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Telomeric repeat-binding factor

Binds the telomeric double-stranded 5'-TTAGGG-3' repeat and negatively regulates telomere length. Involved in the regulation of the mitotic spindle. Component of the shelterin complex (telosome) that is involved in the regulation of telomere length and protection. Shelterin associates with arrays of double-stranded 5'-TTAGGG-3' repeats added by telomerase and protects chromosome ends; without its protective activity, telomeres are no longer hidden from the DNA damage surveillance and chromosome ends are inappropriately processed by DNA repair pathways.

AlphaFold DB , UniProt , Accession A0A096MMA6, Species PAPAN (Papio anubis, Olive baboon), Gene TERF1, Length 438 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	41.8	Very low	39.2	Very low	240 Å²	240	122.7 Å²	122.7	100%	1.182	79%	0.79	S	S	*	*				0	82.5	0	-69.8	-175.2	165.3	0	0	104.9
2	A	39.1	Very low	39.8	Very low	93 Å²	93	122.1 Å²	122.1	77%	0.769	79%	0.787	S	S	*	*				61.3	125.6	81.3	0	0	0	0	0	110.3
3	E	40.8	Very low	39.6	Very low	171 Å²	171	132.1 Å²	132.1	80%	0.799	80%	0.799	S	S	*	*			cis	-163.8	135.7	-2.5	-105.4	-167.9	175.2	0	0	103.3
4	D	39.7	Very low	39	Very low	146 Å²	146	128.4 Å²	128.4	78%	0.781	80%	0.801	S	S	*	*				80.6	146.2	91.7	-135.4	15.8	0	0	0	111.1
5	A	42.1	Very low	39.2	Very low	73 Å²	73	128.9 Å²	128.9	60%	0.603	81%	0.809	S	S	*	*			cis	-161.5	143.7	13.6	0	0	0	0	0	106.5
6	S	39.5	Very low	38.9	Very low	111 Å²	111	126.7 Å²	126.7	78%	0.776	81%	0.807	S	S	*	*				73.1	137.6	92.7	-154	0	0	0	0	112.7
7	S	36.2	Very low	38.8	Very low	101 Å²	101	129.6 Å²	129.6	71%	0.706	82%	0.815	S	S	*	*			cis	-171.5	126.9	38.6	-165.6	0	0	0	0	107.5
8	A	33.9	Very low	38.5	Very low	91 Å²	91	126.2 Å²	126.2	75%	0.752	81%	0.808	S	S	*	*				70.8	117.4	102.9	0	0	0	0	0	118
9	A	35	Very low	38.2	Very low	93 Å²	93	131.6 Å²	131.6	77%	0.769	81%	0.811	S	S	*	*			trans	-19.9	-174.6	150.2	0	0	0	0	0	119.4
10	P	46.1	Very low	38.1	Very low	122 Å²	122	131.9 Å²	131.9	79%	0.792	81%	0.808	S	S	*	*			cis	-138.2	179.5	-2.4	23	4	0	0	0	116.4
11	S	37	Very low	37.8	Very low	109 Å²	109	129.9 Å²	129.9	76%	0.762	80%	0.804	S	S	*	*			trans	-28.7	164.7	157.5	-120.8	0	0	0	0	117.1
12	P	47	Very low	37.3	Very low	115 Å²	115	125.3 Å²	125.3	75%	0.747	78%	0.784	S	S	*	*				-157.3	173	51.4	39.7	-15.8	0	0	0	119.9
13	R	36.3	Very low	36.8	Very low	252 Å²	252	126.3 Å²	126.3	95%	0.951	78%	0.781	S	S	*	*			trans	25.8	136	146.2	-78.5	-179.6	167.2	-167.4	-4.1	122
14	G	31.6	Very low	36.5	Very low	80 Å²	80	125.1 Å²	125.1	83%	0.825	79%	0.786	S	S	*	*			trans	-176.8	115.1	147.3	0	0	0	0	0	113.9
15	C	41.7	Very low	36	Very low	137 Å²	137	126.1 Å²	126.1	93%	0.926	79%	0.786	S	S	*	*			trans	-101.7	141.1	164.3	-65	0	0	0	0	108.9
16	A	35.1	Very low	35.5	Very low	93 Å²	93	131.2 Å²	131.2	77%	0.769	80%	0.797	S	S	*	*			trans	170.6	121.2	157.1	0	0	0	0	0	107.6
17	D	36.4	Very low	35.1	Very low	176 Å²	176	133.1 Å²	133.1	94%	0.941	79%	0.794	S	S	*	*				88.5	137.4	72.1	-105.5	-11.2	0	0	0	114.9
18	G	33.6	Very low	34.8	Very low	68 Å²	68	136 Å²	136	70%	0.701	80%	0.798	S	S	*	*			trans	101.4	109	161.2	0	0	0	0	0	115.6
19	R	33.9	Very low	34.7	Very low	230 Å²	230	136.4 Å²	136.4	87%	0.868	80%	0.802	S	S	*	*				83.7	121.9	69	-84.1	-163.9	-160.4	-153	5	115.9
20	D	34.5	Very low	34.4	Very low	137 Å²	137	140.6 Å²	140.6	73%	0.733	81%	0.805	S	S	*	*			trans	79.1	136.9	137.8	-58.3	-25.9	0	0	0	124.3
21	A	33.5	Very low	33.6	Very low	89 Å²	89	140.9 Å²	140.9	74%	0.736	81%	0.805	S	S	*	*			trans	98.8	113.2	141	0	0	0	0	0	121.1
22	D	30.8	Very low	33.3	Very low	144 Å²	144	143.4 Å²	143.4	77%	0.77	80%	0.804	S	S	*	*				147.7	99.6	122.3	-91.8	-0.4	0	0	0	111
23	T	29.3	Very low	32.3	Very low	115 Å²	115	143.4 Å²	143.4	71%	0.706	80%	0.803	S	S	*	*				60.1	111.3	91.8	58.8	0	0	0	0	115.7
24	T	32.6	Very low	31.9	Very low	146 Å²	146	137.8 Å²	137.8	90%	0.896	79%	0.792	S	S	*	*				-153.4	138.6	128.1	-41.9	0	0	0	0	109.6
25	E	30.9	Very low	31.9	Very low	166 Å²	166	140.6 Å²	140.6	78%	0.776	79%	0.787	S	S	*	*			trans	-82.6	157.7	-166	-57.7	165	128	0	0	114.5
26	E	30.3	Very low	31.2	Very low	181 Å²	181	142.7 Å²	142.7	85%	0.846	78%	0.784	S	S	*	*				-179.6	103.1	123.1	-101	-178.1	158.2	0	0	107.2
27	Q	31	Very low	31.2	Very low	151 Å²	151	147.5 Å²	147.5	71%	0.706	79%	0.79	S	S	*	*				51.5	128.3	88.2	-84	-171.1	2.4	0	0	112.8
28	M	30.6	Very low	30.9	Very low	162 Å²	162	148.3 Å²	148.3	80%	0.798	79%	0.789	S	S	*	*			cis	-160.5	165.9	15.1	-82.9	149.6	167.9	0	0	105
29	A	31.8	Very low	30.8	Very low	99 Å²	99	154.8 Å²	154.8	82%	0.818	80%	0.798	S	S	*	*			cis	-161.6	155	32.5	0	0	0	0	0	110.4
30	E	28	Very low	30.6	Very low	181 Å²	181	150.5 Å²	150.5	85%	0.846	79%	0.792	S	S	*	*			trans	-70.1	159.9	178.6	-60.5	162.9	147.3	0	0	113.2
31	T	30.2	Very low	30.6	Very low	127 Å²	127	149.2 Å²	149.2	78%	0.779	79%	0.792	S	S	*	*				-174.3	106.9	110.1	-53	0	0	0	0	110.5
32	E	30.5	Very low	30.5	Very low	162 Å²	162	154 Å²	154	76%	0.757	80%	0.799	S	S	*	*			trans	40.3	123	133.3	-65.2	-174.5	150.4	0	0	124.5
33	T	26.7	Very low	30.5	Very low	116 Å²	116	156.5 Å²	156.5	71%	0.712	81%	0.807	S	S	*	*				90.3	120	122.8	57.6	0	0	0	0	123.1
34	N	28	Very low	30.9	Very low	134 Å²	134	158.8 Å²	158.8	72%	0.717	81%	0.814	S	S	*	*			trans	72.2	111.1	133.5	-73.6	16.1	0	0	0	122.5
35	D	29.9	Very low	31	Very low	138 Å²	138	159.8 Å²	159.8	74%	0.738	81%	0.812	S	S	*	*				67	136	119.1	-62.9	-27.3	0	0	0	122.9
36	E	28.3	Very low	30.9	Very low	181 Å²	181	161.5 Å²	161.5	85%	0.846	82%	0.821	S	S	*	*			trans	89.2	105.3	153	-74.3	175.4	176.9	0	0	120.6
37	E	34.6	Very low	30.9	Very low	195 Å²	195	158.6 Å²	158.6	91%	0.911	82%	0.819	S	S	*	*			trans	26.9	110	135.5	-63.1	-173.9	159.4	0	0	119.5
38	Q	29.5	Very low	31	Very low	193 Å²	193	160.4 Å²	160.4	90%	0.902	83%	0.828	S	S	*	*			trans	-149.9	104.1	144.7	-156.1	161.2	19.3	0	0	111.8
39	F	31.6	Very low	31.2	Very low	203 Å²	203	157.7 Å²	157.7	89%	0.89	82%	0.82	S	S	*	*			trans	-67.2	123.9	154.3	-99.2	-99.9	0	0	0	108.1
40	D	29.7	Very low	31.1	Very low	141 Å²	141	162.5 Å²	162.5	75%	0.754	83%	0.825	S	S	*	*				-174.5	131.9	129	-110.7	-16.2	0	0	0	113.4
41	C	34.4	Very low	31.7	Very low	109 Å²	109	160.5 Å²	160.5	74%	0.736	83%	0.825	S	S	*	*			trans	34.3	98.3	145.9	-59.6	0	0	0	0	120.3
42	Q	31.5	Very low	31.8	Very low	189 Å²	189	157.8 Å²	157.8	88%	0.883	82%	0.822	S	S	*	*			trans	-154.5	65.4	151.8	-164	78.2	25.7	0	0	112.2
43	E	32.1	Very low	32.1	Very low	198 Å²	198	154.2 Å²	154.2	93%	0.925	82%	0.82	S	S	*	*	S	Bend	trans	-156.7	55.6	155.2	-146.8	172.9	-173.5	0	0	111.3
44	L	35.8	Very low	32.7	Very low	163 Å²	163	154.5 Å²	154.5	85%	0.853	82%	0.824	S	S	*	*			trans	-145.2	53.9	175.8	-127.3	179.3	0	0	0	110.6
45	L	34.8	Very low	33.3	Very low	166 Å²	166	156 Å²	156	87%	0.869	83%	0.827	S	S	*	*			trans	-164.3	66.8	162	-144.3	85.3	0	0	0	114.5
46	E	30.4	Very low	34	Very low	203 Å²	203	158.5 Å²	158.5	95%	0.949	83%	0.834	S	S	*	*			trans	-133.1	82.5	149.4	-81.1	-166.8	167.1	0	0	109.1
47	C	30.3	Very low	34.9	Very low	120 Å²	120	157.4 Å²	157.4	81%	0.811	83%	0.829	S	S	*	*			trans	-143.3	110.1	163.3	-142.4	0	0	0	0	108.6
48	Q	32.2	Very low	35.6	Very low	189 Å²	189	157 Å²	157	88%	0.883	83%	0.827	S	S	*	*			trans	150.9	128.8	151.2	-89.1	-176.5	36.8	0	0	109
49	V	34.5	Very low	36.7	Very low	104 Å²	104	156.4 Å²	156.4	63%	0.63	82%	0.824	S	S	*	*			cis	-161.3	132.4	7.4	151.5	0	0	0	0	105.4	V51	V49-V51 HydrophobicContact CG1-CG2 4.1Å
50	Q	30.1	Very low	37.9	Very low	200 Å²	200	154.1 Å²	154.1	94%	0.935	82%	0.816	S	S	*	*			trans	-144.5	123.5	143.4	-149.9	112.7	60.2	0	0	109.4
51	V	41.7	Very low	39.8	Very low	140 Å²	140	152 Å²	152	85%	0.848	81%	0.805	S	S	*	*			trans	-71.4	129.1	-171.4	172	0	0	0	0	111	V49	V49-V51 HydrophobicContact CG1-CG2 4.1Å
52	G	30.3	Very low	41.8	Very low	69 Å²	69	154.3 Å²	154.3	71%	0.711	81%	0.805	S	S	*	*			trans	151.1	87.2	166.4	0	0	0	0	0	112.6
53	A	37.8	Very low	44.3	Very low	87 Å²	87	147.1 Å²	147.1	72%	0.719	78%	0.781	S	S	*	*			trans	-61.3	160.2	163	0	0	0	0	0	110
54	P	38.5	Very low	46.9	Very low	122 Å²	122	142.8 Å²	142.8	79%	0.792	76%	0.764	S	S	*	*				-101.2	147.2	57.5	-3.8	22.9	0	0	0	110.8	E56	P54-E56 PolarHBondContact O-N 3.37Å; P54-E56 VanDerWaalsContact O-N 3.13Å
55	E	42.3	Very low	49.6	Very low	165 Å²	165	138.1 Å²	138.1	77%	0.771	74%	0.742	S	S	*	*			trans	-45.8	120.2	152.9	-65.3	169	165.6	0	0	106	E57	E55-E57 PolarHBondContact O-N 3.21Å
56	E	44.6	Very low	52.1	Low	192 Å²	192	133.8 Å²	133.8	90%	0.897	72%	0.722	S	S	*	*			trans	-61.8	90.6	158.5	-70.4	-177.7	178.9	0	0	103.7	P54 E58	P54-E56 PolarHBondContact O-N 3.37Å; P54-E56 VanDerWaalsContact O-N 3.13Å; E56-E58 PolarHBondContact O-N 3.33Å
57	E	45.4	Very low	54.9	Low	158 Å²	158	130.2 Å²	130.2	74%	0.738	71%	0.706	S	S	*	*			trans	-46.7	116.4	157.4	-68.6	-176.4	177.5	0	0	103.7	E55 E59	E55-E57 PolarHBondContact O-N 3.21Å; E57-E59 PolarHBondContact O-N 3.18Å
58	E	50.3	Low	57.9	Low	186 Å²	186	127.3 Å²	127.3	87%	0.869	69%	0.691	S	S	*	*			trans	-54.8	92	162	-71.9	-179.3	166.1	0	0	104.3	E56 E60	E56-E58 PolarHBondContact O-N 3.33Å; E58-E60 PolarHBondContact O-N 3.48Å
59	E	51.4	Low	60.8	Low	180 Å²	180	124.4 Å²	124.4	84%	0.841	68%	0.677	S	S	*	*			trans	-61.9	86.6	167.3	-75.3	-166.6	174.9	0	0	103.6	E57 D61	E57-E59 PolarHBondContact O-N 3.18Å; E59-D61 PolarHBondContact O-N 3.36Å
60	E	58.3	Low	63.6	Low	156 Å²	156	121.1 Å²	121.1	73%	0.729	66%	0.661	S	S	*	*			trans	-44.1	115.4	162.8	-79.8	-171.8	160.7	0	0	104.6	E58 E62	E58-E60 PolarHBondContact O-N 3.48Å; E60-E62 VanDerWaalsContact C-N 3.28Å; E60-E62 WeakPolarHBondContact O-CA 3.41Å; E60-E62 PolarHBondContact O-N 3.37Å
61	D	70.1	Confident	66.6	Low	97 Å²	97	114.7 Å²	114.7	52%	0.519	64%	0.635	S	S	.	*			trans	-54	97	-175.6	-176.8	-7.6	0	0	0	108	E59 G63 L64 V65	E59-D61 PolarHBondContact O-N 3.36Å; D61-G63 PolarHBondContact O-N 3.05Å; D61-G63 PolarHBondContact OD1-N 3.41Å; D61-L64 HydrophobicContact CB-CB 4.2Å; D61-L64 HydrophobicContact CB-CD1 3.84Å; D61-L64 HydrophobicContact CB-CG 3.89Å; D61-L64 WeakPolarHBondContact O-CA 3.26Å; D61-L64 WeakPolarHBondContact O-CB 3.35Å; D61-L64 PolarHBondContact O-N 3.35Å; D61-L64 WeakPolarHBondContact OD2-CG 3.34Å; D61-V65 PolarHBondContact O-N 3.44Å
62	E	75.5	Confident	69.2	Low	157 Å²	157	109.8 Å²	109.8	73%	0.734	61%	0.609	S	S	*	*	H	α-helix	trans	-58.7	-25.6	-170.5	-165.2	-177.7	178.7	0	0	109.5	E60 T66	E60-E62 VanDerWaalsContact C-N 3.28Å; E60-E62 WeakPolarHBondContact O-CA 3.41Å; E60-E62 PolarHBondContact O-N 3.37Å; E62-T66 WeakPolarHBondContact O-CB 3.45Å; E62-T66 VanDerWaalsContact O-CG2 3.26Å; E62-T66 WeakPolarHBondContact O-CG2 3.32Å; E62-T66 PolarHBondContact O-N 3.48Å; E62-T66 VanDerWaalsContact O-N 3.13Å; E62-T66 PolarHBondContact O-OG1 3.15Å
63	G	83.1	Confident	72.4	Confident	37 Å²	37	107.2 Å²	107.2	38%	0.381	58%	0.581	S	S	.	*	H	α-helix	trans	-64.5	-43.4	170.4	0	0	0	0	0	114.1	D61 T66 E67	D61-G63 PolarHBondContact O-N 3.05Å; D61-G63 PolarHBondContact OD1-N 3.41Å; G63-T66 WeakPolarHBondContact CA-OG1 3.49Å; G63-T66 PolarHBondContact O-OG1 3.27Å; G63-E67 WeakPolarHBondContact O-CB 3.45Å; G63-E67 PolarHBondContact O-N 3.1Å
64	L	88.4	Confident	75.1	Confident	108 Å²	108	103.6 Å²	103.6	57%	0.565	55%	0.552	S	S	*	*	H	α-helix	trans	-68.7	-39.1	178.5	-68	179.2	0	0	0	112.1	D61 E67 A68	D61-L64 HydrophobicContact CB-CB 4.2Å; D61-L64 HydrophobicContact CB-CD1 3.84Å; D61-L64 HydrophobicContact CB-CG 3.89Å; D61-L64 WeakPolarHBondContact O-CA 3.26Å; D61-L64 WeakPolarHBondContact O-CB 3.35Å; D61-L64 PolarHBondContact O-N 3.35Å; D61-L64 WeakPolarHBondContact OD2-CG 3.34Å; L64-E67 PolarHBondContact O-N 3.47Å; L64-A68 WeakPolarHBondContact O-CB 3.1Å; L64-A68 PolarHBondContact O-N 3.22Å
65	V	90.8	Very high	77.9	Confident	64 Å²	64	102.8 Å²	102.8	39%	0.388	53%	0.533	S	S	.	.	H	α-helix	trans	-64.5	-47.8	177.8	178.9	0	0	0	0	110.2	D61 E67 A68 E69	D61-V65 PolarHBondContact O-N 3.44Å; V65-E67 VanDerWaalsContact C-N 3.33Å; V65-E67 PolarHBondContact O-N 3.11Å; V65-A68 WeakPolarHBondContact O-CB 3.28Å; V65-A68 PolarHBondContact O-N 3.44Å; V65-E69 WeakPolarHBondContact O-CG 3.31Å; V65-E69 PolarHBondContact O-N 3.48Å
66	T	89.1	Confident	80.6	Confident	75 Å²	75	98.5 Å²	98.5	46%	0.46	51%	0.514	S	S	.	.	H	α-helix	trans	-64.8	-35.2	178.5	52.7	0	0	0	0	112.9	E62 G63 E69 A70	E62-T66 WeakPolarHBondContact O-CB 3.45Å; E62-T66 VanDerWaalsContact O-CG2 3.26Å; E62-T66 WeakPolarHBondContact O-CG2 3.32Å; E62-T66 PolarHBondContact O-N 3.48Å; E62-T66 VanDerWaalsContact O-N 3.13Å; E62-T66 PolarHBondContact O-OG1 3.15Å; G63-T66 WeakPolarHBondContact CA-OG1 3.49Å; G63-T66 PolarHBondContact O-OG1 3.27Å; T66-E69 PolarHBondContact O-N 2.81Å; T66-A70 PolarHBondContact O-N 3.23Å
67	E	89.1	Confident	83.1	Confident	128 Å²	128	89.4 Å²	89.4	60%	0.598	47%	0.472	S	S	*	.	H	α-helix	trans	-66.5	-42.5	172.9	-172.1	169.5	-169.9	0	0	111.6	G63 L64 V65 E69 A70 V71	G63-E67 WeakPolarHBondContact O-CB 3.45Å; G63-E67 PolarHBondContact O-N 3.1Å; L64-E67 PolarHBondContact O-N 3.47Å; V65-E67 VanDerWaalsContact C-N 3.33Å; V65-E67 PolarHBondContact O-N 3.11Å; E67-E69 PolarHBondContact O-N 3.01Å; E67-A70 PolarHBondContact O-N 3.28Å; E67-V71 WeakPolarHBondContact O-CG2 3.14Å; E67-V71 PolarHBondContact O-N 3.02Å
68	A	92.7	Very high	85.5	Confident	60 Å²	60	82.9 Å²	82.9	50%	0.496	44%	0.442	S	S	.	.	H	α-helix	trans	-62.2	-40.7	175.3	0	0	0	0	0	112.1	L64 V65 V71 A72	L64-A68 WeakPolarHBondContact O-CB 3.1Å; L64-A68 PolarHBondContact O-N 3.22Å; V65-A68 WeakPolarHBondContact O-CB 3.28Å; V65-A68 PolarHBondContact O-N 3.44Å; A68-V71 PolarHBondContact O-N 2.97Å; A68-A72 WeakPolarHBondContact O-CB 3.47Å; A68-A72 PolarHBondContact O-N 3.44Å
69	E	93.6	Very high	87.8	Confident	128 Å²	128	77.2 Å²	77.2	60%	0.598	42%	0.415	S	S	*	.	H	α-helix	trans	-60.7	-43.7	173.7	-73.5	-172.6	161.3	0	0	111.9	V65 T66 E67 V71 A72 A73	V65-E69 WeakPolarHBondContact O-CG 3.31Å; V65-E69 PolarHBondContact O-N 3.48Å; T66-E69 PolarHBondContact O-N 2.81Å; E67-E69 PolarHBondContact O-N 3.01Å; E69-V71 VanDerWaalsContact C-N 3.35Å; E69-V71 PolarHBondContact O-N 3.48Å; E69-A72 PolarHBondContact O-N 3.04Å; E69-A73 VanDerWaalsContact O-CB 3.3Å; E69-A73 WeakPolarHBondContact O-CB 3.27Å; E69-A73 PolarHBondContact O-N 3.38Å
70	A	91.9	Very high	90	Very high	35 Å²	35	69.7 Å²	69.7	29%	0.289	38%	0.38	S	S	.	.	H	α-helix	trans	-63	-41.2	177.4	0	0	0	0	0	111.9	T66 E67 A73 G74	T66-A70 PolarHBondContact O-N 3.23Å; E67-A70 PolarHBondContact O-N 3.28Å; A70-A73 PolarHBondContact O-N 2.92Å; A70-G74 PolarHBondContact O-N 2.96Å
71	V	94.4	Very high	91.9	Very high	65 Å²	65	62.2 Å²	62.2	39%	0.394	35%	0.345	S	S	.	.	H	α-helix	trans	-63.3	-48.1	174.9	171.5	0	0	0	0	110.8	E67 A68 E69 A73 G74 W75	E67-V71 WeakPolarHBondContact O-CG2 3.14Å; E67-V71 PolarHBondContact O-N 3.02Å; A68-V71 PolarHBondContact O-N 2.97Å; E69-V71 VanDerWaalsContact C-N 3.35Å; E69-V71 PolarHBondContact O-N 3.48Å; V71-A73 VanDerWaalsContact C-N 3.33Å; V71-A73 PolarHBondContact O-N 3.02Å; V71-G74 PolarHBondContact O-N 3.09Å; V71-G74 VanDerWaalsContact O-N 3.16Å; V71-W75 HydrophobicContact CG1-CD2 4.14Å; V71-W75 HydrophobicContact CG1-CE3 4.5Å; V71-W75 HydrophobicContact CG1-CH2 3.86Å; V71-W75 HydrophobicContact CG1-CZ2 3.42Å; V71-W75 VanDerWaalsContact CG1-CZ2 3.42Å; V71-W75 HydrophobicContact CG1-CZ3 4.37Å; V71-W75 PolarHBondContact O-N 3.36Å
72	A	96.1	Very high	93.2	Very high	36 Å²	36	57.7 Å²	57.7	30%	0.298	32%	0.321	S	S	.	.	H	α-helix	trans	-60.9	-42	178	0	0	0	0	0	111.7	A68 E69 G74 W75 M76	A68-A72 WeakPolarHBondContact O-CB 3.47Å; A68-A72 PolarHBondContact O-N 3.44Å; E69-A72 PolarHBondContact O-N 3.04Å; A72-G74 VanDerWaalsContact C-N 3.31Å; A72-G74 PolarHBondContact O-N 3.14Å; A72-W75 PolarHBondContact O-N 3.21Å; A72-M76 WeakPolarHBondContact O-CG 3.31Å; A72-M76 PolarHBondContact O-N 3.37Å
73	A	96.1	Very high	94.2	Very high	15 Å²	15	51.6 Å²	51.6	12%	0.124	30%	0.296	C	S	.	.	H	α-helix	trans	-62.2	-38.1	175.8	0	0	0	0	0	112.3	E69 A70 V71 M76 L77 L110	E69-A73 VanDerWaalsContact O-CB 3.3Å; E69-A73 WeakPolarHBondContact O-CB 3.27Å; E69-A73 PolarHBondContact O-N 3.38Å; A70-A73 PolarHBondContact O-N 2.92Å; V71-A73 VanDerWaalsContact C-N 3.33Å; V71-A73 PolarHBondContact O-N 3.02Å; A73-M76 HydrophobicContact CB-CE 4.37Å; A73-M76 PolarHBondContact O-N 3.14Å; A73-L77 WeakPolarHBondContact O-CB 3.27Å; A73-L77 PolarHBondContact O-N 3.12Å; A73-L110 HydrophobicContact CB-CD2 3.51Å
74	G	95.7	Very high	95	Very high	11 Å²	11	49.9 Å²	49.9	11%	0.113	28%	0.278	C	S	.	.	H	α-helix	trans	-59	-48.1	170.5	0	0	0	0	0	112.8	A70 V71 A72 M76 L77 D78	A70-G74 PolarHBondContact O-N 2.96Å; V71-G74 PolarHBondContact O-N 3.09Å; V71-G74 VanDerWaalsContact O-N 3.16Å; A72-G74 VanDerWaalsContact C-N 3.31Å; A72-G74 PolarHBondContact O-N 3.14Å; G74-M76 PolarHBondContact O-N 3.28Å; G74-L77 PolarHBondContact O-N 3.25Å; G74-D78 PolarHBondContact O-N 3.02Å; G74-D78 VanDerWaalsContact O-N 3.11Å
75	W	97.3	Very high	95.4	Very high	105 Å²	105	44.7 Å²	44.7	40%	0.398	25%	0.251	S	S	.	.	H	α-helix	trans	-63	-40	177.1	-63.7	-17.3	0	0	0	112.8	V71 A72 F79 F253 L254	V71-W75 HydrophobicContact CG1-CD2 4.14Å; V71-W75 HydrophobicContact CG1-CE3 4.5Å; V71-W75 HydrophobicContact CG1-CH2 3.86Å; V71-W75 HydrophobicContact CG1-CZ2 3.42Å; V71-W75 VanDerWaalsContact CG1-CZ2 3.42Å; V71-W75 HydrophobicContact CG1-CZ3 4.37Å; V71-W75 PolarHBondContact O-N 3.36Å; A72-W75 PolarHBondContact O-N 3.21Å; W75-F79 WeakPolarHBondContact O-CB 3.49Å; W75-F79 PolarHBondContact O-N 3.39Å; W75-F79 VanDerWaalsContact O-N 3.09Å; W75-F253 HydrophobicContact CD2-CB 4.44Å; W75-F253 AromaticContact CD2-CD1 3.49Å; W75-F253 HydrophobicContact CD2-CD1 3.49Å; W75-F253 VanDerWaalsContact CD2-CD1 3.49Å; W75-F253 HydrophobicContact CD2-CE1 4.02Å; W75-F253 HydrophobicContact CD2-CG 4.17Å; W75-F253 AromaticContact CE2-CD1 3.74Å; W75-F253 AromaticContact CE3-CD1 3.56Å; W75-F253 HydrophobicContact CE3-CD1 3.56Å; W75-F253 AromaticContact CE3-CE1 3.62Å; W75-F253 HydrophobicContact CE3-CE1 3.62Å; W75-F253 HydrophobicContact CG-CB 4.33Å; W75-F253 HydrophobicContact CG-CD1 4.01Å; W75-F253 HydrophobicContact CH2-CD1 4.12Å; W75-F253 AromaticContact CH2-CE1 3.82Å; W75-F253 HydrophobicContact CH2-CE1 3.82Å; W75-F253 HydrophobicContact CH2-CZ 4.14Å; W75-F253 HydrophobicContact CZ2-CD1 4.06Å; W75-F253 HydrophobicContact CZ2-CE1 4.2Å; W75-F253 HydrophobicContact CZ2-CG 4.29Å; W75-F253 AromaticContact CZ3-CD1 3.89Å; W75-F253 HydrophobicContact CZ3-CD1 3.89Å; W75-F253 AromaticContact CZ3-CE1 3.51Å; W75-F253 HydrophobicContact CZ3-CE1 3.51Å; W75-F253 HydrophobicContact CZ3-CZ 4.2Å; W75-L254 HydrophobicContact CB-CB 4.48Å
