VanDerWaalsContact OD1-CG1 3.26Å; D104-I841 WeakPolarHBondContact OD1-CG1 3.44Å; D104-I841 WeakPolarHBondContact OD1-CG2 2.88Å; D104-I841 WeakPolarHBondContact OD2-CG2 3.47Å
842	F	30.5	Very low	30.9	Very low	208 Å²	208	123.1 Å²	123.1	91%	0.912	68%	0.683	S	S	*	*			trans	-142.1	122.2	149.7	-111.5	-82.3	0	0	0	109.5
843	S	31.3	Very low	31.1	Very low	84 Å²	84	125 Å²	125	59%	0.587	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-76.7	151.6	-174.5	-39.9	0	0	0	0	111.9
844	P	34.5	Very low	31.2	Very low	115 Å²	115	122 Å²	122	75%	0.747	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-69	154.1	177.5	29.5	-35.5	0	0	0	112.4
845	P	32.8	Very low	31.3	Very low	124 Å²	124	122.9 Å²	122.9	81%	0.805	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-74.1	129.5	-169.7	28.4	-35.3	0	0	0	114.1
846	S	33.1	Very low	31.4	Very low	124 Å²	124	122.1 Å²	122.1	87%	0.867	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-65.2	131.9	174.5	-62.6	0	0	0	0	112.6	G848	S846-G848 PolarHBondContact O-N 3.26Å
847	S	34.8	Very low	31.4	Very low	127 Å²	127	128.7 Å²	128.7	89%	0.888	73%	0.73	S	S	*	*			trans	-85	98	-174.6	-68.3	0	0	0	0	113.9
848	G	31.8	Very low	31.2	Very low	68 Å²	68	130.5 Å²	130.5	70%	0.701	73%	0.731	S	S	*	*			trans	61.2	147	141.7	0	0	0	0	0	121.7	S846	S846-G848 PolarHBondContact O-N 3.26Å
849	R	32.5	Very low	31	Very low	222 Å²	222	132.3 Å²	132.3	84%	0.838	75%	0.748	S	S	*	*				-168	146	124	-103.8	178	-171.1	-135.7	1.5	111.3
850	Y	30	Very low	31.1	Very low	211 Å²	211	132.4 Å²	132.4	83%	0.827	76%	0.761	S	S	*	*			trans	13.2	132.5	165.2	-52.4	-77.1	0	0	0	120.1
851	G	30.2	Very low	31	Very low	65 Å²	65	131.6 Å²	131.6	67%	0.67	76%	0.755	S	S	*	*			cis	143.2	174.8	1.9	0	0	0	0	0	111.6
852	S	29.9	Very low	30.9	Very low	120 Å²	120	138.2 Å²	138.2	84%	0.839	77%	0.774	S	S	*	*			trans	64.6	133.5	171.8	-64.8	0	0	0	0	115.8
853	I	32.7	Very low	30.8	Very low	153 Å²	153	132.9 Å²	132.9	79%	0.785	76%	0.762	S	S	*	*			cis	-150.9	161.6	31.3	-116.1	140.4	0	0	0	112.4
854	S	32.5	Very low	30.5	Very low	114 Å²	114	137.1 Å²	137.1	80%	0.797	77%	0.773	S	S	*	*			trans	-26.9	157.8	163.5	-38.2	0	0	0	0	118.1
855	G	30.1	Very low	30.3	Very low	67 Å²	67	138.9 Å²	138.9	69%	0.691	78%	0.776	S	S	*	*			cis	-174	-177.5	7.3	0	0	0	0	0	113.2
856	P	35.8	Very low	30	Very low	104 Å²	104	137.9 Å²	137.9	68%	0.675	77%	0.772	S	S	*	*			trans	-97.6	176.7	-165	39.1	-36.8	0	0	0	114.2
857	Y	29	Very low	29.7	Very low	190 Å²	190	133.8 Å²	133.8	75%	0.745	75%	0.745	S	S	*	*				168.5	144.2	118.5	-94.1	-62.1	0	0	0	114.6
858	Y	28.6	Very low	29.3	Very low	205 Å²	205	129.8 Å²	129.8	80%	0.804	73%	0.725	S	S	*	*			trans	51	151.8	158.5	-65.9	-69.4	0	0	0	120.9
859	S	26	Very low	29.2	Very low	95 Å²	95	128.9 Å²	128.9	66%	0.664	71%	0.707	S	S	*	*			cis	-179.8	138.1	-38.1	49.9	0	0	0	0	111.4
860	S	29.4	Very low	28.9	Very low	110 Å²	110	119 Å²	119	77%	0.769	67%	0.671	S	S	*	*			trans	-175.3	119.9	149.6	-86.7	0	0	0	0	108.7
861	Q	27.9	Very low	28.8	Very low	166 Å²	166	110.2 Å²	110.2	78%	0.776	64%	0.64	S	S	*	*				83	120.6	72.5	-80.4	-161.7	26.4	0	0	114.4
862	R	25.4	Very low	28.8	Very low	231 Å²	231	109.7 Å²	109.7	87%	0.872	64%	0.636	S	S	*	*			trans	65.5	156.4	162.6	-74.2	174.8	171.1	-176.7	-3.3	115.7
863	S	28.2	Very low	28.8	Very low	95 Å²	95	107.3 Å²	107.3	66%	0.664	61%	0.608	S	S	*	*			cis	-157.8	163.5	-8.7	36	0	0	0	0	111.7
864	H	26.3	Very low	28.9	Very low	174 Å²	174	101.7 Å²	101.7	81%	0.806	58%	0.581	S	S	*	*			trans	-5.1	122.8	154	-54.9	-96.8	0	0	0	118.2
865	N	28.6	Very low	29	Very low	151 Å²	151	98 Å²	98	81%	0.807	56%	0.555	S	S	*	*				178.2	131.6	115.7	-86.6	-16.1	0	0	0	109.1
866	S	26.3	Very low	29.3	Very low	103 Å²	103	97.6 Å²	97.6	72%	0.72	54%	0.54	S	S	*	.				64.6	91.1	77.1	-155	0	0	0	0	110.5
867	A	27.1	Very low	29.4	Very low	38 Å²	38	100.2 Å²	100.2	31%	0.314	54%	0.543	S	S	.	.				68.3	104.4	87	0	0	0	0	0	112.9	S569	S569-A867 WeakPolarHBondContact OG-CB 3.4Å
868	G	27.2	Very low	30	Very low	44 Å²	44	93.8 Å²	93.8	45%	0.454	53%	0.527	S	S	.	.			trans	-164.3	118.9	169.7	0	0	0	0	0	109.2	K565 S569	K565-G868 CarbonylContact O-C 3.52Å; S569-G868 VanDerWaalsContact CB-N 3.34Å; S569-G868 PolarHBondContact OG-N 3.11Å; S569-G868 VanDerWaalsContact OG-N 3.12Å
869	S	28.8	Very low	30.3	Very low	48 Å²	48	84.5 Å²	84.5	34%	0.336	49%	0.49	S	S	.	.				60	118.3	77.9	-55	0	0	0	0	112.7	K565 E566	K565-S869 PolarHBondContact O-N 3.28Å; E566-S869 VanDerWaalsContact CA-CA 3.49Å
870	D	27	Very low	31	Very low	15 Å²	15	84.3 Å²	84.3	8%	0.08	48%	0.482	C	S	.	.			trans	127.3	79.1	175.7	-74.2	-50.7	0	0	0	118.6	N563 K565 R873 N1162	N563-D870 PolarHBondContact ND2-N 3.16Å; N563-D870 VanDerWaalsContact OD1-C 3.3Å; N563-D870 VanDerWaalsContact OD1-CA 3.23Å; N563-D870 WeakPolarHBondContact OD1-CA 3.45Å; N563-D870 PolarHBondContact OD1-N 3.35Å; K565-D870 VanDerWaalsContact CD-O 3.27Å; K565-D870 WeakPolarHBondContact CD-O 3.18Å; K565-D870 WeakPolarHBondContact CE-O 3.48Å; K565-D870 VanDerWaalsContact CG-O 3.26Å; K565-D870 WeakPolarHBondContact CG-O 3.36Å; K565-D870 PolarHBondContact NZ-O 2.9Å; D870-R873 HydrophobicContact CB-CB 3.54Å; D870-R873 HydrophobicContact CB-CG 4.34Å; D870-R873 VanDerWaalsContact OD2-CD 3.31Å; D870-R873 WeakPolarHBondContact OD2-CD 3.48Å; D870-R873 IonicContact OD2-CZ 3Å; D870-R873 IonicContact OD2-NE 2.84Å; D870-R873 PolarHBondContact OD2-NE 3.06Å; D870-R873 IonicContact OD2-NH1 2.89Å; D870-R873 PolarHBondContact OD2-NH1 3.34Å; D870-N1162 PolarHBondContact OD1-ND2 2.86Å
871	S	27.4	Very low	31.5	Very low	26 Å²	26	86.3 Å²	86.3	18%	0.182	47%	0.473	C	S	.	.	S	Bend	trans	-49.3	148.9	147.7	-98.4	0	0	0	0	110.7	S562 N563 L564 R873	S562-S871 PolarHBondContact O-OG 3.26Å; N563-S871 WeakPolarHBondContact CA-OG 3.48Å; N563-S871 VanDerWaalsContact CG-N 3.31Å; N563-S871 PolarHBondContact OD1-N 2.88Å; L564-S871 PolarHBondContact N-OG 2.73Å; S871-R873 PolarHBondContact O-N 2.8Å
872	G	30.8	Very low	32.1	Very low	55 Å²	55	81.7 Å²	81.7	57%	0.567	45%	0.453	S	S	*	.	S	Bend	trans	68.8	-24.1	168.8	0	0	0	0	0	116	V874 P1159	G872-V874 PolarHBondContact O-N 3.15Å; G872-P1159 WeakPolarHBondContact O-CB 3.32Å; G872-P1159 WeakPolarHBondContact O-CG 3.45Å
873	R	29	Very low	32.9	Very low	69 Å²	69	73.1 Å²	73.1	26%	0.26	42%	0.424	S	S	.	.			trans	-68.2	97.9	174.2	-155.7	-157.5	-142.9	173.2	-7.5	109.4	K565 D870 S871 S875 N1162	K565-R873 PolarHBondContact NZ-O 3.44Å; D870-R873 HydrophobicContact CB-CB 3.54Å; D870-R873 HydrophobicContact CB-CG 4.34Å; D870-R873 VanDerWaalsContact OD2-CD 3.31Å; D870-R873 WeakPolarHBondContact OD2-CD 3.48Å; D870-R873 IonicContact OD2-CZ 3Å; D870-R873 IonicContact OD2-NE 2.84Å; D870-R873 PolarHBondContact OD2-NE 3.06Å; D870-R873 IonicContact OD2-NH1 2.89Å; D870-R873 PolarHBondContact OD2-NH1 3.34Å; S871-R873 PolarHBondContact O-N 2.8Å; R873-S875 PolarHBondContact O-N 3.49Å; R873-N1162 HydrophobicContact CG-CB 4.42Å; R873-N1162 PolarHBondContact NH2-O 2.83Å
874	V	36.4	Very low	33.6	Very low	36 Å²	36	76.8 Å²	76.8	22%	0.218	42%	0.423	C	S	.	.			trans	-48.5	125.7	162.8	-170.9	0	0	0	0	106.8	G872 M879 I882 Y1116	G872-V874 PolarHBondContact O-N 3.15Å; V874-M879 HydrophobicContact CB-CB 4.36Å; V874-M879 HydrophobicContact CB-CE 4.14Å; V874-M879 HydrophobicContact CG1-CB 3.82Å; V874-I882 HydrophobicContact CG1-CD1 4.18Å; V874-Y1116 HydrophobicContact CG2-CE2 4.02Å
875	S	33.5	Very low	34.2	Very low	37 Å²	37	73.3 Å²	73.3	26%	0.259	41%	0.407	S	S	.	.			trans	-54.1	141.4	176.3	168.5	0	0	0	0	108.6	R873 E877 S878 M879	R873-S875 PolarHBondContact O-N 3.49Å; S875-E877 PolarHBondContact O-N 2.69Å; S875-E877 PolarHBondContact OG-N 2.98Å; S875-S878 CarbonylContact O-C 3.26Å; S875-S878 WeakPolarHBondContact O-CA 3.42Å; S875-S878 PolarHBondContact O-N 3.09Å; S875-M879 VanDerWaalsContact O-CB 3.28Å; S875-M879 WeakPolarHBondContact O-CB 3.23Å; S875-M879 PolarHBondContact O-N 3.38Å
876	P	37	Very low	34.6	Very low	58 Å²	58	68.4 Å²	68.4	38%	0.377	38%	0.383	S	S	.	.	H	α-helix	trans	-51.7	-30.1	172.7	-28.1	36.6	0	0	0	112.5	N880	P876-N880 VanDerWaalsContact O-CB 3.29Å; P876-N880 WeakPolarHBondContact O-CB 3.46Å; P876-N880 PolarHBondContact O-N 3.32Å; P876-N880 PolarHBondContact O-ND2 3.47Å
877	E	38.5	Very low	35.2	Very low	158 Å²	158	66 Å²	66	74%	0.738	36%	0.364	S	S	*	.	H	α-helix	trans	-75.1	-42.6	175	-59.6	169.9	139.7	0	0	112.2	S875 M879 R881	S875-E877 PolarHBondContact O-N 2.69Å; S875-E877 PolarHBondContact OG-N 2.98Å; E877-M879 VanDerWaalsContact C-N 3.29Å; E877-M879 PolarHBondContact O-N 3.09Å; E877-R881 WeakPolarHBondContact O-CB 3.47Å; E877-R881 PolarHBondContact O-N 3Å
878	S	39.8	Very low	35.6	Very low	56 Å²	56	68.5 Å²	68.5	39%	0.392	37%	0.372	S	S	.	.	H	α-helix	trans	-67.1	-30	172.2	-56.9	0	0	0	0	112.3	S875 I882	S875-S878 CarbonylContact O-C 3.26Å; S875-S878 WeakPolarHBondContact O-CA 3.42Å; S875-S878 PolarHBondContact O-N 3.09Å; S878-I882 WeakPolarHBondContact O-CB 3.35Å; S878-I882 WeakPolarHBondContact O-CD1 3.23Å; S878-I882 VanDerWaalsContact O-CG1 3.24Å; S878-I882 WeakPolarHBondContact O-CG1 3.18Å; S878-I882 PolarHBondContact O-N 3.36Å
879	M	35.5	Very low	36	Very low	9 Å²	9	67.6 Å²	67.6	4%	0.044	36%	0.363	C	S	.	.	H	α-helix	trans	-74.4	-49.3	177.9	-178.7	177.7	-45.5	0	0	109.7	V874 S875 E877 R881 I882 I883 Y1116 L1160 L1166	V874-M879 HydrophobicContact CB-CB 4.36Å; V874-M879 HydrophobicContact CB-CE 4.14Å; V874-M879 HydrophobicContact CG1-CB 3.82Å; S875-M879 VanDerWaalsContact O-CB 3.28Å; S875-M879 WeakPolarHBondContact O-CB 3.23Å; S875-M879 PolarHBondContact O-N 3.38Å; E877-M879 VanDerWaalsContact C-N 3.29Å; E877-M879 PolarHBondContact O-N 3.09Å; M879-R881 PolarHBondContact O-N 2.91Å; M879-I882 PolarHBondContact O-N 2.98Å; M879-I883 HydrophobicContact CG-CD1 3.88Å; M879-I883 VanDerWaalsContact O-CB 3.31Å; M879-I883 WeakPolarHBondContact O-CB 3.37Å; M879-I883 WeakPolarHBondContact O-CG1 3.29Å; M879-I883 PolarHBondContact O-N 3.5Å; M879-Y1116 WeakPolarHBondContact CE-OH 3.38Å; M879-Y1116 VanDerWaalsContact CG-OH 3.31Å; M879-Y1116 WeakPolarHBondContact CG-OH 3.45Å; M879-L1160 HydrophobicContact CE-CD2 3.98Å; M879-L1160 HydrophobicContact SD-CD2 4.02Å; M879-L1166 HydrophobicContact CE-CD1 4.33Å; M879-L1166 HydrophobicContact SD-CD1 4.17Å
880	N	40.5	Very low	36.2	Very low	92 Å²	92	67 Å²	67	49%	0.492	36%	0.356	S	S	.	.	H	α-helix	trans	-63.6	-30.1	171	-78.5	-66.7	0	0	0	112.2	P876 R884	P876-N880 VanDerWaalsContact O-CB 3.29Å; P876-N880 WeakPolarHBondContact O-CB 3.46Å; P876-N880 PolarHBondContact O-N 3.32Å; P876-N880 PolarHBondContact O-ND2 3.47Å; N880-R884 VanDerWaalsContact O-CB 3.25Å; N880-R884 WeakPolarHBondContact O-CB 3.3Å; N880-R884 VanDerWaalsContact O-CG 3.28Å; N880-R884 WeakPolarHBondContact O-CG 3.34Å; N880-R884 PolarHBondContact O-N 3.39Å
881	R	40.7	Very low	36.5	Very low	151 Å²	151	72.1 Å²	72.1	57%	0.57	38%	0.379	S	S	*	.	H	α-helix	trans	-66.2	-53.2	170.1	175.8	-172.8	-82.9	-97.1	10.2	111.3	E877 M879 I883 R884 E885	E877-R881 WeakPolarHBondContact O-CB 3.47Å; E877-R881 PolarHBondContact O-N 3Å; M879-R881 PolarHBondContact O-N 2.91Å; R881-I883 VanDerWaalsContact C-N 3.31Å; R881-I883 PolarHBondContact O-N 2.6Å; R881-R884 CarbonylContact O-C 3.47Å; R881-R884 WeakPolarHBondContact O-CA 3.31Å; R881-R884 PolarHBondContact O-N 2.87Å; R881-R884 VanDerWaalsContact O-N 3.12Å; R881-E885 VanDerWaalsContact CD-OE1 3.27Å; R881-E885 WeakPolarHBondContact CD-OE1 3.18Å; R881-E885 HydrophobicContact CG-CG 4.09Å; R881-E885 WeakPolarHBondContact CG-OE1 3.28Å; R881-E885 WeakPolarHBondContact CG-OE2 3.47Å; R881-E885 IonicContact CZ-OE1 3.63Å; R881-E885 IonicContact NE-OE1 3.49Å; R881-E885 IonicContact NH1-OE1 3.8Å; R881-E885 PolarHBondContact NH1-OE1 3.25Å; R881-E885 WeakPolarHBondContact O-CB 3.37Å; R881-E885 WeakPolarHBondContact O-CG 3.28Å; R881-E885 PolarHBondContact O-N 3.06Å
882	I	40.9	Very low	36.6	Very low	70 Å²	70	74.9 Å²	74.9	36%	0.359	40%	0.399	S	S	.	.	H	α-helix	trans	-61.5	-41.5	179.1	-72.2	163	0	0	0	110.5	V874 S878 M879 T886	V874-I882 HydrophobicContact CG1-CD1 4.18Å; S878-I882 WeakPolarHBondContact O-CB 3.35Å; S878-I882 WeakPolarHBondContact O-CD1 3.23Å; S878-I882 VanDerWaalsContact O-CG1 3.24Å; S878-I882 WeakPolarHBondContact O-CG1 3.18Å; S878-I882 PolarHBondContact O-N 3.36Å; M879-I882 PolarHBondContact O-N 2.98Å; I882-T886 WeakPolarHBondContact O-CB 3.35Å; I882-T886 PolarHBondContact O-N 3.19Å; I882-T886 PolarHBondContact O-OG1 3.3Å
883	I	40.7	Very low	36.6	Very low	51 Å²	51	77.8 Å²	77.8	26%	0.262	40%	0.401	S	S	.	.	H	α-helix	trans	-61.5	-44.3	174.3	-69.6	166.7	0	0	0	110.3	M879 R881 T887	M879-I883 HydrophobicContact CG-CD1 3.88Å; M879-I883 VanDerWaalsContact O-CB 3.31Å; M879-I883 WeakPolarHBondContact O-CB 3.37Å; M879-I883 WeakPolarHBondContact O-CG1 3.29Å; M879-I883 PolarHBondContact O-N 3.5Å; R881-I883 VanDerWaalsContact C-N 3.31Å; R881-I883 PolarHBondContact O-N 2.6Å; I883-T887 WeakPolarHBondContact O-CB 3.47Å; I883-T887 PolarHBondContact O-N 3.19Å; I883-T887 PolarHBondContact O-OG1 3.07Å
884	R	42.7	Very low	36.7	Very low	171 Å²	171	77.4 Å²	77.4	65%	0.645	41%	0.408	S	S	*	.	H	α-helix	trans	-63.3	-59.7	173.3	-82.4	177.9	174.2	163.5	-0.2	112.3	N880 R881 T886 T887 D888	N880-R884 VanDerWaalsContact O-CB 3.25Å; N880-R884 WeakPolarHBondContact O-CB 3.3Å; N880-R884 VanDerWaalsContact O-CG 3.28Å; N880-R884 WeakPolarHBondContact O-CG 3.34Å; N880-R884 PolarHBondContact O-N 3.39Å; R881-R884 CarbonylContact O-C 3.47Å; R881-R884 WeakPolarHBondContact O-CA 3.31Å; R881-R884 PolarHBondContact O-N 2.87Å; R881-R884 VanDerWaalsContact O-N 3.12Å; R884-T886 PolarHBondContact O-N 2.9Å; R884-T887 CarbonylContact O-C 3.58Å; R884-T887 WeakPolarHBondContact O-CA 3.48Å; R884-T887 PolarHBondContact O-N 3.07Å; R884-D888 WeakPolarHBondContact O-CB 3.39Å; R884-D888 PolarHBondContact O-N 3.36Å
885	E	39.1	Very low	36.4	Very low	101 Å²	101	83.8 Å²	83.8	47%	0.472	44%	0.438	S	S	.	.	H	α-helix	trans	-55	-32.5	-178.9	-69.9	169.7	175.3	0	0	112.5	R881 G889	R881-E885 VanDerWaalsContact CD-OE1 3.27Å; R881-E885 WeakPolarHBondContact CD-OE1 3.18Å; R881-E885 HydrophobicContact CG-CG 4.09Å; R881-E885 WeakPolarHBondContact CG-OE1 3.28Å; R881-E885 WeakPolarHBondContact CG-OE2 3.47Å; R881-E885 IonicContact CZ-OE1 3.63Å; R881-E885 IonicContact NE-OE1 3.49Å; R881-E885 IonicContact NH1-OE1 3.8Å; R881-E885 PolarHBondContact NH1-OE1 3.25Å; R881-E885 WeakPolarHBondContact O-CB 3.37Å; R881-E885 WeakPolarHBondContact O-CG 3.28Å; R881-E885 PolarHBondContact O-N 3.06Å; E885-G889 PolarHBondContact O-N 2.93Å
886	T	37.1	Very low	36.2	Very low	49 Å²	49	85.4 Å²	85.4	30%	0.301	46%	0.461	S	S	.	.	H	α-helix	trans	-77	-37.2	172.2	-49.5	0	0	0	0	113	I882 R884 L890 L1117	I882-T886 WeakPolarHBondContact O-CB 3.35Å; I882-T886 PolarHBondContact O-N 3.19Å; I882-T886 PolarHBondContact O-OG1 3.3Å; R884-T886 PolarHBondContact O-N 2.9Å; T886-L890 WeakPolarHBondContact O-CB 3.32Å; T886-L890 WeakPolarHBondContact O-CD1 3.43Å; T886-L890 WeakPolarHBondContact O-CG 3.48Å; T886-L890 PolarHBondContact O-N 3.14Å; T886-L1117 HydrophobicContact CG2-CD1 4.15Å; T886-L1117 HydrophobicContact CG2-CD2 3.85Å
887	T	39.4	Very low	35.7	Very low	53 Å²	53	86.4 Å²	86.4	33%	0.325	47%	0.473	S	S	.	.	H	α-helix	trans	-73.8	-39.6	177.5	-57.1	0	0	0	0	112.2	I883 R884 L890 Q891	I883-T887 WeakPolarHBondContact O-CB 3.47Å; I883-T887 PolarHBondContact O-N 3.19Å; I883-T887 PolarHBondContact O-OG1 3.07Å; R884-T887 CarbonylContact O-C 3.58Å; R884-T887 WeakPolarHBondContact O-CA 3.48Å; R884-T887 PolarHBondContact O-N 3.07Å; T887-L890 WeakPolarHBondContact O-CB 3.13Å; T887-L890 PolarHBondContact O-N 3.29Å; T887-Q891 WeakPolarHBondContact O-CG 3.32Å; T887-Q891 PolarHBondContact O-N 3.49Å
888	D	36.3	Very low	35.2	Very low	89 Å²	89	84.4 Å²	84.4	48%	0.476	48%	0.477	S	S	.	.	H	α-helix	trans	-68.8	-39	174.6	-56.8	-25.7	0	0	0	109.3	R884 Q891 S892	R884-D888 WeakPolarHBondContact O-CB 3.39Å; R884-D888 PolarHBondContact O-N 3.36Å; D888-Q891 PolarHBondContact O-N 3.3Å; D888-S892 WeakPolarHBondContact O-CB 3.43Å; D888-S892 PolarHBondContact O-N 3.3Å
889	G	34.3	Very low	34.7	Very low	26 Å²	26	85.6 Å²	85.6	27%	0.268	50%	0.499	S	S	.	.	H	α-helix	trans	-60.5	-44.3	168.4	0	0	0	0	0	112.9	E885 S892 L893	E885-G889 PolarHBondContact O-N 2.93Å; G889-S892 PolarHBondContact O-N 3.49Å; G889-S892 PolarHBondContact O-OG 3Å; G889-L893 PolarHBondContact O-N 3.33Å
890	L	34.2	Very low	34.3	Very low	36 Å²	36	89.4 Å²	89.4	19%	0.188	54%	0.54	C	S	.	.	H	α-helix	trans	-58.6	-49.2	172.7	-89.5	159.7	0	0	0	112	T886 T887 S892 L893 S894 L1079	T886-L890 WeakPolarHBondContact O-CB 3.32Å; T886-L890 WeakPolarHBondContact O-CD1 3.43Å; T886-L890 WeakPolarHBondContact O-CG 3.48Å; T886-L890 PolarHBondContact O-N 3.14Å; T887-L890 WeakPolarHBondContact O-CB 3.13Å; T887-L890 PolarHBondContact O-N 3.29Å; L890-S892 VanDerWaalsContact C-N 3.26Å; L890-S892 PolarHBondContact O-N 2.75Å; L890-L893 PolarHBondContact O-N 2.92Å; L890-S894 PolarHBondContact O-N 3.49Å; L890-S894 VanDerWaalsContact O-N 3.12Å; L890-L1079 HydrophobicContact CD2-CB 3.67Å; L890-L1079 HydrophobicContact CD2-CD1 4.22Å; L890-L1079 HydrophobicContact CD2-CD2 3.59Å; L890-L1079 HydrophobicContact CD2-CG 3.97Å; L890-L1079 HydrophobicContact CG-CD2 4.21Å
891	Q	32.9	Very low	33.7	Very low	122 Å²	122	88.7 Å²	88.7	57%	0.57	55%	0.554	S	S	*	*	H	α-helix	trans	-61.7	-34	177.1	-72	178.3	17.3	0	0	112.3	T887 D888 L893 S894	T887-Q891 WeakPolarHBondContact O-CG 3.32Å; T887-Q891 PolarHBondContact O-N 3.49Å; D888-Q891 PolarHBondContact O-N 3.3Å; Q891-L893 VanDerWaalsContact C-N 3.26Å; Q891-L893 PolarHBondContact O-N 3.29Å; Q891-S894 PolarHBondContact O-N 3.27Å
892	S	30.3	Very low	33.1	Very low	84 Å²	84	89.1 Å²	89.1	59%	0.587	57%	0.566	S	S	*	*	H	α-helix	trans	-66.2	-24.2	175.2	82.6	0	0	0	0	114.1	D888 G889 L890	D888-S892 WeakPolarHBondContact O-CB 3.43Å; D888-S892 PolarHBondContact O-N 3.3Å; G889-S892 PolarHBondContact O-N 3.49Å; G889-S892 PolarHBondContact O-OG 3Å; L890-S892 VanDerWaalsContact C-N 3.26Å; L890-S892 PolarHBondContact O-N 2.75Å
893	L	30	Very low	32.5	Very low	116 Å²	116	93.5 Å²	93.5	61%	0.607	59%	0.589	S	S	*	*	H	α-helix	trans	-90	-33.1	178.6	-66.8	171.3	0	0	0	112.5	G889 L890 Q891 M895 G896 L1079	G889-L893 PolarHBondContact O-N 3.33Å; L890-L893 PolarHBondContact O-N 2.92Å; Q891-L893 VanDerWaalsContact C-N 3.26Å; Q891-L893 PolarHBondContact O-N 3.29Å; L893-M895 VanDerWaalsContact C-N 3.3Å; L893-M895 PolarHBondContact O-N 3.01Å; L893-G896 PolarHBondContact O-N 2.95Å; L893-L1079 HydrophobicContact CD1-CD1 3.99Å
894	S	31.6	Very low	31.9	Very low	61 Å²	61	96.3 Å²	96.3	43%	0.427	61%	0.609	S	S	.	*	H	α-helix	trans	-63	-34.1	178.5	-168.7	0	0	0	0	112.7	L890 Q891 G896	L890-S894 PolarHBondContact O-N 3.49Å; L890-S894 VanDerWaalsContact O-N 3.12Å; Q891-S894 PolarHBondContact O-N 3.27Å; S894-G896 PolarHBondContact O-N 3.34Å; S894-G896 VanDerWaalsContact O-N 3.13Å
895	M	29.9	Very low	31.1	Very low	169 Å²	169	93.2 Å²	93.2	83%	0.833	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-1.1	-179.2	-71.1	-67.9	-67.7	0	0	115.5	L893	L893-M895 VanDerWaalsContact C-N 3.3Å; L893-M895 PolarHBondContact O-N 3.01Å
896	G	28.5	Very low	30.5	Very low	72 Å²	72	94.7 Å²	94.7	74%	0.742	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-15.4	-177.8	0	0	0	0	0	115.9	L893 S894	L893-G896 PolarHBondContact O-N 2.95Å; S894-G896 PolarHBondContact O-N 3.34Å; S894-G896 VanDerWaalsContact O-N 3.13Å
897	A	27.9	Very low	29.9	Very low	78 Å²	78	95.7 Å²	95.7	65%	0.645	65%	0.65	S	S	*	*			trans	-115.3	59	-164.6	0	0	0	0	0	113.4
898	S	27.9	Very low	29.3	Very low	116 Å²	116	100.3 Å²	100.3	81%	0.811	67%	0.671	S	S	*	*			trans	-153.2	88.1	177.9	-75.2	0	0	0	0	112.7
899	G	28.5	Very low	28.9	Very low	82 Å²	82	101.9 Å²	101.9	85%	0.845	68%	0.683	S	S	*	*			trans	164.4	85.7	175.8	0	0	0	0	0	114.3
900	G	27	Very low	28.7	Very low	88 Å²	88	105.7 Å²	105.7	91%	0.907	71%	0.706	S	S	*	*			trans	-82	148.6	174.8	0	0	0	0	0	113.3
901	G	29	Very low	28.7	Very low	77 Å²	77	109.1 Å²	109.1	79%	0.794	73%	0.731	S	S	*	*			trans	-172.2	66.6	-173.9	0	0	0	0	0	116
902	I	27.3	Very low	28.4	Very low	160 Å²	160	108.8 Å²	108.8	82%	0.821	74%	0.737	S	S	*	*			trans	-18	127.8	166.6	-38.7	173	0	0	0	116.3
903	L	27.6	Very low	28.2	Very low	163 Å²	163	113.7 Å²	113.7	85%	0.853	74%	0.743	S	S	*	*				179.6	170.6	121.4	-96.8	170.3	0	0	0	114.6
904	T	28.2	Very low	27.9	Very low	109 Å²	109	117.4 Å²	117.4	67%	0.669	75%	0.749	S	S	*	*			trans	-122.1	136.6	-154.9	51	0	0	0	0	115.9
905	S	25.8	Very low	27.8	Very low	106 Å²	106	120.5 Å²	120.5	74%	0.741	77%	0.765	S	S	*	*			trans	72.6	149.7	137.8	76.5	0	0	0	0	122.1
906	V	26.8	Very low	27.7	Very low	132 Å²	132	117.9 Å²	117.9	80%	0.8	76%	0.763	S	S	*	*			trans	65.8	87.2	161.4	-160.9	0	0	0	0	119.4
907	G	25.2	Very low	27.8	Very low	71 Å²	71	118.7 Å²	118.7	73%	0.732	76%	0.762	S	S	*	*				82.1	164.5	105.1	0	0	0	0	0	122.2
908	I	27.2	Very low	27.9	Very low	150 Å²	150	122.3 Å²	122.3	77%	0.769	77%	0.771	S	S	*	*			trans	75.2	94.2	158.6	-57.8	-179.8	0	0	0	118
909	T	27.9	Very low	28.3	Very low	121 Å²	121	121.8 Å²	121.8	74%	0.742	77%	0.765	S	S	*	*			trans	54.9	115.7	140.8	67.5	0	0	0	0	121.7
910	S	30	Very low	28.4	Very low	107 Å²	107	122.4 Å²	122.4	75%	0.748	76%	0.756	S	S	*	*				2	150.1	114.9	-46.3	0	0	0	0	117.1
911	P	32.8	Very low	28.6	Very low	108 Å²	108	127.2 Å²	127.2	70%	0.701	75%	0.753	S	S	*	*			cis	-158.8	178.4	44.9	39.4	-15.5	0	0	0	120.1
912	T	26.9	Very low	28.6	Very low	114 Å²	114	128.8 Å²	128.8	70%	0.699	75%	0.747	S	S	*	*			trans	71.9	126.2	143.4	40.8	0	0	0	0	123.9
913	R	25.7	Very low	28.7	Very low	188 Å²	188	127.1 Å²	127.1	71%	0.709	74%	0.744	S	S	*	*				94.5	118.1	121.6	-85.5	-178	169.2	-165.5	2.1	122.6
914	R	25.1	Very low	28.7	Very low	194 Å²	194	125.6 Å²	125.6	73%	0.732	74%	0.737	S	S	*	*				86.7	164.4	119.4	-86.7	-179.5	175.4	-166.9	-3.6	120.6
915	V	28.6	Very low	28.6	Very low	126 Å²	126	127 Å²	127	76%	0.764	74%	0.741	S	S	*	*			trans	77.7	109.4	169.6	-154.2	0	0	0	0	110.2
916	S	27.5	Very low	28.7	Very low	114 Å²	114	132.2 Å²	132.2	80%	0.797	75%	0.745	S	S	*	*				70.1	137.8	56.9	-52.5	0	0	0	0	111.5
917	A	31	Very low	29	Very low	88 Å²	88	131.3 Å²	131.3	73%	0.727	74%	0.74	S	S	*	*			cis	-152.8	-162.6	-3.1	0	0	0	0	0	110.3
918	D	29.9	Very low	29.4	Very low	154 Å²	154	138.5 Å²	138.5	82%	0.824	75%	0.747	S	S	*	*			trans	-24.3	164	150.1	-73.3	-59.5	0	0	0	117.2
919	P	36.9	Very low	29.9	Very low	105 Å²	105	135.1 Å²	135.1	68%	0.682	74%	0.741	S	S	*	*			cis	-146	-177.6	26.3	35.5	-12	0	0	0	117.8
920	S	29.9	Very low	30.5	Very low	96 Å²	96	134.9 Å²	134.9	67%	0.671	74%	0.74	S	S	*	*			trans	50	156.8	135	66.8	0	0	0	0	122.6
921	F	31.6	Very low	30.9	Very low	189 Å²	189	137.3 Å²	137.3	83%	0.829	75%	0.745	S	S	*	*			cis	-159.7	171.9	-17.9	-120.8	-113.1	0	0	0	102.4
922	T	29.7	Very low	31.1	Very low	110 Å²	110	135.1 Å²	135.1	68%	0.675	74%	0.742	S	S	*	*			cis	-160.1	164.2	40.8	-5.1	0	0	0	0	109.2
923	T	27.8	Very low	31.8	Very low	124 Å²	124	137.2 Å²	137.2	76%	0.761	75%	0.748	S	S	*	*	S	Bend	trans	-136.7	130.7	150.3	-63.9	0	0	0	0	107.9
924	N	28.4	Very low	32.5	Very low	131 Å²	131	133.7 Å²	133.7	70%	0.701	75%	0.748	S	S	*	*	S	Bend	trans	65	144.3	178.3	-62.4	-3.7	0	0	0	118.7
925	D	26.8	Very low	33.2	Very low	140 Å²	140	128.1 Å²	128.1	75%	0.749	75%	0.751	S	S	*	*			trans	64.3	131.5	161.3	-54.5	-34.8	0	0	0	121.3
926	Y	27.5	Very low	33.8	Very low	214 Å²	214	127.2 Å²	127.2	84%	0.839	75%	0.746	S	S	*	*			trans	75.7	96	176.1	-64.5	-83	0	0	0	120
927	T	33.3	Very low	34.2	Very low	113 Å²	113	128.4 Å²	128.4	69%	0.693	74%	0.742	S	S	*	*			trans	83.9	114.9	136.2	43.1	0	0	0	0	123.8
928	Y	34	Very low	34.6	Very low	222 Å²	222	133.8 Å²	133.8	87%	0.871	74%	0.744	S	S	*	*			trans	75.6	114	144.3	-70.9	-64.9	0	0	0	124.4
929	A	37.5	Very low	35	Very low	79 Å²	79	131.9 Å²	131.9	65%	0.653	74%	0.738	S	S	*	*				98.1	100	123.3	0	0	0	0	0	123.5
930	T	40.1	Very low	35.1	Very low	117 Å²	117	132.4 Å²	132.4	72%	0.718	74%	0.739	S	S	*	*				67.9	120.3	127.5	58.5	0	0	0	0	124.4
931	N	37.5	Very low	35.5	Very low	158 Å²	158	136 Å²	136	85%	0.845	75%	0.745	S	S	*	*				58.9	146	126.8	-51.5	-15.3	0	0	0	120.9
932	G	38.4	Very low	35.8	Very low	62 Å²	62	131.9 Å²	131.9	64%	0.639	74%	0.738	S	S	*	*			cis	-166.8	165.7	3	0	0	0	0	0	111.4
933	N	39.9	Very low	36	Very low	157 Å²	157	133.8 Å²	133.8	84%	0.84	74%	0.744	S	S	*	*				57.5	137.3	93.5	-76.2	-6.8	0	0	0	115
934	T	40.5	Very low	36.5	Very low	115 Å²	115	135 Å²	135	71%	0.706	75%	0.746	S	S	*	*			cis	-161.2	154.6	4.7	5.3	0	0	0	0	107.7	V936	T934-V936 HydrophobicContact CG2-CG2 3.93Å
935	G	40.2	Very low	36.8	Very low	77 Å²	77	138 Å²	138	79%	0.794	75%	0.753	S	S	*	*				93.7	-177.8	68.7	0	0	0	0	0	110.8
936	V	40.9	Very low	37.2	Very low	107 Å²	107	136.6 Å²	136.6	65%	0.648	75%	0.751	S	S	*	*			cis	-157.7	170.1	-2.3	-169.2	0	0	0	0	108	T934	T934-V936 HydrophobicContact CG2-CG2 3.93Å
937	L	36.1	Very low	37.3	Very low	139 Å²	139	134 Å²	134	73%	0.728	75%	0.752	S	S	*	*			trans	113.7	136	148.8	-57.1	174.6	0	0	0	117.8
938	R	39.1	Very low	37.4	Very low	200 Å²	200	134 Å²	134	76%	0.755	76%	0.757	S	S	*	*			cis	-171.8	148.4	-27	-126.1	-170.5	-156.4	165.9	4.6	114.5
939	T	38.5	Very low	37.1	Very low	114 Å²	114	132.2 Å²	132.2	70%	0.699	76%	0.756	S	S	*	*			trans	25.1	153.7	136.3	56.5	0	0	0	0	122.1
940	V	39.6	Very low	36.9	Very low	117 Å²	117	133.5 Å²	133.5	71%	0.709	76%	0.758	S	S	*	*			cis	178.4	161	18	120.3	0	0	0	0	107.3
941	Q	39	Very low	36.4	Very low	170 Å²	170	135 Å²	135	79%	0.794	77%	0.767	S	S	*	*			cis	-164.2	178.9	-16.9	-110.3	174	-37.1	0	0	109.7
942	P	36.1	Very low	35.9	Very low	104 Å²	104	131.8 Å²	131.8	68%	0.675	76%	0.763	S	S	*	*			trans	-115.8	179.7	-166.2	43.8	-37.1	0	0	0	117.2
943	N	35.8	Very low	35.5	Very low	150 Å²	150	135.9 Å²	135.9	80%	0.802	77%	0.769	S	S	*	*			trans	-174.1	158.4	132.5	-104.4	-20.4	0	0	0	117.8
944	N	37.4	Very low	35	Very low	150 Å²	150	136.3 Å²	136.3	80%	0.802	77%	0.766	S	S	*	*			trans	82.7	157	163.7	-74.1	-2.5	0	0	0	122.3
945	F	34.2	Very low	34.4	Very low	193 Å²	193	135.7 Å²	135.7	85%	0.846	77%	0.766	S	S	*	*			trans	-134.2	-176.5	-150.1	-81.3	-85	0	0	0	111.7
946	P	36.5	Very low	33.9	Very low	110 Å²	110	138 Å²	138	71%	0.714	77%	0.767	S	S	*	*			cis	-134.6	142.7	-30.5	29.8	-11.3	0	0	0	114.6
947	N	28.5	Very low	33.2	Very low	161 Å²	161	140 Å²	140	86%	0.861	77%	0.774	S	S	*	*			trans	-170.2	174.3	141	-126.8	-31.5	0	0	0	111.6
948	S	35.2	Very low	33	Very low	113 Å²	113	140.5 Å²	140.5	79%	0.79	78%	0.776	S	S	*	*			trans	83.4	143.4	165.7	-47.7	0	0	0	0	119.7
949	Q	27.7	Very low	32.5	Very low	184 Å²	184	138.2 Å²	138.2	86%	0.86	78%	0.777	S	S	*	*			trans	-67.4	-178.3	157.6	-77.8	-176.7	-56.7	0	0	112.3
950	P	33.3	Very low	32	Very low	106 Å²	106	138.4 Å²	138.4	69%	0.688	78%	0.781	S	S	*	*			cis	-138.2	139.7	-43.4	35.2	-18.9	0	0	0	113.2
951	T	29.2	Very low	31.7	Very low	147 Å²	147	138.1 Å²	138.1	90%	0.902	78%	0.784	S	S	*	*			trans	-154.4	147.1	168.4	6.5	0	0	0	0	113.6
952	A	28.7	Very low	31.2	Very low	92 Å²	92	137.4 Å²	137.4	76%	0.76	79%	0.785	S	S	*	*			trans	-85.6	151.4	160.8	0	0	0	0	0	110
953	L	28.7	Very low	30.8	Very low	148 Å²	148	138.2 Å²	138.2	78%	0.775	79%	0.788	S	S	*	*			trans	-168.5	121.4	151	-105.5	171.5	0	0	0	112.5
954	Q	30	Very low	30.3	Very low	165 Å²	165	138.4 Å²	138.4	77%	0.771	79%	0.789	S	S	*	*			trans	37.7	121.5	141.6	-71	173	-6.4	0	0	123.7
955	S	27.9	Very low	30.1	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	78%	0.783	S	S	*	*				68.8	134.9	121.7	-50.8	0	0	0	0	121
956	P	29.3	Very low	29.8	Very low	124 Å²	124	133 Å²	133	81%	0.805	78%	0.784	S	S	*	*				-114.2	149.4	82.3	34.9	-34.9	0	0	0	113.1
