A0A077Z1D5_TRITR Loading...

Putative mitochondrial transcription termination factor mterf

AlphaFold DB , UniProt , Accession A0A077Z1D5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 331 aa.

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	29.7	Very low	29.4	Very low	241 Å²	241	149 Å²	149	100%	1.187	85%	0.849	S	S	*	*				0	119.2	0	-71.1	-166.5	-178.1	0	0	107.9
2	P	35.3	Very low	29.2	Very low	129 Å²	129	142.8 Å²	142.8	84%	0.838	84%	0.842	S	S	*	*				-131.2	141.1	120.5	25.2	-9.2	0	0	0	111.6
3	Q	27.5	Very low	29.2	Very low	197 Å²	197	145.6 Å²	145.6	92%	0.921	85%	0.85	S	S	*	*			trans	-71.1	130.3	167.6	-76.9	166.6	-58.1	0	0	109.1
4	A	33.8	Very low	29.1	Very low	98 Å²	98	148.4 Å²	148.4	81%	0.81	85%	0.851	S	S	*	*			trans	-126.5	117	160.3	0	0	0	0	0	107.9
5	V	30.5	Very low	28.8	Very low	123 Å²	123	150.9 Å²	150.9	75%	0.745	85%	0.852	S	S	*	*			trans	-68.4	120.4	-179.4	171.2	0	0	0	0	109	T7	V5-T7 HydrophobicContact CG1-CG2 4.11Å
6	L	31	Very low	28.7	Very low	176 Å²	176	150.1 Å²	150.1	92%	0.921	85%	0.851	S	S	*	*			trans	-97.4	91.4	168	-90.3	159.4	0	0	0	108.7
7	T	24	Very low	28.7	Very low	111 Å²	111	147.2 Å²	147.2	68%	0.681	84%	0.837	S	S	*	*			trans	-83.6	125.6	155.8	39	0	0	0	0	108.7	V5	V5-T7 HydrophobicContact CG1-CG2 4.11Å
8	S	28.2	Very low	28.8	Very low	102 Å²	102	146.1 Å²	146.1	71%	0.713	84%	0.836	S	S	*	*			trans	-179.2	116	138.2	-80.7	0	0	0	0	112
9	L	28.6	Very low	29.2	Very low	151 Å²	151	144.5 Å²	144.5	79%	0.791	83%	0.83	S	S	*	*				58.6	100.8	129.2	-60.6	153.3	0	0	0	117
10	E	23.9	Very low	29.6	Very low	192 Å²	192	143 Å²	143	90%	0.897	82%	0.819	S	S	*	*				41.9	91.8	78.4	-69.6	-170.8	168.1	0	0	114
11	S	30.7	Very low	30.1	Very low	119 Å²	119	141.6 Å²	141.6	83%	0.832	81%	0.813	S	S	*	*			trans	-151.5	109.2	151.2	68.6	0	0	0	0	111.5
12	G	27.3	Very low	31	Very low	75 Å²	75	133.3 Å²	133.3	77%	0.773	78%	0.783	S	S	*	*			trans	79.3	72.8	139.7	0	0	0	0	0	118.4
13	L	28.9	Very low	31.9	Very low	179 Å²	179	129.9 Å²	129.9	94%	0.937	76%	0.757	S	S	*	*			trans	-95.7	102.5	148.4	-78.6	165.6	0	0	0	107.5	E15	L13-E15 PolarHBondContact O-N 3.31Å
14	Q	28	Very low	33.1	Very low	185 Å²	185	126.2 Å²	126.2	86%	0.864	75%	0.75	S	S	*	*			trans	-60.7	122.2	172.1	-83.5	175	-20.5	0	0	109.8	V16	Q14-V16 PolarHBondContact O-N 3.01Å; Q14-V16 VanDerWaalsContact O-N 3.16Å
15	E	24.2	Very low	34	Very low	186 Å²	186	123.9 Å²	123.9	87%	0.869	72%	0.724	S	S	*	*			trans	-56.3	110.5	165.3	-92.7	176.8	142.7	0	0	109.9	L13 T17	L13-E15 PolarHBondContact O-N 3.31Å; E15-T17 PolarHBondContact O-N 3.28Å
16	V	27.4	Very low	34.6	Very low	137 Å²	137	120.2 Å²	120.2	83%	0.83	70%	0.703	S	S	*	*			trans	-85.3	98.6	165	-177.3	0	0	0	0	107.1	Q14	Q14-V16 PolarHBondContact O-N 3.01Å; Q14-V16 VanDerWaalsContact O-N 3.16Å
17	T	28.3	Very low	35.5	Very low	102 Å²	102	114.2 Å²	114.2	63%	0.626	68%	0.676	S	S	*	*			trans	-61.7	133	169.4	50.4	0	0	0	0	110.2	E15 T19	E15-T17 PolarHBondContact O-N 3.28Å; T17-T19 PolarHBondContact O-N 3.13Å
18	P	31.3	Very low	36.6	Very low	126 Å²	126	111.5 Å²	111.5	82%	0.818	66%	0.659	S	S	*	*			trans	-79.9	91.2	-179.8	30.7	-31.4	0	0	0	110.4	D20	P18-D20 PolarHBondContact O-N 3.16Å
19	T	35.8	Very low	37.2	Very low	117 Å²	117	111.3 Å²	111.3	72%	0.718	66%	0.658	S	S	*	*			trans	-77	93.6	162.1	6.9	0	0	0	0	108.2	T17 V21	T17-T19 PolarHBondContact O-N 3.13Å; T19-V21 HydrophobicContact CG2-CG2 4.27Å; T19-V21 PolarHBondContact O-N 3.42Å
20	D	36.8	Very low	37.1	Very low	113 Å²	113	110.4 Å²	110.4	60%	0.604	65%	0.653	S	S	*	*			trans	-67	67.7	163.1	-104.3	-19.9	0	0	0	108.5	P18 A22	P18-D20 PolarHBondContact O-N 3.16Å; D20-A22 PolarHBondContact O-N 3.38Å; D20-A22 VanDerWaalsContact O-N 3.13Å
21	V	41.6	Very low	37.5	Very low	114 Å²	114	105.6 Å²	105.6	69%	0.691	64%	0.637	S	S	*	*			trans	-76.2	97.5	164.2	-178.1	0	0	0	0	105.4	T19 D23	T19-V21 HydrophobicContact CG2-CG2 4.27Å; T19-V21 PolarHBondContact O-N 3.42Å; V21-D23 PolarHBondContact O-N 3.32Å
22	A	48.4	Very low	37.2	Very low	67 Å²	67	105.4 Å²	105.4	55%	0.554	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-55.3	123.6	178.4	0	0	0	0	0	110.1	D20	D20-A22 PolarHBondContact O-N 3.38Å; D20-A22 VanDerWaalsContact O-N 3.13Å
23	D	54.4	Low	37.5	Very low	57 Å²	57	108 Å²	108	31%	0.305	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-53.3	135.8	174.1	-55.5	-59.4	0	0	0	109.4	V21 L25 Y240 K241 S242	V21-D23 PolarHBondContact O-N 3.32Å; D23-L25 PolarHBondContact O-N 3.16Å; D23-Y240 HydrophobicContact CB-CD1 4.23Å; D23-Y240 WeakPolarHBondContact O-CD1 3.37Å; D23-Y240 WeakPolarHBondContact O-CE1 3.48Å; D23-K241 PolarHBondContact OD2-N 3.28Å; D23-S242 VanDerWaalsContact OD2-CB 3.28Å; D23-S242 WeakPolarHBondContact OD2-CB 3.47Å; D23-S242 PolarHBondContact OD2-N 3.22Å; D23-S242 PolarHBondContact OD2-OG 3.19Å
24	P	53	Low	37.2	Very low	120 Å²	120	108.4 Å²	108.4	78%	0.779	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-67.4	124.4	173	24	-29.3	0	0	0	110.1
25	L	52.3	Low	37.2	Very low	50 Å²	50	102.2 Å²	102.2	26%	0.262	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-67.5	149.6	163.2	-84.5	167.6	0	0	0	108.9	D23 S27 Y207 Y240	D23-L25 PolarHBondContact O-N 3.16Å; L25-S27 PolarHBondContact O-N 3.33Å; L25-S27 VanDerWaalsContact O-N 3.15Å; L25-Y207 HydrophobicContact CD2-CD1 4.49Å; L25-Y207 HydrophobicContact CD2-CE1 4.05Å; L25-Y240 HydrophobicContact CB-CE1 4.2Å; L25-Y240 HydrophobicContact CD1-CE1 3.77Å; L25-Y240 HydrophobicContact CD1-CE2 4.19Å; L25-Y240 HydrophobicContact CD2-CE1 4.42Å; L25-Y240 HydrophobicContact CG-CD1 3.99Å; L25-Y240 HydrophobicContact CG-CE1 3.42Å; L25-Y240 VanDerWaalsContact CG-CE1 3.42Å
26	P	43.1	Very low	37.2	Very low	45 Å²	45	103 Å²	103	29%	0.292	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-53.8	124.9	171.6	-19.5	28.4	0	0	0	110.6	Y207	P26-Y207 HydrophobicContact CG-CD2 4.37Å; P26-Y207 HydrophobicContact CG-CG 4.14Å
27	S	49.1	Very low	37.1	Very low	51 Å²	51	104.4 Å²	104.4	36%	0.357	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-70.2	140.4	167.7	95.5	0	0	0	0	108.2	L25 S29 D30	L25-S27 PolarHBondContact O-N 3.33Å; L25-S27 VanDerWaalsContact O-N 3.15Å; S27-S29 PolarHBondContact O-N 3.38Å; S27-S29 PolarHBondContact OG-N 2.95Å; S27-S29 PolarHBondContact OG-OG 3.43Å; S27-D30 PolarHBondContact OG-OD2 3.45Å
28	V	47.9	Very low	36.9	Very low	53 Å²	53	105.7 Å²	105.7	32%	0.321	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.8	-11.7	174.6	179.8	0	0	0	0	111	Y163 F167 F203	V28-Y163 HydrophobicContact CG1-CD2 4.24Å; V28-Y163 HydrophobicContact CG1-CG 4.39Å; V28-Y163 HydrophobicContact CG2-CD2 4.22Å; V28-Y163 HydrophobicContact CG2-CE2 4.45Å; V28-F167 HydrophobicContact CG1-CZ 4.33Å; V28-F203 HydrophobicContact CG2-CD1 4.14Å; V28-F203 HydrophobicContact CG2-CE1 4.06Å
29	S	39.8	Very low	36.6	Very low	99 Å²	99	106.2 Å²	106.2	69%	0.692	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-14.4	-176.1	29.8	0	0	0	0	115.4	S27 T31	S27-S29 PolarHBondContact O-N 3.38Å; S27-S29 PolarHBondContact OG-N 2.95Å; S27-S29 PolarHBondContact OG-OG 3.43Å; S29-T31 PolarHBondContact O-N 2.88Å
30	D	27.7	Very low	36.2	Very low	131 Å²	131	106.1 Å²	106.1	70%	0.701	64%	0.635	S	S	*	*			trans	-101.2	36.5	-172.7	-61.8	-45.8	0	0	0	114.7	S27 S32	S27-D30 PolarHBondContact OG-OD2 3.45Å; D30-S32 PolarHBondContact O-N 3.05Å
31	T	30.8	Very low	35.8	Very low	91 Å²	91	111.7 Å²	111.7	56%	0.558	65%	0.648	S	S	*	*			trans	-90.8	85.7	159.3	52.7	0	0	0	0	109.3	S29 V33	S29-T31 PolarHBondContact O-N 2.88Å; T31-V33 PolarHBondContact O-N 3.22Å
32	S	25.7	Very low	35.3	Very low	116 Å²	116	114.1 Å²	114.1	81%	0.811	66%	0.656	S	S	*	*			trans	-59.7	101.5	161.9	-79.6	0	0	0	0	108.9	D30 E34	D30-S32 PolarHBondContact O-N 3.05Å; S32-E34 PolarHBondContact O-N 3.14Å
33	V	33.5	Very low	34.5	Very low	129 Å²	129	116.2 Å²	116.2	78%	0.782	67%	0.674	S	S	*	*			trans	-88.1	96.2	161.9	-175.6	0	0	0	0	106	T31 G35	T31-V33 PolarHBondContact O-N 3.22Å; V33-G35 PolarHBondContact O-N 3.27Å
34	E	23	Very low	33.3	Very low	187 Å²	187	116.9 Å²	116.9	87%	0.874	69%	0.694	S	S	*	*			trans	-67	78	167.6	-75	-175.9	152	0	0	109.6	S32	S32-E34 PolarHBondContact O-N 3.14Å
35	G	27.6	Very low	32.4	Very low	55 Å²	55	122.7 Å²	122.7	57%	0.567	70%	0.701	S	S	*	*			trans	-91	98.8	164	0	0	0	0	0	109.1	V33 L37	V33-G35 PolarHBondContact O-N 3.27Å; G35-L37 PolarHBondContact O-N 3.35Å
36	K	23.4	Very low	31.5	Very low	203 Å²	203	128.3 Å²	128.3	88%	0.883	73%	0.729	S	S	*	*			trans	-51.9	101	171.4	-76.8	175.5	175.3	175.3	0	110.4	T38	K36-T38 PolarHBondContact O-N 2.94Å
37	L	24.9	Very low	31.1	Very low	166 Å²	166	130 Å²	130	87%	0.869	74%	0.742	S	S	*	*			trans	-85.9	102.9	163.9	-77.9	161.5	0	0	0	107.7	G35 V39	G35-L37 PolarHBondContact O-N 3.35Å; L37-V39 PolarHBondContact O-N 3.24Å
38	T	24.4	Very low	30.6	Very low	130 Å²	130	137.2 Å²	137.2	80%	0.798	77%	0.767	S	S	*	*			trans	-61.4	123.3	170.8	36.4	0	0	0	0	109.8	K36 S40	K36-T38 PolarHBondContact O-N 2.94Å; T38-S40 PolarHBondContact O-N 3.41Å
39	V	25	Very low	30	Very low	136 Å²	136	144.3 Å²	144.3	82%	0.824	79%	0.789	S	S	*	*			trans	-72.7	94.8	178.1	179.2	0	0	0	0	108.7	L37	L37-V39 PolarHBondContact O-N 3.24Å
40	S	28.2	Very low	29.5	Very low	116 Å²	116	148.9 Å²	148.9	81%	0.811	80%	0.797	S	S	*	*			trans	-85.9	118.5	160.9	-109.5	0	0	0	0	109.3	T38 D42	T38-S40 PolarHBondContact O-N 3.41Å; S40-D42 PolarHBondContact O-N 3.09Å
41	R	28.2	Very low	30.1	Very low	230 Å²	230	147.2 Å²	147.2	87%	0.868	80%	0.795	S	S	*	*			trans	-66.4	107.2	172.4	-72.4	171.4	166.6	167.8	-4.8	109
42	D	30.8	Very low	30.5	Very low	164 Å²	164	152 Å²	152	88%	0.877	81%	0.808	S	S	*	*			trans	-142.2	86.9	152.3	-100.3	-28	0	0	0	109.2	S40 G44	S40-D42 PolarHBondContact O-N 3.09Å; D42-G44 PolarHBondContact O-N 3.47Å
43	A	31.1	Very low	31.3	Very low	112 Å²	112	153.6 Å²	153.6	93%	0.926	81%	0.807	S	S	*	*			trans	-73.7	97.8	166.8	0	0	0	0	0	108.2
44	G	30.5	Very low	31.8	Very low	70 Å²	70	155.9 Å²	155.9	72%	0.722	81%	0.807	S	S	*	*			trans	178.6	29.6	-178	0	0	0	0	0	119.3	D42	D42-G44 PolarHBondContact O-N 3.47Å
45	R	33.5	Very low	32.8	Very low	243 Å²	243	150.8 Å²	150.8	92%	0.917	79%	0.785	S	S	*	*			trans	-154.3	82.5	162.4	-142.9	169.8	-178.4	178.9	0.1	112.1	S47	R45-S47 PolarHBondContact O-N 2.99Å
46	I	34.1	Very low	33.6	Very low	167 Å²	167	157.6 Å²	157.6	86%	0.856	80%	0.799	S	S	*	*			trans	-58.2	107.7	168.3	-62.4	171.9	0	0	0	107.3	K48	I46-K48 PolarHBondContact O-N 3.32Å
47	S	34.9	Very low	34.7	Very low	80 Å²	80	149.7 Å²	149.7	56%	0.559	77%	0.769	S	S	*	*			trans	-51.3	123.5	175.6	169.6	0	0	0	0	110.2	R45 Y49	R45-S47 PolarHBondContact O-N 2.99Å; S47-Y49 PolarHBondContact O-N 3.28Å; S47-Y49 PolarHBondContact OG-N 3.24Å
48	K	37.2	Very low	36.2	Very low	203 Å²	203	153 Å²	153	88%	0.883	77%	0.772	S	S	*	*	S	Bend	trans	-68.3	6.6	176.9	-74.8	-175.7	175.3	-178.6	0	113.9	I46 K50	I46-K48 PolarHBondContact O-N 3.32Å; K48-K50 PolarHBondContact O-N 3.26Å
49	Y	35	Very low	38.4	Very low	203 Å²	203	149.9 Å²	149.9	80%	0.796	75%	0.753	S	S	*	*			trans	-103	72.4	177.3	-58.6	-78.6	0	0	0	110.3	S47 S51	S47-Y49 PolarHBondContact O-N 3.28Å; S47-Y49 PolarHBondContact OG-N 3.24Å; Y49-S51 VanDerWaalsContact C-N 3.3Å; Y49-S51 PolarHBondContact O-N 3.5Å; Y49-S51 VanDerWaalsContact O-N 3.09Å
50	K	31.1	Very low	40.7	Very low	195 Å²	195	143.6 Å²	143.6	85%	0.848	71%	0.714	S	S	*	*			trans	-71.1	92.5	155.7	-88.6	-174.1	175.8	179.5	0	107.3	K48 K52	K48-K50 PolarHBondContact O-N 3.26Å; K50-K52 PolarHBondContact O-N 3.18Å; K50-K52 VanDerWaalsContact O-N 3.1Å
51	S	39.3	Very low	42.7	Very low	96 Å²	96	141 Å²	141	67%	0.671	70%	0.7	S	S	*	*			trans	-65.8	105.4	165.7	52.4	0	0	0	0	108.8	Y49 L53	Y49-S51 VanDerWaalsContact C-N 3.3Å; Y49-S51 PolarHBondContact O-N 3.5Å; Y49-S51 VanDerWaalsContact O-N 3.09Å; S51-L53 PolarHBondContact O-N 2.94Å
52	K	40.1	Very low	44.8	Very low	192 Å²	192	133.4 Å²	133.4	84%	0.835	68%	0.68	S	S	*	*			trans	-78.6	52.1	172	-77.4	-175.6	174.5	179.7	0	111.8	K50	K50-K52 PolarHBondContact O-N 3.18Å; K50-K52 VanDerWaalsContact O-N 3.1Å
53	L	42.2	Very low	46.8	Very low	149 Å²	149	128 Å²	128	78%	0.78	65%	0.648	S	S	*	*			trans	-125.6	77	170.4	-79.9	159.4	0	0	0	107.7	S51 L55	S51-L53 PolarHBondContact O-N 2.94Å; L53-L55 PolarHBondContact O-N 3.14Å
54	F	44.1	Very low	49	Very low	177 Å²	177	123.7 Å²	123.7	78%	0.776	61%	0.61	S	S	*	*			trans	-68	120.7	165.7	-69.9	-87.8	0	0	0	107	K56	F54-K56 VanDerWaalsContact C-N 3.33Å; F54-K56 PolarHBondContact O-N 3.35Å
55	L	42.4	Very low	51.3	Low	80 Å²	80	126.5 Å²	126.5	42%	0.419	61%	0.609	S	S	.	*			trans	-56.6	96	171.3	-67.9	166.2	0	0	0	108.2	L53 S57 Y63 D91	L53-L55 PolarHBondContact O-N 3.14Å; L55-S57 VanDerWaalsContact C-N 3.34Å; L55-Y63 WeakPolarHBondContact CA-OH 3.45Å; L55-Y63 HydrophobicContact CD2-CE2 3.79Å; L55-D91 WeakPolarHBondContact CD1-OD1 3.45Å
56	K	46.4	Very low	53.6	Low	198 Å²	198	121.9 Å²	121.9	86%	0.861	60%	0.602	S	S	*	*			trans	-86	-8.5	179.5	-87.4	-170.4	175.7	-175.2	0	112.6	F54 Y63	F54-K56 VanDerWaalsContact C-N 3.33Å; F54-K56 PolarHBondContact O-N 3.35Å; K56-Y63 PolarHBondContact N-OH 2.89Å
57	S	44.9	Very low	56.1	Low	37 Å²	37	115 Å²	115	26%	0.259	57%	0.569	S	S	.	*	S	Bend	trans	-121.7	132.4	171.9	50.3	0	0	0	0	109.6	L55 T59 Y63	L55-S57 VanDerWaalsContact C-N 3.34Å; S57-T59 PolarHBondContact O-N 3.48Å; S57-T59 PolarHBondContact OG-O 2.8Å; S57-Y63 WeakPolarHBondContact OG-CE2 3.43Å
58	Y	56.5	Low	58.9	Low	235 Å²	235	115.7 Å²	115.7	92%	0.922	56%	0.563	S	S	*	*	S	Bend	trans	-68.3	15.4	176.2	-67.5	-85.9	0	0	0	113.7
59	T	70.4	Confident	61.6	Low	65 Å²	65	106.2 Å²	106.2	40%	0.399	52%	0.522	S	S	.	.			trans	-138.1	139.4	-173.7	-42.2	0	0	0	0	108.6	S57 A61 P62 E84	S57-T59 PolarHBondContact O-N 3.48Å; S57-T59 PolarHBondContact OG-O 2.8Å; T59-A61 VanDerWaalsContact C-N 3.28Å; T59-A61 HydrophobicContact CG2-CB 3.66Å; T59-P62 WeakPolarHBondContact O-CD 3.36Å; T59-E84 WeakPolarHBondContact CA-OE2 3.42Å; T59-E84 WeakPolarHBondContact CG2-OE2 3.36Å
60	L	73	Confident	64.4	Low	3 Å²	3	96.5 Å²	96.5	2%	0.016	49%	0.485	C	S	.	.	S	Bend	trans	-73.6	-21.1	172.3	-65.6	169.1	0	0	0	111.5	P62 Y63 V64 L70 L80 E84 A90 V94	L60-P62 VanDerWaalsContact C-CD 3.43Å; L60-P62 VanDerWaalsContact C-N 3.34Å; L60-Y63 CarbonylContact O-C 3.48Å; L60-Y63 WeakPolarHBondContact O-CA 3.44Å; L60-Y63 WeakPolarHBondContact O-CB 3.4Å; L60-Y63 PolarHBondContact O-N 2.67Å; L60-V64 PolarHBondContact O-N 3.04Å; L60-L70 HydrophobicContact CB-CD1 4.29Å; L60-L70 HydrophobicContact CD1-CD2 4.34Å; L60-L70 HydrophobicContact CD2-CD1 4.11Å; L60-L80 HydrophobicContact CB-CD1 4.43Å; L60-L80 HydrophobicContact CD1-CB 4.26Å; L60-L80 HydrophobicContact CD1-CD2 4.38Å; L60-E84 VanDerWaalsContact CA-OE1 3.32Å; L60-E84 WeakPolarHBondContact CA-OE1 3.25Å; L60-E84 HydrophobicContact CB-CG 4.17Å; L60-E84 WeakPolarHBondContact CB-OE1 3.29Å; L60-E84 HydrophobicContact CD1-CG 3.6Å; L60-E84 HydrophobicContact CG-CG 3.52Å; L60-E84 WeakPolarHBondContact CG-OE1 3.31Å; L60-E84 PolarHBondContact N-OE1 2.87Å; L60-A90 HydrophobicContact CD1-CB 4.32Å; L60-A90 HydrophobicContact CD2-CB 3.99Å; L60-A90 HydrophobicContact CG-CB 4.34Å; L60-V94 HydrophobicContact CD2-CG1 3.83Å
61	A	72.2	Confident	67.4	Low	61 Å²	61	92.6 Å²	92.6	50%	0.504	46%	0.464	S	S	.	.	H	α-helix	trans	-47.5	-44.5	-177.7	0	0	0	0	0	114.4	T59 Y63 V64	T59-A61 VanDerWaalsContact C-N 3.28Å; T59-A61 HydrophobicContact CG2-CB 3.66Å; A61-Y63 VanDerWaalsContact C-N 3.25Å; A61-Y63 PolarHBondContact O-N 2.98Å; A61-V64 PolarHBondContact O-N 3.36Å
62	P	72	Confident	70	Confident	71 Å²	71	89.1 Å²	89.1	46%	0.461	44%	0.438	S	S	.	.	H	α-helix	trans	-64.3	-28.4	175.4	-22.1	36.6	0	0	0	113.6	T59 L60	T59-P62 WeakPolarHBondContact O-CD 3.36Å; L60-P62 VanDerWaalsContact C-CD 3.43Å; L60-P62 VanDerWaalsContact C-N 3.34Å
63	Y	72.8	Confident	72.6	Confident	51 Å²	51	80 Å²	80	20%	0.2	40%	0.399	C	S	.	.	H	α-helix	trans	-86	-11.6	-178.6	-58.7	-79.8	0	0	0	113.5	L55 K56 S57 L60 A61 N65 D66 S67	L55-Y63 WeakPolarHBondContact CA-OH 3.45Å; L55-Y63 HydrophobicContact CD2-CE2 3.79Å; K56-Y63 PolarHBondContact N-OH 2.89Å; S57-Y63 WeakPolarHBondContact OG-CE2 3.43Å; L60-Y63 CarbonylContact O-C 3.48Å; L60-Y63 WeakPolarHBondContact O-CA 3.44Å; L60-Y63 WeakPolarHBondContact O-CB 3.4Å; L60-Y63 PolarHBondContact O-N 2.67Å; A61-Y63 VanDerWaalsContact C-N 3.25Å; A61-Y63 PolarHBondContact O-N 2.98Å; Y63-N65 VanDerWaalsContact C-N 3.31Å; Y63-N65 PolarHBondContact O-N 3.09Å; Y63-D66 PolarHBondContact O-N 3.45Å; Y63-S67 VanDerWaalsContact O-CB 3.23Å; Y63-S67 WeakPolarHBondContact O-CB 3.43Å; Y63-S67 PolarHBondContact O-N 3.4Å
64	V	76.3	Confident	75.1	Confident	22 Å²	22	76 Å²	76	13%	0.133	38%	0.38	C	S	.	.	H	α-helix	trans	-61.3	-40.9	-177.4	176.6	0	0	0	0	111.3	L60 A61 D66 L70 R71 V74 L80	L60-V64 PolarHBondContact O-N 3.04Å; A61-V64 PolarHBondContact O-N 3.36Å; V64-D66 VanDerWaalsContact C-N 3.3Å; V64-D66 PolarHBondContact O-N 2.82Å; V64-L70 HydrophobicContact CG2-CB 4.28Å; V64-R71 HydrophobicContact CG1-CB 4.27Å; V64-V74 HydrophobicContact CG1-CG2 4.35Å; V64-L80 HydrophobicContact CG2-CD1 3.57Å
65	N	78.4	Confident	77.4	Confident	129 Å²	129	73.4 Å²	73.4	69%	0.69	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-27.7	-179	-68.6	-27.9	0	0	0	113.1	Y63	Y63-N65 VanDerWaalsContact C-N 3.31Å; Y63-N65 PolarHBondContact O-N 3.09Å
66	D	82.2	Confident	79.9	Confident	145 Å²	145	72.2 Å²	72.2	78%	0.775	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-17.8	-178.2	-63	-27.4	0	0	0	112.8	Y63 V64	Y63-D66 PolarHBondContact O-N 3.45Å; V64-D66 VanDerWaalsContact C-N 3.3Å; V64-D66 PolarHBondContact O-N 2.82Å
67	S	87.7	Confident	82.2	Confident	24 Å²	24	65.2 Å²	65.2	17%	0.168	35%	0.35	C	S	.	.			trans	-108.9	107.6	-178.4	-178.5	0	0	0	0	110.9	Y63 V69 L70 R71	Y63-S67 VanDerWaalsContact O-CB 3.23Å; Y63-S67 WeakPolarHBondContact O-CB 3.43Å; Y63-S67 PolarHBondContact O-N 3.4Å; S67-V69 PolarHBondContact O-N 3.09Å; S67-L70 PolarHBondContact O-N 2.9Å; S67-L70 VanDerWaalsContact O-N 3.12Å; S67-L70 WeakPolarHBondContact OG-CG 3.44Å; S67-L70 PolarHBondContact OG-N 3.03Å; S67-R71 PolarHBondContact O-N 3.14Å
68	E	92.6	Very high	84.6	Confident	93 Å²	93	63.9 Å²	63.9	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-51.4	-40.6	172.3	-178.1	-177.8	-160.8	0	0	111.9	N72 W98	E68-N72 VanDerWaalsContact O-CB 3.32Å; E68-N72 WeakPolarHBondContact O-CB 3.44Å; E68-N72 PolarHBondContact O-N 3.43Å; E68-N72 PolarHBondContact O-ND2 3.34Å; E68-N72 PolarHBondContact O-OD1 3.49Å; E68-W98 HydrophobicContact CG-CB 4.11Å; E68-W98 HydrophobicContact CG-CG 4.17Å
69	V	94.6	Very high	86.5	Confident	4 Å²	4	56 Å²	56	2%	0.024	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-52.4	177.2	168.9	0	0	0	0	111.4	S67 R71 N72 L73 L96 W98 V102	S67-V69 PolarHBondContact O-N 3.09Å; V69-R71 PolarHBondContact O-N 2.95Å; V69-N72 PolarHBondContact O-N 2.95Å; V69-L73 HydrophobicContact CG1-CD1 3.77Å; V69-L73 HydrophobicContact CG1-CG 4.28Å; V69-L73 WeakPolarHBondContact O-CB 3.32Å; V69-L73 WeakPolarHBondContact O-CG 3.36Å; V69-L73 PolarHBondContact O-N 3.14Å; V69-L96 HydrophobicContact CG1-CB 4.42Å; V69-L96 HydrophobicContact CG2-CB 4.43Å; V69-L96 WeakPolarHBondContact CG2-O 3.49Å; V69-W98 HydrophobicContact CG2-CB 3.95Å; V69-V102 HydrophobicContact CG1-CG2 3.92Å; V69-V102 HydrophobicContact CG2-CG2 4.06Å
70	L	93.2	Very high	87.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.1	-42.1	-176.5	-64.5	178.6	0	0	0	111.4	L60 V64 S67 L73 V74 L80 L93 V94	L60-L70 HydrophobicContact CB-CD1 4.29Å; L60-L70 HydrophobicContact CD1-CD2 4.34Å; L60-L70 HydrophobicContact CD2-CD1 4.11Å; V64-L70 HydrophobicContact CG2-CB 4.28Å; S67-L70 PolarHBondContact O-N 2.9Å; S67-L70 VanDerWaalsContact O-N 3.12Å; S67-L70 WeakPolarHBondContact OG-CG 3.44Å; S67-L70 PolarHBondContact OG-N 3.03Å; L70-L73 PolarHBondContact O-N 3.2Å; L70-V74 WeakPolarHBondContact O-CG2 3.46Å; L70-V74 PolarHBondContact O-N 3.03Å; L70-L80 HydrophobicContact CB-CD1 4.23Å; L70-L80 HydrophobicContact CD2-CD1 4.34Å; L70-L80 HydrophobicContact CD2-CD2 4.17Å; L70-L93 HydrophobicContact CD2-CB 4.35Å; L70-V94 HydrophobicContact CD1-CG1 4.3Å
71	R	93.2	Very high	88.3	Confident	112 Å²	112	56.2 Å²	56.2	42%	0.423	32%	0.321	S	S	.	.	H	α-helix	trans	-57.5	-52.2	174.8	-175.5	175.8	61.3	-162.3	-4.7	111.5	V64 S67 V69 L73 V74 D75	V64-R71 HydrophobicContact CG1-CB 4.27Å; S67-R71 PolarHBondContact O-N 3.14Å; V69-R71 PolarHBondContact O-N 2.95Å; R71-L73 VanDerWaalsContact C-N 3.3Å; R71-L73 PolarHBondContact O-N 3.49Å; R71-V74 WeakPolarHBondContact O-CB 3.4Å; R71-V74 PolarHBondContact O-N 2.86Å; R71-V74 VanDerWaalsContact O-N 3.1Å; R71-D75 PolarHBondContact O-N 2.98Å
72	N	94.5	Very high	89.3	Confident	24 Å²	24	55.9 Å²	55.9	13%	0.128	31%	0.313	C	S	.	.	H	α-helix	trans	-65.9	-34.6	-178.1	-64.1	-4.7	0	0	0	111.7	E68 V69 V74 D75 F76 W98	E68-N72 VanDerWaalsContact O-CB 3.32Å; E68-N72 WeakPolarHBondContact O-CB 3.44Å; E68-N72 PolarHBondContact O-N 3.43Å; E68-N72 PolarHBondContact O-ND2 3.34Å; E68-N72 PolarHBondContact O-OD1 3.49Å; V69-N72 PolarHBondContact O-N 2.95Å; N72-V74 VanDerWaalsContact C-N 3.34Å; N72-D75 WeakPolarHBondContact O-CB 3.45Å; N72-D75 PolarHBondContact O-N 3.05Å; N72-F76 WeakPolarHBondContact O-CD2 3.31Å; N72-F76 PolarHBondContact O-N 3.09Å; N72-W98 HydrophobicContact CB-CD2 4.43Å; N72-W98 HydrophobicContact CB-CE3 3.82Å; N72-W98 HydrophobicContact CB-CH2 3.58Å; N72-W98 HydrophobicContact CB-CZ2 4.19Å; N72-W98 HydrophobicContact CB-CZ3 3.35Å; N72-W98 WeakPolarHBondContact ND2-CZ2 3.35Å
73	L	95	Very high	90.3	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-63.7	-39.4	173.6	-71.9	174.7	0	0	0	111.8	V69 L70 R71 D75 F76 G77 V78 L93 V102 L123 F130	V69-L73 HydrophobicContact CG1-CD1 3.77Å; V69-L73 HydrophobicContact CG1-CG 4.28Å; V69-L73 WeakPolarHBondContact O-CB 3.32Å; V69-L73 WeakPolarHBondContact O-CG 3.36Å; V69-L73 PolarHBondContact O-N 3.14Å; L70-L73 PolarHBondContact O-N 3.2Å; R71-L73 VanDerWaalsContact C-N 3.3Å; R71-L73 PolarHBondContact O-N 3.49Å; L73-D75 VanDerWaalsContact C-N 3.32Å; L73-F76 PolarHBondContact O-N 3.19Å; L73-G77 PolarHBondContact O-N 3.42Å; L73-V78 HydrophobicContact CB-CB 4.12Å; L73-V78 HydrophobicContact CB-CG2 4.15Å; L73-V78 HydrophobicContact CD2-CG2 4.2Å; L73-V78 WeakPolarHBondContact O-CB 3.38Å; L73-V78 VanDerWaalsContact O-CG2 3.26Å; L73-V78 WeakPolarHBondContact O-CG2 3.02Å; L73-V78 PolarHBondContact O-N 3.3Å; L73-L93 HydrophobicContact CD1-CD2 4.31Å; L73-V102 HydrophobicContact CD2-CG1 4.27Å; L73-L123 HydrophobicContact CD2-CD1 4Å; L73-F130 HydrophobicContact CD2-CE2 4.16Å; L73-F130 HydrophobicContact CD2-CZ 3.95Å
74	V	93.6	Very high	91	Very high	63 Å²	63	52.3 Å²	52.3	38%	0.382	29%	0.292	S	S	.	.	H	α-helix	trans	-62.8	-39.8	173.4	171.5	0	0	0	0	110.9	V64 L70 R71 N72 F76 G77 L80	V64-V74 HydrophobicContact CG1-CG2 4.35Å; L70-V74 WeakPolarHBondContact O-CG2 3.46Å; L70-V74 PolarHBondContact O-N 3.03Å; R71-V74 WeakPolarHBondContact O-CB 3.4Å; R71-V74 PolarHBondContact O-N 2.86Å; R71-V74 VanDerWaalsContact O-N 3.1Å; N72-V74 VanDerWaalsContact C-N 3.34Å; V74-F76 PolarHBondContact O-N 3.15Å; V74-G77 WeakPolarHBondContact O-CA 3.28Å; V74-G77 PolarHBondContact O-N 2.82Å; V74-L80 HydrophobicContact CG2-CD1 3.45Å; V74-L80 VanDerWaalsContact CG2-CD1 3.45Å; V74-L80 HydrophobicContact CG2-CG 3.79Å
75	D	93.4	Very high	91.7	Very high	123 Å²	123	56.9 Å²	56.9	66%	0.658	32%	0.32	S	S	*	.	H	α-helix	trans	-61.6	-30.7	176	-63.8	-25.1	0	0	0	112.6	R71 N72 L73 G77	R71-D75 PolarHBondContact O-N 2.98Å; N72-D75 WeakPolarHBondContact O-CB 3.45Å; N72-D75 PolarHBondContact O-N 3.05Å; L73-D75 VanDerWaalsContact C-N 3.32Å; D75-G77 PolarHBondContact O-N 3.26Å
76	F	94.4	Very high	92.3	Very high	55 Å²	55	53.5 Å²	53.5	24%	0.241	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	2	171.2	-77.8	-72	0	0	0	114.1	N72 L73 V74 W98 L106 F110 V116 I119 G120	N72-F76 WeakPolarHBondContact O-CD2 3.31Å; N72-F76 PolarHBondContact O-N 3.09Å; L73-F76 PolarHBondContact O-N 3.19Å; V74-F76 PolarHBondContact O-N 3.15Å; F76-W98 HydrophobicContact CE2-CH2 4.03Å; F76-L106 HydrophobicContact CD2-CD1 4.06Å; F76-L106 HydrophobicContact CE2-CD1 3.68Å; F76-L106 HydrophobicContact CZ-CD1 4.12Å; F76-F110 HydrophobicContact CE1-CE2 4.45Å; F76-F110 AromaticContact CE1-CZ 3.76Å; F76-F110 HydrophobicContact CE1-CZ 3.76Å; F76-F110 HydrophobicContact CZ-CZ 4.26Å; F76-V116 HydrophobicContact CD1-CG1 4.21Å; F76-V116 HydrophobicContact CE1-CG1 3.98Å; F76-I119 HydrophobicContact CB-CG2 4.1Å; F76-I119 HydrophobicContact CD1-CB 4.3Å; F76-I119 HydrophobicContact CD1-CG2 4.11Å; F76-I119 HydrophobicContact CG-CG2 4.16Å; F76-G120 WeakPolarHBondContact O-CA 3.46Å; F76-G120 PolarHBondContact O-N 2.81Å; F76-G120 VanDerWaalsContact O-N 3.11Å
77	G	95.3	Very high	92.4	Very high	52 Å²	52	50 Å²	50	54%	0.536	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	26.8	-178.8	0	0	0	0	0	114.1	L73 V74 D75 G120	L73-G77 PolarHBondContact O-N 3.42Å; V74-G77 WeakPolarHBondContact O-CA 3.28Å; V74-G77 PolarHBondContact O-N 2.82Å; D75-G77 PolarHBondContact O-N 3.26Å; G77-G120 WeakPolarHBondContact O-CA 3.44Å
78	V	96	Very high	92.5	Very high	8 Å²	8	53 Å²	53	5%	0.048	31%	0.31	C	S	.	.			trans	-74.8	127.7	172.7	179.3	0	0	0	0	110.1	L73 L80 L83 L123 T124	L73-V78 HydrophobicContact CB-CB 4.12Å; L73-V78 HydrophobicContact CB-CG2 4.15Å; L73-V78 HydrophobicContact CD2-CG2 4.2Å; L73-V78 WeakPolarHBondContact O-CB 3.38Å; L73-V78 VanDerWaalsContact O-CG2 3.26Å; L73-V78 WeakPolarHBondContact O-CG2 3.02Å; L73-V78 PolarHBondContact O-N 3.3Å; V78-L80 HydrophobicContact CG1-CD2 4.27Å; V78-L80 PolarHBondContact O-N 3.25Å; V78-L83 HydrophobicContact CG1-CD1 3.49Å; V78-L83 VanDerWaalsContact CG1-CD1 3.49Å; V78-L83 HydrophobicContact CG1-CG 4.42Å; V78-L123 HydrophobicContact CG2-CB 3.88Å; V78-L123 HydrophobicContact CG2-CD1 4.04Å; V78-T124 WeakPolarHBondContact CA-OG1 3.42Å
79	D	94.7	Very high	92.5	Very high	70 Å²	70	48.5 Å²	48.5	37%	0.374	29%	0.289	S	S	.	.			trans	-83.2	95.5	177.2	176.6	-0.4	0	0	0	110.6	A81 T82 L83 T124	D79-A81 VanDerWaalsContact C-N 3.32Å; D79-A81 PolarHBondContact O-N 2.94Å; D79-A81 WeakPolarHBondContact OD1-CB 3.33Å; D79-A81 PolarHBondContact OD1-N 2.96Å; D79-A81 VanDerWaalsContact OD1-N 3.07Å; D79-T82 VanDerWaalsContact CG-OG1 3.3Å; D79-T82 PolarHBondContact O-N 3.39Å; D79-T82 PolarHBondContact OD1-N 2.98Å; D79-T82 WeakPolarHBondContact OD2-CB 3.24Å; D79-T82 PolarHBondContact OD2-OG1 3.32Å; D79-L83 WeakPolarHBondContact O-CG 3.35Å; D79-L83 PolarHBondContact O-N 3.3Å; D79-T124 HydrophobicContact CB-CG2 3.76Å; D79-T124 PolarHBondContact N-OG1 3.43Å
80	L	91.6	Very high	92.3	Very high	13 Å²	13	49 Å²	49	7%	0.068	29%	0.294	C	S	.	.	H	α-helix	trans	-64.8	-32.9	179	-63.5	-173.2	0	0	0	113.1	L60 V64 L70 V74 V78 T82 L83 E84	L60-L80 HydrophobicContact CB-CD1 4.43Å; L60-L80 HydrophobicContact CD1-CB 4.26Å; L60-L80 HydrophobicContact CD1-CD2 4.38Å; V64-L80 HydrophobicContact CG2-CD1 3.57Å; L70-L80 HydrophobicContact CB-CD1 4.23Å; L70-L80 HydrophobicContact CD2-CD1 4.34Å; L70-L80 HydrophobicContact CD2-CD2 4.17Å; V74-L80 HydrophobicContact CG2-CD1 3.45Å; V74-L80 VanDerWaalsContact CG2-CD1 3.45Å; V74-L80 HydrophobicContact CG2-CG 3.79Å; V78-L80 HydrophobicContact CG1-CD2 4.27Å; V78-L80 PolarHBondContact O-N 3.25Å; L80-T82 VanDerWaalsContact C-N 3.34Å; L80-T82 PolarHBondContact O-N 3.04Å; L80-L83 HydrophobicContact CD2-CD1 4.39Å; L80-L83 PolarHBondContact O-N 3.45Å; L80-E84 WeakPolarHBondContact O-CG 3.35Å; L80-E84 PolarHBondContact O-N 2.94Å
81	A	91.4	Very high	92.1	Very high	60 Å²	60	52.5 Å²	52.5	50%	0.496	31%	0.313	S	S	.	.	H	α-helix	trans	-64.6	-42.1	178.7	0	0	0	0	0	110.5	D79 L83	D79-A81 VanDerWaalsContact C-N 3.32Å; D79-A81 PolarHBondContact O-N 2.94Å; D79-A81 WeakPolarHBondContact OD1-CB 3.33Å; D79-A81 PolarHBondContact OD1-N 2.96Å; D79-A81 VanDerWaalsContact OD1-N 3.07Å; A81-L83 VanDerWaalsContact C-N 3.33Å; A81-L83 PolarHBondContact O-N 2.57Å
82	T	92.8	Very high	92.1	Very high	54 Å²	54	48.4 Å²	48.4	33%	0.331	30%	0.298	S	S	.	.	H	α-helix	trans	-60.7	-42.3	170.7	-72.1	0	0	0	0	111.3	D79 L80 T85 R86 T124	D79-T82 VanDerWaalsContact CG-OG1 3.3Å; D79-T82 PolarHBondContact O-N 3.39Å; D79-T82 PolarHBondContact OD1-N 2.98Å; D79-T82 WeakPolarHBondContact OD2-CB 3.24Å; D79-T82 PolarHBondContact OD2-OG1 3.32Å; L80-T82 VanDerWaalsContact C-N 3.34Å; L80-T82 PolarHBondContact O-N 3.04Å; T82-T85 PolarHBondContact O-N 2.78Å; T82-T85 PolarHBondContact O-OG1 3.36Å; T82-R86 WeakPolarHBondContact O-CG 3.48Å; T82-T124 HydrophobicContact CG2-CG2 3.93Å
83	L	92.5	Very high	92	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-68.7	-33.8	-177.6	-67.9	-174	0	0	0	113.9	V78 D79 L80 A81 T85 R86 V89 L93 T124 P127	V78-L83 HydrophobicContact CG1-CD1 3.49Å; V78-L83 VanDerWaalsContact CG1-CD1 3.49Å; V78-L83 HydrophobicContact CG1-CG 4.42Å; D79-L83 WeakPolarHBondContact O-CG 3.35Å; D79-L83 PolarHBondContact O-N 3.3Å; L80-L83 HydrophobicContact CD2-CD1 4.39Å; L80-L83 PolarHBondContact O-N 3.45Å; A81-L83 VanDerWaalsContact C-N 3.33Å; A81-L83 PolarHBondContact O-N 2.57Å; L83-T85 VanDerWaalsContact C-N 3.27Å; L83-T85 PolarHBondContact O-N 3.21Å; L83-R86 WeakPolarHBondContact O-CB 3.49Å; L83-R86 PolarHBondContact O-N 3.43Å; L83-R86 VanDerWaalsContact O-N 3.13Å; L83-V89 HydrophobicContact CB-CG1 3.84Å; L83-V89 HydrophobicContact CD1-CG1 4.44Å; L83-V89 HydrophobicContact CD2-CG1 4.15Å; L83-V89 HydrophobicContact CG-CG1 4.36Å; L83-L93 HydrophobicContact CB-CD1 4.46Å; L83-L93 HydrophobicContact CD1-CD1 3.78Å; L83-T124 WeakPolarHBondContact CD2-O 3.45Å; L83-P127 HydrophobicContact CD1-CB 4.46Å; L83-P127 HydrophobicContact CD2-CB 3.92Å; L83-P127 HydrophobicContact CD2-CG 3.8Å
