G4LUX9_SCHMA Loading...

Serine/threonine protein phosphatase 2A regulatory subunit

AlphaFold DB , UniProt , Accession G4LUX9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 627 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.3	Very low	32.1	Very low	247 Å²	247	133.2 Å²	133.2	100%	1.217	85%	0.85	S	S	*	*				0	141.6	0	-71.8	-165.5	-175.9	0	0	108
2	A	33.2	Very low	31.7	Very low	108 Å²	108	138.1 Å²	138.1	89%	0.893	85%	0.854	S	S	*	*			trans	77.8	112.8	179.2	0	0	0	0	0	117.3
3	S	30.9	Very low	32.1	Very low	125 Å²	125	140.5 Å²	140.5	87%	0.874	86%	0.855	S	S	*	*			trans	-89.1	163.9	-175.2	-41	0	0	0	0	112.5
4	G	38.2	Very low	31.8	Very low	79 Å²	79	141.9 Å²	141.9	81%	0.814	86%	0.855	S	S	*	*			trans	-168	100.3	166.9	0	0	0	0	0	112.8
5	N	34.5	Very low	32	Very low	166 Å²	166	139 Å²	139	89%	0.888	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-67	145.3	-175.3	-78.8	-22.7	0	0	0	114.5
6	S	29.7	Very low	31.9	Very low	117 Å²	117	137.4 Å²	137.4	82%	0.818	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-93.6	132.9	167.3	-173.4	0	0	0	0	110.7
7	V	32.3	Very low	32	Very low	124 Å²	124	136.6 Å²	136.6	75%	0.752	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-94.7	131.9	175.1	173.7	0	0	0	0	109.5	V9	V7-V9 HydrophobicContact CG1-CG2 4.23Å
8	I	29	Very low	32.1	Very low	151 Å²	151	136.2 Å²	136.2	77%	0.774	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-97.1	131.5	171.1	-64.7	174.5	0	0	0	107.7
9	V	31.7	Very low	31.9	Very low	126 Å²	126	134.8 Å²	134.8	76%	0.764	85%	0.845	S	S	*	*			trans	-118.9	112.5	169.4	179.4	0	0	0	0	108.8	V7	V7-V9 HydrophobicContact CG1-CG2 4.23Å
10	S	26.7	Very low	32	Very low	109 Å²	109	135.7 Å²	135.7	76%	0.762	85%	0.849	S	S	*	*			trans	-91.6	140	166.5	-59.7	0	0	0	0	109.2
11	S	33.1	Very low	31.9	Very low	113 Å²	113	136.8 Å²	136.8	79%	0.79	85%	0.848	S	S	*	*			trans	-133.5	116.7	166.3	36.9	0	0	0	0	110.1
12	Q	27.5	Very low	31.9	Very low	192 Å²	192	129.1 Å²	129.1	90%	0.897	82%	0.824	S	S	*	*			trans	-86.9	140.3	163.8	-76	176.6	-31.5	0	0	108.5
13	I	36.9	Very low	32	Very low	169 Å²	169	130.5 Å²	130.5	87%	0.867	82%	0.821	S	S	*	*			trans	-138.1	128.4	155.5	-56.9	-179.2	0	0	0	108.5
14	N	26.9	Very low	31.9	Very low	160 Å²	160	133 Å²	133	86%	0.856	82%	0.819	S	S	*	*			trans	-104.7	140	-178.2	-146.1	13.6	0	0	0	107.6
15	A	35.6	Very low	31.8	Very low	99 Å²	99	136.6 Å²	136.6	82%	0.818	82%	0.819	S	S	*	*			trans	-154.9	131.8	162.8	0	0	0	0	0	111.5
16	S	29.4	Very low	31.8	Very low	114 Å²	114	133.4 Å²	133.4	80%	0.797	81%	0.811	S	S	*	*			trans	-110	156.6	-168	31	0	0	0	0	112.1
17	S	34.7	Very low	31.8	Very low	124 Å²	124	132.6 Å²	132.6	87%	0.867	80%	0.803	S	S	*	*			trans	-179.4	159.4	146.2	-85.2	0	0	0	0	114
18	P	34.1	Very low	31.9	Very low	128 Å²	128	134.1 Å²	134.1	83%	0.831	80%	0.803	S	S	*	*			trans	-118.3	176.2	-140.2	40.1	-27.5	0	0	0	117.6
19	S	27.2	Very low	31.9	Very low	111 Å²	111	133.3 Å²	133.3	78%	0.776	80%	0.8	S	S	*	*			trans	-85.7	156.8	-176.8	59.3	0	0	0	0	116.4
20	V	33.5	Very low	32.1	Very low	151 Å²	151	132.3 Å²	132.3	92%	0.915	80%	0.798	S	S	*	*			trans	-137.2	140.3	160.3	179.5	0	0	0	0	110.1
21	L	30.8	Very low	32.5	Very low	160 Å²	160	134.8 Å²	134.8	84%	0.838	80%	0.801	S	S	*	*			trans	-133.5	143	-168	-143.8	156.2	0	0	0	108.9
22	A	34.1	Very low	32.6	Very low	85 Å²	85	133.4 Å²	133.4	70%	0.702	80%	0.797	S	S	*	*			trans	-160.9	110.3	161.6	0	0	0	0	0	115.2
23	T	34.4	Very low	33	Very low	137 Å²	137	132 Å²	132	84%	0.84	80%	0.795	S	S	*	*				77.2	136.8	128.7	51.6	0	0	0	0	125.3
24	E	30.9	Very low	33	Very low	177 Å²	177	129.4 Å²	129.4	83%	0.827	79%	0.791	S	S	*	*			trans	-94.4	168.3	-168.8	-55.4	166.8	127.8	0	0	115.6
25	N	35	Very low	33.3	Very low	155 Å²	155	129.1 Å²	129.1	83%	0.829	79%	0.79	S	S	*	*				177.5	122.8	122.6	-97.4	-28.4	0	0	0	117.3
26	S	34.5	Very low	33.2	Very low	100 Å²	100	129.5 Å²	129.5	70%	0.699	79%	0.787	S	S	*	*				80.4	116.1	120.2	-151.8	0	0	0	0	126.2
27	C	29.4	Very low	33.4	Very low	99 Å²	99	130.2 Å²	130.2	67%	0.669	79%	0.789	S	S	*	*				65.4	149.6	128.8	-66.8	0	0	0	0	122.5
28	Q	34	Very low	33.3	Very low	157 Å²	157	136.3 Å²	136.3	73%	0.734	79%	0.792	S	S	*	*			cis	-174.3	149.2	11.3	-113.7	166.8	28.5	0	0	112.6
29	N	30.6	Very low	33.2	Very low	133 Å²	133	138 Å²	138	71%	0.711	79%	0.789	S	S	*	*			trans	79.9	133.5	132.9	-71.6	-8.3	0	0	0	128.6
30	S	35.5	Very low	33.5	Very low	105 Å²	105	142 Å²	142	73%	0.734	80%	0.795	S	S	*	*			trans	96.3	144.4	139.1	-22.6	0	0	0	0	120.8
31	I	34	Very low	33.5	Very low	162 Å²	162	140.1 Å²	140.1	83%	0.831	78%	0.784	S	S	*	*			cis	-180	152.5	-22	-99.7	156.5	0	0	0	108.4
32	A	35.7	Very low	33.8	Very low	84 Å²	84	138.7 Å²	138.7	69%	0.694	78%	0.781	S	S	*	*			trans	79.8	149.2	153.4	0	0	0	0	0	122.2
33	L	35.3	Very low	33.9	Very low	163 Å²	163	139.8 Å²	139.8	85%	0.853	78%	0.781	S	S	*	*			cis	178.8	161.3	-26.6	-109.5	162.3	0	0	0	108.5
34	S	36.8	Very low	33.8	Very low	114 Å²	114	142.6 Å²	142.6	80%	0.797	79%	0.785	S	S	*	*			trans	86.9	143.3	160.7	78.9	0	0	0	0	119.8
35	D	33.3	Very low	34.1	Very low	153 Å²	153	137.6 Å²	137.6	82%	0.818	78%	0.781	S	S	*	*			cis	-173.4	161.5	-22.8	-151.5	-11.6	0	0	0	110
36	S	34.1	Very low	34.2	Very low	108 Å²	108	138.4 Å²	138.4	76%	0.755	78%	0.78	S	S	*	*			trans	87.9	116.9	160.3	-62	0	0	0	0	123.9
37	P	33.9	Very low	34.2	Very low	129 Å²	129	138.9 Å²	138.9	84%	0.838	79%	0.789	S	S	*	*			trans	-122.8	168.9	163.1	37.9	-23.7	0	0	0	115.2
38	R	32.4	Very low	34.7	Very low	251 Å²	251	141 Å²	141	95%	0.947	79%	0.789	S	S	*	*			trans	-126.6	139.3	174	-79.5	-174	177	-179.1	0	113.1
39	H	32.2	Very low	35.1	Very low	165 Å²	165	137.7 Å²	137.7	76%	0.764	78%	0.781	S	S	*	*			trans	-57.6	151.4	177.1	-82.6	-91.9	0	0	0	116.1
40	H	33.8	Very low	35.5	Very low	195 Å²	195	136.7 Å²	136.7	90%	0.903	78%	0.782	S	S	*	*				-165.1	158.9	123.3	-89	-56.8	0	0	0	111.6
41	T	33.2	Very low	35.7	Very low	110 Å²	110	136.8 Å²	136.8	68%	0.675	78%	0.78	S	S	*	*			trans	-122.9	145.4	-149	28.2	0	0	0	0	114
42	V	35.7	Very low	35.6	Very low	130 Å²	130	135.8 Å²	135.8	79%	0.788	78%	0.782	S	S	*	*			trans	81.8	153.2	136.5	171.2	0	0	0	0	118.9
43	P	36.9	Very low	35.4	Very low	108 Å²	108	139.5 Å²	139.5	70%	0.701	79%	0.785	S	S	*	*			cis	-135	172.4	-25.7	32.5	-12.4	0	0	0	117.1
44	H	33	Very low	35.2	Very low	197 Å²	197	139.6 Å²	139.6	91%	0.912	79%	0.785	S	S	*	*			trans	0.4	127	156.1	-75.5	-76.1	0	0	0	122.5
45	G	36.3	Very low	35	Very low	72 Å²	72	140.7 Å²	140.7	74%	0.742	78%	0.781	S	S	*	*			trans	-161.4	126.9	155.6	0	0	0	0	0	111.1
46	E	36.8	Very low	34.7	Very low	172 Å²	172	142.2 Å²	142.2	80%	0.804	78%	0.78	S	S	*	*			trans	39	101.1	161.7	-65.2	176	168.5	0	0	119.3	H48	E46-H48 PolarHBondContact O-N 3.38Å
47	A	35	Very low	34.8	Very low	109 Å²	109	143.8 Å²	143.8	90%	0.901	78%	0.779	S	S	*	*			trans	-76.1	87.1	172.5	0	0	0	0	0	111.5
48	H	40.5	Very low	34.6	Very low	143 Å²	143	143.8 Å²	143.8	66%	0.662	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-75.3	141.4	154.2	-70	-77.3	0	0	0	109.3	E46	E46-H48 PolarHBondContact O-N 3.38Å
49	P	42.7	Very low	34.5	Very low	89 Å²	89	137.2 Å²	137.2	58%	0.578	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-59.2	131.9	166.4	26.5	-30.9	0	0	0	107.5
50	P	38.8	Very low	34.7	Very low	111 Å²	111	137 Å²	137	72%	0.721	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-61.9	141.4	-176.5	27.3	-33.5	0	0	0	108.7	T52	P50-T52 PolarHBondContact O-N 2.96Å
51	P	38.4	Very low	34.6	Very low	108 Å²	108	133 Å²	133	70%	0.701	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-59.3	127	170	26.2	-30.6	0	0	0	106.7	Q53	P51-Q53 PolarHBondContact O-N 3.08Å
52	T	32.9	Very low	34.6	Very low	140 Å²	140	130.4 Å²	130.4	86%	0.859	77%	0.765	S	S	*	*			trans	-56.2	95.5	169.9	-53.1	0	0	0	0	107.1	P50 L54	P50-T52 PolarHBondContact O-N 2.96Å; T52-L54 PolarHBondContact O-N 2.81Å; T52-L54 VanDerWaalsContact O-N 3.12Å
53	Q	32.1	Very low	34.5	Very low	162 Å²	162	130.1 Å²	130.1	76%	0.757	77%	0.765	S	S	*	*			trans	-64.8	114.7	168.3	-69.7	-175.3	-1.6	0	0	105.2	P51 I55	P51-Q53 PolarHBondContact O-N 3.08Å; Q53-I55 PolarHBondContact O-N 2.68Å
54	L	30.4	Very low	34.1	Very low	166 Å²	166	130.1 Å²	130.1	87%	0.869	77%	0.768	S	S	*	*			trans	-49.4	99.6	159.4	-89.3	155	0	0	0	106.7	T52 K56	T52-L54 PolarHBondContact O-N 2.81Å; T52-L54 VanDerWaalsContact O-N 3.12Å; L54-K56 VanDerWaalsContact C-N 3.27Å; L54-K56 PolarHBondContact O-N 3.28Å
55	I	31.8	Very low	34.1	Very low	136 Å²	136	126.5 Å²	126.5	70%	0.697	76%	0.759	S	S	*	*			trans	-64.2	100.3	169.5	-65.9	172.4	0	0	0	104.4	Q53 L57	Q53-I55 PolarHBondContact O-N 2.68Å; I55-L57 HydrophobicContact CG2-CB 4.47Å; I55-L57 HydrophobicContact CG2-CD1 3.64Å; I55-L57 PolarHBondContact O-N 3.31Å
56	K	28.9	Very low	33.7	Very low	186 Å²	186	128.1 Å²	128.1	81%	0.809	76%	0.759	S	S	*	*			trans	-54.8	94.9	152.1	-93.7	177	173.8	172.8	0	105.8	L54 N58	L54-K56 VanDerWaalsContact C-N 3.27Å; L54-K56 PolarHBondContact O-N 3.28Å; K56-N58 PolarHBondContact O-N 3.25Å
57	L	34.2	Very low	33.5	Very low	140 Å²	140	129.1 Å²	129.1	73%	0.733	76%	0.756	S	S	*	*			trans	-72.5	77.9	171.2	-144.7	85.2	0	0	0	106.9	I55 S59	I55-L57 HydrophobicContact CG2-CB 4.47Å; I55-L57 HydrophobicContact CG2-CD1 3.64Å; I55-L57 PolarHBondContact O-N 3.31Å; L57-S59 PolarHBondContact O-N 3.42Å
58	N	31.2	Very low	33.3	Very low	130 Å²	130	134 Å²	134	70%	0.695	76%	0.756	S	S	*	*			trans	-64.2	116	163.5	-87.9	0	0	0	0	107.7	K56	K56-N58 PolarHBondContact O-N 3.25Å
59	S	29.9	Very low	33	Very low	113 Å²	113	134.1 Å²	134.1	79%	0.79	76%	0.757	S	S	*	*			trans	49.1	82.8	146.4	64.1	0	0	0	0	116.4	L57	L57-S59 PolarHBondContact O-N 3.42Å
60	L	36.4	Very low	32.7	Very low	159 Å²	159	138.2 Å²	138.2	83%	0.832	77%	0.766	S	S	*	*			trans	-117.9	109.4	153.8	-91.6	144.6	0	0	0	108.4	G62	L60-G62 PolarHBondContact O-N 2.91Å; L60-G62 VanDerWaalsContact O-N 3.09Å
61	A	31.3	Very low	32.9	Very low	112 Å²	112	139.5 Å²	139.5	93%	0.926	77%	0.766	S	S	*	*			trans	-64.7	99.8	-179.9	0	0	0	0	0	110.9
62	G	33.4	Very low	33.5	Very low	56 Å²	56	140.3 Å²	140.3	58%	0.577	76%	0.76	S	S	*	*			trans	-89.5	158.7	157.3	0	0	0	0	0	110.2	L60 S64	L60-G62 PolarHBondContact O-N 2.91Å; L60-G62 VanDerWaalsContact O-N 3.09Å; G62-S64 PolarHBondContact O-N 3.12Å
63	P	34.2	Very low	34.1	Very low	123 Å²	123	136.4 Å²	136.4	80%	0.799	74%	0.736	S	S	*	*			trans	-60.9	126.8	-161.1	26.8	-33.1	0	0	0	111	V65	P63-V65 VanDerWaalsContact C-N 3.34Å; P63-V65 PolarHBondContact O-N 3.28Å
64	S	27.1	Very low	35.2	Very low	108 Å²	108	129.8 Å²	129.8	76%	0.755	71%	0.708	S	S	*	*			trans	-57.2	93.1	172.1	55.5	0	0	0	0	110	G62 S66	G62-S64 PolarHBondContact O-N 3.12Å; S64-S66 PolarHBondContact O-N 3.49Å; S64-S66 VanDerWaalsContact O-N 3.13Å
65	V	33.4	Very low	36.4	Very low	122 Å²	122	122.9 Å²	122.9	74%	0.739	67%	0.674	S	S	*	*			trans	-82.7	74.2	156.5	-173.4	0	0	0	0	105.9	P63 R67	P63-V65 VanDerWaalsContact C-N 3.34Å; P63-V65 PolarHBondContact O-N 3.28Å; V65-R67 HydrophobicContact CG1-CB 4.49Å; V65-R67 PolarHBondContact O-N 2.8Å
66	S	29.5	Very low	37.3	Very low	105 Å²	105	123.9 Å²	123.9	73%	0.734	67%	0.668	S	S	*	*			trans	-67.9	77.7	163.2	41.3	0	0	0	0	107.9	S64 K68	S64-S66 PolarHBondContact O-N 3.49Å; S64-S66 VanDerWaalsContact O-N 3.13Å; S66-K68 VanDerWaalsContact C-N 3.35Å; S66-K68 PolarHBondContact O-N 3.36Å; S66-K68 VanDerWaalsContact O-N 3.15Å
67	R	31.9	Very low	38.3	Very low	194 Å²	194	122.3 Å²	122.3	73%	0.732	66%	0.662	S	S	*	*			trans	-74.1	98.7	161.1	-119.7	-174.2	-160.9	168.8	7.4	105.9	V65 E69	V65-R67 HydrophobicContact CG1-CB 4.49Å; V65-R67 PolarHBondContact O-N 2.8Å; R67-E69 HydrophobicContact CB-CG 4.36Å; R67-E69 PolarHBondContact O-N 3.37Å
68	K	29.7	Very low	38.9	Very low	210 Å²	210	119.1 Å²	119.1	91%	0.913	66%	0.663	S	S	*	*			trans	-64.9	78.5	169.1	-133.3	178	-175.1	178.5	0	107.3	S66 K70	S66-K68 VanDerWaalsContact C-N 3.35Å; S66-K68 PolarHBondContact O-N 3.36Å; S66-K68 VanDerWaalsContact O-N 3.15Å; K68-K70 PolarHBondContact O-N 3.32Å
69	E	35.9	Very low	39.8	Very low	147 Å²	147	114 Å²	114	69%	0.687	64%	0.638	S	S	*	*			trans	-74.4	123.4	175	-78.2	-178.9	177.8	0	0	108.4	R67 L71	R67-E69 HydrophobicContact CB-CG 4.36Å; R67-E69 PolarHBondContact O-N 3.37Å; E69-L71 PolarHBondContact O-N 3.06Å; E69-L71 VanDerWaalsContact O-N 3.11Å
70	K	35.1	Very low	40.8	Very low	174 Å²	174	112.8 Å²	112.8	76%	0.757	63%	0.628	S	S	*	*			trans	-60	113.1	179.6	-90.4	173	168.3	175.7	0	107.9	K68 H72	K68-K70 PolarHBondContact O-N 3.32Å; K70-H72 PolarHBondContact O-CD2 2.79Å; K70-H72 PolarHBondContact O-N 3.33Å; K70-H72 PolarHBondContact O-NE2 2.65Å
71	L	42.9	Very low	41.5	Very low	138 Å²	138	115.9 Å²	115.9	72%	0.723	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-53.6	122	165.7	-69.6	154.4	0	0	0	108.2	E69 V118	E69-L71 PolarHBondContact O-N 3.06Å; E69-L71 VanDerWaalsContact O-N 3.11Å; L71-V118 HydrophobicContact CB-CB 4.49Å; L71-V118 HydrophobicContact CB-CG1 3.17Å; L71-V118 HydrophobicContact CD1-CG1 4.44Å; L71-V118 HydrophobicContact CG-CG1 4.37Å; L71-V118 VanDerWaalsContact O-CG1 3.25Å; L71-V118 WeakPolarHBondContact O-CG1 3.48Å
72	H	52	Low	42.5	Very low	125 Å²	125	115.1 Å²	115.1	58%	0.579	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-95.9	152.2	-171.2	-75.7	-69.9	0	0	0	111.8	K70	K70-H72 PolarHBondContact O-CD2 2.79Å; K70-H72 PolarHBondContact O-N 3.33Å; K70-H72 PolarHBondContact O-NE2 2.65Å
73	T	44.2	Very low	44.2	Very low	59 Å²	59	115 Å²	115	36%	0.362	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-70.1	136.9	-170.5	175.3	0	0	0	0	113	S75 E116	T73-S75 PolarHBondContact O-N 3.08Å; T73-S75 VanDerWaalsContact O-N 3.14Å; T73-S75 PolarHBondContact OG1-N 3.13Å; T73-E116 PolarHBondContact OG1-OE1 3.31Å; T73-E116 VanDerWaalsContact OG1-OE1 3.07Å
74	S	56.3	Low	46.2	Very low	22 Å²	22	117.3 Å²	117.3	15%	0.154	61%	0.605	C	S	.	*	S	Bend	trans	-73.6	9.9	174.8	-25.5	0	0	0	0	113.3	R167 E190	S74-R167 VanDerWaalsContact O-CB 3.24Å; S74-R167 WeakPolarHBondContact O-CB 2.92Å; S74-R167 WeakPolarHBondContact O-CD 3.37Å; S74-E190 PolarHBondContact OG-OE1 3.25Å
75	S	56	Low	48.9	Very low	22 Å²	22	112.8 Å²	112.8	15%	0.154	57%	0.572	C	S	.	*			trans	-117.4	127.8	-179.2	-175.5	0	0	0	0	112.1	T73 F77	T73-S75 PolarHBondContact O-N 3.08Å; T73-S75 VanDerWaalsContact O-N 3.14Å; T73-S75 PolarHBondContact OG1-N 3.13Å; S75-F77 WeakPolarHBondContact CB-O 3.1Å; S75-F77 PolarHBondContact O-N 2.85Å; S75-F77 PolarHBondContact OG-N 2.97Å; S75-F77 PolarHBondContact OG-O 3.37Å
76	R	50.4	Low	51.4	Low	156 Å²	156	112.5 Å²	112.5	59%	0.589	57%	0.566	S	S	*	*	S	Bend	trans	-64.7	-21.2	174	-166.6	176.7	-175.3	-176.7	4.3	112.8
77	F	49.4	Very low	54.3	Low	154 Å²	154	112 Å²	112	68%	0.675	56%	0.561	S	S	*	*	S	Bend	trans	-122.7	124.9	-179.3	-60.5	-78.5	0	0	0	108.8	S75 A79	S75-F77 WeakPolarHBondContact CB-O 3.1Å; S75-F77 PolarHBondContact O-N 2.85Å; S75-F77 PolarHBondContact OG-N 2.97Å; S75-F77 PolarHBondContact OG-O 3.37Å; F77-A79 PolarHBondContact O-N 2.76Å; F77-A79 VanDerWaalsContact O-N 3.16Å
78	G	46.1	Very low	57.1	Low	72 Å²	72	105 Å²	105	74%	0.742	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-50.9	125.2	169.1	0	0	0	0	0	108.9
79	A	50.7	Low	60	Low	22 Å²	22	99 Å²	99	18%	0.182	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-57.9	142.7	-167.2	0	0	0	0	0	111.8	F77 R83	F77-A79 PolarHBondContact O-N 2.76Å; F77-A79 VanDerWaalsContact O-N 3.16Å; A79-R83 VanDerWaalsContact CB-NE 3.3Å
80	P	51.2	Low	62.6	Low	88 Å²	88	96.4 Å²	96.4	57%	0.571	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-58.7	143.6	174.2	23.2	-31.1	0	0	0	111.1	S82	P80-S82 PolarHBondContact O-N 3.05Å
81	K	51.2	Low	65.2	Low	225 Å²	225	88.1 Å²	88.1	98%	0.978	47%	0.474	S	S	*	.	S	Bend	trans	-63.1	-4.8	-172.2	-76.3	-177.8	175.7	179.5	0	115.9
82	S	52.4	Low	67.4	Low	96 Å²	96	86.1 Å²	86.1	67%	0.671	46%	0.46	S	S	*	.			trans	-116.2	95.7	173.8	65.8	0	0	0	0	110.3	P80	P80-S82 PolarHBondContact O-N 3.05Å
83	R	69.1	Low	69.1	Low	54 Å²	54	85.7 Å²	85.7	20%	0.204	46%	0.462	C	S	.	.			trans	-98.5	-2.7	179	-65.9	-175.9	-177.9	171.6	-0.1	114.1	A79 L85 F115 E116 D124	A79-R83 VanDerWaalsContact CB-NE 3.3Å; R83-L85 PolarHBondContact O-N 3.49Å; R83-F115 HydrophobicContact CB-CE1 4.13Å; R83-E116 IonicContact CZ-OE2 2.94Å; R83-E116 IonicContact NH1-OE2 3.64Å; R83-E116 VanDerWaalsContact NH2-CD 3.34Å; R83-E116 IonicContact NH2-OE1 2.86Å; R83-E116 IonicContact NH2-OE2 2.72Å; R83-E116 PolarHBondContact NH2-OE2 2.97Å; R83-D124 WeakPolarHBondContact CD-OD2 3.44Å; R83-D124 IonicContact CZ-OD2 3.53Å; R83-D124 IonicContact NH1-OD2 2.9Å; R83-D124 PolarHBondContact NH1-OD2 3.27Å
84	E	76	Confident	71	Confident	170 Å²	170	83.7 Å²	83.7	79%	0.794	45%	0.45	S	S	*	.			trans	-67.4	121.2	-177.2	-65.3	-175.2	179.2	0	0	110.8
85	L	83.4	Confident	72.2	Confident	13 Å²	13	89.8 Å²	89.8	7%	0.068	48%	0.481	C	S	.	.			trans	-109.8	123.8	177.7	-63.9	-171.4	0	0	0	109.9	R83 Q110 V113 F115 D127 V130 K131	R83-L85 PolarHBondContact O-N 3.49Å; L85-Q110 HydrophobicContact CD1-CG 4Å; L85-Q110 HydrophobicContact CD2-CG 3.95Å; L85-Q110 HydrophobicContact CG-CG 4.45Å; L85-V113 HydrophobicContact CD2-CB 4.3Å; L85-V113 HydrophobicContact CD2-CG2 4.06Å; L85-F115 HydrophobicContact CD1-CE2 3.69Å; L85-F115 HydrophobicContact CD1-CZ 3.54Å; L85-F115 HydrophobicContact CG-CZ 3.89Å; L85-D127 HydrophobicContact CB-CB 4.2Å; L85-D127 HydrophobicContact CG-CB 4.28Å; L85-D127 PolarHBondContact N-OD1 3.4Å; L85-V130 HydrophobicContact CB-CB 4.2Å; L85-V130 HydrophobicContact CB-CG1 3.87Å; L85-V130 HydrophobicContact CD1-CG1 4.46Å; L85-K131 HydrophobicContact CD1-CB 4.1Å
86	N	85.9	Confident	73.6	Confident	116 Å²	116	91.3 Å²	91.3	62%	0.62	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-91.5	130.9	168.3	-68.2	-45.6	0	0	0	109.6	L88 Q110	N86-L88 PolarHBondContact O-N 3.46Å; N86-Q110 PolarHBondContact O-NE2 3.06Å
87	P	89.4	Confident	75.3	Confident	95 Å²	95	88 Å²	88	62%	0.617	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-60.9	123	178	24.7	-32.7	0	0	0	110.4	V130	P87-V130 HydrophobicContact CB-CG1 4.41Å; P87-V130 HydrophobicContact CB-CG2 4.36Å
88	L	91.1	Very high	77.1	Confident	48 Å²	48	88 Å²	88	25%	0.251	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-79.7	149.8	175.6	-65.8	173.9	0	0	0	110.6	N86 Q106 K107 Q110	N86-L88 PolarHBondContact O-N 3.46Å; L88-Q106 HydrophobicContact CD1-CB 3.84Å; L88-K107 HydrophobicContact CB-CG 4.2Å; L88-K107 HydrophobicContact CD1-CB 4.49Å; L88-K107 HydrophobicContact CD1-CG 3.76Å; L88-K107 PolarHBondContact O-NZ 2.85Å; L88-K107 VanDerWaalsContact O-NZ 3.13Å; L88-Q110 HydrophobicContact CD1-CB 4.35Å
89	P	91.6	Very high	79.2	Confident	84 Å²	84	89.5 Å²	89.5	55%	0.545	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-52.6	157	176.1	-25	34.1	0	0	0	113.2	K107	P89-K107 WeakPolarHBondContact O-CE 2.91Å; P89-K107 PolarHBondContact O-NZ 2.9Å
90	L	91.1	Very high	81.1	Confident	92 Å²	92	91.8 Å²	91.8	48%	0.482	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-66.4	140.4	175.8	-63.2	173.2	0	0	0	110.3	K92 D93 E137	L90-K92 VanDerWaalsContact C-N 3.28Å; L90-K92 PolarHBondContact O-N 2.94Å; L90-D93 HydrophobicContact CB-CB 4.41Å; L90-D93 PolarHBondContact O-N 2.86Å; L90-E137 WeakPolarHBondContact CA-OE1 3.15Å
91	I	89.4	Confident	83	Confident	0 Å²	0	89.8 Å²	89.8	0%	0	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-63.8	-39.4	179.3	-59.4	159.6	0	0	0	109.7	D93 S94 R100 F104 K107 E137 L138 Y141	I91-D93 PolarHBondContact O-N 3.24Å; I91-S94 PolarHBondContact O-N 2.89Å; I91-R100 HydrophobicContact CG2-CB 4.06Å; I91-R100 HydrophobicContact CG2-CG 4.25Å; I91-F104 HydrophobicContact CD1-CD2 3.86Å; I91-K107 HydrophobicContact CD1-CD 3.89Å; I91-K107 HydrophobicContact CG1-CD 3.86Å; I91-E137 HydrophobicContact CD1-CG 4.35Å; I91-E137 PolarHBondContact N-OE1 2.98Å; I91-L138 HydrophobicContact CD1-CD2 4.2Å; I91-Y141 HydrophobicContact CB-CD2 4.16Å; I91-Y141 HydrophobicContact CB-CE2 4.23Å; I91-Y141 HydrophobicContact CB-CG 4.43Å; I91-Y141 HydrophobicContact CD1-CD1 4.3Å; I91-Y141 HydrophobicContact CD1-CG 4.16Å; I91-Y141 HydrophobicContact CG2-CD1 4.07Å; I91-Y141 HydrophobicContact CG2-CD2 3.89Å; I91-Y141 HydrophobicContact CG2-CE1 3.73Å; I91-Y141 HydrophobicContact CG2-CE2 3.55Å; I91-Y141 HydrophobicContact CG2-CG 4.14Å; I91-Y141 VanDerWaalsContact CG2-CZ 3.46Å
92	K	87.7	Confident	85	Confident	96 Å²	96	84.3 Å²	84.3	42%	0.417	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-62.3	-26.7	-178.7	-67.9	178.6	177.4	175.4	0	113	L90 S94 E140 Y141 E144	L90-K92 VanDerWaalsContact C-N 3.28Å; L90-K92 PolarHBondContact O-N 2.94Å; K92-S94 VanDerWaalsContact C-N 3.28Å; K92-S94 PolarHBondContact O-N 3.46Å; K92-E140 IonicContact NZ-OE1 3.39Å; K92-E140 PolarHBondContact NZ-OE1 2.67Å; K92-Y141 HydrophobicContact CG-CD2 4.11Å; K92-Y141 HydrophobicContact CG-CE2 4.27Å; K92-E144 WeakPolarHBondContact CE-OE2 3.03Å; K92-E144 IonicContact NZ-OE1 3.63Å; K92-E144 IonicContact NZ-OE2 2.68Å; K92-E144 PolarHBondContact NZ-OE2 3.25Å
93	D	87.9	Confident	87	Confident	115 Å²	115	80.6 Å²	80.6	62%	0.615	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-80.1	-5.8	-176.8	-64.8	-12.4	0	0	0	113.5	L90 I91	L90-D93 HydrophobicContact CB-CB 4.41Å; L90-D93 PolarHBondContact O-N 2.86Å; I91-D93 PolarHBondContact O-N 3.24Å
94	S	85	Confident	88.2	Confident	18 Å²	18	78.1 Å²	78.1	13%	0.126	40%	0.395	C	S	.	.			trans	-83.8	134.2	178.3	-72.1	0	0	0	0	112.8	I91 K92 R100 L103	I91-S94 PolarHBondContact O-N 2.89Å; K92-S94 VanDerWaalsContact C-N 3.28Å; K92-S94 PolarHBondContact O-N 3.46Å; S94-R100 VanDerWaalsContact O-CZ 3.32Å; S94-R100 PolarHBondContact O-NE 3.35Å; S94-R100 PolarHBondContact O-NH2 2.96Å; S94-L103 WeakPolarHBondContact OG-CD1 3.3Å
95	D	81	Confident	89.1	Confident	149 Å²	149	71.4 Å²	71.4	80%	0.797	36%	0.364	S	S	*	.	S	Bend	trans	-72.7	-31	-174.5	-59.4	-44.7	0	0	0	114.3
96	N	85	Confident	89.6	Confident	54 Å²	54	74.2 Å²	74.2	29%	0.289	38%	0.377	S	S	.	.	S	Bend	trans	-117	149.5	-173.8	68.7	-16.5	0	0	0	112.4	E98 K99 R100	N96-E98 VanDerWaalsContact C-N 3.25Å; N96-E98 PolarHBondContact O-N 2.95Å; N96-K99 PolarHBondContact O-N 2.97Å; N96-K99 WeakPolarHBondContact OD1-CB 3.37Å; N96-K99 WeakPolarHBondContact OD1-CD 3.46Å; N96-K99 WeakPolarHBondContact OD1-CG 3.35Å; N96-K99 PolarHBondContact OD1-N 3.32Å; N96-K99 VanDerWaalsContact OD1-N 3.08Å; N96-R100 WeakPolarHBondContact O-CG 3.44Å; N96-R100 PolarHBondContact O-N 2.96Å; N96-R100 VanDerWaalsContact O-N 3.12Å
97	Q	86.5	Confident	90.1	Very high	88 Å²	88	69 Å²	69	41%	0.411	35%	0.349	S	S	.	.	H	α-helix	trans	-60.4	-36.3	179	-172.3	65.5	11.9	0	0	112.2	R100 E101	Q97-R100 WeakPolarHBondContact O-CB 3.35Å; Q97-R100 PolarHBondContact O-N 2.67Å; Q97-E101 PolarHBondContact O-N 3.33Å
98	E	87.7	Confident	90.4	Very high	152 Å²	152	64.5 Å²	64.5	71%	0.71	32%	0.319	S	S	*	.	H	α-helix	trans	-64.7	-44.5	179.3	-65.8	176.7	173.7	0	0	112.8	N96 R100 E101 E102	N96-E98 VanDerWaalsContact C-N 3.25Å; N96-E98 PolarHBondContact O-N 2.95Å; E98-R100 VanDerWaalsContact C-N 3.31Å; E98-R100 PolarHBondContact O-N 2.64Å; E98-E101 PolarHBondContact O-N 2.99Å; E98-E102 WeakPolarHBondContact O-CB 2.96Å; E98-E102 PolarHBondContact O-N 3.39Å
99	K	89.8	Confident	90.6	Very high	105 Å²	105	67.3 Å²	67.3	46%	0.457	33%	0.33	S	S	.	.	H	α-helix	trans	-70.6	-30.5	175.3	-64.9	169.4	-169.8	175.9	0	111.4	N96 E102 L103	N96-K99 PolarHBondContact O-N 2.97Å; N96-K99 WeakPolarHBondContact OD1-CB 3.37Å; N96-K99 WeakPolarHBondContact OD1-CD 3.46Å; N96-K99 WeakPolarHBondContact OD1-CG 3.35Å; N96-K99 PolarHBondContact OD1-N 3.32Å; N96-K99 VanDerWaalsContact OD1-N 3.08Å; K99-E102 PolarHBondContact O-N 3.43Å; K99-L103 VanDerWaalsContact O-CB 3.3Å; K99-L103 WeakPolarHBondContact O-CB 3.17Å; K99-L103 WeakPolarHBondContact O-CG 3.33Å; K99-L103 PolarHBondContact O-N 2.82Å
100	R	91	Very high	90.7	Very high	70 Å²	70	64.4 Å²	64.4	26%	0.264	31%	0.309	S	S	.	.	H	α-helix	trans	-61.3	-45.7	173	-69.5	175.2	-171.9	176	0.2	110.8	I91 S94 N96 Q97 E98 F104 Y141	I91-R100 HydrophobicContact CG2-CB 4.06Å; I91-R100 HydrophobicContact CG2-CG 4.25Å; S94-R100 VanDerWaalsContact O-CZ 3.32Å; S94-R100 PolarHBondContact O-NE 3.35Å; S94-R100 PolarHBondContact O-NH2 2.96Å; N96-R100 WeakPolarHBondContact O-CG 3.44Å; N96-R100 PolarHBondContact O-N 2.96Å; N96-R100 VanDerWaalsContact O-N 3.12Å; Q97-R100 WeakPolarHBondContact O-CB 3.35Å; Q97-R100 PolarHBondContact O-N 2.67Å; E98-R100 VanDerWaalsContact C-N 3.31Å; E98-R100 PolarHBondContact O-N 2.64Å; R100-F104 VanDerWaalsContact O-CB 3.3Å; R100-F104 WeakPolarHBondContact O-CB 3.3Å; R100-F104 PolarHBondContact O-N 3.44Å; R100-Y141 WeakPolarHBondContact CD-OH 3.28Å
101	E	91.9	Very high	91	Very high	45 Å²	45	60 Å²	60	21%	0.21	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-44.7	174.2	-174.2	176	164.8	0	0	111.5	Q97 E98 F104 I105 I148 T150 S152 I153	Q97-E101 PolarHBondContact O-N 3.33Å; E98-E101 PolarHBondContact O-N 2.99Å; E101-F104 WeakPolarHBondContact O-CB 3.41Å; E101-F104 PolarHBondContact O-N 3.41Å; E101-I105 HydrophobicContact CG-CD1 4.29Å; E101-I105 WeakPolarHBondContact O-CG1 3.13Å; E101-I105 PolarHBondContact O-N 2.79Å; E101-I148 HydrophobicContact CB-CD1 4.45Å; E101-T150 PolarHBondContact OE1-OG1 3.22Å; E101-T150 WeakPolarHBondContact OE2-CG2 3.21Å; E101-S152 PolarHBondContact OE1-OG 3.49Å; E101-I153 HydrophobicContact CG-CD1 4.06Å
102	E	92.7	Very high	91.2	Very high	111 Å²	111	61.3 Å²	61.3	52%	0.519	30%	0.295	S	S	.	.	H	α-helix	trans	-61	-47.1	177.4	-169.8	-176	177.5	0	0	112.2	E98 K99 F104 I105 Q106	E98-E102 WeakPolarHBondContact O-CB 2.96Å; E98-E102 PolarHBondContact O-N 3.39Å; K99-E102 PolarHBondContact O-N 3.43Å; E102-F104 VanDerWaalsContact C-N 3.32Å; E102-F104 PolarHBondContact O-N 2.93Å; E102-I105 WeakPolarHBondContact O-CB 3.42Å; E102-I105 PolarHBondContact O-N 3.21Å; E102-Q106 VanDerWaalsContact O-CG 3.32Å; E102-Q106 WeakPolarHBondContact O-CG 3.3Å; E102-Q106 PolarHBondContact O-N 2.77Å; E102-Q106 PolarHBondContact OE1-NE2 3.44Å
103	L	93.2	Very high	91.5	Very high	18 Å²	18	58.3 Å²	58.3	9%	0.094	29%	0.285	C	S	.	.	H	α-helix	trans	-63.1	-38.5	175.9	-77.6	178.6	0	0	0	111.8	S94 K99 I105 Q106 K107	S94-L103 WeakPolarHBondContact OG-CD1 3.3Å; K99-L103 VanDerWaalsContact O-CB 3.3Å; K99-L103 WeakPolarHBondContact O-CB 3.17Å; K99-L103 WeakPolarHBondContact O-CG 3.33Å; K99-L103 PolarHBondContact O-N 2.82Å; L103-I105 VanDerWaalsContact C-N 3.34Å; L103-Q106 PolarHBondContact O-N 3.35Å; L103-K107 WeakPolarHBondContact O-CB 3.36Å; L103-K107 WeakPolarHBondContact O-CG 3.36Å; L103-K107 PolarHBondContact O-N 3.5Å
104	F	94.6	Very high	91.7	Very high	1 Å²	1	54.2 Å²	54.2	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-60	-46.3	174.8	-164.9	-86.5	0	0	0	110.5	I91 R100 E101 E102 K107 L108 L138 Y141 I148 I153 F202	I91-F104 HydrophobicContact CD1-CD2 3.86Å; R100-F104 VanDerWaalsContact O-CB 3.3Å; R100-F104 WeakPolarHBondContact O-CB 3.3Å; R100-F104 PolarHBondContact O-N 3.44Å; E101-F104 WeakPolarHBondContact O-CB 3.41Å; E101-F104 PolarHBondContact O-N 3.41Å; E102-F104 VanDerWaalsContact C-N 3.32Å; E102-F104 PolarHBondContact O-N 2.93Å; F104-K107 PolarHBondContact O-N 2.93Å; F104-L108 HydrophobicContact CD1-CD1 3.75Å; F104-L108 HydrophobicContact CD1-CG 4.16Å; F104-L108 HydrophobicContact CE1-CD1 3.72Å; F104-L108 HydrophobicContact CE1-CD2 4.46Å; F104-L108 HydrophobicContact CE1-CG 4.11Å; F104-L108 WeakPolarHBondContact O-CG 3.5Å; F104-L108 PolarHBondContact O-N 3.34Å; F104-L138 HydrophobicContact CD1-CD2 4.15Å; F104-L138 HydrophobicContact CD2-CD2 3.51Å; F104-L138 HydrophobicContact CE1-CD2 4.1Å; F104-L138 HydrophobicContact CE2-CD2 3.43Å; F104-L138 VanDerWaalsContact CE2-CD2 3.43Å; F104-L138 HydrophobicContact CG-CD2 3.87Å; F104-L138 HydrophobicContact CZ-CD2 3.75Å; F104-Y141 AromaticContact CD2-CD1 3.9Å; F104-Y141 HydrophobicContact CD2-CD1 3.9Å; F104-Y141 HydrophobicContact CD2-CE1 4.37Å; F104-Y141 AromaticContact CE2-CD1 3.97Å; F104-Y141 HydrophobicContact CE2-CD1 3.97Å; F104-I148 HydrophobicContact CB-CD1 4.35Å; F104-I148 HydrophobicContact CD1-CG1 4.45Å; F104-I148 HydrophobicContact CD2-CD1 4.47Å; F104-I148 HydrophobicContact CD2-CG1 3.92Å; F104-I148 HydrophobicContact CE2-CG1 4.2Å; F104-I148 HydrophobicContact CG-CD1 4.4Å; F104-I148 HydrophobicContact CG-CG1 4.07Å; F104-I153 HydrophobicContact CD1-CD1 3.89Å; F104-I153 HydrophobicContact CD1-CG2 4.33Å; F104-I153 HydrophobicContact CE1-CG2 3.93Å; F104-F202 HydrophobicContact CE1-CZ 4.31Å; F104-F202 AromaticContact CZ-CE2 3.93Å; F104-F202 HydrophobicContact CZ-CE2 3.93Å; F104-F202 AromaticContact CZ-CZ 4Å; F104-F202 HydrophobicContact CZ-CZ 4Å
105	I	95	Very high	91.9	Very high	30 Å²	30	53.6 Å²	53.6	15%	0.154	26%	0.259	C	S	.	.	H	α-helix	trans	-62.1	-43.8	174.7	-68.4	168.6	0	0	0	111.5	E101 E102 L103 K107 L108 K109 I153 E156	E101-I105 HydrophobicContact CG-CD1 4.29Å; E101-I105 WeakPolarHBondContact O-CG1 3.13Å; E101-I105 PolarHBondContact O-N 2.79Å; E102-I105 WeakPolarHBondContact O-CB 3.42Å; E102-I105 PolarHBondContact O-N 3.21Å; L103-I105 VanDerWaalsContact C-N 3.34Å; I105-K107 VanDerWaalsContact C-N 3.35Å; I105-K107 PolarHBondContact O-N 3.49Å; I105-L108 PolarHBondContact O-N 3.32Å; I105-K109 HydrophobicContact CG2-CD 4.17Å; I105-K109 WeakPolarHBondContact O-CG 3.32Å; I105-K109 PolarHBondContact O-N 3.11Å; I105-I153 HydrophobicContact CD1-CD1 3.93Å; I105-I153 HydrophobicContact CG1-CD1 3.42Å; I105-I153 VanDerWaalsContact CG1-CD1 3.42Å; I105-E156 HydrophobicContact CG2-CG 4.08Å
106	Q	94.5	Very high	92	Very high	71 Å²	71	48.8 Å²	48.8	33%	0.332	23%	0.231	S	C	.	.	H	α-helix	trans	-62.2	-42.3	178.2	-71.7	177.7	11.7	0	0	111.5	L88 E102 L103 K109 Q110	L88-Q106 HydrophobicContact CD1-CB 3.84Å; E102-Q106 VanDerWaalsContact O-CG 3.32Å; E102-Q106 WeakPolarHBondContact O-CG 3.3Å; E102-Q106 PolarHBondContact O-N 2.77Å; E102-Q106 PolarHBondContact OE1-NE2 3.44Å; L103-Q106 PolarHBondContact O-N 3.35Å; Q106-K109 PolarHBondContact O-N 3.17Å; Q106-Q110 WeakPolarHBondContact O-CB 3.46Å; Q106-Q110 PolarHBondContact O-N 3.09Å
107	K	95.8	Very high	92.2	Very high	7 Å²	7	47.1 Å²	47.1	3%	0.03	22%	0.222	C	C	.	.	H	α-helix	trans	-65.5	-40.7	175	-76.5	178.7	-173.5	-86	0	112	L88 P89 I91 L103 F104 I105 K109 Q110 C111 E137 L138	L88-K107 HydrophobicContact CB-CG 4.2Å; L88-K107 HydrophobicContact CD1-CB 4.49Å; L88-K107 HydrophobicContact CD1-CG 3.76Å; L88-K107 PolarHBondContact O-NZ 2.85Å; L88-K107 VanDerWaalsContact O-NZ 3.13Å; P89-K107 WeakPolarHBondContact O-CE 2.91Å; P89-K107 PolarHBondContact O-NZ 2.9Å; I91-K107 HydrophobicContact CD1-CD 3.89Å; I91-K107 HydrophobicContact CG1-CD 3.86Å; L103-K107 WeakPolarHBondContact O-CB 3.36Å; L103-K107 WeakPolarHBondContact O-CG 3.36Å; L103-K107 PolarHBondContact O-N 3.5Å; F104-K107 PolarHBondContact O-N 2.93Å; I105-K107 VanDerWaalsContact C-N 3.35Å; I105-K107 PolarHBondContact O-N 3.49Å; K107-K109 VanDerWaalsContact C-N 3.35Å; K107-K109 PolarHBondContact O-N 3.36Å; K107-Q110 WeakPolarHBondContact O-CB 3.48Å; K107-Q110 PolarHBondContact O-N 2.97Å; K107-C111 WeakPolarHBondContact O-CB 3.43Å; K107-C111 PolarHBondContact O-N 3.13Å; K107-C111 PolarHBondContact O-SG 3.22Å; K107-E137 WeakPolarHBondContact CE-OE2 3.38Å; K107-E137 IonicContact NZ-OE2 2.77Å; K107-E137 PolarHBondContact NZ-OE2 3.38Å; K107-L138 HydrophobicContact CB-CD1 4.13Å; K107-L138 HydrophobicContact CB-CD2 3.93Å; K107-L138 HydrophobicContact CB-CG 4.15Å
108	L	96.4	Very high	92.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.3	-46.6	172.7	-75	173.1	0	0	0	111.6	F104 I105 Q110 C111 S112 L138 I153 E156 V157 M160 F202	F104-L108 HydrophobicContact CD1-CD1 3.75Å; F104-L108 HydrophobicContact CD1-CG 4.16Å; F104-L108 HydrophobicContact CE1-CD1 3.72Å; F104-L108 HydrophobicContact CE1-CD2 4.46Å; F104-L108 HydrophobicContact CE1-CG 4.11Å; F104-L108 WeakPolarHBondContact O-CG 3.5Å; F104-L108 PolarHBondContact O-N 3.34Å; I105-L108 PolarHBondContact O-N 3.32Å; L108-Q110 VanDerWaalsContact C-N 3.35Å; L108-Q110 PolarHBondContact O-N 2.95Å; L108-C111 PolarHBondContact O-N 3.42Å; L108-S112 PolarHBondContact O-N 2.87Å; L108-S112 VanDerWaalsContact O-N 3.14Å; L108-S112 PolarHBondContact O-OG 2.93Å; L108-L138 HydrophobicContact CD2-CD1 4.01Å; L108-L138 HydrophobicContact CG-CD1 4.42Å; L108-L138 HydrophobicContact CG-CD2 4.45Å; L108-I153 HydrophobicContact CD1-CG2 4.31Å; L108-E156 HydrophobicContact CB-CB 4.46Å; L108-E156 HydrophobicContact CD1-CB 3.88Å; L108-V157 HydrophobicContact CD1-CG2 3.81Å; L108-V157 HydrophobicContact CD2-CG2 4.18Å; L108-M160 HydrophobicContact CD2-CB 4.43Å; L108-M160 HydrophobicContact CD2-CE 4.04Å; L108-M160 HydrophobicContact CD2-CG 4.44Å; L108-F202 HydrophobicContact CD2-CE1 4.01Å; L108-F202 HydrophobicContact CD2-CZ 3.86Å
109	K	95.5	Very high	91.7	Very high	108 Å²	108	42.3 Å²	42.3	47%	0.47	21%	0.211	S	C	.	.	H	α-helix	trans	-62.6	-40.2	176.6	-72	174.8	-179	174.6	0	112.4	I105 Q106 K107 C111 S112 E156	I105-K109 HydrophobicContact CG2-CD 4.17Å; I105-K109 WeakPolarHBondContact O-CG 3.32Å; I105-K109 PolarHBondContact O-N 3.11Å; Q106-K109 PolarHBondContact O-N 3.17Å; K107-K109 VanDerWaalsContact C-N 3.35Å; K107-K109 PolarHBondContact O-N 3.36Å; K109-C111 VanDerWaalsContact C-N 3.33Å; K109-S112 WeakPolarHBondContact O-CB 3.47Å; K109-S112 PolarHBondContact O-N 3.27Å; K109-E156 WeakPolarHBondContact CE-OE2 3.46Å; K109-E156 WeakPolarHBondContact CG-OE2 3.38Å
110	Q	94.1	Very high	91.3	Very high	22 Å²	22	41.4 Å²	41.4	10%	0.103	21%	0.211	C	C	.	.	H	α-helix	trans	-61.7	-41.6	174	174.7	167.6	64.9	0	0	111.5	L85 N86 L88 Q106 K107 L108 S112 V113	L85-Q110 HydrophobicContact CD1-CG 4Å; L85-Q110 HydrophobicContact CD2-CG 3.95Å; L85-Q110 HydrophobicContact CG-CG 4.45Å; N86-Q110 PolarHBondContact O-NE2 3.06Å; L88-Q110 HydrophobicContact CD1-CB 4.35Å; Q106-Q110 WeakPolarHBondContact O-CB 3.46Å; Q106-Q110 PolarHBondContact O-N 3.09Å; K107-Q110 WeakPolarHBondContact O-CB 3.48Å; K107-Q110 PolarHBondContact O-N 2.97Å; L108-Q110 VanDerWaalsContact C-N 3.35Å; L108-Q110 PolarHBondContact O-N 2.95Å; Q110-S112 PolarHBondContact O-N 3.41Å; Q110-V113 PolarHBondContact O-N 2.93Å
111	C	96.3	Very high	90.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-70.6	-16.2	178.7	-65	0	0	0	0	113.7	K107 L108 K109 V113 K131 L135 M160 N164	K107-C111 WeakPolarHBondContact O-CB 3.43Å; K107-C111 PolarHBondContact O-N 3.13Å; K107-C111 PolarHBondContact O-SG 3.22Å; L108-C111 PolarHBondContact O-N 3.42Å; K109-C111 VanDerWaalsContact C-N 3.33Å; C111-V113 PolarHBondContact O-N 3.16Å; C111-K131 WeakPolarHBondContact O-CE 3.37Å; C111-K131 PolarHBondContact O-NZ 2.94Å; C111-L135 HydrophobicContact CB-CD2 3.78Å; C111-L135 HydrophobicContact CB-CG 4.18Å; C111-M160 HydrophobicContact CB-CG 3.9Å; C111-M160 HydrophobicContact CB-SD 4.5Å; C111-N164 PolarHBondContact O-ND2 2.8Å
112	S	94.8	Very high	90.6	Very high	28 Å²	28	47.4 Å²	47.4	20%	0.196	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-12.3	172.3	-58	0	0	0	0	113.5	L108 K109 Q110 V114 M160	L108-S112 PolarHBondContact O-N 2.87Å; L108-S112 VanDerWaalsContact O-N 3.14Å; L108-S112 PolarHBondContact O-OG 2.93Å; K109-S112 WeakPolarHBondContact O-CB 3.47Å; K109-S112 PolarHBondContact O-N 3.27Å; Q110-S112 PolarHBondContact O-N 3.41Å; S112-V114 PolarHBondContact O-N 3.1Å; S112-M160 WeakPolarHBondContact OG-CA 3.23Å
113	V	92.9	Very high	90.4	Very high	33 Å²	33	43.4 Å²	43.4	20%	0.2	23%	0.232	C	C	.	.			trans	-73.8	118.6	173.4	-179.2	0	0	0	0	109.3	L85 Q110 C111 F115 K131	L85-V113 HydrophobicContact CD2-CB 4.3Å; L85-V113 HydrophobicContact CD2-CG2 4.06Å; Q110-V113 PolarHBondContact O-N 2.93Å; C111-V113 PolarHBondContact O-N 3.16Å; V113-F115 HydrophobicContact CG1-CE2 4.34Å; V113-F115 HydrophobicContact CG1-CZ 4.19Å; V113-K131 WeakPolarHBondContact O-CD 3.46Å; V113-K131 PolarHBondContact O-NZ 3.44Å
114	V	91.3	Very high	90.1	Very high	28 Å²	28	44.9 Å²	44.9	17%	0.17	24%	0.24	C	C	.	.			trans	-91.8	132.9	-178.6	-175.7	0	0	0	0	110.2	S112 A163	S112-V114 PolarHBondContact O-N 3.1Å; V114-A163 WeakPolarHBondContact CG2-O 3.37Å
115	F	89	Confident	89.8	Confident	5 Å²	5	49.6 Å²	49.6	2%	0.022	27%	0.265	C	S	.	.			trans	-105.2	144.2	175.1	-66.2	-83.6	0	0	0	110.4	R83 L85 V113 F117 D124 D127 K128 K131 H195	R83-F115 HydrophobicContact CB-CE1 4.13Å; L85-F115 HydrophobicContact CD1-CE2 3.69Å; L85-F115 HydrophobicContact CD1-CZ 3.54Å; L85-F115 HydrophobicContact CG-CZ 3.89Å; V113-F115 HydrophobicContact CG1-CE2 4.34Å; V113-F115 HydrophobicContact CG1-CZ 4.19Å; F115-F117 HydrophobicContact CB-CE2 4.32Å; F115-D124 HydrophobicContact CD1-CB 3.69Å; F115-D124 HydrophobicContact CE1-CB 3.95Å; F115-D127 HydrophobicContact CE1-CB 3.46Å; F115-D127 VanDerWaalsContact CE1-CB 3.46Å; F115-D127 HydrophobicContact CZ-CB 3.47Å; F115-D127 VanDerWaalsContact CZ-CB 3.47Å; F115-K128 HydrophobicContact CB-CG 3.87Å; F115-K128 HydrophobicContact CD1-CG 4.06Å; F115-K128 HydrophobicContact CD2-CG 4.27Å; F115-K128 HydrophobicContact CG-CG 3.79Å; F115-K131 HydrophobicContact CD2-CD 3.81Å; F115-K131 HydrophobicContact CE2-CB 4Å; F115-K131 HydrophobicContact CE2-CD 3.76Å; F115-H195 AromaticContact CD2-CE1 3.72Å
116	E	85.2	Confident	89.7	Confident	48 Å²	48	55 Å²	55	22%	0.224	29%	0.287	C	S	.	.			trans	-88.2	125.5	173.2	-69.1	174.2	153.9	0	0	109.1	T73 R83 K128	T73-E116 PolarHBondContact OG1-OE1 3.31Å; T73-E116 VanDerWaalsContact OG1-OE1 3.07Å; R83-E116 IonicContact CZ-OE2 2.94Å; R83-E116 IonicContact NH1-OE2 3.64Å; R83-E116 VanDerWaalsContact NH2-CD 3.34Å; R83-E116 IonicContact NH2-OE1 2.86Å; R83-E116 IonicContact NH2-OE2 2.72Å; R83-E116 PolarHBondContact NH2-OE2 2.97Å; E116-K128 WeakPolarHBondContact O-CE 3.46Å; E116-K128 PolarHBondContact O-NZ 2.89Å
117	F	87.5	Confident	89.6	Confident	19 Å²	19	52.6 Å²	52.6	8%	0.083	28%	0.277	C	S	.	.			trans	-93.2	-10.7	173.2	-72.9	-100	0	0	0	111.9	F115 I121 K128 A191 A192 H195	F115-F117 HydrophobicContact CB-CE2 4.32Å; F117-I121 WeakPolarHBondContact O-CA 3.4Å; F117-I121 WeakPolarHBondContact O-CG1 3.21Å; F117-I121 PolarHBondContact O-N 2.66Å; F117-K128 HydrophobicContact CE1-CD 4.01Å; F117-K128 HydrophobicContact CZ-CD 4.12Å; F117-K128 HydrophobicContact CZ-CG 4.31Å; F117-A191 HydrophobicContact CB-CB 3.97Å; F117-A192 VanDerWaalsContact CD2-CA 3.5Å; F117-A192 HydrophobicContact CD2-CB 3.52Å; F117-A192 HydrophobicContact CE2-CB 3.96Å; F117-A192 HydrophobicContact CG-CB 4.19Å; F117-H195 HydrophobicContact CE2-CB 4.5Å; F117-H195 AromaticContact CE2-ND1 3.6Å; F117-H195 AromaticContact CZ-CE1 3.68Å; F117-H195 AromaticContact CZ-CG 3.8Å; F117-H195 AromaticContact CZ-ND1 3.62Å; F117-H195 AromaticContact CZ-NE2 3.95Å
118	V	84.3	Confident	89.4	Confident	19 Å²	19	52.8 Å²	52.8	12%	0.115	28%	0.278	C	S	.	.	S	Bend	trans	-132.5	135.3	-176.8	170.7	0	0	0	0	107.9	L71 A191	L71-V118 HydrophobicContact CB-CB 4.49Å; L71-V118 HydrophobicContact CB-CG1 3.17Å; L71-V118 HydrophobicContact CD1-CG1 4.44Å; L71-V118 HydrophobicContact CG-CG1 4.37Å; L71-V118 VanDerWaalsContact O-CG1 3.25Å; L71-V118 WeakPolarHBondContact O-CG1 3.48Å; V118-A191 HydrophobicContact CG2-CB 3.56Å
119	P	81	Confident	89.3	Confident	120 Å²	120	56.6 Å²	56.6	78%	0.779	30%	0.295	S	S	*	.	S	Bend	cis	-83.3	-18.1	5.1	33	-35.5	0	0	0	114.2
120	D	80.6	Confident	89.3	Confident	86 Å²	86	52.4 Å²	52.4	46%	0.46	28%	0.279	S	S	.	.			trans	-104.7	99.2	-174.8	-173.9	5.4	0	0	0	111.8	L122 S123	D120-L122 PolarHBondContact O-N 3.12Å; D120-L122 PolarHBondContact OD1-N 3.28Å; D120-S123 PolarHBondContact O-N 3Å; D120-S123 PolarHBondContact O-OG 3.39Å; D120-S123 PolarHBondContact OD1-N 2.89Å
121	I	83	Confident	89.4	Confident	112 Å²	112	51.4 Å²	51.4	57%	0.574	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-28.9	178.5	-56.9	165.2	0	0	0	111	F117 K128	F117-I121 WeakPolarHBondContact O-CA 3.4Å; F117-I121 WeakPolarHBondContact O-CG1 3.21Å; F117-I121 PolarHBondContact O-N 2.66Å; I121-K128 PolarHBondContact O-NZ 2.94Å
122	L	85.2	Confident	89.4	Confident	130 Å²	130	57.1 Å²	57.1	68%	0.681	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-0.1	-175.6	-58.2	179.8	0	0	0	113.7	D120 L125	D120-L122 PolarHBondContact O-N 3.12Å; D120-L122 PolarHBondContact OD1-N 3.28Å; L122-L125 HydrophobicContact CD2-CD1 4.47Å; L122-L125 WeakPolarHBondContact O-CG 3.39Å
123	S	87.7	Confident	89.4	Confident	26 Å²	26	58.2 Å²	58.2	18%	0.182	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	151.2	172.1	63.9	0	0	0	0	111.9	D120 L125 K128	D120-S123 PolarHBondContact O-N 3Å; D120-S123 PolarHBondContact O-OG 3.39Å; D120-S123 PolarHBondContact OD1-N 2.89Å; S123-L125 PolarHBondContact O-N 2.98Å; S123-K128 WeakPolarHBondContact O-CD 3.46Å; S123-K128 VanDerWaalsContact O-CE 3.32Å; S123-K128 WeakPolarHBondContact O-CE 3.45Å; S123-K128 PolarHBondContact O-NZ 3.16Å; S123-K128 PolarHBondContact OG-NZ 3.44Å
124	D	86.7	Confident	89.6	Confident	49 Å²	49	56.9 Å²	56.9	26%	0.262	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	27.1	170	-54.2	-33.8	0	0	0	114.6	R83 F115 K126 D127 K128	R83-D124 WeakPolarHBondContact CD-OD2 3.44Å; R83-D124 IonicContact CZ-OD2 3.53Å; R83-D124 IonicContact NH1-OD2 2.9Å; R83-D124 PolarHBondContact NH1-OD2 3.27Å; F115-D124 HydrophobicContact CD1-CB 3.69Å; F115-D124 HydrophobicContact CE1-CB 3.95Å; D124-K126 VanDerWaalsContact C-N 3.27Å; D124-K126 PolarHBondContact O-N 2.77Å; D124-D127 PolarHBondContact O-N 3.27Å; D124-D127 VanDerWaalsContact O-N 3.07Å; D124-K128 HydrophobicContact CB-CG 4.42Å; D124-K128 WeakPolarHBondContact O-CB 3.4Å; D124-K128 WeakPolarHBondContact O-CG 3.35Å; D124-K128 PolarHBondContact O-N 2.94Å
125	L	90	Very high	89.8	Confident	101 Å²	101	55.5 Å²	55.5	53%	0.529	29%	0.291	S	S	.	.	H	α-helix	trans	-55.4	-40.8	-172.2	-71.1	175.3	0	0	0	113.1	L122 S123 E129	L122-L125 HydrophobicContact CD2-CD1 4.47Å; L122-L125 WeakPolarHBondContact O-CG 3.39Å; S123-L125 PolarHBondContact O-N 2.98Å; L125-E129 WeakPolarHBondContact O-CB 3.19Å; L125-E129 PolarHBondContact O-N 3.07Å
126	K	91.9	Very high	90.2	Very high	143 Å²	143	60.3 Å²	60.3	62%	0.622	31%	0.313	S	S	*	.	H	α-helix	trans	-61.8	-49.5	177.5	-177.9	-174.2	171.5	-166.1	0	110.8	D124 E129 V130	D124-K126 VanDerWaalsContact C-N 3.27Å; D124-K126 PolarHBondContact O-N 2.77Å; K126-E129 WeakPolarHBondContact O-CB 3.21Å; K126-E129 PolarHBondContact O-N 3.19Å; K126-V130 WeakPolarHBondContact O-CG2 3.35Å; K126-V130 PolarHBondContact O-N 3.26Å
127	D	91.9	Very high	90.7	Very high	21 Å²	21	59.4 Å²	59.4	11%	0.112	31%	0.308	C	S	.	.	H	α-helix	trans	-72.6	-35.4	-176.3	-52.6	-73.1	0	0	0	111.8	L85 F115 D124 E129 V130 K131	L85-D127 HydrophobicContact CB-CB 4.2Å; L85-D127 HydrophobicContact CG-CB 4.28Å; L85-D127 PolarHBondContact N-OD1 3.4Å; F115-D127 HydrophobicContact CE1-CB 3.46Å; F115-D127 VanDerWaalsContact CE1-CB 3.46Å; F115-D127 HydrophobicContact CZ-CB 3.47Å; F115-D127 VanDerWaalsContact CZ-CB 3.47Å; D124-D127 PolarHBondContact O-N 3.27Å; D124-D127 VanDerWaalsContact O-N 3.07Å; D127-E129 VanDerWaalsContact C-N 3.3Å; D127-E129 PolarHBondContact O-N 3.22Å; D127-V130 PolarHBondContact O-N 3.46Å; D127-K131 PolarHBondContact O-N 3.04Å
128	K	92.9	Very high	91.1	Very high	11 Å²	11	58.5 Å²	58.5	5%	0.048	30%	0.304	C	S	.	.	H	α-helix	trans	-58.4	-41.8	169.7	-76.2	172.8	175.4	161.5	0	111.4	F115 E116 F117 I121 S123 D124 R132 H195	F115-K128 HydrophobicContact CB-CG 3.87Å; F115-K128 HydrophobicContact CD1-CG 4.06Å; F115-K128 HydrophobicContact CD2-CG 4.27Å; F115-K128 HydrophobicContact CG-CG 3.79Å; E116-K128 WeakPolarHBondContact O-CE 3.46Å; E116-K128 PolarHBondContact O-NZ 2.89Å; F117-K128 HydrophobicContact CE1-CD 4.01Å; F117-K128 HydrophobicContact CZ-CD 4.12Å; F117-K128 HydrophobicContact CZ-CG 4.31Å; I121-K128 PolarHBondContact O-NZ 2.94Å; S123-K128 WeakPolarHBondContact O-CD 3.46Å; S123-K128 VanDerWaalsContact O-CE 3.32Å; S123-K128 WeakPolarHBondContact O-CE 3.45Å; S123-K128 PolarHBondContact O-NZ 3.16Å; S123-K128 PolarHBondContact OG-NZ 3.44Å; D124-K128 HydrophobicContact CB-CG 4.42Å; D124-K128 WeakPolarHBondContact O-CB 3.4Å; D124-K128 WeakPolarHBondContact O-CG 3.35Å; D124-K128 PolarHBondContact O-N 2.94Å; K128-R132 WeakPolarHBondContact O-CB 3.34Å; K128-R132 PolarHBondContact O-N 2.83Å; K128-H195 PolarHBondContact O-NE2 3.12Å
129	E	94.1	Very high	91.6	Very high	80 Å²	80	58.1 Å²	58.1	37%	0.374	30%	0.302	S	S	.	.	H	α-helix	trans	-68.3	-42.2	176.2	-177.1	54.9	-146.5	0	0	112.1	L125 K126 D127 K131 R132 A133	L125-E129 WeakPolarHBondContact O-CB 3.19Å; L125-E129 PolarHBondContact O-N 3.07Å; K126-E129 WeakPolarHBondContact O-CB 3.21Å; K126-E129 PolarHBondContact O-N 3.19Å; D127-E129 VanDerWaalsContact C-N 3.3Å; D127-E129 PolarHBondContact O-N 3.22Å; E129-K131 VanDerWaalsContact C-N 3.32Å; E129-K131 PolarHBondContact O-N 3.31Å; E129-R132 VanDerWaalsContact CD-CZ 3.47Å; E129-R132 WeakPolarHBondContact O-CB 3.38Å; E129-R132 PolarHBondContact O-N 3.26Å; E129-R132 VanDerWaalsContact O-N 3.16Å; E129-R132 IonicContact OE1-CZ 3.81Å; E129-R132 IonicContact OE1-NE 2.97Å; E129-R132 PolarHBondContact OE1-NE 3.49Å; E129-R132 VanDerWaalsContact OE1-NE 3.12Å; E129-R132 IonicContact OE1-NH2 2.65Å; E129-R132 PolarHBondContact OE1-NH2 3.18Å; E129-R132 IonicContact OE2-CZ 3.69Å; E129-R132 IonicContact OE2-NE 3.22Å; E129-R132 PolarHBondContact OE2-NE 3.34Å; E129-R132 IonicContact OE2-NH1 2.91Å; E129-R132 IonicContact OE2-NH2 2.79Å; E129-R132 PolarHBondContact OE2-NH2 3.25Å; E129-A133 WeakPolarHBondContact O-CB 3.47Å; E129-A133 PolarHBondContact O-N 3.47Å
130	V	94.8	Very high	92.2	Very high	19 Å²	19	56 Å²	56	12%	0.115	28%	0.282	C	S	.	.	H	α-helix	trans	-57.1	-46.4	175.3	171.3	0	0	0	0	110.8	L85 P87 K126 D127 A134	L85-V130 HydrophobicContact CB-CB 4.2Å; L85-V130 HydrophobicContact CB-CG1 3.87Å; L85-V130 HydrophobicContact CD1-CG1 4.46Å; P87-V130 HydrophobicContact CB-CG1 4.41Å; P87-V130 HydrophobicContact CB-CG2 4.36Å; K126-V130 WeakPolarHBondContact O-CG2 3.35Å; K126-V130 PolarHBondContact O-N 3.26Å; D127-V130 PolarHBondContact O-N 3.46Å; V130-A134 WeakPolarHBondContact O-CB 3.45Å; V130-A134 PolarHBondContact O-N 3.05Å
131	K	96.1	Very high	92.8	Very high	1 Å²	1	52.2 Å²	52.2	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-63.7	-42.8	176	177.9	172	172.8	-177.2	0	112.4	L85 C111 V113 F115 D127 E129 A134 L135 N164	L85-K131 HydrophobicContact CD1-CB 4.1Å; C111-K131 WeakPolarHBondContact O-CE 3.37Å; C111-K131 PolarHBondContact O-NZ 2.94Å; V113-K131 WeakPolarHBondContact O-CD 3.46Å; V113-K131 PolarHBondContact O-NZ 3.44Å; F115-K131 HydrophobicContact CD2-CD 3.81Å; F115-K131 HydrophobicContact CE2-CB 4Å; F115-K131 HydrophobicContact CE2-CD 3.76Å; D127-K131 PolarHBondContact O-N 3.04Å; E129-K131 VanDerWaalsContact C-N 3.32Å; E129-K131 PolarHBondContact O-N 3.31Å; K131-A134 PolarHBondContact O-N 2.72Å; K131-L135 HydrophobicContact CG-CD1 4Å; K131-L135 HydrophobicContact CG-CG 4.42Å; K131-L135 WeakPolarHBondContact O-CG 3.28Å; K131-L135 PolarHBondContact O-N 3.32Å; K131-N164 WeakPolarHBondContact CE-OD1 3.38Å; K131-N164 PolarHBondContact NZ-OD1 2.78Å
132	R	95.7	Very high	93.2	Very high	120 Å²	120	47.2 Å²	47.2	45%	0.453	24%	0.236	S	C	.	.	H	α-helix	trans	-58.5	-49.7	177.8	-171	-172.5	74.5	166.2	2.6	111.1	K128 E129 A134 L135 H136 L198	K128-R132 WeakPolarHBondContact O-CB 3.34Å; K128-R132 PolarHBondContact O-N 2.83Å; E129-R132 VanDerWaalsContact CD-CZ 3.47Å; E129-R132 WeakPolarHBondContact O-CB 3.38Å; E129-R132 PolarHBondContact O-N 3.26Å; E129-R132 VanDerWaalsContact O-N 3.16Å; E129-R132 IonicContact OE1-CZ 3.81Å; E129-R132 IonicContact OE1-NE 2.97Å; E129-R132 PolarHBondContact OE1-NE 3.49Å; E129-R132 VanDerWaalsContact OE1-NE 3.12Å; E129-R132 IonicContact OE1-NH2 2.65Å; E129-R132 PolarHBondContact OE1-NH2 3.18Å; E129-R132 IonicContact OE2-CZ 3.69Å; E129-R132 IonicContact OE2-NE 3.22Å; E129-R132 PolarHBondContact OE2-NE 3.34Å; E129-R132 IonicContact OE2-NH1 2.91Å; E129-R132 IonicContact OE2-NH2 2.79Å; E129-R132 PolarHBondContact OE2-NH2 3.25Å; R132-A134 PolarHBondContact O-N 2.84Å; R132-L135 PolarHBondContact O-N 2.86Å; R132-H136 PolarHBondContact O-N 3.46Å; R132-L198 HydrophobicContact CG-CD1 3.69Å