957	N	27.4	Very low	29.3	Very low	149 Å²	149	138.7 Å²	138.7	80%	0.797	79%	0.793	S	S	*	*			cis	85.1	145.3	42.9	-149.9	4.3	0	0	0	113
958	I	30.6	Very low	29.3	Very low	151 Å²	151	135 Å²	135	77%	0.774	79%	0.785	S	S	*	*			trans	84.1	129.8	-172.5	-56.8	169.2	0	0	0	114.5
959	I	29.1	Very low	28.9	Very low	152 Å²	152	134.4 Å²	134.4	78%	0.779	78%	0.781	S	S	*	*			cis	-153.3	158.6	-19	-120.6	167.4	0	0	0	108.4
960	P	28.5	Very low	28.8	Very low	118 Å²	118	130.5 Å²	130.5	77%	0.766	77%	0.774	S	S	*	*			trans	-105.1	166.5	-152.2	39.7	-38.1	0	0	0	117.7
961	S	32	Very low	28.5	Very low	110 Å²	110	134.7 Å²	134.7	77%	0.769	79%	0.785	S	S	*	*			trans	-153.3	125.5	160	61.3	0	0	0	0	113.1
962	N	29.9	Very low	28.4	Very low	155 Å²	155	131 Å²	131	83%	0.829	78%	0.776	S	S	*	*			trans	15.6	128.4	161.2	-60.7	-6.6	0	0	0	120.1
963	V	26.7	Very low	28.3	Very low	121 Å²	121	132.7 Å²	132.7	73%	0.733	78%	0.777	S	S	*	*			cis	64.1	91.9	27.6	-166.2	0	0	0	0	114.8
964	N	26.6	Very low	28.2	Very low	154 Å²	154	132.2 Å²	132.2	82%	0.824	78%	0.78	S	S	*	*				-174.4	163.7	110.6	-105.4	-22.1	0	0	0	112.7
965	P	32.1	Very low	28.1	Very low	103 Å²	103	128.2 Å²	128.2	67%	0.669	78%	0.776	S	S	*	*			trans	-116.4	179.1	-156.5	43.6	-36.8	0	0	0	115.4
966	S	28.5	Very low	28.1	Very low	126 Å²	126	128.2 Å²	128.2	88%	0.881	78%	0.776	S	S	*	*			trans	-145.3	84.9	157.4	-69.4	0	0	0	0	111.6
967	Y	25.8	Very low	28.1	Very low	230 Å²	230	128.7 Å²	128.7	90%	0.902	77%	0.771	S	S	*	*			trans	-71.4	-172.2	146.1	-107.8	-102.2	0	0	0	109
968	A	27.9	Very low	28.2	Very low	83 Å²	83	128.1 Å²	128.1	69%	0.686	77%	0.768	S	S	*	*			trans	83.7	80.6	164.9	0	0	0	0	0	118.5
969	S	26.7	Very low	28.3	Very low	102 Å²	102	125.1 Å²	125.1	71%	0.713	76%	0.758	S	S	*	*				54.5	120	111.2	66.1	0	0	0	0	122.1
970	S	26.9	Very low	28.4	Very low	102 Å²	102	123 Å²	123	71%	0.713	75%	0.753	S	S	*	*				90.8	155.8	122.3	80.5	0	0	0	0	121.8
971	Q	26.7	Very low	28.5	Very low	194 Å²	194	124.5 Å²	124.5	91%	0.907	75%	0.754	S	S	*	*			trans	63.4	100.7	168.2	-55.3	-169.4	12.1	0	0	116.9
972	G	26.2	Very low	28.2	Very low	70 Å²	70	127.2 Å²	127.2	72%	0.722	75%	0.754	S	S	*	*			trans	-147.7	13.4	-176.9	0	0	0	0	0	117.1
973	T	26.7	Very low	28.1	Very low	126 Å²	126	124.5 Å²	124.5	77%	0.773	75%	0.747	S	S	*	*			trans	56.9	132.3	167.8	54	0	0	0	0	120.4
974	T	27.1	Very low	28	Very low	138 Å²	138	123.6 Å²	123.6	85%	0.847	74%	0.742	S	S	*	*			trans	64.9	147.7	156.9	58.6	0	0	0	0	118.9
975	A	26.8	Very low	28.1	Very low	82 Å²	82	126.3 Å²	126.3	68%	0.678	74%	0.742	S	S	*	*			cis	-166.4	165.3	-21.1	0	0	0	0	0	108.9
976	S	28.3	Very low	27.8	Very low	103 Å²	103	124.4 Å²	124.4	72%	0.72	74%	0.741	S	S	*	*			trans	65.9	125.5	174.1	46	0	0	0	0	115.9
977	N	29	Very low	27.6	Very low	134 Å²	134	125.8 Å²	125.8	72%	0.717	74%	0.738	S	S	*	*			cis	67.9	143.3	45.1	-59.2	53.2	0	0	0	110.2
978	D	30.4	Very low	27.6	Very low	136 Å²	136	125.4 Å²	125.4	73%	0.727	74%	0.735	S	S	*	*			cis	-173.6	-170.1	6.8	-115.4	-11.4	0	0	0	106.9
979	P	33.2	Very low	27.4	Very low	88 Å²	88	127.1 Å²	127.1	57%	0.571	74%	0.737	S	S	*	*				-137.8	-156.1	-53	38.4	-19.2	0	0	0	111
980	T	29.9	Very low	27.5	Very low	107 Å²	107	130.4 Å²	130.4	66%	0.656	75%	0.747	S	S	*	*			trans	67.6	153.6	149.5	55.3	0	0	0	0	119.2
981	L	31.9	Very low	27.4	Very low	151 Å²	151	135.1 Å²	135.1	79%	0.791	75%	0.754	S	S	*	*			cis	-121.9	140.3	0.1	-69.5	167.4	0	0	0	107.9
982	Q	25.3	Very low	27.4	Very low	167 Å²	167	130.2 Å²	130.2	78%	0.78	75%	0.747	S	S	*	*				56.9	91.8	50.8	-71.4	-170.3	-17.8	0	0	116
983	S	26.5	Very low	27.3	Very low	97 Å²	97	134.6 Å²	134.6	68%	0.678	75%	0.753	S	S	*	*			trans	-170.8	107.3	135.1	-158.1	0	0	0	0	110.8
984	T	25.7	Very low	27.3	Very low	103 Å²	103	136 Å²	136	63%	0.632	76%	0.755	S	S	*	*				95.8	155.2	82.7	-50.7	0	0	0	0	112.3
985	Y	27.5	Very low	27.4	Very low	211 Å²	211	136.9 Å²	136.9	83%	0.827	75%	0.754	S	S	*	*			trans	74.6	125.2	175.5	-42.3	-74.7	0	0	0	115.9
986	G	26.6	Very low	27.4	Very low	62 Å²	62	138.6 Å²	138.6	64%	0.639	76%	0.756	S	S	*	*			cis	136.1	147.3	-15.5	0	0	0	0	0	114.7
987	L	25.5	Very low	27.4	Very low	156 Å²	156	141.2 Å²	141.2	82%	0.817	76%	0.762	S	S	*	*			trans	69.8	136	175.8	-61.3	116.7	0	0	0	113.7
988	R	23.9	Very low	27.5	Very low	222 Å²	222	141.9 Å²	141.9	84%	0.838	76%	0.764	S	S	*	*				54.5	131.1	64.3	-63.3	-170	-175.3	-173.8	3.8	111.9
989	T	25	Very low	27.4	Very low	119 Å²	119	142.1 Å²	142.1	73%	0.73	77%	0.765	S	S	*	*			cis	-168.5	144.6	-0.3	12.5	0	0	0	0	108.2
990	N	28.4	Very low	27.1	Very low	171 Å²	171	148.3 Å²	148.3	91%	0.914	78%	0.778	S	S	*	*				-160.5	153.2	129.7	-111.9	-40.5	0	0	0	112.3
991	K	25.1	Very low	27.2	Very low	200 Å²	200	149.4 Å²	149.4	87%	0.87	78%	0.78	S	S	*	*			trans	-154.4	151.3	-174.7	-175.1	-179	178.9	-174.6	0	109.6
992	A	25.5	Very low	27.4	Very low	91 Å²	91	147.6 Å²	147.6	75%	0.752	78%	0.777	S	S	*	*			trans	83.4	153.7	-176.2	0	0	0	0	0	114.7
993	L	25.9	Very low	27.7	Very low	162 Å²	162	143.2 Å²	143.2	85%	0.848	78%	0.777	S	S	*	*			trans	64.6	115.3	-167.3	-59.6	173.9	0	0	0	113
994	L	26.6	Very low	27.8	Very low	156 Å²	156	147 Å²	147	82%	0.817	79%	0.79	S	S	*	*			cis	-130.6	152.3	6.4	-85.1	162.9	0	0	0	112.9	T996	L994-T996 PolarHBondContact O-N 3.22Å
995	N	28	Very low	28	Very low	157 Å²	157	144.9 Å²	144.9	84%	0.84	79%	0.789	S	S	*	*			trans	-76.5	115.4	178.8	-73.4	-19.3	0	0	0	111.6
996	T	28.2	Very low	28	Very low	117 Å²	117	140.5 Å²	140.5	72%	0.718	79%	0.786	S	S	*	*				7.9	111.3	122.6	-45.6	0	0	0	0	116.8	L994	L994-T996 PolarHBondContact O-N 3.22Å
997	L	27.8	Very low	28	Very low	159 Å²	159	147.2 Å²	147.2	83%	0.832	80%	0.797	S	S	*	*			trans	46.1	118.7	148.6	-78	65.2	0	0	0	120.1
998	I	30.2	Very low	28	Very low	148 Å²	148	147 Å²	147	76%	0.759	80%	0.796	S	S	*	*			trans	-80.1	138.2	142.3	-71.3	170.9	0	0	0	108.3
999	N	29.3	Very low	28	Very low	141 Å²	141	146.3 Å²	146.3	75%	0.754	80%	0.8	S	S	*	*			trans	28.8	136.8	154	-49.1	-11.3	0	0	0	119.4
1000	Y	27.3	Very low	28.2	Very low	218 Å²	218	144.9 Å²	144.9	86%	0.855	78%	0.783	S	S	*	*				-156	170.3	59.6	-156.3	-99.3	0	0	0	115.1
1001	D	31.4	Very low	28.2	Very low	130 Å²	130	140 Å²	140	70%	0.695	76%	0.76	S	S	*	*			trans	-76.1	-174.8	-174.9	-134.3	23.4	0	0	0	113.5
1002	P	36.3	Very low	28.4	Very low	112 Å²	112	137 Å²	137	73%	0.727	76%	0.759	S	S	*	*			cis	-135.9	175.4	-3.5	41	-23.7	0	0	0	116.4
1003	G	30.3	Very low	28.9	Very low	76 Å²	76	135.4 Å²	135.4	78%	0.784	74%	0.737	S	S	*	*			trans	151.2	96.9	158.8	0	0	0	0	0	116
1004	D	30.3	Very low	29.2	Very low	177 Å²	177	129.2 Å²	129.2	95%	0.947	71%	0.712	S	S	*	*			trans	-64.4	144.2	-177.6	-167.5	13.4	0	0	0	114.2
1005	G	28.4	Very low	29.9	Very low	58 Å²	58	131.2 Å²	131.2	60%	0.598	71%	0.711	S	S	*	*			trans	175.9	123.9	-175.6	0	0	0	0	0	112.4	K1007	G1005-K1007 PolarHBondContact O-N 3.17Å
1006	P	28.9	Very low	30.4	Very low	119 Å²	119	131.8 Å²	131.8	77%	0.773	71%	0.708	S	S	*	*			trans	-86.2	114.7	-155.3	30.7	-36.3	0	0	0	116.8
1007	K	25.2	Very low	31	Very low	202 Å²	202	129.7 Å²	129.7	88%	0.878	70%	0.695	S	S	*	*			trans	41.7	79.9	130.3	-61.5	171.5	-177.3	164.2	0	118.1	G1005	G1005-K1007 PolarHBondContact O-N 3.17Å
1008	L	25.7	Very low	31.5	Very low	152 Å²	152	126.5 Å²	126.5	80%	0.796	68%	0.678	S	S	*	*			trans	-101.2	117.3	151.1	-82.2	169	0	0	0	110.5	K1010	L1008-K1010 PolarHBondContact O-N 3.49Å
1009	K	25.3	Very low	32.6	Very low	208 Å²	208	124.6 Å²	124.6	90%	0.904	67%	0.665	S	S	*	*			trans	-78.4	83.6	177.7	-71	-179.5	178.2	176.6	0	110.4
1010	K	28	Very low	33.6	Very low	88 Å²	88	124.9 Å²	124.9	38%	0.383	66%	0.659	S	S	.	*			trans	-57	139.6	171	-60.2	-170.3	152	145.9	0	109.5	L1008 E1049 K1052 E1091	L1008-K1010 PolarHBondContact O-N 3.49Å; K1010-E1049 WeakPolarHBondContact CD-OE2 3.42Å; K1010-E1049 WeakPolarHBondContact CE-OE1 3.43Å; K1010-E1049 WeakPolarHBondContact CE-OE2 3.35Å; K1010-E1049 VanDerWaalsContact CG-OE2 3.24Å; K1010-E1049 WeakPolarHBondContact CG-OE2 3.47Å; K1010-E1049 IonicContact NZ-OE1 3.02Å; K1010-K1052 HydrophobicContact CD-CD 4.39Å; K1010-E1091 IonicContact NZ-OE1 3.31Å; K1010-E1091 PolarHBondContact NZ-OE1 3.33Å; K1010-E1091 IonicContact NZ-OE2 2.69Å; K1010-E1091 PolarHBondContact NZ-OE2 2.99Å
1011	P	27.8	Very low	34.2	Very low	68 Å²	68	115.9 Å²	115.9	44%	0.442	63%	0.626	S	S	.	*			trans	-76.8	132.9	-142.7	25.8	-35.7	0	0	0	115.4	I1013	P1011-I1013 PolarHBondContact O-N 2.81Å; P1011-I1013 VanDerWaalsContact O-N 3.16Å
1012	V	30.3	Very low	35.1	Very low	139 Å²	139	120.5 Å²	120.5	84%	0.842	63%	0.633	S	S	*	*			trans	-73.1	102.8	160.2	178.1	0	0	0	0	107.7	G1014	V1012-G1014 PolarHBondContact O-N 3.25Å
1013	I	35.1	Very low	36.1	Very low	56 Å²	56	121.3 Å²	121.3	29%	0.287	63%	0.628	S	S	.	*			trans	-58.2	110.5	169.6	-54.6	176.8	0	0	0	107.2	P1011 T1017 L1018 T1053	P1011-I1013 PolarHBondContact O-N 2.81Å; P1011-I1013 VanDerWaalsContact O-N 3.16Å; I1013-T1017 HydrophobicContact CG2-CG2 3.82Å; I1013-L1018 HydrophobicContact CB-CG 4.29Å; I1013-L1018 HydrophobicContact CG2-CG 3.87Å; I1013-T1053 HydrophobicContact CD1-CG2 3.78Å; I1013-T1053 HydrophobicContact CG1-CG2 4.23Å
1014	G	33.4	Very low	37	Very low	32 Å²	32	120.2 Å²	120.2	33%	0.33	60%	0.602	S	S	.	*			trans	-58.6	149.6	-173.6	0	0	0	0	0	111.8	V1012 Q1016 T1017 L1018	V1012-G1014 PolarHBondContact O-N 3.25Å; G1014-Q1016 PolarHBondContact O-N 3.16Å; G1014-Q1016 VanDerWaalsContact O-N 3.07Å; G1014-T1017 WeakPolarHBondContact O-CA 3.32Å; G1014-T1017 WeakPolarHBondContact O-CB 3.39Å; G1014-T1017 PolarHBondContact O-N 3.46Å; G1014-L1018 PolarHBondContact O-N 3.12Å
1015	Y	41.2	Very low	38.4	Very low	199 Å²	199	115 Å²	115	78%	0.78	58%	0.578	S	S	*	*	H	α-helix	trans	-54.6	-32.6	-179.7	-172.6	-91.7	0	0	0	112.5	K1019	Y1015-K1019 WeakPolarHBondContact O-CB 3.39Å; Y1015-K1019 PolarHBondContact O-N 3.19Å
1016	Q	39.3	Very low	40	Very low	168 Å²	168	114.6 Å²	114.6	79%	0.785	57%	0.565	S	S	*	*	H	α-helix	trans	-64.5	-45.6	173.4	-65.5	170.3	-7.2	0	0	112.2	G1014 K1019 K1020	G1014-Q1016 PolarHBondContact O-N 3.16Å; G1014-Q1016 VanDerWaalsContact O-N 3.07Å; Q1016-K1019 PolarHBondContact O-N 3.1Å; Q1016-K1020 WeakPolarHBondContact O-CB 3.33Å; Q1016-K1020 PolarHBondContact O-N 3Å
1017	T	39.3	Very low	41.7	Very low	73 Å²	73	111.4 Å²	111.4	45%	0.448	54%	0.54	S	S	.	.	H	α-helix	trans	-67.3	-43.2	176.1	-44.3	0	0	0	0	111.5	I1013 G1014 K1019 K1020 I1021	I1013-T1017 HydrophobicContact CG2-CG2 3.82Å; G1014-T1017 WeakPolarHBondContact O-CA 3.32Å; G1014-T1017 WeakPolarHBondContact O-CB 3.39Å; G1014-T1017 PolarHBondContact O-N 3.46Å; T1017-K1019 VanDerWaalsContact C-N 3.31Å; T1017-K1019 PolarHBondContact O-N 3.03Å; T1017-K1020 PolarHBondContact O-N 3.1Å; T1017-I1021 HydrophobicContact CG2-CD1 3.99Å; T1017-I1021 WeakPolarHBondContact O-CB 3.47Å; T1017-I1021 VanDerWaalsContact O-CG1 3.3Å; T1017-I1021 WeakPolarHBondContact O-CG1 3.21Å; T1017-I1021 PolarHBondContact O-N 2.68Å
1018	L	38.9	Very low	43.9	Very low	92 Å²	92	105.8 Å²	105.8	48%	0.482	52%	0.519	S	S	.	.	H	α-helix	trans	-60.5	-38.7	172.9	-90.9	168.3	0	0	0	112.3	I1013 G1014 R1022	I1013-L1018 HydrophobicContact CB-CG 4.29Å; I1013-L1018 HydrophobicContact CG2-CG 3.87Å; G1014-L1018 PolarHBondContact O-N 3.12Å; L1018-R1022 VanDerWaalsContact O-CB 3.27Å; L1018-R1022 WeakPolarHBondContact O-CB 3.42Å; L1018-R1022 PolarHBondContact O-N 3.35Å; L1018-R1022 VanDerWaalsContact O-N 3.16Å
1019	K	52.2	Low	46.3	Very low	109 Å²	109	99.2 Å²	99.2	47%	0.474	49%	0.485	S	S	.	.	H	α-helix	trans	-65.4	-50.2	173.9	-178.4	-177.6	171	-173.8	0	110.5	Y1015 Q1016 T1017 I1021 R1022 E1023	Y1015-K1019 WeakPolarHBondContact O-CB 3.39Å; Y1015-K1019 PolarHBondContact O-N 3.19Å; Q1016-K1019 PolarHBondContact O-N 3.1Å; T1017-K1019 VanDerWaalsContact C-N 3.31Å; T1017-K1019 PolarHBondContact O-N 3.03Å; K1019-I1021 PolarHBondContact O-N 2.89Å; K1019-R1022 CarbonylContact O-C 3.5Å; K1019-R1022 WeakPolarHBondContact O-CA 3.42Å; K1019-R1022 WeakPolarHBondContact O-CB 3.14Å; K1019-R1022 PolarHBondContact O-N 3.09Å; K1019-E1023 WeakPolarHBondContact CE-OE1 3.42Å; K1019-E1023 WeakPolarHBondContact CE-OE2 3.24Å; K1019-E1023 HydrophobicContact CG-CG 4.46Å; K1019-E1023 IonicContact NZ-OE1 2.69Å; K1019-E1023 WeakPolarHBondContact O-CG 3.48Å; K1019-E1023 PolarHBondContact O-N 3.39Å
1020	K	50.4	Low	48.9	Very low	147 Å²	147	89.3 Å²	89.3	64%	0.639	44%	0.442	S	S	*	.	H	α-helix	trans	-59.4	-46.4	-179	-159.6	179.9	-175.4	-168.8	0	112.1	Q1016 T1017 R1022 E1023 M1024	Q1016-K1020 WeakPolarHBondContact O-CB 3.33Å; Q1016-K1020 PolarHBondContact O-N 3Å; T1017-K1020 PolarHBondContact O-N 3.1Å; K1020-R1022 VanDerWaalsContact C-N 3.26Å; K1020-R1022 PolarHBondContact O-N 3.35Å; K1020-E1023 PolarHBondContact O-N 3.09Å; K1020-E1023 VanDerWaalsContact O-N 3.11Å; K1020-M1024 WeakPolarHBondContact O-CG 3.45Å; K1020-M1024 PolarHBondContact O-N 3.43Å; K1020-M1024 VanDerWaalsContact O-N 3.1Å
1021	I	40	Very low	51.3	Low	29 Å²	29	87.9 Å²	87.9	15%	0.149	44%	0.443	C	S	.	.	H	α-helix	trans	-60.3	-35.1	173.5	-68	166.9	0	0	0	111.3	T1017 K1019 E1023 I1029	T1017-I1021 HydrophobicContact CG2-CD1 3.99Å; T1017-I1021 WeakPolarHBondContact O-CB 3.47Å; T1017-I1021 VanDerWaalsContact O-CG1 3.3Å; T1017-I1021 WeakPolarHBondContact O-CG1 3.21Å; T1017-I1021 PolarHBondContact O-N 2.68Å; K1019-I1021 PolarHBondContact O-N 2.89Å; I1021-E1023 VanDerWaalsContact C-N 3.31Å; I1021-I1029 HydrophobicContact CG2-CD1 4.11Å; I1021-I1029 HydrophobicContact CG2-CG1 4.28Å; I1021-I1029 HydrophobicContact CG2-CG2 4.3Å; I1021-I1029 WeakPolarHBondContact O-CD1 3.21Å
1022	R	51.7	Low	53.7	Low	226 Å²	226	87.5 Å²	87.5	85%	0.853	44%	0.436	S	S	*	.	H	α-helix	trans	-80.1	-11.9	178.7	-161.7	178.7	-170.9	-166.5	2.5	113.9	L1018 K1019 K1020	L1018-R1022 VanDerWaalsContact O-CB 3.27Å; L1018-R1022 WeakPolarHBondContact O-CB 3.42Å; L1018-R1022 PolarHBondContact O-N 3.35Å; L1018-R1022 VanDerWaalsContact O-N 3.16Å; K1019-R1022 CarbonylContact O-C 3.5Å; K1019-R1022 WeakPolarHBondContact O-CA 3.42Å; K1019-R1022 WeakPolarHBondContact O-CB 3.14Å; K1019-R1022 PolarHBondContact O-N 3.09Å; K1020-R1022 VanDerWaalsContact C-N 3.26Å; K1020-R1022 PolarHBondContact O-N 3.35Å
1023	E	56.6	Low	56.1	Low	130 Å²	130	80.9 Å²	80.9	61%	0.607	40%	0.396	S	S	*	.	H	α-helix	trans	-100.4	-6.9	174.9	-70.5	174.2	155.9	0	0	112.1	K1019 K1020 I1021	K1019-E1023 WeakPolarHBondContact CE-OE1 3.42Å; K1019-E1023 WeakPolarHBondContact CE-OE2 3.24Å; K1019-E1023 HydrophobicContact CG-CG 4.46Å; K1019-E1023 IonicContact NZ-OE1 2.69Å; K1019-E1023 WeakPolarHBondContact O-CG 3.48Å; K1019-E1023 PolarHBondContact O-N 3.39Å; K1020-E1023 PolarHBondContact O-N 3.09Å; K1020-E1023 VanDerWaalsContact O-N 3.11Å; I1021-E1023 VanDerWaalsContact C-N 3.31Å
1024	M	48.2	Very low	58.3	Low	52 Å²	52	79.2 Å²	79.2	26%	0.256	39%	0.387	S	S	.	.	S	Bend	trans	-85	145.1	173.3	-75.8	163.7	63.2	0	0	111.9	K1020 D1028 I1029	K1020-M1024 WeakPolarHBondContact O-CG 3.45Å; K1020-M1024 PolarHBondContact O-N 3.43Å; K1020-M1024 VanDerWaalsContact O-N 3.1Å; M1024-D1028 HydrophobicContact CB-CB 4.5Å; M1024-D1028 HydrophobicContact CE-CB 3.9Å; M1024-I1029 HydrophobicContact CB-CD1 4.33Å; M1024-I1029 HydrophobicContact CB-CG1 3.86Å; M1024-I1029 HydrophobicContact CE-CG1 4.41Å
1025	P	61.8	Low	60.5	Low	67 Å²	67	83.8 Å²	83.8	44%	0.435	40%	0.4	S	S	.	.			trans	-53.3	146.9	164.9	-25.5	33.4	0	0	0	112.9	E1027 D1028 I1029	P1025-E1027 PolarHBondContact O-N 2.9Å; P1025-D1028 VanDerWaalsContact CD-OD2 3.3Å; P1025-D1028 WeakPolarHBondContact CD-OD2 3.22Å; P1025-D1028 PolarHBondContact O-N 3.28Å; P1025-I1029 WeakPolarHBondContact O-CG1 3.43Å; P1025-I1029 PolarHBondContact O-N 3.03Å
1026	P	60.2	Low	62.3	Low	50 Å²	50	76.8 Å²	76.8	33%	0.325	37%	0.374	S	S	.	.	H	α-helix	trans	-54	-36.4	175.7	-27.3	35.9	0	0	0	113.9	I1029 M1030 V1066	P1026-I1029 PolarHBondContact O-N 3.11Å; P1026-M1030 PolarHBondContact O-N 2.86Å; P1026-V1066 HydrophobicContact CB-CG1 4.33Å; P1026-V1066 HydrophobicContact CG-CG1 4.12Å
1027	E	66	Low	64.1	Low	52 Å²	52	68.9 Å²	68.9	24%	0.243	34%	0.337	C	S	.	.	H	α-helix	trans	-66.1	-39.7	-177.4	-45.6	-58.3	-123.9	0	0	111.7	P1025 S1031 N1069 Y1073	P1025-E1027 PolarHBondContact O-N 2.9Å; E1027-S1031 WeakPolarHBondContact O-CB 3.5Å; E1027-S1031 PolarHBondContact O-N 3.31Å; E1027-S1031 PolarHBondContact O-OG 3.48Å; E1027-N1069 PolarHBondContact OE1-ND2 2.6Å; E1027-Y1073 WeakPolarHBondContact CA-OH 3.37Å; E1027-Y1073 VanDerWaalsContact CB-OH 3.3Å; E1027-Y1073 WeakPolarHBondContact CB-OH 3.48Å
1028	D	70.5	Confident	65.8	Low	84 Å²	84	67.9 Å²	67.9	45%	0.449	33%	0.333	S	S	.	.	H	α-helix	trans	-68	-41.1	174.9	-66.5	-5.5	0	0	0	110.9	M1024 P1025 S1031 E1032	M1024-D1028 HydrophobicContact CB-CB 4.5Å; M1024-D1028 HydrophobicContact CE-CB 3.9Å; P1025-D1028 VanDerWaalsContact CD-OD2 3.3Å; P1025-D1028 WeakPolarHBondContact CD-OD2 3.22Å; P1025-D1028 PolarHBondContact O-N 3.28Å; D1028-S1031 PolarHBondContact O-N 2.69Å; D1028-E1032 PolarHBondContact O-N 3.33Å
1029	I	76.5	Confident	67.2	Low	14 Å²	14	66 Å²	66	7%	0.072	32%	0.323	C	S	.	.	H	α-helix	trans	-65.1	-41.1	178.6	-58.4	165.2	0	0	0	110.6	I1021 M1024 P1025 P1026 S1031 E1032 I1033 L1061	I1021-I1029 HydrophobicContact CG2-CD1 4.11Å; I1021-I1029 HydrophobicContact CG2-CG1 4.28Å; I1021-I1029 HydrophobicContact CG2-CG2 4.3Å; I1021-I1029 WeakPolarHBondContact O-CD1 3.21Å; M1024-I1029 HydrophobicContact CB-CD1 4.33Å; M1024-I1029 HydrophobicContact CB-CG1 3.86Å; M1024-I1029 HydrophobicContact CE-CG1 4.41Å; P1025-I1029 WeakPolarHBondContact O-CG1 3.43Å; P1025-I1029 PolarHBondContact O-N 3.03Å; P1026-I1029 PolarHBondContact O-N 3.11Å; I1029-S1031 VanDerWaalsContact C-N 3.34Å; I1029-E1032 PolarHBondContact O-N 3Å; I1029-I1033 HydrophobicContact CG2-CD1 3.95Å; I1029-I1033 WeakPolarHBondContact O-CB 3.49Å; I1029-I1033 VanDerWaalsContact O-CG1 3.31Å; I1029-I1033 WeakPolarHBondContact O-CG1 3.5Å; I1029-I1033 PolarHBondContact O-N 2.94Å; I1029-L1061 HydrophobicContact CG2-CD1 4.05Å
1030	M	80	Confident	67.6	Low	0 Å²	0	63 Å²	63	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-69.7	-35.4	179	-166.3	57.5	-174.7	0	0	111.5	P1026 I1033 L1034 L1058 I1067 W1070 Y1073 T1077	P1026-M1030 PolarHBondContact O-N 2.86Å; M1030-I1033 PolarHBondContact O-N 3.35Å; M1030-I1033 HydrophobicContact SD-CG2 4.46Å; M1030-L1034 HydrophobicContact CE-CD1 4.27Å; M1030-L1034 HydrophobicContact CE-CD2 4.28Å; M1030-L1034 HydrophobicContact CE-CG 4.13Å; M1030-L1034 HydrophobicContact CG-CD1 4.32Å; M1030-L1034 WeakPolarHBondContact O-CB 3.44Å; M1030-L1034 WeakPolarHBondContact O-CG 3.47Å; M1030-L1034 PolarHBondContact O-N 2.8Å; M1030-L1058 HydrophobicContact CE-CD1 3.87Å; M1030-L1058 HydrophobicContact SD-CD1 3.91Å; M1030-I1067 HydrophobicContact CB-CD1 4.16Å; M1030-I1067 HydrophobicContact CG-CD1 4Å; M1030-I1067 HydrophobicContact SD-CD1 3.62Å; M1030-W1070 HydrophobicContact CE-CH2 4.09Å; M1030-W1070 HydrophobicContact CE-CZ3 3.95Å; M1030-Y1073 HydrophobicContact CB-CD1 4.11Å; M1030-Y1073 HydrophobicContact CB-CD2 4.44Å; M1030-Y1073 HydrophobicContact CB-CE1 4.06Å; M1030-Y1073 HydrophobicContact CB-CE2 4.42Å; M1030-Y1073 HydrophobicContact CB-CG 4.3Å; M1030-Y1073 HydrophobicContact CG-CD1 3.52Å; M1030-Y1073 HydrophobicContact CG-CD2 3.97Å; M1030-Y1073 HydrophobicContact CG-CE1 4.01Å; M1030-Y1073 HydrophobicContact CG-CE2 4.42Å; M1030-Y1073 HydrophobicContact CG-CG 3.5Å; M1030-T1077 HydrophobicContact CE-CG2 4.25Å; M1030-T1077 WeakPolarHBondContact CE-OG1 3.43Å
1031	S	78.1	Confident	67.6	Low	59 Å²	59	63 Å²	63	41%	0.413	32%	0.319	S	S	.	.	H	α-helix	trans	-63.6	-45.3	172.4	-58.2	0	0	0	0	112.2	E1027 D1028 I1029 I1033 L1034 Q1035	E1027-S1031 WeakPolarHBondContact O-CB 3.5Å; E1027-S1031 PolarHBondContact O-N 3.31Å; E1027-S1031 PolarHBondContact O-OG 3.48Å; D1028-S1031 PolarHBondContact O-N 2.69Å; I1029-S1031 VanDerWaalsContact C-N 3.34Å; S1031-I1033 PolarHBondContact O-N 2.96Å; S1031-L1034 PolarHBondContact O-N 2.89Å; S1031-Q1035 WeakPolarHBondContact O-CB 3.27Å; S1031-Q1035 PolarHBondContact O-N 3.08Å
1032	E	79.1	Confident	68.1	Low	60 Å²	60	67.4 Å²	67.4	28%	0.28	34%	0.338	S	S	.	.	H	α-helix	trans	-57.8	-45.8	172.4	-175.1	-162.8	116.4	0	0	111.3	D1028 I1029 Q1035 E1036 K1057	D1028-E1032 PolarHBondContact O-N 3.33Å; I1029-E1032 PolarHBondContact O-N 3Å; E1032-Q1035 PolarHBondContact O-N 2.73Å; E1032-E1036 WeakPolarHBondContact O-CG 3.39Å; E1032-E1036 PolarHBondContact O-N 2.72Å; E1032-E1036 VanDerWaalsContact O-N 3.09Å; E1032-K1057 IonicContact OE1-NZ 3.22Å; E1032-K1057 PolarHBondContact OE1-NZ 2.99Å
1033	I	80.2	Confident	68	Low	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-43.8	179.9	-74.8	170.3	0	0	0	111.5	I1029 M1030 S1031 L1037 C1054 K1057 L1058 L1061	I1029-I1033 HydrophobicContact CG2-CD1 3.95Å; I1029-I1033 WeakPolarHBondContact O-CB 3.49Å; I1029-I1033 VanDerWaalsContact O-CG1 3.31Å; I1029-I1033 WeakPolarHBondContact O-CG1 3.5Å; I1029-I1033 PolarHBondContact O-N 2.94Å; M1030-I1033 PolarHBondContact O-N 3.35Å; M1030-I1033 HydrophobicContact SD-CG2 4.46Å; S1031-I1033 PolarHBondContact O-N 2.96Å; I1033-L1037 HydrophobicContact CG2-CD1 3.67Å; I1033-L1037 HydrophobicContact CG2-CG 4.36Å; I1033-L1037 VanDerWaalsContact O-CB 3.32Å; I1033-L1037 WeakPolarHBondContact O-CB 3.39Å; I1033-L1037 WeakPolarHBondContact O-CG 3.2Å; I1033-L1037 PolarHBondContact O-N 3.3Å; I1033-C1054 HydrophobicContact CG2-CB 4.43Å; I1033-K1057 HydrophobicContact CD1-CB 3.79Å; I1033-K1057 HydrophobicContact CD1-CD 3.98Å; I1033-K1057 HydrophobicContact CG1-CB 4.46Å; I1033-K1057 HydrophobicContact CG1-CD 3.95Å; I1033-L1058 HydrophobicContact CG2-CB 4.45Å; I1033-L1058 HydrophobicContact CG2-CD2 4.39Å; I1033-L1061 HydrophobicContact CD1-CD1 3.49Å; I1033-L1061 VanDerWaalsContact CD1-CD1 3.49Å
1034	L	80.5	Confident	68.2	Low	21 Å²	21	67.5 Å²	67.5	11%	0.11	34%	0.341	C	S	.	.	H	α-helix	trans	-67.5	-40.6	179.5	-75.3	171.2	0	0	0	112.1	M1030 S1031 L1037 S1038 Y1073 P1076 I1080	M1030-L1034 HydrophobicContact CE-CD1 4.27Å; M1030-L1034 HydrophobicContact CE-CD2 4.28Å; M1030-L1034 HydrophobicContact CE-CG 4.13Å; M1030-L1034 HydrophobicContact CG-CD1 4.32Å; M1030-L1034 WeakPolarHBondContact O-CB 3.44Å; M1030-L1034 WeakPolarHBondContact O-CG 3.47Å; M1030-L1034 PolarHBondContact O-N 2.8Å; S1031-L1034 PolarHBondContact O-N 2.89Å; L1034-L1037 PolarHBondContact O-N 3Å; L1034-S1038 WeakPolarHBondContact O-CB 3.44Å; L1034-S1038 PolarHBondContact O-N 3.48Å; L1034-Y1073 HydrophobicContact CD1-CD1 3.74Å; L1034-P1076 HydrophobicContact CD1-CB 4.11Å; L1034-P1076 HydrophobicContact CD2-CB 3.99Å; L1034-I1080 HydrophobicContact CD2-CD1 4.09Å
1035	Q	80	Confident	68.8	Low	128 Å²	128	71.5 Å²	71.5	60%	0.598	36%	0.364	S	S	*	.	H	α-helix	trans	-58.7	-54	175	-175.7	169.1	7.4	0	0	111	S1031 E1032 L1037 S1038 N1039	S1031-Q1035 WeakPolarHBondContact O-CB 3.27Å; S1031-Q1035 PolarHBondContact O-N 3.08Å; E1032-Q1035 PolarHBondContact O-N 2.73Å; Q1035-L1037 VanDerWaalsContact C-N 3.28Å; Q1035-L1037 PolarHBondContact O-N 3.46Å; Q1035-S1038 PolarHBondContact O-N 3.07Å; Q1035-S1038 PolarHBondContact O-OG 2.93Å; Q1035-N1039 PolarHBondContact O-N 3.36Å; Q1035-N1039 PolarHBondContact O-OD1 3.21Å
1036	E	78	Confident	68.7	Low	52 Å²	52	73 Å²	73	24%	0.243	37%	0.372	C	S	.	.	H	α-helix	trans	-72	-20.7	-176.2	-60	-67.5	-104.3	0	0	113.5	E1032 N1039 R1051	E1032-E1036 WeakPolarHBondContact O-CG 3.39Å; E1032-E1036 PolarHBondContact O-N 2.72Å; E1032-E1036 VanDerWaalsContact O-N 3.09Å; E1036-N1039 PolarHBondContact OE2-ND2 3.44Å; E1036-R1051 VanDerWaalsContact O-CG 3.25Å; E1036-R1051 WeakPolarHBondContact O-CG 3.38Å
1037	L	77.1	Confident	69.1	Low	2 Å²	2	71 Å²	71	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-79.4	-28	168.9	-69.6	174.1	0	0	0	112.8	I1033 L1034 Q1035 N1039 H1040 R1051 C1054 M1055 L1058 I1080	I1033-L1037 HydrophobicContact CG2-CD1 3.67Å; I1033-L1037 HydrophobicContact CG2-CG 4.36Å; I1033-L1037 VanDerWaalsContact O-CB 3.32Å; I1033-L1037 WeakPolarHBondContact O-CB 3.39Å; I1033-L1037 WeakPolarHBondContact O-CG 3.2Å; I1033-L1037 PolarHBondContact O-N 3.3Å; L1034-L1037 PolarHBondContact O-N 3Å; Q1035-L1037 VanDerWaalsContact C-N 3.28Å; Q1035-L1037 PolarHBondContact O-N 3.46Å; L1037-N1039 VanDerWaalsContact C-N 3.3Å; L1037-N1039 PolarHBondContact O-N 3.23Å; L1037-H1040 PolarHBondContact O-CE1 3Å; L1037-H1040 PolarHBondContact O-ND1 3.32Å; L1037-H1040 VanDerWaalsContact O-ND1 3.08Å; L1037-R1051 HydrophobicContact CD2-CB 4.28Å; L1037-R1051 HydrophobicContact CD2-CG 4.4Å; L1037-C1054 HydrophobicContact CD2-CB 3.93Å; L1037-C1054 HydrophobicContact CG-CB 4Å; L1037-M1055 HydrophobicContact CD2-CE 3.8Å; L1037-M1055 HydrophobicContact CD2-CG 3.82Å; L1037-L1058 HydrophobicContact CD1-CD2 4.19Å; L1037-I1080 HydrophobicContact CB-CG2 3.77Å; L1037-I1080 WeakPolarHBondContact O-CG2 3.45Å
1038	S	75.2	Confident	69.3	Low	52 Å²	52	71.3 Å²	71.3	36%	0.364	36%	0.358	S	S	.	.	H	α-helix	trans	-72.6	-18.8	179.1	74.9	0	0	0	0	114.1	L1034 Q1035 H1040	L1034-S1038 WeakPolarHBondContact O-CB 3.44Å; L1034-S1038 PolarHBondContact O-N 3.48Å; Q1035-S1038 PolarHBondContact O-N 3.07Å; Q1035-S1038 PolarHBondContact O-OG 2.93Å; S1038-H1040 PolarHBondContact O-N 2.76Å; S1038-H1040 PolarHBondContact O-ND1 3.04Å
1039	N	69.3	Low	69.6	Low	51 Å²	51	69 Å²	69	27%	0.273	35%	0.345	S	S	.	.			trans	-70.1	65.4	179.4	-59.7	-20.2	0	0	0	112.8	Q1035 E1036 L1037 T1047	Q1035-N1039 PolarHBondContact O-N 3.36Å; Q1035-N1039 PolarHBondContact O-OD1 3.21Å; E1036-N1039 PolarHBondContact OE2-ND2 3.44Å; L1037-N1039 VanDerWaalsContact C-N 3.3Å; L1037-N1039 PolarHBondContact O-N 3.23Å; N1039-T1047 HydrophobicContact CB-CG2 4.08Å
1040	H	59.5	Low	69.7	Low	46 Å²	46	72 Å²	72	21%	0.213	36%	0.358	C	S	.	.			trans	-79.6	-23.7	179.9	-80.3	61.2	0	0	0	113.6	L1037 S1038 R1051 T1084 D1087	L1037-H1040 PolarHBondContact O-CE1 3Å; L1037-H1040 PolarHBondContact O-ND1 3.32Å; L1037-H1040 VanDerWaalsContact O-ND1 3.08Å; S1038-H1040 PolarHBondContact O-N 2.76Å; S1038-H1040 PolarHBondContact O-ND1 3.04Å; H1040-R1051 PolarHBondContact CE1-NH2 3.23Å; H1040-R1051 PolarHBondContact NE2-NH2 3.19Å; H1040-T1084 PolarHBondContact NE2-OG1 3.18Å; H1040-D1087 IonicContact CD2-OD1 3.24Å
1041	N	51.9	Low	69.7	Low	149 Å²	149	72.8 Å²	72.8	80%	0.797	36%	0.361	S	S	*	.	S	Bend	trans	-83.9	-11.3	-172.5	-78.9	-40.8	0	0	0	115.1
1042	E	49.2	Very low	70	Confident	121 Å²	121	71.6 Å²	71.6	57%	0.565	35%	0.349	S	S	*	.			trans	-92.4	107.8	-179.3	-66.5	-172.2	162.3	0	0	111	D1044 T1047	E1042-D1044 PolarHBondContact O-N 3.21Å; E1042-T1047 HydrophobicContact CB-CG2 4.24Å
1043	R	51.3	Low	70.3	Confident	246 Å²	246	69.9 Å²	69.9	93%	0.928	34%	0.342	S	S	*	.			trans	-75.5	17.6	-175.9	-72.2	-178.6	165.6	172.4	-4.8	114.8
1044	D	59.3	Low	70.6	Confident	111 Å²	111	70.1 Å²	70.1	59%	0.594	34%	0.343	S	S	*	.			trans	-85.4	139.6	-175.6	-79.5	-20.2	0	0	0	112.4	E1042 V1046 T1047 Y1048	E1042-D1044 PolarHBondContact O-N 3.21Å; D1044-V1046 PolarHBondContact O-N 3.27Å; D1044-T1047 WeakPolarHBondContact O-CB 3.15Å; D1044-T1047 PolarHBondContact O-N 3.33Å; D1044-Y1048 PolarHBondContact O-N 2.91Å
1045	N	61.7	Low	71	Confident	136 Å²	136	69.1 Å²	69.1	73%	0.727	34%	0.338	S	S	*	.	H	α-helix	trans	-58.7	-21.6	176.2	-70.6	-67.2	0	0	0	112.8	E1049	N1045-E1049 PolarHBondContact O-N 3.35Å
1046	V	59.6	Low	71.4	Confident	100 Å²	100	67.4 Å²	67.4	61%	0.606	33%	0.333	S	S	*	.	H	α-helix	trans	-68.9	-49	175.6	-170.8	0	0	0	0	110.2	D1044 Y1048 E1049 Q1050	D1044-V1046 PolarHBondContact O-N 3.27Å; V1046-Y1048 VanDerWaalsContact C-N 3.28Å; V1046-Y1048 PolarHBondContact O-N 3.34Å; V1046-E1049 PolarHBondContact O-N 2.95Å; V1046-E1049 VanDerWaalsContact O-N 3.13Å; V1046-Q1050 VanDerWaalsContact C-OE1 3.29Å; V1046-Q1050 WeakPolarHBondContact O-CG 3.39Å; V1046-Q1050 PolarHBondContact O-N 2.83Å; V1046-Q1050 PolarHBondContact O-OE1 3.36Å