76	M	97.9	Very high	95.7	Very high	75 Å²	75	45.2 Å²	45.2	37%	0.369	25%	0.246	S	C	.	.	H	α-helix	trans	-64	-43.3	175.6	-72.6	-170.6	-74.4	0	0	111.6	A72 A73 G74 D78 F79 L80 I106	A72-M76 WeakPolarHBondContact O-CG 3.31Å; A72-M76 PolarHBondContact O-N 3.37Å; A73-M76 HydrophobicContact CB-CE 4.37Å; A73-M76 PolarHBondContact O-N 3.14Å; G74-M76 PolarHBondContact O-N 3.28Å; M76-D78 PolarHBondContact O-N 2.81Å; M76-F79 PolarHBondContact O-N 2.94Å; M76-L80 WeakPolarHBondContact O-CB 3.3Å; M76-L80 WeakPolarHBondContact O-CG 3.49Å; M76-L80 PolarHBondContact O-N 2.98Å; M76-I106 HydrophobicContact CB-CD1 4.4Å; M76-I106 HydrophobicContact CB-CG1 4.39Å; M76-I106 HydrophobicContact CB-CG2 4.35Å; M76-I106 HydrophobicContact CE-CD1 3.87Å; M76-I106 HydrophobicContact SD-CD1 3.9Å
77	L	97.5	Very high	96.1	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-46.2	177.4	175.5	59.1	0	0	0	111.7	A73 G74 L80 C81 I106 I107 L110 Q117 T120 I121	A73-L77 WeakPolarHBondContact O-CB 3.27Å; A73-L77 PolarHBondContact O-N 3.12Å; G74-L77 PolarHBondContact O-N 3.25Å; L77-L80 PolarHBondContact O-N 3.03Å; L77-C81 WeakPolarHBondContact O-CB 3.4Å; L77-C81 PolarHBondContact O-N 2.75Å; L77-I106 HydrophobicContact CB-CG2 4.3Å; L77-I107 HydrophobicContact CD1-CD1 3.74Å; L77-I107 HydrophobicContact CD1-CG1 3.6Å; L77-L110 HydrophobicContact CD2-CD1 4.04Å; L77-Q117 HydrophobicContact CD2-CB 4.02Å; L77-Q117 HydrophobicContact CD2-CG 4.14Å; L77-T120 HydrophobicContact CD1-CG2 4.19Å; L77-T120 HydrophobicContact CD2-CG2 4.29Å; L77-T120 HydrophobicContact CG-CG2 3.84Å; L77-I121 HydrophobicContact CD2-CG1 4.17Å
78	D	96.9	Very high	96.6	Very high	21 Å²	21	36.3 Å²	36.3	11%	0.112	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-46.1	178	-86.8	-28.9	0	0	0	112.6	G74 M76 L80 C81 L82 Y116 K249 T252	G74-D78 PolarHBondContact O-N 3.02Å; G74-D78 VanDerWaalsContact O-N 3.11Å; M76-D78 PolarHBondContact O-N 2.81Å; D78-L80 VanDerWaalsContact C-N 3.34Å; D78-L80 PolarHBondContact O-N 3.37Å; D78-C81 PolarHBondContact O-N 2.92Å; D78-L82 WeakPolarHBondContact O-CB 3.48Å; D78-L82 PolarHBondContact O-N 3.39Å; D78-Y116 VanDerWaalsContact OD1-CE1 3.31Å; D78-Y116 WeakPolarHBondContact OD1-CE1 3.45Å; D78-Y116 PolarHBondContact OD1-OH 3.18Å; D78-Y116 WeakPolarHBondContact OD2-CE1 3.42Å; D78-K249 IonicContact OD1-NZ 2.82Å; D78-K249 PolarHBondContact OD1-NZ 2.93Å; D78-T252 HydrophobicContact CB-CG2 3.9Å
79	F	97.8	Very high	96.8	Very high	67 Å²	67	37.8 Å²	37.8	29%	0.294	19%	0.191	S	C	.	.	H	α-helix	trans	-60.5	-44.5	177.3	174.4	-92.5	0	0	0	111.9	W75 M76 L82 S83 L254 M255	W75-F79 WeakPolarHBondContact O-CB 3.49Å; W75-F79 PolarHBondContact O-N 3.39Å; W75-F79 VanDerWaalsContact O-N 3.09Å; M76-F79 PolarHBondContact O-N 2.94Å; F79-L82 PolarHBondContact O-N 3.15Å; F79-S83 WeakPolarHBondContact O-CB 3.49Å; F79-S83 PolarHBondContact O-N 3.42Å; F79-L254 HydrophobicContact CB-CB 4.23Å; F79-L254 HydrophobicContact CB-CD2 3.78Å; F79-L254 HydrophobicContact CB-CG 4.4Å; F79-L254 HydrophobicContact CD1-CD2 4.37Å; F79-L254 HydrophobicContact CD2-CB 4.43Å; F79-L254 HydrophobicContact CD2-CD2 4.19Å; F79-L254 HydrophobicContact CD2-CG 4.24Å; F79-L254 HydrophobicContact CG-CD2 3.87Å; F79-L254 HydrophobicContact CG-CG 4.4Å; F79-M255 HydrophobicContact CD2-CE 3.55Å; F79-M255 HydrophobicContact CE2-CE 3.31Å; F79-M255 HydrophobicContact CZ-CE 4.36Å
80	L	98.2	Very high	96.9	Very high	22 Å²	22	35.3 Å²	35.3	12%	0.115	18%	0.182	C	C	.	.	H	α-helix	trans	-67.5	-40.4	179.3	-71.5	169	0	0	0	111.5	M76 L77 D78 L82 S83 L84 T99 A103 I106	M76-L80 WeakPolarHBondContact O-CB 3.3Å; M76-L80 WeakPolarHBondContact O-CG 3.49Å; M76-L80 PolarHBondContact O-N 2.98Å; L77-L80 PolarHBondContact O-N 3.03Å; D78-L80 VanDerWaalsContact C-N 3.34Å; D78-L80 PolarHBondContact O-N 3.37Å; L80-L82 VanDerWaalsContact C-N 3.34Å; L80-L82 PolarHBondContact O-N 3.24Å; L80-S83 PolarHBondContact O-N 2.93Å; L80-L84 VanDerWaalsContact O-CB 3.24Å; L80-L84 WeakPolarHBondContact O-CB 3.3Å; L80-L84 PolarHBondContact O-N 2.92Å; L80-T99 HydrophobicContact CB-CG2 4.46Å; L80-T99 HydrophobicContact CD2-CG2 4.05Å; L80-T99 VanDerWaalsContact O-CG2 3.27Å; L80-T99 WeakPolarHBondContact O-CG2 3.39Å; L80-A103 HydrophobicContact CB-CB 4.14Å; L80-A103 HydrophobicContact CD1-CB 4.44Å; L80-I106 HydrophobicContact CD1-CB 4.25Å; L80-I106 HydrophobicContact CD1-CG1 3.62Å
81	C	97.9	Very high	97.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.7	-44.9	173	-179	0	0	0	0	111.4	L77 D78 L84 C85 T120	L77-C81 WeakPolarHBondContact O-CB 3.4Å; L77-C81 PolarHBondContact O-N 2.75Å; D78-C81 PolarHBondContact O-N 2.92Å; C81-L84 PolarHBondContact O-N 3.18Å; C81-C85 WeakPolarHBondContact O-CB 3.42Å; C81-C85 PolarHBondContact O-N 3.05Å; C81-C85 PolarHBondContact O-SG 2.91Å; C81-T120 HydrophobicContact CB-CG2 3.46Å; C81-T120 VanDerWaalsContact CB-CG2 3.46Å
82	L	97	Very high	97.2	Very high	1 Å²	1	38 Å²	38	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-62.8	-43.8	176.8	-173.7	71.7	0	0	0	111.8	D78 F79 L80 C85 R86 L246 K249 M255	D78-L82 WeakPolarHBondContact O-CB 3.48Å; D78-L82 PolarHBondContact O-N 3.39Å; F79-L82 PolarHBondContact O-N 3.15Å; L80-L82 VanDerWaalsContact C-N 3.34Å; L80-L82 PolarHBondContact O-N 3.24Å; L82-C85 PolarHBondContact O-N 2.97Å; L82-R86 WeakPolarHBondContact O-CG 3.29Å; L82-R86 PolarHBondContact O-N 3.19Å; L82-L246 HydrophobicContact CD1-CD2 3.54Å; L82-L246 HydrophobicContact CG-CD2 4.34Å; L82-K249 HydrophobicContact CD1-CB 4.01Å; L82-M255 HydrophobicContact CD2-CB 3.84Å; L82-M255 HydrophobicContact CD2-CE 3.72Å; L82-M255 HydrophobicContact CD2-CG 3.57Å; L82-M255 HydrophobicContact CD2-SD 4.18Å
83	S	97.4	Very high	97.1	Very high	29 Å²	29	40.6 Å²	40.6	20%	0.203	21%	0.213	C	C	.	.	H	α-helix	trans	-62.5	-42.3	175.2	-177	0	0	0	0	111.7	F79 L80 R86 A87 T99	F79-S83 WeakPolarHBondContact O-CB 3.49Å; F79-S83 PolarHBondContact O-N 3.42Å; L80-S83 PolarHBondContact O-N 2.93Å; S83-R86 PolarHBondContact O-N 2.75Å; S83-A87 WeakPolarHBondContact O-CB 3.39Å; S83-A87 PolarHBondContact O-N 3.49Å; S83-T99 PolarHBondContact OG-OG1 3.42Å
84	L	98.3	Very high	97.1	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-63.9	-44.6	179.5	-169.7	72.4	0	0	0	110.7	L80 C81 R86 A87 F88 F96 T99 R100 C124	L80-L84 VanDerWaalsContact O-CB 3.24Å; L80-L84 WeakPolarHBondContact O-CB 3.3Å; L80-L84 PolarHBondContact O-N 2.92Å; C81-L84 PolarHBondContact O-N 3.18Å; L84-R86 PolarHBondContact O-N 3.47Å; L84-A87 PolarHBondContact O-N 3.29Å; L84-F88 VanDerWaalsContact O-CB 3.31Å; L84-F88 WeakPolarHBondContact O-CB 3.32Å; L84-F88 PolarHBondContact O-N 2.91Å; L84-F96 HydrophobicContact CD1-CD1 4.41Å; L84-F96 HydrophobicContact CD1-CD2 3.46Å; L84-F96 VanDerWaalsContact CD1-CD2 3.46Å; L84-F96 HydrophobicContact CD1-CE1 4.39Å; L84-F96 HydrophobicContact CD1-CE2 3.43Å; L84-F96 VanDerWaalsContact CD1-CE2 3.43Å; L84-F96 HydrophobicContact CD1-CG 3.98Å; L84-F96 HydrophobicContact CD1-CZ 3.93Å; L84-F96 WeakPolarHBondContact CD1-O 3.36Å; L84-F96 HydrophobicContact CD2-CE2 4.34Å; L84-F96 HydrophobicContact CG-CD2 3.96Å; L84-F96 HydrophobicContact CG-CE2 3.6Å; L84-F96 HydrophobicContact CG-CZ 4.29Å; L84-T99 HydrophobicContact CB-CG2 3.88Å; L84-T99 HydrophobicContact CD1-CG2 4.2Å; L84-R100 HydrophobicContact CD1-CB 4.04Å; L84-C124 HydrophobicContact CD2-CB 3.78Å
85	C	98.1	Very high	97.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.2	-45.1	174.2	-74.5	0	0	0	0	112	C81 L82 F88 R89 V242 L246	C81-C85 WeakPolarHBondContact O-CB 3.42Å; C81-C85 PolarHBondContact O-N 3.05Å; C81-C85 PolarHBondContact O-SG 2.91Å; L82-C85 PolarHBondContact O-N 2.97Å; C85-F88 PolarHBondContact O-N 3.32Å; C85-R89 WeakPolarHBondContact O-CB 3.43Å; C85-R89 PolarHBondContact O-N 3.25Å; C85-V242 HydrophobicContact CB-CG1 3.76Å; C85-V242 WeakPolarHBondContact O-CG1 3.43Å; C85-L246 HydrophobicContact CB-CD2 3.4Å; C85-L246 VanDerWaalsContact CB-CD2 3.4Å; C85-L246 HydrophobicContact CB-CG 4Å
86	R	97.3	Very high	97.3	Very high	74 Å²	74	42.1 Å²	42.1	28%	0.279	22%	0.22	S	C	.	.	H	α-helix	trans	-63.9	-49.2	176.4	-70.9	178.6	-177.8	145	-2.2	111.4	L82 S83 L84 F88 R89 D90 L246 M255	L82-R86 WeakPolarHBondContact O-CG 3.29Å; L82-R86 PolarHBondContact O-N 3.19Å; S83-R86 PolarHBondContact O-N 2.75Å; L84-R86 PolarHBondContact O-N 3.47Å; R86-F88 VanDerWaalsContact C-N 3.27Å; R86-F88 PolarHBondContact O-N 3Å; R86-R89 PolarHBondContact O-N 2.68Å; R86-D90 WeakPolarHBondContact O-CB 3.44Å; R86-D90 PolarHBondContact O-N 2.92Å; R86-D90 VanDerWaalsContact O-OD2 3.07Å; R86-L246 HydrophobicContact CG-CD1 4.28Å; R86-L246 HydrophobicContact CG-CD2 3.65Å; R86-M255 PolarHBondContact NH1-SD 3.36Å; R86-M255 VanDerWaalsContact NH1-SD 3.37Å
87	A	98	Very high	97.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.8	-39.4	179.2	0	0	0	0	0	112	S83 L84 G91 R92 D95 F96	S83-A87 WeakPolarHBondContact O-CB 3.39Å; S83-A87 PolarHBondContact O-N 3.49Å; L84-A87 PolarHBondContact O-N 3.29Å; A87-G91 PolarHBondContact O-N 3.07Å; A87-G91 VanDerWaalsContact O-N 3.11Å; A87-R92 HydrophobicContact CB-CB 4.41Å; A87-R92 PolarHBondContact O-N 3.39Å; A87-D95 HydrophobicContact CB-CB 4.18Å; A87-F96 HydrophobicContact CB-CB 3.93Å; A87-F96 HydrophobicContact CB-CD2 4.44Å
88	F	98.1	Very high	97.2	Very high	16 Å²	16	49 Å²	49	7%	0.07	24%	0.242	C	C	.	.	H	α-helix	trans	-63.1	-51.8	174.8	-178	-89.6	0	0	0	112.1	L84 C85 R86 D90 G91 F96 L127 I130 A131 M235 I238 K239 V242	L84-F88 VanDerWaalsContact O-CB 3.31Å; L84-F88 WeakPolarHBondContact O-CB 3.32Å; L84-F88 PolarHBondContact O-N 2.91Å; C85-F88 PolarHBondContact O-N 3.32Å; R86-F88 VanDerWaalsContact C-N 3.27Å; R86-F88 PolarHBondContact O-N 3Å; F88-D90 VanDerWaalsContact C-N 3.3Å; F88-D90 PolarHBondContact O-N 3.37Å; F88-G91 PolarHBondContact O-N 2.97Å; F88-F96 HydrophobicContact CB-CD2 3.86Å; F88-F96 HydrophobicContact CB-CE2 3.8Å; F88-F96 HydrophobicContact CD2-CD2 4.4Å; F88-F96 AromaticContact CD2-CE2 3.82Å; F88-F96 HydrophobicContact CD2-CE2 3.82Å; F88-F96 HydrophobicContact CD2-CZ 4.29Å; F88-F96 HydrophobicContact CG-CE2 4.28Å; F88-L127 HydrophobicContact CD1-CD2 4.06Å; F88-L127 HydrophobicContact CD2-CB 4.31Å; F88-L127 HydrophobicContact CD2-CD2 4.28Å; F88-L127 HydrophobicContact CE1-CD2 4.06Å; F88-L127 HydrophobicContact CE2-CD2 4.26Å; F88-L127 HydrophobicContact CG-CD2 4.18Å; F88-L127 HydrophobicContact CZ-CD2 4.15Å; F88-I130 HydrophobicContact CE2-CB 4.4Å; F88-I130 HydrophobicContact CE2-CG2 4.02Å; F88-I130 HydrophobicContact CZ-CB 4.44Å; F88-I130 HydrophobicContact CZ-CG2 3.72Å; F88-A131 HydrophobicContact CD2-CB 4.48Å; F88-A131 HydrophobicContact CE2-CB 4.28Å; F88-M235 HydrophobicContact CE1-CE 4.03Å; F88-M235 HydrophobicContact CE2-CE 4Å; F88-M235 HydrophobicContact CZ-CE 3.4Å; F88-M235 HydrophobicContact CZ-SD 4.22Å; F88-I238 HydrophobicContact CE1-CG2 3.88Å; F88-I238 HydrophobicContact CZ-CG2 4.03Å; F88-K239 HydrophobicContact CE1-CG 4.45Å; F88-V242 HydrophobicContact CD1-CG2 4Å; F88-V242 HydrophobicContact CE1-CG2 4.26Å
89	R	97.4	Very high	97.2	Very high	92 Å²	92	48.6 Å²	48.6	35%	0.347	24%	0.241	S	C	.	.	H	α-helix	trans	-58.7	-44.1	179.9	-178.1	-163.5	66.5	-173.4	-1.3	111.6	C85 R86 G91 V242 N243	C85-R89 WeakPolarHBondContact O-CB 3.43Å; C85-R89 PolarHBondContact O-N 3.25Å; R86-R89 PolarHBondContact O-N 2.68Å; R89-G91 VanDerWaalsContact C-N 3.27Å; R89-G91 PolarHBondContact O-N 3.35Å; R89-V242 HydrophobicContact CB-CG1 4.24Å; R89-N243 WeakPolarHBondContact CD-OD1 3.46Å
90	D	96.4	Very high	97.2	Very high	75 Å²	75	48 Å²	48	40%	0.401	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-5.1	-176	-53.7	-21.6	0	0	0	112.8	R86 F88 R92	R86-D90 WeakPolarHBondContact O-CB 3.44Å; R86-D90 PolarHBondContact O-N 2.92Å; R86-D90 VanDerWaalsContact O-OD2 3.07Å; F88-D90 VanDerWaalsContact C-N 3.3Å; F88-D90 PolarHBondContact O-N 3.37Å; D90-R92 VanDerWaalsContact C-N 3.3Å; D90-R92 HydrophobicContact CB-CG 4.07Å; D90-R92 PolarHBondContact O-N 2.89Å; D90-R92 IonicContact OD2-CZ 3.46Å; D90-R92 IonicContact OD2-NE 2.75Å; D90-R92 PolarHBondContact OD2-NE 3.09Å; D90-R92 IonicContact OD2-NH2 3.05Å; D90-R92 PolarHBondContact OD2-NH2 3.14Å
91	G	94.9	Very high	97.1	Very high	62 Å²	62	49.9 Å²	49.9	64%	0.639	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.6	21.8	-178.2	0	0	0	0	0	114.6	A87 F88 R89 S93	A87-G91 PolarHBondContact O-N 3.07Å; A87-G91 VanDerWaalsContact O-N 3.11Å; F88-G91 PolarHBondContact O-N 2.97Å; R89-G91 VanDerWaalsContact C-N 3.27Å; R89-G91 PolarHBondContact O-N 3.35Å; G91-S93 PolarHBondContact O-N 3.07Å; G91-S93 VanDerWaalsContact O-N 3.11Å
92	R	97.6	Very high	97.1	Very high	96 Å²	96	52.6 Å²	52.6	36%	0.362	27%	0.266	S	S	.	.			trans	-82.7	83.5	-179.5	-66.2	-175.1	-70	128	-3.6	110.8	A87 D90 E94 D95 F96	A87-R92 HydrophobicContact CB-CB 4.41Å; A87-R92 PolarHBondContact O-N 3.39Å; D90-R92 VanDerWaalsContact C-N 3.3Å; D90-R92 HydrophobicContact CB-CG 4.07Å; D90-R92 PolarHBondContact O-N 2.89Å; D90-R92 IonicContact OD2-CZ 3.46Å; D90-R92 IonicContact OD2-NE 2.75Å; D90-R92 PolarHBondContact OD2-NE 3.09Å; D90-R92 IonicContact OD2-NH2 3.05Å; D90-R92 PolarHBondContact OD2-NH2 3.14Å; R92-E94 PolarHBondContact O-N 2.98Å; R92-D95 HydrophobicContact CB-CB 4.01Å; R92-D95 WeakPolarHBondContact CD-OD2 3.44Å; R92-D95 IonicContact CZ-OD2 2.89Å; R92-D95 IonicContact NE-OD2 3.85Å; R92-D95 IonicContact NH1-OD2 3.93Å; R92-D95 PolarHBondContact NH1-OD2 3.33Å; R92-D95 PolarHBondContact O-N 3.15Å; R92-F96 WeakPolarHBondContact O-CB 3.09Å; R92-F96 PolarHBondContact O-N 3.38Å
93	S	94.3	Very high	97.1	Very high	90 Å²	90	52.6 Å²	52.6	63%	0.629	27%	0.266	S	S	*	.	H	α-helix	trans	-57.3	-47.6	-172.4	57.6	0	0	0	0	114.5	G91 F96 R97	G91-S93 PolarHBondContact O-N 3.07Å; G91-S93 VanDerWaalsContact O-N 3.11Å; S93-F96 WeakPolarHBondContact O-CB 2.96Å; S93-F96 PolarHBondContact O-N 3.24Å; S93-R97 WeakPolarHBondContact O-CB 2.99Å; S93-R97 PolarHBondContact O-N 3.23Å
94	E	96.2	Very high	97	Very high	86 Å²	86	52.4 Å²	52.4	40%	0.402	26%	0.262	S	S	.	.	H	α-helix	trans	-68.5	-38.3	-179.1	-78.3	-56	125	0	0	112.3	R92 F96 R97 R98	R92-E94 PolarHBondContact O-N 2.98Å; E94-F96 VanDerWaalsContact C-N 3.34Å; E94-R97 PolarHBondContact O-N 3.37Å; E94-R97 IonicContact OE1-NE 3.62Å; E94-R97 IonicContact OE2-CZ 2.97Å; E94-R97 IonicContact OE2-NE 3.05Å; E94-R97 PolarHBondContact OE2-NE 2.82Å; E94-R97 IonicContact OE2-NH2 3.2Å; E94-R97 PolarHBondContact OE2-NH2 3.05Å; E94-R98 WeakPolarHBondContact O-CG 3.42Å; E94-R98 PolarHBondContact O-N 3Å; E94-R98 IonicContact OE2-NH2 3.37Å
95	D	97.3	Very high	96.9	Very high	56 Å²	56	55.5 Å²	55.5	30%	0.299	29%	0.287	S	S	.	.	H	α-helix	trans	-68.3	-38.3	176.5	-64.1	-18.1	0	0	0	111.1	A87 R92 R97 R98 T99	A87-D95 HydrophobicContact CB-CB 4.18Å; R92-D95 HydrophobicContact CB-CB 4.01Å; R92-D95 WeakPolarHBondContact CD-OD2 3.44Å; R92-D95 IonicContact CZ-OD2 2.89Å; R92-D95 IonicContact NE-OD2 3.85Å; R92-D95 IonicContact NH1-OD2 3.93Å; R92-D95 PolarHBondContact NH1-OD2 3.33Å; R92-D95 PolarHBondContact O-N 3.15Å; D95-R97 VanDerWaalsContact C-N 3.34Å; D95-R98 PolarHBondContact O-N 3.33Å; D95-R98 IonicContact OD1-NH1 3.72Å; D95-R98 PolarHBondContact OD1-NH1 2.7Å; D95-T99 VanDerWaalsContact O-CB 3.27Å; D95-T99 WeakPolarHBondContact O-CB 3.5Å; D95-T99 PolarHBondContact O-N 3.11Å; D95-T99 PolarHBondContact O-OG1 3.03Å
96	F	97.9	Very high	96.8	Very high	20 Å²	20	57.3 Å²	57.3	9%	0.088	30%	0.296	C	S	.	.	H	α-helix	trans	-59.4	-46.4	172.2	-177	-91.6	0	0	0	110.6	L84 A87 F88 R92 S93 E94 T99 R100 L127 T128 A131	L84-F96 HydrophobicContact CD1-CD1 4.41Å; L84-F96 HydrophobicContact CD1-CD2 3.46Å; L84-F96 VanDerWaalsContact CD1-CD2 3.46Å; L84-F96 HydrophobicContact CD1-CE1 4.39Å; L84-F96 HydrophobicContact CD1-CE2 3.43Å; L84-F96 VanDerWaalsContact CD1-CE2 3.43Å; L84-F96 HydrophobicContact CD1-CG 3.98Å; L84-F96 HydrophobicContact CD1-CZ 3.93Å; L84-F96 WeakPolarHBondContact CD1-O 3.36Å; L84-F96 HydrophobicContact CD2-CE2 4.34Å; L84-F96 HydrophobicContact CG-CD2 3.96Å; L84-F96 HydrophobicContact CG-CE2 3.6Å; L84-F96 HydrophobicContact CG-CZ 4.29Å; A87-F96 HydrophobicContact CB-CB 3.93Å; A87-F96 HydrophobicContact CB-CD2 4.44Å; F88-F96 HydrophobicContact CB-CD2 3.86Å; F88-F96 HydrophobicContact CB-CE2 3.8Å; F88-F96 HydrophobicContact CD2-CD2 4.4Å; F88-F96 AromaticContact CD2-CE2 3.82Å; F88-F96 HydrophobicContact CD2-CE2 3.82Å; F88-F96 HydrophobicContact CD2-CZ 4.29Å; F88-F96 HydrophobicContact CG-CE2 4.28Å; R92-F96 WeakPolarHBondContact O-CB 3.09Å; R92-F96 PolarHBondContact O-N 3.38Å; S93-F96 WeakPolarHBondContact O-CB 2.96Å; S93-F96 PolarHBondContact O-N 3.24Å; E94-F96 VanDerWaalsContact C-N 3.34Å; F96-T99 PolarHBondContact O-N 3.44Å; F96-R100 WeakPolarHBondContact O-CB 3.18Å; F96-R100 PolarHBondContact O-N 2.93Å; F96-L127 HydrophobicContact CE2-CB 4.29Å; F96-L127 HydrophobicContact CZ-CB 4.34Å; F96-T128 HydrophobicContact CE1-CG2 4.14Å; F96-T128 HydrophobicContact CZ-CG2 3.96Å; F96-A131 HydrophobicContact CE1-CB 3.79Å; F96-A131 HydrophobicContact CZ-CB 3.96Å
97	R	96.1	Very high	96.8	Very high	96 Å²	96	54.5 Å²	54.5	36%	0.362	29%	0.287	S	S	.	.	H	α-helix	trans	-62.4	-46.2	178.6	-169.7	-174	63.8	77.2	0.7	112.6	S93 E94 D95 R100 N101	S93-R97 WeakPolarHBondContact O-CB 2.99Å; S93-R97 PolarHBondContact O-N 3.23Å; E94-R97 PolarHBondContact O-N 3.37Å; E94-R97 IonicContact OE1-NE 3.62Å; E94-R97 IonicContact OE2-CZ 2.97Å; E94-R97 IonicContact OE2-NE 3.05Å; E94-R97 PolarHBondContact OE2-NE 2.82Å; E94-R97 IonicContact OE2-NH2 3.2Å; E94-R97 PolarHBondContact OE2-NH2 3.05Å; D95-R97 VanDerWaalsContact C-N 3.34Å; R97-R100 PolarHBondContact O-N 2.9Å; R97-N101 VanDerWaalsContact O-CG 3.3Å; R97-N101 PolarHBondContact O-N 3.03Å; R97-N101 VanDerWaalsContact O-N 3.1Å; R97-N101 PolarHBondContact O-OD1 3.1Å