133	A	95.9	Very high	93.5	Very high	52 Å²	52	45.1 Å²	45.1	43%	0.43	23%	0.228	S	C	.	.	H	α-helix	trans	-62	-42.4	178.2	0	0	0	0	0	111.9	E129 H136 E137	E129-A133 WeakPolarHBondContact O-CB 3.47Å; E129-A133 PolarHBondContact O-N 3.47Å; A133-H136 PolarHBondContact O-N 3.39Å; A133-E137 WeakPolarHBondContact O-CB 3.5Å; A133-E137 PolarHBondContact O-N 2.87Å
134	A	96.2	Very high	93.6	Very high	4 Å²	4	49.2 Å²	49.2	3%	0.033	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-44.3	177.5	0	0	0	0	0	112.5	V130 K131 R132 E137 L138	V130-A134 WeakPolarHBondContact O-CB 3.45Å; V130-A134 PolarHBondContact O-N 3.05Å; K131-A134 PolarHBondContact O-N 2.72Å; R132-A134 PolarHBondContact O-N 2.84Å; A134-E137 PolarHBondContact O-N 3.25Å; A134-L138 WeakPolarHBondContact O-CB 3.44Å; A134-L138 WeakPolarHBondContact O-CG 3.45Å; A134-L138 PolarHBondContact O-N 3.35Å
135	L	96.9	Very high	93.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-40.4	176.5	-75.4	170	0	0	0	112.4	C111 K131 R132 L138 T139 M160 L198 V199	C111-L135 HydrophobicContact CB-CD2 3.78Å; C111-L135 HydrophobicContact CB-CG 4.18Å; K131-L135 HydrophobicContact CG-CD1 4Å; K131-L135 HydrophobicContact CG-CG 4.42Å; K131-L135 WeakPolarHBondContact O-CG 3.28Å; K131-L135 PolarHBondContact O-N 3.32Å; R132-L135 PolarHBondContact O-N 2.86Å; L135-L138 PolarHBondContact O-N 2.93Å; L135-T139 PolarHBondContact O-N 3.12Å; L135-T139 VanDerWaalsContact O-N 3.09Å; L135-T139 PolarHBondContact O-OG1 3.37Å; L135-M160 HydrophobicContact CD2-CE 4.34Å; L135-M160 HydrophobicContact CD2-SD 4.23Å; L135-L198 HydrophobicContact CB-CB 3.83Å; L135-L198 HydrophobicContact CB-CD1 3.98Å; L135-L198 HydrophobicContact CD1-CB 4.07Å; L135-V199 HydrophobicContact CD1-CG2 3.84Å; L135-V199 HydrophobicContact CD2-CG2 3.96Å
136	H	95.7	Very high	92.9	Very high	106 Å²	106	48.9 Å²	48.9	49%	0.491	25%	0.25	S	S	.	.	H	α-helix	trans	-62.6	-49.4	176	-174.3	-76.6	0	0	0	111.1	R132 A133 L138 T139 E140	R132-H136 PolarHBondContact O-N 3.46Å; A133-H136 PolarHBondContact O-N 3.39Å; H136-L138 PolarHBondContact O-N 3.42Å; H136-T139 PolarHBondContact O-N 2.78Å; H136-T139 VanDerWaalsContact O-N 3.17Å; H136-E140 IonicContact CE1-OE2 3.28Å; H136-E140 IonicContact ND1-OE2 2.95Å; H136-E140 PolarHBondContact O-N 2.97Å
137	E	95.8	Very high	92.2	Very high	28 Å²	28	44.4 Å²	44.4	13%	0.131	25%	0.245	C	C	.	.	H	α-helix	trans	-60.5	-43.4	177.7	-172.3	-168.5	179.6	0	0	112	L90 I91 K107 A133 A134 T139 E140 Y141	L90-E137 WeakPolarHBondContact CA-OE1 3.15Å; I91-E137 HydrophobicContact CD1-CG 4.35Å; I91-E137 PolarHBondContact N-OE1 2.98Å; K107-E137 WeakPolarHBondContact CE-OE2 3.38Å; K107-E137 IonicContact NZ-OE2 2.77Å; K107-E137 PolarHBondContact NZ-OE2 3.38Å; A133-E137 WeakPolarHBondContact O-CB 3.5Å; A133-E137 PolarHBondContact O-N 2.87Å; A134-E137 PolarHBondContact O-N 3.25Å; E137-T139 VanDerWaalsContact C-N 3.27Å; E137-T139 PolarHBondContact O-N 2.82Å; E137-E140 PolarHBondContact O-N 3.31Å; E137-Y141 WeakPolarHBondContact O-CB 3.48Å; E137-Y141 PolarHBondContact O-N 2.93Å
138	L	96.1	Very high	91.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-57.7	-41.2	175.9	-76.8	170.5	0	0	0	111.6	I91 F104 K107 L108 A134 L135 H136 L142 F202	I91-L138 HydrophobicContact CD1-CD2 4.2Å; F104-L138 HydrophobicContact CD1-CD2 4.15Å; F104-L138 HydrophobicContact CD2-CD2 3.51Å; F104-L138 HydrophobicContact CE1-CD2 4.1Å; F104-L138 HydrophobicContact CE2-CD2 3.43Å; F104-L138 VanDerWaalsContact CE2-CD2 3.43Å; F104-L138 HydrophobicContact CG-CD2 3.87Å; F104-L138 HydrophobicContact CZ-CD2 3.75Å; K107-L138 HydrophobicContact CB-CD1 4.13Å; K107-L138 HydrophobicContact CB-CD2 3.93Å; K107-L138 HydrophobicContact CB-CG 4.15Å; L108-L138 HydrophobicContact CD2-CD1 4.01Å; L108-L138 HydrophobicContact CG-CD1 4.42Å; L108-L138 HydrophobicContact CG-CD2 4.45Å; A134-L138 WeakPolarHBondContact O-CB 3.44Å; A134-L138 WeakPolarHBondContact O-CG 3.45Å; A134-L138 PolarHBondContact O-N 3.35Å; L135-L138 PolarHBondContact O-N 2.93Å; H136-L138 PolarHBondContact O-N 3.42Å; L138-L142 WeakPolarHBondContact O-CB 3.32Å; L138-L142 PolarHBondContact O-N 3.08Å; L138-F202 HydrophobicContact CB-CD2 4.04Å; L138-F202 HydrophobicContact CB-CE2 3.87Å
139	T	94.6	Very high	91.7	Very high	11 Å²	11	43.8 Å²	43.8	7%	0.067	24%	0.242	C	C	.	.	H	α-helix	trans	-71.5	-45.2	-179.2	-55.1	0	0	0	0	112	L135 H136 E137 T143 R205	L135-T139 PolarHBondContact O-N 3.12Å; L135-T139 VanDerWaalsContact O-N 3.09Å; L135-T139 PolarHBondContact O-OG1 3.37Å; H136-T139 PolarHBondContact O-N 2.78Å; H136-T139 VanDerWaalsContact O-N 3.17Å; E137-T139 VanDerWaalsContact C-N 3.27Å; E137-T139 PolarHBondContact O-N 2.82Å; T139-T143 WeakPolarHBondContact O-CB 3.47Å; T139-T143 PolarHBondContact O-N 2.84Å; T139-T143 VanDerWaalsContact O-N 3.11Å; T139-T143 PolarHBondContact O-OG1 3.47Å; T139-R205 HydrophobicContact CG2-CG 4.28Å
140	E	94.1	Very high	91.6	Very high	75 Å²	75	41.8 Å²	41.8	35%	0.35	24%	0.235	S	C	.	.	H	α-helix	trans	-60.6	-50.7	175.6	-173.8	-171.2	138.2	0	0	110.4	K92 H136 E137 L142 T143 E144	K92-E140 IonicContact NZ-OE1 3.39Å; K92-E140 PolarHBondContact NZ-OE1 2.67Å; H136-E140 IonicContact CE1-OE2 3.28Å; H136-E140 IonicContact ND1-OE2 2.95Å; H136-E140 PolarHBondContact O-N 2.97Å; E137-E140 PolarHBondContact O-N 3.31Å; E140-L142 PolarHBondContact O-N 3.16Å; E140-T143 PolarHBondContact O-N 3.48Å; E140-T143 VanDerWaalsContact O-N 3.08Å; E140-E144 WeakPolarHBondContact O-CG 3.38Å; E140-E144 PolarHBondContact O-N 3.47Å
141	Y	92.7	Very high	91.4	Very high	7 Å²	7	45.5 Å²	45.5	3%	0.027	25%	0.254	C	S	.	.	H	α-helix	trans	-61.5	-41.5	-178.5	-172	-96.5	0	0	0	112.5	I91 K92 R100 F104 E137 T143 E144 N145 I148	I91-Y141 HydrophobicContact CB-CD2 4.16Å; I91-Y141 HydrophobicContact CB-CE2 4.23Å; I91-Y141 HydrophobicContact CB-CG 4.43Å; I91-Y141 HydrophobicContact CD1-CD1 4.3Å; I91-Y141 HydrophobicContact CD1-CG 4.16Å; I91-Y141 HydrophobicContact CG2-CD1 4.07Å; I91-Y141 HydrophobicContact CG2-CD2 3.89Å; I91-Y141 HydrophobicContact CG2-CE1 3.73Å; I91-Y141 HydrophobicContact CG2-CE2 3.55Å; I91-Y141 HydrophobicContact CG2-CG 4.14Å; I91-Y141 VanDerWaalsContact CG2-CZ 3.46Å; K92-Y141 HydrophobicContact CG-CD2 4.11Å; K92-Y141 HydrophobicContact CG-CE2 4.27Å; R100-Y141 WeakPolarHBondContact CD-OH 3.28Å; F104-Y141 AromaticContact CD2-CD1 3.9Å; F104-Y141 HydrophobicContact CD2-CD1 3.9Å; F104-Y141 HydrophobicContact CD2-CE1 4.37Å; F104-Y141 AromaticContact CE2-CD1 3.97Å; F104-Y141 HydrophobicContact CE2-CD1 3.97Å; E137-Y141 WeakPolarHBondContact O-CB 3.48Å; E137-Y141 PolarHBondContact O-N 2.93Å; Y141-T143 VanDerWaalsContact C-N 3.3Å; Y141-T143 PolarHBondContact O-N 3.5Å; Y141-E144 PolarHBondContact O-N 3.44Å; Y141-N145 VanDerWaalsContact CD2-ND2 3.3Å; Y141-N145 WeakPolarHBondContact CD2-ND2 3.35Å; Y141-N145 HydrophobicContact CE1-CB 4.37Å; Y141-N145 WeakPolarHBondContact CE2-ND2 3.29Å; Y141-N145 WeakPolarHBondContact O-CB 3.44Å; Y141-N145 PolarHBondContact O-N 3.1Å; Y141-N145 PolarHBondContact O-ND2 2.99Å; Y141-I148 HydrophobicContact CD1-CG1 4.29Å; Y141-I148 HydrophobicContact CE1-CB 4.06Å; Y141-I148 HydrophobicContact CE1-CD1 3.86Å; Y141-I148 HydrophobicContact CE1-CG1 3.77Å
142	L	93	Very high	91.2	Very high	8 Å²	8	47.7 Å²	47.7	4%	0.042	27%	0.27	C	S	.	.	H	α-helix	trans	-63.5	-35.4	175.6	178.3	67.4	0	0	0	112.6	L138 E140 I148 I149 F202 R205 F206	L138-L142 WeakPolarHBondContact O-CB 3.32Å; L138-L142 PolarHBondContact O-N 3.08Å; E140-L142 PolarHBondContact O-N 3.16Å; L142-I148 HydrophobicContact CD1-CG2 3.83Å; L142-I149 HydrophobicContact CD1-CD1 3.94Å; L142-I149 HydrophobicContact CD1-CG1 3.87Å; L142-F202 HydrophobicContact CB-CE2 4.49Å; L142-F202 HydrophobicContact CD2-CD2 4.11Å; L142-F202 HydrophobicContact CD2-CE2 3.76Å; L142-F202 HydrophobicContact CD2-CZ 4.26Å; L142-R205 HydrophobicContact CD2-CB 4.23Å; L142-F206 HydrophobicContact CD1-CD2 4.39Å; L142-F206 HydrophobicContact CD2-CB 3.88Å; L142-F206 HydrophobicContact CD2-CD2 4.36Å
143	T	91.2	Very high	91.2	Very high	85 Å²	85	42 Å²	42	52%	0.521	25%	0.249	S	C	.	.	H	α-helix	trans	-75.9	-37.7	-179.1	-55.5	0	0	0	0	111.4	T139 E140 Y141	T139-T143 WeakPolarHBondContact O-CB 3.47Å; T139-T143 PolarHBondContact O-N 2.84Å; T139-T143 VanDerWaalsContact O-N 3.11Å; T139-T143 PolarHBondContact O-OG1 3.47Å; E140-T143 PolarHBondContact O-N 3.48Å; E140-T143 VanDerWaalsContact O-N 3.08Å; Y141-T143 VanDerWaalsContact C-N 3.3Å; Y141-T143 PolarHBondContact O-N 3.5Å
144	E	90	Very high	91.2	Very high	113 Å²	113	39.6 Å²	39.6	53%	0.528	23%	0.228	S	C	.	.	H	α-helix	trans	-81.1	-27.1	-178.1	-68.8	178.6	170.9	0	0	113.8	K92 E140 Y141	K92-E144 WeakPolarHBondContact CE-OE2 3.03Å; K92-E144 IonicContact NZ-OE1 3.63Å; K92-E144 IonicContact NZ-OE2 2.68Å; K92-E144 PolarHBondContact NZ-OE2 3.25Å; E140-E144 WeakPolarHBondContact O-CG 3.38Å; E140-E144 PolarHBondContact O-N 3.47Å; Y141-E144 PolarHBondContact O-N 3.44Å
145	N	86.7	Confident	91.2	Very high	55 Å²	55	40.9 Å²	40.9	29%	0.294	24%	0.236	S	C	.	.			trans	-118.4	115.5	-169.8	-60.1	-85.7	0	0	0	112.3	Y141 G147	Y141-N145 VanDerWaalsContact CD2-ND2 3.3Å; Y141-N145 WeakPolarHBondContact CD2-ND2 3.35Å; Y141-N145 HydrophobicContact CE1-CB 4.37Å; Y141-N145 WeakPolarHBondContact CE2-ND2 3.29Å; Y141-N145 WeakPolarHBondContact O-CB 3.44Å; Y141-N145 PolarHBondContact O-N 3.1Å; Y141-N145 PolarHBondContact O-ND2 2.99Å; N145-G147 VanDerWaalsContact C-N 3.31Å; N145-G147 PolarHBondContact O-N 3.1Å
146	S	74.1	Confident	91.2	Very high	88 Å²	88	41.9 Å²	41.9	62%	0.615	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-7.4	-177.7	56.1	0	0	0	0	115	N211	S146-N211 WeakPolarHBondContact CA-ND2 3.38Å; S146-N211 WeakPolarHBondContact CB-ND2 3.33Å; S146-N211 PolarHBondContact O-ND2 2.77Å; S146-N211 PolarHBondContact O-OD1 3.4Å
147	G	77.9	Confident	91.2	Very high	49 Å²	49	36.8 Å²	36.8	51%	0.505	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	2.8	-170.8	0	0	0	0	0	116.7	N145	N145-G147 VanDerWaalsContact C-N 3.31Å; N145-G147 PolarHBondContact O-N 3.1Å
148	I	84.5	Confident	91.2	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	21%	0.213	C	C	.	.			trans	-85.6	-22.2	-169.5	-166.1	59.9	0	0	0	114.3	E101 F104 Y141 L142 T150	E101-I148 HydrophobicContact CB-CD1 4.45Å; F104-I148 HydrophobicContact CB-CD1 4.35Å; F104-I148 HydrophobicContact CD1-CG1 4.45Å; F104-I148 HydrophobicContact CD2-CD1 4.47Å; F104-I148 HydrophobicContact CD2-CG1 3.92Å; F104-I148 HydrophobicContact CE2-CG1 4.2Å; F104-I148 HydrophobicContact CG-CD1 4.4Å; F104-I148 HydrophobicContact CG-CG1 4.07Å; Y141-I148 HydrophobicContact CD1-CG1 4.29Å; Y141-I148 HydrophobicContact CE1-CB 4.06Å; Y141-I148 HydrophobicContact CE1-CD1 3.86Å; Y141-I148 HydrophobicContact CE1-CG1 3.77Å; L142-I148 HydrophobicContact CD1-CG2 3.83Å; I148-T150 PolarHBondContact O-N 3.32Å
149	I	90.1	Very high	91.3	Very high	17 Å²	17	41.3 Å²	41.3	9%	0.087	23%	0.234	C	C	.	.			trans	-79.1	89.4	-174.8	-54.8	179.7	0	0	0	109.8	L142 Y154 F206 S209 N211	L142-I149 HydrophobicContact CD1-CD1 3.94Å; L142-I149 HydrophobicContact CD1-CG1 3.87Å; I149-Y154 HydrophobicContact CG2-CE1 4.42Å; I149-Y154 HydrophobicContact CG2-CE2 3.7Å; I149-Y154 WeakPolarHBondContact CG2-OH 3.35Å; I149-F206 HydrophobicContact CD1-CD2 4.06Å; I149-F206 HydrophobicContact CD1-CE2 4.06Å; I149-F206 HydrophobicContact CG1-CD2 4.38Å; I149-F206 HydrophobicContact CG1-CE2 4.11Å; I149-F206 HydrophobicContact CG2-CE2 3.89Å; I149-F206 HydrophobicContact CG2-CZ 4.35Å; I149-S209 WeakPolarHBondContact CD1-OG 3.32Å; I149-N211 HydrophobicContact CD1-CB 4.41Å
150	T	91.1	Very high	91.4	Very high	37 Å²	37	40.8 Å²	40.8	23%	0.227	23%	0.231	C	C	.	.			trans	-97.3	167.3	171	70.4	0	0	0	0	110.9	E101 I148 S152 I153 Y154	E101-T150 PolarHBondContact OE1-OG1 3.22Å; E101-T150 WeakPolarHBondContact OE2-CG2 3.21Å; I148-T150 PolarHBondContact O-N 3.32Å; T150-S152 PolarHBondContact O-N 3.19Å; T150-S152 VanDerWaalsContact O-N 3.16Å; T150-S152 PolarHBondContact OG1-OG 3.06Å; T150-I153 PolarHBondContact O-N 2.99Å; T150-I153 VanDerWaalsContact O-N 3.1Å; T150-Y154 VanDerWaalsContact O-CD2 3.28Å; T150-Y154 WeakPolarHBondContact O-CD2 3Å
151	D	91.5	Very high	91.5	Very high	97 Å²	97	37.2 Å²	37.2	52%	0.519	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-27.1	177.9	-74.5	8.3	0	0	0	112.8	I153 P155 V216	D151-I153 VanDerWaalsContact C-N 3.34Å; D151-P155 WeakPolarHBondContact O-CD 3.36Å; D151-V216 HydrophobicContact CB-CG1 4.41Å
152	S	92.5	Very high	91.6	Very high	48 Å²	48	39.9 Å²	39.9	34%	0.336	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-25.7	179.6	81.4	0	0	0	0	112.8	E101 T150 P155	E101-S152 PolarHBondContact OE1-OG 3.49Å; T150-S152 PolarHBondContact O-N 3.19Å; T150-S152 VanDerWaalsContact O-N 3.16Å; T150-S152 PolarHBondContact OG1-OG 3.06Å; S152-P155 WeakPolarHBondContact O-CD 3.33Å; S152-P155 WeakPolarHBondContact O-CG 3.3Å
153	I	94.8	Very high	91.7	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-76.8	-36.8	-175.6	-63.4	-52.2	0	0	0	112	E101 F104 I105 L108 T150 D151 E156 V157 F206	E101-I153 HydrophobicContact CG-CD1 4.06Å; F104-I153 HydrophobicContact CD1-CD1 3.89Å; F104-I153 HydrophobicContact CD1-CG2 4.33Å; F104-I153 HydrophobicContact CE1-CG2 3.93Å; I105-I153 HydrophobicContact CD1-CD1 3.93Å; I105-I153 HydrophobicContact CG1-CD1 3.42Å; I105-I153 VanDerWaalsContact CG1-CD1 3.42Å; L108-I153 HydrophobicContact CD1-CG2 4.31Å; T150-I153 PolarHBondContact O-N 2.99Å; T150-I153 VanDerWaalsContact O-N 3.1Å; D151-I153 VanDerWaalsContact C-N 3.34Å; I153-E156 PolarHBondContact O-N 3.16Å; I153-E156 VanDerWaalsContact O-N 3.12Å; I153-V157 HydrophobicContact CG2-CG2 3.61Å; I153-V157 WeakPolarHBondContact O-CG2 3.49Å; I153-V157 PolarHBondContact O-N 2.84Å; I153-F206 HydrophobicContact CG2-CE2 4.29Å
154	Y	95.8	Very high	92	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-50.5	-52.9	-178.3	-71	-89.6	0	0	0	114.7	I149 T150 E156 V157 V158 F206 F212 Q213 V216 A217	I149-Y154 HydrophobicContact CG2-CE1 4.42Å; I149-Y154 HydrophobicContact CG2-CE2 3.7Å; I149-Y154 WeakPolarHBondContact CG2-OH 3.35Å; T150-Y154 VanDerWaalsContact O-CD2 3.28Å; T150-Y154 WeakPolarHBondContact O-CD2 3Å; Y154-E156 VanDerWaalsContact C-N 3.29Å; Y154-E156 PolarHBondContact O-N 3Å; Y154-V157 PolarHBondContact O-N 3.1Å; Y154-V158 WeakPolarHBondContact O-CG2 3.45Å; Y154-V158 PolarHBondContact O-N 2.98Å; Y154-F206 HydrophobicContact CD1-CE1 4Å; Y154-F206 AromaticContact CD1-CZ 3.62Å; Y154-F206 HydrophobicContact CD1-CZ 3.62Å; Y154-F206 HydrophobicContact CE1-CE1 4.13Å; Y154-F206 AromaticContact CE1-CZ 3.69Å; Y154-F206 HydrophobicContact CE1-CZ 3.69Å; Y154-F206 HydrophobicContact CG-CZ 4.22Å; Y154-F212 HydrophobicContact CD1-CE2 4.48Å; Y154-F212 AromaticContact CE1-CD2 3.95Å; Y154-F212 HydrophobicContact CE1-CD2 3.95Å; Y154-F212 AromaticContact CE1-CE2 3.8Å; Y154-F212 HydrophobicContact CE1-CE2 3.8Å; Y154-F212 HydrophobicContact CE1-CZ 4.49Å; Y154-Q213 PolarHBondContact OH-N 3.45Å; Y154-V216 HydrophobicContact CD2-CG1 3.77Å; Y154-V216 HydrophobicContact CE2-CB 4.23Å; Y154-V216 HydrophobicContact CE2-CG1 3.91Å; Y154-V216 HydrophobicContact CG-CG1 4.25Å; Y154-A217 HydrophobicContact CD1-CB 3.8Å; Y154-A217 HydrophobicContact CE1-CB 3.66Å
155	P	96	Very high	92.3	Very high	31 Å²	31	32.6 Å²	32.6	20%	0.201	19%	0.194	C	C	.	.	H	α-helix	trans	-63.2	-33.9	179.7	22	-32.6	0	0	0	113.1	D151 S152 R159 Y220	D151-P155 WeakPolarHBondContact O-CD 3.36Å; S152-P155 WeakPolarHBondContact O-CD 3.33Å; S152-P155 WeakPolarHBondContact O-CG 3.3Å; P155-R159 WeakPolarHBondContact O-CB 3.15Å; P155-R159 PolarHBondContact O-N 3.19Å; P155-Y220 HydrophobicContact CB-CD1 4.22Å; P155-Y220 HydrophobicContact CB-CE1 3.6Å; P155-Y220 HydrophobicContact CG-CE1 4.3Å
156	E	96.6	Very high	92.7	Very high	21 Å²	21	30.8 Å²	30.8	10%	0.098	18%	0.184	C	C	.	.	H	α-helix	trans	-75	-38	-178.6	-60.5	-61.7	134.8	0	0	111.3	I105 L108 K109 I153 Y154 R159 M160	I105-E156 HydrophobicContact CG2-CG 4.08Å; L108-E156 HydrophobicContact CB-CB 4.46Å; L108-E156 HydrophobicContact CD1-CB 3.88Å; K109-E156 WeakPolarHBondContact CE-OE2 3.46Å; K109-E156 WeakPolarHBondContact CG-OE2 3.38Å; I153-E156 PolarHBondContact O-N 3.16Å; I153-E156 VanDerWaalsContact O-N 3.12Å; Y154-E156 VanDerWaalsContact C-N 3.29Å; Y154-E156 PolarHBondContact O-N 3Å; E156-R159 PolarHBondContact O-N 3Å; E156-R159 IonicContact OE1-CZ 2.8Å; E156-R159 IonicContact OE1-NH1 3.41Å; E156-R159 PolarHBondContact OE1-NH1 2.87Å; E156-R159 IonicContact OE1-NH2 3.88Å; E156-R159 PolarHBondContact OE1-NH2 3Å; E156-R159 IonicContact OE2-CZ 2.8Å; E156-R159 IonicContact OE2-NH1 3.76Å; E156-R159 PolarHBondContact OE2-NH1 2.8Å; E156-M160 WeakPolarHBondContact O-CB 3.38Å; E156-M160 PolarHBondContact O-N 3.46Å
157	V	96.7	Very high	93.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.1	-49.9	171.2	168.4	0	0	0	0	110.7	L108 I153 Y154 R159 M160 V161 F202 F206	L108-V157 HydrophobicContact CD1-CG2 3.81Å; L108-V157 HydrophobicContact CD2-CG2 4.18Å; I153-V157 HydrophobicContact CG2-CG2 3.61Å; I153-V157 WeakPolarHBondContact O-CG2 3.49Å; I153-V157 PolarHBondContact O-N 2.84Å; Y154-V157 PolarHBondContact O-N 3.1Å; V157-R159 VanDerWaalsContact C-N 3.33Å; V157-R159 PolarHBondContact O-N 3.02Å; V157-M160 PolarHBondContact O-N 2.9Å; V157-V161 HydrophobicContact CG1-CG2 4.38Å; V157-V161 WeakPolarHBondContact O-CB 3.37Å; V157-V161 VanDerWaalsContact O-CG2 3.31Å; V157-V161 WeakPolarHBondContact O-CG2 3.41Å; V157-V161 PolarHBondContact O-N 2.89Å; V157-F202 HydrophobicContact CB-CE1 4.42Å; V157-F202 HydrophobicContact CG1-CE1 3.86Å; V157-F202 HydrophobicContact CG2-CE1 3.86Å; V157-F202 HydrophobicContact CG2-CZ 4.02Å; V157-F206 HydrophobicContact CB-CE1 4.36Å; V157-F206 HydrophobicContact CB-CZ 4.37Å; V157-F206 HydrophobicContact CG1-CD1 3.83Å; V157-F206 HydrophobicContact CG1-CE1 3.88Å; V157-F206 HydrophobicContact CG1-CG 4.21Å; V157-F206 HydrophobicContact CG1-CZ 4.33Å; V157-F206 HydrophobicContact CG2-CD2 4.38Å; V157-F206 HydrophobicContact CG2-CE2 4.12Å; V157-F206 HydrophobicContact CG2-CZ 4.24Å
158	V	96.3	Very high	94.1	Very high	7 Å²	7	29.6 Å²	29.6	4%	0.042	16%	0.162	C	C	.	.	H	α-helix	trans	-63	-41.3	-179.7	172.7	0	0	0	0	110.8	Y154 M160 V161 E162 F221 F225	Y154-V158 WeakPolarHBondContact O-CG2 3.45Å; Y154-V158 PolarHBondContact O-N 2.98Å; V158-M160 PolarHBondContact O-N 3.12Å; V158-V161 PolarHBondContact O-N 3.32Å; V158-E162 HydrophobicContact CG1-CG 4.06Å; V158-E162 WeakPolarHBondContact O-CB 3.41Å; V158-E162 VanDerWaalsContact O-CG 3.31Å; V158-E162 WeakPolarHBondContact O-CG 3.45Å; V158-E162 PolarHBondContact O-N 2.89Å; V158-F221 HydrophobicContact CG2-CD2 4.25Å; V158-F221 HydrophobicContact CG2-CE2 3.81Å; V158-F221 HydrophobicContact CG2-CZ 4.42Å; V158-F225 HydrophobicContact CG1-CD2 4.19Å; V158-F225 HydrophobicContact CG1-CE2 4.39Å
159	R	96.3	Very high	94.4	Very high	115 Å²	115	31.3 Å²	31.3	43%	0.434	17%	0.171	S	C	.	.	H	α-helix	trans	-61.1	-42.5	175.3	-168.1	-174.3	-56.6	136.8	12.5	112.5	P155 E156 V157 V161 A163	P155-R159 WeakPolarHBondContact O-CB 3.15Å; P155-R159 PolarHBondContact O-N 3.19Å; E156-R159 PolarHBondContact O-N 3Å; E156-R159 IonicContact OE1-CZ 2.8Å; E156-R159 IonicContact OE1-NH1 3.41Å; E156-R159 PolarHBondContact OE1-NH1 2.87Å; E156-R159 IonicContact OE1-NH2 3.88Å; E156-R159 PolarHBondContact OE1-NH2 3Å; E156-R159 IonicContact OE2-CZ 2.8Å; E156-R159 IonicContact OE2-NH1 3.76Å; E156-R159 PolarHBondContact OE2-NH1 2.8Å; V157-R159 VanDerWaalsContact C-N 3.33Å; V157-R159 PolarHBondContact O-N 3.02Å; R159-V161 VanDerWaalsContact C-N 3.35Å; R159-A163 WeakPolarHBondContact O-CB 2.98Å; R159-A163 PolarHBondContact O-N 3.32Å
160	M	97	Very high	94.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-42.8	177.1	-175.9	-79.5	-72.3	0	0	111.1	L108 C111 S112 L135 E156 V157 V158 N164 V199 F202	L108-M160 HydrophobicContact CD2-CB 4.43Å; L108-M160 HydrophobicContact CD2-CE 4.04Å; L108-M160 HydrophobicContact CD2-CG 4.44Å; C111-M160 HydrophobicContact CB-CG 3.9Å; C111-M160 HydrophobicContact CB-SD 4.5Å; S112-M160 WeakPolarHBondContact OG-CA 3.23Å; L135-M160 HydrophobicContact CD2-CE 4.34Å; L135-M160 HydrophobicContact CD2-SD 4.23Å; E156-M160 WeakPolarHBondContact O-CB 3.38Å; E156-M160 PolarHBondContact O-N 3.46Å; V157-M160 PolarHBondContact O-N 2.9Å; V158-M160 PolarHBondContact O-N 3.12Å; M160-N164 PolarHBondContact O-N 3.16Å; M160-N164 PolarHBondContact O-ND2 2.95Å; M160-V199 HydrophobicContact CE-CG1 4.4Å; M160-V199 HydrophobicContact SD-CG1 3.89Å; M160-V199 HydrophobicContact SD-CG2 4.05Å; M160-F202 HydrophobicContact CE-CD1 3.44Å; M160-F202 VanDerWaalsContact CE-CD1 3.44Å; M160-F202 HydrophobicContact CE-CE1 3.7Å; M160-F202 HydrophobicContact CE-CG 4.26Å
161	V	96.8	Very high	93.7	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.8	-49.9	175.8	167	0	0	0	0	111.6	V157 V158 R159 A163 N164 L165 F166 V199 L203 F225	V157-V161 HydrophobicContact CG1-CG2 4.38Å; V157-V161 WeakPolarHBondContact O-CB 3.37Å; V157-V161 VanDerWaalsContact O-CG2 3.31Å; V157-V161 WeakPolarHBondContact O-CG2 3.41Å; V157-V161 PolarHBondContact O-N 2.89Å; V158-V161 PolarHBondContact O-N 3.32Å; R159-V161 VanDerWaalsContact C-N 3.35Å; V161-A163 VanDerWaalsContact C-N 3.29Å; V161-A163 PolarHBondContact O-N 3.24Å; V161-N164 PolarHBondContact O-N 2.7Å; V161-L165 HydrophobicContact CG1-CD1 3.82Å; V161-L165 HydrophobicContact CG1-CG 4.26Å; V161-L165 WeakPolarHBondContact O-CB 3.36Å; V161-L165 PolarHBondContact O-N 3.39Å; V161-F166 HydrophobicContact CG1-CZ 4.41Å; V161-V199 HydrophobicContact CG2-CG1 4.47Å; V161-L203 HydrophobicContact CG1-CD2 3.83Å; V161-L203 HydrophobicContact CG2-CB 4.26Å; V161-L203 HydrophobicContact CG2-CD1 4.1Å; V161-L203 HydrophobicContact CG2-CD2 4.09Å; V161-L203 HydrophobicContact CG2-CG 4.38Å; V161-F225 HydrophobicContact CG1-CE2 3.93Å; V161-F225 HydrophobicContact CG1-CZ 4.22Å
162	E	95.9	Very high	93.2	Very high	64 Å²	64	35.8 Å²	35.8	30%	0.299	21%	0.207	S	C	.	.	H	α-helix	trans	-59.4	-40.2	179.9	-72.8	-171.1	140.9	0	0	111.7	V158 F166 K224	V158-E162 HydrophobicContact CG1-CG 4.06Å; V158-E162 WeakPolarHBondContact O-CB 3.41Å; V158-E162 VanDerWaalsContact O-CG 3.31Å; V158-E162 WeakPolarHBondContact O-CG 3.45Å; V158-E162 PolarHBondContact O-N 2.89Å; E162-F166 HydrophobicContact CB-CD2 4Å; E162-F166 HydrophobicContact CB-CE2 4.49Å; E162-F166 HydrophobicContact CG-CD2 3.67Å; E162-F166 HydrophobicContact CG-CE2 3.76Å; E162-F166 PolarHBondContact O-N 3.42Å; E162-K224 IonicContact OE1-NZ 3.56Å
163	A	95	Very high	92.5	Very high	43 Å²	43	36.6 Å²	36.6	36%	0.355	21%	0.213	S	C	.	.	H	α-helix	trans	-66.6	-36	179.3	0	0	0	0	0	112.8	V114 R159 V161	V114-A163 WeakPolarHBondContact CG2-O 3.37Å; R159-A163 WeakPolarHBondContact O-CB 2.98Å; R159-A163 PolarHBondContact O-N 3.32Å; V161-A163 VanDerWaalsContact C-N 3.29Å; V161-A163 PolarHBondContact O-N 3.24Å
164	N	96.4	Very high	91.4	Very high	10 Å²	10	38.1 Å²	38.1	5%	0.053	22%	0.221	C	C	.	.	H	α-helix	trans	-93.2	-41.5	-173.6	-77.1	-76.7	0	0	0	113.8	C111 K131 M160 V161 L196 V199	C111-N164 PolarHBondContact O-ND2 2.8Å; K131-N164 WeakPolarHBondContact CE-OD1 3.38Å; K131-N164 PolarHBondContact NZ-OD1 2.78Å; M160-N164 PolarHBondContact O-N 3.16Å; M160-N164 PolarHBondContact O-ND2 2.95Å; V161-N164 PolarHBondContact O-N 2.7Å; N164-L196 VanDerWaalsContact O-CD2 3.3Å; N164-L196 WeakPolarHBondContact O-CD2 3.4Å; N164-V199 HydrophobicContact CB-CG1 4.05Å; N164-V199 HydrophobicContact CB-CG2 4Å
165	L	96.3	Very high	90.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-93.6	-44.6	-170.7	-57.2	-170.4	0	0	0	112.7	V161 R167 L196 V199 Y200 L203 L232	V161-L165 HydrophobicContact CG1-CD1 3.82Å; V161-L165 HydrophobicContact CG1-CG 4.26Å; V161-L165 WeakPolarHBondContact O-CB 3.36Å; V161-L165 PolarHBondContact O-N 3.39Å; L165-R167 VanDerWaalsContact C-N 3.31Å; L165-R167 PolarHBondContact O-N 3.35Å; L165-R167 PolarHBondContact O-NH1 3.39Å; L165-L196 HydrophobicContact CD2-CD2 3.91Å; L165-V199 HydrophobicContact CD1-CG1 4.19Å; L165-V199 HydrophobicContact CD2-CB 4.07Å; L165-V199 HydrophobicContact CD2-CG1 3.67Å; L165-V199 HydrophobicContact CG-CG1 3.8Å; L165-Y200 HydrophobicContact CD1-CD1 3.73Å; L165-Y200 HydrophobicContact CD1-CE1 3.49Å; L165-Y200 VanDerWaalsContact CD1-CE1 3.49Å; L165-Y200 HydrophobicContact CD1-CG 4.47Å; L165-Y200 HydrophobicContact CD2-CD1 4.26Å; L165-Y200 HydrophobicContact CD2-CD2 4.08Å; L165-Y200 HydrophobicContact CD2-CE1 3.99Å; L165-Y200 HydrophobicContact CD2-CE2 3.75Å; L165-Y200 HydrophobicContact CD2-CG 4.3Å; L165-Y200 HydrophobicContact CG-CE1 4.3Å; L165-L203 HydrophobicContact CD1-CD2 4.17Å; L165-L232 HydrophobicContact CB-CD1 4.16Å; L165-L232 WeakPolarHBondContact O-CD2 3.49Å
166	F	95.6	Very high	89.2	Confident	16 Å²	16	46.8 Å²	46.8	7%	0.07	28%	0.28	C	S	.	.			trans	-82.2	76.2	-167.9	-59.6	-23.9	0	0	0	112.6	V161 E162 F225 Q228 L229 L232	V161-F166 HydrophobicContact CG1-CZ 4.41Å; E162-F166 HydrophobicContact CB-CD2 4Å; E162-F166 HydrophobicContact CB-CE2 4.49Å; E162-F166 HydrophobicContact CG-CD2 3.67Å; E162-F166 HydrophobicContact CG-CE2 3.76Å; E162-F166 PolarHBondContact O-N 3.42Å; F166-F225 AromaticContact CE2-CD2 3.58Å; F166-F225 HydrophobicContact CE2-CD2 3.58Å; F166-F225 AromaticContact CE2-CE2 3.77Å; F166-F225 HydrophobicContact CE2-CE2 3.77Å; F166-F225 HydrophobicContact CE2-CG 4.23Å; F166-F225 HydrophobicContact CZ-CD1 4.43Å; F166-F225 AromaticContact CZ-CD2 3.67Å; F166-F225 HydrophobicContact CZ-CD2 3.67Å; F166-F225 HydrophobicContact CZ-CE1 4.32Å; F166-F225 AromaticContact CZ-CE2 3.55Å; F166-F225 HydrophobicContact CZ-CE2 3.55Å; F166-F225 HydrophobicContact CZ-CG 4.11Å; F166-F225 AromaticContact CZ-CZ 3.89Å; F166-F225 HydrophobicContact CZ-CZ 3.89Å; F166-Q228 HydrophobicContact CB-CB 4.07Å; F166-Q228 HydrophobicContact CD1-CB 3.69Å; F166-Q228 HydrophobicContact CD2-CB 3.62Å; F166-Q228 HydrophobicContact CD2-CG 4.24Å; F166-Q228 HydrophobicContact CE1-CB 3.98Å; F166-Q228 HydrophobicContact CE2-CB 3.91Å; F166-Q228 HydrophobicContact CG-CB 3.53Å; F166-Q228 HydrophobicContact CG-CG 4.37Å; F166-Q228 HydrophobicContact CZ-CB 4.09Å; F166-L229 HydrophobicContact CE1-CB 4.13Å; F166-L229 HydrophobicContact CE1-CD1 4.41Å; F166-L229 HydrophobicContact CZ-CB 4.4Å; F166-L232 HydrophobicContact CD1-CD1 3.87Å; F166-L232 HydrophobicContact CE1-CD1 4.08Å
167	R	92.3	Very high	88	Confident	12 Å²	12	48.3 Å²	48.3	5%	0.045	30%	0.302	C	S	.	.			trans	-109.6	160.8	177.4	66.7	-170.4	-176.4	-64	0.5	111.4	S74 L165 E190 E240	S74-R167 VanDerWaalsContact O-CB 3.24Å; S74-R167 WeakPolarHBondContact O-CB 2.92Å; S74-R167 WeakPolarHBondContact O-CD 3.37Å; L165-R167 VanDerWaalsContact C-N 3.31Å; L165-R167 PolarHBondContact O-N 3.35Å; L165-R167 PolarHBondContact O-NH1 3.39Å; R167-E190 IonicContact CZ-OE2 3.74Å; R167-E190 IonicContact NE-OE2 3.71Å; R167-E190 PolarHBondContact NE-OE2 2.92Å; R167-E190 VanDerWaalsContact NE-OE2 3.16Å; R167-E190 IonicContact NH2-OE2 2.85Å; R167-E190 PolarHBondContact NH2-OE2 3.23Å; R167-E240 IonicContact CZ-OE1 3.88Å; R167-E240 IonicContact CZ-OE2 2.64Å; R167-E240 IonicContact NH1-OE1 3.83Å; R167-E240 PolarHBondContact NH1-OE1 3.25Å; R167-E240 IonicContact NH1-OE2 3.63Å; R167-E240 IonicContact NH2-OE1 3.2Å; R167-E240 PolarHBondContact NH2-OE1 3.33Å; R167-E240 VanDerWaalsContact NH2-OE1 3.13Å; R167-E240 IonicContact NH2-OE2 3.79Å; R167-E240 PolarHBondContact NH2-OE2 3.16Å
168	T	89.5	Confident	86.9	Confident	100 Å²	100	52.8 Å²	52.8	61%	0.613	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-73.7	128.2	164.1	-57.9	0	0	0	0	107.8
169	L	89.8	Confident	85.8	Confident	38 Å²	38	62.1 Å²	62.1	20%	0.199	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-65.5	146.8	176.9	-64.9	173.9	0	0	0	110.5	E231 L232 D234	L169-E231 WeakPolarHBondContact CD1-O 3.46Å; L169-L232 HydrophobicContact CD2-CD2 4.28Å; L169-D234 VanDerWaalsContact CD1-C 3.41Å; L169-D234 HydrophobicContact CD1-CB 3.75Å
170	P	84.7	Confident	84.6	Confident	60 Å²	60	59.5 Å²	59.5	39%	0.39	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-60.7	155.6	175.4	27.1	-34	0	0	0	110.8
171	P	82.4	Confident	83.7	Confident	92 Å²	92	62.6 Å²	62.6	60%	0.597	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-54.8	144.8	171	-22	33	0	0	0	110.7	S173	P171-S173 PolarHBondContact O-N 3.14Å
172	P	80.9	Confident	82.7	Confident	94 Å²	94	64.7 Å²	64.7	61%	0.61	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-54.2	131.7	178.1	-24.3	32.7	0	0	0	111.1
173	S	76.7	Confident	81.7	Confident	65 Å²	65	67 Å²	67	46%	0.455	41%	0.414	S	S	.	.			trans	-80.1	-25.4	177.7	61.3	0	0	0	0	112.4	P171 T188 E236	P171-S173 PolarHBondContact O-N 3.14Å; S173-T188 PolarHBondContact OG-OG1 3.32Å; S173-E236 PolarHBondContact N-OE1 3.04Å; S173-E236 VanDerWaalsContact N-OE1 3.1Å; S173-E236 PolarHBondContact OG-OE1 3.05Å; S173-E236 PolarHBondContact OG-OE2 3.17Å
174	N	73.6	Confident	80.9	Confident	33 Å²	33	72.7 Å²	72.7	18%	0.176	43%	0.434	C	S	.	.	S	Bend	trans	-81	142.7	-174.2	-59.8	-22.9	0	0	0	112.6	S176 F180 D185	N174-S176 PolarHBondContact O-N 2.99Å; N174-F180 HydrophobicContact CB-CE2 3.74Å; N174-F180 HydrophobicContact CB-CZ 3.52Å; N174-D185 WeakPolarHBondContact ND2-CB 3.19Å; N174-D185 PolarHBondContact ND2-OD1 3.47Å; N174-D185 PolarHBondContact ND2-OD2 3.23Å
175	P	74.6	Confident	80.1	Confident	93 Å²	93	74.3 Å²	74.3	60%	0.604	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-63.7	133.4	-179.1	25	-32.7	0	0	0	111.4	F180	P175-F180 HydrophobicContact CG-CD2 3.85Å; P175-F180 HydrophobicContact CG-CE2 3.92Å; P175-F180 WeakPolarHBondContact O-CD2 3.35Å; P175-F180 VanDerWaalsContact O-CE2 3.24Å; P175-F180 WeakPolarHBondContact O-CE2 3.45Å; P175-F180 VanDerWaalsContact O-CG 3.26Å; P175-F180 WeakPolarHBondContact O-CG 3.41Å
176	S	69.5	Low	79.2	Confident	119 Å²	119	82.2 Å²	82.2	83%	0.832	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-85.6	130.6	172.8	-53.5	0	0	0	0	110.7	N174	N174-S176 PolarHBondContact O-N 2.99Å
177	G	71.2	Confident	78.6	Confident	54 Å²	54	85.1 Å²	85.1	56%	0.557	50%	0.5	S	S	*	.	S	Bend	trans	176.9	173.9	177.3	0	0	0	0	0	114.9	F180	G177-F180 WeakPolarHBondContact O-CB 3.3Å
178	A	73.9	Confident	78.2	Confident	94 Å²	94	87.5 Å²	87.5	78%	0.777	52%	0.515	S	S	*	.	S	Bend	trans	-82.6	-18.5	175.4	0	0	0	0	0	113.5	F180	A178-F180 VanDerWaalsContact C-N 3.28Å
179	E	73.2	Confident	78.3	Confident	202 Å²	202	87.5 Å²	87.5	94%	0.944	51%	0.511	S	S	*	.	S	Bend	trans	-87.4	-4.1	175	-59.3	-177.9	-177.3	0	0	112.1
180	F	71.2	Confident	78.3	Confident	61 Å²	61	86.9 Å²	86.9	27%	0.268	51%	0.507	S	S	.	.			trans	-82.7	124.3	-177.5	179.2	-107.9	0	0	0	110.6	N174 P175 G177 A178 P182 D185	N174-F180 HydrophobicContact CB-CE2 3.74Å; N174-F180 HydrophobicContact CB-CZ 3.52Å; P175-F180 HydrophobicContact CG-CD2 3.85Å; P175-F180 HydrophobicContact CG-CE2 3.92Å; P175-F180 WeakPolarHBondContact O-CD2 3.35Å; P175-F180 VanDerWaalsContact O-CE2 3.24Å; P175-F180 WeakPolarHBondContact O-CE2 3.45Å; P175-F180 VanDerWaalsContact O-CG 3.26Å; P175-F180 WeakPolarHBondContact O-CG 3.41Å; G177-F180 WeakPolarHBondContact O-CB 3.3Å; A178-F180 VanDerWaalsContact C-N 3.28Å; F180-P182 HydrophobicContact CD1-CB 4.5Å; F180-P182 HydrophobicContact CD1-CG 4.01Å; F180-P182 HydrophobicContact CE1-CB 3.85Å; F180-P182 HydrophobicContact CE1-CG 3.78Å; F180-P182 HydrophobicContact CZ-CB 4.47Å; F180-D185 WeakPolarHBondContact CE2-OD1 3.5Å; F180-D185 WeakPolarHBondContact CZ-OD1 3.19Å; F180-D185 WeakPolarHBondContact CZ-OD2 3.36Å
181	D	78.4	Confident	78.6	Confident	65 Å²	65	86 Å²	86	35%	0.348	51%	0.505	S	S	.	.			trans	-106.7	110	169.3	-170.4	-8.3	0	0	0	108.9	E183 E184	D181-E183 PolarHBondContact O-N 3.41Å; D181-E183 VanDerWaalsContact O-N 3.08Å; D181-E183 WeakPolarHBondContact OD1-CB 3.21Å; D181-E183 PolarHBondContact OD1-N 3.27Å; D181-E184 HydrophobicContact CB-CG 4.23Å; D181-E184 PolarHBondContact O-N 2.82Å
182	P	75.9	Confident	79.1	Confident	43 Å²	43	81.9 Å²	81.9	28%	0.279	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-9.1	-179.9	-4.8	16.2	0	0	0	113.6	F180 E184 I324	F180-P182 HydrophobicContact CD1-CB 4.5Å; F180-P182 HydrophobicContact CD1-CG 4.01Å; F180-P182 HydrophobicContact CE1-CB 3.85Å; F180-P182 HydrophobicContact CE1-CG 3.78Å; F180-P182 HydrophobicContact CZ-CB 4.47Å; P182-E184 VanDerWaalsContact C-N 3.28Å; P182-I324 HydrophobicContact CB-CD1 3.67Å; P182-I324 HydrophobicContact CG-CD1 4.05Å
183	E	75.1	Confident	79.8	Confident	113 Å²	113	78.4 Å²	78.4	53%	0.528	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-23.6	169.3	-64.4	-165.9	162.9	0	0	113.1	D181 S323 I324	D181-E183 PolarHBondContact O-N 3.41Å; D181-E183 VanDerWaalsContact O-N 3.08Å; D181-E183 WeakPolarHBondContact OD1-CB 3.21Å; D181-E183 PolarHBondContact OD1-N 3.27Å; E183-S323 VanDerWaalsContact CD-OG 3.32Å; E183-S323 WeakPolarHBondContact OE1-CB 3.44Å; E183-S323 PolarHBondContact OE1-OG 3.41Å; E183-I324 HydrophobicContact CG-CG1 4.09Å
184	E	78.5	Confident	80.6	Confident	163 Å²	163	78.5 Å²	78.5	76%	0.762	45%	0.453	S	S	*	.	S	Bend	trans	-89.5	-2.4	179.6	-61.9	-168.2	161.1	0	0	113.2	D181 P182 E186	D181-E184 HydrophobicContact CB-CG 4.23Å; D181-E184 PolarHBondContact O-N 2.82Å; P182-E184 VanDerWaalsContact C-N 3.28Å; E184-E186 PolarHBondContact O-N 3.38Å
185	D	77.9	Confident	81.6	Confident	43 Å²	43	77.3 Å²	77.3	23%	0.23	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-66.6	125.6	-177.4	-77.4	-19.4	0	0	0	113.1	N174 F180 P187	N174-D185 WeakPolarHBondContact ND2-CB 3.19Å; N174-D185 PolarHBondContact ND2-OD1 3.47Å; N174-D185 PolarHBondContact ND2-OD2 3.23Å; F180-D185 WeakPolarHBondContact CE2-OD1 3.5Å; F180-D185 WeakPolarHBondContact CZ-OD1 3.19Å; F180-D185 WeakPolarHBondContact CZ-OD2 3.36Å; D185-P187 WeakPolarHBondContact O-CD 3.45Å
186	E	79.1	Confident	82.7	Confident	167 Å²	167	73.2 Å²	73.2	78%	0.78	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-73.6	122.1	165.7	-71	-170.6	178.3	0	0	109.4	E184 T188	E184-E186 PolarHBondContact O-N 3.38Å; E186-T188 PolarHBondContact O-N 2.89Å
187	P	81.9	Confident	84	Confident	77 Å²	77	71 Å²	71	50%	0.5	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-68.7	125.2	-175.9	26.4	-33.7	0	0	0	111.2	D185 L189	D185-P187 WeakPolarHBondContact O-CD 3.45Å; P187-L189 PolarHBondContact O-N 2.97Å
188	T	84.5	Confident	85.2	Confident	61 Å²	61	69.4 Å²	69.4	37%	0.374	37%	0.374	S	S	.	.			trans	-74.2	113.1	171.4	-70.8	0	0	0	0	110.2	S173 E186	S173-T188 PolarHBondContact OG-OG1 3.32Å; E186-T188 PolarHBondContact O-N 2.89Å
189	L	91.1	Very high	86.4	Confident	100 Å²	100	65 Å²	65	52%	0.524	34%	0.337	S	S	.	.			trans	-82.2	139.7	-179.3	-59.2	-177	0	0	0	111.9	P187 A191	P187-L189 PolarHBondContact O-N 2.97Å; L189-A191 PolarHBondContact O-N 2.96Å
190	E	90	Very high	87.6	Confident	25 Å²	25	55.3 Å²	55.3	12%	0.117	29%	0.292	C	S	.	.			trans	-73.6	122.9	179.2	174.1	61.4	-109.7	0	0	111.2	S74 R167 A192 W193 L196 D237	S74-E190 PolarHBondContact OG-OE1 3.25Å; R167-E190 IonicContact CZ-OE2 3.74Å; R167-E190 IonicContact NE-OE2 3.71Å; R167-E190 PolarHBondContact NE-OE2 2.92Å; R167-E190 VanDerWaalsContact NE-OE2 3.16Å; R167-E190 IonicContact NH2-OE2 2.85Å; R167-E190 PolarHBondContact NH2-OE2 3.23Å; E190-A192 VanDerWaalsContact C-N 3.29Å; E190-A192 HydrophobicContact CG-CB 4.38Å; E190-A192 PolarHBondContact O-N 3.43Å; E190-A192 PolarHBondContact OE1-N 3.22Å; E190-W193 WeakPolarHBondContact O-CB 3.24Å; E190-W193 PolarHBondContact O-N 3.03Å; E190-W193 VanDerWaalsContact O-N 3.15Å; E190-L196 HydrophobicContact CG-CD1 3.44Å; E190-L196 VanDerWaalsContact CG-CD1 3.44Å; E190-D237 HydrophobicContact CB-CB 4.46Å; E190-D237 PolarHBondContact N-OD2 3.34Å
191	A	91.5	Very high	88.8	Confident	41 Å²	41	55 Å²	55	34%	0.339	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-29.9	-176.3	0	0	0	0	0	112.9	F117 V118 L189 W193	F117-A191 HydrophobicContact CB-CB 3.97Å; V118-A191 HydrophobicContact CG2-CB 3.56Å; L189-A191 PolarHBondContact O-N 2.96Å; A191-W193 PolarHBondContact O-N 2.98Å
192	A	93.3	Very high	89.7	Confident	7 Å²	7	51.9 Å²	51.9	6%	0.058	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	6.3	177.1	0	0	0	0	0	114.1	F117 E190 P194 H195 L196	F117-A192 VanDerWaalsContact CD2-CA 3.5Å; F117-A192 HydrophobicContact CD2-CB 3.52Å; F117-A192 HydrophobicContact CE2-CB 3.96Å; F117-A192 HydrophobicContact CG-CB 4.19Å; E190-A192 VanDerWaalsContact C-N 3.29Å; E190-A192 HydrophobicContact CG-CB 4.38Å; E190-A192 PolarHBondContact O-N 3.43Å; E190-A192 PolarHBondContact OE1-N 3.22Å; A192-P194 VanDerWaalsContact C-N 3.32Å; A192-P194 VanDerWaalsContact O-N 3.14Å; A192-H195 PolarHBondContact O-N 3.03Å; A192-L196 HydrophobicContact CB-CD1 4.07Å; A192-L196 HydrophobicContact CB-CG 4.23Å; A192-L196 PolarHBondContact O-N 3.03Å; A192-L196 VanDerWaalsContact O-N 3.12Å
193	W	95.2	Very high	90.7	Very high	21 Å²	21	49.9 Å²	49.9	8%	0.08	26%	0.262	C	S	.	.	H	α-helix	trans	-48.1	-40	-177.1	-169.6	-107.4	0	0	0	115.4	E190 A191 H195 L196 Q197 Y200 R239 E240 L243	E190-W193 WeakPolarHBondContact O-CB 3.24Å; E190-W193 PolarHBondContact O-N 3.03Å; E190-W193 VanDerWaalsContact O-N 3.15Å; A191-W193 PolarHBondContact O-N 2.98Å; W193-H195 PolarHBondContact O-N 2.89Å; W193-H195 VanDerWaalsContact O-N 3.1Å; W193-L196 HydrophobicContact CE3-CB 4.3Å; W193-L196 PolarHBondContact O-N 3.43Å; W193-Q197 HydrophobicContact CD2-CB 4.32Å; W193-Q197 HydrophobicContact CZ2-CB 4.01Å; W193-Q197 HydrophobicContact CZ2-CG 4.2Å; W193-Q197 VanDerWaalsContact O-CB 3.3Å; W193-Q197 WeakPolarHBondContact O-CB 3.31Å; W193-Q197 PolarHBondContact O-N 3.05Å; W193-Y200 HydrophobicContact CH2-CD2 4.48Å; W193-Y200 HydrophobicContact CZ3-CD2 4.33Å; W193-Y200 HydrophobicContact CZ3-CE2 4.34Å; W193-R239 VanDerWaalsContact CD1-NH1 3.31Å; W193-R239 VanDerWaalsContact CH2-C 3.42Å; W193-R239 HydrophobicContact CH2-CB 3.57Å; W193-R239 HydrophobicContact CZ2-CB 3.38Å; W193-R239 HydrophobicContact CZ2-CG 4.42Å; W193-R239 HydrophobicContact CZ3-CB 4.3Å; W193-E240 HydrophobicContact CH2-CB 4.36Å; W193-E240 HydrophobicContact CZ3-CB 3.78Å; W193-E240 HydrophobicContact CZ3-CG 4.45Å; W193-L243 HydrophobicContact CH2-CD1 3.64Å; W193-L243 HydrophobicContact CZ2-CD1 4.01Å
194	P	93.4	Very high	91.8	Very high	67 Å²	67	44.9 Å²	44.9	44%	0.435	24%	0.239	S	C	.	.	H	α-helix	trans	-58	-27.3	179	-26.7	36.1	0	0	0	114.8	A192	A192-P194 VanDerWaalsContact C-N 3.32Å; A192-P194 VanDerWaalsContact O-N 3.14Å
195	H	95.1	Very high	92.6	Very high	7 Å²	7	41.8 Å²	41.8	3%	0.032	22%	0.22	C	C	.	.	H	α-helix	trans	-91.3	-44.3	172.6	-72.5	-179.6	0	0	0	111.4	F115 F117 K128 A192 W193 Q197 L198 V199	F115-H195 AromaticContact CD2-CE1 3.72Å; F117-H195 HydrophobicContact CE2-CB 4.5Å; F117-H195 AromaticContact CE2-ND1 3.6Å; F117-H195 AromaticContact CZ-CE1 3.68Å; F117-H195 AromaticContact CZ-CG 3.8Å; F117-H195 AromaticContact CZ-ND1 3.62Å; F117-H195 AromaticContact CZ-NE2 3.95Å; K128-H195 PolarHBondContact O-NE2 3.12Å; A192-H195 PolarHBondContact O-N 3.03Å; W193-H195 PolarHBondContact O-N 2.89Å; W193-H195 VanDerWaalsContact O-N 3.1Å; H195-Q197 PolarHBondContact O-N 2.81Å; H195-L198 PolarHBondContact O-N 2.94Å; H195-V199 WeakPolarHBondContact O-CG2 3.35Å; H195-V199 PolarHBondContact O-N 3.09Å; H195-V199 VanDerWaalsContact O-N 3.16Å
196	L	96.4	Very high	93.5	Very high	7 Å²	7	39.8 Å²	39.8	4%	0.037	21%	0.209	C	C	.	.	H	α-helix	trans	-62.2	-41.6	-175.9	-65.1	176.2	0	0	0	112.4	N164 L165 E190 A192 W193 L198 V199 Y200	N164-L196 VanDerWaalsContact O-CD2 3.3Å; N164-L196 WeakPolarHBondContact O-CD2 3.4Å; L165-L196 HydrophobicContact CD2-CD2 3.91Å; E190-L196 HydrophobicContact CG-CD1 3.44Å; E190-L196 VanDerWaalsContact CG-CD1 3.44Å; A192-L196 HydrophobicContact CB-CD1 4.07Å; A192-L196 HydrophobicContact CB-CG 4.23Å; A192-L196 PolarHBondContact O-N 3.03Å; A192-L196 VanDerWaalsContact O-N 3.12Å; W193-L196 HydrophobicContact CE3-CB 4.3Å; W193-L196 PolarHBondContact O-N 3.43Å; L196-L198 VanDerWaalsContact C-N 3.29Å; L196-L198 PolarHBondContact O-N 3.22Å; L196-V199 PolarHBondContact O-N 3.4Å; L196-V199 VanDerWaalsContact O-N 3.12Å; L196-Y200 HydrophobicContact CB-CD2 4.37Å; L196-Y200 HydrophobicContact CB-CE2 4.32Å; L196-Y200 WeakPolarHBondContact O-CD2 3.4Å; L196-Y200 PolarHBondContact O-N 3.2Å
197	Q	97.3	Very high	94.3	Very high	73 Å²	73	31.9 Å²	31.9	34%	0.341	17%	0.172	S	C	.	.	H	α-helix	trans	-52.7	-48.7	176.3	-178.7	-178.7	-13.6	0	0	111.2	W193 H195 V199 Y200 E201	W193-Q197 HydrophobicContact CD2-CB 4.32Å; W193-Q197 HydrophobicContact CZ2-CB 4.01Å; W193-Q197 HydrophobicContact CZ2-CG 4.2Å; W193-Q197 VanDerWaalsContact O-CB 3.3Å; W193-Q197 WeakPolarHBondContact O-CB 3.31Å; W193-Q197 PolarHBondContact O-N 3.05Å; H195-Q197 PolarHBondContact O-N 2.81Å; Q197-V199 VanDerWaalsContact C-N 3.35Å; Q197-V199 PolarHBondContact O-N 3.33Å; Q197-Y200 PolarHBondContact O-N 3.13Å; Q197-E201 HydrophobicContact CG-CG 4.48Å; Q197-E201 WeakPolarHBondContact CG-OE1 3.4Å; Q197-E201 PolarHBondContact NE2-OE1 3.25Å; Q197-E201 WeakPolarHBondContact O-CB 3.4Å; Q197-E201 WeakPolarHBondContact O-CG 3.19Å; Q197-E201 PolarHBondContact O-N 2.95Å
198	L	97.4	Very high	94.9	Very high	21 Å²	21	30.9 Å²	30.9	11%	0.11	16%	0.161	C	C	.	.	H	α-helix	trans	-67.5	-35.3	-179	-62.7	175.5	0	0	0	112.2	R132 L135 H195 L196 F202	R132-L198 HydrophobicContact CG-CD1 3.69Å; L135-L198 HydrophobicContact CB-CB 3.83Å; L135-L198 HydrophobicContact CB-CD1 3.98Å; L135-L198 HydrophobicContact CD1-CB 4.07Å; H195-L198 PolarHBondContact O-N 2.94Å; L196-L198 VanDerWaalsContact C-N 3.29Å; L196-L198 PolarHBondContact O-N 3.22Å; L198-F202 WeakPolarHBondContact O-CB 3.39Å; L198-F202 PolarHBondContact O-N 3.45Å
199	V	98	Very high	95.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66.3	-43.7	175.2	177.1	0	0	0	0	110.9	L135 M160 V161 N164 L165 H195 L196 Q197 F202 L203	L135-V199 HydrophobicContact CD1-CG2 3.84Å; L135-V199 HydrophobicContact CD2-CG2 3.96Å; M160-V199 HydrophobicContact CE-CG1 4.4Å; M160-V199 HydrophobicContact SD-CG1 3.89Å; M160-V199 HydrophobicContact SD-CG2 4.05Å; V161-V199 HydrophobicContact CG2-CG1 4.47Å; N164-V199 HydrophobicContact CB-CG1 4.05Å; N164-V199 HydrophobicContact CB-CG2 4Å; L165-V199 HydrophobicContact CD1-CG1 4.19Å; L165-V199 HydrophobicContact CD2-CB 4.07Å; L165-V199 HydrophobicContact CD2-CG1 3.67Å; L165-V199 HydrophobicContact CG-CG1 3.8Å; H195-V199 WeakPolarHBondContact O-CG2 3.35Å; H195-V199 PolarHBondContact O-N 3.09Å; H195-V199 VanDerWaalsContact O-N 3.16Å; L196-V199 PolarHBondContact O-N 3.4Å; L196-V199 VanDerWaalsContact O-N 3.12Å; Q197-V199 VanDerWaalsContact C-N 3.35Å; Q197-V199 PolarHBondContact O-N 3.33Å; V199-F202 PolarHBondContact O-N 2.89Å; V199-L203 WeakPolarHBondContact O-CB 3.32Å; V199-L203 PolarHBondContact O-N 2.97Å
200	Y	98.1	Very high	95.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.2	-46.6	175.4	-80.5	-61.5	0	0	0	112.1	L165 W193 L196 Q197 L203 L204 L232 E240 L243 V244 I247	L165-Y200 HydrophobicContact CD1-CD1 3.73Å; L165-Y200 HydrophobicContact CD1-CE1 3.49Å; L165-Y200 VanDerWaalsContact CD1-CE1 3.49Å; L165-Y200 HydrophobicContact CD1-CG 4.47Å; L165-Y200 HydrophobicContact CD2-CD1 4.26Å; L165-Y200 HydrophobicContact CD2-CD2 4.08Å; L165-Y200 HydrophobicContact CD2-CE1 3.99Å; L165-Y200 HydrophobicContact CD2-CE2 3.75Å; L165-Y200 HydrophobicContact CD2-CG 4.3Å; L165-Y200 HydrophobicContact CG-CE1 4.3Å; W193-Y200 HydrophobicContact CH2-CD2 4.48Å; W193-Y200 HydrophobicContact CZ3-CD2 4.33Å; W193-Y200 HydrophobicContact CZ3-CE2 4.34Å; L196-Y200 HydrophobicContact CB-CD2 4.37Å; L196-Y200 HydrophobicContact CB-CE2 4.32Å; L196-Y200 WeakPolarHBondContact O-CD2 3.4Å; L196-Y200 PolarHBondContact O-N 3.2Å; Q197-Y200 PolarHBondContact O-N 3.13Å; Y200-L203 PolarHBondContact O-N 3.36Å; Y200-L204 WeakPolarHBondContact O-CB 3.49Å; Y200-L204 PolarHBondContact O-N 3.33Å; Y200-L232 WeakPolarHBondContact OH-CD1 3.41Å; Y200-E240 HydrophobicContact CE2-CG 3.74Å; Y200-E240 VanDerWaalsContact OH-CG 3.31Å; Y200-E240 WeakPolarHBondContact OH-CG 3.38Å; Y200-E240 PolarHBondContact OH-OE1 2.77Å; Y200-L243 VanDerWaalsContact CB-CD1 3.48Å; Y200-L243 HydrophobicContact CD1-CB 4.17Å; Y200-L243 HydrophobicContact CD2-CD1 4.03Å; Y200-L243 HydrophobicContact CG-CB 4.02Å; Y200-L243 HydrophobicContact CG-CD1 3.92Å; Y200-V244 HydrophobicContact CE1-CG2 3.57Å; Y200-I247 HydrophobicContact CD1-CD1 3.6Å; Y200-I247 HydrophobicContact CE1-CD1 4.38Å
201	E	96.7	Very high	95.4	Very high	53 Å²	53	31.2 Å²	31.2	25%	0.248	17%	0.17	C	C	.	.	H	α-helix	trans	-61.1	-44.8	176.8	-75.4	179.2	-164.2	0	0	111.6	Q197 L204 R205	Q197-E201 HydrophobicContact CG-CG 4.48Å; Q197-E201 WeakPolarHBondContact CG-OE1 3.4Å; Q197-E201 PolarHBondContact NE2-OE1 3.25Å; Q197-E201 WeakPolarHBondContact O-CB 3.4Å; Q197-E201 WeakPolarHBondContact O-CG 3.19Å; Q197-E201 PolarHBondContact O-N 2.95Å; E201-L204 PolarHBondContact O-N 2.89Å; E201-R205 VanDerWaalsContact O-CG 3.28Å; E201-R205 WeakPolarHBondContact O-CG 3.31Å; E201-R205 PolarHBondContact O-N 3.26Å
202	F	97.6	Very high	95.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.9	-49.8	174.7	176.9	-95.5	0	0	0	111.6	F104 L108 L138 L142 V157 M160 L198 V199 L204 R205 F206	F104-F202 HydrophobicContact CE1-CZ 4.31Å; F104-F202 AromaticContact CZ-CE2 3.93Å; F104-F202 HydrophobicContact CZ-CE2 3.93Å; F104-F202 AromaticContact CZ-CZ 4Å; F104-F202 HydrophobicContact CZ-CZ 4Å; L108-F202 HydrophobicContact CD2-CE1 4.01Å; L108-F202 HydrophobicContact CD2-CZ 3.86Å; L138-F202 HydrophobicContact CB-CD2 4.04Å; L138-F202 HydrophobicContact CB-CE2 3.87Å; L142-F202 HydrophobicContact CB-CE2 4.49Å; L142-F202 HydrophobicContact CD2-CD2 4.11Å; L142-F202 HydrophobicContact CD2-CE2 3.76Å; L142-F202 HydrophobicContact CD2-CZ 4.26Å; V157-F202 HydrophobicContact CB-CE1 4.42Å; V157-F202 HydrophobicContact CG1-CE1 3.86Å; V157-F202 HydrophobicContact CG2-CE1 3.86Å; V157-F202 HydrophobicContact CG2-CZ 4.02Å; M160-F202 HydrophobicContact CE-CD1 3.44Å; M160-F202 VanDerWaalsContact CE-CD1 3.44Å; M160-F202 HydrophobicContact CE-CE1 3.7Å; M160-F202 HydrophobicContact CE-CG 4.26Å; L198-F202 WeakPolarHBondContact O-CB 3.39Å; L198-F202 PolarHBondContact O-N 3.45Å; V199-F202 PolarHBondContact O-N 2.89Å; F202-L204 VanDerWaalsContact C-N 3.33Å; F202-L204 PolarHBondContact O-N 2.97Å; F202-R205 PolarHBondContact O-N 2.7Å; F202-F206 VanDerWaalsContact O-CB 3.32Å; F202-F206 WeakPolarHBondContact O-CB 3.47Å; F202-F206 PolarHBondContact O-N 3.43Å
203	L	97.5	Very high	95.5	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-61	-42.6	179.2	176.9	56.3	0	0	0	111.6	V161 L165 V199 Y200 F206 I207 F221 F225 I247	V161-L203 HydrophobicContact CG1-CD2 3.83Å; V161-L203 HydrophobicContact CG2-CB 4.26Å; V161-L203 HydrophobicContact CG2-CD1 4.1Å; V161-L203 HydrophobicContact CG2-CD2 4.09Å; V161-L203 HydrophobicContact CG2-CG 4.38Å; L165-L203 HydrophobicContact CD1-CD2 4.17Å; V199-L203 WeakPolarHBondContact O-CB 3.32Å; V199-L203 PolarHBondContact O-N 2.97Å; Y200-L203 PolarHBondContact O-N 3.36Å; L203-F206 PolarHBondContact O-N 3.34Å; L203-I207 HydrophobicContact CD1-CD1 3.7Å; L203-I207 HydrophobicContact CD1-CG1 4.06Å; L203-I207 HydrophobicContact CG-CD1 3.92Å; L203-I207 WeakPolarHBondContact O-CG1 3.42Å; L203-I207 PolarHBondContact O-N 3.45Å; L203-F221 HydrophobicContact CD1-CE1 4.44Å; L203-F221 HydrophobicContact CD1-CZ 4.15Å; L203-F225 HydrophobicContact CD2-CZ 4.38Å; L203-I247 HydrophobicContact CB-CD1 4.5Å; L203-I247 HydrophobicContact CD2-CD1 4.12Å; L203-I247 HydrophobicContact CD2-CG2 4.11Å; L203-I247 HydrophobicContact CG-CD1 4.31Å; L203-I247 HydrophobicContact CG-CG2 4.38Å