1047	T	67.6	Low	71.7	Confident	7 Å²	7	66.9 Å²	66.9	4%	0.043	33%	0.33	C	S	.	.	H	α-helix	trans	-60.7	-37.1	177.8	-40.4	0	0	0	0	111.6	N1039 E1042 D1044 Q1050 R1051	N1039-T1047 HydrophobicContact CB-CG2 4.08Å; E1042-T1047 HydrophobicContact CB-CG2 4.24Å; D1044-T1047 WeakPolarHBondContact O-CB 3.15Å; D1044-T1047 PolarHBondContact O-N 3.33Å; T1047-Q1050 PolarHBondContact O-N 3.24Å; T1047-R1051 WeakPolarHBondContact O-CB 3.48Å; T1047-R1051 WeakPolarHBondContact O-CG 3.27Å; T1047-R1051 PolarHBondContact O-N 2.74Å
1048	Y	71	Confident	72.2	Confident	58 Å²	58	66.8 Å²	66.8	23%	0.227	33%	0.329	C	S	.	.	H	α-helix	trans	-58.3	-50.6	171.8	176.8	-85.7	0	0	0	112.8	D1044 V1046 Q1050 R1051 K1052 E1091 T1092	D1044-Y1048 PolarHBondContact O-N 2.91Å; V1046-Y1048 VanDerWaalsContact C-N 3.28Å; V1046-Y1048 PolarHBondContact O-N 3.34Å; Y1048-Q1050 VanDerWaalsContact C-N 3.33Å; Y1048-Q1050 PolarHBondContact O-N 3.08Å; Y1048-R1051 PolarHBondContact O-N 3.38Å; Y1048-K1052 HydrophobicContact CE1-CD 4.43Å; Y1048-K1052 WeakPolarHBondContact O-CB 3.48Å; Y1048-K1052 PolarHBondContact O-N 2.98Å; Y1048-E1091 WeakPolarHBondContact OH-CB 3.25Å; Y1048-E1091 PolarHBondContact OH-OE2 3.44Å; Y1048-T1092 WeakPolarHBondContact CE2-OG1 3.44Å
1049	E	77.3	Confident	72.8	Confident	37 Å²	37	65.2 Å²	65.2	17%	0.173	32%	0.317	C	S	.	.	H	α-helix	trans	-67.6	-33.6	178.9	-65.2	-58.3	159	0	0	112.2	K1010 N1045 V1046 T1053	K1010-E1049 WeakPolarHBondContact CD-OE2 3.42Å; K1010-E1049 WeakPolarHBondContact CE-OE1 3.43Å; K1010-E1049 WeakPolarHBondContact CE-OE2 3.35Å; K1010-E1049 VanDerWaalsContact CG-OE2 3.24Å; K1010-E1049 WeakPolarHBondContact CG-OE2 3.47Å; K1010-E1049 IonicContact NZ-OE1 3.02Å; N1045-E1049 PolarHBondContact O-N 3.35Å; V1046-E1049 PolarHBondContact O-N 2.95Å; V1046-E1049 VanDerWaalsContact O-N 3.13Å; E1049-T1053 VanDerWaalsContact O-CB 3.25Å; E1049-T1053 WeakPolarHBondContact O-CB 3.37Å; E1049-T1053 PolarHBondContact O-N 3.45Å; E1049-T1053 PolarHBondContact O-OG1 2.9Å
1050	Q	77.7	Confident	73.7	Confident	75 Å²	75	68.7 Å²	68.7	35%	0.35	33%	0.329	S	S	.	.	H	α-helix	trans	-64.4	-51.8	173.6	-72.7	165.1	-65	0	0	111.1	V1046 T1047 Y1048 K1052 T1053 C1054	V1046-Q1050 VanDerWaalsContact C-OE1 3.29Å; V1046-Q1050 WeakPolarHBondContact O-CG 3.39Å; V1046-Q1050 PolarHBondContact O-N 2.83Å; V1046-Q1050 PolarHBondContact O-OE1 3.36Å; T1047-Q1050 PolarHBondContact O-N 3.24Å; Y1048-Q1050 VanDerWaalsContact C-N 3.33Å; Y1048-Q1050 PolarHBondContact O-N 3.08Å; Q1050-K1052 VanDerWaalsContact C-N 3.35Å; Q1050-K1052 PolarHBondContact O-N 3.33Å; Q1050-T1053 CarbonylContact O-C 3.58Å; Q1050-T1053 WeakPolarHBondContact O-CB 3.3Å; Q1050-T1053 PolarHBondContact O-N 3.43Å; Q1050-T1053 VanDerWaalsContact O-N 3.09Å; Q1050-C1054 PolarHBondContact O-N 3.28Å; Q1050-C1054 PolarHBondContact O-SG 2.87Å
1051	R	80.9	Confident	74.9	Confident	17 Å²	17	67.7 Å²	67.7	6%	0.064	33%	0.325	C	S	.	.	H	α-helix	trans	-57.2	-45.8	175.8	-75.7	178.6	68.5	-127.4	-3.9	111.3	E1036 L1037 H1040 T1047 Y1048 T1053 C1054 M1055 T1084 D1087	E1036-R1051 VanDerWaalsContact O-CG 3.25Å; E1036-R1051 WeakPolarHBondContact O-CG 3.38Å; L1037-R1051 HydrophobicContact CD2-CB 4.28Å; L1037-R1051 HydrophobicContact CD2-CG 4.4Å; H1040-R1051 PolarHBondContact CE1-NH2 3.23Å; H1040-R1051 PolarHBondContact NE2-NH2 3.19Å; T1047-R1051 WeakPolarHBondContact O-CB 3.48Å; T1047-R1051 WeakPolarHBondContact O-CG 3.27Å; T1047-R1051 PolarHBondContact O-N 2.74Å; Y1048-R1051 PolarHBondContact O-N 3.38Å; R1051-T1053 VanDerWaalsContact C-N 3.34Å; R1051-T1053 PolarHBondContact O-N 2.85Å; R1051-C1054 PolarHBondContact O-N 2.8Å; R1051-M1055 HydrophobicContact CB-CE 4.24Å; R1051-M1055 WeakPolarHBondContact O-CG 3.3Å; R1051-M1055 PolarHBondContact O-N 3.28Å; R1051-T1084 PolarHBondContact NH2-OG1 3.11Å; R1051-D1087 IonicContact CZ-OD2 2.73Å; R1051-D1087 VanDerWaalsContact CZ-OD2 3.24Å; R1051-D1087 IonicContact NH1-OD1 3.45Å; R1051-D1087 IonicContact NH1-OD2 2.72Å; R1051-D1087 PolarHBondContact NH1-OD2 3.18Å; R1051-D1087 IonicContact NH2-OD1 3.8Å; R1051-D1087 IonicContact NH2-OD2 3.68Å; R1051-D1087 PolarHBondContact NH2-OD2 3.4Å
1052	K	84.6	Confident	76.5	Confident	35 Å²	35	61.1 Å²	61.1	15%	0.152	29%	0.29	C	S	.	.	H	α-helix	trans	-59.2	-42.4	174.7	-168.8	178.3	-173.9	176.3	0	112.5	K1010 Y1048 Q1050 L1056 E1091 L1095	K1010-K1052 HydrophobicContact CD-CD 4.39Å; Y1048-K1052 HydrophobicContact CE1-CD 4.43Å; Y1048-K1052 WeakPolarHBondContact O-CB 3.48Å; Y1048-K1052 PolarHBondContact O-N 2.98Å; Q1050-K1052 VanDerWaalsContact C-N 3.35Å; Q1050-K1052 PolarHBondContact O-N 3.33Å; K1052-L1056 WeakPolarHBondContact O-CG 3.41Å; K1052-L1056 PolarHBondContact O-N 2.74Å; K1052-E1091 IonicContact NZ-OE1 2.96Å; K1052-E1091 PolarHBondContact NZ-OE1 2.88Å; K1052-E1091 IonicContact NZ-OE2 2.74Å; K1052-E1091 PolarHBondContact NZ-OE2 3.05Å; K1052-L1095 HydrophobicContact CB-CD2 4.45Å; K1052-L1095 HydrophobicContact CG-CD2 3.63Å
1053	T	84.5	Confident	78.3	Confident	24 Å²	24	63 Å²	63	15%	0.147	29%	0.292	C	S	.	.	H	α-helix	trans	-67	-40.5	177.6	-59.9	0	0	0	0	111.4	I1013 E1049 Q1050 R1051 L1056 K1057	I1013-T1053 HydrophobicContact CD1-CG2 3.78Å; I1013-T1053 HydrophobicContact CG1-CG2 4.23Å; E1049-T1053 VanDerWaalsContact O-CB 3.25Å; E1049-T1053 WeakPolarHBondContact O-CB 3.37Å; E1049-T1053 PolarHBondContact O-N 3.45Å; E1049-T1053 PolarHBondContact O-OG1 2.9Å; Q1050-T1053 CarbonylContact O-C 3.58Å; Q1050-T1053 WeakPolarHBondContact O-CB 3.3Å; Q1050-T1053 PolarHBondContact O-N 3.43Å; Q1050-T1053 VanDerWaalsContact O-N 3.09Å; R1051-T1053 VanDerWaalsContact C-N 3.34Å; R1051-T1053 PolarHBondContact O-N 2.85Å; T1053-L1056 PolarHBondContact O-N 3.19Å; T1053-K1057 WeakPolarHBondContact O-CG 3.46Å; T1053-K1057 PolarHBondContact O-N 3Å
1054	C	86.2	Confident	79.8	Confident	4 Å²	4	56 Å²	56	3%	0.027	27%	0.273	C	S	.	.	H	α-helix	trans	-68	-37.4	177.9	-71.7	0	0	0	0	112.8	I1033 L1037 Q1050 R1051 L1056 K1057 L1058	I1033-C1054 HydrophobicContact CG2-CB 4.43Å; L1037-C1054 HydrophobicContact CD2-CB 3.93Å; L1037-C1054 HydrophobicContact CG-CB 4Å; Q1050-C1054 PolarHBondContact O-N 3.28Å; Q1050-C1054 PolarHBondContact O-SG 2.87Å; R1051-C1054 PolarHBondContact O-N 2.8Å; C1054-L1056 VanDerWaalsContact C-N 3.32Å; C1054-L1056 PolarHBondContact O-N 3.21Å; C1054-K1057 WeakPolarHBondContact O-CB 3.26Å; C1054-K1057 PolarHBondContact O-N 3.16Å; C1054-L1058 VanDerWaalsContact O-CB 3.32Å; C1054-L1058 WeakPolarHBondContact O-CB 3.27Å; C1054-L1058 PolarHBondContact O-N 3.45Å
1055	M	88.2	Confident	80.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62	-38	170.2	-68.4	173.5	-151.3	0	0	112.5	L1037 R1051 L1058 I1059 T1084 T1092 L1095 A1096 V1099	L1037-M1055 HydrophobicContact CD2-CE 3.8Å; L1037-M1055 HydrophobicContact CD2-CG 3.82Å; R1051-M1055 HydrophobicContact CB-CE 4.24Å; R1051-M1055 WeakPolarHBondContact O-CG 3.3Å; R1051-M1055 PolarHBondContact O-N 3.28Å; M1055-L1058 PolarHBondContact O-N 3.1Å; M1055-I1059 PolarHBondContact O-N 3.07Å; M1055-T1084 HydrophobicContact CE-CG2 3.71Å; M1055-T1092 HydrophobicContact CE-CG2 3.67Å; M1055-T1092 HydrophobicContact SD-CG2 4.23Å; M1055-L1095 HydrophobicContact CB-CD2 3.66Å; M1055-L1095 HydrophobicContact CB-CG 3.83Å; M1055-L1095 HydrophobicContact CG-CD2 4.45Å; M1055-L1095 HydrophobicContact SD-CB 4.25Å; M1055-L1095 HydrophobicContact SD-CD2 4.02Å; M1055-L1095 HydrophobicContact SD-CG 4.02Å; M1055-A1096 HydrophobicContact SD-CB 4.44Å; M1055-V1099 HydrophobicContact CB-CG2 3.69Å; M1055-V1099 HydrophobicContact CG-CG2 4Å
1056	L	88.7	Confident	81.6	Confident	93 Å²	93	50.1 Å²	50.1	49%	0.487	26%	0.258	S	S	.	.	H	α-helix	trans	-70.8	-36	174.6	-70	169.9	0	0	0	112.8	K1052 T1053 C1054 L1058 K1060 L1095	K1052-L1056 WeakPolarHBondContact O-CG 3.41Å; K1052-L1056 PolarHBondContact O-N 2.74Å; T1053-L1056 PolarHBondContact O-N 3.19Å; C1054-L1056 VanDerWaalsContact C-N 3.32Å; C1054-L1056 PolarHBondContact O-N 3.21Å; L1056-L1058 VanDerWaalsContact C-N 3.33Å; L1056-K1060 PolarHBondContact O-N 3.01Å; L1056-L1095 HydrophobicContact CD2-CD1 3.95Å; L1056-L1095 HydrophobicContact CG-CD1 4.44Å; L1056-L1095 HydrophobicContact CG-CD2 4.2Å
1057	K	85.2	Confident	82.2	Confident	41 Å²	41	45.8 Å²	45.8	18%	0.178	23%	0.231	C	C	.	.	H	α-helix	trans	-57.7	-47.8	167.5	-68.5	176.8	-174.4	167.7	0	109.9	E1032 I1033 T1053 C1054 K1060 L1061	E1032-K1057 IonicContact OE1-NZ 3.22Å; E1032-K1057 PolarHBondContact OE1-NZ 2.99Å; I1033-K1057 HydrophobicContact CD1-CB 3.79Å; I1033-K1057 HydrophobicContact CD1-CD 3.98Å; I1033-K1057 HydrophobicContact CG1-CB 4.46Å; I1033-K1057 HydrophobicContact CG1-CD 3.95Å; T1053-K1057 WeakPolarHBondContact O-CG 3.46Å; T1053-K1057 PolarHBondContact O-N 3Å; C1054-K1057 WeakPolarHBondContact O-CB 3.26Å; C1054-K1057 PolarHBondContact O-N 3.16Å; K1057-K1060 WeakPolarHBondContact O-CA 3.36Å; K1057-K1060 WeakPolarHBondContact O-CB 3.32Å; K1057-K1060 PolarHBondContact O-N 2.73Å; K1057-K1060 VanDerWaalsContact O-N 3.13Å; K1057-L1061 WeakPolarHBondContact O-CG 3.3Å; K1057-L1061 PolarHBondContact O-N 2.96Å
1058	L	88	Confident	82.4	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-67.1	-44.4	-174	-173.2	55.2	0	0	0	113	M1030 I1033 L1037 C1054 M1055 L1056 K1060 L1061 L1062 W1070 T1077 V1099	M1030-L1058 HydrophobicContact CE-CD1 3.87Å; M1030-L1058 HydrophobicContact SD-CD1 3.91Å; I1033-L1058 HydrophobicContact CG2-CB 4.45Å; I1033-L1058 HydrophobicContact CG2-CD2 4.39Å; L1037-L1058 HydrophobicContact CD1-CD2 4.19Å; C1054-L1058 VanDerWaalsContact O-CB 3.32Å; C1054-L1058 WeakPolarHBondContact O-CB 3.27Å; C1054-L1058 PolarHBondContact O-N 3.45Å; M1055-L1058 PolarHBondContact O-N 3.1Å; L1056-L1058 VanDerWaalsContact C-N 3.33Å; L1058-K1060 PolarHBondContact O-N 2.97Å; L1058-L1061 PolarHBondContact O-N 3.03Å; L1058-L1062 HydrophobicContact CG-CD1 4.39Å; L1058-L1062 WeakPolarHBondContact O-CB 3.39Å; L1058-L1062 WeakPolarHBondContact O-CG 3.46Å; L1058-L1062 PolarHBondContact O-N 3.26Å; L1058-W1070 HydrophobicContact CD1-CH2 3.98Å; L1058-T1077 HydrophobicContact CD2-CG2 3.85Å; L1058-V1099 HydrophobicContact CB-CG1 4.45Å; L1058-V1099 HydrophobicContact CD2-CG1 3.7Å; L1058-V1099 HydrophobicContact CG-CG1 3.89Å
1059	I	87.9	Confident	82.7	Confident	19 Å²	19	50.8 Å²	50.8	10%	0.097	27%	0.269	C	S	.	.	H	α-helix	trans	-53.9	-39.9	169.7	-79.4	161.6	0	0	0	111.3	M1055 R1063 L1095 R1098 V1099 E1102	M1055-I1059 PolarHBondContact O-N 3.07Å; I1059-R1063 WeakPolarHBondContact O-CG 3.34Å; I1059-R1063 PolarHBondContact O-N 3.11Å; I1059-R1063 VanDerWaalsContact O-N 3.16Å; I1059-L1095 HydrophobicContact CD1-CD1 3.79Å; I1059-R1098 HydrophobicContact CD1-CB 4.16Å; I1059-V1099 HydrophobicContact CD1-CG2 3.86Å; I1059-V1099 HydrophobicContact CG1-CB 4.27Å; I1059-V1099 HydrophobicContact CG1-CG2 3.91Å; I1059-E1102 HydrophobicContact CG1-CG 4.33Å; I1059-E1102 HydrophobicContact CG2-CG 4.25Å
1060	K	86.8	Confident	83	Confident	123 Å²	123	49.6 Å²	49.6	54%	0.535	26%	0.263	S	S	.	.	H	α-helix	trans	-71	-45.9	177.9	-173.7	-175.9	167	-170.2	0	111.9	L1056 K1057 L1058 L1062 R1063 D1064	L1056-K1060 PolarHBondContact O-N 3.01Å; K1057-K1060 WeakPolarHBondContact O-CA 3.36Å; K1057-K1060 WeakPolarHBondContact O-CB 3.32Å; K1057-K1060 PolarHBondContact O-N 2.73Å; K1057-K1060 VanDerWaalsContact O-N 3.13Å; L1058-K1060 PolarHBondContact O-N 2.97Å; K1060-L1062 VanDerWaalsContact C-N 3.26Å; K1060-L1062 PolarHBondContact O-N 3.38Å; K1060-R1063 PolarHBondContact O-N 3.29Å; K1060-D1064 WeakPolarHBondContact CE-OD2 3.07Å; K1060-D1064 IonicContact NZ-OD2 2.87Å; K1060-D1064 VanDerWaalsContact O-CB 3.31Å; K1060-D1064 WeakPolarHBondContact O-CB 3.11Å; K1060-D1064 PolarHBondContact O-N 3.1Å
1061	L	85.7	Confident	82.9	Confident	25 Å²	25	52.5 Å²	52.5	13%	0.131	28%	0.281	C	S	.	.	H	α-helix	trans	-60.5	-36	178.4	-70.4	169.5	0	0	0	112.4	I1029 I1033 K1057 L1058 G1065 V1066 I1067	I1029-L1061 HydrophobicContact CG2-CD1 4.05Å; I1033-L1061 HydrophobicContact CD1-CD1 3.49Å; I1033-L1061 VanDerWaalsContact CD1-CD1 3.49Å; K1057-L1061 WeakPolarHBondContact O-CG 3.3Å; K1057-L1061 PolarHBondContact O-N 2.96Å; L1058-L1061 PolarHBondContact O-N 3.03Å; L1061-G1065 PolarHBondContact O-N 3.07Å; L1061-G1065 VanDerWaalsContact O-N 3.12Å; L1061-V1066 HydrophobicContact CD2-CB 4.02Å; L1061-V1066 HydrophobicContact CD2-CG1 4.27Å; L1061-V1066 HydrophobicContact CD2-CG2 4.18Å; L1061-V1066 PolarHBondContact O-N 3.38Å; L1061-I1067 HydrophobicContact CB-CD1 4.37Å; L1061-I1067 HydrophobicContact CD1-CD1 4.36Å
1062	L	85.9	Confident	82.9	Confident	12 Å²	12	58.6 Å²	58.6	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-48.8	172.5	-78.4	164.5	0	0	0	112.3	L1058 K1060 G1065 W1070 V1099 E1102 L1103 A1106	L1058-L1062 HydrophobicContact CG-CD1 4.39Å; L1058-L1062 WeakPolarHBondContact O-CB 3.39Å; L1058-L1062 WeakPolarHBondContact O-CG 3.46Å; L1058-L1062 PolarHBondContact O-N 3.26Å; K1060-L1062 VanDerWaalsContact C-N 3.26Å; K1060-L1062 PolarHBondContact O-N 3.38Å; L1062-G1065 PolarHBondContact O-N 3.34Å; L1062-W1070 HydrophobicContact CD2-CH2 3.68Å; L1062-W1070 HydrophobicContact CD2-CZ2 3.34Å; L1062-W1070 HydrophobicContact CG-CH2 4.13Å; L1062-W1070 HydrophobicContact CG-CZ2 3.99Å; L1062-V1099 HydrophobicContact CD1-CG1 4.3Å; L1062-E1102 HydrophobicContact CD1-CB 4.41Å; L1062-L1103 HydrophobicContact CD1-CB 3.99Å; L1062-L1103 HydrophobicContact CD1-CD1 4.25Å; L1062-L1103 HydrophobicContact CD2-CD1 3.59Å; L1062-A1106 HydrophobicContact CD2-CB 4.29Å
1063	R	86.9	Confident	82.8	Confident	161 Å²	161	58 Å²	58	61%	0.608	31%	0.307	S	S	*	.	H	α-helix	trans	-70.5	-33.2	179.5	-73.1	175.7	172.9	-179.6	0.9	113.9	I1059 K1060 G1065 E1102	I1059-R1063 WeakPolarHBondContact O-CG 3.34Å; I1059-R1063 PolarHBondContact O-N 3.11Å; I1059-R1063 VanDerWaalsContact O-N 3.16Å; K1060-R1063 PolarHBondContact O-N 3.29Å; R1063-G1065 VanDerWaalsContact C-N 3.29Å; R1063-E1102 IonicContact CZ-OE1 2.69Å; R1063-E1102 IonicContact CZ-OE2 3.91Å; R1063-E1102 IonicContact NE-OE1 3.54Å; R1063-E1102 IonicContact NE-OE2 3.26Å; R1063-E1102 PolarHBondContact NE-OE2 2.8Å; R1063-E1102 IonicContact NH2-OE1 3.45Å; R1063-E1102 PolarHBondContact NH2-OE1 3.03Å; R1063-E1102 IonicContact NH2-OE2 2.88Å; R1063-E1102 PolarHBondContact NH2-OE2 3.41Å
1064	D	82.8	Confident	82.9	Confident	98 Å²	98	57.1 Å²	57.1	52%	0.524	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-9	177	-72.7	-1.2	0	0	0	112	K1060 V1066	K1060-D1064 WeakPolarHBondContact CE-OD2 3.07Å; K1060-D1064 IonicContact NZ-OD2 2.87Å; K1060-D1064 VanDerWaalsContact O-CB 3.31Å; K1060-D1064 WeakPolarHBondContact O-CB 3.11Å; K1060-D1064 PolarHBondContact O-N 3.1Å; D1064-V1066 VanDerWaalsContact C-N 3.35Å; D1064-V1066 HydrophobicContact CB-CG2 3.66Å; D1064-V1066 PolarHBondContact O-N 3.35Å
1065	G	79.9	Confident	82.8	Confident	60 Å²	60	62.1 Å²	62.1	62%	0.619	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	25.7	175.1	0	0	0	0	0	115.3	L1061 L1062 R1063	L1061-G1065 PolarHBondContact O-N 3.07Å; L1061-G1065 VanDerWaalsContact O-N 3.12Å; L1062-G1065 PolarHBondContact O-N 3.34Å; R1063-G1065 VanDerWaalsContact C-N 3.29Å
1066	V	77.6	Confident	82.5	Confident	64 Å²	64	64.7 Å²	64.7	39%	0.388	34%	0.339	S	S	.	.			trans	-76.7	-31.9	-164.3	-177.9	0	0	0	0	113.7	P1026 L1061 D1064	P1026-V1066 HydrophobicContact CB-CG1 4.33Å; P1026-V1066 HydrophobicContact CG-CG1 4.12Å; L1061-V1066 HydrophobicContact CD2-CB 4.02Å; L1061-V1066 HydrophobicContact CD2-CG1 4.27Å; L1061-V1066 HydrophobicContact CD2-CG2 4.18Å; L1061-V1066 PolarHBondContact O-N 3.38Å; D1064-V1066 VanDerWaalsContact C-N 3.35Å; D1064-V1066 HydrophobicContact CB-CG2 3.66Å; D1064-V1066 PolarHBondContact O-N 3.35Å
1067	I	73.5	Confident	82.4	Confident	9 Å²	9	60.3 Å²	60.3	5%	0.046	32%	0.316	C	S	.	.			trans	-92	117.6	-177.2	-61.6	166.8	0	0	0	108.7	M1030 L1061 W1070 Y1073	M1030-I1067 HydrophobicContact CB-CD1 4.16Å; M1030-I1067 HydrophobicContact CG-CD1 4Å; M1030-I1067 HydrophobicContact SD-CD1 3.62Å; L1061-I1067 HydrophobicContact CB-CD1 4.37Å; L1061-I1067 HydrophobicContact CD1-CD1 4.36Å; I1067-W1070 HydrophobicContact CB-CZ2 4.1Å; I1067-W1070 HydrophobicContact CD1-CH2 4.23Å; I1067-W1070 HydrophobicContact CD1-CZ2 3.86Å; I1067-W1070 HydrophobicContact CG2-CD2 4.2Å; I1067-W1070 HydrophobicContact CG2-CG 4.23Å; I1067-W1070 HydrophobicContact CG2-CZ2 4.35Å; I1067-W1070 PolarHBondContact O-NE1 3.48Å; I1067-Y1073 HydrophobicContact CG2-CD2 4.22Å
1068	S	71.8	Confident	82.5	Confident	92 Å²	92	58.4 Å²	58.4	64%	0.643	31%	0.308	S	S	*	.			trans	-83.7	-38.9	172.4	53.5	0	0	0	0	112.4	W1070	S1068-W1070 VanDerWaalsContact C-N 3.3Å; S1068-W1070 PolarHBondContact O-N 2.86Å
1069	N	76.1	Confident	82.2	Confident	78 Å²	78	59.9 Å²	59.9	42%	0.417	32%	0.316	S	S	.	.			trans	-92.3	51.1	-162	-60.1	-10.2	0	0	0	112.2	E1027 D1071 Y1073	E1027-N1069 PolarHBondContact OE1-ND2 2.6Å; N1069-D1071 PolarHBondContact O-N 2.86Å; N1069-Y1073 WeakPolarHBondContact O-CD2 3.36Å
1070	W	83.5	Confident	82	Confident	12 Å²	12	60.1 Å²	60.1	5%	0.045	32%	0.317	C	S	.	.	H	α-helix	trans	-63.7	-22.2	-173.8	-83.9	96.3	0	0	0	114.8	M1030 L1058 L1062 I1067 S1068 E1072 Y1073 F1074 T1077 L1103 L1110	M1030-W1070 HydrophobicContact CE-CH2 4.09Å; M1030-W1070 HydrophobicContact CE-CZ3 3.95Å; L1058-W1070 HydrophobicContact CD1-CH2 3.98Å; L1062-W1070 HydrophobicContact CD2-CH2 3.68Å; L1062-W1070 HydrophobicContact CD2-CZ2 3.34Å; L1062-W1070 HydrophobicContact CG-CH2 4.13Å; L1062-W1070 HydrophobicContact CG-CZ2 3.99Å; I1067-W1070 HydrophobicContact CB-CZ2 4.1Å; I1067-W1070 HydrophobicContact CD1-CH2 4.23Å; I1067-W1070 HydrophobicContact CD1-CZ2 3.86Å; I1067-W1070 HydrophobicContact CG2-CD2 4.2Å; I1067-W1070 HydrophobicContact CG2-CG 4.23Å; I1067-W1070 HydrophobicContact CG2-CZ2 4.35Å; I1067-W1070 PolarHBondContact O-NE1 3.48Å; S1068-W1070 VanDerWaalsContact C-N 3.3Å; S1068-W1070 PolarHBondContact O-N 2.86Å; W1070-E1072 PolarHBondContact O-N 2.91Å; W1070-Y1073 PolarHBondContact O-N 2.8Å; W1070-F1074 HydrophobicContact CE3-CB 4.39Å; W1070-F1074 WeakPolarHBondContact O-CA 3.23Å; W1070-F1074 WeakPolarHBondContact O-CB 3.43Å; W1070-F1074 PolarHBondContact O-N 3.48Å; W1070-T1077 HydrophobicContact CZ3-CG2 4.43Å; W1070-L1103 HydrophobicContact CE3-CD1 4.31Å; W1070-L1103 HydrophobicContact CH2-CD1 4.19Å; W1070-L1103 HydrophobicContact CZ3-CD1 3.98Å; W1070-L1110 HydrophobicContact CB-CD1 3.66Å; W1070-L1110 HydrophobicContact CG-CD1 4.21Å
1071	D	77.1	Confident	82.1	Confident	136 Å²	136	54.3 Å²	54.3	73%	0.727	29%	0.292	S	S	*	.	H	α-helix	trans	-58.7	-32.1	-177	-60.7	-53.1	0	0	0	113.6	N1069	N1069-D1071 PolarHBondContact O-N 2.86Å
1072	E	79.7	Confident	82.1	Confident	145 Å²	145	53.8 Å²	53.8	68%	0.678	29%	0.289	S	S	*	.	H	α-helix	trans	-82.3	-43.1	178	-171.4	160.3	-148.9	0	0	111.9	W1070 P1076	W1070-E1072 PolarHBondContact O-N 2.91Å; E1072-P1076 WeakPolarHBondContact O-CD 3.34Å
1073	Y	83	Confident	81.9	Confident	22 Å²	22	57.2 Å²	57.2	9%	0.086	31%	0.305	C	S	.	.	H	α-helix	trans	-85.3	-23.8	-175.1	-57.4	-65.7	0	0	0	114.9	E1027 M1030 L1034 I1067 N1069 W1070 K1075 P1076 T1077	E1027-Y1073 WeakPolarHBondContact CA-OH 3.37Å; E1027-Y1073 VanDerWaalsContact CB-OH 3.3Å; E1027-Y1073 WeakPolarHBondContact CB-OH 3.48Å; M1030-Y1073 HydrophobicContact CB-CD1 4.11Å; M1030-Y1073 HydrophobicContact CB-CD2 4.44Å; M1030-Y1073 HydrophobicContact CB-CE1 4.06Å; M1030-Y1073 HydrophobicContact CB-CE2 4.42Å; M1030-Y1073 HydrophobicContact CB-CG 4.3Å; M1030-Y1073 HydrophobicContact CG-CD1 3.52Å; M1030-Y1073 HydrophobicContact CG-CD2 3.97Å; M1030-Y1073 HydrophobicContact CG-CE1 4.01Å; M1030-Y1073 HydrophobicContact CG-CE2 4.42Å; M1030-Y1073 HydrophobicContact CG-CG 3.5Å; L1034-Y1073 HydrophobicContact CD1-CD1 3.74Å; I1067-Y1073 HydrophobicContact CG2-CD2 4.22Å; N1069-Y1073 WeakPolarHBondContact O-CD2 3.36Å; W1070-Y1073 PolarHBondContact O-N 2.8Å; Y1073-K1075 PolarHBondContact O-N 2.93Å; Y1073-P1076 WeakPolarHBondContact O-CD 3.48Å; Y1073-T1077 VanDerWaalsContact O-CB 3.32Å; Y1073-T1077 WeakPolarHBondContact O-CB 3.21Å; Y1073-T1077 PolarHBondContact O-N 2.89Å; Y1073-T1077 PolarHBondContact O-OG1 3.47Å
1074	F	86.8	Confident	81.8	Confident	5 Å²	5	49.6 Å²	49.6	2%	0.022	28%	0.276	C	S	.	.	H	α-helix	trans	-62.4	-45.8	-170	172.8	-102.3	0	0	0	112.9	W1070 T1077 L1078 L1103 L1110 F1111 F1114	W1070-F1074 HydrophobicContact CE3-CB 4.39Å; W1070-F1074 WeakPolarHBondContact O-CA 3.23Å; W1070-F1074 WeakPolarHBondContact O-CB 3.43Å; W1070-F1074 PolarHBondContact O-N 3.48Å; F1074-T1077 PolarHBondContact O-N 2.91Å; F1074-L1078 HydrophobicContact CE1-CD2 3.96Å; F1074-L1078 HydrophobicContact CZ-CB 4.42Å; F1074-L1078 HydrophobicContact CZ-CD2 3.77Å; F1074-L1078 WeakPolarHBondContact O-CB 3.47Å; F1074-L1078 PolarHBondContact O-N 3.17Å; F1074-L1103 HydrophobicContact CD2-CD1 4.37Å; F1074-L1103 HydrophobicContact CD2-CD2 4.25Å; F1074-L1103 HydrophobicContact CE2-CD2 3.99Å; F1074-L1103 HydrophobicContact CE2-CG 4.31Å; F1074-L1110 HydrophobicContact CB-CD1 4.03Å; F1074-L1110 HydrophobicContact CD1-CB 3.94Å; F1074-L1110 HydrophobicContact CD2-CB 3.71Å; F1074-L1110 HydrophobicContact CD2-CD1 3.56Å; F1074-L1110 HydrophobicContact CD2-CG 4.28Å; F1074-L1110 HydrophobicContact CE1-CB 3.79Å; F1074-L1110 WeakPolarHBondContact CE1-O 3.39Å; F1074-L1110 HydrophobicContact CE2-CB 3.54Å; F1074-L1110 HydrophobicContact CE2-CD1 4.16Å; F1074-L1110 HydrophobicContact CG-CB 3.9Å; F1074-L1110 HydrophobicContact CG-CD1 3.83Å; F1074-L1110 HydrophobicContact CG-CG 4.41Å; F1074-L1110 HydrophobicContact CZ-CB 3.58Å; F1074-L1110 WeakPolarHBondContact CZ-O 3.44Å; F1074-F1111 HydrophobicContact CE2-CD2 4.19Å; F1074-F1111 HydrophobicContact CE2-CE1 4.45Å; F1074-F1111 AromaticContact CE2-CE2 3.88Å; F1074-F1111 HydrophobicContact CE2-CE2 3.88Å; F1074-F1111 HydrophobicContact CE2-CZ 4.05Å; F1074-F1111 HydrophobicContact CZ-CD1 4.27Å; F1074-F1111 HydrophobicContact CZ-CD2 4.19Å; F1074-F1111 HydrophobicContact CZ-CE1 4.38Å; F1074-F1111 HydrophobicContact CZ-CE2 4.28Å; F1074-F1111 HydrophobicContact CZ-CG 4.2Å; F1074-F1111 HydrophobicContact CZ-CZ 4.39Å; F1074-F1114 AromaticContact CE1-CD2 3.79Å; F1074-F1114 HydrophobicContact CE1-CD2 3.79Å; F1074-F1114 HydrophobicContact CE1-CE2 4.01Å
1075	K	82.7	Confident	82	Confident	109 Å²	109	46.1 Å²	46.1	47%	0.474	26%	0.257	S	S	.	.	H	α-helix	trans	-63.9	-52.9	-178.2	-63.5	-176.1	-177.3	-174.8	0	111.4	Y1073 T1077 L1078 L1079 F1114	Y1073-K1075 PolarHBondContact O-N 2.93Å; K1075-T1077 VanDerWaalsContact C-N 3.32Å; K1075-T1077 PolarHBondContact O-N 3.05Å; K1075-L1078 PolarHBondContact O-N 3.49Å; K1075-L1079 VanDerWaalsContact O-CG 3.24Å; K1075-L1079 WeakPolarHBondContact O-CG 3.49Å; K1075-L1079 PolarHBondContact O-N 3.36Å; K1075-L1079 VanDerWaalsContact O-N 3.09Å; K1075-F1114 HydrophobicContact CD-CE2 4.42Å; K1075-F1114 HydrophobicContact CD-CZ 3.92Å; K1075-F1114 HydrophobicContact CG-CE2 4.18Å; K1075-F1114 HydrophobicContact CG-CZ 3.85Å
1076	P	83.3	Confident	82	Confident	54 Å²	54	46.4 Å²	46.4	35%	0.351	26%	0.261	S	S	.	.	H	α-helix	trans	-52.5	-46.6	170.8	-27.7	34.9	0	0	0	113.3	L1034 E1072 Y1073 L1078 L1079 I1080	L1034-P1076 HydrophobicContact CD1-CB 4.11Å; L1034-P1076 HydrophobicContact CD2-CB 3.99Å; E1072-P1076 WeakPolarHBondContact O-CD 3.34Å; Y1073-P1076 WeakPolarHBondContact O-CD 3.48Å; P1076-L1078 PolarHBondContact O-N 3.11Å; P1076-L1079 PolarHBondContact O-N 2.97Å; P1076-I1080 WeakPolarHBondContact O-CB 3.32Å; P1076-I1080 WeakPolarHBondContact O-CD1 3.33Å; P1076-I1080 WeakPolarHBondContact O-CG1 3.43Å; P1076-I1080 PolarHBondContact O-N 3.38Å; P1076-I1080 VanDerWaalsContact O-N 3.1Å
1077	T	86.3	Confident	82.1	Confident	2 Å²	2	45 Å²	45	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-58.8	-49.6	-179.4	-55.1	0	0	0	0	112	M1030 L1058 W1070 Y1073 F1074 K1075 L1081 L1103	M1030-T1077 HydrophobicContact CE-CG2 4.25Å; M1030-T1077 WeakPolarHBondContact CE-OG1 3.43Å; L1058-T1077 HydrophobicContact CD2-CG2 3.85Å; W1070-T1077 HydrophobicContact CZ3-CG2 4.43Å; Y1073-T1077 VanDerWaalsContact O-CB 3.32Å; Y1073-T1077 WeakPolarHBondContact O-CB 3.21Å; Y1073-T1077 PolarHBondContact O-N 2.89Å; Y1073-T1077 PolarHBondContact O-OG1 3.47Å; F1074-T1077 PolarHBondContact O-N 2.91Å; K1075-T1077 VanDerWaalsContact C-N 3.32Å; K1075-T1077 PolarHBondContact O-N 3.05Å; T1077-L1081 HydrophobicContact CG2-CD1 3.76Å; T1077-L1081 HydrophobicContact CG2-CG 4.46Å; T1077-L1081 WeakPolarHBondContact O-CB 3.46Å; T1077-L1081 WeakPolarHBondContact O-CG 3.48Å; T1077-L1081 PolarHBondContact O-N 3.01Å; T1077-L1103 HydrophobicContact CG2-CD2 4.49Å
1078	L	87.2	Confident	82.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65	-46.4	-176.9	179.1	63.1	0	0	0	111.3	F1074 K1075 P1076 L1081 L1082 L1100 F1111 F1114	F1074-L1078 HydrophobicContact CE1-CD2 3.96Å; F1074-L1078 HydrophobicContact CZ-CB 4.42Å; F1074-L1078 HydrophobicContact CZ-CD2 3.77Å; F1074-L1078 WeakPolarHBondContact O-CB 3.47Å; F1074-L1078 PolarHBondContact O-N 3.17Å; K1075-L1078 PolarHBondContact O-N 3.49Å; P1076-L1078 PolarHBondContact O-N 3.11Å; L1078-L1081 PolarHBondContact O-N 2.86Å; L1078-L1082 HydrophobicContact CD1-CD1 3.9Å; L1078-L1082 HydrophobicContact CD1-CG 4.05Å; L1078-L1082 HydrophobicContact CG-CD1 3.91Å; L1078-L1082 HydrophobicContact CG-CG 4.39Å; L1078-L1082 WeakPolarHBondContact O-CB 3.45Å; L1078-L1082 VanDerWaalsContact O-CG 3.26Å; L1078-L1082 WeakPolarHBondContact O-CG 3.43Å; L1078-L1082 PolarHBondContact O-N 2.98Å; L1078-L1100 HydrophobicContact CD1-CD2 3.7Å; L1078-F1111 HydrophobicContact CD1-CE1 3.88Å; L1078-F1114 HydrophobicContact CD2-CB 3.61Å; L1078-F1114 HydrophobicContact CD2-CD1 3.84Å; L1078-F1114 HydrophobicContact CD2-CD2 4.19Å; L1078-F1114 HydrophobicContact CD2-CG 3.61Å
1079	L	82.5	Confident	82.9	Confident	32 Å²	32	49.1 Å²	49.1	17%	0.168	27%	0.271	C	S	.	.	H	α-helix	trans	-63.3	-47.2	-177.6	-62.1	176.3	0	0	0	111	L890 L893 K1075 P1076 L1081 L1082 E1083	L890-L1079 HydrophobicContact CD2-CB 3.67Å; L890-L1079 HydrophobicContact CD2-CD1 4.22Å; L890-L1079 HydrophobicContact CD2-CD2 3.59Å; L890-L1079 HydrophobicContact CD2-CG 3.97Å; L890-L1079 HydrophobicContact CG-CD2 4.21Å; L893-L1079 HydrophobicContact CD1-CD1 3.99Å; K1075-L1079 VanDerWaalsContact O-CG 3.24Å; K1075-L1079 WeakPolarHBondContact O-CG 3.49Å; K1075-L1079 PolarHBondContact O-N 3.36Å; K1075-L1079 VanDerWaalsContact O-N 3.09Å; P1076-L1079 PolarHBondContact O-N 2.97Å; L1079-L1081 VanDerWaalsContact C-N 3.35Å; L1079-L1081 PolarHBondContact O-N 2.99Å; L1079-L1082 PolarHBondContact O-N 3.1Å; L1079-E1083 WeakPolarHBondContact O-CB 3.45Å; L1079-E1083 PolarHBondContact O-N 2.83Å
1080	I	83.2	Confident	83.5	Confident	24 Å²	24	49.3 Å²	49.3	12%	0.123	27%	0.269	C	S	.	.	H	α-helix	trans	-62.6	-39.7	177.7	-65.2	170.3	0	0	0	111.5	L1034 L1037 P1076 T1084	L1034-I1080 HydrophobicContact CD2-CD1 4.09Å; L1037-I1080 HydrophobicContact CB-CG2 3.77Å; L1037-I1080 WeakPolarHBondContact O-CG2 3.45Å; P1076-I1080 WeakPolarHBondContact O-CB 3.32Å; P1076-I1080 WeakPolarHBondContact O-CD1 3.33Å; P1076-I1080 WeakPolarHBondContact O-CG1 3.43Å; P1076-I1080 PolarHBondContact O-N 3.38Å; P1076-I1080 VanDerWaalsContact O-N 3.1Å; I1080-T1084 WeakPolarHBondContact O-CB 3.37Å; I1080-T1084 PolarHBondContact O-N 3.33Å; I1080-T1084 PolarHBondContact O-OG1 3.41Å