84	E	88.3	Confident	91.7	Very high	44 Å²	44	49.9 Å²	49.9	21%	0.206	31%	0.308	C	S	.	.	H	α-helix	trans	-59.1	-37.6	176.3	-78.1	162.7	-154.6	0	0	113.1	T59 L60 L80 R86	T59-E84 WeakPolarHBondContact CA-OE2 3.42Å; T59-E84 WeakPolarHBondContact CG2-OE2 3.36Å; L60-E84 VanDerWaalsContact CA-OE1 3.32Å; L60-E84 WeakPolarHBondContact CA-OE1 3.25Å; L60-E84 HydrophobicContact CB-CG 4.17Å; L60-E84 WeakPolarHBondContact CB-OE1 3.29Å; L60-E84 HydrophobicContact CD1-CG 3.6Å; L60-E84 HydrophobicContact CG-CG 3.52Å; L60-E84 WeakPolarHBondContact CG-OE1 3.31Å; L60-E84 PolarHBondContact N-OE1 2.87Å; L80-E84 WeakPolarHBondContact O-CG 3.35Å; L80-E84 PolarHBondContact O-N 2.94Å; E84-R86 PolarHBondContact O-N 3.41Å
85	T	90.3	Very high	91.7	Very high	118 Å²	118	54.4 Å²	54.4	72%	0.724	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-6.4	-179.6	67.4	0	0	0	0	113.3	T82 L83 G87	T82-T85 PolarHBondContact O-N 2.78Å; T82-T85 PolarHBondContact O-OG1 3.36Å; L83-T85 VanDerWaalsContact C-N 3.27Å; L83-T85 PolarHBondContact O-N 3.21Å; T85-G87 PolarHBondContact O-N 2.99Å
86	R	90.8	Very high	91.8	Very high	58 Å²	58	50 Å²	50	22%	0.219	30%	0.299	C	S	.	.	S	Bend	trans	-104.2	72.3	-169.4	-62.1	179.4	75.7	-174.2	6	112.1	T82 L83 E84 N88 V89 T124 K125 W128 Y163	T82-R86 WeakPolarHBondContact O-CG 3.48Å; L83-R86 WeakPolarHBondContact O-CB 3.49Å; L83-R86 PolarHBondContact O-N 3.43Å; L83-R86 VanDerWaalsContact O-N 3.13Å; E84-R86 PolarHBondContact O-N 3.41Å; R86-N88 PolarHBondContact O-N 3.28Å; R86-V89 HydrophobicContact CB-CB 4.37Å; R86-V89 HydrophobicContact CB-CG2 3.96Å; R86-V89 WeakPolarHBondContact O-CB 3.49Å; R86-V89 WeakPolarHBondContact O-CG2 3.27Å; R86-V89 PolarHBondContact O-N 2.83Å; R86-V89 VanDerWaalsContact O-N 3.17Å; R86-T124 PolarHBondContact NH1-O 2.9Å; R86-K125 VanDerWaalsContact NH1-C 3.34Å; R86-K125 PolarHBondContact NH1-O 3.45Å; R86-K125 PolarHBondContact NH2-O 2.91Å; R86-W128 VanDerWaalsContact NH2-CH2 3.33Å; R86-Y163 PolarHBondContact NH2-OH 3.33Å; R86-Y163 VanDerWaalsContact NH2-OH 3.16Å
87	G	85.2	Confident	91.8	Very high	72 Å²	72	51.3 Å²	51.3	74%	0.742	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	-126.3	170.9	0	0	0	0	0	112.7	T85 V89	T85-G87 PolarHBondContact O-N 2.99Å; G87-V89 VanDerWaalsContact C-N 3.26Å; G87-V89 PolarHBondContact O-N 3.12Å
88	N	89.4	Confident	91.8	Very high	85 Å²	85	50.2 Å²	50.2	46%	0.455	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	13.9	-176.1	73.2	-25.6	0	0	0	114.8	R86 D91 F92	R86-N88 PolarHBondContact O-N 3.28Å; N88-D91 PolarHBondContact O-N 3.18Å; N88-F92 VanDerWaalsContact O-CD1 3.32Å; N88-F92 WeakPolarHBondContact O-CD1 3.1Å; N88-F92 PolarHBondContact O-N 3.17Å
89	V	93.2	Very high	91.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.3	-47.9	-174.3	169.5	0	0	0	0	111.8	L83 R86 G87 D91 F92 L93 P127 W128	L83-V89 HydrophobicContact CB-CG1 3.84Å; L83-V89 HydrophobicContact CD1-CG1 4.44Å; L83-V89 HydrophobicContact CD2-CG1 4.15Å; L83-V89 HydrophobicContact CG-CG1 4.36Å; R86-V89 HydrophobicContact CB-CB 4.37Å; R86-V89 HydrophobicContact CB-CG2 3.96Å; R86-V89 WeakPolarHBondContact O-CB 3.49Å; R86-V89 WeakPolarHBondContact O-CG2 3.27Å; R86-V89 PolarHBondContact O-N 2.83Å; R86-V89 VanDerWaalsContact O-N 3.17Å; G87-V89 VanDerWaalsContact C-N 3.26Å; G87-V89 PolarHBondContact O-N 3.12Å; V89-D91 VanDerWaalsContact C-N 3.27Å; V89-D91 PolarHBondContact O-N 2.8Å; V89-F92 VanDerWaalsContact CA-CE1 3.48Å; V89-F92 HydrophobicContact CB-CE1 4.04Å; V89-F92 HydrophobicContact CG1-CE1 4.17Å; V89-F92 HydrophobicContact CG1-CZ 4.27Å; V89-F92 HydrophobicContact CG2-CE1 3.84Å; V89-F92 HydrophobicContact CG2-CZ 4.44Å; V89-F92 WeakPolarHBondContact O-CD1 3.27Å; V89-F92 PolarHBondContact O-N 2.77Å; V89-L93 HydrophobicContact CG1-CD1 3.52Å; V89-L93 HydrophobicContact CG1-CG 4.03Å; V89-L93 WeakPolarHBondContact O-CB 3.46Å; V89-L93 VanDerWaalsContact O-CG 3.27Å; V89-L93 WeakPolarHBondContact O-CG 3.15Å; V89-L93 PolarHBondContact O-N 3.12Å; V89-P127 HydrophobicContact CB-CG 4.44Å; V89-P127 HydrophobicContact CG1-CB 3.79Å; V89-P127 HydrophobicContact CG1-CG 3.88Å; V89-P127 HydrophobicContact CG2-CB 4.3Å; V89-P127 HydrophobicContact CG2-CG 3.6Å; V89-W128 HydrophobicContact CG2-CZ2 3.93Å
90	A	89.5	Confident	91.9	Very high	14 Å²	14	58.8 Å²	58.8	12%	0.116	32%	0.322	C	S	.	.	H	α-helix	trans	-54.1	-45.5	175.7	0	0	0	0	0	111.6	L60 F92 L93 V94	L60-A90 HydrophobicContact CD1-CB 4.32Å; L60-A90 HydrophobicContact CD2-CB 3.99Å; L60-A90 HydrophobicContact CG-CB 4.34Å; A90-F92 VanDerWaalsContact C-N 3.34Å; A90-F92 PolarHBondContact O-N 3.13Å; A90-L93 PolarHBondContact O-N 3.37Å; A90-V94 WeakPolarHBondContact O-CG1 3.46Å; A90-V94 WeakPolarHBondContact O-CG2 3.48Å; A90-V94 PolarHBondContact O-N 2.66Å
91	D	89.5	Confident	92.1	Very high	74 Å²	74	59.8 Å²	59.8	40%	0.396	33%	0.328	S	S	.	.	H	α-helix	trans	-62.3	-34.9	-176.1	-70.3	-21	0	0	0	114.3	L55 N88 V89 V94 K95	L55-D91 WeakPolarHBondContact CD1-OD1 3.45Å; N88-D91 PolarHBondContact O-N 3.18Å; V89-D91 VanDerWaalsContact C-N 3.27Å; V89-D91 PolarHBondContact O-N 2.8Å; D91-V94 WeakPolarHBondContact O-CG2 3.02Å; D91-K95 VanDerWaalsContact O-CD 3.24Å; D91-K95 WeakPolarHBondContact O-CD 3.49Å; D91-K95 VanDerWaalsContact O-CE 3.22Å; D91-K95 WeakPolarHBondContact O-CE 3.33Å; D91-K95 WeakPolarHBondContact O-CG 3.44Å
92	F	92.3	Very high	92.4	Very high	25 Å²	25	56.9 Å²	56.9	11%	0.11	30%	0.304	C	S	.	.	H	α-helix	trans	-87.7	-33.8	178.1	80.7	-107.6	0	0	0	112	N88 V89 A90 V94 K95 L96 P127 F130 Q131	N88-F92 VanDerWaalsContact O-CD1 3.32Å; N88-F92 WeakPolarHBondContact O-CD1 3.1Å; N88-F92 PolarHBondContact O-N 3.17Å; V89-F92 VanDerWaalsContact CA-CE1 3.48Å; V89-F92 HydrophobicContact CB-CE1 4.04Å; V89-F92 HydrophobicContact CG1-CE1 4.17Å; V89-F92 HydrophobicContact CG1-CZ 4.27Å; V89-F92 HydrophobicContact CG2-CE1 3.84Å; V89-F92 HydrophobicContact CG2-CZ 4.44Å; V89-F92 WeakPolarHBondContact O-CD1 3.27Å; V89-F92 PolarHBondContact O-N 2.77Å; A90-F92 VanDerWaalsContact C-N 3.34Å; A90-F92 PolarHBondContact O-N 3.13Å; F92-V94 VanDerWaalsContact C-N 3.33Å; F92-V94 PolarHBondContact O-N 3.3Å; F92-K95 PolarHBondContact O-N 2.98Å; F92-K95 VanDerWaalsContact O-N 3.08Å; F92-L96 HydrophobicContact CD2-CD1 4.38Å; F92-L96 HydrophobicContact CE2-CD1 4.5Å; F92-L96 WeakPolarHBondContact O-CG 3.35Å; F92-L96 PolarHBondContact O-N 3.11Å; F92-P127 HydrophobicContact CZ-CB 3.97Å; F92-P127 WeakPolarHBondContact CZ-O 2.92Å; F92-F130 HydrophobicContact CE2-CB 4.33Å; F92-Q131 HydrophobicContact CD2-CG 4.47Å; F92-Q131 HydrophobicContact CE2-CG 4.4Å
93	L	92.9	Very high	92.6	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-61.2	-42.2	179.6	-72.8	177.1	0	0	0	111.8	L70 L73 L83 V89 A90 K95 L96 F130	L70-L93 HydrophobicContact CD2-CB 4.35Å; L73-L93 HydrophobicContact CD1-CD2 4.31Å; L83-L93 HydrophobicContact CB-CD1 4.46Å; L83-L93 HydrophobicContact CD1-CD1 3.78Å; V89-L93 HydrophobicContact CG1-CD1 3.52Å; V89-L93 HydrophobicContact CG1-CG 4.03Å; V89-L93 WeakPolarHBondContact O-CB 3.46Å; V89-L93 VanDerWaalsContact O-CG 3.27Å; V89-L93 WeakPolarHBondContact O-CG 3.15Å; V89-L93 PolarHBondContact O-N 3.12Å; A90-L93 PolarHBondContact O-N 3.37Å; L93-K95 PolarHBondContact O-N 3.3Å; L93-L96 HydrophobicContact CD2-CD1 3.87Å; L93-L96 PolarHBondContact O-N 2.97Å; L93-F130 HydrophobicContact CD2-CD2 4.04Å; L93-F130 HydrophobicContact CD2-CE2 4.41Å
94	V	89.9	Confident	92.8	Very high	56 Å²	56	59 Å²	59	34%	0.339	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-16	177.5	-61.1	0	0	0	0	113.7	L60 L70 A90 D91 F92	L60-V94 HydrophobicContact CD2-CG1 3.83Å; L70-V94 HydrophobicContact CD1-CG1 4.3Å; A90-V94 WeakPolarHBondContact O-CG1 3.46Å; A90-V94 WeakPolarHBondContact O-CG2 3.48Å; A90-V94 PolarHBondContact O-N 2.66Å; D91-V94 WeakPolarHBondContact O-CG2 3.02Å; F92-V94 VanDerWaalsContact C-N 3.33Å; F92-V94 PolarHBondContact O-N 3.3Å
95	K	92.1	Very high	93.3	Very high	157 Å²	157	58 Å²	58	68%	0.683	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-10.6	179.6	-66	172.3	-172.5	160.9	0	113.2	D91 F92 L93	D91-K95 VanDerWaalsContact O-CD 3.24Å; D91-K95 WeakPolarHBondContact O-CD 3.49Å; D91-K95 VanDerWaalsContact O-CE 3.22Å; D91-K95 WeakPolarHBondContact O-CE 3.33Å; D91-K95 WeakPolarHBondContact O-CG 3.44Å; F92-K95 PolarHBondContact O-N 2.98Å; F92-K95 VanDerWaalsContact O-N 3.08Å; L93-K95 PolarHBondContact O-N 3.3Å
96	L	95.2	Very high	93.6	Very high	32 Å²	32	52.6 Å²	52.6	17%	0.168	27%	0.273	C	S	.	.			trans	-70.8	147.3	179.5	-63.5	178.2	0	0	0	110.5	V69 F92 L93 D101 V102 F130	V69-L96 HydrophobicContact CG1-CB 4.42Å; V69-L96 HydrophobicContact CG2-CB 4.43Å; V69-L96 WeakPolarHBondContact CG2-O 3.49Å; F92-L96 HydrophobicContact CD2-CD1 4.38Å; F92-L96 HydrophobicContact CE2-CD1 4.5Å; F92-L96 WeakPolarHBondContact O-CG 3.35Å; F92-L96 PolarHBondContact O-N 3.11Å; L93-L96 HydrophobicContact CD2-CD1 3.87Å; L93-L96 PolarHBondContact O-N 2.97Å; L96-D101 HydrophobicContact CB-CB 4.25Å; L96-D101 HydrophobicContact CD2-CB 3.93Å; L96-V102 HydrophobicContact CB-CG2 4.06Å; L96-V102 HydrophobicContact CD1-CG2 4.03Å; L96-F130 HydrophobicContact CD1-CB 3.8Å; L96-F130 HydrophobicContact CD1-CD1 4.47Å; L96-F130 HydrophobicContact CD1-CD2 4.07Å; L96-F130 HydrophobicContact CD1-CG 3.87Å
97	N	95.4	Very high	93.9	Very high	81 Å²	81	55.2 Å²	55.2	43%	0.433	29%	0.288	S	S	.	.			trans	-99	136.2	167.9	177.7	-86.1	0	0	0	110.2	E99 K100 D101 V102	N97-E99 PolarHBondContact OD1-N 3.11Å; N97-E99 VanDerWaalsContact OD1-N 3.16Å; N97-K100 HydrophobicContact CB-CB 4.11Å; N97-K100 WeakPolarHBondContact OD1-CB 3.37Å; N97-K100 PolarHBondContact OD1-N 3.03Å; N97-D101 PolarHBondContact N-OD2 3.39Å; N97-D101 WeakPolarHBondContact O-CA 3.46Å; N97-D101 VanDerWaalsContact O-CB 3.31Å; N97-D101 WeakPolarHBondContact O-CB 2.96Å; N97-D101 PolarHBondContact O-N 3.42Å; N97-V102 PolarHBondContact O-N 3.5Å
98	W	95.7	Very high	94.6	Very high	29 Å²	29	52.7 Å²	52.7	11%	0.11	26%	0.256	C	S	.	.	I	π-helix	trans	-59.3	-56.7	-177.1	173.5	-112.7	0	0	0	112.9	E68 V69 N72 F76 V102 K103 L106	E68-W98 HydrophobicContact CG-CB 4.11Å; E68-W98 HydrophobicContact CG-CG 4.17Å; V69-W98 HydrophobicContact CG2-CB 3.95Å; N72-W98 HydrophobicContact CB-CD2 4.43Å; N72-W98 HydrophobicContact CB-CE3 3.82Å; N72-W98 HydrophobicContact CB-CH2 3.58Å; N72-W98 HydrophobicContact CB-CZ2 4.19Å; N72-W98 HydrophobicContact CB-CZ3 3.35Å; N72-W98 WeakPolarHBondContact ND2-CZ2 3.35Å; F76-W98 HydrophobicContact CE2-CH2 4.03Å; W98-V102 HydrophobicContact CE3-CB 3.78Å; W98-V102 HydrophobicContact CE3-CG1 3.66Å; W98-V102 HydrophobicContact CH2-CG1 4.36Å; W98-V102 HydrophobicContact CZ3-CB 4.06Å; W98-V102 HydrophobicContact CZ3-CG1 3.41Å; W98-V102 VanDerWaalsContact CZ3-CG1 3.41Å; W98-V102 PolarHBondContact O-N 2.94Å; W98-K103 HydrophobicContact CZ2-CB 4.3Å; W98-K103 VanDerWaalsContact O-CB 3.32Å; W98-K103 WeakPolarHBondContact O-CB 3.37Å; W98-K103 PolarHBondContact O-N 3.22Å; W98-L106 HydrophobicContact CH2-CD1 3.83Å; W98-L106 HydrophobicContact CZ3-CD1 4.15Å
99	E	96.5	Very high	94.9	Very high	101 Å²	101	48.7 Å²	48.7	47%	0.472	24%	0.235	S	C	.	.	I	π-helix	trans	-70.4	-35.8	-175.3	-72.4	-64.4	147	0	0	112.8	N97 K103 P104	N97-E99 PolarHBondContact OD1-N 3.11Å; N97-E99 VanDerWaalsContact OD1-N 3.16Å; E99-K103 IonicContact OE1-NZ 2.94Å; E99-K103 PolarHBondContact OE1-NZ 3.44Å; E99-K103 VanDerWaalsContact OE2-CD 3.25Å; E99-K103 WeakPolarHBondContact OE2-CD 3.17Å; E99-K103 IonicContact OE2-NZ 2.6Å; E99-K103 PolarHBondContact OE2-NZ 2.78Å; E99-P104 VanDerWaalsContact O-CD 3.25Å; E99-P104 WeakPolarHBondContact O-CD 3.43Å; E99-P104 VanDerWaalsContact O-CG 3.28Å; E99-P104 WeakPolarHBondContact O-CG 3.33Å
100	K	96	Very high	95.2	Very high	157 Å²	157	51.8 Å²	51.8	68%	0.683	25%	0.248	S	C	*	.	I	π-helix	trans	-86.3	-42.6	-176.6	-175.6	-175	173.4	-174.9	0	113.3	N97	N97-K100 HydrophobicContact CB-CB 4.11Å; N97-K100 WeakPolarHBondContact OD1-CB 3.37Å; N97-K100 PolarHBondContact OD1-N 3.03Å
101	D	96.1	Very high	95.5	Very high	34 Å²	34	55.5 Å²	55.5	18%	0.182	27%	0.274	C	S	.	.	I	π-helix	trans	-106.8	-41.8	-166.9	-55.9	-50.6	0	0	0	112.8	L96 N97 R105	L96-D101 HydrophobicContact CB-CB 4.25Å; L96-D101 HydrophobicContact CD2-CB 3.93Å; N97-D101 PolarHBondContact N-OD2 3.39Å; N97-D101 WeakPolarHBondContact O-CA 3.46Å; N97-D101 VanDerWaalsContact O-CB 3.31Å; N97-D101 WeakPolarHBondContact O-CB 2.96Å; N97-D101 PolarHBondContact O-N 3.42Å; D101-R105 VanDerWaalsContact O-CD 3.31Å; D101-R105 WeakPolarHBondContact O-CD 3.48Å; D101-R105 PolarHBondContact O-NH1 3.2Å
102	V	96.8	Very high	95.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-90.2	-59.3	-170.9	-178.3	0	0	0	0	111.5	V69 L73 L96 N97 W98 R105 L106 F130	V69-V102 HydrophobicContact CG1-CG2 3.92Å; V69-V102 HydrophobicContact CG2-CG2 4.06Å; L73-V102 HydrophobicContact CD2-CG1 4.27Å; L96-V102 HydrophobicContact CB-CG2 4.06Å; L96-V102 HydrophobicContact CD1-CG2 4.03Å; N97-V102 PolarHBondContact O-N 3.5Å; W98-V102 HydrophobicContact CE3-CB 3.78Å; W98-V102 HydrophobicContact CE3-CG1 3.66Å; W98-V102 HydrophobicContact CH2-CG1 4.36Å; W98-V102 HydrophobicContact CZ3-CB 4.06Å; W98-V102 HydrophobicContact CZ3-CG1 3.41Å; W98-V102 VanDerWaalsContact CZ3-CG1 3.41Å; W98-V102 PolarHBondContact O-N 2.94Å; V102-R105 PolarHBondContact O-N 3.43Å; V102-R105 VanDerWaalsContact O-N 3.07Å; V102-L106 HydrophobicContact CG1-CD1 3.94Å; V102-L106 HydrophobicContact CG1-CG 4.15Å; V102-L106 PolarHBondContact O-N 3.29Å; V102-F130 HydrophobicContact CB-CE1 4.26Å; V102-F130 HydrophobicContact CG1-CE1 3.8Å; V102-F130 HydrophobicContact CG1-CZ 3.97Å; V102-F130 HydrophobicContact CG2-CE1 4.32Å
103	K	96.9	Very high	96.2	Very high	67 Å²	67	54.1 Å²	54.1	29%	0.291	28%	0.278	S	S	.	.	H	α-helix	trans	-55.7	-44.4	-173.8	-178.9	-174.1	-176.6	-179.1	0	113.9	W98 E99 R105 L106 Q107	W98-K103 HydrophobicContact CZ2-CB 4.3Å; W98-K103 VanDerWaalsContact O-CB 3.32Å; W98-K103 WeakPolarHBondContact O-CB 3.37Å; W98-K103 PolarHBondContact O-N 3.22Å; E99-K103 IonicContact OE1-NZ 2.94Å; E99-K103 PolarHBondContact OE1-NZ 3.44Å; E99-K103 VanDerWaalsContact OE2-CD 3.25Å; E99-K103 WeakPolarHBondContact OE2-CD 3.17Å; E99-K103 IonicContact OE2-NZ 2.6Å; E99-K103 PolarHBondContact OE2-NZ 2.78Å; K103-R105 VanDerWaalsContact C-N 3.27Å; K103-R105 PolarHBondContact O-N 2.87Å; K103-L106 PolarHBondContact O-N 3Å; K103-Q107 WeakPolarHBondContact O-CG 3.43Å; K103-Q107 PolarHBondContact O-N 3Å
104	P	97.9	Very high	96.4	Very high	33 Å²	33	54.3 Å²	54.3	21%	0.214	28%	0.279	C	S	.	.	H	α-helix	trans	-63.7	-33.3	178.6	-23.7	36.4	0	0	0	113	E99 F108 M134	E99-P104 VanDerWaalsContact O-CD 3.25Å; E99-P104 WeakPolarHBondContact O-CD 3.43Å; E99-P104 VanDerWaalsContact O-CG 3.28Å; E99-P104 WeakPolarHBondContact O-CG 3.33Å; P104-F108 WeakPolarHBondContact O-CB 3.37Å; P104-F108 PolarHBondContact O-N 3.21Å; P104-M134 HydrophobicContact CB-CE 4.48Å; P104-M134 HydrophobicContact CB-SD 4.37Å
105	R	97.5	Very high	96.7	Very high	25 Å²	25	54.1 Å²	54.1	9%	0.094	28%	0.279	C	S	.	.	H	α-helix	trans	-75.6	-34.5	178	-72.5	179.1	178.1	80.2	-6.2	112	D101 V102 K103 F108 L109 F129 F130 Q132 M134 L137	D101-R105 VanDerWaalsContact O-CD 3.31Å; D101-R105 WeakPolarHBondContact O-CD 3.48Å; D101-R105 PolarHBondContact O-NH1 3.2Å; V102-R105 PolarHBondContact O-N 3.43Å; V102-R105 VanDerWaalsContact O-N 3.07Å; K103-R105 VanDerWaalsContact C-N 3.27Å; K103-R105 PolarHBondContact O-N 2.87Å; R105-F108 WeakPolarHBondContact O-CB 3.43Å; R105-F108 PolarHBondContact O-N 3.03Å; R105-L109 PolarHBondContact O-N 3.43Å; R105-L109 VanDerWaalsContact O-N 3.13Å; R105-F129 HydrophobicContact CB-CE1 3.66Å; R105-F129 HydrophobicContact CB-CZ 4.1Å; R105-F129 HydrophobicContact CG-CE1 4.45Å; R105-F130 HydrophobicContact CB-CD1 4.43Å; R105-F130 HydrophobicContact CB-CE1 4.43Å; R105-F130 PolarHBondContact NE-O 3.19Å; R105-F130 PolarHBondContact NH2-O 2.63Å; R105-Q132 VanDerWaalsContact CZ-O 3.22Å; R105-Q132 PolarHBondContact NE-O 3.18Å; R105-Q132 PolarHBondContact NH2-O 3.08Å; R105-M134 HydrophobicContact CG-SD 3.61Å; R105-L137 HydrophobicContact CG-CD1 4.16Å
106	L	97.2	Very high	96.8	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-65	-48.3	170.6	-63.3	-176.6	0	0	0	111.1	F76 W98 V102 K103 F108 L109 F110 I119 L123	F76-L106 HydrophobicContact CD2-CD1 4.06Å; F76-L106 HydrophobicContact CE2-CD1 3.68Å; F76-L106 HydrophobicContact CZ-CD1 4.12Å; W98-L106 HydrophobicContact CH2-CD1 3.83Å; W98-L106 HydrophobicContact CZ3-CD1 4.15Å; V102-L106 HydrophobicContact CG1-CD1 3.94Å; V102-L106 HydrophobicContact CG1-CG 4.15Å; V102-L106 PolarHBondContact O-N 3.29Å; K103-L106 PolarHBondContact O-N 3Å; L106-F108 PolarHBondContact O-N 2.75Å; L106-L109 PolarHBondContact O-N 3.13Å; L106-F110 HydrophobicContact CB-CD2 4.49Å; L106-F110 HydrophobicContact CB-CE2 3.91Å; L106-F110 HydrophobicContact CB-CZ 4.43Å; L106-F110 WeakPolarHBondContact O-CD2 3.17Å; L106-F110 WeakPolarHBondContact O-CG 3.3Å; L106-F110 PolarHBondContact O-N 3.22Å; L106-I119 HydrophobicContact CD2-CG2 3.95Å; L106-L123 HydrophobicContact CD2-CD1 3.8Å
107	Q	97.7	Very high	96.9	Very high	113 Å²	113	56.1 Å²	56.1	53%	0.528	30%	0.301	S	S	.	.	H	α-helix	trans	-56	-38.9	174.9	-73.7	175.5	-20	0	0	112.1	K103 F110 S111	K103-Q107 WeakPolarHBondContact O-CG 3.43Å; K103-Q107 PolarHBondContact O-N 3Å; Q107-F110 PolarHBondContact O-N 3.06Å; Q107-S111 WeakPolarHBondContact O-CB 3.38Å; Q107-S111 PolarHBondContact O-N 3.38Å
108	F	98.1	Very high	96.9	Very high	19 Å²	19	55.4 Å²	55.4	8%	0.083	29%	0.292	C	S	.	.	H	α-helix	trans	-61.3	-46.5	173.6	177.5	-102.9	0	0	0	112.4	P104 R105 L106 F110 S111 L112 F129 M134 L137 R138 I141 L165	P104-F108 WeakPolarHBondContact O-CB 3.37Å; P104-F108 PolarHBondContact O-N 3.21Å; R105-F108 WeakPolarHBondContact O-CB 3.43Å; R105-F108 PolarHBondContact O-N 3.03Å; L106-F108 PolarHBondContact O-N 2.75Å; F108-F110 VanDerWaalsContact C-N 3.33Å; F108-F110 PolarHBondContact O-N 3.38Å; F108-S111 PolarHBondContact O-N 2.75Å; F108-S111 PolarHBondContact O-OG 2.78Å; F108-L112 HydrophobicContact CD1-CD1 3.99Å; F108-L112 HydrophobicContact CE1-CD1 3.55Å; F108-L112 HydrophobicContact CE2-CD1 4.25Å; F108-L112 HydrophobicContact CZ-CD1 3.72Å; F108-L112 WeakPolarHBondContact O-CG 3.14Å; F108-L112 PolarHBondContact O-N 3.09Å; F108-F129 HydrophobicContact CD1-CZ 4.32Å; F108-M134 HydrophobicContact CB-CE 4.12Å; F108-M134 HydrophobicContact CD2-CE 4.5Å; F108-M134 HydrophobicContact CG-CE 4.48Å; F108-L137 HydrophobicContact CD1-CB 4.27Å; F108-L137 HydrophobicContact CD1-CD1 4.24Å; F108-L137 HydrophobicContact CE1-CB 3.68Å; F108-L137 HydrophobicContact CE1-CD1 4.34Å; F108-L137 HydrophobicContact CE1-CD2 4.49Å; F108-L137 HydrophobicContact CE1-CG 4.39Å; F108-L137 HydrophobicContact CZ-CB 3.79Å; F108-L137 WeakPolarHBondContact CZ-O 3.18Å; F108-R138 HydrophobicContact CE2-CG 4.03Å; F108-I141 HydrophobicContact CE1-CG1 4.34Å; F108-I141 HydrophobicContact CE2-CG1 4.27Å; F108-I141 HydrophobicContact CZ-CG1 3.53Å; F108-L165 HydrophobicContact CE1-CD1 4.25Å
109	L	97.7	Very high	96.9	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.7	-41.9	175.3	-68.5	176.8	0	0	0	111.8	R105 L106 S111 L112 V114 I119 Y122 F129 I158 L165	R105-L109 PolarHBondContact O-N 3.43Å; R105-L109 VanDerWaalsContact O-N 3.13Å; L106-L109 PolarHBondContact O-N 3.13Å; L109-S111 VanDerWaalsContact C-N 3.35Å; L109-S111 PolarHBondContact O-N 3.23Å; L109-L112 PolarHBondContact O-N 3.25Å; L109-L112 VanDerWaalsContact O-N 3.11Å; L109-V114 HydrophobicContact CB-CB 4.23Å; L109-V114 HydrophobicContact CB-CG2 4.29Å; L109-V114 HydrophobicContact CD2-CG2 4.42Å; L109-V114 WeakPolarHBondContact O-CB 3.18Å; L109-V114 WeakPolarHBondContact O-CG2 3.2Å; L109-V114 PolarHBondContact O-N 2.95Å; L109-I119 HydrophobicContact CB-CD1 4.03Å; L109-I119 HydrophobicContact CD1-CD1 3.88Å; L109-Y122 HydrophobicContact CD1-CD1 4.06Å; L109-Y122 HydrophobicContact CD1-CE1 3.9Å; L109-Y122 HydrophobicContact CD2-CE1 4.35Å; L109-F129 HydrophobicContact CD1-CD1 4.27Å; L109-F129 HydrophobicContact CD1-CE1 3.61Å; L109-F129 HydrophobicContact CD1-CZ 3.87Å; L109-F129 HydrophobicContact CD2-CE1 4.35Å; L109-F129 HydrophobicContact CD2-CE2 4.09Å; L109-F129 HydrophobicContact CD2-CZ 3.75Å; L109-F129 HydrophobicContact CG-CE1 3.87Å; L109-F129 HydrophobicContact CG-CE2 4.45Å; L109-F129 HydrophobicContact CG-CZ 3.63Å; L109-I158 HydrophobicContact CD2-CG2 4.23Å; L109-L165 HydrophobicContact CD2-CD1 4.14Å
110	F	97.6	Very high	96.9	Very high	66 Å²	66	49.3 Å²	49.3	29%	0.289	27%	0.266	S	S	.	.	H	α-helix	trans	-62.6	-40.1	176	-59.9	-40.8	0	0	0	112.6	F76 L106 Q107 F108 L112 G113 V116 I119	F76-F110 HydrophobicContact CE1-CE2 4.45Å; F76-F110 AromaticContact CE1-CZ 3.76Å; F76-F110 HydrophobicContact CE1-CZ 3.76Å; F76-F110 HydrophobicContact CZ-CZ 4.26Å; L106-F110 HydrophobicContact CB-CD2 4.49Å; L106-F110 HydrophobicContact CB-CE2 3.91Å; L106-F110 HydrophobicContact CB-CZ 4.43Å; L106-F110 WeakPolarHBondContact O-CD2 3.17Å; L106-F110 WeakPolarHBondContact O-CG 3.3Å; L106-F110 PolarHBondContact O-N 3.22Å; Q107-F110 PolarHBondContact O-N 3.06Å; F108-F110 VanDerWaalsContact C-N 3.33Å; F108-F110 PolarHBondContact O-N 3.38Å; F110-L112 PolarHBondContact O-N 2.92Å; F110-L112 VanDerWaalsContact O-N 3.17Å; F110-G113 PolarHBondContact O-N 3Å; F110-V116 HydrophobicContact CD1-CG2 4.2Å; F110-V116 HydrophobicContact CE1-CB 4.31Å; F110-V116 HydrophobicContact CE1-CG2 3.75Å; F110-V116 HydrophobicContact CZ-CG2 4.26Å; F110-I119 HydrophobicContact CD1-CD1 4.32Å; F110-I119 HydrophobicContact CD1-CG1 4.41Å; F110-I119 HydrophobicContact CE1-CD1 3.72Å; F110-I119 HydrophobicContact CE1-CG1 3.41Å; F110-I119 VanDerWaalsContact CE1-CG1 3.41Å; F110-I119 HydrophobicContact CZ-CD1 4.32Å; F110-I119 HydrophobicContact CZ-CG1 3.88Å
111	S	97.5	Very high	97	Very high	92 Å²	92	43.8 Å²	43.8	64%	0.643	25%	0.247	S	C	*	.	H	α-helix	trans	-64	-19.8	176.1	71.7	0	0	0	0	113.5	Q107 F108 L109 G113	Q107-S111 WeakPolarHBondContact O-CB 3.38Å; Q107-S111 PolarHBondContact O-N 3.38Å; F108-S111 PolarHBondContact O-N 2.75Å; F108-S111 PolarHBondContact O-OG 2.78Å; L109-S111 VanDerWaalsContact C-N 3.35Å; L109-S111 PolarHBondContact O-N 3.23Å; S111-G113 VanDerWaalsContact C-N 3.3Å
112	L	97.4	Very high	97	Very high	23 Å²	23	42.3 Å²	42.3	12%	0.12	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	8	175.4	-59.8	169.8	0	0	0	112	F108 L109 F110 I141 T155 I158	F108-L112 HydrophobicContact CD1-CD1 3.99Å; F108-L112 HydrophobicContact CE1-CD1 3.55Å; F108-L112 HydrophobicContact CE2-CD1 4.25Å; F108-L112 HydrophobicContact CZ-CD1 3.72Å; F108-L112 WeakPolarHBondContact O-CG 3.14Å; F108-L112 PolarHBondContact O-N 3.09Å; L109-L112 PolarHBondContact O-N 3.25Å; L109-L112 VanDerWaalsContact O-N 3.11Å; F110-L112 PolarHBondContact O-N 2.92Å; F110-L112 VanDerWaalsContact O-N 3.17Å; L112-I141 HydrophobicContact CD1-CD1 3.8Å; L112-I141 HydrophobicContact CD1-CG1 3.93Å; L112-I141 HydrophobicContact CD2-CD1 4.13Å; L112-I141 HydrophobicContact CD2-CG1 4.02Å; L112-I141 HydrophobicContact CD2-CG2 3.78Å; L112-T155 WeakPolarHBondContact O-CB 3.37Å; L112-T155 VanDerWaalsContact O-CG2 3.3Å; L112-T155 WeakPolarHBondContact O-CG2 3.38Å; L112-T155 PolarHBondContact O-OG1 2.83Å; L112-I158 HydrophobicContact CB-CD1 4.15Å; L112-I158 HydrophobicContact CD1-CD1 3.56Å; L112-I158 HydrophobicContact CG-CD1 4.35Å
113	G	97.1	Very high	97	Very high	47 Å²	47	42.4 Å²	42.4	49%	0.485	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	15.3	178.9	0	0	0	0	0	114.5	F110 S111 P115 T155	F110-G113 PolarHBondContact O-N 3Å; S111-G113 VanDerWaalsContact C-N 3.3Å; G113-P115 WeakPolarHBondContact O-CD 3.5Å; G113-T155 WeakPolarHBondContact O-CG2 3.28Å
114	V	97.2	Very high	97	Very high	5 Å²	5	40 Å²	40	3%	0.03	23%	0.23	C	C	.	.			trans	-68.8	122.9	174	-179.2	0	0	0	0	109	L109 Y118 I119 I158 M159	L109-V114 HydrophobicContact CB-CB 4.23Å; L109-V114 HydrophobicContact CB-CG2 4.29Å; L109-V114 HydrophobicContact CD2-CG2 4.42Å; L109-V114 WeakPolarHBondContact O-CB 3.18Å; L109-V114 WeakPolarHBondContact O-CG2 3.2Å; L109-V114 PolarHBondContact O-N 2.95Å; V114-Y118 HydrophobicContact CG1-CD1 3.96Å; V114-I119 HydrophobicContact CB-CD1 4.46Å; V114-I119 HydrophobicContact CG1-CD1 3.78Å; V114-I158 HydrophobicContact CG2-CG2 4.29Å; V114-M159 HydrophobicContact CG2-CG 4.39Å
115	P	96.5	Very high	96.9	Very high	52 Å²	52	42.8 Å²	42.8	34%	0.338	24%	0.239	S	C	.	.			trans	-63	145.8	179.8	-24.8	36.3	0	0	0	112.8	G113 D117 Y118 M159	G113-P115 WeakPolarHBondContact O-CD 3.5Å; P115-D117 VanDerWaalsContact C-N 3.34Å; P115-D117 WeakPolarHBondContact CB-OD1 3.33Å; P115-D117 PolarHBondContact O-N 2.53Å; P115-Y118 WeakPolarHBondContact O-CB 3.17Å; P115-Y118 PolarHBondContact O-N 3.19Å; P115-M159 HydrophobicContact CG-CE 4.14Å
116	V	95.5	Very high	96.8	Very high	87 Å²	87	41.6 Å²	41.6	53%	0.527	23%	0.234	S	C	.	.	H	α-helix	trans	-60.6	-42.9	-178.1	176.9	0	0	0	0	112	F76 F110 Y118 I119	F76-V116 HydrophobicContact CD1-CG1 4.21Å; F76-V116 HydrophobicContact CE1-CG1 3.98Å; F110-V116 HydrophobicContact CD1-CG2 4.2Å; F110-V116 HydrophobicContact CE1-CB 4.31Å; F110-V116 HydrophobicContact CE1-CG2 3.75Å; F110-V116 HydrophobicContact CZ-CG2 4.26Å; V116-Y118 PolarHBondContact O-N 3Å; V116-I119 WeakPolarHBondContact O-CB 3.07Å; V116-I119 PolarHBondContact O-N 2.76Å
117	D	95.5	Very high	96.7	Very high	144 Å²	144	41.5 Å²	41.5	77%	0.77	23%	0.234	S	C	*	.	H	α-helix	trans	-65	-18.4	176.3	62.3	-40.1	0	0	0	113.3	P115	P115-D117 VanDerWaalsContact C-N 3.34Å; P115-D117 WeakPolarHBondContact CB-OD1 3.33Å; P115-D117 PolarHBondContact O-N 2.53Å
118	Y	96.3	Very high	96.7	Very high	66 Å²	66	39.3 Å²	39.3	26%	0.259	22%	0.221	S	C	.	.	H	α-helix	trans	-84.2	-22.3	176.2	-165.3	-107.6	0	0	0	113.5	V114 P115 V116 G120 S121 Y122 M159	V114-Y118 HydrophobicContact CG1-CD1 3.96Å; P115-Y118 WeakPolarHBondContact O-CB 3.17Å; P115-Y118 PolarHBondContact O-N 3.19Å; V116-Y118 PolarHBondContact O-N 3Å; Y118-G120 PolarHBondContact O-N 3.11Å; Y118-S121 PolarHBondContact O-N 3.31Å; Y118-S121 PolarHBondContact O-OG 2.89Å; Y118-Y122 HydrophobicContact CE1-CD2 4.03Å; Y118-Y122 PolarHBondContact O-N 3.17Å; Y118-M159 HydrophobicContact CD1-CB 4.48Å; Y118-M159 HydrophobicContact CD1-CE 3.99Å; Y118-M159 HydrophobicContact CD1-CG 4.06Å; Y118-M159 HydrophobicContact CD2-CE 4.09Å; Y118-M159 HydrophobicContact CE1-CB 3.86Å; Y118-M159 HydrophobicContact CE1-CE 4.26Å; Y118-M159 HydrophobicContact CE1-CG 3.92Å; Y118-M159 HydrophobicContact CE2-CE 4.39Å; Y118-M159 HydrophobicContact CG-CE 3.89Å; Y118-M159 PolarHBondContact OH-O 3.12Å
119	I	96.6	Very high	96.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.5	-47.3	-171.9	-67	-61.3	0	0	0	112.5	F76 L106 L109 F110 V114 V116 S121 Y122 L123	F76-I119 HydrophobicContact CB-CG2 4.1Å; F76-I119 HydrophobicContact CD1-CB 4.3Å; F76-I119 HydrophobicContact CD1-CG2 4.11Å; F76-I119 HydrophobicContact CG-CG2 4.16Å; L106-I119 HydrophobicContact CD2-CG2 3.95Å; L109-I119 HydrophobicContact CB-CD1 4.03Å; L109-I119 HydrophobicContact CD1-CD1 3.88Å; F110-I119 HydrophobicContact CD1-CD1 4.32Å; F110-I119 HydrophobicContact CD1-CG1 4.41Å; F110-I119 HydrophobicContact CE1-CD1 3.72Å; F110-I119 HydrophobicContact CE1-CG1 3.41Å; F110-I119 VanDerWaalsContact CE1-CG1 3.41Å; F110-I119 HydrophobicContact CZ-CD1 4.32Å; F110-I119 HydrophobicContact CZ-CG1 3.88Å; V114-I119 HydrophobicContact CB-CD1 4.46Å; V114-I119 HydrophobicContact CG1-CD1 3.78Å; V116-I119 WeakPolarHBondContact O-CB 3.07Å; V116-I119 PolarHBondContact O-N 2.76Å; I119-S121 VanDerWaalsContact C-N 3.31Å; I119-S121 PolarHBondContact O-N 3.05Å; I119-Y122 WeakPolarHBondContact O-CB 3.47Å; I119-Y122 PolarHBondContact O-N 3.2Å; I119-Y122 VanDerWaalsContact O-N 3.1Å; I119-L123 HydrophobicContact CG2-CD1 3.49Å; I119-L123 VanDerWaalsContact CG2-CD1 3.49Å; I119-L123 HydrophobicContact CG2-CG 4.07Å; I119-L123 WeakPolarHBondContact O-CG 3.48Å; I119-L123 PolarHBondContact O-N 3.09Å
120	G	96.4	Very high	96.5	Very high	2 Å²	2	38.8 Å²	38.8	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-54.1	-49.6	179.7	0	0	0	0	0	112	F76 G77 Y118 Y122 T124	F76-G120 WeakPolarHBondContact O-CA 3.46Å; F76-G120 PolarHBondContact O-N 2.81Å; F76-G120 VanDerWaalsContact O-N 3.11Å; G77-G120 WeakPolarHBondContact O-CA 3.44Å; Y118-G120 PolarHBondContact O-N 3.11Å; G120-Y122 VanDerWaalsContact C-N 3.34Å; G120-Y122 PolarHBondContact O-N 3.24Å; G120-T124 VanDerWaalsContact O-CB 3.26Å; G120-T124 WeakPolarHBondContact O-CB 3.48Å; G120-T124 PolarHBondContact O-N 3.49Å; G120-T124 PolarHBondContact O-OG1 3.21Å
121	S	96.8	Very high	96.4	Very high	41 Å²	41	40.3 Å²	40.3	29%	0.287	23%	0.227	S	C	.	.	H	α-helix	trans	-66.5	-34.7	178.9	85.8	0	0	0	0	113.1	Y118 I119 K125	Y118-S121 PolarHBondContact O-N 3.31Å; Y118-S121 PolarHBondContact O-OG 2.89Å; I119-S121 VanDerWaalsContact C-N 3.31Å; I119-S121 PolarHBondContact O-N 3.05Å; S121-K125 WeakPolarHBondContact O-CD 3.46Å; S121-K125 WeakPolarHBondContact O-CG 3.38Å; S121-K125 PolarHBondContact O-N 3.27Å