204	L	97.1	Very high	95.5	Very high	8 Å²	8	35.2 Å²	35.2	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-61.3	-49.5	177.2	-179.2	59.9	0	0	0	111	Y200 E201 F202 F206 I207 E208 T246 I247 R250	Y200-L204 WeakPolarHBondContact O-CB 3.49Å; Y200-L204 PolarHBondContact O-N 3.33Å; E201-L204 PolarHBondContact O-N 2.89Å; F202-L204 VanDerWaalsContact C-N 3.33Å; F202-L204 PolarHBondContact O-N 2.97Å; L204-F206 VanDerWaalsContact C-N 3.3Å; L204-F206 PolarHBondContact O-N 2.79Å; L204-I207 PolarHBondContact O-N 3.36Å; L204-E208 HydrophobicContact CD1-CG 4Å; L204-E208 HydrophobicContact CG-CG 4.45Å; L204-E208 WeakPolarHBondContact O-CB 3.45Å; L204-E208 WeakPolarHBondContact O-CG 3.32Å; L204-E208 PolarHBondContact O-N 3.02Å; L204-T246 HydrophobicContact CD1-CG2 3.76Å; L204-T246 HydrophobicContact CD2-CG2 4.01Å; L204-I247 HydrophobicContact CB-CG1 4.15Å; L204-I247 HydrophobicContact CD1-CG1 4.16Å; L204-R250 HydrophobicContact CD1-CG 4.13Å
205	R	95.7	Very high	95.5	Very high	99 Å²	99	37.9 Å²	37.9	37%	0.374	20%	0.195	S	C	.	.	H	α-helix	trans	-62.7	-36.5	177.5	-65.2	-68.8	151.5	62.7	8.3	112.3	T139 L142 E201 F202 E208 S209	T139-R205 HydrophobicContact CG2-CG 4.28Å; L142-R205 HydrophobicContact CD2-CB 4.23Å; E201-R205 VanDerWaalsContact O-CG 3.28Å; E201-R205 WeakPolarHBondContact O-CG 3.31Å; E201-R205 PolarHBondContact O-N 3.26Å; F202-R205 PolarHBondContact O-N 2.7Å; R205-E208 PolarHBondContact O-N 3.02Å; R205-S209 PolarHBondContact O-N 3.12Å
206	F	96.2	Very high	95.5	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-62.2	-47	175	-179.1	-107.3	0	0	0	112.2	L142 I149 I153 Y154 V157 F202 L203 L204 S209 F212 F221	L142-F206 HydrophobicContact CD1-CD2 4.39Å; L142-F206 HydrophobicContact CD2-CB 3.88Å; L142-F206 HydrophobicContact CD2-CD2 4.36Å; I149-F206 HydrophobicContact CD1-CD2 4.06Å; I149-F206 HydrophobicContact CD1-CE2 4.06Å; I149-F206 HydrophobicContact CG1-CD2 4.38Å; I149-F206 HydrophobicContact CG1-CE2 4.11Å; I149-F206 HydrophobicContact CG2-CE2 3.89Å; I149-F206 HydrophobicContact CG2-CZ 4.35Å; I153-F206 HydrophobicContact CG2-CE2 4.29Å; Y154-F206 HydrophobicContact CD1-CE1 4Å; Y154-F206 AromaticContact CD1-CZ 3.62Å; Y154-F206 HydrophobicContact CD1-CZ 3.62Å; Y154-F206 HydrophobicContact CE1-CE1 4.13Å; Y154-F206 AromaticContact CE1-CZ 3.69Å; Y154-F206 HydrophobicContact CE1-CZ 3.69Å; Y154-F206 HydrophobicContact CG-CZ 4.22Å; V157-F206 HydrophobicContact CB-CE1 4.36Å; V157-F206 HydrophobicContact CB-CZ 4.37Å; V157-F206 HydrophobicContact CG1-CD1 3.83Å; V157-F206 HydrophobicContact CG1-CE1 3.88Å; V157-F206 HydrophobicContact CG1-CG 4.21Å; V157-F206 HydrophobicContact CG1-CZ 4.33Å; V157-F206 HydrophobicContact CG2-CD2 4.38Å; V157-F206 HydrophobicContact CG2-CE2 4.12Å; V157-F206 HydrophobicContact CG2-CZ 4.24Å; F202-F206 VanDerWaalsContact O-CB 3.32Å; F202-F206 WeakPolarHBondContact O-CB 3.47Å; F202-F206 PolarHBondContact O-N 3.43Å; L203-F206 PolarHBondContact O-N 3.34Å; L204-F206 VanDerWaalsContact C-N 3.3Å; L204-F206 PolarHBondContact O-N 2.79Å; F206-S209 WeakPolarHBondContact O-CB 3.43Å; F206-F212 HydrophobicContact CD1-CD2 4.11Å; F206-F212 AromaticContact CD1-CE2 3.92Å; F206-F212 HydrophobicContact CD1-CE2 3.92Å; F206-F212 AromaticContact CE1-CD2 3.9Å; F206-F212 HydrophobicContact CE1-CD2 3.9Å; F206-F212 AromaticContact CE1-CE2 3.58Å; F206-F212 HydrophobicContact CE1-CE2 3.58Å; F206-F212 HydrophobicContact CZ-CD2 4.24Å; F206-F212 HydrophobicContact CZ-CE2 4.26Å; F206-F212 VanDerWaalsContact O-CD2 3.3Å; F206-F212 WeakPolarHBondContact O-CD2 3.44Å; F206-F221 HydrophobicContact CE1-CE2 4.49Å
207	I	95.9	Very high	95.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-69.7	-38.3	178.3	-64.9	165.4	0	0	0	111	L203 L204 S209 F212 F221 I247 R250 V251 K254	L203-I207 HydrophobicContact CD1-CD1 3.7Å; L203-I207 HydrophobicContact CD1-CG1 4.06Å; L203-I207 HydrophobicContact CG-CD1 3.92Å; L203-I207 WeakPolarHBondContact O-CG1 3.42Å; L203-I207 PolarHBondContact O-N 3.45Å; L204-I207 PolarHBondContact O-N 3.36Å; I207-S209 VanDerWaalsContact C-N 3.31Å; I207-F212 HydrophobicContact CG1-CE2 4.42Å; I207-F221 HydrophobicContact CD1-CE1 3.93Å; I207-F221 HydrophobicContact CD1-CZ 4.34Å; I207-F221 HydrophobicContact CG1-CE1 4.21Å; I207-F221 HydrophobicContact CG1-CZ 4.21Å; I207-I247 HydrophobicContact CD1-CG2 3.89Å; I207-R250 HydrophobicContact CG2-CB 3.76Å; I207-V251 HydrophobicContact CD1-CG2 4.11Å; I207-K254 HydrophobicContact CG2-CD 4.17Å; I207-K254 WeakPolarHBondContact O-CE 3.33Å; I207-K254 PolarHBondContact O-NZ 3.43Å
208	E	94.4	Very high	95.2	Very high	56 Å²	56	40.6 Å²	40.6	26%	0.262	21%	0.207	S	C	.	.	H	α-helix	trans	-76	-17.8	-179	-71.4	-174.1	153.3	0	0	113.6	L204 R205 R250	L204-E208 HydrophobicContact CD1-CG 4Å; L204-E208 HydrophobicContact CG-CG 4.45Å; L204-E208 WeakPolarHBondContact O-CB 3.45Å; L204-E208 WeakPolarHBondContact O-CG 3.32Å; L204-E208 PolarHBondContact O-N 3.02Å; R205-E208 PolarHBondContact O-N 3.02Å; E208-R250 HydrophobicContact CG-CG 4.28Å; E208-R250 IonicContact OE1-CZ 4Å; E208-R250 VanDerWaalsContact OE1-CZ 3.23Å; E208-R250 IonicContact OE1-NE 3.16Å; E208-R250 PolarHBondContact OE1-NE 3.18Å; E208-R250 IonicContact OE1-NH2 2.66Å; E208-R250 PolarHBondContact OE1-NH2 3.4Å
209	S	93.3	Very high	95	Very high	12 Å²	12	48.9 Å²	48.9	8%	0.084	24%	0.237	C	C	.	.			trans	-51.8	135.1	179	-176.9	0	0	0	0	111.7	I149 R205 F206 I207 N211 F212	I149-S209 WeakPolarHBondContact CD1-OG 3.32Å; R205-S209 PolarHBondContact O-N 3.12Å; F206-S209 WeakPolarHBondContact O-CB 3.43Å; I207-S209 VanDerWaalsContact C-N 3.31Å; S209-N211 PolarHBondContact O-N 3.15Å; S209-N211 PolarHBondContact OG-N 2.86Å; S209-F212 WeakPolarHBondContact O-CB 3.4Å; S209-F212 PolarHBondContact O-N 2.69Å; S209-F212 VanDerWaalsContact O-N 3.13Å
210	P	91.6	Very high	94.9	Very high	121 Å²	121	52.4 Å²	52.4	79%	0.786	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-21.5	176.1	25.7	-33.7	0	0	0	112.7	F212	P210-F212 VanDerWaalsContact C-N 3.33Å
211	N	91.7	Very high	94.8	Very high	61 Å²	61	52.5 Å²	52.5	33%	0.326	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-0.7	179	-53	-66.2	0	0	0	113	S146 I149 S209 Q213	S146-N211 WeakPolarHBondContact CA-ND2 3.38Å; S146-N211 WeakPolarHBondContact CB-ND2 3.33Å; S146-N211 PolarHBondContact O-ND2 2.77Å; S146-N211 PolarHBondContact O-OD1 3.4Å; I149-N211 HydrophobicContact CD1-CB 4.41Å; S209-N211 PolarHBondContact O-N 3.15Å; S209-N211 PolarHBondContact OG-N 2.86Å; N211-Q213 PolarHBondContact O-N 3.35Å
212	F	93.9	Very high	94.7	Very high	11 Å²	11	53 Å²	53	5%	0.048	26%	0.255	C	S	.	.			trans	-67.4	126.1	174.6	-177.3	-92.3	0	0	0	110.6	Y154 F206 I207 S209 P210 P214 A217 F221 K254 F255	Y154-F212 HydrophobicContact CD1-CE2 4.48Å; Y154-F212 AromaticContact CE1-CD2 3.95Å; Y154-F212 HydrophobicContact CE1-CD2 3.95Å; Y154-F212 AromaticContact CE1-CE2 3.8Å; Y154-F212 HydrophobicContact CE1-CE2 3.8Å; Y154-F212 HydrophobicContact CE1-CZ 4.49Å; F206-F212 HydrophobicContact CD1-CD2 4.11Å; F206-F212 AromaticContact CD1-CE2 3.92Å; F206-F212 HydrophobicContact CD1-CE2 3.92Å; F206-F212 AromaticContact CE1-CD2 3.9Å; F206-F212 HydrophobicContact CE1-CD2 3.9Å; F206-F212 AromaticContact CE1-CE2 3.58Å; F206-F212 HydrophobicContact CE1-CE2 3.58Å; F206-F212 HydrophobicContact CZ-CD2 4.24Å; F206-F212 HydrophobicContact CZ-CE2 4.26Å; F206-F212 VanDerWaalsContact O-CD2 3.3Å; F206-F212 WeakPolarHBondContact O-CD2 3.44Å; I207-F212 HydrophobicContact CG1-CE2 4.42Å; S209-F212 WeakPolarHBondContact O-CB 3.4Å; S209-F212 PolarHBondContact O-N 2.69Å; S209-F212 VanDerWaalsContact O-N 3.13Å; P210-F212 VanDerWaalsContact C-N 3.33Å; F212-P214 HydrophobicContact CD1-CG 4.19Å; F212-P214 HydrophobicContact CE1-CG 4.2Å; F212-P214 WeakPolarHBondContact O-CD 3.37Å; F212-A217 HydrophobicContact CE1-CB 3.99Å; F212-A217 HydrophobicContact CE2-CB 3.94Å; F212-A217 HydrophobicContact CZ-CB 3.4Å; F212-A217 VanDerWaalsContact CZ-CB 3.4Å; F212-F221 HydrophobicContact CE2-CE2 4.43Å; F212-F221 HydrophobicContact CZ-CE2 4.41Å; F212-K254 HydrophobicContact CD1-CD 3.84Å; F212-K254 HydrophobicContact CE1-CD 4.04Å; F212-F255 HydrophobicContact CE1-CE2 4.23Å; F212-F255 AromaticContact CE1-CZ 3.84Å; F212-F255 HydrophobicContact CE1-CZ 3.84Å; F212-F255 HydrophobicContact CZ-CE2 4.17Å; F212-F255 AromaticContact CZ-CZ 3.71Å; F212-F255 HydrophobicContact CZ-CZ 3.71Å
213	Q	94	Very high	94.7	Very high	99 Å²	99	56.1 Å²	56.1	46%	0.463	28%	0.275	S	S	.	.			trans	-108.5	102.8	-177.7	-60.9	-174.3	31.9	0	0	110.8	Y154 N211 N215 V216 A217	Y154-Q213 PolarHBondContact OH-N 3.45Å; N211-Q213 PolarHBondContact O-N 3.35Å; Q213-N215 PolarHBondContact O-N 2.87Å; Q213-N215 VanDerWaalsContact O-N 3.1Å; Q213-V216 HydrophobicContact CB-CB 4.41Å; Q213-V216 HydrophobicContact CB-CG2 4.13Å; Q213-V216 PolarHBondContact O-N 3.4Å; Q213-V216 VanDerWaalsContact O-N 3.1Å; Q213-A217 PolarHBondContact O-N 3.1Å; Q213-A217 VanDerWaalsContact O-N 3.08Å
214	P	94.3	Very high	94.6	Very high	43 Å²	43	61.3 Å²	61.3	28%	0.279	30%	0.297	S	S	.	.	H	α-helix	trans	-58	-29.6	-178.9	-25.9	35	0	0	0	113.8	F212 V216 A217 K218 K254 F255	F212-P214 HydrophobicContact CD1-CG 4.19Å; F212-P214 HydrophobicContact CE1-CG 4.2Å; F212-P214 WeakPolarHBondContact O-CD 3.37Å; P214-V216 VanDerWaalsContact C-N 3.33Å; P214-V216 PolarHBondContact O-N 2.93Å; P214-A217 PolarHBondContact O-N 2.93Å; P214-K218 WeakPolarHBondContact O-CB 3.39Å; P214-K218 PolarHBondContact O-N 2.98Å; P214-K254 HydrophobicContact CG-CB 4.33Å; P214-F255 HydrophobicContact CB-CD1 4.33Å; P214-F255 HydrophobicContact CB-CE1 4.13Å; P214-F255 WeakPolarHBondContact O-CE1 3.19Å
215	N	93.1	Very high	94.6	Very high	123 Å²	123	61 Å²	61	66%	0.658	30%	0.295	S	S	*	.	H	α-helix	trans	-67.8	-29.4	-180	-75.5	-32.2	0	0	0	114	Q213 K218	Q213-N215 PolarHBondContact O-N 2.87Å; Q213-N215 VanDerWaalsContact O-N 3.1Å; N215-K218 VanDerWaalsContact O-CE 3.23Å; N215-K218 WeakPolarHBondContact O-CE 3.2Å; N215-K218 WeakPolarHBondContact O-CG 3.3Å
216	V	94.2	Very high	94.7	Very high	22 Å²	22	56.2 Å²	56.2	13%	0.133	28%	0.278	C	S	.	.	H	α-helix	trans	-85	-48	174.3	-178.2	0	0	0	0	109	D151 Y154 Q213 P214 K218 R219	D151-V216 HydrophobicContact CB-CG1 4.41Å; Y154-V216 HydrophobicContact CD2-CG1 3.77Å; Y154-V216 HydrophobicContact CE2-CB 4.23Å; Y154-V216 HydrophobicContact CE2-CG1 3.91Å; Y154-V216 HydrophobicContact CG-CG1 4.25Å; Q213-V216 HydrophobicContact CB-CB 4.41Å; Q213-V216 HydrophobicContact CB-CG2 4.13Å; Q213-V216 PolarHBondContact O-N 3.4Å; Q213-V216 VanDerWaalsContact O-N 3.1Å; P214-V216 VanDerWaalsContact C-N 3.33Å; P214-V216 PolarHBondContact O-N 2.93Å; V216-K218 VanDerWaalsContact C-N 3.26Å; V216-K218 PolarHBondContact O-N 3.22Å; V216-R219 PolarHBondContact O-N 3.24Å
217	A	94.7	Very high	94.7	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-31	-177.1	0	0	0	0	0	114.1	Y154 F212 Q213 P214 R219 Y220 F221 F255	Y154-A217 HydrophobicContact CD1-CB 3.8Å; Y154-A217 HydrophobicContact CE1-CB 3.66Å; F212-A217 HydrophobicContact CE1-CB 3.99Å; F212-A217 HydrophobicContact CE2-CB 3.94Å; F212-A217 HydrophobicContact CZ-CB 3.4Å; F212-A217 VanDerWaalsContact CZ-CB 3.4Å; Q213-A217 PolarHBondContact O-N 3.1Å; Q213-A217 VanDerWaalsContact O-N 3.08Å; P214-A217 PolarHBondContact O-N 2.93Å; A217-R219 PolarHBondContact O-N 3.44Å; A217-Y220 PolarHBondContact O-N 2.84Å; A217-F221 HydrophobicContact CB-CD2 3.93Å; A217-F221 HydrophobicContact CB-CE2 4.31Å; A217-F221 WeakPolarHBondContact O-CD2 3.05Å; A217-F221 PolarHBondContact O-N 3.2Å; A217-F255 HydrophobicContact CB-CE1 3.88Å; A217-F255 HydrophobicContact CB-CZ 3.68Å
218	K	93.9	Very high	94.8	Very high	122 Å²	122	60.4 Å²	60.4	53%	0.53	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-18.3	-178.6	73.1	-174.5	-178.7	-177	0	114.7	P214 N215 V216 Y220 F255	P214-K218 WeakPolarHBondContact O-CB 3.39Å; P214-K218 PolarHBondContact O-N 2.98Å; N215-K218 VanDerWaalsContact O-CE 3.23Å; N215-K218 WeakPolarHBondContact O-CE 3.2Å; N215-K218 WeakPolarHBondContact O-CG 3.3Å; V216-K218 VanDerWaalsContact C-N 3.26Å; V216-K218 PolarHBondContact O-N 3.22Å; K218-Y220 VanDerWaalsContact C-N 3.26Å; K218-F255 HydrophobicContact CB-CD1 4.31Å; K218-F255 HydrophobicContact CB-CE1 4.23Å
219	R	94.1	Very high	94.9	Very high	195 Å²	195	57.8 Å²	57.8	74%	0.736	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-20.8	175.6	-60	-177.3	-172.3	-163.2	3.3	112.7	V216 A217	V216-R219 PolarHBondContact O-N 3.24Å; A217-R219 PolarHBondContact O-N 3.44Å
220	Y	95.3	Very high	95.1	Very high	73 Å²	73	57.5 Å²	57.5	29%	0.286	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-33.5	-175	-49.8	-75.9	0	0	0	111.9	P155 A217 K218 D222	P155-Y220 HydrophobicContact CB-CD1 4.22Å; P155-Y220 HydrophobicContact CB-CE1 3.6Å; P155-Y220 HydrophobicContact CG-CE1 4.3Å; A217-Y220 PolarHBondContact O-N 2.84Å; K218-Y220 VanDerWaalsContact C-N 3.26Å; Y220-D222 PolarHBondContact O-N 3.48Å; Y220-D222 VanDerWaalsContact O-N 3.09Å
221	F	95.7	Very high	95.4	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.009	27%	0.274	C	S	.	.	S	Bend	trans	-84.1	67	169.7	-72	-105	0	0	0	109.2	V158 L203 F206 I207 F212 A217 F225 V251 F255 L258	V158-F221 HydrophobicContact CG2-CD2 4.25Å; V158-F221 HydrophobicContact CG2-CE2 3.81Å; V158-F221 HydrophobicContact CG2-CZ 4.42Å; L203-F221 HydrophobicContact CD1-CE1 4.44Å; L203-F221 HydrophobicContact CD1-CZ 4.15Å; F206-F221 HydrophobicContact CE1-CE2 4.49Å; I207-F221 HydrophobicContact CD1-CE1 3.93Å; I207-F221 HydrophobicContact CD1-CZ 4.34Å; I207-F221 HydrophobicContact CG1-CE1 4.21Å; I207-F221 HydrophobicContact CG1-CZ 4.21Å; F212-F221 HydrophobicContact CE2-CE2 4.43Å; F212-F221 HydrophobicContact CZ-CE2 4.41Å; A217-F221 HydrophobicContact CB-CD2 3.93Å; A217-F221 HydrophobicContact CB-CE2 4.31Å; A217-F221 WeakPolarHBondContact O-CD2 3.05Å; A217-F221 PolarHBondContact O-N 3.2Å; F221-F225 AromaticContact CD1-CD1 3.87Å; F221-F225 HydrophobicContact CD1-CD1 3.87Å; F221-F225 AromaticContact CD1-CE1 3.6Å; F221-F225 HydrophobicContact CD1-CE1 3.6Å; F221-F225 HydrophobicContact CD1-CZ 4.03Å; F221-F225 HydrophobicContact CE1-CD1 4.4Å; F221-F225 AromaticContact CE1-CE1 3.69Å; F221-F225 HydrophobicContact CE1-CE1 3.69Å; F221-F225 HydrophobicContact CE1-CE2 4.46Å; F221-F225 AromaticContact CE1-CZ 3.73Å; F221-F225 HydrophobicContact CE1-CZ 3.73Å; F221-F225 HydrophobicContact CZ-CZ 4.41Å; F221-V251 HydrophobicContact CD1-CG2 4.26Å; F221-V251 HydrophobicContact CE1-CG2 4.39Å; F221-F255 HydrophobicContact CB-CE1 4.16Å; F221-F255 HydrophobicContact CB-CE2 4.05Å; F221-F255 HydrophobicContact CB-CZ 3.73Å; F221-F255 AromaticContact CD1-CE2 3.99Å; F221-F255 HydrophobicContact CD1-CE2 3.99Å; F221-F255 HydrophobicContact CD1-CZ 4.2Å; F221-F255 HydrophobicContact CD2-CZ 4.15Å; F221-F255 HydrophobicContact CG-CE2 4.02Å; F221-F255 AromaticContact CG-CZ 3.77Å; F221-F255 HydrophobicContact CG-CZ 3.77Å; F221-L258 WeakPolarHBondContact O-CD1 3.25Å
222	D	94.6	Very high	95.6	Very high	63 Å²	63	54.8 Å²	54.8	34%	0.337	26%	0.259	S	S	.	.			trans	-91.5	-173.5	-178.7	72	-1.6	0	0	0	112	Y220 K224 F225 V226	Y220-D222 PolarHBondContact O-N 3.48Å; Y220-D222 VanDerWaalsContact O-N 3.09Å; D222-K224 PolarHBondContact O-N 3.35Å; D222-K224 WeakPolarHBondContact OD1-CA 3.31Å; D222-K224 WeakPolarHBondContact OD1-CB 3.42Å; D222-K224 PolarHBondContact OD1-N 2.71Å; D222-F225 PolarHBondContact O-N 2.75Å; D222-F225 PolarHBondContact OD1-N 3.37Å; D222-V226 WeakPolarHBondContact O-CG2 3.44Å; D222-V226 PolarHBondContact O-N 3.35Å
223	T	96.9	Very high	95.8	Very high	67 Å²	67	54.2 Å²	54.2	41%	0.411	26%	0.257	S	S	.	.	H	α-helix	trans	-64.9	-29.5	177.8	50.3	0	0	0	0	112.8	L227 L258 F261	T223-L227 WeakPolarHBondContact O-CG 3.44Å; T223-L227 PolarHBondContact O-N 3.46Å; T223-L258 HydrophobicContact CG2-CD2 4.36Å; T223-F261 HydrophobicContact CG2-CD1 3.9Å; T223-F261 HydrophobicContact CG2-CD2 3.87Å; T223-F261 HydrophobicContact CG2-CE1 3.99Å; T223-F261 HydrophobicContact CG2-CE2 3.96Å; T223-F261 HydrophobicContact CG2-CG 3.83Å; T223-F261 HydrophobicContact CG2-CZ 4.02Å; T223-F261 WeakPolarHBondContact O-CE1 3.35Å
224	K	96.3	Very high	95.8	Very high	110 Å²	110	52.5 Å²	52.5	48%	0.478	25%	0.251	S	S	.	.	H	α-helix	trans	-69.2	-46.7	177.1	-179.9	-165.7	168.2	-146	0	110.2	E162 D222 V226 L227 Q228	E162-K224 IonicContact OE1-NZ 3.56Å; D222-K224 PolarHBondContact O-N 3.35Å; D222-K224 WeakPolarHBondContact OD1-CA 3.31Å; D222-K224 WeakPolarHBondContact OD1-CB 3.42Å; D222-K224 PolarHBondContact OD1-N 2.71Å; K224-V226 VanDerWaalsContact C-N 3.27Å; K224-V226 PolarHBondContact O-N 3.08Å; K224-L227 PolarHBondContact O-N 3.03Å; K224-L227 VanDerWaalsContact O-N 3.15Å; K224-Q228 WeakPolarHBondContact O-CG 3.31Å; K224-Q228 PolarHBondContact O-N 2.87Å
225	F	96.9	Very high	95.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-54.2	-46.4	174.3	-177.1	-84.6	0	0	0	111.1	V158 V161 F166 L203 F221 D222 L227 Q228 L229	V158-F225 HydrophobicContact CG1-CD2 4.19Å; V158-F225 HydrophobicContact CG1-CE2 4.39Å; V161-F225 HydrophobicContact CG1-CE2 3.93Å; V161-F225 HydrophobicContact CG1-CZ 4.22Å; F166-F225 AromaticContact CE2-CD2 3.58Å; F166-F225 HydrophobicContact CE2-CD2 3.58Å; F166-F225 AromaticContact CE2-CE2 3.77Å; F166-F225 HydrophobicContact CE2-CE2 3.77Å; F166-F225 HydrophobicContact CE2-CG 4.23Å; F166-F225 HydrophobicContact CZ-CD1 4.43Å; F166-F225 AromaticContact CZ-CD2 3.67Å; F166-F225 HydrophobicContact CZ-CD2 3.67Å; F166-F225 HydrophobicContact CZ-CE1 4.32Å; F166-F225 AromaticContact CZ-CE2 3.55Å; F166-F225 HydrophobicContact CZ-CE2 3.55Å; F166-F225 HydrophobicContact CZ-CG 4.11Å; F166-F225 AromaticContact CZ-CZ 3.89Å; F166-F225 HydrophobicContact CZ-CZ 3.89Å; L203-F225 HydrophobicContact CD2-CZ 4.38Å; F221-F225 AromaticContact CD1-CD1 3.87Å; F221-F225 HydrophobicContact CD1-CD1 3.87Å; F221-F225 AromaticContact CD1-CE1 3.6Å; F221-F225 HydrophobicContact CD1-CE1 3.6Å; F221-F225 HydrophobicContact CD1-CZ 4.03Å; F221-F225 HydrophobicContact CE1-CD1 4.4Å; F221-F225 AromaticContact CE1-CE1 3.69Å; F221-F225 HydrophobicContact CE1-CE1 3.69Å; F221-F225 HydrophobicContact CE1-CE2 4.46Å; F221-F225 AromaticContact CE1-CZ 3.73Å; F221-F225 HydrophobicContact CE1-CZ 3.73Å; F221-F225 HydrophobicContact CZ-CZ 4.41Å; D222-F225 PolarHBondContact O-N 2.75Å; D222-F225 PolarHBondContact OD1-N 3.37Å; F225-L227 PolarHBondContact O-N 3.48Å; F225-Q228 PolarHBondContact O-N 3.4Å; F225-L229 HydrophobicContact CE1-CD2 4.25Å; F225-L229 WeakPolarHBondContact O-CB 3.37Å; F225-L229 PolarHBondContact O-N 2.92Å
226	V	97.3	Very high	95.8	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-41.5	178.1	171.5	0	0	0	0	112.3	D222 K224 L229 L230 V251 L258 F261 I262	D222-V226 WeakPolarHBondContact O-CG2 3.44Å; D222-V226 PolarHBondContact O-N 3.35Å; K224-V226 VanDerWaalsContact C-N 3.27Å; K224-V226 PolarHBondContact O-N 3.08Å; V226-L229 PolarHBondContact O-N 3.15Å; V226-L230 HydrophobicContact CG1-CD1 3.9Å; V226-L230 HydrophobicContact CG1-CG 4.43Å; V226-L230 WeakPolarHBondContact O-CB 3.44Å; V226-L230 VanDerWaalsContact O-CG 3.31Å; V226-L230 WeakPolarHBondContact O-CG 3.4Å; V226-L230 PolarHBondContact O-N 3.36Å; V226-V251 HydrophobicContact CG2-CG1 4.39Å; V226-L258 HydrophobicContact CG2-CD1 3.92Å; V226-F261 HydrophobicContact CB-CD1 4.39Å; V226-F261 HydrophobicContact CB-CE1 4.12Å; V226-F261 HydrophobicContact CG1-CD1 4.02Å; V226-F261 HydrophobicContact CG1-CE1 3.91Å; V226-I262 HydrophobicContact CG1-CD1 4.47Å; V226-I262 HydrophobicContact CG1-CG1 3.7Å
227	L	97.1	Very high	95.8	Very high	64 Å²	64	45 Å²	45	34%	0.335	21%	0.207	S	C	.	.	H	α-helix	trans	-62.9	-46.6	177.6	-76.1	169.4	0	0	0	111.8	T223 K224 F225 L229 L230 E231 F261 Q265	T223-L227 WeakPolarHBondContact O-CG 3.44Å; T223-L227 PolarHBondContact O-N 3.46Å; K224-L227 PolarHBondContact O-N 3.03Å; K224-L227 VanDerWaalsContact O-N 3.15Å; F225-L227 PolarHBondContact O-N 3.48Å; L227-L229 VanDerWaalsContact C-N 3.3Å; L227-L229 PolarHBondContact O-N 3.09Å; L227-L230 WeakPolarHBondContact O-CB 3.49Å; L227-L230 PolarHBondContact O-N 3Å; L227-L230 VanDerWaalsContact O-N 3.12Å; L227-E231 WeakPolarHBondContact O-CG 3.46Å; L227-E231 PolarHBondContact O-N 3.39Å; L227-F261 HydrophobicContact CD1-CZ 3.96Å; L227-F261 HydrophobicContact CD2-CE1 4.36Å; L227-F261 HydrophobicContact CD2-CZ 3.94Å; L227-F261 HydrophobicContact CG-CE1 4.07Å; L227-F261 HydrophobicContact CG-CZ 3.72Å; L227-Q265 HydrophobicContact CD2-CG 3.86Å
228	Q	97	Very high	95.7	Very high	25 Å²	25	47.5 Å²	47.5	12%	0.117	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-35.1	179	-64	-175.5	-83	0	0	111.8	F166 K224 F225 L230	F166-Q228 HydrophobicContact CB-CB 4.07Å; F166-Q228 HydrophobicContact CD1-CB 3.69Å; F166-Q228 HydrophobicContact CD2-CB 3.62Å; F166-Q228 HydrophobicContact CD2-CG 4.24Å; F166-Q228 HydrophobicContact CE1-CB 3.98Å; F166-Q228 HydrophobicContact CE2-CB 3.91Å; F166-Q228 HydrophobicContact CG-CB 3.53Å; F166-Q228 HydrophobicContact CG-CG 4.37Å; F166-Q228 HydrophobicContact CZ-CB 4.09Å; K224-Q228 WeakPolarHBondContact O-CG 3.31Å; K224-Q228 PolarHBondContact O-N 2.87Å; F225-Q228 PolarHBondContact O-N 3.4Å; Q228-L230 VanDerWaalsContact C-N 3.34Å
229	L	97.4	Very high	95.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.8	-37.2	172.1	-174.6	64.7	0	0	0	112	F166 F225 V226 L227 L232 V244 I247 L248	F166-L229 HydrophobicContact CE1-CB 4.13Å; F166-L229 HydrophobicContact CE1-CD1 4.41Å; F166-L229 HydrophobicContact CZ-CB 4.4Å; F225-L229 HydrophobicContact CE1-CD2 4.25Å; F225-L229 WeakPolarHBondContact O-CB 3.37Å; F225-L229 PolarHBondContact O-N 2.92Å; V226-L229 PolarHBondContact O-N 3.15Å; L227-L229 VanDerWaalsContact C-N 3.3Å; L227-L229 PolarHBondContact O-N 3.09Å; L229-L232 HydrophobicContact CD1-CD1 4.38Å; L229-L232 WeakPolarHBondContact O-CB 3.15Å; L229-L232 PolarHBondContact O-N 2.69Å; L229-V244 HydrophobicContact CD1-CG1 3.88Å; L229-V244 HydrophobicContact CG-CG1 4.16Å; L229-V244 WeakPolarHBondContact O-CG1 3.49Å; L229-I247 HydrophobicContact CD1-CG2 4.5Å; L229-I247 HydrophobicContact CD2-CG2 4Å; L229-L248 HydrophobicContact CD2-CB 4.17Å; L229-L248 HydrophobicContact CD2-CD1 4.1Å
230	L	97.6	Very high	96	Very high	6 Å²	6	36.9 Å²	36.9	3%	0.031	18%	0.18	C	C	.	.	H	α-helix	trans	-68.8	-36.1	177.9	-80.2	168.5	0	0	0	113.1	V226 L227 Q228 L232 F233 L248 Q265 F266 I269 L286	V226-L230 HydrophobicContact CG1-CD1 3.9Å; V226-L230 HydrophobicContact CG1-CG 4.43Å; V226-L230 WeakPolarHBondContact O-CB 3.44Å; V226-L230 VanDerWaalsContact O-CG 3.31Å; V226-L230 WeakPolarHBondContact O-CG 3.4Å; V226-L230 PolarHBondContact O-N 3.36Å; L227-L230 WeakPolarHBondContact O-CB 3.49Å; L227-L230 PolarHBondContact O-N 3Å; L227-L230 VanDerWaalsContact O-N 3.12Å; Q228-L230 VanDerWaalsContact C-N 3.34Å; L230-L232 PolarHBondContact O-N 3.38Å; L230-F233 HydrophobicContact CD2-CD2 4.18Å; L230-F233 HydrophobicContact CD2-CE2 4.12Å; L230-F233 PolarHBondContact O-N 2.87Å; L230-F233 VanDerWaalsContact O-N 3.17Å; L230-L248 HydrophobicContact CD2-CD2 3.64Å; L230-Q265 HydrophobicContact CD1-CB 3.52Å; L230-Q265 HydrophobicContact CD1-CG 4.12Å; L230-F266 HydrophobicContact CD2-CD1 4.17Å; L230-F266 HydrophobicContact CD2-CE1 3.75Å; L230-I269 HydrophobicContact CB-CD1 4.26Å; L230-I269 HydrophobicContact CD2-CD1 4.11Å; L230-L286 HydrophobicContact CD2-CD2 4.12Å
231	E	96.4	Very high	96.1	Very high	124 Å²	124	35 Å²	35	58%	0.579	17%	0.172	S	C	*	.	H	α-helix	trans	-58.9	-27.7	175.5	-73.2	172.2	-173.8	0	0	112.2	L169 L227 F233 D234	L169-E231 WeakPolarHBondContact CD1-O 3.46Å; L227-E231 WeakPolarHBondContact O-CG 3.46Å; L227-E231 PolarHBondContact O-N 3.39Å; E231-F233 VanDerWaalsContact C-N 3.29Å; E231-F233 PolarHBondContact O-N 2.99Å; E231-D234 PolarHBondContact O-N 3.25Å
232	L	97.3	Very high	96.2	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-74.2	-13.5	-180	-61.6	171.9	0	0	0	114.3	L165 F166 L169 Y200 L229 L230 D234 S235 V244	L165-L232 HydrophobicContact CB-CD1 4.16Å; L165-L232 WeakPolarHBondContact O-CD2 3.49Å; F166-L232 HydrophobicContact CD1-CD1 3.87Å; F166-L232 HydrophobicContact CE1-CD1 4.08Å; L169-L232 HydrophobicContact CD2-CD2 4.28Å; Y200-L232 WeakPolarHBondContact OH-CD1 3.41Å; L229-L232 HydrophobicContact CD1-CD1 4.38Å; L229-L232 WeakPolarHBondContact O-CB 3.15Å; L229-L232 PolarHBondContact O-N 2.69Å; L230-L232 PolarHBondContact O-N 3.38Å; L232-D234 PolarHBondContact O-N 3.18Å; L232-S235 VanDerWaalsContact O-CB 3.32Å; L232-S235 WeakPolarHBondContact O-CB 3.49Å; L232-S235 PolarHBondContact O-N 3.1Å; L232-S235 VanDerWaalsContact O-N 3.17Å; L232-V244 HydrophobicContact CB-CG1 4.39Å; L232-V244 HydrophobicContact CB-CG2 3.99Å
233	F	97.4	Very high	96.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-64.6	-19.8	173.2	-84.6	-92.2	0	0	0	112.8	L230 E231 S235 R241 V244 K245 L248 G282 E285 L286 I289	L230-F233 HydrophobicContact CD2-CD2 4.18Å; L230-F233 HydrophobicContact CD2-CE2 4.12Å; L230-F233 PolarHBondContact O-N 2.87Å; L230-F233 VanDerWaalsContact O-N 3.17Å; E231-F233 VanDerWaalsContact C-N 3.29Å; E231-F233 PolarHBondContact O-N 2.99Å; F233-S235 PolarHBondContact O-N 3.49Å; F233-R241 WeakPolarHBondContact O-CD 3.24Å; F233-V244 HydrophobicContact CD2-CG1 3.6Å; F233-V244 HydrophobicContact CE2-CB 4.49Å; F233-V244 HydrophobicContact CE2-CG1 3.35Å; F233-V244 HydrophobicContact CG-CG1 4.31Å; F233-V244 HydrophobicContact CZ-CG1 3.86Å; F233-K245 HydrophobicContact CE1-CB 4.16Å; F233-K245 HydrophobicContact CZ-CB 4.46Å; F233-L248 HydrophobicContact CE2-CB 4.28Å; F233-L248 HydrophobicContact CE2-CD2 3.46Å; F233-L248 VanDerWaalsContact CE2-CD2 3.46Å; F233-L248 HydrophobicContact CE2-CG 4.48Å; F233-L248 HydrophobicContact CZ-CB 4.27Å; F233-L248 HydrophobicContact CZ-CD2 3.68Å; F233-G282 WeakPolarHBondContact O-CA 3.29Å; F233-G282 PolarHBondContact O-N 3.39Å; F233-G282 VanDerWaalsContact O-N 3.08Å; F233-E285 HydrophobicContact CD1-CB 4.07Å; F233-E285 HydrophobicContact CE1-CB 3.86Å; F233-L286 HydrophobicContact CD1-CD2 3.79Å; F233-L286 HydrophobicContact CD1-CG 3.75Å; F233-L286 HydrophobicContact CD2-CD2 3.94Å; F233-L286 HydrophobicContact CE1-CD2 3.76Å; F233-L286 HydrophobicContact CE1-CG 4.04Å; F233-L286 HydrophobicContact CE2-CD2 3.9Å; F233-L286 HydrophobicContact CG-CD2 3.87Å; F233-L286 HydrophobicContact CG-CG 4.07Å; F233-L286 HydrophobicContact CZ-CD2 3.81Å; F233-I289 HydrophobicContact CE1-CD1 4.24Å; F233-I289 HydrophobicContact CZ-CD1 3.77Å
234	D	95.1	Very high	96.4	Very high	63 Å²	63	32.7 Å²	32.7	34%	0.337	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-84	5.9	178.2	-152.9	27.7	0	0	0	112.8	L169 E231 L232 E236 H280 N281	L169-D234 VanDerWaalsContact CD1-C 3.41Å; L169-D234 HydrophobicContact CD1-CB 3.75Å; E231-D234 PolarHBondContact O-N 3.25Å; L232-D234 PolarHBondContact O-N 3.18Å; D234-E236 PolarHBondContact O-N 2.71Å; D234-H280 VanDerWaalsContact OD1-CA 3.31Å; D234-H280 WeakPolarHBondContact OD1-CA 3.32Å; D234-H280 IonicContact OD1-CD2 2.68Å; D234-H280 IonicContact OD1-CG 3.61Å; D234-H280 IonicContact OD1-ND1 3.08Å; D234-N281 PolarHBondContact O-ND2 2.85Å; D234-N281 PolarHBondContact OD1-N 2.78Å
235	S	94	Very high	96.5	Very high	7 Å²	7	28.2 Å²	28.2	5%	0.049	14%	0.138	C	C	.	.			trans	-59.9	134.1	174.1	-175.1	0	0	0	0	111	L232 F233 D237 E240 R241	L232-S235 VanDerWaalsContact O-CB 3.32Å; L232-S235 WeakPolarHBondContact O-CB 3.49Å; L232-S235 PolarHBondContact O-N 3.1Å; L232-S235 VanDerWaalsContact O-N 3.17Å; F233-S235 PolarHBondContact O-N 3.49Å; S235-D237 PolarHBondContact O-N 3.39Å; S235-D237 PolarHBondContact OG-N 3.03Å; S235-E240 WeakPolarHBondContact CB-OE2 2.91Å; S235-E240 PolarHBondContact OG-OE2 2.79Å; S235-R241 VanDerWaalsContact O-CD 3.3Å; S235-R241 WeakPolarHBondContact O-CD 3.39Å; S235-R241 WeakPolarHBondContact O-CG 3.14Å; S235-R241 PolarHBondContact O-NH1 3.4Å
236	E	92.2	Very high	96.5	Very high	23 Å²	23	28.8 Å²	28.8	11%	0.107	14%	0.141	C	C	.	.	S	Bend	trans	-66.1	-24.3	174.4	-71.7	177.9	116.6	0	0	111.5	S173 D234 P238 R241	S173-E236 PolarHBondContact N-OE1 3.04Å; S173-E236 VanDerWaalsContact N-OE1 3.1Å; S173-E236 PolarHBondContact OG-OE1 3.05Å; S173-E236 PolarHBondContact OG-OE2 3.17Å; D234-E236 PolarHBondContact O-N 2.71Å; E236-P238 VanDerWaalsContact O-CD 3.27Å; E236-P238 WeakPolarHBondContact O-CD 3.35Å; E236-R241 VanDerWaalsContact C-NH1 3.28Å; E236-R241 PolarHBondContact O-NH1 3.28Å
237	D	93.6	Very high	96.6	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	14%	0.141	C	C	.	.			trans	-78.9	111.5	-179.2	-165.6	-38.1	0	0	0	111.8	E190 S235 R239 E240 R241	E190-D237 HydrophobicContact CB-CB 4.46Å; E190-D237 PolarHBondContact N-OD2 3.34Å; S235-D237 PolarHBondContact O-N 3.39Å; S235-D237 PolarHBondContact OG-N 3.03Å; D237-R239 PolarHBondContact O-N 3.34Å; D237-R239 VanDerWaalsContact O-N 3.17Å; D237-R239 WeakPolarHBondContact OD1-CB 3.22Å; D237-R239 WeakPolarHBondContact OD1-CG 3.31Å; D237-R239 IonicContact OD1-CZ 2.72Å; D237-R239 PolarHBondContact OD1-N 3.33Å; D237-R239 IonicContact OD1-NE 2.78Å; D237-R239 PolarHBondContact OD1-NE 3.28Å; D237-R239 IonicContact OD1-NH2 3.23Å; D237-R239 IonicContact OD2-CZ 3.12Å; D237-R239 IonicContact OD2-NE 3.64Å; D237-R239 PolarHBondContact OD2-NE 2.95Å; D237-R239 IonicContact OD2-NH2 2.84Å; D237-R239 PolarHBondContact OD2-NH2 3Å; D237-E240 HydrophobicContact CB-CB 4.26Å; D237-E240 WeakPolarHBondContact O-CB 3.49Å; D237-E240 PolarHBondContact O-N 2.95Å; D237-E240 VanDerWaalsContact O-N 3.13Å; D237-R241 PolarHBondContact O-N 3.07Å
238	P	94.4	Very high	96.6	Very high	51 Å²	51	25.7 Å²	25.7	33%	0.331	13%	0.125	S	C	.	.	H	α-helix	trans	-62.2	-26.2	-178.7	24.6	-33.7	0	0	0	113.4	E236 E240 R241 D242	E236-P238 VanDerWaalsContact O-CD 3.27Å; E236-P238 WeakPolarHBondContact O-CD 3.35Å; P238-E240 VanDerWaalsContact C-N 3.34Å; P238-R241 PolarHBondContact O-N 3.34Å; P238-D242 PolarHBondContact O-N 3.39Å
239	R	96.4	Very high	96.7	Very high	94 Å²	94	26.1 Å²	26.1	36%	0.355	13%	0.127	S	C	.	.	H	α-helix	trans	-68.7	-38.2	179.3	-52.7	171.2	-67.4	-179.4	4	110.7	W193 D237 L243	W193-R239 VanDerWaalsContact CD1-NH1 3.31Å; W193-R239 VanDerWaalsContact CH2-C 3.42Å; W193-R239 HydrophobicContact CH2-CB 3.57Å; W193-R239 HydrophobicContact CZ2-CB 3.38Å; W193-R239 HydrophobicContact CZ2-CG 4.42Å; W193-R239 HydrophobicContact CZ3-CB 4.3Å; D237-R239 PolarHBondContact O-N 3.34Å; D237-R239 VanDerWaalsContact O-N 3.17Å; D237-R239 WeakPolarHBondContact OD1-CB 3.22Å; D237-R239 WeakPolarHBondContact OD1-CG 3.31Å; D237-R239 IonicContact OD1-CZ 2.72Å; D237-R239 PolarHBondContact OD1-N 3.33Å; D237-R239 IonicContact OD1-NE 2.78Å; D237-R239 PolarHBondContact OD1-NE 3.28Å; D237-R239 IonicContact OD1-NH2 3.23Å; D237-R239 IonicContact OD2-CZ 3.12Å; D237-R239 IonicContact OD2-NE 3.64Å; D237-R239 PolarHBondContact OD2-NE 2.95Å; D237-R239 IonicContact OD2-NH2 2.84Å; D237-R239 PolarHBondContact OD2-NH2 3Å; R239-L243 PolarHBondContact O-N 2.67Å
240	E	97.2	Very high	96.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.8	-48.2	174.8	-174.3	160.5	-149.9	0	0	110.2	R167 W193 Y200 S235 D237 P238 D242 L243 V244	R167-E240 IonicContact CZ-OE1 3.88Å; R167-E240 IonicContact CZ-OE2 2.64Å; R167-E240 IonicContact NH1-OE1 3.83Å; R167-E240 PolarHBondContact NH1-OE1 3.25Å; R167-E240 IonicContact NH1-OE2 3.63Å; R167-E240 IonicContact NH2-OE1 3.2Å; R167-E240 PolarHBondContact NH2-OE1 3.33Å; R167-E240 VanDerWaalsContact NH2-OE1 3.13Å; R167-E240 IonicContact NH2-OE2 3.79Å; R167-E240 PolarHBondContact NH2-OE2 3.16Å; W193-E240 HydrophobicContact CH2-CB 4.36Å; W193-E240 HydrophobicContact CZ3-CB 3.78Å; W193-E240 HydrophobicContact CZ3-CG 4.45Å; Y200-E240 HydrophobicContact CE2-CG 3.74Å; Y200-E240 VanDerWaalsContact OH-CG 3.31Å; Y200-E240 WeakPolarHBondContact OH-CG 3.38Å; Y200-E240 PolarHBondContact OH-OE1 2.77Å; S235-E240 WeakPolarHBondContact CB-OE2 2.91Å; S235-E240 PolarHBondContact OG-OE2 2.79Å; D237-E240 HydrophobicContact CB-CB 4.26Å; D237-E240 WeakPolarHBondContact O-CB 3.49Å; D237-E240 PolarHBondContact O-N 2.95Å; D237-E240 VanDerWaalsContact O-N 3.13Å; P238-E240 VanDerWaalsContact C-N 3.34Å; E240-D242 VanDerWaalsContact C-N 3.33Å; E240-D242 PolarHBondContact O-N 3.17Å; E240-L243 PolarHBondContact O-N 2.8Å; E240-V244 HydrophobicContact CG-CG2 4.17Å; E240-V244 WeakPolarHBondContact O-CB 3.49Å; E240-V244 VanDerWaalsContact O-CG2 3.22Å; E240-V244 WeakPolarHBondContact O-CG2 3.5Å; E240-V244 PolarHBondContact O-N 2.6Å
241	R	96.9	Very high	96.6	Very high	34 Å²	34	26.5 Å²	26.5	13%	0.128	13%	0.128	C	C	.	.	H	α-helix	trans	-58.6	-41.2	179.4	-61.1	-163.7	-58.4	-89.4	5.4	112.7	F233 S235 E236 D237 P238 V244 K245 E285	F233-R241 WeakPolarHBondContact O-CD 3.24Å; S235-R241 VanDerWaalsContact O-CD 3.3Å; S235-R241 WeakPolarHBondContact O-CD 3.39Å; S235-R241 WeakPolarHBondContact O-CG 3.14Å; S235-R241 PolarHBondContact O-NH1 3.4Å; E236-R241 VanDerWaalsContact C-NH1 3.28Å; E236-R241 PolarHBondContact O-NH1 3.28Å; D237-R241 PolarHBondContact O-N 3.07Å; P238-R241 PolarHBondContact O-N 3.34Å; R241-V244 PolarHBondContact O-N 3.34Å; R241-K245 WeakPolarHBondContact O-CB 3.12Å; R241-K245 PolarHBondContact O-N 3.35Å; R241-E285 HydrophobicContact CB-CG 4.11Å; R241-E285 IonicContact CZ-OE1 2.82Å; R241-E285 IonicContact NE-OE1 3.2Å; R241-E285 PolarHBondContact NE-OE1 2.8Å; R241-E285 IonicContact NE-OE2 3.22Å; R241-E285 IonicContact NH2-OE1 2.84Å
242	D	97.7	Very high	96.7	Very high	56 Å²	56	21.4 Å²	21.4	30%	0.299	10%	0.104	S	C	.	.	H	α-helix	trans	-65.8	-38.5	179.1	-170	64.4	0	0	0	113.3	P238 E240 K245 T246	P238-D242 PolarHBondContact O-N 3.39Å; E240-D242 VanDerWaalsContact C-N 3.33Å; E240-D242 PolarHBondContact O-N 3.17Å; D242-K245 WeakPolarHBondContact O-CB 3.49Å; D242-K245 WeakPolarHBondContact OD1-CE 3.21Å; D242-K245 IonicContact OD1-NZ 3.65Å; D242-K245 PolarHBondContact OD1-NZ 3.13Å; D242-T246 PolarHBondContact O-N 3.02Å; D242-T246 VanDerWaalsContact O-N 3.1Å; D242-T246 PolarHBondContact O-OG1 2.9Å
243	L	97.9	Very high	96.6	Very high	27 Å²	27	22.4 Å²	22.4	14%	0.141	11%	0.114	C	C	.	.	H	α-helix	trans	-70	-45.2	174.9	-71.4	174.1	0	0	0	111.5	W193 Y200 R239 E240 K245 T246 I247	W193-L243 HydrophobicContact CH2-CD1 3.64Å; W193-L243 HydrophobicContact CZ2-CD1 4.01Å; Y200-L243 VanDerWaalsContact CB-CD1 3.48Å; Y200-L243 HydrophobicContact CD1-CB 4.17Å; Y200-L243 HydrophobicContact CD2-CD1 4.03Å; Y200-L243 HydrophobicContact CG-CB 4.02Å; Y200-L243 HydrophobicContact CG-CD1 3.92Å; R239-L243 PolarHBondContact O-N 2.67Å; E240-L243 PolarHBondContact O-N 2.8Å; L243-K245 VanDerWaalsContact C-N 3.27Å; L243-K245 PolarHBondContact O-N 2.7Å; L243-T246 PolarHBondContact O-N 3.13Å; L243-I247 VanDerWaalsContact O-CG1 3.31Å; L243-I247 WeakPolarHBondContact O-CG1 3.22Å; L243-I247 PolarHBondContact O-N 2.79Å
244	V	98.1	Very high	96.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.2	-42.1	175.6	176.7	0	0	0	0	110.1	Y200 L229 L232 F233 E240 R241 T246 I247 L248	Y200-V244 HydrophobicContact CE1-CG2 3.57Å; L229-V244 HydrophobicContact CD1-CG1 3.88Å; L229-V244 HydrophobicContact CG-CG1 4.16Å; L229-V244 WeakPolarHBondContact O-CG1 3.49Å; L232-V244 HydrophobicContact CB-CG1 4.39Å; L232-V244 HydrophobicContact CB-CG2 3.99Å; F233-V244 HydrophobicContact CD2-CG1 3.6Å; F233-V244 HydrophobicContact CE2-CB 4.49Å; F233-V244 HydrophobicContact CE2-CG1 3.35Å; F233-V244 HydrophobicContact CG-CG1 4.31Å; F233-V244 HydrophobicContact CZ-CG1 3.86Å; E240-V244 HydrophobicContact CG-CG2 4.17Å; E240-V244 WeakPolarHBondContact O-CB 3.49Å; E240-V244 VanDerWaalsContact O-CG2 3.22Å; E240-V244 WeakPolarHBondContact O-CG2 3.5Å; E240-V244 PolarHBondContact O-N 2.6Å; R241-V244 PolarHBondContact O-N 3.34Å; V244-T246 PolarHBondContact O-N 3.25Å; V244-I247 PolarHBondContact O-N 2.81Å; V244-L248 VanDerWaalsContact O-CB 3.31Å; V244-L248 WeakPolarHBondContact O-CB 3.41Å; V244-L248 PolarHBondContact O-N 2.67Å
245	K	98.3	Very high	96.5	Very high	16 Å²	16	22.4 Å²	22.4	7%	0.07	11%	0.111	C	C	.	.	H	α-helix	trans	-53.5	-53.7	174.2	178.7	-175.3	62.8	-174.9	0	111.6	F233 R241 D242 L243 L248 H249 E285 E288 I289	F233-K245 HydrophobicContact CE1-CB 4.16Å; F233-K245 HydrophobicContact CZ-CB 4.46Å; R241-K245 WeakPolarHBondContact O-CB 3.12Å; R241-K245 PolarHBondContact O-N 3.35Å; D242-K245 WeakPolarHBondContact O-CB 3.49Å; D242-K245 WeakPolarHBondContact OD1-CE 3.21Å; D242-K245 IonicContact OD1-NZ 3.65Å; D242-K245 PolarHBondContact OD1-NZ 3.13Å; L243-K245 VanDerWaalsContact C-N 3.27Å; L243-K245 PolarHBondContact O-N 2.7Å; K245-L248 PolarHBondContact O-N 3.14Å; K245-H249 WeakPolarHBondContact O-CB 3.47Å; K245-H249 PolarHBondContact O-N 3.16Å; K245-E285 HydrophobicContact CB-CB 4.17Å; K245-E285 HydrophobicContact CD-CB 3.91Å; K245-E285 HydrophobicContact CD-CG 4.18Å; K245-E285 HydrophobicContact CG-CB 4.21Å; K245-E288 HydrophobicContact CD-CB 4.1Å; K245-E288 IonicContact NZ-OE1 2.74Å; K245-E288 PolarHBondContact NZ-OE1 3.24Å; K245-E288 IonicContact NZ-OE2 2.64Å; K245-E288 PolarHBondContact NZ-OE2 3.41Å; K245-I289 HydrophobicContact CB-CD1 4.4Å; K245-I289 HydrophobicContact CG-CD1 3.9Å; K245-I289 HydrophobicContact CG-CG1 3.69Å; K245-I289 WeakPolarHBondContact O-CD1 3.47Å
246	T	98.1	Very high	96.5	Very high	12 Å²	12	27.6 Å²	27.6	7%	0.074	14%	0.138	C	C	.	.	H	α-helix	trans	-62.2	-47.1	-178.3	-57.5	0	0	0	0	111.2	L204 D242 L243 V244 H249 R250	L204-T246 HydrophobicContact CD1-CG2 3.76Å; L204-T246 HydrophobicContact CD2-CG2 4.01Å; D242-T246 PolarHBondContact O-N 3.02Å; D242-T246 VanDerWaalsContact O-N 3.1Å; D242-T246 PolarHBondContact O-OG1 2.9Å; L243-T246 PolarHBondContact O-N 3.13Å; V244-T246 PolarHBondContact O-N 3.25Å; T246-H249 PolarHBondContact O-N 3.09Å; T246-R250 WeakPolarHBondContact O-CG 3.26Å; T246-R250 PolarHBondContact O-N 2.86Å; T246-R250 VanDerWaalsContact O-N 3.08Å
247	I	98.1	Very high	96.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.5	-47.7	-179.7	-69.7	164.5	0	0	0	111	Y200 L203 L204 I207 L229 L243 V244 H249 R250 V251	Y200-I247 HydrophobicContact CD1-CD1 3.6Å; Y200-I247 HydrophobicContact CE1-CD1 4.38Å; L203-I247 HydrophobicContact CB-CD1 4.5Å; L203-I247 HydrophobicContact CD2-CD1 4.12Å; L203-I247 HydrophobicContact CD2-CG2 4.11Å; L203-I247 HydrophobicContact CG-CD1 4.31Å; L203-I247 HydrophobicContact CG-CG2 4.38Å; L204-I247 HydrophobicContact CB-CG1 4.15Å; L204-I247 HydrophobicContact CD1-CG1 4.16Å; I207-I247 HydrophobicContact CD1-CG2 3.89Å; L229-I247 HydrophobicContact CD1-CG2 4.5Å; L229-I247 HydrophobicContact CD2-CG2 4Å; L243-I247 VanDerWaalsContact O-CG1 3.31Å; L243-I247 WeakPolarHBondContact O-CG1 3.22Å; L243-I247 PolarHBondContact O-N 2.79Å; V244-I247 PolarHBondContact O-N 2.81Å; I247-H249 VanDerWaalsContact C-N 3.31Å; I247-H249 PolarHBondContact O-N 3.35Å; I247-R250 WeakPolarHBondContact O-CB 3.37Å; I247-R250 PolarHBondContact O-N 2.87Å; I247-R250 VanDerWaalsContact O-N 3.15Å; I247-V251 HydrophobicContact CG2-CG2 4.42Å; I247-V251 WeakPolarHBondContact O-CG2 3.45Å; I247-V251 PolarHBondContact O-N 3.23Å
248	L	98.3	Very high	96.8	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-40	179.7	-178.9	66.7	0	0	0	111.6	L229 L230 F233 V244 K245 R250 V251 Y252 I262 F266 I289	L229-L248 HydrophobicContact CD2-CB 4.17Å; L229-L248 HydrophobicContact CD2-CD1 4.1Å; L230-L248 HydrophobicContact CD2-CD2 3.64Å; F233-L248 HydrophobicContact CE2-CB 4.28Å; F233-L248 HydrophobicContact CE2-CD2 3.46Å; F233-L248 VanDerWaalsContact CE2-CD2 3.46Å; F233-L248 HydrophobicContact CE2-CG 4.48Å; F233-L248 HydrophobicContact CZ-CB 4.27Å; F233-L248 HydrophobicContact CZ-CD2 3.68Å; V244-L248 VanDerWaalsContact O-CB 3.31Å; V244-L248 WeakPolarHBondContact O-CB 3.41Å; V244-L248 PolarHBondContact O-N 2.67Å; K245-L248 PolarHBondContact O-N 3.14Å; L248-R250 VanDerWaalsContact C-N 3.33Å; L248-R250 PolarHBondContact O-N 3.29Å; L248-V251 PolarHBondContact O-N 3.36Å; L248-Y252 PolarHBondContact O-N 3.12Å; L248-I262 HydrophobicContact CD1-CD1 4.37Å; L248-F266 HydrophobicContact CD2-CE1 3.72Å; L248-F266 HydrophobicContact CD2-CZ 3.76Å; L248-I289 HydrophobicContact CB-CD1 4.19Å; L248-I289 HydrophobicContact CD2-CD1 3.89Å; L248-I289 HydrophobicContact CG-CD1 4.28Å
249	H	97.9	Very high	97	Very high	34 Å²	34	31.9 Å²	31.9	16%	0.157	17%	0.172	C	C	.	.	H	α-helix	trans	-60.5	-42.1	175	-176.6	-152.7	0	0	0	111.7	K245 T246 I247 Y252 G253 I289 S292	K245-H249 WeakPolarHBondContact O-CB 3.47Å; K245-H249 PolarHBondContact O-N 3.16Å; T246-H249 PolarHBondContact O-N 3.09Å; I247-H249 VanDerWaalsContact C-N 3.31Å; I247-H249 PolarHBondContact O-N 3.35Å; H249-Y252 PolarHBondContact O-N 2.92Å; H249-G253 PolarHBondContact O-N 3.37Å; H249-I289 HydrophobicContact CB-CG1 4.35Å; H249-I289 HydrophobicContact CB-CG2 4.29Å; H249-S292 PolarHBondContact CE1-OG 3.42Å; H249-S292 PolarHBondContact NE2-OG 3.12Å
250	R	97.1	Very high	96.9	Very high	13 Å²	13	30.3 Å²	30.3	5%	0.049	18%	0.179	C	C	.	.	H	α-helix	trans	-63.7	-42.9	173.9	-64.1	-46.8	-163.8	169.4	12.5	112.7	L204 I207 E208 T246 I247 L248 G253 K254 A610	L204-R250 HydrophobicContact CD1-CG 4.13Å; I207-R250 HydrophobicContact CG2-CB 3.76Å; E208-R250 HydrophobicContact CG-CG 4.28Å; E208-R250 IonicContact OE1-CZ 4Å; E208-R250 VanDerWaalsContact OE1-CZ 3.23Å; E208-R250 IonicContact OE1-NE 3.16Å; E208-R250 PolarHBondContact OE1-NE 3.18Å; E208-R250 IonicContact OE1-NH2 2.66Å; E208-R250 PolarHBondContact OE1-NH2 3.4Å; T246-R250 WeakPolarHBondContact O-CG 3.26Å; T246-R250 PolarHBondContact O-N 2.86Å; T246-R250 VanDerWaalsContact O-N 3.08Å; I247-R250 WeakPolarHBondContact O-CB 3.37Å; I247-R250 PolarHBondContact O-N 2.87Å; I247-R250 VanDerWaalsContact O-N 3.15Å; L248-R250 VanDerWaalsContact C-N 3.33Å; L248-R250 PolarHBondContact O-N 3.29Å; R250-G253 PolarHBondContact O-N 3.47Å; R250-K254 PolarHBondContact O-N 3.47Å; R250-A610 VanDerWaalsContact NH1-CB 3.27Å; R250-A610 PolarHBondContact NH1-O 3.38Å; R250-A610 VanDerWaalsContact NH1-O 3.13Å
251	V	97.1	Very high	97	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.8	-46.8	175.9	171.2	0	0	0	0	110.2	I207 F221 V226 I247 L248 G253 K254 F255 L258 I262	I207-V251 HydrophobicContact CD1-CG2 4.11Å; F221-V251 HydrophobicContact CD1-CG2 4.26Å; F221-V251 HydrophobicContact CE1-CG2 4.39Å; V226-V251 HydrophobicContact CG2-CG1 4.39Å; I247-V251 HydrophobicContact CG2-CG2 4.42Å; I247-V251 WeakPolarHBondContact O-CG2 3.45Å; I247-V251 PolarHBondContact O-N 3.23Å; L248-V251 PolarHBondContact O-N 3.36Å; V251-G253 VanDerWaalsContact C-N 3.3Å; V251-G253 PolarHBondContact O-N 2.95Å; V251-K254 PolarHBondContact O-N 3.2Å; V251-F255 HydrophobicContact CB-CD2 4.32Å; V251-F255 HydrophobicContact CG1-CD2 3.8Å; V251-F255 HydrophobicContact CG1-CE2 4.35Å; V251-F255 WeakPolarHBondContact O-CB 3.21Å; V251-F255 VanDerWaalsContact O-CD2 3.32Å; V251-F255 WeakPolarHBondContact O-CD2 3.4Å; V251-F255 PolarHBondContact O-N 3.22Å; V251-L258 HydrophobicContact CG1-CD1 4.15Å; V251-I262 HydrophobicContact CG1-CD1 4.47Å
252	Y	97.3	Very high	97	Very high	17 Å²	17	31 Å²	31	7%	0.067	18%	0.182	C	C	.	.	H	α-helix	trans	-59.8	-39.9	176.2	-175.7	-88.3	0	0	0	112.7	L248 H249 R259 I262 R263 I293	L248-Y252 PolarHBondContact O-N 3.12Å; H249-Y252 PolarHBondContact O-N 2.92Å; Y252-R259 HydrophobicContact CD1-CG 4.37Å; Y252-R259 HydrophobicContact CD2-CB 4.24Å; Y252-R259 HydrophobicContact CD2-CG 3.94Å; Y252-R259 HydrophobicContact CE1-CG 4.07Å; Y252-R259 HydrophobicContact CE2-CB 3.59Å; Y252-R259 HydrophobicContact CE2-CG 3.61Å; Y252-R259 HydrophobicContact CG-CG 4.31Å; Y252-R259 PolarHBondContact O-NE 3.44Å; Y252-I262 HydrophobicContact CD2-CB 4.07Å; Y252-I262 HydrophobicContact CD2-CD1 3.91Å; Y252-I262 HydrophobicContact CD2-CG2 3.94Å; Y252-R263 HydrophobicContact CE2-CG 4.19Å; Y252-R263 PolarHBondContact OH-NH1 3.41Å; Y252-I293 HydrophobicContact CD1-CD1 3.84Å; Y252-I293 HydrophobicContact CD1-CG1 3.77Å; Y252-I293 HydrophobicContact CD2-CD1 3.81Å; Y252-I293 HydrophobicContact CE1-CB 4.3Å; Y252-I293 HydrophobicContact CE1-CD1 3.74Å; Y252-I293 HydrophobicContact CE1-CG1 3.49Å; Y252-I293 VanDerWaalsContact CE1-CG1 3.49Å; Y252-I293 HydrophobicContact CE1-CG2 4.02Å; Y252-I293 HydrophobicContact CE2-CD1 3.69Å; Y252-I293 HydrophobicContact CE2-CG1 4.36Å; Y252-I293 HydrophobicContact CG-CD1 3.89Å; Y252-I293 HydrophobicContact CG-CG1 4.33Å; Y252-I293 VanDerWaalsContact OH-CG2 3.28Å; Y252-I293 WeakPolarHBondContact OH-CG2 3.35Å
253	G	95.4	Very high	97	Very high	22 Å²	22	30.1 Å²	30.1	23%	0.227	18%	0.175	C	C	.	.	H	α-helix	trans	-62.2	-53.2	176.8	0	0	0	0	0	112.6	H249 R250 V251 R259	H249-G253 PolarHBondContact O-N 3.37Å; R250-G253 PolarHBondContact O-N 3.47Å; V251-G253 VanDerWaalsContact C-N 3.3Å; V251-G253 PolarHBondContact O-N 2.95Å; G253-R259 PolarHBondContact O-NH2 3.19Å
254	K	95.2	Very high	97	Very high	52 Å²	52	35.5 Å²	35.5	23%	0.226	20%	0.197	C	C	.	.	H	α-helix	trans	-79.1	-31.3	-173	-66.6	-158.1	173.7	-158.5	0	114.5	I207 F212 P214 R250 V251	I207-K254 HydrophobicContact CG2-CD 4.17Å; I207-K254 WeakPolarHBondContact O-CE 3.33Å; I207-K254 PolarHBondContact O-NZ 3.43Å; F212-K254 HydrophobicContact CD1-CD 3.84Å; F212-K254 HydrophobicContact CE1-CD 4.04Å; P214-K254 HydrophobicContact CG-CB 4.33Å; R250-K254 PolarHBondContact O-N 3.47Å; V251-K254 PolarHBondContact O-N 3.2Å
255	F	96.2	Very high	97	Very high	11 Å²	11	37 Å²	37	5%	0.048	21%	0.205	C	C	.	.			trans	-107.3	85.8	-174.5	-62.3	-80.6	0	0	0	112.4	F212 P214 A217 K218 F221 V251 G257 L258	F212-F255 HydrophobicContact CE1-CE2 4.23Å; F212-F255 AromaticContact CE1-CZ 3.84Å; F212-F255 HydrophobicContact CE1-CZ 3.84Å; F212-F255 HydrophobicContact CZ-CE2 4.17Å; F212-F255 AromaticContact CZ-CZ 3.71Å; F212-F255 HydrophobicContact CZ-CZ 3.71Å; P214-F255 HydrophobicContact CB-CD1 4.33Å; P214-F255 HydrophobicContact CB-CE1 4.13Å; P214-F255 WeakPolarHBondContact O-CE1 3.19Å; A217-F255 HydrophobicContact CB-CE1 3.88Å; A217-F255 HydrophobicContact CB-CZ 3.68Å; K218-F255 HydrophobicContact CB-CD1 4.31Å; K218-F255 HydrophobicContact CB-CE1 4.23Å; F221-F255 HydrophobicContact CB-CE1 4.16Å; F221-F255 HydrophobicContact CB-CE2 4.05Å; F221-F255 HydrophobicContact CB-CZ 3.73Å; F221-F255 AromaticContact CD1-CE2 3.99Å; F221-F255 HydrophobicContact CD1-CE2 3.99Å; F221-F255 HydrophobicContact CD1-CZ 4.2Å; F221-F255 HydrophobicContact CD2-CZ 4.15Å; F221-F255 HydrophobicContact CG-CE2 4.02Å; F221-F255 AromaticContact CG-CZ 3.77Å; F221-F255 HydrophobicContact CG-CZ 3.77Å; V251-F255 HydrophobicContact CB-CD2 4.32Å; V251-F255 HydrophobicContact CG1-CD2 3.8Å; V251-F255 HydrophobicContact CG1-CE2 4.35Å; V251-F255 WeakPolarHBondContact O-CB 3.21Å; V251-F255 VanDerWaalsContact O-CD2 3.32Å; V251-F255 WeakPolarHBondContact O-CD2 3.4Å; V251-F255 PolarHBondContact O-N 3.22Å; F255-G257 PolarHBondContact O-N 3.25Å; F255-L258 HydrophobicContact CB-CB 4.18Å; F255-L258 HydrophobicContact CB-CD1 3.66Å; F255-L258 HydrophobicContact CB-CG 3.96Å; F255-L258 HydrophobicContact CD2-CD1 4.38Å; F255-L258 HydrophobicContact CG-CD1 4Å; F255-L258 PolarHBondContact O-N 3.1Å