1081	L	87.8	Confident	83.7	Confident	1 Å²	1	52 Å²	52	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-69.6	-32.1	176.4	-73.5	172	0	0	0	113.3	T1077 L1078 L1079 A1096 V1099 L1100	T1077-L1081 HydrophobicContact CG2-CD1 3.76Å; T1077-L1081 HydrophobicContact CG2-CG 4.46Å; T1077-L1081 WeakPolarHBondContact O-CB 3.46Å; T1077-L1081 WeakPolarHBondContact O-CG 3.48Å; T1077-L1081 PolarHBondContact O-N 3.01Å; L1078-L1081 PolarHBondContact O-N 2.86Å; L1079-L1081 VanDerWaalsContact C-N 3.35Å; L1079-L1081 PolarHBondContact O-N 2.99Å; L1081-A1096 HydrophobicContact CD2-CB 4.25Å; L1081-V1099 HydrophobicContact CD1-CB 3.99Å; L1081-V1099 HydrophobicContact CD1-CG1 3.5Å; L1081-V1099 VanDerWaalsContact CD1-CG1 3.5Å; L1081-V1099 HydrophobicContact CD2-CB 3.91Å; L1081-V1099 HydrophobicContact CD2-CG1 4.01Å; L1081-V1099 HydrophobicContact CD2-CG2 4.08Å; L1081-V1099 HydrophobicContact CG-CG1 4.42Å; L1081-L1100 HydrophobicContact CB-CD1 4.43Å; L1081-L1100 HydrophobicContact CB-CD2 3.93Å; L1081-L1100 HydrophobicContact CB-CG 4.17Å; L1081-L1100 HydrophobicContact CD1-CD2 3.95Å; L1081-L1100 HydrophobicContact CD1-CG 4.27Å
1082	L	86.3	Confident	84.2	Confident	14 Å²	14	45.6 Å²	45.6	7%	0.073	25%	0.248	C	C	.	.	H	α-helix	trans	-76.6	-35.8	175.8	-70.2	176.5	0	0	0	112.1	L1078 L1079 T1084 L1085 L1100 L1117 F1118 K1121	L1078-L1082 HydrophobicContact CD1-CD1 3.9Å; L1078-L1082 HydrophobicContact CD1-CG 4.05Å; L1078-L1082 HydrophobicContact CG-CD1 3.91Å; L1078-L1082 HydrophobicContact CG-CG 4.39Å; L1078-L1082 WeakPolarHBondContact O-CB 3.45Å; L1078-L1082 VanDerWaalsContact O-CG 3.26Å; L1078-L1082 WeakPolarHBondContact O-CG 3.43Å; L1078-L1082 PolarHBondContact O-N 2.98Å; L1079-L1082 PolarHBondContact O-N 3.1Å; L1082-T1084 VanDerWaalsContact C-N 3.35Å; L1082-L1085 HydrophobicContact CD2-CD1 3.94Å; L1082-L1085 WeakPolarHBondContact O-CB 3.19Å; L1082-L1085 PolarHBondContact O-N 3.22Å; L1082-L1100 HydrophobicContact CD2-CD1 4.11Å; L1082-L1117 HydrophobicContact CD1-CD2 3.62Å; L1082-L1117 HydrophobicContact CD1-CG 4.03Å; L1082-F1118 HydrophobicContact CD2-CD2 4.3Å; L1082-K1121 HydrophobicContact CD2-CB 3.85Å; L1082-K1121 HydrophobicContact CD2-CG 4.14Å
1083	E	82.8	Confident	84.7	Confident	84 Å²	84	40 Å²	40	39%	0.393	22%	0.221	S	C	.	.	H	α-helix	trans	-64.4	-40.7	171.3	-171.1	167.1	-164	0	0	111	L1079 L1085 G1086	L1079-E1083 WeakPolarHBondContact O-CB 3.45Å; L1079-E1083 PolarHBondContact O-N 2.83Å; E1083-L1085 PolarHBondContact O-N 3.23Å; E1083-L1085 VanDerWaalsContact O-N 3.08Å; E1083-G1086 PolarHBondContact O-N 2.94Å
1084	T	84.8	Confident	85.2	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-58	-21.2	172.8	-62.4	0	0	0	0	113.5	H1040 R1051 M1055 I1080 L1082 G1086 D1087 T1092 A1096	H1040-T1084 PolarHBondContact NE2-OG1 3.18Å; R1051-T1084 PolarHBondContact NH2-OG1 3.11Å; M1055-T1084 HydrophobicContact CE-CG2 3.71Å; I1080-T1084 WeakPolarHBondContact O-CB 3.37Å; I1080-T1084 PolarHBondContact O-N 3.33Å; I1080-T1084 PolarHBondContact O-OG1 3.41Å; L1082-T1084 VanDerWaalsContact C-N 3.35Å; T1084-G1086 PolarHBondContact O-N 3.06Å; T1084-D1087 WeakPolarHBondContact O-CB 3.35Å; T1084-D1087 PolarHBondContact O-N 3.05Å; T1084-T1092 HydrophobicContact CG2-CG2 3.64Å; T1084-A1096 HydrophobicContact CG2-CB 3.67Å
1085	L	85.6	Confident	85.4	Confident	25 Å²	25	39.7 Å²	39.7	13%	0.131	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-70.9	-10.5	172.4	-58.6	179.1	0	0	0	113.1	L1082 E1083 R1093 A1096 L1097 L1100 K1121	L1082-L1085 HydrophobicContact CD2-CD1 3.94Å; L1082-L1085 WeakPolarHBondContact O-CB 3.19Å; L1082-L1085 PolarHBondContact O-N 3.22Å; E1083-L1085 PolarHBondContact O-N 3.23Å; E1083-L1085 VanDerWaalsContact O-N 3.08Å; L1085-R1093 WeakPolarHBondContact O-CD 3.4Å; L1085-A1096 HydrophobicContact CD2-CB 3.98Å; L1085-L1097 HydrophobicContact CD1-CD2 4.3Å; L1085-L1097 HydrophobicContact CD2-CD2 3.87Å; L1085-L1097 HydrophobicContact CD2-CG 3.73Å; L1085-L1100 HydrophobicContact CD1-CD1 4.17Å; L1085-K1121 HydrophobicContact CD1-CB 4.03Å
1086	G	79.8	Confident	85.9	Confident	67 Å²	67	34.5 Å²	34.5	69%	0.691	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-87.9	-9.5	170.7	0	0	0	0	0	115	E1083 T1084	E1083-G1086 PolarHBondContact O-N 2.94Å; T1084-G1086 PolarHBondContact O-N 3.06Å
1087	D	81.1	Confident	86.4	Confident	34 Å²	34	31.9 Å²	31.9	18%	0.182	18%	0.183	C	C	.	.			trans	-62	140.8	-177.2	-80.8	-1.7	0	0	0	112.6	H1040 R1051 T1084 G1089 R1093	H1040-D1087 IonicContact CD2-OD1 3.24Å; R1051-D1087 IonicContact CZ-OD2 2.73Å; R1051-D1087 VanDerWaalsContact CZ-OD2 3.24Å; R1051-D1087 IonicContact NH1-OD1 3.45Å; R1051-D1087 IonicContact NH1-OD2 2.72Å; R1051-D1087 PolarHBondContact NH1-OD2 3.18Å; R1051-D1087 IonicContact NH2-OD1 3.8Å; R1051-D1087 IonicContact NH2-OD2 3.68Å; R1051-D1087 PolarHBondContact NH2-OD2 3.4Å; T1084-D1087 WeakPolarHBondContact O-CB 3.35Å; T1084-D1087 PolarHBondContact O-N 3.05Å; D1087-G1089 PolarHBondContact O-N 3.44Å; D1087-G1089 VanDerWaalsContact O-N 3.14Å; D1087-R1093 VanDerWaalsContact O-CD 3.27Å; D1087-R1093 WeakPolarHBondContact O-CD 3.21Å; D1087-R1093 WeakPolarHBondContact O-CG 3.45Å; D1087-R1093 PolarHBondContact O-NH1 3.25Å
1088	D	79.3	Confident	86.8	Confident	165 Å²	165	37.9 Å²	37.9	88%	0.882	21%	0.205	S	C	*	.	S	Bend	trans	-54.8	-32.8	172.2	-66.6	-52.1	0	0	0	112.8	H1090 R1093	D1088-H1090 PolarHBondContact O-N 3.01Å; D1088-R1093 VanDerWaalsContact C-NH1 3.27Å; D1088-R1093 PolarHBondContact O-NH1 3.41Å
1089	G	81.5	Confident	87.1	Confident	22 Å²	22	37.9 Å²	37.9	23%	0.227	21%	0.205	C	C	.	.			trans	-72.2	101.9	-176	0	0	0	0	0	113.9	D1087 E1091 T1092 R1093	D1087-G1089 PolarHBondContact O-N 3.44Å; D1087-G1089 VanDerWaalsContact O-N 3.14Å; G1089-E1091 VanDerWaalsContact C-N 3.28Å; G1089-E1091 PolarHBondContact O-N 3.36Å; G1089-T1092 WeakPolarHBondContact O-CA 3.12Å; G1089-T1092 VanDerWaalsContact O-CB 3.27Å; G1089-T1092 WeakPolarHBondContact O-CB 3.32Å; G1089-T1092 PolarHBondContact O-N 2.86Å; G1089-R1093 PolarHBondContact O-N 3.34Å
1090	H	88.2	Confident	87.6	Confident	83 Å²	83	36.3 Å²	36.3	38%	0.384	20%	0.197	S	C	.	.	H	α-helix	trans	-59.7	-34.1	178.4	70.8	-97.1	0	0	0	113.7	D1088 T1092 A1094 E1130 V1133	D1088-H1090 PolarHBondContact O-N 3.01Å; H1090-T1092 VanDerWaalsContact C-N 3.26Å; H1090-T1092 PolarHBondContact O-N 2.86Å; H1090-A1094 VanDerWaalsContact O-CB 3.25Å; H1090-A1094 WeakPolarHBondContact O-CB 3.46Å; H1090-A1094 PolarHBondContact O-N 3.4Å; H1090-E1130 HydrophobicContact CB-CB 4.07Å; H1090-E1130 HydrophobicContact CB-CG 3.77Å; H1090-V1133 HydrophobicContact CB-CG2 3.97Å; H1090-V1133 WeakPolarHBondContact O-CG2 3.4Å
1091	E	88.9	Confident	88.2	Confident	67 Å²	67	36.4 Å²	36.4	31%	0.313	20%	0.197	S	C	.	.	H	α-helix	trans	-58.8	-39.4	171.7	-106.5	-159.9	162.5	0	0	111	K1010 Y1048 K1052 G1089 L1095	K1010-E1091 IonicContact NZ-OE1 3.31Å; K1010-E1091 PolarHBondContact NZ-OE1 3.33Å; K1010-E1091 IonicContact NZ-OE2 2.69Å; K1010-E1091 PolarHBondContact NZ-OE2 2.99Å; Y1048-E1091 WeakPolarHBondContact OH-CB 3.25Å; Y1048-E1091 PolarHBondContact OH-OE2 3.44Å; K1052-E1091 IonicContact NZ-OE1 2.96Å; K1052-E1091 PolarHBondContact NZ-OE1 2.88Å; K1052-E1091 IonicContact NZ-OE2 2.74Å; K1052-E1091 PolarHBondContact NZ-OE2 3.05Å; G1089-E1091 VanDerWaalsContact C-N 3.28Å; G1089-E1091 PolarHBondContact O-N 3.36Å; E1091-L1095 WeakPolarHBondContact O-CB 3.48Å; E1091-L1095 PolarHBondContact O-N 3.03Å; E1091-L1095 VanDerWaalsContact O-N 3.11Å
1092	T	87.4	Confident	88.4	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.012	20%	0.2	C	C	.	.	H	α-helix	trans	-72.4	-49.3	179.7	-41.9	0	0	0	0	111	Y1048 M1055 T1084 G1089 H1090 A1094 L1095 A1096	Y1048-T1092 WeakPolarHBondContact CE2-OG1 3.44Å; M1055-T1092 HydrophobicContact CE-CG2 3.67Å; M1055-T1092 HydrophobicContact SD-CG2 4.23Å; T1084-T1092 HydrophobicContact CG2-CG2 3.64Å; G1089-T1092 WeakPolarHBondContact O-CA 3.12Å; G1089-T1092 VanDerWaalsContact O-CB 3.27Å; G1089-T1092 WeakPolarHBondContact O-CB 3.32Å; G1089-T1092 PolarHBondContact O-N 2.86Å; H1090-T1092 VanDerWaalsContact C-N 3.26Å; H1090-T1092 PolarHBondContact O-N 2.86Å; T1092-A1094 VanDerWaalsContact C-N 3.35Å; T1092-A1094 PolarHBondContact O-N 3.23Å; T1092-L1095 PolarHBondContact O-N 3.32Å; T1092-A1096 PolarHBondContact O-N 3.27Å
1093	R	89.8	Confident	88.7	Confident	28 Å²	28	36.4 Å²	36.4	11%	0.106	20%	0.196	C	C	.	.	H	α-helix	trans	-56.4	-47.7	175.7	-61.2	-162.1	-59.5	-81.2	6.5	111.6	L1085 D1087 D1088 G1089 L1095 A1096 L1097 D1128 V1133	L1085-R1093 WeakPolarHBondContact O-CD 3.4Å; D1087-R1093 VanDerWaalsContact O-CD 3.27Å; D1087-R1093 WeakPolarHBondContact O-CD 3.21Å; D1087-R1093 WeakPolarHBondContact O-CG 3.45Å; D1087-R1093 PolarHBondContact O-NH1 3.25Å; D1088-R1093 VanDerWaalsContact C-NH1 3.27Å; D1088-R1093 PolarHBondContact O-NH1 3.41Å; G1089-R1093 PolarHBondContact O-N 3.34Å; R1093-L1095 VanDerWaalsContact C-N 3.26Å; R1093-L1095 PolarHBondContact O-N 3.42Å; R1093-A1096 PolarHBondContact O-N 3.34Å; R1093-L1097 WeakPolarHBondContact O-CG 3.35Å; R1093-L1097 PolarHBondContact O-N 3.05Å; R1093-D1128 IonicContact CZ-OD1 3.77Å; R1093-D1128 IonicContact CZ-OD2 2.67Å; R1093-D1128 IonicContact NE-OD2 3.5Å; R1093-D1128 PolarHBondContact NE-OD2 3.45Å; R1093-D1128 VanDerWaalsContact NH2-CG 3.32Å; R1093-D1128 IonicContact NH2-OD1 2.7Å; R1093-D1128 PolarHBondContact NH2-OD1 3.41Å; R1093-D1128 IonicContact NH2-OD2 3.53Å; R1093-D1128 PolarHBondContact NH2-OD2 3.35Å; R1093-V1133 HydrophobicContact CB-CG1 4.14Å; R1093-V1133 HydrophobicContact CB-CG2 4.21Å
1094	A	93.3	Very high	89.1	Confident	9 Å²	9	32.4 Å²	32.4	7%	0.074	18%	0.178	C	C	.	.	H	α-helix	trans	-64.5	-27.5	177	0	0	0	0	0	113.5	H1090 T1092 R1098 V1133 A1136	H1090-A1094 VanDerWaalsContact O-CB 3.25Å; H1090-A1094 WeakPolarHBondContact O-CB 3.46Å; H1090-A1094 PolarHBondContact O-N 3.4Å; T1092-A1094 VanDerWaalsContact C-N 3.35Å; T1092-A1094 PolarHBondContact O-N 3.23Å; A1094-R1098 WeakPolarHBondContact O-CG 3.4Å; A1094-V1133 HydrophobicContact CB-CG2 4.12Å; A1094-A1136 HydrophobicContact CB-CB 4.31Å
1095	L	92.2	Very high	89.5	Confident	11 Å²	11	37.1 Å²	37.1	6%	0.058	20%	0.195	C	C	.	.	H	α-helix	trans	-81	-41.9	175.3	-174.6	59.9	0	0	0	112	K1052 M1055 L1056 I1059 E1091 T1092 R1093 L1097 R1098 V1099	K1052-L1095 HydrophobicContact CB-CD2 4.45Å; K1052-L1095 HydrophobicContact CG-CD2 3.63Å; M1055-L1095 HydrophobicContact CB-CD2 3.66Å; M1055-L1095 HydrophobicContact CB-CG 3.83Å; M1055-L1095 HydrophobicContact CG-CD2 4.45Å; M1055-L1095 HydrophobicContact SD-CB 4.25Å; M1055-L1095 HydrophobicContact SD-CD2 4.02Å; M1055-L1095 HydrophobicContact SD-CG 4.02Å; L1056-L1095 HydrophobicContact CD2-CD1 3.95Å; L1056-L1095 HydrophobicContact CG-CD1 4.44Å; L1056-L1095 HydrophobicContact CG-CD2 4.2Å; I1059-L1095 HydrophobicContact CD1-CD1 3.79Å; E1091-L1095 WeakPolarHBondContact O-CB 3.48Å; E1091-L1095 PolarHBondContact O-N 3.03Å; E1091-L1095 VanDerWaalsContact O-N 3.11Å; T1092-L1095 PolarHBondContact O-N 3.32Å; R1093-L1095 VanDerWaalsContact C-N 3.26Å; R1093-L1095 PolarHBondContact O-N 3.42Å; L1095-L1097 VanDerWaalsContact C-N 3.33Å; L1095-L1097 PolarHBondContact O-N 3.42Å; L1095-R1098 CarbonylContact O-C 3.6Å; L1095-R1098 WeakPolarHBondContact O-CA 3.24Å; L1095-R1098 WeakPolarHBondContact O-CB 3.3Å; L1095-R1098 PolarHBondContact O-N 3.12Å; L1095-V1099 WeakPolarHBondContact O-CG2 3.21Å; L1095-V1099 PolarHBondContact O-N 3.28Å
1096	A	92	Very high	89.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.4	-42.4	175	0	0	0	0	0	111.7	M1055 L1081 T1084 L1085 T1092 R1093 R1098 V1099 L1100	M1055-A1096 HydrophobicContact SD-CB 4.44Å; L1081-A1096 HydrophobicContact CD2-CB 4.25Å; T1084-A1096 HydrophobicContact CG2-CB 3.67Å; L1085-A1096 HydrophobicContact CD2-CB 3.98Å; T1092-A1096 PolarHBondContact O-N 3.27Å; R1093-A1096 PolarHBondContact O-N 3.34Å; A1096-R1098 PolarHBondContact O-N 3.28Å; A1096-V1099 WeakPolarHBondContact O-CB 2.75Å; A1096-V1099 PolarHBondContact O-N 3.49Å; A1096-V1099 VanDerWaalsContact O-N 3.09Å; A1096-L1100 WeakPolarHBondContact O-CG 3.29Å; A1096-L1100 PolarHBondContact O-N 3.28Å
1097	L	94.5	Very high	90	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-56.5	-35.6	171.1	-72.1	167.6	0	0	0	113	L1085 R1093 L1095 Q1101 V1122 A1125 V1133 A1136 A1137	L1085-L1097 HydrophobicContact CD1-CD2 4.3Å; L1085-L1097 HydrophobicContact CD2-CD2 3.87Å; L1085-L1097 HydrophobicContact CD2-CG 3.73Å; R1093-L1097 WeakPolarHBondContact O-CG 3.35Å; R1093-L1097 PolarHBondContact O-N 3.05Å; L1095-L1097 VanDerWaalsContact C-N 3.33Å; L1095-L1097 PolarHBondContact O-N 3.42Å; L1097-Q1101 VanDerWaalsContact O-CB 3.29Å; L1097-Q1101 WeakPolarHBondContact O-CB 3.37Å; L1097-Q1101 PolarHBondContact O-N 2.9Å; L1097-V1122 HydrophobicContact CD2-CG2 4.4Å; L1097-A1125 HydrophobicContact CD1-CB 4.01Å; L1097-A1125 HydrophobicContact CD2-CB 4.02Å; L1097-V1133 HydrophobicContact CD1-CG1 3.58Å; L1097-A1136 HydrophobicContact CB-CB 4.1Å; L1097-A1136 HydrophobicContact CD1-CB 4.05Å; L1097-A1137 HydrophobicContact CD1-CB 3.95Å
1098	R	94.4	Very high	90.4	Very high	127 Å²	127	37.9 Å²	37.9	48%	0.479	19%	0.189	S	C	.	.	H	α-helix	trans	-74.6	-35.9	174.8	-70.6	169	175.8	170.1	0.1	112.5	I1059 A1094 L1095 A1096 L1100 Q1101 E1102	I1059-R1098 HydrophobicContact CD1-CB 4.16Å; A1094-R1098 WeakPolarHBondContact O-CG 3.4Å; L1095-R1098 CarbonylContact O-C 3.6Å; L1095-R1098 WeakPolarHBondContact O-CA 3.24Å; L1095-R1098 WeakPolarHBondContact O-CB 3.3Å; L1095-R1098 PolarHBondContact O-N 3.12Å; A1096-R1098 PolarHBondContact O-N 3.28Å; R1098-L1100 VanDerWaalsContact C-N 3.33Å; R1098-Q1101 PolarHBondContact O-N 2.69Å; R1098-E1102 WeakPolarHBondContact O-CG 3.49Å; R1098-E1102 PolarHBondContact O-N 3.24Å
1099	V	93.2	Very high	90.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.2	-47.6	170.8	-172.5	0	0	0	0	109.6	M1055 L1058 I1059 L1062 L1081 L1095 A1096 Q1101 E1102 L1103	M1055-V1099 HydrophobicContact CB-CG2 3.69Å; M1055-V1099 HydrophobicContact CG-CG2 4Å; L1058-V1099 HydrophobicContact CB-CG1 4.45Å; L1058-V1099 HydrophobicContact CD2-CG1 3.7Å; L1058-V1099 HydrophobicContact CG-CG1 3.89Å; I1059-V1099 HydrophobicContact CD1-CG2 3.86Å; I1059-V1099 HydrophobicContact CG1-CB 4.27Å; I1059-V1099 HydrophobicContact CG1-CG2 3.91Å; L1062-V1099 HydrophobicContact CD1-CG1 4.3Å; L1081-V1099 HydrophobicContact CD1-CB 3.99Å; L1081-V1099 HydrophobicContact CD1-CG1 3.5Å; L1081-V1099 VanDerWaalsContact CD1-CG1 3.5Å; L1081-V1099 HydrophobicContact CD2-CB 3.91Å; L1081-V1099 HydrophobicContact CD2-CG1 4.01Å; L1081-V1099 HydrophobicContact CD2-CG2 4.08Å; L1081-V1099 HydrophobicContact CG-CG1 4.42Å; L1095-V1099 WeakPolarHBondContact O-CG2 3.21Å; L1095-V1099 PolarHBondContact O-N 3.28Å; A1096-V1099 WeakPolarHBondContact O-CB 2.75Å; A1096-V1099 PolarHBondContact O-N 3.49Å; A1096-V1099 VanDerWaalsContact O-N 3.09Å; V1099-Q1101 VanDerWaalsContact C-N 3.35Å; V1099-Q1101 PolarHBondContact O-N 3.45Å; V1099-E1102 PolarHBondContact O-N 3.09Å; V1099-L1103 VanDerWaalsContact O-CB 3.31Å; V1099-L1103 WeakPolarHBondContact O-CB 3.18Å; V1099-L1103 PolarHBondContact O-N 3.48Å
1100	L	94.2	Very high	91.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-39.1	177.5	-67.7	167.2	0	0	0	112.3	L1078 L1081 L1082 L1085 A1096 R1098 L1103 V1104 F1118	L1078-L1100 HydrophobicContact CD1-CD2 3.7Å; L1081-L1100 HydrophobicContact CB-CD1 4.43Å; L1081-L1100 HydrophobicContact CB-CD2 3.93Å; L1081-L1100 HydrophobicContact CB-CG 4.17Å; L1081-L1100 HydrophobicContact CD1-CD2 3.95Å; L1081-L1100 HydrophobicContact CD1-CG 4.27Å; L1082-L1100 HydrophobicContact CD2-CD1 4.11Å; L1085-L1100 HydrophobicContact CD1-CD1 4.17Å; A1096-L1100 WeakPolarHBondContact O-CG 3.29Å; A1096-L1100 PolarHBondContact O-N 3.28Å; R1098-L1100 VanDerWaalsContact C-N 3.33Å; L1100-L1103 PolarHBondContact O-N 3.26Å; L1100-V1104 WeakPolarHBondContact O-CG1 3.32Å; L1100-V1104 PolarHBondContact O-N 2.69Å; L1100-F1118 HydrophobicContact CB-CE2 3.84Å; L1100-F1118 HydrophobicContact CB-CZ 4.26Å; L1100-F1118 HydrophobicContact CD1-CE2 4.16Å; L1100-F1118 HydrophobicContact CD2-CE2 4.22Å; L1100-F1118 HydrophobicContact CG-CE2 4.3Å
1101	Q	94.4	Very high	91.1	Very high	26 Å²	26	30.7 Å²	30.7	12%	0.121	15%	0.145	C	C	.	.	H	α-helix	trans	-61.8	-40.8	175	-174.7	-174	19.3	0	0	112.7	L1097 R1098 V1099 R1105 D1139 C1140 T1143	L1097-Q1101 VanDerWaalsContact O-CB 3.29Å; L1097-Q1101 WeakPolarHBondContact O-CB 3.37Å; L1097-Q1101 PolarHBondContact O-N 2.9Å; R1098-Q1101 PolarHBondContact O-N 2.69Å; V1099-Q1101 VanDerWaalsContact C-N 3.35Å; V1099-Q1101 PolarHBondContact O-N 3.45Å; Q1101-R1105 WeakPolarHBondContact O-CB 3.25Å; Q1101-R1105 PolarHBondContact O-N 2.97Å; Q1101-D1139 PolarHBondContact NE2-O 3.02Å; Q1101-C1140 HydrophobicContact CB-CB 4.22Å; Q1101-T1143 HydrophobicContact CG-CG2 4Å; Q1101-T1143 WeakPolarHBondContact CG-OG1 3.25Å; Q1101-T1143 PolarHBondContact NE2-OG1 3.38Å
1102	E	92.8	Very high	90.9	Very high	15 Å²	15	31.9 Å²	31.9	7%	0.07	15%	0.151	C	C	.	.	H	α-helix	trans	-75.9	-35.7	175.7	-59.8	-61.7	143	0	0	111.6	I1059 L1062 R1063 R1098 V1099 R1105 A1106	I1059-E1102 HydrophobicContact CG1-CG 4.33Å; I1059-E1102 HydrophobicContact CG2-CG 4.25Å; L1062-E1102 HydrophobicContact CD1-CB 4.41Å; R1063-E1102 IonicContact CZ-OE1 2.69Å; R1063-E1102 IonicContact CZ-OE2 3.91Å; R1063-E1102 IonicContact NE-OE1 3.54Å; R1063-E1102 IonicContact NE-OE2 3.26Å; R1063-E1102 PolarHBondContact NE-OE2 2.8Å; R1063-E1102 IonicContact NH2-OE1 3.45Å; R1063-E1102 PolarHBondContact NH2-OE1 3.03Å; R1063-E1102 IonicContact NH2-OE2 2.88Å; R1063-E1102 PolarHBondContact NH2-OE2 3.41Å; R1098-E1102 WeakPolarHBondContact O-CG 3.49Å; R1098-E1102 PolarHBondContact O-N 3.24Å; V1099-E1102 PolarHBondContact O-N 3.09Å; E1102-R1105 PolarHBondContact O-N 3.41Å; E1102-R1105 IonicContact OE1-CZ 2.78Å; E1102-R1105 IonicContact OE1-NH1 3.69Å; E1102-R1105 PolarHBondContact OE1-NH1 3.21Å; E1102-R1105 IonicContact OE2-NH1 2.77Å; E1102-R1105 PolarHBondContact OE2-NH1 3.27Å; E1102-A1106 VanDerWaalsContact O-CB 3.3Å; E1102-A1106 WeakPolarHBondContact O-CB 3.46Å; E1102-A1106 PolarHBondContact O-N 3.46Å
1103	L	91.8	Very high	90.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.2	-46.1	177.3	-175.8	62.1	0	0	0	111.4	L1062 W1070 F1074 T1077 V1099 L1100 R1105 A1106 K1107 F1111	L1062-L1103 HydrophobicContact CD1-CB 3.99Å; L1062-L1103 HydrophobicContact CD1-CD1 4.25Å; L1062-L1103 HydrophobicContact CD2-CD1 3.59Å; W1070-L1103 HydrophobicContact CE3-CD1 4.31Å; W1070-L1103 HydrophobicContact CH2-CD1 4.19Å; W1070-L1103 HydrophobicContact CZ3-CD1 3.98Å; F1074-L1103 HydrophobicContact CD2-CD1 4.37Å; F1074-L1103 HydrophobicContact CD2-CD2 4.25Å; F1074-L1103 HydrophobicContact CE2-CD2 3.99Å; F1074-L1103 HydrophobicContact CE2-CG 4.31Å; T1077-L1103 HydrophobicContact CG2-CD2 4.49Å; V1099-L1103 VanDerWaalsContact O-CB 3.31Å; V1099-L1103 WeakPolarHBondContact O-CB 3.18Å; V1099-L1103 PolarHBondContact O-N 3.48Å; L1100-L1103 PolarHBondContact O-N 3.26Å; L1103-R1105 VanDerWaalsContact C-N 3.32Å; L1103-R1105 PolarHBondContact O-N 2.92Å; L1103-A1106 PolarHBondContact O-N 3.44Å; L1103-K1107 CarbonylContact O-C 3.58Å; L1103-K1107 WeakPolarHBondContact O-CA 3.21Å; L1103-K1107 PolarHBondContact O-N 2.89Å; L1103-F1111 HydrophobicContact CB-CE2 4.43Å; L1103-F1111 HydrophobicContact CB-CZ 4.18Å; L1103-F1111 HydrophobicContact CD2-CE2 4.37Å; L1103-F1111 HydrophobicContact CD2-CZ 3.83Å; L1103-F1111 HydrophobicContact CG-CE2 3.84Å; L1103-F1111 HydrophobicContact CG-CZ 3.72Å
1104	V	92.3	Very high	90.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-70.9	-25.4	176.8	75.2	0	0	0	0	113.2	L1100 P1108 F1111 F1118 T1143 V1144 L1148	L1100-V1104 WeakPolarHBondContact O-CG1 3.32Å; L1100-V1104 PolarHBondContact O-N 2.69Å; V1104-P1108 WeakPolarHBondContact O-CA 3.08Å; V1104-P1108 WeakPolarHBondContact O-CB 3.39Å; V1104-P1108 WeakPolarHBondContact O-CD 3.38Å; V1104-F1111 VanDerWaalsContact CA-CE2 3.46Å; V1104-F1111 HydrophobicContact CB-CD2 4.21Å; V1104-F1111 HydrophobicContact CB-CE2 3.76Å; V1104-F1111 HydrophobicContact CB-CZ 3.95Å; V1104-F1111 HydrophobicContact CG2-CD2 3.98Å; V1104-F1111 HydrophobicContact CG2-CE2 4.06Å; V1104-F1111 HydrophobicContact CG2-CG 4.32Å; V1104-F1111 HydrophobicContact CG2-CZ 4.46Å; V1104-F1118 HydrophobicContact CB-CE1 4.09Å; V1104-F1118 HydrophobicContact CB-CZ 4.35Å; V1104-F1118 HydrophobicContact CG1-CE1 4.49Å; V1104-F1118 HydrophobicContact CG1-CZ 4.44Å; V1104-F1118 HydrophobicContact CG2-CE1 4.01Å; V1104-T1143 HydrophobicContact CG1-CG2 4.25Å; V1104-V1144 HydrophobicContact CG1-CG2 3.98Å; V1104-V1144 HydrophobicContact CG2-CG2 4.36Å; V1104-L1148 HydrophobicContact CG2-CD1 4.4Å; V1104-L1148 HydrophobicContact CG2-CD2 3.59Å; V1104-L1148 HydrophobicContact CG2-CG 3.8Å
1105	R	92.5	Very high	89.9	Confident	98 Å²	98	39 Å²	39	37%	0.37	19%	0.188	S	C	.	.	H	α-helix	trans	-77.6	-38	174.3	-169.6	-174.9	-60.9	129.8	3.9	112.4	Q1101 E1102 L1103 T1143	Q1101-R1105 WeakPolarHBondContact O-CB 3.25Å; Q1101-R1105 PolarHBondContact O-N 2.97Å; E1102-R1105 PolarHBondContact O-N 3.41Å; E1102-R1105 IonicContact OE1-CZ 2.78Å; E1102-R1105 IonicContact OE1-NH1 3.69Å; E1102-R1105 PolarHBondContact OE1-NH1 3.21Å; E1102-R1105 IonicContact OE2-NH1 2.77Å; E1102-R1105 PolarHBondContact OE2-NH1 3.27Å; L1103-R1105 VanDerWaalsContact C-N 3.32Å; L1103-R1105 PolarHBondContact O-N 2.92Å; R1105-T1143 HydrophobicContact CB-CG2 4.13Å; R1105-T1143 PolarHBondContact NH2-OG1 3.19Å
1106	A	89.3	Confident	89.5	Confident	48 Å²	48	40.8 Å²	40.8	40%	0.397	19%	0.194	S	C	.	.	H	α-helix	trans	-82.7	-30.8	-179.7	0	0	0	0	0	113	L1062 E1102 L1103	L1062-A1106 HydrophobicContact CD2-CB 4.29Å; E1102-A1106 VanDerWaalsContact O-CB 3.3Å; E1102-A1106 WeakPolarHBondContact O-CB 3.46Å; E1102-A1106 PolarHBondContact O-N 3.46Å; L1103-A1106 PolarHBondContact O-N 3.44Å
1107	K	87.7	Confident	89.1	Confident	61 Å²	61	42 Å²	42	27%	0.265	20%	0.2	S	C	.	.			trans	-142.9	58.2	-171.1	-74.4	-59	-167.3	-177.5	0	113.4	L1103 E1109 L1110 F1111	L1103-K1107 CarbonylContact O-C 3.58Å; L1103-K1107 WeakPolarHBondContact O-CA 3.21Å; L1103-K1107 PolarHBondContact O-N 2.89Å; K1107-E1109 VanDerWaalsContact CA-OE2 3.26Å; K1107-E1109 WeakPolarHBondContact CA-OE2 3.38Å; K1107-E1109 WeakPolarHBondContact CD-OE1 3.31Å; K1107-E1109 WeakPolarHBondContact CE-OE1 3.33Å; K1107-E1109 IonicContact NZ-OE1 2.69Å; K1107-E1109 PolarHBondContact NZ-OE1 3.04Å; K1107-E1109 PolarHBondContact O-N 2.93Å; K1107-L1110 HydrophobicContact CB-CD1 3.72Å; K1107-L1110 HydrophobicContact CB-CG 4.11Å; K1107-L1110 HydrophobicContact CD-CD1 4.33Å; K1107-L1110 HydrophobicContact CG-CD1 4.02Å; K1107-L1110 PolarHBondContact O-N 2.93Å; K1107-F1111 WeakPolarHBondContact O-CD2 3.39Å
1108	P	89.1	Confident	88.9	Confident	33 Å²	33	42 Å²	42	21%	0.214	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-60.4	-27.8	178.2	26.7	-34.9	0	0	0	112.9	V1104 L1110 F1111 N1147 L1148	V1104-P1108 WeakPolarHBondContact O-CA 3.08Å; V1104-P1108 WeakPolarHBondContact O-CB 3.39Å; V1104-P1108 WeakPolarHBondContact O-CD 3.38Å; P1108-L1110 PolarHBondContact O-N 3.19Å; P1108-F1111 PolarHBondContact O-N 3.17Å; P1108-N1147 VanDerWaalsContact CB-O 3.3Å; P1108-N1147 WeakPolarHBondContact CB-O 3.36Å; P1108-L1148 HydrophobicContact CB-CD2 3.84Å
1109	E	87.6	Confident	88.7	Confident	91 Å²	91	36 Å²	36	43%	0.425	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-64.2	-26.5	-176.5	71.8	-85.5	-153.1	0	0	113.9	K1107 F1111 H1112	K1107-E1109 VanDerWaalsContact CA-OE2 3.26Å; K1107-E1109 WeakPolarHBondContact CA-OE2 3.38Å; K1107-E1109 WeakPolarHBondContact CD-OE1 3.31Å; K1107-E1109 WeakPolarHBondContact CE-OE1 3.33Å; K1107-E1109 IonicContact NZ-OE1 2.69Å; K1107-E1109 PolarHBondContact NZ-OE1 3.04Å; K1107-E1109 PolarHBondContact O-N 2.93Å; E1109-F1111 VanDerWaalsContact C-N 3.32Å; E1109-F1111 PolarHBondContact O-N 3.17Å; E1109-H1112 PolarHBondContact O-ND1 2.91Å
1110	L	88	Confident	88.5	Confident	28 Å²	28	36.5 Å²	36.5	15%	0.147	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-77.4	-19.4	-177.9	-56.5	178.3	0	0	0	112.8	W1070 F1074 K1107 P1108	W1070-L1110 HydrophobicContact CB-CD1 3.66Å; W1070-L1110 HydrophobicContact CG-CD1 4.21Å; F1074-L1110 HydrophobicContact CB-CD1 4.03Å; F1074-L1110 HydrophobicContact CD1-CB 3.94Å; F1074-L1110 HydrophobicContact CD2-CB 3.71Å; F1074-L1110 HydrophobicContact CD2-CD1 3.56Å; F1074-L1110 HydrophobicContact CD2-CG 4.28Å; F1074-L1110 HydrophobicContact CE1-CB 3.79Å; F1074-L1110 WeakPolarHBondContact CE1-O 3.39Å; F1074-L1110 HydrophobicContact CE2-CB 3.54Å; F1074-L1110 HydrophobicContact CE2-CD1 4.16Å; F1074-L1110 HydrophobicContact CG-CB 3.9Å; F1074-L1110 HydrophobicContact CG-CD1 3.83Å; F1074-L1110 HydrophobicContact CG-CG 4.41Å; F1074-L1110 HydrophobicContact CZ-CB 3.58Å; F1074-L1110 WeakPolarHBondContact CZ-O 3.44Å; K1107-L1110 HydrophobicContact CB-CD1 3.72Å; K1107-L1110 HydrophobicContact CB-CG 4.11Å; K1107-L1110 HydrophobicContact CD-CD1 4.33Å; K1107-L1110 HydrophobicContact CG-CD1 4.02Å; K1107-L1110 PolarHBondContact O-N 2.93Å; P1108-L1110 PolarHBondContact O-N 3.19Å
1111	F	88.4	Confident	88.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-83.1	-8.6	-174	-75	-94.1	0	0	0	114.6	F1074 L1078 L1103 V1104 K1107 P1108 E1109 D1113 F1114 A1115 F1118 L1148	F1074-F1111 HydrophobicContact CE2-CD2 4.19Å; F1074-F1111 HydrophobicContact CE2-CE1 4.45Å; F1074-F1111 AromaticContact CE2-CE2 3.88Å; F1074-F1111 HydrophobicContact CE2-CE2 3.88Å; F1074-F1111 HydrophobicContact CE2-CZ 4.05Å; F1074-F1111 HydrophobicContact CZ-CD1 4.27Å; F1074-F1111 HydrophobicContact CZ-CD2 4.19Å; F1074-F1111 HydrophobicContact CZ-CE1 4.38Å; F1074-F1111 HydrophobicContact CZ-CE2 4.28Å; F1074-F1111 HydrophobicContact CZ-CG 4.2Å; F1074-F1111 HydrophobicContact CZ-CZ 4.39Å; L1078-F1111 HydrophobicContact CD1-CE1 3.88Å; L1103-F1111 HydrophobicContact CB-CE2 4.43Å; L1103-F1111 HydrophobicContact CB-CZ 4.18Å; L1103-F1111 HydrophobicContact CD2-CE2 4.37Å; L1103-F1111 HydrophobicContact CD2-CZ 3.83Å; L1103-F1111 HydrophobicContact CG-CE2 3.84Å; L1103-F1111 HydrophobicContact CG-CZ 3.72Å; V1104-F1111 VanDerWaalsContact CA-CE2 3.46Å; V1104-F1111 HydrophobicContact CB-CD2 4.21Å; V1104-F1111 HydrophobicContact CB-CE2 3.76Å; V1104-F1111 HydrophobicContact CB-CZ 3.95Å; V1104-F1111 HydrophobicContact CG2-CD2 3.98Å; V1104-F1111 HydrophobicContact CG2-CE2 4.06Å; V1104-F1111 HydrophobicContact CG2-CG 4.32Å; V1104-F1111 HydrophobicContact CG2-CZ 4.46Å; K1107-F1111 WeakPolarHBondContact O-CD2 3.39Å; P1108-F1111 PolarHBondContact O-N 3.17Å; E1109-F1111 VanDerWaalsContact C-N 3.32Å; E1109-F1111 PolarHBondContact O-N 3.17Å; F1111-D1113 PolarHBondContact O-N 3.32Å; F1111-F1114 CarbonylContact O-C 3.54Å; F1111-F1114 PolarHBondContact O-N 2.89Å; F1111-A1115 WeakPolarHBondContact O-CA 3.49Å; F1111-A1115 WeakPolarHBondContact O-CB 3.2Å; F1111-A1115 PolarHBondContact O-N 3.42Å; F1111-F1118 HydrophobicContact CD1-CB 4.32Å; F1111-F1118 AromaticContact CD1-CD1 3.33Å; F1111-F1118 HydrophobicContact CD1-CD1 3.33Å; F1111-F1118 AromaticContact CD1-CE1 3.72Å; F1111-F1118 HydrophobicContact CD1-CE1 3.72Å; F1111-F1118 AromaticContact CD1-CG 3.89Å; F1111-F1118 HydrophobicContact CD1-CG 3.89Å; F1111-F1118 AromaticContact CE1-CD1 3.5Å; F1111-F1118 HydrophobicContact CE1-CD1 3.5Å; F1111-F1118 VanDerWaalsContact CE1-CD1 3.5Å; F1111-F1118 HydrophobicContact CE1-CD2 4.25Å; F1111-F1118 AromaticContact CE1-CE1 3.55Å; F1111-F1118 HydrophobicContact CE1-CE1 3.55Å; F1111-F1118 HydrophobicContact CE1-CE2 4.33Å; F1111-F1118 AromaticContact CE1-CG 3.86Å; F1111-F1118 HydrophobicContact CE1-CG 3.86Å; F1111-F1118 AromaticContact CE1-CZ 3.99Å; F1111-F1118 HydrophobicContact CE1-CZ 3.99Å; F1111-F1118 HydrophobicContact CG-CD1 4.31Å; F1111-F1118 HydrophobicContact CZ-CE1 4.27Å; F1111-L1148 HydrophobicContact CB-CD2 4.02Å