122	Y	97.3	Very high	96.3	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.008	20%	0.203	C	C	.	.	H	α-helix	trans	-67.4	-51.8	178.7	179.4	-86.6	0	0	0	111	L109 Y118 I119 G120 K125 N126 F129 I158 R162	L109-Y122 HydrophobicContact CD1-CD1 4.06Å; L109-Y122 HydrophobicContact CD1-CE1 3.9Å; L109-Y122 HydrophobicContact CD2-CE1 4.35Å; Y118-Y122 HydrophobicContact CE1-CD2 4.03Å; Y118-Y122 PolarHBondContact O-N 3.17Å; I119-Y122 WeakPolarHBondContact O-CB 3.47Å; I119-Y122 PolarHBondContact O-N 3.2Å; I119-Y122 VanDerWaalsContact O-N 3.1Å; G120-Y122 VanDerWaalsContact C-N 3.34Å; G120-Y122 PolarHBondContact O-N 3.24Å; Y122-K125 PolarHBondContact O-N 2.77Å; Y122-N126 PolarHBondContact O-N 3.31Å; Y122-F129 HydrophobicContact CE1-CB 4.48Å; Y122-F129 HydrophobicContact CE1-CD2 4.47Å; Y122-F129 HydrophobicContact CE1-CG 4.24Å; Y122-I158 HydrophobicContact CE2-CG2 3.86Å; Y122-R162 HydrophobicContact CD2-CB 3.97Å; Y122-R162 HydrophobicContact CE2-CB 3.82Å; Y122-R162 PolarHBondContact OH-O 3.09Å
123	L	96.8	Very high	96.2	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-71.7	-38.7	-176.3	-65.4	175.4	0	0	0	112.7	L73 V78 L106 I119 K125 N126 P127 F129 F130	L73-L123 HydrophobicContact CD2-CD1 4Å; V78-L123 HydrophobicContact CG2-CB 3.88Å; V78-L123 HydrophobicContact CG2-CD1 4.04Å; L106-L123 HydrophobicContact CD2-CD1 3.8Å; I119-L123 HydrophobicContact CG2-CD1 3.49Å; I119-L123 VanDerWaalsContact CG2-CD1 3.49Å; I119-L123 HydrophobicContact CG2-CG 4.07Å; I119-L123 WeakPolarHBondContact O-CG 3.48Å; I119-L123 PolarHBondContact O-N 3.09Å; L123-K125 PolarHBondContact O-N 3.41Å; L123-N126 CarbonylContact O-C 3.43Å; L123-N126 PolarHBondContact O-N 3.29Å; L123-P127 WeakPolarHBondContact O-CD 3.38Å; L123-P127 VanDerWaalsContact O-N 3.08Å; L123-F129 HydrophobicContact CD2-CD1 3.89Å; L123-F130 HydrophobicContact CD1-CE2 4.26Å; L123-F130 HydrophobicContact CD1-CZ 3.82Å; L123-F130 HydrophobicContact CD2-CE1 4.48Å; L123-F130 HydrophobicContact CD2-CE2 3.87Å; L123-F130 HydrophobicContact CD2-CZ 3.73Å; L123-F130 HydrophobicContact CG-CZ 4.38Å
124	T	96.3	Very high	96.2	Very high	16 Å²	16	38.4 Å²	38.4	10%	0.098	20%	0.2	C	C	.	.	H	α-helix	trans	-52.8	-39.6	172	-61.2	0	0	0	0	110.9	V78 D79 T82 L83 R86 G120	V78-T124 WeakPolarHBondContact CA-OG1 3.42Å; D79-T124 HydrophobicContact CB-CG2 3.76Å; D79-T124 PolarHBondContact N-OG1 3.43Å; T82-T124 HydrophobicContact CG2-CG2 3.93Å; L83-T124 WeakPolarHBondContact CD2-O 3.45Å; R86-T124 PolarHBondContact NH1-O 2.9Å; G120-T124 VanDerWaalsContact O-CB 3.26Å; G120-T124 WeakPolarHBondContact O-CB 3.48Å; G120-T124 PolarHBondContact O-N 3.49Å; G120-T124 PolarHBondContact O-OG1 3.21Å
125	K	95.7	Very high	96.3	Very high	93 Å²	93	43.6 Å²	43.6	40%	0.404	23%	0.228	S	C	.	.	H	α-helix	trans	-87.2	-29.5	-177.5	-63.4	172.5	-174.8	162	0	112.9	R86 S121 Y122 L123 R162 Y163	R86-K125 VanDerWaalsContact NH1-C 3.34Å; R86-K125 PolarHBondContact NH1-O 3.45Å; R86-K125 PolarHBondContact NH2-O 2.91Å; S121-K125 WeakPolarHBondContact O-CD 3.46Å; S121-K125 WeakPolarHBondContact O-CG 3.38Å; S121-K125 PolarHBondContact O-N 3.27Å; Y122-K125 PolarHBondContact O-N 2.77Å; L123-K125 PolarHBondContact O-N 3.41Å; K125-R162 VanDerWaalsContact CB-NE 3.35Å; K125-R162 PolarHBondContact O-NE 3.48Å; K125-Y163 PolarHBondContact O-OH 3.17Å
126	N	96.3	Very high	96.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.222	C	C	.	.			trans	-131.3	76.1	176.5	-178.3	23.5	0	0	0	112.5	Y122 L123 W128 F129 R162 Y163 N166	Y122-N126 PolarHBondContact O-N 3.31Å; L123-N126 CarbonylContact O-C 3.43Å; L123-N126 PolarHBondContact O-N 3.29Å; N126-W128 VanDerWaalsContact C-N 3.27Å; N126-W128 PolarHBondContact O-N 3.28Å; N126-F129 WeakPolarHBondContact O-CB 3.31Å; N126-F129 PolarHBondContact O-N 3.27Å; N126-F129 PolarHBondContact OD1-N 2.82Å; N126-R162 HydrophobicContact CB-CB 4.13Å; N126-R162 HydrophobicContact CB-CG 4.06Å; N126-R162 PolarHBondContact ND2-O 2.91Å; N126-Y163 HydrophobicContact CB-CD1 3.89Å; N126-Y163 HydrophobicContact CB-CE1 3.73Å; N126-Y163 VanDerWaalsContact CG-CD1 3.44Å; N126-Y163 WeakPolarHBondContact OD1-CD1 3.3Å; N126-Y163 WeakPolarHBondContact OD1-CE1 3.36Å; N126-N166 PolarHBondContact ND2-OD1 3.39Å; N126-N166 PolarHBondContact OD1-ND2 3.19Å
127	P	95.5	Very high	96.4	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-70.2	-24	177.1	31.3	-39.2	0	0	0	112.5	L83 V89 F92 L123 F129 F130	L83-P127 HydrophobicContact CD1-CB 4.46Å; L83-P127 HydrophobicContact CD2-CB 3.92Å; L83-P127 HydrophobicContact CD2-CG 3.8Å; V89-P127 HydrophobicContact CB-CG 4.44Å; V89-P127 HydrophobicContact CG1-CB 3.79Å; V89-P127 HydrophobicContact CG1-CG 3.88Å; V89-P127 HydrophobicContact CG2-CB 4.3Å; V89-P127 HydrophobicContact CG2-CG 3.6Å; F92-P127 HydrophobicContact CZ-CB 3.97Å; F92-P127 WeakPolarHBondContact CZ-O 2.92Å; L123-P127 WeakPolarHBondContact O-CD 3.38Å; L123-P127 VanDerWaalsContact O-N 3.08Å; P127-F129 PolarHBondContact O-N 2.75Å; P127-F129 VanDerWaalsContact O-N 3.1Å; P127-F130 WeakPolarHBondContact O-CD2 3.22Å; P127-F130 PolarHBondContact O-N 2.94Å
128	W	95.8	Very high	96.5	Very high	68 Å²	68	37.9 Å²	37.9	26%	0.258	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-68.6	-5.5	178.3	-57.8	-85	0	0	0	114.2	R86 V89 N126 F130 Q131 Q132 Y163	R86-W128 VanDerWaalsContact NH2-CH2 3.33Å; V89-W128 HydrophobicContact CG2-CZ2 3.93Å; N126-W128 VanDerWaalsContact C-N 3.27Å; N126-W128 PolarHBondContact O-N 3.28Å; W128-F130 PolarHBondContact O-N 3.1Å; W128-Q131 WeakPolarHBondContact O-CB 3.45Å; W128-Q131 PolarHBondContact O-N 2.98Å; W128-Q132 PolarHBondContact O-NE2 3.09Å; W128-Y163 HydrophobicContact CE3-CE1 4.02Å; W128-Y163 HydrophobicContact CZ3-CE1 4.08Å
129	F	96.5	Very high	96.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-52.8	-37.5	165.9	175.4	-112.2	0	0	0	111.8	R105 F108 L109 Y122 L123 N126 P127 Q131 Q132 L137 L165	R105-F129 HydrophobicContact CB-CE1 3.66Å; R105-F129 HydrophobicContact CB-CZ 4.1Å; R105-F129 HydrophobicContact CG-CE1 4.45Å; F108-F129 HydrophobicContact CD1-CZ 4.32Å; L109-F129 HydrophobicContact CD1-CD1 4.27Å; L109-F129 HydrophobicContact CD1-CE1 3.61Å; L109-F129 HydrophobicContact CD1-CZ 3.87Å; L109-F129 HydrophobicContact CD2-CE1 4.35Å; L109-F129 HydrophobicContact CD2-CE2 4.09Å; L109-F129 HydrophobicContact CD2-CZ 3.75Å; L109-F129 HydrophobicContact CG-CE1 3.87Å; L109-F129 HydrophobicContact CG-CE2 4.45Å; L109-F129 HydrophobicContact CG-CZ 3.63Å; Y122-F129 HydrophobicContact CE1-CB 4.48Å; Y122-F129 HydrophobicContact CE1-CD2 4.47Å; Y122-F129 HydrophobicContact CE1-CG 4.24Å; L123-F129 HydrophobicContact CD2-CD1 3.89Å; N126-F129 WeakPolarHBondContact O-CB 3.31Å; N126-F129 PolarHBondContact O-N 3.27Å; N126-F129 PolarHBondContact OD1-N 2.82Å; P127-F129 PolarHBondContact O-N 2.75Å; P127-F129 VanDerWaalsContact O-N 3.1Å; F129-Q131 PolarHBondContact O-N 2.94Å; F129-Q132 WeakPolarHBondContact O-CB 3.1Å; F129-Q132 WeakPolarHBondContact O-CG 3.28Å; F129-Q132 PolarHBondContact O-N 2.98Å; F129-Q132 VanDerWaalsContact O-N 3.16Å; F129-L137 HydrophobicContact CD2-CD1 4.47Å; F129-L137 HydrophobicContact CD2-CD2 4.06Å; F129-L137 HydrophobicContact CE2-CD1 3.66Å; F129-L137 HydrophobicContact CE2-CD2 3.59Å; F129-L137 HydrophobicContact CE2-CG 4.29Å; F129-L137 HydrophobicContact CZ-CD1 3.85Å; F129-L165 HydrophobicContact CD2-CB 4.45Å; F129-L165 HydrophobicContact CE2-CB 4.5Å; F129-L165 HydrophobicContact CE2-CD1 3.92Å
130	F	96	Very high	96.6	Very high	8 Å²	8	37.4 Å²	37.4	4%	0.035	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-68.4	-18.6	178	-65.8	-59	0	0	0	114.2	L73 F92 L93 L96 V102 R105 L123 P127 W128 Q132	L73-F130 HydrophobicContact CD2-CE2 4.16Å; L73-F130 HydrophobicContact CD2-CZ 3.95Å; F92-F130 HydrophobicContact CE2-CB 4.33Å; L93-F130 HydrophobicContact CD2-CD2 4.04Å; L93-F130 HydrophobicContact CD2-CE2 4.41Å; L96-F130 HydrophobicContact CD1-CB 3.8Å; L96-F130 HydrophobicContact CD1-CD1 4.47Å; L96-F130 HydrophobicContact CD1-CD2 4.07Å; L96-F130 HydrophobicContact CD1-CG 3.87Å; V102-F130 HydrophobicContact CB-CE1 4.26Å; V102-F130 HydrophobicContact CG1-CE1 3.8Å; V102-F130 HydrophobicContact CG1-CZ 3.97Å; V102-F130 HydrophobicContact CG2-CE1 4.32Å; R105-F130 HydrophobicContact CB-CD1 4.43Å; R105-F130 HydrophobicContact CB-CE1 4.43Å; R105-F130 PolarHBondContact NE-O 3.19Å; R105-F130 PolarHBondContact NH2-O 2.63Å; L123-F130 HydrophobicContact CD1-CE2 4.26Å; L123-F130 HydrophobicContact CD1-CZ 3.82Å; L123-F130 HydrophobicContact CD2-CE1 4.48Å; L123-F130 HydrophobicContact CD2-CE2 3.87Å; L123-F130 HydrophobicContact CD2-CZ 3.73Å; L123-F130 HydrophobicContact CG-CZ 4.38Å; P127-F130 WeakPolarHBondContact O-CD2 3.22Å; P127-F130 PolarHBondContact O-N 2.94Å; W128-F130 PolarHBondContact O-N 3.1Å; F130-Q132 VanDerWaalsContact C-N 3.3Å
131	Q	94.8	Very high	96.7	Very high	98 Å²	98	37.5 Å²	37.5	46%	0.458	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-83.5	-8.7	176.6	-62.3	-177.1	-9.2	0	0	112.8	F92 W128 F129	F92-Q131 HydrophobicContact CD2-CG 4.47Å; F92-Q131 HydrophobicContact CE2-CG 4.4Å; W128-Q131 WeakPolarHBondContact O-CB 3.45Å; W128-Q131 PolarHBondContact O-N 2.98Å; F129-Q131 PolarHBondContact O-N 2.94Å
132	Q	95.9	Very high	96.8	Very high	32 Å²	32	40.5 Å²	40.5	15%	0.15	20%	0.2	C	C	.	.	S	Bend	trans	-80.9	137	177.5	-53	-54.3	-57.4	0	0	110.2	R105 W128 F129 F130 L137	R105-Q132 VanDerWaalsContact CZ-O 3.22Å; R105-Q132 PolarHBondContact NE-O 3.18Å; R105-Q132 PolarHBondContact NH2-O 3.08Å; W128-Q132 PolarHBondContact O-NE2 3.09Å; F129-Q132 WeakPolarHBondContact O-CB 3.1Å; F129-Q132 WeakPolarHBondContact O-CG 3.28Å; F129-Q132 PolarHBondContact O-N 2.98Å; F129-Q132 VanDerWaalsContact O-N 3.16Å; F130-Q132 VanDerWaalsContact C-N 3.3Å; Q132-L137 HydrophobicContact CB-CD1 4.34Å; Q132-L137 HydrophobicContact CB-CD2 3.75Å; Q132-L137 HydrophobicContact CB-CG 3.9Å; Q132-L137 HydrophobicContact CG-CD2 4.27Å
133	S	96.3	Very high	96.8	Very high	52 Å²	52	41.5 Å²	41.5	36%	0.364	20%	0.204	S	C	.	.			trans	-69.5	151.2	174.7	86.4	0	0	0	0	111.1	D135 S136 L137	S133-D135 PolarHBondContact O-N 3.24Å; S133-S136 PolarHBondContact O-N 2.97Å; S133-S136 WeakPolarHBondContact OG-CB 3.16Å; S133-S136 PolarHBondContact OG-N 2.86Å; S133-S136 PolarHBondContact OG-OG 3.31Å; S133-L137 WeakPolarHBondContact O-CG 3.28Å; S133-L137 PolarHBondContact O-N 2.79Å
134	M	97.4	Very high	96.9	Very high	38 Å²	38	41.4 Å²	41.4	19%	0.187	20%	0.204	C	C	.	.	H	α-helix	trans	-60.5	-35.2	176.6	-76	-62.3	-63.9	0	0	112.3	P104 R105 F108 L137 R138	P104-M134 HydrophobicContact CB-CE 4.48Å; P104-M134 HydrophobicContact CB-SD 4.37Å; R105-M134 HydrophobicContact CG-SD 3.61Å; F108-M134 HydrophobicContact CB-CE 4.12Å; F108-M134 HydrophobicContact CD2-CE 4.5Å; F108-M134 HydrophobicContact CG-CE 4.48Å; M134-L137 PolarHBondContact O-N 3.03Å; M134-L137 HydrophobicContact SD-CD1 4.3Å; M134-R138 VanDerWaalsContact O-CG 3.3Å; M134-R138 WeakPolarHBondContact O-CG 3.42Å; M134-R138 PolarHBondContact O-N 3.27Å
135	D	97.5	Very high	97	Very high	113 Å²	113	44.5 Å²	44.5	60%	0.604	22%	0.216	S	C	*	.	H	α-helix	trans	-70.1	-40.1	179.1	-62.4	-29.3	0	0	0	111.6	S133 L137 R138 S139	S133-D135 PolarHBondContact O-N 3.24Å; D135-L137 VanDerWaalsContact C-N 3.35Å; D135-R138 PolarHBondContact O-N 3.47Å; D135-R138 IonicContact OD1-NH1 2.81Å; D135-S139 WeakPolarHBondContact O-CB 3.23Å; D135-S139 PolarHBondContact O-N 3.49Å; D135-S139 PolarHBondContact O-OG 3.27Å
136	S	96.9	Very high	97.1	Very high	32 Å²	32	43.8 Å²	43.8	22%	0.224	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-42.1	172.7	-56.6	0	0	0	0	111.6	S133 S139 R140	S133-S136 PolarHBondContact O-N 2.97Å; S133-S136 WeakPolarHBondContact OG-CB 3.16Å; S133-S136 PolarHBondContact OG-N 2.86Å; S133-S136 PolarHBondContact OG-OG 3.31Å; S136-S139 PolarHBondContact O-OG 3.07Å; S136-R140 VanDerWaalsContact O-CD 3.25Å; S136-R140 WeakPolarHBondContact O-CD 3.34Å; S136-R140 WeakPolarHBondContact O-CG 3.44Å; S136-R140 PolarHBondContact O-N 2.98Å; S136-R140 VanDerWaalsContact O-N 3.17Å
137	L	98	Very high	97.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-46.6	177.3	-70.7	178.6	0	0	0	111.4	R105 F108 F129 Q132 S133 M134 D135 R140 I141 L165	R105-L137 HydrophobicContact CG-CD1 4.16Å; F108-L137 HydrophobicContact CD1-CB 4.27Å; F108-L137 HydrophobicContact CD1-CD1 4.24Å; F108-L137 HydrophobicContact CE1-CB 3.68Å; F108-L137 HydrophobicContact CE1-CD1 4.34Å; F108-L137 HydrophobicContact CE1-CD2 4.49Å; F108-L137 HydrophobicContact CE1-CG 4.39Å; F108-L137 HydrophobicContact CZ-CB 3.79Å; F108-L137 WeakPolarHBondContact CZ-O 3.18Å; F129-L137 HydrophobicContact CD2-CD1 4.47Å; F129-L137 HydrophobicContact CD2-CD2 4.06Å; F129-L137 HydrophobicContact CE2-CD1 3.66Å; F129-L137 HydrophobicContact CE2-CD2 3.59Å; F129-L137 HydrophobicContact CE2-CG 4.29Å; F129-L137 HydrophobicContact CZ-CD1 3.85Å; Q132-L137 HydrophobicContact CB-CD1 4.34Å; Q132-L137 HydrophobicContact CB-CD2 3.75Å; Q132-L137 HydrophobicContact CB-CG 3.9Å; Q132-L137 HydrophobicContact CG-CD2 4.27Å; S133-L137 WeakPolarHBondContact O-CG 3.28Å; S133-L137 PolarHBondContact O-N 2.79Å; M134-L137 PolarHBondContact O-N 3.03Å; M134-L137 HydrophobicContact SD-CD1 4.3Å; D135-L137 VanDerWaalsContact C-N 3.35Å; L137-R140 PolarHBondContact O-N 2.66Å; L137-I141 PolarHBondContact O-N 2.87Å; L137-L165 HydrophobicContact CD2-CB 3.91Å; L137-L165 HydrophobicContact CD2-CD1 4.43Å
138	R	97.9	Very high	97.3	Very high	132 Å²	132	53.2 Å²	53.2	50%	0.498	27%	0.269	S	S	.	.	H	α-helix	trans	-62.7	-46.9	177.3	-72.5	170.7	-178.5	154.8	-3.5	112	F108 M134 D135 R140 I141 E142	F108-R138 HydrophobicContact CE2-CG 4.03Å; M134-R138 VanDerWaalsContact O-CG 3.3Å; M134-R138 WeakPolarHBondContact O-CG 3.42Å; M134-R138 PolarHBondContact O-N 3.27Å; D135-R138 PolarHBondContact O-N 3.47Å; D135-R138 IonicContact OD1-NH1 2.81Å; R138-R140 VanDerWaalsContact C-N 3.26Å; R138-R140 PolarHBondContact O-N 3.03Å; R138-I141 PolarHBondContact O-N 2.79Å; R138-E142 WeakPolarHBondContact O-CG 3.31Å; R138-E142 PolarHBondContact O-N 3.14Å
139	S	97.8	Very high	97.5	Very high	56 Å²	56	50.4 Å²	50.4	39%	0.392	26%	0.258	S	S	.	.	H	α-helix	trans	-61.2	-35.3	-178.7	69.8	0	0	0	0	112.5	D135 S136 I141 Y143	D135-S139 WeakPolarHBondContact O-CB 3.23Å; D135-S139 PolarHBondContact O-N 3.49Å; D135-S139 PolarHBondContact O-OG 3.27Å; S136-S139 PolarHBondContact O-OG 3.07Å; S139-I141 VanDerWaalsContact C-N 3.35Å; S139-I141 PolarHBondContact O-N 3.26Å; S139-Y143 VanDerWaalsContact O-CB 3.28Å; S139-Y143 WeakPolarHBondContact O-CB 3.33Å; S139-Y143 PolarHBondContact O-N 3.48Å
140	R	97.7	Very high	97.5	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.5	-37.3	174.5	-70.1	162.6	-179.4	153.8	1.3	112.7	S136 L137 R138 L144 L165 F167 E168 V169	S136-R140 VanDerWaalsContact O-CD 3.25Å; S136-R140 WeakPolarHBondContact O-CD 3.34Å; S136-R140 WeakPolarHBondContact O-CG 3.44Å; S136-R140 PolarHBondContact O-N 2.98Å; S136-R140 VanDerWaalsContact O-N 3.17Å; L137-R140 PolarHBondContact O-N 2.66Å; R138-R140 VanDerWaalsContact C-N 3.26Å; R138-R140 PolarHBondContact O-N 3.03Å; R140-L144 PolarHBondContact O-N 2.83Å; R140-L165 HydrophobicContact CB-CD2 4.22Å; R140-L165 PolarHBondContact NH1-O 3.18Å; R140-F167 WeakPolarHBondContact CD-O 3.43Å; R140-F167 PolarHBondContact NE-O 3.25Å; R140-E168 IonicContact CZ-OE1 3.45Å; R140-E168 IonicContact NH2-OE1 2.94Å; R140-E168 PolarHBondContact NH2-OE1 3.28Å; R140-V169 HydrophobicContact CB-CG2 4.49Å; R140-V169 HydrophobicContact CG-CG2 3.93Å
141	I	98.2	Very high	97.6	Very high	4 Å²	4	58.9 Å²	58.9	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-75.7	-46	176.8	-61.5	-56.1	0	0	0	111.3	F108 L112 L137 R138 S139 Y143 L144 K145 I154 I158 L165	F108-I141 HydrophobicContact CE1-CG1 4.34Å; F108-I141 HydrophobicContact CE2-CG1 4.27Å; F108-I141 HydrophobicContact CZ-CG1 3.53Å; L112-I141 HydrophobicContact CD1-CD1 3.8Å; L112-I141 HydrophobicContact CD1-CG1 3.93Å; L112-I141 HydrophobicContact CD2-CD1 4.13Å; L112-I141 HydrophobicContact CD2-CG1 4.02Å; L112-I141 HydrophobicContact CD2-CG2 3.78Å; L137-I141 PolarHBondContact O-N 2.87Å; R138-I141 PolarHBondContact O-N 2.79Å; S139-I141 VanDerWaalsContact C-N 3.35Å; S139-I141 PolarHBondContact O-N 3.26Å; I141-Y143 PolarHBondContact O-N 3.4Å; I141-L144 WeakPolarHBondContact O-CB 3.25Å; I141-L144 PolarHBondContact O-N 3.49Å; I141-K145 HydrophobicContact CG2-CD 4.45Å; I141-K145 PolarHBondContact O-N 2.81Å; I141-I154 HydrophobicContact CD1-CG2 3.8Å; I141-I158 HydrophobicContact CD1-CD1 3.76Å; I141-L165 HydrophobicContact CD1-CD2 3.88Å; I141-L165 HydrophobicContact CG1-CD2 4.48Å
142	E	98.2	Very high	97.8	Very high	103 Å²	103	57.9 Å²	57.9	48%	0.481	32%	0.316	S	S	.	.	H	α-helix	trans	-61.3	-34.5	177.6	-68.3	-52	128	0	0	111.6	R138 K145 S146	R138-E142 WeakPolarHBondContact O-CG 3.31Å; R138-E142 PolarHBondContact O-N 3.14Å; E142-K145 PolarHBondContact O-N 3.37Å; E142-K145 IonicContact OE1-NZ 2.87Å; E142-K145 PolarHBondContact OE1-NZ 3.04Å; E142-S146 WeakPolarHBondContact O-CB 3.48Å; E142-S146 PolarHBondContact O-N 2.61Å
143	Y	98.4	Very high	97.9	Very high	24 Å²	24	57.4 Å²	57.4	9%	0.094	32%	0.317	C	S	.	.	H	α-helix	trans	-59.1	-49	169.5	171	-96.7	0	0	0	112.4	S139 I141 K145 S146 K147 V169 I172 D173 L176	S139-Y143 VanDerWaalsContact O-CB 3.28Å; S139-Y143 WeakPolarHBondContact O-CB 3.33Å; S139-Y143 PolarHBondContact O-N 3.48Å; I141-Y143 PolarHBondContact O-N 3.4Å; Y143-K145 VanDerWaalsContact C-N 3.31Å; Y143-K145 PolarHBondContact O-N 3.46Å; Y143-S146 WeakPolarHBondContact O-CB 3.47Å; Y143-S146 PolarHBondContact O-N 3.46Å; Y143-S146 VanDerWaalsContact O-N 3.14Å; Y143-S146 PolarHBondContact O-OG 2.94Å; Y143-K147 HydrophobicContact CE1-CG 4.15Å; Y143-K147 HydrophobicContact CE2-CD 4.34Å; Y143-K147 HydrophobicContact CE2-CG 4.05Å; Y143-K147 WeakPolarHBondContact O-CG 3.39Å; Y143-K147 PolarHBondContact O-N 2.6Å; Y143-K147 VanDerWaalsContact O-N 3.14Å; Y143-K147 WeakPolarHBondContact OH-CE 3.46Å; Y143-V169 HydrophobicContact CD1-CG1 4.2Å; Y143-V169 HydrophobicContact CD2-CG1 3.37Å; Y143-V169 HydrophobicContact CE2-CG1 3.92Å; Y143-V169 HydrophobicContact CG-CG1 3.52Å; Y143-I172 HydrophobicContact CD1-CG2 4.31Å; Y143-I172 HydrophobicContact CE1-CB 4.46Å; Y143-I172 HydrophobicContact CE1-CG2 3.69Å; Y143-D173 HydrophobicContact CE2-CB 3.95Å; Y143-D173 WeakPolarHBondContact CE2-OD1 3.41Å; Y143-D173 WeakPolarHBondContact OH-CA 3.45Å; Y143-D173 WeakPolarHBondContact OH-CB 3.24Å; Y143-D173 VanDerWaalsContact OH-CG 3.3Å; Y143-D173 PolarHBondContact OH-OD1 2.87Å; Y143-L176 HydrophobicContact CE1-CD1 3.93Å; Y143-L176 WeakPolarHBondContact OH-CD1 3.3Å
144	L	98.4	Very high	98	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-43	178.1	-76.3	174.9	0	0	0	111.8	R140 I141 S146 K147 N148 F149 I154 W164	R140-L144 PolarHBondContact O-N 2.83Å; I141-L144 WeakPolarHBondContact O-CB 3.25Å; I141-L144 PolarHBondContact O-N 3.49Å; L144-S146 VanDerWaalsContact C-N 3.34Å; L144-S146 PolarHBondContact O-N 2.95Å; L144-K147 CarbonylContact O-C 3.56Å; L144-K147 PolarHBondContact O-N 2.92Å; L144-K147 VanDerWaalsContact O-N 3.12Å; L144-N148 PolarHBondContact O-N 2.96Å; L144-F149 HydrophobicContact CB-CB 4.32Å; L144-F149 HydrophobicContact CB-CD2 4.43Å; L144-F149 HydrophobicContact CD2-CD2 3.75Å; L144-F149 HydrophobicContact CD2-CE2 3.9Å; L144-F149 HydrophobicContact CD2-CG 4.11Å; L144-F149 HydrophobicContact CD2-CZ 4.39Å; L144-F149 WeakPolarHBondContact O-CB 3.38Å; L144-F149 WeakPolarHBondContact O-CD2 3.38Å; L144-F149 PolarHBondContact O-N 3.12Å; L144-F149 VanDerWaalsContact O-N 3.14Å; L144-I154 HydrophobicContact CB-CD1 3.88Å; L144-I154 HydrophobicContact CB-CG1 4Å; L144-I154 HydrophobicContact CD1-CG1 4.16Å; L144-I154 HydrophobicContact CD1-CG2 4.11Å; L144-W164 HydrophobicContact CD1-CZ2 4.49Å; L144-W164 HydrophobicContact CD2-CZ2 3.84Å
145	K	98.2	Very high	98	Very high	81 Å²	81	54.4 Å²	54.4	35%	0.352	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-43	174.4	-67.6	178.5	-177.9	168.3	0	111.8	I141 E142 Y143 K147 N148 I154	I141-K145 HydrophobicContact CG2-CD 4.45Å; I141-K145 PolarHBondContact O-N 2.81Å; E142-K145 PolarHBondContact O-N 3.37Å; E142-K145 IonicContact OE1-NZ 2.87Å; E142-K145 PolarHBondContact OE1-NZ 3.04Å; Y143-K145 VanDerWaalsContact C-N 3.31Å; Y143-K145 PolarHBondContact O-N 3.46Å; K145-K147 PolarHBondContact O-N 3.23Å; K145-K147 VanDerWaalsContact O-N 3.15Å; K145-N148 WeakPolarHBondContact O-CA 3.49Å; K145-N148 PolarHBondContact O-N 3.07Å; K145-I154 HydrophobicContact CG-CD1 3.73Å
146	S	98.2	Very high	98.1	Very high	77 Å²	77	54 Å²	54	54%	0.538	29%	0.288	S	S	.	.	H	α-helix	trans	-61.2	-23.6	176.5	82.1	0	0	0	0	113.5	E142 Y143 L144 N148	E142-S146 WeakPolarHBondContact O-CB 3.48Å; E142-S146 PolarHBondContact O-N 2.61Å; Y143-S146 WeakPolarHBondContact O-CB 3.47Å; Y143-S146 PolarHBondContact O-N 3.46Å; Y143-S146 VanDerWaalsContact O-N 3.14Å; Y143-S146 PolarHBondContact O-OG 2.94Å; L144-S146 VanDerWaalsContact C-N 3.34Å; L144-S146 PolarHBondContact O-N 2.95Å; S146-N148 VanDerWaalsContact C-N 3.31Å
147	K	98	Very high	98.1	Very high	84 Å²	84	52.4 Å²	52.4	37%	0.365	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	13.9	174.4	-59.1	-59.8	-174.9	167.5	0	113.1	Y143 L144 K145 F149 D173 R191	Y143-K147 HydrophobicContact CE1-CG 4.15Å; Y143-K147 HydrophobicContact CE2-CD 4.34Å; Y143-K147 HydrophobicContact CE2-CG 4.05Å; Y143-K147 WeakPolarHBondContact O-CG 3.39Å; Y143-K147 PolarHBondContact O-N 2.6Å; Y143-K147 VanDerWaalsContact O-N 3.14Å; Y143-K147 WeakPolarHBondContact OH-CE 3.46Å; L144-K147 CarbonylContact O-C 3.56Å; L144-K147 PolarHBondContact O-N 2.92Å; L144-K147 VanDerWaalsContact O-N 3.12Å; K145-K147 PolarHBondContact O-N 3.23Å; K145-K147 VanDerWaalsContact O-N 3.15Å; K147-F149 VanDerWaalsContact C-N 3.31Å; K147-F149 HydrophobicContact CB-CD2 3.94Å; K147-F149 HydrophobicContact CB-CE2 4.05Å; K147-F149 PolarHBondContact O-N 3.26Å; K147-D173 WeakPolarHBondContact CE-OD1 3.19Å; K147-D173 IonicContact NZ-OD1 3.62Å; K147-D173 PolarHBondContact NZ-OD1 3.09Å; K147-D173 VanDerWaalsContact NZ-OD1 3.09Å; K147-R191 PolarHBondContact O-NH1 3.02Å
148	N	98.2	Very high	98.1	Very high	116 Å²	116	52.4 Å²	52.4	62%	0.62	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	32.5	178.8	-56.3	-45.5	0	0	0	113.8	L144 K145 S146 P150 R191	L144-N148 PolarHBondContact O-N 2.96Å; K145-N148 WeakPolarHBondContact O-CA 3.49Å; K145-N148 PolarHBondContact O-N 3.07Å; S146-N148 VanDerWaalsContact C-N 3.31Å; N148-P150 WeakPolarHBondContact O-CD 3.4Å; N148-R191 WeakPolarHBondContact O-CD 3.46Å
149	F	98.6	Very high	98.1	Very high	9 Å²	9	48.3 Å²	48.3	4%	0.039	26%	0.264	C	S	.	.			trans	-72.6	124.7	166.7	-78	-96	0	0	0	109.4	L144 K147 I154 I157 R191 V194	L144-F149 HydrophobicContact CB-CB 4.32Å; L144-F149 HydrophobicContact CB-CD2 4.43Å; L144-F149 HydrophobicContact CD2-CD2 3.75Å; L144-F149 HydrophobicContact CD2-CE2 3.9Å; L144-F149 HydrophobicContact CD2-CG 4.11Å; L144-F149 HydrophobicContact CD2-CZ 4.39Å; L144-F149 WeakPolarHBondContact O-CB 3.38Å; L144-F149 WeakPolarHBondContact O-CD2 3.38Å; L144-F149 PolarHBondContact O-N 3.12Å; L144-F149 VanDerWaalsContact O-N 3.14Å; K147-F149 VanDerWaalsContact C-N 3.31Å; K147-F149 HydrophobicContact CB-CD2 3.94Å; K147-F149 HydrophobicContact CB-CE2 4.05Å; K147-F149 PolarHBondContact O-N 3.26Å; F149-I154 HydrophobicContact CB-CD1 4.31Å; F149-I154 HydrophobicContact CB-CG1 3.86Å; F149-I157 HydrophobicContact CD1-CD1 3.63Å; F149-I157 HydrophobicContact CE1-CD1 3.7Å; F149-R191 HydrophobicContact CD1-CB 4.34Å; F149-R191 HydrophobicContact CD1-CG 4.06Å; F149-R191 HydrophobicContact CD2-CG 4.06Å; F149-R191 HydrophobicContact CE1-CB 3.97Å; F149-R191 HydrophobicContact CE1-CG 3.83Å; F149-R191 HydrophobicContact CE2-CG 3.83Å; F149-R191 HydrophobicContact CG-CG 4.18Å; F149-R191 HydrophobicContact CZ-CB 4.22Å; F149-R191 HydrophobicContact CZ-CG 3.72Å; F149-V194 HydrophobicContact CE1-CB 4.1Å; F149-V194 HydrophobicContact CE1-CG1 3.95Å; F149-V194 HydrophobicContact CZ-CB 4.18Å; F149-V194 HydrophobicContact CZ-CG1 4.04Å
150	P	97.7	Very high	98	Very high	76 Å²	76	50.3 Å²	50.3	49%	0.494	27%	0.266	S	S	.	.			trans	-61.2	150.3	172.5	-22.3	33.2	0	0	0	111.5	N148 A152 S153 I154	N148-P150 WeakPolarHBondContact O-CD 3.4Å; P150-A152 VanDerWaalsContact C-N 3.28Å; P150-A152 PolarHBondContact O-N 3.02Å; P150-S153 WeakPolarHBondContact O-CA 3.23Å; P150-S153 VanDerWaalsContact O-CB 3.26Å; P150-S153 WeakPolarHBondContact O-CB 3.41Å; P150-S153 PolarHBondContact O-N 3.13Å; P150-I154 PolarHBondContact O-N 3.34Å
151	D	98.1	Very high	98	Very high	109 Å²	109	50.5 Å²	50.5	58%	0.583	27%	0.268	S	S	*	.	H	α-helix	trans	-55.2	-42.9	-179.2	-69.6	-27.9	0	0	0	112.3	S153 I154 T155	D151-S153 VanDerWaalsContact C-N 3.25Å; D151-S153 PolarHBondContact O-N 3.01Å; D151-I154 WeakPolarHBondContact O-CA 3.45Å; D151-I154 WeakPolarHBondContact O-CB 3.34Å; D151-I154 PolarHBondContact O-N 3.44Å; D151-T155 PolarHBondContact O-N 3.41Å; D151-T155 PolarHBondContact O-OG1 3.46Å; D151-T155 VanDerWaalsContact O-OG1 3.04Å
152	A	97.9	Very high	97.8	Very high	77 Å²	77	54.3 Å²	54.3	64%	0.636	28%	0.282	S	S	*	.	H	α-helix	trans	-59.8	-34.6	175.6	0	0	0	0	0	113.1	P150 R156	P150-A152 VanDerWaalsContact C-N 3.28Å; P150-A152 PolarHBondContact O-N 3.02Å; A152-R156 WeakPolarHBondContact O-CB 3.37Å; A152-R156 PolarHBondContact O-N 3.15Å; A152-R156 VanDerWaalsContact O-N 3.09Å
153	S	98.4	Very high	97.7	Very high	23 Å²	23	50.9 Å²	50.9	16%	0.161	27%	0.265	C	S	.	.	H	α-helix	trans	-70.1	-40.1	174	-63.1	0	0	0	0	111.4	P150 D151 R156 I157 T195	P150-S153 WeakPolarHBondContact O-CA 3.23Å; P150-S153 VanDerWaalsContact O-CB 3.26Å; P150-S153 WeakPolarHBondContact O-CB 3.41Å; P150-S153 PolarHBondContact O-N 3.13Å; D151-S153 VanDerWaalsContact C-N 3.25Å; D151-S153 PolarHBondContact O-N 3.01Å; S153-R156 PolarHBondContact O-N 3.42Å; S153-I157 WeakPolarHBondContact O-CB 3.36Å; S153-I157 WeakPolarHBondContact O-CD1 3.43Å; S153-I157 VanDerWaalsContact O-CG1 3.22Å; S153-I157 WeakPolarHBondContact O-CG1 3.48Å; S153-I157 PolarHBondContact O-N 3.17Å; S153-T195 WeakPolarHBondContact CB-OG1 3.37Å
154	I	98.4	Very high	97.7	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-60.8	-49	175.7	-63.8	176.2	0	0	0	110.3	I141 L144 K145 F149 P150 D151 R156 I157 I158	I141-I154 HydrophobicContact CD1-CG2 3.8Å; L144-I154 HydrophobicContact CB-CD1 3.88Å; L144-I154 HydrophobicContact CB-CG1 4Å; L144-I154 HydrophobicContact CD1-CG1 4.16Å; L144-I154 HydrophobicContact CD1-CG2 4.11Å; K145-I154 HydrophobicContact CG-CD1 3.73Å; F149-I154 HydrophobicContact CB-CD1 4.31Å; F149-I154 HydrophobicContact CB-CG1 3.86Å; P150-I154 PolarHBondContact O-N 3.34Å; D151-I154 WeakPolarHBondContact O-CA 3.45Å; D151-I154 WeakPolarHBondContact O-CB 3.34Å; D151-I154 PolarHBondContact O-N 3.44Å; I154-R156 VanDerWaalsContact C-N 3.31Å; I154-R156 PolarHBondContact O-N 2.85Å; I154-I157 WeakPolarHBondContact O-CB 3.31Å; I154-I157 PolarHBondContact O-N 2.86Å; I154-I157 VanDerWaalsContact O-N 3.14Å; I154-I158 HydrophobicContact CG2-CD1 3.8Å; I154-I158 WeakPolarHBondContact O-CD1 3.49Å; I154-I158 WeakPolarHBondContact O-CG1 3.34Å; I154-I158 PolarHBondContact O-N 3.31Å
155	T	98.3	Very high	97.6	Very high	24 Å²	24	49.8 Å²	49.8	15%	0.147	26%	0.26	C	S	.	.	H	α-helix	trans	-53.8	-50	174.8	-48.5	0	0	0	0	110.8	L112 G113 D151 I157 I158 M159	L112-T155 WeakPolarHBondContact O-CB 3.37Å; L112-T155 VanDerWaalsContact O-CG2 3.3Å; L112-T155 WeakPolarHBondContact O-CG2 3.38Å; L112-T155 PolarHBondContact O-OG1 2.83Å; G113-T155 WeakPolarHBondContact O-CG2 3.28Å; D151-T155 PolarHBondContact O-N 3.41Å; D151-T155 PolarHBondContact O-OG1 3.46Å; D151-T155 VanDerWaalsContact O-OG1 3.04Å; T155-I157 VanDerWaalsContact C-N 3.33Å; T155-I157 PolarHBondContact O-N 3.39Å; T155-I158 PolarHBondContact O-N 3.16Å; T155-M159 HydrophobicContact CG2-CG 4.48Å; T155-M159 HydrophobicContact CG2-SD 3.84Å; T155-M159 WeakPolarHBondContact O-CB 3.35Å; T155-M159 VanDerWaalsContact O-CG 3.28Å; T155-M159 WeakPolarHBondContact O-CG 3.45Å; T155-M159 PolarHBondContact O-N 3.49Å
156	R	98.2	Very high	97.5	Very high	104 Å²	104	47.7 Å²	47.7	39%	0.392	25%	0.253	S	S	.	.	H	α-helix	trans	-60.8	-39.9	178.6	177.5	170.4	167.3	161	3.8	112.5	A152 S153 I154 K160 T195	A152-R156 WeakPolarHBondContact O-CB 3.37Å; A152-R156 PolarHBondContact O-N 3.15Å; A152-R156 VanDerWaalsContact O-N 3.09Å; S153-R156 PolarHBondContact O-N 3.42Å; I154-R156 VanDerWaalsContact C-N 3.31Å; I154-R156 PolarHBondContact O-N 2.85Å; R156-K160 HydrophobicContact CG-CD 4.13Å; R156-K160 HydrophobicContact CG-CG 4.4Å; R156-K160 VanDerWaalsContact NH2-NZ 3.16Å; R156-K160 WeakPolarHBondContact O-CB 3.47Å; R156-K160 WeakPolarHBondContact O-CG 3.19Å; R156-K160 PolarHBondContact O-N 2.74Å; R156-T195 WeakPolarHBondContact CD-O 3.46Å; R156-T195 HydrophobicContact CG-CG2 4.36Å; R156-T195 PolarHBondContact NE-O 3.17Å