256	L	94.3	Very high	97	Very high	116 Å²	116	36.3 Å²	36.3	61%	0.607	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-55.1	-37.3	-179.2	-57.9	-176.2	0	0	0	113.4	L258 R259	L256-L258 VanDerWaalsContact C-N 3.27Å; L256-L258 PolarHBondContact O-N 3.43Å; L256-R259 VanDerWaalsContact CD2-NH2 3.25Å; L256-R259 WeakPolarHBondContact O-CB 3.32Å; L256-R259 WeakPolarHBondContact O-CG 3.31Å; L256-R259 PolarHBondContact O-N 3.42Å
257	G	95.5	Very high	96.9	Very high	77 Å²	77	36 Å²	36	79%	0.794	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-67.6	-20.7	179.9	0	0	0	0	0	114.8	F255	F255-G257 PolarHBondContact O-N 3.25Å
258	L	96.7	Very high	96.9	Very high	20 Å²	20	39.2 Å²	39.2	11%	0.105	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-90.2	-12.7	179	-63.3	176.2	0	0	0	112.8	F221 T223 V226 V251 F255 L256 A260 F261 I262	F221-L258 WeakPolarHBondContact O-CD1 3.25Å; T223-L258 HydrophobicContact CG2-CD2 4.36Å; V226-L258 HydrophobicContact CG2-CD1 3.92Å; V251-L258 HydrophobicContact CG1-CD1 4.15Å; F255-L258 HydrophobicContact CB-CB 4.18Å; F255-L258 HydrophobicContact CB-CD1 3.66Å; F255-L258 HydrophobicContact CB-CG 3.96Å; F255-L258 HydrophobicContact CD2-CD1 4.38Å; F255-L258 HydrophobicContact CG-CD1 4Å; F255-L258 PolarHBondContact O-N 3.1Å; L256-L258 VanDerWaalsContact C-N 3.27Å; L256-L258 PolarHBondContact O-N 3.43Å; L258-A260 PolarHBondContact O-N 3.49Å; L258-F261 WeakPolarHBondContact O-CB 3.47Å; L258-F261 PolarHBondContact O-N 2.82Å; L258-F261 VanDerWaalsContact O-N 3.1Å; L258-I262 HydrophobicContact CB-CD1 4.01Å; L258-I262 HydrophobicContact CB-CG1 4.46Å; L258-I262 WeakPolarHBondContact O-CG1 3.48Å; L258-I262 PolarHBondContact O-N 3.07Å
259	R	96.6	Very high	96.9	Very high	69 Å²	69	40.7 Å²	40.7	26%	0.26	23%	0.225	S	C	.	.	H	α-helix	trans	-58.7	-45.5	-171.8	-68.7	-173.7	172.9	-177.1	1.8	113.5	Y252 G253 L256 F261 I262 R263	Y252-R259 HydrophobicContact CD1-CG 4.37Å; Y252-R259 HydrophobicContact CD2-CB 4.24Å; Y252-R259 HydrophobicContact CD2-CG 3.94Å; Y252-R259 HydrophobicContact CE1-CG 4.07Å; Y252-R259 HydrophobicContact CE2-CB 3.59Å; Y252-R259 HydrophobicContact CE2-CG 3.61Å; Y252-R259 HydrophobicContact CG-CG 4.31Å; Y252-R259 PolarHBondContact O-NE 3.44Å; G253-R259 PolarHBondContact O-NH2 3.19Å; L256-R259 VanDerWaalsContact CD2-NH2 3.25Å; L256-R259 WeakPolarHBondContact O-CB 3.32Å; L256-R259 WeakPolarHBondContact O-CG 3.31Å; L256-R259 PolarHBondContact O-N 3.42Å; R259-F261 VanDerWaalsContact C-N 3.32Å; R259-F261 PolarHBondContact O-N 3.36Å; R259-I262 PolarHBondContact O-N 2.82Å; R259-R263 WeakPolarHBondContact O-CG 3.44Å; R259-R263 PolarHBondContact O-N 3.45Å
260	A	95.9	Very high	96.9	Very high	60 Å²	60	39.1 Å²	39.1	50%	0.496	22%	0.218	S	C	.	.	H	α-helix	trans	-64.1	-39.7	178.4	0	0	0	0	0	111.6	L258 K264	L258-A260 PolarHBondContact O-N 3.49Å; A260-K264 WeakPolarHBondContact O-CB 3.32Å; A260-K264 PolarHBondContact O-N 3.43Å
261	F	97.9	Very high	97	Very high	47 Å²	47	42.5 Å²	42.5	21%	0.206	23%	0.231	C	C	.	.	H	α-helix	trans	-64.9	-48.9	176.9	-179.8	-100.4	0	0	0	111.7	T223 V226 L227 L258 R259 R263 K264 Q265	T223-F261 HydrophobicContact CG2-CD1 3.9Å; T223-F261 HydrophobicContact CG2-CD2 3.87Å; T223-F261 HydrophobicContact CG2-CE1 3.99Å; T223-F261 HydrophobicContact CG2-CE2 3.96Å; T223-F261 HydrophobicContact CG2-CG 3.83Å; T223-F261 HydrophobicContact CG2-CZ 4.02Å; T223-F261 WeakPolarHBondContact O-CE1 3.35Å; V226-F261 HydrophobicContact CB-CD1 4.39Å; V226-F261 HydrophobicContact CB-CE1 4.12Å; V226-F261 HydrophobicContact CG1-CD1 4.02Å; V226-F261 HydrophobicContact CG1-CE1 3.91Å; L227-F261 HydrophobicContact CD1-CZ 3.96Å; L227-F261 HydrophobicContact CD2-CE1 4.36Å; L227-F261 HydrophobicContact CD2-CZ 3.94Å; L227-F261 HydrophobicContact CG-CE1 4.07Å; L227-F261 HydrophobicContact CG-CZ 3.72Å; L258-F261 WeakPolarHBondContact O-CB 3.47Å; L258-F261 PolarHBondContact O-N 2.82Å; L258-F261 VanDerWaalsContact O-N 3.1Å; R259-F261 VanDerWaalsContact C-N 3.32Å; R259-F261 PolarHBondContact O-N 3.36Å; F261-R263 PolarHBondContact O-N 3.2Å; F261-K264 WeakPolarHBondContact O-CB 3.43Å; F261-K264 PolarHBondContact O-N 3.01Å; F261-K264 VanDerWaalsContact O-N 3.16Å; F261-Q265 HydrophobicContact CD1-CG 4.23Å; F261-Q265 HydrophobicContact CE1-CG 3.8Å; F261-Q265 HydrophobicContact CE2-CG 4.21Å; F261-Q265 VanDerWaalsContact CE2-NE2 3.27Å; F261-Q265 HydrophobicContact CZ-CG 3.8Å; F261-Q265 WeakPolarHBondContact O-CG 3.28Å; F261-Q265 PolarHBondContact O-N 3.02Å
262	I	98.1	Very high	97	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-57.6	-49.2	178.5	-68.5	166.3	0	0	0	110.6	V226 L248 V251 Y252 L258 R259 K264 Q265 F266	V226-I262 HydrophobicContact CG1-CD1 4.47Å; V226-I262 HydrophobicContact CG1-CG1 3.7Å; L248-I262 HydrophobicContact CD1-CD1 4.37Å; V251-I262 HydrophobicContact CG1-CD1 4.47Å; Y252-I262 HydrophobicContact CD2-CB 4.07Å; Y252-I262 HydrophobicContact CD2-CD1 3.91Å; Y252-I262 HydrophobicContact CD2-CG2 3.94Å; L258-I262 HydrophobicContact CB-CD1 4.01Å; L258-I262 HydrophobicContact CB-CG1 4.46Å; L258-I262 WeakPolarHBondContact O-CG1 3.48Å; L258-I262 PolarHBondContact O-N 3.07Å; R259-I262 PolarHBondContact O-N 2.82Å; I262-K264 VanDerWaalsContact C-N 3.29Å; I262-K264 PolarHBondContact O-N 3.5Å; I262-Q265 PolarHBondContact O-N 3.15Å; I262-Q265 VanDerWaalsContact O-N 3.1Å; I262-F266 HydrophobicContact CG2-CD1 3.95Å; I262-F266 HydrophobicContact CG2-CE1 3.47Å; I262-F266 VanDerWaalsContact CG2-CE1 3.47Å; I262-F266 HydrophobicContact CG2-CZ 4.01Å; I262-F266 VanDerWaalsContact O-CD1 3.22Å; I262-F266 WeakPolarHBondContact O-CD1 3.42Å; I262-F266 PolarHBondContact O-N 2.96Å
263	R	97.6	Very high	97	Very high	39 Å²	39	47.2 Å²	47.2	15%	0.147	25%	0.252	C	S	.	.	H	α-helix	trans	-60.1	-38.9	177.6	-70.6	-167.1	-54.7	-91	3.7	112.7	Y252 R259 F261 F266 G267 E304	Y252-R263 HydrophobicContact CE2-CG 4.19Å; Y252-R263 PolarHBondContact OH-NH1 3.41Å; R259-R263 WeakPolarHBondContact O-CG 3.44Å; R259-R263 PolarHBondContact O-N 3.45Å; F261-R263 PolarHBondContact O-N 3.2Å; R263-F266 PolarHBondContact O-N 3.02Å; R263-G267 PolarHBondContact O-N 2.97Å; R263-G267 VanDerWaalsContact O-N 3.11Å; R263-E304 IonicContact NH2-OE1 3.2Å
264	K	97.3	Very high	97.1	Very high	140 Å²	140	46.6 Å²	46.6	61%	0.609	24%	0.244	S	C	*	.	H	α-helix	trans	-63	-43.2	174.9	-175.7	179.5	179.5	-179.3	0	111.3	A260 F261 I262 G267 N268	A260-K264 WeakPolarHBondContact O-CB 3.32Å; A260-K264 PolarHBondContact O-N 3.43Å; F261-K264 WeakPolarHBondContact O-CB 3.43Å; F261-K264 PolarHBondContact O-N 3.01Å; F261-K264 VanDerWaalsContact O-N 3.16Å; I262-K264 VanDerWaalsContact C-N 3.29Å; I262-K264 PolarHBondContact O-N 3.5Å; K264-G267 PolarHBondContact O-N 3.44Å; K264-N268 PolarHBondContact O-N 3.01Å; K264-N268 PolarHBondContact O-OD1 3.1Å
265	Q	97.9	Very high	97.2	Very high	32 Å²	32	50.4 Å²	50.4	15%	0.15	26%	0.257	C	S	.	.	H	α-helix	trans	-68.2	-35.6	178.3	-62.9	-52.8	-23.3	0	0	112.8	L227 L230 F261 I262 G267 N268 I269	L227-Q265 HydrophobicContact CD2-CG 3.86Å; L230-Q265 HydrophobicContact CD1-CB 3.52Å; L230-Q265 HydrophobicContact CD1-CG 4.12Å; F261-Q265 HydrophobicContact CD1-CG 4.23Å; F261-Q265 HydrophobicContact CE1-CG 3.8Å; F261-Q265 HydrophobicContact CE2-CG 4.21Å; F261-Q265 VanDerWaalsContact CE2-NE2 3.27Å; F261-Q265 HydrophobicContact CZ-CG 3.8Å; F261-Q265 WeakPolarHBondContact O-CG 3.28Å; F261-Q265 PolarHBondContact O-N 3.02Å; I262-Q265 PolarHBondContact O-N 3.15Å; I262-Q265 VanDerWaalsContact O-N 3.1Å; Q265-G267 VanDerWaalsContact C-N 3.3Å; Q265-G267 PolarHBondContact O-N 3.18Å; Q265-N268 PolarHBondContact O-N 3.34Å; Q265-N268 PolarHBondContact OE1-ND2 3.41Å; Q265-I269 WeakPolarHBondContact O-CG1 3.38Å; Q265-I269 PolarHBondContact O-N 2.83Å
266	F	98	Very high	97.2	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-57.7	-47.6	171.1	-79.2	30.7	0	0	0	110.1	L230 L248 I262 R263 N268 I269 F270 L286 I289 L290	L230-F266 HydrophobicContact CD2-CD1 4.17Å; L230-F266 HydrophobicContact CD2-CE1 3.75Å; L248-F266 HydrophobicContact CD2-CE1 3.72Å; L248-F266 HydrophobicContact CD2-CZ 3.76Å; I262-F266 HydrophobicContact CG2-CD1 3.95Å; I262-F266 HydrophobicContact CG2-CE1 3.47Å; I262-F266 VanDerWaalsContact CG2-CE1 3.47Å; I262-F266 HydrophobicContact CG2-CZ 4.01Å; I262-F266 VanDerWaalsContact O-CD1 3.22Å; I262-F266 WeakPolarHBondContact O-CD1 3.42Å; I262-F266 PolarHBondContact O-N 2.96Å; R263-F266 PolarHBondContact O-N 3.02Å; F266-N268 VanDerWaalsContact C-N 3.33Å; F266-N268 PolarHBondContact O-N 3.39Å; F266-I269 PolarHBondContact O-N 3.06Å; F266-F270 HydrophobicContact CB-CD2 4.5Å; F266-F270 HydrophobicContact CB-CE2 4.17Å; F266-F270 WeakPolarHBondContact O-CB 3.48Å; F266-F270 VanDerWaalsContact O-CD2 3.23Å; F266-F270 WeakPolarHBondContact O-CD2 3.46Å; F266-F270 VanDerWaalsContact O-CG 3.25Å; F266-F270 WeakPolarHBondContact O-CG 3.3Å; F266-F270 PolarHBondContact O-N 3.49Å; F266-L286 HydrophobicContact CD1-CD2 4.36Å; F266-L286 HydrophobicContact CE1-CD2 3.92Å; F266-L286 HydrophobicContact CE2-CD2 4.32Å; F266-L286 HydrophobicContact CZ-CD2 3.88Å; F266-I289 HydrophobicContact CE2-CB 4.34Å; F266-I289 HydrophobicContact CE2-CG2 4.31Å; F266-I289 HydrophobicContact CZ-CB 4.45Å; F266-I289 HydrophobicContact CZ-CD1 4.44Å; F266-I289 HydrophobicContact CZ-CG2 4.23Å; F266-L290 HydrophobicContact CD2-CB 4.41Å; F266-L290 HydrophobicContact CD2-CD1 4.18Å; F266-L290 HydrophobicContact CE2-CB 4.39Å
267	G	97.6	Very high	97	Very high	5 Å²	5	54.2 Å²	54.2	5%	0.052	28%	0.277	C	S	.	.	H	α-helix	trans	-55.8	-46.1	174.9	0	0	0	0	0	112.7	R263 K264 Q265 F270 Y271	R263-G267 PolarHBondContact O-N 2.97Å; R263-G267 VanDerWaalsContact O-N 3.11Å; K264-G267 PolarHBondContact O-N 3.44Å; Q265-G267 VanDerWaalsContact C-N 3.3Å; Q265-G267 PolarHBondContact O-N 3.18Å; G267-F270 PolarHBondContact O-N 3.42Å; G267-Y271 WeakPolarHBondContact O-CB 3.4Å; G267-Y271 WeakPolarHBondContact O-CD2 3.44Å; G267-Y271 PolarHBondContact O-N 3.4Å
268	N	97.8	Very high	96.9	Very high	69 Å²	69	54.5 Å²	54.5	37%	0.369	26%	0.257	S	S	.	.	H	α-helix	trans	-62.5	-45.5	178.5	-65.7	-18.9	0	0	0	112.6	K264 Q265 F266 Y271 K272	K264-N268 PolarHBondContact O-N 3.01Å; K264-N268 PolarHBondContact O-OD1 3.1Å; Q265-N268 PolarHBondContact O-N 3.34Å; Q265-N268 PolarHBondContact OE1-ND2 3.41Å; F266-N268 VanDerWaalsContact C-N 3.33Å; F266-N268 PolarHBondContact O-N 3.39Å; N268-Y271 PolarHBondContact O-N 2.87Å; N268-K272 PolarHBondContact O-N 3.48Å
269	I	98.1	Very high	96.5	Very high	31 Å²	31	57.8 Å²	57.8	16%	0.159	28%	0.278	C	S	.	.	H	α-helix	trans	-60.1	-48.6	177.8	-68.3	166.1	0	0	0	109.6	L230 Q265 F266 Y271 K272 F273 L286	L230-I269 HydrophobicContact CB-CD1 4.26Å; L230-I269 HydrophobicContact CD2-CD1 4.11Å; Q265-I269 WeakPolarHBondContact O-CG1 3.38Å; Q265-I269 PolarHBondContact O-N 2.83Å; F266-I269 PolarHBondContact O-N 3.06Å; I269-Y271 PolarHBondContact O-N 3.33Å; I269-K272 PolarHBondContact O-N 3.27Å; I269-F273 WeakPolarHBondContact O-CB 3.33Å; I269-F273 PolarHBondContact O-N 3.33Å; I269-L286 HydrophobicContact CG2-CD1 3.97Å
270	F	98.4	Very high	96.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.5	-39.6	178.1	-63.7	-30.4	0	0	0	112.5	F266 G267 F273 I274 I283 L286 L287 L290 F308 V312 L316	F266-F270 HydrophobicContact CB-CD2 4.5Å; F266-F270 HydrophobicContact CB-CE2 4.17Å; F266-F270 WeakPolarHBondContact O-CB 3.48Å; F266-F270 VanDerWaalsContact O-CD2 3.23Å; F266-F270 WeakPolarHBondContact O-CD2 3.46Å; F266-F270 VanDerWaalsContact O-CG 3.25Å; F266-F270 WeakPolarHBondContact O-CG 3.3Å; F266-F270 PolarHBondContact O-N 3.49Å; G267-F270 PolarHBondContact O-N 3.42Å; F270-F273 PolarHBondContact O-N 3.28Å; F270-I274 HydrophobicContact CB-CD1 4.39Å; F270-I274 WeakPolarHBondContact O-CB 3.37Å; F270-I274 VanDerWaalsContact O-CD1 3.23Å; F270-I274 WeakPolarHBondContact O-CD1 3.5Å; F270-I274 WeakPolarHBondContact O-CG1 3.3Å; F270-I274 PolarHBondContact O-N 2.78Å; F270-I283 HydrophobicContact CD1-CD1 3.88Å; F270-I283 HydrophobicContact CE1-CD1 3.96Å; F270-I283 HydrophobicContact CE1-CG2 4.32Å; F270-L286 HydrophobicContact CE1-CB 4Å; F270-L286 HydrophobicContact CE1-CD1 4.06Å; F270-L286 HydrophobicContact CZ-CB 3.88Å; F270-L287 HydrophobicContact CE2-CD2 4.41Å; F270-L287 HydrophobicContact CZ-CD2 4.08Å; F270-L287 HydrophobicContact CZ-CG 4.24Å; F270-L290 HydrophobicContact CE2-CD2 4.31Å; F270-F308 HydrophobicContact CD2-CZ 4.02Å; F270-F308 HydrophobicContact CE2-CZ 4.13Å; F270-V312 HydrophobicContact CB-CG1 3.47Å; F270-V312 VanDerWaalsContact CB-CG1 3.47Å; F270-V312 HydrophobicContact CD2-CG1 3.59Å; F270-V312 HydrophobicContact CG-CG1 3.98Å; F270-L316 HydrophobicContact CB-CD2 4.5Å; F270-L316 HydrophobicContact CD1-CD2 4.48Å; F270-L316 HydrophobicContact CG-CD1 4.38Å
271	Y	98	Very high	96.3	Very high	84 Å²	84	56 Å²	56	33%	0.329	26%	0.264	S	S	.	.	H	α-helix	trans	-61.6	-45.9	175.1	-78.2	-51.2	0	0	0	112.6	G267 N268 I269 F273 I274 Y275 R311 V312	G267-Y271 WeakPolarHBondContact O-CB 3.4Å; G267-Y271 WeakPolarHBondContact O-CD2 3.44Å; G267-Y271 PolarHBondContact O-N 3.4Å; N268-Y271 PolarHBondContact O-N 2.87Å; I269-Y271 PolarHBondContact O-N 3.33Å; Y271-F273 VanDerWaalsContact C-N 3.32Å; Y271-F273 PolarHBondContact O-N 3.29Å; Y271-I274 PolarHBondContact O-N 3.05Å; Y271-Y275 AromaticContact CD1-CD2 3.92Å; Y271-Y275 HydrophobicContact CD1-CD2 3.92Å; Y271-Y275 AromaticContact CD1-CE2 3.65Å; Y271-Y275 HydrophobicContact CD1-CE2 3.65Å; Y271-Y275 HydrophobicContact CE1-CE2 4.09Å; Y271-Y275 WeakPolarHBondContact O-CB 3.47Å; Y271-Y275 WeakPolarHBondContact O-CD2 3.25Å; Y271-Y275 PolarHBondContact O-N 3.16Å; Y271-R311 WeakPolarHBondContact CE1-O 3.43Å; Y271-R311 WeakPolarHBondContact OH-CB 3.44Å; Y271-V312 HydrophobicContact CE1-CG2 4.07Å; Y271-V312 HydrophobicContact CE2-CG2 3.95Å; Y271-V312 WeakPolarHBondContact OH-CG2 3.49Å
272	K	97.5	Very high	96.2	Very high	114 Å²	114	53.8 Å²	53.8	50%	0.496	25%	0.254	S	S	.	.	H	α-helix	trans	-61.9	-41	176	-175.1	-175.9	178	-165.7	0	111.5	N268 I269 E276 T277	N268-K272 PolarHBondContact O-N 3.48Å; I269-K272 PolarHBondContact O-N 3.27Å; K272-E276 HydrophobicContact CG-CB 4.26Å; K272-E276 WeakPolarHBondContact O-CA 3.37Å; K272-E276 WeakPolarHBondContact O-CB 3.27Å; K272-E276 PolarHBondContact O-N 2.94Å; K272-T277 HydrophobicContact CG-CG2 4.18Å; K272-T277 PolarHBondContact O-N 3.27Å; K272-T277 PolarHBondContact O-OG1 3.44Å
273	F	96.8	Very high	96.2	Very high	3 Å²	3	53.9 Å²	53.9	1%	0.013	26%	0.255	C	S	.	.	I	π-helix	trans	-62.8	-50.2	176	173.7	-114.7	0	0	0	111.7	I269 F270 Y271 E278 H280 I283 L316 V319 Y325	I269-F273 WeakPolarHBondContact O-CB 3.33Å; I269-F273 PolarHBondContact O-N 3.33Å; F270-F273 PolarHBondContact O-N 3.28Å; Y271-F273 VanDerWaalsContact C-N 3.32Å; Y271-F273 PolarHBondContact O-N 3.29Å; F273-E278 WeakPolarHBondContact O-CA 3.38Å; F273-E278 PolarHBondContact O-N 2.9Å; F273-H280 HydrophobicContact CD2-CB 3.76Å; F273-H280 HydrophobicContact CE2-CB 4.31Å; F273-H280 HydrophobicContact CG-CB 4.41Å; F273-I283 HydrophobicContact CB-CD1 4.12Å; F273-I283 HydrophobicContact CD1-CD1 3.82Å; F273-I283 HydrophobicContact CD1-CG1 4.03Å; F273-I283 HydrophobicContact CD2-CD1 4.25Å; F273-I283 HydrophobicContact CD2-CG1 4.2Å; F273-I283 HydrophobicContact CE1-CD1 4.29Å; F273-I283 HydrophobicContact CE1-CG1 3.99Å; F273-I283 HydrophobicContact CE1-CG2 4.35Å; F273-I283 HydrophobicContact CE2-CG1 4.17Å; F273-I283 HydrophobicContact CG-CD1 3.8Å; F273-I283 HydrophobicContact CG-CG1 4.13Å; F273-I283 HydrophobicContact CZ-CG1 4.06Å; F273-L316 HydrophobicContact CD1-CD2 3.65Å; F273-L316 HydrophobicContact CE1-CD2 3.87Å; F273-V319 HydrophobicContact CD1-CG2 4.36Å; F273-V319 HydrophobicContact CE1-CB 4.2Å; F273-V319 HydrophobicContact CE1-CG1 4.06Å; F273-V319 HydrophobicContact CE1-CG2 3.87Å; F273-V319 HydrophobicContact CE2-CG1 4.25Å; F273-V319 HydrophobicContact CZ-CB 4.25Å; F273-V319 HydrophobicContact CZ-CG1 3.66Å; F273-V319 HydrophobicContact CZ-CG2 4.34Å; F273-Y325 AromaticContact CE1-CE1 3.87Å; F273-Y325 HydrophobicContact CE1-CE1 3.87Å; F273-Y325 AromaticContact CE1-CZ 3.86Å; F273-Y325 AromaticContact CZ-CE1 3.77Å; F273-Y325 HydrophobicContact CZ-CE1 3.77Å
274	I	97.1	Very high	96.2	Very high	9 Å²	9	52.5 Å²	52.5	5%	0.046	25%	0.252	C	S	.	.	I	π-helix	trans	-69.3	-39	-174.8	-63.3	157.8	0	0	0	112.8	F270 Y271 P315 L316 V319	F270-I274 HydrophobicContact CB-CD1 4.39Å; F270-I274 WeakPolarHBondContact O-CB 3.37Å; F270-I274 VanDerWaalsContact O-CD1 3.23Å; F270-I274 WeakPolarHBondContact O-CD1 3.5Å; F270-I274 WeakPolarHBondContact O-CG1 3.3Å; F270-I274 PolarHBondContact O-N 2.78Å; Y271-I274 PolarHBondContact O-N 3.05Å; I274-P315 HydrophobicContact CD1-CB 4.29Å; I274-P315 HydrophobicContact CG2-CB 4.24Å; I274-L316 HydrophobicContact CD1-CD2 3.7Å; I274-L316 HydrophobicContact CD1-CG 3.82Å; I274-L316 HydrophobicContact CG1-CD2 3.56Å; I274-L316 HydrophobicContact CG1-CG 4.16Å; I274-V319 HydrophobicContact CB-CG2 4.5Å; I274-V319 HydrophobicContact CG1-CG2 4.25Å
275	Y	96.9	Very high	96.2	Very high	131 Å²	131	46.9 Å²	46.9	51%	0.514	23%	0.228	S	C	.	.	I	π-helix	trans	-113.7	-16.2	-165.2	-62.6	-61.1	0	0	0	115	Y271	Y271-Y275 AromaticContact CD1-CD2 3.92Å; Y271-Y275 HydrophobicContact CD1-CD2 3.92Å; Y271-Y275 AromaticContact CD1-CE2 3.65Å; Y271-Y275 HydrophobicContact CD1-CE2 3.65Å; Y271-Y275 HydrophobicContact CE1-CE2 4.09Å; Y271-Y275 WeakPolarHBondContact O-CB 3.47Å; Y271-Y275 WeakPolarHBondContact O-CD2 3.25Å; Y271-Y275 PolarHBondContact O-N 3.16Å
276	E	96.2	Very high	96.3	Very high	148 Å²	148	45.4 Å²	45.4	69%	0.692	22%	0.221	S	C	*	.	I	π-helix	trans	-118.5	-48.3	-174.6	-58.2	177.2	-149.1	0	0	113	K272	K272-E276 HydrophobicContact CG-CB 4.26Å; K272-E276 WeakPolarHBondContact O-CA 3.37Å; K272-E276 WeakPolarHBondContact O-CB 3.27Å; K272-E276 PolarHBondContact O-N 2.94Å
277	T	91.8	Very high	96.3	Very high	60 Å²	60	45.4 Å²	45.4	37%	0.368	22%	0.221	S	C	.	.	I	π-helix	trans	-113.1	-34.3	-164.6	52.1	0	0	0	0	114.5	K272 V279	K272-T277 HydrophobicContact CG-CG2 4.18Å; K272-T277 PolarHBondContact O-N 3.27Å; K272-T277 PolarHBondContact O-OG1 3.44Å; T277-V279 PolarHBondContact O-N 2.93Å
278	E	91.5	Very high	96.3	Very high	82 Å²	82	47.2 Å²	47.2	38%	0.383	23%	0.228	S	C	.	.	S	Bend	trans	51.7	13.5	-170.3	-61.1	-163	143.4	0	0	115	F273 V319	F273-E278 WeakPolarHBondContact O-CA 3.38Å; F273-E278 PolarHBondContact O-N 2.9Å; E278-V319 HydrophobicContact CB-CG1 4.15Å; E278-V319 HydrophobicContact CG-CG1 4.21Å
279	V	90.3	Very high	96.3	Very high	89 Å²	89	44.1 Å²	44.1	54%	0.539	21%	0.211	S	C	.	.			trans	-134.1	121.6	-178.8	179.4	0	0	0	0	108.9	T277	T277-V279 PolarHBondContact O-N 2.93Å
280	H	93.8	Very high	96.3	Very high	39 Å²	39	42.9 Å²	42.9	18%	0.181	21%	0.205	C	C	.	.			trans	-167.9	128.2	172	-173.9	-70	0	0	0	109.5	D234 F273 G282 I283	D234-H280 VanDerWaalsContact OD1-CA 3.31Å; D234-H280 WeakPolarHBondContact OD1-CA 3.32Å; D234-H280 IonicContact OD1-CD2 2.68Å; D234-H280 IonicContact OD1-CG 3.61Å; D234-H280 IonicContact OD1-ND1 3.08Å; F273-H280 HydrophobicContact CD2-CB 3.76Å; F273-H280 HydrophobicContact CE2-CB 4.31Å; F273-H280 HydrophobicContact CG-CB 4.41Å; H280-G282 PolarHBondContact ND1-N 3.37Å; H280-I283 HydrophobicContact CB-CD1 3.9Å; H280-I283 HydrophobicContact CB-CG1 3.89Å
281	N	93.3	Very high	96.3	Very high	53 Å²	53	42.9 Å²	42.9	28%	0.283	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-33	-170.4	-66.1	-45.1	0	0	0	114	D234	D234-N281 PolarHBondContact O-ND2 2.85Å; D234-N281 PolarHBondContact OD1-N 2.78Å
282	G	96	Very high	96.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	22.3	-171.8	0	0	0	0	0	117.6	F233 H280 A284 E285 L286	F233-G282 WeakPolarHBondContact O-CA 3.29Å; F233-G282 PolarHBondContact O-N 3.39Å; F233-G282 VanDerWaalsContact O-N 3.08Å; H280-G282 PolarHBondContact ND1-N 3.37Å; G282-A284 VanDerWaalsContact C-N 3.35Å; G282-A284 PolarHBondContact O-N 3.32Å; G282-E285 VanDerWaalsContact CA-OE2 3.29Å; G282-E285 WeakPolarHBondContact CA-OE2 3.16Å; G282-L286 VanDerWaalsContact O-CG 3.25Å; G282-L286 WeakPolarHBondContact O-CG 3.16Å; G282-L286 PolarHBondContact O-N 3.08Å; G282-L286 VanDerWaalsContact O-N 3.12Å
283	I	98	Very high	96.2	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.015	18%	0.178	C	C	.	.	H	α-helix	trans	-64.8	-39.5	-176.2	-61.9	-64	0	0	0	111.6	F270 F273 H280 L286 L287 Y325	F270-I283 HydrophobicContact CD1-CD1 3.88Å; F270-I283 HydrophobicContact CE1-CD1 3.96Å; F270-I283 HydrophobicContact CE1-CG2 4.32Å; F273-I283 HydrophobicContact CB-CD1 4.12Å; F273-I283 HydrophobicContact CD1-CD1 3.82Å; F273-I283 HydrophobicContact CD1-CG1 4.03Å; F273-I283 HydrophobicContact CD2-CD1 4.25Å; F273-I283 HydrophobicContact CD2-CG1 4.2Å; F273-I283 HydrophobicContact CE1-CD1 4.29Å; F273-I283 HydrophobicContact CE1-CG1 3.99Å; F273-I283 HydrophobicContact CE1-CG2 4.35Å; F273-I283 HydrophobicContact CE2-CG1 4.17Å; F273-I283 HydrophobicContact CG-CD1 3.8Å; F273-I283 HydrophobicContact CG-CG1 4.13Å; F273-I283 HydrophobicContact CZ-CG1 4.06Å; H280-I283 HydrophobicContact CB-CD1 3.9Å; H280-I283 HydrophobicContact CB-CG1 3.89Å; I283-L286 PolarHBondContact O-N 3.47Å; I283-L287 HydrophobicContact CG2-CD1 3.96Å; I283-L287 HydrophobicContact CG2-CG 4.49Å; I283-L287 WeakPolarHBondContact O-CG 3.34Å; I283-L287 PolarHBondContact O-N 3.08Å; I283-Y325 HydrophobicContact CB-CD1 4.09Å; I283-Y325 HydrophobicContact CB-CG 4.35Å; I283-Y325 HydrophobicContact CG2-CD1 3.74Å; I283-Y325 HydrophobicContact CG2-CD2 3.97Å; I283-Y325 HydrophobicContact CG2-CE1 4.1Å; I283-Y325 HydrophobicContact CG2-CE2 4.33Å; I283-Y325 HydrophobicContact CG2-CG 3.67Å
284	A	97.6	Very high	96.2	Very high	11 Å²	11	35.2 Å²	35.2	9%	0.091	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-48.8	179	0	0	0	0	0	111.5	G282 L286 L287 E288 Q328	G282-A284 VanDerWaalsContact C-N 3.35Å; G282-A284 PolarHBondContact O-N 3.32Å; A284-L286 PolarHBondContact O-N 3.14Å; A284-L287 PolarHBondContact O-N 3.4Å; A284-L287 VanDerWaalsContact O-N 3.14Å; A284-E288 PolarHBondContact O-N 3.17Å; A284-Q328 HydrophobicContact CB-CG 4.49Å
285	E	98.2	Very high	96.1	Very high	22 Å²	22	37.7 Å²	37.7	10%	0.103	19%	0.191	C	C	.	.	H	α-helix	trans	-65.5	-37.8	-178.9	-65.7	85.7	164.6	0	0	111.8	F233 R241 K245 G282 L287 E288 I289	F233-E285 HydrophobicContact CD1-CB 4.07Å; F233-E285 HydrophobicContact CE1-CB 3.86Å; R241-E285 HydrophobicContact CB-CG 4.11Å; R241-E285 IonicContact CZ-OE1 2.82Å; R241-E285 IonicContact NE-OE1 3.2Å; R241-E285 PolarHBondContact NE-OE1 2.8Å; R241-E285 IonicContact NE-OE2 3.22Å; R241-E285 IonicContact NH2-OE1 2.84Å; K245-E285 HydrophobicContact CB-CB 4.17Å; K245-E285 HydrophobicContact CD-CB 3.91Å; K245-E285 HydrophobicContact CD-CG 4.18Å; K245-E285 HydrophobicContact CG-CB 4.21Å; G282-E285 VanDerWaalsContact CA-OE2 3.29Å; G282-E285 WeakPolarHBondContact CA-OE2 3.16Å; E285-L287 VanDerWaalsContact C-N 3.34Å; E285-E288 PolarHBondContact O-N 3.49Å; E285-I289 WeakPolarHBondContact O-CG1 3.41Å; E285-I289 PolarHBondContact O-N 3.17Å
286	L	98.5	Very high	96	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.2	-40.4	173.2	-71.7	171.5	0	0	0	111.7	L230 F233 F266 I269 F270 G282 I283 A284 I289 L290	L230-L286 HydrophobicContact CD2-CD2 4.12Å; F233-L286 HydrophobicContact CD1-CD2 3.79Å; F233-L286 HydrophobicContact CD1-CG 3.75Å; F233-L286 HydrophobicContact CD2-CD2 3.94Å; F233-L286 HydrophobicContact CE1-CD2 3.76Å; F233-L286 HydrophobicContact CE1-CG 4.04Å; F233-L286 HydrophobicContact CE2-CD2 3.9Å; F233-L286 HydrophobicContact CG-CD2 3.87Å; F233-L286 HydrophobicContact CG-CG 4.07Å; F233-L286 HydrophobicContact CZ-CD2 3.81Å; F266-L286 HydrophobicContact CD1-CD2 4.36Å; F266-L286 HydrophobicContact CE1-CD2 3.92Å; F266-L286 HydrophobicContact CE2-CD2 4.32Å; F266-L286 HydrophobicContact CZ-CD2 3.88Å; I269-L286 HydrophobicContact CG2-CD1 3.97Å; F270-L286 HydrophobicContact CE1-CB 4Å; F270-L286 HydrophobicContact CE1-CD1 4.06Å; F270-L286 HydrophobicContact CZ-CB 3.88Å; G282-L286 VanDerWaalsContact O-CG 3.25Å; G282-L286 WeakPolarHBondContact O-CG 3.16Å; G282-L286 PolarHBondContact O-N 3.08Å; G282-L286 VanDerWaalsContact O-N 3.12Å; I283-L286 PolarHBondContact O-N 3.47Å; A284-L286 PolarHBondContact O-N 3.14Å; L286-I289 PolarHBondContact O-N 3.38Å; L286-L290 WeakPolarHBondContact O-CB 3.36Å; L286-L290 PolarHBondContact O-N 3.21Å
287	L	98.6	Very high	96	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-68.9	-35.2	176.8	-74.2	169.6	0	0	0	112.5	F270 I283 A284 E285 I289 L290 G291 L313 L316 Y325 Q328 L329 C332	F270-L287 HydrophobicContact CE2-CD2 4.41Å; F270-L287 HydrophobicContact CZ-CD2 4.08Å; F270-L287 HydrophobicContact CZ-CG 4.24Å; I283-L287 HydrophobicContact CG2-CD1 3.96Å; I283-L287 HydrophobicContact CG2-CG 4.49Å; I283-L287 WeakPolarHBondContact O-CG 3.34Å; I283-L287 PolarHBondContact O-N 3.08Å; A284-L287 PolarHBondContact O-N 3.4Å; A284-L287 VanDerWaalsContact O-N 3.14Å; E285-L287 VanDerWaalsContact C-N 3.34Å; L287-I289 PolarHBondContact O-N 2.86Å; L287-L290 HydrophobicContact CD2-CD2 4.25Å; L287-L290 PolarHBondContact O-N 3.1Å; L287-G291 PolarHBondContact O-N 3.14Å; L287-L313 HydrophobicContact CD2-CD2 3.85Å; L287-L316 HydrophobicContact CD2-CD1 4.16Å; L287-Y325 HydrophobicContact CD1-CD2 3.74Å; L287-Y325 HydrophobicContact CD1-CG 4.25Å; L287-Q328 HydrophobicContact CB-CB 3.67Å; L287-Q328 HydrophobicContact CD1-CB 4.43Å; L287-L329 HydrophobicContact CD1-CB 3.95Å; L287-L329 HydrophobicContact CD1-CD1 4.45Å; L287-L329 HydrophobicContact CD2-CD1 4.22Å; L287-C332 PolarHBondContact O-SG 3.35Å
288	E	97.9	Very high	96.1	Very high	43 Å²	43	29.4 Å²	29.4	20%	0.201	18%	0.183	C	C	.	.	H	α-helix	trans	-58.3	-47.5	172.8	-73.7	-177	-106.8	0	0	111.8	K245 A284 E285 L290 G291 S292 Q328	K245-E288 HydrophobicContact CD-CB 4.1Å; K245-E288 IonicContact NZ-OE1 2.74Å; K245-E288 PolarHBondContact NZ-OE1 3.24Å; K245-E288 IonicContact NZ-OE2 2.64Å; K245-E288 PolarHBondContact NZ-OE2 3.41Å; A284-E288 PolarHBondContact O-N 3.17Å; E285-E288 PolarHBondContact O-N 3.49Å; E288-L290 VanDerWaalsContact C-N 3.29Å; E288-L290 PolarHBondContact O-N 3.31Å; E288-G291 PolarHBondContact O-N 3.05Å; E288-S292 PolarHBondContact O-N 3.01Å; E288-Q328 HydrophobicContact CG-CG 3.74Å
289	I	98.2	Very high	96.2	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-61.3	-45.2	176.2	-59.1	171.7	0	0	0	109.5	F233 K245 L248 H249 F266 E285 L286 L287 G291 S292 I293	F233-I289 HydrophobicContact CE1-CD1 4.24Å; F233-I289 HydrophobicContact CZ-CD1 3.77Å; K245-I289 HydrophobicContact CB-CD1 4.4Å; K245-I289 HydrophobicContact CG-CD1 3.9Å; K245-I289 HydrophobicContact CG-CG1 3.69Å; K245-I289 WeakPolarHBondContact O-CD1 3.47Å; L248-I289 HydrophobicContact CB-CD1 4.19Å; L248-I289 HydrophobicContact CD2-CD1 3.89Å; L248-I289 HydrophobicContact CG-CD1 4.28Å; H249-I289 HydrophobicContact CB-CG1 4.35Å; H249-I289 HydrophobicContact CB-CG2 4.29Å; F266-I289 HydrophobicContact CE2-CB 4.34Å; F266-I289 HydrophobicContact CE2-CG2 4.31Å; F266-I289 HydrophobicContact CZ-CB 4.45Å; F266-I289 HydrophobicContact CZ-CD1 4.44Å; F266-I289 HydrophobicContact CZ-CG2 4.23Å; E285-I289 WeakPolarHBondContact O-CG1 3.41Å; E285-I289 PolarHBondContact O-N 3.17Å; L286-I289 PolarHBondContact O-N 3.38Å; L287-I289 PolarHBondContact O-N 2.86Å; I289-G291 VanDerWaalsContact C-N 3.32Å; I289-G291 PolarHBondContact O-N 3.44Å; I289-S292 WeakPolarHBondContact O-CB 3.34Å; I289-S292 PolarHBondContact O-N 3.42Å; I289-I293 HydrophobicContact CG2-CD1 3.79Å; I289-I293 HydrophobicContact CG2-CG1 4.3Å; I289-I293 WeakPolarHBondContact O-CG1 3.32Å; I289-I293 PolarHBondContact O-N 3.04Å
290	L	97.9	Very high	96.5	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-39.8	-178	-171.7	71	0	0	0	111.8	F266 F270 L286 L287 E288 S292 I293 I294 F308 L313	F266-L290 HydrophobicContact CD2-CB 4.41Å; F266-L290 HydrophobicContact CD2-CD1 4.18Å; F266-L290 HydrophobicContact CE2-CB 4.39Å; F270-L290 HydrophobicContact CE2-CD2 4.31Å; L286-L290 WeakPolarHBondContact O-CB 3.36Å; L286-L290 PolarHBondContact O-N 3.21Å; L287-L290 HydrophobicContact CD2-CD2 4.25Å; L287-L290 PolarHBondContact O-N 3.1Å; E288-L290 VanDerWaalsContact C-N 3.29Å; E288-L290 PolarHBondContact O-N 3.31Å; L290-S292 VanDerWaalsContact C-N 3.33Å; L290-S292 PolarHBondContact O-N 2.91Å; L290-I293 CarbonylContact O-C 3.58Å; L290-I293 WeakPolarHBondContact O-CA 3.25Å; L290-I293 WeakPolarHBondContact O-CB 3.46Å; L290-I293 PolarHBondContact O-N 3.37Å; L290-I294 HydrophobicContact CD2-CD1 4.13Å; L290-I294 HydrophobicContact CG-CD1 3.8Å; L290-I294 HydrophobicContact CG-CG1 4.23Å; L290-I294 VanDerWaalsContact O-CG1 3.25Å; L290-I294 WeakPolarHBondContact O-CG1 3.47Å; L290-I294 PolarHBondContact O-N 2.94Å; L290-F308 HydrophobicContact CD1-CE1 4.32Å; L290-F308 HydrophobicContact CD1-CZ 4.45Å; L290-F308 HydrophobicContact CD2-CE1 3.53Å; L290-F308 HydrophobicContact CD2-CZ 3.97Å; L290-L313 HydrophobicContact CD2-CD1 4.43Å; L290-L313 HydrophobicContact CD2-CD2 3.72Å
291	G	97.1	Very high	96.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.1	-43.8	174.7	0	0	0	0	0	112.3	L287 E288 I289 I293 I294 N295	L287-G291 PolarHBondContact O-N 3.14Å; E288-G291 PolarHBondContact O-N 3.05Å; I289-G291 VanDerWaalsContact C-N 3.32Å; I289-G291 PolarHBondContact O-N 3.44Å; G291-I293 PolarHBondContact O-N 3.47Å; G291-I294 PolarHBondContact O-N 3.12Å; G291-N295 PolarHBondContact O-N 3.21Å; G291-N295 VanDerWaalsContact O-N 3.1Å
292	S	96	Very high	96.7	Very high	31 Å²	31	34.7 Å²	34.7	22%	0.217	21%	0.212	C	C	.	.	H	α-helix	trans	-60.5	-42.8	171.8	178	0	0	0	0	112.1	H249 E288 I289 L290 G296	H249-S292 PolarHBondContact CE1-OG 3.42Å; H249-S292 PolarHBondContact NE2-OG 3.12Å; E288-S292 PolarHBondContact O-N 3.01Å; I289-S292 WeakPolarHBondContact O-CB 3.34Å; I289-S292 PolarHBondContact O-N 3.42Å; L290-S292 VanDerWaalsContact C-N 3.33Å; L290-S292 PolarHBondContact O-N 2.91Å; S292-G296 PolarHBondContact O-N 3.32Å
293	I	97.3	Very high	96.7	Very high	8 Å²	8	40.6 Å²	40.6	4%	0.041	24%	0.24	C	C	.	.	H	α-helix	trans	-63.3	-45.2	178.1	-68.6	172.9	0	0	0	111.8	Y252 I289 L290 G291 G296 F297	Y252-I293 HydrophobicContact CD1-CD1 3.84Å; Y252-I293 HydrophobicContact CD1-CG1 3.77Å; Y252-I293 HydrophobicContact CD2-CD1 3.81Å; Y252-I293 HydrophobicContact CE1-CB 4.3Å; Y252-I293 HydrophobicContact CE1-CD1 3.74Å; Y252-I293 HydrophobicContact CE1-CG1 3.49Å; Y252-I293 VanDerWaalsContact CE1-CG1 3.49Å; Y252-I293 HydrophobicContact CE1-CG2 4.02Å; Y252-I293 HydrophobicContact CE2-CD1 3.69Å; Y252-I293 HydrophobicContact CE2-CG1 4.36Å; Y252-I293 HydrophobicContact CG-CD1 3.89Å; Y252-I293 HydrophobicContact CG-CG1 4.33Å; Y252-I293 VanDerWaalsContact OH-CG2 3.28Å; Y252-I293 WeakPolarHBondContact OH-CG2 3.35Å; I289-I293 HydrophobicContact CG2-CD1 3.79Å; I289-I293 HydrophobicContact CG2-CG1 4.3Å; I289-I293 WeakPolarHBondContact O-CG1 3.32Å; I289-I293 PolarHBondContact O-N 3.04Å; L290-I293 CarbonylContact O-C 3.58Å; L290-I293 WeakPolarHBondContact O-CA 3.25Å; L290-I293 WeakPolarHBondContact O-CB 3.46Å; L290-I293 PolarHBondContact O-N 3.37Å; G291-I293 PolarHBondContact O-N 3.47Å; I293-G296 CarbonylContact O-C 3.58Å; I293-G296 WeakPolarHBondContact O-CA 3.34Å; I293-G296 PolarHBondContact O-N 3.05Å; I293-G296 VanDerWaalsContact O-N 3.1Å; I293-F297 HydrophobicContact CG2-CD1 4.4Å; I293-F297 HydrophobicContact CG2-CE1 3.58Å; I293-F297 HydrophobicContact CG2-CZ 4.06Å; I293-F297 WeakPolarHBondContact O-CD1 3.4Å; I293-F297 PolarHBondContact O-N 2.99Å
294	I	97.4	Very high	96.6	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-44.3	-178.7	-66.7	159.5	0	0	0	110.2	L290 G291 G296 F297 L313 C332 Q335 F336	L290-I294 HydrophobicContact CD2-CD1 4.13Å; L290-I294 HydrophobicContact CG-CD1 3.8Å; L290-I294 HydrophobicContact CG-CG1 4.23Å; L290-I294 VanDerWaalsContact O-CG1 3.25Å; L290-I294 WeakPolarHBondContact O-CG1 3.47Å; L290-I294 PolarHBondContact O-N 2.94Å; G291-I294 PolarHBondContact O-N 3.12Å; I294-G296 PolarHBondContact O-N 2.92Å; I294-F297 HydrophobicContact CB-CD2 4.3Å; I294-F297 HydrophobicContact CB-CE2 4.13Å; I294-F297 HydrophobicContact CG1-CD2 4.46Å; I294-F297 HydrophobicContact CG1-CE2 3.8Å; I294-F297 HydrophobicContact CG1-CZ 4.15Å; I294-F297 HydrophobicContact CG2-CD2 4.12Å; I294-F297 HydrophobicContact CG2-CE2 4.22Å; I294-F297 WeakPolarHBondContact O-CB 3.5Å; I294-F297 WeakPolarHBondContact O-CG 3.42Å; I294-F297 PolarHBondContact O-N 2.95Å; I294-L313 HydrophobicContact CD1-CD1 4.27Å; I294-C332 HydrophobicContact CD1-CB 3.82Å; I294-Q335 HydrophobicContact CB-CB 4.43Å; I294-Q335 HydrophobicContact CG2-CB 3.81Å; I294-F336 HydrophobicContact CD1-CD2 3.74Å; I294-F336 HydrophobicContact CD1-CE2 3.43Å; I294-F336 VanDerWaalsContact CD1-CE2 3.43Å; I294-F336 HydrophobicContact CD1-CZ 4.44Å; I294-F336 HydrophobicContact CG1-CD2 4.16Å; I294-F336 HydrophobicContact CG1-CE2 3.66Å; I294-F336 HydrophobicContact CG1-CZ 4.23Å; I294-F336 HydrophobicContact CG2-CD2 3.82Å; I294-F336 HydrophobicContact CG2-CE2 4.04Å; I294-F336 HydrophobicContact CG2-CG 4.09Å; I294-F336 HydrophobicContact CG2-CZ 4.49Å
295	N	95.5	Very high	96.6	Very high	61 Å²	61	45 Å²	45	33%	0.326	26%	0.258	S	S	.	.	H	α-helix	trans	-58.7	-30.6	175.2	-171.4	12.9	0	0	0	111.8	G291 F297 K339	G291-N295 PolarHBondContact O-N 3.21Å; G291-N295 VanDerWaalsContact O-N 3.1Å; N295-F297 PolarHBondContact O-N 3.41Å; N295-K339 WeakPolarHBondContact O-CE 3.22Å; N295-K339 PolarHBondContact O-NZ 3.37Å
296	G	94.9	Very high	96.6	Very high	61 Å²	61	46.3 Å²	46.3	63%	0.629	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	0.1	174.7	0	0	0	0	0	116.2	S292 I293 I294	S292-G296 PolarHBondContact O-N 3.32Å; I293-G296 CarbonylContact O-C 3.58Å; I293-G296 WeakPolarHBondContact O-CA 3.34Å; I293-G296 PolarHBondContact O-N 3.05Å; I293-G296 VanDerWaalsContact O-N 3.1Å; I294-G296 PolarHBondContact O-N 2.92Å
297	F	95.9	Very high	96.5	Very high	23 Å²	23	50.4 Å²	50.4	10%	0.101	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-65.6	138.9	179.7	-71.6	-19.7	0	0	0	112.5	I293 I294 N295 L301 H305 F336	I293-F297 HydrophobicContact CG2-CD1 4.4Å; I293-F297 HydrophobicContact CG2-CE1 3.58Å; I293-F297 HydrophobicContact CG2-CZ 4.06Å; I293-F297 WeakPolarHBondContact O-CD1 3.4Å; I293-F297 PolarHBondContact O-N 2.99Å; I294-F297 HydrophobicContact CB-CD2 4.3Å; I294-F297 HydrophobicContact CB-CE2 4.13Å; I294-F297 HydrophobicContact CG1-CD2 4.46Å; I294-F297 HydrophobicContact CG1-CE2 3.8Å; I294-F297 HydrophobicContact CG1-CZ 4.15Å; I294-F297 HydrophobicContact CG2-CD2 4.12Å; I294-F297 HydrophobicContact CG2-CE2 4.22Å; I294-F297 WeakPolarHBondContact O-CB 3.5Å; I294-F297 WeakPolarHBondContact O-CG 3.42Å; I294-F297 PolarHBondContact O-N 2.95Å; N295-F297 PolarHBondContact O-N 3.41Å; F297-L301 HydrophobicContact CB-CD2 3.81Å; F297-L301 HydrophobicContact CD2-CD2 3.9Å; F297-L301 HydrophobicContact CG-CD2 4.31Å; F297-H305 AromaticContact CD1-NE2 3.98Å; F297-H305 HydrophobicContact CD2-CB 4.34Å; F297-H305 AromaticContact CD2-CD2 3.78Å; F297-H305 AromaticContact CE1-CD2 3.98Å; F297-H305 AromaticContact CE1-NE2 3.82Å; F297-H305 HydrophobicContact CE2-CB 3.87Å; F297-H305 AromaticContact CE2-CD2 3.75Å; F297-H305 AromaticContact CE2-CG 3.68Å; F297-H305 AromaticContact CG-CD2 3.93Å; F297-H305 HydrophobicContact CZ-CB 4.41Å; F297-H305 AromaticContact CZ-CD2 3.85Å; F297-H305 AromaticContact CZ-CG 3.8Å; F297-H305 AromaticContact CZ-ND1 3.9Å; F297-F336 HydrophobicContact CD2-CE1 4.46Å; F297-F336 HydrophobicContact CE2-CE1 4.12Å; F297-F336 AromaticContact CE2-CZ 3.81Å; F297-F336 HydrophobicContact CE2-CZ 3.81Å
298	A	94.7	Very high	96.5	Very high	82 Å²	82	52 Å²	52	68%	0.678	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-75.6	147.6	172.1	0	0	0	0	0	110.2	P300	A298-P300 CarbonylContact O-C 3.4Å
299	L	94	Very high	96.5	Very high	111 Å²	111	50 Å²	50	58%	0.581	28%	0.282	S	S	*	.	S	Bend	trans	-98.3	142	172.6	-60.1	-179.4	0	0	0	109.8	L301 K339	L299-L301 HydrophobicContact CD2-CD2 4.27Å; L299-L301 HydrophobicContact CD2-CG 4.17Å; L299-K339 HydrophobicContact CD2-CB 4Å; L299-K339 HydrophobicContact CD2-CD 4.11Å; L299-K339 VanDerWaalsContact CD2-O 3.3Å; L299-K339 WeakPolarHBondContact CD2-O 3.48Å
300	P	95.2	Very high	96.5	Very high	122 Å²	122	51.9 Å²	51.9	79%	0.792	29%	0.291	S	S	*	.	S	Bend	cis	-70	149.9	-2.8	30.5	-35.8	0	0	0	112.8	A298 K302	A298-P300 CarbonylContact O-C 3.4Å; P300-K302 PolarHBondContact O-N 3.18Å
301	L	95.9	Very high	96.4	Very high	14 Å²	14	59.6 Å²	59.6	7%	0.073	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-59.8	133.5	176.9	-72	-177.9	0	0	0	111	F297 L299 F336 K339 D340 L343	F297-L301 HydrophobicContact CB-CD2 3.81Å; F297-L301 HydrophobicContact CD2-CD2 3.9Å; F297-L301 HydrophobicContact CG-CD2 4.31Å; L299-L301 HydrophobicContact CD2-CD2 4.27Å; L299-L301 HydrophobicContact CD2-CG 4.17Å; L301-F336 HydrophobicContact CD1-CD1 4.04Å; L301-F336 HydrophobicContact CD1-CE1 4.4Å; L301-K339 HydrophobicContact CD1-CB 3.98Å; L301-K339 HydrophobicContact CD2-CB 4.05Å; L301-K339 HydrophobicContact CG-CB 4.17Å; L301-D340 HydrophobicContact CD1-CB 3.57Å; L301-D340 HydrophobicContact CG-CB 4.26Å; L301-L343 HydrophobicContact CD1-CD1 4.06Å
302	K	96	Very high	96.5	Very high	126 Å²	126	59.7 Å²	59.7	55%	0.548	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-68.5	147.4	174.2	-61.8	-175.8	178.1	-174.8	0	111.3	P300 E304 H305 K306	P300-K302 PolarHBondContact O-N 3.18Å; K302-E304 VanDerWaalsContact C-N 3.26Å; K302-E304 HydrophobicContact CB-CG 3.82Å; K302-E304 HydrophobicContact CD-CG 4.4Å; K302-E304 WeakPolarHBondContact CD-OE1 3.46Å; K302-E304 PolarHBondContact O-N 3.43Å; K302-H305 WeakPolarHBondContact O-CB 3.34Å; K302-H305 PolarHBondContact O-N 2.67Å; K302-K306 PolarHBondContact O-N 3.01Å
303	E	96.4	Very high	96.6	Very high	125 Å²	125	58.2 Å²	58.2	58%	0.584	31%	0.31	S	S	*	.	H	α-helix	trans	-58.4	-37	178.9	-171.4	56.2	-151.3	0	0	112.7	H305 K306 I307	E303-H305 PolarHBondContact O-N 3.36Å; E303-K306 PolarHBondContact O-N 3.13Å; E303-K306 VanDerWaalsContact O-N 3.13Å; E303-I307 HydrophobicContact CG-CD1 4.05Å; E303-I307 HydrophobicContact CG-CG1 4.43Å; E303-I307 WeakPolarHBondContact O-CG1 3.23Å; E303-I307 PolarHBondContact O-N 3.34Å
304	E	96	Very high	96.6	Very high	91 Å²	91	57.8 Å²	57.8	43%	0.425	31%	0.308	S	S	.	.	H	α-helix	trans	-56.6	-33	174.7	54	164.5	179.7	0	0	113	R263 K302 F308	R263-E304 IonicContact NH2-OE1 3.2Å; K302-E304 VanDerWaalsContact C-N 3.26Å; K302-E304 HydrophobicContact CB-CG 3.82Å; K302-E304 HydrophobicContact CD-CG 4.4Å; K302-E304 WeakPolarHBondContact CD-OE1 3.46Å; K302-E304 PolarHBondContact O-N 3.43Å; E304-F308 WeakPolarHBondContact O-CB 3.5Å; E304-F308 PolarHBondContact O-N 3.44Å
305	H	97.1	Very high	96.7	Very high	16 Å²	16	58.1 Å²	58.1	7%	0.074	31%	0.31	C	S	.	.	H	α-helix	trans	-77.7	-37.3	179.4	-55.6	-21.7	0	0	0	111.2	F297 K302 E303 F308 L309 F336	F297-H305 AromaticContact CD1-NE2 3.98Å; F297-H305 HydrophobicContact CD2-CB 4.34Å; F297-H305 AromaticContact CD2-CD2 3.78Å; F297-H305 AromaticContact CE1-CD2 3.98Å; F297-H305 AromaticContact CE1-NE2 3.82Å; F297-H305 HydrophobicContact CE2-CB 3.87Å; F297-H305 AromaticContact CE2-CD2 3.75Å; F297-H305 AromaticContact CE2-CG 3.68Å; F297-H305 AromaticContact CG-CD2 3.93Å; F297-H305 HydrophobicContact CZ-CB 4.41Å; F297-H305 AromaticContact CZ-CD2 3.85Å; F297-H305 AromaticContact CZ-CG 3.8Å; F297-H305 AromaticContact CZ-ND1 3.9Å; K302-H305 WeakPolarHBondContact O-CB 3.34Å; K302-H305 PolarHBondContact O-N 2.67Å; E303-H305 PolarHBondContact O-N 3.36Å; H305-F308 WeakPolarHBondContact O-CB 3.25Å; H305-F308 PolarHBondContact O-N 3.33Å; H305-L309 PolarHBondContact O-N 2.89Å; H305-F336 HydrophobicContact CB-CE1 3.96Å; H305-F336 HydrophobicContact CB-CZ 4.19Å; H305-F336 WeakPolarHBondContact O-CE1 3.47Å; H305-F336 WeakPolarHBondContact O-CZ 3.41Å
306	K	97.6	Very high	96.8	Very high	48 Å²	48	55.2 Å²	55.2	21%	0.209	30%	0.295	C	S	.	.	H	α-helix	trans	-63.2	-44.4	173.5	-60.4	-173.2	175.9	-154.7	0	111.1	K302 E303 F308 L309 M310 D340 L343	K302-K306 PolarHBondContact O-N 3.01Å; E303-K306 PolarHBondContact O-N 3.13Å; E303-K306 VanDerWaalsContact O-N 3.13Å; K306-F308 VanDerWaalsContact C-N 3.31Å; K306-F308 PolarHBondContact O-N 3.27Å; K306-L309 PolarHBondContact O-N 3.07Å; K306-M310 WeakPolarHBondContact O-CG 3.31Å; K306-M310 PolarHBondContact O-N 3.18Å; K306-M310 VanDerWaalsContact O-N 3.09Å; K306-D340 VanDerWaalsContact CE-OD2 3.28Å; K306-D340 WeakPolarHBondContact CE-OD2 3.42Å; K306-D340 IonicContact NZ-OD2 3.08Å; K306-D340 PolarHBondContact NZ-OD2 3.03Å; K306-L343 HydrophobicContact CD-CD2 4.11Å; K306-L343 HydrophobicContact CG-CD1 4.44Å; K306-L343 HydrophobicContact CG-CD2 4.27Å
307	I	97.3	Very high	97	Very high	86 Å²	86	52.3 Å²	52.3	44%	0.441	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-43.2	174.1	-66.9	170.1	0	0	0	110.5	E303 M310 R311	E303-I307 HydrophobicContact CG-CD1 4.05Å; E303-I307 HydrophobicContact CG-CG1 4.43Å; E303-I307 WeakPolarHBondContact O-CG1 3.23Å; E303-I307 PolarHBondContact O-N 3.34Å; I307-M310 PolarHBondContact O-N 3.4Å; I307-R311 HydrophobicContact CG2-CB 4.46Å; I307-R311 HydrophobicContact CG2-CG 3.95Å; I307-R311 VanDerWaalsContact O-CB 3.26Å; I307-R311 WeakPolarHBondContact O-CB 3.37Å; I307-R311 WeakPolarHBondContact O-CG 3.36Å; I307-R311 PolarHBondContact O-N 3.11Å
308	F	97.8	Very high	97	Very high	34 Å²	34	56.1 Å²	56.1	15%	0.149	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-45.5	178.3	-173	-85.2	0	0	0	112.2	F270 L290 E304 H305 K306 M310 V312 L313	F270-F308 HydrophobicContact CD2-CZ 4.02Å; F270-F308 HydrophobicContact CE2-CZ 4.13Å; L290-F308 HydrophobicContact CD1-CE1 4.32Å; L290-F308 HydrophobicContact CD1-CZ 4.45Å; L290-F308 HydrophobicContact CD2-CE1 3.53Å; L290-F308 HydrophobicContact CD2-CZ 3.97Å; E304-F308 WeakPolarHBondContact O-CB 3.5Å; E304-F308 PolarHBondContact O-N 3.44Å; H305-F308 WeakPolarHBondContact O-CB 3.25Å; H305-F308 PolarHBondContact O-N 3.33Å; K306-F308 VanDerWaalsContact C-N 3.31Å; K306-F308 PolarHBondContact O-N 3.27Å; F308-M310 PolarHBondContact O-N 2.92Å; F308-V312 HydrophobicContact CD1-CB 4.45Å; F308-V312 HydrophobicContact CD2-CB 4.21Å; F308-V312 HydrophobicContact CD2-CG2 3.88Å; F308-V312 HydrophobicContact CE1-CB 4.3Å; F308-V312 HydrophobicContact CE1-CG1 4.4Å; F308-V312 HydrophobicContact CE2-CB 4.11Å; F308-V312 HydrophobicContact CE2-CG1 4.05Å; F308-V312 HydrophobicContact CE2-CG2 4.03Å; F308-V312 HydrophobicContact CG-CB 4.39Å; F308-V312 HydrophobicContact CG-CG2 4.35Å; F308-V312 HydrophobicContact CZ-CB 4.15Å; F308-V312 HydrophobicContact CZ-CG1 3.92Å; F308-V312 WeakPolarHBondContact O-CA 3.44Å; F308-V312 VanDerWaalsContact O-CB 3.23Å; F308-V312 WeakPolarHBondContact O-CB 3.49Å; F308-V312 PolarHBondContact O-N 3.1Å; F308-L313 HydrophobicContact CD1-CD1 4.31Å; F308-L313 HydrophobicContact CD1-CG 4.03Å; F308-L313 HydrophobicContact CE1-CD1 4.23Å; F308-L313 HydrophobicContact CE1-CD2 3.87Å; F308-L313 HydrophobicContact CE1-CG 3.75Å; F308-L313 PolarHBondContact O-N 2.93Å
309	L	98.2	Very high	97	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.25	C	C	.	.	I	π-helix	trans	-54.6	-54.2	172.8	173.3	65	0	0	0	111	H305 K306 L313 L314 V333 F336 L343 V347	H305-L309 PolarHBondContact O-N 2.89Å; K306-L309 PolarHBondContact O-N 3.07Å; L309-L313 HydrophobicContact CD1-CB 4.17Å; L309-L313 HydrophobicContact CD1-CD1 4.04Å; L309-L313 PolarHBondContact O-N 3.34Å; L309-L314 HydrophobicContact CD1-CD2 4.43Å; L309-L314 HydrophobicContact CD1-CG 4.43Å; L309-L314 WeakPolarHBondContact O-CG 3.49Å; L309-L314 PolarHBondContact O-N 3.06Å; L309-V333 HydrophobicContact CD1-CG2 4.44Å; L309-F336 HydrophobicContact CB-CD1 4.3Å; L309-F336 HydrophobicContact CB-CD2 4.26Å; L309-F336 HydrophobicContact CB-CE1 4.2Å; L309-F336 HydrophobicContact CB-CE2 4.16Å; L309-F336 HydrophobicContact CB-CG 4.32Å; L309-F336 HydrophobicContact CB-CZ 4.12Å; L309-F336 HydrophobicContact CD1-CB 4.25Å; L309-F336 HydrophobicContact CD1-CD2 3.92Å; L309-F336 HydrophobicContact CD1-CE2 4.49Å; L309-F336 HydrophobicContact CD1-CG 4.12Å; L309-F336 HydrophobicContact CD2-CB 3.95Å; L309-F336 HydrophobicContact CD2-CD1 4.09Å; L309-F336 HydrophobicContact CD2-CG 3.97Å; L309-F336 HydrophobicContact CG-CD2 4.46Å; L309-F336 HydrophobicContact CG-CG 4.36Å; L309-L343 HydrophobicContact CD2-CB 4.4Å; L309-L343 HydrophobicContact CD2-CD1 3.92Å; L309-V347 HydrophobicContact CD1-CG2 4.46Å; L309-V347 HydrophobicContact CD2-CG2 3.86Å; L309-V347 HydrophobicContact CG-CG2 4.36Å
310	M	97.6	Very high	96.9	Very high	45 Å²	45	53.4 Å²	53.4	22%	0.222	25%	0.25	C	C	.	.	I	π-helix	trans	-71.4	-33.9	-172.3	-65.5	-56.3	-62.3	0	0	114.4	K306 I307 F308 L314 Q346	K306-M310 WeakPolarHBondContact O-CG 3.31Å; K306-M310 PolarHBondContact O-N 3.18Å; K306-M310 VanDerWaalsContact O-N 3.09Å; I307-M310 PolarHBondContact O-N 3.4Å; F308-M310 PolarHBondContact O-N 2.92Å; M310-L314 HydrophobicContact CE-CD1 3.82Å; M310-L314 HydrophobicContact SD-CD1 3.47Å; M310-L314 WeakPolarHBondContact SD-CD1 3.37Å; M310-Q346 HydrophobicContact CE-CB 3.77Å; M310-Q346 HydrophobicContact SD-CB 3.93Å
311	R	97.3	Very high	96.8	Very high	166 Å²	166	48.3 Å²	48.3	63%	0.626	22%	0.217	S	C	*	.	I	π-helix	trans	-102.1	-18.5	-172.2	-61.9	-64.9	-173.7	164.2	0.1	114	Y271 I307 P315	Y271-R311 WeakPolarHBondContact CE1-O 3.43Å; Y271-R311 WeakPolarHBondContact OH-CB 3.44Å; I307-R311 HydrophobicContact CG2-CB 4.46Å; I307-R311 HydrophobicContact CG2-CG 3.95Å; I307-R311 VanDerWaalsContact O-CB 3.26Å; I307-R311 WeakPolarHBondContact O-CB 3.37Å; I307-R311 WeakPolarHBondContact O-CG 3.36Å; I307-R311 PolarHBondContact O-N 3.11Å; R311-P315 WeakPolarHBondContact O-CG 3.42Å
312	V	98	Very high	96.7	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.012	21%	0.213	C	C	.	.	I	π-helix	trans	-119.4	-58.8	-176.6	-170	0	0	0	0	111.1	F270 Y271 F308 P315 L316	F270-V312 HydrophobicContact CB-CG1 3.47Å; F270-V312 VanDerWaalsContact CB-CG1 3.47Å; F270-V312 HydrophobicContact CD2-CG1 3.59Å; F270-V312 HydrophobicContact CG-CG1 3.98Å; Y271-V312 HydrophobicContact CE1-CG2 4.07Å; Y271-V312 HydrophobicContact CE2-CG2 3.95Å; Y271-V312 WeakPolarHBondContact OH-CG2 3.49Å; F308-V312 HydrophobicContact CD1-CB 4.45Å; F308-V312 HydrophobicContact CD2-CB 4.21Å; F308-V312 HydrophobicContact CD2-CG2 3.88Å; F308-V312 HydrophobicContact CE1-CB 4.3Å; F308-V312 HydrophobicContact CE1-CG1 4.4Å; F308-V312 HydrophobicContact CE2-CB 4.11Å; F308-V312 HydrophobicContact CE2-CG1 4.05Å; F308-V312 HydrophobicContact CE2-CG2 4.03Å; F308-V312 HydrophobicContact CG-CB 4.39Å; F308-V312 HydrophobicContact CG-CG2 4.35Å; F308-V312 HydrophobicContact CZ-CB 4.15Å; F308-V312 HydrophobicContact CZ-CG1 3.92Å; F308-V312 WeakPolarHBondContact O-CA 3.44Å; F308-V312 VanDerWaalsContact O-CB 3.23Å; F308-V312 WeakPolarHBondContact O-CB 3.49Å; F308-V312 PolarHBondContact O-N 3.1Å; V312-P315 WeakPolarHBondContact O-CD 3.2Å; V312-L316 WeakPolarHBondContact O-CG 3.42Å; V312-L316 PolarHBondContact O-N 3.18Å
313	L	98.5	Very high	96.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.201	C	C	.	.	I	π-helix	trans	-66.8	-48.5	-175.5	-66.1	-177.3	0	0	0	112.9	L287 L290 I294 F308 L309 L316 H317 L329 C332 F336	L287-L313 HydrophobicContact CD2-CD2 3.85Å; L290-L313 HydrophobicContact CD2-CD1 4.43Å; L290-L313 HydrophobicContact CD2-CD2 3.72Å; I294-L313 HydrophobicContact CD1-CD1 4.27Å; F308-L313 HydrophobicContact CD1-CD1 4.31Å; F308-L313 HydrophobicContact CD1-CG 4.03Å; F308-L313 HydrophobicContact CE1-CD1 4.23Å; F308-L313 HydrophobicContact CE1-CD2 3.87Å; F308-L313 HydrophobicContact CE1-CG 3.75Å; F308-L313 PolarHBondContact O-N 2.93Å; L309-L313 HydrophobicContact CD1-CB 4.17Å; L309-L313 HydrophobicContact CD1-CD1 4.04Å; L309-L313 PolarHBondContact O-N 3.34Å; L313-L316 HydrophobicContact CD2-CD1 4.15Å; L313-L316 WeakPolarHBondContact O-CB 3.45Å; L313-L316 PolarHBondContact O-N 3.16Å; L313-H317 PolarHBondContact O-ND1 3.47Å; L313-L329 HydrophobicContact CB-CD1 4.24Å; L313-L329 HydrophobicContact CD2-CD1 4Å; L313-C332 HydrophobicContact CD1-CB 4.12Å; L313-F336 HydrophobicContact CD1-CD2 3.85Å; L313-F336 HydrophobicContact CD1-CE2 3.59Å