1112	H	83.6	Confident	88.2	Confident	93 Å²	93	38.5 Å²	38.5	43%	0.431	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-51.3	-51	-173.7	-72.9	97.5	0	0	0	113.5	E1109 F1114	E1109-H1112 PolarHBondContact O-ND1 2.91Å; H1112-F1114 PolarHBondContact O-N 3.26Å
1113	D	79.9	Confident	88.2	Confident	145 Å²	145	37.8 Å²	37.8	78%	0.775	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-70.4	-16.1	179.7	-67.7	-12.8	0	0	0	113.6	F1111	F1111-D1113 PolarHBondContact O-N 3.32Å
1114	F	85.3	Confident	88.2	Confident	41 Å²	41	41.6 Å²	41.6	18%	0.18	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-117.5	-3.8	-171	-62.5	-87	0	0	0	114	F1074 K1075 L1078 F1111 H1112 Y1116 L1117 F1118	F1074-F1114 AromaticContact CE1-CD2 3.79Å; F1074-F1114 HydrophobicContact CE1-CD2 3.79Å; F1074-F1114 HydrophobicContact CE1-CE2 4.01Å; K1075-F1114 HydrophobicContact CD-CE2 4.42Å; K1075-F1114 HydrophobicContact CD-CZ 3.92Å; K1075-F1114 HydrophobicContact CG-CE2 4.18Å; K1075-F1114 HydrophobicContact CG-CZ 3.85Å; L1078-F1114 HydrophobicContact CD2-CB 3.61Å; L1078-F1114 HydrophobicContact CD2-CD1 3.84Å; L1078-F1114 HydrophobicContact CD2-CD2 4.19Å; L1078-F1114 HydrophobicContact CD2-CG 3.61Å; F1111-F1114 CarbonylContact O-C 3.54Å; F1111-F1114 PolarHBondContact O-N 2.89Å; H1112-F1114 PolarHBondContact O-N 3.26Å; F1114-Y1116 PolarHBondContact O-N 2.7Å; F1114-Y1116 VanDerWaalsContact O-N 3.14Å; F1114-L1117 PolarHBondContact O-N 2.74Å; F1114-L1117 VanDerWaalsContact O-N 3.15Å; F1114-F1118 PolarHBondContact O-N 2.78Å
1115	A	85.7	Confident	88.2	Confident	2 Å²	2	42.2 Å²	42.2	2%	0.017	21%	0.209	C	C	.	.	H	α-helix	trans	-57.9	-35.1	-169.2	0	0	0	0	0	112.8	F1111 V1119 L1148 L1152	F1111-A1115 WeakPolarHBondContact O-CA 3.49Å; F1111-A1115 WeakPolarHBondContact O-CB 3.2Å; F1111-A1115 PolarHBondContact O-N 3.42Å; A1115-V1119 VanDerWaalsContact O-CB 3.25Å; A1115-V1119 WeakPolarHBondContact O-CB 3.39Å; A1115-V1119 VanDerWaalsContact O-CG2 3.22Å; A1115-V1119 WeakPolarHBondContact O-CG2 3.5Å; A1115-V1119 PolarHBondContact O-N 3.34Å; A1115-L1148 HydrophobicContact CB-CD1 4.43Å; A1115-L1152 HydrophobicContact CB-CD1 4.18Å; A1115-L1152 HydrophobicContact CB-CD2 3.77Å; A1115-L1152 HydrophobicContact CB-CG 4Å
1116	Y	82.4	Confident	88.2	Confident	48 Å²	48	38.3 Å²	38.3	19%	0.188	20%	0.196	C	C	.	.	H	α-helix	trans	-61.2	-52.6	177.3	-169	-92	0	0	0	112.5	V874 M879 F1114 I1120 V1156	V874-Y1116 HydrophobicContact CG2-CE2 4.02Å; M879-Y1116 WeakPolarHBondContact CE-OH 3.38Å; M879-Y1116 VanDerWaalsContact CG-OH 3.31Å; M879-Y1116 WeakPolarHBondContact CG-OH 3.45Å; F1114-Y1116 PolarHBondContact O-N 2.7Å; F1114-Y1116 VanDerWaalsContact O-N 3.14Å; Y1116-I1120 HydrophobicContact CD1-CD1 3.87Å; Y1116-I1120 HydrophobicContact CE1-CD1 3.32Å; Y1116-I1120 HydrophobicContact CE2-CD1 4.32Å; Y1116-I1120 WeakPolarHBondContact O-CG1 3.31Å; Y1116-I1120 PolarHBondContact O-N 3.16Å; Y1116-V1156 HydrophobicContact CD2-CG1 4.01Å; Y1116-V1156 HydrophobicContact CD2-CG2 4.2Å; Y1116-V1156 HydrophobicContact CE2-CG1 4.5Å
1117	L	84.4	Confident	88.3	Confident	25 Å²	25	42.1 Å²	42.1	13%	0.131	20%	0.201	C	C	.	.	H	α-helix	trans	-62.6	-46.9	177.7	179.5	71.5	0	0	0	111	T886 L1082 F1114 I1120 K1121	T886-L1117 HydrophobicContact CG2-CD1 4.15Å; T886-L1117 HydrophobicContact CG2-CD2 3.85Å; L1082-L1117 HydrophobicContact CD1-CD2 3.62Å; L1082-L1117 HydrophobicContact CD1-CG 4.03Å; F1114-L1117 PolarHBondContact O-N 2.74Å; F1114-L1117 VanDerWaalsContact O-N 3.15Å; L1117-I1120 PolarHBondContact O-N 2.84Å; L1117-K1121 WeakPolarHBondContact O-CB 3.48Å; L1117-K1121 WeakPolarHBondContact O-CG 3.44Å; L1117-K1121 PolarHBondContact O-N 3.27Å
1118	F	90.5	Very high	88.5	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.8	-48.8	-176.9	172.5	-133.5	0	0	0	112.4	L1082 L1100 V1104 F1111 F1114 I1120 K1121 V1122 V1144	L1082-F1118 HydrophobicContact CD2-CD2 4.3Å; L1100-F1118 HydrophobicContact CB-CE2 3.84Å; L1100-F1118 HydrophobicContact CB-CZ 4.26Å; L1100-F1118 HydrophobicContact CD1-CE2 4.16Å; L1100-F1118 HydrophobicContact CD2-CE2 4.22Å; L1100-F1118 HydrophobicContact CG-CE2 4.3Å; V1104-F1118 HydrophobicContact CB-CE1 4.09Å; V1104-F1118 HydrophobicContact CB-CZ 4.35Å; V1104-F1118 HydrophobicContact CG1-CE1 4.49Å; V1104-F1118 HydrophobicContact CG1-CZ 4.44Å; V1104-F1118 HydrophobicContact CG2-CE1 4.01Å; F1111-F1118 HydrophobicContact CD1-CB 4.32Å; F1111-F1118 AromaticContact CD1-CD1 3.33Å; F1111-F1118 HydrophobicContact CD1-CD1 3.33Å; F1111-F1118 AromaticContact CD1-CE1 3.72Å; F1111-F1118 HydrophobicContact CD1-CE1 3.72Å; F1111-F1118 AromaticContact CD1-CG 3.89Å; F1111-F1118 HydrophobicContact CD1-CG 3.89Å; F1111-F1118 AromaticContact CE1-CD1 3.5Å; F1111-F1118 HydrophobicContact CE1-CD1 3.5Å; F1111-F1118 VanDerWaalsContact CE1-CD1 3.5Å; F1111-F1118 HydrophobicContact CE1-CD2 4.25Å; F1111-F1118 AromaticContact CE1-CE1 3.55Å; F1111-F1118 HydrophobicContact CE1-CE1 3.55Å; F1111-F1118 HydrophobicContact CE1-CE2 4.33Å; F1111-F1118 AromaticContact CE1-CG 3.86Å; F1111-F1118 HydrophobicContact CE1-CG 3.86Å; F1111-F1118 AromaticContact CE1-CZ 3.99Å; F1111-F1118 HydrophobicContact CE1-CZ 3.99Å; F1111-F1118 HydrophobicContact CG-CD1 4.31Å; F1111-F1118 HydrophobicContact CZ-CE1 4.27Å; F1114-F1118 PolarHBondContact O-N 2.78Å; F1118-I1120 PolarHBondContact O-N 3.36Å; F1118-K1121 PolarHBondContact O-N 3.19Å; F1118-V1122 HydrophobicContact CD2-CG2 3.89Å; F1118-V1122 HydrophobicContact CE2-CG2 3.46Å; F1118-V1122 VanDerWaalsContact CE2-CG2 3.46Å; F1118-V1122 HydrophobicContact CZ-CG2 4.09Å; F1118-V1122 WeakPolarHBondContact O-CG2 3.43Å; F1118-V1122 PolarHBondContact O-N 3.05Å; F1118-V1144 HydrophobicContact CE1-CG2 3.62Å; F1118-V1144 HydrophobicContact CZ-CG2 3.8Å
1119	V	90.7	Very high	88.6	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-42.1	179.1	169.2	0	0	0	0	111	A1115 K1121 V1122 L1123 V1144 V1156 L1157 M1175	A1115-V1119 VanDerWaalsContact O-CB 3.25Å; A1115-V1119 WeakPolarHBondContact O-CB 3.39Å; A1115-V1119 VanDerWaalsContact O-CG2 3.22Å; A1115-V1119 WeakPolarHBondContact O-CG2 3.5Å; A1115-V1119 PolarHBondContact O-N 3.34Å; V1119-K1121 PolarHBondContact O-N 3.39Å; V1119-V1122 PolarHBondContact O-N 2.79Å; V1119-L1123 HydrophobicContact CG1-CD1 3.72Å; V1119-L1123 HydrophobicContact CG1-CG 4.22Å; V1119-L1123 WeakPolarHBondContact O-CB 3.47Å; V1119-L1123 VanDerWaalsContact O-CG 3.22Å; V1119-L1123 WeakPolarHBondContact O-CG 3.38Å; V1119-L1123 PolarHBondContact O-N 3.23Å; V1119-V1144 HydrophobicContact CG2-CG1 4.15Å; V1119-V1156 HydrophobicContact CB-CG1 3.9Å; V1119-V1156 HydrophobicContact CG1-CG1 3.79Å; V1119-L1157 HydrophobicContact CG1-CD2 4.25Å; V1119-M1175 HydrophobicContact CG1-CE 4.39Å; V1119-M1175 HydrophobicContact CG1-SD 4.28Å; V1119-M1175 HydrophobicContact CG2-CE 4.42Å
1120	I	87.4	Confident	88.9	Confident	9 Å²	9	44 Å²	44	5%	0.046	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-46.8	175.2	-71.8	175.6	0	0	0	110.9	Y1116 L1117 F1118 V1122 L1123 E1124 L1160	Y1116-I1120 HydrophobicContact CD1-CD1 3.87Å; Y1116-I1120 HydrophobicContact CE1-CD1 3.32Å; Y1116-I1120 HydrophobicContact CE2-CD1 4.32Å; Y1116-I1120 WeakPolarHBondContact O-CG1 3.31Å; Y1116-I1120 PolarHBondContact O-N 3.16Å; L1117-I1120 PolarHBondContact O-N 2.84Å; F1118-I1120 PolarHBondContact O-N 3.36Å; I1120-V1122 VanDerWaalsContact C-N 3.32Å; I1120-V1122 PolarHBondContact O-N 3.29Å; I1120-L1123 PolarHBondContact O-N 2.97Å; I1120-L1123 VanDerWaalsContact O-N 3.11Å; I1120-E1124 HydrophobicContact CG2-CG 4.24Å; I1120-E1124 WeakPolarHBondContact O-CG 3.37Å; I1120-E1124 PolarHBondContact O-N 3.49Å; I1120-L1160 HydrophobicContact CD1-CD2 4.07Å; I1120-L1160 HydrophobicContact CG1-CD1 3.97Å; I1120-L1160 HydrophobicContact CG1-CD2 4.23Å
1121	K	89.4	Confident	89.1	Confident	66 Å²	66	50.6 Å²	50.6	29%	0.287	25%	0.247	S	C	.	.	H	α-helix	trans	-63	-35.3	179.8	-73	-75.3	156.8	-148.3	0	113.1	L1082 L1085 L1117 F1118 V1119 E1124 A1125	L1082-K1121 HydrophobicContact CD2-CB 3.85Å; L1082-K1121 HydrophobicContact CD2-CG 4.14Å; L1085-K1121 HydrophobicContact CD1-CB 4.03Å; L1117-K1121 WeakPolarHBondContact O-CB 3.48Å; L1117-K1121 WeakPolarHBondContact O-CG 3.44Å; L1117-K1121 PolarHBondContact O-N 3.27Å; F1118-K1121 PolarHBondContact O-N 3.19Å; V1119-K1121 PolarHBondContact O-N 3.39Å; K1121-E1124 WeakPolarHBondContact CD-OE2 3.37Å; K1121-E1124 WeakPolarHBondContact CE-OE2 3.35Å; K1121-E1124 IonicContact NZ-OE1 2.66Å; K1121-E1124 IonicContact NZ-OE2 3.08Å; K1121-E1124 PolarHBondContact NZ-OE2 3.13Å; K1121-A1125 WeakPolarHBondContact O-CB 3.08Å; K1121-A1125 PolarHBondContact O-N 3.37Å; K1121-A1125 VanDerWaalsContact O-N 3.14Å
1122	V	93.4	Very high	89.3	Confident	2 Å²	2	53 Å²	53	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-68.8	-42.1	171.8	174.5	0	0	0	0	111.5	L1097 F1118 V1119 I1120 E1124 A1125 C1126 C1140 A1141	L1097-V1122 HydrophobicContact CD2-CG2 4.4Å; F1118-V1122 HydrophobicContact CD2-CG2 3.89Å; F1118-V1122 HydrophobicContact CE2-CG2 3.46Å; F1118-V1122 VanDerWaalsContact CE2-CG2 3.46Å; F1118-V1122 HydrophobicContact CZ-CG2 4.09Å; F1118-V1122 WeakPolarHBondContact O-CG2 3.43Å; F1118-V1122 PolarHBondContact O-N 3.05Å; V1119-V1122 PolarHBondContact O-N 2.79Å; I1120-V1122 VanDerWaalsContact C-N 3.32Å; I1120-V1122 PolarHBondContact O-N 3.29Å; V1122-E1124 PolarHBondContact O-N 3.49Å; V1122-A1125 PolarHBondContact O-N 3.48Å; V1122-C1126 PolarHBondContact O-N 3.04Å; V1122-C1126 PolarHBondContact O-SG 3.29Å; V1122-C1126 VanDerWaalsContact O-SG 3.34Å; V1122-C1140 HydrophobicContact CG1-CB 4.23Å; V1122-A1141 HydrophobicContact CG1-CB 3.94Å
1123	L	93.4	Very high	89.8	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-68.5	-31.3	178.3	-70.1	172.6	0	0	0	113.5	V1119 I1120 C1126 L1157 L1160 I1168 P1171 A1172 M1175	V1119-L1123 HydrophobicContact CG1-CD1 3.72Å; V1119-L1123 HydrophobicContact CG1-CG 4.22Å; V1119-L1123 WeakPolarHBondContact O-CB 3.47Å; V1119-L1123 VanDerWaalsContact O-CG 3.22Å; V1119-L1123 WeakPolarHBondContact O-CG 3.38Å; V1119-L1123 PolarHBondContact O-N 3.23Å; I1120-L1123 PolarHBondContact O-N 2.97Å; I1120-L1123 VanDerWaalsContact O-N 3.11Å; L1123-C1126 WeakPolarHBondContact O-CB 3.34Å; L1123-L1157 HydrophobicContact CD1-CD2 3.83Å; L1123-L1160 HydrophobicContact CD1-CD1 3.77Å; L1123-I1168 HydrophobicContact CB-CB 4.25Å; L1123-I1168 HydrophobicContact CB-CD1 4.2Å; L1123-I1168 HydrophobicContact CB-CG2 4.41Å; L1123-I1168 HydrophobicContact CD1-CD1 4.41Å; L1123-P1171 HydrophobicContact CD2-CB 3.9Å; L1123-P1171 HydrophobicContact CD2-CG 4.41Å; L1123-A1172 HydrophobicContact CD1-CB 4.16Å; L1123-A1172 HydrophobicContact CD2-CB 4.48Å; L1123-M1175 HydrophobicContact CD2-CB 4.43Å; L1123-M1175 HydrophobicContact CD2-SD 4.09Å
1124	E	90.4	Very high	90.4	Very high	80 Å²	80	43.1 Å²	43.1	37%	0.374	22%	0.216	S	C	.	.	H	α-helix	trans	-64.7	-47.2	168.6	-73.6	174.6	161.2	0	0	110.6	I1120 K1121 V1122 C1126 R1127 I1168	I1120-E1124 HydrophobicContact CG2-CG 4.24Å; I1120-E1124 WeakPolarHBondContact O-CG 3.37Å; I1120-E1124 PolarHBondContact O-N 3.49Å; K1121-E1124 WeakPolarHBondContact CD-OE2 3.37Å; K1121-E1124 WeakPolarHBondContact CE-OE2 3.35Å; K1121-E1124 IonicContact NZ-OE1 2.66Å; K1121-E1124 IonicContact NZ-OE2 3.08Å; K1121-E1124 PolarHBondContact NZ-OE2 3.13Å; V1122-E1124 PolarHBondContact O-N 3.49Å; E1124-C1126 VanDerWaalsContact C-N 3.26Å; E1124-C1126 PolarHBondContact O-N 3.1Å; E1124-R1127 PolarHBondContact O-N 2.89Å; E1124-I1168 HydrophobicContact CG-CG2 4.15Å
1125	A	93.1	Very high	90.9	Very high	13 Å²	13	49.5 Å²	49.5	11%	0.107	24%	0.239	C	C	.	.	H	α-helix	trans	-64.9	-24.8	177.5	0	0	0	0	0	113.7	L1097 K1121 V1122 R1127 D1128 A1137	L1097-A1125 HydrophobicContact CD1-CB 4.01Å; L1097-A1125 HydrophobicContact CD2-CB 4.02Å; K1121-A1125 WeakPolarHBondContact O-CB 3.08Å; K1121-A1125 PolarHBondContact O-N 3.37Å; K1121-A1125 VanDerWaalsContact O-N 3.14Å; V1122-A1125 PolarHBondContact O-N 3.48Å; A1125-R1127 PolarHBondContact O-N 3.5Å; A1125-D1128 WeakPolarHBondContact O-CB 3.38Å; A1125-D1128 PolarHBondContact O-N 2.92Å; A1125-D1128 VanDerWaalsContact O-N 3.14Å; A1125-A1137 VanDerWaalsContact C-CB 3.43Å; A1125-A1137 HydrophobicContact CB-CB 3.76Å
1126	C	93.3	Very high	91.4	Very high	15 Å²	15	49.5 Å²	49.5	10%	0.101	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-3.5	167.6	-70.7	0	0	0	0	113.8	V1122 L1123 E1124 A1137 P1171	V1122-C1126 PolarHBondContact O-N 3.04Å; V1122-C1126 PolarHBondContact O-SG 3.29Å; V1122-C1126 VanDerWaalsContact O-SG 3.34Å; L1123-C1126 WeakPolarHBondContact O-CB 3.34Å; E1124-C1126 VanDerWaalsContact C-N 3.26Å; E1124-C1126 PolarHBondContact O-N 3.1Å; C1126-A1137 HydrophobicContact CB-CB 4.33Å; C1126-A1137 VanDerWaalsContact SG-C 3.54Å; C1126-A1137 VanDerWaalsContact SG-CB 3.55Å; C1126-P1171 HydrophobicContact CB-CB 3.57Å; C1126-P1171 HydrophobicContact CB-CG 3.99Å
1127	R	90.5	Very high	92	Very high	129 Å²	129	47.2 Å²	47.2	49%	0.487	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.4	19.1	175	-56.4	-178.1	70.3	-97.5	4.9	113.4	E1124 A1125 H1167 P1171	E1124-R1127 PolarHBondContact O-N 2.89Å; A1125-R1127 PolarHBondContact O-N 3.5Å; R1127-H1167 WeakPolarHBondContact CD-O 3.41Å; R1127-H1167 PolarHBondContact NE-O 2.95Å; R1127-P1171 HydrophobicContact CG-CG 4.19Å
1128	D	92.3	Very high	92.5	Very high	33 Å²	33	49 Å²	49	18%	0.176	24%	0.237	C	C	.	.			trans	-56.6	152.5	170.2	-163.2	-64.7	0	0	0	111	R1093 A1125 E1130 V1133 V1134	R1093-D1128 IonicContact CZ-OD1 3.77Å; R1093-D1128 IonicContact CZ-OD2 2.67Å; R1093-D1128 IonicContact NE-OD2 3.5Å; R1093-D1128 PolarHBondContact NE-OD2 3.45Å; R1093-D1128 VanDerWaalsContact NH2-CG 3.32Å; R1093-D1128 IonicContact NH2-OD1 2.7Å; R1093-D1128 PolarHBondContact NH2-OD1 3.41Å; R1093-D1128 IonicContact NH2-OD2 3.53Å; R1093-D1128 PolarHBondContact NH2-OD2 3.35Å; A1125-D1128 WeakPolarHBondContact O-CB 3.38Å; A1125-D1128 PolarHBondContact O-N 2.92Å; A1125-D1128 VanDerWaalsContact O-N 3.14Å; D1128-E1130 PolarHBondContact O-N 3.11Å; D1128-E1130 PolarHBondContact OD1-N 3.12Å; D1128-V1133 HydrophobicContact CB-CB 3.86Å; D1128-V1133 HydrophobicContact CB-CG1 3.82Å; D1128-V1133 WeakPolarHBondContact OD2-CG1 3.35Å; D1128-V1134 HydrophobicContact CB-CG2 4.07Å; D1128-V1134 WeakPolarHBondContact O-CG2 3.33Å
1129	S	90.5	Very high	92.7	Very high	106 Å²	106	52.8 Å²	52.8	74%	0.741	26%	0.258	S	S	*	.	S	Bend	trans	-64.1	-29.7	173.4	45.4	0	0	0	0	112.3
1130	E	93.5	Very high	92.9	Very high	84 Å²	84	52.6 Å²	52.6	39%	0.393	26%	0.257	S	S	.	.			trans	-92.4	120	-174.9	-78.5	-59	153.8	0	0	113.6	H1090 D1128 S1132 V1133 V1134	H1090-E1130 HydrophobicContact CB-CB 4.07Å; H1090-E1130 HydrophobicContact CB-CG 3.77Å; D1128-E1130 PolarHBondContact O-N 3.11Å; D1128-E1130 PolarHBondContact OD1-N 3.12Å; E1130-S1132 PolarHBondContact O-N 3.19Å; E1130-V1133 HydrophobicContact CB-CB 4.44Å; E1130-V1133 HydrophobicContact CB-CG2 3.91Å; E1130-V1133 PolarHBondContact O-N 3.5Å; E1130-V1134 PolarHBondContact O-N 3.14Å
1131	K	92.5	Very high	93.2	Very high	167 Å²	167	52.5 Å²	52.5	73%	0.726	26%	0.257	S	S	*	.	H	α-helix	trans	-61.7	-20.8	-178	-64.5	175.1	-176.6	169.5	0	113.5	R1135	K1131-R1135 PolarHBondContact O-N 3.11Å
1132	S	92.9	Very high	93.4	Very high	50 Å²	50	52.2 Å²	52.2	35%	0.35	26%	0.259	S	S	.	.	H	α-helix	trans	-73.1	-41.6	173.6	53.3	0	0	0	0	111.8	E1130 A1136	E1130-S1132 PolarHBondContact O-N 3.19Å; S1132-A1136 PolarHBondContact O-N 2.79Å
1133	V	93.8	Very high	93.5	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-70.4	-46.5	174.3	-172.2	0	0	0	0	110	H1090 R1093 A1094 L1097 D1128 E1130 R1135 A1136 A1137	H1090-V1133 HydrophobicContact CB-CG2 3.97Å; H1090-V1133 WeakPolarHBondContact O-CG2 3.4Å; R1093-V1133 HydrophobicContact CB-CG1 4.14Å; R1093-V1133 HydrophobicContact CB-CG2 4.21Å; A1094-V1133 HydrophobicContact CB-CG2 4.12Å; L1097-V1133 HydrophobicContact CD1-CG1 3.58Å; D1128-V1133 HydrophobicContact CB-CB 3.86Å; D1128-V1133 HydrophobicContact CB-CG1 3.82Å; D1128-V1133 WeakPolarHBondContact OD2-CG1 3.35Å; E1130-V1133 HydrophobicContact CB-CB 4.44Å; E1130-V1133 HydrophobicContact CB-CG2 3.91Å; E1130-V1133 PolarHBondContact O-N 3.5Å; V1133-R1135 VanDerWaalsContact C-N 3.32Å; V1133-R1135 PolarHBondContact O-N 3.09Å; V1133-A1136 CarbonylContact O-C 3.56Å; V1133-A1136 PolarHBondContact O-N 2.91Å; V1133-A1137 WeakPolarHBondContact O-CB 3.4Å; V1133-A1137 PolarHBondContact O-N 3.36Å
1134	V	94.1	Very high	93.5	Very high	31 Å²	31	52.5 Å²	52.5	19%	0.188	26%	0.26	C	S	.	.	H	α-helix	trans	-56.6	-43.6	178	174.8	0	0	0	0	111.8	D1128 E1130 A1137 E1138	D1128-V1134 HydrophobicContact CB-CG2 4.07Å; D1128-V1134 WeakPolarHBondContact O-CG2 3.33Å; E1130-V1134 PolarHBondContact O-N 3.14Å; V1134-A1137 PolarHBondContact O-N 3.36Å; V1134-E1138 WeakPolarHBondContact O-CG 3.4Å; V1134-E1138 PolarHBondContact O-N 2.87Å
1135	R	95.2	Very high	93.6	Very high	174 Å²	174	48.8 Å²	48.8	66%	0.657	24%	0.244	S	C	*	.	H	α-helix	trans	-62.2	-46.9	173.5	-83	-168.4	178.3	119.1	-7.8	112.5	K1131 V1133 A1137 E1138 D1139	K1131-R1135 PolarHBondContact O-N 3.11Å; V1133-R1135 VanDerWaalsContact C-N 3.32Å; V1133-R1135 PolarHBondContact O-N 3.09Å; R1135-A1137 PolarHBondContact O-N 3.31Å; R1135-E1138 PolarHBondContact O-N 3.36Å; R1135-D1139 WeakPolarHBondContact O-CB 3.47Å; R1135-D1139 VanDerWaalsContact O-CG 3.27Å; R1135-D1139 PolarHBondContact O-N 2.98Å
1136	A	94.7	Very high	93.5	Very high	2 Å²	2	54.3 Å²	54.3	2%	0.017	27%	0.267	C	S	.	.	H	α-helix	trans	-61.3	-32.7	178	0	0	0	0	0	112.2	A1094 L1097 S1132 V1133 C1140	A1094-A1136 HydrophobicContact CB-CB 4.31Å; L1097-A1136 HydrophobicContact CB-CB 4.1Å; L1097-A1136 HydrophobicContact CD1-CB 4.05Å; S1132-A1136 PolarHBondContact O-N 2.79Å; V1133-A1136 CarbonylContact O-C 3.56Å; V1133-A1136 PolarHBondContact O-N 2.91Å; A1136-C1140 WeakPolarHBondContact O-CB 3.34Å; A1136-C1140 PolarHBondContact O-N 3.06Å
1137	A	95.4	Very high	93.5	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-73.5	-43.1	175.2	0	0	0	0	0	112.3	L1097 A1125 C1126 V1133 V1134 R1135 C1140 A1141	L1097-A1137 HydrophobicContact CD1-CB 3.95Å; A1125-A1137 VanDerWaalsContact C-CB 3.43Å; A1125-A1137 HydrophobicContact CB-CB 3.76Å; C1126-A1137 HydrophobicContact CB-CB 4.33Å; C1126-A1137 VanDerWaalsContact SG-C 3.54Å; C1126-A1137 VanDerWaalsContact SG-CB 3.55Å; V1133-A1137 WeakPolarHBondContact O-CB 3.4Å; V1133-A1137 PolarHBondContact O-N 3.36Å; V1134-A1137 PolarHBondContact O-N 3.36Å; R1135-A1137 PolarHBondContact O-N 3.31Å; A1137-C1140 PolarHBondContact O-N 3.49Å; A1137-A1141 WeakPolarHBondContact O-CB 3.08Å; A1137-A1141 PolarHBondContact O-N 3.39Å
1138	E	94.5	Very high	93.5	Very high	62 Å²	62	50.5 Å²	50.5	29%	0.29	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-42.1	173.9	-71.1	-167.2	125.8	0	0	111.8	V1134 R1135 C1140 A1141 N1142 K1174	V1134-E1138 WeakPolarHBondContact O-CG 3.4Å; V1134-E1138 PolarHBondContact O-N 2.87Å; R1135-E1138 PolarHBondContact O-N 3.36Å; E1138-C1140 VanDerWaalsContact C-N 3.33Å; E1138-C1140 PolarHBondContact O-N 2.68Å; E1138-A1141 PolarHBondContact O-N 2.98Å; E1138-N1142 WeakPolarHBondContact O-CB 3.49Å; E1138-N1142 PolarHBondContact O-N 2.96Å; E1138-N1142 PolarHBondContact O-ND2 2.66Å; E1138-K1174 IonicContact OE1-NZ 3.54Å; E1138-K1174 PolarHBondContact OE1-NZ 3.13Å
1139	D	94.9	Very high	93.4	Very high	80 Å²	80	51.5 Å²	51.5	43%	0.428	26%	0.264	S	S	.	.	H	α-helix	trans	-63.5	-37.9	174.4	-70.9	-27.1	0	0	0	112	Q1101 R1135 T1143	Q1101-D1139 PolarHBondContact NE2-O 3.02Å; R1135-D1139 WeakPolarHBondContact O-CB 3.47Å; R1135-D1139 VanDerWaalsContact O-CG 3.27Å; R1135-D1139 PolarHBondContact O-N 2.98Å; D1139-T1143 WeakPolarHBondContact O-CB 3.4Å; D1139-T1143 PolarHBondContact O-N 3.07Å; D1139-T1143 VanDerWaalsContact O-N 3.07Å; D1139-T1143 PolarHBondContact O-OG1 3.01Å
1140	C	95.4	Very high	93.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-67.2	-49.8	173.9	-167	0	0	0	0	111	Q1101 V1122 A1136 A1137 E1138 N1142 T1143 V1144	Q1101-C1140 HydrophobicContact CB-CB 4.22Å; V1122-C1140 HydrophobicContact CG1-CB 4.23Å; A1136-C1140 WeakPolarHBondContact O-CB 3.34Å; A1136-C1140 PolarHBondContact O-N 3.06Å; A1137-C1140 PolarHBondContact O-N 3.49Å; E1138-C1140 VanDerWaalsContact C-N 3.33Å; E1138-C1140 PolarHBondContact O-N 2.68Å; C1140-N1142 VanDerWaalsContact C-N 3.32Å; C1140-N1142 PolarHBondContact O-N 2.87Å; C1140-T1143 CarbonylContact O-C 3.58Å; C1140-T1143 WeakPolarHBondContact O-CA 3.48Å; C1140-T1143 WeakPolarHBondContact O-CB 3.41Å; C1140-T1143 PolarHBondContact O-N 3.22Å; C1140-V1144 WeakPolarHBondContact O-CG2 3.48Å; C1140-V1144 PolarHBondContact O-N 3.11Å
1141	A	94.5	Very high	93.2	Very high	7 Å²	7	50.6 Å²	50.6	6%	0.058	25%	0.248	C	C	.	.	H	α-helix	trans	-57.4	-41.6	176.6	0	0	0	0	0	112.7	V1122 A1137 E1138 T1143 V1144 A1145 M1175	V1122-A1141 HydrophobicContact CG1-CB 3.94Å; A1137-A1141 WeakPolarHBondContact O-CB 3.08Å; A1137-A1141 PolarHBondContact O-N 3.39Å; E1138-A1141 PolarHBondContact O-N 2.98Å; A1141-T1143 VanDerWaalsContact C-N 3.34Å; A1141-V1144 PolarHBondContact O-N 3.28Å; A1141-A1145 WeakPolarHBondContact O-CB 3.34Å; A1141-A1145 PolarHBondContact O-N 2.94Å; A1141-M1175 HydrophobicContact CB-CG 4.4Å; A1141-M1175 HydrophobicContact CB-SD 4.01Å
1142	N	93.9	Very high	93.1	Very high	59 Å²	59	44.5 Å²	44.5	32%	0.316	22%	0.223	S	C	.	.	H	α-helix	trans	-62.7	-40.1	173.1	-71.4	-32.9	0	0	0	111.8	E1138 C1140 A1145 Q1146	E1138-N1142 WeakPolarHBondContact O-CB 3.49Å; E1138-N1142 PolarHBondContact O-N 2.96Å; E1138-N1142 PolarHBondContact O-ND2 2.66Å; C1140-N1142 VanDerWaalsContact C-N 3.32Å; C1140-N1142 PolarHBondContact O-N 2.87Å; N1142-A1145 PolarHBondContact O-N 3.18Å; N1142-Q1146 VanDerWaalsContact O-CG 3.31Å; N1142-Q1146 WeakPolarHBondContact O-CG 3.14Å; N1142-Q1146 PolarHBondContact O-N 3.5Å
1143	T	94	Very high	93	Very high	8 Å²	8	42.2 Å²	42.2	5%	0.049	21%	0.207	C	C	.	.	H	α-helix	trans	-67.3	-42.4	176.3	-54.2	0	0	0	0	111.1	Q1101 V1104 R1105 D1139 C1140 A1141 A1145 Q1146 N1147	Q1101-T1143 HydrophobicContact CG-CG2 4Å; Q1101-T1143 WeakPolarHBondContact CG-OG1 3.25Å; Q1101-T1143 PolarHBondContact NE2-OG1 3.38Å; V1104-T1143 HydrophobicContact CG1-CG2 4.25Å; R1105-T1143 HydrophobicContact CB-CG2 4.13Å; R1105-T1143 PolarHBondContact NH2-OG1 3.19Å; D1139-T1143 WeakPolarHBondContact O-CB 3.4Å; D1139-T1143 PolarHBondContact O-N 3.07Å; D1139-T1143 VanDerWaalsContact O-N 3.07Å; D1139-T1143 PolarHBondContact O-OG1 3.01Å; C1140-T1143 CarbonylContact O-C 3.58Å; C1140-T1143 WeakPolarHBondContact O-CA 3.48Å; C1140-T1143 WeakPolarHBondContact O-CB 3.41Å; C1140-T1143 PolarHBondContact O-N 3.22Å; A1141-T1143 VanDerWaalsContact C-N 3.34Å; T1143-A1145 PolarHBondContact O-N 2.79Å; T1143-Q1146 PolarHBondContact O-N 2.98Å; T1143-Q1146 VanDerWaalsContact O-N 3.15Å; T1143-N1147 WeakPolarHBondContact O-CB 3.32Å; T1143-N1147 PolarHBondContact O-N 3.19Å; T1143-N1147 PolarHBondContact O-ND2 3.03Å
1144	V	93.5	Very high	93	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-60.1	-46.4	175.6	175.6	0	0	0	0	110.7	V1104 F1118 V1119 C1140 A1141 Q1146 N1147 L1148 M1175	V1104-V1144 HydrophobicContact CG1-CG2 3.98Å; V1104-V1144 HydrophobicContact CG2-CG2 4.36Å; F1118-V1144 HydrophobicContact CE1-CG2 3.62Å; F1118-V1144 HydrophobicContact CZ-CG2 3.8Å; V1119-V1144 HydrophobicContact CG2-CG1 4.15Å; C1140-V1144 WeakPolarHBondContact O-CG2 3.48Å; C1140-V1144 PolarHBondContact O-N 3.11Å; A1141-V1144 PolarHBondContact O-N 3.28Å; V1144-Q1146 PolarHBondContact O-N 3.42Å; V1144-Q1146 VanDerWaalsContact O-N 3.09Å; V1144-N1147 PolarHBondContact O-N 2.92Å; V1144-L1148 HydrophobicContact CG1-CB 4.41Å; V1144-L1148 HydrophobicContact CG1-CD1 3.66Å; V1144-L1148 HydrophobicContact CG1-CG 3.97Å; V1144-L1148 PolarHBondContact O-N 2.87Å; V1144-M1175 HydrophobicContact CB-CE 3.77Å; V1144-M1175 HydrophobicContact CG1-CE 3.45Å; V1144-M1175 VanDerWaalsContact CG1-CE 3.45Å
1145	A	92.5	Very high	92.8	Very high	3 Å²	3	45.1 Å²	45.1	3%	0.025	22%	0.221	C	C	.	.	H	α-helix	trans	-66.1	-6.7	177.3	0	0	0	0	0	115	A1141 N1142 T1143 M1175 Q1178 V1179 N1182	A1141-A1145 WeakPolarHBondContact O-CB 3.34Å; A1141-A1145 PolarHBondContact O-N 2.94Å; N1142-A1145 PolarHBondContact O-N 3.18Å; T1143-A1145 PolarHBondContact O-N 2.79Å; A1145-M1175 HydrophobicContact CB-CE 4.43Å; A1145-M1175 HydrophobicContact CB-CG 4.27Å; A1145-Q1178 HydrophobicContact CB-CB 4.11Å; A1145-V1179 HydrophobicContact CB-CG2 3.64Å; A1145-N1182 PolarHBondContact O-ND2 3.16Å
1146	Q	92.1	Very high	92.5	Very high	128 Å²	128	37.2 Å²	37.2	60%	0.598	19%	0.193	S	C	*	.	H	α-helix	trans	-108.2	-26.1	175.3	-72.8	172.2	-4.1	0	0	113.6	N1142 T1143 V1144	N1142-Q1146 VanDerWaalsContact O-CG 3.31Å; N1142-Q1146 WeakPolarHBondContact O-CG 3.14Å; N1142-Q1146 PolarHBondContact O-N 3.5Å; T1143-Q1146 PolarHBondContact O-N 2.98Å; T1143-Q1146 VanDerWaalsContact O-N 3.15Å; V1144-Q1146 PolarHBondContact O-N 3.42Å; V1144-Q1146 VanDerWaalsContact O-N 3.09Å
1147	N	92.2	Very high	92.4	Very high	56 Å²	56	37.1 Å²	37.1	30%	0.299	19%	0.192	S	C	.	.	H	α-helix	trans	-115.8	-23.7	-168.4	-66.7	-98.4	0	0	0	114.1	P1108 T1143 V1144	P1108-N1147 VanDerWaalsContact CB-O 3.3Å; P1108-N1147 WeakPolarHBondContact CB-O 3.36Å; T1143-N1147 WeakPolarHBondContact O-CB 3.32Å; T1143-N1147 PolarHBondContact O-N 3.19Å; T1143-N1147 PolarHBondContact O-ND2 3.03Å; V1144-N1147 PolarHBondContact O-N 2.92Å
1148	L	91	Very high	92.2	Very high	8 Å²	8	37.5 Å²	37.5	4%	0.042	19%	0.194	C	C	.	.	S	Bend	trans	-85.3	154.6	170.1	-69.5	-166.4	0	0	0	111.3	V1104 P1108 F1111 A1115 V1144 Q1150	V1104-L1148 HydrophobicContact CG2-CD1 4.4Å; V1104-L1148 HydrophobicContact CG2-CD2 3.59Å; V1104-L1148 HydrophobicContact CG2-CG 3.8Å; P1108-L1148 HydrophobicContact CB-CD2 3.84Å; F1111-L1148 HydrophobicContact CB-CD2 4.02Å; A1115-L1148 HydrophobicContact CB-CD1 4.43Å; V1144-L1148 HydrophobicContact CG1-CB 4.41Å; V1144-L1148 HydrophobicContact CG1-CD1 3.66Å; V1144-L1148 HydrophobicContact CG1-CG 3.97Å; V1144-L1148 PolarHBondContact O-N 2.87Å; L1148-Q1150 PolarHBondContact O-N 3.47Å
1149	P	89.4	Confident	91.8	Very high	55 Å²	55	34.7 Å²	34.7	36%	0.357	18%	0.181	S	C	.	.			trans	-53.6	135.9	173.7	-26.2	34.8	0	0	0	112.3	E1151 L1152 C1153	P1149-E1151 PolarHBondContact O-N 2.96Å; P1149-L1152 HydrophobicContact CB-CB 4.06Å; P1149-L1152 WeakPolarHBondContact O-CB 3.38Å; P1149-L1152 PolarHBondContact O-N 2.96Å; P1149-C1153 PolarHBondContact O-N 3.47Å; P1149-C1153 PolarHBondContact O-SG 3.38Å; P1149-C1153 VanDerWaalsContact O-SG 3.39Å
1150	Q	90.3	Very high	91.4	Very high	58 Å²	58	30.9 Å²	30.9	27%	0.271	16%	0.161	S	C	.	.	H	α-helix	trans	-64.7	-41.7	-174.2	-66.2	164.8	-7.8	0	0	111.3	L1148 L1152 C1153 L1154 V1179 N1182 L1187	L1148-Q1150 PolarHBondContact O-N 3.47Å; Q1150-L1152 PolarHBondContact O-N 2.94Å; Q1150-C1153 PolarHBondContact O-N 3.21Å; Q1150-L1154 WeakPolarHBondContact O-CG 3.36Å; Q1150-L1154 PolarHBondContact O-N 3.44Å; Q1150-V1179 HydrophobicContact CB-CG1 4.19Å; Q1150-V1179 HydrophobicContact CG-CG1 4.47Å; Q1150-N1182 PolarHBondContact NE2-O 3.44Å; Q1150-L1187 HydrophobicContact CB-CD1 3.91Å; Q1150-L1187 HydrophobicContact CB-CD2 4.43Å