98	R	97.9	Very high	96.5	Very high	124 Å²	124	59.1 Å²	59.1	47%	0.468	31%	0.308	S	S	.	.	H	α-helix	trans	-64	-45.7	177.7	-69	-179.8	-164.4	100.6	6.3	111.7	E94 D95 R100 N101 S102	E94-R98 WeakPolarHBondContact O-CG 3.42Å; E94-R98 PolarHBondContact O-N 3Å; E94-R98 IonicContact OE2-NH2 3.37Å; D95-R98 PolarHBondContact O-N 3.33Å; D95-R98 IonicContact OD1-NH1 3.72Å; D95-R98 PolarHBondContact OD1-NH1 2.7Å; R98-R100 VanDerWaalsContact C-N 3.34Å; R98-R100 PolarHBondContact O-N 2.89Å; R98-N101 PolarHBondContact O-N 2.91Å; R98-S102 PolarHBondContact O-N 3.25Å; R98-S102 PolarHBondContact O-OG 3.37Å
99	T	98.2	Very high	96.2	Very high	14 Å²	14	61.3 Å²	61.3	9%	0.086	34%	0.336	C	S	.	.	H	α-helix	trans	-64.1	-41.7	179.3	-54.4	0	0	0	0	110.9	L80 S83 L84 D95 F96 S102 A103	L80-T99 HydrophobicContact CB-CG2 4.46Å; L80-T99 HydrophobicContact CD2-CG2 4.05Å; L80-T99 VanDerWaalsContact O-CG2 3.27Å; L80-T99 WeakPolarHBondContact O-CG2 3.39Å; S83-T99 PolarHBondContact OG-OG1 3.42Å; L84-T99 HydrophobicContact CB-CG2 3.88Å; L84-T99 HydrophobicContact CD1-CG2 4.2Å; D95-T99 VanDerWaalsContact O-CB 3.27Å; D95-T99 WeakPolarHBondContact O-CB 3.5Å; D95-T99 PolarHBondContact O-N 3.11Å; D95-T99 PolarHBondContact O-OG1 3.03Å; F96-T99 PolarHBondContact O-N 3.44Å; T99-S102 PolarHBondContact O-N 3.17Å; T99-A103 WeakPolarHBondContact O-CB 3.25Å; T99-A103 PolarHBondContact O-N 2.89Å
100	R	97.2	Very high	95.9	Very high	55 Å²	55	58.3 Å²	58.3	21%	0.208	33%	0.326	C	S	.	.	H	α-helix	trans	-56.2	-51.9	174.2	175.9	-161.8	70.8	-176	2	111.6	L84 F96 R97 R98 S102 A103 E104 T128 F320	L84-R100 HydrophobicContact CD1-CB 4.04Å; F96-R100 WeakPolarHBondContact O-CB 3.18Å; F96-R100 PolarHBondContact O-N 2.93Å; R97-R100 PolarHBondContact O-N 2.9Å; R98-R100 VanDerWaalsContact C-N 3.34Å; R98-R100 PolarHBondContact O-N 2.89Å; R100-S102 PolarHBondContact O-N 3.26Å; R100-A103 PolarHBondContact O-N 2.99Å; R100-E104 PolarHBondContact O-N 3.29Å; R100-T128 HydrophobicContact CB-CG2 4.47Å; R100-T128 HydrophobicContact CG-CG2 3.71Å; R100-F320 HydrophobicContact CG-CB 3.62Å; R100-F320 HydrophobicContact CG-CG 4.14Å
101	N	96.3	Very high	95.5	Very high	61 Å²	61	60.4 Å²	60.4	33%	0.326	35%	0.347	S	S	.	.	H	α-helix	trans	-61.1	-37.8	-179.1	-69.1	5.4	0	0	0	111.4	R97 R98 E104 A105	R97-N101 VanDerWaalsContact O-CG 3.3Å; R97-N101 PolarHBondContact O-N 3.03Å; R97-N101 VanDerWaalsContact O-N 3.1Å; R97-N101 PolarHBondContact O-OD1 3.1Å; R98-N101 PolarHBondContact O-N 2.91Å; N101-E104 PolarHBondContact O-N 3.45Å; N101-A105 PolarHBondContact O-N 3.39Å; N101-A105 VanDerWaalsContact O-N 3.14Å
102	S	97.9	Very high	95.2	Very high	57 Å²	57	61 Å²	61	40%	0.399	34%	0.341	S	S	.	.	H	α-helix	trans	-66.6	-45	176.2	-51.6	0	0	0	0	111.2	R98 T99 R100 E104 A105 I106	R98-S102 PolarHBondContact O-N 3.25Å; R98-S102 PolarHBondContact O-OG 3.37Å; T99-S102 PolarHBondContact O-N 3.17Å; R100-S102 PolarHBondContact O-N 3.26Å; S102-E104 VanDerWaalsContact C-N 3.32Å; S102-E104 PolarHBondContact O-N 3.4Å; S102-A105 PolarHBondContact O-N 2.92Å; S102-I106 WeakPolarHBondContact O-CG1 3.46Å; S102-I106 PolarHBondContact O-N 2.91Å
103	A	97.3	Very high	95	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.008	35%	0.347	C	S	.	.	H	α-helix	trans	-61.5	-41	176.5	0	0	0	0	0	111.6	L80 T99 R100 I106 I107	L80-A103 HydrophobicContact CB-CB 4.14Å; L80-A103 HydrophobicContact CD1-CB 4.44Å; T99-A103 WeakPolarHBondContact O-CB 3.25Å; T99-A103 PolarHBondContact O-N 2.89Å; R100-A103 PolarHBondContact O-N 2.99Å; A103-I106 PolarHBondContact O-N 2.92Å; A103-I107 WeakPolarHBondContact O-CB 3.33Å; A103-I107 WeakPolarHBondContact O-CD1 3.2Å; A103-I107 WeakPolarHBondContact O-CG1 3.48Å; A103-I107 PolarHBondContact O-N 2.81Å
104	E	95	Very high	95	Very high	25 Å²	25	60 Å²	60	12%	0.117	34%	0.338	C	S	.	.	H	α-helix	trans	-58.3	-48	175.5	-168.8	158.6	-132	0	0	112.1	R100 N101 S102 I107 H108 L319 F320 V321	R100-E104 PolarHBondContact O-N 3.29Å; N101-E104 PolarHBondContact O-N 3.45Å; S102-E104 VanDerWaalsContact C-N 3.32Å; S102-E104 PolarHBondContact O-N 3.4Å; E104-I107 PolarHBondContact O-N 2.78Å; E104-H108 PolarHBondContact O-CD2 3.33Å; E104-H108 PolarHBondContact O-N 3.44Å; E104-L319 HydrophobicContact CG-CB 4.47Å; E104-L319 PolarHBondContact OE1-N 3.21Å; E104-F320 HydrophobicContact CB-CD2 3.51Å; E104-F320 HydrophobicContact CB-CE2 4.1Å; E104-F320 HydrophobicContact CB-CG 4.49Å; E104-F320 HydrophobicContact CG-CD2 3.71Å; E104-F320 HydrophobicContact CG-CE2 4.45Å; E104-F320 PolarHBondContact OE1-N 3.11Å; E104-V321 PolarHBondContact OE1-N 3.44Å; E104-V321 WeakPolarHBondContact OE2-CG2 3.2Å
105	A	96.3	Very high	94.8	Very high	65 Å²	65	60 Å²	60	54%	0.537	35%	0.353	S	S	.	.	H	α-helix	trans	-60.6	-46.7	178	0	0	0	0	0	111.9	N101 S102 I107 H108 G109	N101-A105 PolarHBondContact O-N 3.39Å; N101-A105 VanDerWaalsContact O-N 3.14Å; S102-A105 PolarHBondContact O-N 2.92Å; A105-I107 PolarHBondContact O-N 2.83Å; A105-H108 PolarHBondContact O-N 3.3Å; A105-G109 PolarHBondContact O-N 3.27Å; A105-G109 VanDerWaalsContact O-N 3.14Å
106	I	96.4	Very high	94.5	Very high	38 Å²	38	61.9 Å²	61.9	20%	0.195	36%	0.356	C	S	.	.	H	α-helix	trans	-61	-45.4	177.2	-65.7	-56.1	0	0	0	111	M76 L77 L80 S102 A103 H108 G109 L110	M76-I106 HydrophobicContact CB-CD1 4.4Å; M76-I106 HydrophobicContact CB-CG1 4.39Å; M76-I106 HydrophobicContact CB-CG2 4.35Å; M76-I106 HydrophobicContact CE-CD1 3.87Å; M76-I106 HydrophobicContact SD-CD1 3.9Å; L77-I106 HydrophobicContact CB-CG2 4.3Å; L80-I106 HydrophobicContact CD1-CB 4.25Å; L80-I106 HydrophobicContact CD1-CG1 3.62Å; S102-I106 WeakPolarHBondContact O-CG1 3.46Å; S102-I106 PolarHBondContact O-N 2.91Å; A103-I106 PolarHBondContact O-N 2.92Å; I106-H108 VanDerWaalsContact C-N 3.31Å; I106-H108 PolarHBondContact O-N 2.87Å; I106-G109 PolarHBondContact O-N 3.28Å; I106-L110 PolarHBondContact O-N 3.43Å
107	I	95.5	Very high	94.3	Very high	15 Å²	15	62 Å²	62	8%	0.077	36%	0.357	C	S	.	.	H	α-helix	trans	-65.6	-36.1	-177.8	-67.1	161.7	0	0	0	111.7	L77 A103 E104 A105 G109 L110 I121 L319 F320	L77-I107 HydrophobicContact CD1-CD1 3.74Å; L77-I107 HydrophobicContact CD1-CG1 3.6Å; A103-I107 WeakPolarHBondContact O-CB 3.33Å; A103-I107 WeakPolarHBondContact O-CD1 3.2Å; A103-I107 WeakPolarHBondContact O-CG1 3.48Å; A103-I107 PolarHBondContact O-N 2.81Å; E104-I107 PolarHBondContact O-N 2.78Å; A105-I107 PolarHBondContact O-N 2.83Å; I107-G109 VanDerWaalsContact C-N 3.28Å; I107-G109 PolarHBondContact O-N 3.4Å; I107-L110 PolarHBondContact O-N 3.43Å; I107-I121 HydrophobicContact CD1-CB 4.44Å; I107-I121 HydrophobicContact CD1-CG1 3.77Å; I107-I121 HydrophobicContact CD1-CG2 4.36Å; I107-I121 HydrophobicContact CG1-CD1 4.33Å; I107-I121 HydrophobicContact CG1-CG1 3.89Å; I107-I121 HydrophobicContact CG2-CD1 3.69Å; I107-I121 HydrophobicContact CG2-CG1 3.99Å; I107-I121 HydrophobicContact CG2-CG2 4.45Å; I107-L319 HydrophobicContact CB-CD2 3.99Å; I107-L319 HydrophobicContact CD1-CD2 4.38Å; I107-L319 HydrophobicContact CG2-CD2 3.31Å; I107-F320 HydrophobicContact CD1-CE2 3.42Å; I107-F320 VanDerWaalsContact CD1-CE2 3.42Å; I107-F320 HydrophobicContact CD1-CZ 3.37Å
108	H	93.4	Very high	94.3	Very high	97 Å²	97	60.5 Å²	60.5	45%	0.449	36%	0.356	S	S	.	.	H	α-helix	trans	-68	-26.9	173.7	-78.3	-57	0	0	0	113.6	E104 A105 I106 L110 H316	E104-H108 PolarHBondContact O-CD2 3.33Å; E104-H108 PolarHBondContact O-N 3.44Å; A105-H108 PolarHBondContact O-N 3.3Å; I106-H108 VanDerWaalsContact C-N 3.31Å; I106-H108 PolarHBondContact O-N 2.87Å; H108-L110 VanDerWaalsContact C-N 3.33Å; H108-H316 PolarHBondContact CE1-O 2.84Å
109	G	91.2	Very high	94.1	Very high	63 Å²	63	56.5 Å²	56.5	65%	0.649	34%	0.341	S	S	*	.	H	α-helix	trans	-79.2	-10.4	175.5	0	0	0	0	0	114.5	A105 I106 I107 S111	A105-G109 PolarHBondContact O-N 3.27Å; A105-G109 VanDerWaalsContact O-N 3.14Å; I106-G109 PolarHBondContact O-N 3.28Å; I107-G109 VanDerWaalsContact C-N 3.28Å; I107-G109 PolarHBondContact O-N 3.4Å; G109-S111 PolarHBondContact O-N 2.97Å
110	L	90.8	Very high	94	Very high	29 Å²	29	55.8 Å²	55.8	15%	0.152	34%	0.337	C	S	.	.			trans	-73.5	120.8	180	-67	171.9	0	0	0	111.2	A73 L77 I106 I107 H108 L113	A73-L110 HydrophobicContact CB-CD2 3.51Å; L77-L110 HydrophobicContact CD2-CD1 4.04Å; I106-L110 PolarHBondContact O-N 3.43Å; I107-L110 PolarHBondContact O-N 3.43Å; H108-L110 VanDerWaalsContact C-N 3.33Å; L110-L113 HydrophobicContact CB-CD2 4.18Å; L110-L113 HydrophobicContact CD1-CD2 3.63Å
111	S	88.5	Confident	93.9	Very high	118 Å²	118	53.6 Å²	53.6	83%	0.825	33%	0.329	S	S	*	.	S	Bend	trans	-81.4	-24.3	175.6	57	0	0	0	0	113.2	G109	G109-S111 PolarHBondContact O-N 2.97Å
112	S	88.3	Confident	93.9	Very high	74 Å²	74	53.6 Å²	53.6	52%	0.517	33%	0.325	S	S	.	.			trans	-140.7	157.2	177.9	68.9	0	0	0	0	111.3
113	L	92.9	Very high	93.9	Very high	93 Å²	93	51 Å²	51	49%	0.487	31%	0.306	S	S	.	.			trans	-133.9	121.2	-178.2	-69	175.6	0	0	0	111.2	L110 Q117 I121	L110-L113 HydrophobicContact CB-CD2 4.18Å; L110-L113 HydrophobicContact CD1-CD2 3.63Å; L113-Q117 HydrophobicContact CD2-CB 4.24Å; L113-I121 HydrophobicContact CD1-CD1 4.1Å; L113-I121 HydrophobicContact CD2-CD1 3.53Å; L113-I121 HydrophobicContact CG-CD1 4.49Å
114	T	93.6	Very high	93.9	Very high	74 Å²	74	50.9 Å²	50.9	45%	0.454	31%	0.306	S	S	.	.			trans	-76.9	160.9	164.8	64.3	0	0	0	0	110.8	Y116 Q117 L118	T114-Y116 PolarHBondContact O-N 3.26Å; T114-Q117 PolarHBondContact O-N 3.01Å; T114-Q117 WeakPolarHBondContact OG1-CB 3.44Å; T114-Q117 VanDerWaalsContact OG1-CG 3.27Å; T114-Q117 WeakPolarHBondContact OG1-CG 3.43Å; T114-Q117 PolarHBondContact OG1-N 3.5Å; T114-Q117 VanDerWaalsContact OG1-N 3.14Å; T114-Q117 PolarHBondContact OG1-OE1 2.98Å; T114-L118 WeakPolarHBondContact O-CB 3.43Å; T114-L118 PolarHBondContact O-N 3.36Å
115	A	92.3	Very high	94	Very high	86 Å²	86	50.6 Å²	50.6	71%	0.711	30%	0.304	S	S	*	.	H	α-helix	trans	-59	-34.6	174.6	0	0	0	0	0	112.4	L118 R119	A115-L118 PolarHBondContact O-N 3.39Å; A115-R119 PolarHBondContact O-N 3.49Å
116	Y	91.8	Very high	94	Very high	94 Å²	94	47.5 Å²	47.5	37%	0.369	28%	0.279	S	S	.	.	H	α-helix	trans	-67.3	-45.3	176.5	-179.3	-98.4	0	0	0	112.4	D78 T114 L118 R119 T120 K249	D78-Y116 VanDerWaalsContact OD1-CE1 3.31Å; D78-Y116 WeakPolarHBondContact OD1-CE1 3.45Å; D78-Y116 PolarHBondContact OD1-OH 3.18Å; D78-Y116 WeakPolarHBondContact OD2-CE1 3.42Å; T114-Y116 PolarHBondContact O-N 3.26Å; Y116-L118 VanDerWaalsContact C-N 3.34Å; Y116-R119 PolarHBondContact O-N 3.33Å; Y116-T120 PolarHBondContact O-N 3.42Å; Y116-T120 PolarHBondContact O-OG1 3.34Å; Y116-K249 PolarHBondContact OH-NZ 3.03Å
117	Q	94.3	Very high	94.1	Very high	23 Å²	23	45.7 Å²	45.7	11%	0.107	27%	0.269	C	S	.	.	H	α-helix	trans	-64	-40.7	174.6	-72.5	164.5	-40.1	0	0	111	L77 L113 T114 R119 T120 I121	L77-Q117 HydrophobicContact CD2-CB 4.02Å; L77-Q117 HydrophobicContact CD2-CG 4.14Å; L113-Q117 HydrophobicContact CD2-CB 4.24Å; T114-Q117 PolarHBondContact O-N 3.01Å; T114-Q117 WeakPolarHBondContact OG1-CB 3.44Å; T114-Q117 VanDerWaalsContact OG1-CG 3.27Å; T114-Q117 WeakPolarHBondContact OG1-CG 3.43Å; T114-Q117 PolarHBondContact OG1-N 3.5Å; T114-Q117 VanDerWaalsContact OG1-N 3.14Å; T114-Q117 PolarHBondContact OG1-OE1 2.98Å; Q117-R119 PolarHBondContact O-N 3.24Å; Q117-T120 WeakPolarHBondContact O-CA 3.32Å; Q117-T120 WeakPolarHBondContact O-CB 3.27Å; Q117-T120 PolarHBondContact O-N 2.69Å; Q117-T120 VanDerWaalsContact O-N 3.1Å; Q117-I121 WeakPolarHBondContact O-CG1 3.38Å; Q117-I121 PolarHBondContact O-N 3.49Å
118	L	94.4	Very high	94.2	Very high	64 Å²	64	45.2 Å²	45.2	34%	0.335	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-44.5	176.1	-176.6	62	0	0	0	112.2	T114 A115 Y116 T120 I121 Y122	T114-L118 WeakPolarHBondContact O-CB 3.43Å; T114-L118 PolarHBondContact O-N 3.36Å; A115-L118 PolarHBondContact O-N 3.39Å; Y116-L118 VanDerWaalsContact C-N 3.34Å; L118-T120 VanDerWaalsContact C-N 3.28Å; L118-T120 PolarHBondContact O-N 3.18Å; L118-I121 WeakPolarHBondContact O-CB 3.33Å; L118-I121 PolarHBondContact O-N 2.96Å; L118-Y122 HydrophobicContact CD1-CE1 4.3Å; L118-Y122 HydrophobicContact CD1-CE2 4Å; L118-Y122 HydrophobicContact CD2-CE2 4.06Å; L118-Y122 HydrophobicContact CG-CD2 4.19Å; L118-Y122 HydrophobicContact CG-CE2 3.66Å; L118-Y122 WeakPolarHBondContact O-CD2 3.31Å; L118-Y122 PolarHBondContact O-N 3.49Å
119	R	94.1	Very high	94.4	Very high	40 Å²	40	41 Å²	41	15%	0.151	25%	0.247	C	C	.	.	H	α-helix	trans	-58	-42.6	172.4	-178.9	177.3	178.4	-99.8	5.5	111.3	A115 Y116 Q117 I121 Y122 I123 E160 E248	A115-R119 PolarHBondContact O-N 3.49Å; Y116-R119 PolarHBondContact O-N 3.33Å; Q117-R119 PolarHBondContact O-N 3.24Å; R119-I121 VanDerWaalsContact C-N 3.34Å; R119-I121 PolarHBondContact O-N 3.29Å; R119-Y122 PolarHBondContact O-N 3.03Å; R119-I123 HydrophobicContact CG-CD1 4.19Å; R119-I123 WeakPolarHBondContact O-CG1 3.32Å; R119-I123 PolarHBondContact O-N 3.15Å; R119-E160 IonicContact CZ-OE2 3.9Å; R119-E160 IonicContact NE-OE2 3.42Å; R119-E160 IonicContact NH2-OE2 3.01Å; R119-E160 PolarHBondContact NH2-OE2 3.32Å; R119-E248 IonicContact CZ-OE2 3.45Å; R119-E248 VanDerWaalsContact NH1-CD 3.29Å; R119-E248 IonicContact NH1-OE1 2.69Å; R119-E248 PolarHBondContact NH1-OE1 3Å; R119-E248 IonicContact NH1-OE2 3.4Å; R119-E248 PolarHBondContact NH1-OE2 3.32Å; R119-E248 IonicContact NH2-OE2 2.76Å; R119-E248 PolarHBondContact NH2-OE2 3.2Å
120	T	95.8	Very high	94.7	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.6	-39.2	179	-55.7	0	0	0	0	112.2	L77 C81 Y116 Q117 L118 I123 C124 K249	L77-T120 HydrophobicContact CD1-CG2 4.19Å; L77-T120 HydrophobicContact CD2-CG2 4.29Å; L77-T120 HydrophobicContact CG-CG2 3.84Å; C81-T120 HydrophobicContact CB-CG2 3.46Å; C81-T120 VanDerWaalsContact CB-CG2 3.46Å; Y116-T120 PolarHBondContact O-N 3.42Å; Y116-T120 PolarHBondContact O-OG1 3.34Å; Q117-T120 WeakPolarHBondContact O-CA 3.32Å; Q117-T120 WeakPolarHBondContact O-CB 3.27Å; Q117-T120 PolarHBondContact O-N 2.69Å; Q117-T120 VanDerWaalsContact O-N 3.1Å; L118-T120 VanDerWaalsContact C-N 3.28Å; L118-T120 PolarHBondContact O-N 3.18Å; T120-I123 PolarHBondContact O-N 3.23Å; T120-C124 PolarHBondContact O-N 3.45Å; T120-C124 VanDerWaalsContact O-N 3.15Å; T120-C124 PolarHBondContact O-SG 2.74Å; T120-K249 PolarHBondContact OG1-NZ 2.93Å
121	I	96.4	Very high	95	Very high	8 Å²	8	39 Å²	39	4%	0.041	23%	0.23	C	C	.	.	H	α-helix	trans	-62.8	-47.6	172.8	-67.3	166.1	0	0	0	110.1	L77 I107 L113 Q117 L118 R119 I123 C124 Q125 L319	L77-I121 HydrophobicContact CD2-CG1 4.17Å; I107-I121 HydrophobicContact CD1-CB 4.44Å; I107-I121 HydrophobicContact CD1-CG1 3.77Å; I107-I121 HydrophobicContact CD1-CG2 4.36Å; I107-I121 HydrophobicContact CG1-CD1 4.33Å; I107-I121 HydrophobicContact CG1-CG1 3.89Å; I107-I121 HydrophobicContact CG2-CD1 3.69Å; I107-I121 HydrophobicContact CG2-CG1 3.99Å; I107-I121 HydrophobicContact CG2-CG2 4.45Å; L113-I121 HydrophobicContact CD1-CD1 4.1Å; L113-I121 HydrophobicContact CD2-CD1 3.53Å; L113-I121 HydrophobicContact CG-CD1 4.49Å; Q117-I121 WeakPolarHBondContact O-CG1 3.38Å; Q117-I121 PolarHBondContact O-N 3.49Å; L118-I121 WeakPolarHBondContact O-CB 3.33Å; L118-I121 PolarHBondContact O-N 2.96Å; R119-I121 VanDerWaalsContact C-N 3.34Å; R119-I121 PolarHBondContact O-N 3.29Å; I121-I123 VanDerWaalsContact C-N 3.32Å; I121-I123 PolarHBondContact O-N 3.47Å; I121-C124 PolarHBondContact O-N 3.1Å; I121-Q125 HydrophobicContact CG2-CG 4.22Å; I121-Q125 WeakPolarHBondContact O-CB 3.35Å; I121-Q125 WeakPolarHBondContact O-CG 3.47Å; I121-Q125 PolarHBondContact O-N 3.13Å; I121-L319 HydrophobicContact CG2-CD2 4.38Å
122	Y	96.4	Very high	95.4	Very high	62 Å²	62	34.1 Å²	34.1	24%	0.243	20%	0.196	C	C	.	.	H	α-helix	trans	-60.7	-40.2	178.6	-69.9	-40	0	0	0	112.6	L118 R119 C124 Q125 F126 I155 I159	L118-Y122 HydrophobicContact CD1-CE1 4.3Å; L118-Y122 HydrophobicContact CD1-CE2 4Å; L118-Y122 HydrophobicContact CD2-CE2 4.06Å; L118-Y122 HydrophobicContact CG-CD2 4.19Å; L118-Y122 HydrophobicContact CG-CE2 3.66Å; L118-Y122 WeakPolarHBondContact O-CD2 3.31Å; L118-Y122 PolarHBondContact O-N 3.49Å; R119-Y122 PolarHBondContact O-N 3.03Å; Y122-C124 PolarHBondContact O-N 2.9Å; Y122-Q125 PolarHBondContact O-N 3.32Å; Y122-F126 VanDerWaalsContact O-CB 3.28Å; Y122-F126 WeakPolarHBondContact O-CB 3.45Å; Y122-F126 PolarHBondContact O-N 3.48Å; Y122-I155 HydrophobicContact CD1-CD1 4.34Å; Y122-I155 HydrophobicContact CD1-CG2 4.13Å; Y122-I155 HydrophobicContact CG-CG2 4.37Å; Y122-I155 WeakPolarHBondContact O-CG2 3.32Å; Y122-I159 VanDerWaalsContact CB-CG1 3.48Å; Y122-I159 HydrophobicContact CG-CG1 4.43Å
123	I	96.6	Very high	95.7	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-57.8	-50.3	174.1	-69.7	166.1	0	0	0	110.6	R119 T120 I121 Q125 F126 L127 I159 V245	R119-I123 HydrophobicContact CG-CD1 4.19Å; R119-I123 WeakPolarHBondContact O-CG1 3.32Å; R119-I123 PolarHBondContact O-N 3.15Å; T120-I123 PolarHBondContact O-N 3.23Å; I121-I123 VanDerWaalsContact C-N 3.32Å; I121-I123 PolarHBondContact O-N 3.47Å; I123-Q125 VanDerWaalsContact C-N 3.26Å; I123-Q125 PolarHBondContact O-N 2.9Å; I123-F126 PolarHBondContact O-N 3.29Å; I123-L127 HydrophobicContact CG2-CD1 4.34Å; I123-L127 WeakPolarHBondContact O-CG 3.47Å; I123-L127 PolarHBondContact O-N 2.85Å; I123-I159 HydrophobicContact CG1-CG2 4.33Å; I123-V245 HydrophobicContact CD1-CG1 4.09Å; I123-V245 HydrophobicContact CD1-CG2 4.12Å; I123-V245 HydrophobicContact CG2-CG1 4.28Å
124	C	97.7	Very high	95.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59	-43.4	178.3	-63.4	0	0	0	0	110.7	L84 T120 I121 Y122 F126 L127 T128 F320	L84-C124 HydrophobicContact CD2-CB 3.78Å; T120-C124 PolarHBondContact O-N 3.45Å; T120-C124 VanDerWaalsContact O-N 3.15Å; T120-C124 PolarHBondContact O-SG 2.74Å; I121-C124 PolarHBondContact O-N 3.1Å; Y122-C124 PolarHBondContact O-N 2.9Å; C124-F126 PolarHBondContact O-N 3.42Å; C124-L127 PolarHBondContact O-N 2.88Å; C124-T128 WeakPolarHBondContact O-CG2 3.46Å; C124-T128 PolarHBondContact O-N 3.01Å; C124-T128 PolarHBondContact O-OG1 3.21Å; C124-F320 VanDerWaalsContact C-CE1 3.49Å; C124-F320 HydrophobicContact CB-CD1 4.49Å; C124-F320 HydrophobicContact CB-CE1 3.4Å; C124-F320 HydrophobicContact CB-CZ 3.67Å