314	L	98.3	Very high	96.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.8	-42.6	-178.3	-60.1	175.8	0	0	0	112.6	L309 M310 L316 H317 V333 V347 F354	L309-L314 HydrophobicContact CD1-CD2 4.43Å; L309-L314 HydrophobicContact CD1-CG 4.43Å; L309-L314 WeakPolarHBondContact O-CG 3.49Å; L309-L314 PolarHBondContact O-N 3.06Å; M310-L314 HydrophobicContact CE-CD1 3.82Å; M310-L314 HydrophobicContact SD-CD1 3.47Å; M310-L314 WeakPolarHBondContact SD-CD1 3.37Å; L314-L316 VanDerWaalsContact C-N 3.26Å; L314-L316 PolarHBondContact O-N 3Å; L314-H317 PolarHBondContact O-N 3.07Å; L314-H317 PolarHBondContact O-ND1 2.59Å; L314-V333 HydrophobicContact CD2-CG2 4.41Å; L314-V347 HydrophobicContact CD1-CG2 4.28Å; L314-V347 HydrophobicContact CD2-CB 4.49Å; L314-V347 HydrophobicContact CD2-CG1 4.01Å; L314-V347 HydrophobicContact CD2-CG2 4.34Å; L314-F354 HydrophobicContact CB-CE2 4.23Å
315	P	98.2	Very high	96.6	Very high	7 Å²	7	37 Å²	37	5%	0.045	17%	0.172	C	C	.	.	H	α-helix	trans	-63.6	-20.7	174.7	-28.1	39.4	0	0	0	115.9	I274 R311 V312 H317 K318	I274-P315 HydrophobicContact CD1-CB 4.29Å; I274-P315 HydrophobicContact CG2-CB 4.24Å; R311-P315 WeakPolarHBondContact O-CG 3.42Å; V312-P315 WeakPolarHBondContact O-CD 3.2Å; P315-H317 PolarHBondContact O-N 2.72Å; P315-K318 HydrophobicContact CB-CD 4.48Å; P315-K318 VanDerWaalsContact O-CB 3.3Å; P315-K318 WeakPolarHBondContact O-CB 3.43Å; P315-K318 WeakPolarHBondContact O-CG 3.28Å; P315-K318 PolarHBondContact O-N 3.25Å
316	L	98.2	Very high	96.7	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.6	-24.8	175.3	-77.3	168.9	0	0	0	113.1	F270 F273 I274 L287 V312 L313 L314 K318 V319 Y325 L329	F270-L316 HydrophobicContact CB-CD2 4.5Å; F270-L316 HydrophobicContact CD1-CD2 4.48Å; F270-L316 HydrophobicContact CG-CD1 4.38Å; F273-L316 HydrophobicContact CD1-CD2 3.65Å; F273-L316 HydrophobicContact CE1-CD2 3.87Å; I274-L316 HydrophobicContact CD1-CD2 3.7Å; I274-L316 HydrophobicContact CD1-CG 3.82Å; I274-L316 HydrophobicContact CG1-CD2 3.56Å; I274-L316 HydrophobicContact CG1-CG 4.16Å; L287-L316 HydrophobicContact CD2-CD1 4.16Å; V312-L316 WeakPolarHBondContact O-CG 3.42Å; V312-L316 PolarHBondContact O-N 3.18Å; L313-L316 HydrophobicContact CD2-CD1 4.15Å; L313-L316 WeakPolarHBondContact O-CB 3.45Å; L313-L316 PolarHBondContact O-N 3.16Å; L314-L316 VanDerWaalsContact C-N 3.26Å; L314-L316 PolarHBondContact O-N 3Å; L316-K318 PolarHBondContact O-N 3.06Å; L316-V319 PolarHBondContact O-N 3.36Å; L316-Y325 HydrophobicContact CB-CE2 4.28Å; L316-Y325 PolarHBondContact O-OH 3.43Å; L316-L329 HydrophobicContact CB-CD1 4.26Å; L316-L329 HydrophobicContact CB-CD2 3.68Å; L316-L329 HydrophobicContact CD1-CD1 4.02Å
317	H	98.2	Very high	96.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-19.7	176.4	-59.5	85.1	0	0	0	113.2	L313 L314 P315 L329 K362 F366 E369	L313-H317 PolarHBondContact O-ND1 3.47Å; L314-H317 PolarHBondContact O-N 3.07Å; L314-H317 PolarHBondContact O-ND1 2.59Å; P315-H317 PolarHBondContact O-N 2.72Å; H317-L329 VanDerWaalsContact CE1-CD2 3.43Å; H317-L329 WeakPolarHBondContact CE1-CD2 3.29Å; H317-L329 VanDerWaalsContact NE2-CD2 3.33Å; H317-L329 WeakPolarHBondContact NE2-CD2 3.34Å; H317-K362 PolarHBondContact O-NZ 2.98Å; H317-F366 HydrophobicContact CB-CE2 4.07Å; H317-F366 HydrophobicContact CB-CZ 3.66Å; H317-E369 IonicContact CD2-OE2 2.78Å; H317-E369 PolarHBondContact CD2-OE2 3.26Å; H317-E369 VanDerWaalsContact CD2-OE2 3.24Å; H317-E369 IonicContact CE1-OE1 3.79Å; H317-E369 IonicContact NE2-OE1 3.24Å; H317-E369 PolarHBondContact NE2-OE1 2.99Å; H317-E369 IonicContact NE2-OE2 3.01Å; H317-E369 PolarHBondContact NE2-OE2 3.04Å; H317-E369 VanDerWaalsContact NE2-OE2 3.08Å
318	K	96.5	Very high	96.7	Very high	103 Å²	103	35.2 Å²	35.2	45%	0.448	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-34.6	-178.1	-65.3	173.9	65	-150.1	0	112.7	P315 L316 F354 K362	P315-K318 HydrophobicContact CB-CD 4.48Å; P315-K318 VanDerWaalsContact O-CB 3.3Å; P315-K318 WeakPolarHBondContact O-CB 3.43Å; P315-K318 WeakPolarHBondContact O-CG 3.28Å; P315-K318 PolarHBondContact O-N 3.25Å; L316-K318 PolarHBondContact O-N 3.06Å; K318-F354 HydrophobicContact CD-CD1 3.97Å; K318-F354 HydrophobicContact CD-CE1 3.87Å; K318-F354 HydrophobicContact CD-CG 4.42Å; K318-F354 HydrophobicContact CD-CZ 4.23Å; K318-F354 HydrophobicContact CG-CB 4.32Å; K318-F354 HydrophobicContact CG-CD1 3.9Å; K318-F354 HydrophobicContact CG-CD2 4.3Å; K318-F354 HydrophobicContact CG-CE1 4.28Å; K318-F354 HydrophobicContact CG-CG 3.92Å; K318-K362 PolarHBondContact O-NZ 3.35Å; K318-K362 VanDerWaalsContact O-NZ 3.1Å
319	V	94.5	Very high	96.7	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.012	17%	0.166	C	C	.	.	S	Bend	trans	-63.7	144	-172	-170.2	0	0	0	0	110.5	F273 I274 E278 L316 V322 Y325 K362	F273-V319 HydrophobicContact CD1-CG2 4.36Å; F273-V319 HydrophobicContact CE1-CB 4.2Å; F273-V319 HydrophobicContact CE1-CG1 4.06Å; F273-V319 HydrophobicContact CE1-CG2 3.87Å; F273-V319 HydrophobicContact CE2-CG1 4.25Å; F273-V319 HydrophobicContact CZ-CB 4.25Å; F273-V319 HydrophobicContact CZ-CG1 3.66Å; F273-V319 HydrophobicContact CZ-CG2 4.34Å; I274-V319 HydrophobicContact CB-CG2 4.5Å; I274-V319 HydrophobicContact CG1-CG2 4.25Å; E278-V319 HydrophobicContact CB-CG1 4.15Å; E278-V319 HydrophobicContact CG-CG1 4.21Å; L316-V319 PolarHBondContact O-N 3.36Å; V319-V322 WeakPolarHBondContact O-CB 3.37Å; V319-V322 PolarHBondContact O-N 2.96Å; V319-Y325 WeakPolarHBondContact CB-OH 3.39Å; V319-K362 PolarHBondContact O-NZ 3.17Å
320	K	91.8	Very high	96.7	Very high	134 Å²	134	33.7 Å²	33.7	58%	0.583	17%	0.166	S	C	*	.	G	3₁₀ helix	trans	-62.1	-45.8	-173.4	-63.4	175.5	-173.2	167.6	0	112.3	V322	K320-V322 PolarHBondContact O-N 3.25Å
321	S	92.6	Very high	96.7	Very high	15 Å²	15	32.8 Å²	32.8	11%	0.105	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-74	23.3	-179.6	53.3	0	0	0	0	115	S323 I324 Y325	S321-S323 PolarHBondContact O-N 3.18Å; S321-I324 PolarHBondContact O-N 3.11Å; S321-Y325 VanDerWaalsContact O-CE1 3.25Å; S321-Y325 WeakPolarHBondContact O-CE1 3.42Å
322	V	95.5	Very high	96.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-61.3	-26	-178.5	64.5	0	0	0	0	112.9	V319 K320 I324 Y325 H326 K362 M365	V319-V322 WeakPolarHBondContact O-CB 3.37Å; V319-V322 PolarHBondContact O-N 2.96Å; K320-V322 PolarHBondContact O-N 3.25Å; V322-I324 PolarHBondContact O-N 2.94Å; V322-Y325 HydrophobicContact CB-CE2 4.3Å; V322-Y325 HydrophobicContact CG2-CE2 3.86Å; V322-Y325 PolarHBondContact O-N 3.17Å; V322-H326 HydrophobicContact CG2-CB 4.25Å; V322-H326 WeakPolarHBondContact O-CA 3.34Å; V322-H326 VanDerWaalsContact O-CB 3.24Å; V322-H326 WeakPolarHBondContact O-CB 3.46Å; V322-H326 PolarHBondContact O-N 3.41Å; V322-K362 HydrophobicContact CG1-CD 3.59Å; V322-K362 HydrophobicContact CG1-CG 3.62Å; V322-M365 HydrophobicContact CG1-CE 3.97Å; V322-M365 HydrophobicContact CG2-CE 4.36Å
323	S	94.5	Very high	96.8	Very high	42 Å²	42	24.8 Å²	24.8	29%	0.294	13%	0.13	S	C	.	.	G	3₁₀ helix	trans	-57.4	-31.5	180	58.4	0	0	0	0	113.7	E183 S321 Y325 M365	E183-S323 VanDerWaalsContact CD-OG 3.32Å; E183-S323 WeakPolarHBondContact OE1-CB 3.44Å; E183-S323 PolarHBondContact OE1-OG 3.41Å; S321-S323 PolarHBondContact O-N 3.18Å; S323-Y325 PolarHBondContact O-N 3.27Å; S323-M365 VanDerWaalsContact CA-CE 3.41Å
324	I	94.3	Very high	96.8	Very high	74 Å²	74	25.1 Å²	25.1	38%	0.379	13%	0.132	S	C	.	.	G	3₁₀ helix	trans	-67.1	-34	179.5	-53.8	169.9	0	0	0	112.8	P182 E183 S321 V322	P182-I324 HydrophobicContact CB-CD1 3.67Å; P182-I324 HydrophobicContact CG-CD1 4.05Å; E183-I324 HydrophobicContact CG-CG1 4.09Å; S321-I324 PolarHBondContact O-N 3.11Å; V322-I324 PolarHBondContact O-N 2.94Å
325	Y	96.8	Very high	96.7	Very high	4 Å²	4	25.2 Å²	25.2	2%	0.016	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.5	6.8	-169.7	61.1	-100.5	0	0	0	114.3	F273 I283 L287 L316 V319 S321 V322 S323 A327 Q328 L329	F273-Y325 AromaticContact CE1-CE1 3.87Å; F273-Y325 HydrophobicContact CE1-CE1 3.87Å; F273-Y325 AromaticContact CE1-CZ 3.86Å; F273-Y325 AromaticContact CZ-CE1 3.77Å; F273-Y325 HydrophobicContact CZ-CE1 3.77Å; I283-Y325 HydrophobicContact CB-CD1 4.09Å; I283-Y325 HydrophobicContact CB-CG 4.35Å; I283-Y325 HydrophobicContact CG2-CD1 3.74Å; I283-Y325 HydrophobicContact CG2-CD2 3.97Å; I283-Y325 HydrophobicContact CG2-CE1 4.1Å; I283-Y325 HydrophobicContact CG2-CE2 4.33Å; I283-Y325 HydrophobicContact CG2-CG 3.67Å; L287-Y325 HydrophobicContact CD1-CD2 3.74Å; L287-Y325 HydrophobicContact CD1-CG 4.25Å; L316-Y325 HydrophobicContact CB-CE2 4.28Å; L316-Y325 PolarHBondContact O-OH 3.43Å; V319-Y325 WeakPolarHBondContact CB-OH 3.39Å; S321-Y325 VanDerWaalsContact O-CE1 3.25Å; S321-Y325 WeakPolarHBondContact O-CE1 3.42Å; V322-Y325 HydrophobicContact CB-CE2 4.3Å; V322-Y325 HydrophobicContact CG2-CE2 3.86Å; V322-Y325 PolarHBondContact O-N 3.17Å; S323-Y325 PolarHBondContact O-N 3.27Å; Y325-A327 PolarHBondContact O-N 3.33Å; Y325-Q328 PolarHBondContact O-N 2.81Å; Y325-Q328 PolarHBondContact O-OE1 3.1Å; Y325-L329 HydrophobicContact CD2-CB 4.33Å; Y325-L329 HydrophobicContact CD2-CD2 4.35Å; Y325-L329 HydrophobicContact CE2-CD2 4Å; Y325-L329 PolarHBondContact O-N 2.73Å
326	H	97.9	Very high	96.7	Very high	18 Å²	18	25 Å²	25	8%	0.083	13%	0.13	C	C	.	.	H	α-helix	trans	-60.7	-42	-173.2	176.1	-96.5	0	0	0	113.3	V322 Q328 L329 A330 M365 E369	V322-H326 HydrophobicContact CG2-CB 4.25Å; V322-H326 WeakPolarHBondContact O-CA 3.34Å; V322-H326 VanDerWaalsContact O-CB 3.24Å; V322-H326 WeakPolarHBondContact O-CB 3.46Å; V322-H326 PolarHBondContact O-N 3.41Å; H326-Q328 VanDerWaalsContact C-N 3.3Å; H326-Q328 PolarHBondContact O-N 3.48Å; H326-L329 PolarHBondContact O-N 2.94Å; H326-L329 VanDerWaalsContact O-N 3.16Å; H326-A330 WeakPolarHBondContact O-CB 3.24Å; H326-A330 PolarHBondContact O-N 3.33Å; H326-M365 HydrophobicContact CB-CE 3.11Å; H326-M365 PolarHBondContact CE1-O 2.95Å; H326-M365 VanDerWaalsContact CE1-O 3.28Å; H326-M365 PolarHBondContact NE2-O 3.17Å; H326-E369 IonicContact NE2-OE2 2.87Å
327	A	97.4	Very high	96.7	Very high	60 Å²	60	25.2 Å²	25.2	50%	0.496	13%	0.132	S	C	.	.	H	α-helix	trans	-60.3	-42.6	-179.1	0	0	0	0	0	111.5	Y325 Y331	Y325-A327 PolarHBondContact O-N 3.33Å; A327-Y331 WeakPolarHBondContact O-CB 3.31Å; A327-Y331 PolarHBondContact O-N 3.31Å
328	Q	98.1	Very high	96.6	Very high	34 Å²	34	29.9 Å²	29.9	16%	0.159	15%	0.154	C	C	.	.	H	α-helix	trans	-68.3	-37.1	177.1	-60	79.4	-4.5	0	0	111.3	A284 L287 E288 Y325 H326 C332 L601	A284-Q328 HydrophobicContact CB-CG 4.49Å; L287-Q328 HydrophobicContact CB-CB 3.67Å; L287-Q328 HydrophobicContact CD1-CB 4.43Å; E288-Q328 HydrophobicContact CG-CG 3.74Å; Y325-Q328 PolarHBondContact O-N 2.81Å; Y325-Q328 PolarHBondContact O-OE1 3.1Å; H326-Q328 VanDerWaalsContact C-N 3.3Å; H326-Q328 PolarHBondContact O-N 3.48Å; Q328-C332 PolarHBondContact O-N 3.41Å; Q328-C332 VanDerWaalsContact O-N 3.1Å; Q328-C332 PolarHBondContact O-SG 2.7Å; Q328-L601 HydrophobicContact CG-CD2 4.05Å
329	L	98.6	Very high	96.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67	-49.6	176.5	-178.6	56.2	0	0	0	111.9	L287 L313 L316 H317 Y325 H326 Y331 C332 V333	L287-L329 HydrophobicContact CD1-CB 3.95Å; L287-L329 HydrophobicContact CD1-CD1 4.45Å; L287-L329 HydrophobicContact CD2-CD1 4.22Å; L313-L329 HydrophobicContact CB-CD1 4.24Å; L313-L329 HydrophobicContact CD2-CD1 4Å; L316-L329 HydrophobicContact CB-CD1 4.26Å; L316-L329 HydrophobicContact CB-CD2 3.68Å; L316-L329 HydrophobicContact CD1-CD1 4.02Å; H317-L329 VanDerWaalsContact CE1-CD2 3.43Å; H317-L329 WeakPolarHBondContact CE1-CD2 3.29Å; H317-L329 VanDerWaalsContact NE2-CD2 3.33Å; H317-L329 WeakPolarHBondContact NE2-CD2 3.34Å; Y325-L329 HydrophobicContact CD2-CB 4.33Å; Y325-L329 HydrophobicContact CD2-CD2 4.35Å; Y325-L329 HydrophobicContact CE2-CD2 4Å; Y325-L329 PolarHBondContact O-N 2.73Å; H326-L329 PolarHBondContact O-N 2.94Å; H326-L329 VanDerWaalsContact O-N 3.16Å; L329-Y331 VanDerWaalsContact C-N 3.3Å; L329-Y331 PolarHBondContact O-N 3.37Å; L329-C332 WeakPolarHBondContact O-CA 3.36Å; L329-C332 WeakPolarHBondContact O-CB 3.33Å; L329-C332 PolarHBondContact O-N 3.12Å; L329-V333 PolarHBondContact O-N 3.03Å
330	A	98.2	Very high	96.6	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-57.1	-45.1	176.6	0	0	0	0	0	110.7	H326 C332 V333 I334 E369	H326-A330 WeakPolarHBondContact O-CB 3.24Å; H326-A330 PolarHBondContact O-N 3.33Å; A330-C332 VanDerWaalsContact C-N 3.34Å; A330-C332 PolarHBondContact O-N 2.8Å; A330-V333 PolarHBondContact O-N 2.9Å; A330-V333 VanDerWaalsContact O-N 3.12Å; A330-I334 WeakPolarHBondContact O-CG1 3.32Å; A330-I334 PolarHBondContact O-N 2.8Å; A330-E369 HydrophobicContact CB-CB 4.35Å; A330-E369 HydrophobicContact CB-CG 3.87Å
331	Y	98	Very high	96.8	Very high	26 Å²	26	24 Å²	24	10%	0.102	13%	0.133	C	C	.	.	H	α-helix	trans	-55.9	-45.8	173	176.3	-104.4	0	0	0	112.3	A327 L329 V333 I334 Q335 S599 L601	A327-Y331 WeakPolarHBondContact O-CB 3.31Å; A327-Y331 PolarHBondContact O-N 3.31Å; L329-Y331 VanDerWaalsContact C-N 3.3Å; L329-Y331 PolarHBondContact O-N 3.37Å; Y331-V333 VanDerWaalsContact C-N 3.33Å; Y331-V333 PolarHBondContact O-N 2.64Å; Y331-I334 PolarHBondContact O-N 2.68Å; Y331-Q335 HydrophobicContact CD1-CG 4.25Å; Y331-Q335 HydrophobicContact CD2-CG 4.24Å; Y331-Q335 HydrophobicContact CE1-CG 3.89Å; Y331-Q335 HydrophobicContact CE2-CG 3.86Å; Y331-Q335 VanDerWaalsContact CE2-NE2 3.28Å; Y331-Q335 HydrophobicContact CG-CG 4.42Å; Y331-Q335 WeakPolarHBondContact O-CB 3.5Å; Y331-Q335 WeakPolarHBondContact O-CG 3.31Å; Y331-Q335 PolarHBondContact O-N 3.5Å; Y331-Q335 PolarHBondContact OH-NE2 3.42Å; Y331-S599 WeakPolarHBondContact CD2-OG 3.27Å; Y331-S599 WeakPolarHBondContact CE2-O 3.37Å; Y331-S599 VanDerWaalsContact CE2-OG 3.26Å; Y331-S599 WeakPolarHBondContact CE2-OG 3.47Å; Y331-L601 HydrophobicContact CD1-CD1 3.51Å; Y331-L601 HydrophobicContact CD2-CD1 3.99Å; Y331-L601 HydrophobicContact CE1-CD1 3.96Å; Y331-L601 HydrophobicContact CE2-CD1 4.41Å; Y331-L601 HydrophobicContact CG-CD1 3.52Å
332	C	98.5	Very high	97	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.8	-41	176.7	-69.4	0	0	0	0	112.5	L287 I294 L313 Q328 L329 A330 F336	L287-C332 PolarHBondContact O-SG 3.35Å; I294-C332 HydrophobicContact CD1-CB 3.82Å; L313-C332 HydrophobicContact CD1-CB 4.12Å; Q328-C332 PolarHBondContact O-N 3.41Å; Q328-C332 VanDerWaalsContact O-N 3.1Å; Q328-C332 PolarHBondContact O-SG 2.7Å; L329-C332 WeakPolarHBondContact O-CA 3.36Å; L329-C332 WeakPolarHBondContact O-CB 3.33Å; L329-C332 PolarHBondContact O-N 3.12Å; A330-C332 VanDerWaalsContact C-N 3.34Å; A330-C332 PolarHBondContact O-N 2.8Å; C332-F336 WeakPolarHBondContact O-CD2 3.25Å; C332-F336 PolarHBondContact O-N 3.17Å
333	V	98.5	Very high	97.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.9	-49	178.4	173.2	0	0	0	0	110.6	L309 L314 L329 A330 Y331 Q335 F336 L337 V347 I373	L309-V333 HydrophobicContact CD1-CG2 4.44Å; L314-V333 HydrophobicContact CD2-CG2 4.41Å; L329-V333 PolarHBondContact O-N 3.03Å; A330-V333 PolarHBondContact O-N 2.9Å; A330-V333 VanDerWaalsContact O-N 3.12Å; Y331-V333 VanDerWaalsContact C-N 3.33Å; Y331-V333 PolarHBondContact O-N 2.64Å; V333-Q335 VanDerWaalsContact C-N 3.32Å; V333-Q335 PolarHBondContact O-N 3.39Å; V333-F336 WeakPolarHBondContact O-CB 3.23Å; V333-F336 PolarHBondContact O-N 3.21Å; V333-F336 VanDerWaalsContact O-N 3.07Å; V333-L337 WeakPolarHBondContact O-CG 3.43Å; V333-L337 PolarHBondContact O-N 2.88Å; V333-L337 VanDerWaalsContact O-N 3.13Å; V333-V347 HydrophobicContact CG1-CG1 3.6Å; V333-I373 HydrophobicContact CG1-CD1 4.1Å
334	I	97.5	Very high	97.2	Very high	7 Å²	7	25.4 Å²	25.4	4%	0.036	14%	0.139	C	C	.	.	H	α-helix	trans	-59.2	-44.4	178.3	-67.1	161	0	0	0	110.6	A330 Y331 F336 L337 E338 E372 I373 V376	A330-I334 WeakPolarHBondContact O-CG1 3.32Å; A330-I334 PolarHBondContact O-N 2.8Å; Y331-I334 PolarHBondContact O-N 2.68Å; I334-F336 VanDerWaalsContact C-N 3.26Å; I334-F336 PolarHBondContact O-N 3.32Å; I334-L337 PolarHBondContact O-N 3.42Å; I334-E338 HydrophobicContact CG2-CG 4.38Å; I334-E338 PolarHBondContact O-N 2.9Å; I334-E372 HydrophobicContact CD1-CB 3.59Å; I334-E372 HydrophobicContact CD1-CG 4.45Å; I334-E372 VanDerWaalsContact CD1-OE2 3.32Å; I334-E372 WeakPolarHBondContact CD1-OE2 3.33Å; I334-E372 HydrophobicContact CG1-CB 4.5Å; I334-I373 HydrophobicContact CG1-CG1 4.39Å; I334-V376 HydrophobicContact CG2-CG2 4.35Å
335	Q	97.3	Very high	97.4	Very high	3 Å²	3	25.2 Å²	25.2	1%	0.014	14%	0.137	C	C	.	.	H	α-helix	trans	-59.1	-35.3	176.3	-74	-64.4	-17	0	0	112.8	I294 Y331 V333 K339	I294-Q335 HydrophobicContact CB-CB 4.43Å; I294-Q335 HydrophobicContact CG2-CB 3.81Å; Y331-Q335 HydrophobicContact CD1-CG 4.25Å; Y331-Q335 HydrophobicContact CD2-CG 4.24Å; Y331-Q335 HydrophobicContact CE1-CG 3.89Å; Y331-Q335 HydrophobicContact CE2-CG 3.86Å; Y331-Q335 VanDerWaalsContact CE2-NE2 3.28Å; Y331-Q335 HydrophobicContact CG-CG 4.42Å; Y331-Q335 WeakPolarHBondContact O-CB 3.5Å; Y331-Q335 WeakPolarHBondContact O-CG 3.31Å; Y331-Q335 PolarHBondContact O-N 3.5Å; Y331-Q335 PolarHBondContact OH-NE2 3.42Å; V333-Q335 VanDerWaalsContact C-N 3.32Å; V333-Q335 PolarHBondContact O-N 3.39Å; Q335-K339 VanDerWaalsContact O-CG 3.23Å; Q335-K339 WeakPolarHBondContact O-CG 3.47Å; Q335-K339 PolarHBondContact O-N 2.89Å
336	F	97.8	Very high	97.4	Very high	1 Å²	1	29.8 Å²	29.8	0%	0.004	16%	0.158	C	C	.	.	H	α-helix	trans	-66.3	-41.1	172.7	-98.4	-75.5	0	0	0	112.5	I294 F297 L301 H305 L309 L313 C332 V333 I334 K339 D340 L343	I294-F336 HydrophobicContact CD1-CD2 3.74Å; I294-F336 HydrophobicContact CD1-CE2 3.43Å; I294-F336 VanDerWaalsContact CD1-CE2 3.43Å; I294-F336 HydrophobicContact CD1-CZ 4.44Å; I294-F336 HydrophobicContact CG1-CD2 4.16Å; I294-F336 HydrophobicContact CG1-CE2 3.66Å; I294-F336 HydrophobicContact CG1-CZ 4.23Å; I294-F336 HydrophobicContact CG2-CD2 3.82Å; I294-F336 HydrophobicContact CG2-CE2 4.04Å; I294-F336 HydrophobicContact CG2-CG 4.09Å; I294-F336 HydrophobicContact CG2-CZ 4.49Å; F297-F336 HydrophobicContact CD2-CE1 4.46Å; F297-F336 HydrophobicContact CE2-CE1 4.12Å; F297-F336 AromaticContact CE2-CZ 3.81Å; F297-F336 HydrophobicContact CE2-CZ 3.81Å; L301-F336 HydrophobicContact CD1-CD1 4.04Å; L301-F336 HydrophobicContact CD1-CE1 4.4Å; H305-F336 HydrophobicContact CB-CE1 3.96Å; H305-F336 HydrophobicContact CB-CZ 4.19Å; H305-F336 WeakPolarHBondContact O-CE1 3.47Å; H305-F336 WeakPolarHBondContact O-CZ 3.41Å; L309-F336 HydrophobicContact CB-CD1 4.3Å; L309-F336 HydrophobicContact CB-CD2 4.26Å; L309-F336 HydrophobicContact CB-CE1 4.2Å; L309-F336 HydrophobicContact CB-CE2 4.16Å; L309-F336 HydrophobicContact CB-CG 4.32Å; L309-F336 HydrophobicContact CB-CZ 4.12Å; L309-F336 HydrophobicContact CD1-CB 4.25Å; L309-F336 HydrophobicContact CD1-CD2 3.92Å; L309-F336 HydrophobicContact CD1-CE2 4.49Å; L309-F336 HydrophobicContact CD1-CG 4.12Å; L309-F336 HydrophobicContact CD2-CB 3.95Å; L309-F336 HydrophobicContact CD2-CD1 4.09Å; L309-F336 HydrophobicContact CD2-CG 3.97Å; L309-F336 HydrophobicContact CG-CD2 4.46Å; L309-F336 HydrophobicContact CG-CG 4.36Å; L313-F336 HydrophobicContact CD1-CD2 3.85Å; L313-F336 HydrophobicContact CD1-CE2 3.59Å; C332-F336 WeakPolarHBondContact O-CD2 3.25Å; C332-F336 PolarHBondContact O-N 3.17Å; V333-F336 WeakPolarHBondContact O-CB 3.23Å; V333-F336 PolarHBondContact O-N 3.21Å; V333-F336 VanDerWaalsContact O-N 3.07Å; I334-F336 VanDerWaalsContact C-N 3.26Å; I334-F336 PolarHBondContact O-N 3.32Å; F336-K339 PolarHBondContact O-N 2.95Å; F336-D340 PolarHBondContact O-N 3.13Å; F336-L343 HydrophobicContact CD1-CD1 4.41Å
337	L	97.4	Very high	97.5	Very high	6 Å²	6	29 Å²	29	3%	0.031	15%	0.154	C	C	.	.	H	α-helix	trans	-69.5	-37.2	-179.9	-61.5	-174.7	0	0	0	112.1	V333 I334 K339 D340 P341 L343 T344 V347 I373	V333-L337 WeakPolarHBondContact O-CG 3.43Å; V333-L337 PolarHBondContact O-N 2.88Å; V333-L337 VanDerWaalsContact O-N 3.13Å; I334-L337 PolarHBondContact O-N 3.42Å; L337-K339 PolarHBondContact O-N 3.32Å; L337-D340 CarbonylContact O-C 3.59Å; L337-D340 VanDerWaalsContact O-C 3.3Å; L337-D340 PolarHBondContact O-N 3.43Å; L337-P341 WeakPolarHBondContact O-CA 3.48Å; L337-P341 WeakPolarHBondContact O-CD 3.02Å; L337-L343 HydrophobicContact CD2-CB 4Å; L337-T344 HydrophobicContact CD1-CG2 4.45Å; L337-V347 HydrophobicContact CD1-CG1 4.48Å; L337-V347 HydrophobicContact CD2-CB 4.34Å; L337-V347 HydrophobicContact CD2-CG2 3.94Å; L337-I373 HydrophobicContact CD1-CB 4.33Å; L337-I373 HydrophobicContact CD1-CG1 4.01Å; L337-I373 HydrophobicContact CD1-CG2 3.63Å
338	E	95.9	Very high	97.5	Very high	97 Å²	97	26.1 Å²	26.1	45%	0.453	13%	0.131	S	C	.	.	H	α-helix	trans	-62.2	-30.4	172.5	-72	-170.5	166.9	0	0	112.4	I334	I334-E338 HydrophobicContact CG2-CG 4.38Å; I334-E338 PolarHBondContact O-N 2.9Å
339	K	95.6	Very high	97.5	Very high	51 Å²	51	28 Å²	28	22%	0.222	14%	0.141	C	C	.	.	H	α-helix	trans	-79.5	-37.6	177.4	-67.4	-66.1	178	-169.7	0	113.1	N295 L299 L301 Q335 F336 L337	N295-K339 WeakPolarHBondContact O-CE 3.22Å; N295-K339 PolarHBondContact O-NZ 3.37Å; L299-K339 HydrophobicContact CD2-CB 4Å; L299-K339 HydrophobicContact CD2-CD 4.11Å; L299-K339 VanDerWaalsContact CD2-O 3.3Å; L299-K339 WeakPolarHBondContact CD2-O 3.48Å; L301-K339 HydrophobicContact CD1-CB 3.98Å; L301-K339 HydrophobicContact CD2-CB 4.05Å; L301-K339 HydrophobicContact CG-CB 4.17Å; Q335-K339 VanDerWaalsContact O-CG 3.23Å; Q335-K339 WeakPolarHBondContact O-CG 3.47Å; Q335-K339 PolarHBondContact O-N 2.89Å; F336-K339 PolarHBondContact O-N 2.95Å; L337-K339 PolarHBondContact O-N 3.32Å
340	D	96.4	Very high	97.5	Very high	25 Å²	25	28.9 Å²	28.9	13%	0.134	15%	0.148	C	C	.	.			trans	-148.7	92.3	-179.2	-173.6	-5.2	0	0	0	110.6	L301 K306 F336 L337 T342 L343	L301-D340 HydrophobicContact CD1-CB 3.57Å; L301-D340 HydrophobicContact CG-CB 4.26Å; K306-D340 VanDerWaalsContact CE-OD2 3.28Å; K306-D340 WeakPolarHBondContact CE-OD2 3.42Å; K306-D340 IonicContact NZ-OD2 3.08Å; K306-D340 PolarHBondContact NZ-OD2 3.03Å; F336-D340 PolarHBondContact O-N 3.13Å; L337-D340 CarbonylContact O-C 3.59Å; L337-D340 VanDerWaalsContact O-C 3.3Å; L337-D340 PolarHBondContact O-N 3.43Å; D340-T342 VanDerWaalsContact CG-OG1 3.31Å; D340-T342 PolarHBondContact O-N 3.09Å; D340-T342 WeakPolarHBondContact OD1-CB 3.33Å; D340-T342 WeakPolarHBondContact OD1-CG2 3.23Å; D340-T342 PolarHBondContact OD1-N 3.28Å; D340-T342 PolarHBondContact OD1-OG1 3.16Å; D340-T342 PolarHBondContact OD2-OG1 2.96Å; D340-L343 HydrophobicContact CB-CD1 4.01Å; D340-L343 HydrophobicContact CB-CG 4.22Å; D340-L343 WeakPolarHBondContact O-CB 3.47Å; D340-L343 PolarHBondContact O-N 2.81Å
341	P	96.2	Very high	97.5	Very high	40 Å²	40	29 Å²	29	26%	0.26	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-59.3	-21.9	-178.1	-27.4	35.4	0	0	0	114.1	L337 L343 T344 D378	L337-P341 WeakPolarHBondContact O-CA 3.48Å; L337-P341 WeakPolarHBondContact O-CD 3.02Å; P341-L343 PolarHBondContact O-N 3.46Å; P341-T344 VanDerWaalsContact O-CB 3.3Å; P341-T344 WeakPolarHBondContact O-CB 3.46Å; P341-T344 PolarHBondContact O-N 3.19Å; P341-T344 PolarHBondContact O-OG1 3.41Å; P341-D378 WeakPolarHBondContact CB-OD2 3.48Å; P341-D378 WeakPolarHBondContact CG-OD2 3.33Å
342	T	96.5	Very high	97.5	Very high	78 Å²	78	29.1 Å²	29.1	48%	0.479	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-63.2	-16.7	180	72.3	0	0	0	0	113.3	D340 T344	D340-T342 VanDerWaalsContact CG-OG1 3.31Å; D340-T342 PolarHBondContact O-N 3.09Å; D340-T342 WeakPolarHBondContact OD1-CB 3.33Å; D340-T342 WeakPolarHBondContact OD1-CG2 3.23Å; D340-T342 PolarHBondContact OD1-N 3.28Å; D340-T342 PolarHBondContact OD1-OG1 3.16Å; D340-T342 PolarHBondContact OD2-OG1 2.96Å; T342-T344 VanDerWaalsContact C-N 3.31Å
343	L	97.4	Very high	97.4	Very high	6 Å²	6	37.1 Å²	37.1	3%	0.031	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-77.4	-16.4	176.9	-60.4	176.1	0	0	0	112.9	L301 K306 L309 F336 L337 D340 P341 Q345 Q346 V347	L301-L343 HydrophobicContact CD1-CD1 4.06Å; K306-L343 HydrophobicContact CD-CD2 4.11Å; K306-L343 HydrophobicContact CG-CD1 4.44Å; K306-L343 HydrophobicContact CG-CD2 4.27Å; L309-L343 HydrophobicContact CD2-CB 4.4Å; L309-L343 HydrophobicContact CD2-CD1 3.92Å; F336-L343 HydrophobicContact CD1-CD1 4.41Å; L337-L343 HydrophobicContact CD2-CB 4Å; D340-L343 HydrophobicContact CB-CD1 4.01Å; D340-L343 HydrophobicContact CB-CG 4.22Å; D340-L343 WeakPolarHBondContact O-CB 3.47Å; D340-L343 PolarHBondContact O-N 2.81Å; P341-L343 PolarHBondContact O-N 3.46Å; L343-Q345 VanDerWaalsContact C-N 3.34Å; L343-Q345 PolarHBondContact O-N 3.39Å; L343-Q346 PolarHBondContact O-N 2.95Å; L343-V347 PolarHBondContact O-N 3.38Å; L343-V347 VanDerWaalsContact O-N 3.08Å
344	T	97.9	Very high	97.4	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.018	20%	0.196	C	C	.	.	H	α-helix	trans	-55.9	-45.4	-171.7	-55.2	0	0	0	0	112.8	L337 P341 T342 Q346 V347 V348 I373 V377	L337-T344 HydrophobicContact CD1-CG2 4.45Å; P341-T344 VanDerWaalsContact O-CB 3.3Å; P341-T344 WeakPolarHBondContact O-CB 3.46Å; P341-T344 PolarHBondContact O-N 3.19Å; P341-T344 PolarHBondContact O-OG1 3.41Å; T342-T344 VanDerWaalsContact C-N 3.31Å; T344-Q346 VanDerWaalsContact C-N 3.29Å; T344-Q346 PolarHBondContact O-N 3.44Å; T344-V347 PolarHBondContact O-N 2.9Å; T344-V348 HydrophobicContact CG2-CG2 4.1Å; T344-V348 WeakPolarHBondContact O-CG2 3.37Å; T344-V348 PolarHBondContact O-N 3.48Å; T344-I373 HydrophobicContact CG2-CG2 4.28Å; T344-V377 HydrophobicContact CG2-CG2 3.73Å
345	Q	97.6	Very high	97.4	Very high	69 Å²	69	40 Å²	40	32%	0.322	20%	0.197	S	C	.	.	H	α-helix	trans	-57.2	-44.2	179.6	-174	-175.2	11	0	0	111.7	L343 L349 K384 I385	L343-Q345 VanDerWaalsContact C-N 3.34Å; L343-Q345 PolarHBondContact O-N 3.39Å; Q345-L349 HydrophobicContact CG-CD1 3.96Å; Q345-L349 WeakPolarHBondContact O-CB 3.3Å; Q345-L349 WeakPolarHBondContact O-CG 3.4Å; Q345-L349 PolarHBondContact O-N 3.03Å; Q345-L349 VanDerWaalsContact O-N 3.09Å; Q345-K384 HydrophobicContact CB-CB 4.49Å; Q345-K384 HydrophobicContact CB-CD 4.49Å; Q345-K384 HydrophobicContact CG-CB 4.05Å; Q345-I385 HydrophobicContact CB-CG2 4.22Å; Q345-I385 HydrophobicContact CG-CG2 3.97Å
346	Q	97.5	Very high	97.4	Very high	101 Å²	101	40.5 Å²	40.5	47%	0.472	20%	0.201	S	C	.	.	H	α-helix	trans	-71.4	-38.1	-177.7	-63.4	-174.6	45.9	0	0	112.1	M310 L343 T344 S350	M310-Q346 HydrophobicContact CE-CB 3.77Å; M310-Q346 HydrophobicContact SD-CB 3.93Å; L343-Q346 PolarHBondContact O-N 2.95Å; T344-Q346 VanDerWaalsContact C-N 3.29Å; T344-Q346 PolarHBondContact O-N 3.44Å; Q346-S350 WeakPolarHBondContact O-CB 3.26Å; Q346-S350 PolarHBondContact O-N 3.43Å; Q346-S350 PolarHBondContact O-OG 3.46Å
347	V	98.4	Very high	97.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-54.6	176.2	168.2	0	0	0	0	110.5	L309 L314 V333 L337 L343 T344 L349 S350 L351 I373	L309-V347 HydrophobicContact CD1-CG2 4.46Å; L309-V347 HydrophobicContact CD2-CG2 3.86Å; L309-V347 HydrophobicContact CG-CG2 4.36Å; L314-V347 HydrophobicContact CD1-CG2 4.28Å; L314-V347 HydrophobicContact CD2-CB 4.49Å; L314-V347 HydrophobicContact CD2-CG1 4.01Å; L314-V347 HydrophobicContact CD2-CG2 4.34Å; V333-V347 HydrophobicContact CG1-CG1 3.6Å; L337-V347 HydrophobicContact CD1-CG1 4.48Å; L337-V347 HydrophobicContact CD2-CB 4.34Å; L337-V347 HydrophobicContact CD2-CG2 3.94Å; L343-V347 PolarHBondContact O-N 3.38Å; L343-V347 VanDerWaalsContact O-N 3.08Å; T344-V347 PolarHBondContact O-N 2.9Å; V347-L349 PolarHBondContact O-N 3.18Å; V347-S350 WeakPolarHBondContact O-CB 3.46Å; V347-S350 PolarHBondContact O-N 3.26Å; V347-L351 HydrophobicContact CG1-CD1 4.3Å; V347-L351 PolarHBondContact O-N 2.95Å; V347-I373 HydrophobicContact CG1-CD1 4.13Å
348	V	98.3	Very high	97.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.8	-44.5	-178.2	172.8	0	0	0	0	111.3	T344 S350 L351 L352 L370 I373 I385	T344-V348 HydrophobicContact CG2-CG2 4.1Å; T344-V348 WeakPolarHBondContact O-CG2 3.37Å; T344-V348 PolarHBondContact O-N 3.48Å; V348-S350 PolarHBondContact O-N 3.5Å; V348-L351 PolarHBondContact O-N 3.13Å; V348-L352 HydrophobicContact CG1-CD1 4Å; V348-L352 HydrophobicContact CG1-CG 4.3Å; V348-L352 WeakPolarHBondContact O-CB 3.38Å; V348-L352 VanDerWaalsContact O-CG 3.26Å; V348-L352 WeakPolarHBondContact O-CG 3.48Å; V348-L352 PolarHBondContact O-N 3.39Å; V348-L370 HydrophobicContact CG1-CD1 4.1Å; V348-L370 HydrophobicContact CG2-CD1 4.18Å; V348-I373 HydrophobicContact CG2-CG2 4Å; V348-I385 HydrophobicContact CB-CD1 4.21Å; V348-I385 HydrophobicContact CB-CG2 4.18Å; V348-I385 HydrophobicContact CG1-CB 4.21Å; V348-I385 HydrophobicContact CG1-CD1 4.02Å; V348-I385 HydrophobicContact CG1-CG2 4.23Å; V348-I385 HydrophobicContact CG2-CD1 3.88Å
349	L	98.2	Very high	97	Very high	73 Å²	73	55.4 Å²	55.4	38%	0.382	28%	0.277	S	S	.	.	H	α-helix	trans	-62.6	-31.3	176.6	-70.2	177.4	0	0	0	112.7	Q345 V347 K353 P388	Q345-L349 HydrophobicContact CG-CD1 3.96Å; Q345-L349 WeakPolarHBondContact O-CB 3.3Å; Q345-L349 WeakPolarHBondContact O-CG 3.4Å; Q345-L349 PolarHBondContact O-N 3.03Å; Q345-L349 VanDerWaalsContact O-N 3.09Å; V347-L349 PolarHBondContact O-N 3.18Å; L349-K353 WeakPolarHBondContact O-CB 3.43Å; L349-K353 PolarHBondContact O-N 3.23Å; L349-P388 HydrophobicContact CD2-CB 4.05Å; L349-P388 HydrophobicContact CD2-CG 3.77Å
350	S	98.1	Very high	97	Very high	20 Å²	20	54.6 Å²	54.6	14%	0.14	28%	0.278	C	S	.	.	H	α-helix	trans	-73.4	-42.5	175.5	-60.4	0	0	0	0	112.3	Q346 V347 V348 L352 K353 F354	Q346-S350 WeakPolarHBondContact O-CB 3.26Å; Q346-S350 PolarHBondContact O-N 3.43Å; Q346-S350 PolarHBondContact O-OG 3.46Å; V347-S350 WeakPolarHBondContact O-CB 3.46Å; V347-S350 PolarHBondContact O-N 3.26Å; V348-S350 PolarHBondContact O-N 3.5Å; S350-L352 VanDerWaalsContact C-N 3.33Å; S350-L352 PolarHBondContact O-N 3.3Å; S350-K353 WeakPolarHBondContact O-CB 3.46Å; S350-K353 PolarHBondContact O-N 2.89Å; S350-K353 VanDerWaalsContact O-N 3.12Å; S350-F354 VanDerWaalsContact O-CD2 3.29Å; S350-F354 WeakPolarHBondContact O-CD2 2.97Å; S350-F354 WeakPolarHBondContact O-CG 3.47Å; S350-F354 PolarHBondContact O-N 2.89Å
351	L	98.3	Very high	97	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-59.7	-45.3	173.2	-69.4	176.9	0	0	0	110.8	V347 V348 K353 F354 W355 F366 E369 I373	V347-L351 HydrophobicContact CG1-CD1 4.3Å; V347-L351 PolarHBondContact O-N 2.95Å; V348-L351 PolarHBondContact O-N 3.13Å; L351-K353 VanDerWaalsContact C-N 3.27Å; L351-K353 PolarHBondContact O-N 3.2Å; L351-F354 CarbonylContact O-C 3.59Å; L351-F354 PolarHBondContact O-N 2.94Å; L351-F354 VanDerWaalsContact O-N 3.09Å; L351-W355 PolarHBondContact O-N 3.42Å; L351-F366 HydrophobicContact CD2-CE1 4.33Å; L351-F366 WeakPolarHBondContact O-CE1 3.25Å; L351-E369 HydrophobicContact CD1-CG 4.5Å; L351-I373 HydrophobicContact CD1-CD1 3.54Å
352	L	98.1	Very high	97	Very high	29 Å²	29	55.7 Å²	55.7	15%	0.152	29%	0.285	C	S	.	.	H	α-helix	trans	-62	-33.3	174.7	-67.8	176.9	0	0	0	112.7	V348 S350 W355 P388 Q392	V348-L352 HydrophobicContact CG1-CD1 4Å; V348-L352 HydrophobicContact CG1-CG 4.3Å; V348-L352 WeakPolarHBondContact O-CB 3.38Å; V348-L352 VanDerWaalsContact O-CG 3.26Å; V348-L352 WeakPolarHBondContact O-CG 3.48Å; V348-L352 PolarHBondContact O-N 3.39Å; S350-L352 VanDerWaalsContact C-N 3.33Å; S350-L352 PolarHBondContact O-N 3.3Å; L352-W355 HydrophobicContact CD2-CE3 4.06Å; L352-W355 HydrophobicContact CD2-CZ3 4.23Å; L352-W355 WeakPolarHBondContact O-CB 2.97Å; L352-P388 HydrophobicContact CD1-CB 3.86Å; L352-Q392 HydrophobicContact CD2-CB 3.62Å; L352-Q392 HydrophobicContact CD2-CG 3.75Å
353	K	97.8	Very high	97.1	Very high	168 Å²	168	53.2 Å²	53.2	73%	0.73	27%	0.268	S	S	*	.	H	α-helix	trans	-69.1	-36.1	174	179.4	-177.2	177.2	-178.8	0	112.2	L349 S350 L351 W355	L349-K353 WeakPolarHBondContact O-CB 3.43Å; L349-K353 PolarHBondContact O-N 3.23Å; S350-K353 WeakPolarHBondContact O-CB 3.46Å; S350-K353 PolarHBondContact O-N 2.89Å; S350-K353 VanDerWaalsContact O-N 3.12Å; L351-K353 VanDerWaalsContact C-N 3.27Å; L351-K353 PolarHBondContact O-N 3.2Å; K353-W355 VanDerWaalsContact C-N 3.3Å
354	F	97.1	Very high	97.1	Very high	49 Å²	49	54.2 Å²	54.2	22%	0.215	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	8.2	179.6	-57.9	-35.4	0	0	0	113.7	L314 K318 S350 L351 F366	L314-F354 HydrophobicContact CB-CE2 4.23Å; K318-F354 HydrophobicContact CD-CD1 3.97Å; K318-F354 HydrophobicContact CD-CE1 3.87Å; K318-F354 HydrophobicContact CD-CG 4.42Å; K318-F354 HydrophobicContact CD-CZ 4.23Å; K318-F354 HydrophobicContact CG-CB 4.32Å; K318-F354 HydrophobicContact CG-CD1 3.9Å; K318-F354 HydrophobicContact CG-CD2 4.3Å; K318-F354 HydrophobicContact CG-CE1 4.28Å; K318-F354 HydrophobicContact CG-CG 3.92Å; S350-F354 VanDerWaalsContact O-CD2 3.29Å; S350-F354 WeakPolarHBondContact O-CD2 2.97Å; S350-F354 WeakPolarHBondContact O-CG 3.47Å; S350-F354 PolarHBondContact O-N 2.89Å; L351-F354 CarbonylContact O-C 3.59Å; L351-F354 PolarHBondContact O-N 2.94Å; L351-F354 VanDerWaalsContact O-N 3.09Å; F354-F366 HydrophobicContact CB-CE1 4.26Å; F354-F366 HydrophobicContact CB-CZ 4.39Å
355	W	98.1	Very high	97	Very high	18 Å²	18	55.3 Å²	55.3	7%	0.068	28%	0.279	C	S	.	.			trans	-52	125.3	-174.3	-160.4	-89.5	0	0	0	112.6	L351 L352 K353 K357 E363 F366 L367 L370 Q392 C396	L351-W355 PolarHBondContact O-N 3.42Å; L352-W355 HydrophobicContact CD2-CE3 4.06Å; L352-W355 HydrophobicContact CD2-CZ3 4.23Å; L352-W355 WeakPolarHBondContact O-CB 2.97Å; K353-W355 VanDerWaalsContact C-N 3.3Å; W355-K357 PolarHBondContact O-N 3.31Å; W355-E363 HydrophobicContact CZ2-CG 3.92Å; W355-E363 PolarHBondContact NE1-OE1 3.22Å; W355-F366 HydrophobicContact CD2-CD1 4.45Å; W355-F366 HydrophobicContact CE3-CB 4.25Å; W355-F366 AromaticContact CE3-CD1 3.82Å; W355-F366 HydrophobicContact CE3-CD1 3.82Å; W355-F366 HydrophobicContact CE3-CG 4.49Å; W355-F366 HydrophobicContact CH2-CB 3.96Å; W355-F366 HydrophobicContact CZ2-CB 4.47Å; W355-F366 HydrophobicContact CZ3-CB 3.83Å; W355-F366 HydrophobicContact CZ3-CD1 4.11Å; W355-F366 HydrophobicContact CZ3-CG 4.49Å; W355-L367 HydrophobicContact CH2-CD2 3.77Å; W355-L367 HydrophobicContact CH2-CG 3.96Å; W355-L367 HydrophobicContact CZ2-CD2 4Å; W355-L367 HydrophobicContact CZ2-CG 4.02Å; W355-L370 HydrophobicContact CH2-CD2 4.35Å; W355-L370 HydrophobicContact CZ3-CD2 4.15Å; W355-Q392 VanDerWaalsContact CD1-NE2 3.3Å; W355-Q392 HydrophobicContact CD2-CG 3.75Å; W355-Q392 HydrophobicContact CE3-CG 4.04Å; W355-Q392 HydrophobicContact CG-CG 4.22Å; W355-Q392 HydrophobicContact CH2-CG 4.36Å; W355-Q392 HydrophobicContact CZ2-CG 4.1Å; W355-Q392 HydrophobicContact CZ3-CG 4.32Å; W355-C396 WeakPolarHBondContact CZ2-SG 2.85Å
356	P	96.8	Very high	97.1	Very high	14 Å²	14	52.1 Å²	52.1	9%	0.091	26%	0.264	C	S	.	.			trans	-61.3	132.6	178.3	-22.4	33.6	0	0	0	111.6	K362 E363 F366	P356-K362 HydrophobicContact CB-CB 3.97Å; P356-K362 HydrophobicContact CG-CB 3.61Å; P356-E363 HydrophobicContact CB-CB 4.46Å; P356-F366 HydrophobicContact CG-CD2 3.9Å; P356-F366 HydrophobicContact CG-CE2 3.82Å; P356-F366 HydrophobicContact CG-CG 4.26Å; P356-F366 HydrophobicContact CG-CZ 4.12Å
357	K	95.5	Very high	97.1	Very high	195 Å²	195	47.3 Å²	47.3	85%	0.848	24%	0.242	S	C	*	.	S	Bend	trans	-111.4	-14	178.9	-63	-179.7	-176.3	174.7	0	114	W355	W355-K357 PolarHBondContact O-N 3.31Å
358	T	94.2	Very high	97	Very high	143 Å²	143	50 Å²	50	88%	0.877	26%	0.256	S	S	*	.	S	Bend	trans	-134.2	6.7	-172.2	58.5	0	0	0	0	112.7
359	H	93.6	Very high	97	Very high	80 Å²	80	50 Å²	50	37%	0.37	26%	0.256	S	S	.	.			trans	-137.8	86.9	-173.2	-165	-66.9	0	0	0	110.4	K362 E363	H359-K362 HydrophobicContact CB-CB 4.21Å; H359-K362 HydrophobicContact CB-CD 4.31Å; H359-K362 HydrophobicContact CB-CG 4.48Å; H359-K362 WeakPolarHBondContact ND1-CB 2.91Å; H359-K362 VanDerWaalsContact ND1-CG 3.3Å; H359-K362 WeakPolarHBondContact ND1-CG 3.24Å; H359-K362 PolarHBondContact ND1-N 3.12Å; H359-K362 WeakPolarHBondContact O-CB 3.33Å; H359-K362 PolarHBondContact O-N 3.32Å; H359-E363 PolarHBondContact O-N 3.16Å; H359-E363 VanDerWaalsContact O-N 3.12Å
360	S	95.9	Very high	97	Very high	33 Å²	33	46.6 Å²	46.6	23%	0.231	24%	0.239	C	C	.	.	H	α-helix	trans	-58.4	-40	-173.6	-57.5	0	0	0	0	114.4	K362 E363 V364 H401	S360-K362 PolarHBondContact O-N 3.44Å; S360-E363 WeakPolarHBondContact O-CB 3.41Å; S360-E363 PolarHBondContact O-N 3Å; S360-E363 VanDerWaalsContact O-N 3.07Å; S360-V364 PolarHBondContact O-N 3.21Å; S360-H401 PolarHBondContact OG-CD2 3.31Å
361	P	95.4	Very high	97	Very high	73 Å²	73	47 Å²	47	47%	0.474	24%	0.238	S	C	.	.	H	α-helix	trans	-58.7	-36.6	174.2	-25.7	33.6	0	0	0	113.2	V364 M365	P361-V364 PolarHBondContact O-N 3.31Å; P361-M365 VanDerWaalsContact O-CG 3.23Å; P361-M365 WeakPolarHBondContact O-CG 3.49Å; P361-M365 PolarHBondContact O-N 3.27Å
362	K	96.5	Very high	96.9	Very high	16 Å²	16	51.2 Å²	51.2	7%	0.07	26%	0.258	C	S	.	.	H	α-helix	trans	-71	-35.4	177.6	-79.8	-178.3	64.1	150.6	0	110.8	H317 K318 V319 V322 P356 H359 S360 V364 M365 F366	H317-K362 PolarHBondContact O-NZ 2.98Å; K318-K362 PolarHBondContact O-NZ 3.35Å; K318-K362 VanDerWaalsContact O-NZ 3.1Å; V319-K362 PolarHBondContact O-NZ 3.17Å; V322-K362 HydrophobicContact CG1-CD 3.59Å; V322-K362 HydrophobicContact CG1-CG 3.62Å; P356-K362 HydrophobicContact CB-CB 3.97Å; P356-K362 HydrophobicContact CG-CB 3.61Å; H359-K362 HydrophobicContact CB-CB 4.21Å; H359-K362 HydrophobicContact CB-CD 4.31Å; H359-K362 HydrophobicContact CB-CG 4.48Å; H359-K362 WeakPolarHBondContact ND1-CB 2.91Å; H359-K362 VanDerWaalsContact ND1-CG 3.3Å; H359-K362 WeakPolarHBondContact ND1-CG 3.24Å; H359-K362 PolarHBondContact ND1-N 3.12Å; H359-K362 WeakPolarHBondContact O-CB 3.33Å; H359-K362 PolarHBondContact O-N 3.32Å; S360-K362 PolarHBondContact O-N 3.44Å; K362-V364 VanDerWaalsContact C-N 3.33Å; K362-M365 HydrophobicContact CG-SD 4.36Å; K362-M365 WeakPolarHBondContact O-CB 3.23Å; K362-M365 PolarHBondContact O-N 3.48Å; K362-F366 WeakPolarHBondContact O-CD2 3.11Å; K362-F366 PolarHBondContact O-N 3.32Å
363	E	97.8	Very high	96.9	Very high	25 Å²	25	49.8 Å²	49.8	12%	0.117	25%	0.25	C	S	.	.	H	α-helix	trans	-62.8	-41	174.3	-174.7	166.7	-149.9	0	0	111.6	W355 P356 H359 S360 M365 F366 L367 V404	W355-E363 HydrophobicContact CZ2-CG 3.92Å; W355-E363 PolarHBondContact NE1-OE1 3.22Å; P356-E363 HydrophobicContact CB-CB 4.46Å; H359-E363 PolarHBondContact O-N 3.16Å; H359-E363 VanDerWaalsContact O-N 3.12Å; S360-E363 WeakPolarHBondContact O-CB 3.41Å; S360-E363 PolarHBondContact O-N 3Å; S360-E363 VanDerWaalsContact O-N 3.07Å; E363-M365 VanDerWaalsContact C-N 3.34Å; E363-M365 PolarHBondContact O-N 3Å; E363-F366 PolarHBondContact O-N 3.48Å; E363-L367 WeakPolarHBondContact O-CG 3.42Å; E363-L367 PolarHBondContact O-N 2.93Å; E363-V404 HydrophobicContact CB-CG2 4.18Å; E363-V404 VanDerWaalsContact CD-CG1 3.47Å; E363-V404 HydrophobicContact CG-CG1 3.83Å; E363-V404 HydrophobicContact CG-CG2 4.11Å
364	V	97.7	Very high	96.8	Very high	28 Å²	28	41.9 Å²	41.9	17%	0.17	22%	0.216	C	C	.	.	H	α-helix	trans	-61.6	-41.6	173.1	175	0	0	0	0	111.3	S360 P361 K362 L367 N368 Q403 V404 R407	S360-V364 PolarHBondContact O-N 3.21Å; P361-V364 PolarHBondContact O-N 3.31Å; K362-V364 VanDerWaalsContact C-N 3.33Å; V364-L367 PolarHBondContact O-N 2.93Å; V364-N368 PolarHBondContact O-N 3.48Å; V364-N368 PolarHBondContact O-ND2 3.36Å; V364-Q403 HydrophobicContact CG2-CB 4.1Å; V364-V404 HydrophobicContact CG2-CG2 4.04Å; V364-R407 HydrophobicContact CG1-CB 4.36Å; V364-R407 HydrophobicContact CG1-CG 4.11Å
365	M	97.1	Very high	96.7	Very high	25 Å²	25	41.1 Å²	41.1	12%	0.123	21%	0.214	C	C	.	.	H	α-helix	trans	-63.8	-44.4	176.5	-64.9	162.5	65.7	0	0	112.5	V322 S323 H326 P361 K362 E363 L367 N368 E369	V322-M365 HydrophobicContact CG1-CE 3.97Å; V322-M365 HydrophobicContact CG2-CE 4.36Å; S323-M365 VanDerWaalsContact CA-CE 3.41Å; H326-M365 HydrophobicContact CB-CE 3.11Å; H326-M365 PolarHBondContact CE1-O 2.95Å; H326-M365 VanDerWaalsContact CE1-O 3.28Å; H326-M365 PolarHBondContact NE2-O 3.17Å; P361-M365 VanDerWaalsContact O-CG 3.23Å; P361-M365 WeakPolarHBondContact O-CG 3.49Å; P361-M365 PolarHBondContact O-N 3.27Å; K362-M365 HydrophobicContact CG-SD 4.36Å; K362-M365 WeakPolarHBondContact O-CB 3.23Å; K362-M365 PolarHBondContact O-N 3.48Å; E363-M365 VanDerWaalsContact C-N 3.34Å; E363-M365 PolarHBondContact O-N 3Å; M365-L367 VanDerWaalsContact C-N 3.29Å; M365-L367 PolarHBondContact O-N 2.91Å; M365-N368 WeakPolarHBondContact O-CA 3.33Å; M365-N368 WeakPolarHBondContact O-CB 3.41Å; M365-N368 PolarHBondContact O-N 2.72Å; M365-N368 VanDerWaalsContact O-N 3.09Å; M365-E369 PolarHBondContact O-N 3.34Å
366	F	98.3	Very high	96.6	Very high	3 Å²	3	42.6 Å²	42.6	1%	0.013	23%	0.225	C	C	.	.	H	α-helix	trans	-61.2	-37.9	174.7	-86.7	-124.9	0	0	0	111.8	H317 L351 F354 W355 P356 K362 E363 L370	H317-F366 HydrophobicContact CB-CE2 4.07Å; H317-F366 HydrophobicContact CB-CZ 3.66Å; L351-F366 HydrophobicContact CD2-CE1 4.33Å; L351-F366 WeakPolarHBondContact O-CE1 3.25Å; F354-F366 HydrophobicContact CB-CE1 4.26Å; F354-F366 HydrophobicContact CB-CZ 4.39Å; W355-F366 HydrophobicContact CD2-CD1 4.45Å; W355-F366 HydrophobicContact CE3-CB 4.25Å; W355-F366 AromaticContact CE3-CD1 3.82Å; W355-F366 HydrophobicContact CE3-CD1 3.82Å; W355-F366 HydrophobicContact CE3-CG 4.49Å; W355-F366 HydrophobicContact CH2-CB 3.96Å; W355-F366 HydrophobicContact CZ2-CB 4.47Å; W355-F366 HydrophobicContact CZ3-CB 3.83Å; W355-F366 HydrophobicContact CZ3-CD1 4.11Å; W355-F366 HydrophobicContact CZ3-CG 4.49Å; P356-F366 HydrophobicContact CG-CD2 3.9Å; P356-F366 HydrophobicContact CG-CE2 3.82Å; P356-F366 HydrophobicContact CG-CG 4.26Å; P356-F366 HydrophobicContact CG-CZ 4.12Å; K362-F366 WeakPolarHBondContact O-CD2 3.11Å; K362-F366 PolarHBondContact O-N 3.32Å; E363-F366 PolarHBondContact O-N 3.48Å; F366-L370 WeakPolarHBondContact O-CB 3.45Å; F366-L370 PolarHBondContact O-N 3.48Å
367	L	98.1	Very high	96.6	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.9	-37.5	173.8	-72.2	167.2	0	0	0	112.1	W355 E363 V364 M365 E371 L393 C396 V404 R407 A408 F411	W355-L367 HydrophobicContact CH2-CD2 3.77Å; W355-L367 HydrophobicContact CH2-CG 3.96Å; W355-L367 HydrophobicContact CZ2-CD2 4Å; W355-L367 HydrophobicContact CZ2-CG 4.02Å; E363-L367 WeakPolarHBondContact O-CG 3.42Å; E363-L367 PolarHBondContact O-N 2.93Å; V364-L367 PolarHBondContact O-N 2.93Å; M365-L367 VanDerWaalsContact C-N 3.29Å; M365-L367 PolarHBondContact O-N 2.91Å; L367-E371 PolarHBondContact O-N 3.08Å; L367-E371 VanDerWaalsContact O-N 3.08Å; L367-L393 HydrophobicContact CD2-CD2 3.62Å; L367-C396 HydrophobicContact CD1-CB 4.36Å; L367-C396 HydrophobicContact CD2-CB 4.39Å; L367-V404 HydrophobicContact CD1-CG1 4.19Å; L367-R407 HydrophobicContact CB-CG 3.69Å; L367-R407 HydrophobicContact CD1-CB 4.09Å; L367-R407 HydrophobicContact CD1-CG 4.05Å; L367-A408 HydrophobicContact CD1-CB 4.11Å; L367-A408 HydrophobicContact CD2-CB 4.24Å; L367-F411 HydrophobicContact CB-CE2 4.36Å; L367-F411 HydrophobicContact CD2-CE2 4.17Å; L367-F411 HydrophobicContact CD2-CZ 4.31Å; L367-F411 WeakPolarHBondContact O-CZ 3.35Å
368	N	96.9	Very high	96.6	Very high	56 Å²	56	36.1 Å²	36.1	30%	0.299	20%	0.199	S	C	.	.	H	α-helix	trans	-60.5	-55.7	172.6	-78.7	-53.7	0	0	0	111.8	V364 M365 L370 E371 E372 R407	V364-N368 PolarHBondContact O-N 3.48Å; V364-N368 PolarHBondContact O-ND2 3.36Å; M365-N368 WeakPolarHBondContact O-CA 3.33Å; M365-N368 WeakPolarHBondContact O-CB 3.41Å; M365-N368 PolarHBondContact O-N 2.72Å; M365-N368 VanDerWaalsContact O-N 3.09Å; N368-L370 VanDerWaalsContact C-N 3.26Å; N368-L370 PolarHBondContact O-N 3.01Å; N368-E371 WeakPolarHBondContact O-CB 3.37Å; N368-E371 PolarHBondContact O-N 3.06Å; N368-E371 VanDerWaalsContact O-N 3.13Å; N368-E372 PolarHBondContact O-N 3.09Å; N368-E372 VanDerWaalsContact O-N 3.09Å; N368-R407 PolarHBondContact OD1-NE 3.45Å; N368-R407 PolarHBondContact OD1-NH2 3.39Å
369	E	98	Very high	96.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.5	-40.4	-179.1	-177.1	-176.5	177.8	0	0	111.4	H317 H326 A330 L351 M365 E371 E372 I373	H317-E369 IonicContact CD2-OE2 2.78Å; H317-E369 PolarHBondContact CD2-OE2 3.26Å; H317-E369 VanDerWaalsContact CD2-OE2 3.24Å; H317-E369 IonicContact CE1-OE1 3.79Å; H317-E369 IonicContact NE2-OE1 3.24Å; H317-E369 PolarHBondContact NE2-OE1 2.99Å; H317-E369 IonicContact NE2-OE2 3.01Å; H317-E369 PolarHBondContact NE2-OE2 3.04Å; H317-E369 VanDerWaalsContact NE2-OE2 3.08Å; H326-E369 IonicContact NE2-OE2 2.87Å; A330-E369 HydrophobicContact CB-CB 4.35Å; A330-E369 HydrophobicContact CB-CG 3.87Å; L351-E369 HydrophobicContact CD1-CG 4.5Å; M365-E369 PolarHBondContact O-N 3.34Å; E369-E371 VanDerWaalsContact C-N 3.34Å; E369-E371 PolarHBondContact O-N 3.13Å; E369-E372 PolarHBondContact O-N 3.28Å; E369-I373 HydrophobicContact CG-CD1 3.94Å; E369-I373 HydrophobicContact CG-CG1 4.48Å; E369-I373 VanDerWaalsContact O-CG1 3.31Å; E369-I373 WeakPolarHBondContact O-CG1 3.5Å; E369-I373 PolarHBondContact O-N 2.92Å
370	L	98	Very high	96.8	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-66.5	-35.5	179	-168.6	60.8	0	0	0	112.4	V348 W355 F366 N368 L374 L389 F411	V348-L370 HydrophobicContact CG1-CD1 4.1Å; V348-L370 HydrophobicContact CG2-CD1 4.18Å; W355-L370 HydrophobicContact CH2-CD2 4.35Å; W355-L370 HydrophobicContact CZ3-CD2 4.15Å; F366-L370 WeakPolarHBondContact O-CB 3.45Å; F366-L370 PolarHBondContact O-N 3.48Å; N368-L370 VanDerWaalsContact C-N 3.26Å; N368-L370 PolarHBondContact O-N 3.01Å; L370-L374 WeakPolarHBondContact O-CB 3.15Å; L370-L374 WeakPolarHBondContact O-CG 3.48Å; L370-L374 PolarHBondContact O-N 2.64Å; L370-L389 HydrophobicContact CD1-CD1 4.04Å; L370-L389 HydrophobicContact CD2-CD1 3.29Å; L370-L389 HydrophobicContact CG-CD1 3.84Å; L370-F411 HydrophobicContact CB-CZ 4.37Å
371	E	97.1	Very high	96.8	Very high	29 Å²	29	31.6 Å²	31.6	14%	0.136	18%	0.179	C	C	.	.	H	α-helix	trans	-63.5	-45.8	171.6	-170.5	-175.2	158.9	0	0	111	L367 N368 E369 I373 L374 D375 R407 F411 N414 I417	L367-E371 PolarHBondContact O-N 3.08Å; L367-E371 VanDerWaalsContact O-N 3.08Å; N368-E371 WeakPolarHBondContact O-CB 3.37Å; N368-E371 PolarHBondContact O-N 3.06Å; N368-E371 VanDerWaalsContact O-N 3.13Å; E369-E371 VanDerWaalsContact C-N 3.34Å; E369-E371 PolarHBondContact O-N 3.13Å; E371-I373 VanDerWaalsContact C-N 3.34Å; E371-I373 PolarHBondContact O-N 2.84Å; E371-L374 CarbonylContact O-C 3.46Å; E371-L374 PolarHBondContact O-N 2.74Å; E371-L374 VanDerWaalsContact O-N 3.13Å; E371-D375 PolarHBondContact O-N 2.81Å; E371-R407 IonicContact OE2-CZ 3.88Å; E371-R407 IonicContact OE2-NH1 3.79Å; E371-R407 PolarHBondContact OE2-NH1 3.39Å; E371-R407 IonicContact OE2-NH2 3.98Å; E371-R407 PolarHBondContact OE2-NH2 2.87Å; E371-F411 HydrophobicContact CB-CE1 4.44Å; E371-F411 HydrophobicContact CB-CE2 4.12Å; E371-F411 HydrophobicContact CB-CZ 3.94Å; E371-N414 PolarHBondContact OE1-ND2 3.32Å; E371-I417 HydrophobicContact CG-CD1 3.73Å