1151	E	89.5	Confident	91.2	Very high	112 Å²	112	31.2 Å²	31.2	52%	0.523	16%	0.163	S	C	.	.	H	α-helix	trans	-56.6	-46.4	173.6	-57.3	173	-165.2	0	0	111.9	P1149 C1153 L1154 N1155 L1187 F1191	P1149-E1151 PolarHBondContact O-N 2.96Å; E1151-C1153 VanDerWaalsContact C-N 3.35Å; E1151-C1153 PolarHBondContact O-N 3.27Å; E1151-L1154 PolarHBondContact O-N 2.94Å; E1151-N1155 VanDerWaalsContact O-CB 3.27Å; E1151-N1155 WeakPolarHBondContact O-CB 3.27Å; E1151-N1155 VanDerWaalsContact O-CG 3.29Å; E1151-N1155 PolarHBondContact O-N 3.38Å; E1151-N1155 PolarHBondContact O-ND2 3.41Å; E1151-L1187 HydrophobicContact CG-CD1 3.69Å; E1151-L1187 HydrophobicContact CG-CG 4.27Å; E1151-F1191 HydrophobicContact CB-CE2 4.36Å; E1151-F1191 HydrophobicContact CB-CZ 4.32Å; E1151-F1191 HydrophobicContact CG-CE2 4.32Å
1152	L	90.5	Very high	90.7	Very high	40 Å²	40	31.1 Å²	31.1	21%	0.209	16%	0.161	C	C	.	.	H	α-helix	trans	-61.7	-43.8	177.4	-176.7	65.1	0	0	0	110.8	A1115 P1149 Q1150 N1155 V1156	A1115-L1152 HydrophobicContact CB-CD1 4.18Å; A1115-L1152 HydrophobicContact CB-CD2 3.77Å; A1115-L1152 HydrophobicContact CB-CG 4Å; P1149-L1152 HydrophobicContact CB-CB 4.06Å; P1149-L1152 WeakPolarHBondContact O-CB 3.38Å; P1149-L1152 PolarHBondContact O-N 2.96Å; Q1150-L1152 PolarHBondContact O-N 2.94Å; L1152-N1155 PolarHBondContact O-N 2.72Å; L1152-V1156 WeakPolarHBondContact O-CG2 3.14Å; L1152-V1156 PolarHBondContact O-N 2.96Å; L1152-V1156 VanDerWaalsContact O-N 3.12Å
1153	C	92.1	Very high	90.2	Very high	2 Å²	2	29 Å²	29	1%	0.014	15%	0.15	C	C	.	.	H	α-helix	trans	-64.8	-43.7	176.7	-64.8	0	0	0	0	112.4	P1149 Q1150 E1151 V1156 L1157 V1179	P1149-C1153 PolarHBondContact O-N 3.47Å; P1149-C1153 PolarHBondContact O-SG 3.38Å; P1149-C1153 VanDerWaalsContact O-SG 3.39Å; Q1150-C1153 PolarHBondContact O-N 3.21Å; E1151-C1153 VanDerWaalsContact C-N 3.35Å; E1151-C1153 PolarHBondContact O-N 3.27Å; C1153-V1156 PolarHBondContact O-N 3.2Å; C1153-L1157 HydrophobicContact CB-CD1 4.39Å; C1153-L1157 VanDerWaalsContact O-CB 3.31Å; C1153-L1157 WeakPolarHBondContact O-CB 3.3Å; C1153-L1157 WeakPolarHBondContact O-CD1 3.31Å; C1153-L1157 VanDerWaalsContact O-CG 3.23Å; C1153-L1157 WeakPolarHBondContact O-CG 3.29Å; C1153-L1157 PolarHBondContact O-N 3.36Å; C1153-V1179 HydrophobicContact CB-CG1 4.06Å; C1153-V1179 HydrophobicContact CB-CG2 3.76Å
1154	L	92.5	Very high	89.3	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.9	-37.2	177.2	-66	-172.5	0	0	0	112.1	Q1150 E1151 V1156 L1157 T1158 Q1176 V1179 I1180 L1187 F1191 L1195	Q1150-L1154 WeakPolarHBondContact O-CG 3.36Å; Q1150-L1154 PolarHBondContact O-N 3.44Å; E1151-L1154 PolarHBondContact O-N 2.94Å; L1154-V1156 VanDerWaalsContact C-N 3.29Å; L1154-V1156 PolarHBondContact O-N 3.01Å; L1154-L1157 PolarHBondContact O-N 3.4Å; L1154-T1158 VanDerWaalsContact O-CB 3.27Å; L1154-T1158 WeakPolarHBondContact O-CB 3.44Å; L1154-T1158 PolarHBondContact O-N 3.02Å; L1154-T1158 PolarHBondContact O-OG1 3.4Å; L1154-Q1176 HydrophobicContact CD2-CG 3.88Å; L1154-V1179 HydrophobicContact CD2-CB 4.14Å; L1154-V1179 HydrophobicContact CD2-CG1 3.63Å; L1154-V1179 HydrophobicContact CG-CG1 3.86Å; L1154-I1180 HydrophobicContact CD2-CG1 4.3Å; L1154-L1187 HydrophobicContact CD1-CD2 3.57Å; L1154-F1191 HydrophobicContact CB-CD1 3.69Å; L1154-F1191 HydrophobicContact CB-CE1 3.65Å; L1154-F1191 HydrophobicContact CB-CG 4.28Å; L1154-F1191 HydrophobicContact CB-CZ 4.22Å; L1154-F1191 HydrophobicContact CD1-CB 3.93Å; L1154-F1191 HydrophobicContact CD1-CD1 3.98Å; L1154-F1191 HydrophobicContact CD1-CD2 4.03Å; L1154-F1191 HydrophobicContact CD1-CG 3.7Å; L1154-L1195 HydrophobicContact CD2-CD2 4.15Å
1155	N	89.8	Confident	88.4	Confident	92 Å²	92	37.7 Å²	37.7	49%	0.492	20%	0.195	S	C	.	.	H	α-helix	trans	-63.4	-30.3	174.4	-81.3	-42	0	0	0	113.1	E1151 L1152 P1159 F1191	E1151-N1155 VanDerWaalsContact O-CB 3.27Å; E1151-N1155 WeakPolarHBondContact O-CB 3.27Å; E1151-N1155 VanDerWaalsContact O-CG 3.29Å; E1151-N1155 PolarHBondContact O-N 3.38Å; E1151-N1155 PolarHBondContact O-ND2 3.41Å; L1152-N1155 PolarHBondContact O-N 2.72Å; N1155-P1159 WeakPolarHBondContact O-CD 3.48Å; N1155-P1159 WeakPolarHBondContact O-CG 3.39Å; N1155-F1191 WeakPolarHBondContact OD1-CE1 3.21Å
1156	V	90	Very high	87.7	Confident	9 Å²	9	39.6 Å²	39.6	6%	0.055	20%	0.204	C	C	.	.	H	α-helix	trans	-86.3	-39.1	174.1	179.2	0	0	0	0	112.4	Y1116 V1119 L1152 C1153 L1154 P1159 L1160	Y1116-V1156 HydrophobicContact CD2-CG1 4.01Å; Y1116-V1156 HydrophobicContact CD2-CG2 4.2Å; Y1116-V1156 HydrophobicContact CE2-CG1 4.5Å; V1119-V1156 HydrophobicContact CB-CG1 3.9Å; V1119-V1156 HydrophobicContact CG1-CG1 3.79Å; L1152-V1156 WeakPolarHBondContact O-CG2 3.14Å; L1152-V1156 PolarHBondContact O-N 2.96Å; L1152-V1156 VanDerWaalsContact O-N 3.12Å; C1153-V1156 PolarHBondContact O-N 3.2Å; L1154-V1156 VanDerWaalsContact C-N 3.29Å; L1154-V1156 PolarHBondContact O-N 3.01Å; V1156-P1159 WeakPolarHBondContact O-CG 3.43Å; V1156-L1160 HydrophobicContact CG1-CD1 4.44Å; V1156-L1160 WeakPolarHBondContact O-CD1 3.08Å; V1156-L1160 WeakPolarHBondContact O-CG 3.46Å
1157	L	92.5	Very high	87.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-77.4	-36.8	-173.3	-71.3	165.3	0	0	0	113.7	V1119 L1123 C1153 L1154 L1160 I1161 A1172 M1175 Q1176 V1179	V1119-L1157 HydrophobicContact CG1-CD2 4.25Å; L1123-L1157 HydrophobicContact CD1-CD2 3.83Å; C1153-L1157 HydrophobicContact CB-CD1 4.39Å; C1153-L1157 VanDerWaalsContact O-CB 3.31Å; C1153-L1157 WeakPolarHBondContact O-CB 3.3Å; C1153-L1157 WeakPolarHBondContact O-CD1 3.31Å; C1153-L1157 VanDerWaalsContact O-CG 3.23Å; C1153-L1157 WeakPolarHBondContact O-CG 3.29Å; C1153-L1157 PolarHBondContact O-N 3.36Å; L1154-L1157 PolarHBondContact O-N 3.4Å; L1157-L1160 PolarHBondContact O-N 2.95Å; L1157-I1161 HydrophobicContact CB-CD1 4.35Å; L1157-I1161 WeakPolarHBondContact O-CG1 3.35Å; L1157-I1161 PolarHBondContact O-N 3Å; L1157-A1172 HydrophobicContact CD2-CB 4.22Å; L1157-M1175 HydrophobicContact CD1-CB 4.21Å; L1157-M1175 HydrophobicContact CD1-CE 4.5Å; L1157-M1175 HydrophobicContact CD1-CG 3.9Å; L1157-M1175 HydrophobicContact CD1-SD 4.23Å; L1157-M1175 HydrophobicContact CD2-CB 4.14Å; L1157-M1175 HydrophobicContact CD2-CG 4.27Å; L1157-M1175 HydrophobicContact CD2-SD 3.94Å; L1157-Q1176 HydrophobicContact CB-CB 4.34Å; L1157-Q1176 HydrophobicContact CB-CG 4.47Å; L1157-Q1176 HydrophobicContact CD1-CB 4.19Å; L1157-V1179 HydrophobicContact CD1-CG2 4.07Å
1158	T	90.4	Very high	87.1	Confident	7 Å²	7	38.6 Å²	38.6	4%	0.043	20%	0.198	C	C	.	.	H	α-helix	trans	-64.2	-46.3	-177.1	-49.2	0	0	0	0	113.3	L1154 L1160 I1161 N1162 Q1176 A1194	L1154-T1158 VanDerWaalsContact O-CB 3.27Å; L1154-T1158 WeakPolarHBondContact O-CB 3.44Å; L1154-T1158 PolarHBondContact O-N 3.02Å; L1154-T1158 PolarHBondContact O-OG1 3.4Å; T1158-L1160 PolarHBondContact O-N 3.1Å; T1158-I1161 PolarHBondContact O-N 3.36Å; T1158-N1162 PolarHBondContact O-N 3.45Å; T1158-N1162 VanDerWaalsContact O-N 3.1Å; T1158-N1162 PolarHBondContact O-OD1 2.92Å; T1158-Q1176 PolarHBondContact OG1-NE2 3.18Å; T1158-A1194 HydrophobicContact CG2-CB 3.97Å; T1158-A1194 WeakPolarHBondContact CG2-O 3.05Å
1159	P	86.1	Confident	87	Confident	4 Å²	4	38.6 Å²	38.6	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-45.4	-47	168.1	-11.3	-1.9	0	0	0	114	G872 N1155 V1156	G872-P1159 WeakPolarHBondContact O-CB 3.32Å; G872-P1159 WeakPolarHBondContact O-CG 3.45Å; N1155-P1159 WeakPolarHBondContact O-CD 3.48Å; N1155-P1159 WeakPolarHBondContact O-CG 3.39Å; V1156-P1159 WeakPolarHBondContact O-CG 3.43Å
1160	L	87.6	Confident	87.2	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-70.3	-47.5	-173.7	-56.7	172.9	0	0	0	110.7	M879 I1120 L1123 V1156 L1157 T1158 N1162 D1163 L1166 I1168 N1169	M879-L1160 HydrophobicContact CE-CD2 3.98Å; M879-L1160 HydrophobicContact SD-CD2 4.02Å; I1120-L1160 HydrophobicContact CD1-CD2 4.07Å; I1120-L1160 HydrophobicContact CG1-CD1 3.97Å; I1120-L1160 HydrophobicContact CG1-CD2 4.23Å; L1123-L1160 HydrophobicContact CD1-CD1 3.77Å; V1156-L1160 HydrophobicContact CG1-CD1 4.44Å; V1156-L1160 WeakPolarHBondContact O-CD1 3.08Å; V1156-L1160 WeakPolarHBondContact O-CG 3.46Å; L1157-L1160 PolarHBondContact O-N 2.95Å; T1158-L1160 PolarHBondContact O-N 3.1Å; L1160-N1162 VanDerWaalsContact C-N 3.3Å; L1160-N1162 PolarHBondContact O-N 2.69Å; L1160-D1163 PolarHBondContact O-N 3.46Å; L1160-D1163 VanDerWaalsContact O-N 3.11Å; L1160-L1166 HydrophobicContact CB-CD1 4.19Å; L1160-L1166 HydrophobicContact CD2-CD1 3.74Å; L1160-I1168 HydrophobicContact CD1-CD1 4.12Å; L1160-I1168 HydrophobicContact CD2-CD1 4.31Å; L1160-N1169 PolarHBondContact O-OD1 2.95Å
1161	I	90.5	Very high	87.3	Confident	7 Å²	7	35.8 Å²	35.8	4%	0.036	18%	0.182	C	C	.	.	H	α-helix	trans	-66.2	-31.1	-177.5	-66.4	165.6	0	0	0	112.5	L1157 T1158 D1163 N1169 A1172 I1173 Q1176 L1199	L1157-I1161 HydrophobicContact CB-CD1 4.35Å; L1157-I1161 WeakPolarHBondContact O-CG1 3.35Å; L1157-I1161 PolarHBondContact O-N 3Å; T1158-I1161 PolarHBondContact O-N 3.36Å; I1161-D1163 VanDerWaalsContact C-N 3.32Å; I1161-N1169 WeakPolarHBondContact CA-OD1 3.21Å; I1161-A1172 HydrophobicContact CD1-CB 4.1Å; I1161-A1172 HydrophobicContact CG1-CB 3.6Å; I1161-I1173 HydrophobicContact CB-CG1 4.44Å; I1161-I1173 HydrophobicContact CD1-CG1 4.08Å; I1161-I1173 HydrophobicContact CG1-CG1 3.91Å; I1161-I1173 HydrophobicContact CG2-CD1 4.3Å; I1161-I1173 HydrophobicContact CG2-CG1 3.73Å; I1161-Q1176 HydrophobicContact CD1-CB 3.6Å; I1161-Q1176 HydrophobicContact CD1-CG 4.02Å; I1161-L1199 HydrophobicContact CG2-CD2 4.48Å
1162	N	85.2	Confident	87.5	Confident	4 Å²	4	30.4 Å²	30.4	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-69.8	-30.4	176	-70.6	9.4	0	0	0	111.2	D870 R873 T1158 L1160 S1164 G1198	D870-N1162 PolarHBondContact OD1-ND2 2.86Å; R873-N1162 HydrophobicContact CG-CB 4.42Å; R873-N1162 PolarHBondContact NH2-O 2.83Å; T1158-N1162 PolarHBondContact O-N 3.45Å; T1158-N1162 VanDerWaalsContact O-N 3.1Å; T1158-N1162 PolarHBondContact O-OD1 2.92Å; L1160-N1162 VanDerWaalsContact C-N 3.3Å; L1160-N1162 PolarHBondContact O-N 2.69Å; N1162-S1164 PolarHBondContact O-N 2.92Å; N1162-G1198 WeakPolarHBondContact OD1-CA 3.42Å; N1162-G1198 PolarHBondContact OD1-N 3.08Å
1163	D	83.1	Confident	87.7	Confident	15 Å²	15	28.6 Å²	28.6	8%	0.08	15%	0.148	C	C	.	.			trans	-82.9	90.8	174.6	-169.7	-1	0	0	0	113.1	L1160 I1161 Q1165 L1166 N1169	L1160-D1163 PolarHBondContact O-N 3.46Å; L1160-D1163 VanDerWaalsContact O-N 3.11Å; I1161-D1163 VanDerWaalsContact C-N 3.32Å; D1163-Q1165 PolarHBondContact O-N 3.44Å; D1163-Q1165 WeakPolarHBondContact OD1-CB 3.48Å; D1163-Q1165 PolarHBondContact OD1-N 3.15Å; D1163-L1166 HydrophobicContact CB-CD1 3.98Å; D1163-L1166 HydrophobicContact CB-CG 3.98Å; D1163-L1166 WeakPolarHBondContact O-CB 3.41Å; D1163-L1166 PolarHBondContact O-N 3.19Å; D1163-N1169 PolarHBondContact O-ND2 2.81Å
1164	S	73.5	Confident	87.8	Confident	46 Å²	46	32.7 Å²	32.7	32%	0.322	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.5	-25.4	171.9	62.9	0	0	0	0	116.3	N1162 N1169	N1162-S1164 PolarHBondContact O-N 2.92Å; S1164-N1169 WeakPolarHBondContact CA-ND2 3.23Å; S1164-N1169 PolarHBondContact O-ND2 3.42Å
1165	Q	74.7	Confident	87.9	Confident	146 Å²	146	33 Å²	33	68%	0.682	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-19.7	-178.6	-55.9	-56.2	-72.3	0	0	112.7	D1163 H1167	D1163-Q1165 PolarHBondContact O-N 3.44Å; D1163-Q1165 WeakPolarHBondContact OD1-CB 3.48Å; D1163-Q1165 PolarHBondContact OD1-N 3.15Å; Q1165-H1167 PolarHBondContact O-N 2.87Å
1166	L	78.4	Confident	88.1	Confident	42 Å²	42	28.7 Å²	28.7	22%	0.22	14%	0.144	C	C	.	.			trans	-71.1	116.4	-179.8	-67.3	179.9	0	0	0	111.4	M879 L1160 D1163 I1168 N1169	M879-L1166 HydrophobicContact CE-CD1 4.33Å; M879-L1166 HydrophobicContact SD-CD1 4.17Å; L1160-L1166 HydrophobicContact CB-CD1 4.19Å; L1160-L1166 HydrophobicContact CD2-CD1 3.74Å; D1163-L1166 HydrophobicContact CB-CD1 3.98Å; D1163-L1166 HydrophobicContact CB-CG 3.98Å; D1163-L1166 WeakPolarHBondContact O-CB 3.41Å; D1163-L1166 PolarHBondContact O-N 3.19Å; L1166-I1168 HydrophobicContact CB-CG1 4.13Å; L1166-I1168 PolarHBondContact O-N 2.87Å; L1166-N1169 WeakPolarHBondContact O-CB 3.35Å; L1166-N1169 PolarHBondContact O-N 3.46Å; L1166-N1169 PolarHBondContact O-ND2 2.69Å
1167	H	82	Confident	88.4	Confident	146 Å²	146	30.1 Å²	30.1	68%	0.676	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.8	178.5	-58.9	-43.5	0	0	0	113.8	R1127 Q1165 N1169	R1127-H1167 WeakPolarHBondContact CD-O 3.41Å; R1127-H1167 PolarHBondContact NE-O 2.95Å; Q1165-H1167 PolarHBondContact O-N 2.87Å; H1167-N1169 VanDerWaalsContact C-N 3.25Å; H1167-N1169 PolarHBondContact O-N 3.33Å
1168	I	90.5	Very high	88.4	Confident	18 Å²	18	32.9 Å²	32.9	9%	0.092	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	4.8	174.6	60.5	170.5	0	0	0	114.6	L1123 E1124 L1160 L1166 L1170 P1171 A1172	L1123-I1168 HydrophobicContact CB-CB 4.25Å; L1123-I1168 HydrophobicContact CB-CD1 4.2Å; L1123-I1168 HydrophobicContact CB-CG2 4.41Å; L1123-I1168 HydrophobicContact CD1-CD1 4.41Å; E1124-I1168 HydrophobicContact CG-CG2 4.15Å; L1160-I1168 HydrophobicContact CD1-CD1 4.12Å; L1160-I1168 HydrophobicContact CD2-CD1 4.31Å; L1166-I1168 HydrophobicContact CB-CG1 4.13Å; L1166-I1168 PolarHBondContact O-N 2.87Å; I1168-L1170 PolarHBondContact O-N 2.67Å; I1168-P1171 HydrophobicContact CB-CG 4.39Å; I1168-P1171 WeakPolarHBondContact O-CD 3.49Å; I1168-P1171 VanDerWaalsContact O-CG 3.27Å; I1168-P1171 WeakPolarHBondContact O-CG 3.3Å; I1168-A1172 VanDerWaalsContact O-CB 3.29Å; I1168-A1172 WeakPolarHBondContact O-CB 3.31Å; I1168-A1172 PolarHBondContact O-N 3.27Å
1169	N	88.5	Confident	88.6	Confident	7 Å²	7	32.6 Å²	32.6	4%	0.037	16%	0.161	C	C	.	.	H	α-helix	trans	-54.9	-42.7	179	-86.7	-38.1	0	0	0	114.5	L1160 I1161 D1163 S1164 L1166 H1167 A1172 I1173 I1210	L1160-N1169 PolarHBondContact O-OD1 2.95Å; I1161-N1169 WeakPolarHBondContact CA-OD1 3.21Å; D1163-N1169 PolarHBondContact O-ND2 2.81Å; S1164-N1169 WeakPolarHBondContact CA-ND2 3.23Å; S1164-N1169 PolarHBondContact O-ND2 3.42Å; L1166-N1169 WeakPolarHBondContact O-CB 3.35Å; L1166-N1169 PolarHBondContact O-N 3.46Å; L1166-N1169 PolarHBondContact O-ND2 2.69Å; H1167-N1169 VanDerWaalsContact C-N 3.25Å; H1167-N1169 PolarHBondContact O-N 3.33Å; N1169-A1172 PolarHBondContact O-N 3.41Å; N1169-I1173 VanDerWaalsContact O-CG1 3.27Å; N1169-I1173 WeakPolarHBondContact O-CG1 3.41Å; N1169-I1173 PolarHBondContact O-N 3.5Å; N1169-I1210 HydrophobicContact CB-CD1 4.18Å
1170	L	92.8	Very high	89	Confident	42 Å²	42	32.4 Å²	32.4	22%	0.22	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-52	-179.5	-178.2	60.4	0	0	0	113.4	I1168 A1172 K1174 A1209 I1210 A1213	I1168-L1170 PolarHBondContact O-N 2.67Å; L1170-A1172 VanDerWaalsContact C-N 3.33Å; L1170-K1174 WeakPolarHBondContact O-CG 3.23Å; L1170-K1174 PolarHBondContact O-N 2.7Å; L1170-A1209 HydrophobicContact CD1-CB 4.03Å; L1170-A1209 HydrophobicContact CD2-CB 3.79Å; L1170-I1210 HydrophobicContact CB-CD1 4.3Å; L1170-I1210 HydrophobicContact CB-CG1 3.86Å; L1170-I1210 HydrophobicContact CD1-CG1 4.02Å; L1170-I1210 HydrophobicContact CG-CG1 4.45Å; L1170-A1213 HydrophobicContact CD1-CB 3.91Å
1171	P	93.6	Very high	89.2	Confident	12 Å²	12	36.8 Å²	36.8	8%	0.078	18%	0.181	C	C	.	.	H	α-helix	trans	-66.7	-31.7	174	25	-33	0	0	0	113	L1123 C1126 R1127 I1168 K1174 M1175	L1123-P1171 HydrophobicContact CD2-CB 3.9Å; L1123-P1171 HydrophobicContact CD2-CG 4.41Å; C1126-P1171 HydrophobicContact CB-CB 3.57Å; C1126-P1171 HydrophobicContact CB-CG 3.99Å; R1127-P1171 HydrophobicContact CG-CG 4.19Å; I1168-P1171 HydrophobicContact CB-CG 4.39Å; I1168-P1171 WeakPolarHBondContact O-CD 3.49Å; I1168-P1171 VanDerWaalsContact O-CG 3.27Å; I1168-P1171 WeakPolarHBondContact O-CG 3.3Å; P1171-K1174 WeakPolarHBondContact O-CB 3.43Å; P1171-K1174 PolarHBondContact O-N 3.02Å; P1171-M1175 WeakPolarHBondContact O-CB 3.46Å; P1171-M1175 PolarHBondContact O-N 3.25Å
1172	A	93.8	Very high	89.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-47.1	175.7	0	0	0	0	0	111.7	L1123 L1157 I1161 I1168 N1169 L1170 K1174 M1175 Q1176	L1123-A1172 HydrophobicContact CD1-CB 4.16Å; L1123-A1172 HydrophobicContact CD2-CB 4.48Å; L1157-A1172 HydrophobicContact CD2-CB 4.22Å; I1161-A1172 HydrophobicContact CD1-CB 4.1Å; I1161-A1172 HydrophobicContact CG1-CB 3.6Å; I1168-A1172 VanDerWaalsContact O-CB 3.29Å; I1168-A1172 WeakPolarHBondContact O-CB 3.31Å; I1168-A1172 PolarHBondContact O-N 3.27Å; N1169-A1172 PolarHBondContact O-N 3.41Å; L1170-A1172 VanDerWaalsContact C-N 3.33Å; A1172-K1174 VanDerWaalsContact C-N 3.35Å; A1172-K1174 PolarHBondContact O-N 2.7Å; A1172-M1175 PolarHBondContact O-N 3.26Å; A1172-Q1176 WeakPolarHBondContact O-CB 3.46Å; A1172-Q1176 PolarHBondContact O-N 3.45Å
1173	I	94.1	Very high	89.5	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-62.8	-39.8	176.4	-64.3	164.5	0	0	0	111.3	I1161 N1169 Q1176 M1177 L1199 A1202 I1210 A1213 C1217	I1161-I1173 HydrophobicContact CB-CG1 4.44Å; I1161-I1173 HydrophobicContact CD1-CG1 4.08Å; I1161-I1173 HydrophobicContact CG1-CG1 3.91Å; I1161-I1173 HydrophobicContact CG2-CD1 4.3Å; I1161-I1173 HydrophobicContact CG2-CG1 3.73Å; N1169-I1173 VanDerWaalsContact O-CG1 3.27Å; N1169-I1173 WeakPolarHBondContact O-CG1 3.41Å; N1169-I1173 PolarHBondContact O-N 3.5Å; I1173-Q1176 PolarHBondContact O-N 3.39Å; I1173-M1177 WeakPolarHBondContact O-CB 3.24Å; I1173-M1177 PolarHBondContact O-N 3.45Å; I1173-L1199 HydrophobicContact CG2-CD2 4.16Å; I1173-A1202 HydrophobicContact CD1-CB 3.79Å; I1173-I1210 HydrophobicContact CD1-CG2 3.93Å; I1173-A1213 HydrophobicContact CB-CB 4.36Å; I1173-A1213 HydrophobicContact CG2-CB 3.75Å; I1173-C1217 HydrophobicContact CG2-CB 4.14Å
1174	K	94.6	Very high	89.9	Confident	88 Å²	88	40.9 Å²	40.9	38%	0.383	21%	0.207	S	C	.	.	H	α-helix	trans	-57.8	-47.5	173.1	-76.7	176.9	171.4	179.8	0	111.5	E1138 L1170 P1171 A1172 M1177 Q1178	E1138-K1174 IonicContact OE1-NZ 3.54Å; E1138-K1174 PolarHBondContact OE1-NZ 3.13Å; L1170-K1174 WeakPolarHBondContact O-CG 3.23Å; L1170-K1174 PolarHBondContact O-N 2.7Å; P1171-K1174 WeakPolarHBondContact O-CB 3.43Å; P1171-K1174 PolarHBondContact O-N 3.02Å; A1172-K1174 VanDerWaalsContact C-N 3.35Å; A1172-K1174 PolarHBondContact O-N 2.7Å; K1174-M1177 WeakPolarHBondContact O-CB 3.48Å; K1174-M1177 PolarHBondContact O-N 3.49Å; K1174-Q1178 PolarHBondContact O-N 3.45Å
1175	M	94.4	Very high	90.6	Very high	7 Å²	7	41.4 Å²	41.4	3%	0.034	21%	0.209	C	C	.	.	H	α-helix	trans	-68.8	-41.5	-178.2	-169.7	178.2	172.2	0	0	111.5	V1119 L1123 A1141 V1144 A1145 L1157 P1171 A1172 M1177 Q1178 V1179	V1119-M1175 HydrophobicContact CG1-CE 4.39Å; V1119-M1175 HydrophobicContact CG1-SD 4.28Å; V1119-M1175 HydrophobicContact CG2-CE 4.42Å; L1123-M1175 HydrophobicContact CD2-CB 4.43Å; L1123-M1175 HydrophobicContact CD2-SD 4.09Å; A1141-M1175 HydrophobicContact CB-CG 4.4Å; A1141-M1175 HydrophobicContact CB-SD 4.01Å; V1144-M1175 HydrophobicContact CB-CE 3.77Å; V1144-M1175 HydrophobicContact CG1-CE 3.45Å; V1144-M1175 VanDerWaalsContact CG1-CE 3.45Å; A1145-M1175 HydrophobicContact CB-CE 4.43Å; A1145-M1175 HydrophobicContact CB-CG 4.27Å; L1157-M1175 HydrophobicContact CD1-CB 4.21Å; L1157-M1175 HydrophobicContact CD1-CE 4.5Å; L1157-M1175 HydrophobicContact CD1-CG 3.9Å; L1157-M1175 HydrophobicContact CD1-SD 4.23Å; L1157-M1175 HydrophobicContact CD2-CB 4.14Å; L1157-M1175 HydrophobicContact CD2-CG 4.27Å; L1157-M1175 HydrophobicContact CD2-SD 3.94Å; P1171-M1175 WeakPolarHBondContact O-CB 3.46Å; P1171-M1175 PolarHBondContact O-N 3.25Å; A1172-M1175 PolarHBondContact O-N 3.26Å; M1175-M1177 VanDerWaalsContact C-N 3.31Å; M1175-M1177 PolarHBondContact O-N 3.39Å; M1175-Q1178 WeakPolarHBondContact O-CB 3.39Å; M1175-Q1178 PolarHBondContact O-N 3.42Å; M1175-Q1178 VanDerWaalsContact O-N 3.15Å; M1175-V1179 WeakPolarHBondContact O-CG2 3.24Å; M1175-V1179 PolarHBondContact O-N 2.93Å
1176	Q	94.8	Very high	91.2	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-62.5	-38.6	176.5	-166.9	-170.3	59.4	0	0	111.6	L1154 L1157 T1158 I1161 A1172 I1173 Q1178 V1179 I1180 L1195	L1154-Q1176 HydrophobicContact CD2-CG 3.88Å; L1157-Q1176 HydrophobicContact CB-CB 4.34Å; L1157-Q1176 HydrophobicContact CB-CG 4.47Å; L1157-Q1176 HydrophobicContact CD1-CB 4.19Å; T1158-Q1176 PolarHBondContact OG1-NE2 3.18Å; I1161-Q1176 HydrophobicContact CD1-CB 3.6Å; I1161-Q1176 HydrophobicContact CD1-CG 4.02Å; A1172-Q1176 WeakPolarHBondContact O-CB 3.46Å; A1172-Q1176 PolarHBondContact O-N 3.45Å; I1173-Q1176 PolarHBondContact O-N 3.39Å; Q1176-Q1178 PolarHBondContact O-N 3.25Å; Q1176-V1179 PolarHBondContact O-N 2.84Å; Q1176-I1180 HydrophobicContact CG-CD1 3.9Å; Q1176-I1180 WeakPolarHBondContact O-CB 3.41Å; Q1176-I1180 WeakPolarHBondContact O-CD1 3.49Å; Q1176-I1180 VanDerWaalsContact O-CG1 3.27Å; Q1176-I1180 WeakPolarHBondContact O-CG1 3.46Å; Q1176-I1180 PolarHBondContact O-N 3.02Å; Q1176-L1195 HydrophobicContact CG-CD2 4.26Å
1177	M	94.6	Very high	91.8	Very high	39 Å²	39	39.7 Å²	39.7	19%	0.192	20%	0.2	C	C	.	.	H	α-helix	trans	-59	-43.3	172.9	-178.2	-174.5	73.6	0	0	112	I1173 K1174 M1175 I1180 Q1181 F1216 C1217 A1220	I1173-M1177 WeakPolarHBondContact O-CB 3.24Å; I1173-M1177 PolarHBondContact O-N 3.45Å; K1174-M1177 WeakPolarHBondContact O-CB 3.48Å; K1174-M1177 PolarHBondContact O-N 3.49Å; M1175-M1177 VanDerWaalsContact C-N 3.31Å; M1175-M1177 PolarHBondContact O-N 3.39Å; M1177-I1180 PolarHBondContact O-N 3.4Å; M1177-Q1181 VanDerWaalsContact O-CG 3.28Å; M1177-Q1181 WeakPolarHBondContact O-CG 3.26Å; M1177-Q1181 PolarHBondContact O-N 2.95Å; M1177-Q1181 PolarHBondContact O-OE1 3.39Å; M1177-F1216 HydrophobicContact SD-CB 3.72Å; M1177-C1217 HydrophobicContact CB-CB 4.19Å; M1177-A1220 HydrophobicContact CG-CB 4.18Å
1178	Q	94.1	Very high	92.2	Very high	58 Å²	58	32.8 Å²	32.8	27%	0.271	17%	0.168	S	C	.	.	H	α-helix	trans	-64.6	-44.8	175.6	-66.6	-69.2	-17.4	0	0	111.9	A1145 K1174 M1175 Q1176 I1180 Q1181 N1182	A1145-Q1178 HydrophobicContact CB-CB 4.11Å; K1174-Q1178 PolarHBondContact O-N 3.45Å; M1175-Q1178 WeakPolarHBondContact O-CB 3.39Å; M1175-Q1178 PolarHBondContact O-N 3.42Å; M1175-Q1178 VanDerWaalsContact O-N 3.15Å; Q1176-Q1178 PolarHBondContact O-N 3.25Å; Q1178-I1180 VanDerWaalsContact C-N 3.33Å; Q1178-I1180 PolarHBondContact O-N 2.86Å; Q1178-Q1181 PolarHBondContact O-N 3.34Å; Q1178-N1182 PolarHBondContact O-N 2.7Å; Q1178-N1182 PolarHBondContact O-ND2 2.81Å
1179	V	94.3	Very high	92.2	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-58.8	-45.5	175.6	177.3	0	0	0	0	110.6	A1145 Q1150 C1153 L1154 L1157 M1175 Q1176 Q1181 N1182 S1183	A1145-V1179 HydrophobicContact CB-CG2 3.64Å; Q1150-V1179 HydrophobicContact CB-CG1 4.19Å; Q1150-V1179 HydrophobicContact CG-CG1 4.47Å; C1153-V1179 HydrophobicContact CB-CG1 4.06Å; C1153-V1179 HydrophobicContact CB-CG2 3.76Å; L1154-V1179 HydrophobicContact CD2-CB 4.14Å; L1154-V1179 HydrophobicContact CD2-CG1 3.63Å; L1154-V1179 HydrophobicContact CG-CG1 3.86Å; L1157-V1179 HydrophobicContact CD1-CG2 4.07Å; M1175-V1179 WeakPolarHBondContact O-CG2 3.24Å; M1175-V1179 PolarHBondContact O-N 2.93Å; Q1176-V1179 PolarHBondContact O-N 2.84Å; V1179-Q1181 PolarHBondContact O-N 2.76Å; V1179-N1182 CarbonylContact O-C 3.5Å; V1179-N1182 PolarHBondContact O-N 3.11Å; V1179-S1183 WeakPolarHBondContact O-CB 3.28Å; V1179-S1183 PolarHBondContact O-N 2.71Å; V1179-S1183 PolarHBondContact O-OG 2.95Å
1180	I	93.9	Very high	92.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.8	-39	177.7	-71.3	162.5	0	0	0	111.6	L1154 Q1176 M1177 Q1178 N1182 S1183 V1188 L1195 A1220 I1221 K1224	L1154-I1180 HydrophobicContact CD2-CG1 4.3Å; Q1176-I1180 HydrophobicContact CG-CD1 3.9Å; Q1176-I1180 WeakPolarHBondContact O-CB 3.41Å; Q1176-I1180 WeakPolarHBondContact O-CD1 3.49Å; Q1176-I1180 VanDerWaalsContact O-CG1 3.27Å; Q1176-I1180 WeakPolarHBondContact O-CG1 3.46Å; Q1176-I1180 PolarHBondContact O-N 3.02Å; M1177-I1180 PolarHBondContact O-N 3.4Å; Q1178-I1180 VanDerWaalsContact C-N 3.33Å; Q1178-I1180 PolarHBondContact O-N 2.86Å; I1180-N1182 VanDerWaalsContact C-N 3.32Å; I1180-N1182 PolarHBondContact O-N 3.45Å; I1180-S1183 PolarHBondContact O-N 3.15Å; I1180-V1188 HydrophobicContact CG2-CG2 4.17Å; I1180-L1195 HydrophobicContact CD1-CD1 4.09Å; I1180-L1195 HydrophobicContact CD1-CD2 4.43Å; I1180-L1195 HydrophobicContact CG1-CD1 4.43Å; I1180-A1220 HydrophobicContact CG2-CB 4.11Å; I1180-I1221 HydrophobicContact CD1-CD1 4.05Å; I1180-I1221 HydrophobicContact CD1-CG1 3.88Å; I1180-I1221 HydrophobicContact CG2-CG1 3.91Å; I1180-K1224 VanDerWaalsContact O-CE 3.24Å; I1180-K1224 WeakPolarHBondContact O-CE 3.38Å
1181	Q	92.5	Very high	92.2	Very high	92 Å²	92	39.6 Å²	39.6	43%	0.43	20%	0.198	S	C	.	.	H	α-helix	trans	-62.1	-39.6	175	-75.1	172.4	-53.4	0	0	111.8	M1177 Q1178 V1179 A1220 K1224	M1177-Q1181 VanDerWaalsContact O-CG 3.28Å; M1177-Q1181 WeakPolarHBondContact O-CG 3.26Å; M1177-Q1181 PolarHBondContact O-N 2.95Å; M1177-Q1181 PolarHBondContact O-OE1 3.39Å; Q1178-Q1181 PolarHBondContact O-N 3.34Å; V1179-Q1181 PolarHBondContact O-N 2.76Å; Q1181-A1220 HydrophobicContact CG-CB 4.01Å; Q1181-K1224 WeakPolarHBondContact O-CE 3.43Å; Q1181-K1224 PolarHBondContact O-NZ 2.9Å
1182	N	90.9	Very high	92	Very high	65 Å²	65	39 Å²	39	35%	0.348	19%	0.194	S	C	.	.	H	α-helix	trans	-75.8	-20.2	175	-63.4	-22.3	0	0	0	113.7	A1145 Q1150 Q1178 V1179 I1180	A1145-N1182 PolarHBondContact O-ND2 3.16Å; Q1150-N1182 PolarHBondContact NE2-O 3.44Å; Q1178-N1182 PolarHBondContact O-N 2.7Å; Q1178-N1182 PolarHBondContact O-ND2 2.81Å; V1179-N1182 CarbonylContact O-C 3.5Å; V1179-N1182 PolarHBondContact O-N 3.11Å; I1180-N1182 VanDerWaalsContact C-N 3.32Å; I1180-N1182 PolarHBondContact O-N 3.45Å
1183	S	91.4	Very high	91.8	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.014	20%	0.2	C	C	.	.	S	Bend	trans	-74.1	152.1	-171.6	-66	0	0	0	0	114.5	V1179 I1180 K1224	V1179-S1183 WeakPolarHBondContact O-CB 3.28Å; V1179-S1183 PolarHBondContact O-N 2.71Å; V1179-S1183 PolarHBondContact O-OG 2.95Å; I1180-S1183 PolarHBondContact O-N 3.15Å; S1183-K1224 WeakPolarHBondContact O-CE 3.18Å; S1183-K1224 PolarHBondContact O-NZ 3.33Å
1184	S	89.8	Confident	91.5	Very high	46 Å²	46	41.1 Å²	41.1	32%	0.322	21%	0.208	S	C	.	.			trans	-68.4	150.8	167.8	99.9	0	0	0	0	110.6	E1186 L1187 V1188	S1184-E1186 WeakPolarHBondContact CB-OE2 3.41Å; S1184-E1186 PolarHBondContact O-N 2.69Å; S1184-E1186 PolarHBondContact OG-N 2.84Å; S1184-E1186 PolarHBondContact OG-OE2 3.12Å; S1184-L1187 PolarHBondContact O-N 3.33Å; S1184-L1187 PolarHBondContact OG-N 2.98Å; S1184-V1188 WeakPolarHBondContact O-CG2 3.19Å; S1184-V1188 PolarHBondContact O-N 3.36Å; S1184-V1188 VanDerWaalsContact O-N 3.1Å
1185	P	88.6	Confident	91.4	Very high	56 Å²	56	36.9 Å²	36.9	36%	0.364	19%	0.19	S	C	.	.	H	α-helix	trans	-64.6	-28.7	178.8	27.2	-34	0	0	0	112.5	H1189 K1224	P1185-H1189 WeakPolarHBondContact O-CB 3.5Å; P1185-H1189 PolarHBondContact O-N 2.86Å; P1185-K1224 HydrophobicContact CB-CB 4.46Å; P1185-K1224 WeakPolarHBondContact CB-O 3.37Å
1186	E	88.5	Confident	91.3	Very high	132 Å²	132	37.2 Å²	37.2	62%	0.617	19%	0.191	S	C	*	.	H	α-helix	trans	-65.4	-47.1	175.1	-53.9	75.5	-164.5	0	0	111.3	S1184 V1188 H1189 E1190	S1184-E1186 WeakPolarHBondContact CB-OE2 3.41Å; S1184-E1186 PolarHBondContact O-N 2.69Å; S1184-E1186 PolarHBondContact OG-N 2.84Å; S1184-E1186 PolarHBondContact OG-OE2 3.12Å; E1186-V1188 VanDerWaalsContact C-N 3.35Å; E1186-V1188 PolarHBondContact O-N 2.96Å; E1186-H1189 CarbonylContact O-C 3.54Å; E1186-H1189 WeakPolarHBondContact O-CA 3.3Å; E1186-H1189 WeakPolarHBondContact O-CB 3.28Å; E1186-H1189 PolarHBondContact O-N 3.43Å; E1186-H1189 VanDerWaalsContact O-N 3.11Å; E1186-E1190 PolarHBondContact O-N 3.25Å