125	Q	96.9	Very high	95.8	Very high	18 Å²	18	30.6 Å²	30.6	8%	0.084	17%	0.166	C	C	.	.	H	α-helix	trans	-64.9	-45.2	-175.3	-83	-175.4	-31.3	0	0	110.5	I121 Y122 I123 T128 R129 I155 F320	I121-Q125 HydrophobicContact CG2-CG 4.22Å; I121-Q125 WeakPolarHBondContact O-CB 3.35Å; I121-Q125 WeakPolarHBondContact O-CG 3.47Å; I121-Q125 PolarHBondContact O-N 3.13Å; Y122-Q125 PolarHBondContact O-N 3.32Å; I123-Q125 VanDerWaalsContact C-N 3.26Å; I123-Q125 PolarHBondContact O-N 2.9Å; Q125-T128 PolarHBondContact O-N 2.95Å; Q125-T128 PolarHBondContact O-OG1 3.15Å; Q125-R129 WeakPolarHBondContact O-CD 3.28Å; Q125-R129 VanDerWaalsContact O-CG 3.28Å; Q125-R129 WeakPolarHBondContact O-CG 3.46Å; Q125-R129 PolarHBondContact O-N 3.1Å; Q125-R129 VanDerWaalsContact O-N 3.15Å; Q125-R129 PolarHBondContact O-NH1 3.39Å; Q125-I155 HydrophobicContact CB-CG2 4.31Å; Q125-F320 HydrophobicContact CB-CE1 4.2Å; Q125-F320 HydrophobicContact CG-CD1 4.13Å; Q125-F320 HydrophobicContact CG-CE1 3.56Å; Q125-F320 HydrophobicContact CG-CZ 4.07Å
126	F	97.9	Very high	95.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-57	-52.1	174.9	173.8	-108.8	0	0	0	111.3	Y122 I123 C124 T128 R129 I130 A152 I155 W156 I159 I170 I174 I238	Y122-F126 VanDerWaalsContact O-CB 3.28Å; Y122-F126 WeakPolarHBondContact O-CB 3.45Å; Y122-F126 PolarHBondContact O-N 3.48Å; I123-F126 PolarHBondContact O-N 3.29Å; C124-F126 PolarHBondContact O-N 3.42Å; F126-T128 VanDerWaalsContact C-N 3.3Å; F126-T128 PolarHBondContact O-N 3.48Å; F126-R129 PolarHBondContact O-N 3.22Å; F126-R129 VanDerWaalsContact O-N 3.1Å; F126-I130 HydrophobicContact CD1-CG1 4.42Å; F126-I130 HydrophobicContact CD2-CG1 4.11Å; F126-I130 HydrophobicContact CE1-CG1 4.08Å; F126-I130 HydrophobicContact CE2-CD1 3.84Å; F126-I130 HydrophobicContact CE2-CG1 3.74Å; F126-I130 HydrophobicContact CG-CG1 4.43Å; F126-I130 HydrophobicContact CZ-CD1 3.99Å; F126-I130 HydrophobicContact CZ-CG1 3.72Å; F126-I130 WeakPolarHBondContact O-CG1 3.22Å; F126-I130 PolarHBondContact O-N 3.32Å; F126-A152 HydrophobicContact CD2-CB 4.13Å; F126-A152 HydrophobicContact CE2-CB 4.21Å; F126-I155 HydrophobicContact CB-CG2 3.96Å; F126-W156 AromaticContact CD1-CE3 3.96Å; F126-W156 HydrophobicContact CD1-CE3 3.96Å; F126-W156 AromaticContact CD1-CZ3 3.98Å; F126-W156 HydrophobicContact CD1-CZ3 3.98Å; F126-W156 HydrophobicContact CD2-CB 4.27Å; F126-W156 AromaticContact CD2-CE3 3.81Å; F126-W156 HydrophobicContact CD2-CE3 3.81Å; F126-W156 AromaticContact CE1-CE3 3.63Å; F126-W156 HydrophobicContact CE1-CE3 3.63Å; F126-W156 AromaticContact CE1-CZ3 3.55Å; F126-W156 HydrophobicContact CE1-CZ3 3.55Å; F126-W156 HydrophobicContact CE2-CB 4.05Å; F126-W156 AromaticContact CE2-CD2 3.98Å; F126-W156 HydrophobicContact CE2-CD2 3.98Å; F126-W156 AromaticContact CE2-CE3 3.47Å; F126-W156 HydrophobicContact CE2-CE3 3.47Å; F126-W156 VanDerWaalsContact CE2-CE3 3.47Å; F126-W156 HydrophobicContact CE2-CG 4.25Å; F126-W156 HydrophobicContact CE2-CZ3 4.26Å; F126-W156 HydrophobicContact CG-CE3 4.04Å; F126-W156 HydrophobicContact CG-CZ3 4.5Å; F126-W156 HydrophobicContact CZ-CD2 4.05Å; F126-W156 AromaticContact CZ-CE3 3.37Å; F126-W156 HydrophobicContact CZ-CE3 3.37Å; F126-W156 AromaticContact CZ-CZ3 3.71Å; F126-W156 HydrophobicContact CZ-CZ3 3.71Å; F126-I159 HydrophobicContact CB-CD1 3.62Å; F126-I159 HydrophobicContact CD1-CD1 4.42Å; F126-I159 HydrophobicContact CD2-CD1 4.5Å; F126-I159 HydrophobicContact CG-CD1 3.95Å; F126-I170 HydrophobicContact CZ-CG2 4.23Å; F126-I174 HydrophobicContact CE2-CD1 3.62Å; F126-I174 HydrophobicContact CZ-CD1 3.9Å; F126-I238 HydrophobicContact CE1-CG2 3.93Å; F126-I238 HydrophobicContact CZ-CD1 4.11Å; F126-I238 HydrophobicContact CZ-CG1 4.22Å; F126-I238 HydrophobicContact CZ-CG2 4.44Å
127	L	97.9	Very high	95.8	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.9	-38.1	-179.4	-65.8	-178.7	0	0	0	112.8	F88 F96 I123 C124 R129 I130 A131 I238 V242	F88-L127 HydrophobicContact CD1-CD2 4.06Å; F88-L127 HydrophobicContact CD2-CB 4.31Å; F88-L127 HydrophobicContact CD2-CD2 4.28Å; F88-L127 HydrophobicContact CE1-CD2 4.06Å; F88-L127 HydrophobicContact CE2-CD2 4.26Å; F88-L127 HydrophobicContact CG-CD2 4.18Å; F88-L127 HydrophobicContact CZ-CD2 4.15Å; F96-L127 HydrophobicContact CE2-CB 4.29Å; F96-L127 HydrophobicContact CZ-CB 4.34Å; I123-L127 HydrophobicContact CG2-CD1 4.34Å; I123-L127 WeakPolarHBondContact O-CG 3.47Å; I123-L127 PolarHBondContact O-N 2.85Å; C124-L127 PolarHBondContact O-N 2.88Å; L127-R129 VanDerWaalsContact C-N 3.34Å; L127-R129 PolarHBondContact O-N 2.85Å; L127-I130 PolarHBondContact O-N 3.15Å; L127-A131 VanDerWaalsContact O-CB 3.32Å; L127-A131 WeakPolarHBondContact O-CB 3.36Å; L127-A131 PolarHBondContact O-N 2.74Å; L127-I238 HydrophobicContact CD2-CG2 4.27Å; L127-V242 HydrophobicContact CD1-CG2 4.34Å; L127-V242 HydrophobicContact CD2-CG2 3.63Å
128	T	97.4	Very high	95.8	Very high	5 Å²	5	27 Å²	27	3%	0.031	14%	0.143	C	C	.	.	H	α-helix	trans	-65.8	-36.1	176.4	57.2	0	0	0	0	113.5	F96 R100 C124 Q125 F126 A132 F320	F96-T128 HydrophobicContact CE1-CG2 4.14Å; F96-T128 HydrophobicContact CZ-CG2 3.96Å; R100-T128 HydrophobicContact CB-CG2 4.47Å; R100-T128 HydrophobicContact CG-CG2 3.71Å; C124-T128 WeakPolarHBondContact O-CG2 3.46Å; C124-T128 PolarHBondContact O-N 3.01Å; C124-T128 PolarHBondContact O-OG1 3.21Å; Q125-T128 PolarHBondContact O-N 2.95Å; Q125-T128 PolarHBondContact O-OG1 3.15Å; F126-T128 VanDerWaalsContact C-N 3.3Å; F126-T128 PolarHBondContact O-N 3.48Å; T128-A132 PolarHBondContact O-N 3.01Å; T128-A132 VanDerWaalsContact O-N 3.13Å; T128-F320 HydrophobicContact CG2-CB 4.24Å; T128-F320 HydrophobicContact CG2-CD1 3.66Å; T128-F320 HydrophobicContact CG2-CG 4.35Å
129	R	97.8	Very high	95.7	Very high	8 Å²	8	25.3 Å²	25.3	3%	0.03	13%	0.133	C	C	.	.	H	α-helix	trans	-72.3	-40.7	178.6	-69.6	155.6	171.9	66.6	3	111	Q125 F126 L127 A132 G133 F140 E141 S151 A152 L319	Q125-R129 WeakPolarHBondContact O-CD 3.28Å; Q125-R129 VanDerWaalsContact O-CG 3.28Å; Q125-R129 WeakPolarHBondContact O-CG 3.46Å; Q125-R129 PolarHBondContact O-N 3.1Å; Q125-R129 VanDerWaalsContact O-N 3.15Å; Q125-R129 PolarHBondContact O-NH1 3.39Å; F126-R129 PolarHBondContact O-N 3.22Å; F126-R129 VanDerWaalsContact O-N 3.1Å; L127-R129 VanDerWaalsContact C-N 3.34Å; L127-R129 PolarHBondContact O-N 2.85Å; R129-A132 CarbonylContact O-C 3.57Å; R129-A132 PolarHBondContact O-N 3.42Å; R129-G133 PolarHBondContact O-N 3.39Å; R129-G133 VanDerWaalsContact O-N 3.1Å; R129-F140 HydrophobicContact CG-CD1 3.87Å; R129-F140 HydrophobicContact CG-CD2 4.31Å; R129-F140 HydrophobicContact CG-CE1 4.06Å; R129-F140 HydrophobicContact CG-CE2 4.49Å; R129-F140 HydrophobicContact CG-CG 3.99Å; R129-F140 HydrophobicContact CG-CZ 4.36Å; R129-E141 IonicContact NH2-OE1 3.64Å; R129-S151 WeakPolarHBondContact CD-OG 3.39Å; R129-S151 PolarHBondContact NE-OG 3.24Å; R129-A152 HydrophobicContact CB-CB 3.76Å; R129-L319 PolarHBondContact NH1-O 3.38Å
130	I	98	Very high	95.6	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.7	-45.7	173.4	-64.6	-61.9	0	0	0	110.9	F88 F126 L127 A132 G133 L149 A152 I174 Y231 M235 I238	F88-I130 HydrophobicContact CE2-CB 4.4Å; F88-I130 HydrophobicContact CE2-CG2 4.02Å; F88-I130 HydrophobicContact CZ-CB 4.44Å; F88-I130 HydrophobicContact CZ-CG2 3.72Å; F126-I130 HydrophobicContact CD1-CG1 4.42Å; F126-I130 HydrophobicContact CD2-CG1 4.11Å; F126-I130 HydrophobicContact CE1-CG1 4.08Å; F126-I130 HydrophobicContact CE2-CD1 3.84Å; F126-I130 HydrophobicContact CE2-CG1 3.74Å; F126-I130 HydrophobicContact CG-CG1 4.43Å; F126-I130 HydrophobicContact CZ-CD1 3.99Å; F126-I130 HydrophobicContact CZ-CG1 3.72Å; F126-I130 WeakPolarHBondContact O-CG1 3.22Å; F126-I130 PolarHBondContact O-N 3.32Å; L127-I130 PolarHBondContact O-N 3.15Å; I130-A132 PolarHBondContact O-N 2.81Å; I130-G133 WeakPolarHBondContact O-CA 3.48Å; I130-G133 PolarHBondContact O-N 2.94Å; I130-L149 HydrophobicContact CD1-CD2 4.01Å; I130-A152 HydrophobicContact CD1-CB 3.66Å; I130-A152 HydrophobicContact CG1-CB 4.16Å; I130-I174 HydrophobicContact CD1-CD1 4.11Å; I130-I174 HydrophobicContact CD1-CG1 4.15Å; I130-Y231 PolarHBondContact O-OH 3.08Å; I130-M235 HydrophobicContact CG2-CE 4.31Å; I130-M235 HydrophobicContact CG2-SD 3.54Å; I130-M235 VanDerWaalsContact CG2-SD 3.54Å; I130-I238 HydrophobicContact CD1-CD1 3.67Å; I130-I238 HydrophobicContact CG1-CD1 3.94Å; I130-I238 HydrophobicContact CG2-CD1 3.78Å
131	A	96.3	Very high	95.5	Very high	52 Å²	52	26.3 Å²	26.3	43%	0.43	14%	0.139	S	C	.	.	H	α-helix	trans	-60.7	-33	177.7	0	0	0	0	0	112.8	F88 F96 L127 G133	F88-A131 HydrophobicContact CD2-CB 4.48Å; F88-A131 HydrophobicContact CE2-CB 4.28Å; F96-A131 HydrophobicContact CE1-CB 3.79Å; F96-A131 HydrophobicContact CZ-CB 3.96Å; L127-A131 VanDerWaalsContact O-CB 3.32Å; L127-A131 WeakPolarHBondContact O-CB 3.36Å; L127-A131 PolarHBondContact O-N 2.74Å; A131-G133 VanDerWaalsContact C-N 3.32Å
132	A	95.7	Very high	95.2	Very high	15 Å²	15	32.1 Å²	32.1	12%	0.124	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	10.7	173.7	0	0	0	0	0	113.5	T128 R129 I130 K134 T135 A138 F140 P148	T128-A132 PolarHBondContact O-N 3.01Å; T128-A132 VanDerWaalsContact O-N 3.13Å; R129-A132 CarbonylContact O-C 3.57Å; R129-A132 PolarHBondContact O-N 3.42Å; I130-A132 PolarHBondContact O-N 2.81Å; A132-K134 PolarHBondContact O-N 3.23Å; A132-T135 WeakPolarHBondContact O-CB 3.49Å; A132-T135 PolarHBondContact O-N 2.9Å; A132-A138 HydrophobicContact CB-CB 4.41Å; A132-F140 HydrophobicContact CB-CE2 3.72Å; A132-F140 HydrophobicContact CB-CZ 3.66Å; A132-P148 HydrophobicContact CB-CB 4.43Å
133	G	95.6	Very high	95	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-22.3	-167.5	0	0	0	0	0	115.6	R129 I130 A131	R129-G133 PolarHBondContact O-N 3.39Å; R129-G133 VanDerWaalsContact O-N 3.1Å; I130-G133 WeakPolarHBondContact O-CA 3.48Å; I130-G133 PolarHBondContact O-N 2.94Å; A131-G133 VanDerWaalsContact C-N 3.32Å
134	K	95.2	Very high	94.7	Very high	105 Å²	105	38.4 Å²	38.4	46%	0.457	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-9.3	176	-62.7	-166.5	176.8	-161	0	114.1	A132 L136 V181 Y231	A132-K134 PolarHBondContact O-N 3.23Å; K134-L136 PolarHBondContact O-N 2.79Å; K134-V181 HydrophobicContact CG-CG2 4.42Å; K134-Y231 HydrophobicContact CG-CD2 4.31Å; K134-Y231 HydrophobicContact CG-CE2 3.81Å
135	T	94.2	Very high	94.4	Very high	61 Å²	61	43.8 Å²	43.8	37%	0.374	22%	0.224	S	C	.	.			trans	-94.2	77.4	-174.1	-51.6	0	0	0	0	107.9	A132 D137 A138 P148	A132-T135 WeakPolarHBondContact O-CB 3.49Å; A132-T135 PolarHBondContact O-N 2.9Å; T135-D137 WeakPolarHBondContact CG2-OD1 3.45Å; T135-D137 PolarHBondContact O-N 3.26Å; T135-D137 VanDerWaalsContact O-N 3.15Å; T135-A138 HydrophobicContact CG2-CB 3.89Å; T135-A138 WeakPolarHBondContact O-CB 3.41Å; T135-A138 PolarHBondContact O-N 3.27Å; T135-P148 WeakPolarHBondContact O-CG 3.39Å
136	L	92.7	Very high	94.3	Very high	30 Å²	30	44.2 Å²	44.2	16%	0.157	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-21.3	-173	-64.7	-176.7	0	0	0	114.2	K134 A138 T147 V181 N185	K134-L136 PolarHBondContact O-N 2.79Å; L136-A138 VanDerWaalsContact C-N 3.27Å; L136-T147 HydrophobicContact CD2-CG2 4.15Å; L136-V181 HydrophobicContact CD1-CG1 4.37Å; L136-V181 HydrophobicContact CD2-CG1 3.73Å; L136-V181 HydrophobicContact CG-CG1 4.06Å; L136-N185 HydrophobicContact CD1-CB 4.08Å; L136-N185 VanDerWaalsContact CD1-ND2 3.31Å; L136-N185 WeakPolarHBondContact CD1-ND2 3.3Å
137	D	91.5	Very high	94.2	Very high	96 Å²	96	44.4 Å²	44.4	51%	0.513	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-8.5	173.6	57.4	-37.5	0	0	0	113.6	T135 Q139 L324	T135-D137 WeakPolarHBondContact CG2-OD1 3.45Å; T135-D137 PolarHBondContact O-N 3.26Å; T135-D137 VanDerWaalsContact O-N 3.15Å; D137-Q139 PolarHBondContact O-N 2.96Å; D137-L324 WeakPolarHBondContact OD2-CD1 3.28Å
138	A	92.6	Very high	94.2	Very high	3 Å²	3	44.4 Å²	44.4	3%	0.025	23%	0.228	C	C	.	.			trans	-77.3	112.4	176.9	0	0	0	0	0	111.7	A132 T135 L136 F140 P148 S322	A132-A138 HydrophobicContact CB-CB 4.41Å; T135-A138 HydrophobicContact CG2-CB 3.89Å; T135-A138 WeakPolarHBondContact O-CB 3.41Å; T135-A138 PolarHBondContact O-N 3.27Å; L136-A138 VanDerWaalsContact C-N 3.27Å; A138-F140 HydrophobicContact CB-CE2 3.9Å; A138-P148 HydrophobicContact CB-CG 3.99Å; A138-P148 WeakPolarHBondContact O-CG 3.32Å; A138-S322 VanDerWaalsContact CB-CB 3.5Å; A138-S322 WeakPolarHBondContact CB-OG 3.4Å
139	Q	93.8	Very high	94.2	Very high	27 Å²	27	44.3 Å²	44.3	13%	0.126	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-92.4	112.9	177.3	-173.4	-174.8	7.3	0	0	113	D137 E141 S322 K323	D137-Q139 PolarHBondContact O-N 2.96Å; Q139-E141 VanDerWaalsContact CG-O 3.3Å; Q139-E141 WeakPolarHBondContact CG-O 3.21Å; Q139-E141 PolarHBondContact NE2-O 3.34Å; Q139-S322 VanDerWaalsContact O-CA 3.3Å; Q139-S322 WeakPolarHBondContact O-CA 3.35Å; Q139-K323 HydrophobicContact CB-CB 4.46Å; Q139-K323 PolarHBondContact O-N 2.98Å
140	F	91.2	Very high	94.2	Very high	12 Å²	12	44.3 Å²	44.3	5%	0.053	23%	0.227	C	C	.	.			trans	-99.5	-31.4	173.5	-70.2	-86.9	0	0	0	113.5	R129 A132 A138 P148	R129-F140 HydrophobicContact CG-CD1 3.87Å; R129-F140 HydrophobicContact CG-CD2 4.31Å; R129-F140 HydrophobicContact CG-CE1 4.06Å; R129-F140 HydrophobicContact CG-CE2 4.49Å; R129-F140 HydrophobicContact CG-CG 3.99Å; R129-F140 HydrophobicContact CG-CZ 4.36Å; A132-F140 HydrophobicContact CB-CE2 3.72Å; A132-F140 HydrophobicContact CB-CZ 3.66Å; A138-F140 HydrophobicContact CB-CE2 3.9Å; F140-P148 HydrophobicContact CD2-CB 4.01Å; F140-P148 HydrophobicContact CD2-CG 4.12Å; F140-P148 HydrophobicContact CE2-CB 3.81Å; F140-P148 HydrophobicContact CE2-CG 3.95Å
141	E	93.2	Very high	94.1	Very high	50 Å²	50	44.3 Å²	44.3	23%	0.234	23%	0.227	C	C	.	.	S	Bend	trans	-103.1	162.9	-175.6	-59.3	-58	144.7	0	0	112.2	R129 Q139 D143 I146 S151 M154	R129-E141 IonicContact NH2-OE1 3.64Å; Q139-E141 VanDerWaalsContact CG-O 3.3Å; Q139-E141 WeakPolarHBondContact CG-O 3.21Å; Q139-E141 PolarHBondContact NE2-O 3.34Å; E141-D143 VanDerWaalsContact C-N 3.25Å; E141-D143 PolarHBondContact O-N 3.46Å; E141-I146 HydrophobicContact CB-CB 4.12Å; E141-I146 HydrophobicContact CB-CG1 4.45Å; E141-I146 HydrophobicContact CB-CG2 4.39Å; E141-I146 HydrophobicContact CG-CB 4.12Å; E141-I146 HydrophobicContact CG-CG2 3.82Å; E141-S151 PolarHBondContact OE1-OG 3.3Å; E141-M154 HydrophobicContact CG-CE 3.75Å
142	N	90.9	Very high	94.2	Very high	130 Å²	130	41.9 Å²	41.9	70%	0.695	21%	0.207	S	C	*	.	S	Bend	trans	-65.8	-32	173.6	-66	-54.1	0	0	0	112	E144	N142-E144 PolarHBondContact O-N 2.97Å
143	D	91.6	Very high	94.1	Very high	49 Å²	49	42.4 Å²	42.4	26%	0.262	21%	0.208	S	C	.	.	S	Bend	trans	-80.8	109.5	171.6	-172.3	-12.9	0	0	0	108.8	E141 R145 I146	E141-D143 VanDerWaalsContact C-N 3.25Å; E141-D143 PolarHBondContact O-N 3.46Å; D143-R145 PolarHBondContact O-N 3.45Å; D143-R145 VanDerWaalsContact O-N 3.11Å; D143-R145 WeakPolarHBondContact OD1-CB 3.5Å; D143-R145 WeakPolarHBondContact OD1-CG 3.39Å; D143-R145 IonicContact OD1-CZ 3.47Å; D143-R145 PolarHBondContact OD1-N 2.85Å; D143-R145 VanDerWaalsContact OD1-N 3.1Å; D143-R145 IonicContact OD1-NE 3.33Å; D143-R145 PolarHBondContact OD1-NE 3.36Å; D143-R145 IonicContact OD1-NH2 2.68Å; D143-R145 IonicContact OD2-CZ 2.69Å; D143-R145 IonicContact OD2-NE 3.56Å; D143-R145 PolarHBondContact OD2-NE 3.48Å; D143-R145 IonicContact OD2-NH2 3.68Å; D143-R145 PolarHBondContact OD2-NH2 3.06Å; D143-I146 HydrophobicContact CB-CG1 3.84Å; D143-I146 PolarHBondContact O-N 2.88Å; D143-I146 VanDerWaalsContact O-N 3.16Å
144	E	90.2	Very high	94	Very high	145 Å²	145	46.9 Å²	46.9	68%	0.678	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.2	-178.6	-72.6	172.9	-166.5	0	0	113.5	N142 I146	N142-E144 PolarHBondContact O-N 2.97Å; E144-I146 VanDerWaalsContact C-N 3.28Å; E144-I146 PolarHBondContact O-N 2.97Å
145	R	91.7	Very high	94	Very high	114 Å²	114	42.7 Å²	42.7	43%	0.43	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-15.8	-179.6	-58.6	174.6	-66.3	168.7	3.2	113	D143 T147 R197 E385	D143-R145 PolarHBondContact O-N 3.45Å; D143-R145 VanDerWaalsContact O-N 3.11Å; D143-R145 WeakPolarHBondContact OD1-CB 3.5Å; D143-R145 WeakPolarHBondContact OD1-CG 3.39Å; D143-R145 IonicContact OD1-CZ 3.47Å; D143-R145 PolarHBondContact OD1-N 2.85Å; D143-R145 VanDerWaalsContact OD1-N 3.1Å; D143-R145 IonicContact OD1-NE 3.33Å; D143-R145 PolarHBondContact OD1-NE 3.36Å; D143-R145 IonicContact OD1-NH2 2.68Å; D143-R145 IonicContact OD2-CZ 2.69Å; D143-R145 IonicContact OD2-NE 3.56Å; D143-R145 PolarHBondContact OD2-NE 3.48Å; D143-R145 IonicContact OD2-NH2 3.68Å; D143-R145 PolarHBondContact OD2-NH2 3.06Å; R145-T147 PolarHBondContact O-N 2.78Å; R145-R197 PolarHBondContact O-NH2 2.94Å; R145-E385 IonicContact NH2-OE1 3.93Å
146	I	94.5	Very high	94.1	Very high	26 Å²	26	39.9 Å²	39.9	13%	0.133	19%	0.194	C	C	.	.			trans	-82.8	114.8	-174.5	-56.8	-61.2	0	0	0	109.2	E141 D143 E144 E150 M154	E141-I146 HydrophobicContact CB-CB 4.12Å; E141-I146 HydrophobicContact CB-CG1 4.45Å; E141-I146 HydrophobicContact CB-CG2 4.39Å; E141-I146 HydrophobicContact CG-CB 4.12Å; E141-I146 HydrophobicContact CG-CG2 3.82Å; D143-I146 HydrophobicContact CB-CG1 3.84Å; D143-I146 PolarHBondContact O-N 2.88Å; D143-I146 VanDerWaalsContact O-N 3.16Å; E144-I146 VanDerWaalsContact C-N 3.28Å; E144-I146 PolarHBondContact O-N 2.97Å; I146-E150 HydrophobicContact CG2-CB 3.67Å; I146-M154 HydrophobicContact CG2-CE 3.68Å
147	T	96.6	Very high	94	Very high	5 Å²	5	40.6 Å²	40.6	3%	0.031	21%	0.209	C	C	.	.			trans	-68.4	159.9	177.6	61.9	0	0	0	0	111.7	L136 R145 L149 E150 S151 V194	L136-T147 HydrophobicContact CD2-CG2 4.15Å; R145-T147 PolarHBondContact O-N 2.78Å; T147-L149 PolarHBondContact O-N 2.97Å; T147-E150 WeakPolarHBondContact CB-OE2 3.35Å; T147-E150 WeakPolarHBondContact CG2-OE2 3.27Å; T147-E150 PolarHBondContact N-OE2 3.33Å; T147-E150 PolarHBondContact O-N 3.19Å; T147-E150 VanDerWaalsContact O-N 3.15Å; T147-E150 VanDerWaalsContact OG1-CG 3.27Å; T147-E150 WeakPolarHBondContact OG1-CG 3.48Å; T147-E150 PolarHBondContact OG1-N 3.5Å; T147-E150 PolarHBondContact OG1-OE2 3.08Å; T147-S151 PolarHBondContact O-N 3.34Å; T147-V194 HydrophobicContact CG2-CG2 4.02Å
148	P	97.8	Very high	93.9	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-53.6	-39.1	175.5	-29.1	35.6	0	0	0	114	A132 T135 A138 F140 S151 A152	A132-P148 HydrophobicContact CB-CB 4.43Å; T135-P148 WeakPolarHBondContact O-CG 3.39Å; A138-P148 HydrophobicContact CB-CG 3.99Å; A138-P148 WeakPolarHBondContact O-CG 3.32Å; F140-P148 HydrophobicContact CD2-CB 4.01Å; F140-P148 HydrophobicContact CD2-CG 4.12Å; F140-P148 HydrophobicContact CE2-CB 3.81Å; F140-P148 HydrophobicContact CE2-CG 3.95Å; P148-S151 PolarHBondContact O-N 3.31Å; P148-A152 PolarHBondContact O-N 2.85Å