372	E	96.8	Very high	96.9	Very high	89 Å²	89	28.1 Å²	28.1	42%	0.416	16%	0.157	S	C	.	.	H	α-helix	trans	-62.5	-39.4	178.7	-66.5	-178.5	-128.6	0	0	112.3	I334 N368 E369 L374 D375	I334-E372 HydrophobicContact CD1-CB 3.59Å; I334-E372 HydrophobicContact CD1-CG 4.45Å; I334-E372 VanDerWaalsContact CD1-OE2 3.32Å; I334-E372 WeakPolarHBondContact CD1-OE2 3.33Å; I334-E372 HydrophobicContact CG1-CB 4.5Å; N368-E372 PolarHBondContact O-N 3.09Å; N368-E372 VanDerWaalsContact O-N 3.09Å; E369-E372 PolarHBondContact O-N 3.28Å; E372-L374 VanDerWaalsContact C-N 3.34Å; E372-L374 PolarHBondContact O-N 3.15Å; E372-D375 WeakPolarHBondContact O-CB 3.42Å; E372-D375 PolarHBondContact O-N 3.46Å
373	I	97.8	Very high	96.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-41.8	173.3	-71.4	168	0	0	0	111.1	V333 I334 L337 T344 V347 V348 L351 E369 E371 D375 V376 V377	V333-I373 HydrophobicContact CG1-CD1 4.1Å; I334-I373 HydrophobicContact CG1-CG1 4.39Å; L337-I373 HydrophobicContact CD1-CB 4.33Å; L337-I373 HydrophobicContact CD1-CG1 4.01Å; L337-I373 HydrophobicContact CD1-CG2 3.63Å; T344-I373 HydrophobicContact CG2-CG2 4.28Å; V347-I373 HydrophobicContact CG1-CD1 4.13Å; V348-I373 HydrophobicContact CG2-CG2 4Å; L351-I373 HydrophobicContact CD1-CD1 3.54Å; E369-I373 HydrophobicContact CG-CD1 3.94Å; E369-I373 HydrophobicContact CG-CG1 4.48Å; E369-I373 VanDerWaalsContact O-CG1 3.31Å; E369-I373 WeakPolarHBondContact O-CG1 3.5Å; E369-I373 PolarHBondContact O-N 2.92Å; E371-I373 VanDerWaalsContact C-N 3.34Å; E371-I373 PolarHBondContact O-N 2.84Å; I373-D375 VanDerWaalsContact C-N 3.29Å; I373-D375 PolarHBondContact O-N 3.23Å; I373-V376 WeakPolarHBondContact O-CG2 3.21Å; I373-V376 PolarHBondContact O-N 3.39Å; I373-V377 PolarHBondContact O-N 3.49Å
374	L	97.2	Very high	96.9	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-71.8	-21.9	178.3	-68.8	175.4	0	0	0	112.9	L370 E371 E372 V376 V377 F382 I385 L389 F411 Y416 I417	L370-L374 WeakPolarHBondContact O-CB 3.15Å; L370-L374 WeakPolarHBondContact O-CG 3.48Å; L370-L374 PolarHBondContact O-N 2.64Å; E371-L374 CarbonylContact O-C 3.46Å; E371-L374 PolarHBondContact O-N 2.74Å; E371-L374 VanDerWaalsContact O-N 3.13Å; E372-L374 VanDerWaalsContact C-N 3.34Å; E372-L374 PolarHBondContact O-N 3.15Å; L374-V376 PolarHBondContact O-N 3.36Å; L374-V377 HydrophobicContact CD2-CG1 4.03Å; L374-V377 WeakPolarHBondContact O-CG1 3.39Å; L374-F382 HydrophobicContact CD2-CD2 3.81Å; L374-F382 HydrophobicContact CD2-CE2 3.94Å; L374-I385 HydrophobicContact CD2-CD1 4.16Å; L374-L389 HydrophobicContact CD1-CD2 3.89Å; L374-L389 HydrophobicContact CD2-CD2 3.92Å; L374-L389 HydrophobicContact CG-CD2 4.49Å; L374-F411 HydrophobicContact CD1-CD1 4.11Å; L374-F411 HydrophobicContact CD1-CE1 3.71Å; L374-Y416 VanDerWaalsContact O-CD1 3.31Å; L374-Y416 WeakPolarHBondContact O-CD1 3.33Å; L374-Y416 VanDerWaalsContact O-CE1 3.25Å; L374-Y416 WeakPolarHBondContact O-CE1 3.05Å; L374-I417 HydrophobicContact CB-CD1 3.86Å; L374-I417 HydrophobicContact CB-CG1 4.03Å; L374-I417 HydrophobicContact CD1-CD1 4.14Å
375	D	95.1	Very high	96.9	Very high	34 Å²	34	37.9 Å²	37.9	18%	0.182	19%	0.191	C	C	.	.	H	α-helix	trans	-68.4	-21.1	174.5	-135.3	32.4	0	0	0	112	E371 E372 I373 N414 K591	E371-D375 PolarHBondContact O-N 2.81Å; E372-D375 WeakPolarHBondContact O-CB 3.42Å; E372-D375 PolarHBondContact O-N 3.46Å; I373-D375 VanDerWaalsContact C-N 3.29Å; I373-D375 PolarHBondContact O-N 3.23Å; D375-N414 PolarHBondContact OD1-ND2 3.04Å; D375-K591 IonicContact OD1-NZ 3.06Å; D375-K591 IonicContact OD2-NZ 3.02Å; D375-K591 PolarHBondContact OD2-NZ 2.93Å
376	V	94.9	Very high	96.9	Very high	49 Å²	49	36.7 Å²	36.7	30%	0.297	19%	0.185	S	C	.	.	S	Bend	trans	-117.1	5.3	-178.6	-58.2	0	0	0	0	114.2	I334 I373 L374	I334-V376 HydrophobicContact CG2-CG2 4.35Å; I373-V376 WeakPolarHBondContact O-CG2 3.21Å; I373-V376 PolarHBondContact O-N 3.39Å; L374-V376 PolarHBondContact O-N 3.36Å
377	V	96.6	Very high	96.9	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.012	21%	0.211	C	C	.	.			trans	-76.2	137.3	-176.4	71.3	0	0	0	0	112.2	T344 I373 L374 E381 F382 Y416 L420	T344-V377 HydrophobicContact CG2-CG2 3.73Å; I373-V377 PolarHBondContact O-N 3.49Å; L374-V377 HydrophobicContact CD2-CG1 4.03Å; L374-V377 WeakPolarHBondContact O-CG1 3.39Å; V377-E381 HydrophobicContact CG2-CB 4.05Å; V377-F382 HydrophobicContact CG1-CB 4.14Å; V377-F382 HydrophobicContact CG1-CD2 4.25Å; V377-F382 HydrophobicContact CG2-CB 4.16Å; V377-Y416 HydrophobicContact CG1-CE1 4.37Å; V377-Y416 PolarHBondContact O-OH 2.95Å; V377-L420 HydrophobicContact CG1-CD1 3.77Å
378	D	95.2	Very high	96.9	Very high	71 Å²	71	46 Å²	46	38%	0.38	23%	0.227	S	C	.	.			trans	-71.3	138.9	168.7	-74.4	-24.5	0	0	0	111.1	P341 S380 E381 F382	P341-D378 WeakPolarHBondContact CB-OD2 3.48Å; P341-D378 WeakPolarHBondContact CG-OD2 3.33Å; D378-S380 PolarHBondContact O-N 3.14Å; D378-S380 VanDerWaalsContact O-N 3.08Å; D378-E381 HydrophobicContact CB-CG 4.26Å; D378-E381 PolarHBondContact O-N 3.32Å; D378-F382 PolarHBondContact O-N 2.98Å
379	P	95.9	Very high	96.9	Very high	70 Å²	70	43.3 Å²	43.3	46%	0.455	21%	0.213	S	C	.	.	H	α-helix	trans	-54	-33.9	178.8	-28.5	34.8	0	0	0	114.3	E381 F382 R383 L420	P379-E381 VanDerWaalsContact C-N 3.34Å; P379-E381 PolarHBondContact O-N 3.08Å; P379-F382 PolarHBondContact O-N 3.04Å; P379-R383 PolarHBondContact O-N 3.44Å; P379-R383 VanDerWaalsContact O-N 3.17Å; P379-L420 HydrophobicContact CB-CD2 4.22Å; P379-L420 HydrophobicContact CG-CD2 4.12Å
380	S	96.2	Very high	96.9	Very high	77 Å²	77	43.4 Å²	43.4	54%	0.538	21%	0.213	S	C	.	.	H	α-helix	trans	-66.5	-33.8	176.5	52.6	0	0	0	0	113.4	D378	D378-S380 PolarHBondContact O-N 3.14Å; D378-S380 VanDerWaalsContact O-N 3.08Å
381	E	97	Very high	96.9	Very high	14 Å²	14	46.3 Å²	46.3	7%	0.065	23%	0.231	C	C	.	.	H	α-helix	trans	-81	-38.4	177	-62.7	-56.1	133.6	0	0	110.9	V377 D378 P379 R383 K384	V377-E381 HydrophobicContact CG2-CB 4.05Å; D378-E381 HydrophobicContact CB-CG 4.26Å; D378-E381 PolarHBondContact O-N 3.32Å; P379-E381 VanDerWaalsContact C-N 3.34Å; P379-E381 PolarHBondContact O-N 3.08Å; E381-R383 VanDerWaalsContact C-N 3.28Å; E381-R383 PolarHBondContact O-N 3.46Å; E381-K384 WeakPolarHBondContact O-CB 3.43Å; E381-K384 PolarHBondContact O-N 3.22Å; E381-K384 IonicContact OE1-NZ 3.46Å; E381-K384 PolarHBondContact OE1-NZ 2.66Å; E381-K384 WeakPolarHBondContact OE2-CE 3.3Å; E381-K384 IonicContact OE2-NZ 2.7Å; E381-K384 PolarHBondContact OE2-NZ 2.6Å
382	F	97.3	Very high	97	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-53.3	-46.1	174.3	-179.8	-107.3	0	0	0	111.6	L374 V377 D378 P379 K384 I385 I386 L389 F390 L420 H424 I428	L374-F382 HydrophobicContact CD2-CD2 3.81Å; L374-F382 HydrophobicContact CD2-CE2 3.94Å; V377-F382 HydrophobicContact CG1-CB 4.14Å; V377-F382 HydrophobicContact CG1-CD2 4.25Å; V377-F382 HydrophobicContact CG2-CB 4.16Å; D378-F382 PolarHBondContact O-N 2.98Å; P379-F382 PolarHBondContact O-N 3.04Å; F382-K384 PolarHBondContact O-N 3.13Å; F382-I385 HydrophobicContact CD2-CD1 4.47Å; F382-I385 HydrophobicContact CD2-CG1 4.49Å; F382-I385 WeakPolarHBondContact O-CG1 3.38Å; F382-I385 PolarHBondContact O-N 3.11Å; F382-I386 HydrophobicContact CD1-CD1 3.96Å; F382-I386 HydrophobicContact CD1-CG1 3.91Å; F382-I386 HydrophobicContact CE1-CD1 3.81Å; F382-I386 HydrophobicContact CE1-CG1 3.76Å; F382-I386 HydrophobicContact CZ-CG1 4.25Å; F382-I386 VanDerWaalsContact O-CG1 3.27Å; F382-I386 WeakPolarHBondContact O-CG1 3.29Å; F382-I386 PolarHBondContact O-N 3.37Å; F382-L389 HydrophobicContact CE2-CD2 4.08Å; F382-F390 HydrophobicContact CE2-CE2 4.15Å; F382-F390 AromaticContact CZ-CE2 3.69Å; F382-F390 HydrophobicContact CZ-CE2 3.69Å; F382-F390 HydrophobicContact CZ-CZ 4.21Å; F382-L420 HydrophobicContact CD1-CB 4.04Å; F382-L420 HydrophobicContact CD1-CD1 4.47Å; F382-L420 HydrophobicContact CD1-CD2 4.22Å; F382-L420 HydrophobicContact CD1-CG 4.49Å; F382-L420 HydrophobicContact CD2-CD1 4.04Å; F382-L420 HydrophobicContact CE1-CB 3.72Å; F382-L420 HydrophobicContact CE2-CB 4.41Å; F382-L420 HydrophobicContact CE2-CD1 4.27Å; F382-L420 HydrophobicContact CG-CB 4.5Å; F382-L420 HydrophobicContact CG-CD1 4.12Å; F382-L420 HydrophobicContact CG-CD2 4.38Å; F382-L420 HydrophobicContact CZ-CB 3.89Å; F382-H424 AromaticContact CD1-CD2 3.8Å; F382-H424 AromaticContact CE1-CD2 3.87Å; F382-I428 HydrophobicContact CE1-CD1 4.37Å; F382-I428 HydrophobicContact CZ-CD1 4.37Å
383	R	97	Very high	97	Very high	177 Å²	177	42 Å²	42	67%	0.668	21%	0.211	S	C	*	.	H	α-helix	trans	-52.1	-32.4	177.5	-171	178.3	178.7	-170.7	1.3	113.7	P379 E381 I385	P379-R383 PolarHBondContact O-N 3.44Å; P379-R383 VanDerWaalsContact O-N 3.17Å; E381-R383 VanDerWaalsContact C-N 3.28Å; E381-R383 PolarHBondContact O-N 3.46Å; R383-I385 VanDerWaalsContact C-N 3.31Å; R383-I385 PolarHBondContact O-N 3.17Å
384	K	97.2	Very high	97	Very high	96 Å²	96	42.5 Å²	42.5	42%	0.417	22%	0.215	S	C	.	.	H	α-helix	trans	-76.6	-18.4	-177.8	-54.8	178.6	-164.9	163.4	0	113.2	Q345 E381 F382	Q345-K384 HydrophobicContact CB-CB 4.49Å; Q345-K384 HydrophobicContact CB-CD 4.49Å; Q345-K384 HydrophobicContact CG-CB 4.05Å; E381-K384 WeakPolarHBondContact O-CB 3.43Å; E381-K384 PolarHBondContact O-N 3.22Å; E381-K384 IonicContact OE1-NZ 3.46Å; E381-K384 PolarHBondContact OE1-NZ 2.66Å; E381-K384 WeakPolarHBondContact OE2-CE 3.3Å; E381-K384 IonicContact OE2-NZ 2.7Å; E381-K384 PolarHBondContact OE2-NZ 2.6Å; F382-K384 PolarHBondContact O-N 3.13Å
385	I	97.5	Very high	97	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-113.4	-7.4	-173.7	59.6	169.1	0	0	0	113.9	Q345 V348 L374 F382 R383 R387 P388 L389	Q345-I385 HydrophobicContact CB-CG2 4.22Å; Q345-I385 HydrophobicContact CG-CG2 3.97Å; V348-I385 HydrophobicContact CB-CD1 4.21Å; V348-I385 HydrophobicContact CB-CG2 4.18Å; V348-I385 HydrophobicContact CG1-CB 4.21Å; V348-I385 HydrophobicContact CG1-CD1 4.02Å; V348-I385 HydrophobicContact CG1-CG2 4.23Å; V348-I385 HydrophobicContact CG2-CD1 3.88Å; L374-I385 HydrophobicContact CD2-CD1 4.16Å; F382-I385 HydrophobicContact CD2-CD1 4.47Å; F382-I385 HydrophobicContact CD2-CG1 4.49Å; F382-I385 WeakPolarHBondContact O-CG1 3.38Å; F382-I385 PolarHBondContact O-N 3.11Å; R383-I385 VanDerWaalsContact C-N 3.31Å; R383-I385 PolarHBondContact O-N 3.17Å; I385-R387 PolarHBondContact O-N 3.33Å; I385-P388 WeakPolarHBondContact O-CD 3.2Å; I385-P388 VanDerWaalsContact O-CG 3.26Å; I385-P388 WeakPolarHBondContact O-CG 3.49Å; I385-L389 HydrophobicContact CD1-CD2 4.36Å; I385-L389 WeakPolarHBondContact O-CB 3.49Å; I385-L389 PolarHBondContact O-N 3.48Å
386	I	97.2	Very high	97.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-46.6	-61.5	-176.1	-63.2	-176.2	0	0	0	112.3	F382 L389 F390 H424 E427 I428	F382-I386 HydrophobicContact CD1-CD1 3.96Å; F382-I386 HydrophobicContact CD1-CG1 3.91Å; F382-I386 HydrophobicContact CE1-CD1 3.81Å; F382-I386 HydrophobicContact CE1-CG1 3.76Å; F382-I386 HydrophobicContact CZ-CG1 4.25Å; F382-I386 VanDerWaalsContact O-CG1 3.27Å; F382-I386 WeakPolarHBondContact O-CG1 3.29Å; F382-I386 PolarHBondContact O-N 3.37Å; I386-L389 PolarHBondContact O-N 2.68Å; I386-F390 HydrophobicContact CG2-CD2 3.99Å; I386-F390 HydrophobicContact CG2-CE2 4.49Å; I386-F390 WeakPolarHBondContact O-CD2 3.23Å; I386-F390 PolarHBondContact O-N 3.17Å; I386-H424 HydrophobicContact CD1-CB 3.55Å; I386-H424 VanDerWaalsContact CD1-CG 3.44Å; I386-E427 HydrophobicContact CG2-CB 4.43Å; I386-E427 HydrophobicContact CG2-CG 3.95Å; I386-I428 HydrophobicContact CG2-CD1 4.1Å; I386-I428 HydrophobicContact CG2-CG1 3.48Å; I386-I428 VanDerWaalsContact CG2-CG1 3.48Å
387	R	97.7	Very high	97.2	Very high	148 Å²	148	44.3 Å²	44.3	56%	0.558	22%	0.217	S	C	*	.	H	α-helix	trans	-56.8	-55.8	-175.9	-68.4	-172.2	-175.1	-90.1	-15	113.4	I385 L389 T391 E427 I431	I385-R387 PolarHBondContact O-N 3.33Å; R387-L389 PolarHBondContact O-N 3.27Å; R387-T391 VanDerWaalsContact O-CB 3.26Å; R387-T391 WeakPolarHBondContact O-CB 3.1Å; R387-T391 PolarHBondContact O-N 3.44Å; R387-T391 PolarHBondContact O-OG1 2.98Å; R387-E427 HydrophobicContact CG-CG 4.14Å; R387-E427 VanDerWaalsContact CG-OE1 3.3Å; R387-E427 WeakPolarHBondContact CG-OE1 3.42Å; R387-E427 IonicContact CZ-OE1 3.21Å; R387-E427 IonicContact NE-OE1 2.68Å; R387-E427 PolarHBondContact NE-OE1 3.04Å; R387-E427 IonicContact NH2-OE1 3.68Å; R387-E427 PolarHBondContact NH2-OE1 3.48Å; R387-I431 HydrophobicContact CG-CD1 4.3Å
388	P	97.9	Very high	97.1	Very high	50 Å²	50	46.4 Å²	46.4	33%	0.325	23%	0.232	S	C	.	.	H	α-helix	trans	-64.8	-38.1	-178.5	23.6	-33.1	0	0	0	112.6	L349 L352 I385 Q392	L349-P388 HydrophobicContact CD2-CB 4.05Å; L349-P388 HydrophobicContact CD2-CG 3.77Å; L352-P388 HydrophobicContact CD1-CB 3.86Å; I385-P388 WeakPolarHBondContact O-CD 3.2Å; I385-P388 VanDerWaalsContact O-CG 3.26Å; I385-P388 WeakPolarHBondContact O-CG 3.49Å; P388-Q392 PolarHBondContact O-N 3.34Å
389	L	98.1	Very high	97.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61	-57.9	177.3	173.1	62	0	0	0	111.8	L370 L374 F382 I385 I386 R387 T391 Q392 L393	L370-L389 HydrophobicContact CD1-CD1 4.04Å; L370-L389 HydrophobicContact CD2-CD1 3.29Å; L370-L389 HydrophobicContact CG-CD1 3.84Å; L374-L389 HydrophobicContact CD1-CD2 3.89Å; L374-L389 HydrophobicContact CD2-CD2 3.92Å; L374-L389 HydrophobicContact CG-CD2 4.49Å; F382-L389 HydrophobicContact CE2-CD2 4.08Å; I385-L389 HydrophobicContact CD1-CD2 4.36Å; I385-L389 WeakPolarHBondContact O-CB 3.49Å; I385-L389 PolarHBondContact O-N 3.48Å; I386-L389 PolarHBondContact O-N 2.68Å; R387-L389 PolarHBondContact O-N 3.27Å; L389-T391 VanDerWaalsContact C-N 3.28Å; L389-T391 PolarHBondContact O-N 3.05Å; L389-Q392 WeakPolarHBondContact O-CB 3.43Å; L389-Q392 PolarHBondContact O-N 2.96Å; L389-L393 HydrophobicContact CD1-CD1 4.16Å; L389-L393 HydrophobicContact CD1-CG 4.31Å; L389-L393 HydrophobicContact CG-CD1 4.15Å; L389-L393 PolarHBondContact O-N 3.3Å
390	F	98.2	Very high	97	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-70.8	-25.2	-176.2	-78	-83.3	0	0	0	112.7	F382 I386 Q392 L393 A394 M421 I428 I431 M432	F382-F390 HydrophobicContact CE2-CE2 4.15Å; F382-F390 AromaticContact CZ-CE2 3.69Å; F382-F390 HydrophobicContact CZ-CE2 3.69Å; F382-F390 HydrophobicContact CZ-CZ 4.21Å; I386-F390 HydrophobicContact CG2-CD2 3.99Å; I386-F390 HydrophobicContact CG2-CE2 4.49Å; I386-F390 WeakPolarHBondContact O-CD2 3.23Å; I386-F390 PolarHBondContact O-N 3.17Å; F390-Q392 VanDerWaalsContact C-N 3.27Å; F390-Q392 PolarHBondContact O-N 3.18Å; F390-L393 HydrophobicContact CD1-CD1 4.01Å; F390-L393 HydrophobicContact CE1-CD1 4.02Å; F390-L393 PolarHBondContact O-N 2.97Å; F390-A394 VanDerWaalsContact O-CB 3.22Å; F390-A394 WeakPolarHBondContact O-CB 3.48Å; F390-A394 PolarHBondContact O-N 3.08Å; F390-M421 HydrophobicContact CE1-CG 4.08Å; F390-M421 HydrophobicContact CE1-SD 3.65Å; F390-M421 HydrophobicContact CZ-CG 3.63Å; F390-M421 HydrophobicContact CZ-SD 3.81Å; F390-I428 HydrophobicContact CD1-CG2 3.61Å; F390-I428 HydrophobicContact CD2-CD1 4.18Å; F390-I428 HydrophobicContact CD2-CG1 3.88Å; F390-I428 HydrophobicContact CD2-CG2 4.33Å; F390-I428 HydrophobicContact CE1-CG2 3.66Å; F390-I428 HydrophobicContact CE2-CD1 3.67Å; F390-I428 HydrophobicContact CE2-CG1 3.9Å; F390-I428 HydrophobicContact CE2-CG2 4.38Å; F390-I428 HydrophobicContact CG-CG1 4.28Å; F390-I428 HydrophobicContact CG-CG2 3.96Å; F390-I428 HydrophobicContact CZ-CD1 3.9Å; F390-I428 HydrophobicContact CZ-CG1 4.3Å; F390-I428 HydrophobicContact CZ-CG2 4.07Å; F390-I431 HydrophobicContact CB-CG2 4.26Å; F390-M432 HydrophobicContact CB-CG 4.44Å; F390-M432 HydrophobicContact CB-SD 4.2Å; F390-M432 HydrophobicContact CD1-CG 3.74Å; F390-M432 HydrophobicContact CD1-SD 3.8Å; F390-M432 VanDerWaalsContact O-SD 3.38Å
391	T	98.1	Very high	97	Very high	63 Å²	63	44.5 Å²	44.5	39%	0.387	22%	0.217	S	C	.	.	H	α-helix	trans	-63.8	-35.7	169.4	-59.6	0	0	0	0	111.5	R387 L389	R387-T391 VanDerWaalsContact O-CB 3.26Å; R387-T391 WeakPolarHBondContact O-CB 3.1Å; R387-T391 PolarHBondContact O-N 3.44Å; R387-T391 PolarHBondContact O-OG1 2.98Å; L389-T391 VanDerWaalsContact C-N 3.28Å; L389-T391 PolarHBondContact O-N 3.05Å
392	Q	98.1	Very high	96.9	Very high	26 Å²	26	47.6 Å²	47.6	12%	0.121	23%	0.23	C	C	.	.	H	α-helix	trans	-77.4	-43.7	176	-172.9	54.1	43.4	0	0	111.7	L352 W355 P388 L389 F390 A394 K395 C396	L352-Q392 HydrophobicContact CD2-CB 3.62Å; L352-Q392 HydrophobicContact CD2-CG 3.75Å; W355-Q392 VanDerWaalsContact CD1-NE2 3.3Å; W355-Q392 HydrophobicContact CD2-CG 3.75Å; W355-Q392 HydrophobicContact CE3-CG 4.04Å; W355-Q392 HydrophobicContact CG-CG 4.22Å; W355-Q392 HydrophobicContact CH2-CG 4.36Å; W355-Q392 HydrophobicContact CZ2-CG 4.1Å; W355-Q392 HydrophobicContact CZ3-CG 4.32Å; P388-Q392 PolarHBondContact O-N 3.34Å; L389-Q392 WeakPolarHBondContact O-CB 3.43Å; L389-Q392 PolarHBondContact O-N 2.96Å; F390-Q392 VanDerWaalsContact C-N 3.27Å; F390-Q392 PolarHBondContact O-N 3.18Å; Q392-A394 VanDerWaalsContact C-N 3.26Å; Q392-A394 PolarHBondContact O-N 2.9Å; Q392-K395 WeakPolarHBondContact O-CB 3.42Å; Q392-K395 PolarHBondContact O-N 3.38Å; Q392-C396 PolarHBondContact O-N 2.99Å; Q392-C396 VanDerWaalsContact O-N 3.1Å; Q392-C396 PolarHBondContact O-SG 2.95Å
393	L	97.8	Very high	96.9	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-58.1	-38.9	174.6	-69.9	175.6	0	0	0	111.9	L367 L389 F390 K395 C396 V397 F411 M432	L367-L393 HydrophobicContact CD2-CD2 3.62Å; L389-L393 HydrophobicContact CD1-CD1 4.16Å; L389-L393 HydrophobicContact CD1-CG 4.31Å; L389-L393 HydrophobicContact CG-CD1 4.15Å; L389-L393 PolarHBondContact O-N 3.3Å; F390-L393 HydrophobicContact CD1-CD1 4.01Å; F390-L393 HydrophobicContact CE1-CD1 4.02Å; F390-L393 PolarHBondContact O-N 2.97Å; L393-K395 VanDerWaalsContact C-N 3.25Å; L393-K395 PolarHBondContact O-N 3.22Å; L393-C396 PolarHBondContact O-N 3.24Å; L393-C396 VanDerWaalsContact O-N 3.07Å; L393-V397 WeakPolarHBondContact O-CG2 3.45Å; L393-V397 PolarHBondContact O-N 3.36Å; L393-F411 HydrophobicContact CD1-CD1 3.92Å; L393-F411 HydrophobicContact CD1-CE1 4.1Å; L393-F411 HydrophobicContact CD2-CD1 4.28Å; L393-F411 HydrophobicContact CD2-CE1 4.01Å; L393-F411 HydrophobicContact CD2-CE2 4.38Å; L393-F411 HydrophobicContact CD2-CZ 4.08Å; L393-M432 HydrophobicContact CB-SD 4.28Å
394	A	97.5	Very high	96.9	Very high	11 Å²	11	43.5 Å²	43.5	9%	0.091	22%	0.219	C	C	.	.	H	α-helix	trans	-56.3	-38.1	174.4	0	0	0	0	0	112.8	F390 Q392 S398 M432 A435	F390-A394 VanDerWaalsContact O-CB 3.22Å; F390-A394 WeakPolarHBondContact O-CB 3.48Å; F390-A394 PolarHBondContact O-N 3.08Å; Q392-A394 VanDerWaalsContact C-N 3.26Å; Q392-A394 PolarHBondContact O-N 2.9Å; A394-S398 WeakPolarHBondContact O-CB 3.49Å; A394-S398 PolarHBondContact O-N 3.47Å; A394-S398 PolarHBondContact O-OG 3.09Å; A394-M432 HydrophobicContact CB-CE 4.23Å; A394-M432 HydrophobicContact CB-SD 3.82Å; A394-A435 HydrophobicContact CB-CB 3.71Å; A394-A435 WeakPolarHBondContact O-CB 3.31Å
395	K	96.9	Very high	96.8	Very high	123 Å²	123	38.9 Å²	38.9	54%	0.535	20%	0.199	S	C	.	.	H	α-helix	trans	-70.8	-41.3	174.9	-62.6	172.9	-169.7	165.8	0	111.8	Q392 L393 S398 S399	Q392-K395 WeakPolarHBondContact O-CB 3.42Å; Q392-K395 PolarHBondContact O-N 3.38Å; L393-K395 VanDerWaalsContact C-N 3.25Å; L393-K395 PolarHBondContact O-N 3.22Å; K395-S398 CarbonylContact O-C 3.46Å; K395-S398 PolarHBondContact O-N 3.24Å; K395-S399 PolarHBondContact O-N 3.01Å; K395-S399 VanDerWaalsContact O-N 3.12Å
396	C	97.2	Very high	96.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.2	-43.5	-179.9	-55.8	0	0	0	0	111.1	W355 L367 Q392 L393 S398 S399 V404 A405 A408	W355-C396 WeakPolarHBondContact CZ2-SG 2.85Å; L367-C396 HydrophobicContact CD1-CB 4.36Å; L367-C396 HydrophobicContact CD2-CB 4.39Å; Q392-C396 PolarHBondContact O-N 2.99Å; Q392-C396 VanDerWaalsContact O-N 3.1Å; Q392-C396 PolarHBondContact O-SG 2.95Å; L393-C396 PolarHBondContact O-N 3.24Å; L393-C396 VanDerWaalsContact O-N 3.07Å; C396-S398 VanDerWaalsContact C-N 3.31Å; C396-S398 PolarHBondContact O-N 2.88Å; C396-S399 WeakPolarHBondContact O-CB 3.4Å; C396-S399 PolarHBondContact O-N 2.99Å; C396-S399 VanDerWaalsContact O-N 3.09Å; C396-V404 HydrophobicContact CB-CG1 4.01Å; C396-A405 WeakPolarHBondContact O-CA 3.47Å; C396-A408 HydrophobicContact CB-CB 3.68Å
397	V	96.3	Very high	96.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-39.7	174.5	169.9	0	0	0	0	111.4	L393 S399 A408 L409 W412 M432 L436 T439	L393-V397 WeakPolarHBondContact O-CG2 3.45Å; L393-V397 PolarHBondContact O-N 3.36Å; V397-S399 PolarHBondContact O-N 3.32Å; V397-A408 HydrophobicContact CG2-CB 3.89Å; V397-L409 HydrophobicContact CG1-CD2 3.97Å; V397-L409 HydrophobicContact CG1-CG 4.37Å; V397-L409 HydrophobicContact CG2-CD2 4.11Å; V397-L409 HydrophobicContact CG2-CG 4.23Å; V397-W412 HydrophobicContact CG2-CZ3 4.28Å; V397-M432 HydrophobicContact CB-CE 4.46Å; V397-M432 HydrophobicContact CG2-CE 4.03Å; V397-L436 HydrophobicContact CG1-CD2 3.73Å; V397-L436 HydrophobicContact CG1-CG 4.33Å; V397-T439 VanDerWaalsContact O-CG2 3.32Å; V397-T439 WeakPolarHBondContact O-CG2 3.46Å; V397-T439 PolarHBondContact O-OG1 2.84Å
398	S	95	Very high	96.7	Very high	45 Å²	45	35.2 Å²	35.2	32%	0.315	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	7.2	176.8	-48.4	0	0	0	0	113.6	A394 K395 C396 A435 T439	A394-S398 WeakPolarHBondContact O-CB 3.49Å; A394-S398 PolarHBondContact O-N 3.47Å; A394-S398 PolarHBondContact O-OG 3.09Å; K395-S398 CarbonylContact O-C 3.46Å; K395-S398 PolarHBondContact O-N 3.24Å; C396-S398 VanDerWaalsContact C-N 3.31Å; C396-S398 PolarHBondContact O-N 2.88Å; S398-A435 WeakPolarHBondContact OG-CA 3.36Å; S398-A435 WeakPolarHBondContact OG-CB 3.4Å; S398-T439 WeakPolarHBondContact CA-OG1 3.32Å
399	S	95	Very high	96.6	Very high	18 Å²	18	33 Å²	33	13%	0.126	17%	0.172	C	C	.	.			trans	-70.1	138.6	-177.6	-175.8	0	0	0	0	110.3	K395 C396 V397 H401 H442	K395-S399 PolarHBondContact O-N 3.01Å; K395-S399 VanDerWaalsContact O-N 3.12Å; C396-S399 WeakPolarHBondContact O-CB 3.4Å; C396-S399 PolarHBondContact O-N 2.99Å; C396-S399 VanDerWaalsContact O-N 3.09Å; V397-S399 PolarHBondContact O-N 3.32Å; S399-H401 PolarHBondContact O-N 3.05Å; S399-H401 PolarHBondContact OG-N 3.36Å; S399-H442 PolarHBondContact O-NE2 3.32Å
400	P	94.3	Very high	96.4	Very high	103 Å²	103	33.5 Å²	33.5	67%	0.669	17%	0.174	S	C	*	.	S	Bend	trans	-72	-12.7	172.4	31.2	-36	0	0	0	112.9	F402 W443	P400-F402 PolarHBondContact O-N 3.48Å; P400-W443 PolarHBondContact O-NE1 3.07Å
401	H	95.7	Very high	96.4	Very high	58 Å²	58	33.5 Å²	33.5	27%	0.269	17%	0.174	S	C	.	.	S	Bend	trans	-85.2	109.4	179.8	-168.2	-69.4	0	0	0	110.1	S360 S399 Q403 V404 A405	S360-H401 PolarHBondContact OG-CD2 3.31Å; S399-H401 PolarHBondContact O-N 3.05Å; S399-H401 PolarHBondContact OG-N 3.36Å; H401-Q403 VanDerWaalsContact C-N 3.34Å; H401-Q403 PolarHBondContact CE1-OE1 3.24Å; H401-Q403 PolarHBondContact ND1-N 3.29Å; H401-Q403 PolarHBondContact O-N 2.88Å; H401-V404 HydrophobicContact CB-CB 4.37Å; H401-V404 HydrophobicContact CB-CG2 4.21Å; H401-V404 PolarHBondContact O-N 2.86Å; H401-A405 PolarHBondContact O-N 2.99Å; H401-A405 VanDerWaalsContact O-N 3.14Å
402	F	95.1	Very high	96.2	Very high	78 Å²	78	30.6 Å²	30.6	34%	0.342	16%	0.156	S	C	.	.	H	α-helix	trans	-56.8	-42.1	-169.4	82.2	-84	0	0	0	113.4	P400 V404 A405 E406 W443	P400-F402 PolarHBondContact O-N 3.48Å; F402-V404 PolarHBondContact O-N 3.37Å; F402-A405 PolarHBondContact O-N 3.33Å; F402-E406 WeakPolarHBondContact O-CB 3.44Å; F402-E406 PolarHBondContact O-N 2.93Å; F402-W443 HydrophobicContact CB-CZ2 4.27Å; F402-W443 HydrophobicContact CD1-CZ2 4.29Å
403	Q	96.6	Very high	95.9	Very high	91 Å²	91	30 Å²	30	43%	0.425	16%	0.155	S	C	.	.	H	α-helix	trans	-62.6	-30.8	179.6	-59.2	-178.2	-80.1	0	0	112.9	V364 H401 R407	V364-Q403 HydrophobicContact CG2-CB 4.1Å; H401-Q403 VanDerWaalsContact C-N 3.34Å; H401-Q403 PolarHBondContact CE1-OE1 3.24Å; H401-Q403 PolarHBondContact ND1-N 3.29Å; H401-Q403 PolarHBondContact O-N 2.88Å; Q403-R407 WeakPolarHBondContact O-CB 3.47Å; Q403-R407 PolarHBondContact O-N 3.08Å; Q403-R407 VanDerWaalsContact O-N 3.12Å
404	V	97.4	Very high	95.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-76.1	-48.7	178.6	172.7	0	0	0	0	109.9	E363 V364 L367 C396 H401 F402 R407 A408	E363-V404 HydrophobicContact CB-CG2 4.18Å; E363-V404 VanDerWaalsContact CD-CG1 3.47Å; E363-V404 HydrophobicContact CG-CG1 3.83Å; E363-V404 HydrophobicContact CG-CG2 4.11Å; V364-V404 HydrophobicContact CG2-CG2 4.04Å; L367-V404 HydrophobicContact CD1-CG1 4.19Å; C396-V404 HydrophobicContact CB-CG1 4.01Å; H401-V404 HydrophobicContact CB-CB 4.37Å; H401-V404 HydrophobicContact CB-CG2 4.21Å; H401-V404 PolarHBondContact O-N 2.86Å; F402-V404 PolarHBondContact O-N 3.37Å; V404-R407 PolarHBondContact O-N 3.18Å; V404-A408 WeakPolarHBondContact O-CB 3.42Å; V404-A408 PolarHBondContact O-N 3Å
405	A	96.5	Very high	95.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.2	-46.4	179.1	0	0	0	0	0	111.5	C396 H401 F402 A408 L409 I447	C396-A405 WeakPolarHBondContact O-CA 3.47Å; H401-A405 PolarHBondContact O-N 2.99Å; H401-A405 VanDerWaalsContact O-N 3.14Å; F402-A405 PolarHBondContact O-N 3.33Å; A405-A408 PolarHBondContact O-N 3.31Å; A405-L409 WeakPolarHBondContact O-CB 3.09Å; A405-L409 WeakPolarHBondContact O-CD1 3.41Å; A405-L409 VanDerWaalsContact O-CG 3.28Å; A405-L409 WeakPolarHBondContact O-CG 3.27Å; A405-L409 PolarHBondContact O-N 3.47Å; A405-I447 HydrophobicContact CB-CD1 3.97Å; A405-I447 HydrophobicContact CB-CG2 4.42Å
406	E	95.1	Very high	95.5	Very high	47 Å²	47	32.7 Å²	32.7	22%	0.22	17%	0.168	C	C	.	.	H	α-helix	trans	-57.5	-51.4	175.7	-171.4	-167.4	-156.5	0	0	110.8	F402 A408 L409 Y410 I447 L450	F402-E406 WeakPolarHBondContact O-CB 3.44Å; F402-E406 PolarHBondContact O-N 2.93Å; E406-A408 VanDerWaalsContact C-N 3.3Å; E406-A408 PolarHBondContact O-N 3.19Å; E406-L409 PolarHBondContact O-N 3.27Å; E406-L409 VanDerWaalsContact O-N 3.13Å; E406-Y410 HydrophobicContact CG-CD2 4.36Å; E406-Y410 HydrophobicContact CG-CE2 3.52Å; E406-Y410 WeakPolarHBondContact O-CD2 3.17Å; E406-Y410 PolarHBondContact O-N 3.41Å; E406-Y410 VanDerWaalsContact O-N 3.11Å; E406-Y410 PolarHBondContact OE1-OH 2.92Å; E406-I447 HydrophobicContact CB-CD1 3.74Å; E406-L450 HydrophobicContact CB-CD1 4.49Å; E406-L450 HydrophobicContact CG-CD1 3.82Å
407	R	97	Very high	95.5	Very high	23 Å²	23	32.7 Å²	32.7	9%	0.087	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-38.5	-178.4	-177.3	61.8	-172.7	96.4	-15.6	113	V364 L367 N368 E371 Q403 V404 Y410	V364-R407 HydrophobicContact CG1-CB 4.36Å; V364-R407 HydrophobicContact CG1-CG 4.11Å; L367-R407 HydrophobicContact CB-CG 3.69Å; L367-R407 HydrophobicContact CD1-CB 4.09Å; L367-R407 HydrophobicContact CD1-CG 4.05Å; N368-R407 PolarHBondContact OD1-NE 3.45Å; N368-R407 PolarHBondContact OD1-NH2 3.39Å; E371-R407 IonicContact OE2-CZ 3.88Å; E371-R407 IonicContact OE2-NH1 3.79Å; E371-R407 PolarHBondContact OE2-NH1 3.39Å; E371-R407 IonicContact OE2-NH2 3.98Å; E371-R407 PolarHBondContact OE2-NH2 2.87Å; Q403-R407 WeakPolarHBondContact O-CB 3.47Å; Q403-R407 PolarHBondContact O-N 3.08Å; Q403-R407 VanDerWaalsContact O-N 3.12Å; V404-R407 PolarHBondContact O-N 3.18Å; R407-Y410 PolarHBondContact O-N 3.21Å
408	A	97.3	Very high	95.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-67.9	-39.1	176.1	0	0	0	0	0	111.8	L367 C396 V397 V404 A405 E406 Y410 F411	L367-A408 HydrophobicContact CD1-CB 4.11Å; L367-A408 HydrophobicContact CD2-CB 4.24Å; C396-A408 HydrophobicContact CB-CB 3.68Å; V397-A408 HydrophobicContact CG2-CB 3.89Å; V404-A408 WeakPolarHBondContact O-CB 3.42Å; V404-A408 PolarHBondContact O-N 3Å; A405-A408 PolarHBondContact O-N 3.31Å; E406-A408 VanDerWaalsContact C-N 3.3Å; E406-A408 PolarHBondContact O-N 3.19Å; A408-Y410 VanDerWaalsContact C-N 3.25Å; A408-Y410 PolarHBondContact O-N 3.3Å; A408-F411 WeakPolarHBondContact O-CB 3.34Å; A408-F411 WeakPolarHBondContact O-CD2 3.42Å; A408-F411 PolarHBondContact O-N 3.49Å
409	L	95.7	Very high	95.5	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-68.5	-22.6	177.9	-73.1	164	0	0	0	113	V397 A405 E406 F411 W412 L436 I447 L450 V451 A454	V397-L409 HydrophobicContact CG1-CD2 3.97Å; V397-L409 HydrophobicContact CG1-CG 4.37Å; V397-L409 HydrophobicContact CG2-CD2 4.11Å; V397-L409 HydrophobicContact CG2-CG 4.23Å; A405-L409 WeakPolarHBondContact O-CB 3.09Å; A405-L409 WeakPolarHBondContact O-CD1 3.41Å; A405-L409 VanDerWaalsContact O-CG 3.28Å; A405-L409 WeakPolarHBondContact O-CG 3.27Å; A405-L409 PolarHBondContact O-N 3.47Å; E406-L409 PolarHBondContact O-N 3.27Å; E406-L409 VanDerWaalsContact O-N 3.13Å; L409-F411 PolarHBondContact O-N 2.87Å; L409-W412 HydrophobicContact CD2-CE3 4.48Å; L409-W412 PolarHBondContact O-N 3.31Å; L409-L436 HydrophobicContact CD2-CD2 3.8Å; L409-I447 HydrophobicContact CD1-CG2 4.02Å; L409-L450 HydrophobicContact CB-CB 4.01Å; L409-L450 HydrophobicContact CB-CD1 4.23Å; L409-L450 HydrophobicContact CD1-CB 3.68Å; L409-L450 HydrophobicContact CD1-CD1 4.4Å; L409-L450 HydrophobicContact CG-CB 4.34Å; L409-V451 HydrophobicContact CD1-CG2 3.79Å; L409-V451 HydrophobicContact CD2-CG2 4.17Å; L409-A454 HydrophobicContact CD2-CB 4.23Å
410	Y	94.9	Very high	95.5	Very high	10 Å²	10	36.1 Å²	36.1	4%	0.039	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-64.9	-13.8	173	-69.6	-41.9	0	0	0	114.6	E406 R407 A408 W412 S413 L450 I583 R587	E406-Y410 HydrophobicContact CG-CD2 4.36Å; E406-Y410 HydrophobicContact CG-CE2 3.52Å; E406-Y410 WeakPolarHBondContact O-CD2 3.17Å; E406-Y410 PolarHBondContact O-N 3.41Å; E406-Y410 VanDerWaalsContact O-N 3.11Å; E406-Y410 PolarHBondContact OE1-OH 2.92Å; R407-Y410 PolarHBondContact O-N 3.21Å; A408-Y410 VanDerWaalsContact C-N 3.25Å; A408-Y410 PolarHBondContact O-N 3.3Å; Y410-W412 PolarHBondContact O-N 2.94Å; Y410-S413 VanDerWaalsContact O-CB 3.29Å; Y410-S413 WeakPolarHBondContact O-CB 3.48Å; Y410-S413 PolarHBondContact O-N 2.93Å; Y410-L450 HydrophobicContact CE1-CD1 4.31Å; Y410-L450 HydrophobicContact CE1-CD2 4.21Å; Y410-I583 HydrophobicContact CE1-CG2 4.43Å; Y410-R587 VanDerWaalsContact CZ-CZ 3.43Å
411	F	96.2	Very high	95.6	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.009	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-60.3	-29.1	172.8	-79.4	-125.5	0	0	0	112.2	L367 L370 E371 L374 L393 A408 L409 S413 N414 I417	L367-F411 HydrophobicContact CB-CE2 4.36Å; L367-F411 HydrophobicContact CD2-CE2 4.17Å; L367-F411 HydrophobicContact CD2-CZ 4.31Å; L367-F411 WeakPolarHBondContact O-CZ 3.35Å; L370-F411 HydrophobicContact CB-CZ 4.37Å; E371-F411 HydrophobicContact CB-CE1 4.44Å; E371-F411 HydrophobicContact CB-CE2 4.12Å; E371-F411 HydrophobicContact CB-CZ 3.94Å; L374-F411 HydrophobicContact CD1-CD1 4.11Å; L374-F411 HydrophobicContact CD1-CE1 3.71Å; L393-F411 HydrophobicContact CD1-CD1 3.92Å; L393-F411 HydrophobicContact CD1-CE1 4.1Å; L393-F411 HydrophobicContact CD2-CD1 4.28Å; L393-F411 HydrophobicContact CD2-CE1 4.01Å; L393-F411 HydrophobicContact CD2-CE2 4.38Å; L393-F411 HydrophobicContact CD2-CZ 4.08Å; A408-F411 WeakPolarHBondContact O-CB 3.34Å; A408-F411 WeakPolarHBondContact O-CD2 3.42Å; A408-F411 PolarHBondContact O-N 3.49Å; L409-F411 PolarHBondContact O-N 2.87Å; F411-S413 PolarHBondContact O-N 3.04Å; F411-N414 PolarHBondContact O-N 3.4Å; F411-I417 HydrophobicContact CD1-CD1 4.13Å
412	W	94.7	Very high	95.6	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.008	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-75.4	-5.6	174.5	-77.5	-97.8	0	0	0	113.8	V397 L409 Y410 M421 M432 A454 L457 F458	V397-W412 HydrophobicContact CG2-CZ3 4.28Å; L409-W412 HydrophobicContact CD2-CE3 4.48Å; L409-W412 PolarHBondContact O-N 3.31Å; Y410-W412 PolarHBondContact O-N 2.94Å; W412-M421 HydrophobicContact CD2-CE 4.42Å; W412-M421 HydrophobicContact CG-CE 4.21Å; W412-M421 HydrophobicContact CZ2-SD 4.25Å; W412-M432 HydrophobicContact CH2-CE 3.53Å; W412-M432 HydrophobicContact CH2-SD 4.4Å; W412-M432 HydrophobicContact CZ2-CE 4.1Å; W412-M432 HydrophobicContact CZ2-CG 4.41Å; W412-A454 HydrophobicContact CD2-CB 3.96Å; W412-A454 HydrophobicContact CG-CB 3.91Å; W412-L457 HydrophobicContact CB-CD1 4.04Å; W412-L457 HydrophobicContact CG-CD1 4.47Å; W412-F458 AromaticContact CE2-CE2 3.53Å; W412-F458 AromaticContact CE2-CZ 3.87Å; W412-F458 AromaticContact CZ2-CE2 3.43Å; W412-F458 HydrophobicContact CZ2-CE2 3.43Å; W412-F458 VanDerWaalsContact CZ2-CE2 3.43Å; W412-F458 AromaticContact CZ2-CZ 3.66Å; W412-F458 HydrophobicContact CZ2-CZ 3.66Å; W412-F458 AromaticContact NE1-CD2 3.74Å; W412-F458 AromaticContact NE1-CE2 3.14Å; W412-F458 AromaticContact NE1-CZ 3.46Å
413	S	91.7	Very high	95.6	Very high	14 Å²	14	33.7 Å²	33.7	10%	0.098	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-94.4	-11.5	176.1	-53	0	0	0	0	112.7	Y410 F411	Y410-S413 VanDerWaalsContact O-CB 3.29Å; Y410-S413 WeakPolarHBondContact O-CB 3.48Å; Y410-S413 PolarHBondContact O-N 2.93Å; F411-S413 PolarHBondContact O-N 3.04Å
414	N	93.1	Very high	95.6	Very high	11 Å²	11	31.6 Å²	31.6	6%	0.059	15%	0.152	C	C	.	.			trans	-89.5	117.9	176.6	-177.6	-44.9	0	0	0	110	E371 D375 F411 Y416 I417 L418	E371-N414 PolarHBondContact OE1-ND2 3.32Å; D375-N414 PolarHBondContact OD1-ND2 3.04Å; F411-N414 PolarHBondContact O-N 3.4Å; N414-Y416 VanDerWaalsContact C-N 3.34Å; N414-Y416 PolarHBondContact O-N 3.02Å; N414-Y416 PolarHBondContact OD1-N 3.21Å; N414-I417 HydrophobicContact CB-CB 4.14Å; N414-I417 HydrophobicContact CB-CD1 3.95Å; N414-I417 HydrophobicContact CB-CG1 4.04Å; N414-I417 PolarHBondContact O-N 3.01Å; N414-I417 PolarHBondContact OD1-N 3.26Å; N414-L418 WeakPolarHBondContact O-CB 3.26Å; N414-L418 PolarHBondContact O-N 3.08Å
415	D	94.7	Very high	95.5	Very high	99 Å²	99	32.1 Å²	32.1	53%	0.529	16%	0.155	S	C	.	.	H	α-helix	trans	-62.4	-36.6	-175.9	-68.8	-28.5	0	0	0	113.4	L418 Q419	D415-L418 PolarHBondContact O-N 3.06Å; D415-Q419 PolarHBondContact O-N 3.23Å
416	Y	96.6	Very high	95.5	Very high	82 Å²	82	39.4 Å²	39.4	32%	0.322	19%	0.189	S	C	.	.	H	α-helix	trans	-70.5	-44.9	179.3	-177.5	-118.5	0	0	0	111.4	L374 V377 N414 L418 Q419 L420	L374-Y416 VanDerWaalsContact O-CD1 3.31Å; L374-Y416 WeakPolarHBondContact O-CD1 3.33Å; L374-Y416 VanDerWaalsContact O-CE1 3.25Å; L374-Y416 WeakPolarHBondContact O-CE1 3.05Å; V377-Y416 HydrophobicContact CG1-CE1 4.37Å; V377-Y416 PolarHBondContact O-OH 2.95Å; N414-Y416 VanDerWaalsContact C-N 3.34Å; N414-Y416 PolarHBondContact O-N 3.02Å; N414-Y416 PolarHBondContact OD1-N 3.21Å; Y416-L418 VanDerWaalsContact C-N 3.28Å; Y416-L418 PolarHBondContact O-N 2.85Å; Y416-Q419 WeakPolarHBondContact O-CB 3.4Å; Y416-Q419 PolarHBondContact O-N 3.12Å; Y416-L420 HydrophobicContact CD1-CD1 4.09Å; Y416-L420 HydrophobicContact CE1-CD1 3.68Å; Y416-L420 HydrophobicContact CE1-CG 4.3Å; Y416-L420 HydrophobicContact CE2-CG 4.43Å; Y416-L420 WeakPolarHBondContact O-CG 3.33Å; Y416-L420 PolarHBondContact O-N 2.99Å
417	I	96.3	Very high	95.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.4	-39.6	174.7	-58.8	179.6	0	0	0	110	E371 L374 F411 N414 Q419 L420 M421	E371-I417 HydrophobicContact CG-CD1 3.73Å; L374-I417 HydrophobicContact CB-CD1 3.86Å; L374-I417 HydrophobicContact CB-CG1 4.03Å; L374-I417 HydrophobicContact CD1-CD1 4.14Å; F411-I417 HydrophobicContact CD1-CD1 4.13Å; N414-I417 HydrophobicContact CB-CB 4.14Å; N414-I417 HydrophobicContact CB-CD1 3.95Å; N414-I417 HydrophobicContact CB-CG1 4.04Å; N414-I417 PolarHBondContact O-N 3.01Å; N414-I417 PolarHBondContact OD1-N 3.26Å; I417-Q419 VanDerWaalsContact C-N 3.34Å; I417-Q419 PolarHBondContact O-N 2.8Å; I417-L420 PolarHBondContact O-N 3.27Å; I417-M421 HydrophobicContact CG2-CE 4.12Å; I417-M421 HydrophobicContact CG2-CG 4.44Å; I417-M421 WeakPolarHBondContact O-CB 3.25Å; I417-M421 VanDerWaalsContact O-CG 3.29Å; I417-M421 WeakPolarHBondContact O-CG 3.4Å; I417-M421 PolarHBondContact O-N 3.3Å
418	L	95	Very high	95.6	Very high	31 Å²	31	38.4 Å²	38.4	16%	0.162	19%	0.186	C	C	.	.	H	α-helix	trans	-61	-41.3	175.8	-166.3	72.4	0	0	0	111.9	N414 D415 Y416 M421 H422 L457 M461	N414-L418 WeakPolarHBondContact O-CB 3.26Å; N414-L418 PolarHBondContact O-N 3.08Å; D415-L418 PolarHBondContact O-N 3.06Å; Y416-L418 VanDerWaalsContact C-N 3.28Å; Y416-L418 PolarHBondContact O-N 2.85Å; L418-M421 HydrophobicContact CB-CE 4.44Å; L418-M421 HydrophobicContact CD1-CE 3.86Å; L418-M421 PolarHBondContact O-N 2.82Å; L418-H422 PolarHBondContact O-N 2.88Å; L418-L457 HydrophobicContact CD1-CD1 4.21Å; L418-M461 HydrophobicContact CD1-CE 3.31Å; L418-M461 HydrophobicContact CG-CE 3.67Å; L418-M461 WeakPolarHBondContact O-CE 3.43Å
419	Q	95.9	Very high	95.5	Very high	100 Å²	100	38.4 Å²	38.4	47%	0.467	19%	0.186	S	C	.	.	H	α-helix	trans	-64	-45.6	174.4	-178.3	59.3	47.9	0	0	112	D415 Y416 I417 M421 H422 D423	D415-Q419 PolarHBondContact O-N 3.23Å; Y416-Q419 WeakPolarHBondContact O-CB 3.4Å; Y416-Q419 PolarHBondContact O-N 3.12Å; I417-Q419 VanDerWaalsContact C-N 3.34Å; I417-Q419 PolarHBondContact O-N 2.8Å; Q419-M421 VanDerWaalsContact C-N 3.26Å; Q419-M421 PolarHBondContact O-N 2.81Å; Q419-H422 WeakPolarHBondContact O-CB 3.34Å; Q419-H422 PolarHBondContact O-N 3.1Å; Q419-H422 VanDerWaalsContact O-N 3.16Å; Q419-D423 PolarHBondContact NE2-OD1 2.91Å; Q419-D423 VanDerWaalsContact NE2-OD1 3.12Å; Q419-D423 PolarHBondContact NE2-OD2 3.44Å; Q419-D423 PolarHBondContact O-N 3.25Å; Q419-D423 VanDerWaalsContact O-N 3.17Å
420	L	96.2	Very high	95.5	Very high	4 Å²	4	40.4 Å²	40.4	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-60.1	-37.4	174.9	-69.6	175	0	0	0	112	V377 P379 F382 Y416 I417 H424	V377-L420 HydrophobicContact CG1-CD1 3.77Å; P379-L420 HydrophobicContact CB-CD2 4.22Å; P379-L420 HydrophobicContact CG-CD2 4.12Å; F382-L420 HydrophobicContact CD1-CB 4.04Å; F382-L420 HydrophobicContact CD1-CD1 4.47Å; F382-L420 HydrophobicContact CD1-CD2 4.22Å; F382-L420 HydrophobicContact CD1-CG 4.49Å; F382-L420 HydrophobicContact CD2-CD1 4.04Å; F382-L420 HydrophobicContact CE1-CB 3.72Å; F382-L420 HydrophobicContact CE2-CB 4.41Å; F382-L420 HydrophobicContact CE2-CD1 4.27Å; F382-L420 HydrophobicContact CG-CB 4.5Å; F382-L420 HydrophobicContact CG-CD1 4.12Å; F382-L420 HydrophobicContact CG-CD2 4.38Å; F382-L420 HydrophobicContact CZ-CB 3.89Å; Y416-L420 HydrophobicContact CD1-CD1 4.09Å; Y416-L420 HydrophobicContact CE1-CD1 3.68Å; Y416-L420 HydrophobicContact CE1-CG 4.3Å; Y416-L420 HydrophobicContact CE2-CG 4.43Å; Y416-L420 WeakPolarHBondContact O-CG 3.33Å; Y416-L420 PolarHBondContact O-N 2.99Å; I417-L420 PolarHBondContact O-N 3.27Å; L420-H424 PolarHBondContact O-N 3.18Å
421	M	96.3	Very high	95.6	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-67.4	-39.8	175.1	-72.9	-169.4	-67.7	0	0	112.3	F390 W412 I417 L418 Q419 H424 V425 I428 F458 M461	F390-M421 HydrophobicContact CE1-CG 4.08Å; F390-M421 HydrophobicContact CE1-SD 3.65Å; F390-M421 HydrophobicContact CZ-CG 3.63Å; F390-M421 HydrophobicContact CZ-SD 3.81Å; W412-M421 HydrophobicContact CD2-CE 4.42Å; W412-M421 HydrophobicContact CG-CE 4.21Å; W412-M421 HydrophobicContact CZ2-SD 4.25Å; I417-M421 HydrophobicContact CG2-CE 4.12Å; I417-M421 HydrophobicContact CG2-CG 4.44Å; I417-M421 WeakPolarHBondContact O-CB 3.25Å; I417-M421 VanDerWaalsContact O-CG 3.29Å; I417-M421 WeakPolarHBondContact O-CG 3.4Å; I417-M421 PolarHBondContact O-N 3.3Å; L418-M421 HydrophobicContact CB-CE 4.44Å; L418-M421 HydrophobicContact CD1-CE 3.86Å; L418-M421 PolarHBondContact O-N 2.82Å; Q419-M421 VanDerWaalsContact C-N 3.26Å; Q419-M421 PolarHBondContact O-N 2.81Å; M421-H424 CarbonylContact O-C 3.51Å; M421-H424 PolarHBondContact O-N 3.42Å; M421-V425 VanDerWaalsContact O-CA 3.31Å; M421-V425 WeakPolarHBondContact O-CA 3.45Å; M421-V425 PolarHBondContact O-N 3.44Å; M421-I428 HydrophobicContact CB-CD1 4.24Å; M421-I428 HydrophobicContact CG-CD1 4.07Å; M421-F458 HydrophobicContact SD-CZ 4.4Å; M421-M461 HydrophobicContact CB-CE 4.23Å
422	H	95.5	Very high	95.6	Very high	90 Å²	90	41.6 Å²	41.6	42%	0.417	21%	0.206	S	C	.	.	H	α-helix	trans	-59.2	-46.9	177.5	177.9	-81.4	0	0	0	111.4	L418 Q419 H424 V425 M461	L418-H422 PolarHBondContact O-N 2.88Å; Q419-H422 WeakPolarHBondContact O-CB 3.34Å; Q419-H422 PolarHBondContact O-N 3.1Å; Q419-H422 VanDerWaalsContact O-N 3.16Å; H422-H424 PolarHBondContact O-N 2.93Å; H422-V425 PolarHBondContact O-N 3.1Å; H422-M461 HydrophobicContact CB-CE 4.2Å; H422-M461 HydrophobicContact CB-SD 4.48Å
423	D	95.5	Very high	95.7	Very high	96 Å²	96	41.6 Å²	41.6	51%	0.513	21%	0.206	S	C	.	.	H	α-helix	trans	-68.8	-18.1	-177.2	-64	-19.5	0	0	0	113.5	Q419	Q419-D423 PolarHBondContact NE2-OD1 2.91Å; Q419-D423 VanDerWaalsContact NE2-OD1 3.12Å; Q419-D423 PolarHBondContact NE2-OD2 3.44Å; Q419-D423 PolarHBondContact O-N 3.25Å; Q419-D423 VanDerWaalsContact O-N 3.17Å
424	H	95.9	Very high	95.7	Very high	48 Å²	48	42.1 Å²	42.1	22%	0.222	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.7	24.6	-179.2	-63	-59.5	0	0	0	113.7	F382 I386 L420 M421 H422 E426 E427 I428	F382-H424 AromaticContact CD1-CD2 3.8Å; F382-H424 AromaticContact CE1-CD2 3.87Å; I386-H424 HydrophobicContact CD1-CB 3.55Å; I386-H424 VanDerWaalsContact CD1-CG 3.44Å; L420-H424 PolarHBondContact O-N 3.18Å; M421-H424 CarbonylContact O-C 3.51Å; M421-H424 PolarHBondContact O-N 3.42Å; H422-H424 PolarHBondContact O-N 2.93Å; H424-E426 PolarHBondContact O-N 2.79Å; H424-E426 VanDerWaalsContact O-N 3.14Å; H424-E427 PolarHBondContact O-N 2.96Å; H424-I428 HydrophobicContact CB-CD1 3.9Å; H424-I428 PolarHBondContact O-N 3.41Å; H424-I428 VanDerWaalsContact O-N 3.17Å
425	V	96.3	Very high	95.8	Very high	11 Å²	11	41.6 Å²	41.6	7%	0.067	21%	0.206	C	C	.	.	H	α-helix	trans	-58	-32.9	-174.3	69.1	0	0	0	0	112.8	M421 H422 E427 I428 L429 F458 M461 N462 L465	M421-V425 VanDerWaalsContact O-CA 3.31Å; M421-V425 WeakPolarHBondContact O-CA 3.45Å; M421-V425 PolarHBondContact O-N 3.44Å; H422-V425 PolarHBondContact O-N 3.1Å; V425-E427 PolarHBondContact O-N 3.35Å; V425-I428 PolarHBondContact O-N 3.2Å; V425-L429 HydrophobicContact CG2-CB 4.06Å; V425-L429 HydrophobicContact CG2-CD2 4.33Å; V425-L429 VanDerWaalsContact O-CB 3.28Å; V425-L429 WeakPolarHBondContact O-CB 3.33Å; V425-L429 PolarHBondContact O-N 3.36Å; V425-F458 HydrophobicContact CG2-CD1 4.28Å; V425-M461 HydrophobicContact CG2-CB 4.11Å; V425-M461 HydrophobicContact CG2-SD 4.32Å; V425-N462 HydrophobicContact CG1-CB 4.12Å; V425-N462 HydrophobicContact CG2-CB 4.42Å; V425-L465 HydrophobicContact CG1-CD2 4.48Å; V425-L465 HydrophobicContact CG2-CD2 4.33Å; V425-L465 WeakPolarHBondContact O-CD2 3.5Å
426	E	96	Very high	95.7	Very high	152 Å²	152	36.9 Å²	36.9	71%	0.71	18%	0.181	S	C	*	.	H	α-helix	trans	-59.5	-30.5	177.8	-64	-170.7	170.2	0	0	113.7	H424 P430 L465	H424-E426 PolarHBondContact O-N 2.79Å; H424-E426 VanDerWaalsContact O-N 3.14Å; E426-P430 WeakPolarHBondContact O-CD 3.41Å; E426-P430 WeakPolarHBondContact O-CG 3.41Å; E426-L465 HydrophobicContact CG-CD2 4.45Å
427	E	95.7	Very high	95.3	Very high	49 Å²	49	33.4 Å²	33.4	23%	0.229	17%	0.167	C	C	.	.	H	α-helix	trans	-94.5	-34.7	178.4	-175	164.9	-139.1	0	0	112.3	I386 R387 H424 V425 I431	I386-E427 HydrophobicContact CG2-CB 4.43Å; I386-E427 HydrophobicContact CG2-CG 3.95Å; R387-E427 HydrophobicContact CG-CG 4.14Å; R387-E427 VanDerWaalsContact CG-OE1 3.3Å; R387-E427 WeakPolarHBondContact CG-OE1 3.42Å; R387-E427 IonicContact CZ-OE1 3.21Å; R387-E427 IonicContact NE-OE1 2.68Å; R387-E427 PolarHBondContact NE-OE1 3.04Å; R387-E427 IonicContact NH2-OE1 3.68Å; R387-E427 PolarHBondContact NH2-OE1 3.48Å; H424-E427 PolarHBondContact O-N 2.96Å; V425-E427 PolarHBondContact O-N 3.35Å; E427-I431 WeakPolarHBondContact O-CD1 3.25Å; E427-I431 WeakPolarHBondContact O-CG1 3.47Å
428	I	97.3	Very high	94.8	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-80.6	-47.6	-172.6	-67.5	167.1	0	0	0	112	F382 I386 F390 M421 H424 V425 I431 M432 F458	F382-I428 HydrophobicContact CE1-CD1 4.37Å; F382-I428 HydrophobicContact CZ-CD1 4.37Å; I386-I428 HydrophobicContact CG2-CD1 4.1Å; I386-I428 HydrophobicContact CG2-CG1 3.48Å; I386-I428 VanDerWaalsContact CG2-CG1 3.48Å; F390-I428 HydrophobicContact CD1-CG2 3.61Å; F390-I428 HydrophobicContact CD2-CD1 4.18Å; F390-I428 HydrophobicContact CD2-CG1 3.88Å; F390-I428 HydrophobicContact CD2-CG2 4.33Å; F390-I428 HydrophobicContact CE1-CG2 3.66Å; F390-I428 HydrophobicContact CE2-CD1 3.67Å; F390-I428 HydrophobicContact CE2-CG1 3.9Å; F390-I428 HydrophobicContact CE2-CG2 4.38Å; F390-I428 HydrophobicContact CG-CG1 4.28Å; F390-I428 HydrophobicContact CG-CG2 3.96Å; F390-I428 HydrophobicContact CZ-CD1 3.9Å; F390-I428 HydrophobicContact CZ-CG1 4.3Å; F390-I428 HydrophobicContact CZ-CG2 4.07Å; M421-I428 HydrophobicContact CB-CD1 4.24Å; M421-I428 HydrophobicContact CG-CD1 4.07Å; H424-I428 HydrophobicContact CB-CD1 3.9Å; H424-I428 PolarHBondContact O-N 3.41Å; H424-I428 VanDerWaalsContact O-N 3.17Å; V425-I428 PolarHBondContact O-N 3.2Å; I428-I431 WeakPolarHBondContact O-CB 3.12Å; I428-I431 PolarHBondContact O-N 3.28Å; I428-M432 HydrophobicContact CG2-CG 4.06Å; I428-M432 PolarHBondContact O-N 3.09Å; I428-M432 VanDerWaalsContact O-N 3.07Å; I428-F458 HydrophobicContact CG2-CE1 4.09Å; I428-F458 HydrophobicContact CG2-CZ 4.01Å
429	L	96.2	Very high	94.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.9	-44.5	-172.7	179.7	54.4	0	0	0	112.8	V425 I431 M432 F433 F458 L465 F466	V425-L429 HydrophobicContact CG2-CB 4.06Å; V425-L429 HydrophobicContact CG2-CD2 4.33Å; V425-L429 VanDerWaalsContact O-CB 3.28Å; V425-L429 WeakPolarHBondContact O-CB 3.33Å; V425-L429 PolarHBondContact O-N 3.36Å; L429-I431 PolarHBondContact O-N 3.36Å; L429-I431 VanDerWaalsContact O-N 3.15Å; L429-M432 PolarHBondContact O-N 2.85Å; L429-F433 HydrophobicContact CD1-CB 4.17Å; L429-F433 HydrophobicContact CD1-CD2 4.4Å; L429-F433 VanDerWaalsContact O-CB 3.23Å; L429-F433 WeakPolarHBondContact O-CB 3.14Å; L429-F433 PolarHBondContact O-N 3.48Å; L429-F458 HydrophobicContact CB-CD1 4.33Å; L429-F458 HydrophobicContact CB-CE1 4.49Å; L429-F458 HydrophobicContact CD1-CB 3.75Å; L429-F458 HydrophobicContact CD1-CD1 3.79Å; L429-F458 HydrophobicContact CD1-CD2 4.03Å; L429-F458 HydrophobicContact CD1-CE1 4.37Å; L429-F458 HydrophobicContact CD1-CG 3.61Å; L429-F458 HydrophobicContact CD2-CB 4.47Å; L429-F458 HydrophobicContact CG-CD1 4.47Å; L429-L465 HydrophobicContact CB-CD2 4.04Å; L429-L465 HydrophobicContact CD2-CB 4.29Å; L429-L465 HydrophobicContact CD2-CD2 3.94Å; L429-L465 HydrophobicContact CD2-CG 3.93Å; L429-L465 HydrophobicContact CG-CD2 4.45Å; L429-F466 HydrophobicContact CD1-CD2 4.44Å; L429-F466 HydrophobicContact CD2-CB 4.16Å; L429-F466 HydrophobicContact CD2-CD2 4.41Å
430	P	96.1	Very high	93.4	Very high	46 Å²	46	34.7 Å²	34.7	30%	0.299	17%	0.168	S	C	.	.	H	α-helix	trans	-60.3	-25.6	176.4	-24.2	34.6	0	0	0	114.5	E426 P434	E426-P430 WeakPolarHBondContact O-CD 3.41Å; E426-P430 WeakPolarHBondContact O-CG 3.41Å; P430-P434 WeakPolarHBondContact O-CD 3.47Å
431	I	96.7	Very high	92.7	Very high	38 Å²	38	40.9 Å²	40.9	20%	0.195	20%	0.196	C	C	.	.	H	α-helix	trans	-81.3	-44.3	178.6	-59.3	172.5	0	0	0	110.4	R387 F390 E427 I428 L429	R387-I431 HydrophobicContact CG-CD1 4.3Å; F390-I431 HydrophobicContact CB-CG2 4.26Å; E427-I431 WeakPolarHBondContact O-CD1 3.25Å; E427-I431 WeakPolarHBondContact O-CG1 3.47Å; I428-I431 WeakPolarHBondContact O-CB 3.12Å; I428-I431 PolarHBondContact O-N 3.28Å; L429-I431 PolarHBondContact O-N 3.36Å; L429-I431 VanDerWaalsContact O-N 3.15Å