1187	L	89.7	Confident	91	Very high	21 Å²	21	39.1 Å²	39.1	11%	0.11	20%	0.204	C	C	.	.	H	α-helix	trans	-63.8	-40.7	177.6	-171.9	159.4	0	0	0	111.1	Q1150 E1151 L1154 S1184 H1189 E1190 F1191	Q1150-L1187 HydrophobicContact CB-CD1 3.91Å; Q1150-L1187 HydrophobicContact CB-CD2 4.43Å; E1151-L1187 HydrophobicContact CG-CD1 3.69Å; E1151-L1187 HydrophobicContact CG-CG 4.27Å; L1154-L1187 HydrophobicContact CD1-CD2 3.57Å; S1184-L1187 PolarHBondContact O-N 3.33Å; S1184-L1187 PolarHBondContact OG-N 2.98Å; L1187-H1189 VanDerWaalsContact C-N 3.3Å; L1187-H1189 PolarHBondContact O-N 3.09Å; L1187-E1190 PolarHBondContact O-N 2.97Å; L1187-F1191 HydrophobicContact CD2-CD2 4.07Å; L1187-F1191 HydrophobicContact CD2-CE2 4.43Å; L1187-F1191 HydrophobicContact CG-CD2 4.46Å; L1187-F1191 PolarHBondContact O-N 3.37Å; L1187-F1191 VanDerWaalsContact O-N 3.08Å
1188	V	91.5	Very high	90.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-64.1	-35.3	173.3	175.9	0	0	0	0	111.5	I1180 S1184 E1186 I1192 I1221 K1224 L1225	I1180-V1188 HydrophobicContact CG2-CG2 4.17Å; S1184-V1188 WeakPolarHBondContact O-CG2 3.19Å; S1184-V1188 PolarHBondContact O-N 3.36Å; S1184-V1188 VanDerWaalsContact O-N 3.1Å; E1186-V1188 VanDerWaalsContact C-N 3.35Å; E1186-V1188 PolarHBondContact O-N 2.96Å; V1188-I1192 WeakPolarHBondContact O-CB 3.42Å; V1188-I1192 PolarHBondContact O-N 3.22Å; V1188-I1192 VanDerWaalsContact O-N 3.1Å; V1188-I1221 HydrophobicContact CG1-CG1 4.49Å; V1188-I1221 HydrophobicContact CG1-CG2 4.14Å; V1188-K1224 HydrophobicContact CB-CB 4.4Å; V1188-K1224 HydrophobicContact CG1-CB 4.22Å; V1188-K1224 HydrophobicContact CG2-CB 4.46Å; V1188-K1224 HydrophobicContact CG2-CG 4.34Å; V1188-L1225 HydrophobicContact CG1-CD1 4.5Å; V1188-L1225 HydrophobicContact CG1-CD2 4.37Å; V1188-L1225 HydrophobicContact CG1-CG 4.26Å
1189	H	90.3	Very high	90.6	Very high	88 Å²	88	34.5 Å²	34.5	41%	0.407	18%	0.182	S	C	.	.	H	α-helix	trans	-71.5	-32.5	174.9	-168.9	-62.3	0	0	0	112.7	P1185 E1186 L1187 I1192 L1225 Y1232	P1185-H1189 WeakPolarHBondContact O-CB 3.5Å; P1185-H1189 PolarHBondContact O-N 2.86Å; E1186-H1189 CarbonylContact O-C 3.54Å; E1186-H1189 WeakPolarHBondContact O-CA 3.3Å; E1186-H1189 WeakPolarHBondContact O-CB 3.28Å; E1186-H1189 PolarHBondContact O-N 3.43Å; E1186-H1189 VanDerWaalsContact O-N 3.11Å; L1187-H1189 VanDerWaalsContact C-N 3.3Å; L1187-H1189 PolarHBondContact O-N 3.09Å; H1189-I1192 WeakPolarHBondContact O-CG2 3.48Å; H1189-L1225 HydrophobicContact CB-CD2 3.84Å; H1189-Y1232 PolarHBondContact CE1-OH 3.18Å; H1189-Y1232 PolarHBondContact NE2-OH 3.45Å
1190	E	89.5	Confident	90.4	Very high	98 Å²	98	35 Å²	35	46%	0.458	19%	0.185	S	C	.	.	H	α-helix	trans	-67.2	-47.8	173.7	-174.1	173	159.1	0	0	111.3	Y594 E1186 L1187 I1192	Y594-E1190 PolarHBondContact OH-OE1 3.21Å; E1186-E1190 PolarHBondContact O-N 3.25Å; L1187-E1190 PolarHBondContact O-N 2.97Å; E1190-I1192 VanDerWaalsContact C-N 3.3Å; E1190-I1192 PolarHBondContact O-N 2.65Å
1191	F	90.5	Very high	90.1	Very high	25 Å²	25	39.4 Å²	39.4	11%	0.11	21%	0.207	C	C	.	.	H	α-helix	trans	-76.8	-9.4	-178.3	-83.9	-98	0	0	0	114.4	E1151 L1154 N1155 L1187 N1193 A1194 L1195	E1151-F1191 HydrophobicContact CB-CE2 4.36Å; E1151-F1191 HydrophobicContact CB-CZ 4.32Å; E1151-F1191 HydrophobicContact CG-CE2 4.32Å; L1154-F1191 HydrophobicContact CB-CD1 3.69Å; L1154-F1191 HydrophobicContact CB-CE1 3.65Å; L1154-F1191 HydrophobicContact CB-CG 4.28Å; L1154-F1191 HydrophobicContact CB-CZ 4.22Å; L1154-F1191 HydrophobicContact CD1-CB 3.93Å; L1154-F1191 HydrophobicContact CD1-CD1 3.98Å; L1154-F1191 HydrophobicContact CD1-CD2 4.03Å; L1154-F1191 HydrophobicContact CD1-CG 3.7Å; N1155-F1191 WeakPolarHBondContact OD1-CE1 3.21Å; L1187-F1191 HydrophobicContact CD2-CD2 4.07Å; L1187-F1191 HydrophobicContact CD2-CE2 4.43Å; L1187-F1191 HydrophobicContact CG-CD2 4.46Å; L1187-F1191 PolarHBondContact O-N 3.37Å; L1187-F1191 VanDerWaalsContact O-N 3.08Å; F1191-N1193 VanDerWaalsContact C-N 3.31Å; F1191-N1193 PolarHBondContact O-N 3.37Å; F1191-N1193 VanDerWaalsContact O-N 3.09Å; F1191-A1194 WeakPolarHBondContact O-CB 3.37Å; F1191-A1194 PolarHBondContact O-N 3.01Å; F1191-L1195 HydrophobicContact CB-CD1 3.95Å; F1191-L1195 HydrophobicContact CB-CG 4.06Å; F1191-L1195 WeakPolarHBondContact O-CG 3.44Å; F1191-L1195 PolarHBondContact O-N 3Å; F1191-L1195 VanDerWaalsContact O-N 3.1Å
1192	I	90.8	Very high	90	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-52.7	-40.8	-166.9	-165.8	58.2	0	0	0	114.7	V1188 H1189 E1190 A1194 L1195 I1196 I1221 L1225 Y1232	V1188-I1192 WeakPolarHBondContact O-CB 3.42Å; V1188-I1192 PolarHBondContact O-N 3.22Å; V1188-I1192 VanDerWaalsContact O-N 3.1Å; H1189-I1192 WeakPolarHBondContact O-CG2 3.48Å; E1190-I1192 VanDerWaalsContact C-N 3.3Å; E1190-I1192 PolarHBondContact O-N 2.65Å; I1192-A1194 VanDerWaalsContact C-N 3.27Å; I1192-A1194 PolarHBondContact O-N 2.89Å; I1192-L1195 PolarHBondContact O-N 3.26Å; I1192-I1196 HydrophobicContact CD1-CD1 3.9Å; I1192-I1196 HydrophobicContact CD1-CG1 3.6Å; I1192-I1196 HydrophobicContact CG1-CG1 3.97Å; I1192-I1196 WeakPolarHBondContact O-CB 2.95Å; I1192-I1196 VanDerWaalsContact O-CG1 3.23Å; I1192-I1196 WeakPolarHBondContact O-CG1 3.44Å; I1192-I1196 PolarHBondContact O-N 3.13Å; I1192-I1196 VanDerWaalsContact O-N 3.09Å; I1192-I1221 HydrophobicContact CD1-CG2 3.48Å; I1192-I1221 VanDerWaalsContact CD1-CG2 3.48Å; I1192-L1225 HydrophobicContact CB-CD1 4.48Å; I1192-L1225 HydrophobicContact CD1-CD1 3.52Å; I1192-L1225 HydrophobicContact CG1-CD1 3.81Å; I1192-Y1232 HydrophobicContact CG1-CD1 3.92Å; I1192-Y1232 HydrophobicContact CG1-CD2 3.89Å; I1192-Y1232 HydrophobicContact CG1-CE1 4.19Å; I1192-Y1232 HydrophobicContact CG1-CE2 4.14Å; I1192-Y1232 HydrophobicContact CG1-CG 3.78Å; I1192-Y1232 HydrophobicContact CG2-CD1 3.96Å; I1192-Y1232 HydrophobicContact CG2-CE1 3.46Å; I1192-Y1232 VanDerWaalsContact CG2-CE1 3.46Å; I1192-Y1232 HydrophobicContact CG2-CE2 4.25Å
1193	N	88.7	Confident	89.9	Confident	24 Å²	24	32.5 Å²	32.5	13%	0.128	18%	0.175	C	C	.	.	H	α-helix	trans	-69.5	-23.6	-179.7	-63.5	-56.1	0	0	0	113.2	V560 S562 F1191 P1197	V560-N1193 PolarHBondContact O-ND2 3.03Å; S562-N1193 PolarHBondContact OG-ND2 2.71Å; F1191-N1193 VanDerWaalsContact C-N 3.31Å; F1191-N1193 PolarHBondContact O-N 3.37Å; F1191-N1193 VanDerWaalsContact O-N 3.09Å; N1193-P1197 WeakPolarHBondContact O-CD 3.24Å; N1193-P1197 WeakPolarHBondContact O-CG 3.41Å
1194	A	89.3	Confident	89.7	Confident	20 Å²	20	37.1 Å²	37.1	17%	0.165	20%	0.2	C	C	.	.	H	α-helix	trans	-86.1	-37.3	175.7	0	0	0	0	0	111.4	T1158 F1191 I1192	T1158-A1194 HydrophobicContact CG2-CB 3.97Å; T1158-A1194 WeakPolarHBondContact CG2-O 3.05Å; F1191-A1194 WeakPolarHBondContact O-CB 3.37Å; F1191-A1194 PolarHBondContact O-N 3.01Å; I1192-A1194 VanDerWaalsContact C-N 3.27Å; I1192-A1194 PolarHBondContact O-N 2.89Å
1195	L	91.9	Very high	89.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-69.9	-44.4	-179	-60.2	173.4	0	0	0	113.2	L1154 Q1176 I1180 F1191 I1192 L1199 I1221	L1154-L1195 HydrophobicContact CD2-CD2 4.15Å; Q1176-L1195 HydrophobicContact CG-CD2 4.26Å; I1180-L1195 HydrophobicContact CD1-CD1 4.09Å; I1180-L1195 HydrophobicContact CD1-CD2 4.43Å; I1180-L1195 HydrophobicContact CG1-CD1 4.43Å; F1191-L1195 HydrophobicContact CB-CD1 3.95Å; F1191-L1195 HydrophobicContact CB-CG 4.06Å; F1191-L1195 WeakPolarHBondContact O-CG 3.44Å; F1191-L1195 PolarHBondContact O-N 3Å; F1191-L1195 VanDerWaalsContact O-N 3.1Å; I1192-L1195 PolarHBondContact O-N 3.26Å; L1195-L1199 WeakPolarHBondContact O-CG 3.36Å; L1195-L1199 PolarHBondContact O-N 3.41Å; L1195-I1221 HydrophobicContact CB-CD1 4.24Å; L1195-I1221 HydrophobicContact CD1-CD1 4.28Å
1196	I	91.4	Very high	89.7	Confident	13 Å²	13	43.2 Å²	43.2	7%	0.067	22%	0.218	C	C	.	.	H	α-helix	trans	-64.4	-43.2	-169	-69.2	-72.4	0	0	0	114.1	I1192 G1198 L1199 V1200 L1218 I1221 L1233	I1192-I1196 HydrophobicContact CD1-CD1 3.9Å; I1192-I1196 HydrophobicContact CD1-CG1 3.6Å; I1192-I1196 HydrophobicContact CG1-CG1 3.97Å; I1192-I1196 WeakPolarHBondContact O-CB 2.95Å; I1192-I1196 VanDerWaalsContact O-CG1 3.23Å; I1192-I1196 WeakPolarHBondContact O-CG1 3.44Å; I1192-I1196 PolarHBondContact O-N 3.13Å; I1192-I1196 VanDerWaalsContact O-N 3.09Å; I1196-G1198 PolarHBondContact O-N 3.44Å; I1196-L1199 PolarHBondContact O-N 2.83Å; I1196-V1200 HydrophobicContact CG2-CG2 3.89Å; I1196-V1200 WeakPolarHBondContact O-CB 3.49Å; I1196-V1200 WeakPolarHBondContact O-CG2 3.27Å; I1196-V1200 PolarHBondContact O-N 3.16Å; I1196-L1218 HydrophobicContact CD1-CD2 3.64Å; I1196-I1221 HydrophobicContact CD1-CD1 4.41Å; I1196-L1233 HydrophobicContact CD1-CD2 3.97Å; I1196-L1233 HydrophobicContact CD1-CG 4.45Å; I1196-L1233 HydrophobicContact CG2-CD2 4.11Å
1197	P	88.6	Confident	89.7	Confident	41 Å²	41	41.7 Å²	41.7	27%	0.266	21%	0.211	S	C	.	.	H	α-helix	trans	-56.7	-51.9	-178.1	-28	36.4	0	0	0	113.9	N1193 L1199 V1200 I1201	N1193-P1197 WeakPolarHBondContact O-CD 3.24Å; N1193-P1197 WeakPolarHBondContact O-CG 3.41Å; P1197-L1199 VanDerWaalsContact C-N 3.33Å; P1197-L1199 PolarHBondContact O-N 3.16Å; P1197-V1200 PolarHBondContact O-N 3.3Å; P1197-I1201 WeakPolarHBondContact O-CG1 3.45Å; P1197-I1201 PolarHBondContact O-N 2.72Å
1198	G	88.3	Confident	89.7	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-60.3	-41.2	177.8	0	0	0	0	0	112.7	N1162 I1196 I1201 A1202	N1162-G1198 WeakPolarHBondContact OD1-CA 3.42Å; N1162-G1198 PolarHBondContact OD1-N 3.08Å; I1196-G1198 PolarHBondContact O-N 3.44Å; G1198-I1201 PolarHBondContact O-N 3.39Å; G1198-A1202 VanDerWaalsContact O-CB 3.24Å; G1198-A1202 WeakPolarHBondContact O-CB 3.43Å; G1198-A1202 PolarHBondContact O-N 2.72Å
1199	L	92.4	Very high	89.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-69.4	-33.8	178.4	-64.8	175.9	0	0	0	113.1	I1161 I1173 L1195 I1196 P1197 C1203 C1217 L1218 I1221	I1161-L1199 HydrophobicContact CG2-CD2 4.48Å; I1173-L1199 HydrophobicContact CG2-CD2 4.16Å; L1195-L1199 WeakPolarHBondContact O-CG 3.36Å; L1195-L1199 PolarHBondContact O-N 3.41Å; I1196-L1199 PolarHBondContact O-N 2.83Å; P1197-L1199 VanDerWaalsContact C-N 3.33Å; P1197-L1199 PolarHBondContact O-N 3.16Å; L1199-C1203 WeakPolarHBondContact O-CB 3.41Å; L1199-C1203 PolarHBondContact O-N 2.81Å; L1199-C1203 PolarHBondContact O-SG 2.89Å; L1199-C1217 HydrophobicContact CD1-CB 4.16Å; L1199-C1217 HydrophobicContact CD2-CB 3.83Å; L1199-L1218 HydrophobicContact CB-CD2 3.84Å; L1199-L1218 HydrophobicContact CB-CG 4.12Å; L1199-L1218 HydrophobicContact CD1-CD2 3.94Å; L1199-L1218 HydrophobicContact CD1-CG 4.46Å; L1199-I1221 HydrophobicContact CD1-CD1 3.56Å
1200	V	89.9	Confident	89.8	Confident	11 Å²	11	42.8 Å²	42.8	7%	0.067	23%	0.232	C	C	.	.	H	α-helix	trans	-70.7	-37.9	173.9	170.2	0	0	0	0	111.2	I1196 P1197 N1204 L1233 E1235	I1196-V1200 HydrophobicContact CG2-CG2 3.89Å; I1196-V1200 WeakPolarHBondContact O-CB 3.49Å; I1196-V1200 WeakPolarHBondContact O-CG2 3.27Å; I1196-V1200 PolarHBondContact O-N 3.16Å; P1197-V1200 PolarHBondContact O-N 3.3Å; V1200-N1204 PolarHBondContact O-ND2 2.77Å; V1200-L1233 HydrophobicContact CG2-CD2 3.79Å; V1200-E1235 HydrophobicContact CG1-CB 4.5Å
1201	I	88.4	Confident	90	Very high	92 Å²	92	42.5 Å²	42.5	47%	0.472	23%	0.226	S	C	.	.	H	α-helix	trans	-64.5	-49.7	171.4	-66.9	165.4	0	0	0	110	P1197 G1198 C1203 N1204 H1205	P1197-I1201 WeakPolarHBondContact O-CG1 3.45Å; P1197-I1201 PolarHBondContact O-N 2.72Å; G1198-I1201 PolarHBondContact O-N 3.39Å; I1201-C1203 VanDerWaalsContact C-N 3.26Å; I1201-C1203 PolarHBondContact O-N 2.69Å; I1201-N1204 WeakPolarHBondContact O-CA 3.4Å; I1201-N1204 WeakPolarHBondContact O-CB 3.49Å; I1201-N1204 PolarHBondContact O-N 2.83Å; I1201-H1205 PolarHBondContact O-N 2.82Å
1202	A	89.8	Confident	90.1	Very high	7 Å²	7	47.9 Å²	47.9	6%	0.058	25%	0.25	C	C	.	.	H	α-helix	trans	-60.5	-32	178.6	0	0	0	0	0	113.1	I1173 G1198 N1204 H1205 I1210 S1214	I1173-A1202 HydrophobicContact CD1-CB 3.79Å; G1198-A1202 VanDerWaalsContact O-CB 3.24Å; G1198-A1202 WeakPolarHBondContact O-CB 3.43Å; G1198-A1202 PolarHBondContact O-N 2.72Å; A1202-N1204 PolarHBondContact O-N 2.91Å; A1202-N1204 VanDerWaalsContact O-N 3.14Å; A1202-H1205 VanDerWaalsContact O-CB 3.26Å; A1202-H1205 WeakPolarHBondContact O-CB 3.36Å; A1202-H1205 PolarHBondContact O-N 2.78Å; A1202-H1205 VanDerWaalsContact O-N 3.12Å; A1202-I1210 HydrophobicContact CB-CG2 3.83Å; A1202-S1214 VanDerWaalsContact C-OG 3.25Å; A1202-S1214 PolarHBondContact O-OG 2.81Å
1203	C	89.3	Confident	90.2	Very high	6 Å²	6	48.6 Å²	48.6	4%	0.041	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-15.9	171.1	-80.7	0	0	0	0	113.7	L1199 I1201 S1214 L1236 K1240	L1199-C1203 WeakPolarHBondContact O-CB 3.41Å; L1199-C1203 PolarHBondContact O-N 2.81Å; L1199-C1203 PolarHBondContact O-SG 2.89Å; I1201-C1203 VanDerWaalsContact C-N 3.26Å; I1201-C1203 PolarHBondContact O-N 2.69Å; C1203-S1214 WeakPolarHBondContact CA-OG 3.35Å; C1203-S1214 PolarHBondContact N-OG 2.97Å; C1203-L1236 HydrophobicContact CB-CD1 4.31Å; C1203-K1240 PolarHBondContact O-NZ 2.94Å
1204	N	86.9	Confident	90.4	Very high	99 Å²	99	47.5 Å²	47.5	53%	0.529	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-3.3	176	-64.7	-69.9	0	0	0	113.8	V1200 I1201 A1202 K1240	V1200-N1204 PolarHBondContact O-ND2 2.77Å; I1201-N1204 WeakPolarHBondContact O-CA 3.4Å; I1201-N1204 WeakPolarHBondContact O-CB 3.49Å; I1201-N1204 PolarHBondContact O-N 2.83Å; A1202-N1204 PolarHBondContact O-N 2.91Å; A1202-N1204 VanDerWaalsContact O-N 3.14Å; N1204-K1240 PolarHBondContact OD1-NZ 3.25Å
1205	H	89.5	Confident	90.6	Very high	48 Å²	48	47.8 Å²	47.8	22%	0.222	25%	0.249	C	C	.	.			trans	-57.4	156.1	-177.2	-164.5	-99.4	0	0	0	113.7	I1201 A1202 E1207 I1210 R1211	I1201-H1205 PolarHBondContact O-N 2.82Å; A1202-H1205 VanDerWaalsContact O-CB 3.26Å; A1202-H1205 WeakPolarHBondContact O-CB 3.36Å; A1202-H1205 PolarHBondContact O-N 2.78Å; A1202-H1205 VanDerWaalsContact O-N 3.12Å; H1205-E1207 PolarHBondContact ND1-N 3.13Å; H1205-I1210 HydrophobicContact CB-CB 4.2Å; H1205-I1210 HydrophobicContact CB-CG2 3.61Å; H1205-I1210 VanDerWaalsContact CE1-CD1 3.47Å; H1205-I1210 WeakPolarHBondContact CE1-CD1 3.49Å; H1205-R1211 HydrophobicContact CB-CG 4.48Å; H1205-R1211 WeakPolarHBondContact O-CD 3.41Å; H1205-R1211 WeakPolarHBondContact O-CG 3.35Å; H1205-R1211 PolarHBondContact O-NH1 3.22Å
1206	E	89	Confident	90.7	Very high	182 Å²	182	51 Å²	51	85%	0.85	26%	0.263	S	S	*	.	S	Bend	trans	-71	-38.7	-177.1	-60.7	-167.9	162.2	0	0	113.3	S1208 R1211	E1206-S1208 PolarHBondContact O-N 3.46Å; E1206-R1211 VanDerWaalsContact C-NH1 3.25Å; E1206-R1211 PolarHBondContact O-NH1 3.47Å
1207	E	87.8	Confident	90.8	Very high	99 Å²	99	50.4 Å²	50.4	46%	0.463	26%	0.26	S	S	.	.	S	Bend	trans	-67.7	128.9	173	-68.3	-169.4	-179.5	0	0	112.6	H1205 A1209 I1210 R1211	H1205-E1207 PolarHBondContact ND1-N 3.13Å; E1207-A1209 VanDerWaalsContact C-N 3.25Å; E1207-A1209 PolarHBondContact O-N 3.02Å; E1207-I1210 HydrophobicContact CB-CB 4.29Å; E1207-I1210 HydrophobicContact CB-CD1 4.32Å; E1207-I1210 HydrophobicContact CB-CG1 4.37Å; E1207-I1210 PolarHBondContact O-N 3.17Å; E1207-I1210 WeakPolarHBondContact OE2-CD1 3.09Å; E1207-R1211 PolarHBondContact O-N 3.23Å; E1207-R1211 VanDerWaalsContact O-N 3.16Å
1208	S	90.8	Very high	91.1	Very high	83 Å²	83	48.5 Å²	48.5	58%	0.58	25%	0.248	S	C	*	.	H	α-helix	trans	-63.6	-29.8	173	58.2	0	0	0	0	113.2	E1206 K1212	E1206-S1208 PolarHBondContact O-N 3.46Å; S1208-K1212 VanDerWaalsContact O-CB 3.29Å; S1208-K1212 WeakPolarHBondContact O-CB 3.48Å; S1208-K1212 PolarHBondContact O-N 3.42Å
1209	A	92	Very high	91.3	Very high	40 Å²	40	48.6 Å²	48.6	33%	0.331	25%	0.249	S	C	.	.	H	α-helix	trans	-64.6	-47.8	177	0	0	0	0	0	111.9	L1170 E1207 K1212 A1213	L1170-A1209 HydrophobicContact CD1-CB 4.03Å; L1170-A1209 HydrophobicContact CD2-CB 3.79Å; E1207-A1209 VanDerWaalsContact C-N 3.25Å; E1207-A1209 PolarHBondContact O-N 3.02Å; A1209-K1212 PolarHBondContact O-N 2.9Å; A1209-A1213 WeakPolarHBondContact O-CB 3.44Å; A1209-A1213 PolarHBondContact O-N 2.93Å
1210	I	92	Very high	91.3	Very high	9 Å²	9	49.1 Å²	49.1	5%	0.046	25%	0.252	C	S	.	.	H	α-helix	trans	-66.9	-40.6	177.6	-70.7	170.7	0	0	0	111.2	N1169 L1170 I1173 A1202 H1205 E1207 K1212 A1213 S1214	N1169-I1210 HydrophobicContact CB-CD1 4.18Å; L1170-I1210 HydrophobicContact CB-CD1 4.3Å; L1170-I1210 HydrophobicContact CB-CG1 3.86Å; L1170-I1210 HydrophobicContact CD1-CG1 4.02Å; L1170-I1210 HydrophobicContact CG-CG1 4.45Å; I1173-I1210 HydrophobicContact CD1-CG2 3.93Å; A1202-I1210 HydrophobicContact CB-CG2 3.83Å; H1205-I1210 HydrophobicContact CB-CB 4.2Å; H1205-I1210 HydrophobicContact CB-CG2 3.61Å; H1205-I1210 VanDerWaalsContact CE1-CD1 3.47Å; H1205-I1210 WeakPolarHBondContact CE1-CD1 3.49Å; E1207-I1210 HydrophobicContact CB-CB 4.29Å; E1207-I1210 HydrophobicContact CB-CD1 4.32Å; E1207-I1210 HydrophobicContact CB-CG1 4.37Å; E1207-I1210 PolarHBondContact O-N 3.17Å; E1207-I1210 WeakPolarHBondContact OE2-CD1 3.09Å; I1210-K1212 VanDerWaalsContact C-N 3.31Å; I1210-K1212 PolarHBondContact O-N 3.48Å; I1210-A1213 PolarHBondContact O-N 3.32Å; I1210-S1214 WeakPolarHBondContact O-CB 3.26Å; I1210-S1214 PolarHBondContact O-N 2.93Å; I1210-S1214 PolarHBondContact O-OG 3.49Å
1211	R	92.4	Very high	91.5	Very high	92 Å²	92	48.6 Å²	48.6	35%	0.347	25%	0.249	S	C	.	.	H	α-helix	trans	-60.6	-38.5	171.6	-67.6	-164.6	-59.1	-88.4	0.7	112.8	H1205 E1206 E1207 S1214 V1215	H1205-R1211 HydrophobicContact CB-CG 4.48Å; H1205-R1211 WeakPolarHBondContact O-CD 3.41Å; H1205-R1211 WeakPolarHBondContact O-CG 3.35Å; H1205-R1211 PolarHBondContact O-NH1 3.22Å; E1206-R1211 VanDerWaalsContact C-NH1 3.25Å; E1206-R1211 PolarHBondContact O-NH1 3.47Å; E1207-R1211 PolarHBondContact O-N 3.23Å; E1207-R1211 VanDerWaalsContact O-N 3.16Å; R1211-S1214 WeakPolarHBondContact CA-OG 3.38Å; R1211-S1214 PolarHBondContact O-OG 2.84Å; R1211-V1215 WeakPolarHBondContact O-CG2 3.45Å; R1211-V1215 PolarHBondContact O-N 3.27Å
1212	K	93	Very high	91.7	Very high	139 Å²	139	44.2 Å²	44.2	60%	0.604	23%	0.227	S	C	*	.	H	α-helix	trans	-68.9	-49.5	177.4	-175.3	179.1	177.9	-175.4	0	110.8	S1208 A1209 I1210 S1214 V1215 F1216	S1208-K1212 VanDerWaalsContact O-CB 3.29Å; S1208-K1212 WeakPolarHBondContact O-CB 3.48Å; S1208-K1212 PolarHBondContact O-N 3.42Å; A1209-K1212 PolarHBondContact O-N 2.9Å; I1210-K1212 VanDerWaalsContact C-N 3.31Å; I1210-K1212 PolarHBondContact O-N 3.48Å; K1212-S1214 PolarHBondContact O-N 2.89Å; K1212-V1215 PolarHBondContact O-N 3.41Å; K1212-F1216 HydrophobicContact CD-CE2 4.36Å; K1212-F1216 HydrophobicContact CG-CD2 3.9Å; K1212-F1216 HydrophobicContact CG-CE2 3.72Å; K1212-F1216 VanDerWaalsContact O-CD2 3.25Å; K1212-F1216 WeakPolarHBondContact O-CD2 3.32Å; K1212-F1216 PolarHBondContact O-N 3.3Å; K1212-F1216 VanDerWaalsContact O-N 3.07Å
1213	A	93.8	Very high	91.8	Very high	15 Å²	15	47.9 Å²	47.9	12%	0.124	24%	0.244	C	C	.	.	H	α-helix	trans	-61.6	-43.2	-179	0	0	0	0	0	112.3	L1170 I1173 A1209 I1210 F1216 C1217	L1170-A1213 HydrophobicContact CD1-CB 3.91Å; I1173-A1213 HydrophobicContact CB-CB 4.36Å; I1173-A1213 HydrophobicContact CG2-CB 3.75Å; A1209-A1213 WeakPolarHBondContact O-CB 3.44Å; A1209-A1213 PolarHBondContact O-N 2.93Å; I1210-A1213 PolarHBondContact O-N 3.32Å; A1213-F1216 PolarHBondContact O-N 3.19Å; A1213-C1217 WeakPolarHBondContact O-CB 3.43Å; A1213-C1217 PolarHBondContact O-N 3.03Å
1214	S	92.9	Very high	91.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-37.8	177.3	49.9	0	0	0	0	113	A1202 C1203 I1210 R1211 K1212 C1217 L1218	A1202-S1214 VanDerWaalsContact C-OG 3.25Å; A1202-S1214 PolarHBondContact O-OG 2.81Å; C1203-S1214 WeakPolarHBondContact CA-OG 3.35Å; C1203-S1214 PolarHBondContact N-OG 2.97Å; I1210-S1214 WeakPolarHBondContact O-CB 3.26Å; I1210-S1214 PolarHBondContact O-N 2.93Å; I1210-S1214 PolarHBondContact O-OG 3.49Å; R1211-S1214 WeakPolarHBondContact CA-OG 3.38Å; R1211-S1214 PolarHBondContact O-OG 2.84Å; K1212-S1214 PolarHBondContact O-N 2.89Å; S1214-C1217 PolarHBondContact O-N 3.38Å; S1214-L1218 WeakPolarHBondContact O-CG 3.47Å; S1214-L1218 PolarHBondContact O-N 2.65Å
1215	V	92.8	Very high	91.9	Very high	26 Å²	26	47 Å²	47	16%	0.158	24%	0.236	C	C	.	.	H	α-helix	trans	-62.2	-45.5	171	169.8	0	0	0	0	111.4	R1211 K1212 C1217 L1218 V1219 L1244 Y1247	R1211-V1215 WeakPolarHBondContact O-CG2 3.45Å; R1211-V1215 PolarHBondContact O-N 3.27Å; K1212-V1215 PolarHBondContact O-N 3.41Å; V1215-C1217 VanDerWaalsContact C-N 3.33Å; V1215-C1217 PolarHBondContact O-N 3.03Å; V1215-L1218 PolarHBondContact O-N 3.41Å; V1215-V1219 VanDerWaalsContact O-CG2 3.3Å; V1215-V1219 WeakPolarHBondContact O-CG2 3.4Å; V1215-V1219 PolarHBondContact O-N 3.06Å; V1215-L1244 HydrophobicContact CG1-CD1 4.38Å; V1215-Y1247 HydrophobicContact CG1-CD2 3.78Å; V1215-Y1247 HydrophobicContact CG1-CE2 4.1Å; V1215-Y1247 HydrophobicContact CG1-CG 4.48Å
1216	F	93.8	Very high	91.8	Very high	68 Å²	68	46.3 Å²	46.3	30%	0.298	24%	0.242	S	C	.	.	H	α-helix	trans	-64.8	-35.5	176.8	-79.8	-72.1	0	0	0	113	M1177 K1212 A1213 V1219 A1220 Y1247	M1177-F1216 HydrophobicContact SD-CB 3.72Å; K1212-F1216 HydrophobicContact CD-CE2 4.36Å; K1212-F1216 HydrophobicContact CG-CD2 3.9Å; K1212-F1216 HydrophobicContact CG-CE2 3.72Å; K1212-F1216 VanDerWaalsContact O-CD2 3.25Å; K1212-F1216 WeakPolarHBondContact O-CD2 3.32Å; K1212-F1216 PolarHBondContact O-N 3.3Å; K1212-F1216 VanDerWaalsContact O-N 3.07Å; A1213-F1216 PolarHBondContact O-N 3.19Å; F1216-V1219 PolarHBondContact O-N 2.88Å; F1216-A1220 PolarHBondContact O-N 3.42Å; F1216-Y1247 HydrophobicContact CZ-CE1 4.42Å
1217	C	94.1	Very high	91.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.2	-44.1	172.9	-164.6	0	0	0	0	111.8	I1173 M1177 L1199 A1213 S1214 V1215 V1219 A1220 I1221	I1173-C1217 HydrophobicContact CG2-CB 4.14Å; M1177-C1217 HydrophobicContact CB-CB 4.19Å; L1199-C1217 HydrophobicContact CD1-CB 4.16Å; L1199-C1217 HydrophobicContact CD2-CB 3.83Å; A1213-C1217 WeakPolarHBondContact O-CB 3.43Å; A1213-C1217 PolarHBondContact O-N 3.03Å; S1214-C1217 PolarHBondContact O-N 3.38Å; V1215-C1217 VanDerWaalsContact C-N 3.33Å; V1215-C1217 PolarHBondContact O-N 3.03Å; C1217-V1219 VanDerWaalsContact C-N 3.29Å; C1217-V1219 PolarHBondContact O-N 3.48Å; C1217-A1220 WeakPolarHBondContact O-CB 3.44Å; C1217-A1220 PolarHBondContact O-N 2.84Å; C1217-A1220 VanDerWaalsContact O-N 3.13Å; C1217-I1221 WeakPolarHBondContact O-CG1 3.45Å; C1217-I1221 PolarHBondContact O-N 3.38Å
1218	L	93.6	Very high	91.5	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-61.9	-34.2	173.1	-71.7	179.9	0	0	0	113	I1196 L1199 S1214 V1215 I1221 A1222 I1229 L1233 L1244	I1196-L1218 HydrophobicContact CD1-CD2 3.64Å; L1199-L1218 HydrophobicContact CB-CD2 3.84Å; L1199-L1218 HydrophobicContact CB-CG 4.12Å; L1199-L1218 HydrophobicContact CD1-CD2 3.94Å; L1199-L1218 HydrophobicContact CD1-CG 4.46Å; S1214-L1218 WeakPolarHBondContact O-CG 3.47Å; S1214-L1218 PolarHBondContact O-N 2.65Å; V1215-L1218 PolarHBondContact O-N 3.41Å; L1218-I1221 HydrophobicContact CD2-CD1 4.45Å; L1218-A1222 WeakPolarHBondContact O-CB 3.4Å; L1218-A1222 PolarHBondContact O-N 3.36Å; L1218-I1229 WeakPolarHBondContact O-CD1 3.44Å; L1218-L1233 HydrophobicContact CD1-CD2 4.17Å; L1218-L1233 HydrophobicContact CD2-CD2 4.01Å; L1218-L1244 HydrophobicContact CB-CD1 3.88Å; L1218-L1244 HydrophobicContact CB-CD2 4.26Å; L1218-L1244 HydrophobicContact CD1-CD2 4.38Å
1219	V	93.2	Very high	91.4	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.024	21%	0.208	C	C	.	.	H	α-helix	trans	-67.8	-40.8	172.9	177.9	0	0	0	0	110.9	V1215 F1216 C1217 I1221 A1222 M1223 L1244 I1248 Q1251	V1215-V1219 VanDerWaalsContact O-CG2 3.3Å; V1215-V1219 WeakPolarHBondContact O-CG2 3.4Å; V1215-V1219 PolarHBondContact O-N 3.06Å; F1216-V1219 PolarHBondContact O-N 2.88Å; C1217-V1219 VanDerWaalsContact C-N 3.29Å; C1217-V1219 PolarHBondContact O-N 3.48Å; V1219-I1221 VanDerWaalsContact C-N 3.34Å; V1219-I1221 PolarHBondContact O-N 3.45Å; V1219-A1222 WeakPolarHBondContact O-CB 3.49Å; V1219-A1222 PolarHBondContact O-N 2.86Å; V1219-A1222 VanDerWaalsContact O-N 3.15Å; V1219-M1223 HydrophobicContact CG1-CG 4.49Å; V1219-M1223 WeakPolarHBondContact O-CG 3.35Å; V1219-M1223 PolarHBondContact O-N 3.46Å; V1219-L1244 HydrophobicContact CG2-CD1 3.55Å; V1219-I1248 HydrophobicContact CG1-CG1 4.33Å; V1219-I1248 HydrophobicContact CG2-CG1 4.29Å; V1219-Q1251 HydrophobicContact CG1-CB 4.22Å; V1219-Q1251 HydrophobicContact CG1-CG 3.7Å
1220	A	93.4	Very high	91.3	Very high	10 Å²	10	40.8 Å²	40.8	8%	0.083	20%	0.204	C	C	.	.	H	α-helix	trans	-61.4	-40.6	175.2	0	0	0	0	0	112.2	M1177 I1180 Q1181 F1216 C1217 M1223 K1224	M1177-A1220 HydrophobicContact CG-CB 4.18Å; I1180-A1220 HydrophobicContact CG2-CB 4.11Å; Q1181-A1220 HydrophobicContact CG-CB 4.01Å; F1216-A1220 PolarHBondContact O-N 3.42Å; C1217-A1220 WeakPolarHBondContact O-CB 3.44Å; C1217-A1220 PolarHBondContact O-N 2.84Å; C1217-A1220 VanDerWaalsContact O-N 3.13Å; A1220-M1223 PolarHBondContact O-N 2.87Å; A1220-K1224 WeakPolarHBondContact O-CG 3.4Å; A1220-K1224 PolarHBondContact O-N 2.66Å
1221	I	93.5	Very high	91.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-43.6	171.8	-64.6	172.9	0	0	0	110.9	I1180 V1188 I1192 L1195 I1196 L1199 C1217 L1218 V1219 M1223 K1224 L1225 I1229	I1180-I1221 HydrophobicContact CD1-CD1 4.05Å; I1180-I1221 HydrophobicContact CD1-CG1 3.88Å; I1180-I1221 HydrophobicContact CG2-CG1 3.91Å; V1188-I1221 HydrophobicContact CG1-CG1 4.49Å; V1188-I1221 HydrophobicContact CG1-CG2 4.14Å; I1192-I1221 HydrophobicContact CD1-CG2 3.48Å; I1192-I1221 VanDerWaalsContact CD1-CG2 3.48Å; L1195-I1221 HydrophobicContact CB-CD1 4.24Å; L1195-I1221 HydrophobicContact CD1-CD1 4.28Å; I1196-I1221 HydrophobicContact CD1-CD1 4.41Å; L1199-I1221 HydrophobicContact CD1-CD1 3.56Å; C1217-I1221 WeakPolarHBondContact O-CG1 3.45Å; C1217-I1221 PolarHBondContact O-N 3.38Å; L1218-I1221 HydrophobicContact CD2-CD1 4.45Å; V1219-I1221 VanDerWaalsContact C-N 3.34Å; V1219-I1221 PolarHBondContact O-N 3.45Å; I1221-M1223 VanDerWaalsContact C-N 3.3Å; I1221-M1223 PolarHBondContact O-N 3.23Å; I1221-K1224 PolarHBondContact O-N 2.89Å; I1221-L1225 HydrophobicContact CG2-CD1 3.9Å; I1221-L1225 HydrophobicContact CG2-CG 4.31Å; I1221-L1225 PolarHBondContact O-N 3.48Å; I1221-I1229 HydrophobicContact CB-CD1 4.05Å; I1221-I1229 HydrophobicContact CG2-CD1 3.73Å; I1221-I1229 HydrophobicContact CG2-CG1 4.19Å
1222	A	92.2	Very high	90.7	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-64.1	-33.8	179.5	0	0	0	0	0	112.9	L1218 V1219 K1224 G1226 I1229 I1248	L1218-A1222 WeakPolarHBondContact O-CB 3.4Å; L1218-A1222 PolarHBondContact O-N 3.36Å; V1219-A1222 WeakPolarHBondContact O-CB 3.49Å; V1219-A1222 PolarHBondContact O-N 2.86Å; V1219-A1222 VanDerWaalsContact O-N 3.15Å; A1222-K1224 PolarHBondContact O-N 3.5Å; A1222-G1226 WeakPolarHBondContact O-CA 3.36Å; A1222-G1226 PolarHBondContact O-N 2.98Å; A1222-I1229 HydrophobicContact CB-CD1 3.82Å; A1222-I1229 HydrophobicContact CB-CG2 3.95Å; A1222-I1248 HydrophobicContact CB-CD1 3.41Å; A1222-I1248 VanDerWaalsContact CB-CD1 3.41Å; A1222-I1248 HydrophobicContact CB-CG1 3.66Å; A1222-I1248 HydrophobicContact CB-CG2 4.49Å
1223	M	91.8	Very high	90.4	Very high	83 Å²	83	33.8 Å²	33.8	41%	0.409	18%	0.182	S	C	.	.	H	α-helix	trans	-70	-14.8	173.3	-65.8	-59	-66.2	0	0	113.3	V1219 A1220 I1221 Q1251 Q1252	V1219-M1223 HydrophobicContact CG1-CG 4.49Å; V1219-M1223 WeakPolarHBondContact O-CG 3.35Å; V1219-M1223 PolarHBondContact O-N 3.46Å; A1220-M1223 PolarHBondContact O-N 2.87Å; I1221-M1223 VanDerWaalsContact C-N 3.3Å; I1221-M1223 PolarHBondContact O-N 3.23Å; M1223-Q1251 HydrophobicContact CG-CB 4.5Å; M1223-Q1251 HydrophobicContact SD-CB 4.01Å; M1223-Q1252 HydrophobicContact CE-CG 4.03Å; M1223-Q1252 HydrophobicContact SD-CG 3.67Å