149	L	97.9	Very high	93.5	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-74	-33.3	179.7	-67.7	179.7	0	0	0	112.8	I130 T147 A152 L153 I174 Q177 A178 V181 Y231 M234	I130-L149 HydrophobicContact CD1-CD2 4.01Å; T147-L149 PolarHBondContact O-N 2.97Å; L149-A152 WeakPolarHBondContact O-CB 3.42Å; L149-A152 PolarHBondContact O-N 3.14Å; L149-L153 PolarHBondContact O-N 3.28Å; L149-I174 HydrophobicContact CB-CG2 4.46Å; L149-I174 WeakPolarHBondContact O-CG2 3.48Å; L149-Q177 HydrophobicContact CD1-CB 4.05Å; L149-A178 HydrophobicContact CB-CB 3.85Å; L149-V181 HydrophobicContact CD1-CG2 3.94Å; L149-Y231 HydrophobicContact CD1-CE2 4.44Å; L149-M234 HydrophobicContact CD2-CE 4.29Å
150	E	96.8	Very high	92.5	Very high	9 Å²	9	40.3 Å²	40.3	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-64.8	-42.3	169.3	-74.2	172	103.3	0	0	111.4	I146 T147 A152 L153 M154 V194 R197 I198	I146-E150 HydrophobicContact CG2-CB 3.67Å; T147-E150 WeakPolarHBondContact CB-OE2 3.35Å; T147-E150 WeakPolarHBondContact CG2-OE2 3.27Å; T147-E150 PolarHBondContact N-OE2 3.33Å; T147-E150 PolarHBondContact O-N 3.19Å; T147-E150 VanDerWaalsContact O-N 3.15Å; T147-E150 VanDerWaalsContact OG1-CG 3.27Å; T147-E150 WeakPolarHBondContact OG1-CG 3.48Å; T147-E150 PolarHBondContact OG1-N 3.5Å; T147-E150 PolarHBondContact OG1-OE2 3.08Å; E150-A152 VanDerWaalsContact C-N 3.33Å; E150-A152 PolarHBondContact O-N 3.4Å; E150-L153 WeakPolarHBondContact O-CB 3.27Å; E150-L153 PolarHBondContact O-N 3.26Å; E150-M154 PolarHBondContact O-N 3.04Å; E150-M154 VanDerWaalsContact O-N 3.08Å; E150-V194 HydrophobicContact CG-CG1 4.08Å; E150-R197 IonicContact OE1-CZ 3.03Å; E150-R197 IonicContact OE1-NE 3.66Å; E150-R197 PolarHBondContact OE1-NE 3.24Å; E150-R197 IonicContact OE1-NH2 2.82Å; E150-R197 PolarHBondContact OE1-NH2 3.14Å; E150-R197 IonicContact OE2-CZ 3.7Å; E150-R197 IonicContact OE2-NE 2.7Å; E150-R197 IonicContact OE2-NH2 3.39Å; E150-R197 PolarHBondContact OE2-NH2 3.01Å; E150-I198 HydrophobicContact CG-CD1 4.06Å; E150-I198 HydrophobicContact CG-CG1 4.3Å
151	S	96.8	Very high	91.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.8	-42.8	173.1	-178.3	0	0	0	0	111.2	R129 E141 T147 P148 L153 M154 I155	R129-S151 WeakPolarHBondContact CD-OG 3.39Å; R129-S151 PolarHBondContact NE-OG 3.24Å; E141-S151 PolarHBondContact OE1-OG 3.3Å; T147-S151 PolarHBondContact O-N 3.34Å; P148-S151 PolarHBondContact O-N 3.31Å; S151-L153 VanDerWaalsContact C-N 3.29Å; S151-L153 PolarHBondContact O-N 3.24Å; S151-M154 PolarHBondContact O-N 3.5Å; S151-I155 WeakPolarHBondContact O-CG1 3.45Å; S151-I155 PolarHBondContact O-N 2.85Å; S151-I155 VanDerWaalsContact O-N 3.13Å
152	A	97.3	Very high	90	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59	-41.1	174.7	0	0	0	0	0	111.9	F126 R129 I130 P148 L149 E150 I155 W156	F126-A152 HydrophobicContact CD2-CB 4.13Å; F126-A152 HydrophobicContact CE2-CB 4.21Å; R129-A152 HydrophobicContact CB-CB 3.76Å; I130-A152 HydrophobicContact CD1-CB 3.66Å; I130-A152 HydrophobicContact CG1-CB 4.16Å; P148-A152 PolarHBondContact O-N 2.85Å; L149-A152 WeakPolarHBondContact O-CB 3.42Å; L149-A152 PolarHBondContact O-N 3.14Å; E150-A152 VanDerWaalsContact C-N 3.33Å; E150-A152 PolarHBondContact O-N 3.4Å; A152-I155 PolarHBondContact O-N 2.93Å; A152-W156 WeakPolarHBondContact O-CB 3.39Å; A152-W156 PolarHBondContact O-N 3.43Å
153	L	94.9	Very high	88.9	Confident	27 Å²	27	54 Å²	54	14%	0.141	27%	0.268	C	S	.	.	H	α-helix	trans	-63.6	-40.7	178.6	-171.3	66.9	0	0	0	112.4	L149 E150 S151 W156 G157 Q171 I174 K175 I198	L149-L153 PolarHBondContact O-N 3.28Å; E150-L153 WeakPolarHBondContact O-CB 3.27Å; E150-L153 PolarHBondContact O-N 3.26Å; S151-L153 VanDerWaalsContact C-N 3.29Å; S151-L153 PolarHBondContact O-N 3.24Å; L153-W156 PolarHBondContact O-N 2.74Å; L153-G157 PolarHBondContact O-N 3.46Å; L153-Q171 HydrophobicContact CD1-CG 3.66Å; L153-I174 HydrophobicContact CB-CG2 3.98Å; L153-I174 HydrophobicContact CD1-CB 4.34Å; L153-I174 HydrophobicContact CD1-CG2 4.13Å; L153-K175 HydrophobicContact CD1-CG 3.93Å; L153-K175 HydrophobicContact CD2-CD 4.46Å; L153-K175 HydrophobicContact CD2-CG 3.64Å; L153-K175 HydrophobicContact CG-CG 4.47Å; L153-I198 HydrophobicContact CD2-CD1 4.4Å; L153-I198 HydrophobicContact CD2-CG1 4.31Å; L153-I198 HydrophobicContact CD2-CG2 4.18Å
154	M	93.4	Very high	88.5	Confident	93 Å²	93	55.9 Å²	55.9	46%	0.458	28%	0.278	S	S	.	.	H	α-helix	trans	-63.7	-41.9	176	-68.7	-171.3	-71.1	0	0	112.1	E141 I146 E150 S151 S158	E141-M154 HydrophobicContact CG-CE 3.75Å; I146-M154 HydrophobicContact CG2-CE 3.68Å; E150-M154 PolarHBondContact O-N 3.04Å; E150-M154 VanDerWaalsContact O-N 3.08Å; S151-M154 PolarHBondContact O-N 3.5Å; M154-S158 PolarHBondContact O-OG 3.39Å
155	I	95.3	Very high	88.6	Confident	17 Å²	17	56.4 Å²	56.4	9%	0.087	28%	0.278	C	S	.	.	H	α-helix	trans	-68.4	-40.3	175.9	-59	-56.9	0	0	0	110.8	Y122 Q125 F126 S151 A152 G157 S158 I159	Y122-I155 HydrophobicContact CD1-CD1 4.34Å; Y122-I155 HydrophobicContact CD1-CG2 4.13Å; Y122-I155 HydrophobicContact CG-CG2 4.37Å; Y122-I155 WeakPolarHBondContact O-CG2 3.32Å; Q125-I155 HydrophobicContact CB-CG2 4.31Å; F126-I155 HydrophobicContact CB-CG2 3.96Å; S151-I155 WeakPolarHBondContact O-CG1 3.45Å; S151-I155 PolarHBondContact O-N 2.85Å; S151-I155 VanDerWaalsContact O-N 3.13Å; A152-I155 PolarHBondContact O-N 2.93Å; I155-G157 VanDerWaalsContact C-N 3.31Å; I155-G157 PolarHBondContact O-N 3.42Å; I155-S158 WeakPolarHBondContact O-CA 3.31Å; I155-S158 WeakPolarHBondContact O-CB 3.35Å; I155-S158 PolarHBondContact O-N 2.91Å; I155-I159 HydrophobicContact CG2-CD1 3.93Å; I155-I159 HydrophobicContact CG2-CG1 4.17Å; I155-I159 WeakPolarHBondContact O-CG1 3.48Å; I155-I159 PolarHBondContact O-N 3.07Å
156	W	94.9	Very high	88.5	Confident	2 Å²	2	53 Å²	53	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-56.5	-44.7	-179.9	-169.7	-112	0	0	0	112.3	F126 A152 L153 S158 I159 H167 I170 I174 Y241	F126-W156 AromaticContact CD1-CE3 3.96Å; F126-W156 HydrophobicContact CD1-CE3 3.96Å; F126-W156 AromaticContact CD1-CZ3 3.98Å; F126-W156 HydrophobicContact CD1-CZ3 3.98Å; F126-W156 HydrophobicContact CD2-CB 4.27Å; F126-W156 AromaticContact CD2-CE3 3.81Å; F126-W156 HydrophobicContact CD2-CE3 3.81Å; F126-W156 AromaticContact CE1-CE3 3.63Å; F126-W156 HydrophobicContact CE1-CE3 3.63Å; F126-W156 AromaticContact CE1-CZ3 3.55Å; F126-W156 HydrophobicContact CE1-CZ3 3.55Å; F126-W156 HydrophobicContact CE2-CB 4.05Å; F126-W156 AromaticContact CE2-CD2 3.98Å; F126-W156 HydrophobicContact CE2-CD2 3.98Å; F126-W156 AromaticContact CE2-CE3 3.47Å; F126-W156 HydrophobicContact CE2-CE3 3.47Å; F126-W156 VanDerWaalsContact CE2-CE3 3.47Å; F126-W156 HydrophobicContact CE2-CG 4.25Å; F126-W156 HydrophobicContact CE2-CZ3 4.26Å; F126-W156 HydrophobicContact CG-CE3 4.04Å; F126-W156 HydrophobicContact CG-CZ3 4.5Å; F126-W156 HydrophobicContact CZ-CD2 4.05Å; F126-W156 AromaticContact CZ-CE3 3.37Å; F126-W156 HydrophobicContact CZ-CE3 3.37Å; F126-W156 AromaticContact CZ-CZ3 3.71Å; F126-W156 HydrophobicContact CZ-CZ3 3.71Å; A152-W156 WeakPolarHBondContact O-CB 3.39Å; A152-W156 PolarHBondContact O-N 3.43Å; L153-W156 PolarHBondContact O-N 2.74Å; W156-S158 PolarHBondContact O-N 3.34Å; W156-S158 VanDerWaalsContact O-N 3.1Å; W156-I159 HydrophobicContact CE3-CD1 3.93Å; W156-I159 HydrophobicContact CZ3-CD1 4.28Å; W156-I159 PolarHBondContact O-N 3.27Å; W156-H167 AromaticContact CD1-CE1 3.62Å; W156-H167 AromaticContact CD1-NE2 3.67Å; W156-H167 AromaticContact CE2-CE1 3.7Å; W156-H167 AromaticContact CE2-ND1 3.49Å; W156-H167 HydrophobicContact CZ2-CB 4.43Å; W156-H167 AromaticContact CZ2-ND1 3.62Å; W156-H167 AromaticContact NE1-CD2 3.67Å; W156-H167 AromaticContact NE1-CE1 3.32Å; W156-H167 PolarHBondContact NE1-CE1 3.32Å; W156-H167 VanDerWaalsContact NE1-CE1 3.32Å; W156-H167 AromaticContact NE1-CG 3.59Å; W156-H167 AromaticContact NE1-ND1 3.36Å; W156-H167 PolarHBondContact NE1-ND1 3.02Å; W156-H167 AromaticContact NE1-NE2 3.51Å; W156-H167 PolarHBondContact NE1-O 3.21Å; W156-H167 VanDerWaalsContact NE1-O 3.16Å; W156-H167 PolarHBondContact O-CE1 2.79Å; W156-I170 HydrophobicContact CD2-CG2 4.11Å; W156-I170 HydrophobicContact CH2-CD1 3.86Å; W156-I170 HydrophobicContact CH2-CG2 4.25Å; W156-I170 HydrophobicContact CZ2-CB 3.87Å; W156-I170 HydrophobicContact CZ2-CD1 3.72Å; W156-I170 HydrophobicContact CZ2-CG1 4.4Å; W156-I170 HydrophobicContact CZ2-CG2 3.71Å; W156-I174 HydrophobicContact CG-CD1 4.49Å; W156-Y241 AromaticContact CH2-CD1 3.79Å; W156-Y241 HydrophobicContact CH2-CD1 3.79Å; W156-Y241 AromaticContact CH2-CD2 3.7Å; W156-Y241 HydrophobicContact CH2-CD2 3.7Å; W156-Y241 AromaticContact CH2-CE1 3.97Å; W156-Y241 HydrophobicContact CH2-CE1 3.97Å; W156-Y241 AromaticContact CH2-CE2 3.87Å; W156-Y241 HydrophobicContact CH2-CE2 3.87Å; W156-Y241 AromaticContact CH2-CG 3.65Å; W156-Y241 HydrophobicContact CH2-CG 3.65Å; W156-Y241 AromaticContact CZ3-CD1 3.79Å; W156-Y241 HydrophobicContact CZ3-CD1 3.79Å; W156-Y241 HydrophobicContact CZ3-CD2 4.38Å; W156-Y241 AromaticContact CZ3-CE1 3.66Å; W156-Y241 HydrophobicContact CZ3-CE1 3.66Å; W156-Y241 HydrophobicContact CZ3-CE2 4.26Å; W156-Y241 HydrophobicContact CZ3-CG 4.15Å; W156-Y241 AromaticContact CZ3-CZ 3.91Å
157	G	90.6	Very high	88.4	Confident	45 Å²	45	51.9 Å²	51.9	46%	0.464	26%	0.263	S	S	.	.	H	α-helix	trans	-65.9	-9.3	174.8	0	0	0	0	0	114.9	L153 I155	L153-G157 PolarHBondContact O-N 3.46Å; I155-G157 VanDerWaalsContact C-N 3.31Å; I155-G157 PolarHBondContact O-N 3.42Å
158	S	89.3	Confident	88.1	Confident	64 Å²	64	56.8 Å²	56.8	45%	0.448	29%	0.285	S	S	.	.	H	α-helix	trans	-104.1	-13.9	178.5	-54.4	0	0	0	0	113.7	M154 I155 W156	M154-S158 PolarHBondContact O-OG 3.39Å; I155-S158 WeakPolarHBondContact O-CA 3.31Å; I155-S158 WeakPolarHBondContact O-CB 3.35Å; I155-S158 PolarHBondContact O-N 2.91Å; W156-S158 PolarHBondContact O-N 3.34Å; W156-S158 VanDerWaalsContact O-N 3.1Å
159	I	85.4	Confident	87.9	Confident	10 Å²	10	59.5 Å²	59.5	5%	0.051	30%	0.298	C	S	.	.	H	α-helix	trans	-78.8	-48.6	-175.3	-73.8	167.9	0	0	0	112.1	Y122 I123 F126 I155 W156 Y241	Y122-I159 VanDerWaalsContact CB-CG1 3.48Å; Y122-I159 HydrophobicContact CG-CG1 4.43Å; I123-I159 HydrophobicContact CG1-CG2 4.33Å; F126-I159 HydrophobicContact CB-CD1 3.62Å; F126-I159 HydrophobicContact CD1-CD1 4.42Å; F126-I159 HydrophobicContact CD2-CD1 4.5Å; F126-I159 HydrophobicContact CG-CD1 3.95Å; I155-I159 HydrophobicContact CG2-CD1 3.93Å; I155-I159 HydrophobicContact CG2-CG1 4.17Å; I155-I159 WeakPolarHBondContact O-CG1 3.48Å; I155-I159 PolarHBondContact O-N 3.07Å; W156-I159 HydrophobicContact CE3-CD1 3.93Å; W156-I159 HydrophobicContact CZ3-CD1 4.28Å; W156-I159 PolarHBondContact O-N 3.27Å; I159-Y241 VanDerWaalsContact CG2-OH 3.24Å; I159-Y241 WeakPolarHBondContact CG2-OH 3.46Å
160	E	72	Confident	87.8	Confident	46 Å²	46	59.4 Å²	59.4	22%	0.215	30%	0.297	C	S	.	.			trans	-126.6	122.3	-167.4	-150.9	64.5	-106.9	0	0	109.3	R119	R119-E160 IonicContact CZ-OE2 3.9Å; R119-E160 IonicContact NE-OE2 3.42Å; R119-E160 IonicContact NH2-OE2 3.01Å; R119-E160 PolarHBondContact NH2-OE2 3.32Å
161	K	65.1	Low	87.7	Confident	202 Å²	202	61.4 Å²	61.4	88%	0.878	31%	0.306	S	S	*	.	S	Bend	trans	-85.3	-24.1	177.4	-68.1	-176.7	179.8	179.1	0	112.1
162	E	66.1	Low	87.6	Confident	162 Å²	162	63 Å²	63	76%	0.757	32%	0.315	S	S	*	.	S	Bend	trans	-88.8	107.8	174	-62.2	-160.3	177.7	0	0	108.8	D164	E162-D164 VanDerWaalsContact C-N 3.33Å; E162-D164 PolarHBondContact O-N 2.86Å
163	H	68.4	Low	87.5	Confident	117 Å²	117	63.3 Å²	63.3	54%	0.542	32%	0.317	S	S	.	.			trans	-80.4	84.7	177.7	-64.1	-57.2	0	0	0	109.4	H167	H163-H167 AromaticContact CE1-CD2 3.97Å; H163-H167 AromaticContact CE1-NE2 3.61Å; H163-H167 AromaticContact ND1-CD2 3.18Å; H163-H167 PolarHBondContact ND1-CD2 3.35Å; H163-H167 AromaticContact ND1-CG 3.94Å; H163-H167 AromaticContact ND1-NE2 3.28Å; H163-H167 PolarHBondContact ND1-NE2 3.36Å
164	D	84.3	Confident	87.6	Confident	88 Å²	88	62 Å²	62	47%	0.471	31%	0.31	S	S	.	.			trans	-74.8	168.2	167.4	77.6	-3.9	0	0	0	111.1	E162 L166 H167 E168	E162-D164 VanDerWaalsContact C-N 3.33Å; E162-D164 PolarHBondContact O-N 2.86Å; D164-L166 PolarHBondContact O-N 3.19Å; D164-L166 PolarHBondContact OD1-N 3.18Å; D164-H167 WeakPolarHBondContact O-CB 3.37Å; D164-H167 PolarHBondContact O-N 3.21Å; D164-H167 VanDerWaalsContact O-N 3.11Å; D164-H167 VanDerWaalsContact OD1-CB 3.24Å; D164-H167 WeakPolarHBondContact OD1-CB 3.34Å; D164-H167 PolarHBondContact OD1-N 2.89Å; D164-E168 PolarHBondContact O-N 3.02Å
165	K	90.5	Very high	87.7	Confident	156 Å²	156	58.3 Å²	58.3	68%	0.678	29%	0.291	S	S	*	.	H	α-helix	trans	-58.4	-34.6	179.6	-175.8	178.5	178	-176.5	0	112.2	H167 E169	K165-H167 VanDerWaalsContact C-N 3.34Å; K165-E169 WeakPolarHBondContact CE-OE1 3.46Å; K165-E169 WeakPolarHBondContact O-CB 3.03Å; K165-E169 VanDerWaalsContact O-CG 3.29Å; K165-E169 WeakPolarHBondContact O-CG 3.34Å; K165-E169 PolarHBondContact O-N 3.12Å
166	L	91.1	Very high	87.7	Confident	41 Å²	41	57.6 Å²	57.6	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-66.7	-39.4	178.9	-179.8	62.6	0	0	0	110.9	D164 E169 I170 K237	D164-L166 PolarHBondContact O-N 3.19Å; D164-L166 PolarHBondContact OD1-N 3.18Å; L166-E169 PolarHBondContact O-N 2.93Å; L166-I170 HydrophobicContact CD1-CD1 3.93Å; L166-I170 HydrophobicContact CD1-CG1 4.18Å; L166-I170 HydrophobicContact CD2-CD1 4.49Å; L166-I170 HydrophobicContact CG-CD1 3.85Å; L166-I170 HydrophobicContact CG-CG1 4.46Å; L166-I170 WeakPolarHBondContact O-CB 3.46Å; L166-I170 WeakPolarHBondContact O-CG1 3.34Å; L166-I170 PolarHBondContact O-N 3.27Å; L166-K237 HydrophobicContact CD1-CD 4.25Å
167	H	91.7	Very high	87.8	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.019	29%	0.287	C	S	.	.	H	α-helix	trans	-61.6	-46.4	177.3	-172.9	98.6	0	0	0	111.8	W156 H163 D164 K165 Q171	W156-H167 AromaticContact CD1-CE1 3.62Å; W156-H167 AromaticContact CD1-NE2 3.67Å; W156-H167 AromaticContact CE2-CE1 3.7Å; W156-H167 AromaticContact CE2-ND1 3.49Å; W156-H167 HydrophobicContact CZ2-CB 4.43Å; W156-H167 AromaticContact CZ2-ND1 3.62Å; W156-H167 AromaticContact NE1-CD2 3.67Å; W156-H167 AromaticContact NE1-CE1 3.32Å; W156-H167 PolarHBondContact NE1-CE1 3.32Å; W156-H167 VanDerWaalsContact NE1-CE1 3.32Å; W156-H167 AromaticContact NE1-CG 3.59Å; W156-H167 AromaticContact NE1-ND1 3.36Å; W156-H167 PolarHBondContact NE1-ND1 3.02Å; W156-H167 AromaticContact NE1-NE2 3.51Å; W156-H167 PolarHBondContact NE1-O 3.21Å; W156-H167 VanDerWaalsContact NE1-O 3.16Å; W156-H167 PolarHBondContact O-CE1 2.79Å; H163-H167 AromaticContact CE1-CD2 3.97Å; H163-H167 AromaticContact CE1-NE2 3.61Å; H163-H167 AromaticContact ND1-CD2 3.18Å; H163-H167 PolarHBondContact ND1-CD2 3.35Å; H163-H167 AromaticContact ND1-CG 3.94Å; H163-H167 AromaticContact ND1-NE2 3.28Å; H163-H167 PolarHBondContact ND1-NE2 3.36Å; D164-H167 WeakPolarHBondContact O-CB 3.37Å; D164-H167 PolarHBondContact O-N 3.21Å; D164-H167 VanDerWaalsContact O-N 3.11Å; D164-H167 VanDerWaalsContact OD1-CB 3.24Å; D164-H167 WeakPolarHBondContact OD1-CB 3.34Å; D164-H167 PolarHBondContact OD1-N 2.89Å; K165-H167 VanDerWaalsContact C-N 3.34Å; H167-Q171 VanDerWaalsContact O-CB 3.22Å; H167-Q171 WeakPolarHBondContact O-CB 3.17Å; H167-Q171 PolarHBondContact O-N 3.22Å
168	E	91.5	Very high	88.1	Confident	107 Å²	107	55.4 Å²	55.4	50%	0.5	27%	0.266	S	S	.	.	H	α-helix	trans	-64.9	-42	175.7	-67.6	-171.4	171.2	0	0	112.4	D164 Q171 N172	D164-E168 PolarHBondContact O-N 3.02Å; E168-Q171 PolarHBondContact O-N 3.47Å; E168-N172 WeakPolarHBondContact O-CB 3.48Å; E168-N172 VanDerWaalsContact O-CG 3.26Å; E168-N172 PolarHBondContact O-N 3.46Å; E168-N172 PolarHBondContact O-ND2 3.11Å; E168-N172 VanDerWaalsContact O-ND2 3.12Å
169	E	93.3	Very high	88.4	Confident	58 Å²	58	52.4 Å²	52.4	27%	0.271	25%	0.245	S	C	.	.	H	α-helix	trans	-60.4	-50.7	176.8	-77.9	178.4	-170.1	0	0	111.4	K165 L166 Q171 N172 L173 K237	K165-E169 WeakPolarHBondContact CE-OE1 3.46Å; K165-E169 WeakPolarHBondContact O-CB 3.03Å; K165-E169 VanDerWaalsContact O-CG 3.29Å; K165-E169 WeakPolarHBondContact O-CG 3.34Å; K165-E169 PolarHBondContact O-N 3.12Å; L166-E169 PolarHBondContact O-N 2.93Å; E169-Q171 VanDerWaalsContact C-N 3.33Å; E169-Q171 PolarHBondContact O-N 3Å; E169-N172 PolarHBondContact O-N 3.24Å; E169-L173 WeakPolarHBondContact O-CB 3.41Å; E169-L173 WeakPolarHBondContact O-CD1 3.33Å; E169-L173 VanDerWaalsContact O-CG 3.22Å; E169-L173 WeakPolarHBondContact O-CG 3.29Å; E169-L173 PolarHBondContact O-N 3.42Å; E169-K237 WeakPolarHBondContact OE2-CE 3.35Å; E169-K237 IonicContact OE2-NZ 3.87Å; E169-K237 PolarHBondContact OE2-NZ 3.21Å
170	I	95.4	Very high	88.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.4	-45.2	177.1	-70.7	171	0	0	0	110.2	F126 W156 L166 N172 L173 I174 K237 I238 Y241	F126-I170 HydrophobicContact CZ-CG2 4.23Å; W156-I170 HydrophobicContact CD2-CG2 4.11Å; W156-I170 HydrophobicContact CH2-CD1 3.86Å; W156-I170 HydrophobicContact CH2-CG2 4.25Å; W156-I170 HydrophobicContact CZ2-CB 3.87Å; W156-I170 HydrophobicContact CZ2-CD1 3.72Å; W156-I170 HydrophobicContact CZ2-CG1 4.4Å; W156-I170 HydrophobicContact CZ2-CG2 3.71Å; L166-I170 HydrophobicContact CD1-CD1 3.93Å; L166-I170 HydrophobicContact CD1-CG1 4.18Å; L166-I170 HydrophobicContact CD2-CD1 4.49Å; L166-I170 HydrophobicContact CG-CD1 3.85Å; L166-I170 HydrophobicContact CG-CG1 4.46Å; L166-I170 WeakPolarHBondContact O-CB 3.46Å; L166-I170 WeakPolarHBondContact O-CG1 3.34Å; L166-I170 PolarHBondContact O-N 3.27Å; I170-N172 PolarHBondContact O-N 3.05Å; I170-L173 PolarHBondContact O-N 3.38Å; I170-I174 HydrophobicContact CG2-CD1 3.59Å; I170-I174 HydrophobicContact CG2-CG1 4.28Å; I170-I174 VanDerWaalsContact O-CG1 3.29Å; I170-I174 WeakPolarHBondContact O-CG1 3.38Å; I170-I174 PolarHBondContact O-N 3.05Å; I170-K237 HydrophobicContact CG1-CB 3.95Å; I170-I238 HydrophobicContact CD1-CG1 4.48Å; I170-I238 HydrophobicContact CG1-CG1 4.37Å; I170-I238 HydrophobicContact CG2-CG1 3.92Å; I170-Y241 HydrophobicContact CD1-CG 4.47Å