157	I	98.4	Very high	97.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.5	-52	177.5	-75.1	162.8	0	0	0	110.5	F149 S153 I154 T155 M159 K160 A161 W164 V194 P198	F149-I157 HydrophobicContact CD1-CD1 3.63Å; F149-I157 HydrophobicContact CE1-CD1 3.7Å; S153-I157 WeakPolarHBondContact O-CB 3.36Å; S153-I157 WeakPolarHBondContact O-CD1 3.43Å; S153-I157 VanDerWaalsContact O-CG1 3.22Å; S153-I157 WeakPolarHBondContact O-CG1 3.48Å; S153-I157 PolarHBondContact O-N 3.17Å; I154-I157 WeakPolarHBondContact O-CB 3.31Å; I154-I157 PolarHBondContact O-N 2.86Å; I154-I157 VanDerWaalsContact O-N 3.14Å; T155-I157 VanDerWaalsContact C-N 3.33Å; T155-I157 PolarHBondContact O-N 3.39Å; I157-M159 VanDerWaalsContact C-N 3.34Å; I157-M159 PolarHBondContact O-N 3.41Å; I157-K160 PolarHBondContact O-N 3.34Å; I157-A161 PolarHBondContact O-N 3.46Å; I157-W164 HydrophobicContact CG2-CB 4.45Å; I157-W164 HydrophobicContact CG2-CD2 3.41Å; I157-W164 VanDerWaalsContact CG2-CD2 3.41Å; I157-W164 HydrophobicContact CG2-CE3 3.53Å; I157-W164 HydrophobicContact CG2-CG 3.8Å; I157-W164 HydrophobicContact CG2-CH2 4.28Å; I157-W164 HydrophobicContact CG2-CZ2 4.22Å; I157-W164 HydrophobicContact CG2-CZ3 3.92Å; I157-V194 HydrophobicContact CD1-CG1 3.97Å; I157-V194 HydrophobicContact CG1-CG1 4.35Å; I157-P198 HydrophobicContact CB-CB 4.3Å; I157-P198 HydrophobicContact CB-CG 4.17Å; I157-P198 HydrophobicContact CG1-CB 4.14Å; I157-P198 HydrophobicContact CG1-CG 3.94Å; I157-P198 HydrophobicContact CG2-CB 3.98Å; I157-P198 HydrophobicContact CG2-CG 4.37Å
158	I	97.5	Very high	97.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-46.3	-179.2	-64	160.4	0	0	0	110.2	L109 L112 V114 Y122 I141 I154 T155 A161 R162 L165	L109-I158 HydrophobicContact CD2-CG2 4.23Å; L112-I158 HydrophobicContact CB-CD1 4.15Å; L112-I158 HydrophobicContact CD1-CD1 3.56Å; L112-I158 HydrophobicContact CG-CD1 4.35Å; V114-I158 HydrophobicContact CG2-CG2 4.29Å; Y122-I158 HydrophobicContact CE2-CG2 3.86Å; I141-I158 HydrophobicContact CD1-CD1 3.76Å; I154-I158 HydrophobicContact CG2-CD1 3.8Å; I154-I158 WeakPolarHBondContact O-CD1 3.49Å; I154-I158 WeakPolarHBondContact O-CG1 3.34Å; I154-I158 PolarHBondContact O-N 3.31Å; T155-I158 PolarHBondContact O-N 3.16Å; I158-A161 CarbonylContact O-C 3.51Å; I158-R162 PolarHBondContact O-N 3.33Å; I158-L165 HydrophobicContact CD1-CD1 4.38Å; I158-L165 HydrophobicContact CG1-CD1 4.19Å; I158-L165 HydrophobicContact CG1-CG 4.29Å; I158-L165 HydrophobicContact CG2-CD1 3.94Å
159	M	97.2	Very high	97.3	Very high	45 Å²	45	41.5 Å²	41.5	22%	0.222	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-46.2	-178.9	-69.9	176.4	73.7	0	0	112.1	V114 P115 Y118 T155 I157	V114-M159 HydrophobicContact CG2-CG 4.39Å; P115-M159 HydrophobicContact CG-CE 4.14Å; Y118-M159 HydrophobicContact CD1-CB 4.48Å; Y118-M159 HydrophobicContact CD1-CE 3.99Å; Y118-M159 HydrophobicContact CD1-CG 4.06Å; Y118-M159 HydrophobicContact CD2-CE 4.09Å; Y118-M159 HydrophobicContact CE1-CB 3.86Å; Y118-M159 HydrophobicContact CE1-CE 4.26Å; Y118-M159 HydrophobicContact CE1-CG 3.92Å; Y118-M159 HydrophobicContact CE2-CE 4.39Å; Y118-M159 HydrophobicContact CG-CE 3.89Å; Y118-M159 PolarHBondContact OH-O 3.12Å; T155-M159 HydrophobicContact CG2-CG 4.48Å; T155-M159 HydrophobicContact CG2-SD 3.84Å; T155-M159 WeakPolarHBondContact O-CB 3.35Å; T155-M159 VanDerWaalsContact O-CG 3.28Å; T155-M159 WeakPolarHBondContact O-CG 3.45Å; T155-M159 PolarHBondContact O-N 3.49Å; I157-M159 VanDerWaalsContact C-N 3.34Å; I157-M159 PolarHBondContact O-N 3.41Å
160	K	96.7	Very high	97.2	Very high	99 Å²	99	47.4 Å²	47.4	43%	0.43	24%	0.242	S	C	.	.	H	α-helix	trans	-76.9	-27.9	-176.6	-73.8	-167.7	178.2	-165	0	113.8	R156 I157 E196 P198	R156-K160 HydrophobicContact CG-CD 4.13Å; R156-K160 HydrophobicContact CG-CG 4.4Å; R156-K160 VanDerWaalsContact NH2-NZ 3.16Å; R156-K160 WeakPolarHBondContact O-CB 3.47Å; R156-K160 WeakPolarHBondContact O-CG 3.19Å; R156-K160 PolarHBondContact O-N 2.74Å; I157-K160 PolarHBondContact O-N 3.34Å; K160-E196 PolarHBondContact NZ-O 2.82Å; K160-P198 HydrophobicContact CB-CG 3.93Å
161	A	96.8	Very high	97.2	Very high	4 Å²	4	46.1 Å²	46.1	3%	0.033	24%	0.235	C	C	.	.			trans	-125.7	76.2	179.2	0	0	0	0	0	110.5	I157 I158 Y163 W164 P198 T202	I157-A161 PolarHBondContact O-N 3.46Å; I158-A161 CarbonylContact O-C 3.51Å; A161-Y163 PolarHBondContact O-N 2.98Å; A161-W164 HydrophobicContact CB-CB 4.29Å; A161-W164 WeakPolarHBondContact O-CB 3.43Å; A161-W164 PolarHBondContact O-N 3.11Å; A161-P198 HydrophobicContact CB-CB 3.75Å; A161-P198 HydrophobicContact CB-CG 4.34Å; A161-T202 HydrophobicContact CB-CG2 3.88Å
162	R	94.3	Very high	97.2	Very high	83 Å²	83	40.9 Å²	40.9	31%	0.313	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-28.4	-177.6	66.2	-177.4	-178.5	-102.4	10.6	116.5	Y122 K125 N126 I158	Y122-R162 HydrophobicContact CD2-CB 3.97Å; Y122-R162 HydrophobicContact CE2-CB 3.82Å; Y122-R162 PolarHBondContact OH-O 3.09Å; K125-R162 VanDerWaalsContact CB-NE 3.35Å; K125-R162 PolarHBondContact O-NE 3.48Å; N126-R162 HydrophobicContact CB-CB 4.13Å; N126-R162 HydrophobicContact CB-CG 4.06Å; N126-R162 PolarHBondContact ND2-O 2.91Å; I158-R162 PolarHBondContact O-N 3.33Å
163	Y	95.9	Very high	97.2	Very high	32 Å²	32	40.3 Å²	40.3	13%	0.125	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-1	179.3	-62	-63.4	0	0	0	113.3	V28 R86 K125 N126 W128 A161 L165 N166 F167	V28-Y163 HydrophobicContact CG1-CD2 4.24Å; V28-Y163 HydrophobicContact CG1-CG 4.39Å; V28-Y163 HydrophobicContact CG2-CD2 4.22Å; V28-Y163 HydrophobicContact CG2-CE2 4.45Å; R86-Y163 PolarHBondContact NH2-OH 3.33Å; R86-Y163 VanDerWaalsContact NH2-OH 3.16Å; K125-Y163 PolarHBondContact O-OH 3.17Å; N126-Y163 HydrophobicContact CB-CD1 3.89Å; N126-Y163 HydrophobicContact CB-CE1 3.73Å; N126-Y163 VanDerWaalsContact CG-CD1 3.44Å; N126-Y163 WeakPolarHBondContact OD1-CD1 3.3Å; N126-Y163 WeakPolarHBondContact OD1-CE1 3.36Å; W128-Y163 HydrophobicContact CE3-CE1 4.02Å; W128-Y163 HydrophobicContact CZ3-CE1 4.08Å; A161-Y163 PolarHBondContact O-N 2.98Å; Y163-L165 VanDerWaalsContact C-N 3.25Å; Y163-L165 PolarHBondContact O-N 2.96Å; Y163-N166 WeakPolarHBondContact O-CB 3.32Å; Y163-N166 PolarHBondContact O-N 3.4Å; Y163-F167 WeakPolarHBondContact O-CD2 3.38Å; Y163-F167 WeakPolarHBondContact O-CE2 3.03Å
164	W	97.3	Very high	97.2	Very high	1 Å²	1	42.2 Å²	42.2	0%	0.004	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-53.1	-47.5	179.4	-178.2	-77.3	0	0	0	111.2	L144 I157 A161 N166 F167 I172 V194 P198 I201 T202	L144-W164 HydrophobicContact CD1-CZ2 4.49Å; L144-W164 HydrophobicContact CD2-CZ2 3.84Å; I157-W164 HydrophobicContact CG2-CB 4.45Å; I157-W164 HydrophobicContact CG2-CD2 3.41Å; I157-W164 VanDerWaalsContact CG2-CD2 3.41Å; I157-W164 HydrophobicContact CG2-CE3 3.53Å; I157-W164 HydrophobicContact CG2-CG 3.8Å; I157-W164 HydrophobicContact CG2-CH2 4.28Å; I157-W164 HydrophobicContact CG2-CZ2 4.22Å; I157-W164 HydrophobicContact CG2-CZ3 3.92Å; A161-W164 HydrophobicContact CB-CB 4.29Å; A161-W164 WeakPolarHBondContact O-CB 3.43Å; A161-W164 PolarHBondContact O-N 3.11Å; W164-N166 PolarHBondContact O-N 3.14Å; W164-F167 PolarHBondContact O-N 2.98Å; W164-F167 VanDerWaalsContact O-N 3.1Å; W164-I172 HydrophobicContact CH2-CG2 4.1Å; W164-I172 HydrophobicContact CZ2-CD1 4.25Å; W164-I172 HydrophobicContact CZ2-CG1 4.37Å; W164-I172 HydrophobicContact CZ2-CG2 3.52Å; W164-V194 HydrophobicContact CH2-CG1 3.62Å; W164-V194 HydrophobicContact CZ3-CG1 3.85Å; W164-P198 HydrophobicContact CE3-CB 4.02Å; W164-P198 HydrophobicContact CZ3-CB 4Å; W164-I201 HydrophobicContact CE3-CB 4.12Å; W164-I201 HydrophobicContact CE3-CG2 4.33Å; W164-I201 HydrophobicContact CH2-CB 3.82Å; W164-I201 HydrophobicContact CH2-CG1 3.67Å; W164-I201 HydrophobicContact CH2-CG2 3.79Å; W164-I201 HydrophobicContact CZ2-CG2 4.5Å; W164-I201 HydrophobicContact CZ3-CB 3.36Å; W164-I201 HydrophobicContact CZ3-CG1 3.51Å; W164-I201 HydrophobicContact CZ3-CG2 3.72Å; W164-T202 HydrophobicContact CB-CG2 4.16Å; W164-T202 HydrophobicContact CE3-CG2 4.12Å
165	L	96.8	Very high	97.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-71.5	8.7	178.1	-66.3	179.6	0	0	0	113.9	F108 L109 F129 L137 R140 I141 I158 Y163	F108-L165 HydrophobicContact CE1-CD1 4.25Å; L109-L165 HydrophobicContact CD2-CD1 4.14Å; F129-L165 HydrophobicContact CD2-CB 4.45Å; F129-L165 HydrophobicContact CE2-CB 4.5Å; F129-L165 HydrophobicContact CE2-CD1 3.92Å; L137-L165 HydrophobicContact CD2-CB 3.91Å; L137-L165 HydrophobicContact CD2-CD1 4.43Å; R140-L165 HydrophobicContact CB-CD2 4.22Å; R140-L165 PolarHBondContact NH1-O 3.18Å; I141-L165 HydrophobicContact CD1-CD2 3.88Å; I141-L165 HydrophobicContact CG1-CD2 4.48Å; I158-L165 HydrophobicContact CD1-CD1 4.38Å; I158-L165 HydrophobicContact CG1-CD1 4.19Å; I158-L165 HydrophobicContact CG1-CG 4.29Å; I158-L165 HydrophobicContact CG2-CD1 3.94Å; Y163-L165 VanDerWaalsContact C-N 3.25Å; Y163-L165 PolarHBondContact O-N 2.96Å
166	N	96.2	Very high	97.1	Very high	37 Å²	37	43.1 Å²	43.1	20%	0.198	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-103.3	-10.3	170.9	-60.2	47.4	0	0	0	111.9	N126 Y163 W164	N126-N166 PolarHBondContact ND2-OD1 3.39Å; N126-N166 PolarHBondContact OD1-ND2 3.19Å; Y163-N166 WeakPolarHBondContact O-CB 3.32Å; Y163-N166 PolarHBondContact O-N 3.4Å; W164-N166 PolarHBondContact O-N 3.14Å
167	F	96.3	Very high	97.1	Very high	25 Å²	25	39.8 Å²	39.8	11%	0.11	21%	0.21	C	C	.	.	S	Bend	trans	-91.3	139.9	-179	-70.9	-80.1	0	0	0	112.1	V28 R140 Y163 W164 I172 T202	V28-F167 HydrophobicContact CG1-CZ 4.33Å; R140-F167 WeakPolarHBondContact CD-O 3.43Å; R140-F167 PolarHBondContact NE-O 3.25Å; Y163-F167 WeakPolarHBondContact O-CD2 3.38Å; Y163-F167 WeakPolarHBondContact O-CE2 3.03Å; W164-F167 PolarHBondContact O-N 2.98Å; W164-F167 VanDerWaalsContact O-N 3.1Å; F167-I172 HydrophobicContact CB-CD1 4.21Å; F167-I172 HydrophobicContact CB-CG1 3.99Å; F167-T202 HydrophobicContact CD2-CG2 4.07Å; F167-T202 HydrophobicContact CE2-CG2 3.75Å; F167-T202 VanDerWaalsContact CZ-O 3.29Å; F167-T202 WeakPolarHBondContact CZ-O 3.45Å
168	E	95.9	Very high	97.1	Very high	92 Å²	92	41.7 Å²	41.7	43%	0.43	22%	0.217	S	C	.	.			trans	-62.4	147.1	171.8	-66.5	-51.2	115.6	0	0	112.1	R140 Q170 S171 I172	R140-E168 IonicContact CZ-OE1 3.45Å; R140-E168 IonicContact NH2-OE1 2.94Å; R140-E168 PolarHBondContact NH2-OE1 3.28Å; E168-Q170 PolarHBondContact O-N 2.81Å; E168-S171 WeakPolarHBondContact O-CB 3.34Å; E168-S171 PolarHBondContact O-N 3.41Å; E168-I172 PolarHBondContact O-N 2.99Å; E168-I172 VanDerWaalsContact O-N 3.07Å
169	V	97.6	Very high	97.2	Very high	29 Å²	29	41.8 Å²	41.8	18%	0.176	22%	0.217	C	C	.	.	H	α-helix	trans	-56.2	-39.7	-179.4	170.8	0	0	0	0	111.3	R140 Y143 S171 I172 D173	R140-V169 HydrophobicContact CB-CG2 4.49Å; R140-V169 HydrophobicContact CG-CG2 3.93Å; Y143-V169 HydrophobicContact CD1-CG1 4.2Å; Y143-V169 HydrophobicContact CD2-CG1 3.37Å; Y143-V169 HydrophobicContact CE2-CG1 3.92Å; Y143-V169 HydrophobicContact CG-CG1 3.52Å; V169-S171 VanDerWaalsContact C-N 3.3Å; V169-S171 PolarHBondContact O-N 3.3Å; V169-I172 PolarHBondContact O-N 2.96Å; V169-D173 WeakPolarHBondContact O-CB 3.11Å; V169-D173 PolarHBondContact O-N 2.67Å
170	Q	97.8	Very high	97.2	Very high	134 Å²	134	43.9 Å²	43.9	63%	0.626	23%	0.227	S	C	*	.	H	α-helix	trans	-62.6	-37.9	178.4	-60	80.7	-0.8	0	0	111.7	E168 A174	E168-Q170 PolarHBondContact O-N 2.81Å; Q170-A174 VanDerWaalsContact O-CB 3.28Å; Q170-A174 WeakPolarHBondContact O-CB 3.33Å; Q170-A174 PolarHBondContact O-N 3.07Å
171	S	96.8	Very high	97.3	Very high	48 Å²	48	47.2 Å²	47.2	34%	0.336	24%	0.241	S	C	.	.	H	α-helix	trans	-69.1	-39.9	176.3	-70.2	0	0	0	0	111.5	E168 V169 R175	E168-S171 WeakPolarHBondContact O-CB 3.34Å; E168-S171 PolarHBondContact O-N 3.41Å; V169-S171 VanDerWaalsContact C-N 3.3Å; V169-S171 PolarHBondContact O-N 3.3Å; S171-R175 WeakPolarHBondContact O-CB 3.22Å; S171-R175 WeakPolarHBondContact O-CD 3.26Å; S171-R175 WeakPolarHBondContact O-CG 3.17Å; S171-R175 PolarHBondContact O-N 3.07Å
172	I	97.7	Very high	97.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-49.9	175.7	-65.8	167	0	0	0	109.8	Y143 W164 F167 E168 V169 A174 R175 L176 I201	Y143-I172 HydrophobicContact CD1-CG2 4.31Å; Y143-I172 HydrophobicContact CE1-CB 4.46Å; Y143-I172 HydrophobicContact CE1-CG2 3.69Å; W164-I172 HydrophobicContact CH2-CG2 4.1Å; W164-I172 HydrophobicContact CZ2-CD1 4.25Å; W164-I172 HydrophobicContact CZ2-CG1 4.37Å; W164-I172 HydrophobicContact CZ2-CG2 3.52Å; F167-I172 HydrophobicContact CB-CD1 4.21Å; F167-I172 HydrophobicContact CB-CG1 3.99Å; E168-I172 PolarHBondContact O-N 2.99Å; E168-I172 VanDerWaalsContact O-N 3.07Å; V169-I172 PolarHBondContact O-N 2.96Å; I172-A174 PolarHBondContact O-N 2.67Å; I172-R175 PolarHBondContact O-N 2.99Å; I172-L176 HydrophobicContact CG2-CD1 3.75Å; I172-L176 HydrophobicContact CG2-CG 4.25Å; I172-L176 VanDerWaalsContact O-CG 3.29Å; I172-L176 WeakPolarHBondContact O-CG 3.42Å; I172-L176 PolarHBondContact O-N 3.39Å; I172-I201 HydrophobicContact CG1-CG2 4.46Å; I172-I201 HydrophobicContact CG2-CG2 4.43Å
173	D	98.2	Very high	97.5	Very high	65 Å²	65	47.7 Å²	47.7	35%	0.348	25%	0.246	S	C	.	.	H	α-helix	trans	-61	-45.5	-178.6	-169	76.8	0	0	0	112.3	Y143 K147 V169 R175 L176 G177	Y143-D173 HydrophobicContact CE2-CB 3.95Å; Y143-D173 WeakPolarHBondContact CE2-OD1 3.41Å; Y143-D173 WeakPolarHBondContact OH-CA 3.45Å; Y143-D173 WeakPolarHBondContact OH-CB 3.24Å; Y143-D173 VanDerWaalsContact OH-CG 3.3Å; Y143-D173 PolarHBondContact OH-OD1 2.87Å; K147-D173 WeakPolarHBondContact CE-OD1 3.19Å; K147-D173 IonicContact NZ-OD1 3.62Å; K147-D173 PolarHBondContact NZ-OD1 3.09Å; K147-D173 VanDerWaalsContact NZ-OD1 3.09Å; V169-D173 WeakPolarHBondContact O-CB 3.11Å; V169-D173 PolarHBondContact O-N 2.67Å; D173-R175 VanDerWaalsContact C-N 3.32Å; D173-R175 PolarHBondContact O-N 3.2Å; D173-L176 PolarHBondContact O-N 2.83Å; D173-G177 PolarHBondContact O-N 3.18Å
174	A	98.2	Very high	97.6	Very high	63 Å²	63	54.4 Å²	54.4	52%	0.521	28%	0.276	S	S	.	.	H	α-helix	trans	-59.7	-41.1	176.2	0	0	0	0	0	112.4	Q170 I172 W178	Q170-A174 VanDerWaalsContact O-CB 3.28Å; Q170-A174 WeakPolarHBondContact O-CB 3.33Å; Q170-A174 PolarHBondContact O-N 3.07Å; I172-A174 PolarHBondContact O-N 2.67Å; A174-W178 WeakPolarHBondContact O-CB 3.18Å; A174-W178 PolarHBondContact O-N 2.94Å
175	R	98	Very high	97.7	Very high	35 Å²	35	54.8 Å²	54.8	13%	0.132	28%	0.278	C	S	.	.	H	α-helix	trans	-70.9	-42.8	179.3	-68.5	173	-167.5	173.7	5.9	111.5	S171 I172 D173 W178 Y179 I201 T205	S171-R175 WeakPolarHBondContact O-CB 3.22Å; S171-R175 WeakPolarHBondContact O-CD 3.26Å; S171-R175 WeakPolarHBondContact O-CG 3.17Å; S171-R175 PolarHBondContact O-N 3.07Å; I172-R175 PolarHBondContact O-N 2.99Å; D173-R175 VanDerWaalsContact C-N 3.32Å; D173-R175 PolarHBondContact O-N 3.2Å; R175-W178 WeakPolarHBondContact O-CB 3.35Å; R175-W178 PolarHBondContact O-N 3.47Å; R175-Y179 VanDerWaalsContact O-CD2 3.3Å; R175-Y179 WeakPolarHBondContact O-CD2 3.35Å; R175-Y179 PolarHBondContact O-N 2.89Å; R175-Y179 VanDerWaalsContact O-N 3.09Å; R175-I201 HydrophobicContact CB-CD1 4.07Å; R175-I201 HydrophobicContact CB-CG2 4.13Å; R175-I201 WeakPolarHBondContact CD-O 3.49Å; R175-I201 PolarHBondContact NH1-O 3.03Å; R175-T205 HydrophobicContact CB-CG2 4.34Å; R175-T205 HydrophobicContact CG-CG2 4.16Å
176	L	98.2	Very high	97.8	Very high	10 Å²	10	57.2 Å²	57.2	5%	0.052	30%	0.295	C	S	.	.	H	α-helix	trans	-59.3	-48.7	174.3	-69.2	173.2	0	0	0	111.1	Y143 I172 D173 W178 Y179 Q180 V190 V194 I201	Y143-L176 HydrophobicContact CE1-CD1 3.93Å; Y143-L176 WeakPolarHBondContact OH-CD1 3.3Å; I172-L176 HydrophobicContact CG2-CD1 3.75Å; I172-L176 HydrophobicContact CG2-CG 4.25Å; I172-L176 VanDerWaalsContact O-CG 3.29Å; I172-L176 WeakPolarHBondContact O-CG 3.42Å; I172-L176 PolarHBondContact O-N 3.39Å; D173-L176 PolarHBondContact O-N 2.83Å; L176-W178 VanDerWaalsContact C-N 3.29Å; L176-W178 PolarHBondContact O-N 3.45Å; L176-Y179 PolarHBondContact O-N 3.26Å; L176-Q180 PolarHBondContact O-N 3.41Å; L176-V190 HydrophobicContact CB-CG1 4.49Å; L176-V190 HydrophobicContact CD2-CG1 3.88Å; L176-V194 HydrophobicContact CD2-CB 4.43Å; L176-V194 HydrophobicContact CD2-CG1 4.33Å; L176-V194 HydrophobicContact CD2-CG2 3.43Å; L176-V194 VanDerWaalsContact CD2-CG2 3.43Å; L176-I201 HydrophobicContact CD2-CD1 3.74Å; L176-I201 HydrophobicContact CD2-CG1 4.11Å; L176-I201 HydrophobicContact CG-CD1 4.26Å
177	G	98.1	Very high	97.8	Very high	34 Å²	34	56.9 Å²	56.9	35%	0.351	30%	0.3	S	S	.	.	H	α-helix	trans	-61.4	-35.8	176.5	0	0	0	0	0	112.9	D173 Q180 K181	D173-G177 PolarHBondContact O-N 3.18Å; G177-Q180 PolarHBondContact O-N 2.84Å; G177-K181 WeakPolarHBondContact O-CB 3.34Å; G177-K181 PolarHBondContact O-N 3.19Å
178	W	98.3	Very high	98	Very high	40 Å²	40	60.9 Å²	60.9	15%	0.152	32%	0.323	C	S	.	.	H	α-helix	trans	-63	-48.8	174.6	179.7	91.4	0	0	0	112.2	A174 R175 L176 Q180 K181 Q182 F183 T205 T208 Q209	A174-W178 WeakPolarHBondContact O-CB 3.18Å; A174-W178 PolarHBondContact O-N 2.94Å; R175-W178 WeakPolarHBondContact O-CB 3.35Å; R175-W178 PolarHBondContact O-N 3.47Å; L176-W178 VanDerWaalsContact C-N 3.29Å; L176-W178 PolarHBondContact O-N 3.45Å; W178-Q180 VanDerWaalsContact C-N 3.31Å; W178-Q180 PolarHBondContact O-N 2.92Å; W178-K181 PolarHBondContact O-N 3.13Å; W178-Q182 HydrophobicContact CD2-CG 4Å; W178-Q182 VanDerWaalsContact CE2-CG 3.45Å; W178-Q182 HydrophobicContact CG-CG 4.33Å; W178-Q182 HydrophobicContact CH2-CB 4.45Å; W178-Q182 HydrophobicContact CH2-CG 4.38Å; W178-Q182 HydrophobicContact CZ2-CB 4.17Å; W178-Q182 HydrophobicContact CZ2-CG 3.63Å; W178-Q182 WeakPolarHBondContact O-CB 3.44Å; W178-Q182 WeakPolarHBondContact O-CG 3.24Å; W178-Q182 PolarHBondContact O-N 2.92Å; W178-F183 HydrophobicContact CH2-CE2 4.03Å; W178-F183 HydrophobicContact CZ3-CE2 4.05Å; W178-T205 HydrophobicContact CB-CG2 4.17Å; W178-T205 HydrophobicContact CD2-CG2 3.51Å; W178-T205 HydrophobicContact CE3-CG2 3.31Å; W178-T205 HydrophobicContact CG-CG2 3.88Å; W178-T205 HydrophobicContact CZ3-CG2 3.97Å; W178-T208 HydrophobicContact CH2-CG2 3.78Å; W178-T208 HydrophobicContact CZ3-CG2 3.82Å; W178-Q209 HydrophobicContact CH2-CG 3.93Å; W178-Q209 HydrophobicContact CZ2-CG 3.29Å; W178-Q209 VanDerWaalsContact NE1-NE2 3.19Å
179	Y	98.4	Very high	98.1	Very high	1 Å²	1	58.6 Å²	58.6	0%	0.004	31%	0.312	C	S	.	.	H	α-helix	trans	-61	-43.3	176.4	-84.3	-82.1	0	0	0	111.1	R175 L176 K181 F183 I193 L200 I201 T205 T208 L230	R175-Y179 VanDerWaalsContact O-CD2 3.3Å; R175-Y179 WeakPolarHBondContact O-CD2 3.35Å; R175-Y179 PolarHBondContact O-N 2.89Å; R175-Y179 VanDerWaalsContact O-N 3.09Å; L176-Y179 PolarHBondContact O-N 3.26Å; Y179-K181 PolarHBondContact O-N 3.47Å; Y179-F183 HydrophobicContact CD1-CD2 4.04Å; Y179-F183 HydrophobicContact CD1-CE2 4.01Å; Y179-F183 HydrophobicContact CE1-CE2 4.33Å; Y179-F183 PolarHBondContact O-N 2.9Å; Y179-I193 HydrophobicContact CD1-CD1 4.13Å; Y179-I193 HydrophobicContact CG-CD1 4.42Å; Y179-L200 HydrophobicContact CE1-CB 4.4Å; Y179-L200 HydrophobicContact CE1-CD1 4.4Å; Y179-L200 HydrophobicContact CE1-CD2 4.09Å; Y179-L200 HydrophobicContact CE2-CB 4.07Å; Y179-L200 VanDerWaalsContact CE2-O 3.32Å; Y179-L200 WeakPolarHBondContact CE2-O 3.47Å; Y179-L200 WeakPolarHBondContact OH-CB 3.42Å; Y179-L200 WeakPolarHBondContact OH-CD2 3.46Å; Y179-L200 PolarHBondContact OH-O 3.01Å; Y179-I201 HydrophobicContact CD2-CD1 3.87Å; Y179-I201 HydrophobicContact CE2-CD1 3.93Å; Y179-T205 HydrophobicContact CE2-CG2 4.23Å; Y179-T208 HydrophobicContact CE1-CG2 3.61Å; Y179-T208 PolarHBondContact OH-OG1 3.28Å; Y179-L230 HydrophobicContact CD1-CD2 4.09Å
180	Q	98.5	Very high	98.1	Very high	90 Å²	90	57.7 Å²	57.7	42%	0.421	31%	0.307	S	S	.	.	H	α-helix	trans	-58	-48.8	178.7	-165.1	178.6	2.3	0	0	111.8	L176 G177 W178 K184 L185 V190	L176-Q180 PolarHBondContact O-N 3.41Å; G177-Q180 PolarHBondContact O-N 2.84Å; W178-Q180 VanDerWaalsContact C-N 3.31Å; W178-Q180 PolarHBondContact O-N 2.92Å; Q180-K184 CarbonylContact O-C 3.57Å; Q180-K184 VanDerWaalsContact O-CA 3.24Å; Q180-K184 WeakPolarHBondContact O-CA 3.42Å; Q180-K184 PolarHBondContact O-N 3.02Å; Q180-L185 WeakPolarHBondContact CG-O 3.49Å; Q180-L185 PolarHBondContact O-N 3.26Å; Q180-V190 HydrophobicContact CB-CG2 3.72Å; Q180-V190 HydrophobicContact CG-CG2 3.81Å
181	K	98.3	Very high	98.2	Very high	169 Å²	169	53.8 Å²	53.8	74%	0.735	29%	0.286	S	S	*	.	H	α-helix	trans	-68.9	-48	-179.7	-176.8	177.2	178.1	179.2	0	112	G177 W178 Y179 K184	G177-K181 WeakPolarHBondContact O-CB 3.34Å; G177-K181 PolarHBondContact O-N 3.19Å; W178-K181 PolarHBondContact O-N 3.13Å; Y179-K181 PolarHBondContact O-N 3.47Å; K181-K184 PolarHBondContact O-N 3.16Å
182	Q	97.5	Very high	98.3	Very high	88 Å²	88	55.2 Å²	55.2	41%	0.411	29%	0.287	S	S	.	.	H	α-helix	trans	-70.7	-35.6	-172.1	-74.5	-57.3	-1	0	0	113.9	W178	W178-Q182 HydrophobicContact CD2-CG 4Å; W178-Q182 VanDerWaalsContact CE2-CG 3.45Å; W178-Q182 HydrophobicContact CG-CG 4.33Å; W178-Q182 HydrophobicContact CH2-CB 4.45Å; W178-Q182 HydrophobicContact CH2-CG 4.38Å; W178-Q182 HydrophobicContact CZ2-CB 4.17Å; W178-Q182 HydrophobicContact CZ2-CG 3.63Å; W178-Q182 WeakPolarHBondContact O-CB 3.44Å; W178-Q182 WeakPolarHBondContact O-CG 3.24Å; W178-Q182 PolarHBondContact O-N 2.92Å
183	F	98	Very high	98.3	Very high	8 Å²	8	55.2 Å²	55.2	4%	0.035	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	6	179.4	-66.6	-88.3	0	0	0	112.9	W178 Y179 L185 T208 Q212 K227 L230 W237	W178-F183 HydrophobicContact CH2-CE2 4.03Å; W178-F183 HydrophobicContact CZ3-CE2 4.05Å; Y179-F183 HydrophobicContact CD1-CD2 4.04Å; Y179-F183 HydrophobicContact CD1-CE2 4.01Å; Y179-F183 HydrophobicContact CE1-CE2 4.33Å; Y179-F183 PolarHBondContact O-N 2.9Å; F183-L185 VanDerWaalsContact C-N 3.29Å; F183-L185 HydrophobicContact CB-CD1 4.12Å; F183-L185 HydrophobicContact CB-CD2 3.74Å; F183-L185 HydrophobicContact CB-CG 3.69Å; F183-L185 PolarHBondContact O-N 3.45Å; F183-T208 HydrophobicContact CE2-CG2 4.15Å; F183-T208 HydrophobicContact CZ-CG2 4.2Å; F183-Q212 HydrophobicContact CZ-CG 4.33Å; F183-K227 WeakPolarHBondContact O-CD 3.1Å; F183-K227 WeakPolarHBondContact O-CG 3.42Å; F183-L230 HydrophobicContact CB-CD2 3.86Å; F183-L230 HydrophobicContact CD1-CB 4.34Å; F183-L230 HydrophobicContact CD1-CD2 3.62Å; F183-L230 HydrophobicContact CD2-CD2 3.51Å; F183-L230 HydrophobicContact CE1-CB 4.47Å; F183-L230 HydrophobicContact CE1-CD2 3.98Å; F183-L230 HydrophobicContact CE2-CD2 3.88Å; F183-L230 HydrophobicContact CG-CD2 3.36Å; F183-L230 HydrophobicContact CZ-CD2 4.1Å; F183-W237 AromaticContact CE1-CH2 3.33Å; F183-W237 HydrophobicContact CE1-CH2 3.33Å; F183-W237 AromaticContact CE1-CZ2 3.5Å; F183-W237 HydrophobicContact CE1-CZ2 3.5Å; F183-W237 VanDerWaalsContact CE1-CZ2 3.5Å; F183-W237 AromaticContact CE1-CZ3 3.93Å; F183-W237 HydrophobicContact CE1-CZ3 3.93Å; F183-W237 HydrophobicContact CZ-CD2 4.42Å; F183-W237 HydrophobicContact CZ-CE3 4.04Å; F183-W237 AromaticContact CZ-CH2 3.45Å; F183-W237 HydrophobicContact CZ-CH2 3.45Å; F183-W237 VanDerWaalsContact CZ-CH2 3.45Å; F183-W237 AromaticContact CZ-CZ2 3.89Å; F183-W237 HydrophobicContact CZ-CZ2 3.89Å; F183-W237 AromaticContact CZ-CZ3 3.52Å; F183-W237 HydrophobicContact CZ-CZ3 3.52Å
184	K	98.2	Very high	98.3	Very high	174 Å²	174	52.1 Å²	52.1	76%	0.757	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	51.3	-177.2	-57.6	-179.9	-178.4	179.6	0	111.6	Q180 K181 K227	Q180-K184 CarbonylContact O-C 3.57Å; Q180-K184 VanDerWaalsContact O-CA 3.24Å; Q180-K184 WeakPolarHBondContact O-CA 3.42Å; Q180-K184 PolarHBondContact O-N 3.02Å; K181-K184 PolarHBondContact O-N 3.16Å; K184-K227 PolarHBondContact O-NZ 2.81Å
185	L	98.6	Very high	98.3	Very high	9 Å²	9	49.8 Å²	49.8	5%	0.047	25%	0.25	C	S	.	.			trans	-85.3	145.4	-177.4	-54.5	176.2	0	0	0	111	Q180 F183 E189 V190 I193 K227 L230 V231	Q180-L185 WeakPolarHBondContact CG-O 3.49Å; Q180-L185 PolarHBondContact O-N 3.26Å; F183-L185 VanDerWaalsContact C-N 3.29Å; F183-L185 HydrophobicContact CB-CD1 4.12Å; F183-L185 HydrophobicContact CB-CD2 3.74Å; F183-L185 HydrophobicContact CB-CG 3.69Å; F183-L185 PolarHBondContact O-N 3.45Å; L185-E189 VanDerWaalsContact CA-OE2 3.29Å; L185-E189 WeakPolarHBondContact CA-OE2 3.48Å; L185-E189 HydrophobicContact CB-CB 3.94Å; L185-E189 HydrophobicContact CD2-CB 4.17Å; L185-V190 HydrophobicContact CB-CG2 3.75Å; L185-V190 HydrophobicContact CD1-CG2 4.01Å; L185-I193 HydrophobicContact CD1-CD1 3.43Å; L185-I193 VanDerWaalsContact CD1-CD1 3.43Å; L185-I193 HydrophobicContact CD1-CG1 4.45Å; L185-K227 HydrophobicContact CD2-CD 4.32Å; L185-K227 HydrophobicContact CD2-CG 3.91Å; L185-L230 HydrophobicContact CD1-CD2 4.12Å; L185-V231 HydrophobicContact CD2-CG2 3.9Å
186	S	98.3	Very high	98.3	Very high	51 Å²	51	51 Å²	51	36%	0.357	26%	0.258	S	S	.	.			trans	-70.2	165.7	163	79.6	0	0	0	0	110.7	D188 E189 V190	S186-D188 PolarHBondContact O-N 3.07Å; S186-D188 PolarHBondContact OG-N 3.18Å; S186-E189 PolarHBondContact N-OE2 3.29Å; S186-E189 PolarHBondContact O-N 2.91Å; S186-E189 WeakPolarHBondContact OG-CG 3.37Å; S186-E189 PolarHBondContact OG-N 2.92Å; S186-E189 VanDerWaalsContact OG-N 3.08Å; S186-V190 WeakPolarHBondContact O-CG2 3.31Å; S186-V190 PolarHBondContact O-N 3.41Å
187	G	98.1	Very high	98.3	Very high	30 Å²	30	51.4 Å²	51.4	31%	0.309	26%	0.26	S	S	.	.	H	α-helix	trans	-59.7	-35.6	174	0	0	0	0	0	112.9	R191	G187-R191 WeakPolarHBondContact O-CG 3.47Å; G187-R191 PolarHBondContact O-N 2.99Å; G187-R191 VanDerWaalsContact O-N 3.13Å
188	D	98.5	Very high	98.3	Very high	109 Å²	109	49.8 Å²	49.8	58%	0.583	24%	0.243	S	C	*	.	H	α-helix	trans	-67.8	-44.2	175.8	-69.6	-51.7	0	0	0	112	S186 V190 R191 Q192	S186-D188 PolarHBondContact O-N 3.07Å; S186-D188 PolarHBondContact OG-N 3.18Å; D188-V190 VanDerWaalsContact C-N 3.33Å; D188-V190 PolarHBondContact O-N 2.97Å; D188-R191 PolarHBondContact O-N 3.22Å; D188-R191 IonicContact OD1-CZ 2.84Å; D188-R191 IonicContact OD1-NE 3.74Å; D188-R191 IonicContact OD1-NH2 3.63Å; D188-R191 PolarHBondContact OD1-NH2 3.44Å; D188-R191 IonicContact OD2-NH2 2.74Å; D188-Q192 WeakPolarHBondContact O-CB 3.47Å; D188-Q192 PolarHBondContact O-N 2.98Å
189	E	98.7	Very high	98.2	Very high	43 Å²	43	52.1 Å²	52.1	20%	0.201	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-40.6	177.4	-72.3	173.6	139.5	0	0	111.1	L185 S186 Q192 I193 K227 V231	L185-E189 VanDerWaalsContact CA-OE2 3.29Å; L185-E189 WeakPolarHBondContact CA-OE2 3.48Å; L185-E189 HydrophobicContact CB-CB 3.94Å; L185-E189 HydrophobicContact CD2-CB 4.17Å; S186-E189 PolarHBondContact N-OE2 3.29Å; S186-E189 PolarHBondContact O-N 2.91Å; S186-E189 WeakPolarHBondContact OG-CG 3.37Å; S186-E189 PolarHBondContact OG-N 2.92Å; S186-E189 VanDerWaalsContact OG-N 3.08Å; E189-Q192 WeakPolarHBondContact O-CB 3.43Å; E189-Q192 PolarHBondContact O-N 3.27Å; E189-I193 WeakPolarHBondContact O-CG2 3.32Å; E189-I193 PolarHBondContact O-N 3.06Å; E189-K227 VanDerWaalsContact CD-CE 3.48Å; E189-K227 WeakPolarHBondContact OE1-CE 3.14Å; E189-K227 IonicContact OE1-NZ 2.8Å; E189-K227 PolarHBondContact OE1-NZ 3.29Å; E189-K227 VanDerWaalsContact OE1-NZ 3.1Å; E189-K227 VanDerWaalsContact OE2-CE 3.27Å; E189-K227 WeakPolarHBondContact OE2-CE 3.36Å; E189-K227 IonicContact OE2-NZ 3.09Å; E189-K227 PolarHBondContact OE2-NZ 3.17Å; E189-V231 HydrophobicContact CB-CG2 4.4Å; E189-V231 HydrophobicContact CG-CG2 4.32Å
190	V	98.6	Very high	98.1	Very high	11 Å²	11	52.1 Å²	52.1	7%	0.067	25%	0.254	C	S	.	.	H	α-helix	trans	-60.1	-47.9	174	174.4	0	0	0	0	111	L176 Q180 L185 S186 D188 Q192 I193 V194	L176-V190 HydrophobicContact CB-CG1 4.49Å; L176-V190 HydrophobicContact CD2-CG1 3.88Å; Q180-V190 HydrophobicContact CB-CG2 3.72Å; Q180-V190 HydrophobicContact CG-CG2 3.81Å; L185-V190 HydrophobicContact CB-CG2 3.75Å; L185-V190 HydrophobicContact CD1-CG2 4.01Å; S186-V190 WeakPolarHBondContact O-CG2 3.31Å; S186-V190 PolarHBondContact O-N 3.41Å; D188-V190 VanDerWaalsContact C-N 3.33Å; D188-V190 PolarHBondContact O-N 2.97Å; V190-Q192 VanDerWaalsContact C-N 3.3Å; V190-Q192 PolarHBondContact O-N 3.17Å; V190-I193 WeakPolarHBondContact O-CG1 3.46Å; V190-V194 HydrophobicContact CG1-CG2 4.31Å; V190-V194 WeakPolarHBondContact O-CB 3.33Å; V190-V194 WeakPolarHBondContact O-CG2 3.49Å; V190-V194 PolarHBondContact O-N 3.17Å; V190-V194 VanDerWaalsContact O-N 3.15Å
191	R	98.6	Very high	98.1	Very high	52 Å²	52	47.8 Å²	47.8	20%	0.196	23%	0.234	C	C	.	.	H	α-helix	trans	-60.4	-41.8	177.7	-76.2	-173.5	-72.3	-86.2	1.1	111.7	K147 N148 F149 G187 D188 T195	K147-R191 PolarHBondContact O-NH1 3.02Å; N148-R191 WeakPolarHBondContact O-CD 3.46Å; F149-R191 HydrophobicContact CD1-CB 4.34Å; F149-R191 HydrophobicContact CD1-CG 4.06Å; F149-R191 HydrophobicContact CD2-CG 4.06Å; F149-R191 HydrophobicContact CE1-CB 3.97Å; F149-R191 HydrophobicContact CE1-CG 3.83Å; F149-R191 HydrophobicContact CE2-CG 3.83Å; F149-R191 HydrophobicContact CG-CG 4.18Å; F149-R191 HydrophobicContact CZ-CB 4.22Å; F149-R191 HydrophobicContact CZ-CG 3.72Å; G187-R191 WeakPolarHBondContact O-CG 3.47Å; G187-R191 PolarHBondContact O-N 2.99Å; G187-R191 VanDerWaalsContact O-N 3.13Å; D188-R191 PolarHBondContact O-N 3.22Å; D188-R191 IonicContact OD1-CZ 2.84Å; D188-R191 IonicContact OD1-NE 3.74Å; D188-R191 IonicContact OD1-NH2 3.63Å; D188-R191 PolarHBondContact OD1-NH2 3.44Å; D188-R191 IonicContact OD2-NH2 2.74Å; R191-T195 VanDerWaalsContact O-CB 3.22Å; R191-T195 WeakPolarHBondContact O-CB 3.37Å; R191-T195 PolarHBondContact O-N 3.47Å; R191-T195 PolarHBondContact O-OG1 3.42Å