432	M	96.5	Very high	92.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-80.5	-32.4	-174.6	-70.3	-55	-49.2	0	0	113.6	F390 L393 A394 V397 W412 I428 L429 A435 L436 F458	F390-M432 HydrophobicContact CB-CG 4.44Å; F390-M432 HydrophobicContact CB-SD 4.2Å; F390-M432 HydrophobicContact CD1-CG 3.74Å; F390-M432 HydrophobicContact CD1-SD 3.8Å; F390-M432 VanDerWaalsContact O-SD 3.38Å; L393-M432 HydrophobicContact CB-SD 4.28Å; A394-M432 HydrophobicContact CB-CE 4.23Å; A394-M432 HydrophobicContact CB-SD 3.82Å; V397-M432 HydrophobicContact CB-CE 4.46Å; V397-M432 HydrophobicContact CG2-CE 4.03Å; W412-M432 HydrophobicContact CH2-CE 3.53Å; W412-M432 HydrophobicContact CH2-SD 4.4Å; W412-M432 HydrophobicContact CZ2-CE 4.1Å; W412-M432 HydrophobicContact CZ2-CG 4.41Å; I428-M432 HydrophobicContact CG2-CG 4.06Å; I428-M432 PolarHBondContact O-N 3.09Å; I428-M432 VanDerWaalsContact O-N 3.07Å; L429-M432 PolarHBondContact O-N 2.85Å; M432-A435 WeakPolarHBondContact O-CB 3.39Å; M432-A435 PolarHBondContact O-N 2.98Å; M432-A435 VanDerWaalsContact O-N 3.09Å; M432-L436 HydrophobicContact CB-CD1 4.24Å; M432-L436 PolarHBondContact O-N 3.2Å; M432-F458 HydrophobicContact CB-CE2 4.17Å; M432-F458 HydrophobicContact CB-CZ 4.26Å; M432-F458 HydrophobicContact CG-CZ 4.4Å
433	F	95	Very high	92.2	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.009	21%	0.21	C	C	.	.	H	α-helix	trans	-55.3	-49.2	-174.1	-176.6	-85	0	0	0	113.3	L429 A435 L436 Y437 L455 F466 C469 T470 Y473	L429-F433 HydrophobicContact CD1-CB 4.17Å; L429-F433 HydrophobicContact CD1-CD2 4.4Å; L429-F433 VanDerWaalsContact O-CB 3.23Å; L429-F433 WeakPolarHBondContact O-CB 3.14Å; L429-F433 PolarHBondContact O-N 3.48Å; F433-A435 PolarHBondContact O-N 3.12Å; F433-L436 PolarHBondContact O-N 3.45Å; F433-Y437 HydrophobicContact CZ-CD2 4.48Å; F433-Y437 WeakPolarHBondContact O-CB 3.16Å; F433-Y437 PolarHBondContact O-N 2.82Å; F433-L455 HydrophobicContact CD2-CD2 4.46Å; F433-F466 HydrophobicContact CD2-CD2 4.31Å; F433-F466 HydrophobicContact CD2-CE2 4.05Å; F433-F466 HydrophobicContact CD2-CZ 4.47Å; F433-F466 HydrophobicContact CE2-CD2 4.26Å; F433-F466 HydrophobicContact CE2-CE1 4.19Å; F433-F466 AromaticContact CE2-CE2 3.81Å; F433-F466 HydrophobicContact CE2-CE2 3.81Å; F433-F466 AromaticContact CE2-CZ 3.78Å; F433-F466 HydrophobicContact CE2-CZ 3.78Å; F433-C469 HydrophobicContact CB-CB 4.21Å; F433-C469 HydrophobicContact CD1-CB 4.26Å; F433-C469 HydrophobicContact CD2-CB 4.2Å; F433-C469 HydrophobicContact CG-CB 3.96Å; F433-T470 WeakPolarHBondContact CE2-OG1 3.17Å; F433-T470 HydrophobicContact CZ-CG2 4.31Å; F433-T470 WeakPolarHBondContact CZ-OG1 3.48Å; F433-Y473 HydrophobicContact CD1-CG 4.34Å; F433-Y473 HydrophobicContact CE1-CD1 4.44Å; F433-Y473 AromaticContact CE1-CG 4Å; F433-Y473 HydrophobicContact CE1-CG 4Å
434	P	93.3	Very high	91.9	Very high	24 Å²	24	42 Å²	42	16%	0.156	19%	0.192	C	C	.	.	H	α-helix	trans	-61.5	-30.6	179	-23.7	35.3	0	0	0	113.9	P430 R438 Y473	P430-P434 WeakPolarHBondContact O-CD 3.47Å; P434-R438 WeakPolarHBondContact O-CB 3.3Å; P434-R438 VanDerWaalsContact O-CG 3.27Å; P434-R438 WeakPolarHBondContact O-CG 3.28Å; P434-R438 PolarHBondContact O-N 2.99Å; P434-R438 PolarHBondContact O-NE 3.25Å; P434-R438 VanDerWaalsContact O-NE 3.14Å; P434-Y473 HydrophobicContact CB-CD2 3.84Å; P434-Y473 HydrophobicContact CB-CE2 3.85Å; P434-Y473 HydrophobicContact CG-CD2 4.15Å
435	A	94.1	Very high	91.7	Very high	1 Å²	1	47 Å²	47	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-74.5	-51.7	178.1	0	0	0	0	0	111.5	A394 S398 M432 F433 Y437 R438 T439	A394-A435 HydrophobicContact CB-CB 3.71Å; A394-A435 WeakPolarHBondContact O-CB 3.31Å; S398-A435 WeakPolarHBondContact OG-CA 3.36Å; S398-A435 WeakPolarHBondContact OG-CB 3.4Å; M432-A435 WeakPolarHBondContact O-CB 3.39Å; M432-A435 PolarHBondContact O-N 2.98Å; M432-A435 VanDerWaalsContact O-N 3.09Å; F433-A435 PolarHBondContact O-N 3.12Å; A435-Y437 VanDerWaalsContact C-N 3.34Å; A435-Y437 PolarHBondContact O-N 3.42Å; A435-R438 PolarHBondContact O-N 3.48Å; A435-T439 PolarHBondContact O-N 3.39Å; A435-T439 VanDerWaalsContact O-N 3.08Å; A435-T439 PolarHBondContact O-OG1 3.26Å
436	L	93.1	Very high	91.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.2	-46.4	177.7	-73.7	165.6	0	0	0	111.4	V397 L409 M432 F433 R438 T439 V451 A454 L455 F458	V397-L436 HydrophobicContact CG1-CD2 3.73Å; V397-L436 HydrophobicContact CG1-CG 4.33Å; L409-L436 HydrophobicContact CD2-CD2 3.8Å; M432-L436 HydrophobicContact CB-CD1 4.24Å; M432-L436 PolarHBondContact O-N 3.2Å; F433-L436 PolarHBondContact O-N 3.45Å; L436-R438 PolarHBondContact O-N 3.32Å; L436-T439 PolarHBondContact O-N 2.89Å; L436-T439 VanDerWaalsContact O-N 3.17Å; L436-V451 HydrophobicContact CB-CG1 4.44Å; L436-V451 HydrophobicContact CD2-CG1 4.26Å; L436-V451 HydrophobicContact CD2-CG2 4.4Å; L436-V451 WeakPolarHBondContact O-CG1 3.14Å; L436-A454 HydrophobicContact CD1-CB 4.42Å; L436-A454 HydrophobicContact CD2-CB 3.93Å; L436-L455 HydrophobicContact CB-CD2 3.79Å; L436-L455 HydrophobicContact CB-CG 4.16Å; L436-L455 HydrophobicContact CD1-CD2 4.23Å; L436-F458 HydrophobicContact CD1-CD2 3.86Å; L436-F458 HydrophobicContact CD1-CE2 3.7Å
437	Y	88.2	Confident	91.2	Very high	9 Å²	9	41.2 Å²	41.2	4%	0.035	19%	0.189	C	C	.	.	H	α-helix	trans	-67.5	-33.6	-178.6	-168	-98.6	0	0	0	113.1	F433 A435 T439 K440 Y473 D560 V563 S566	F433-Y437 HydrophobicContact CZ-CD2 4.48Å; F433-Y437 WeakPolarHBondContact O-CB 3.16Å; F433-Y437 PolarHBondContact O-N 2.82Å; A435-Y437 VanDerWaalsContact C-N 3.34Å; A435-Y437 PolarHBondContact O-N 3.42Å; Y437-T439 VanDerWaalsContact C-N 3.33Å; Y437-K440 HydrophobicContact CE1-CD 4.31Å; Y437-K440 HydrophobicContact CE2-CD 4.29Å; Y437-K440 VanDerWaalsContact CZ-NZ 3.34Å; Y437-K440 VanDerWaalsContact O-CD 3.26Å; Y437-K440 WeakPolarHBondContact O-CD 3.47Å; Y437-K440 WeakPolarHBondContact O-CG 3.37Å; Y437-K440 PolarHBondContact OH-NZ 3.29Å; Y437-Y473 AromaticContact CD1-CD1 3.94Å; Y437-Y473 HydrophobicContact CD1-CD1 3.94Å; Y437-Y473 AromaticContact CD1-CE1 3.3Å; Y437-Y473 HydrophobicContact CD1-CE1 3.3Å; Y437-Y473 AromaticContact CD1-CZ 3.7Å; Y437-Y473 HydrophobicContact CE1-CD1 4.22Å; Y437-Y473 AromaticContact CE1-CE1 3.62Å; Y437-Y473 HydrophobicContact CE1-CE1 3.62Å; Y437-Y473 HydrophobicContact CG-CE1 4.33Å; Y437-D560 PolarHBondContact OH-O 2.68Å; Y437-D560 VanDerWaalsContact OH-O 3.13Å; Y437-V563 HydrophobicContact CD2-CG1 4.32Å; Y437-V563 HydrophobicContact CE1-CG2 4.37Å; Y437-V563 HydrophobicContact CE2-CB 3.93Å; Y437-V563 HydrophobicContact CE2-CG1 3.76Å; Y437-V563 HydrophobicContact CE2-CG2 3.63Å; Y437-V563 WeakPolarHBondContact OH-CA 3.48Å; Y437-V563 WeakPolarHBondContact OH-CG2 3.46Å; Y437-S566 PolarHBondContact OH-OG 2.9Å
438	R	86.5	Confident	91	Very high	116 Å²	116	39.7 Å²	39.7	44%	0.438	18%	0.182	S	C	.	.	H	α-helix	trans	-70.3	-29.8	173.3	-79.3	-173.5	-66.7	-116.2	-1.4	113	P434 A435 L436 K440 E441 Y473	P434-R438 WeakPolarHBondContact O-CB 3.3Å; P434-R438 VanDerWaalsContact O-CG 3.27Å; P434-R438 WeakPolarHBondContact O-CG 3.28Å; P434-R438 PolarHBondContact O-N 2.99Å; P434-R438 PolarHBondContact O-NE 3.25Å; P434-R438 VanDerWaalsContact O-NE 3.14Å; A435-R438 PolarHBondContact O-N 3.48Å; L436-R438 PolarHBondContact O-N 3.32Å; R438-K440 PolarHBondContact O-N 2.9Å; R438-K440 VanDerWaalsContact O-N 3.14Å; R438-E441 PolarHBondContact O-N 2.97Å; R438-Y473 VanDerWaalsContact CG-OH 3.3Å; R438-Y473 WeakPolarHBondContact CG-OH 3.23Å
439	T	82.7	Confident	90.6	Very high	8 Å²	8	39.8 Å²	39.8	5%	0.049	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-73.1	-1.5	-177.8	-48.6	0	0	0	0	112.4	V397 S398 A435 L436 Y437 E441 H442 I447 V451	V397-T439 VanDerWaalsContact O-CG2 3.32Å; V397-T439 WeakPolarHBondContact O-CG2 3.46Å; V397-T439 PolarHBondContact O-OG1 2.84Å; S398-T439 WeakPolarHBondContact CA-OG1 3.32Å; A435-T439 PolarHBondContact O-N 3.39Å; A435-T439 VanDerWaalsContact O-N 3.08Å; A435-T439 PolarHBondContact O-OG1 3.26Å; L436-T439 PolarHBondContact O-N 2.89Å; L436-T439 VanDerWaalsContact O-N 3.17Å; Y437-T439 VanDerWaalsContact C-N 3.33Å; T439-E441 PolarHBondContact O-N 3.37Å; T439-H442 HydrophobicContact CG2-CB 4.26Å; T439-H442 WeakPolarHBondContact O-CB 3.43Å; T439-H442 PolarHBondContact O-N 2.99Å; T439-I447 HydrophobicContact CG2-CG2 3.76Å; T439-V451 HydrophobicContact CG2-CG2 3.8Å
440	K	77.9	Confident	90.4	Very high	34 Å²	34	40 Å²	40	15%	0.148	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-64	-14.3	170.3	78.2	-176.1	-178.5	164	0	114.3	Y437 R438 H448 S566 L570	Y437-K440 HydrophobicContact CE1-CD 4.31Å; Y437-K440 HydrophobicContact CE2-CD 4.29Å; Y437-K440 VanDerWaalsContact CZ-NZ 3.34Å; Y437-K440 VanDerWaalsContact O-CD 3.26Å; Y437-K440 WeakPolarHBondContact O-CD 3.47Å; Y437-K440 WeakPolarHBondContact O-CG 3.37Å; Y437-K440 PolarHBondContact OH-NZ 3.29Å; R438-K440 PolarHBondContact O-N 2.9Å; R438-K440 VanDerWaalsContact O-N 3.14Å; K440-H448 PolarHBondContact O-CE1 2.88Å; K440-H448 PolarHBondContact O-NE2 2.67Å; K440-S566 PolarHBondContact NZ-OG 3.11Å; K440-L570 HydrophobicContact CB-CD1 4.05Å; K440-L570 HydrophobicContact CB-CD2 4.21Å; K440-L570 HydrophobicContact CB-CG 4.46Å
441	E	81.4	Confident	90.3	Very high	134 Å²	134	37.9 Å²	37.9	63%	0.626	17%	0.17	S	C	*	.	G	3₁₀ helix	trans	-99.6	16.8	178.7	-65.2	169	-158.3	0	0	112	R438 T439	R438-E441 PolarHBondContact O-N 2.97Å; T439-E441 PolarHBondContact O-N 3.37Å
442	H	88.6	Confident	90	Very high	21 Å²	21	37.5 Å²	37.5	10%	0.097	17%	0.166	C	C	.	.			trans	-68.4	149	-179	-161	-77.4	0	0	0	110.9	S399 T439 N444 I447 H448	S399-H442 PolarHBondContact O-NE2 3.32Å; T439-H442 HydrophobicContact CG2-CB 4.26Å; T439-H442 WeakPolarHBondContact O-CB 3.43Å; T439-H442 PolarHBondContact O-N 2.99Å; H442-N444 VanDerWaalsContact ND1-CB 3.34Å; H442-N444 WeakPolarHBondContact ND1-CB 3.5Å; H442-N444 PolarHBondContact ND1-N 3.12Å; H442-N444 PolarHBondContact O-N 3.27Å; H442-I447 HydrophobicContact CB-CB 4.46Å; H442-I447 HydrophobicContact CB-CG2 4.18Å; H442-H448 WeakPolarHBondContact CA-NE2 3.46Å; H442-H448 PolarHBondContact N-NE2 3.1Å; H442-H448 PolarHBondContact O-CE1 3.39Å; H442-H448 PolarHBondContact O-NE2 3.03Å
443	W	92.4	Very high	89.8	Confident	163 Å²	163	38.8 Å²	38.8	62%	0.617	17%	0.173	S	C	*	.	S	Bend	trans	-75.7	-8.6	179.8	68.2	-90.2	0	0	0	113.5	P400 F402	P400-W443 PolarHBondContact O-NE1 3.07Å; F402-W443 HydrophobicContact CB-CZ2 4.27Å; F402-W443 HydrophobicContact CD1-CZ2 4.29Å
444	N	90.3	Very high	89.7	Confident	25 Å²	25	38.8 Å²	38.8	13%	0.134	17%	0.173	C	C	.	.			trans	-114.6	119.2	-169.3	-177.3	-33.4	0	0	0	109.5	H442 T446 I447 H448	H442-N444 VanDerWaalsContact ND1-CB 3.34Å; H442-N444 WeakPolarHBondContact ND1-CB 3.5Å; H442-N444 PolarHBondContact ND1-N 3.12Å; H442-N444 PolarHBondContact O-N 3.27Å; N444-T446 PolarHBondContact O-N 3.43Å; N444-T446 WeakPolarHBondContact OD1-CB 3.39Å; N444-T446 PolarHBondContact OD1-N 3.4Å; N444-T446 PolarHBondContact OD1-OG1 3.34Å; N444-I447 HydrophobicContact CB-CG1 4Å; N444-I447 WeakPolarHBondContact O-CB 3.46Å; N444-I447 PolarHBondContact O-N 2.93Å; N444-H448 PolarHBondContact O-N 3.23Å
445	K	90.5	Very high	89.7	Confident	154 Å²	154	37.8 Å²	37.8	67%	0.67	17%	0.167	S	C	*	.	H	α-helix	trans	-64.7	-34.5	-176.1	-62.8	-177.1	178	-177.6	0	113.6	I447 H448 G449	K445-I447 VanDerWaalsContact C-N 3.26Å; K445-I447 PolarHBondContact O-N 3.06Å; K445-H448 WeakPolarHBondContact O-CB 3.29Å; K445-H448 PolarHBondContact O-N 2.95Å; K445-H448 VanDerWaalsContact O-N 3.1Å; K445-G449 PolarHBondContact O-N 3.19Å
446	T	90.6	Very high	89.6	Confident	41 Å²	41	41.6 Å²	41.6	25%	0.252	18%	0.183	S	C	.	.	H	α-helix	trans	-60.3	-40	176.5	-51.7	0	0	0	0	110.8	N444 H448 G449 L450 L580	N444-T446 PolarHBondContact O-N 3.43Å; N444-T446 WeakPolarHBondContact OD1-CB 3.39Å; N444-T446 PolarHBondContact OD1-N 3.4Å; N444-T446 PolarHBondContact OD1-OG1 3.34Å; T446-H448 VanDerWaalsContact C-N 3.33Å; T446-H448 PolarHBondContact O-N 2.98Å; T446-G449 PolarHBondContact O-N 3.05Å; T446-L450 WeakPolarHBondContact O-CG 3.34Å; T446-L450 PolarHBondContact O-N 3.01Å; T446-L450 VanDerWaalsContact O-N 3.09Å; T446-L580 HydrophobicContact CG2-CD1 3.47Å; T446-L580 VanDerWaalsContact CG2-CD1 3.47Å
447	I	92.2	Very high	89.6	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-64	-40.3	176.3	-58.2	-58.4	0	0	0	110.8	A405 E406 L409 T439 H442 N444 K445 G449 L450 V451	A405-I447 HydrophobicContact CB-CD1 3.97Å; A405-I447 HydrophobicContact CB-CG2 4.42Å; E406-I447 HydrophobicContact CB-CD1 3.74Å; L409-I447 HydrophobicContact CD1-CG2 4.02Å; T439-I447 HydrophobicContact CG2-CG2 3.76Å; H442-I447 HydrophobicContact CB-CB 4.46Å; H442-I447 HydrophobicContact CB-CG2 4.18Å; N444-I447 HydrophobicContact CB-CG1 4Å; N444-I447 WeakPolarHBondContact O-CB 3.46Å; N444-I447 PolarHBondContact O-N 2.93Å; K445-I447 VanDerWaalsContact C-N 3.26Å; K445-I447 PolarHBondContact O-N 3.06Å; I447-G449 VanDerWaalsContact C-N 3.34Å; I447-G449 PolarHBondContact O-N 3.14Å; I447-L450 PolarHBondContact O-N 3.36Å; I447-V451 HydrophobicContact CG2-CG2 4.07Å; I447-V451 WeakPolarHBondContact O-CB 3.45Å; I447-V451 VanDerWaalsContact O-CG2 3.25Å; I447-V451 WeakPolarHBondContact O-CG2 3.3Å; I447-V451 PolarHBondContact O-N 3.36Å
448	H	91.2	Very high	89.9	Confident	17 Å²	17	42.1 Å²	42.1	8%	0.079	19%	0.186	C	C	.	.	H	α-helix	trans	-58.2	-45.8	177.2	-68.1	-176.2	0	0	0	112.2	K440 H442 N444 K445 T446 V451 Y452 L570 E573	K440-H448 PolarHBondContact O-CE1 2.88Å; K440-H448 PolarHBondContact O-NE2 2.67Å; H442-H448 WeakPolarHBondContact CA-NE2 3.46Å; H442-H448 PolarHBondContact N-NE2 3.1Å; H442-H448 PolarHBondContact O-CE1 3.39Å; H442-H448 PolarHBondContact O-NE2 3.03Å; N444-H448 PolarHBondContact O-N 3.23Å; K445-H448 WeakPolarHBondContact O-CB 3.29Å; K445-H448 PolarHBondContact O-N 2.95Å; K445-H448 VanDerWaalsContact O-N 3.1Å; T446-H448 VanDerWaalsContact C-N 3.33Å; T446-H448 PolarHBondContact O-N 2.98Å; H448-V451 PolarHBondContact O-N 2.99Å; H448-Y452 WeakPolarHBondContact O-CB 3.45Å; H448-Y452 PolarHBondContact O-N 3.11Å; H448-L570 HydrophobicContact CB-CD2 3.71Å; H448-E573 WeakPolarHBondContact CB-OE2 3.34Å; H448-E573 IonicContact CE1-OE2 2.64Å; H448-E573 IonicContact CG-OE2 2.84Å; H448-E573 IonicContact ND1-OE2 3.48Å; H448-E573 PolarHBondContact ND1-OE2 2.81Å
449	G	90	Very high	90.2	Very high	2 Å²	2	39 Å²	39	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-69.1	-35	178.7	0	0	0	0	0	113.8	K445 T446 I447 Y452 N453 L580	K445-G449 PolarHBondContact O-N 3.19Å; T446-G449 PolarHBondContact O-N 3.05Å; I447-G449 VanDerWaalsContact C-N 3.34Å; I447-G449 PolarHBondContact O-N 3.14Å; G449-Y452 PolarHBondContact O-N 3.17Å; G449-N453 WeakPolarHBondContact O-CB 3.28Å; G449-N453 PolarHBondContact O-N 2.92Å; G449-L580 VanDerWaalsContact CA-CD2 3.48Å
450	L	92.4	Very high	90.7	Very high	5 Å²	5	44.7 Å²	44.7	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-40.8	171.8	-70.8	175.7	0	0	0	112.3	E406 L409 Y410 T446 I447 N453 A454 L580 I584	E406-L450 HydrophobicContact CB-CD1 4.49Å; E406-L450 HydrophobicContact CG-CD1 3.82Å; L409-L450 HydrophobicContact CB-CB 4.01Å; L409-L450 HydrophobicContact CB-CD1 4.23Å; L409-L450 HydrophobicContact CD1-CB 3.68Å; L409-L450 HydrophobicContact CD1-CD1 4.4Å; L409-L450 HydrophobicContact CG-CB 4.34Å; Y410-L450 HydrophobicContact CE1-CD1 4.31Å; Y410-L450 HydrophobicContact CE1-CD2 4.21Å; T446-L450 WeakPolarHBondContact O-CG 3.34Å; T446-L450 PolarHBondContact O-N 3.01Å; T446-L450 VanDerWaalsContact O-N 3.09Å; I447-L450 PolarHBondContact O-N 3.36Å; L450-N453 PolarHBondContact O-N 3.09Å; L450-A454 PolarHBondContact O-N 3.03Å; L450-L580 HydrophobicContact CG-CD1 4.41Å; L450-I584 HydrophobicContact CD2-CD1 4.17Å; L450-I584 HydrophobicContact CD2-CG1 4.05Å
451	V	92.9	Very high	91.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64	-43.7	175.2	168.8	0	0	0	0	110.9	L409 L436 T439 I447 H448 N453 A454 L455	L409-V451 HydrophobicContact CD1-CG2 3.79Å; L409-V451 HydrophobicContact CD2-CG2 4.17Å; L436-V451 HydrophobicContact CB-CG1 4.44Å; L436-V451 HydrophobicContact CD2-CG1 4.26Å; L436-V451 HydrophobicContact CD2-CG2 4.4Å; L436-V451 WeakPolarHBondContact O-CG1 3.14Å; T439-V451 HydrophobicContact CG2-CG2 3.8Å; I447-V451 HydrophobicContact CG2-CG2 4.07Å; I447-V451 WeakPolarHBondContact O-CB 3.45Å; I447-V451 VanDerWaalsContact O-CG2 3.25Å; I447-V451 WeakPolarHBondContact O-CG2 3.3Å; I447-V451 PolarHBondContact O-N 3.36Å; H448-V451 PolarHBondContact O-N 2.99Å; V451-N453 PolarHBondContact O-N 3.33Å; V451-A454 PolarHBondContact O-N 3.36Å; V451-L455 HydrophobicContact CG1-CD1 3.97Å; V451-L455 HydrophobicContact CG1-CG 4.4Å; V451-L455 WeakPolarHBondContact O-CG 3.1Å; V451-L455 PolarHBondContact O-N 3.48Å
452	Y	90.7	Very high	92.1	Very high	31 Å²	31	40.4 Å²	40.4	12%	0.122	19%	0.185	C	C	.	.	H	α-helix	trans	-56.1	-50.3	174.2	175.4	-104.6	0	0	0	111.6	H448 G449 A454 L455 K456 L567 L570 Q571 A574	H448-Y452 WeakPolarHBondContact O-CB 3.45Å; H448-Y452 PolarHBondContact O-N 3.11Å; G449-Y452 PolarHBondContact O-N 3.17Å; Y452-A454 VanDerWaalsContact C-N 3.33Å; Y452-A454 PolarHBondContact O-N 2.96Å; Y452-L455 PolarHBondContact O-N 2.92Å; Y452-K456 HydrophobicContact CE1-CD 4.31Å; Y452-K456 WeakPolarHBondContact O-CB 3.26Å; Y452-K456 PolarHBondContact O-N 3.04Å; Y452-L567 HydrophobicContact CD2-CD1 3.64Å; Y452-L567 HydrophobicContact CE2-CD1 3.8Å; Y452-L567 WeakPolarHBondContact CE2-O 3.41Å; Y452-L570 HydrophobicContact CD2-CB 3.96Å; Y452-L570 HydrophobicContact CG-CB 4.34Å; Y452-Q571 HydrophobicContact CD2-CB 4.01Å; Y452-Q571 HydrophobicContact CE1-CB 4.2Å; Y452-Q571 HydrophobicContact CE1-CG 4.06Å; Y452-Q571 HydrophobicContact CE2-CB 3.37Å; Y452-Q571 HydrophobicContact CE2-CG 3.97Å; Y452-Q571 VanDerWaalsContact CZ-CB 3.49Å; Y452-Q571 VanDerWaalsContact OH-CG 3.25Å; Y452-Q571 WeakPolarHBondContact OH-CG 3.41Å; Y452-Q571 PolarHBondContact OH-OE1 2.95Å; Y452-A574 HydrophobicContact CD1-CB 4.01Å; Y452-A574 HydrophobicContact CG-CB 4.46Å
453	N	91.3	Very high	92.4	Very high	27 Å²	27	43.6 Å²	43.6	14%	0.144	20%	0.2	C	C	.	.	H	α-helix	trans	-58.7	-44.9	178.7	-177.1	47.1	0	0	0	111.4	G449 L450 V451 K456 L457 I584	G449-N453 WeakPolarHBondContact O-CB 3.28Å; G449-N453 PolarHBondContact O-N 2.92Å; L450-N453 PolarHBondContact O-N 3.09Å; V451-N453 PolarHBondContact O-N 3.33Å; N453-K456 PolarHBondContact O-N 3.25Å; N453-L457 WeakPolarHBondContact O-CG 3.37Å; N453-L457 PolarHBondContact O-N 3.39Å; N453-I584 HydrophobicContact CB-CD1 4.45Å
454	A	94	Very high	92.5	Very high	1 Å²	1	44 Å²	44	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-43.5	176.9	0	0	0	0	0	112.8	L409 W412 L436 L450 V451 Y452 L457 F458	L409-A454 HydrophobicContact CD2-CB 4.23Å; W412-A454 HydrophobicContact CD2-CB 3.96Å; W412-A454 HydrophobicContact CG-CB 3.91Å; L436-A454 HydrophobicContact CD1-CB 4.42Å; L436-A454 HydrophobicContact CD2-CB 3.93Å; L450-A454 PolarHBondContact O-N 3.03Å; V451-A454 PolarHBondContact O-N 3.36Å; Y452-A454 VanDerWaalsContact C-N 3.33Å; Y452-A454 PolarHBondContact O-N 2.96Å; A454-L457 PolarHBondContact O-N 2.96Å; A454-F458 WeakPolarHBondContact O-CD2 3.26Å; A454-F458 PolarHBondContact O-N 3.27Å; A454-F458 VanDerWaalsContact O-N 3.11Å
455	L	93.1	Very high	92.8	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-62.3	-42.1	175.7	-75.2	171.4	0	0	0	111.7	F433 L436 V451 Y452 F458 M459 F466 L567 L570	F433-L455 HydrophobicContact CD2-CD2 4.46Å; L436-L455 HydrophobicContact CB-CD2 3.79Å; L436-L455 HydrophobicContact CB-CG 4.16Å; L436-L455 HydrophobicContact CD1-CD2 4.23Å; V451-L455 HydrophobicContact CG1-CD1 3.97Å; V451-L455 HydrophobicContact CG1-CG 4.4Å; V451-L455 WeakPolarHBondContact O-CG 3.1Å; V451-L455 PolarHBondContact O-N 3.48Å; Y452-L455 PolarHBondContact O-N 2.92Å; L455-F458 PolarHBondContact O-N 3.32Å; L455-M459 WeakPolarHBondContact O-CB 3.35Å; L455-M459 PolarHBondContact O-N 2.96Å; L455-F466 HydrophobicContact CB-CE2 4.49Å; L455-F466 HydrophobicContact CD2-CE2 4Å; L455-F466 HydrophobicContact CD2-CZ 4.28Å; L455-L567 HydrophobicContact CB-CD1 4.07Å; L455-L567 HydrophobicContact CD1-CD1 4.11Å; L455-L570 HydrophobicContact CD1-CD1 4.27Å
456	K	91.8	Very high	93	Very high	80 Å²	80	37.4 Å²	37.4	35%	0.348	18%	0.178	S	C	.	.	H	α-helix	trans	-61.9	-45.4	176.7	-176.5	179.1	175.2	-179.4	0	111.9	Y452 N453 F458 M459 E460	Y452-K456 HydrophobicContact CE1-CD 4.31Å; Y452-K456 WeakPolarHBondContact O-CB 3.26Å; Y452-K456 PolarHBondContact O-N 3.04Å; N453-K456 PolarHBondContact O-N 3.25Å; K456-F458 VanDerWaalsContact C-N 3.34Å; K456-F458 PolarHBondContact O-N 3.34Å; K456-M459 WeakPolarHBondContact O-CB 3.38Å; K456-M459 PolarHBondContact O-N 3.17Å; K456-E460 WeakPolarHBondContact CE-OE1 3.46Å; K456-E460 WeakPolarHBondContact O-CG 3.49Å; K456-E460 PolarHBondContact O-N 2.92Å
457	L	93.3	Very high	93.1	Very high	19 Å²	19	39.3 Å²	39.3	10%	0.099	19%	0.187	C	C	.	.	H	α-helix	trans	-60	-42.9	176.6	-71.1	168.1	0	0	0	111.8	W412 L418 N453 A454 M459 E460 M461	W412-L457 HydrophobicContact CB-CD1 4.04Å; W412-L457 HydrophobicContact CG-CD1 4.47Å; L418-L457 HydrophobicContact CD1-CD1 4.21Å; N453-L457 WeakPolarHBondContact O-CG 3.37Å; N453-L457 PolarHBondContact O-N 3.39Å; A454-L457 PolarHBondContact O-N 2.96Å; L457-M459 VanDerWaalsContact C-N 3.34Å; L457-M459 PolarHBondContact O-N 3.48Å; L457-E460 PolarHBondContact O-N 3.35Å; L457-M461 VanDerWaalsContact O-CG 3.3Å; L457-M461 WeakPolarHBondContact O-CG 3.49Å; L457-M461 PolarHBondContact O-N 3.29Å
458	F	94.7	Very high	93.2	Very high	1 Å²	1	42.8 Å²	42.8	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-65.4	-36.9	175.7	-83.6	-57.2	0	0	0	113.6	W412 M421 V425 I428 L429 M432 L436 A454 L455 K456 E460 M461 N462 F466	W412-F458 AromaticContact CE2-CE2 3.53Å; W412-F458 AromaticContact CE2-CZ 3.87Å; W412-F458 AromaticContact CZ2-CE2 3.43Å; W412-F458 HydrophobicContact CZ2-CE2 3.43Å; W412-F458 VanDerWaalsContact CZ2-CE2 3.43Å; W412-F458 AromaticContact CZ2-CZ 3.66Å; W412-F458 HydrophobicContact CZ2-CZ 3.66Å; W412-F458 AromaticContact NE1-CD2 3.74Å; W412-F458 AromaticContact NE1-CE2 3.14Å; W412-F458 AromaticContact NE1-CZ 3.46Å; M421-F458 HydrophobicContact SD-CZ 4.4Å; V425-F458 HydrophobicContact CG2-CD1 4.28Å; I428-F458 HydrophobicContact CG2-CE1 4.09Å; I428-F458 HydrophobicContact CG2-CZ 4.01Å; L429-F458 HydrophobicContact CB-CD1 4.33Å; L429-F458 HydrophobicContact CB-CE1 4.49Å; L429-F458 HydrophobicContact CD1-CB 3.75Å; L429-F458 HydrophobicContact CD1-CD1 3.79Å; L429-F458 HydrophobicContact CD1-CD2 4.03Å; L429-F458 HydrophobicContact CD1-CE1 4.37Å; L429-F458 HydrophobicContact CD1-CG 3.61Å; L429-F458 HydrophobicContact CD2-CB 4.47Å; L429-F458 HydrophobicContact CG-CD1 4.47Å; M432-F458 HydrophobicContact CB-CE2 4.17Å; M432-F458 HydrophobicContact CB-CZ 4.26Å; M432-F458 HydrophobicContact CG-CZ 4.4Å; L436-F458 HydrophobicContact CD1-CD2 3.86Å; L436-F458 HydrophobicContact CD1-CE2 3.7Å; A454-F458 WeakPolarHBondContact O-CD2 3.26Å; A454-F458 PolarHBondContact O-N 3.27Å; A454-F458 VanDerWaalsContact O-N 3.11Å; L455-F458 PolarHBondContact O-N 3.32Å; K456-F458 VanDerWaalsContact C-N 3.34Å; K456-F458 PolarHBondContact O-N 3.34Å; F458-E460 VanDerWaalsContact C-N 3.34Å; F458-M461 HydrophobicContact CD1-SD 3.96Å; F458-M461 HydrophobicContact CE1-SD 4.32Å; F458-M461 PolarHBondContact O-N 2.73Å; F458-N462 PolarHBondContact O-N 3.09Å; F458-N462 VanDerWaalsContact O-N 3.17Å; F458-F466 HydrophobicContact CB-CD2 4.24Å
459	M	92.7	Very high	93.4	Very high	51 Å²	51	42.6 Å²	42.6	25%	0.251	21%	0.211	S	C	.	.	H	α-helix	trans	-63.7	-41.6	175	-173.6	176.7	70	0	0	111.1	L455 K456 L457 N462 Q463 F466 L567	L455-M459 WeakPolarHBondContact O-CB 3.35Å; L455-M459 PolarHBondContact O-N 2.96Å; K456-M459 WeakPolarHBondContact O-CB 3.38Å; K456-M459 PolarHBondContact O-N 3.17Å; L457-M459 VanDerWaalsContact C-N 3.34Å; L457-M459 PolarHBondContact O-N 3.48Å; M459-N462 CarbonylContact O-C 3.3Å; M459-Q463 PolarHBondContact O-N 3.27Å; M459-Q463 VanDerWaalsContact O-N 3.14Å; M459-F466 HydrophobicContact CB-CD1 4.4Å; M459-F466 HydrophobicContact CB-CD2 4.07Å; M459-F466 HydrophobicContact CB-CE2 4.24Å; M459-F466 HydrophobicContact CB-CG 4.15Å; M459-F466 HydrophobicContact CB-CZ 4.48Å; M459-F466 HydrophobicContact CG-CD1 4.25Å; M459-F466 HydrophobicContact CG-CG 4.36Å; M459-F466 HydrophobicContact SD-CE1 4.49Å; M459-L567 HydrophobicContact SD-CD2 4.29Å
460	E	93.4	Very high	93.4	Very high	127 Å²	127	43.2 Å²	43.2	59%	0.593	22%	0.215	S	C	*	.	H	α-helix	trans	-65.7	-35.2	174.8	-71.2	172.6	-174.7	0	0	112.7	K456 L457 F458	K456-E460 WeakPolarHBondContact CE-OE1 3.46Å; K456-E460 WeakPolarHBondContact O-CG 3.49Å; K456-E460 PolarHBondContact O-N 2.92Å; L457-E460 PolarHBondContact O-N 3.35Å; F458-E460 VanDerWaalsContact C-N 3.34Å
461	M	93.9	Very high	93.4	Very high	33 Å²	33	47.6 Å²	47.6	16%	0.163	24%	0.235	C	C	.	.	H	α-helix	trans	-66.2	-46.9	176.5	-71.5	176.3	174.1	0	0	112.7	L418 M421 H422 V425 L457 F458	L418-M461 HydrophobicContact CD1-CE 3.31Å; L418-M461 HydrophobicContact CG-CE 3.67Å; L418-M461 WeakPolarHBondContact O-CE 3.43Å; M421-M461 HydrophobicContact CB-CE 4.23Å; H422-M461 HydrophobicContact CB-CE 4.2Å; H422-M461 HydrophobicContact CB-SD 4.48Å; V425-M461 HydrophobicContact CG2-CB 4.11Å; V425-M461 HydrophobicContact CG2-SD 4.32Å; L457-M461 VanDerWaalsContact O-CG 3.3Å; L457-M461 WeakPolarHBondContact O-CG 3.49Å; L457-M461 PolarHBondContact O-N 3.29Å; F458-M461 HydrophobicContact CD1-SD 3.96Å; F458-M461 HydrophobicContact CE1-SD 4.32Å; F458-M461 PolarHBondContact O-N 2.73Å
462	N	94.1	Very high	93.4	Very high	45 Å²	45	54.5 Å²	54.5	24%	0.241	26%	0.261	C	S	.	.			trans	-157.6	89	-179.9	-168.6	-28.3	0	0	0	112.3	V425 F458 M459 K464 L465 F466	V425-N462 HydrophobicContact CG1-CB 4.12Å; V425-N462 HydrophobicContact CG2-CB 4.42Å; F458-N462 PolarHBondContact O-N 3.09Å; F458-N462 VanDerWaalsContact O-N 3.17Å; M459-N462 CarbonylContact O-C 3.3Å; N462-K464 PolarHBondContact O-N 3.12Å; N462-K464 PolarHBondContact OD1-N 3.14Å; N462-L465 HydrophobicContact CB-CB 4Å; N462-L465 VanDerWaalsContact CG-CB 3.46Å; N462-L465 PolarHBondContact O-N 3.06Å; N462-L465 WeakPolarHBondContact OD1-CB 3.34Å; N462-L465 PolarHBondContact OD1-N 3.03Å; N462-F466 WeakPolarHBondContact O-CB 3.48Å; N462-F466 PolarHBondContact O-N 3.01Å
463	Q	94.3	Very high	93.4	Very high	88 Å²	88	53.7 Å²	53.7	41%	0.411	26%	0.258	S	S	.	.	H	α-helix	trans	-52.5	-47.6	178.7	-175.8	67.5	48.6	0	0	113.2	M459 L465 F466 D467	M459-Q463 PolarHBondContact O-N 3.27Å; M459-Q463 VanDerWaalsContact O-N 3.14Å; Q463-L465 VanDerWaalsContact C-N 3.32Å; Q463-L465 PolarHBondContact O-N 3.48Å; Q463-F466 WeakPolarHBondContact O-CB 3.41Å; Q463-F466 PolarHBondContact O-N 3.09Å; Q463-D467 PolarHBondContact NE2-OD1 3.1Å; Q463-D467 PolarHBondContact NE2-OD2 3.26Å; Q463-D467 VanDerWaalsContact O-CG 3.25Å; Q463-D467 PolarHBondContact O-N 3.24Å
464	K	95.6	Very high	93.3	Very high	171 Å²	171	55.2 Å²	55.2	74%	0.743	26%	0.264	S	S	*	.	H	α-helix	trans	-63.5	-40.6	-175.8	-68.9	-177.8	179.8	176.9	0	111.8	N462 S468	N462-K464 PolarHBondContact O-N 3.12Å; N462-K464 PolarHBondContact OD1-N 3.14Å; K464-S468 WeakPolarHBondContact O-CB 3.48Å; K464-S468 PolarHBondContact O-N 2.81Å; K464-S468 VanDerWaalsContact O-N 3.08Å; K464-S468 PolarHBondContact O-OG 3.13Å
465	L	95.7	Very high	93.2	Very high	33 Å²	33	60.1 Å²	60.1	17%	0.173	29%	0.286	C	S	.	.	H	α-helix	trans	-69.4	-40.4	176.6	-176.8	65.6	0	0	0	111	V425 E426 L429 N462 Q463 D467 S468 C469	V425-L465 HydrophobicContact CG1-CD2 4.48Å; V425-L465 HydrophobicContact CG2-CD2 4.33Å; V425-L465 WeakPolarHBondContact O-CD2 3.5Å; E426-L465 HydrophobicContact CG-CD2 4.45Å; L429-L465 HydrophobicContact CB-CD2 4.04Å; L429-L465 HydrophobicContact CD2-CB 4.29Å; L429-L465 HydrophobicContact CD2-CD2 3.94Å; L429-L465 HydrophobicContact CD2-CG 3.93Å; L429-L465 HydrophobicContact CG-CD2 4.45Å; N462-L465 HydrophobicContact CB-CB 4Å; N462-L465 VanDerWaalsContact CG-CB 3.46Å; N462-L465 PolarHBondContact O-N 3.06Å; N462-L465 WeakPolarHBondContact OD1-CB 3.34Å; N462-L465 PolarHBondContact OD1-N 3.03Å; Q463-L465 VanDerWaalsContact C-N 3.32Å; Q463-L465 PolarHBondContact O-N 3.48Å; L465-D467 PolarHBondContact O-N 3.41Å; L465-S468 WeakPolarHBondContact O-CB 3.37Å; L465-S468 PolarHBondContact O-N 3.18Å; L465-C469 WeakPolarHBondContact O-CB 3.32Å; L465-C469 PolarHBondContact O-N 2.73Å; L465-C469 PolarHBondContact O-SG 3.05Å; L465-C469 VanDerWaalsContact O-SG 3.4Å
466	F	94.1	Very high	93.1	Very high	9 Å²	9	64.2 Å²	64.2	4%	0.039	31%	0.305	C	S	.	.	H	α-helix	trans	-58.3	-46.6	175.8	-173.2	-86.5	0	0	0	112	L429 F433 L455 F458 M459 N462 Q463 S468 C469 T470	L429-F466 HydrophobicContact CD1-CD2 4.44Å; L429-F466 HydrophobicContact CD2-CB 4.16Å; L429-F466 HydrophobicContact CD2-CD2 4.41Å; F433-F466 HydrophobicContact CD2-CD2 4.31Å; F433-F466 HydrophobicContact CD2-CE2 4.05Å; F433-F466 HydrophobicContact CD2-CZ 4.47Å; F433-F466 HydrophobicContact CE2-CD2 4.26Å; F433-F466 HydrophobicContact CE2-CE1 4.19Å; F433-F466 AromaticContact CE2-CE2 3.81Å; F433-F466 HydrophobicContact CE2-CE2 3.81Å; F433-F466 AromaticContact CE2-CZ 3.78Å; F433-F466 HydrophobicContact CE2-CZ 3.78Å; L455-F466 HydrophobicContact CB-CE2 4.49Å; L455-F466 HydrophobicContact CD2-CE2 4Å; L455-F466 HydrophobicContact CD2-CZ 4.28Å; F458-F466 HydrophobicContact CB-CD2 4.24Å; M459-F466 HydrophobicContact CB-CD1 4.4Å; M459-F466 HydrophobicContact CB-CD2 4.07Å; M459-F466 HydrophobicContact CB-CE2 4.24Å; M459-F466 HydrophobicContact CB-CG 4.15Å; M459-F466 HydrophobicContact CB-CZ 4.48Å; M459-F466 HydrophobicContact CG-CD1 4.25Å; M459-F466 HydrophobicContact CG-CG 4.36Å; M459-F466 HydrophobicContact SD-CE1 4.49Å; N462-F466 WeakPolarHBondContact O-CB 3.48Å; N462-F466 PolarHBondContact O-N 3.01Å; Q463-F466 WeakPolarHBondContact O-CB 3.41Å; Q463-F466 PolarHBondContact O-N 3.09Å; F466-S468 VanDerWaalsContact C-N 3.33Å; F466-S468 PolarHBondContact O-N 3.45Å; F466-C469 PolarHBondContact O-N 2.7Å; F466-T470 WeakPolarHBondContact O-CB 3.04Å; F466-T470 PolarHBondContact O-N 3.45Å; F466-T470 PolarHBondContact O-OG1 3.39Å
467	D	93.4	Very high	92.9	Very high	81 Å²	81	64.6 Å²	64.6	43%	0.433	30%	0.304	S	S	.	.	H	α-helix	trans	-63.1	-40.3	176.1	-62.9	-26.1	0	0	0	111.4	Q463 L465 T470 Q471	Q463-D467 PolarHBondContact NE2-OD1 3.1Å; Q463-D467 PolarHBondContact NE2-OD2 3.26Å; Q463-D467 VanDerWaalsContact O-CG 3.25Å; Q463-D467 PolarHBondContact O-N 3.24Å; L465-D467 PolarHBondContact O-N 3.41Å; D467-T470 WeakPolarHBondContact O-CB 3.38Å; D467-T470 PolarHBondContact O-N 2.87Å; D467-Q471 PolarHBondContact O-N 3.23Å
468	S	94.7	Very high	92.7	Very high	74 Å²	74	68 Å²	68	52%	0.517	32%	0.32	S	S	.	.	H	α-helix	trans	-65.1	-43.2	177	-58.9	0	0	0	0	112.2	K464 L465 F466 T470 Q471 R472	K464-S468 WeakPolarHBondContact O-CB 3.48Å; K464-S468 PolarHBondContact O-N 2.81Å; K464-S468 VanDerWaalsContact O-N 3.08Å; K464-S468 PolarHBondContact O-OG 3.13Å; L465-S468 WeakPolarHBondContact O-CB 3.37Å; L465-S468 PolarHBondContact O-N 3.18Å; F466-S468 VanDerWaalsContact C-N 3.33Å; F466-S468 PolarHBondContact O-N 3.45Å; S468-T470 VanDerWaalsContact C-N 3.31Å; S468-Q471 PolarHBondContact O-N 2.96Å; S468-R472 WeakPolarHBondContact O-CB 3.46Å; S468-R472 PolarHBondContact O-N 3.17Å
469	C	94.3	Very high	92.6	Very high	12 Å²	12	75.2 Å²	75.2	8%	0.081	35%	0.351	C	S	.	.	H	α-helix	trans	-63.8	-38.7	174.7	-75	0	0	0	0	111.6	F433 L465 F466 R472 Y473	F433-C469 HydrophobicContact CB-CB 4.21Å; F433-C469 HydrophobicContact CD1-CB 4.26Å; F433-C469 HydrophobicContact CD2-CB 4.2Å; F433-C469 HydrophobicContact CG-CB 3.96Å; L465-C469 WeakPolarHBondContact O-CB 3.32Å; L465-C469 PolarHBondContact O-N 2.73Å; L465-C469 PolarHBondContact O-SG 3.05Å; L465-C469 VanDerWaalsContact O-SG 3.4Å; F466-C469 PolarHBondContact O-N 2.7Å; C469-R472 PolarHBondContact O-N 3.05Å; C469-Y473 VanDerWaalsContact O-CB 3.3Å; C469-Y473 WeakPolarHBondContact O-CB 3.32Å; C469-Y473 PolarHBondContact O-N 3.34Å
470	T	91.9	Very high	92.5	Very high	15 Å²	15	76.4 Å²	76.4	9%	0.092	36%	0.364	C	S	.	.	H	α-helix	trans	-59.2	-50.5	174.7	-62.7	0	0	0	0	111.2	F433 F466 D467 S468 Y473 K474 V563	F433-T470 WeakPolarHBondContact CE2-OG1 3.17Å; F433-T470 HydrophobicContact CZ-CG2 4.31Å; F433-T470 WeakPolarHBondContact CZ-OG1 3.48Å; F466-T470 WeakPolarHBondContact O-CB 3.04Å; F466-T470 PolarHBondContact O-N 3.45Å; F466-T470 PolarHBondContact O-OG1 3.39Å; D467-T470 WeakPolarHBondContact O-CB 3.38Å; D467-T470 PolarHBondContact O-N 2.87Å; S468-T470 VanDerWaalsContact C-N 3.31Å; T470-Y473 PolarHBondContact O-N 3.42Å; T470-K474 WeakPolarHBondContact O-CG 3.47Å; T470-K474 PolarHBondContact O-N 3.08Å; T470-K474 VanDerWaalsContact O-N 3.13Å; T470-V563 HydrophobicContact CG2-CB 3.7Å; T470-V563 HydrophobicContact CG2-CG1 3.65Å; T470-V563 HydrophobicContact CG2-CG2 3.42Å; T470-V563 VanDerWaalsContact CG2-CG2 3.42Å
471	Q	92.1	Very high	92.3	Very high	97 Å²	97	74.4 Å²	74.4	45%	0.453	35%	0.352	S	S	.	.	H	α-helix	trans	-62.8	-46.9	179.2	-179	55.7	28.9	0	0	111.7	D467 S468 Y473 K474 E475	D467-Q471 PolarHBondContact O-N 3.23Å; S468-Q471 PolarHBondContact O-N 2.96Å; Q471-Y473 VanDerWaalsContact C-N 3.29Å; Q471-Y473 PolarHBondContact O-N 3.29Å; Q471-K474 WeakPolarHBondContact O-CB 3.22Å; Q471-K474 PolarHBondContact O-N 2.95Å; Q471-K474 VanDerWaalsContact O-N 3.15Å; Q471-E475 WeakPolarHBondContact CG-OE1 3.41Å; Q471-E475 PolarHBondContact NE2-OE1 3.35Å; Q471-E475 WeakPolarHBondContact O-CG 3.49Å; Q471-E475 PolarHBondContact O-N 2.88Å
472	R	92.6	Very high	92.3	Very high	146 Å²	146	77.9 Å²	77.9	55%	0.551	37%	0.367	S	S	*	.	H	α-helix	trans	-59.4	-40.3	177.1	-178.3	177.7	171.3	170	0.2	112.3	S468 C469 E475 E476	S468-R472 WeakPolarHBondContact O-CB 3.46Å; S468-R472 PolarHBondContact O-N 3.17Å; C469-R472 PolarHBondContact O-N 3.05Å; R472-E475 PolarHBondContact O-N 3.33Å; R472-E476 HydrophobicContact CG-CG 4.41Å; R472-E476 IonicContact CZ-OE1 3.8Å; R472-E476 IonicContact NE-OE1 3.7Å; R472-E476 PolarHBondContact NE-OE1 3.47Å; R472-E476 IonicContact NH2-OE1 3.69Å; R472-E476 PolarHBondContact NH2-OE1 3.24Å; R472-E476 WeakPolarHBondContact O-CB 3.41Å; R472-E476 WeakPolarHBondContact O-CG 3.47Å; R472-E476 PolarHBondContact O-N 3.31Å
473	Y	90.9	Very high	92.3	Very high	14 Å²	14	79.4 Å²	79.4	6%	0.055	37%	0.373	C	S	.	.	H	α-helix	trans	-62.6	-41.9	176.9	178.9	-92.9	0	0	0	111.9	F433 P434 Y437 R438 C469 T470 Q471 E476 R477	F433-Y473 HydrophobicContact CD1-CG 4.34Å; F433-Y473 HydrophobicContact CE1-CD1 4.44Å; F433-Y473 AromaticContact CE1-CG 4Å; F433-Y473 HydrophobicContact CE1-CG 4Å; P434-Y473 HydrophobicContact CB-CD2 3.84Å; P434-Y473 HydrophobicContact CB-CE2 3.85Å; P434-Y473 HydrophobicContact CG-CD2 4.15Å; Y437-Y473 AromaticContact CD1-CD1 3.94Å; Y437-Y473 HydrophobicContact CD1-CD1 3.94Å; Y437-Y473 AromaticContact CD1-CE1 3.3Å; Y437-Y473 HydrophobicContact CD1-CE1 3.3Å; Y437-Y473 AromaticContact CD1-CZ 3.7Å; Y437-Y473 HydrophobicContact CE1-CD1 4.22Å; Y437-Y473 AromaticContact CE1-CE1 3.62Å; Y437-Y473 HydrophobicContact CE1-CE1 3.62Å; Y437-Y473 HydrophobicContact CG-CE1 4.33Å; R438-Y473 VanDerWaalsContact CG-OH 3.3Å; R438-Y473 WeakPolarHBondContact CG-OH 3.23Å; C469-Y473 VanDerWaalsContact O-CB 3.3Å; C469-Y473 WeakPolarHBondContact O-CB 3.32Å; C469-Y473 PolarHBondContact O-N 3.34Å; T470-Y473 PolarHBondContact O-N 3.42Å; Q471-Y473 VanDerWaalsContact C-N 3.29Å; Q471-Y473 PolarHBondContact O-N 3.29Å; Y473-E476 PolarHBondContact O-N 3.14Å; Y473-R477 HydrophobicContact CD1-CG 4.41Å; Y473-R477 HydrophobicContact CE1-CG 3.87Å; Y473-R477 WeakPolarHBondContact O-CB 3.44Å; Y473-R477 PolarHBondContact O-N 3.28Å
474	K	88.8	Confident	92.2	Very high	59 Å²	59	77.2 Å²	77.2	26%	0.257	37%	0.37	S	S	.	.	H	α-helix	trans	-61.5	-46.1	174.8	-67	-176.1	-168.3	-169	0	111.6	T470 Q471 R477 Q478 E561	T470-K474 WeakPolarHBondContact O-CG 3.47Å; T470-K474 PolarHBondContact O-N 3.08Å; T470-K474 VanDerWaalsContact O-N 3.13Å; Q471-K474 WeakPolarHBondContact O-CB 3.22Å; Q471-K474 PolarHBondContact O-N 2.95Å; Q471-K474 VanDerWaalsContact O-N 3.15Å; K474-R477 PolarHBondContact O-N 3.45Å; K474-Q478 WeakPolarHBondContact O-CB 3.4Å; K474-Q478 PolarHBondContact O-N 3.12Å; K474-E561 WeakPolarHBondContact CE-O 3.31Å; K474-E561 PolarHBondContact NZ-O 2.87Å
475	E	91.6	Very high	92.1	Very high	104 Å²	104	74.8 Å²	74.8	49%	0.486	36%	0.359	S	S	.	.	H	α-helix	trans	-61.3	-44.9	177.3	-70.8	170.4	-169.2	0	0	112.1	Q471 R472 R477 Q478 K479	Q471-E475 WeakPolarHBondContact CG-OE1 3.41Å; Q471-E475 PolarHBondContact NE2-OE1 3.35Å; Q471-E475 WeakPolarHBondContact O-CG 3.49Å; Q471-E475 PolarHBondContact O-N 2.88Å; R472-E475 PolarHBondContact O-N 3.33Å; E475-R477 PolarHBondContact O-N 3.39Å; E475-Q478 PolarHBondContact O-N 3.39Å; E475-K479 WeakPolarHBondContact O-CB 3.43Å; E475-K479 PolarHBondContact O-N 3.34Å
476	E	91	Very high	92.1	Very high	89 Å²	89	78.7 Å²	78.7	42%	0.416	37%	0.372	S	S	.	.	H	α-helix	trans	-64.7	-38.9	176.9	-74.5	-179.7	-175.2	0	0	111.8	R472 Y473 S480	R472-E476 HydrophobicContact CG-CG 4.41Å; R472-E476 IonicContact CZ-OE1 3.8Å; R472-E476 IonicContact NE-OE1 3.7Å; R472-E476 PolarHBondContact NE-OE1 3.47Å; R472-E476 IonicContact NH2-OE1 3.69Å; R472-E476 PolarHBondContact NH2-OE1 3.24Å; R472-E476 WeakPolarHBondContact O-CB 3.41Å; R472-E476 WeakPolarHBondContact O-CG 3.47Å; R472-E476 PolarHBondContact O-N 3.31Å; Y473-E476 PolarHBondContact O-N 3.14Å; E476-S480 VanDerWaalsContact O-CB 3.31Å; E476-S480 WeakPolarHBondContact O-CB 3.45Å; E476-S480 PolarHBondContact O-N 3.19Å
477	R	87.7	Confident	92.1	Very high	88 Å²	88	84.7 Å²	84.7	33%	0.332	39%	0.394	S	S	.	.	H	α-helix	trans	-63.7	-44.4	173.1	-93.5	-94.9	153.9	132.6	-9	112	Y473 K474 E475 S480 R481	Y473-R477 HydrophobicContact CD1-CG 4.41Å; Y473-R477 HydrophobicContact CE1-CG 3.87Å; Y473-R477 WeakPolarHBondContact O-CB 3.44Å; Y473-R477 PolarHBondContact O-N 3.28Å; K474-R477 PolarHBondContact O-N 3.45Å; E475-R477 PolarHBondContact O-N 3.39Å; R477-S480 PolarHBondContact O-N 3.3Å; R477-R481 WeakPolarHBondContact O-CG 3.46Å; R477-R481 PolarHBondContact O-N 3.09Å
478	Q	89.8	Confident	92.1	Very high	90 Å²	90	87.4 Å²	87.4	42%	0.421	41%	0.405	S	S	.	.	H	α-helix	trans	-62.1	-49.3	175.3	-177.8	176.1	-12.2	0	0	111.2	K474 E475 S480 R481 E482	K474-Q478 WeakPolarHBondContact O-CB 3.4Å; K474-Q478 PolarHBondContact O-N 3.12Å; E475-Q478 PolarHBondContact O-N 3.39Å; Q478-S480 VanDerWaalsContact C-N 3.29Å; Q478-S480 PolarHBondContact O-N 3Å; Q478-R481 WeakPolarHBondContact O-CB 3.26Å; Q478-R481 PolarHBondContact O-N 2.86Å; Q478-R481 VanDerWaalsContact O-N 3.11Å; Q478-E482 WeakPolarHBondContact CG-OE1 3.47Å; Q478-E482 PolarHBondContact NE2-OE1 3.07Å; Q478-E482 WeakPolarHBondContact O-CG 3.34Å; Q478-E482 PolarHBondContact O-N 2.85Å
479	K	92.5	Very high	92.1	Very high	153 Å²	153	91.7 Å²	91.7	67%	0.665	41%	0.409	S	S	*	.	H	α-helix	trans	-58.9	-39.5	176.9	-173.1	178.3	-178.7	178.8	0	112.3	E475 E482 E483	E475-K479 WeakPolarHBondContact O-CB 3.43Å; E475-K479 PolarHBondContact O-N 3.34Å; K479-E482 PolarHBondContact O-N 3.27Å; K479-E483 VanDerWaalsContact O-CB 3.29Å; K479-E483 WeakPolarHBondContact O-CB 3.5Å; K479-E483 PolarHBondContact O-N 3.19Å
480	S	90.4	Very high	92.2	Very high	76 Å²	76	94.8 Å²	94.8	53%	0.531	43%	0.428	S	S	.	.	H	α-helix	trans	-65.2	-40	176.2	-171.4	0	0	0	0	112.2	E476 R477 Q478 E483 A484	E476-S480 VanDerWaalsContact O-CB 3.31Å; E476-S480 WeakPolarHBondContact O-CB 3.45Å; E476-S480 PolarHBondContact O-N 3.19Å; R477-S480 PolarHBondContact O-N 3.3Å; Q478-S480 VanDerWaalsContact C-N 3.29Å; Q478-S480 PolarHBondContact O-N 3Å; S480-E483 PolarHBondContact O-N 3.1Å; S480-A484 WeakPolarHBondContact O-CB 3.36Å; S480-A484 PolarHBondContact O-N 3.02Å
481	R	89.9	Confident	92.2	Very high	86 Å²	86	102.5 Å²	102.5	33%	0.325	46%	0.455	S	S	.	.	H	α-helix	trans	-64.8	-43.9	173.6	-73.2	-177.2	-70.2	-167.5	4.6	111.8	R477 Q478 A484 K485 E561	R477-R481 WeakPolarHBondContact O-CG 3.46Å; R477-R481 PolarHBondContact O-N 3.09Å; Q478-R481 WeakPolarHBondContact O-CB 3.26Å; Q478-R481 PolarHBondContact O-N 2.86Å; Q478-R481 VanDerWaalsContact O-N 3.11Å; R481-A484 PolarHBondContact O-N 3.32Å; R481-K485 WeakPolarHBondContact O-CG 3.32Å; R481-K485 PolarHBondContact O-N 3.48Å; R481-E561 IonicContact CZ-OE1 3.73Å; R481-E561 IonicContact NH1-OE1 3.33Å; R481-E561 IonicContact NH2-OE1 2.81Å; R481-E561 PolarHBondContact NH2-OE1 3.5Å
482	E	93.4	Very high	92.3	Very high	105 Å²	105	100.7 Å²	100.7	49%	0.491	46%	0.457	S	S	.	.	H	α-helix	trans	-62.5	-42.9	175.9	-72	171.9	-172.4	0	0	111.9	Q478 K479 K485 R486	Q478-E482 WeakPolarHBondContact CG-OE1 3.47Å; Q478-E482 PolarHBondContact NE2-OE1 3.07Å; Q478-E482 WeakPolarHBondContact O-CG 3.34Å; Q478-E482 PolarHBondContact O-N 2.85Å; K479-E482 PolarHBondContact O-N 3.27Å; E482-K485 PolarHBondContact O-N 2.89Å; E482-R486 WeakPolarHBondContact O-CB 3.3Å; E482-R486 PolarHBondContact O-N 2.9Å
483	E	93.4	Very high	92.3	Very high	78 Å²	78	98.1 Å²	98.1	36%	0.364	46%	0.458	S	S	.	.	H	α-helix	trans	-66.7	-36.8	176.6	-178.6	58.4	-158.5	0	0	112.1	K479 S480 R486 R487	K479-E483 VanDerWaalsContact O-CB 3.29Å; K479-E483 WeakPolarHBondContact O-CB 3.5Å; K479-E483 PolarHBondContact O-N 3.19Å; S480-E483 PolarHBondContact O-N 3.1Å; E483-R486 PolarHBondContact O-N 3.46Å; E483-R486 IonicContact OE1-CZ 3.38Å; E483-R486 IonicContact OE1-NE 2.67Å; E483-R486 PolarHBondContact OE1-NE 3.25Å; E483-R486 IonicContact OE1-NH2 3.83Å; E483-R486 PolarHBondContact OE1-NH2 3.07Å; E483-R486 IonicContact OE2-CZ 2.64Å; E483-R486 IonicContact OE2-NE 2.87Å; E483-R486 PolarHBondContact OE2-NE 2.96Å; E483-R486 IonicContact OE2-NH2 3.23Å; E483-R487 WeakPolarHBondContact O-CG 3.49Å; E483-R487 PolarHBondContact O-N 3.4Å
484	A	92.8	Very high	92.4	Very high	42 Å²	42	102 Å²	102	35%	0.347	48%	0.479	S	S	.	.	H	α-helix	trans	-61.8	-48.9	171.7	0	0	0	0	0	111.6	S480 R481 R486 R487 E488	S480-A484 WeakPolarHBondContact O-CB 3.36Å; S480-A484 PolarHBondContact O-N 3.02Å; R481-A484 PolarHBondContact O-N 3.32Å; A484-R486 VanDerWaalsContact C-N 3.29Å; A484-R486 PolarHBondContact O-N 3.19Å; A484-R487 PolarHBondContact O-N 3.38Å; A484-E488 PolarHBondContact O-N 2.93Å
485	K	94	Very high	92.5	Very high	119 Å²	119	101.8 Å²	101.8	52%	0.517	48%	0.484	S	S	.	.	H	α-helix	trans	-59.6	-38.8	174.2	-70.8	179	179.1	-174.5	0	111.8	R481 E482 E488 R489	R481-K485 WeakPolarHBondContact O-CG 3.32Å; R481-K485 PolarHBondContact O-N 3.48Å; E482-K485 PolarHBondContact O-N 2.89Å; K485-E488 PolarHBondContact O-N 2.89Å; K485-R489 WeakPolarHBondContact O-CG 3.26Å; K485-R489 PolarHBondContact O-N 2.82Å
486	R	94.6	Very high	92.5	Very high	116 Å²	116	102.3 Å²	102.3	44%	0.438	49%	0.487	S	S	.	.	H	α-helix	trans	-63.3	-46.8	175.8	-168.8	-165	69.8	74.4	0	111.3	E482 E483 A484 E488 R489 V490	E482-R486 WeakPolarHBondContact O-CB 3.3Å; E482-R486 PolarHBondContact O-N 2.9Å; E483-R486 PolarHBondContact O-N 3.46Å; E483-R486 IonicContact OE1-CZ 3.38Å; E483-R486 IonicContact OE1-NE 2.67Å; E483-R486 PolarHBondContact OE1-NE 3.25Å; E483-R486 IonicContact OE1-NH2 3.83Å; E483-R486 PolarHBondContact OE1-NH2 3.07Å; E483-R486 IonicContact OE2-CZ 2.64Å; E483-R486 IonicContact OE2-NE 2.87Å; E483-R486 PolarHBondContact OE2-NE 2.96Å; E483-R486 IonicContact OE2-NH2 3.23Å; A484-R486 VanDerWaalsContact C-N 3.29Å; A484-R486 PolarHBondContact O-N 3.19Å; R486-E488 VanDerWaalsContact C-N 3.33Å; R486-E488 PolarHBondContact O-N 3.5Å; R486-R489 PolarHBondContact O-N 3.2Å; R486-V490 WeakPolarHBondContact O-CG2 3.43Å; R486-V490 PolarHBondContact O-N 3.4Å
487	R	94.5	Very high	92.5	Very high	134 Å²	134	102.7 Å²	102.7	51%	0.506	50%	0.495	S	S	.	.	H	α-helix	trans	-60.6	-43	176.4	-73.6	-174.6	-62.5	-175.4	2.3	111.5	E483 A484 V490 W491	E483-R487 WeakPolarHBondContact O-CG 3.49Å; E483-R487 PolarHBondContact O-N 3.4Å; A484-R487 PolarHBondContact O-N 3.38Å; R487-V490 PolarHBondContact O-N 2.77Å; R487-W491 WeakPolarHBondContact O-CB 3.47Å; R487-W491 PolarHBondContact O-N 3.15Å
488	E	94	Very high	92.4	Very high	139 Å²	139	100.5 Å²	100.5	65%	0.65	50%	0.496	S	S	*	.	H	α-helix	trans	-58.9	-46.6	176	-174.2	178.8	-167.7	0	0	111.9	A484 K485 R486 V490 W491 A492	A484-E488 PolarHBondContact O-N 2.93Å; K485-E488 PolarHBondContact O-N 2.89Å; R486-E488 VanDerWaalsContact C-N 3.33Å; R486-E488 PolarHBondContact O-N 3.5Å; E488-V490 PolarHBondContact O-N 3.45Å; E488-W491 PolarHBondContact O-N 3.24Å; E488-A492 WeakPolarHBondContact O-CB 3.37Å; E488-A492 PolarHBondContact O-N 2.96Å
489	R	95	Very high	92.3	Very high	164 Å²	164	100.9 Å²	100.9	62%	0.619	50%	0.496	S	S	*	.	H	α-helix	trans	-60.7	-43.2	175	-68.7	173	-163	150.2	1.6	112.5	K485 R486 A492 T493	K485-R489 WeakPolarHBondContact O-CG 3.26Å; K485-R489 PolarHBondContact O-N 2.82Å; R486-R489 PolarHBondContact O-N 3.2Å; R489-A492 PolarHBondContact O-N 3.02Å; R489-T493 PolarHBondContact O-N 2.8Å; R489-T493 PolarHBondContact O-OG1 3.32Å; R489-T493 VanDerWaalsContact O-OG1 3.04Å
490	V	94.5	Very high	92.1	Very high	77 Å²	77	96.7 Å²	96.7	47%	0.467	50%	0.497	S	S	.	.	H	α-helix	trans	-63	-43.8	177.5	172.2	0	0	0	0	111	R486 R487 E488 T493 L494	R486-V490 WeakPolarHBondContact O-CG2 3.43Å; R486-V490 PolarHBondContact O-N 3.4Å; R487-V490 PolarHBondContact O-N 2.77Å; E488-V490 PolarHBondContact O-N 3.45Å; V490-T493 PolarHBondContact O-N 3.12Å; V490-L494 WeakPolarHBondContact O-CB 3.12Å; V490-L494 PolarHBondContact O-N 3.08Å
491	W	93.3	Very high	91.8	Very high	177 Å²	177	97 Å²	97	67%	0.67	49%	0.492	S	S	*	.	H	α-helix	trans	-63.6	-40.2	175.3	-84.1	113.4	0	0	0	112.5	R487 E488 L494 S495	R487-W491 WeakPolarHBondContact O-CB 3.47Å; R487-W491 PolarHBondContact O-N 3.15Å; E488-W491 PolarHBondContact O-N 3.24Å; W491-L494 HydrophobicContact CE3-CD2 3.98Å; W491-L494 HydrophobicContact CZ3-CD2 3.87Å; W491-L494 PolarHBondContact O-N 3.05Å; W491-S495 WeakPolarHBondContact O-CB 3.39Å; W491-S495 PolarHBondContact O-N 2.67Å
492	A	93.9	Very high	91.5	Very high	59 Å²	59	98.7 Å²	98.7	49%	0.488	52%	0.515	S	S	.	.	H	α-helix	trans	-62.9	-46.9	175.6	0	0	0	0	0	111.6	E488 R489 L494 S495 E496	E488-A492 WeakPolarHBondContact O-CB 3.37Å; E488-A492 PolarHBondContact O-N 2.96Å; R489-A492 PolarHBondContact O-N 3.02Å; A492-L494 PolarHBondContact O-N 2.78Å; A492-S495 PolarHBondContact O-N 2.64Å; A492-E496 PolarHBondContact O-N 3.04Å
493	T	93.3	Very high	91	Very high	92 Å²	92	98.9 Å²	98.9	56%	0.564	52%	0.518	S	S	*	.	H	α-helix	trans	-63.1	-40.7	175.8	-57.2	0	0	0	0	111.9	R489 V490 E496 T497	R489-T493 PolarHBondContact O-N 2.8Å; R489-T493 PolarHBondContact O-OG1 3.32Å; R489-T493 VanDerWaalsContact O-OG1 3.04Å; V490-T493 PolarHBondContact O-N 3.12Å; T493-E496 PolarHBondContact O-N 3.47Å; T493-T497 WeakPolarHBondContact O-CB 3.36Å; T493-T497 PolarHBondContact O-N 3.24Å; T493-T497 PolarHBondContact O-OG1 3.2Å
494	L	92.6	Very high	90.5	Very high	95 Å²	95	98.9 Å²	98.9	50%	0.497	52%	0.515	S	S	.	.	H	α-helix	trans	-63.6	-43.5	175.7	-179.6	62.7	0	0	0	111.1	V490 W491 A492 E496 T497 A498	V490-L494 WeakPolarHBondContact O-CB 3.12Å; V490-L494 PolarHBondContact O-N 3.08Å; W491-L494 HydrophobicContact CE3-CD2 3.98Å; W491-L494 HydrophobicContact CZ3-CD2 3.87Å; W491-L494 PolarHBondContact O-N 3.05Å; A492-L494 PolarHBondContact O-N 2.78Å; L494-E496 VanDerWaalsContact C-N 3.34Å; L494-E496 PolarHBondContact O-N 3.23Å; L494-T497 PolarHBondContact O-N 2.9Å; L494-A498 VanDerWaalsContact O-CB 3.27Å; L494-A498 WeakPolarHBondContact O-CB 3.27Å; L494-A498 PolarHBondContact O-N 3.43Å
495	S	90.5	Very high	89.8	Confident	54 Å²	54	100.2 Å²	100.2	38%	0.378	53%	0.526	S	S	.	.	H	α-helix	trans	-61.1	-42.7	176.1	179.7	0	0	0	0	111.6	W491 A492 A498 K499	W491-S495 WeakPolarHBondContact O-CB 3.39Å; W491-S495 PolarHBondContact O-N 2.67Å; A492-S495 PolarHBondContact O-N 2.64Å; S495-A498 PolarHBondContact O-N 3.1Å; S495-K499 WeakPolarHBondContact O-CG 3.16Å; S495-K499 PolarHBondContact O-N 3.28Å