1224	K	90	Very high	89.8	Confident	66 Å²	66	37.3 Å²	37.3	29%	0.287	20%	0.202	S	C	.	.	H	α-helix	trans	-97.3	-35.3	175.3	-63.4	-76.4	176.5	166.7	0	112.9	I1180 Q1181 S1183 P1185 V1188 A1220 I1221 A1222	I1180-K1224 VanDerWaalsContact O-CE 3.24Å; I1180-K1224 WeakPolarHBondContact O-CE 3.38Å; Q1181-K1224 WeakPolarHBondContact O-CE 3.43Å; Q1181-K1224 PolarHBondContact O-NZ 2.9Å; S1183-K1224 WeakPolarHBondContact O-CE 3.18Å; S1183-K1224 PolarHBondContact O-NZ 3.33Å; P1185-K1224 HydrophobicContact CB-CB 4.46Å; P1185-K1224 WeakPolarHBondContact CB-O 3.37Å; V1188-K1224 HydrophobicContact CB-CB 4.4Å; V1188-K1224 HydrophobicContact CG1-CB 4.22Å; V1188-K1224 HydrophobicContact CG2-CB 4.46Å; V1188-K1224 HydrophobicContact CG2-CG 4.34Å; A1220-K1224 WeakPolarHBondContact O-CG 3.4Å; A1220-K1224 PolarHBondContact O-N 2.66Å; I1221-K1224 PolarHBondContact O-N 2.89Å; A1222-K1224 PolarHBondContact O-N 3.5Å
1225	L	88.1	Confident	89.3	Confident	22 Å²	22	45 Å²	45	12%	0.115	24%	0.238	C	C	.	.	H	α-helix	trans	-102.1	-10.3	-176.5	-60.1	-174.3	0	0	0	114.9	V1188 H1189 I1192 I1221 D1228	V1188-L1225 HydrophobicContact CG1-CD1 4.5Å; V1188-L1225 HydrophobicContact CG1-CD2 4.37Å; V1188-L1225 HydrophobicContact CG1-CG 4.26Å; H1189-L1225 HydrophobicContact CB-CD2 3.84Å; I1192-L1225 HydrophobicContact CB-CD1 4.48Å; I1192-L1225 HydrophobicContact CD1-CD1 3.52Å; I1192-L1225 HydrophobicContact CG1-CD1 3.81Å; I1221-L1225 HydrophobicContact CG2-CD1 3.9Å; I1221-L1225 HydrophobicContact CG2-CG 4.31Å; I1221-L1225 PolarHBondContact O-N 3.48Å; L1225-D1228 PolarHBondContact O-N 3.15Å
1226	G	87.7	Confident	88.9	Confident	33 Å²	33	44.1 Å²	44.1	34%	0.34	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	61	-142.6	-172.5	0	0	0	0	0	112.4	A1222 D1228 I1229	A1222-G1226 WeakPolarHBondContact O-CA 3.36Å; A1222-G1226 PolarHBondContact O-N 2.98Å; G1226-D1228 PolarHBondContact O-N 3.38Å; G1226-I1229 WeakPolarHBondContact O-CG2 3.49Å
1227	D	84.9	Confident	88.4	Confident	117 Å²	117	46 Å²	46	63%	0.626	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-68.9	-13.7	-177.8	-82.9	-41.3	0	0	0	114.2	I1229 W1230	D1227-I1229 PolarHBondContact O-N 3.16Å; D1227-I1229 VanDerWaalsContact O-N 3.15Å; D1227-W1230 WeakPolarHBondContact O-CB 3.13Å; D1227-W1230 PolarHBondContact O-N 3.26Å; D1227-W1230 PolarHBondContact OD1-NE1 3.22Å
1228	D	85.9	Confident	87.9	Confident	106 Å²	106	49 Å²	49	57%	0.567	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-64.1	-21.9	179	-75.9	-31	0	0	0	112.6	L1225 G1226 W1230 S1231 Y1232	L1225-D1228 PolarHBondContact O-N 3.15Å; G1226-D1228 PolarHBondContact O-N 3.38Å; D1228-W1230 PolarHBondContact O-N 2.94Å; D1228-S1231 WeakPolarHBondContact O-CB 3.27Å; D1228-S1231 PolarHBondContact O-N 3.07Å; D1228-S1231 PolarHBondContact O-OG 3.46Å; D1228-Y1232 WeakPolarHBondContact O-CD2 3.42Å
1229	I	88.8	Confident	87.5	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-57.7	-28.7	172.4	-159.6	-178.4	0	0	0	112.9	L1218 I1221 A1222 G1226 D1227 S1231 Y1232 L1233	L1218-I1229 WeakPolarHBondContact O-CD1 3.44Å; I1221-I1229 HydrophobicContact CB-CD1 4.05Å; I1221-I1229 HydrophobicContact CG2-CD1 3.73Å; I1221-I1229 HydrophobicContact CG2-CG1 4.19Å; A1222-I1229 HydrophobicContact CB-CD1 3.82Å; A1222-I1229 HydrophobicContact CB-CG2 3.95Å; G1226-I1229 WeakPolarHBondContact O-CG2 3.49Å; D1227-I1229 PolarHBondContact O-N 3.16Å; D1227-I1229 VanDerWaalsContact O-N 3.15Å; I1229-S1231 PolarHBondContact O-N 3.06Å; I1229-Y1232 PolarHBondContact O-N 3.22Å; I1229-Y1232 VanDerWaalsContact O-N 3.11Å; I1229-L1233 HydrophobicContact CD1-CD1 3.92Å; I1229-L1233 HydrophobicContact CG1-CD1 3.85Å; I1229-L1233 HydrophobicContact CG1-CG 4.18Å; I1229-L1233 PolarHBondContact O-N 3.07Å; I1229-L1233 VanDerWaalsContact O-N 3.08Å
1230	W	89.8	Confident	87.2	Confident	65 Å²	65	54 Å²	54	25%	0.246	31%	0.305	C	S	.	.	H	α-helix	trans	-66.3	-25.2	179	-60.2	121.4	0	0	0	112.6	D1227 D1228 K1241 L1244 K1245 I1248	D1227-W1230 WeakPolarHBondContact O-CB 3.13Å; D1227-W1230 PolarHBondContact O-N 3.26Å; D1227-W1230 PolarHBondContact OD1-NE1 3.22Å; D1228-W1230 PolarHBondContact O-N 2.94Å; W1230-K1241 HydrophobicContact CZ3-CB 4.35Å; W1230-L1244 HydrophobicContact CH2-CB 4.4Å; W1230-L1244 HydrophobicContact CH2-CD2 4.25Å; W1230-L1244 HydrophobicContact CH2-CG 4.2Å; W1230-L1244 HydrophobicContact CZ3-CD2 4.07Å; W1230-L1244 HydrophobicContact CZ3-CG 4.47Å; W1230-K1245 HydrophobicContact CH2-CB 3.69Å; W1230-K1245 HydrophobicContact CZ2-CB 3.85Å; W1230-K1245 HydrophobicContact CZ2-CG 4.17Å; W1230-I1248 HydrophobicContact CH2-CD1 3.75Å; W1230-I1248 HydrophobicContact CZ2-CD1 3.63Å
1231	S	86.5	Confident	86.9	Confident	57 Å²	57	56.1 Å²	56.1	40%	0.399	31%	0.312	S	S	.	.	H	α-helix	trans	-66	-49.8	170.4	76.4	0	0	0	0	110.3	K559 D1228 I1229 L1233	K559-S1231 WeakPolarHBondContact CE-O 3.14Å; K559-S1231 PolarHBondContact NZ-O 2.85Å; D1228-S1231 WeakPolarHBondContact O-CB 3.27Å; D1228-S1231 PolarHBondContact O-N 3.07Å; D1228-S1231 PolarHBondContact O-OG 3.46Å; I1229-S1231 PolarHBondContact O-N 3.06Å; S1231-L1233 PolarHBondContact O-N 3.24Å
1232	Y	85.1	Confident	86.7	Confident	35 Å²	35	65.3 Å²	65.3	14%	0.137	35%	0.347	C	S	.	.	H	α-helix	trans	-65	-36	-176.6	-65.3	-78.9	0	0	0	112.9	K559 H1189 I1192 D1228 I1229 T1234	K559-Y1232 HydrophobicContact CD-CD1 4.11Å; K559-Y1232 PolarHBondContact NZ-O 3.27Å; H1189-Y1232 PolarHBondContact CE1-OH 3.18Å; H1189-Y1232 PolarHBondContact NE2-OH 3.45Å; I1192-Y1232 HydrophobicContact CG1-CD1 3.92Å; I1192-Y1232 HydrophobicContact CG1-CD2 3.89Å; I1192-Y1232 HydrophobicContact CG1-CE1 4.19Å; I1192-Y1232 HydrophobicContact CG1-CE2 4.14Å; I1192-Y1232 HydrophobicContact CG1-CG 3.78Å; I1192-Y1232 HydrophobicContact CG2-CD1 3.96Å; I1192-Y1232 HydrophobicContact CG2-CE1 3.46Å; I1192-Y1232 VanDerWaalsContact CG2-CE1 3.46Å; I1192-Y1232 HydrophobicContact CG2-CE2 4.25Å; D1228-Y1232 WeakPolarHBondContact O-CD2 3.42Å; I1229-Y1232 PolarHBondContact O-N 3.22Å; I1229-Y1232 VanDerWaalsContact O-N 3.11Å; Y1232-T1234 VanDerWaalsContact C-N 3.26Å; Y1232-T1234 PolarHBondContact O-N 3.25Å
1233	L	87.5	Confident	86.5	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.005	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	29.7	-175.6	-68.9	172.8	0	0	0	115.8	I1196 V1200 L1218 I1229 S1231 E1235 L1236 K1241 L1244	I1196-L1233 HydrophobicContact CD1-CD2 3.97Å; I1196-L1233 HydrophobicContact CD1-CG 4.45Å; I1196-L1233 HydrophobicContact CG2-CD2 4.11Å; V1200-L1233 HydrophobicContact CG2-CD2 3.79Å; L1218-L1233 HydrophobicContact CD1-CD2 4.17Å; L1218-L1233 HydrophobicContact CD2-CD2 4.01Å; I1229-L1233 HydrophobicContact CD1-CD1 3.92Å; I1229-L1233 HydrophobicContact CG1-CD1 3.85Å; I1229-L1233 HydrophobicContact CG1-CG 4.18Å; I1229-L1233 PolarHBondContact O-N 3.07Å; I1229-L1233 VanDerWaalsContact O-N 3.08Å; S1231-L1233 PolarHBondContact O-N 3.24Å; L1233-E1235 VanDerWaalsContact C-N 3.3Å; L1233-E1235 PolarHBondContact O-N 3.02Å; L1233-E1235 VanDerWaalsContact O-N 3.16Å; L1233-L1236 HydrophobicContact CB-CB 4.38Å; L1233-L1236 HydrophobicContact CD1-CD2 4.44Å; L1233-L1236 HydrophobicContact CD2-CD2 4.46Å; L1233-L1236 WeakPolarHBondContact O-CB 3.48Å; L1233-L1236 PolarHBondContact O-N 3.35Å; L1233-L1236 VanDerWaalsContact O-N 3.13Å; L1233-K1241 WeakPolarHBondContact O-CE 3.49Å; L1233-K1241 PolarHBondContact O-NZ 3.28Å; L1233-L1244 HydrophobicContact CD1-CD2 3.35Å
1234	T	81	Confident	86.5	Confident	88 Å²	88	65.5 Å²	65.5	54%	0.54	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-45.8	-177.5	38.9	0	0	0	0	114.1	K559 Y1232 L1236 K1241	K559-T1234 PolarHBondContact NZ-OG1 3.35Å; Y1232-T1234 VanDerWaalsContact C-N 3.26Å; Y1232-T1234 PolarHBondContact O-N 3.25Å; T1234-L1236 VanDerWaalsContact C-N 3.33Å; T1234-L1236 PolarHBondContact O-N 3.27Å; T1234-K1241 PolarHBondContact O-NZ 2.89Å
1235	E	81.4	Confident	86.4	Confident	162 Å²	162	66.6 Å²	66.6	76%	0.757	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-21	-174.2	-59	-178.7	168.7	0	0	114.2	V1200 L1233 N1237	V1200-E1235 HydrophobicContact CG1-CB 4.5Å; L1233-E1235 VanDerWaalsContact C-N 3.3Å; L1233-E1235 PolarHBondContact O-N 3.02Å; L1233-E1235 VanDerWaalsContact O-N 3.16Å; E1235-N1237 PolarHBondContact O-N 3.33Å
1236	L	83.7	Confident	86.6	Confident	7 Å²	7	71 Å²	71	4%	0.037	38%	0.377	C	S	.	.	S	Bend	trans	-66.1	123.1	-175.8	-167.8	69	0	0	0	110.5	C1203 L1233 T1234 A1238 K1240 K1241 L1244	C1203-L1236 HydrophobicContact CB-CD1 4.31Å; L1233-L1236 HydrophobicContact CB-CB 4.38Å; L1233-L1236 HydrophobicContact CD1-CD2 4.44Å; L1233-L1236 HydrophobicContact CD2-CD2 4.46Å; L1233-L1236 WeakPolarHBondContact O-CB 3.48Å; L1233-L1236 PolarHBondContact O-N 3.35Å; L1233-L1236 VanDerWaalsContact O-N 3.13Å; T1234-L1236 VanDerWaalsContact C-N 3.33Å; T1234-L1236 PolarHBondContact O-N 3.27Å; L1236-A1238 PolarHBondContact O-N 3.06Å; L1236-K1240 HydrophobicContact CD1-CB 3.86Å; L1236-K1240 HydrophobicContact CD1-CD 4.08Å; L1236-K1240 HydrophobicContact CD2-CB 4.16Å; L1236-K1240 HydrophobicContact CG-CB 3.78Å; L1236-K1241 HydrophobicContact CB-CG 4.15Å; L1236-K1241 HydrophobicContact CD2-CG 4.15Å; L1236-K1241 HydrophobicContact CG-CG 4.31Å; L1236-K1241 WeakPolarHBondContact O-CG 3.4Å; L1236-K1241 PolarHBondContact O-NZ 3.08Å; L1236-L1244 HydrophobicContact CD2-CD2 4.19Å
1237	N	83.3	Confident	86.8	Confident	109 Å²	109	73.6 Å²	73.6	58%	0.583	38%	0.377	S	S	*	.			trans	-49.6	137.7	179.7	179.3	-32.2	0	0	0	111.6	E1235 G1239 K1240 K1241	E1235-N1237 PolarHBondContact O-N 3.33Å; N1237-G1239 PolarHBondContact O-N 2.85Å; N1237-G1239 VanDerWaalsContact O-N 3.07Å; N1237-G1239 PolarHBondContact OD1-N 2.89Å; N1237-K1240 CarbonylContact O-C 3.57Å; N1237-K1240 WeakPolarHBondContact O-CA 3.14Å; N1237-K1240 WeakPolarHBondContact O-CB 3.22Å; N1237-K1240 PolarHBondContact O-N 3.02Å; N1237-K1241 PolarHBondContact O-N 3.44Å
1238	A	84.6	Confident	87	Confident	62 Å²	62	68.4 Å²	68.4	51%	0.512	35%	0.349	S	S	.	.	H	α-helix	trans	-50.3	-34.3	-179.6	0	0	0	0	0	114.3	L1236 K1241 R1242	L1236-A1238 PolarHBondContact O-N 3.06Å; A1238-K1241 PolarHBondContact O-N 2.94Å; A1238-R1242 WeakPolarHBondContact O-CG 3.26Å; A1238-R1242 PolarHBondContact O-N 3.06Å
1239	G	85.2	Confident	87.1	Confident	45 Å²	45	66 Å²	66	46%	0.464	34%	0.336	S	S	.	.	H	α-helix	trans	-64.7	-41.4	173.1	0	0	0	0	0	113	N1237 R1242 L1243	N1237-G1239 PolarHBondContact O-N 2.85Å; N1237-G1239 VanDerWaalsContact O-N 3.07Å; N1237-G1239 PolarHBondContact OD1-N 2.89Å; G1239-R1242 PolarHBondContact O-N 3.43Å; G1239-L1243 PolarHBondContact O-N 3.34Å; G1239-L1243 VanDerWaalsContact O-N 3.1Å
1240	K	86.7	Confident	87.2	Confident	66 Å²	66	74.4 Å²	74.4	29%	0.287	37%	0.368	S	S	.	.	H	α-helix	trans	-72.6	-34.4	175.7	-67.2	-173	-179.5	-176.5	0	112.2	C1203 N1204 L1236 N1237 L1243 L1244	C1203-K1240 PolarHBondContact O-NZ 2.94Å; N1204-K1240 PolarHBondContact OD1-NZ 3.25Å; L1236-K1240 HydrophobicContact CD1-CB 3.86Å; L1236-K1240 HydrophobicContact CD1-CD 4.08Å; L1236-K1240 HydrophobicContact CD2-CB 4.16Å; L1236-K1240 HydrophobicContact CG-CB 3.78Å; N1237-K1240 CarbonylContact O-C 3.57Å; N1237-K1240 WeakPolarHBondContact O-CA 3.14Å; N1237-K1240 WeakPolarHBondContact O-CB 3.22Å; N1237-K1240 PolarHBondContact O-N 3.02Å; K1240-L1243 PolarHBondContact O-N 3.07Å; K1240-L1244 WeakPolarHBondContact O-CB 3.34Å; K1240-L1244 PolarHBondContact O-N 3.43Å
1241	K	87.6	Confident	87	Confident	54 Å²	54	75.3 Å²	75.3	24%	0.235	38%	0.375	C	S	.	.	H	α-helix	trans	-59.5	-44.7	170	-74.4	-173.6	166.2	96.9	0	112.2	W1230 L1233 T1234 L1236 N1237 A1238 L1244 K1245	W1230-K1241 HydrophobicContact CZ3-CB 4.35Å; L1233-K1241 WeakPolarHBondContact O-CE 3.49Å; L1233-K1241 PolarHBondContact O-NZ 3.28Å; T1234-K1241 PolarHBondContact O-NZ 2.89Å; L1236-K1241 HydrophobicContact CB-CG 4.15Å; L1236-K1241 HydrophobicContact CD2-CG 4.15Å; L1236-K1241 HydrophobicContact CG-CG 4.31Å; L1236-K1241 WeakPolarHBondContact O-CG 3.4Å; L1236-K1241 PolarHBondContact O-NZ 3.08Å; N1237-K1241 PolarHBondContact O-N 3.44Å; A1238-K1241 PolarHBondContact O-N 2.94Å; K1241-L1244 PolarHBondContact O-N 3.39Å; K1241-K1245 PolarHBondContact O-N 3.45Å
1242	R	88.5	Confident	86.8	Confident	192 Å²	192	76.6 Å²	76.6	73%	0.725	37%	0.374	S	S	*	.	H	α-helix	trans	-62.1	-44.7	174.9	-71.7	175.5	-175	178.9	1.9	112.1	A1238 G1239 K1245 L1246	A1238-R1242 WeakPolarHBondContact O-CG 3.26Å; A1238-R1242 PolarHBondContact O-N 3.06Å; G1239-R1242 PolarHBondContact O-N 3.43Å; R1242-K1245 PolarHBondContact O-N 3.12Å; R1242-L1246 WeakPolarHBondContact O-CG 3.32Å; R1242-L1246 PolarHBondContact O-N 2.85Å
1243	L	88.9	Confident	86.5	Confident	83 Å²	83	77.7 Å²	77.7	44%	0.435	39%	0.387	S	S	.	.	H	α-helix	trans	-61.9	-44.9	176.8	-177.8	62.8	0	0	0	111.8	G1239 K1240 K1245 L1246 Y1247	G1239-L1243 PolarHBondContact O-N 3.34Å; G1239-L1243 VanDerWaalsContact O-N 3.1Å; K1240-L1243 PolarHBondContact O-N 3.07Å; L1243-K1245 PolarHBondContact O-N 3.43Å; L1243-L1246 PolarHBondContact O-N 3.32Å; L1243-Y1247 HydrophobicContact CD1-CD2 4.21Å; L1243-Y1247 HydrophobicContact CD1-CE2 3.68Å; L1243-Y1247 HydrophobicContact CD2-CE2 4.42Å; L1243-Y1247 HydrophobicContact CG-CD2 4.13Å; L1243-Y1247 HydrophobicContact CG-CE2 3.82Å; L1243-Y1247 VanDerWaalsContact O-CD2 3.24Å; L1243-Y1247 WeakPolarHBondContact O-CD2 3.4Å; L1243-Y1247 PolarHBondContact O-N 3.32Å
1244	L	90.4	Very high	85.9	Confident	5 Å²	5	80 Å²	80	3%	0.026	40%	0.404	C	S	.	.	H	α-helix	trans	-60.9	-44	175.9	-179.4	63.5	0	0	0	111.3	V1215 L1218 V1219 W1230 L1233 L1236 K1240 K1241 L1246 Y1247 I1248	V1215-L1244 HydrophobicContact CG1-CD1 4.38Å; L1218-L1244 HydrophobicContact CB-CD1 3.88Å; L1218-L1244 HydrophobicContact CB-CD2 4.26Å; L1218-L1244 HydrophobicContact CD1-CD2 4.38Å; V1219-L1244 HydrophobicContact CG2-CD1 3.55Å; W1230-L1244 HydrophobicContact CH2-CB 4.4Å; W1230-L1244 HydrophobicContact CH2-CD2 4.25Å; W1230-L1244 HydrophobicContact CH2-CG 4.2Å; W1230-L1244 HydrophobicContact CZ3-CD2 4.07Å; W1230-L1244 HydrophobicContact CZ3-CG 4.47Å; L1233-L1244 HydrophobicContact CD1-CD2 3.35Å; L1236-L1244 HydrophobicContact CD2-CD2 4.19Å; K1240-L1244 WeakPolarHBondContact O-CB 3.34Å; K1240-L1244 PolarHBondContact O-N 3.43Å; K1241-L1244 PolarHBondContact O-N 3.39Å; L1244-L1246 PolarHBondContact O-N 2.97Å; L1244-Y1247 PolarHBondContact O-N 3.39Å; L1244-Y1247 VanDerWaalsContact O-N 3.09Å; L1244-I1248 HydrophobicContact CD1-CD1 4.3Å; L1244-I1248 HydrophobicContact CD1-CG1 4.49Å; L1244-I1248 HydrophobicContact CD2-CD1 4.45Å; L1244-I1248 HydrophobicContact CG-CD1 3.85Å; L1244-I1248 HydrophobicContact CG-CG1 4.47Å; L1244-I1248 WeakPolarHBondContact O-CG1 3.33Å; L1244-I1248 PolarHBondContact O-N 2.88Å
1245	K	89.9	Confident	85.2	Confident	90 Å²	90	77.6 Å²	77.6	39%	0.391	39%	0.393	S	S	.	.	H	α-helix	trans	-59.3	-44.8	176.3	-177.5	169.4	173.2	61.8	0	111.5	W1230 K1241 R1242 L1243 Y1247 I1248 D1249	W1230-K1245 HydrophobicContact CH2-CB 3.69Å; W1230-K1245 HydrophobicContact CZ2-CB 3.85Å; W1230-K1245 HydrophobicContact CZ2-CG 4.17Å; K1241-K1245 PolarHBondContact O-N 3.45Å; R1242-K1245 PolarHBondContact O-N 3.12Å; L1243-K1245 PolarHBondContact O-N 3.43Å; K1245-Y1247 PolarHBondContact O-N 2.82Å; K1245-I1248 PolarHBondContact O-N 3.1Å; K1245-I1248 VanDerWaalsContact O-N 3.08Å; K1245-D1249 WeakPolarHBondContact CE-OD1 3.46Å; K1245-D1249 WeakPolarHBondContact CE-OD2 3.29Å; K1245-D1249 WeakPolarHBondContact CG-OD1 3.5Å; K1245-D1249 WeakPolarHBondContact CG-OD2 3.24Å; K1245-D1249 IonicContact NZ-OD1 2.71Å; K1245-D1249 PolarHBondContact NZ-OD1 2.98Å; K1245-D1249 IonicContact NZ-OD2 3.83Å; K1245-D1249 WeakPolarHBondContact O-CB 3.34Å; K1245-D1249 PolarHBondContact O-N 3.43Å
1246	L	90.3	Very high	84.3	Confident	115 Å²	115	73.9 Å²	73.9	60%	0.602	38%	0.381	S	S	*	.	H	α-helix	trans	-59.5	-32.3	175.7	-69.8	169.7	0	0	0	113.3	R1242 L1243 L1244 R1250	R1242-L1246 WeakPolarHBondContact O-CG 3.32Å; R1242-L1246 PolarHBondContact O-N 2.85Å; L1243-L1246 PolarHBondContact O-N 3.32Å; L1244-L1246 PolarHBondContact O-N 2.97Å; L1246-R1250 VanDerWaalsContact O-CB 3.24Å; L1246-R1250 WeakPolarHBondContact O-CB 3.48Å; L1246-R1250 PolarHBondContact O-N 3.16Å
1247	Y	92	Very high	83.2	Confident	86 Å²	86	76.5 Å²	76.5	34%	0.337	40%	0.4	S	S	.	.	H	α-helix	trans	-76.2	-34.8	173.3	-77	-67.3	0	0	0	113.3	V1215 F1216 L1243 L1244 K1245 Q1251	V1215-Y1247 HydrophobicContact CG1-CD2 3.78Å; V1215-Y1247 HydrophobicContact CG1-CE2 4.1Å; V1215-Y1247 HydrophobicContact CG1-CG 4.48Å; F1216-Y1247 HydrophobicContact CZ-CE1 4.42Å; L1243-Y1247 HydrophobicContact CD1-CD2 4.21Å; L1243-Y1247 HydrophobicContact CD1-CE2 3.68Å; L1243-Y1247 HydrophobicContact CD2-CE2 4.42Å; L1243-Y1247 HydrophobicContact CG-CD2 4.13Å; L1243-Y1247 HydrophobicContact CG-CE2 3.82Å; L1243-Y1247 VanDerWaalsContact O-CD2 3.24Å; L1243-Y1247 WeakPolarHBondContact O-CD2 3.4Å; L1243-Y1247 PolarHBondContact O-N 3.32Å; L1244-Y1247 PolarHBondContact O-N 3.39Å; L1244-Y1247 VanDerWaalsContact O-N 3.09Å; K1245-Y1247 PolarHBondContact O-N 2.82Å; Y1247-Q1251 PolarHBondContact O-N 3.27Å
1248	I	89.9	Confident	81.9	Confident	8 Å²	8	77.9 Å²	77.9	4%	0.041	40%	0.403	C	S	.	.	H	α-helix	trans	-67	-54.1	174.4	-66	163	0	0	0	110.1	V1219 A1222 W1230 L1244 K1245 R1250 Q1251 Q1252	V1219-I1248 HydrophobicContact CG1-CG1 4.33Å; V1219-I1248 HydrophobicContact CG2-CG1 4.29Å; A1222-I1248 HydrophobicContact CB-CD1 3.41Å; A1222-I1248 VanDerWaalsContact CB-CD1 3.41Å; A1222-I1248 HydrophobicContact CB-CG1 3.66Å; A1222-I1248 HydrophobicContact CB-CG2 4.49Å; W1230-I1248 HydrophobicContact CH2-CD1 3.75Å; W1230-I1248 HydrophobicContact CZ2-CD1 3.63Å; L1244-I1248 HydrophobicContact CD1-CD1 4.3Å; L1244-I1248 HydrophobicContact CD1-CG1 4.49Å; L1244-I1248 HydrophobicContact CD2-CD1 4.45Å; L1244-I1248 HydrophobicContact CG-CD1 3.85Å; L1244-I1248 HydrophobicContact CG-CG1 4.47Å; L1244-I1248 WeakPolarHBondContact O-CG1 3.33Å; L1244-I1248 PolarHBondContact O-N 2.88Å; K1245-I1248 PolarHBondContact O-N 3.1Å; K1245-I1248 VanDerWaalsContact O-N 3.08Å; I1248-R1250 PolarHBondContact O-N 3.1Å; I1248-Q1251 PolarHBondContact O-N 3.27Å; I1248-Q1252 HydrophobicContact CG2-CG 4.32Å; I1248-Q1252 WeakPolarHBondContact O-CG 3.48Å; I1248-Q1252 PolarHBondContact O-N 2.99Å
1249	D	88.3	Confident	80.2	Confident	57 Å²	57	79.8 Å²	79.8	31%	0.305	41%	0.405	S	S	.	.	H	α-helix	trans	-54.5	-39.7	178.3	-61.1	-11.4	0	0	0	110.1	K1245 S1253	K1245-D1249 WeakPolarHBondContact CE-OD1 3.46Å; K1245-D1249 WeakPolarHBondContact CE-OD2 3.29Å; K1245-D1249 WeakPolarHBondContact CG-OD1 3.5Å; K1245-D1249 WeakPolarHBondContact CG-OD2 3.24Å; K1245-D1249 IonicContact NZ-OD1 2.71Å; K1245-D1249 PolarHBondContact NZ-OD1 2.98Å; K1245-D1249 IonicContact NZ-OD2 3.83Å; K1245-D1249 WeakPolarHBondContact O-CB 3.34Å; K1245-D1249 PolarHBondContact O-N 3.43Å; D1249-S1253 WeakPolarHBondContact O-CB 3.46Å; D1249-S1253 PolarHBondContact O-N 2.97Å; D1249-S1253 PolarHBondContact O-OG 3.32Å
1250	R	89.8	Confident	78.5	Confident	176 Å²	176	80.8 Å²	80.8	66%	0.664	40%	0.404	S	S	*	.	H	α-helix	trans	-66.7	-44	174.8	-176.5	173.7	178.8	162.9	2.6	113.5	L1246 I1248 S1253 S1254	L1246-R1250 VanDerWaalsContact O-CB 3.24Å; L1246-R1250 WeakPolarHBondContact O-CB 3.48Å; L1246-R1250 PolarHBondContact O-N 3.16Å; I1248-R1250 PolarHBondContact O-N 3.1Å; R1250-S1253 PolarHBondContact O-N 3.25Å; R1250-S1253 PolarHBondContact O-OG 3.39Å; R1250-S1254 PolarHBondContact O-N 2.99Å; R1250-S1254 VanDerWaalsContact O-N 3.1Å; R1250-S1254 PolarHBondContact O-OG 2.54Å
1251	Q	86.1	Confident	76.9	Confident	84 Å²	84	82.8 Å²	82.8	39%	0.393	42%	0.417	S	S	.	.	H	α-helix	trans	-65.1	-43.3	176.6	-80.7	-68.1	4.3	0	0	111.7	V1219 M1223 Y1247 I1248 S1253 S1254 A1255	V1219-Q1251 HydrophobicContact CG1-CB 4.22Å; V1219-Q1251 HydrophobicContact CG1-CG 3.7Å; M1223-Q1251 HydrophobicContact CG-CB 4.5Å; M1223-Q1251 HydrophobicContact SD-CB 4.01Å; Y1247-Q1251 PolarHBondContact O-N 3.27Å; I1248-Q1251 PolarHBondContact O-N 3.27Å; Q1251-S1253 PolarHBondContact O-N 3.21Å; Q1251-S1254 WeakPolarHBondContact O-CB 3.23Å; Q1251-S1254 PolarHBondContact O-N 3.29Å; Q1251-S1254 VanDerWaalsContact O-N 3.12Å; Q1251-A1255 PolarHBondContact O-N 3.01Å
1252	Q	82.8	Confident	75.1	Confident	83 Å²	83	84.6 Å²	84.6	39%	0.388	43%	0.433	S	S	.	.	H	α-helix	trans	-58.9	-46.4	175	-69.5	178.1	-8.3	0	0	111.4	M1223 I1248 S1254 A1255 T1256	M1223-Q1252 HydrophobicContact CE-CG 4.03Å; M1223-Q1252 HydrophobicContact SD-CG 3.67Å; I1248-Q1252 HydrophobicContact CG2-CG 4.32Å; I1248-Q1252 WeakPolarHBondContact O-CG 3.48Å; I1248-Q1252 PolarHBondContact O-N 2.99Å; Q1252-S1254 PolarHBondContact O-N 3.21Å; Q1252-A1255 PolarHBondContact O-N 3.14Å; Q1252-T1256 PolarHBondContact O-N 2.88Å; Q1252-T1256 PolarHBondContact O-OG1 3.18Å
1253	S	78.6	Confident	73.3	Confident	58 Å²	58	81 Å²	81	41%	0.406	43%	0.432	S	S	.	.	H	α-helix	trans	-61.6	-31.3	176.5	70.7	0	0	0	0	113.6	D1249 R1250 Q1251 T1256 S1257	D1249-S1253 WeakPolarHBondContact O-CB 3.46Å; D1249-S1253 PolarHBondContact O-N 2.97Å; D1249-S1253 PolarHBondContact O-OG 3.32Å; R1250-S1253 PolarHBondContact O-N 3.25Å; R1250-S1253 PolarHBondContact O-OG 3.39Å; Q1251-S1253 PolarHBondContact O-N 3.21Å; S1253-T1256 WeakPolarHBondContact CA-OG1 3.35Å; S1253-T1256 PolarHBondContact O-OG1 3.43Å; S1253-T1256 VanDerWaalsContact O-OG1 3.05Å; S1253-S1257 PolarHBondContact O-N 3.43Å; S1253-S1257 PolarHBondContact O-OG 3.27Å
1254	S	76	Confident	71.2	Confident	50 Å²	50	88 Å²	88	35%	0.35	45%	0.453	S	S	.	.	H	α-helix	trans	-69.9	-49.9	177.1	-54.1	0	0	0	0	110.4	R1250 Q1251 Q1252 T1256 S1257 E1258	R1250-S1254 PolarHBondContact O-N 2.99Å; R1250-S1254 VanDerWaalsContact O-N 3.1Å; R1250-S1254 PolarHBondContact O-OG 2.54Å; Q1251-S1254 WeakPolarHBondContact O-CB 3.23Å; Q1251-S1254 PolarHBondContact O-N 3.29Å; Q1251-S1254 VanDerWaalsContact O-N 3.12Å; Q1252-S1254 PolarHBondContact O-N 3.21Å; S1254-T1256 PolarHBondContact O-N 3.07Å; S1254-S1257 WeakPolarHBondContact O-CB 3.1Å; S1254-S1257 PolarHBondContact O-N 3.02Å; S1254-E1258 PolarHBondContact O-N 2.88Å; S1254-E1258 VanDerWaalsContact O-N 3.16Å
1255	A	66	Low	68.6	Low	38 Å²	38	94.9 Å²	94.9	31%	0.314	50%	0.502	S	S	.	.	H	α-helix	trans	-58.2	-46.9	176.1	0	0	0	0	0	112.4	Q1251 Q1252 S1257 E1258 D1259	Q1251-A1255 PolarHBondContact O-N 3.01Å; Q1252-A1255 PolarHBondContact O-N 3.14Å; A1255-S1257 PolarHBondContact O-N 3.04Å; A1255-S1257 VanDerWaalsContact O-N 3.16Å; A1255-E1258 PolarHBondContact O-N 3.39Å; A1255-E1258 VanDerWaalsContact O-N 3.08Å; A1255-D1259 PolarHBondContact O-N 2.93Å
1256	T	61.6	Low	67.5	Low	84 Å²	84	95.2 Å²	95.2	52%	0.515	51%	0.507	S	S	.	.	H	α-helix	trans	-64.2	-22.4	177.4	54.3	0	0	0	0	113.6	Q1252 S1253 S1254 S1260	Q1252-T1256 PolarHBondContact O-N 2.88Å; Q1252-T1256 PolarHBondContact O-OG1 3.18Å; S1253-T1256 WeakPolarHBondContact CA-OG1 3.35Å; S1253-T1256 PolarHBondContact O-OG1 3.43Å; S1253-T1256 VanDerWaalsContact O-OG1 3.05Å; S1254-T1256 PolarHBondContact O-N 3.07Å; T1256-S1260 WeakPolarHBondContact O-CB 3.26Å; T1256-S1260 PolarHBondContact O-N 3.16Å; T1256-S1260 PolarHBondContact O-OG 2.75Å
1257	S	60	Low	66.3	Low	62 Å²	62	94.1 Å²	94.1	43%	0.434	50%	0.502	S	S	.	.	H	α-helix	trans	-76.2	-38.8	174.2	-58.2	0	0	0	0	111.3	S1253 S1254 A1255 S1260 I1261	S1253-S1257 PolarHBondContact O-N 3.43Å; S1253-S1257 PolarHBondContact O-OG 3.27Å; S1254-S1257 WeakPolarHBondContact O-CB 3.1Å; S1254-S1257 PolarHBondContact O-N 3.02Å; A1255-S1257 PolarHBondContact O-N 3.04Å; A1255-S1257 VanDerWaalsContact O-N 3.16Å; S1257-S1260 PolarHBondContact O-OG 3.05Å; S1257-I1261 WeakPolarHBondContact O-CD1 3.47Å; S1257-I1261 VanDerWaalsContact O-CG1 3.25Å; S1257-I1261 WeakPolarHBondContact O-CG1 3.43Å; S1257-I1261 PolarHBondContact O-N 3.47Å; S1257-I1261 VanDerWaalsContact O-N 3.14Å
1258	E	57.2	Low	64.9	Low	137 Å²	137	94.6 Å²	94.6	64%	0.64	51%	0.511	S	S	*	.	H	α-helix	trans	-70.1	-40.9	175.5	-65.7	-176.7	154	0	0	111.5	S1254 A1255 S1260 I1261 T1262	S1254-E1258 PolarHBondContact O-N 2.88Å; S1254-E1258 VanDerWaalsContact O-N 3.16Å; A1255-E1258 PolarHBondContact O-N 3.39Å; A1255-E1258 VanDerWaalsContact O-N 3.08Å; E1258-S1260 VanDerWaalsContact C-N 3.35Å; E1258-S1260 PolarHBondContact O-N 3.26Å; E1258-I1261 PolarHBondContact O-N 2.68Å; E1258-T1262 WeakPolarHBondContact O-CB 3.2Å; E1258-T1262 WeakPolarHBondContact O-CG2 3.27Å; E1258-T1262 PolarHBondContact O-N 2.71Å; E1258-T1262 PolarHBondContact O-OG1 3.07Å
1259	D	49.2	Very low	63.4	Low	102 Å²	102	99.6 Å²	99.6	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-61.1	-39.4	173.6	-73.9	-27.6	0	0	0	112.6	A1255 T1262 T1263	A1255-D1259 PolarHBondContact O-N 2.93Å; D1259-T1262 WeakPolarHBondContact CA-OG1 3.45Å; D1259-T1262 PolarHBondContact O-OG1 2.93Å; D1259-T1263 WeakPolarHBondContact O-CB 3.37Å; D1259-T1263 WeakPolarHBondContact O-CG2 3.35Å; D1259-T1263 PolarHBondContact O-N 2.77Å; D1259-T1263 PolarHBondContact O-OG1 2.69Å
1260	S	49.9	Very low	61.9	Low	66 Å²	66	102.3 Å²	102.3	46%	0.462	55%	0.554	S	S	.	*	H	α-helix	trans	-81.2	-13.9	-179.6	55.9	0	0	0	0	114.5	T1256 S1257 E1258	T1256-S1260 WeakPolarHBondContact O-CB 3.26Å; T1256-S1260 PolarHBondContact O-N 3.16Å; T1256-S1260 PolarHBondContact O-OG 2.75Å; S1257-S1260 PolarHBondContact O-OG 3.05Å; E1258-S1260 VanDerWaalsContact C-N 3.35Å; E1258-S1260 PolarHBondContact O-N 3.26Å
1261	I	51.5	Low	60	Low	108 Å²	108	97.4 Å²	97.4	55%	0.554	55%	0.546	S	S	*	.	H	α-helix	trans	-84.8	-43.3	167.5	-70.2	166.5	0	0	0	110.3	S1257 E1258 T1263 R1264 S1265	S1257-I1261 WeakPolarHBondContact O-CD1 3.47Å; S1257-I1261 VanDerWaalsContact O-CG1 3.25Å; S1257-I1261 WeakPolarHBondContact O-CG1 3.43Å; S1257-I1261 PolarHBondContact O-N 3.47Å; S1257-I1261 VanDerWaalsContact O-N 3.14Å; E1258-I1261 PolarHBondContact O-N 2.68Å; I1261-T1263 VanDerWaalsContact C-N 3.34Å; I1261-T1263 PolarHBondContact O-N 3.22Å; I1261-R1264 PolarHBondContact O-N 3.01Å; I1261-S1265 PolarHBondContact O-N 2.67Å; I1261-S1265 PolarHBondContact O-OG 2.79Å
1262	T	49.9	Very low	58.2	Low	92 Å²	92	98.4 Å²	98.4	56%	0.564	56%	0.557	S	S	*	*	H	α-helix	trans	-74.6	-17.5	-179.6	52.9	0	0	0	0	114.3	E1258 D1259	E1258-T1262 WeakPolarHBondContact O-CB 3.2Å; E1258-T1262 WeakPolarHBondContact O-CG2 3.27Å; E1258-T1262 PolarHBondContact O-N 2.71Å; E1258-T1262 PolarHBondContact O-OG1 3.07Å; D1259-T1262 WeakPolarHBondContact CA-OG1 3.45Å; D1259-T1262 PolarHBondContact O-OG1 2.93Å
1263	T	50.6	Low	56.3	Low	116 Å²	116	99.5 Å²	99.5	71%	0.712	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	3.4	169.3	52.1	0	0	0	0	114.1	D1259 I1261	D1259-T1263 WeakPolarHBondContact O-CB 3.37Å; D1259-T1263 WeakPolarHBondContact O-CG2 3.35Å; D1259-T1263 PolarHBondContact O-N 2.77Å; D1259-T1263 PolarHBondContact O-OG1 2.69Å; I1261-T1263 VanDerWaalsContact C-N 3.34Å; I1261-T1263 PolarHBondContact O-N 3.22Å
1264	R	45.1	Very low	54.4	Low	231 Å²	231	103 Å²	103	87%	0.872	58%	0.584	S	S	*	*			trans	-118.7	4.9	173.1	-94	-175.4	165.8	-169.2	-3.1	113.8	I1261	I1261-R1264 PolarHBondContact O-N 3.01Å
1265	S	36	Very low	52.4	Low	150 Å²	150	107.8 Å²	107.8	100%	1.049	61%	0.606	S	S	*	*			trans	-115.4	0	178.7	-52.5	0	0	0	0	110.5	I1261	I1261-S1265 PolarHBondContact O-N 2.67Å; I1261-S1265 PolarHBondContact O-OG 2.79Å

Retrieved 1,265 of 1,265 residues in 793.9 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).