192	Q	98.6	Very high	97.9	Very high	77 Å²	77	40.2 Å²	40.2	36%	0.36	20%	0.202	S	C	.	.	H	α-helix	trans	-59.3	-58.5	178.5	-177.7	-172.9	-8.5	0	0	111	D188 E189 V190 V194 T195 E196 V231	D188-Q192 WeakPolarHBondContact O-CB 3.47Å; D188-Q192 PolarHBondContact O-N 2.98Å; E189-Q192 WeakPolarHBondContact O-CB 3.43Å; E189-Q192 PolarHBondContact O-N 3.27Å; V190-Q192 VanDerWaalsContact C-N 3.3Å; V190-Q192 PolarHBondContact O-N 3.17Å; Q192-V194 VanDerWaalsContact C-N 3.27Å; Q192-V194 PolarHBondContact O-N 2.75Å; Q192-T195 PolarHBondContact O-N 3.19Å; Q192-E196 VanDerWaalsContact CG-OE1 3.23Å; Q192-E196 WeakPolarHBondContact CG-OE1 3.37Å; Q192-E196 PolarHBondContact NE2-OE1 3.41Å; Q192-E196 WeakPolarHBondContact O-CB 3.41Å; Q192-E196 WeakPolarHBondContact O-CG 3.01Å; Q192-E196 PolarHBondContact O-N 3.28Å; Q192-V231 PolarHBondContact NE2-O 3.44Å
193	I	98.5	Very high	97.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.5	-35.8	-173.8	68.2	172.1	0	0	0	112.1	Y179 L185 E189 V190 E196 N197 L200 L230 V231 P234	Y179-I193 HydrophobicContact CD1-CD1 4.13Å; Y179-I193 HydrophobicContact CG-CD1 4.42Å; L185-I193 HydrophobicContact CD1-CD1 3.43Å; L185-I193 VanDerWaalsContact CD1-CD1 3.43Å; L185-I193 HydrophobicContact CD1-CG1 4.45Å; E189-I193 WeakPolarHBondContact O-CG2 3.32Å; E189-I193 PolarHBondContact O-N 3.06Å; V190-I193 WeakPolarHBondContact O-CG1 3.46Å; I193-E196 PolarHBondContact O-N 2.84Å; I193-N197 PolarHBondContact O-N 3.45Å; I193-L200 HydrophobicContact CB-CD1 4.17Å; I193-L200 HydrophobicContact CD1-CD1 4.24Å; I193-L200 HydrophobicContact CG1-CD1 4.25Å; I193-L230 HydrophobicContact CD1-CD1 4.12Å; I193-L230 HydrophobicContact CD1-CD2 3.81Å; I193-L230 HydrophobicContact CD1-CG 4Å; I193-L230 HydrophobicContact CG2-CG 4.27Å; I193-V231 HydrophobicContact CG2-CG2 4.36Å; I193-P234 HydrophobicContact CB-CB 4.19Å; I193-P234 HydrophobicContact CB-CG 3.88Å; I193-P234 HydrophobicContact CG2-CG 3.93Å
194	V	98.3	Very high	97.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-71.3	-40.9	178.8	173.1	0	0	0	0	110.7	F149 I157 W164 L176 V190 Q192 E196 N197 P198 I201	F149-V194 HydrophobicContact CE1-CB 4.1Å; F149-V194 HydrophobicContact CE1-CG1 3.95Å; F149-V194 HydrophobicContact CZ-CB 4.18Å; F149-V194 HydrophobicContact CZ-CG1 4.04Å; I157-V194 HydrophobicContact CD1-CG1 3.97Å; I157-V194 HydrophobicContact CG1-CG1 4.35Å; W164-V194 HydrophobicContact CH2-CG1 3.62Å; W164-V194 HydrophobicContact CZ3-CG1 3.85Å; L176-V194 HydrophobicContact CD2-CB 4.43Å; L176-V194 HydrophobicContact CD2-CG1 4.33Å; L176-V194 HydrophobicContact CD2-CG2 3.43Å; L176-V194 VanDerWaalsContact CD2-CG2 3.43Å; V190-V194 HydrophobicContact CG1-CG2 4.31Å; V190-V194 WeakPolarHBondContact O-CB 3.33Å; V190-V194 WeakPolarHBondContact O-CG2 3.49Å; V190-V194 PolarHBondContact O-N 3.17Å; V190-V194 VanDerWaalsContact O-N 3.15Å; Q192-V194 VanDerWaalsContact C-N 3.27Å; Q192-V194 PolarHBondContact O-N 2.75Å; V194-E196 VanDerWaalsContact C-N 3.31Å; V194-N197 CarbonylContact O-C 3.55Å; V194-P198 WeakPolarHBondContact O-CA 3.5Å; V194-P198 VanDerWaalsContact O-CB 3.23Å; V194-P198 WeakPolarHBondContact O-CB 3.35Å; V194-P198 WeakPolarHBondContact O-CD 3.21Å; V194-P198 WeakPolarHBondContact O-CG 3.26Å; V194-I201 HydrophobicContact CG1-CG1 4.25Å; V194-I201 HydrophobicContact CG2-CD1 4.16Å; V194-I201 HydrophobicContact CG2-CG1 4.08Å
195	T	98.4	Very high	97.1	Very high	14 Å²	14	32 Å²	32	9%	0.086	17%	0.172	C	C	.	.	H	α-helix	trans	-66.3	-37.9	175.8	-58.6	0	0	0	0	111.2	S153 R156 R191 Q192	S153-T195 WeakPolarHBondContact CB-OG1 3.37Å; R156-T195 WeakPolarHBondContact CD-O 3.46Å; R156-T195 HydrophobicContact CG-CG2 4.36Å; R156-T195 PolarHBondContact NE-O 3.17Å; R191-T195 VanDerWaalsContact O-CB 3.22Å; R191-T195 WeakPolarHBondContact O-CB 3.37Å; R191-T195 PolarHBondContact O-N 3.47Å; R191-T195 PolarHBondContact O-OG1 3.42Å; Q192-T195 PolarHBondContact O-N 3.19Å
196	E	98.1	Very high	97	Very high	62 Å²	62	33.4 Å²	33.4	29%	0.29	19%	0.188	S	C	.	.	H	α-helix	trans	-70.2	-49	-179	-77.6	-178.2	-158.7	0	0	112.6	K160 Q192 I193 V194 P234	K160-E196 PolarHBondContact NZ-O 2.82Å; Q192-E196 VanDerWaalsContact CG-OE1 3.23Å; Q192-E196 WeakPolarHBondContact CG-OE1 3.37Å; Q192-E196 PolarHBondContact NE2-OE1 3.41Å; Q192-E196 WeakPolarHBondContact O-CB 3.41Å; Q192-E196 WeakPolarHBondContact O-CG 3.01Å; Q192-E196 PolarHBondContact O-N 3.28Å; I193-E196 PolarHBondContact O-N 2.84Å; V194-E196 VanDerWaalsContact C-N 3.31Å; E196-P234 HydrophobicContact CB-CG 3.9Å; E196-P234 WeakPolarHBondContact OE2-CD 3.47Å; E196-P234 VanDerWaalsContact OE2-CG 3.3Å; E196-P234 WeakPolarHBondContact OE2-CG 3.32Å
197	N	97.8	Very high	96.9	Very high	17 Å²	17	32.4 Å²	32.4	9%	0.091	18%	0.177	C	C	.	.			trans	-135.8	78.7	179.2	-170.4	39.1	0	0	0	112.1	I193 V194 K199 L200 P234 T238	I193-N197 PolarHBondContact O-N 3.45Å; V194-N197 CarbonylContact O-C 3.55Å; N197-K199 PolarHBondContact O-N 3.39Å; N197-L200 HydrophobicContact CB-CG 4.39Å; N197-L200 WeakPolarHBondContact O-CB 2.99Å; N197-L200 VanDerWaalsContact O-CG 3.24Å; N197-L200 WeakPolarHBondContact O-CG 3.36Å; N197-L200 PolarHBondContact O-N 3.33Å; N197-P234 HydrophobicContact CB-CB 3.74Å; N197-P234 PolarHBondContact ND2-O 3.11Å; N197-T238 VanDerWaalsContact ND2-CG2 3.31Å; N197-T238 WeakPolarHBondContact ND2-CG2 3.43Å; N197-T238 PolarHBondContact ND2-OG1 2.93Å
198	P	97.9	Very high	96.8	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.006	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-11.5	-175.1	-5.7	13.8	0	0	0	114.1	I157 K160 A161 W164 V194 L200 I201 T202	I157-P198 HydrophobicContact CB-CB 4.3Å; I157-P198 HydrophobicContact CB-CG 4.17Å; I157-P198 HydrophobicContact CG1-CB 4.14Å; I157-P198 HydrophobicContact CG1-CG 3.94Å; I157-P198 HydrophobicContact CG2-CB 3.98Å; I157-P198 HydrophobicContact CG2-CG 4.37Å; K160-P198 HydrophobicContact CB-CG 3.93Å; A161-P198 HydrophobicContact CB-CB 3.75Å; A161-P198 HydrophobicContact CB-CG 4.34Å; W164-P198 HydrophobicContact CE3-CB 4.02Å; W164-P198 HydrophobicContact CZ3-CB 4Å; V194-P198 WeakPolarHBondContact O-CA 3.5Å; V194-P198 VanDerWaalsContact O-CB 3.23Å; V194-P198 WeakPolarHBondContact O-CB 3.35Å; V194-P198 WeakPolarHBondContact O-CD 3.21Å; V194-P198 WeakPolarHBondContact O-CG 3.26Å; P198-L200 PolarHBondContact O-N 3.21Å; P198-I201 PolarHBondContact O-N 3.24Å; P198-T202 PolarHBondContact O-N 3.05Å
199	K	96.4	Very high	96.8	Very high	88 Å²	88	30.1 Å²	30.1	38%	0.383	16%	0.155	S	C	.	.	H	α-helix	trans	-58.1	-23.8	171.2	-70.4	-175.7	178	-177	0	113.4	N197 I201 T202 F203 T238	N197-K199 PolarHBondContact O-N 3.39Å; K199-I201 PolarHBondContact O-N 3.32Å; K199-I201 VanDerWaalsContact O-N 3.17Å; K199-T202 WeakPolarHBondContact CA-OG1 3.26Å; K199-T202 PolarHBondContact O-N 3.18Å; K199-F203 HydrophobicContact CB-CD2 3.89Å; K199-F203 HydrophobicContact CB-CE2 3.9Å; K199-F203 HydrophobicContact CD-CE2 3.83Å; K199-F203 HydrophobicContact CD-CZ 4.26Å; K199-F203 HydrophobicContact CG-CE2 4.23Å; K199-F203 WeakPolarHBondContact O-CB 3.5Å; K199-F203 PolarHBondContact O-N 3.43Å; K199-T238 HydrophobicContact CB-CG2 4.16Å
200	L	97.1	Very high	96.7	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-52.1	-33.3	171	-71.1	177.5	0	0	0	112.9	Y179 I193 N197 P198 L230 P234 W237 T238	Y179-L200 HydrophobicContact CE1-CB 4.4Å; Y179-L200 HydrophobicContact CE1-CD1 4.4Å; Y179-L200 HydrophobicContact CE1-CD2 4.09Å; Y179-L200 HydrophobicContact CE2-CB 4.07Å; Y179-L200 VanDerWaalsContact CE2-O 3.32Å; Y179-L200 WeakPolarHBondContact CE2-O 3.47Å; Y179-L200 WeakPolarHBondContact OH-CB 3.42Å; Y179-L200 WeakPolarHBondContact OH-CD2 3.46Å; Y179-L200 PolarHBondContact OH-O 3.01Å; I193-L200 HydrophobicContact CB-CD1 4.17Å; I193-L200 HydrophobicContact CD1-CD1 4.24Å; I193-L200 HydrophobicContact CG1-CD1 4.25Å; N197-L200 HydrophobicContact CB-CG 4.39Å; N197-L200 WeakPolarHBondContact O-CB 2.99Å; N197-L200 VanDerWaalsContact O-CG 3.24Å; N197-L200 WeakPolarHBondContact O-CG 3.36Å; N197-L200 PolarHBondContact O-N 3.33Å; P198-L200 PolarHBondContact O-N 3.21Å; L200-L230 HydrophobicContact CD1-CD1 4.15Å; L200-P234 HydrophobicContact CD1-CB 3.99Å; L200-W237 HydrophobicContact CD2-CB 3.59Å; L200-T238 HydrophobicContact CD2-CG2 4.03Å
201	I	97.2	Very high	96.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-91.3	-42.4	179.8	-54.1	-54.7	0	0	0	110.2	W164 I172 R175 L176 Y179 V194 P198 K199 F203 G204	W164-I201 HydrophobicContact CE3-CB 4.12Å; W164-I201 HydrophobicContact CE3-CG2 4.33Å; W164-I201 HydrophobicContact CH2-CB 3.82Å; W164-I201 HydrophobicContact CH2-CG1 3.67Å; W164-I201 HydrophobicContact CH2-CG2 3.79Å; W164-I201 HydrophobicContact CZ2-CG2 4.5Å; W164-I201 HydrophobicContact CZ3-CB 3.36Å; W164-I201 HydrophobicContact CZ3-CG1 3.51Å; W164-I201 HydrophobicContact CZ3-CG2 3.72Å; I172-I201 HydrophobicContact CG1-CG2 4.46Å; I172-I201 HydrophobicContact CG2-CG2 4.43Å; R175-I201 HydrophobicContact CB-CD1 4.07Å; R175-I201 HydrophobicContact CB-CG2 4.13Å; R175-I201 WeakPolarHBondContact CD-O 3.49Å; R175-I201 PolarHBondContact NH1-O 3.03Å; L176-I201 HydrophobicContact CD2-CD1 3.74Å; L176-I201 HydrophobicContact CD2-CG1 4.11Å; L176-I201 HydrophobicContact CG-CD1 4.26Å; Y179-I201 HydrophobicContact CD2-CD1 3.87Å; Y179-I201 HydrophobicContact CE2-CD1 3.93Å; V194-I201 HydrophobicContact CG1-CG1 4.25Å; V194-I201 HydrophobicContact CG2-CD1 4.16Å; V194-I201 HydrophobicContact CG2-CG1 4.08Å; P198-I201 PolarHBondContact O-N 3.24Å; K199-I201 PolarHBondContact O-N 3.32Å; K199-I201 VanDerWaalsContact O-N 3.17Å; I201-F203 PolarHBondContact O-N 3.1Å; I201-G204 PolarHBondContact O-N 2.98Å
202	T	94.7	Very high	96.6	Very high	10 Å²	10	30.8 Å²	30.8	6%	0.061	17%	0.165	C	C	.	.	H	α-helix	trans	-73.6	-23	-174.7	60.3	0	0	0	0	114.4	A161 W164 F167 P198 K199 G204	A161-T202 HydrophobicContact CB-CG2 3.88Å; W164-T202 HydrophobicContact CB-CG2 4.16Å; W164-T202 HydrophobicContact CE3-CG2 4.12Å; F167-T202 HydrophobicContact CD2-CG2 4.07Å; F167-T202 HydrophobicContact CE2-CG2 3.75Å; F167-T202 VanDerWaalsContact CZ-O 3.29Å; F167-T202 WeakPolarHBondContact CZ-O 3.45Å; P198-T202 PolarHBondContact O-N 3.05Å; K199-T202 WeakPolarHBondContact CA-OG1 3.26Å; K199-T202 PolarHBondContact O-N 3.18Å; T202-G204 VanDerWaalsContact C-N 3.32Å
203	F	91.3	Very high	96.5	Very high	51 Å²	51	33 Å²	33	22%	0.224	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-2	174.6	-71.5	-41.1	0	0	0	114.2	V28 K199 I201 T238	V28-F203 HydrophobicContact CG2-CD1 4.14Å; V28-F203 HydrophobicContact CG2-CE1 4.06Å; K199-F203 HydrophobicContact CB-CD2 3.89Å; K199-F203 HydrophobicContact CB-CE2 3.9Å; K199-F203 HydrophobicContact CD-CE2 3.83Å; K199-F203 HydrophobicContact CD-CZ 4.26Å; K199-F203 HydrophobicContact CG-CE2 4.23Å; K199-F203 WeakPolarHBondContact O-CB 3.5Å; K199-F203 PolarHBondContact O-N 3.43Å; I201-F203 PolarHBondContact O-N 3.1Å; F203-T238 HydrophobicContact CD2-CG2 4.04Å; F203-T238 HydrophobicContact CE2-CG2 4.47Å
204	G	90.6	Very high	96.5	Very high	14 Å²	14	33 Å²	33	14%	0.144	17%	0.173	C	C	.	.			trans	74.4	-175.2	-172.3	0	0	0	0	0	112.7	I201 T202	I201-G204 PolarHBondContact O-N 2.98Å; T202-G204 VanDerWaalsContact C-N 3.32Å
205	T	95.4	Very high	96.5	Very high	32 Å²	32	33 Å²	33	20%	0.196	17%	0.173	C	C	.	.	S	Bend	trans	-103.6	-13.6	-171	54	0	0	0	0	113.8	R175 W178 Y179 T208 Q209	R175-T205 HydrophobicContact CB-CG2 4.34Å; R175-T205 HydrophobicContact CG-CG2 4.16Å; W178-T205 HydrophobicContact CB-CG2 4.17Å; W178-T205 HydrophobicContact CD2-CG2 3.51Å; W178-T205 HydrophobicContact CE3-CG2 3.31Å; W178-T205 HydrophobicContact CG-CG2 3.88Å; W178-T205 HydrophobicContact CZ3-CG2 3.97Å; Y179-T205 HydrophobicContact CE2-CG2 4.23Å; T205-T208 WeakPolarHBondContact O-CB 3.43Å; T205-T208 PolarHBondContact O-N 3.02Å; T205-Q209 WeakPolarHBondContact O-CG 3.35Å; T205-Q209 PolarHBondContact O-N 3.4Å
206	G	96.1	Very high	96.4	Very high	38 Å²	38	37.7 Å²	37.7	39%	0.392	19%	0.192	S	C	.	.	H	α-helix	trans	-61.2	-47.7	-176	0	0	0	0	0	113.3	T208 Q209 T210	G206-T208 VanDerWaalsContact C-N 3.32Å; G206-T208 PolarHBondContact O-N 2.94Å; G206-Q209 WeakPolarHBondContact O-CB 3.36Å; G206-Q209 PolarHBondContact O-N 2.91Å; G206-Q209 VanDerWaalsContact O-N 3.14Å; G206-T210 PolarHBondContact O-N 3.22Å; G206-T210 VanDerWaalsContact O-N 3.11Å; G206-T210 PolarHBondContact O-OG1 3.41Å
207	Y	95.9	Very high	96.4	Very high	30 Å²	30	39.7 Å²	39.7	12%	0.118	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-39.2	177.7	-173	-107.7	0	0	0	112.4	L25 P26 Q209 T210 L211 T239 Y240 K241	L25-Y207 HydrophobicContact CD2-CD1 4.49Å; L25-Y207 HydrophobicContact CD2-CE1 4.05Å; P26-Y207 HydrophobicContact CG-CD2 4.37Å; P26-Y207 HydrophobicContact CG-CG 4.14Å; Y207-Q209 VanDerWaalsContact C-N 3.29Å; Y207-Q209 PolarHBondContact O-N 2.68Å; Y207-T210 WeakPolarHBondContact O-CB 3.1Å; Y207-T210 PolarHBondContact O-N 2.89Å; Y207-L211 HydrophobicContact CD1-CD1 4Å; Y207-L211 HydrophobicContact CD1-CG 4.27Å; Y207-L211 HydrophobicContact CE1-CD1 3.49Å; Y207-L211 VanDerWaalsContact CE1-CD1 3.49Å; Y207-L211 HydrophobicContact CE1-CD2 4.29Å; Y207-L211 HydrophobicContact CE1-CG 3.9Å; Y207-L211 PolarHBondContact O-N 2.96Å; Y207-T239 WeakPolarHBondContact CE1-O 3.47Å; Y207-T239 PolarHBondContact OH-O 3.01Å; Y207-Y240 VanDerWaalsContact OH-CA 3.25Å; Y207-Y240 WeakPolarHBondContact OH-CA 3.48Å; Y207-K241 PolarHBondContact OH-N 3.35Å
208	T	96.9	Very high	96.4	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.018	22%	0.218	C	C	.	.	H	α-helix	trans	-61.5	-37.7	174.5	-52.2	0	0	0	0	111.6	W178 Y179 F183 T205 G206 L211 Q212 W237	W178-T208 HydrophobicContact CH2-CG2 3.78Å; W178-T208 HydrophobicContact CZ3-CG2 3.82Å; Y179-T208 HydrophobicContact CE1-CG2 3.61Å; Y179-T208 PolarHBondContact OH-OG1 3.28Å; F183-T208 HydrophobicContact CE2-CG2 4.15Å; F183-T208 HydrophobicContact CZ-CG2 4.2Å; T205-T208 WeakPolarHBondContact O-CB 3.43Å; T205-T208 PolarHBondContact O-N 3.02Å; G206-T208 VanDerWaalsContact C-N 3.32Å; G206-T208 PolarHBondContact O-N 2.94Å; T208-L211 PolarHBondContact O-N 3.44Å; T208-Q212 WeakPolarHBondContact O-CB 3.34Å; T208-Q212 PolarHBondContact O-N 3.34Å; T208-W237 HydrophobicContact CG2-CB 4.43Å; T208-W237 HydrophobicContact CG2-CD2 4.21Å; T208-W237 HydrophobicContact CG2-CE3 3.45Å; T208-W237 VanDerWaalsContact CG2-CE3 3.45Å; T208-W237 HydrophobicContact CG2-CZ3 4.05Å
209	Q	97	Very high	96.4	Very high	88 Å²	88	43.7 Å²	43.7	41%	0.411	22%	0.22	S	C	.	.	H	α-helix	trans	-62.9	-43	173.8	-71	165.7	11.4	0	0	111.8	W178 T205 G206 Y207 L211 Q212 F213	W178-Q209 HydrophobicContact CH2-CG 3.93Å; W178-Q209 HydrophobicContact CZ2-CG 3.29Å; W178-Q209 VanDerWaalsContact NE1-NE2 3.19Å; T205-Q209 WeakPolarHBondContact O-CG 3.35Å; T205-Q209 PolarHBondContact O-N 3.4Å; G206-Q209 WeakPolarHBondContact O-CB 3.36Å; G206-Q209 PolarHBondContact O-N 2.91Å; G206-Q209 VanDerWaalsContact O-N 3.14Å; Y207-Q209 VanDerWaalsContact C-N 3.29Å; Y207-Q209 PolarHBondContact O-N 2.68Å; Q209-L211 VanDerWaalsContact C-N 3.33Å; Q209-L211 PolarHBondContact O-N 2.89Å; Q209-Q212 WeakPolarHBondContact O-CB 3.21Å; Q209-Q212 PolarHBondContact O-N 2.89Å; Q209-F213 PolarHBondContact O-N 2.8Å
210	T	97.2	Very high	96.5	Very high	71 Å²	71	41.8 Å²	41.8	44%	0.436	23%	0.225	S	C	.	.	H	α-helix	trans	-59.1	-45.1	174.4	-54.7	0	0	0	0	111.5	G206 Y207 Q212 F213 M214	G206-T210 PolarHBondContact O-N 3.22Å; G206-T210 VanDerWaalsContact O-N 3.11Å; G206-T210 PolarHBondContact O-OG1 3.41Å; Y207-T210 WeakPolarHBondContact O-CB 3.1Å; Y207-T210 PolarHBondContact O-N 2.89Å; T210-Q212 VanDerWaalsContact C-N 3.33Å; T210-F213 PolarHBondContact O-N 3.46Å; T210-M214 PolarHBondContact O-N 2.91Å
211	L	97.8	Very high	96.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67	-35.6	176.2	-65.4	-173.9	0	0	0	112.2	Y207 T208 Q209 F213 M214 F215 W237 K241 L244	Y207-L211 HydrophobicContact CD1-CD1 4Å; Y207-L211 HydrophobicContact CD1-CG 4.27Å; Y207-L211 HydrophobicContact CE1-CD1 3.49Å; Y207-L211 VanDerWaalsContact CE1-CD1 3.49Å; Y207-L211 HydrophobicContact CE1-CD2 4.29Å; Y207-L211 HydrophobicContact CE1-CG 3.9Å; Y207-L211 PolarHBondContact O-N 2.96Å; T208-L211 PolarHBondContact O-N 3.44Å; Q209-L211 VanDerWaalsContact C-N 3.33Å; Q209-L211 PolarHBondContact O-N 2.89Å; L211-F213 VanDerWaalsContact C-N 3.35Å; L211-M214 HydrophobicContact CD2-CE 3.65Å; L211-M214 PolarHBondContact O-N 2.95Å; L211-F215 HydrophobicContact CB-CD2 4.41Å; L211-F215 HydrophobicContact CB-CE2 4.49Å; L211-F215 WeakPolarHBondContact O-CB 3.09Å; L211-F215 WeakPolarHBondContact O-CD2 3.4Å; L211-F215 PolarHBondContact O-N 3.01Å; L211-W237 HydrophobicContact CB-CE3 3.91Å; L211-W237 HydrophobicContact CB-CZ3 4.07Å; L211-K241 HydrophobicContact CD2-CB 4.04Å; L211-K241 HydrophobicContact CD2-CG 4.34Å; L211-L244 HydrophobicContact CD1-CD1 4.16Å; L211-L244 HydrophobicContact CD2-CD1 3.96Å
212	Q	96.7	Very high	96.6	Very high	50 Å²	50	44.5 Å²	44.5	23%	0.234	24%	0.244	C	C	.	.	H	α-helix	trans	-63	-45.1	178.1	-172.3	-178.4	5.9	0	0	110.8	F183 T208 Q209 T210 K216 W237	F183-Q212 HydrophobicContact CZ-CG 4.33Å; T208-Q212 WeakPolarHBondContact O-CB 3.34Å; T208-Q212 PolarHBondContact O-N 3.34Å; Q209-Q212 WeakPolarHBondContact O-CB 3.21Å; Q209-Q212 PolarHBondContact O-N 2.89Å; T210-Q212 VanDerWaalsContact C-N 3.33Å; Q212-K216 WeakPolarHBondContact O-CB 3.23Å; Q212-K216 PolarHBondContact O-N 3.33Å; Q212-K216 VanDerWaalsContact O-N 3.14Å; Q212-W237 HydrophobicContact CB-CH2 4.17Å; Q212-W237 HydrophobicContact CB-CZ3 3.77Å; Q212-W237 HydrophobicContact CG-CH2 4.43Å; Q212-W237 HydrophobicContact CG-CZ3 4.46Å
213	F	97.2	Very high	96.7	Very high	124 Å²	124	47.7 Å²	47.7	54%	0.544	27%	0.272	S	S	.	.	H	α-helix	trans	-60.2	-48.7	173.8	-179.2	-88.4	0	0	0	110.9	Q209 T210 L211 F215 K216 E217	Q209-F213 PolarHBondContact O-N 2.8Å; T210-F213 PolarHBondContact O-N 3.46Å; L211-F213 VanDerWaalsContact C-N 3.35Å; F213-F215 PolarHBondContact O-N 3.01Å; F213-K216 PolarHBondContact O-N 3.47Å; F213-E217 HydrophobicContact CD1-CB 4.41Å; F213-E217 HydrophobicContact CD1-CG 4.44Å; F213-E217 HydrophobicContact CD2-CG 3.73Å; F213-E217 HydrophobicContact CE1-CB 4.07Å; F213-E217 HydrophobicContact CE1-CG 4.28Å; F213-E217 HydrophobicContact CE2-CB 4.22Å; F213-E217 HydrophobicContact CE2-CG 3.56Å; F213-E217 HydrophobicContact CG-CG 4.18Å; F213-E217 HydrophobicContact CZ-CB 3.97Å; F213-E217 HydrophobicContact CZ-CG 3.84Å; F213-E217 WeakPolarHBondContact O-CB 3.23Å; F213-E217 PolarHBondContact O-N 3.17Å
214	M	98.1	Very high	97	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.285	C	S	.	.	I	π-helix	trans	-59.5	-49.1	178.5	171.9	-86.1	-73	0	0	112.2	T210 L211 K216 E218 L219 K241 L244	T210-M214 PolarHBondContact O-N 2.91Å; L211-M214 HydrophobicContact CD2-CE 3.65Å; L211-M214 PolarHBondContact O-N 2.95Å; M214-K216 PolarHBondContact O-N 3.27Å; M214-E218 HydrophobicContact CG-CB 4.23Å; M214-E218 HydrophobicContact CG-CG 4.49Å; M214-E218 VanDerWaalsContact CG-OE2 3.28Å; M214-E218 WeakPolarHBondContact CG-OE2 3.43Å; M214-E218 WeakPolarHBondContact O-CA 3.43Å; M214-E218 VanDerWaalsContact O-CB 3.31Å; M214-E218 WeakPolarHBondContact O-CB 3.49Å; M214-E218 PolarHBondContact O-N 3.32Å; M214-L219 HydrophobicContact CE-CD1 4.45Å; M214-L219 HydrophobicContact CG-CG 4.33Å; M214-L219 PolarHBondContact O-N 3.05Å; M214-L219 HydrophobicContact SD-CD1 3.22Å; M214-L219 WeakPolarHBondContact SD-CD1 3.47Å; M214-L219 HydrophobicContact SD-CD2 4.15Å; M214-L219 HydrophobicContact SD-CG 3.45Å; M214-L219 WeakPolarHBondContact SD-CG 3.44Å; M214-K241 HydrophobicContact CE-CG 4.26Å; M214-K241 HydrophobicContact CG-CG 4.29Å; M214-L244 HydrophobicContact CE-CB 3.91Å; M214-L244 HydrophobicContact CE-CD1 3.79Å
215	F	98.3	Very high	97.4	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.287	C	S	.	.	I	π-helix	trans	-58.7	-38.2	179.2	-86.2	-64.9	0	0	0	112.1	L211 F213 L219 G220 F221 L229 W237 L244 L269	L211-F215 HydrophobicContact CB-CD2 4.41Å; L211-F215 HydrophobicContact CB-CE2 4.49Å; L211-F215 WeakPolarHBondContact O-CB 3.09Å; L211-F215 WeakPolarHBondContact O-CD2 3.4Å; L211-F215 PolarHBondContact O-N 3.01Å; F213-F215 PolarHBondContact O-N 3.01Å; F215-L219 HydrophobicContact CD1-CD1 3.83Å; F215-L219 HydrophobicContact CE1-CD1 3.98Å; F215-L219 CarbonylContact O-C 3.59Å; F215-G220 PolarHBondContact O-N 3.21Å; F215-F221 HydrophobicContact CB-CD2 4.45Å; F215-F221 AromaticContact CD1-CD2 3.67Å; F215-F221 HydrophobicContact CD1-CD2 3.67Å; F215-F221 AromaticContact CD1-CE2 3.86Å; F215-F221 HydrophobicContact CD1-CE2 3.86Å; F215-F221 HydrophobicContact CD1-CG 4.44Å; F215-F221 HydrophobicContact CE1-CD2 4.49Å; F215-F221 HydrophobicContact CE1-CE2 4.25Å; F215-F221 WeakPolarHBondContact O-CB 3.5Å; F215-F221 WeakPolarHBondContact O-CD2 3.48Å; F215-F221 PolarHBondContact O-N 3.47Å; F215-L229 HydrophobicContact CD1-CD1 3.72Å; F215-L229 HydrophobicContact CE1-CD1 3.74Å; F215-L229 HydrophobicContact CG-CD1 4.37Å; F215-L229 HydrophobicContact CZ-CD1 4.38Å; F215-W237 AromaticContact CD2-CH2 3.91Å; F215-W237 HydrophobicContact CD2-CH2 3.91Å; F215-W237 HydrophobicContact CD2-CZ2 4.15Å; F215-W237 HydrophobicContact CD2-CZ3 4.22Å; F215-W237 HydrophobicContact CE2-CZ2 4.48Å; F215-L244 HydrophobicContact CE2-CD1 4.16Å; F215-L244 HydrophobicContact CZ-CD1 4.08Å; F215-L244 HydrophobicContact CZ-CD2 4.49Å; F215-L269 HydrophobicContact CE1-CD1 3.87Å; F215-L269 HydrophobicContact CZ-CD1 4.32Å
216	K	97.6	Very high	97.5	Very high	111 Å²	111	49.7 Å²	49.7	48%	0.483	28%	0.279	S	S	.	.	I	π-helix	trans	-80.5	-57.4	-177.8	-175.1	176.2	174	-111.3	0	112.8	Q212 F213 M214 G220 F221	Q212-K216 WeakPolarHBondContact O-CB 3.23Å; Q212-K216 PolarHBondContact O-N 3.33Å; Q212-K216 VanDerWaalsContact O-N 3.14Å; F213-K216 PolarHBondContact O-N 3.47Å; M214-K216 PolarHBondContact O-N 3.27Å; K216-G220 WeakPolarHBondContact O-CA 3.27Å; K216-G220 PolarHBondContact O-N 3.41Å; K216-F221 WeakPolarHBondContact CA-O 3.42Å
217	E	97	Very high	97.6	Very high	105 Å²	105	49.9 Å²	49.9	49%	0.491	27%	0.269	S	S	.	.	I	π-helix	trans	-87.4	-33.8	-168.3	-52.8	-58.8	150.8	0	0	112.5	F213	F213-E217 HydrophobicContact CD1-CB 4.41Å; F213-E217 HydrophobicContact CD1-CG 4.44Å; F213-E217 HydrophobicContact CD2-CG 3.73Å; F213-E217 HydrophobicContact CE1-CB 4.07Å; F213-E217 HydrophobicContact CE1-CG 4.28Å; F213-E217 HydrophobicContact CE2-CB 4.22Å; F213-E217 HydrophobicContact CE2-CG 3.56Å; F213-E217 HydrophobicContact CG-CG 4.18Å; F213-E217 HydrophobicContact CZ-CB 3.97Å; F213-E217 HydrophobicContact CZ-CG 3.84Å; F213-E217 WeakPolarHBondContact O-CB 3.23Å; F213-E217 PolarHBondContact O-N 3.17Å
218	E	97.3	Very high	97.7	Very high	93 Å²	93	51.2 Å²	51.2	44%	0.435	28%	0.277	S	S	.	.	I	π-helix	trans	-94	-40.4	-178.4	-57.5	173.7	-160.7	0	0	111.8	M214 K241	M214-E218 HydrophobicContact CG-CB 4.23Å; M214-E218 HydrophobicContact CG-CG 4.49Å; M214-E218 VanDerWaalsContact CG-OE2 3.28Å; M214-E218 WeakPolarHBondContact CG-OE2 3.43Å; M214-E218 WeakPolarHBondContact O-CA 3.43Å; M214-E218 VanDerWaalsContact O-CB 3.31Å; M214-E218 WeakPolarHBondContact O-CB 3.49Å; M214-E218 PolarHBondContact O-N 3.32Å; E218-K241 IonicContact OE1-NZ 3.03Å; E218-K241 PolarHBondContact OE1-NZ 3.1Å; E218-K241 VanDerWaalsContact OE2-CE 3.23Å; E218-K241 WeakPolarHBondContact OE2-CE 3.35Å; E218-K241 IonicContact OE2-NZ 2.67Å; E218-K241 PolarHBondContact OE2-NZ 3.18Å
219	L	98.1	Very high	97.8	Very high	8 Å²	8	51 Å²	51	4%	0.042	28%	0.276	C	S	.	.	S	Bend	trans	-101.5	-4.9	-176.5	-48.9	-170.2	0	0	0	114	M214 F215 F221 F248 H259	M214-L219 HydrophobicContact CE-CD1 4.45Å; M214-L219 HydrophobicContact CG-CG 4.33Å; M214-L219 PolarHBondContact O-N 3.05Å; M214-L219 HydrophobicContact SD-CD1 3.22Å; M214-L219 WeakPolarHBondContact SD-CD1 3.47Å; M214-L219 HydrophobicContact SD-CD2 4.15Å; M214-L219 HydrophobicContact SD-CG 3.45Å; M214-L219 WeakPolarHBondContact SD-CG 3.44Å; F215-L219 HydrophobicContact CD1-CD1 3.83Å; F215-L219 HydrophobicContact CE1-CD1 3.98Å; F215-L219 CarbonylContact O-C 3.59Å; L219-F221 HydrophobicContact CB-CD2 3.8Å; L219-F221 HydrophobicContact CB-CE2 3.9Å; L219-F221 HydrophobicContact CD1-CE2 4.27Å; L219-F221 PolarHBondContact O-N 3.32Å; L219-F248 HydrophobicContact CB-CD1 4.08Å; L219-F248 HydrophobicContact CB-CD2 4.26Å; L219-F248 HydrophobicContact CB-CE1 3.94Å; L219-F248 HydrophobicContact CB-CE2 4.15Å; L219-F248 HydrophobicContact CB-CG 4.22Å; L219-F248 HydrophobicContact CB-CZ 3.98Å; L219-F248 HydrophobicContact CD1-CB 3.86Å; L219-F248 HydrophobicContact CD1-CD1 4.24Å; L219-F248 HydrophobicContact CD1-CD2 4.05Å; L219-F248 HydrophobicContact CD1-CG 3.78Å; L219-F248 HydrophobicContact CD2-CB 4.2Å; L219-F248 HydrophobicContact CD2-CD1 3.55Å; L219-F248 HydrophobicContact CD2-CE1 4.08Å; L219-F248 HydrophobicContact CD2-CG 3.93Å; L219-F248 HydrophobicContact CG-CD1 4.14Å; L219-F248 HydrophobicContact CG-CE1 4.47Å; L219-F248 HydrophobicContact CG-CG 4.18Å; L219-F248 WeakPolarHBondContact O-CZ 3.4Å; L219-H259 PolarHBondContact O-NE2 3.31Å
220	G	98	Very high	97.9	Very high	48 Å²	48	46.9 Å²	46.9	50%	0.495	26%	0.256	S	S	.	.			trans	72.1	19.4	172.6	0	0	0	0	0	116	F215 K216	F215-G220 PolarHBondContact O-N 3.21Å; K216-G220 WeakPolarHBondContact O-CA 3.27Å; K216-G220 PolarHBondContact O-N 3.41Å
221	F	98.5	Very high	97.9	Very high	3 Å²	3	44.5 Å²	44.5	1%	0.013	24%	0.242	C	C	.	.			trans	-74.2	138.2	172.5	-70.7	-89	0	0	0	111.1	F215 K216 L219 Q225 L229 F248 H259 I262 L263	F215-F221 HydrophobicContact CB-CD2 4.45Å; F215-F221 AromaticContact CD1-CD2 3.67Å; F215-F221 HydrophobicContact CD1-CD2 3.67Å; F215-F221 AromaticContact CD1-CE2 3.86Å; F215-F221 HydrophobicContact CD1-CE2 3.86Å; F215-F221 HydrophobicContact CD1-CG 4.44Å; F215-F221 HydrophobicContact CE1-CD2 4.49Å; F215-F221 HydrophobicContact CE1-CE2 4.25Å; F215-F221 WeakPolarHBondContact O-CB 3.5Å; F215-F221 WeakPolarHBondContact O-CD2 3.48Å; F215-F221 PolarHBondContact O-N 3.47Å; K216-F221 WeakPolarHBondContact CA-O 3.42Å; L219-F221 HydrophobicContact CB-CD2 3.8Å; L219-F221 HydrophobicContact CB-CE2 3.9Å; L219-F221 HydrophobicContact CD1-CE2 4.27Å; L219-F221 PolarHBondContact O-N 3.32Å; F221-Q225 HydrophobicContact CB-CB 4.23Å; F221-Q225 HydrophobicContact CD1-CB 3.91Å; F221-L229 HydrophobicContact CD1-CD1 3.84Å; F221-L229 HydrophobicContact CD2-CD1 4.28Å; F221-L229 HydrophobicContact CE1-CD1 3.9Å; F221-L229 HydrophobicContact CE2-CD1 4.32Å; F221-L229 HydrophobicContact CG-CD1 4.03Å; F221-L229 HydrophobicContact CZ-CD1 4.14Å; F221-F248 HydrophobicContact CD2-CE2 4.37Å; F221-F248 AromaticContact CE2-CD2 3.65Å; F221-F248 HydrophobicContact CE2-CD2 3.65Å; F221-F248 AromaticContact CE2-CE2 3.36Å; F221-F248 HydrophobicContact CE2-CE2 3.36Å; F221-F248 HydrophobicContact CE2-CZ 4.29Å; F221-F248 AromaticContact CZ-CD2 3.95Å; F221-F248 HydrophobicContact CZ-CD2 3.95Å; F221-F248 AromaticContact CZ-CE2 3.62Å; F221-F248 HydrophobicContact CZ-CE2 3.62Å; F221-H259 HydrophobicContact CD1-CB 4.24Å; F221-H259 AromaticContact CD1-CD2 3.59Å; F221-H259 AromaticContact CD2-CD2 3.96Å; F221-H259 HydrophobicContact CE1-CB 3.98Å; F221-H259 AromaticContact CE1-CD2 3.63Å; F221-H259 AromaticContact CG-CD2 3.77Å; F221-H259 AromaticContact CZ-CD2 3.85Å; F221-I262 HydrophobicContact CZ-CG2 4.06Å; F221-L263 HydrophobicContact CE1-CG 4.43Å
222	S	98	Very high	98	Very high	56 Å²	56	49.6 Å²	49.6	39%	0.392	26%	0.264	S	S	.	.			trans	-69.5	164	171	85.1	0	0	0	0	111.6	D224 Q225 A226	S222-D224 PolarHBondContact O-N 3.24Å; S222-D224 PolarHBondContact OG-N 2.79Å; S222-Q225 PolarHBondContact O-N 2.73Å; S222-Q225 WeakPolarHBondContact OG-CG 3.08Å; S222-Q225 PolarHBondContact OG-N 3.42Å; S222-A226 WeakPolarHBondContact O-CB 3.39Å; S222-A226 PolarHBondContact O-N 3.44Å
223	A	97.4	Very high	98	Very high	77 Å²	77	48.1 Å²	48.1	64%	0.636	26%	0.257	S	S	*	.	H	α-helix	trans	-59.7	-35.9	176.1	0	0	0	0	0	112.7	K227	A223-K227 PolarHBondContact O-N 3.15Å
224	D	98	Very high	98.1	Very high	93 Å²	93	42.3 Å²	42.3	50%	0.497	23%	0.232	S	C	.	.	H	α-helix	trans	-67.7	-44.2	175.4	-177.8	74.7	0	0	0	111.3	S222 A226 K227 Q228	S222-D224 PolarHBondContact O-N 3.24Å; S222-D224 PolarHBondContact OG-N 2.79Å; D224-A226 VanDerWaalsContact C-N 3.33Å; D224-A226 PolarHBondContact O-N 3.02Å; D224-K227 WeakPolarHBondContact O-CB 3.36Å; D224-K227 PolarHBondContact O-N 2.78Å; D224-Q228 WeakPolarHBondContact O-CG 3.42Å; D224-Q228 PolarHBondContact O-N 3.1Å; D224-Q228 PolarHBondContact OD2-NE2 2.93Å
225	Q	98.3	Very high	98	Very high	40 Å²	40	47.7 Å²	47.7	19%	0.187	26%	0.256	C	S	.	.	H	α-helix	trans	-64.9	-37.8	176.9	-66	176	-37.5	0	0	111.8	F221 S222 K227 Q228 L229 L263	F221-Q225 HydrophobicContact CB-CB 4.23Å; F221-Q225 HydrophobicContact CD1-CB 3.91Å; S222-Q225 PolarHBondContact O-N 2.73Å; S222-Q225 WeakPolarHBondContact OG-CG 3.08Å; S222-Q225 PolarHBondContact OG-N 3.42Å; Q225-K227 VanDerWaalsContact C-N 3.34Å; Q225-K227 PolarHBondContact O-N 2.94Å; Q225-Q228 WeakPolarHBondContact O-CB 3.34Å; Q225-Q228 PolarHBondContact O-N 2.8Å; Q225-Q228 VanDerWaalsContact O-N 3.16Å; Q225-L229 WeakPolarHBondContact O-CG 3.42Å; Q225-L229 PolarHBondContact O-N 3.39Å; Q225-L263 HydrophobicContact CB-CD1 3.85Å; Q225-L263 HydrophobicContact CB-CD2 4.42Å; Q225-L263 HydrophobicContact CG-CD1 3.56Å
226	A	98.2	Very high	98	Very high	5 Å²	5	47.7 Å²	47.7	4%	0.041	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-40.2	173.7	0	0	0	0	0	112	S222 D224 L229 L230 W237	S222-A226 WeakPolarHBondContact O-CB 3.39Å; S222-A226 PolarHBondContact O-N 3.44Å; D224-A226 VanDerWaalsContact C-N 3.33Å; D224-A226 PolarHBondContact O-N 3.02Å; A226-L229 PolarHBondContact O-N 3.3Å; A226-L230 PolarHBondContact O-N 3.27Å; A226-W237 HydrophobicContact CB-CH2 4.46Å; A226-W237 HydrophobicContact CB-CZ2 4.43Å