171	Q	94.5	Very high	90.1	Very high	50 Å²	50	49.8 Å²	49.8	23%	0.234	23%	0.232	C	C	.	.	H	α-helix	trans	-58.3	-47.6	179.2	-173.8	179.3	-99.2	0	0	111.7	L153 H167 E168 E169 I174 K175	L153-Q171 HydrophobicContact CD1-CG 3.66Å; H167-Q171 VanDerWaalsContact O-CB 3.22Å; H167-Q171 WeakPolarHBondContact O-CB 3.17Å; H167-Q171 PolarHBondContact O-N 3.22Å; E168-Q171 PolarHBondContact O-N 3.47Å; E169-Q171 VanDerWaalsContact C-N 3.33Å; E169-Q171 PolarHBondContact O-N 3Å; Q171-I174 PolarHBondContact O-N 3.34Å; Q171-K175 WeakPolarHBondContact O-CG 3.37Å; Q171-K175 PolarHBondContact O-N 3.05Å; Q171-K175 VanDerWaalsContact O-N 3.07Å
172	N	93.4	Very high	91.5	Very high	33 Å²	33	40.2 Å²	40.2	18%	0.176	19%	0.191	C	C	.	.	H	α-helix	trans	-65.7	-39.2	179.6	-71.2	-32.2	0	0	0	111.7	E168 E169 I170 K175 I176 F208	E168-N172 WeakPolarHBondContact O-CB 3.48Å; E168-N172 VanDerWaalsContact O-CG 3.26Å; E168-N172 PolarHBondContact O-N 3.46Å; E168-N172 PolarHBondContact O-ND2 3.11Å; E168-N172 VanDerWaalsContact O-ND2 3.12Å; E169-N172 PolarHBondContact O-N 3.24Å; I170-N172 PolarHBondContact O-N 3.05Å; N172-K175 PolarHBondContact O-N 3.1Å; N172-I176 VanDerWaalsContact O-CG1 3.28Å; N172-I176 WeakPolarHBondContact O-CG1 3.24Å; N172-I176 PolarHBondContact O-N 3.34Å; N172-F208 HydrophobicContact CB-CE2 4.38Å
173	L	96.4	Very high	92.9	Very high	7 Å²	7	32.5 Å²	32.5	4%	0.037	16%	0.155	C	C	.	.	H	α-helix	trans	-64.4	-42.6	176.8	-71.5	166.9	0	0	0	112.2	E169 I170 K175 I176 Q177 F229 M234 K237	E169-L173 WeakPolarHBondContact O-CB 3.41Å; E169-L173 WeakPolarHBondContact O-CD1 3.33Å; E169-L173 VanDerWaalsContact O-CG 3.22Å; E169-L173 WeakPolarHBondContact O-CG 3.29Å; E169-L173 PolarHBondContact O-N 3.42Å; I170-L173 PolarHBondContact O-N 3.38Å; L173-K175 PolarHBondContact O-N 2.87Å; L173-I176 PolarHBondContact O-N 2.88Å; L173-Q177 VanDerWaalsContact O-CB 3.32Å; L173-Q177 WeakPolarHBondContact O-CB 3.49Å; L173-Q177 WeakPolarHBondContact O-CG 3.35Å; L173-Q177 PolarHBondContact O-N 3.49Å; L173-F229 HydrophobicContact CD2-CB 4.23Å; L173-F229 HydrophobicContact CD2-CD1 3.75Å; L173-F229 HydrophobicContact CD2-CG 4.5Å; L173-M234 HydrophobicContact CB-CB 3.96Å; L173-M234 HydrophobicContact CB-CG 3.89Å; L173-K237 HydrophobicContact CD1-CB 4Å; L173-K237 HydrophobicContact CD1-CG 3.68Å
174	I	96.8	Very high	94.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.8	-44.7	175.5	-66.7	165	0	0	0	110.5	F126 I130 L149 L153 W156 I170 Q171 I176 Q177 A178 M234	F126-I174 HydrophobicContact CE2-CD1 3.62Å; F126-I174 HydrophobicContact CZ-CD1 3.9Å; I130-I174 HydrophobicContact CD1-CD1 4.11Å; I130-I174 HydrophobicContact CD1-CG1 4.15Å; L149-I174 HydrophobicContact CB-CG2 4.46Å; L149-I174 WeakPolarHBondContact O-CG2 3.48Å; L153-I174 HydrophobicContact CB-CG2 3.98Å; L153-I174 HydrophobicContact CD1-CB 4.34Å; L153-I174 HydrophobicContact CD1-CG2 4.13Å; W156-I174 HydrophobicContact CG-CD1 4.49Å; I170-I174 HydrophobicContact CG2-CD1 3.59Å; I170-I174 HydrophobicContact CG2-CG1 4.28Å; I170-I174 VanDerWaalsContact O-CG1 3.29Å; I170-I174 WeakPolarHBondContact O-CG1 3.38Å; I170-I174 PolarHBondContact O-N 3.05Å; Q171-I174 PolarHBondContact O-N 3.34Å; I174-I176 VanDerWaalsContact C-N 3.35Å; I174-I176 PolarHBondContact O-N 3.26Å; I174-Q177 PolarHBondContact O-N 2.85Å; I174-A178 WeakPolarHBondContact O-CB 3.33Å; I174-A178 PolarHBondContact O-N 3.16Å; I174-M234 HydrophobicContact CB-SD 4.44Å; I174-M234 HydrophobicContact CG1-CG 4.37Å; I174-M234 HydrophobicContact CG1-SD 3.88Å
175	K	95.3	Very high	94.5	Very high	15 Å²	15	31.5 Å²	31.5	7%	0.065	15%	0.15	C	C	.	.	H	α-helix	trans	-58.8	-45.1	176.9	-70.9	177.4	179.3	176.8	0	112.2	L153 Q171 N172 L173 I198 F199	L153-K175 HydrophobicContact CD1-CG 3.93Å; L153-K175 HydrophobicContact CD2-CD 4.46Å; L153-K175 HydrophobicContact CD2-CG 3.64Å; L153-K175 HydrophobicContact CG-CG 4.47Å; Q171-K175 WeakPolarHBondContact O-CG 3.37Å; Q171-K175 PolarHBondContact O-N 3.05Å; Q171-K175 VanDerWaalsContact O-N 3.07Å; N172-K175 PolarHBondContact O-N 3.1Å; L173-K175 PolarHBondContact O-N 2.87Å; K175-I198 HydrophobicContact CB-CG2 4.12Å; K175-I198 HydrophobicContact CD-CG2 3.85Å; K175-I198 HydrophobicContact CG-CG2 3.64Å; K175-F199 HydrophobicContact CB-CE2 4.3Å; K175-F199 HydrophobicContact CB-CZ 3.92Å; K175-F199 HydrophobicContact CD-CE1 4.33Å; K175-F199 HydrophobicContact CD-CZ 4.08Å; K175-F199 HydrophobicContact CG-CZ 4.48Å
176	I	95.4	Very high	94.5	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-63.8	-46.3	177.7	-68.5	164.4	0	0	0	110.2	N172 L173 I174 I179 A180 F208 L212 F225 F226 F229	N172-I176 VanDerWaalsContact O-CG1 3.28Å; N172-I176 WeakPolarHBondContact O-CG1 3.24Å; N172-I176 PolarHBondContact O-N 3.34Å; L173-I176 PolarHBondContact O-N 2.88Å; I174-I176 VanDerWaalsContact C-N 3.35Å; I174-I176 PolarHBondContact O-N 3.26Å; I176-I179 PolarHBondContact O-N 3.2Å; I176-A180 WeakPolarHBondContact O-CB 3.45Å; I176-A180 PolarHBondContact O-N 3.31Å; I176-F208 HydrophobicContact CD1-CD2 3.91Å; I176-F208 HydrophobicContact CD1-CE2 4.3Å; I176-F208 HydrophobicContact CD1-CG 4.36Å; I176-L212 HydrophobicContact CG1-CD1 4.23Å; I176-L212 HydrophobicContact CG2-CD2 4.47Å; I176-F225 HydrophobicContact CD1-CE1 4Å; I176-F225 HydrophobicContact CD1-CZ 3.82Å; I176-F225 HydrophobicContact CG1-CE1 4.03Å; I176-F225 HydrophobicContact CG1-CZ 4.22Å; I176-F225 HydrophobicContact CG2-CD1 4.45Å; I176-F225 HydrophobicContact CG2-CE1 3.78Å; I176-F226 HydrophobicContact CG2-CD1 3.94Å; I176-F226 HydrophobicContact CG2-CE1 4Å; I176-F229 HydrophobicContact CD1-CB 3.94Å; I176-F229 HydrophobicContact CD1-CD1 3.82Å; I176-F229 HydrophobicContact CD1-CD2 4.24Å; I176-F229 HydrophobicContact CD1-CE1 4.38Å; I176-F229 HydrophobicContact CD1-CG 3.74Å; I176-F229 HydrophobicContact CG2-CB 3.9Å
177	Q	97.4	Very high	94.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-72.5	-29.8	-175.9	-73.5	-61.4	-54.4	0	0	113.4	L149 L173 I174 I179 A180 V181 F229 Y231 M234	L149-Q177 HydrophobicContact CD1-CB 4.05Å; L173-Q177 VanDerWaalsContact O-CB 3.32Å; L173-Q177 WeakPolarHBondContact O-CB 3.49Å; L173-Q177 WeakPolarHBondContact O-CG 3.35Å; L173-Q177 PolarHBondContact O-N 3.49Å; I174-Q177 PolarHBondContact O-N 2.85Å; Q177-I179 PolarHBondContact O-N 2.92Å; Q177-A180 PolarHBondContact O-N 2.93Å; Q177-V181 WeakPolarHBondContact O-CB 3.43Å; Q177-V181 VanDerWaalsContact O-CG2 3.3Å; Q177-V181 WeakPolarHBondContact O-CG2 3.18Å; Q177-V181 PolarHBondContact O-N 3.43Å; Q177-F229 PolarHBondContact NE2-O 3.18Å; Q177-Y231 VanDerWaalsContact OE1-CA 3.31Å; Q177-Y231 VanDerWaalsContact OE1-CB 3.27Å; Q177-M234 HydrophobicContact CB-CE 4.21Å; Q177-M234 HydrophobicContact CB-SD 3.64Å; Q177-M234 HydrophobicContact CG-CB 4.11Å; Q177-M234 HydrophobicContact CG-CE 4.3Å; Q177-M234 HydrophobicContact CG-SD 3.77Å
178	A	96.9	Very high	94.8	Very high	2 Å²	2	29.7 Å²	29.7	2%	0.017	16%	0.155	C	C	.	.	H	α-helix	trans	-56.8	-38.8	171.5	0	0	0	0	0	111.6	L149 I174 C182 V194 I198	L149-A178 HydrophobicContact CB-CB 3.85Å; I174-A178 WeakPolarHBondContact O-CB 3.33Å; I174-A178 PolarHBondContact O-N 3.16Å; A178-C182 PolarHBondContact O-SG 2.73Å; A178-V194 HydrophobicContact CB-CG1 4Å; A178-I198 HydrophobicContact CB-CD1 3.85Å
179	I	95.9	Very high	94.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-77.5	-46	175	-64.5	161.1	0	0	0	110.7	I176 Q177 V181 C182 M183 A191 V194 F195 F199 L212 I216 F226	I176-I179 PolarHBondContact O-N 3.2Å; Q177-I179 PolarHBondContact O-N 2.92Å; I179-V181 PolarHBondContact O-N 3.47Å; I179-C182 PolarHBondContact O-N 2.82Å; I179-M183 HydrophobicContact CG2-CG 4.1Å; I179-M183 VanDerWaalsContact O-CG 3.29Å; I179-M183 WeakPolarHBondContact O-CG 3.29Å; I179-M183 PolarHBondContact O-N 3.33Å; I179-A191 HydrophobicContact CG2-CB 4.37Å; I179-V194 HydrophobicContact CG1-CG1 4.14Å; I179-F195 HydrophobicContact CD1-CB 4.13Å; I179-F195 HydrophobicContact CD1-CD2 3.79Å; I179-F195 HydrophobicContact CD1-CG 4.46Å; I179-F195 HydrophobicContact CG1-CB 4.39Å; I179-F199 HydrophobicContact CD1-CD2 4.27Å; I179-F199 HydrophobicContact CD1-CE2 3.76Å; I179-L212 HydrophobicContact CD1-CB 4.42Å; I179-L212 HydrophobicContact CD1-CD1 3.93Å; I179-L212 HydrophobicContact CD1-CD2 4.23Å; I179-L212 HydrophobicContact CD1-CG 4.43Å; I179-I216 HydrophobicContact CD1-CD1 4.47Å; I179-I216 HydrophobicContact CG2-CD1 3.69Å; I179-I216 HydrophobicContact CG2-CG1 3.81Å; I179-F226 HydrophobicContact CG2-CZ 4.43Å
180	A	95.5	Very high	94.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59	-44	-175.9	0	0	0	0	0	112.3	I176 Q177 C182 M183 E184 F226	I176-A180 WeakPolarHBondContact O-CB 3.45Å; I176-A180 PolarHBondContact O-N 3.31Å; Q177-A180 PolarHBondContact O-N 2.93Å; A180-C182 VanDerWaalsContact C-N 3.32Å; A180-C182 PolarHBondContact O-N 3.31Å; A180-M183 WeakPolarHBondContact O-CB 3.44Å; A180-M183 PolarHBondContact O-N 3.38Å; A180-M183 VanDerWaalsContact O-N 3.15Å; A180-E184 WeakPolarHBondContact O-CB 3.49Å; A180-E184 WeakPolarHBondContact O-CG 3.16Å; A180-E184 PolarHBondContact O-N 3.5Å; A180-F226 HydrophobicContact CB-CD1 3.56Å; A180-F226 HydrophobicContact CB-CE1 3.64Å; A180-F226 HydrophobicContact CB-CG 4.08Å; A180-F226 HydrophobicContact CB-CZ 4.22Å
181	V	96.5	Very high	94.9	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.012	16%	0.161	C	C	.	.	H	α-helix	trans	-62.3	-39.6	178.4	173.4	0	0	0	0	111.4	K134 L136 L149 Q177 I179 E184 N185 Y231	K134-V181 HydrophobicContact CG-CG2 4.42Å; L136-V181 HydrophobicContact CD1-CG1 4.37Å; L136-V181 HydrophobicContact CD2-CG1 3.73Å; L136-V181 HydrophobicContact CG-CG1 4.06Å; L149-V181 HydrophobicContact CD1-CG2 3.94Å; Q177-V181 WeakPolarHBondContact O-CB 3.43Å; Q177-V181 VanDerWaalsContact O-CG2 3.3Å; Q177-V181 WeakPolarHBondContact O-CG2 3.18Å; Q177-V181 PolarHBondContact O-N 3.43Å; I179-V181 PolarHBondContact O-N 3.47Å; V181-E184 PolarHBondContact O-N 3.41Å; V181-N185 PolarHBondContact O-N 3.05Å; V181-N185 VanDerWaalsContact O-N 3.11Å; V181-Y231 HydrophobicContact CG2-CD2 4.12Å; V181-Y231 HydrophobicContact CG2-CE2 4.24Å
182	C	95.9	Very high	94.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.2	-41.5	175	-62.4	0	0	0	0	111.6	A178 I179 A180 N185 G186 N187 A191	A178-C182 PolarHBondContact O-SG 2.73Å; I179-C182 PolarHBondContact O-N 2.82Å; A180-C182 VanDerWaalsContact C-N 3.32Å; A180-C182 PolarHBondContact O-N 3.31Å; C182-N185 PolarHBondContact O-N 3.05Å; C182-G186 PolarHBondContact O-N 3.35Å; C182-N187 WeakPolarHBondContact O-CA 3.3Å; C182-N187 PolarHBondContact O-N 3.13Å; C182-A191 HydrophobicContact CB-CB 3.65Å
183	M	94.6	Very high	95	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-64	-43	176.3	-68	-88.8	-53.8	0	0	112.3	I179 A180 N185 G186 F188 A191 I215 I216 T221 F226	I179-M183 HydrophobicContact CG2-CG 4.1Å; I179-M183 VanDerWaalsContact O-CG 3.29Å; I179-M183 WeakPolarHBondContact O-CG 3.29Å; I179-M183 PolarHBondContact O-N 3.33Å; A180-M183 WeakPolarHBondContact O-CB 3.44Å; A180-M183 PolarHBondContact O-N 3.38Å; A180-M183 VanDerWaalsContact O-N 3.15Å; M183-N185 VanDerWaalsContact C-N 3.31Å; M183-N185 PolarHBondContact O-N 2.71Å; M183-G186 PolarHBondContact O-N 3.48Å; M183-G186 VanDerWaalsContact O-N 3.1Å; M183-F188 HydrophobicContact CE-CD1 4.37Å; M183-F188 HydrophobicContact CE-CE1 4.23Å; M183-F188 HydrophobicContact SD-CD1 3.89Å; M183-F188 HydrophobicContact SD-CE1 4.29Å; M183-A191 HydrophobicContact CG-CB 3.98Å; M183-A191 HydrophobicContact SD-CB 4.26Å; M183-I215 HydrophobicContact CE-CG2 3.94Å; M183-I216 HydrophobicContact SD-CB 4.48Å; M183-I216 HydrophobicContact SD-CG1 4.12Å; M183-T221 WeakPolarHBondContact O-CG2 3.42Å; M183-T221 PolarHBondContact O-OG1 3.45Å; M183-F226 HydrophobicContact CE-CE2 4.29Å; M183-F226 HydrophobicContact CG-CE2 4.43Å; M183-F226 HydrophobicContact CG-CZ 4.47Å
184	E	93.8	Very high	94.9	Very high	95 Å²	95	36 Å²	36	44%	0.444	18%	0.18	S	C	.	.	H	α-helix	trans	-63.5	-35.7	178.1	-76.1	177.6	-173.6	0	0	111.8	A180 V181 G186 T221	A180-E184 WeakPolarHBondContact O-CB 3.49Å; A180-E184 WeakPolarHBondContact O-CG 3.16Å; A180-E184 PolarHBondContact O-N 3.5Å; V181-E184 PolarHBondContact O-N 3.41Å; E184-G186 PolarHBondContact O-N 2.77Å; E184-T221 HydrophobicContact CG-CG2 4.22Å
185	N	91.6	Very high	94.8	Very high	89 Å²	89	36.1 Å²	36.1	48%	0.476	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-1.7	175.2	-74.9	14.8	0	0	0	113.7	L136 V181 C182 M183 N187	L136-N185 HydrophobicContact CD1-CB 4.08Å; L136-N185 VanDerWaalsContact CD1-ND2 3.31Å; L136-N185 WeakPolarHBondContact CD1-ND2 3.3Å; V181-N185 PolarHBondContact O-N 3.05Å; V181-N185 VanDerWaalsContact O-N 3.11Å; C182-N185 PolarHBondContact O-N 3.05Å; M183-N185 VanDerWaalsContact C-N 3.31Å; M183-N185 PolarHBondContact O-N 2.71Å; N185-N187 PolarHBondContact O-N 3.37Å; N185-N187 PolarHBondContact O-OD1 3.3Å
186	G	92	Very high	94.7	Very high	38 Å²	38	40.2 Å²	40.2	39%	0.392	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	7.3	-176.7	0	0	0	0	0	114.2	C182 M183 E184 F188	C182-G186 PolarHBondContact O-N 3.35Å; M183-G186 PolarHBondContact O-N 3.48Å; M183-G186 VanDerWaalsContact O-N 3.1Å; E184-G186 PolarHBondContact O-N 2.77Å; G186-F188 VanDerWaalsContact C-N 3.28Å; G186-F188 VanDerWaalsContact O-CD2 3.26Å; G186-F188 WeakPolarHBondContact O-CD2 3.4Å; G186-F188 PolarHBondContact O-N 2.63Å
187	N	93.9	Very high	94.6	Very high	67 Å²	67	43.7 Å²	43.7	36%	0.358	21%	0.214	S	C	.	.			trans	-86.1	62	-178.5	-65.4	-2.8	0	0	0	110.9	C182 N185 K189 E190 A191	C182-N187 WeakPolarHBondContact O-CA 3.3Å; C182-N187 PolarHBondContact O-N 3.13Å; N185-N187 PolarHBondContact O-N 3.37Å; N185-N187 PolarHBondContact O-OD1 3.3Å; N187-K189 VanDerWaalsContact C-N 3.29Å; N187-K189 PolarHBondContact O-N 3.37Å; N187-E190 HydrophobicContact CB-CB 3.88Å; N187-E190 WeakPolarHBondContact CB-OE2 3.44Å; N187-E190 PolarHBondContact ND2-OE2 3.19Å; N187-E190 WeakPolarHBondContact O-CB 3.45Å; N187-E190 PolarHBondContact O-N 3.26Å; N187-E190 VanDerWaalsContact O-N 3.12Å; N187-A191 PolarHBondContact O-N 3.08Å
188	F	93.9	Very high	94.3	Very high	58 Å²	58	44.9 Å²	44.9	25%	0.254	22%	0.22	S	C	.	.	H	α-helix	trans	-59.8	-36.1	-174.9	-56.7	-70.7	0	0	0	114	M183 G186 A191 E192 K219	M183-F188 HydrophobicContact CE-CD1 4.37Å; M183-F188 HydrophobicContact CE-CE1 4.23Å; M183-F188 HydrophobicContact SD-CD1 3.89Å; M183-F188 HydrophobicContact SD-CE1 4.29Å; G186-F188 VanDerWaalsContact C-N 3.28Å; G186-F188 VanDerWaalsContact O-CD2 3.26Å; G186-F188 WeakPolarHBondContact O-CD2 3.4Å; G186-F188 PolarHBondContact O-N 2.63Å; F188-A191 WeakPolarHBondContact O-CB 3.24Å; F188-A191 PolarHBondContact O-N 2.87Å; F188-E192 PolarHBondContact O-N 3.47Å; F188-K219 HydrophobicContact CD1-CB 3.9Å; F188-K219 HydrophobicContact CD1-CD 4.34Å; F188-K219 HydrophobicContact CD1-CG 3.9Å; F188-K219 HydrophobicContact CD2-CD 4.07Å; F188-K219 HydrophobicContact CE1-CB 3.72Å; F188-K219 HydrophobicContact CE1-CG 4.23Å; F188-K219 HydrophobicContact CE2-CD 4.38Å; F188-K219 HydrophobicContact CG-CB 4.44Å; F188-K219 HydrophobicContact CG-CD 4.05Å; F188-K219 HydrophobicContact CG-CG 4.05Å; F188-K219 HydrophobicContact CZ-CB 4.12Å
189	K	94	Very high	93.8	Very high	151 Å²	151	45 Å²	45	66%	0.657	22%	0.22	S	C	*	.	H	α-helix	trans	-65.8	-42.6	177.3	-176.8	179.7	177.5	-174	0	111.2	N187 A191 E192 E193	N187-K189 VanDerWaalsContact C-N 3.29Å; N187-K189 PolarHBondContact O-N 3.37Å; K189-A191 VanDerWaalsContact C-N 3.33Å; K189-E192 PolarHBondContact O-N 3.19Å; K189-E193 VanDerWaalsContact CE-OE1 3.25Å; K189-E193 WeakPolarHBondContact CE-OE1 3.42Å; K189-E193 WeakPolarHBondContact O-CG 3.27Å; K189-E193 PolarHBondContact O-N 2.9Å
190	E	94.4	Very high	92.7	Very high	51 Å²	51	46.5 Å²	46.5	24%	0.238	24%	0.235	C	C	.	.	H	α-helix	trans	-64.6	-41.1	175.8	-169	173.4	-161.8	0	0	110.5	N187 E192 E193 V194	N187-E190 HydrophobicContact CB-CB 3.88Å; N187-E190 WeakPolarHBondContact CB-OE2 3.44Å; N187-E190 PolarHBondContact ND2-OE2 3.19Å; N187-E190 WeakPolarHBondContact O-CB 3.45Å; N187-E190 PolarHBondContact O-N 3.26Å; N187-E190 VanDerWaalsContact O-N 3.12Å; E190-E192 VanDerWaalsContact C-N 3.32Å; E190-E192 PolarHBondContact O-N 3.39Å; E190-E193 PolarHBondContact O-N 3.35Å; E190-V194 HydrophobicContact CG-CG2 4.43Å; E190-V194 WeakPolarHBondContact O-CB 3.4Å; E190-V194 WeakPolarHBondContact O-CG2 3.32Å; E190-V194 PolarHBondContact O-N 3.29Å
191	A	95.3	Very high	91.7	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59	-40.2	175.1	0	0	0	0	0	112.9	I179 C182 M183 N187 F188 K189 F195	I179-A191 HydrophobicContact CG2-CB 4.37Å; C182-A191 HydrophobicContact CB-CB 3.65Å; M183-A191 HydrophobicContact CG-CB 3.98Å; M183-A191 HydrophobicContact SD-CB 4.26Å; N187-A191 PolarHBondContact O-N 3.08Å; F188-A191 WeakPolarHBondContact O-CB 3.24Å; F188-A191 PolarHBondContact O-N 2.87Å; K189-A191 VanDerWaalsContact C-N 3.33Å; A191-F195 WeakPolarHBondContact O-CB 3.41Å; A191-F195 PolarHBondContact O-N 3.05Å
192	E	94.2	Very high	90	Very high	106 Å²	106	55.2 Å²	55.2	50%	0.495	29%	0.287	S	S	.	.	H	α-helix	trans	-66.5	-44	174.4	-172.4	176	-165.1	0	0	111.5	F188 K189 E190 F195 E196 I216	F188-E192 PolarHBondContact O-N 3.47Å; K189-E192 PolarHBondContact O-N 3.19Å; E190-E192 VanDerWaalsContact C-N 3.32Å; E190-E192 PolarHBondContact O-N 3.39Å; E192-F195 WeakPolarHBondContact O-CB 3.22Å; E192-F195 PolarHBondContact O-N 2.84Å; E192-E196 WeakPolarHBondContact O-CG 3.28Å; E192-E196 PolarHBondContact O-N 2.83Å; E192-I216 HydrophobicContact CB-CG2 4.14Å
193	E	94.6	Very high	88.1	Confident	78 Å²	78	62.4 Å²	62.4	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-64.6	-40.5	176.5	-69.3	177.6	-168.9	0	0	112.6	K189 E190 E196 R197	K189-E193 VanDerWaalsContact CE-OE1 3.25Å; K189-E193 WeakPolarHBondContact CE-OE1 3.42Å; K189-E193 WeakPolarHBondContact O-CG 3.27Å; K189-E193 PolarHBondContact O-N 2.9Å; E190-E193 PolarHBondContact O-N 3.35Å; E193-E196 PolarHBondContact O-N 3.33Å; E193-R197 WeakPolarHBondContact O-CG 3.32Å; E193-R197 PolarHBondContact O-N 3.35Å; E193-R197 IonicContact OE2-NH1 3.05Å