496	E	90.9	Very high	89.1	Confident	115 Å²	115	98 Å²	98	54%	0.537	52%	0.523	S	S	.	.	H	α-helix	trans	-68.7	-41.2	178.6	-161.1	57.7	-151.6	0	0	112.2	A492 T493 L494 A498 K499 G500	A492-E496 PolarHBondContact O-N 3.04Å; T493-E496 PolarHBondContact O-N 3.47Å; L494-E496 VanDerWaalsContact C-N 3.34Å; L494-E496 PolarHBondContact O-N 3.23Å; E496-A498 VanDerWaalsContact C-N 3.3Å; E496-A498 PolarHBondContact O-N 3.2Å; E496-K499 PolarHBondContact O-N 3.43Å; E496-K499 WeakPolarHBondContact OE2-CD 3.46Å; E496-K499 IonicContact OE2-NZ 3.84Å; E496-K499 PolarHBondContact OE2-NZ 2.94Å; E496-G500 PolarHBondContact O-N 2.85Å
497	T	91	Very high	88.3	Confident	97 Å²	97	96.4 Å²	96.4	60%	0.595	53%	0.526	S	S	*	.	H	α-helix	trans	-63.1	-39	174	-52.5	0	0	0	0	111.3	T493 L494 G500	T493-T497 WeakPolarHBondContact O-CB 3.36Å; T493-T497 PolarHBondContact O-N 3.24Å; T493-T497 PolarHBondContact O-OG1 3.2Å; L494-T497 PolarHBondContact O-N 2.9Å; T497-G500 PolarHBondContact O-N 3.31Å
498	A	87.3	Confident	87.6	Confident	42 Å²	42	94.6 Å²	94.6	35%	0.347	52%	0.524	S	S	.	.	H	α-helix	trans	-64.2	-41.7	175.9	0	0	0	0	0	111.9	L494 S495 E496 G500 N501 Y504	L494-A498 VanDerWaalsContact O-CB 3.27Å; L494-A498 WeakPolarHBondContact O-CB 3.27Å; L494-A498 PolarHBondContact O-N 3.43Å; S495-A498 PolarHBondContact O-N 3.1Å; E496-A498 VanDerWaalsContact C-N 3.3Å; E496-A498 PolarHBondContact O-N 3.2Å; A498-G500 PolarHBondContact O-N 2.94Å; A498-N501 VanDerWaalsContact O-CB 3.27Å; A498-N501 WeakPolarHBondContact O-CB 3.21Å; A498-N501 PolarHBondContact O-N 3.1Å; A498-N501 VanDerWaalsContact O-N 3.09Å; A498-Y504 HydrophobicContact CB-CD2 4.45Å; A498-Y504 WeakPolarHBondContact O-CB 3.41Å; A498-Y504 WeakPolarHBondContact O-CD2 3.46Å
499	K	86.7	Confident	86.7	Confident	98 Å²	98	94.7 Å²	94.7	43%	0.426	52%	0.522	S	S	.	.	H	α-helix	trans	-60.1	-32	175.2	-72.4	172.3	-163.3	163.2	0	113.3	S495 E496 N501 Y504	S495-K499 WeakPolarHBondContact O-CG 3.16Å; S495-K499 PolarHBondContact O-N 3.28Å; E496-K499 PolarHBondContact O-N 3.43Å; E496-K499 WeakPolarHBondContact OE2-CD 3.46Å; E496-K499 IonicContact OE2-NZ 3.84Å; E496-K499 PolarHBondContact OE2-NZ 2.94Å; K499-N501 PolarHBondContact O-N 3.48Å; K499-Y504 HydrophobicContact CB-CE1 4.36Å; K499-Y504 HydrophobicContact CB-CE2 4.48Å; K499-Y504 HydrophobicContact CG-CE1 3.89Å; K499-Y504 HydrophobicContact CG-CE2 3.94Å
500	G	87.5	Confident	85.6	Confident	65 Å²	65	92.3 Å²	92.3	67%	0.67	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-10.5	176.7	0	0	0	0	0	114.7	E496 T497 A498	E496-G500 PolarHBondContact O-N 2.85Å; T497-G500 PolarHBondContact O-N 3.31Å; A498-G500 PolarHBondContact O-N 2.94Å
501	N	85.2	Confident	84.2	Confident	83 Å²	83	90.6 Å²	90.6	44%	0.444	51%	0.513	S	S	.	.	S	Bend	trans	-72.7	131.1	179.6	-169.6	-42.2	0	0	0	110.5	A498 K499 L503 Y504	A498-N501 VanDerWaalsContact O-CB 3.27Å; A498-N501 WeakPolarHBondContact O-CB 3.21Å; A498-N501 PolarHBondContact O-N 3.1Å; A498-N501 VanDerWaalsContact O-N 3.09Å; K499-N501 PolarHBondContact O-N 3.48Å; N501-L503 PolarHBondContact O-N 3.48Å; N501-L503 WeakPolarHBondContact OD1-CB 3.41Å; N501-L503 PolarHBondContact OD1-N 3.14Å; N501-Y504 WeakPolarHBondContact O-CB 3.3Å; N501-Y504 PolarHBondContact O-N 2.92Å
502	P	83.7	Confident	82.8	Confident	122 Å²	122	85.3 Å²	85.3	79%	0.792	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-29	176.7	-25.9	33.3	0	0	0	114.3	Y504	P502-Y504 VanDerWaalsContact C-N 3.33Å
503	L	83.4	Confident	81.2	Confident	109 Å²	109	86.1 Å²	86.1	57%	0.571	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-7.5	178.1	-60.4	176.6	0	0	0	113.2	N501 A505 V506 V507	N501-L503 PolarHBondContact O-N 3.48Å; N501-L503 WeakPolarHBondContact OD1-CB 3.41Å; N501-L503 PolarHBondContact OD1-N 3.14Å; L503-A505 VanDerWaalsContact C-N 3.3Å; L503-A505 PolarHBondContact O-N 3.08Å; L503-V506 WeakPolarHBondContact O-CB 3.34Å; L503-V506 PolarHBondContact O-N 3.42Å; L503-V507 WeakPolarHBondContact O-CG2 3.41Å; L503-V507 PolarHBondContact O-N 3.28Å
504	Y	81.9	Confident	79.5	Confident	77 Å²	77	85 Å²	85	30%	0.302	49%	0.494	S	S	.	.	H	α-helix	trans	-55.9	-45.3	-177.5	-178.2	-100	0	0	0	112	A498 K499 N501 P502 V506 V507 M508	A498-Y504 HydrophobicContact CB-CD2 4.45Å; A498-Y504 WeakPolarHBondContact O-CB 3.41Å; A498-Y504 WeakPolarHBondContact O-CD2 3.46Å; K499-Y504 HydrophobicContact CB-CE1 4.36Å; K499-Y504 HydrophobicContact CB-CE2 4.48Å; K499-Y504 HydrophobicContact CG-CE1 3.89Å; K499-Y504 HydrophobicContact CG-CE2 3.94Å; N501-Y504 WeakPolarHBondContact O-CB 3.3Å; N501-Y504 PolarHBondContact O-N 2.92Å; P502-Y504 VanDerWaalsContact C-N 3.33Å; Y504-V506 VanDerWaalsContact C-N 3.28Å; Y504-V506 PolarHBondContact O-N 2.7Å; Y504-V507 PolarHBondContact O-N 3.17Å; Y504-M508 HydrophobicContact CD1-CG 3.97Å; Y504-M508 HydrophobicContact CD2-CG 4.22Å; Y504-M508 HydrophobicContact CE1-CG 3.57Å; Y504-M508 HydrophobicContact CE2-CG 3.86Å; Y504-M508 HydrophobicContact CE2-SD 4.18Å; Y504-M508 HydrophobicContact CG-CG 4.28Å; Y504-M508 WeakPolarHBondContact O-CB 3.32Å; Y504-M508 VanDerWaalsContact O-CG 3.29Å; Y504-M508 WeakPolarHBondContact O-CG 3.44Å; Y504-M508 PolarHBondContact O-N 2.95Å
505	A	77.5	Confident	77.5	Confident	70 Å²	70	87 Å²	87	58%	0.579	51%	0.505	S	S	*	.	H	α-helix	trans	-63.7	-34.5	178.1	0	0	0	0	0	112.4	L503 K509	L503-A505 VanDerWaalsContact C-N 3.3Å; L503-A505 PolarHBondContact O-N 3.08Å; A505-K509 WeakPolarHBondContact O-CB 3.38Å; A505-K509 PolarHBondContact O-N 3.14Å
506	V	79.1	Confident	75.8	Confident	73 Å²	73	95.2 Å²	95.2	44%	0.442	53%	0.528	S	S	.	.	H	α-helix	trans	-68.6	-50.1	177.6	-177.4	0	0	0	0	109.8	L503 Y504 M508 K509 E510	L503-V506 WeakPolarHBondContact O-CB 3.34Å; L503-V506 PolarHBondContact O-N 3.42Å; Y504-V506 VanDerWaalsContact C-N 3.28Å; Y504-V506 PolarHBondContact O-N 2.7Å; V506-M508 PolarHBondContact O-N 3.23Å; V506-K509 WeakPolarHBondContact O-CB 3.06Å; V506-K509 PolarHBondContact O-N 2.82Å; V506-E510 WeakPolarHBondContact O-CG 3.47Å; V506-E510 PolarHBondContact O-N 2.91Å
507	V	78.9	Confident	73.5	Confident	83 Å²	83	96.8 Å²	96.8	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-64.5	-42.3	-179.9	176.7	0	0	0	0	111.6	L503 Y504 K509 E510 A511	L503-V507 WeakPolarHBondContact O-CG2 3.41Å; L503-V507 PolarHBondContact O-N 3.28Å; Y504-V507 PolarHBondContact O-N 3.17Å; V507-K509 VanDerWaalsContact C-N 3.3Å; V507-K509 PolarHBondContact O-N 3.31Å; V507-E510 PolarHBondContact O-N 3.41Å; V507-A511 WeakPolarHBondContact O-CB 3.46Å; V507-A511 PolarHBondContact O-N 3.35Å
508	M	79.8	Confident	70.8	Confident	95 Å²	95	98.3 Å²	98.3	47%	0.468	54%	0.539	S	S	.	.	H	α-helix	trans	-65.8	-35.3	176.4	-72.7	-60.3	-67.6	0	0	111.8	Y504 V506 A511 S512	Y504-M508 HydrophobicContact CD1-CG 3.97Å; Y504-M508 HydrophobicContact CD2-CG 4.22Å; Y504-M508 HydrophobicContact CE1-CG 3.57Å; Y504-M508 HydrophobicContact CE2-CG 3.86Å; Y504-M508 HydrophobicContact CE2-SD 4.18Å; Y504-M508 HydrophobicContact CG-CG 4.28Å; Y504-M508 WeakPolarHBondContact O-CB 3.32Å; Y504-M508 VanDerWaalsContact O-CG 3.29Å; Y504-M508 WeakPolarHBondContact O-CG 3.44Å; Y504-M508 PolarHBondContact O-N 2.95Å; V506-M508 PolarHBondContact O-N 3.23Å; M508-A511 PolarHBondContact O-N 3.09Å; M508-S512 WeakPolarHBondContact O-CB 3.4Å; M508-S512 PolarHBondContact O-N 3.46Å; M508-S512 PolarHBondContact O-OG 3.48Å
509	K	75.7	Confident	68.3	Low	141 Å²	141	101.4 Å²	101.4	61%	0.613	56%	0.556	S	S	*	*	H	α-helix	trans	-67.3	-45.4	174.4	-158.9	175.2	-174.9	-177.7	0	110.5	A505 V506 V507 A511 S512 I513	A505-K509 WeakPolarHBondContact O-CB 3.38Å; A505-K509 PolarHBondContact O-N 3.14Å; V506-K509 WeakPolarHBondContact O-CB 3.06Å; V506-K509 PolarHBondContact O-N 2.82Å; V507-K509 VanDerWaalsContact C-N 3.3Å; V507-K509 PolarHBondContact O-N 3.31Å; K509-A511 VanDerWaalsContact C-N 3.35Å; K509-A511 PolarHBondContact O-N 3.32Å; K509-S512 WeakPolarHBondContact CA-OG 3.43Å; K509-S512 CarbonylContact O-C 3.58Å; K509-S512 PolarHBondContact O-N 2.89Å; K509-S512 PolarHBondContact O-OG 2.97Å; K509-I513 HydrophobicContact CG-CD1 4.07Å; K509-I513 WeakPolarHBondContact O-CB 3.47Å; K509-I513 WeakPolarHBondContact O-CD1 3.48Å; K509-I513 WeakPolarHBondContact O-CG1 3.3Å; K509-I513 PolarHBondContact O-N 3.28Å
510	E	70.6	Confident	65.9	Low	114 Å²	114	104.7 Å²	104.7	53%	0.533	58%	0.576	S	S	.	*	H	α-helix	trans	-62.4	-36.2	173.8	-74.4	177.5	175.7	0	0	113.1	V506 V507 I513 S514	V506-E510 WeakPolarHBondContact O-CG 3.47Å; V506-E510 PolarHBondContact O-N 2.91Å; V507-E510 PolarHBondContact O-N 3.41Å; E510-I513 PolarHBondContact O-N 3.13Å; E510-S514 VanDerWaalsContact O-CB 3.23Å; E510-S514 WeakPolarHBondContact O-CB 3.4Å; E510-S514 PolarHBondContact O-N 3.23Å; E510-S514 PolarHBondContact O-OG 2.98Å
511	A	66.4	Low	63.2	Low	42 Å²	42	106.6 Å²	106.6	35%	0.347	58%	0.579	S	S	.	*	H	α-helix	trans	-69.2	-38.7	173.9	0	0	0	0	0	111.6	V507 M508 K509 I513 N515	V507-A511 WeakPolarHBondContact O-CB 3.46Å; V507-A511 PolarHBondContact O-N 3.35Å; M508-A511 PolarHBondContact O-N 3.09Å; K509-A511 VanDerWaalsContact C-N 3.35Å; K509-A511 PolarHBondContact O-N 3.32Å; A511-I513 VanDerWaalsContact C-N 3.32Å; A511-N515 VanDerWaalsContact O-CB 3.25Å; A511-N515 WeakPolarHBondContact O-CB 3.27Å; A511-N515 VanDerWaalsContact O-CG 3.24Å; A511-N515 PolarHBondContact O-N 3.05Å; A511-N515 PolarHBondContact O-ND2 3.01Å
512	S	63.7	Low	60.7	Low	65 Å²	65	108.7 Å²	108.7	46%	0.455	60%	0.595	S	S	.	*	H	α-helix	trans	-72.8	-22.8	174.3	60.3	0	0	0	0	113.8	M508 K509	M508-S512 WeakPolarHBondContact O-CB 3.4Å; M508-S512 PolarHBondContact O-N 3.46Å; M508-S512 PolarHBondContact O-OG 3.48Å; K509-S512 WeakPolarHBondContact CA-OG 3.43Å; K509-S512 CarbonylContact O-C 3.58Å; K509-S512 PolarHBondContact O-N 2.89Å; K509-S512 PolarHBondContact O-OG 2.97Å
513	I	60.2	Low	58.2	Low	76 Å²	76	106.8 Å²	106.8	39%	0.39	59%	0.59	S	S	.	*	H	α-helix	trans	-82.5	-42.8	172	-65.9	162.2	0	0	0	110.3	K509 E510 A511 N515 R516 E517	K509-I513 HydrophobicContact CG-CD1 4.07Å; K509-I513 WeakPolarHBondContact O-CB 3.47Å; K509-I513 WeakPolarHBondContact O-CD1 3.48Å; K509-I513 WeakPolarHBondContact O-CG1 3.3Å; K509-I513 PolarHBondContact O-N 3.28Å; E510-I513 PolarHBondContact O-N 3.13Å; A511-I513 VanDerWaalsContact C-N 3.32Å; I513-N515 VanDerWaalsContact C-N 3.26Å; I513-N515 PolarHBondContact O-N 2.72Å; I513-R516 CarbonylContact O-C 3.48Å; I513-R516 WeakPolarHBondContact O-CA 3.38Å; I513-R516 PolarHBondContact O-N 3.15Å; I513-E517 HydrophobicContact CG2-CG 4.39Å; I513-E517 PolarHBondContact O-N 3.34Å
514	S	56.4	Low	55.7	Low	70 Å²	70	106.9 Å²	106.9	49%	0.49	60%	0.596	S	S	.	*	H	α-helix	trans	-65.2	-30.1	175.3	-62	0	0	0	0	112.2	E510 R516	E510-S514 VanDerWaalsContact O-CB 3.23Å; E510-S514 WeakPolarHBondContact O-CB 3.4Å; E510-S514 PolarHBondContact O-N 3.23Å; E510-S514 PolarHBondContact O-OG 2.98Å; S514-R516 VanDerWaalsContact C-N 3.28Å
515	N	52.4	Low	53.4	Low	137 Å²	137	111.1 Å²	111.1	73%	0.733	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-6.2	170.3	-74	-16.6	0	0	0	113.7	A511 I513	A511-N515 VanDerWaalsContact O-CB 3.25Å; A511-N515 WeakPolarHBondContact O-CB 3.27Å; A511-N515 VanDerWaalsContact O-CG 3.24Å; A511-N515 PolarHBondContact O-N 3.05Å; A511-N515 PolarHBondContact O-ND2 3.01Å; I513-N515 VanDerWaalsContact C-N 3.26Å; I513-N515 PolarHBondContact O-N 2.72Å
516	R	54	Low	51.3	Low	225 Å²	225	111.9 Å²	111.9	85%	0.849	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	-17	174.3	-100.4	-179.7	168.5	-179.2	-3.1	113.9	I513 S514	I513-R516 CarbonylContact O-C 3.48Å; I513-R516 WeakPolarHBondContact O-CA 3.38Å; I513-R516 PolarHBondContact O-N 3.15Å; S514-R516 VanDerWaalsContact C-N 3.28Å
517	E	41.5	Very low	49.2	Very low	149 Å²	149	116.5 Å²	116.5	70%	0.696	65%	0.646	S	S	*	*	S	Bend	trans	-114.8	26.8	-176.1	-69.5	-173.8	163	0	0	114.1	I513 P519	I513-E517 HydrophobicContact CG2-CG 4.39Å; I513-E517 PolarHBondContact O-N 3.34Å; E517-P519 WeakPolarHBondContact O-CD 3.33Å
518	L	35.5	Very low	47.1	Very low	128 Å²	128	116.8 Å²	116.8	67%	0.67	65%	0.652	S	S	*	*			trans	-96.2	106.6	161.6	-76.5	162.2	0	0	0	108.5	I520	L518-I520 PolarHBondContact O-N 3.39Å
519	P	35.4	Very low	44.9	Very low	107 Å²	107	117.3 Å²	117.3	70%	0.695	67%	0.665	S	S	*	*			trans	-61.9	115.1	161.3	8.3	1.7	0	0	0	106.4	E517 S521	E517-P519 WeakPolarHBondContact O-CD 3.33Å; P519-S521 PolarHBondContact O-N 3.13Å
520	I	36.2	Very low	42.9	Very low	167 Å²	167	116 Å²	116	86%	0.856	67%	0.673	S	S	*	*			trans	-63.9	87.4	166.7	-61.3	169.6	0	0	0	106.1	L518	L518-I520 PolarHBondContact O-N 3.39Å
521	S	30.5	Very low	41.3	Very low	105 Å²	105	116.2 Å²	116.2	73%	0.734	68%	0.684	S	S	*	*			trans	-112.7	60.6	166.3	61.4	0	0	0	0	109.3	P519	P519-S521 PolarHBondContact O-N 3.13Å
522	V	33.2	Very low	39.8	Very low	127 Å²	127	119.3 Å²	119.3	77%	0.77	70%	0.704	S	S	*	*	S	Bend	trans	-119.5	102.1	152.2	-169.6	0	0	0	0	105.2	P524	V522-P524 WeakPolarHBondContact O-CD 3.49Å
523	A	30.4	Very low	38.6	Very low	83 Å²	83	121.8 Å²	121.8	69%	0.686	72%	0.718	S	S	*	*			trans	-51.7	124.3	-178.9	0	0	0	0	0	110.9	N525	A523-N525 PolarHBondContact O-N 3.33Å
524	P	30.8	Very low	37.4	Very low	110 Å²	110	127.4 Å²	127.4	71%	0.714	75%	0.745	S	S	*	*			trans	-80.7	106.9	151.1	30.2	-20.4	0	0	0	105.6	V522 S526	V522-P524 WeakPolarHBondContact O-CD 3.49Å; P524-S526 PolarHBondContact O-N 2.94Å
525	N	32.8	Very low	36.4	Very low	166 Å²	166	127.4 Å²	127.4	89%	0.888	76%	0.756	S	S	*	*			trans	-68	88.8	157.9	-99.7	2.5	0	0	0	107.5	A523	A523-N525 PolarHBondContact O-N 3.33Å
526	S	33.8	Very low	35.5	Very low	87 Å²	87	127.8 Å²	127.8	61%	0.608	76%	0.758	S	S	*	*			trans	-49.7	136.7	159.5	42.5	0	0	0	0	112	P524	P524-S526 PolarHBondContact O-N 2.94Å
527	I	35.6	Very low	34.6	Very low	169 Å²	169	124.6 Å²	124.6	87%	0.867	75%	0.753	S	S	*	*				-132.7	91.3	121.9	-57.5	-177.6	0	0	0	103.6
528	S	33.3	Very low	34.4	Very low	90 Å²	90	123.9 Å²	123.9	63%	0.629	76%	0.763	S	S	*	*				57.3	114.1	85.1	-173.6	0	0	0	0	110.6
529	S	34.6	Very low	34.5	Very low	106 Å²	106	123 Å²	123	74%	0.741	76%	0.762	S	S	*	*				169.7	141.3	81.1	35.2	0	0	0	0	106.5
530	S	33.9	Very low	34.6	Very low	112 Å²	112	125.8 Å²	125.8	78%	0.783	77%	0.771	S	S	*	*			cis	-163.8	149.2	15.6	-65.4	0	0	0	0	109.7
531	P	36.2	Very low	34.5	Very low	119 Å²	119	125.1 Å²	125.1	77%	0.773	77%	0.769	S	S	*	*			trans	-114.4	175.5	174.1	37.4	-26.5	0	0	0	114.2
532	S	34.9	Very low	34.7	Very low	108 Å²	108	123.8 Å²	123.8	76%	0.755	77%	0.772	S	S	*	*			trans	110.1	162.8	148.7	-50.1	0	0	0	0	116.9
533	P	38.4	Very low	34.8	Very low	116 Å²	116	124.2 Å²	124.2	75%	0.753	78%	0.775	S	S	*	*			cis	-141.4	166.5	-33.4	30.5	-9.9	0	0	0	115.7
534	M	36.6	Very low	35.1	Very low	195 Å²	195	125.6 Å²	125.6	96%	0.961	78%	0.777	S	S	*	*			trans	15.1	143.2	147.5	-53.4	-154.8	-153.5	0	0	123.2
535	G	33.8	Very low	35.2	Very low	69 Å²	69	125.7 Å²	125.7	71%	0.711	78%	0.78	S	S	*	*			trans	165.9	94.7	150.9	0	0	0	0	0	116.6
536	D	35.1	Very low	35.2	Very low	146 Å²	146	122.4 Å²	122.4	78%	0.781	77%	0.77	S	S	*	*			trans	73	121.8	139.9	-68	-8.3	0	0	0	125.3
537	H	35	Very low	35	Very low	158 Å²	158	125.1 Å²	125.1	73%	0.731	78%	0.778	S	S	*	*			trans	63.9	110.5	133.1	-69.4	-56.6	0	0	0	121
538	C	35.8	Very low	34.9	Very low	134 Å²	134	124.2 Å²	124.2	91%	0.905	78%	0.775	S	S	*	*				-160.3	137.1	110.6	-105.8	0	0	0	0	113.3
539	V	37.7	Very low	34.8	Very low	108 Å²	108	125 Å²	125	66%	0.655	78%	0.776	S	S	*	*			trans	-81.8	136.2	174.7	177.4	0	0	0	0	108.5
540	N	37.4	Very low	34.6	Very low	166 Å²	166	127.6 Å²	127.6	89%	0.888	78%	0.78	S	S	*	*			trans	-156.3	124.4	141.1	-114	-11.6	0	0	0	112.9
541	N	34.3	Very low	34.4	Very low	154 Å²	154	130.2 Å²	130.2	82%	0.824	78%	0.78	S	S	*	*			trans	-71	141.9	176.8	-82.5	-29	0	0	0	111.9
542	G	34.7	Very low	34.1	Very low	76 Å²	76	131.3 Å²	131.3	78%	0.784	78%	0.779	S	S	*	*			trans	-156.5	94.2	164.5	0	0	0	0	0	109.8
543	T	36.1	Very low	34	Very low	137 Å²	137	133.4 Å²	133.4	84%	0.84	78%	0.782	S	S	*	*			trans	-59.8	159	-174.9	-18	0	0	0	0	113.1
544	P	36	Very low	33.6	Very low	111 Å²	111	135 Å²	135	72%	0.721	78%	0.784	S	S	*	*			trans	-97.5	160.4	-154.2	38.5	-31.3	0	0	0	113.2
545	S	33.7	Very low	33.5	Very low	112 Å²	112	128.9 Å²	128.9	78%	0.783	77%	0.77	S	S	*	*			trans	-150.3	109.8	164	-75.8	0	0	0	0	111.2
546	S	32.1	Very low	33.4	Very low	98 Å²	98	130.5 Å²	130.5	69%	0.685	77%	0.771	S	S	*	*				68.2	121.1	124.4	-37.8	0	0	0	0	119.7
547	N	30.1	Very low	33.6	Very low	144 Å²	144	129.2 Å²	129.2	77%	0.77	76%	0.763	S	S	*	*			trans	75	104.6	145.8	-56.9	-12.7	0	0	0	116.6
548	N	32.6	Very low	34.2	Very low	149 Å²	149	123 Å²	123	80%	0.797	74%	0.742	S	S	*	*				-170.6	123.8	105	-91.6	-16.4	0	0	0	112.2
549	T	31.8	Very low	35	Very low	106 Å²	106	122.4 Å²	122.4	65%	0.65	74%	0.737	S	S	*	*			trans	48	105.1	143.7	32.5	0	0	0	0	119.6	E551	T549-E551 PolarHBondContact O-N 3.45Å
550	I	29.7	Very low	35.8	Very low	161 Å²	161	120.3 Å²	120.3	83%	0.826	72%	0.722	S	S	*	*			trans	-54.3	93.5	140.9	-61.5	166.1	0	0	0	106.7
551	E	31.5	Very low	36.8	Very low	168 Å²	168	114.3 Å²	114.3	79%	0.785	69%	0.688	S	S	*	*			trans	-82.1	114.1	163.6	-75.9	-172.5	166.3	0	0	107.9	T549 D553	T549-E551 PolarHBondContact O-N 3.45Å; E551-D553 PolarHBondContact O-N 3.35Å; E551-D553 VanDerWaalsContact O-N 3.09Å
552	N	29.4	Very low	38.6	Very low	141 Å²	141	111.3 Å²	111.3	75%	0.754	67%	0.672	S	S	*	*			trans	-56.8	107	159.5	-60.1	-52.9	0	0	0	107	D554	N552-D554 PolarHBondContact O-N 2.9Å
553	D	32.1	Very low	40.4	Very low	153 Å²	153	108.3 Å²	108.3	82%	0.818	64%	0.639	S	S	*	*			trans	-72.1	82.5	167.7	-173.6	33.7	0	0	0	108.2	E551 G555	E551-D553 PolarHBondContact O-N 3.35Å; E551-D553 VanDerWaalsContact O-N 3.09Å; D553-G555 PolarHBondContact O-N 3.21Å
554	D	31.2	Very low	42.1	Very low	150 Å²	150	105.2 Å²	105.2	80%	0.802	62%	0.623	S	S	*	*			trans	-81	106.4	175.2	-155.7	10.9	0	0	0	107.9	N552 S556	N552-D554 PolarHBondContact O-N 2.9Å; D554-S556 PolarHBondContact O-N 2.84Å; D554-S556 VanDerWaalsContact O-N 3.08Å
555	G	32.7	Very low	44	Very low	65 Å²	65	100.7 Å²	100.7	67%	0.67	60%	0.596	S	S	*	*			trans	68.8	16.1	144.3	0	0	0	0	0	120.1	D553 L557	D553-G555 PolarHBondContact O-N 3.21Å; G555-L557 PolarHBondContact O-N 2.77Å; G555-L557 VanDerWaalsContact O-N 3.12Å
556	S	32.2	Very low	46.1	Very low	103 Å²	103	96.1 Å²	96.1	72%	0.72	56%	0.564	S	S	*	*			trans	-72	110.5	174.6	-167.5	0	0	0	0	111.2	D554 G558	D554-S556 PolarHBondContact O-N 2.84Å; D554-S556 VanDerWaalsContact O-N 3.08Å; S556-G558 PolarHBondContact O-N 3.47Å
557	L	39.9	Very low	48.3	Very low	119 Å²	119	92.9 Å²	92.9	62%	0.623	54%	0.539	S	S	*	.			trans	-53.8	111.4	170.6	-61.1	163	0	0	0	108.2	G555 E561	G555-L557 PolarHBondContact O-N 2.77Å; G555-L557 VanDerWaalsContact O-N 3.12Å; L557-E561 VanDerWaalsContact CD2-OE1 3.27Å; L557-E561 WeakPolarHBondContact CD2-OE1 3.43Å; L557-E561 WeakPolarHBondContact CD2-OE2 3.47Å
558	G	46.6	Very low	50.5	Low	27 Å²	27	91.3 Å²	91.3	28%	0.278	53%	0.529	S	S	.	.			trans	-59.1	158.9	177.2	0	0	0	0	0	111.6	S556 D560 E561	S556-G558 PolarHBondContact O-N 3.47Å; G558-D560 PolarHBondContact O-N 2.79Å; G558-E561 PolarHBondContact O-N 3.34Å
559	P	52.5	Low	52.9	Low	123 Å²	123	88.2 Å²	88.2	80%	0.799	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-57.5	-4	-178.1	21.6	-32.2	0	0	0	115.3	E561	P559-E561 PolarHBondContact O-N 3.44Å
560	D	54.9	Low	55.1	Low	63 Å²	63	83.5 Å²	83.5	34%	0.337	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-65.8	-15.2	178	-68.6	-19.9	0	0	0	115	Y437 G558	Y437-D560 PolarHBondContact OH-O 2.68Å; Y437-D560 VanDerWaalsContact OH-O 3.13Å; G558-D560 PolarHBondContact O-N 2.79Å
561	E	59.1	Low	57.5	Low	41 Å²	41	79 Å²	79	19%	0.192	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-92.6	-10	-173.3	-62.5	-166	-174.3	0	0	115.1	K474 R481 L557 G558 P559 V563	K474-E561 WeakPolarHBondContact CE-O 3.31Å; K474-E561 PolarHBondContact NZ-O 2.87Å; R481-E561 IonicContact CZ-OE1 3.73Å; R481-E561 IonicContact NH1-OE1 3.33Å; R481-E561 IonicContact NH2-OE1 2.81Å; R481-E561 PolarHBondContact NH2-OE1 3.5Å; L557-E561 VanDerWaalsContact CD2-OE1 3.27Å; L557-E561 WeakPolarHBondContact CD2-OE1 3.43Å; L557-E561 WeakPolarHBondContact CD2-OE2 3.47Å; G558-E561 PolarHBondContact O-N 3.34Å; P559-E561 PolarHBondContact O-N 3.44Å; E561-V563 PolarHBondContact O-N 3.29Å
562	D	71.9	Confident	59.8	Low	91 Å²	91	78.3 Å²	78.3	49%	0.487	45%	0.448	S	S	.	.			trans	-90.9	87.1	173.8	-170.6	8.2	0	0	0	111.4	S564 G565 S566	D562-S564 VanDerWaalsContact C-N 3.26Å; D562-S564 PolarHBondContact O-N 2.86Å; D562-S564 WeakPolarHBondContact OD1-CB 3.42Å; D562-S564 PolarHBondContact OD1-N 2.89Å; D562-S564 VanDerWaalsContact OD1-N 3.1Å; D562-G565 PolarHBondContact OD1-N 3.12Å; D562-G565 WeakPolarHBondContact OD2-CA 3.43Å; D562-G565 PolarHBondContact OD2-N 3.04Å; D562-S566 WeakPolarHBondContact O-CB 3.45Å; D562-S566 PolarHBondContact O-N 3.4Å; D562-S566 PolarHBondContact O-OG 3.32Å
563	V	71.8	Confident	62.1	Low	13 Å²	13	75.5 Å²	75.5	8%	0.079	43%	0.431	C	S	.	.	H	α-helix	trans	-65.4	-33.8	175.9	173.3	0	0	0	0	111	Y437 T470 E561 S566 L567	Y437-V563 HydrophobicContact CD2-CG1 4.32Å; Y437-V563 HydrophobicContact CE1-CG2 4.37Å; Y437-V563 HydrophobicContact CE2-CB 3.93Å; Y437-V563 HydrophobicContact CE2-CG1 3.76Å; Y437-V563 HydrophobicContact CE2-CG2 3.63Å; Y437-V563 WeakPolarHBondContact OH-CA 3.48Å; Y437-V563 WeakPolarHBondContact OH-CG2 3.46Å; T470-V563 HydrophobicContact CG2-CB 3.7Å; T470-V563 HydrophobicContact CG2-CG1 3.65Å; T470-V563 HydrophobicContact CG2-CG2 3.42Å; T470-V563 VanDerWaalsContact CG2-CG2 3.42Å; E561-V563 PolarHBondContact O-N 3.29Å; V563-S566 PolarHBondContact O-N 3.02Å; V563-L567 PolarHBondContact O-N 2.92Å
564	S	72	Confident	64	Low	72 Å²	72	69 Å²	69	50%	0.503	40%	0.398	S	S	.	.	H	α-helix	trans	-70.3	-47.4	179.4	-167.5	0	0	0	0	110.6	D562 S566 L567 M568	D562-S564 VanDerWaalsContact C-N 3.26Å; D562-S564 PolarHBondContact O-N 2.86Å; D562-S564 WeakPolarHBondContact OD1-CB 3.42Å; D562-S564 PolarHBondContact OD1-N 2.89Å; D562-S564 VanDerWaalsContact OD1-N 3.1Å; S564-S566 VanDerWaalsContact C-N 3.32Å; S564-S566 PolarHBondContact O-N 2.9Å; S564-L567 WeakPolarHBondContact O-CB 3.29Å; S564-L567 PolarHBondContact O-N 3.05Å; S564-M568 WeakPolarHBondContact O-CG 3.42Å; S564-M568 PolarHBondContact O-N 3.48Å
565	G	76	Confident	66	Low	16 Å²	16	67.2 Å²	67.2	17%	0.165	39%	0.385	C	S	.	.	H	α-helix	trans	-60.8	-39.4	173.1	0	0	0	0	0	112.8	D562 M568 N569	D562-G565 PolarHBondContact OD1-N 3.12Å; D562-G565 WeakPolarHBondContact OD2-CA 3.43Å; D562-G565 PolarHBondContact OD2-N 3.04Å; G565-M568 PolarHBondContact O-N 2.9Å; G565-N569 VanDerWaalsContact O-CG 3.32Å; G565-N569 PolarHBondContact O-N 3.41Å
566	S	78.2	Confident	67.8	Low	16 Å²	16	70.3 Å²	70.3	11%	0.112	39%	0.386	C	S	.	.	H	α-helix	trans	-62.4	-43.7	174.1	-62.1	0	0	0	0	112	Y437 K440 D562 V563 S564 N569 L570	Y437-S566 PolarHBondContact OH-OG 2.9Å; K440-S566 PolarHBondContact NZ-OG 3.11Å; D562-S566 WeakPolarHBondContact O-CB 3.45Å; D562-S566 PolarHBondContact O-N 3.4Å; D562-S566 PolarHBondContact O-OG 3.32Å; V563-S566 PolarHBondContact O-N 3.02Å; S564-S566 VanDerWaalsContact C-N 3.32Å; S564-S566 PolarHBondContact O-N 2.9Å; S566-N569 PolarHBondContact O-N 2.8Å; S566-L570 WeakPolarHBondContact O-CG 3.4Å; S566-L570 PolarHBondContact O-N 3.08Å; S566-L570 VanDerWaalsContact O-N 3.08Å
567	L	77.7	Confident	69.5	Low	30 Å²	30	67.4 Å²	67.4	16%	0.157	36%	0.363	C	S	.	.	H	α-helix	trans	-61.1	-43	174.6	-114.5	-34.1	0	0	0	111.7	Y452 L455 M459 V563 S564 N569 L570 Q571	Y452-L567 HydrophobicContact CD2-CD1 3.64Å; Y452-L567 HydrophobicContact CE2-CD1 3.8Å; Y452-L567 WeakPolarHBondContact CE2-O 3.41Å; L455-L567 HydrophobicContact CB-CD1 4.07Å; L455-L567 HydrophobicContact CD1-CD1 4.11Å; M459-L567 HydrophobicContact SD-CD2 4.29Å; V563-L567 PolarHBondContact O-N 2.92Å; S564-L567 WeakPolarHBondContact O-CB 3.29Å; S564-L567 PolarHBondContact O-N 3.05Å; L567-N569 VanDerWaalsContact C-N 3.34Å; L567-L570 PolarHBondContact O-N 3.5Å; L567-Q571 WeakPolarHBondContact O-CB 3.37Å; L567-Q571 PolarHBondContact O-N 2.99Å
568	M	77.3	Confident	70.6	Confident	111 Å²	111	67.4 Å²	67.4	55%	0.547	37%	0.368	S	S	.	.	H	α-helix	trans	-65.9	-35.8	179.6	-72.1	-175.6	-175.1	0	0	112.4	S564 G565 Q571 R572	S564-M568 WeakPolarHBondContact O-CG 3.42Å; S564-M568 PolarHBondContact O-N 3.48Å; G565-M568 PolarHBondContact O-N 2.9Å; M568-Q571 WeakPolarHBondContact O-CB 3.37Å; M568-Q571 PolarHBondContact O-N 3.34Å; M568-R572 PolarHBondContact O-N 3.21Å
569	N	81.6	Confident	71.5	Confident	83 Å²	83	73.4 Å²	73.4	44%	0.444	39%	0.389	S	S	.	.	H	α-helix	trans	-67.3	-47.5	175.1	-71.5	-16.4	0	0	0	111	G565 S566 L567 Q571 R572 E573	G565-N569 VanDerWaalsContact O-CG 3.32Å; G565-N569 PolarHBondContact O-N 3.41Å; S566-N569 PolarHBondContact O-N 2.8Å; L567-N569 VanDerWaalsContact C-N 3.34Å; N569-Q571 PolarHBondContact O-N 3.34Å; N569-R572 PolarHBondContact O-N 3.38Å; N569-R572 VanDerWaalsContact O-N 3.17Å; N569-E573 WeakPolarHBondContact O-CG 3.5Å; N569-E573 PolarHBondContact O-N 2.91Å
570	L	78.7	Confident	72	Confident	8 Å²	8	67.8 Å²	67.8	4%	0.042	35%	0.352	C	S	.	.	H	α-helix	trans	-60.5	-36	175	-70	170.4	0	0	0	111.9	K440 H448 Y452 L455 S566 L567 A574	K440-L570 HydrophobicContact CB-CD1 4.05Å; K440-L570 HydrophobicContact CB-CD2 4.21Å; K440-L570 HydrophobicContact CB-CG 4.46Å; H448-L570 HydrophobicContact CB-CD2 3.71Å; Y452-L570 HydrophobicContact CD2-CB 3.96Å; Y452-L570 HydrophobicContact CG-CB 4.34Å; L455-L570 HydrophobicContact CD1-CD1 4.27Å; S566-L570 WeakPolarHBondContact O-CG 3.4Å; S566-L570 PolarHBondContact O-N 3.08Å; S566-L570 VanDerWaalsContact O-N 3.08Å; L567-L570 PolarHBondContact O-N 3.5Å; L570-A574 WeakPolarHBondContact O-CB 3.37Å; L570-A574 PolarHBondContact O-N 2.64Å
571	Q	80	Confident	72.3	Confident	66 Å²	66	73 Å²	73	31%	0.308	37%	0.367	S	S	.	.	H	α-helix	trans	-61.3	-48.8	173.9	-176	169.5	-15.7	0	0	111.7	Y452 L567 M568 N569 E573 A574 E575	Y452-Q571 HydrophobicContact CD2-CB 4.01Å; Y452-Q571 HydrophobicContact CE1-CB 4.2Å; Y452-Q571 HydrophobicContact CE1-CG 4.06Å; Y452-Q571 HydrophobicContact CE2-CB 3.37Å; Y452-Q571 HydrophobicContact CE2-CG 3.97Å; Y452-Q571 VanDerWaalsContact CZ-CB 3.49Å; Y452-Q571 VanDerWaalsContact OH-CG 3.25Å; Y452-Q571 WeakPolarHBondContact OH-CG 3.41Å; Y452-Q571 PolarHBondContact OH-OE1 2.95Å; L567-Q571 WeakPolarHBondContact O-CB 3.37Å; L567-Q571 PolarHBondContact O-N 2.99Å; M568-Q571 WeakPolarHBondContact O-CB 3.37Å; M568-Q571 PolarHBondContact O-N 3.34Å; N569-Q571 PolarHBondContact O-N 3.34Å; Q571-E573 VanDerWaalsContact C-N 3.32Å; Q571-E573 PolarHBondContact O-N 3.35Å; Q571-A574 PolarHBondContact O-N 3.23Å; Q571-E575 HydrophobicContact CG-CG 4.33Å; Q571-E575 WeakPolarHBondContact CG-OE1 3.23Å; Q571-E575 PolarHBondContact NE2-OE1 3.32Å; Q571-E575 WeakPolarHBondContact O-CB 3.38Å; Q571-E575 WeakPolarHBondContact O-CG 3.25Å; Q571-E575 PolarHBondContact O-N 3.07Å
572	R	79.5	Confident	72.5	Confident	153 Å²	153	72.4 Å²	72.4	58%	0.577	37%	0.371	S	S	*	.	H	α-helix	trans	-60.4	-44.6	-179.4	-167.8	-176.3	-56.2	155.9	8.7	111	M568 N569 A574 E575 D576	M568-R572 PolarHBondContact O-N 3.21Å; N569-R572 PolarHBondContact O-N 3.38Å; N569-R572 VanDerWaalsContact O-N 3.17Å; R572-A574 VanDerWaalsContact C-N 3.32Å; R572-A574 PolarHBondContact O-N 2.82Å; R572-E575 PolarHBondContact O-N 3.09Å; R572-D576 PolarHBondContact O-N 3.03Å; R572-D576 VanDerWaalsContact O-N 3.1Å
573	E	77.6	Confident	72.1	Confident	82 Å²	82	70.7 Å²	70.7	38%	0.383	36%	0.361	S	S	.	.	H	α-helix	trans	-62.9	-38.1	176.2	-69	179.5	-169.1	0	0	112.5	H448 N569 Q571	H448-E573 WeakPolarHBondContact CB-OE2 3.34Å; H448-E573 IonicContact CE1-OE2 2.64Å; H448-E573 IonicContact CG-OE2 2.84Å; H448-E573 IonicContact ND1-OE2 3.48Å; H448-E573 PolarHBondContact ND1-OE2 2.81Å; N569-E573 WeakPolarHBondContact O-CG 3.5Å; N569-E573 PolarHBondContact O-N 2.91Å; Q571-E573 VanDerWaalsContact C-N 3.32Å; Q571-E573 PolarHBondContact O-N 3.35Å
574	A	73.3	Confident	71.7	Confident	16 Å²	16	71 Å²	71	13%	0.132	36%	0.362	C	S	.	.	H	α-helix	trans	-71.7	-29.2	176.9	0	0	0	0	0	113.3	Y452 L570 Q571 R572	Y452-A574 HydrophobicContact CD1-CB 4.01Å; Y452-A574 HydrophobicContact CG-CB 4.46Å; L570-A574 WeakPolarHBondContact O-CB 3.37Å; L570-A574 PolarHBondContact O-N 2.64Å; Q571-A574 PolarHBondContact O-N 3.23Å; R572-A574 VanDerWaalsContact C-N 3.32Å; R572-A574 PolarHBondContact O-N 2.82Å
575	E	73.5	Confident	71.2	Confident	113 Å²	113	70.7 Å²	70.7	53%	0.528	36%	0.355	S	S	.	.	H	α-helix	trans	-78.1	-30.7	178.3	-75.5	174.5	-179.9	0	0	112.5	Q571 R572 D577	Q571-E575 HydrophobicContact CG-CG 4.33Å; Q571-E575 WeakPolarHBondContact CG-OE1 3.23Å; Q571-E575 PolarHBondContact NE2-OE1 3.32Å; Q571-E575 WeakPolarHBondContact O-CB 3.38Å; Q571-E575 WeakPolarHBondContact O-CG 3.25Å; Q571-E575 PolarHBondContact O-N 3.07Å; R572-E575 PolarHBondContact O-N 3.09Å; E575-D577 VanDerWaalsContact C-N 3.29Å; E575-D577 PolarHBondContact O-N 2.85Å
576	D	68.9	Low	70.4	Confident	130 Å²	130	75.6 Å²	75.6	70%	0.695	37%	0.374	S	S	*	.	H	α-helix	trans	-71	-24.3	176.2	-71.3	-19.6	0	0	0	112.4	R572 T578	R572-D576 PolarHBondContact O-N 3.03Å; R572-D576 VanDerWaalsContact O-N 3.1Å; D576-T578 PolarHBondContact O-N 3.45Å
577	D	67.6	Low	69.5	Low	43 Å²	43	80.3 Å²	80.3	23%	0.23	39%	0.389	C	S	.	.			trans	-91.3	90.8	-180	-163.4	-21.3	0	0	0	112	E575 E579 L580	E575-D577 VanDerWaalsContact C-N 3.29Å; E575-D577 PolarHBondContact O-N 2.85Å; D577-E579 VanDerWaalsContact C-N 3.27Å; D577-E579 PolarHBondContact O-N 3.49Å; D577-E579 PolarHBondContact OD1-N 3.44Å; D577-L580 HydrophobicContact CB-CB 3.88Å; D577-L580 WeakPolarHBondContact O-CB 3.36Å; D577-L580 PolarHBondContact O-N 2.85Å; D577-L580 PolarHBondContact OD1-N 3.29Å; D577-L580 VanDerWaalsContact OD1-N 3.14Å
578	T	63.4	Low	68.5	Low	119 Å²	119	82.8 Å²	82.8	73%	0.73	40%	0.396	S	S	*	.	H	α-helix	trans	-65.8	-30.1	-179.8	-50.2	0	0	0	0	112.2	D576 G582	D576-T578 PolarHBondContact O-N 3.45Å; T578-G582 PolarHBondContact O-N 3Å
579	E	65.7	Low	67.2	Low	153 Å²	153	86.3 Å²	86.3	72%	0.715	40%	0.403	S	S	*	.	H	α-helix	trans	-68.4	-40.1	177.5	-69.5	-172.1	164.5	0	0	110.9	D577 R581 G582 I583	D577-E579 VanDerWaalsContact C-N 3.27Å; D577-E579 PolarHBondContact O-N 3.49Å; D577-E579 PolarHBondContact OD1-N 3.44Å; E579-R581 VanDerWaalsContact C-N 3.29Å; E579-R581 PolarHBondContact O-N 3.26Å; E579-G582 WeakPolarHBondContact O-CA 3.33Å; E579-G582 PolarHBondContact O-N 2.89Å; E579-I583 WeakPolarHBondContact O-CG1 3.42Å; E579-I583 PolarHBondContact O-N 2.91Å
580	L	63.7	Low	65.6	Low	5 Å²	5	88.7 Å²	88.7	3%	0.026	42%	0.416	C	S	.	.	H	α-helix	trans	-58.9	-40	178.5	-163	79.9	0	0	0	112.6	T446 G449 L450 D577 G582 I583 I584	T446-L580 HydrophobicContact CG2-CD1 3.47Å; T446-L580 VanDerWaalsContact CG2-CD1 3.47Å; G449-L580 VanDerWaalsContact CA-CD2 3.48Å; L450-L580 HydrophobicContact CG-CD1 4.41Å; D577-L580 HydrophobicContact CB-CB 3.88Å; D577-L580 WeakPolarHBondContact O-CB 3.36Å; D577-L580 PolarHBondContact O-N 2.85Å; D577-L580 PolarHBondContact OD1-N 3.29Å; D577-L580 VanDerWaalsContact OD1-N 3.14Å; L580-G582 VanDerWaalsContact C-N 3.26Å; L580-G582 PolarHBondContact O-N 2.98Å; L580-I583 PolarHBondContact O-N 3.4Å; L580-I584 HydrophobicContact CD2-CD1 4.28Å; L580-I584 HydrophobicContact CG-CD1 4.04Å; L580-I584 WeakPolarHBondContact O-CG1 3.32Å; L580-I584 PolarHBondContact O-N 2.88Å
581	R	61.8	Low	63.7	Low	173 Å²	173	93.8 Å²	93.8	65%	0.653	44%	0.438	S	S	*	.	H	α-helix	trans	-63.3	-33.7	174.3	-117.1	-177.7	-177.4	-129.8	4.5	112.1	E579 N585	E579-R581 VanDerWaalsContact C-N 3.29Å; E579-R581 PolarHBondContact O-N 3.26Å; R581-N585 WeakPolarHBondContact O-CB 3.18Å; R581-N585 VanDerWaalsContact O-CG 3.28Å; R581-N585 PolarHBondContact O-N 3.35Å; R581-N585 PolarHBondContact O-ND2 3.43Å
582	G	61.8	Low	61.3	Low	27 Å²	27	98 Å²	98	28%	0.278	46%	0.462	S	S	.	.	H	α-helix	trans	-64.1	-55.4	172.2	0	0	0	0	0	110.8	T578 E579 L580 I584 N585 E586	T578-G582 PolarHBondContact O-N 3Å; E579-G582 WeakPolarHBondContact O-CA 3.33Å; E579-G582 PolarHBondContact O-N 2.89Å; L580-G582 VanDerWaalsContact C-N 3.26Å; L580-G582 PolarHBondContact O-N 2.98Å; G582-I584 PolarHBondContact O-N 2.92Å; G582-N585 PolarHBondContact O-N 3.34Å; G582-N585 VanDerWaalsContact O-N 3.12Å; G582-E586 WeakPolarHBondContact O-CB 3.48Å; G582-E586 WeakPolarHBondContact O-CG 3.35Å; G582-E586 PolarHBondContact O-N 2.94Å
583	I	65	Low	59	Low	55 Å²	55	95.8 Å²	95.8	28%	0.282	47%	0.468	S	S	.	.	H	α-helix	trans	-59	-45	-175.3	-64.1	166.2	0	0	0	112.1	Y410 E579 L580 N585 R587	Y410-I583 HydrophobicContact CE1-CG2 4.43Å; E579-I583 WeakPolarHBondContact O-CG1 3.42Å; E579-I583 PolarHBondContact O-N 2.91Å; L580-I583 PolarHBondContact O-N 3.4Å; I583-N585 PolarHBondContact O-N 2.84Å; I583-R587 PolarHBondContact O-N 2.78Å; I583-R587 VanDerWaalsContact O-N 3.16Å
584	I	63.1	Low	56.8	Low	19 Å²	19	97.9 Å²	97.9	10%	0.097	48%	0.479	C	S	.	.	H	α-helix	trans	-65.6	-40.1	179.5	-65	168.7	0	0	0	110.9	L450 N453 L580 G582 R588	L450-I584 HydrophobicContact CD2-CD1 4.17Å; L450-I584 HydrophobicContact CD2-CG1 4.05Å; N453-I584 HydrophobicContact CB-CD1 4.45Å; L580-I584 HydrophobicContact CD2-CD1 4.28Å; L580-I584 HydrophobicContact CG-CD1 4.04Å; L580-I584 WeakPolarHBondContact O-CG1 3.32Å; L580-I584 PolarHBondContact O-N 2.88Å; G582-I584 PolarHBondContact O-N 2.92Å; I584-R588 WeakPolarHBondContact O-CG 3.29Å; I584-R588 PolarHBondContact O-N 3Å
585	N	60.7	Low	54.7	Low	66 Å²	66	104 Å²	104	35%	0.353	51%	0.508	S	S	.	.	H	α-helix	trans	-77.9	-35.4	-178.7	-74.7	-40.8	0	0	0	112.9	R581 G582 I583 R588 R589	R581-N585 WeakPolarHBondContact O-CB 3.18Å; R581-N585 VanDerWaalsContact O-CG 3.28Å; R581-N585 PolarHBondContact O-N 3.35Å; R581-N585 PolarHBondContact O-ND2 3.43Å; G582-N585 PolarHBondContact O-N 3.34Å; G582-N585 VanDerWaalsContact O-N 3.12Å; I583-N585 PolarHBondContact O-N 2.84Å; N585-R588 PolarHBondContact O-N 3.39Å; N585-R589 WeakPolarHBondContact O-CG 3.43Å; N585-R589 PolarHBondContact O-N 3.04Å
586	E	60.1	Low	52.6	Low	120 Å²	120	107.5 Å²	107.5	56%	0.561	52%	0.524	S	S	*	.	H	α-helix	trans	-63.4	-49.4	176	-78.5	177.4	176.8	0	0	110.3	G582 R588 R589 D590	G582-E586 WeakPolarHBondContact O-CB 3.48Å; G582-E586 WeakPolarHBondContact O-CG 3.35Å; G582-E586 PolarHBondContact O-N 2.94Å; E586-R588 VanDerWaalsContact C-N 3.29Å; E586-R588 PolarHBondContact O-N 2.89Å; E586-R589 PolarHBondContact O-N 2.86Å; E586-D590 PolarHBondContact O-N 3.39Å
587	R	58.5	Low	50.8	Low	114 Å²	114	112 Å²	112	43%	0.43	53%	0.532	S	S	.	.	H	α-helix	trans	-62.7	-33.3	177.2	-74.4	-167.1	-169.3	-139.2	3.8	113.8	Y410 I583 R589	Y410-R587 VanDerWaalsContact CZ-CZ 3.43Å; I583-R587 PolarHBondContact O-N 2.78Å; I583-R587 VanDerWaalsContact O-N 3.16Å; R587-R589 VanDerWaalsContact C-N 3.33Å
588	R	56.7	Low	49.3	Very low	82 Å²	82	117 Å²	117	31%	0.309	55%	0.551	S	S	.	*	H	α-helix	trans	-69.6	-28.9	172.5	-78.5	-175.9	176.7	177.3	0.1	112.8	I584 N585 E586	I584-R588 WeakPolarHBondContact O-CG 3.29Å; I584-R588 PolarHBondContact O-N 3Å; N585-R588 PolarHBondContact O-N 3.39Å; E586-R588 VanDerWaalsContact C-N 3.29Å; E586-R588 PolarHBondContact O-N 2.89Å
589	R	49.8	Very low	47.9	Very low	185 Å²	185	113.2 Å²	113.2	70%	0.698	53%	0.529	S	S	*	.	H	α-helix	trans	-85.3	-27.2	178.7	-74.9	-176.5	-158.4	161.5	7.6	113.6	N585 E586 R587 K591	N585-R589 WeakPolarHBondContact O-CG 3.43Å; N585-R589 PolarHBondContact O-N 3.04Å; E586-R589 PolarHBondContact O-N 2.86Å; R587-R589 VanDerWaalsContact C-N 3.33Å; R589-K591 PolarHBondContact O-N 3.21Å; R589-K591 VanDerWaalsContact O-N 3.09Å
590	D	47.3	Very low	46.4	Very low	133 Å²	133	112.9 Å²	112.9	71%	0.711	53%	0.528	S	S	*	.	S	Bend	trans	-73.3	2.6	-175.4	-75.3	-20.8	0	0	0	114.6	E586	E586-D590 PolarHBondContact O-N 3.39Å
591	K	40.9	Very low	45.4	Very low	115 Å²	115	114 Å²	114	50%	0.5	53%	0.534	S	S	.	.			trans	-117.8	78.1	164.9	-71.7	-168.5	176.7	-172.7	0	111.6	D375 R589	D375-K591 IonicContact OD1-NZ 3.06Å; D375-K591 IonicContact OD2-NZ 3.02Å; D375-K591 PolarHBondContact OD2-NZ 2.93Å; R589-K591 PolarHBondContact O-N 3.21Å; R589-K591 VanDerWaalsContact O-N 3.09Å
592	L	29.5	Very low	44.3	Very low	154 Å²	154	112 Å²	112	81%	0.806	54%	0.543	S	S	*	.			trans	-57	146.3	155.3	-85.8	148.8	0	0	0	109.3	M594	L592-M594 PolarHBondContact O-N 3.45Å
593	P	31	Very low	43.6	Very low	108 Å²	108	113.1 Å²	113.1	70%	0.701	54%	0.541	S	S	*	.			trans	-51.8	125.3	-158.8	20.7	-32.5	0	0	0	111.1	I595	P593-I595 PolarHBondContact O-N 2.76Å
594	M	30.3	Very low	42.7	Very low	125 Å²	125	112.6 Å²	112.6	62%	0.616	54%	0.542	S	S	*	.			trans	-65.1	80.2	-177.3	-159.6	172.6	86.9	0	0	110	L592 Q596	L592-M594 PolarHBondContact O-N 3.45Å; M594-Q596 PolarHBondContact O-N 2.87Å; M594-Q596 VanDerWaalsContact O-N 3.09Å
595	I	28.8	Very low	41.9	Very low	145 Å²	145	119.1 Å²	119.1	74%	0.744	57%	0.572	S	S	*	*			trans	-60.9	106.2	151	-66	174	0	0	0	104.3	P593 R597	P593-I595 PolarHBondContact O-N 2.76Å; I595-R597 PolarHBondContact O-N 2.85Å
596	Q	31.2	Very low	41.4	Very low	187 Å²	187	119.1 Å²	119.1	87%	0.874	58%	0.575	S	S	*	*			trans	-1.5	74	166.7	-74.8	179.5	-15	0	0	113.6	M594 K598	M594-Q596 PolarHBondContact O-N 2.87Å; M594-Q596 VanDerWaalsContact O-N 3.09Å; Q596-K598 PolarHBondContact O-N 3.47Å
597	R	30.8	Very low	41	Very low	225 Å²	225	114.3 Å²	114.3	85%	0.849	55%	0.554	S	S	*	*			trans	-92.9	97.2	167.8	-84.8	-173.4	179.9	153.7	0.8	103.7	I595 S599	I595-R597 PolarHBondContact O-N 2.85Å; R597-S599 PolarHBondContact O-N 3.49Å
598	K	35.7	Very low	40.9	Very low	146 Å²	146	111.7 Å²	111.7	64%	0.635	55%	0.548	S	S	*	.			trans	-33.9	125.9	158.6	-68.5	175.9	176.1	178.5	0	107	Q596 E600	Q596-K598 PolarHBondContact O-N 3.47Å; K598-E600 PolarHBondContact O-N 2.8Å
599	S	34	Very low	40.7	Very low	40 Å²	40	115.7 Å²	115.7	28%	0.28	56%	0.563	S	S	.	*			trans	-55.7	92.6	170.5	36.2	0	0	0	0	108.1	Y331 R597 L601	Y331-S599 WeakPolarHBondContact CD2-OG 3.27Å; Y331-S599 WeakPolarHBondContact CE2-O 3.37Å; Y331-S599 VanDerWaalsContact CE2-OG 3.26Å; Y331-S599 WeakPolarHBondContact CE2-OG 3.47Å; R597-S599 PolarHBondContact O-N 3.49Å; S599-L601 PolarHBondContact O-N 2.85Å
600	E	34.6	Very low	41	Very low	147 Å²	147	107 Å²	107	69%	0.687	53%	0.531	S	S	*	.			trans	-86.1	104.7	175.8	-74.8	-177.3	-169.9	0	0	106.8	K598	K598-E600 PolarHBondContact O-N 2.8Å
601	L	41.6	Very low	41.2	Very low	29 Å²	29	103.9 Å²	103.9	15%	0.152	51%	0.514	C	S	.	.			trans	-50.1	156	159.3	-83.5	131	0	0	0	109.5	Q328 Y331 S599 H603	Q328-L601 HydrophobicContact CG-CD2 4.05Å; Y331-L601 HydrophobicContact CD1-CD1 3.51Å; Y331-L601 HydrophobicContact CD2-CD1 3.99Å; Y331-L601 HydrophobicContact CE1-CD1 3.96Å; Y331-L601 HydrophobicContact CE2-CD1 4.41Å; Y331-L601 HydrophobicContact CG-CD1 3.52Å; S599-L601 PolarHBondContact O-N 2.85Å; L601-H603 VanDerWaalsContact C-N 3.31Å; L601-H603 PolarHBondContact O-CE1 3.45Å; L601-H603 PolarHBondContact O-N 3.47Å; L601-H603 PolarHBondContact O-ND1 3.32Å
602	P	38.2	Very low	42	Very low	129 Å²	129	105 Å²	105	84%	0.838	52%	0.521	S	S	*	.			trans	-60.6	95.8	168.1	-15.4	28.5	0	0	0	108.9
603	H	48.7	Very low	43.2	Very low	51 Å²	51	104.7 Å²	104.7	24%	0.236	52%	0.515	C	S	.	.			trans	-85.1	135.9	178.5	-64.5	84.6	0	0	0	108.8	L601 Q605 I608	L601-H603 VanDerWaalsContact C-N 3.31Å; L601-H603 PolarHBondContact O-CE1 3.45Å; L601-H603 PolarHBondContact O-N 3.47Å; L601-H603 PolarHBondContact O-ND1 3.32Å; H603-Q605 PolarHBondContact O-N 3.49Å; H603-I608 HydrophobicContact CB-CD1 3.89Å; H603-I608 HydrophobicContact CB-CG1 3.49Å; H603-I608 VanDerWaalsContact CB-CG1 3.49Å
604	S	44.9	Very low	44.2	Very low	45 Å²	45	104.2 Å²	104.2	32%	0.315	50%	0.504	S	S	.	.			trans	-51.4	134.5	157.2	165.4	0	0	0	0	109.2	T606 T607 I608	S604-T606 PolarHBondContact O-N 3.35Å; S604-T606 PolarHBondContact OG-N 2.99Å; S604-T606 PolarHBondContact OG-OG1 2.77Å; S604-T607 WeakPolarHBondContact O-CA 3.41Å; S604-T607 WeakPolarHBondContact O-CB 3.49Å; S604-T607 PolarHBondContact O-N 2.94Å; S604-I608 PolarHBondContact O-N 3.28Å
605	Q	46.2	Very low	44.8	Very low	155 Å²	155	109 Å²	109	72%	0.724	52%	0.515	S	S	*	.	H	α-helix	trans	-51.7	-28.2	178.2	-102.4	175.2	15.6	0	0	112.5	H603 R609	H603-Q605 PolarHBondContact O-N 3.49Å; Q605-R609 PolarHBondContact O-N 3.39Å
606	T	50	Low	45.4	Very low	66 Å²	66	110.6 Å²	110.6	41%	0.405	51%	0.511	S	S	.	.	H	α-helix	trans	-67.8	-39.2	175.8	-37	0	0	0	0	111.7	S604 A610	S604-T606 PolarHBondContact O-N 3.35Å; S604-T606 PolarHBondContact OG-N 2.99Å; S604-T606 PolarHBondContact OG-OG1 2.77Å; T606-A610 VanDerWaalsContact O-CB 3.24Å; T606-A610 WeakPolarHBondContact O-CB 3.34Å; T606-A610 PolarHBondContact O-N 2.85Å
607	T	52.7	Low	45.6	Very low	19 Å²	19	107.4 Å²	107.4	12%	0.117	51%	0.507	C	S	.	.	H	α-helix	trans	-69.8	-35.3	177.8	-50.4	0	0	0	0	112	S604 A610 L611	S604-T607 WeakPolarHBondContact O-CA 3.41Å; S604-T607 WeakPolarHBondContact O-CB 3.49Å; S604-T607 PolarHBondContact O-N 2.94Å; T607-A610 WeakPolarHBondContact O-CB 3.19Å; T607-A610 PolarHBondContact O-N 3.05Å; T607-L611 HydrophobicContact CG2-CD1 4.11Å; T607-L611 WeakPolarHBondContact O-CB 3.44Å; T607-L611 WeakPolarHBondContact O-CD1 3.15Å; T607-L611 WeakPolarHBondContact O-CG 3.5Å; T607-L611 PolarHBondContact O-N 3.01Å
608	I	55.6	Low	46	Very low	60 Å²	60	100.4 Å²	100.4	31%	0.308	49%	0.486	S	S	.	.	H	α-helix	trans	-66.3	-49.9	175.3	-63.1	175.2	0	0	0	110.3	H603 S604 A610 L611 E612	H603-I608 HydrophobicContact CB-CD1 3.89Å; H603-I608 HydrophobicContact CB-CG1 3.49Å; H603-I608 VanDerWaalsContact CB-CG1 3.49Å; S604-I608 PolarHBondContact O-N 3.28Å; I608-A610 PolarHBondContact O-N 3.2Å; I608-L611 PolarHBondContact O-N 3.39Å; I608-E612 HydrophobicContact CG2-CG 4.31Å; I608-E612 WeakPolarHBondContact O-CG 3.39Å; I608-E612 PolarHBondContact O-N 3.4Å
609	R	53.7	Low	46.3	Very low	165 Å²	165	101.4 Å²	101.4	62%	0.623	49%	0.493	S	S	*	.	H	α-helix	trans	-59.4	-36.1	176.4	-73.2	-177.4	179.4	176.2	2.4	111.9	Q605 Q613	Q605-R609 PolarHBondContact O-N 3.39Å; R609-Q613 WeakPolarHBondContact O-CB 3.08Å; R609-Q613 VanDerWaalsContact O-CG 3.29Å; R609-Q613 WeakPolarHBondContact O-CG 3.27Å; R609-Q613 PolarHBondContact O-N 2.9Å
610	A	54.8	Low	46.4	Very low	4 Å²	4	109.1 Å²	109.1	3%	0.033	52%	0.518	C	S	.	.	H	α-helix	trans	-61	-41.5	174.6	0	0	0	0	0	113.7	R250 T606 T607 I608 H614	R250-A610 VanDerWaalsContact NH1-CB 3.27Å; R250-A610 PolarHBondContact NH1-O 3.38Å; R250-A610 VanDerWaalsContact NH1-O 3.13Å; T606-A610 VanDerWaalsContact O-CB 3.24Å; T606-A610 WeakPolarHBondContact O-CB 3.34Å; T606-A610 PolarHBondContact O-N 2.85Å; T607-A610 WeakPolarHBondContact O-CB 3.19Å; T607-A610 PolarHBondContact O-N 3.05Å; I608-A610 PolarHBondContact O-N 3.2Å; A610-H614 PolarHBondContact O-N 3.31Å
611	L	52.4	Low	46.4	Very low	67 Å²	67	109 Å²	109	35%	0.351	52%	0.521	S	S	.	.	H	α-helix	trans	-75.6	-40.1	179.6	-71.4	165.6	0	0	0	111.6	T607 I608 H614 R615	T607-L611 HydrophobicContact CG2-CD1 4.11Å; T607-L611 WeakPolarHBondContact O-CB 3.44Å; T607-L611 WeakPolarHBondContact O-CD1 3.15Å; T607-L611 WeakPolarHBondContact O-CG 3.5Å; T607-L611 PolarHBondContact O-N 3.01Å; I608-L611 PolarHBondContact O-N 3.39Å; L611-H614 PolarHBondContact O-N 3.32Å; L611-H614 VanDerWaalsContact O-N 3.16Å; L611-R615 PolarHBondContact O-N 2.86Å
612	E	56.4	Low	46.1	Very low	138 Å²	138	117.6 Å²	117.6	65%	0.645	56%	0.557	S	S	*	*	H	α-helix	trans	-63.6	-41.2	176.3	-72.5	178.7	157.6	0	0	112	I608 H614 R615	I608-E612 HydrophobicContact CG2-CG 4.31Å; I608-E612 WeakPolarHBondContact O-CG 3.39Å; I608-E612 PolarHBondContact O-N 3.4Å; E612-H614 PolarHBondContact O-N 3.43Å; E612-R615 PolarHBondContact O-N 3.24Å
613	Q	55.8	Low	46.1	Very low	148 Å²	148	117.9 Å²	117.9	69%	0.692	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-9	175.9	-71.2	178.5	-5.7	0	0	113.9	R609	R609-Q613 WeakPolarHBondContact O-CB 3.08Å; R609-Q613 VanDerWaalsContact O-CG 3.29Å; R609-Q613 WeakPolarHBondContact O-CG 3.27Å; R609-Q613 PolarHBondContact O-N 2.9Å
614	H	52	Low	45.3	Very low	98 Å²	98	123.1 Å²	123.1	45%	0.454	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-113	14.2	178.4	-87.7	30.8	0	0	0	113.6	A610 L611 E612 R616	A610-H614 PolarHBondContact O-N 3.31Å; L611-H614 PolarHBondContact O-N 3.32Å; L611-H614 VanDerWaalsContact O-N 3.16Å; E612-H614 PolarHBondContact O-N 3.43Å; H614-R616 PolarHBondContact O-N 3.27Å
615	R	43.6	Very low	44.8	Very low	226 Å²	226	126.9 Å²	126.9	85%	0.853	61%	0.605	S	S	*	*			trans	-63.7	103.4	163.9	-158.2	177.6	-176.3	173.5	0.2	108.2	L611 E612	L611-R615 PolarHBondContact O-N 2.86Å; E612-R615 PolarHBondContact O-N 3.24Å
616	R	39.8	Very low	44.6	Very low	178 Å²	178	126.4 Å²	126.4	67%	0.672	61%	0.607	S	S	*	*			trans	-45.5	124.3	179.5	-94.3	166.7	153.5	-159.8	0.5	111.6	H614 D618	H614-R616 PolarHBondContact O-N 3.27Å; R616-D618 HydrophobicContact CB-CB 4.03Å; R616-D618 WeakPolarHBondContact CD-OD2 3.47Å; R616-D618 WeakPolarHBondContact CG-OD2 3.42Å; R616-D618 IonicContact CZ-OD2 2.79Å; R616-D618 IonicContact NE-OD2 2.86Å; R616-D618 PolarHBondContact NE-OD2 2.86Å; R616-D618 IonicContact NH1-OD2 3.13Å; R616-D618 PolarHBondContact NH1-OD2 3.4Å; R616-D618 PolarHBondContact O-N 3.07Å
617	P	36.9	Very low	43.8	Very low	119 Å²	119	132.6 Å²	132.6	77%	0.773	65%	0.653	S	S	*	*			trans	-77.4	63.4	160.6	32.4	-30.7	0	0	0	109.1	E619	P617-E619 VanDerWaalsContact C-N 3.35Å
618	D	38.5	Very low	43.4	Very low	78 Å²	78	138.3 Å²	138.3	42%	0.417	68%	0.68	S	S	.	*			trans	-97.4	27.8	-178.1	-77.8	1.6	0	0	0	112.4	R616 Y620	R616-D618 HydrophobicContact CB-CB 4.03Å; R616-D618 WeakPolarHBondContact CD-OD2 3.47Å; R616-D618 WeakPolarHBondContact CG-OD2 3.42Å; R616-D618 IonicContact CZ-OD2 2.79Å; R616-D618 IonicContact NE-OD2 2.86Å; R616-D618 PolarHBondContact NE-OD2 2.86Å; R616-D618 IonicContact NH1-OD2 3.13Å; R616-D618 PolarHBondContact NH1-OD2 3.4Å; R616-D618 PolarHBondContact O-N 3.07Å; D618-Y620 PolarHBondContact O-N 3.09Å
619	E	41.1	Very low	42.8	Very low	168 Å²	168	142.4 Å²	142.4	79%	0.785	70%	0.699	S	S	*	*	S	Bend	trans	-76.2	1.4	169.2	-142.5	176.3	-173	0	0	112.8	P617	P617-E619 VanDerWaalsContact C-N 3.35Å
620	Y	36.8	Very low	42.2	Very low	202 Å²	202	141.1 Å²	141.1	79%	0.792	70%	0.703	S	S	*	*	S	Bend	trans	-134.6	13.6	-172.2	-67.9	-73.4	0	0	0	117.4	D618	D618-Y620 PolarHBondContact O-N 3.09Å
621	L	35.5	Very low	41.4	Very low	145 Å²	145	149.2 Å²	149.2	76%	0.759	74%	0.743	S	S	*	*			trans	-125.2	88.2	174.3	-75	165.9	0	0	0	111.8	T623	L621-T623 PolarHBondContact O-N 3.3Å; L621-T623 VanDerWaalsContact O-N 3.16Å
622	K	34.8	Very low	40.7	Very low	208 Å²	208	154.3 Å²	154.3	90%	0.904	77%	0.767	S	S	*	*			trans	-62.1	108.9	162.2	-71.7	179.7	178.5	178.4	0	108.6	Q624	K622-Q624 PolarHBondContact O-N 2.95Å
623	T	37.5	Very low	39.7	Very low	136 Å²	136	155.4 Å²	155.4	83%	0.834	78%	0.775	S	S	*	*			trans	-70.2	121.8	162.8	44.1	0	0	0	0	108.6	L621	L621-T623 PolarHBondContact O-N 3.3Å; L621-T623 VanDerWaalsContact O-N 3.16Å
624	Q	33	Very low	38.5	Very low	161 Å²	161	155.9 Å²	155.9	75%	0.752	78%	0.781	S	S	*	*			trans	-61	147.9	174.5	-70.8	-155.2	-22	0	0	111.3	K622 D626	K622-Q624 PolarHBondContact O-N 2.95Å; Q624-D626 PolarHBondContact O-N 2.94Å
625	P	34.8	Very low	37.5	Very low	124 Å²	124	160.4 Å²	160.4	81%	0.805	81%	0.807	S	S	*	*			trans	-82.8	108.8	170.8	32.3	-25.4	0	0	0	108.2
626	D	40.9	Very low	37	Very low	145 Å²	145	154.9 Å²	154.9	78%	0.775	80%	0.803	S	S	*	*			trans	-94.2	139.6	170.2	-78.4	-25.9	0	0	0	110.8	Q624	Q624-D626 PolarHBondContact O-N 2.94Å
627	S	34.2	Very low	36.7	Very low	195 Å²	195	152.8 Å²	152.8	100%	1.364	82%	0.815	S	S	*	*			trans	-56.8	0	-174	-57	0	0	0	0	115.3

Retrieved 627 of 627 residues in 362.9 ms (Link to these results)

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