227	K	98.3	Very high	98	Very high	43 Å²	43	42.4 Å²	42.4	19%	0.187	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-48.6	169.9	174.2	-174.3	176	163.5	0	110.7	F183 K184 L185 E189 A223 D224 Q225 L229 L230 V231	F183-K227 WeakPolarHBondContact O-CD 3.1Å; F183-K227 WeakPolarHBondContact O-CG 3.42Å; K184-K227 PolarHBondContact O-NZ 2.81Å; L185-K227 HydrophobicContact CD2-CD 4.32Å; L185-K227 HydrophobicContact CD2-CG 3.91Å; E189-K227 VanDerWaalsContact CD-CE 3.48Å; E189-K227 WeakPolarHBondContact OE1-CE 3.14Å; E189-K227 IonicContact OE1-NZ 2.8Å; E189-K227 PolarHBondContact OE1-NZ 3.29Å; E189-K227 VanDerWaalsContact OE1-NZ 3.1Å; E189-K227 VanDerWaalsContact OE2-CE 3.27Å; E189-K227 WeakPolarHBondContact OE2-CE 3.36Å; E189-K227 IonicContact OE2-NZ 3.09Å; E189-K227 PolarHBondContact OE2-NZ 3.17Å; A223-K227 PolarHBondContact O-N 3.15Å; D224-K227 WeakPolarHBondContact O-CB 3.36Å; D224-K227 PolarHBondContact O-N 2.78Å; Q225-K227 VanDerWaalsContact C-N 3.34Å; Q225-K227 PolarHBondContact O-N 2.94Å; K227-L229 VanDerWaalsContact C-N 3.33Å; K227-L229 PolarHBondContact O-N 3.3Å; K227-L230 WeakPolarHBondContact O-CB 3.27Å; K227-L230 PolarHBondContact O-N 2.71Å; K227-L230 VanDerWaalsContact O-N 3.13Å; K227-V231 HydrophobicContact CG-CG2 4.35Å; K227-V231 WeakPolarHBondContact O-CG2 3Å; K227-V231 PolarHBondContact O-N 3Å
228	Q	98.4	Very high	98	Very high	57 Å²	57	38.3 Å²	38.3	27%	0.266	22%	0.215	S	C	.	.	H	α-helix	trans	-60.5	-40.9	179.1	-68.5	-174.4	50.6	0	0	112.4	D224 Q225 L230 V231 K232 L263	D224-Q228 WeakPolarHBondContact O-CG 3.42Å; D224-Q228 PolarHBondContact O-N 3.1Å; D224-Q228 PolarHBondContact OD2-NE2 2.93Å; Q225-Q228 WeakPolarHBondContact O-CB 3.34Å; Q225-Q228 PolarHBondContact O-N 2.8Å; Q225-Q228 VanDerWaalsContact O-N 3.16Å; Q228-L230 VanDerWaalsContact C-N 3.35Å; Q228-V231 PolarHBondContact O-N 3.43Å; Q228-K232 VanDerWaalsContact O-CB 3.23Å; Q228-K232 WeakPolarHBondContact O-CB 3.29Å; Q228-K232 WeakPolarHBondContact O-CG 3.39Å; Q228-K232 PolarHBondContact O-N 3.45Å; Q228-L263 HydrophobicContact CB-CD2 3.82Å
229	L	98.5	Very high	98	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.9	-44.5	173.6	-71	173.5	0	0	0	111.4	F215 F221 Q225 A226 K227 D233 L236 L263 P266 L269	F215-L229 HydrophobicContact CD1-CD1 3.72Å; F215-L229 HydrophobicContact CE1-CD1 3.74Å; F215-L229 HydrophobicContact CG-CD1 4.37Å; F215-L229 HydrophobicContact CZ-CD1 4.38Å; F221-L229 HydrophobicContact CD1-CD1 3.84Å; F221-L229 HydrophobicContact CD2-CD1 4.28Å; F221-L229 HydrophobicContact CE1-CD1 3.9Å; F221-L229 HydrophobicContact CE2-CD1 4.32Å; F221-L229 HydrophobicContact CG-CD1 4.03Å; F221-L229 HydrophobicContact CZ-CD1 4.14Å; Q225-L229 WeakPolarHBondContact O-CG 3.42Å; Q225-L229 PolarHBondContact O-N 3.39Å; A226-L229 PolarHBondContact O-N 3.3Å; K227-L229 VanDerWaalsContact C-N 3.33Å; K227-L229 PolarHBondContact O-N 3.3Å; L229-D233 CarbonylContact O-C 3.41Å; L229-D233 PolarHBondContact O-N 3.06Å; L229-L236 HydrophobicContact CB-CD1 4.12Å; L229-L236 HydrophobicContact CD2-CD1 4.05Å; L229-L263 HydrophobicContact CD2-CD2 3.71Å; L229-L263 HydrophobicContact CG-CD2 3.75Å; L229-P266 HydrophobicContact CD2-CB 3.73Å; L229-P266 HydrophobicContact CD2-CG 3.99Å; L229-L269 HydrophobicContact CD2-CD1 4.25Å
230	L	98.4	Very high	97.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.7	-47	177.4	178.4	61.6	0	0	0	112.4	Y179 F183 L185 I193 L200 A226 K227 Q228 P234 W237	Y179-L230 HydrophobicContact CD1-CD2 4.09Å; F183-L230 HydrophobicContact CB-CD2 3.86Å; F183-L230 HydrophobicContact CD1-CB 4.34Å; F183-L230 HydrophobicContact CD1-CD2 3.62Å; F183-L230 HydrophobicContact CD2-CD2 3.51Å; F183-L230 HydrophobicContact CE1-CB 4.47Å; F183-L230 HydrophobicContact CE1-CD2 3.98Å; F183-L230 HydrophobicContact CE2-CD2 3.88Å; F183-L230 HydrophobicContact CG-CD2 3.36Å; F183-L230 HydrophobicContact CZ-CD2 4.1Å; L185-L230 HydrophobicContact CD1-CD2 4.12Å; I193-L230 HydrophobicContact CD1-CD1 4.12Å; I193-L230 HydrophobicContact CD1-CD2 3.81Å; I193-L230 HydrophobicContact CD1-CG 4Å; I193-L230 HydrophobicContact CG2-CG 4.27Å; L200-L230 HydrophobicContact CD1-CD1 4.15Å; A226-L230 PolarHBondContact O-N 3.27Å; K227-L230 WeakPolarHBondContact O-CB 3.27Å; K227-L230 PolarHBondContact O-N 2.71Å; K227-L230 VanDerWaalsContact O-N 3.13Å; Q228-L230 VanDerWaalsContact C-N 3.35Å; L230-P234 VanDerWaalsContact O-CA 3.31Å; L230-P234 WeakPolarHBondContact O-CA 3.39Å; L230-P234 VanDerWaalsContact O-CD 3.26Å; L230-P234 WeakPolarHBondContact O-CD 3.18Å; L230-P234 WeakPolarHBondContact O-CG 3.29Å; L230-P234 VanDerWaalsContact O-N 3.17Å; L230-W237 HydrophobicContact CB-CZ2 4.22Å; L230-W237 VanDerWaalsContact CB-NE1 3.31Å; L230-W237 HydrophobicContact CD1-CB 4.34Å; L230-W237 HydrophobicContact CD1-CD2 4.22Å; L230-W237 HydrophobicContact CD1-CG 3.69Å
231	V	98.4	Very high	97.8	Very high	22 Å²	22	38.6 Å²	38.6	13%	0.133	20%	0.2	C	C	.	.	H	α-helix	trans	-71.1	-40.9	-177.4	175	0	0	0	0	111.6	L185 E189 Q192 I193 K227 Q228	L185-V231 HydrophobicContact CD2-CG2 3.9Å; E189-V231 HydrophobicContact CB-CG2 4.4Å; E189-V231 HydrophobicContact CG-CG2 4.32Å; Q192-V231 PolarHBondContact NE2-O 3.44Å; I193-V231 HydrophobicContact CG2-CG2 4.36Å; K227-V231 HydrophobicContact CG-CG2 4.35Å; K227-V231 WeakPolarHBondContact O-CG2 3Å; K227-V231 PolarHBondContact O-N 3Å; Q228-V231 PolarHBondContact O-N 3.43Å
232	K	98.3	Very high	97.8	Very high	107 Å²	107	39.8 Å²	39.8	47%	0.465	21%	0.209	S	C	.	.	H	α-helix	trans	-76.9	-33.3	-179	-72.5	176	171.6	171	0	113.5	Q228 L263 P266	Q228-K232 VanDerWaalsContact O-CB 3.23Å; Q228-K232 WeakPolarHBondContact O-CB 3.29Å; Q228-K232 WeakPolarHBondContact O-CG 3.39Å; Q228-K232 PolarHBondContact O-N 3.45Å; K232-L263 PolarHBondContact NZ-O 3.08Å; K232-P266 HydrophobicContact CB-CG 3.93Å; K232-P266 HydrophobicContact CD-CG 4.13Å
233	D	98.1	Very high	97.8	Very high	18 Å²	18	39.6 Å²	39.6	10%	0.096	20%	0.203	C	C	.	.			trans	-146.5	77.9	177.8	-164.5	-3	0	0	0	113.3	L229 K235 L236 P266 R267 R270	L229-D233 CarbonylContact O-C 3.41Å; L229-D233 PolarHBondContact O-N 3.06Å; D233-K235 PolarHBondContact O-N 3.34Å; D233-K235 PolarHBondContact OD1-N 2.96Å; D233-L236 HydrophobicContact CB-CD1 3.98Å; D233-L236 HydrophobicContact CB-CG 4.04Å; D233-L236 WeakPolarHBondContact O-CB 3.12Å; D233-L236 WeakPolarHBondContact O-CG 3.24Å; D233-L236 PolarHBondContact O-N 3.46Å; D233-P266 HydrophobicContact CB-CB 3.97Å; D233-R267 WeakPolarHBondContact OD2-CA 3.44Å; D233-R270 IonicContact OD1-CZ 2.83Å; D233-R270 IonicContact OD1-NH1 3.19Å; D233-R270 PolarHBondContact OD1-NH1 2.91Å; D233-R270 IonicContact OD1-NH2 2.76Å; D233-R270 IonicContact OD2-CZ 3.45Å; D233-R270 IonicContact OD2-NE 3.58Å; D233-R270 IonicContact OD2-NH1 2.75Å; D233-R270 PolarHBondContact OD2-NH1 3.33Å; D233-R270 IonicContact OD2-NH2 3.64Å; D233-R270 PolarHBondContact OD2-NH2 3.27Å
234	P	98.2	Very high	97.9	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.013	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-55.3	-22.8	-177.9	-27.9	34.3	0	0	0	115.1	I193 E196 N197 L200 L230 L236 W237	I193-P234 HydrophobicContact CB-CB 4.19Å; I193-P234 HydrophobicContact CB-CG 3.88Å; I193-P234 HydrophobicContact CG2-CG 3.93Å; E196-P234 HydrophobicContact CB-CG 3.9Å; E196-P234 WeakPolarHBondContact OE2-CD 3.47Å; E196-P234 VanDerWaalsContact OE2-CG 3.3Å; E196-P234 WeakPolarHBondContact OE2-CG 3.32Å; N197-P234 HydrophobicContact CB-CB 3.74Å; N197-P234 PolarHBondContact ND2-O 3.11Å; L200-P234 HydrophobicContact CD1-CB 3.99Å; L230-P234 VanDerWaalsContact O-CA 3.31Å; L230-P234 WeakPolarHBondContact O-CA 3.39Å; L230-P234 VanDerWaalsContact O-CD 3.26Å; L230-P234 WeakPolarHBondContact O-CD 3.18Å; L230-P234 WeakPolarHBondContact O-CG 3.29Å; L230-P234 VanDerWaalsContact O-N 3.17Å; P234-L236 VanDerWaalsContact C-N 3.29Å; P234-L236 PolarHBondContact O-N 3.05Å; P234-W237 PolarHBondContact O-N 3.26Å
235	K	97.6	Very high	97.9	Very high	114 Å²	114	32.3 Å²	32.3	50%	0.496	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-75.7	-15.9	-178.7	165.4	-179	-178	-173.6	0	112.9	D233 W237 T238 T239	D233-K235 PolarHBondContact O-N 3.34Å; D233-K235 PolarHBondContact OD1-N 2.96Å; K235-W237 PolarHBondContact O-N 3.09Å; K235-T238 PolarHBondContact O-N 2.86Å; K235-T238 VanDerWaalsContact O-N 3.12Å; K235-T238 PolarHBondContact O-OG1 3.01Å; K235-T238 VanDerWaalsContact O-OG1 3.09Å; K235-T239 PolarHBondContact O-N 3.46Å; K235-T239 PolarHBondContact O-OG1 3.27Å
236	L	98.1	Very high	97.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-51.8	-41.3	167.5	-69.2	173.8	0	0	0	111.3	L229 D233 P234 T238 T239 L244 P266 L269 R270	L229-L236 HydrophobicContact CB-CD1 4.12Å; L229-L236 HydrophobicContact CD2-CD1 4.05Å; D233-L236 HydrophobicContact CB-CD1 3.98Å; D233-L236 HydrophobicContact CB-CG 4.04Å; D233-L236 WeakPolarHBondContact O-CB 3.12Å; D233-L236 WeakPolarHBondContact O-CG 3.24Å; D233-L236 PolarHBondContact O-N 3.46Å; P234-L236 VanDerWaalsContact C-N 3.29Å; P234-L236 PolarHBondContact O-N 3.05Å; L236-T238 PolarHBondContact O-N 3.36Å; L236-T238 VanDerWaalsContact O-N 3.07Å; L236-T239 WeakPolarHBondContact O-CB 3.16Å; L236-T239 PolarHBondContact O-N 2.85Å; L236-L244 HydrophobicContact CD2-CD2 3.6Å; L236-L244 WeakPolarHBondContact O-CD1 3.3Å; L236-P266 HydrophobicContact CD1-CB 3.8Å; L236-L269 HydrophobicContact CD1-CD1 4.4Å; L236-L269 HydrophobicContact CD2-CB 3.77Å; L236-L269 HydrophobicContact CD2-CD1 4.36Å; L236-R270 HydrophobicContact CD2-CG 3.54Å
237	W	97.6	Very high	97.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-76.8	5	-176	-60.2	88	0	0	0	114.8	F183 L200 T208 L211 Q212 F215 A226 L230 P234 K235	F183-W237 AromaticContact CE1-CH2 3.33Å; F183-W237 HydrophobicContact CE1-CH2 3.33Å; F183-W237 AromaticContact CE1-CZ2 3.5Å; F183-W237 HydrophobicContact CE1-CZ2 3.5Å; F183-W237 VanDerWaalsContact CE1-CZ2 3.5Å; F183-W237 AromaticContact CE1-CZ3 3.93Å; F183-W237 HydrophobicContact CE1-CZ3 3.93Å; F183-W237 HydrophobicContact CZ-CD2 4.42Å; F183-W237 HydrophobicContact CZ-CE3 4.04Å; F183-W237 AromaticContact CZ-CH2 3.45Å; F183-W237 HydrophobicContact CZ-CH2 3.45Å; F183-W237 VanDerWaalsContact CZ-CH2 3.45Å; F183-W237 AromaticContact CZ-CZ2 3.89Å; F183-W237 HydrophobicContact CZ-CZ2 3.89Å; F183-W237 AromaticContact CZ-CZ3 3.52Å; F183-W237 HydrophobicContact CZ-CZ3 3.52Å; L200-W237 HydrophobicContact CD2-CB 3.59Å; T208-W237 HydrophobicContact CG2-CB 4.43Å; T208-W237 HydrophobicContact CG2-CD2 4.21Å; T208-W237 HydrophobicContact CG2-CE3 3.45Å; T208-W237 VanDerWaalsContact CG2-CE3 3.45Å; T208-W237 HydrophobicContact CG2-CZ3 4.05Å; L211-W237 HydrophobicContact CB-CE3 3.91Å; L211-W237 HydrophobicContact CB-CZ3 4.07Å; Q212-W237 HydrophobicContact CB-CH2 4.17Å; Q212-W237 HydrophobicContact CB-CZ3 3.77Å; Q212-W237 HydrophobicContact CG-CH2 4.43Å; Q212-W237 HydrophobicContact CG-CZ3 4.46Å; F215-W237 AromaticContact CD2-CH2 3.91Å; F215-W237 HydrophobicContact CD2-CH2 3.91Å; F215-W237 HydrophobicContact CD2-CZ2 4.15Å; F215-W237 HydrophobicContact CD2-CZ3 4.22Å; F215-W237 HydrophobicContact CE2-CZ2 4.48Å; A226-W237 HydrophobicContact CB-CH2 4.46Å; A226-W237 HydrophobicContact CB-CZ2 4.43Å; L230-W237 HydrophobicContact CB-CZ2 4.22Å; L230-W237 VanDerWaalsContact CB-NE1 3.31Å; L230-W237 HydrophobicContact CD1-CB 4.34Å; L230-W237 HydrophobicContact CD1-CD2 4.22Å; L230-W237 HydrophobicContact CD1-CG 3.69Å; P234-W237 PolarHBondContact O-N 3.26Å; K235-W237 PolarHBondContact O-N 3.09Å
238	T	96.1	Very high	97.9	Very high	19 Å²	19	31.3 Å²	31.3	12%	0.117	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-129.7	8.1	171.2	56.2	0	0	0	0	112	N197 K199 L200 F203 K235 L236	N197-T238 VanDerWaalsContact ND2-CG2 3.31Å; N197-T238 WeakPolarHBondContact ND2-CG2 3.43Å; N197-T238 PolarHBondContact ND2-OG1 2.93Å; K199-T238 HydrophobicContact CB-CG2 4.16Å; L200-T238 HydrophobicContact CD2-CG2 4.03Å; F203-T238 HydrophobicContact CD2-CG2 4.04Å; F203-T238 HydrophobicContact CE2-CG2 4.47Å; K235-T238 PolarHBondContact O-N 2.86Å; K235-T238 VanDerWaalsContact O-N 3.12Å; K235-T238 PolarHBondContact O-OG1 3.01Å; K235-T238 VanDerWaalsContact O-OG1 3.09Å; L236-T238 PolarHBondContact O-N 3.36Å; L236-T238 VanDerWaalsContact O-N 3.07Å
239	T	97.1	Very high	97.9	Very high	15 Å²	15	31.9 Å²	31.9	9%	0.092	16%	0.157	C	C	.	.	S	Bend	trans	-87.4	148.7	176.6	-58.8	0	0	0	0	109	Y207 K235 L236 I243 L244 R270	Y207-T239 WeakPolarHBondContact CE1-O 3.47Å; Y207-T239 PolarHBondContact OH-O 3.01Å; K235-T239 PolarHBondContact O-N 3.46Å; K235-T239 PolarHBondContact O-OG1 3.27Å; L236-T239 WeakPolarHBondContact O-CB 3.16Å; L236-T239 PolarHBondContact O-N 2.85Å; T239-I243 HydrophobicContact CG2-CB 4.14Å; T239-I243 HydrophobicContact CG2-CD1 4.41Å; T239-I243 HydrophobicContact CG2-CG2 4.15Å; T239-L244 HydrophobicContact CG2-CD2 3.95Å; T239-L244 HydrophobicContact CG2-CG 4.06Å; T239-R270 HydrophobicContact CG2-CG 4.22Å; T239-R270 WeakPolarHBondContact OG1-CD 3.48Å
240	Y	96.3	Very high	97.9	Very high	82 Å²	82	32.8 Å²	32.8	32%	0.322	16%	0.16	S	C	.	.			trans	-56.2	135.8	176.3	-65	-74.6	0	0	0	111.7	D23 L25 Y207 S242 I243 L244	D23-Y240 HydrophobicContact CB-CD1 4.23Å; D23-Y240 WeakPolarHBondContact O-CD1 3.37Å; D23-Y240 WeakPolarHBondContact O-CE1 3.48Å; L25-Y240 HydrophobicContact CB-CE1 4.2Å; L25-Y240 HydrophobicContact CD1-CE1 3.77Å; L25-Y240 HydrophobicContact CD1-CE2 4.19Å; L25-Y240 HydrophobicContact CD2-CE1 4.42Å; L25-Y240 HydrophobicContact CG-CD1 3.99Å; L25-Y240 HydrophobicContact CG-CE1 3.42Å; L25-Y240 VanDerWaalsContact CG-CE1 3.42Å; Y207-Y240 VanDerWaalsContact OH-CA 3.25Å; Y207-Y240 WeakPolarHBondContact OH-CA 3.48Å; Y240-S242 VanDerWaalsContact C-N 3.33Å; Y240-S242 PolarHBondContact O-N 3.43Å; Y240-I243 HydrophobicContact CD2-CD1 3.93Å; Y240-I243 HydrophobicContact CG-CD1 4.49Å; Y240-I243 PolarHBondContact O-N 2.92Å; Y240-L244 PolarHBondContact O-N 3.24Å
241	K	97	Very high	97.9	Very high	58 Å²	58	32.8 Å²	32.8	25%	0.252	16%	0.16	S	C	.	.	H	α-helix	trans	-56	-48.4	-178.9	-177.6	-175.9	177	179.6	0	110.7	D23 Y207 L211 M214 E218 I243 L244 S245	D23-K241 PolarHBondContact OD2-N 3.28Å; Y207-K241 PolarHBondContact OH-N 3.35Å; L211-K241 HydrophobicContact CD2-CB 4.04Å; L211-K241 HydrophobicContact CD2-CG 4.34Å; M214-K241 HydrophobicContact CE-CG 4.26Å; M214-K241 HydrophobicContact CG-CG 4.29Å; E218-K241 IonicContact OE1-NZ 3.03Å; E218-K241 PolarHBondContact OE1-NZ 3.1Å; E218-K241 VanDerWaalsContact OE2-CE 3.23Å; E218-K241 WeakPolarHBondContact OE2-CE 3.35Å; E218-K241 IonicContact OE2-NZ 2.67Å; E218-K241 PolarHBondContact OE2-NZ 3.18Å; K241-I243 VanDerWaalsContact C-N 3.33Å; K241-I243 PolarHBondContact O-N 3.43Å; K241-L244 PolarHBondContact O-N 2.98Å; K241-L244 VanDerWaalsContact O-N 3.09Å; K241-S245 PolarHBondContact O-N 3.49Å; K241-S245 PolarHBondContact O-OG 3.35Å
242	S	97.4	Very high	97.9	Very high	28 Å²	28	34.3 Å²	34.3	20%	0.196	17%	0.166	C	C	.	.	H	α-helix	trans	-48.8	-47.4	175.4	42.2	0	0	0	0	113.8	D23 Y240 N246	D23-S242 VanDerWaalsContact OD2-CB 3.28Å; D23-S242 WeakPolarHBondContact OD2-CB 3.47Å; D23-S242 PolarHBondContact OD2-N 3.22Å; D23-S242 PolarHBondContact OD2-OG 3.19Å; Y240-S242 VanDerWaalsContact C-N 3.33Å; Y240-S242 PolarHBondContact O-N 3.43Å; S242-N246 WeakPolarHBondContact O-CB 3.47Å; S242-N246 PolarHBondContact O-N 3.2Å; S242-N246 PolarHBondContact O-ND2 2.91Å
243	I	98.3	Very high	97.9	Very high	51 Å²	51	34.3 Å²	34.3	26%	0.262	17%	0.171	S	C	.	.	H	α-helix	trans	-61.5	-49.3	178	-62.7	175.9	0	0	0	110.3	T239 Y240 K241 N246 S247	T239-I243 HydrophobicContact CG2-CB 4.14Å; T239-I243 HydrophobicContact CG2-CD1 4.41Å; T239-I243 HydrophobicContact CG2-CG2 4.15Å; Y240-I243 HydrophobicContact CD2-CD1 3.93Å; Y240-I243 HydrophobicContact CG-CD1 4.49Å; Y240-I243 PolarHBondContact O-N 2.92Å; K241-I243 VanDerWaalsContact C-N 3.33Å; K241-I243 PolarHBondContact O-N 3.43Å; I243-N246 PolarHBondContact O-N 3.12Å; I243-S247 VanDerWaalsContact O-CB 3.31Å; I243-S247 WeakPolarHBondContact O-CB 3.37Å; I243-S247 PolarHBondContact O-N 3.39Å; I243-S247 PolarHBondContact O-OG 3.32Å
244	L	98.6	Very high	97.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.8	-48	-177.5	-61.6	172	0	0	0	111.7	L211 M214 F215 L236 T239 Y240 K241 F248 L269 R270	L211-L244 HydrophobicContact CD1-CD1 4.16Å; L211-L244 HydrophobicContact CD2-CD1 3.96Å; M214-L244 HydrophobicContact CE-CB 3.91Å; M214-L244 HydrophobicContact CE-CD1 3.79Å; F215-L244 HydrophobicContact CE2-CD1 4.16Å; F215-L244 HydrophobicContact CZ-CD1 4.08Å; F215-L244 HydrophobicContact CZ-CD2 4.49Å; L236-L244 HydrophobicContact CD2-CD2 3.6Å; L236-L244 WeakPolarHBondContact O-CD1 3.3Å; T239-L244 HydrophobicContact CG2-CD2 3.95Å; T239-L244 HydrophobicContact CG2-CG 4.06Å; Y240-L244 PolarHBondContact O-N 3.24Å; K241-L244 PolarHBondContact O-N 2.98Å; K241-L244 VanDerWaalsContact O-N 3.09Å; L244-F248 VanDerWaalsContact O-CB 3.3Å; L244-F248 WeakPolarHBondContact O-CB 3.42Å; L244-F248 PolarHBondContact O-N 3.39Å; L244-L269 HydrophobicContact CD2-CB 4.03Å; L244-R270 HydrophobicContact CD2-CG 4.44Å
245	S	98.2	Very high	97.8	Very high	17 Å²	17	38.8 Å²	38.8	12%	0.119	20%	0.197	C	C	.	.	H	α-helix	trans	-65.8	-45.2	-179.8	-61.4	0	0	0	0	111.8	K241 S247 F248 N249	K241-S245 PolarHBondContact O-N 3.49Å; K241-S245 PolarHBondContact O-OG 3.35Å; S245-S247 VanDerWaalsContact C-N 3.32Å; S245-S247 PolarHBondContact O-N 2.99Å; S245-F248 PolarHBondContact O-N 3.09Å; S245-N249 VanDerWaalsContact O-CB 3.28Å; S245-N249 WeakPolarHBondContact O-CB 3.32Å; S245-N249 PolarHBondContact O-N 3.31Å; S245-N249 PolarHBondContact O-ND2 3.38Å
246	N	98.4	Very high	97.8	Very high	62 Å²	62	36 Å²	36	33%	0.332	20%	0.201	S	C	.	.	H	α-helix	trans	-63.2	-40.1	179.7	-74.9	-23	0	0	0	112	S242 I243 Y250 K273	S242-N246 WeakPolarHBondContact O-CB 3.47Å; S242-N246 PolarHBondContact O-N 3.2Å; S242-N246 PolarHBondContact O-ND2 2.91Å; I243-N246 PolarHBondContact O-N 3.12Å; N246-Y250 PolarHBondContact O-N 3.26Å; N246-K273 HydrophobicContact CB-CB 4.09Å; N246-K273 HydrophobicContact CB-CD 4.27Å
247	S	98.6	Very high	97.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-72.7	-43.4	178.9	-61.8	0	0	0	0	111.8	I243 S245 Y250 L251 L269 E271	I243-S247 VanDerWaalsContact O-CB 3.31Å; I243-S247 WeakPolarHBondContact O-CB 3.37Å; I243-S247 PolarHBondContact O-N 3.39Å; I243-S247 PolarHBondContact O-OG 3.32Å; S245-S247 VanDerWaalsContact C-N 3.32Å; S245-S247 PolarHBondContact O-N 2.99Å; S247-Y250 PolarHBondContact O-N 2.88Å; S247-L251 WeakPolarHBondContact O-CB 3.18Å; S247-L251 WeakPolarHBondContact O-CD1 3.36Å; S247-L251 WeakPolarHBondContact O-CG 3.41Å; S247-L251 PolarHBondContact O-N 2.97Å; S247-L269 WeakPolarHBondContact CB-O 3.44Å; S247-E271 PolarHBondContact OG-O 2.98Å
248	F	98.7	Very high	97.7	Very high	5 Å²	5	39.1 Å²	39.1	2%	0.022	22%	0.222	C	C	.	.	H	α-helix	trans	-58.2	-50.3	173	180	-89.5	0	0	0	111.5	L219 F221 L244 S245 Y250 L251 H252 H259 I262 L269	L219-F248 HydrophobicContact CB-CD1 4.08Å; L219-F248 HydrophobicContact CB-CD2 4.26Å; L219-F248 HydrophobicContact CB-CE1 3.94Å; L219-F248 HydrophobicContact CB-CE2 4.15Å; L219-F248 HydrophobicContact CB-CG 4.22Å; L219-F248 HydrophobicContact CB-CZ 3.98Å; L219-F248 HydrophobicContact CD1-CB 3.86Å; L219-F248 HydrophobicContact CD1-CD1 4.24Å; L219-F248 HydrophobicContact CD1-CD2 4.05Å; L219-F248 HydrophobicContact CD1-CG 3.78Å; L219-F248 HydrophobicContact CD2-CB 4.2Å; L219-F248 HydrophobicContact CD2-CD1 3.55Å; L219-F248 HydrophobicContact CD2-CE1 4.08Å; L219-F248 HydrophobicContact CD2-CG 3.93Å; L219-F248 HydrophobicContact CG-CD1 4.14Å; L219-F248 HydrophobicContact CG-CE1 4.47Å; L219-F248 HydrophobicContact CG-CG 4.18Å; L219-F248 WeakPolarHBondContact O-CZ 3.4Å; F221-F248 HydrophobicContact CD2-CE2 4.37Å; F221-F248 AromaticContact CE2-CD2 3.65Å; F221-F248 HydrophobicContact CE2-CD2 3.65Å; F221-F248 AromaticContact CE2-CE2 3.36Å; F221-F248 HydrophobicContact CE2-CE2 3.36Å; F221-F248 HydrophobicContact CE2-CZ 4.29Å; F221-F248 AromaticContact CZ-CD2 3.95Å; F221-F248 HydrophobicContact CZ-CD2 3.95Å; F221-F248 AromaticContact CZ-CE2 3.62Å; F221-F248 HydrophobicContact CZ-CE2 3.62Å; L244-F248 VanDerWaalsContact O-CB 3.3Å; L244-F248 WeakPolarHBondContact O-CB 3.42Å; L244-F248 PolarHBondContact O-N 3.39Å; S245-F248 PolarHBondContact O-N 3.09Å; F248-Y250 PolarHBondContact O-N 3.32Å; F248-L251 PolarHBondContact O-N 3.02Å; F248-H252 HydrophobicContact CD1-CB 4.1Å; F248-H252 HydrophobicContact CD2-CB 4.45Å; F248-H252 HydrophobicContact CE1-CB 3.71Å; F248-H252 AromaticContact CE1-CD2 3.68Å; F248-H252 AromaticContact CE1-CG 3.87Å; F248-H252 HydrophobicContact CE2-CB 4.06Å; F248-H252 HydrophobicContact CG-CB 4.48Å; F248-H252 HydrophobicContact CZ-CB 3.67Å; F248-H252 AromaticContact CZ-CD2 3.6Å; F248-H252 AromaticContact CZ-CG 3.6Å; F248-H252 VanDerWaalsContact O-CB 3.3Å; F248-H252 WeakPolarHBondContact O-CB 3.28Å; F248-H252 PolarHBondContact O-N 2.67Å; F248-H259 AromaticContact CZ-NE2 3.74Å; F248-I262 HydrophobicContact CD2-CD1 3.76Å; F248-I262 HydrophobicContact CE2-CD1 3.71Å; F248-L269 HydrophobicContact CB-CD2 3.86Å; F248-L269 HydrophobicContact CD2-CD2 4.09Å
249	N	98.5	Very high	97.8	Very high	70 Å²	70	39.9 Å²	39.9	37%	0.374	22%	0.224	S	C	.	.	H	α-helix	trans	-58	-38.8	-176.4	-77.6	-25.4	0	0	0	112	S245 N253	S245-N249 VanDerWaalsContact O-CB 3.28Å; S245-N249 WeakPolarHBondContact O-CB 3.32Å; S245-N249 PolarHBondContact O-N 3.31Å; S245-N249 PolarHBondContact O-ND2 3.38Å; N249-N253 WeakPolarHBondContact O-CA 3.3Å; N249-N253 WeakPolarHBondContact O-CB 3.42Å; N249-N253 PolarHBondContact O-N 3.3Å; N249-N253 PolarHBondContact OD1-ND2 2.91Å
250	Y	98.6	Very high	97.8	Very high	18 Å²	18	44.7 Å²	44.7	7%	0.071	25%	0.245	C	C	.	.	I	π-helix	trans	-72.8	-49.2	175.9	-163	-84.6	0	0	0	111.9	N246 S247 F248 H252 V254 I255 K273 I276 E277 H280	N246-Y250 PolarHBondContact O-N 3.26Å; S247-Y250 PolarHBondContact O-N 2.88Å; F248-Y250 PolarHBondContact O-N 3.32Å; Y250-H252 PolarHBondContact O-N 2.85Å; Y250-V254 HydrophobicContact CD1-CB 4.41Å; Y250-V254 HydrophobicContact CD2-CB 4.11Å; Y250-V254 HydrophobicContact CD2-CG1 4.35Å; Y250-V254 HydrophobicContact CD2-CG2 3.91Å; Y250-V254 HydrophobicContact CE1-CB 4.45Å; Y250-V254 HydrophobicContact CE1-CG1 4.31Å; Y250-V254 HydrophobicContact CE2-CB 4.16Å; Y250-V254 HydrophobicContact CE2-CG1 3.88Å; Y250-V254 HydrophobicContact CE2-CG2 4.2Å; Y250-V254 HydrophobicContact CG-CB 4.25Å; Y250-V254 HydrophobicContact CG-CG2 4.33Å; Y250-V254 WeakPolarHBondContact O-CA 3.34Å; Y250-V254 VanDerWaalsContact O-CB 3.27Å; Y250-V254 WeakPolarHBondContact O-CB 3.39Å; Y250-V254 PolarHBondContact O-N 3.2Å; Y250-V254 VanDerWaalsContact O-N 3.09Å; Y250-I255 HydrophobicContact CD1-CD1 4.01Å; Y250-I255 HydrophobicContact CD1-CG1 3.96Å; Y250-I255 HydrophobicContact CE1-CD1 3.92Å; Y250-I255 HydrophobicContact CE1-CG1 3.82Å; Y250-I255 PolarHBondContact O-N 3.43Å; Y250-K273 HydrophobicContact CD2-CG 4.45Å; Y250-I276 HydrophobicContact CD1-CB 4.42Å; Y250-I276 HydrophobicContact CD1-CG2 3.62Å; Y250-I276 HydrophobicContact CE1-CG2 4.16Å; Y250-E277 HydrophobicContact CD2-CB 4.22Å; Y250-E277 HydrophobicContact CE1-CB 4.14Å; Y250-E277 HydrophobicContact CE2-CB 3.69Å; Y250-E277 HydrophobicContact CE2-CG 3.62Å; Y250-H280 HydrophobicContact CE1-CB 4Å; Y250-H280 AromaticContact CE1-ND1 3.46Å; Y250-H280 WeakPolarHBondContact CE1-ND1 3.42Å; Y250-H280 AromaticContact CZ-ND1 3.61Å; Y250-H280 PolarHBondContact OH-ND1 3.17Å
251	L	98.5	Very high	97.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.241	C	C	.	.	I	π-helix	trans	-60.5	-44.5	-178.8	-69	168.1	0	0	0	112.3	S247 F248 I255 G256 F257 C268 L269 I276 I301 M304 L305	S247-L251 WeakPolarHBondContact O-CB 3.18Å; S247-L251 WeakPolarHBondContact O-CD1 3.36Å; S247-L251 WeakPolarHBondContact O-CG 3.41Å; S247-L251 PolarHBondContact O-N 2.97Å; F248-L251 PolarHBondContact O-N 3.02Å; L251-I255 HydrophobicContact CD2-CD1 4.1Å; L251-I255 WeakPolarHBondContact O-CB 3.38Å; L251-G256 PolarHBondContact O-N 3.14Å; L251-F257 HydrophobicContact CB-CD2 4.09Å; L251-F257 HydrophobicContact CD2-CD2 3.77Å; L251-F257 HydrophobicContact CD2-CE2 3.75Å; L251-F257 WeakPolarHBondContact O-CB 3.21Å; L251-F257 PolarHBondContact O-N 2.84Å; L251-C268 HydrophobicContact CD1-CB 3.85Å; L251-L269 HydrophobicContact CD1-CD2 4.36Å; L251-I276 HydrophobicContact CD1-CD1 4.13Å; L251-I276 HydrophobicContact CD2-CD1 4.39Å; L251-I276 HydrophobicContact CD2-CG2 3.53Å; L251-I276 HydrophobicContact CG-CD1 4.14Å; L251-I276 HydrophobicContact CG-CG2 4.08Å; L251-I301 HydrophobicContact CD1-CD1 4.34Å; L251-I301 HydrophobicContact CD2-CD1 4.04Å; L251-I301 HydrophobicContact CD2-CG1 4.49Å; L251-M304 HydrophobicContact CD2-CE 4.39Å; L251-L305 HydrophobicContact CD2-CD1 4.19Å
252	H	98.3	Very high	97.9	Very high	55 Å²	55	39.9 Å²	39.9	26%	0.255	23%	0.229	S	C	.	.	I	π-helix	trans	-82.8	-55.2	-176.9	-172.4	57.7	0	0	0	112	F248 Y250 G256 F257 H259 I262	F248-H252 HydrophobicContact CD1-CB 4.1Å; F248-H252 HydrophobicContact CD2-CB 4.45Å; F248-H252 HydrophobicContact CE1-CB 3.71Å; F248-H252 AromaticContact CE1-CD2 3.68Å; F248-H252 AromaticContact CE1-CG 3.87Å; F248-H252 HydrophobicContact CE2-CB 4.06Å; F248-H252 HydrophobicContact CG-CB 4.48Å; F248-H252 HydrophobicContact CZ-CB 3.67Å; F248-H252 AromaticContact CZ-CD2 3.6Å; F248-H252 AromaticContact CZ-CG 3.6Å; F248-H252 VanDerWaalsContact O-CB 3.3Å; F248-H252 WeakPolarHBondContact O-CB 3.28Å; F248-H252 PolarHBondContact O-N 2.67Å; Y250-H252 PolarHBondContact O-N 2.85Å; H252-G256 WeakPolarHBondContact O-CA 3.23Å; H252-G256 PolarHBondContact O-N 3.17Å; H252-G256 VanDerWaalsContact O-N 3.11Å; H252-F257 PolarHBondContact ND1-O 3.41Å; H252-H259 AromaticContact CE1-CE1 3.6Å; H252-H259 AromaticContact CE1-ND1 3.84Å; H252-H259 AromaticContact NE2-CE1 3.74Å; H252-I262 HydrophobicContact CB-CD1 4.44Å
253	N	97.8	Very high	97.9	Very high	107 Å²	107	38.5 Å²	38.5	57%	0.572	22%	0.22	S	C	*	.	I	π-helix	trans	-84.7	-27.3	-169.5	-52.4	-34.9	0	0	0	113.4	N249	N249-N253 WeakPolarHBondContact O-CA 3.3Å; N249-N253 WeakPolarHBondContact O-CB 3.42Å; N249-N253 PolarHBondContact O-N 3.3Å; N249-N253 PolarHBondContact OD1-ND2 2.91Å
254	V	97.7	Very high	97.8	Very high	86 Å²	86	38.6 Å²	38.6	52%	0.521	23%	0.225	S	C	.	.	I	π-helix	trans	-98	-47	-178.3	-176.1	0	0	0	0	111.7	Y250	Y250-V254 HydrophobicContact CD1-CB 4.41Å; Y250-V254 HydrophobicContact CD2-CB 4.11Å; Y250-V254 HydrophobicContact CD2-CG1 4.35Å; Y250-V254 HydrophobicContact CD2-CG2 3.91Å; Y250-V254 HydrophobicContact CE1-CB 4.45Å; Y250-V254 HydrophobicContact CE1-CG1 4.31Å; Y250-V254 HydrophobicContact CE2-CB 4.16Å; Y250-V254 HydrophobicContact CE2-CG1 3.88Å; Y250-V254 HydrophobicContact CE2-CG2 4.2Å; Y250-V254 HydrophobicContact CG-CB 4.25Å; Y250-V254 HydrophobicContact CG-CG2 4.33Å; Y250-V254 WeakPolarHBondContact O-CA 3.34Å; Y250-V254 VanDerWaalsContact O-CB 3.27Å; Y250-V254 WeakPolarHBondContact O-CB 3.39Å; Y250-V254 PolarHBondContact O-N 3.2Å; Y250-V254 VanDerWaalsContact O-N 3.09Å
255	I	97.1	Very high	97.8	Very high	28 Å²	28	39.9 Å²	39.9	14%	0.144	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-30.5	179	-49.4	-175.1	0	0	0	111.4	Y250 L251 F257 I276 H280 F291 M304	Y250-I255 HydrophobicContact CD1-CD1 4.01Å; Y250-I255 HydrophobicContact CD1-CG1 3.96Å; Y250-I255 HydrophobicContact CE1-CD1 3.92Å; Y250-I255 HydrophobicContact CE1-CG1 3.82Å; Y250-I255 PolarHBondContact O-N 3.43Å; L251-I255 HydrophobicContact CD2-CD1 4.1Å; L251-I255 WeakPolarHBondContact O-CB 3.38Å; I255-F257 HydrophobicContact CB-CE1 4.45Å; I255-F257 HydrophobicContact CD1-CE2 4.2Å; I255-F257 HydrophobicContact CD1-CZ 4.42Å; I255-F257 HydrophobicContact CG2-CD1 3.88Å; I255-F257 HydrophobicContact CG2-CE1 3.46Å; I255-F257 VanDerWaalsContact CG2-CE1 3.46Å; I255-F257 HydrophobicContact CG2-CE2 4.16Å; I255-F257 HydrophobicContact CG2-CG 4.38Å; I255-F257 HydrophobicContact CG2-CZ 3.63Å; I255-I276 HydrophobicContact CD1-CG2 4.16Å; I255-H280 HydrophobicContact CD1-CB 3.98Å; I255-F291 HydrophobicContact CG2-CD2 3.6Å; I255-F291 HydrophobicContact CG2-CE2 3.44Å; I255-F291 VanDerWaalsContact CG2-CE2 3.44Å; I255-F291 HydrophobicContact CG2-CG 4.5Å; I255-F291 HydrophobicContact CG2-CZ 4.22Å; I255-M304 HydrophobicContact CD1-CE 4.01Å
256	G	96.7	Very high	97.8	Very high	56 Å²	56	39.6 Å²	39.6	58%	0.577	23%	0.227	S	C	*	.			trans	89.9	19.3	-178	0	0	0	0	0	114.2	L251 H252 S258	L251-G256 PolarHBondContact O-N 3.14Å; H252-G256 WeakPolarHBondContact O-CA 3.23Å; H252-G256 PolarHBondContact O-N 3.17Å; H252-G256 VanDerWaalsContact O-N 3.11Å; G256-S258 PolarHBondContact O-N 3.08Å