194	V	95.5	Very high	86.7	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.3	-45.7	172.7	170.6	0	0	0	0	110	T147 E150 A178 I179 E190 E196 R197 I198	T147-V194 HydrophobicContact CG2-CG2 4.02Å; E150-V194 HydrophobicContact CG-CG1 4.08Å; A178-V194 HydrophobicContact CB-CG1 4Å; I179-V194 HydrophobicContact CG1-CG1 4.14Å; E190-V194 HydrophobicContact CG-CG2 4.43Å; E190-V194 WeakPolarHBondContact O-CB 3.4Å; E190-V194 WeakPolarHBondContact O-CG2 3.32Å; E190-V194 PolarHBondContact O-N 3.29Å; V194-E196 PolarHBondContact O-N 3.22Å; V194-R197 VanDerWaalsContact CG2-NH2 3.3Å; V194-R197 PolarHBondContact O-N 3.08Å; V194-I198 HydrophobicContact CG1-CD1 3.62Å; V194-I198 HydrophobicContact CG1-CG1 4.35Å; V194-I198 WeakPolarHBondContact O-CG1 3.38Å; V194-I198 PolarHBondContact O-N 2.95Å
195	F	94.1	Very high	85.3	Confident	3 Å²	3	69.6 Å²	69.6	1%	0.013	36%	0.355	C	S	.	.	H	α-helix	trans	-58.2	-47	176.2	175.3	-87.1	0	0	0	111.5	I179 A191 E192 R197 I198 F199 K209 L212 L213 I216	I179-F195 HydrophobicContact CD1-CB 4.13Å; I179-F195 HydrophobicContact CD1-CD2 3.79Å; I179-F195 HydrophobicContact CD1-CG 4.46Å; I179-F195 HydrophobicContact CG1-CB 4.39Å; A191-F195 WeakPolarHBondContact O-CB 3.41Å; A191-F195 PolarHBondContact O-N 3.05Å; E192-F195 WeakPolarHBondContact O-CB 3.22Å; E192-F195 PolarHBondContact O-N 2.84Å; F195-R197 VanDerWaalsContact C-N 3.33Å; F195-R197 PolarHBondContact O-N 3.49Å; F195-I198 PolarHBondContact O-N 3.43Å; F195-F199 HydrophobicContact CD2-CB 4.42Å; F195-F199 AromaticContact CD2-CD2 3.63Å; F195-F199 HydrophobicContact CD2-CD2 3.63Å; F195-F199 HydrophobicContact CD2-CE2 4.24Å; F195-F199 HydrophobicContact CD2-CG 4.27Å; F195-F199 HydrophobicContact CE1-CB 4.29Å; F195-F199 HydrophobicContact CE2-CB 4.12Å; F195-F199 AromaticContact CE2-CD2 3.83Å; F195-F199 HydrophobicContact CE2-CD2 3.83Å; F195-F199 HydrophobicContact CE2-CE2 4.48Å; F195-F199 HydrophobicContact CE2-CG 4.05Å; F195-F199 HydrophobicContact CG-CD2 4.26Å; F195-F199 HydrophobicContact CZ-CB 4.05Å; F195-F199 HydrophobicContact CZ-CG 4.45Å; F195-F199 WeakPolarHBondContact O-CA 3.42Å; F195-F199 WeakPolarHBondContact O-CB 3.42Å; F195-F199 PolarHBondContact O-N 3.38Å; F195-K209 HydrophobicContact CE2-CG 4.15Å; F195-K209 WeakPolarHBondContact CE2-O 3.49Å; F195-K209 HydrophobicContact CZ-CG 3.71Å; F195-L212 HydrophobicContact CD2-CB 4.19Å; F195-L212 HydrophobicContact CE2-CB 3.95Å; F195-L213 HydrophobicContact CD1-CD1 4.32Å; F195-L213 HydrophobicContact CE1-CB 4.31Å; F195-L213 HydrophobicContact CE1-CD1 3.84Å; F195-L213 HydrophobicContact CE1-CG 4.49Å; F195-L213 HydrophobicContact CE2-CB 4.16Å; F195-L213 HydrophobicContact CZ-CB 3.74Å; F195-L213 HydrophobicContact CZ-CD1 4.16Å; F195-L213 HydrophobicContact CZ-CG 4.38Å; F195-I216 HydrophobicContact CB-CD1 3.63Å; F195-I216 HydrophobicContact CD2-CD1 3.77Å; F195-I216 HydrophobicContact CG-CD1 3.8Å
196	E	92.8	Very high	84.5	Confident	102 Å²	102	67.8 Å²	67.8	48%	0.477	35%	0.345	S	S	.	.	H	α-helix	trans	-63.8	-35.7	178	-72	-58.8	132.7	0	0	112.4	E192 E193 V194 G200	E192-E196 WeakPolarHBondContact O-CG 3.28Å; E192-E196 PolarHBondContact O-N 2.83Å; E193-E196 PolarHBondContact O-N 3.33Å; V194-E196 PolarHBondContact O-N 3.22Å; E196-G200 WeakPolarHBondContact O-CA 3.39Å; E196-G200 PolarHBondContact O-N 3.4Å
197	R	93.1	Very high	83.8	Confident	75 Å²	75	68.3 Å²	68.3	28%	0.283	34%	0.342	S	S	.	.	H	α-helix	trans	-69.6	-40.2	176	-72.1	-174.5	-60.4	-105.4	11.2	112.7	R145 E150 E193 V194 F195	R145-R197 PolarHBondContact O-NH2 2.94Å; E150-R197 IonicContact OE1-CZ 3.03Å; E150-R197 IonicContact OE1-NE 3.66Å; E150-R197 PolarHBondContact OE1-NE 3.24Å; E150-R197 IonicContact OE1-NH2 2.82Å; E150-R197 PolarHBondContact OE1-NH2 3.14Å; E150-R197 IonicContact OE2-CZ 3.7Å; E150-R197 IonicContact OE2-NE 2.7Å; E150-R197 IonicContact OE2-NH2 3.39Å; E150-R197 PolarHBondContact OE2-NH2 3.01Å; E193-R197 WeakPolarHBondContact O-CG 3.32Å; E193-R197 PolarHBondContact O-N 3.35Å; E193-R197 IonicContact OE2-NH1 3.05Å; V194-R197 VanDerWaalsContact CG2-NH2 3.3Å; V194-R197 PolarHBondContact O-N 3.08Å; F195-R197 VanDerWaalsContact C-N 3.33Å; F195-R197 PolarHBondContact O-N 3.49Å
198	I	90.8	Very high	83.4	Confident	25 Å²	25	68.7 Å²	68.7	13%	0.128	34%	0.34	C	S	.	.	H	α-helix	trans	-79.4	-39.8	-177.7	-64	175.4	0	0	0	111.9	E150 L153 K175 A178 V194 F195	E150-I198 HydrophobicContact CG-CD1 4.06Å; E150-I198 HydrophobicContact CG-CG1 4.3Å; L153-I198 HydrophobicContact CD2-CD1 4.4Å; L153-I198 HydrophobicContact CD2-CG1 4.31Å; L153-I198 HydrophobicContact CD2-CG2 4.18Å; K175-I198 HydrophobicContact CB-CG2 4.12Å; K175-I198 HydrophobicContact CD-CG2 3.85Å; K175-I198 HydrophobicContact CG-CG2 3.64Å; A178-I198 HydrophobicContact CB-CD1 3.85Å; V194-I198 HydrophobicContact CG1-CD1 3.62Å; V194-I198 HydrophobicContact CG1-CG1 4.35Å; V194-I198 WeakPolarHBondContact O-CG1 3.38Å; V194-I198 PolarHBondContact O-N 2.95Å; F195-I198 PolarHBondContact O-N 3.43Å
199	F	86.4	Confident	83.1	Confident	5 Å²	5	67.8 Å²	67.8	2%	0.022	34%	0.336	C	S	.	.	H	α-helix	trans	-118.6	-1.9	-169.2	-64.2	-82.8	0	0	0	114.5	K175 I179 F195 D201 M206 K209 L212	K175-F199 HydrophobicContact CB-CE2 4.3Å; K175-F199 HydrophobicContact CB-CZ 3.92Å; K175-F199 HydrophobicContact CD-CE1 4.33Å; K175-F199 HydrophobicContact CD-CZ 4.08Å; K175-F199 HydrophobicContact CG-CZ 4.48Å; I179-F199 HydrophobicContact CD1-CD2 4.27Å; I179-F199 HydrophobicContact CD1-CE2 3.76Å; F195-F199 HydrophobicContact CD2-CB 4.42Å; F195-F199 AromaticContact CD2-CD2 3.63Å; F195-F199 HydrophobicContact CD2-CD2 3.63Å; F195-F199 HydrophobicContact CD2-CE2 4.24Å; F195-F199 HydrophobicContact CD2-CG 4.27Å; F195-F199 HydrophobicContact CE1-CB 4.29Å; F195-F199 HydrophobicContact CE2-CB 4.12Å; F195-F199 AromaticContact CE2-CD2 3.83Å; F195-F199 HydrophobicContact CE2-CD2 3.83Å; F195-F199 HydrophobicContact CE2-CE2 4.48Å; F195-F199 HydrophobicContact CE2-CG 4.05Å; F195-F199 HydrophobicContact CG-CD2 4.26Å; F195-F199 HydrophobicContact CZ-CB 4.05Å; F195-F199 HydrophobicContact CZ-CG 4.45Å; F195-F199 WeakPolarHBondContact O-CA 3.42Å; F195-F199 WeakPolarHBondContact O-CB 3.42Å; F195-F199 PolarHBondContact O-N 3.38Å; F199-D201 PolarHBondContact O-N 3.39Å; F199-M206 HydrophobicContact CD1-CB 3.67Å; F199-M206 HydrophobicContact CD1-CG 4.13Å; F199-M206 HydrophobicContact CD1-SD 3.48Å; F199-M206 WeakPolarHBondContact CD1-SD 3.34Å; F199-M206 HydrophobicContact CE1-CB 3.78Å; F199-M206 HydrophobicContact CE1-CG 4.41Å; F199-M206 HydrophobicContact CE1-SD 3.75Å; F199-M206 HydrophobicContact CG-SD 4.45Å; F199-K209 HydrophobicContact CB-CD 4.07Å; F199-K209 HydrophobicContact CB-CG 4.1Å; F199-K209 HydrophobicContact CD1-CB 4Å; F199-K209 HydrophobicContact CD1-CD 4.32Å; F199-K209 HydrophobicContact CD1-CG 4.08Å; F199-K209 HydrophobicContact CE1-CB 4.39Å; F199-K209 HydrophobicContact CG-CG 4.29Å; F199-K209 VanDerWaalsContact O-CE 3.24Å; F199-K209 WeakPolarHBondContact O-CE 3.28Å; F199-K209 PolarHBondContact O-NZ 2.95Å; F199-L212 HydrophobicContact CE2-CD1 3.91Å; F199-L212 HydrophobicContact CZ-CD1 3.77Å
200	G	73.4	Confident	82.8	Confident	30 Å²	30	65.5 Å²	65.5	31%	0.309	34%	0.339	S	S	.	.			trans	-67.8	1.8	-168.5	0	0	0	0	0	116.4	E196 P202	E196-G200 WeakPolarHBondContact O-CA 3.39Å; E196-G200 PolarHBondContact O-N 3.4Å; G200-P202 WeakPolarHBondContact O-CD 3.15Å
201	D	75.7	Confident	82.7	Confident	74 Å²	74	66.7 Å²	66.7	40%	0.396	34%	0.343	S	S	.	.			trans	-70.4	112.7	164.5	-167	-23.9	0	0	0	109.4	F199 N203 S204 K209	F199-D201 PolarHBondContact O-N 3.39Å; D201-N203 PolarHBondContact O-N 3.37Å; D201-N203 PolarHBondContact OD1-N 2.81Å; D201-S204 PolarHBondContact O-N 2.9Å; D201-K209 PolarHBondContact O-NZ 3.36Å
202	P	59.4	Low	82.5	Confident	111 Å²	111	66.7 Å²	66.7	72%	0.721	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.6	-178.8	-17.9	32.6	0	0	0	112.7	G200	G200-P202 WeakPolarHBondContact O-CD 3.15Å
203	N	57.4	Low	82.4	Confident	151 Å²	151	65.1 Å²	65.1	81%	0.807	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-8.7	-173.3	-62	-40.1	0	0	0	113.4	D201	D201-N203 PolarHBondContact O-N 3.37Å; D201-N203 PolarHBondContact OD1-N 2.81Å
204	S	64.1	Low	82.3	Confident	34 Å²	34	64.4 Å²	64.4	24%	0.238	34%	0.335	C	S	.	.			trans	-87	115.4	176.5	86.9	0	0	0	0	110.1	D201 M206	D201-S204 PolarHBondContact O-N 2.9Å; S204-M206 PolarHBondContact O-N 3.33Å
205	Y	64.4	Low	82.1	Confident	213 Å²	213	64.4 Å²	64.4	84%	0.835	34%	0.335	S	S	*	.			trans	-66.8	115.3	161.4	179.5	-96.1	0	0	0	107.7
206	M	75.5	Confident	82.1	Confident	51 Å²	51	64.8 Å²	64.8	25%	0.251	34%	0.337	S	S	.	.			trans	-119.7	137.2	172.7	-78.7	-157.4	168.7	0	0	109.7	F199 S204 F208 K209	F199-M206 HydrophobicContact CD1-CB 3.67Å; F199-M206 HydrophobicContact CD1-CG 4.13Å; F199-M206 HydrophobicContact CD1-SD 3.48Å; F199-M206 WeakPolarHBondContact CD1-SD 3.34Å; F199-M206 HydrophobicContact CE1-CB 3.78Å; F199-M206 HydrophobicContact CE1-CG 4.41Å; F199-M206 HydrophobicContact CE1-SD 3.75Å; F199-M206 HydrophobicContact CG-SD 4.45Å; S204-M206 PolarHBondContact O-N 3.33Å; M206-F208 PolarHBondContact O-N 3.41Å; M206-K209 HydrophobicContact CB-CB 4.32Å; M206-K209 WeakPolarHBondContact O-CB 3.47Å; M206-K209 PolarHBondContact O-N 3.21Å
207	P	77	Confident	82	Confident	50 Å²	50	64 Å²	64	33%	0.325	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	138.5	172.7	-27	34.8	0	0	0	111.1	K209	P207-K209 PolarHBondContact O-N 3.43Å
208	F	84.8	Confident	82.1	Confident	74 Å²	74	66.1 Å²	66.1	33%	0.325	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	-4.1	174.8	-41.2	-66.6	0	0	0	117.3	N172 I176 M206 S210 K211 L212 F225 F229	N172-F208 HydrophobicContact CB-CE2 4.38Å; I176-F208 HydrophobicContact CD1-CD2 3.91Å; I176-F208 HydrophobicContact CD1-CE2 4.3Å; I176-F208 HydrophobicContact CD1-CG 4.36Å; M206-F208 PolarHBondContact O-N 3.41Å; F208-S210 PolarHBondContact O-N 3.16Å; F208-K211 PolarHBondContact O-N 2.95Å; F208-K211 VanDerWaalsContact O-N 3.07Å; F208-L212 HydrophobicContact CB-CD1 4.15Å; F208-L212 HydrophobicContact CB-CG 4.4Å; F208-L212 WeakPolarHBondContact O-CG 3.45Å; F208-L212 PolarHBondContact O-N 3.43Å; F208-F225 HydrophobicContact CB-CE2 4.35Å; F208-F225 HydrophobicContact CB-CZ 3.76Å; F208-F225 AromaticContact CD1-CE2 3.73Å; F208-F225 HydrophobicContact CD1-CE2 3.73Å; F208-F225 AromaticContact CD1-CZ 3.81Å; F208-F225 HydrophobicContact CD1-CZ 3.81Å; F208-F225 HydrophobicContact CE1-CE2 4.38Å; F208-F225 HydrophobicContact CG-CE2 4.21Å; F208-F225 AromaticContact CG-CZ 3.81Å; F208-F225 HydrophobicContact CG-CZ 3.81Å; F208-F229 HydrophobicContact CE1-CE2 4.22Å; F208-F229 AromaticContact CE1-CZ 3.81Å; F208-F229 HydrophobicContact CE1-CZ 3.81Å; F208-F229 HydrophobicContact CZ-CE1 4.16Å; F208-F229 AromaticContact CZ-CZ 3.78Å; F208-F229 HydrophobicContact CZ-CZ 3.78Å
209	K	88.7	Confident	82.1	Confident	40 Å²	40	71 Å²	71	17%	0.174	38%	0.377	C	S	.	.	H	α-helix	trans	-49.7	-54.2	-178.1	-178.1	175.3	174.3	172.3	0	113.2	F195 F199 D201 M206 P207 K211 L212 L213	F195-K209 HydrophobicContact CE2-CG 4.15Å; F195-K209 WeakPolarHBondContact CE2-O 3.49Å; F195-K209 HydrophobicContact CZ-CG 3.71Å; F199-K209 HydrophobicContact CB-CD 4.07Å; F199-K209 HydrophobicContact CB-CG 4.1Å; F199-K209 HydrophobicContact CD1-CB 4Å; F199-K209 HydrophobicContact CD1-CD 4.32Å; F199-K209 HydrophobicContact CD1-CG 4.08Å; F199-K209 HydrophobicContact CE1-CB 4.39Å; F199-K209 HydrophobicContact CG-CG 4.29Å; F199-K209 VanDerWaalsContact O-CE 3.24Å; F199-K209 WeakPolarHBondContact O-CE 3.28Å; F199-K209 PolarHBondContact O-NZ 2.95Å; D201-K209 PolarHBondContact O-NZ 3.36Å; M206-K209 HydrophobicContact CB-CB 4.32Å; M206-K209 WeakPolarHBondContact O-CB 3.47Å; M206-K209 PolarHBondContact O-N 3.21Å; P207-K209 PolarHBondContact O-N 3.43Å; K209-K211 VanDerWaalsContact C-N 3.32Å; K209-K211 PolarHBondContact O-N 3.32Å; K209-L212 PolarHBondContact O-N 3.04Å; K209-L213 WeakPolarHBondContact O-CB 3.5Å; K209-L213 PolarHBondContact O-N 2.67Å
210	S	87.8	Confident	82.4	Confident	102 Å²	102	73.6 Å²	73.6	71%	0.713	39%	0.391	S	S	*	.	H	α-helix	trans	-64.8	-35.4	-179.1	-50.1	0	0	0	0	112.9	F208 M214	F208-S210 PolarHBondContact O-N 3.16Å; S210-M214 WeakPolarHBondContact O-CB 3.22Å; S210-M214 PolarHBondContact O-N 3.07Å; S210-M214 VanDerWaalsContact O-N 3.09Å
211	K	91.1	Very high	83.2	Confident	76 Å²	76	73.2 Å²	73.2	33%	0.33	38%	0.382	S	S	.	.	H	α-helix	trans	-71	-42.6	179.6	-173.8	65.9	-175.7	174.4	0	111	F208 K209 M214 I215 H223 F225	F208-K211 PolarHBondContact O-N 2.95Å; F208-K211 VanDerWaalsContact O-N 3.07Å; K209-K211 VanDerWaalsContact C-N 3.32Å; K209-K211 PolarHBondContact O-N 3.32Å; K211-M214 HydrophobicContact CD-CE 4.02Å; K211-M214 HydrophobicContact CD-SD 4.48Å; K211-M214 WeakPolarHBondContact O-CB 3.24Å; K211-M214 PolarHBondContact O-N 3.22Å; K211-I215 HydrophobicContact CG-CD1 4.16Å; K211-I215 VanDerWaalsContact O-CG1 3.27Å; K211-I215 WeakPolarHBondContact O-CG1 3.18Å; K211-I215 PolarHBondContact O-N 2.96Å; K211-H223 WeakPolarHBondContact CE-CE1 3.17Å; K211-H223 WeakPolarHBondContact CE-NE2 3.34Å; K211-H223 PolarHBondContact NZ-CE1 3.44Å; K211-H223 PolarHBondContact NZ-NE2 3.32Å; K211-F225 HydrophobicContact CG-CD2 3.99Å; K211-F225 HydrophobicContact CG-CE2 4.23Å; K211-F225 HydrophobicContact CG-CG 4.43Å
212	L	91.7	Very high	83.7	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-62.9	-45.8	175.2	-74.2	166.1	0	0	0	111.3	I176 I179 F195 F199 F208 K209 M214 I215 I216 F225 F226	I176-L212 HydrophobicContact CG1-CD1 4.23Å; I176-L212 HydrophobicContact CG2-CD2 4.47Å; I179-L212 HydrophobicContact CD1-CB 4.42Å; I179-L212 HydrophobicContact CD1-CD1 3.93Å; I179-L212 HydrophobicContact CD1-CD2 4.23Å; I179-L212 HydrophobicContact CD1-CG 4.43Å; F195-L212 HydrophobicContact CD2-CB 4.19Å; F195-L212 HydrophobicContact CE2-CB 3.95Å; F199-L212 HydrophobicContact CE2-CD1 3.91Å; F199-L212 HydrophobicContact CZ-CD1 3.77Å; F208-L212 HydrophobicContact CB-CD1 4.15Å; F208-L212 HydrophobicContact CB-CG 4.4Å; F208-L212 WeakPolarHBondContact O-CG 3.45Å; F208-L212 PolarHBondContact O-N 3.43Å; K209-L212 PolarHBondContact O-N 3.04Å; L212-M214 VanDerWaalsContact C-N 3.29Å; L212-M214 PolarHBondContact O-N 2.99Å; L212-I215 PolarHBondContact O-N 2.98Å; L212-I215 VanDerWaalsContact O-N 3.14Å; L212-I216 VanDerWaalsContact O-CG1 3.3Å; L212-I216 WeakPolarHBondContact O-CG1 3.48Å; L212-I216 PolarHBondContact O-N 3.22Å; L212-F225 HydrophobicContact CD2-CD1 4.31Å; L212-F225 HydrophobicContact CD2-CE1 3.75Å; L212-F225 HydrophobicContact CG-CE1 4.22Å; L212-F226 HydrophobicContact CD2-CE1 3.89Å; L212-F226 HydrophobicContact CD2-CZ 4.24Å
213	L	91.1	Very high	85.3	Confident	73 Å²	73	73.4 Å²	73.4	38%	0.382	37%	0.369	S	S	.	.	H	α-helix	trans	-58.5	-42.4	176.6	-175.9	61.1	0	0	0	111.9	F195 K209 S217	F195-L213 HydrophobicContact CD1-CD1 4.32Å; F195-L213 HydrophobicContact CE1-CB 4.31Å; F195-L213 HydrophobicContact CE1-CD1 3.84Å; F195-L213 HydrophobicContact CE1-CG 4.49Å; F195-L213 HydrophobicContact CE2-CB 4.16Å; F195-L213 HydrophobicContact CZ-CB 3.74Å; F195-L213 HydrophobicContact CZ-CD1 4.16Å; F195-L213 HydrophobicContact CZ-CG 4.38Å; K209-L213 WeakPolarHBondContact O-CB 3.5Å; K209-L213 PolarHBondContact O-N 2.67Å; L213-S217 WeakPolarHBondContact O-CB 3.31Å; L213-S217 PolarHBondContact O-N 3.18Å; L213-S217 PolarHBondContact O-OG 3.11Å
214	M	92.4	Very high	86.9	Confident	64 Å²	64	69.1 Å²	69.1	32%	0.315	35%	0.351	S	S	.	.	H	α-helix	trans	-60.1	-46.2	175.5	-173.8	-152.4	76	0	0	111.5	S210 K211 L212 S217 Q218	S210-M214 WeakPolarHBondContact O-CB 3.22Å; S210-M214 PolarHBondContact O-N 3.07Å; S210-M214 VanDerWaalsContact O-N 3.09Å; K211-M214 HydrophobicContact CD-CE 4.02Å; K211-M214 HydrophobicContact CD-SD 4.48Å; K211-M214 WeakPolarHBondContact O-CB 3.24Å; K211-M214 PolarHBondContact O-N 3.22Å; L212-M214 VanDerWaalsContact C-N 3.29Å; L212-M214 PolarHBondContact O-N 2.99Å; M214-S217 PolarHBondContact O-N 2.73Å; M214-Q218 WeakPolarHBondContact O-CB 3.49Å; M214-Q218 VanDerWaalsContact O-CG 3.31Å; M214-Q218 WeakPolarHBondContact O-CG 3.24Å; M214-Q218 PolarHBondContact O-N 3.25Å
215	I	92.7	Very high	88.3	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-64.8	-45.5	-179.5	-67.2	164.8	0	0	0	111.3	M183 K211 L212 S217 Q218 K219 D220 H223 F225 F226	M183-I215 HydrophobicContact CE-CG2 3.94Å; K211-I215 HydrophobicContact CG-CD1 4.16Å; K211-I215 VanDerWaalsContact O-CG1 3.27Å; K211-I215 WeakPolarHBondContact O-CG1 3.18Å; K211-I215 PolarHBondContact O-N 2.96Å; L212-I215 PolarHBondContact O-N 2.98Å; L212-I215 VanDerWaalsContact O-N 3.14Å; I215-S217 VanDerWaalsContact C-N 3.34Å; I215-S217 PolarHBondContact O-N 3.07Å; I215-Q218 CarbonylContact O-C 3.43Å; I215-Q218 PolarHBondContact O-N 3.01Å; I215-K219 PolarHBondContact O-N 2.89Å; I215-D220 HydrophobicContact CG2-CB 4.48Å; I215-D220 VanDerWaalsContact CG2-O 3.28Å; I215-D220 WeakPolarHBondContact CG2-O 3.39Å; I215-D220 PolarHBondContact O-N 3.08Å; I215-H223 HydrophobicContact CD1-CB 4.25Å; I215-H223 HydrophobicContact CG1-CB 4.23Å; I215-H223 HydrophobicContact CG2-CB 4.14Å; I215-F225 HydrophobicContact CD1-CB 3.68Å; I215-F225 HydrophobicContact CD1-CD1 3.89Å; I215-F225 HydrophobicContact CD1-CG 3.9Å; I215-F226 HydrophobicContact CG2-CD2 4.44Å; I215-F226 HydrophobicContact CG2-CE2 3.53Å; I215-F226 HydrophobicContact CG2-CZ 3.95Å
216	I	93.3	Very high	89.5	Confident	10 Å²	10	58.8 Å²	58.8	5%	0.051	31%	0.306	C	S	.	.	H	α-helix	trans	-60.5	-45.9	177.2	-64.5	164.5	0	0	0	110.2	I179 M183 E192 F195 L212 Q218 K219	I179-I216 HydrophobicContact CD1-CD1 4.47Å; I179-I216 HydrophobicContact CG2-CD1 3.69Å; I179-I216 HydrophobicContact CG2-CG1 3.81Å; M183-I216 HydrophobicContact SD-CB 4.48Å; M183-I216 HydrophobicContact SD-CG1 4.12Å; E192-I216 HydrophobicContact CB-CG2 4.14Å; F195-I216 HydrophobicContact CB-CD1 3.63Å; F195-I216 HydrophobicContact CD2-CD1 3.77Å; F195-I216 HydrophobicContact CG-CD1 3.8Å; L212-I216 VanDerWaalsContact O-CG1 3.3Å; L212-I216 WeakPolarHBondContact O-CG1 3.48Å; L212-I216 PolarHBondContact O-N 3.22Å; I216-Q218 VanDerWaalsContact C-N 3.29Å; I216-Q218 PolarHBondContact O-N 3.24Å; I216-K219 PolarHBondContact O-N 3.46Å
217	S	91.9	Very high	90.2	Very high	87 Å²	87	62.7 Å²	62.7	61%	0.608	32%	0.324	S	S	*	.	H	α-helix	trans	-61.5	-37.9	179.3	-59.5	0	0	0	0	112.3	L213 M214 I215 K219	L213-S217 WeakPolarHBondContact O-CB 3.31Å; L213-S217 PolarHBondContact O-N 3.18Å; L213-S217 PolarHBondContact O-OG 3.11Å; M214-S217 PolarHBondContact O-N 2.73Å; I215-S217 VanDerWaalsContact C-N 3.34Å; I215-S217 PolarHBondContact O-N 3.07Å; S217-K219 VanDerWaalsContact C-N 3.29Å