257	F	97.6	Very high	97.8	Very high	10 Å²	10	41.5 Å²	41.5	4%	0.044	23%	0.23	C	C	.	.			trans	-67	128.5	176.2	-68.4	-19.3	0	0	0	111.4	L251 H252 I255 T261 I262 F291 I301 M304	L251-F257 HydrophobicContact CB-CD2 4.09Å; L251-F257 HydrophobicContact CD2-CD2 3.77Å; L251-F257 HydrophobicContact CD2-CE2 3.75Å; L251-F257 WeakPolarHBondContact O-CB 3.21Å; L251-F257 PolarHBondContact O-N 2.84Å; H252-F257 PolarHBondContact ND1-O 3.41Å; I255-F257 HydrophobicContact CB-CE1 4.45Å; I255-F257 HydrophobicContact CD1-CE2 4.2Å; I255-F257 HydrophobicContact CD1-CZ 4.42Å; I255-F257 HydrophobicContact CG2-CD1 3.88Å; I255-F257 HydrophobicContact CG2-CE1 3.46Å; I255-F257 VanDerWaalsContact CG2-CE1 3.46Å; I255-F257 HydrophobicContact CG2-CE2 4.16Å; I255-F257 HydrophobicContact CG2-CG 4.38Å; I255-F257 HydrophobicContact CG2-CZ 3.63Å; F257-T261 HydrophobicContact CB-CG2 4.12Å; F257-T261 HydrophobicContact CD1-CG2 4.03Å; F257-T261 HydrophobicContact CD2-CG2 4.46Å; F257-T261 HydrophobicContact CG-CG2 3.96Å; F257-I262 HydrophobicContact CB-CG1 4.27Å; F257-F291 HydrophobicContact CD1-CB 4.48Å; F257-F291 HydrophobicContact CE1-CB 3.54Å; F257-F291 AromaticContact CE1-CD1 3.82Å; F257-F291 HydrophobicContact CE1-CD1 3.82Å; F257-F291 AromaticContact CE1-CD2 3.75Å; F257-F291 HydrophobicContact CE1-CD2 3.75Å; F257-F291 HydrophobicContact CE1-CE1 4.46Å; F257-F291 HydrophobicContact CE1-CE2 4.39Å; F257-F291 AromaticContact CE1-CG 3.43Å; F257-F291 HydrophobicContact CE1-CG 3.43Å; F257-F291 VanDerWaalsContact CE1-CG 3.43Å; F257-F291 HydrophobicContact CZ-CB 4.28Å; F257-F291 AromaticContact CZ-CD1 3.67Å; F257-F291 HydrophobicContact CZ-CD1 3.67Å; F257-F291 HydrophobicContact CZ-CD2 4.11Å; F257-F291 AromaticContact CZ-CE1 3.96Å; F257-F291 HydrophobicContact CZ-CE1 3.96Å; F257-F291 HydrophobicContact CZ-CE2 4.35Å; F257-F291 AromaticContact CZ-CG 3.77Å; F257-F291 HydrophobicContact CZ-CG 3.77Å; F257-F291 HydrophobicContact CZ-CZ 4.28Å; F257-I301 HydrophobicContact CD2-CD1 3.6Å; F257-I301 HydrophobicContact CD2-CG1 4.21Å; F257-I301 HydrophobicContact CE2-CB 4.04Å; F257-I301 HydrophobicContact CE2-CD1 3.63Å; F257-I301 HydrophobicContact CE2-CG1 3.71Å; F257-I301 HydrophobicContact CZ-CB 4.48Å; F257-M304 HydrophobicContact CE2-CE 4.12Å; F257-M304 HydrophobicContact CZ-CE 4.33Å
258	S	96.9	Very high	97.8	Very high	55 Å²	55	41.5 Å²	41.5	39%	0.385	23%	0.23	S	C	.	.			trans	-67.3	160	171.7	64.4	0	0	0	0	111.9	G256 E260 T261 I262	G256-S258 PolarHBondContact O-N 3.08Å; S258-E260 PolarHBondContact O-N 3.43Å; S258-T261 WeakPolarHBondContact O-CB 3.49Å; S258-T261 PolarHBondContact O-N 3.38Å; S258-T261 PolarHBondContact OG-N 3.21Å; S258-T261 PolarHBondContact OG-OG1 3.2Å; S258-I262 PolarHBondContact O-N 3.3Å
259	H	98.2	Very high	97.8	Very high	35 Å²	35	41.3 Å²	41.3	16%	0.162	23%	0.229	C	C	.	.	H	α-helix	trans	-53.1	-37.5	170.9	-61.8	69.4	0	0	0	112	L219 F221 F248 H252 I262 L263	L219-H259 PolarHBondContact O-NE2 3.31Å; F221-H259 HydrophobicContact CD1-CB 4.24Å; F221-H259 AromaticContact CD1-CD2 3.59Å; F221-H259 AromaticContact CD2-CD2 3.96Å; F221-H259 HydrophobicContact CE1-CB 3.98Å; F221-H259 AromaticContact CE1-CD2 3.63Å; F221-H259 AromaticContact CG-CD2 3.77Å; F221-H259 AromaticContact CZ-CD2 3.85Å; F248-H259 AromaticContact CZ-NE2 3.74Å; H252-H259 AromaticContact CE1-CE1 3.6Å; H252-H259 AromaticContact CE1-ND1 3.84Å; H252-H259 AromaticContact NE2-CE1 3.74Å; H259-I262 PolarHBondContact O-N 3.1Å; H259-L263 WeakPolarHBondContact O-CB 3.34Å; H259-L263 WeakPolarHBondContact O-CD1 3.48Å; H259-L263 VanDerWaalsContact O-CG 3.24Å; H259-L263 WeakPolarHBondContact O-CG 3.49Å; H259-L263 PolarHBondContact O-N 3.13Å
260	E	96.7	Very high	97.7	Very high	116 Å²	116	40.5 Å²	40.5	54%	0.542	22%	0.221	S	C	.	.	H	α-helix	trans	-65	-39.5	176.2	-173.6	56.2	-155.7	0	0	112.6	S258 I262 L263 S264	S258-E260 PolarHBondContact O-N 3.43Å; E260-I262 VanDerWaalsContact C-N 3.34Å; E260-I262 PolarHBondContact O-N 2.6Å; E260-L263 PolarHBondContact O-N 3.01Å; E260-S264 PolarHBondContact O-N 3.27Å; E260-S264 VanDerWaalsContact O-N 3.07Å
261	T	96.6	Very high	97.7	Very high	38 Å²	38	40.8 Å²	40.8	23%	0.233	22%	0.223	C	C	.	.	H	α-helix	trans	-64	-42.7	175.5	-56.3	0	0	0	0	110.6	F257 S258 S264	F257-T261 HydrophobicContact CB-CG2 4.12Å; F257-T261 HydrophobicContact CD1-CG2 4.03Å; F257-T261 HydrophobicContact CD2-CG2 4.46Å; F257-T261 HydrophobicContact CG-CG2 3.96Å; S258-T261 WeakPolarHBondContact O-CB 3.49Å; S258-T261 PolarHBondContact O-N 3.38Å; S258-T261 PolarHBondContact OG-N 3.21Å; S258-T261 PolarHBondContact OG-OG1 3.2Å; T261-S264 WeakPolarHBondContact O-CB 3.5Å; T261-S264 PolarHBondContact O-N 3.38Å; T261-S264 PolarHBondContact O-OG 3.35Å
262	I	98.3	Very high	97.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-42.4	175.9	-66	170.8	0	0	0	110.9	F221 F248 H252 F257 S258 H259 E260 S264 W265 P266 L269	F221-I262 HydrophobicContact CZ-CG2 4.06Å; F248-I262 HydrophobicContact CD2-CD1 3.76Å; F248-I262 HydrophobicContact CE2-CD1 3.71Å; H252-I262 HydrophobicContact CB-CD1 4.44Å; F257-I262 HydrophobicContact CB-CG1 4.27Å; S258-I262 PolarHBondContact O-N 3.3Å; H259-I262 PolarHBondContact O-N 3.1Å; E260-I262 VanDerWaalsContact C-N 3.34Å; E260-I262 PolarHBondContact O-N 2.6Å; I262-S264 PolarHBondContact O-N 3.31Å; I262-W265 CarbonylContact O-C 3.21Å; I262-W265 PolarHBondContact O-N 3.06Å; I262-W265 VanDerWaalsContact O-N 3.1Å; I262-P266 WeakPolarHBondContact O-CA 3.22Å; I262-L269 HydrophobicContact CG2-CD1 3.87Å; I262-L269 HydrophobicContact CG2-CD2 3.92Å; I262-L269 HydrophobicContact CG2-CG 3.84Å
263	L	97.9	Very high	97.6	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64	-21.4	177.1	-78.3	163.7	0	0	0	114.2	F221 Q225 Q228 L229 K232 H259 E260 W265	F221-L263 HydrophobicContact CE1-CG 4.43Å; Q225-L263 HydrophobicContact CB-CD1 3.85Å; Q225-L263 HydrophobicContact CB-CD2 4.42Å; Q225-L263 HydrophobicContact CG-CD1 3.56Å; Q228-L263 HydrophobicContact CB-CD2 3.82Å; L229-L263 HydrophobicContact CD2-CD2 3.71Å; L229-L263 HydrophobicContact CG-CD2 3.75Å; K232-L263 PolarHBondContact NZ-O 3.08Å; H259-L263 WeakPolarHBondContact O-CB 3.34Å; H259-L263 WeakPolarHBondContact O-CD1 3.48Å; H259-L263 VanDerWaalsContact O-CG 3.24Å; H259-L263 WeakPolarHBondContact O-CG 3.49Å; H259-L263 PolarHBondContact O-N 3.13Å; E260-L263 PolarHBondContact O-N 3.01Å; L263-W265 VanDerWaalsContact C-N 3.27Å
264	S	96.7	Very high	97.5	Very high	52 Å²	52	49.2 Å²	49.2	36%	0.364	26%	0.255	S	S	.	.	H	α-helix	trans	-69	-26.7	174.4	77.6	0	0	0	0	112.7	E260 T261 I262 R293	E260-S264 PolarHBondContact O-N 3.27Å; E260-S264 VanDerWaalsContact O-N 3.07Å; T261-S264 WeakPolarHBondContact O-CB 3.5Å; T261-S264 PolarHBondContact O-N 3.38Å; T261-S264 PolarHBondContact O-OG 3.35Å; I262-S264 PolarHBondContact O-N 3.31Å; S264-R293 PolarHBondContact OG-NH2 2.86Å
265	W	97.7	Very high	97.5	Very high	27 Å²	27	47.6 Å²	47.6	10%	0.102	24%	0.241	C	C	.	.	S	Bend	trans	-150.3	76	174.2	-167.7	75.6	0	0	0	111.4	I262 L263 R267 C268 I301 E302 L305 N306	I262-W265 CarbonylContact O-C 3.21Å; I262-W265 PolarHBondContact O-N 3.06Å; I262-W265 VanDerWaalsContact O-N 3.1Å; L263-W265 VanDerWaalsContact C-N 3.27Å; W265-R267 HydrophobicContact CD2-CB 4.14Å; W265-R267 HydrophobicContact CE3-CB 4.42Å; W265-R267 HydrophobicContact CH2-CB 4.29Å; W265-R267 HydrophobicContact CH2-CG 3.93Å; W265-R267 HydrophobicContact CZ2-CB 4.05Å; W265-R267 HydrophobicContact CZ2-CG 3.87Å; W265-R267 HydrophobicContact CZ3-CB 4.47Å; W265-R267 HydrophobicContact CZ3-CG 4.44Å; W265-R267 PolarHBondContact O-N 3.1Å; W265-C268 HydrophobicContact CE3-CB 3.66Å; W265-C268 HydrophobicContact CZ3-CB 3.82Å; W265-C268 PolarHBondContact O-N 3.05Å; W265-C268 VanDerWaalsContact O-N 3.09Å; W265-C268 PolarHBondContact O-SG 2.91Å; W265-I301 HydrophobicContact CB-CG2 3.87Å; W265-I301 HydrophobicContact CE3-CG2 4.45Å; W265-E302 HydrophobicContact CB-CB 4.4Å; W265-E302 HydrophobicContact CD2-CB 3.76Å; W265-E302 HydrophobicContact CD2-CG 4.1Å; W265-E302 HydrophobicContact CE3-CB 4.26Å; W265-E302 HydrophobicContact CG-CB 3.82Å; W265-E302 HydrophobicContact CG-CG 4.29Å; W265-E302 HydrophobicContact CZ2-CB 4.45Å; W265-E302 HydrophobicContact CZ2-CG 4.01Å; W265-E302 PolarHBondContact NE1-OE1 3.12Å; W265-L305 HydrophobicContact CH2-CB 4.01Å; W265-L305 HydrophobicContact CZ3-CB 3.65Å; W265-L305 HydrophobicContact CZ3-CD1 4.2Å; W265-N306 HydrophobicContact CH2-CB 4.05Å; W265-N306 HydrophobicContact CZ2-CB 3.82Å
266	P	98.3	Very high	97.6	Very high	11 Å²	11	46.3 Å²	46.3	7%	0.071	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-58.3	-21.9	-170.7	-28.9	37.7	0	0	0	115.3	L229 K232 D233 L236 I262 C268 L269	L229-P266 HydrophobicContact CD2-CB 3.73Å; L229-P266 HydrophobicContact CD2-CG 3.99Å; K232-P266 HydrophobicContact CB-CG 3.93Å; K232-P266 HydrophobicContact CD-CG 4.13Å; D233-P266 HydrophobicContact CB-CB 3.97Å; L236-P266 HydrophobicContact CD1-CB 3.8Å; I262-P266 WeakPolarHBondContact O-CA 3.22Å; P266-C268 PolarHBondContact O-N 3.48Å; P266-C268 VanDerWaalsContact O-N 3.08Å; P266-L269 WeakPolarHBondContact O-CB 3.47Å; P266-L269 PolarHBondContact O-N 3.03Å; P266-L269 VanDerWaalsContact O-N 3.09Å
267	R	98.1	Very high	97.6	Very high	103 Å²	103	45.7 Å²	45.7	39%	0.389	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-53.9	-27.6	175.2	173.4	171.1	176.7	-176.1	0	113	D233 W265 L269 R270 E271	D233-R267 WeakPolarHBondContact OD2-CA 3.44Å; W265-R267 HydrophobicContact CD2-CB 4.14Å; W265-R267 HydrophobicContact CE3-CB 4.42Å; W265-R267 HydrophobicContact CH2-CB 4.29Å; W265-R267 HydrophobicContact CH2-CG 3.93Å; W265-R267 HydrophobicContact CZ2-CB 4.05Å; W265-R267 HydrophobicContact CZ2-CG 3.87Å; W265-R267 HydrophobicContact CZ3-CB 4.47Å; W265-R267 HydrophobicContact CZ3-CG 4.44Å; W265-R267 PolarHBondContact O-N 3.1Å; R267-L269 PolarHBondContact O-N 3.47Å; R267-L269 VanDerWaalsContact O-N 3.12Å; R267-R270 PolarHBondContact O-N 3.21Å; R267-E271 IonicContact NE-OE1 2.73Å
268	C	98.3	Very high	97.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-52.3	-32.8	176.2	58.8	0	0	0	0	113.4	L251 W265 P266 R270 E271 I301 L305	L251-C268 HydrophobicContact CD1-CB 3.85Å; W265-C268 HydrophobicContact CE3-CB 3.66Å; W265-C268 HydrophobicContact CZ3-CB 3.82Å; W265-C268 PolarHBondContact O-N 3.05Å; W265-C268 VanDerWaalsContact O-N 3.09Å; W265-C268 PolarHBondContact O-SG 2.91Å; P266-C268 PolarHBondContact O-N 3.48Å; P266-C268 VanDerWaalsContact O-N 3.08Å; C268-R270 PolarHBondContact O-N 3.1Å; C268-E271 WeakPolarHBondContact O-CB 3.46Å; C268-E271 PolarHBondContact O-N 3.38Å; C268-I301 HydrophobicContact CB-CD1 3.44Å; C268-I301 VanDerWaalsContact CB-CD1 3.44Å; C268-I301 HydrophobicContact CB-CG1 3.86Å; C268-I301 WeakPolarHBondContact SG-CD1 3.22Å; C268-L305 HydrophobicContact CB-CD1 3.71Å
269	L	98.5	Very high	97.6	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-68.7	-17.2	-179.6	-64.1	175.3	0	0	0	113.2	F215 L229 L236 L244 S247 F248 L251 I262 P266 R267	F215-L269 HydrophobicContact CE1-CD1 3.87Å; F215-L269 HydrophobicContact CZ-CD1 4.32Å; L229-L269 HydrophobicContact CD2-CD1 4.25Å; L236-L269 HydrophobicContact CD1-CD1 4.4Å; L236-L269 HydrophobicContact CD2-CB 3.77Å; L236-L269 HydrophobicContact CD2-CD1 4.36Å; L244-L269 HydrophobicContact CD2-CB 4.03Å; S247-L269 WeakPolarHBondContact CB-O 3.44Å; F248-L269 HydrophobicContact CB-CD2 3.86Å; F248-L269 HydrophobicContact CD2-CD2 4.09Å; L251-L269 HydrophobicContact CD1-CD2 4.36Å; I262-L269 HydrophobicContact CG2-CD1 3.87Å; I262-L269 HydrophobicContact CG2-CD2 3.92Å; I262-L269 HydrophobicContact CG2-CG 3.84Å; P266-L269 WeakPolarHBondContact O-CB 3.47Å; P266-L269 PolarHBondContact O-N 3.03Å; P266-L269 VanDerWaalsContact O-N 3.09Å; R267-L269 PolarHBondContact O-N 3.47Å; R267-L269 VanDerWaalsContact O-N 3.12Å
270	R	97.9	Very high	97.6	Very high	53 Å²	53	41.8 Å²	41.8	20%	0.2	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-94.9	-9.5	176	-58.3	-165.1	-58.5	-124.9	-15.2	114.1	D233 L236 T239 L244 R267 C268	D233-R270 IonicContact OD1-CZ 2.83Å; D233-R270 IonicContact OD1-NH1 3.19Å; D233-R270 PolarHBondContact OD1-NH1 2.91Å; D233-R270 IonicContact OD1-NH2 2.76Å; D233-R270 IonicContact OD2-CZ 3.45Å; D233-R270 IonicContact OD2-NE 3.58Å; D233-R270 IonicContact OD2-NH1 2.75Å; D233-R270 PolarHBondContact OD2-NH1 3.33Å; D233-R270 IonicContact OD2-NH2 3.64Å; D233-R270 PolarHBondContact OD2-NH2 3.27Å; L236-R270 HydrophobicContact CD2-CG 3.54Å; T239-R270 HydrophobicContact CG2-CG 4.22Å; T239-R270 WeakPolarHBondContact OG1-CD 3.48Å; L244-R270 HydrophobicContact CD2-CG 4.44Å; R267-R270 PolarHBondContact O-N 3.21Å; C268-R270 PolarHBondContact O-N 3.1Å
271	E	97.7	Very high	97.6	Very high	25 Å²	25	39.7 Å²	39.7	12%	0.117	18%	0.183	C	C	.	.	S	Bend	trans	-70	145.8	175.1	-62.6	-63.3	146.5	0	0	108.3	S247 R267 C268 K275 I276 L305	S247-E271 PolarHBondContact OG-O 2.98Å; R267-E271 IonicContact NE-OE1 2.73Å; C268-E271 WeakPolarHBondContact O-CB 3.46Å; C268-E271 PolarHBondContact O-N 3.38Å; E271-K275 WeakPolarHBondContact OE2-CD 3.48Å; E271-K275 WeakPolarHBondContact OE2-CE 3.39Å; E271-K275 IonicContact OE2-NZ 3.01Å; E271-K275 PolarHBondContact OE2-NZ 3.39Å; E271-I276 HydrophobicContact CB-CD1 4.2Å; E271-I276 HydrophobicContact CB-CG1 4.07Å; E271-L305 HydrophobicContact CG-CB 4.31Å; E271-L305 HydrophobicContact CG-CD1 4.49Å
272	K	96.8	Very high	97.6	Very high	146 Å²	146	38.3 Å²	38.3	64%	0.635	17%	0.173	S	C	*	.			trans	-68	138.9	178.8	-66.3	-174.9	178.4	-174.8	0	110.2	Q274 K275 I276	K272-Q274 PolarHBondContact O-N 3.2Å; K272-Q274 VanDerWaalsContact O-N 3.15Å; K272-K275 WeakPolarHBondContact O-CB 3.46Å; K272-K275 PolarHBondContact O-N 3.07Å; K272-I276 PolarHBondContact O-N 2.99Å
273	K	97.5	Very high	97.5	Very high	82 Å²	82	38.3 Å²	38.3	36%	0.357	17%	0.173	S	C	.	.	H	α-helix	trans	-48.4	-43.7	175.7	178.6	-173.2	169	-169.7	0	112.2	N246 Y250 K275 I276 E277	N246-K273 HydrophobicContact CB-CB 4.09Å; N246-K273 HydrophobicContact CB-CD 4.27Å; Y250-K273 HydrophobicContact CD2-CG 4.45Å; K273-K275 VanDerWaalsContact C-N 3.29Å; K273-K275 PolarHBondContact O-N 3.2Å; K273-I276 PolarHBondContact O-N 2.93Å; K273-I276 VanDerWaalsContact O-N 3.11Å; K273-E277 WeakPolarHBondContact CE-OE2 3.39Å; K273-E277 VanDerWaalsContact O-CB 3.27Å; K273-E277 WeakPolarHBondContact O-CB 3.22Å; K273-E277 PolarHBondContact O-N 2.83Å
274	Q	96.7	Very high	97.4	Very high	110 Å²	110	44.4 Å²	44.4	51%	0.514	20%	0.2	S	C	.	.	H	α-helix	trans	-57	-41.3	-180	-61.3	85.6	-14.9	0	0	112.1	K272 A278	K272-Q274 PolarHBondContact O-N 3.2Å; K272-Q274 VanDerWaalsContact O-N 3.15Å; Q274-A278 VanDerWaalsContact O-CB 3.25Å; Q274-A278 WeakPolarHBondContact O-CB 3.47Å; Q274-A278 PolarHBondContact O-N 2.87Å
275	K	97.1	Very high	97.4	Very high	53 Å²	53	47.2 Å²	47.2	23%	0.23	21%	0.21	C	C	.	.	H	α-helix	trans	-67.5	-44.7	176.6	178	-178.9	171.2	-172.7	0	111.3	E271 K272 K273 E277 R279 L305	E271-K275 WeakPolarHBondContact OE2-CD 3.48Å; E271-K275 WeakPolarHBondContact OE2-CE 3.39Å; E271-K275 IonicContact OE2-NZ 3.01Å; E271-K275 PolarHBondContact OE2-NZ 3.39Å; K272-K275 WeakPolarHBondContact O-CB 3.46Å; K272-K275 PolarHBondContact O-N 3.07Å; K273-K275 VanDerWaalsContact C-N 3.29Å; K273-K275 PolarHBondContact O-N 3.2Å; K275-E277 VanDerWaalsContact C-N 3.34Å; K275-R279 WeakPolarHBondContact O-CB 3.32Å; K275-R279 WeakPolarHBondContact O-CG 3.45Å; K275-R279 PolarHBondContact O-N 3.36Å; K275-R279 VanDerWaalsContact O-N 3.14Å; K275-L305 WeakPolarHBondContact CE-O 3.25Å; K275-L305 PolarHBondContact NZ-O 3.49Å
276	I	98.3	Very high	97.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-48.4	179	-58	167.4	0	0	0	109.9	Y250 L251 I255 E271 K272 K273 H280 M304 L305	Y250-I276 HydrophobicContact CD1-CB 4.42Å; Y250-I276 HydrophobicContact CD1-CG2 3.62Å; Y250-I276 HydrophobicContact CE1-CG2 4.16Å; L251-I276 HydrophobicContact CD1-CD1 4.13Å; L251-I276 HydrophobicContact CD2-CD1 4.39Å; L251-I276 HydrophobicContact CD2-CG2 3.53Å; L251-I276 HydrophobicContact CG-CD1 4.14Å; L251-I276 HydrophobicContact CG-CG2 4.08Å; I255-I276 HydrophobicContact CD1-CG2 4.16Å; E271-I276 HydrophobicContact CB-CD1 4.2Å; E271-I276 HydrophobicContact CB-CG1 4.07Å; K272-I276 PolarHBondContact O-N 2.99Å; K273-I276 PolarHBondContact O-N 2.93Å; K273-I276 VanDerWaalsContact O-N 3.11Å; I276-H280 VanDerWaalsContact O-CB 3.29Å; I276-H280 WeakPolarHBondContact O-CB 3.21Å; I276-H280 PolarHBondContact O-N 3.27Å; I276-M304 HydrophobicContact CG2-CE 4.43Å; I276-L305 HydrophobicContact CB-CD2 4.16Å; I276-L305 HydrophobicContact CG1-CD1 4.13Å; I276-L305 HydrophobicContact CG1-CD2 3.78Å; I276-L305 HydrophobicContact CG2-CD2 4.33Å
277	E	97.8	Very high	96.9	Very high	44 Å²	44	59.7 Å²	59.7	21%	0.206	26%	0.264	C	S	.	.	H	α-helix	trans	-63.9	-47.4	-178.5	176	165.5	-173.8	0	0	112.5	Y250 K273 K275 R279 H280 K281	Y250-E277 HydrophobicContact CD2-CB 4.22Å; Y250-E277 HydrophobicContact CE1-CB 4.14Å; Y250-E277 HydrophobicContact CE2-CB 3.69Å; Y250-E277 HydrophobicContact CE2-CG 3.62Å; K273-E277 WeakPolarHBondContact CE-OE2 3.39Å; K273-E277 VanDerWaalsContact O-CB 3.27Å; K273-E277 WeakPolarHBondContact O-CB 3.22Å; K273-E277 PolarHBondContact O-N 2.83Å; K275-E277 VanDerWaalsContact C-N 3.34Å; E277-R279 PolarHBondContact O-N 2.92Å; E277-H280 PolarHBondContact O-N 2.94Å; E277-K281 HydrophobicContact CG-CD 3.97Å; E277-K281 HydrophobicContact CG-CG 4.38Å; E277-K281 VanDerWaalsContact O-CB 3.32Å; E277-K281 WeakPolarHBondContact O-CB 3.38Å; E277-K281 VanDerWaalsContact O-CG 3.31Å; E277-K281 WeakPolarHBondContact O-CG 3.28Å; E277-K281 PolarHBondContact O-N 3.03Å; E277-K281 WeakPolarHBondContact OE1-CE 3.24Å; E277-K281 IonicContact OE1-NZ 3.81Å; E277-K281 PolarHBondContact OE1-NZ 3.11Å
278	A	97	Very high	96.7	Very high	7 Å²	7	59.4 Å²	59.4	6%	0.058	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-47.7	178	0	0	0	0	0	112.1	Q274 K281 W282 F327 L328	Q274-A278 VanDerWaalsContact O-CB 3.25Å; Q274-A278 WeakPolarHBondContact O-CB 3.47Å; Q274-A278 PolarHBondContact O-N 2.87Å; A278-K281 PolarHBondContact O-N 3.19Å; A278-W282 WeakPolarHBondContact O-CB 3.16Å; A278-W282 PolarHBondContact O-N 3.28Å; A278-F327 WeakPolarHBondContact O-CE1 3.36Å; A278-L328 HydrophobicContact CB-CD2 3.49Å; A278-L328 VanDerWaalsContact CB-CD2 3.49Å
279	R	97.7	Very high	96.6	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66	-42.5	-180	-69.4	-169.2	179.8	-170.5	-1.7	111.9	K275 E277 W282 L283 M304 L305 N306 G307 S308 D309 F312 Y324	K275-R279 WeakPolarHBondContact O-CB 3.32Å; K275-R279 WeakPolarHBondContact O-CG 3.45Å; K275-R279 PolarHBondContact O-N 3.36Å; K275-R279 VanDerWaalsContact O-N 3.14Å; E277-R279 PolarHBondContact O-N 2.92Å; R279-W282 PolarHBondContact O-N 3.44Å; R279-L283 WeakPolarHBondContact O-CG 3.29Å; R279-L283 PolarHBondContact O-N 3.39Å; R279-M304 HydrophobicContact CB-CG 4.19Å; R279-M304 WeakPolarHBondContact CD-O 3.47Å; R279-M304 PolarHBondContact NH1-O 3.3Å; R279-L305 VanDerWaalsContact NH1-C 3.33Å; R279-L305 PolarHBondContact NH1-O 3.17Å; R279-N306 PolarHBondContact NH1-O 2.94Å; R279-G307 PolarHBondContact NH2-O 3.36Å; R279-G307 VanDerWaalsContact NH2-O 3.12Å; R279-S308 PolarHBondContact NH2-O 3.26Å; R279-D309 IonicContact CZ-OD1 3.55Å; R279-D309 IonicContact NE-OD1 3.86Å; R279-D309 PolarHBondContact NE-OD1 2.8Å; R279-D309 IonicContact NH2-OD1 2.62Å; R279-D309 PolarHBondContact NH2-OD1 2.74Å; R279-F312 HydrophobicContact CB-CE1 4.17Å; R279-F312 HydrophobicContact CB-CE2 3.87Å; R279-F312 HydrophobicContact CB-CZ 3.64Å; R279-F312 HydrophobicContact CG-CD1 4.05Å; R279-F312 HydrophobicContact CG-CD2 4.22Å; R279-F312 HydrophobicContact CG-CE1 3.8Å; R279-F312 HydrophobicContact CG-CE2 3.97Å; R279-F312 HydrophobicContact CG-CG 4.25Å; R279-F312 HydrophobicContact CG-CZ 3.75Å; R279-Y324 VanDerWaalsContact CG-OH 3.24Å; R279-Y324 WeakPolarHBondContact CG-OH 3.41Å
280	H	97.5	Very high	96.4	Very high	10 Å²	10	64.6 Å²	64.6	5%	0.046	29%	0.289	C	S	.	.	H	α-helix	trans	-62.8	-50.4	175.7	172.1	-134.2	0	0	0	112.1	Y250 I255 I276 E277 W282 L283 K284 F291 M304	Y250-H280 HydrophobicContact CE1-CB 4Å; Y250-H280 AromaticContact CE1-ND1 3.46Å; Y250-H280 WeakPolarHBondContact CE1-ND1 3.42Å; Y250-H280 AromaticContact CZ-ND1 3.61Å; Y250-H280 PolarHBondContact OH-ND1 3.17Å; I255-H280 HydrophobicContact CD1-CB 3.98Å; I276-H280 VanDerWaalsContact O-CB 3.29Å; I276-H280 WeakPolarHBondContact O-CB 3.21Å; I276-H280 PolarHBondContact O-N 3.27Å; E277-H280 PolarHBondContact O-N 2.94Å; H280-W282 VanDerWaalsContact C-N 3.27Å; H280-W282 PolarHBondContact O-N 3.35Å; H280-L283 PolarHBondContact O-N 3.47Å; H280-K284 WeakPolarHBondContact O-CB 3.32Å; H280-K284 PolarHBondContact O-N 3.26Å; H280-F291 AromaticContact CD2-CE2 3.97Å; H280-M304 HydrophobicContact CB-SD 4.49Å
281	K	97.1	Very high	96.2	Very high	72 Å²	72	64 Å²	64	31%	0.313	29%	0.288	S	S	.	.	H	α-helix	trans	-58.4	-40.1	178.5	-76.5	178.9	-178.6	169.1	0	111.7	E277 A278 K284 L285 F327	E277-K281 HydrophobicContact CG-CD 3.97Å; E277-K281 HydrophobicContact CG-CG 4.38Å; E277-K281 VanDerWaalsContact O-CB 3.32Å; E277-K281 WeakPolarHBondContact O-CB 3.38Å; E277-K281 VanDerWaalsContact O-CG 3.31Å; E277-K281 WeakPolarHBondContact O-CG 3.28Å; E277-K281 PolarHBondContact O-N 3.03Å; E277-K281 WeakPolarHBondContact OE1-CE 3.24Å; E277-K281 IonicContact OE1-NZ 3.81Å; E277-K281 PolarHBondContact OE1-NZ 3.11Å; A278-K281 PolarHBondContact O-N 3.19Å; K281-K284 PolarHBondContact O-N 2.6Å; K281-L285 WeakPolarHBondContact O-CB 3.38Å; K281-L285 PolarHBondContact O-N 3.03Å; K281-F327 HydrophobicContact CB-CZ 3.81Å
282	W	96.7	Very high	96	Very high	10 Å²	10	65.3 Å²	65.3	4%	0.038	30%	0.296	C	S	.	.	H	α-helix	trans	-63.1	-50.1	175.3	179.8	-88.5	0	0	0	112.1	A278 R279 H280 K284 L285 F286 C319 A323 Y324 F327	A278-W282 WeakPolarHBondContact O-CB 3.16Å; A278-W282 PolarHBondContact O-N 3.28Å; R279-W282 PolarHBondContact O-N 3.44Å; H280-W282 VanDerWaalsContact C-N 3.27Å; H280-W282 PolarHBondContact O-N 3.35Å; W282-K284 VanDerWaalsContact C-N 3.27Å; W282-K284 PolarHBondContact O-N 3.04Å; W282-L285 WeakPolarHBondContact O-CB 3.34Å; W282-L285 PolarHBondContact O-N 2.99Å; W282-F286 HydrophobicContact CD2-CD2 4.05Å; W282-F286 AromaticContact CD2-CE2 3.79Å; W282-F286 HydrophobicContact CD2-CE2 3.79Å; W282-F286 AromaticContact CE2-CD2 3.66Å; W282-F286 AromaticContact CE2-CE2 3.42Å; W282-F286 VanDerWaalsContact CE2-CE2 3.42Å; W282-F286 AromaticContact CE3-CE2 3.97Å; W282-F286 HydrophobicContact CE3-CE2 3.97Å; W282-F286 HydrophobicContact CG-CD2 4.4Å; W282-F286 AromaticContact CH2-CE2 3.57Å; W282-F286 HydrophobicContact CH2-CE2 3.57Å; W282-F286 HydrophobicContact CH2-CZ 4.07Å; W282-F286 AromaticContact CZ2-CD2 3.97Å; W282-F286 HydrophobicContact CZ2-CD2 3.97Å; W282-F286 AromaticContact CZ2-CE2 3.32Å; W282-F286 HydrophobicContact CZ2-CE2 3.32Å; W282-F286 HydrophobicContact CZ2-CZ 4.02Å; W282-F286 AromaticContact CZ3-CE2 3.88Å; W282-F286 HydrophobicContact CZ3-CE2 3.88Å; W282-F286 AromaticContact NE1-CD2 3.72Å; W282-F286 AromaticContact NE1-CE2 3.98Å; W282-F286 WeakPolarHBondContact O-CD2 3.39Å; W282-F286 PolarHBondContact O-N 3.07Å; W282-C319 HydrophobicContact CZ2-CB 3.6Å; W282-C319 WeakPolarHBondContact CZ2-SG 3.33Å; W282-A323 HydrophobicContact CH2-CB 3.89Å; W282-A323 WeakPolarHBondContact CH2-O 3.41Å; W282-A323 WeakPolarHBondContact CZ3-O 3.31Å; W282-Y324 HydrophobicContact CB-CD2 4.13Å; W282-Y324 HydrophobicContact CB-CE2 3.84Å; W282-Y324 AromaticContact CD2-CD2 3.58Å; W282-Y324 HydrophobicContact CD2-CD2 3.58Å; W282-Y324 HydrophobicContact CD2-CE2 4.23Å; W282-Y324 AromaticContact CE3-CD2 3.73Å; W282-Y324 HydrophobicContact CE3-CD2 3.73Å; W282-Y324 HydrophobicContact CE3-CE2 4.47Å; W282-Y324 AromaticContact CG-CD2 3.75Å; W282-Y324 HydrophobicContact CG-CD2 3.75Å; W282-Y324 AromaticContact CG-CE2 3.96Å; W282-Y324 HydrophobicContact CG-CE2 3.96Å; W282-Y324 HydrophobicContact CZ3-CD2 4.35Å; W282-F327 HydrophobicContact CB-CE1 4.01Å; W282-F327 HydrophobicContact CB-CZ 4.25Å; W282-F327 HydrophobicContact CE3-CB 3.62Å; W282-F327 AromaticContact CE3-CD1 3.64Å; W282-F327 HydrophobicContact CE3-CD1 3.64Å; W282-F327 AromaticContact CE3-CD2 3.95Å; W282-F327 HydrophobicContact CE3-CD2 3.95Å; W282-F327 HydrophobicContact CE3-CE1 4.21Å; W282-F327 HydrophobicContact CE3-CE2 4.48Å; W282-F327 AromaticContact CE3-CG 3.48Å; W282-F327 HydrophobicContact CE3-CG 3.48Å; W282-F327 VanDerWaalsContact CE3-CG 3.48Å; W282-F327 HydrophobicContact CZ3-CB 3.4Å; W282-F327 VanDerWaalsContact CZ3-CB 3.4Å; W282-F327 HydrophobicContact CZ3-CD1 4.32Å; W282-F327 HydrophobicContact CZ3-CD2 4.35Å; W282-F327 AromaticContact CZ3-CG 3.82Å; W282-F327 HydrophobicContact CZ3-CG 3.82Å
283	L	97	Very high	95.7	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.4	-41.6	178.1	-69.1	177.3	0	0	0	111.4	R279 H280 L285 F286 K287 R288 D289 F291 V299 M304 F312 V316 A317	R279-L283 WeakPolarHBondContact O-CG 3.29Å; R279-L283 PolarHBondContact O-N 3.39Å; H280-L283 PolarHBondContact O-N 3.47Å; L283-L285 PolarHBondContact O-N 2.87Å; L283-F286 CarbonylContact O-C 3.16Å; L283-F286 PolarHBondContact O-N 3.02Å; L283-K287 PolarHBondContact O-N 3.13Å; L283-R288 HydrophobicContact CB-CB 4.4Å; L283-R288 HydrophobicContact CD2-CB 3.79Å; L283-R288 PolarHBondContact O-N 2.68Å; L283-D289 HydrophobicContact CB-CB 4.08Å; L283-F291 HydrophobicContact CD1-CZ 4.48Å; L283-V299 HydrophobicContact CD1-CG1 4.37Å; L283-M304 HydrophobicContact CD1-CG 4.03Å; L283-M304 HydrophobicContact CD1-SD 4.14Å; L283-F312 HydrophobicContact CD1-CE2 4.19Å; L283-F312 HydrophobicContact CD1-CZ 4.44Å; L283-F312 HydrophobicContact CD2-CE2 4.29Å; L283-F312 HydrophobicContact CD2-CZ 4.13Å; L283-F312 HydrophobicContact CG-CE2 4.23Å; L283-F312 HydrophobicContact CG-CZ 4.02Å; L283-V316 HydrophobicContact CD1-CG1 4.35Å; L283-V316 HydrophobicContact CD2-CG1 4.16Å; L283-A317 HydrophobicContact CD2-CB 4.13Å
284	K	96	Very high	95.5	Very high	127 Å²	127	67.8 Å²	67.8	55%	0.552	31%	0.312	S	S	*	.	H	α-helix	trans	-62.6	-41.1	176.6	-172.4	169.4	-175	171.8	0	112.6	H280 K281 W282 F286 K287 D289	H280-K284 WeakPolarHBondContact O-CB 3.32Å; H280-K284 PolarHBondContact O-N 3.26Å; K281-K284 PolarHBondContact O-N 2.6Å; W282-K284 VanDerWaalsContact C-N 3.27Å; W282-K284 PolarHBondContact O-N 3.04Å; K284-F286 PolarHBondContact O-N 3.28Å; K284-K287 PolarHBondContact O-N 3.23Å; K284-K287 VanDerWaalsContact O-N 3.14Å; K284-D289 HydrophobicContact CB-CB 4.35Å
285	L	95	Very high	95.4	Very high	112 Å²	112	67.6 Å²	67.6	59%	0.586	31%	0.31	S	S	*	.	H	α-helix	trans	-57.9	-37	176.6	-177.4	62.3	0	0	0	112	K281 W282 L283	K281-L285 WeakPolarHBondContact O-CB 3.38Å; K281-L285 PolarHBondContact O-N 3.03Å; W282-L285 WeakPolarHBondContact O-CB 3.34Å; W282-L285 PolarHBondContact O-N 2.99Å; L283-L285 PolarHBondContact O-N 2.87Å
286	F	93.8	Very high	95.1	Very high	109 Å²	109	70.2 Å²	70.2	48%	0.478	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	13.1	179.5	-65.8	-76.3	0	0	0	114.1	W282 L283 K284 R288	W282-F286 HydrophobicContact CD2-CD2 4.05Å; W282-F286 AromaticContact CD2-CE2 3.79Å; W282-F286 HydrophobicContact CD2-CE2 3.79Å; W282-F286 AromaticContact CE2-CD2 3.66Å; W282-F286 AromaticContact CE2-CE2 3.42Å; W282-F286 VanDerWaalsContact CE2-CE2 3.42Å; W282-F286 AromaticContact CE3-CE2 3.97Å; W282-F286 HydrophobicContact CE3-CE2 3.97Å; W282-F286 HydrophobicContact CG-CD2 4.4Å; W282-F286 AromaticContact CH2-CE2 3.57Å; W282-F286 HydrophobicContact CH2-CE2 3.57Å; W282-F286 HydrophobicContact CH2-CZ 4.07Å; W282-F286 AromaticContact CZ2-CD2 3.97Å; W282-F286 HydrophobicContact CZ2-CD2 3.97Å; W282-F286 AromaticContact CZ2-CE2 3.32Å; W282-F286 HydrophobicContact CZ2-CE2 3.32Å; W282-F286 HydrophobicContact CZ2-CZ 4.02Å; W282-F286 AromaticContact CZ3-CE2 3.88Å; W282-F286 HydrophobicContact CZ3-CE2 3.88Å; W282-F286 AromaticContact NE1-CD2 3.72Å; W282-F286 AromaticContact NE1-CE2 3.98Å; W282-F286 WeakPolarHBondContact O-CD2 3.39Å; W282-F286 PolarHBondContact O-N 3.07Å; L283-F286 CarbonylContact O-C 3.16Å; L283-F286 PolarHBondContact O-N 3.02Å; K284-F286 PolarHBondContact O-N 3.28Å; F286-R288 PolarHBondContact O-N 3.24Å
287	K	93.4	Very high	94.8	Very high	190 Å²	190	76.5 Å²	76.5	83%	0.826	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	38.1	-179.8	-55.2	-179.1	179.8	179.6	0	113.7	L283 K284	L283-K287 PolarHBondContact O-N 3.13Å; K284-K287 PolarHBondContact O-N 3.23Å; K284-K287 VanDerWaalsContact O-N 3.14Å
288	R	93.9	Very high	94.6	Very high	98 Å²	98	77.9 Å²	77.9	37%	0.37	37%	0.371	S	S	.	.			trans	-108.8	10.9	176.9	-68.4	-177.3	177.6	-84.7	-1.8	112.6	L283 F286 Q290 A317	L283-R288 HydrophobicContact CB-CB 4.4Å; L283-R288 HydrophobicContact CD2-CB 3.79Å; L283-R288 PolarHBondContact O-N 2.68Å; F286-R288 PolarHBondContact O-N 3.24Å; R288-Q290 PolarHBondContact O-N 3.41Å; R288-Q290 VanDerWaalsContact O-N 3.14Å; R288-A317 WeakPolarHBondContact CD-O 3.32Å; R288-A317 PolarHBondContact NE-O 2.91Å
289	D	94.2	Very high	94.5	Very high	52 Å²	52	78.3 Å²	78.3	28%	0.278	37%	0.373	S	S	.	.			trans	-83.4	39.7	179	60.7	-38.7	0	0	0	112.8	L283 K284 F291	L283-D289 HydrophobicContact CB-CB 4.08Å; K284-D289 HydrophobicContact CB-CB 4.35Å; D289-F291 HydrophobicContact CB-CE2 3.87Å; D289-F291 HydrophobicContact CB-CZ 4.17Å; D289-F291 VanDerWaalsContact O-CD2 3.31Å; D289-F291 WeakPolarHBondContact O-CD2 3.48Å; D289-F291 PolarHBondContact O-N 2.74Å
290	Q	95.1	Very high	94.4	Very high	57 Å²	57	80 Å²	80	27%	0.266	39%	0.385	S	S	.	.			trans	-82.8	104	176.5	-178.9	55.6	-96.4	0	0	110.3	R288 K295 F298 V299	R288-Q290 PolarHBondContact O-N 3.41Å; R288-Q290 VanDerWaalsContact O-N 3.14Å; Q290-K295 HydrophobicContact CG-CB 3.85Å; Q290-F298 CarbonylContact O-C 3.44Å; Q290-F298 WeakPolarHBondContact O-CA 3.38Å; Q290-V299 PolarHBondContact O-N 3.02Å
291	F	94.7	Very high	94.3	Very high	39 Å²	39	79.9 Å²	79.9	17%	0.171	39%	0.385	C	S	.	.			trans	-104.9	2.5	179.8	-54.7	-65.4	0	0	0	114.2	I255 F257 H280 L283 D289 F298 V299 M304	I255-F291 HydrophobicContact CG2-CD2 3.6Å; I255-F291 HydrophobicContact CG2-CE2 3.44Å; I255-F291 VanDerWaalsContact CG2-CE2 3.44Å; I255-F291 HydrophobicContact CG2-CG 4.5Å; I255-F291 HydrophobicContact CG2-CZ 4.22Å; F257-F291 HydrophobicContact CD1-CB 4.48Å; F257-F291 HydrophobicContact CE1-CB 3.54Å; F257-F291 AromaticContact CE1-CD1 3.82Å; F257-F291 HydrophobicContact CE1-CD1 3.82Å; F257-F291 AromaticContact CE1-CD2 3.75Å; F257-F291 HydrophobicContact CE1-CD2 3.75Å; F257-F291 HydrophobicContact CE1-CE1 4.46Å; F257-F291 HydrophobicContact CE1-CE2 4.39Å; F257-F291 AromaticContact CE1-CG 3.43Å; F257-F291 HydrophobicContact CE1-CG 3.43Å; F257-F291 VanDerWaalsContact CE1-CG 3.43Å; F257-F291 HydrophobicContact CZ-CB 4.28Å; F257-F291 AromaticContact CZ-CD1 3.67Å; F257-F291 HydrophobicContact CZ-CD1 3.67Å; F257-F291 HydrophobicContact CZ-CD2 4.11Å; F257-F291 AromaticContact CZ-CE1 3.96Å; F257-F291 HydrophobicContact CZ-CE1 3.96Å; F257-F291 HydrophobicContact CZ-CE2 4.35Å; F257-F291 AromaticContact CZ-CG 3.77Å; F257-F291 HydrophobicContact CZ-CG 3.77Å; F257-F291 HydrophobicContact CZ-CZ 4.28Å; H280-F291 AromaticContact CD2-CE2 3.97Å; L283-F291 HydrophobicContact CD1-CZ 4.48Å; D289-F291 HydrophobicContact CB-CE2 3.87Å; D289-F291 HydrophobicContact CB-CZ 4.17Å; D289-F291 VanDerWaalsContact O-CD2 3.31Å; D289-F291 WeakPolarHBondContact O-CD2 3.48Å; D289-F291 PolarHBondContact O-N 2.74Å; F291-F298 WeakPolarHBondContact O-CD2 3.5Å; F291-F298 WeakPolarHBondContact O-CE2 3.11Å; F291-V299 HydrophobicContact CD1-CB 4.33Å; F291-V299 WeakPolarHBondContact CD1-O 3.5Å; F291-V299 HydrophobicContact CE1-CB 4.32Å; F291-V299 HydrophobicContact CE1-CG1 4.35Å; F291-M304 HydrophobicContact CE1-SD 3.67Å; F291-M304 HydrophobicContact CZ-SD 3.65Å
292	D	92.5	Very high	94.3	Very high	53 Å²	53	80.5 Å²	80.5	28%	0.283	39%	0.389	S	S	.	.			trans	-80.4	117.9	172.8	-172	-19.5	0	0	0	110.1	T294 K295 F298	D292-T294 VanDerWaalsContact CG-OG1 3.25Å; D292-T294 PolarHBondContact O-N 3.14Å; D292-T294 VanDerWaalsContact O-N 3.12Å; D292-T294 WeakPolarHBondContact OD1-CB 3.45Å; D292-T294 PolarHBondContact OD1-N 3.37Å; D292-T294 PolarHBondContact OD1-OG1 3.46Å; D292-T294 PolarHBondContact OD2-OG1 2.92Å; D292-K295 HydrophobicContact CB-CB 4.22Å; D292-K295 HydrophobicContact CB-CD 3.87Å; D292-K295 HydrophobicContact CB-CG 4.05Å; D292-K295 PolarHBondContact O-N 2.62Å; D292-K295 VanDerWaalsContact O-N 3.13Å; D292-K295 WeakPolarHBondContact OD2-CD 3.31Å; D292-K295 WeakPolarHBondContact OD2-CE 3.46Å; D292-K295 IonicContact OD2-NZ 3.69Å; D292-K295 PolarHBondContact OD2-NZ 2.71Å; D292-F298 VanDerWaalsContact C-CD2 3.45Å; D292-F298 WeakPolarHBondContact O-CD2 3.26Å
293	R	91.1	Very high	94.2	Very high	158 Å²	158	81.9 Å²	81.9	60%	0.596	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.4	180	-72	178.7	-178	-175.4	1.8	113.5	S264 F298	S264-R293 PolarHBondContact OG-NH2 2.86Å; R293-F298 HydrophobicContact CB-CD2 4.45Å; R293-F298 HydrophobicContact CB-CE2 4.39Å; R293-F298 HydrophobicContact CB-CZ 4.46Å; R293-F298 HydrophobicContact CG-CD1 4.21Å; R293-F298 HydrophobicContact CG-CD2 4.02Å; R293-F298 HydrophobicContact CG-CE1 3.71Å; R293-F298 HydrophobicContact CG-CE2 3.51Å; R293-F298 HydrophobicContact CG-CG 4.35Å; R293-F298 HydrophobicContact CG-CZ 3.33Å
294	T	93.2	Very high	94.2	Very high	122 Å²	122	81.9 Å²	81.9	75%	0.748	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-8.7	-177.9	68.3	0	0	0	0	113.2	D292	D292-T294 VanDerWaalsContact CG-OG1 3.25Å; D292-T294 PolarHBondContact O-N 3.14Å; D292-T294 VanDerWaalsContact O-N 3.12Å; D292-T294 WeakPolarHBondContact OD1-CB 3.45Å; D292-T294 PolarHBondContact OD1-N 3.37Å; D292-T294 PolarHBondContact OD1-OG1 3.46Å; D292-T294 PolarHBondContact OD2-OG1 2.92Å
295	K	93.9	Very high	94.3	Very high	106 Å²	106	75.9 Å²	75.9	46%	0.461	38%	0.376	S	S	.	.	S	Bend	trans	-105.2	151.2	-174.5	-70	-179.8	-173.9	148	0	112.3	Q290 D292 F298	Q290-K295 HydrophobicContact CG-CB 3.85Å; D292-K295 HydrophobicContact CB-CB 4.22Å; D292-K295 HydrophobicContact CB-CD 3.87Å; D292-K295 HydrophobicContact CB-CG 4.05Å; D292-K295 PolarHBondContact O-N 2.62Å; D292-K295 VanDerWaalsContact O-N 3.13Å; D292-K295 WeakPolarHBondContact OD2-CD 3.31Å; D292-K295 WeakPolarHBondContact OD2-CE 3.46Å; D292-K295 IonicContact OD2-NZ 3.69Å; D292-K295 PolarHBondContact OD2-NZ 2.71Å; K295-F298 PolarHBondContact O-N 3.27Å
296	P	91.6	Very high	94.3	Very high	108 Å²	108	73.4 Å²	73.4	70%	0.701	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	150	175.3	26.9	-34.8	0	0	0	110.8	F298	P296-F298 VanDerWaalsContact C-N 3.25Å; P296-F298 PolarHBondContact O-N 3.36Å
297	N	90.6	Very high	94.3	Very high	132 Å²	132	69.9 Å²	69.9	71%	0.706	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	25.5	-175.5	-51.4	-54.9	0	0	0	114.4	V299	N297-V299 PolarHBondContact O-N 3.16Å
298	F	94.4	Very high	94.4	Very high	73 Å²	73	63.3 Å²	63.3	32%	0.32	34%	0.336	S	S	.	.			trans	-51	130.2	171.3	168.5	-113	0	0	0	112	Q290 F291 D292 R293 K295 P296 S300	Q290-F298 CarbonylContact O-C 3.44Å; Q290-F298 WeakPolarHBondContact O-CA 3.38Å; F291-F298 WeakPolarHBondContact O-CD2 3.5Å; F291-F298 WeakPolarHBondContact O-CE2 3.11Å; D292-F298 VanDerWaalsContact C-CD2 3.45Å; D292-F298 WeakPolarHBondContact O-CD2 3.26Å; R293-F298 HydrophobicContact CB-CD2 4.45Å; R293-F298 HydrophobicContact CB-CE2 4.39Å; R293-F298 HydrophobicContact CB-CZ 4.46Å; R293-F298 HydrophobicContact CG-CD1 4.21Å; R293-F298 HydrophobicContact CG-CD2 4.02Å; R293-F298 HydrophobicContact CG-CE1 3.71Å; R293-F298 HydrophobicContact CG-CE2 3.51Å; R293-F298 HydrophobicContact CG-CG 4.35Å; R293-F298 HydrophobicContact CG-CZ 3.33Å; K295-F298 PolarHBondContact O-N 3.27Å; P296-F298 VanDerWaalsContact C-N 3.25Å; P296-F298 PolarHBondContact O-N 3.36Å; F298-S300 VanDerWaalsContact CZ-CA 3.43Å
299	V	94.5	Very high	94.5	Very high	16 Å²	16	61 Å²	61	10%	0.097	33%	0.331	C	S	.	.			trans	-111.7	119.7	172.9	179.5	0	0	0	0	107.9	L283 Q290 F291 N297 A303 M304 V316	L283-V299 HydrophobicContact CD1-CG1 4.37Å; Q290-V299 PolarHBondContact O-N 3.02Å; F291-V299 HydrophobicContact CD1-CB 4.33Å; F291-V299 WeakPolarHBondContact CD1-O 3.5Å; F291-V299 HydrophobicContact CE1-CB 4.32Å; F291-V299 HydrophobicContact CE1-CG1 4.35Å; N297-V299 PolarHBondContact O-N 3.16Å; V299-A303 HydrophobicContact CG1-CB 4.33Å; V299-M304 HydrophobicContact CG1-CB 4.03Å; V299-V316 HydrophobicContact CG1-CG1 3.57Å; V299-V316 HydrophobicContact CG2-CG1 4.07Å
300	S	95.6	Very high	94.5	Very high	36 Å²	36	63.3 Å²	63.3	25%	0.252	34%	0.34	S	S	.	.			trans	-73.2	153.7	172.9	72	0	0	0	0	111.2	F298 E302 A303 M304	F298-S300 VanDerWaalsContact CZ-CA 3.43Å; S300-E302 PolarHBondContact O-N 3.04Å; S300-A303 PolarHBondContact O-N 3.47Å; S300-A303 VanDerWaalsContact O-N 3.09Å; S300-A303 WeakPolarHBondContact OG-CB 3.34Å; S300-A303 PolarHBondContact OG-N 2.73Å; S300-M304 PolarHBondContact O-N 2.74Å
301	I	96	Very high	94.6	Very high	7 Å²	7	63.2 Å²	63.2	4%	0.036	34%	0.344	C	S	.	.	H	α-helix	trans	-55.4	-37	173.3	-171	170.8	0	0	0	111.8	L251 F257 W265 C268 L305	L251-I301 HydrophobicContact CD1-CD1 4.34Å; L251-I301 HydrophobicContact CD2-CD1 4.04Å; L251-I301 HydrophobicContact CD2-CG1 4.49Å; F257-I301 HydrophobicContact CD2-CD1 3.6Å; F257-I301 HydrophobicContact CD2-CG1 4.21Å; F257-I301 HydrophobicContact CE2-CB 4.04Å; F257-I301 HydrophobicContact CE2-CD1 3.63Å; F257-I301 HydrophobicContact CE2-CG1 3.71Å; F257-I301 HydrophobicContact CZ-CB 4.48Å; W265-I301 HydrophobicContact CB-CG2 3.87Å; W265-I301 HydrophobicContact CE3-CG2 4.45Å; C268-I301 HydrophobicContact CB-CD1 3.44Å; C268-I301 VanDerWaalsContact CB-CD1 3.44Å; C268-I301 HydrophobicContact CB-CG1 3.86Å; C268-I301 WeakPolarHBondContact SG-CD1 3.22Å; I301-L305 HydrophobicContact CG1-CD1 3.9Å; I301-L305 WeakPolarHBondContact O-CB 3.43Å; I301-L305 WeakPolarHBondContact O-CG 3.43Å; I301-L305 PolarHBondContact O-N 3.09Å
302	E	96.8	Very high	94.7	Very high	86 Å²	86	61.4 Å²	61.4	40%	0.402	34%	0.336	S	S	.	.	H	α-helix	trans	-66.2	-47.3	174.9	177.1	166.5	-145.9	0	0	111.5	W265 S300 M304 L305 N306	W265-E302 HydrophobicContact CB-CB 4.4Å; W265-E302 HydrophobicContact CD2-CB 3.76Å; W265-E302 HydrophobicContact CD2-CG 4.1Å; W265-E302 HydrophobicContact CE3-CB 4.26Å; W265-E302 HydrophobicContact CG-CB 3.82Å; W265-E302 HydrophobicContact CG-CG 4.29Å; W265-E302 HydrophobicContact CZ2-CB 4.45Å; W265-E302 HydrophobicContact CZ2-CG 4.01Å; W265-E302 PolarHBondContact NE1-OE1 3.12Å; S300-E302 PolarHBondContact O-N 3.04Å; E302-M304 VanDerWaalsContact C-N 3.28Å; E302-M304 PolarHBondContact O-N 3.45Å; E302-L305 PolarHBondContact O-N 2.58Å; E302-N306 HydrophobicContact CG-CB 4.02Å; E302-N306 WeakPolarHBondContact O-CA 3.16Å; E302-N306 WeakPolarHBondContact O-CB 3.41Å; E302-N306 PolarHBondContact O-N 3.24Å
303	A	95.5	Very high	94.8	Very high	39 Å²	39	59 Å²	59	32%	0.322	32%	0.323	S	S	.	.	H	α-helix	trans	-59.7	-43.3	177.5	0	0	0	0	0	110.8	V299 S300 L305 V316	V299-A303 HydrophobicContact CG1-CB 4.33Å; S300-A303 PolarHBondContact O-N 3.47Å; S300-A303 VanDerWaalsContact O-N 3.09Å; S300-A303 WeakPolarHBondContact OG-CB 3.34Å; S300-A303 PolarHBondContact OG-N 2.73Å; A303-L305 PolarHBondContact O-N 3.09Å; A303-V316 HydrophobicContact CB-CG2 4.05Å; A303-V316 WeakPolarHBondContact O-CG2 3.37Å
304	M	96.4	Very high	95	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.1	-41.5	177.9	-176.2	177.4	71.7	0	0	112.2	L251 I255 F257 I276 R279 H280 L283 F291 V299 S300 E302 F312	L251-M304 HydrophobicContact CD2-CE 4.39Å; I255-M304 HydrophobicContact CD1-CE 4.01Å; F257-M304 HydrophobicContact CE2-CE 4.12Å; F257-M304 HydrophobicContact CZ-CE 4.33Å; I276-M304 HydrophobicContact CG2-CE 4.43Å; R279-M304 HydrophobicContact CB-CG 4.19Å; R279-M304 WeakPolarHBondContact CD-O 3.47Å; R279-M304 PolarHBondContact NH1-O 3.3Å; H280-M304 HydrophobicContact CB-SD 4.49Å; L283-M304 HydrophobicContact CD1-CG 4.03Å; L283-M304 HydrophobicContact CD1-SD 4.14Å; F291-M304 HydrophobicContact CE1-SD 3.67Å; F291-M304 HydrophobicContact CZ-SD 3.65Å; V299-M304 HydrophobicContact CG1-CB 4.03Å; S300-M304 PolarHBondContact O-N 2.74Å; E302-M304 VanDerWaalsContact C-N 3.28Å; E302-M304 PolarHBondContact O-N 3.45Å; M304-F312 HydrophobicContact CG-CE2 4.46Å; M304-F312 WeakPolarHBondContact O-CD2 3.22Å
305	L	97.1	Very high	95	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-109.6	-22.9	-165.2	-65.7	179.5	0	0	0	115.3	L251 W265 C268 E271 K275 I276 R279 I301 E302 A303	L251-L305 HydrophobicContact CD2-CD1 4.19Å; W265-L305 HydrophobicContact CH2-CB 4.01Å; W265-L305 HydrophobicContact CZ3-CB 3.65Å; W265-L305 HydrophobicContact CZ3-CD1 4.2Å; C268-L305 HydrophobicContact CB-CD1 3.71Å; E271-L305 HydrophobicContact CG-CB 4.31Å; E271-L305 HydrophobicContact CG-CD1 4.49Å; K275-L305 WeakPolarHBondContact CE-O 3.25Å; K275-L305 PolarHBondContact NZ-O 3.49Å; I276-L305 HydrophobicContact CB-CD2 4.16Å; I276-L305 HydrophobicContact CG1-CD1 4.13Å; I276-L305 HydrophobicContact CG1-CD2 3.78Å; I276-L305 HydrophobicContact CG2-CD2 4.33Å; R279-L305 VanDerWaalsContact NH1-C 3.33Å; R279-L305 PolarHBondContact NH1-O 3.17Å; I301-L305 HydrophobicContact CG1-CD1 3.9Å; I301-L305 WeakPolarHBondContact O-CB 3.43Å; I301-L305 WeakPolarHBondContact O-CG 3.43Å; I301-L305 PolarHBondContact O-N 3.09Å; E302-L305 PolarHBondContact O-N 2.58Å; A303-L305 PolarHBondContact O-N 3.09Å
306	N	95.4	Very high	95	Very high	60 Å²	60	49.6 Å²	49.6	32%	0.321	29%	0.291	S	S	.	.	S	Bend	trans	-72.7	155.6	180	-163.2	22.7	0	0	0	110.9	W265 R279 E302	W265-N306 HydrophobicContact CH2-CB 4.05Å; W265-N306 HydrophobicContact CZ2-CB 3.82Å; R279-N306 PolarHBondContact NH1-O 2.94Å; E302-N306 HydrophobicContact CG-CB 4.02Å; E302-N306 WeakPolarHBondContact O-CA 3.16Å; E302-N306 WeakPolarHBondContact O-CB 3.41Å; E302-N306 PolarHBondContact O-N 3.24Å
307	G	93.7	Very high	95	Very high	35 Å²	35	44.6 Å²	44.6	36%	0.361	26%	0.258	S	S	.	.	S	Bend	trans	72.5	-175.8	176.8	0	0	0	0	0	115.8	R279	R279-G307 PolarHBondContact NH2-O 3.36Å; R279-G307 VanDerWaalsContact NH2-O 3.12Å
308	S	95.8	Very high	95.1	Very high	53 Å²	53	44 Å²	44	37%	0.371	25%	0.25	S	C	.	.			trans	-82.1	173.1	179.6	73.7	0	0	0	0	112	R279 E310 T311 F312	R279-S308 PolarHBondContact NH2-O 3.26Å; S308-E310 VanDerWaalsContact C-N 3.28Å; S308-E310 WeakPolarHBondContact CB-OE2 3.36Å; S308-E310 PolarHBondContact O-N 3.32Å; S308-E310 PolarHBondContact OG-OE2 2.85Å; S308-T311 PolarHBondContact N-OG1 2.9Å; S308-T311 PolarHBondContact O-N 2.85Å; S308-T311 PolarHBondContact O-OG1 3.06Å; S308-F312 PolarHBondContact O-N 3.16Å
309	D	95.9	Very high	95.1	Very high	50 Å²	50	42.1 Å²	42.1	27%	0.267	25%	0.245	S	C	.	.	H	α-helix	trans	-69.2	-29.1	-179.4	-70.2	-16.4	0	0	0	112.2	R279 F312 C313 L321 Y324	R279-D309 IonicContact CZ-OD1 3.55Å; R279-D309 IonicContact NE-OD1 3.86Å; R279-D309 PolarHBondContact NE-OD1 2.8Å; R279-D309 IonicContact NH2-OD1 2.62Å; R279-D309 PolarHBondContact NH2-OD1 2.74Å; D309-F312 PolarHBondContact O-N 2.84Å; D309-C313 WeakPolarHBondContact O-CB 3.18Å; D309-C313 PolarHBondContact O-N 3.44Å; D309-C313 PolarHBondContact O-SG 2.98Å; D309-L321 HydrophobicContact CB-CD1 4.12Å; D309-Y324 HydrophobicContact CB-CD1 4.1Å; D309-Y324 HydrophobicContact CB-CE1 3.91Å
310	E	95.7	Very high	95.1	Very high	99 Å²	99	44.8 Å²	44.8	46%	0.463	26%	0.264	S	S	.	.	H	α-helix	trans	-59.9	-50.8	171.2	-59	74.8	-162.2	0	0	110.8	S308 F312 C313 S314 L321	S308-E310 VanDerWaalsContact C-N 3.28Å; S308-E310 WeakPolarHBondContact CB-OE2 3.36Å; S308-E310 PolarHBondContact O-N 3.32Å; S308-E310 PolarHBondContact OG-OE2 2.85Å; E310-F312 VanDerWaalsContact C-N 3.31Å; E310-F312 PolarHBondContact O-N 3.24Å; E310-C313 PolarHBondContact O-N 2.92Å; E310-S314 PolarHBondContact O-N 3Å; E310-S314 PolarHBondContact O-OG 3.45Å; E310-L321 HydrophobicContact CG-CD1 4.09Å; E310-L321 HydrophobicContact CG-CD2 3.77Å; E310-L321 HydrophobicContact CG-CG 4.46Å
311	T	95.5	Very high	95.1	Very high	55 Å²	55	45.4 Å²	45.4	34%	0.337	27%	0.265	S	S	.	.	H	α-helix	trans	-65.4	-36	-179.7	61.6	0	0	0	0	112.1	S308 S314 N315	S308-T311 PolarHBondContact N-OG1 2.9Å; S308-T311 PolarHBondContact O-N 2.85Å; S308-T311 PolarHBondContact O-OG1 3.06Å; T311-S314 PolarHBondContact O-OG 3.45Å; T311-N315 WeakPolarHBondContact O-CB 3.25Å; T311-N315 PolarHBondContact O-N 3.39Å
312	F	97	Very high	95.1	Very high	1 Å²	1	53.6 Å²	53.6	0%	0.004	30%	0.295	C	S	.	.	H	α-helix	trans	-64.3	-47.4	173.8	169.1	-106.4	0	0	0	111.5	R279 L283 M304 S308 D309 E310 V316 A317 Y324	R279-F312 HydrophobicContact CB-CE1 4.17Å; R279-F312 HydrophobicContact CB-CE2 3.87Å; R279-F312 HydrophobicContact CB-CZ 3.64Å; R279-F312 HydrophobicContact CG-CD1 4.05Å; R279-F312 HydrophobicContact CG-CD2 4.22Å; R279-F312 HydrophobicContact CG-CE1 3.8Å; R279-F312 HydrophobicContact CG-CE2 3.97Å; R279-F312 HydrophobicContact CG-CG 4.25Å; R279-F312 HydrophobicContact CG-CZ 3.75Å; L283-F312 HydrophobicContact CD1-CE2 4.19Å; L283-F312 HydrophobicContact CD1-CZ 4.44Å; L283-F312 HydrophobicContact CD2-CE2 4.29Å; L283-F312 HydrophobicContact CD2-CZ 4.13Å; L283-F312 HydrophobicContact CG-CE2 4.23Å; L283-F312 HydrophobicContact CG-CZ 4.02Å; M304-F312 HydrophobicContact CG-CE2 4.46Å; M304-F312 WeakPolarHBondContact O-CD2 3.22Å; S308-F312 PolarHBondContact O-N 3.16Å; D309-F312 PolarHBondContact O-N 2.84Å; E310-F312 VanDerWaalsContact C-N 3.31Å; E310-F312 PolarHBondContact O-N 3.24Å; F312-V316 HydrophobicContact CD2-CB 4.01Å; F312-V316 HydrophobicContact CD2-CG1 4.36Å; F312-V316 HydrophobicContact CD2-CG2 4.48Å; F312-V316 HydrophobicContact CE2-CB 4.23Å; F312-V316 HydrophobicContact CE2-CG1 4.14Å; F312-V316 WeakPolarHBondContact O-CA 3.33Å; F312-V316 WeakPolarHBondContact O-CB 3.35Å; F312-V316 PolarHBondContact O-N 3.39Å; F312-A317 HydrophobicContact CD1-CB 4.32Å; F312-A317 HydrophobicContact CE1-CB 3.86Å; F312-A317 HydrophobicContact CE2-CB 4.45Å; F312-A317 HydrophobicContact CZ-CB 3.94Å; F312-A317 PolarHBondContact O-N 3Å; F312-Y324 HydrophobicContact CD1-CE1 4.32Å; F312-Y324 HydrophobicContact CD1-CE2 4.35Å; F312-Y324 HydrophobicContact CE1-CD2 4.18Å; F312-Y324 AromaticContact CE1-CE2 3.75Å; F312-Y324 HydrophobicContact CE1-CE2 3.75Å; F312-Y324 AromaticContact CE1-CZ 3.93Å
313	C	96	Very high	95	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.014	29%	0.29	C	S	.	.	I	π-helix	trans	-62.1	-46.1	179.9	-69.5	0	0	0	0	112.1	D309 E310 K318 C319 Y324	D309-C313 WeakPolarHBondContact O-CB 3.18Å; D309-C313 PolarHBondContact O-N 3.44Å; D309-C313 PolarHBondContact O-SG 2.98Å; E310-C313 PolarHBondContact O-N 2.92Å; C313-K318 VanDerWaalsContact O-CA 3.28Å; C313-K318 WeakPolarHBondContact O-CA 3.49Å; C313-K318 PolarHBondContact O-N 3.06Å; C313-C319 PolarHBondContact O-N 3.29Å; C313-C319 VanDerWaalsContact O-N 3.09Å; C313-Y324 WeakPolarHBondContact SG-CB 3.41Å
314	S	94.1	Very high	95	Very high	62 Å²	62	49.5 Å²	49.5	43%	0.434	28%	0.276	S	S	.	.	I	π-helix	trans	-73.3	-43	-178	67.7	0	0	0	0	112.8	E310 T311 K318	E310-S314 PolarHBondContact O-N 3Å; E310-S314 PolarHBondContact O-OG 3.45Å; T311-S314 PolarHBondContact O-OG 3.45Å; S314-K318 WeakPolarHBondContact O-CD 3.42Å; S314-K318 PolarHBondContact O-NZ 3.4Å
315	N	93.1	Very high	95	Very high	106 Å²	106	53.3 Å²	53.3	57%	0.567	29%	0.293	S	S	*	.	I	π-helix	trans	-94.5	-31.4	-166.2	-60.8	-12.8	0	0	0	112.4	T311 K318	T311-N315 WeakPolarHBondContact O-CB 3.25Å; T311-N315 PolarHBondContact O-N 3.39Å; N315-K318 WeakPolarHBondContact O-CE 3.25Å; N315-K318 PolarHBondContact O-NZ 2.89Å
316	V	93.9	Very high	94.9	Very high	21 Å²	21	56.9 Å²	56.9	13%	0.127	31%	0.31	C	S	.	.	I	π-helix	trans	-115	-59	-172.6	-173.9	0	0	0	0	111.5	L283 V299 A303 F312 K318	L283-V316 HydrophobicContact CD1-CG1 4.35Å; L283-V316 HydrophobicContact CD2-CG1 4.16Å; V299-V316 HydrophobicContact CG1-CG1 3.57Å; V299-V316 HydrophobicContact CG2-CG1 4.07Å; A303-V316 HydrophobicContact CB-CG2 4.05Å; A303-V316 WeakPolarHBondContact O-CG2 3.37Å; F312-V316 HydrophobicContact CD2-CB 4.01Å; F312-V316 HydrophobicContact CD2-CG1 4.36Å; F312-V316 HydrophobicContact CD2-CG2 4.48Å; F312-V316 HydrophobicContact CE2-CB 4.23Å; F312-V316 HydrophobicContact CE2-CG1 4.14Å; F312-V316 WeakPolarHBondContact O-CA 3.33Å; F312-V316 WeakPolarHBondContact O-CB 3.35Å; F312-V316 PolarHBondContact O-N 3.39Å; V316-K318 VanDerWaalsContact C-N 3.31Å; V316-K318 PolarHBondContact O-N 3.48Å
317	A	93.1	Very high	94.9	Very high	3 Å²	3	55.4 Å²	55.4	3%	0.025	30%	0.301	C	S	.	.	I	π-helix	trans	-76.2	-19.7	-172.4	0	0	0	0	0	113.7	L283 R288 F312 C319	L283-A317 HydrophobicContact CD2-CB 4.13Å; R288-A317 WeakPolarHBondContact CD-O 3.32Å; R288-A317 PolarHBondContact NE-O 2.91Å; F312-A317 HydrophobicContact CD1-CB 4.32Å; F312-A317 HydrophobicContact CE1-CB 3.86Å; F312-A317 HydrophobicContact CE2-CB 4.45Å; F312-A317 HydrophobicContact CZ-CB 3.94Å; F312-A317 PolarHBondContact O-N 3Å; A317-C319 VanDerWaalsContact C-N 3.33Å; A317-C319 PolarHBondContact O-N 3.4Å
318	K	92.7	Very high	94.9	Very high	120 Å²	120	56.6 Å²	56.6	52%	0.522	30%	0.299	S	S	.	.			trans	53.7	47.6	-178.8	-53.3	-59	174.8	-171.3	0	112.3	C313 S314 N315 V316	C313-K318 VanDerWaalsContact O-CA 3.28Å; C313-K318 WeakPolarHBondContact O-CA 3.49Å; C313-K318 PolarHBondContact O-N 3.06Å; S314-K318 WeakPolarHBondContact O-CD 3.42Å; S314-K318 PolarHBondContact O-NZ 3.4Å; N315-K318 WeakPolarHBondContact O-CE 3.25Å; N315-K318 PolarHBondContact O-NZ 2.89Å; V316-K318 VanDerWaalsContact C-N 3.31Å; V316-K318 PolarHBondContact O-N 3.48Å
319	C	92.9	Very high	94.8	Very high	33 Å²	33	62.3 Å²	62.3	22%	0.223	32%	0.317	C	S	.	.	S	Bend	trans	-132.4	170.1	179.6	64.4	0	0	0	0	111.7	W282 C313 A317	W282-C319 HydrophobicContact CZ2-CB 3.6Å; W282-C319 WeakPolarHBondContact CZ2-SG 3.33Å; C313-C319 PolarHBondContact O-N 3.29Å; C313-C319 VanDerWaalsContact O-N 3.09Å; A317-C319 VanDerWaalsContact C-N 3.33Å; A317-C319 PolarHBondContact O-N 3.4Å
320	S	94.9	Very high	94.4	Very high	72 Å²	72	69.7 Å²	69.7	50%	0.503	34%	0.341	S	S	.	.			trans	-76.2	143.9	169.8	65.8	0	0	0	0	110.6	R322 A323 Y324	S320-R322 VanDerWaalsContact C-N 3.25Å; S320-R322 PolarHBondContact O-N 3Å; S320-A323 PolarHBondContact O-N 3.14Å; S320-A323 VanDerWaalsContact O-N 3.16Å; S320-A323 WeakPolarHBondContact OG-CB 3.39Å; S320-A323 PolarHBondContact OG-N 3.14Å; S320-Y324 PolarHBondContact O-N 3.39Å
321	L	95.4	Very high	93.4	Very high	50 Å²	50	71.3 Å²	71.3	26%	0.262	35%	0.349	S	S	.	.	H	α-helix	trans	-53.5	-45.6	175.4	178.8	67.3	0	0	0	111.5	D309 E310 A323 Y324 E325	D309-L321 HydrophobicContact CB-CD1 4.12Å; E310-L321 HydrophobicContact CG-CD1 4.09Å; E310-L321 HydrophobicContact CG-CD2 3.77Å; E310-L321 HydrophobicContact CG-CG 4.46Å; L321-A323 VanDerWaalsContact C-N 3.3Å; L321-A323 PolarHBondContact O-N 3.31Å; L321-Y324 WeakPolarHBondContact O-CB 3.28Å; L321-Y324 PolarHBondContact O-N 2.86Å; L321-E325 HydrophobicContact CD1-CG 4.34Å; L321-E325 HydrophobicContact CG-CG 4.19Å; L321-E325 WeakPolarHBondContact O-CG 3.3Å; L321-E325 PolarHBondContact O-N 2.87Å
322	R	95.9	Very high	93.3	Very high	178 Å²	178	72.2 Å²	72.2	67%	0.672	35%	0.349	S	S	*	.	H	α-helix	trans	-55.1	-43.1	179.1	-179.2	179.1	172.2	167	2.4	112.7	S320 Y324 E325 E326	S320-R322 VanDerWaalsContact C-N 3.25Å; S320-R322 PolarHBondContact O-N 3Å; R322-Y324 VanDerWaalsContact C-N 3.3Å; R322-Y324 PolarHBondContact O-N 2.64Å; R322-E325 PolarHBondContact O-N 3.15Å; R322-E326 IonicContact CZ-OE1 3.1Å; R322-E326 IonicContact NE-OE1 3.95Å; R322-E326 PolarHBondContact NE-OE1 3.29Å; R322-E326 IonicContact NH2-OE1 3.7Å; R322-E326 WeakPolarHBondContact O-CB 3.5Å; R322-E326 WeakPolarHBondContact O-CG 3.49Å; R322-E326 PolarHBondContact O-N 2.79Å
323	A	94.8	Very high	93.1	Very high	37 Å²	37	75.9 Å²	75.9	31%	0.306	37%	0.367	S	S	.	.	H	α-helix	trans	-65.8	-36.9	179.9	0	0	0	0	0	111.4	W282 S320 L321 F327	W282-A323 HydrophobicContact CH2-CB 3.89Å; W282-A323 WeakPolarHBondContact CH2-O 3.41Å; W282-A323 WeakPolarHBondContact CZ3-O 3.31Å; S320-A323 PolarHBondContact O-N 3.14Å; S320-A323 VanDerWaalsContact O-N 3.16Å; S320-A323 WeakPolarHBondContact OG-CB 3.39Å; S320-A323 PolarHBondContact OG-N 3.14Å; L321-A323 VanDerWaalsContact C-N 3.3Å; L321-A323 PolarHBondContact O-N 3.31Å; A323-F327 PolarHBondContact O-N 2.9Å
324	Y	96.2	Very high	92.9	Very high	3 Å²	3	80 Å²	80	1%	0.012	39%	0.387	C	S	.	.	H	α-helix	trans	-69.1	-43.7	175.2	-176.8	-113.3	0	0	0	112.1	R279 W282 D309 F312 C313 S320 L321 R322 E326 F327 L328	R279-Y324 VanDerWaalsContact CG-OH 3.24Å; R279-Y324 WeakPolarHBondContact CG-OH 3.41Å; W282-Y324 HydrophobicContact CB-CD2 4.13Å; W282-Y324 HydrophobicContact CB-CE2 3.84Å; W282-Y324 AromaticContact CD2-CD2 3.58Å; W282-Y324 HydrophobicContact CD2-CD2 3.58Å; W282-Y324 HydrophobicContact CD2-CE2 4.23Å; W282-Y324 AromaticContact CE3-CD2 3.73Å; W282-Y324 HydrophobicContact CE3-CD2 3.73Å; W282-Y324 HydrophobicContact CE3-CE2 4.47Å; W282-Y324 AromaticContact CG-CD2 3.75Å; W282-Y324 HydrophobicContact CG-CD2 3.75Å; W282-Y324 AromaticContact CG-CE2 3.96Å; W282-Y324 HydrophobicContact CG-CE2 3.96Å; W282-Y324 HydrophobicContact CZ3-CD2 4.35Å; D309-Y324 HydrophobicContact CB-CD1 4.1Å; D309-Y324 HydrophobicContact CB-CE1 3.91Å; F312-Y324 HydrophobicContact CD1-CE1 4.32Å; F312-Y324 HydrophobicContact CD1-CE2 4.35Å; F312-Y324 HydrophobicContact CE1-CD2 4.18Å; F312-Y324 AromaticContact CE1-CE2 3.75Å; F312-Y324 HydrophobicContact CE1-CE2 3.75Å; F312-Y324 AromaticContact CE1-CZ 3.93Å; C313-Y324 WeakPolarHBondContact SG-CB 3.41Å; S320-Y324 PolarHBondContact O-N 3.39Å; L321-Y324 WeakPolarHBondContact O-CB 3.28Å; L321-Y324 PolarHBondContact O-N 2.86Å; R322-Y324 VanDerWaalsContact C-N 3.3Å; R322-Y324 PolarHBondContact O-N 2.64Å; Y324-E326 VanDerWaalsContact C-N 3.34Å; Y324-E326 PolarHBondContact O-N 3.02Å; Y324-F327 HydrophobicContact CD2-CD1 4.2Å; Y324-F327 HydrophobicContact CE2-CD1 4.14Å; Y324-F327 HydrophobicContact CE2-CE1 4.3Å; Y324-F327 WeakPolarHBondContact O-CA 3.46Å; Y324-F327 WeakPolarHBondContact O-CB 3.42Å; Y324-F327 PolarHBondContact O-N 3.17Å; Y324-F327 VanDerWaalsContact O-N 3.09Å; Y324-L328 HydrophobicContact CD1-CD1 4.09Å; Y324-L328 HydrophobicContact CD1-CG 4.37Å; Y324-L328 HydrophobicContact CE1-CD1 3.7Å; Y324-L328 HydrophobicContact CE1-CD2 4.19Å; Y324-L328 HydrophobicContact CE1-CG 4.05Å; Y324-L328 HydrophobicContact CE2-CD2 4.29Å; Y324-L328 WeakPolarHBondContact O-CG 3.42Å; Y324-L328 PolarHBondContact O-N 2.98Å
325	E	95.5	Very high	92.9	Very high	80 Å²	80	81.1 Å²	81.1	37%	0.374	38%	0.384	S	S	.	.	H	α-helix	trans	-60.7	-40.9	175.3	-71	176.4	165.9	0	0	112.7	L321 R322 F327 L328 K329	L321-E325 HydrophobicContact CD1-CG 4.34Å; L321-E325 HydrophobicContact CG-CG 4.19Å; L321-E325 WeakPolarHBondContact O-CG 3.3Å; L321-E325 PolarHBondContact O-N 2.87Å; R322-E325 PolarHBondContact O-N 3.15Å; E325-F327 VanDerWaalsContact C-N 3.25Å; E325-F327 PolarHBondContact O-N 3.33Å; E325-L328 PolarHBondContact O-N 3.31Å; E325-K329 WeakPolarHBondContact O-CG 3.39Å; E325-K329 PolarHBondContact O-N 3.04Å; E325-K329 VanDerWaalsContact O-N 3.14Å
326	E	95.4	Very high	92.8	Very high	74 Å²	74	79.5 Å²	79.5	35%	0.346	37%	0.373	S	S	.	.	H	α-helix	trans	-62.8	-33.8	174.8	-76.2	177.9	-166	0	0	111.9	R322 Y324 R330	R322-E326 IonicContact CZ-OE1 3.1Å; R322-E326 IonicContact NE-OE1 3.95Å; R322-E326 PolarHBondContact NE-OE1 3.29Å; R322-E326 IonicContact NH2-OE1 3.7Å; R322-E326 WeakPolarHBondContact O-CB 3.5Å; R322-E326 WeakPolarHBondContact O-CG 3.49Å; R322-E326 PolarHBondContact O-N 2.79Å; Y324-E326 VanDerWaalsContact C-N 3.34Å; Y324-E326 PolarHBondContact O-N 3.02Å; E326-R330 WeakPolarHBondContact O-CG 3.28Å
327	F	95.1	Very high	92.8	Very high	30 Å²	30	83.4 Å²	83.4	13%	0.132	39%	0.389	C	S	.	.	H	α-helix	trans	-70.5	-40.8	172.6	160.7	-92.8	0	0	0	112.9	A278 K281 W282 A323 Y324 E325 K329 R330 Q331	A278-F327 WeakPolarHBondContact O-CE1 3.36Å; K281-F327 HydrophobicContact CB-CZ 3.81Å; W282-F327 HydrophobicContact CB-CE1 4.01Å; W282-F327 HydrophobicContact CB-CZ 4.25Å; W282-F327 HydrophobicContact CE3-CB 3.62Å; W282-F327 AromaticContact CE3-CD1 3.64Å; W282-F327 HydrophobicContact CE3-CD1 3.64Å; W282-F327 AromaticContact CE3-CD2 3.95Å; W282-F327 HydrophobicContact CE3-CD2 3.95Å; W282-F327 HydrophobicContact CE3-CE1 4.21Å; W282-F327 HydrophobicContact CE3-CE2 4.48Å; W282-F327 AromaticContact CE3-CG 3.48Å; W282-F327 HydrophobicContact CE3-CG 3.48Å; W282-F327 VanDerWaalsContact CE3-CG 3.48Å; W282-F327 HydrophobicContact CZ3-CB 3.4Å; W282-F327 VanDerWaalsContact CZ3-CB 3.4Å; W282-F327 HydrophobicContact CZ3-CD1 4.32Å; W282-F327 HydrophobicContact CZ3-CD2 4.35Å; W282-F327 AromaticContact CZ3-CG 3.82Å; W282-F327 HydrophobicContact CZ3-CG 3.82Å; A323-F327 PolarHBondContact O-N 2.9Å; Y324-F327 HydrophobicContact CD2-CD1 4.2Å; Y324-F327 HydrophobicContact CE2-CD1 4.14Å; Y324-F327 HydrophobicContact CE2-CE1 4.3Å; Y324-F327 WeakPolarHBondContact O-CA 3.46Å; Y324-F327 WeakPolarHBondContact O-CB 3.42Å; Y324-F327 PolarHBondContact O-N 3.17Å; Y324-F327 VanDerWaalsContact O-N 3.09Å; E325-F327 VanDerWaalsContact C-N 3.25Å; E325-F327 PolarHBondContact O-N 3.33Å; F327-K329 VanDerWaalsContact C-N 3.26Å; F327-K329 PolarHBondContact O-N 3.42Å; F327-R330 PolarHBondContact O-N 3.3Å; F327-R330 VanDerWaalsContact O-N 3.13Å; F327-Q331 HydrophobicContact CE1-CG 4.44Å; F327-Q331 HydrophobicContact CZ-CG 4.46Å
328	L	94.8	Very high	92.7	Very high	60 Å²	60	89.1 Å²	89.1	31%	0.314	42%	0.415	S	S	.	.	H	α-helix	trans	-60.6	-36.4	177.3	-67.7	-178.3	0	0	0	112.3	A278 Y324 E325 R330 Q331	A278-L328 HydrophobicContact CB-CD2 3.49Å; A278-L328 VanDerWaalsContact CB-CD2 3.49Å; Y324-L328 HydrophobicContact CD1-CD1 4.09Å; Y324-L328 HydrophobicContact CD1-CG 4.37Å; Y324-L328 HydrophobicContact CE1-CD1 3.7Å; Y324-L328 HydrophobicContact CE1-CD2 4.19Å; Y324-L328 HydrophobicContact CE1-CG 4.05Å; Y324-L328 HydrophobicContact CE2-CD2 4.29Å; Y324-L328 WeakPolarHBondContact O-CG 3.42Å; Y324-L328 PolarHBondContact O-N 2.98Å; E325-L328 PolarHBondContact O-N 3.31Å; L328-R330 PolarHBondContact O-N 2.97Å; L328-Q331 PolarHBondContact O-N 3.23Å
329	K	92.9	Very high	92.7	Very high	173 Å²	173	86.8 Å²	86.8	75%	0.752	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-15.1	178.5	-70	174.6	-174	175.3	0	114.2	E325 F327	E325-K329 WeakPolarHBondContact O-CG 3.39Å; E325-K329 PolarHBondContact O-N 3.04Å; E325-K329 VanDerWaalsContact O-N 3.14Å; F327-K329 VanDerWaalsContact C-N 3.26Å; F327-K329 PolarHBondContact O-N 3.42Å
330	R	87.9	Confident	92.7	Very high	204 Å²	204	91.3 Å²	91.3	77%	0.77	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-2.9	-178.2	-66.9	176.2	-176.5	159.6	5.5	113.4	E326 F327 L328	E326-R330 WeakPolarHBondContact O-CG 3.28Å; F327-R330 PolarHBondContact O-N 3.3Å; F327-R330 VanDerWaalsContact O-N 3.13Å; L328-R330 PolarHBondContact O-N 2.97Å
331	Q	74	Confident	92.5	Very high	134 Å²	134	93 Å²	93	63%	0.626	42%	0.415	S	S	*	.			trans	-85	0	-175.6	-70.5	-103.7	-34.5	0	0	112.8	F327 L328	F327-Q331 HydrophobicContact CE1-CG 4.44Å; F327-Q331 HydrophobicContact CZ-CG 4.46Å; L328-Q331 PolarHBondContact O-N 3.23Å

Retrieved 331 of 331 residues in 1492.9 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).