218	Q	93.6	Very high	90.8	Very high	118 Å²	118	66.8 Å²	66.8	55%	0.551	34%	0.338	S	S	*	.	H	α-helix	trans	-79.4	-11.3	176.7	-70.4	174.2	-2.9	0	0	113.1	M214 I215 I216 D220	M214-Q218 WeakPolarHBondContact O-CB 3.49Å; M214-Q218 VanDerWaalsContact O-CG 3.31Å; M214-Q218 WeakPolarHBondContact O-CG 3.24Å; M214-Q218 PolarHBondContact O-N 3.25Å; I215-Q218 CarbonylContact O-C 3.43Å; I215-Q218 PolarHBondContact O-N 3.01Å; I216-Q218 VanDerWaalsContact C-N 3.29Å; I216-Q218 PolarHBondContact O-N 3.24Å; Q218-D220 HydrophobicContact CB-CB 4.35Å; Q218-D220 PolarHBondContact O-N 3.34Å
219	K	92.5	Very high	91.2	Very high	129 Å²	129	65.9 Å²	65.9	56%	0.561	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	34.3	-172.5	-58.1	-177.5	179.5	178.9	0	112.7	F188 I215 I216 S217 T221	F188-K219 HydrophobicContact CD1-CB 3.9Å; F188-K219 HydrophobicContact CD1-CD 4.34Å; F188-K219 HydrophobicContact CD1-CG 3.9Å; F188-K219 HydrophobicContact CD2-CD 4.07Å; F188-K219 HydrophobicContact CE1-CB 3.72Å; F188-K219 HydrophobicContact CE1-CG 4.23Å; F188-K219 HydrophobicContact CE2-CD 4.38Å; F188-K219 HydrophobicContact CG-CB 4.44Å; F188-K219 HydrophobicContact CG-CD 4.05Å; F188-K219 HydrophobicContact CG-CG 4.05Å; F188-K219 HydrophobicContact CZ-CB 4.12Å; I215-K219 PolarHBondContact O-N 2.89Å; I216-K219 PolarHBondContact O-N 3.46Å; S217-K219 VanDerWaalsContact C-N 3.29Å; K219-T221 PolarHBondContact O-N 3.42Å; K219-T221 VanDerWaalsContact O-N 3.15Å
220	D	91.3	Very high	91.5	Very high	59 Å²	59	65.5 Å²	65.5	32%	0.316	34%	0.337	S	S	.	.			trans	-85.6	85.3	-178.9	-174.2	1.7	0	0	0	110.5	I215 Q218 F222 H223	I215-D220 HydrophobicContact CG2-CB 4.48Å; I215-D220 VanDerWaalsContact CG2-O 3.28Å; I215-D220 WeakPolarHBondContact CG2-O 3.39Å; I215-D220 PolarHBondContact O-N 3.08Å; Q218-D220 HydrophobicContact CB-CB 4.35Å; Q218-D220 PolarHBondContact O-N 3.34Å; D220-F222 VanDerWaalsContact C-N 3.26Å; D220-F222 PolarHBondContact O-N 3.49Å; D220-F222 PolarHBondContact OD1-N 2.9Å; D220-H223 HydrophobicContact CB-CB 4.21Å; D220-H223 PolarHBondContact OD1-N 3.31Å; D220-H223 WeakPolarHBondContact OD2-CB 3.41Å; D220-H223 IonicContact OD2-CD2 3.81Å; D220-H223 PolarHBondContact OD2-CD2 3.14Å; D220-H223 IonicContact OD2-CG 2.81Å
221	T	90.3	Very high	91.9	Very high	21 Å²	21	61.9 Å²	61.9	13%	0.129	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.5	-178.5	-58.7	0	0	0	0	113.3	M183 E184 K219	M183-T221 WeakPolarHBondContact O-CG2 3.42Å; M183-T221 PolarHBondContact O-OG1 3.45Å; E184-T221 HydrophobicContact CG-CG2 4.22Å; K219-T221 PolarHBondContact O-N 3.42Å; K219-T221 VanDerWaalsContact O-N 3.15Å
222	F	87.1	Confident	92.1	Very high	165 Å²	165	63.9 Å²	63.9	72%	0.724	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	16.1	-172.7	-60.3	-73	0	0	0	113.6	D220 S224 Q227	D220-F222 VanDerWaalsContact C-N 3.26Å; D220-F222 PolarHBondContact O-N 3.49Å; D220-F222 PolarHBondContact OD1-N 2.9Å; F222-S224 PolarHBondContact O-N 3.06Å; F222-Q227 PolarHBondContact O-NE2 3.2Å
223	H	92.4	Very high	92.3	Very high	24 Å²	24	67.5 Å²	67.5	11%	0.111	34%	0.339	C	S	.	.			trans	-52.3	137.5	-180	-172.5	-76.3	0	0	0	111.5	K211 I215 D220 F225 F226	K211-H223 WeakPolarHBondContact CE-CE1 3.17Å; K211-H223 WeakPolarHBondContact CE-NE2 3.34Å; K211-H223 PolarHBondContact NZ-CE1 3.44Å; K211-H223 PolarHBondContact NZ-NE2 3.32Å; I215-H223 HydrophobicContact CD1-CB 4.25Å; I215-H223 HydrophobicContact CG1-CB 4.23Å; I215-H223 HydrophobicContact CG2-CB 4.14Å; D220-H223 HydrophobicContact CB-CB 4.21Å; D220-H223 PolarHBondContact OD1-N 3.31Å; D220-H223 WeakPolarHBondContact OD2-CB 3.41Å; D220-H223 IonicContact OD2-CD2 3.81Å; D220-H223 PolarHBondContact OD2-CD2 3.14Å; D220-H223 IonicContact OD2-CG 2.81Å; H223-F225 WeakPolarHBondContact ND1-CB 3.45Å; H223-F225 PolarHBondContact ND1-N 3.07Å; H223-F225 PolarHBondContact O-N 3.37Å; H223-F226 PolarHBondContact O-N 3.38Å
224	S	92	Very high	92.6	Very high	61 Å²	61	64 Å²	64	43%	0.427	32%	0.32	S	S	.	.	H	α-helix	trans	-51.6	-31	-177	59.4	0	0	0	0	114.1	F222 F226 Q227 H228	F222-S224 PolarHBondContact O-N 3.06Å; S224-F226 PolarHBondContact O-N 3.37Å; S224-Q227 WeakPolarHBondContact O-CA 3.34Å; S224-Q227 WeakPolarHBondContact O-CB 3.34Å; S224-Q227 PolarHBondContact O-N 3.26Å; S224-H228 PolarHBondContact O-CD2 3.39Å; S224-H228 PolarHBondContact O-N 3.34Å
225	F	92.1	Very high	92.9	Very high	19 Å²	19	62.5 Å²	62.5	8%	0.083	31%	0.313	C	S	.	.	H	α-helix	trans	-50.1	-47.5	171.6	-172.2	-96.1	0	0	0	113.6	I176 F208 K211 L212 I215 H223 Q227 H228 F229	I176-F225 HydrophobicContact CD1-CE1 4Å; I176-F225 HydrophobicContact CD1-CZ 3.82Å; I176-F225 HydrophobicContact CG1-CE1 4.03Å; I176-F225 HydrophobicContact CG1-CZ 4.22Å; I176-F225 HydrophobicContact CG2-CD1 4.45Å; I176-F225 HydrophobicContact CG2-CE1 3.78Å; F208-F225 HydrophobicContact CB-CE2 4.35Å; F208-F225 HydrophobicContact CB-CZ 3.76Å; F208-F225 AromaticContact CD1-CE2 3.73Å; F208-F225 HydrophobicContact CD1-CE2 3.73Å; F208-F225 AromaticContact CD1-CZ 3.81Å; F208-F225 HydrophobicContact CD1-CZ 3.81Å; F208-F225 HydrophobicContact CE1-CE2 4.38Å; F208-F225 HydrophobicContact CG-CE2 4.21Å; F208-F225 AromaticContact CG-CZ 3.81Å; F208-F225 HydrophobicContact CG-CZ 3.81Å; K211-F225 HydrophobicContact CG-CD2 3.99Å; K211-F225 HydrophobicContact CG-CE2 4.23Å; K211-F225 HydrophobicContact CG-CG 4.43Å; L212-F225 HydrophobicContact CD2-CD1 4.31Å; L212-F225 HydrophobicContact CD2-CE1 3.75Å; L212-F225 HydrophobicContact CG-CE1 4.22Å; I215-F225 HydrophobicContact CD1-CB 3.68Å; I215-F225 HydrophobicContact CD1-CD1 3.89Å; I215-F225 HydrophobicContact CD1-CG 3.9Å; H223-F225 WeakPolarHBondContact ND1-CB 3.45Å; H223-F225 PolarHBondContact ND1-N 3.07Å; H223-F225 PolarHBondContact O-N 3.37Å; F225-Q227 VanDerWaalsContact C-N 3.28Å; F225-Q227 PolarHBondContact O-N 2.89Å; F225-H228 PolarHBondContact O-N 2.9Å; F225-F229 HydrophobicContact CD1-CD2 4.2Å; F225-F229 AromaticContact CD2-CD2 3.77Å; F225-F229 HydrophobicContact CD2-CD2 3.77Å; F225-F229 AromaticContact CD2-CE2 3.82Å; F225-F229 HydrophobicContact CD2-CE2 3.82Å; F225-F229 AromaticContact CE1-CD2 3.91Å; F225-F229 HydrophobicContact CE1-CD2 3.91Å; F225-F229 AromaticContact CE2-CD2 3.46Å; F225-F229 HydrophobicContact CE2-CD2 3.46Å; F225-F229 VanDerWaalsContact CE2-CD2 3.46Å; F225-F229 AromaticContact CE2-CE2 3.31Å; F225-F229 HydrophobicContact CE2-CE2 3.31Å; F225-F229 HydrophobicContact CE2-CZ 4.38Å; F225-F229 HydrophobicContact CG-CD2 4.13Å; F225-F229 AromaticContact CZ-CD2 3.52Å; F225-F229 HydrophobicContact CZ-CD2 3.52Å; F225-F229 AromaticContact CZ-CE2 3.73Å; F225-F229 HydrophobicContact CZ-CE2 3.73Å; F225-F229 HydrophobicContact CZ-CG 4.33Å; F225-F229 WeakPolarHBondContact O-CD2 3.49Å; F225-F229 PolarHBondContact O-N 3.47Å
226	F	90.4	Very high	93.1	Very high	11 Å²	11	67.3 Å²	67.3	5%	0.048	34%	0.335	C	S	.	.	H	α-helix	trans	-73.6	-21	178.2	-63.8	-48.8	0	0	0	112.8	I176 I179 A180 M183 L212 I215 H223 S224 F229 S230	I176-F226 HydrophobicContact CG2-CD1 3.94Å; I176-F226 HydrophobicContact CG2-CE1 4Å; I179-F226 HydrophobicContact CG2-CZ 4.43Å; A180-F226 HydrophobicContact CB-CD1 3.56Å; A180-F226 HydrophobicContact CB-CE1 3.64Å; A180-F226 HydrophobicContact CB-CG 4.08Å; A180-F226 HydrophobicContact CB-CZ 4.22Å; M183-F226 HydrophobicContact CE-CE2 4.29Å; M183-F226 HydrophobicContact CG-CE2 4.43Å; M183-F226 HydrophobicContact CG-CZ 4.47Å; L212-F226 HydrophobicContact CD2-CE1 3.89Å; L212-F226 HydrophobicContact CD2-CZ 4.24Å; I215-F226 HydrophobicContact CG2-CD2 4.44Å; I215-F226 HydrophobicContact CG2-CE2 3.53Å; I215-F226 HydrophobicContact CG2-CZ 3.95Å; H223-F226 PolarHBondContact O-N 3.38Å; S224-F226 PolarHBondContact O-N 3.37Å; F226-F229 CarbonylContact O-C 3.6Å; F226-S230 WeakPolarHBondContact O-CA 3.21Å; F226-S230 PolarHBondContact O-N 3.47Å
227	Q	90.3	Very high	93.2	Very high	133 Å²	133	69.5 Å²	69.5	62%	0.621	34%	0.344	S	S	*	.	H	α-helix	trans	-71.4	-42.1	172.4	-55	177.4	10.2	0	0	110.9	F222 S224 F225	F222-Q227 PolarHBondContact O-NE2 3.2Å; S224-Q227 WeakPolarHBondContact O-CA 3.34Å; S224-Q227 WeakPolarHBondContact O-CB 3.34Å; S224-Q227 PolarHBondContact O-N 3.26Å; F225-Q227 VanDerWaalsContact C-N 3.28Å; F225-Q227 PolarHBondContact O-N 2.89Å
228	H	89.7	Confident	93.5	Very high	137 Å²	137	65.3 Å²	65.3	63%	0.634	32%	0.315	S	S	*	.	H	α-helix	trans	-69.2	-49.6	174.9	-69.3	-64.7	0	0	0	111.9	S224 F225 S230	S224-H228 PolarHBondContact O-CD2 3.39Å; S224-H228 PolarHBondContact O-N 3.34Å; F225-H228 PolarHBondContact O-N 2.9Å; H228-S230 VanDerWaalsContact C-N 3.27Å; H228-S230 PolarHBondContact O-N 3.41Å
229	F	92.9	Very high	93.7	Very high	54 Å²	54	62.3 Å²	62.3	24%	0.237	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	52.5	177.5	-63	-77.5	0	0	0	110.9	L173 I176 Q177 F208 F225 F226	L173-F229 HydrophobicContact CD2-CB 4.23Å; L173-F229 HydrophobicContact CD2-CD1 3.75Å; L173-F229 HydrophobicContact CD2-CG 4.5Å; I176-F229 HydrophobicContact CD1-CB 3.94Å; I176-F229 HydrophobicContact CD1-CD1 3.82Å; I176-F229 HydrophobicContact CD1-CD2 4.24Å; I176-F229 HydrophobicContact CD1-CE1 4.38Å; I176-F229 HydrophobicContact CD1-CG 3.74Å; I176-F229 HydrophobicContact CG2-CB 3.9Å; Q177-F229 PolarHBondContact NE2-O 3.18Å; F208-F229 HydrophobicContact CE1-CE2 4.22Å; F208-F229 AromaticContact CE1-CZ 3.81Å; F208-F229 HydrophobicContact CE1-CZ 3.81Å; F208-F229 HydrophobicContact CZ-CE1 4.16Å; F208-F229 AromaticContact CZ-CZ 3.78Å; F208-F229 HydrophobicContact CZ-CZ 3.78Å; F225-F229 HydrophobicContact CD1-CD2 4.2Å; F225-F229 AromaticContact CD2-CD2 3.77Å; F225-F229 HydrophobicContact CD2-CD2 3.77Å; F225-F229 AromaticContact CD2-CE2 3.82Å; F225-F229 HydrophobicContact CD2-CE2 3.82Å; F225-F229 AromaticContact CE1-CD2 3.91Å; F225-F229 HydrophobicContact CE1-CD2 3.91Å; F225-F229 AromaticContact CE2-CD2 3.46Å; F225-F229 HydrophobicContact CE2-CD2 3.46Å; F225-F229 VanDerWaalsContact CE2-CD2 3.46Å; F225-F229 AromaticContact CE2-CE2 3.31Å; F225-F229 HydrophobicContact CE2-CE2 3.31Å; F225-F229 HydrophobicContact CE2-CZ 4.38Å; F225-F229 HydrophobicContact CG-CD2 4.13Å; F225-F229 AromaticContact CZ-CD2 3.52Å; F225-F229 HydrophobicContact CZ-CD2 3.52Å; F225-F229 AromaticContact CZ-CE2 3.73Å; F225-F229 HydrophobicContact CZ-CE2 3.73Å; F225-F229 HydrophobicContact CZ-CG 4.33Å; F225-F229 WeakPolarHBondContact O-CD2 3.49Å; F225-F229 PolarHBondContact O-N 3.47Å; F226-F229 CarbonylContact O-C 3.6Å
230	S	95	Very high	93.9	Very high	32 Å²	32	59.1 Å²	59.1	22%	0.224	29%	0.294	C	S	.	.			trans	-71.9	161.5	-172.7	66.3	0	0	0	0	114	F226 H228 N232 H233 M234	F226-S230 WeakPolarHBondContact O-CA 3.21Å; F226-S230 PolarHBondContact O-N 3.47Å; H228-S230 VanDerWaalsContact C-N 3.27Å; H228-S230 PolarHBondContact O-N 3.41Å; S230-N232 PolarHBondContact O-N 3.26Å; S230-H233 WeakPolarHBondContact O-CB 3.41Å; S230-H233 PolarHBondContact O-N 3.25Å; S230-H233 PolarHBondContact OG-N 3.34Å; S230-M234 PolarHBondContact O-N 3.05Å
231	Y	95.4	Very high	94.1	Very high	27 Å²	27	56.8 Å²	56.8	11%	0.106	28%	0.281	C	S	.	.	H	α-helix	trans	-55.8	-39.5	172.4	-164.4	-85.1	0	0	0	111.5	I130 K134 L149 Q177 V181 H233 M234 M235	I130-Y231 PolarHBondContact O-OH 3.08Å; K134-Y231 HydrophobicContact CG-CD2 4.31Å; K134-Y231 HydrophobicContact CG-CE2 3.81Å; L149-Y231 HydrophobicContact CD1-CE2 4.44Å; Q177-Y231 VanDerWaalsContact OE1-CA 3.31Å; Q177-Y231 VanDerWaalsContact OE1-CB 3.27Å; V181-Y231 HydrophobicContact CG2-CD2 4.12Å; V181-Y231 HydrophobicContact CG2-CE2 4.24Å; Y231-H233 PolarHBondContact O-N 3.09Å; Y231-M234 HydrophobicContact CD1-CE 4.42Å; Y231-M234 HydrophobicContact CD2-CE 3.73Å; Y231-M234 HydrophobicContact CE1-CE 4.2Å; Y231-M234 HydrophobicContact CE2-CE 3.46Å; Y231-M234 VanDerWaalsContact CE2-CE 3.46Å; Y231-M234 HydrophobicContact CG-CE 4.2Å; Y231-M234 WeakPolarHBondContact O-CB 3.43Å; Y231-M234 PolarHBondContact O-N 3.24Å; Y231-M235 HydrophobicContact CD1-CG 3.66Å; Y231-M235 HydrophobicContact CE1-CG 3.48Å; Y231-M235 VanDerWaalsContact CE1-CG 3.48Å; Y231-M235 HydrophobicContact CE1-SD 3.78Å; Y231-M235 VanDerWaalsContact O-CG 3.27Å; Y231-M235 WeakPolarHBondContact O-CG 3.45Å; Y231-M235 PolarHBondContact O-N 3.48Å
232	N	95.4	Very high	94.4	Very high	118 Å²	118	55.9 Å²	55.9	63%	0.631	28%	0.275	S	S	*	.	H	α-helix	trans	-63.9	-41.7	176.4	-68.1	-22.5	0	0	0	111.4	S230 M234 M235 E236	S230-N232 PolarHBondContact O-N 3.26Å; N232-M234 VanDerWaalsContact C-N 3.34Å; N232-M234 PolarHBondContact O-N 3.44Å; N232-M235 PolarHBondContact O-N 3Å; N232-E236 WeakPolarHBondContact O-CG 3.26Å; N232-E236 PolarHBondContact O-N 3.41Å
233	H	96.4	Very high	94.8	Very high	76 Å²	76	51.5 Å²	51.5	35%	0.352	26%	0.259	S	S	.	.	H	α-helix	trans	-62.6	-41.9	176.7	-172	59.3	0	0	0	112	S230 Y231 E236 K237	S230-H233 WeakPolarHBondContact O-CB 3.41Å; S230-H233 PolarHBondContact O-N 3.25Å; S230-H233 PolarHBondContact OG-N 3.34Å; Y231-H233 PolarHBondContact O-N 3.09Å; H233-E236 PolarHBondContact O-N 3.48Å; H233-K237 WeakPolarHBondContact O-CG 3.36Å; H233-K237 PolarHBondContact O-N 2.94Å; H233-K237 VanDerWaalsContact O-N 3.15Å
234	M	97.8	Very high	94.9	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-57.2	-49.1	170.8	-177.8	-171.9	69.1	0	0	111.5	L149 L173 I174 Q177 S230 Y231 N232 E236 K237 I238	L149-M234 HydrophobicContact CD2-CE 4.29Å; L173-M234 HydrophobicContact CB-CB 3.96Å; L173-M234 HydrophobicContact CB-CG 3.89Å; I174-M234 HydrophobicContact CB-SD 4.44Å; I174-M234 HydrophobicContact CG1-CG 4.37Å; I174-M234 HydrophobicContact CG1-SD 3.88Å; Q177-M234 HydrophobicContact CB-CE 4.21Å; Q177-M234 HydrophobicContact CB-SD 3.64Å; Q177-M234 HydrophobicContact CG-CB 4.11Å; Q177-M234 HydrophobicContact CG-CE 4.3Å; Q177-M234 HydrophobicContact CG-SD 3.77Å; S230-M234 PolarHBondContact O-N 3.05Å; Y231-M234 HydrophobicContact CD1-CE 4.42Å; Y231-M234 HydrophobicContact CD2-CE 3.73Å; Y231-M234 HydrophobicContact CE1-CE 4.2Å; Y231-M234 HydrophobicContact CE2-CE 3.46Å; Y231-M234 VanDerWaalsContact CE2-CE 3.46Å; Y231-M234 HydrophobicContact CG-CE 4.2Å; Y231-M234 WeakPolarHBondContact O-CB 3.43Å; Y231-M234 PolarHBondContact O-N 3.24Å; N232-M234 VanDerWaalsContact C-N 3.34Å; N232-M234 PolarHBondContact O-N 3.44Å; M234-E236 PolarHBondContact O-N 3.46Å; M234-K237 PolarHBondContact O-N 2.94Å; M234-I238 HydrophobicContact CG-CD1 3.78Å; M234-I238 WeakPolarHBondContact O-CG1 3.39Å; M234-I238 PolarHBondContact O-N 3.37Å; M234-I238 HydrophobicContact SD-CD1 4.39Å
235	M	97.5	Very high	94.9	Very high	32 Å²	32	53.1 Å²	53.1	16%	0.158	26%	0.256	C	S	.	.	H	α-helix	trans	-61.8	-40.8	-179.2	-71.3	-62	-66.9	0	0	112.6	F88 I130 Y231 N232 I238 K239	F88-M235 HydrophobicContact CE1-CE 4.03Å; F88-M235 HydrophobicContact CE2-CE 4Å; F88-M235 HydrophobicContact CZ-CE 3.4Å; F88-M235 HydrophobicContact CZ-SD 4.22Å; I130-M235 HydrophobicContact CG2-CE 4.31Å; I130-M235 HydrophobicContact CG2-SD 3.54Å; I130-M235 VanDerWaalsContact CG2-SD 3.54Å; Y231-M235 HydrophobicContact CD1-CG 3.66Å; Y231-M235 HydrophobicContact CE1-CG 3.48Å; Y231-M235 VanDerWaalsContact CE1-CG 3.48Å; Y231-M235 HydrophobicContact CE1-SD 3.78Å; Y231-M235 VanDerWaalsContact O-CG 3.27Å; Y231-M235 WeakPolarHBondContact O-CG 3.45Å; Y231-M235 PolarHBondContact O-N 3.48Å; N232-M235 PolarHBondContact O-N 3Å; M235-I238 PolarHBondContact O-N 2.88Å; M235-K239 VanDerWaalsContact O-CG 3.31Å; M235-K239 WeakPolarHBondContact O-CG 3.36Å; M235-K239 PolarHBondContact O-N 3.15Å
236	E	96.9	Very high	95.1	Very high	101 Å²	101	52.9 Å²	52.9	47%	0.472	26%	0.256	S	S	.	.	H	α-helix	trans	-65	-39.6	177.1	-69.9	-52.1	124.2	0	0	112.3	N232 H233 M234 K239 S240	N232-E236 WeakPolarHBondContact O-CG 3.26Å; N232-E236 PolarHBondContact O-N 3.41Å; H233-E236 PolarHBondContact O-N 3.48Å; M234-E236 PolarHBondContact O-N 3.46Å; E236-K239 PolarHBondContact O-N 2.87Å; E236-K239 IonicContact OE1-NZ 3.98Å; E236-K239 PolarHBondContact OE1-NZ 3.34Å; E236-S240 PolarHBondContact O-N 3.46Å; E236-S240 PolarHBondContact O-OG 2.96Å
237	K	97.2	Very high	95.2	Very high	55 Å²	55	55.9 Å²	55.9	24%	0.239	28%	0.278	C	S	.	.	H	α-helix	trans	-65.2	-41.2	174.3	-69.2	-71.1	-179.2	165.4	0	112.1	L166 E169 I170 L173 H233 M234 K239 S240 Y241	L166-K237 HydrophobicContact CD1-CD 4.25Å; E169-K237 WeakPolarHBondContact OE2-CE 3.35Å; E169-K237 IonicContact OE2-NZ 3.87Å; E169-K237 PolarHBondContact OE2-NZ 3.21Å; I170-K237 HydrophobicContact CG1-CB 3.95Å; L173-K237 HydrophobicContact CD1-CB 4Å; L173-K237 HydrophobicContact CD1-CG 3.68Å; H233-K237 WeakPolarHBondContact O-CG 3.36Å; H233-K237 PolarHBondContact O-N 2.94Å; H233-K237 VanDerWaalsContact O-N 3.15Å; M234-K237 PolarHBondContact O-N 2.94Å; K237-K239 VanDerWaalsContact C-N 3.35Å; K237-S240 WeakPolarHBondContact O-CB 3.4Å; K237-S240 PolarHBondContact O-N 3.2Å; K237-Y241 PolarHBondContact O-N 3.12Å
238	I	97.5	Very high	95.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.8	-39	174.7	-67.1	169.7	0	0	0	111	F88 F126 L127 I130 I170 M234 M235 S240 Y241 V242	F88-I238 HydrophobicContact CE1-CG2 3.88Å; F88-I238 HydrophobicContact CZ-CG2 4.03Å; F126-I238 HydrophobicContact CE1-CG2 3.93Å; F126-I238 HydrophobicContact CZ-CD1 4.11Å; F126-I238 HydrophobicContact CZ-CG1 4.22Å; F126-I238 HydrophobicContact CZ-CG2 4.44Å; L127-I238 HydrophobicContact CD2-CG2 4.27Å; I130-I238 HydrophobicContact CD1-CD1 3.67Å; I130-I238 HydrophobicContact CG1-CD1 3.94Å; I130-I238 HydrophobicContact CG2-CD1 3.78Å; I170-I238 HydrophobicContact CD1-CG1 4.48Å; I170-I238 HydrophobicContact CG1-CG1 4.37Å; I170-I238 HydrophobicContact CG2-CG1 3.92Å; M234-I238 HydrophobicContact CG-CD1 3.78Å; M234-I238 WeakPolarHBondContact O-CG1 3.39Å; M234-I238 PolarHBondContact O-N 3.37Å; M234-I238 HydrophobicContact SD-CD1 4.39Å; M235-I238 PolarHBondContact O-N 2.88Å; I238-S240 VanDerWaalsContact C-N 3.29Å; I238-S240 PolarHBondContact O-N 2.97Å; I238-Y241 WeakPolarHBondContact O-CB 3.35Å; I238-Y241 PolarHBondContact O-N 3.18Å; I238-Y241 VanDerWaalsContact O-N 3.14Å; I238-V242 HydrophobicContact CG2-CG2 4.42Å; I238-V242 WeakPolarHBondContact O-CG2 3.4Å; I238-V242 PolarHBondContact O-N 3.37Å
239	K	97.3	Very high	95.2	Very high	55 Å²	55	45.9 Å²	45.9	24%	0.239	23%	0.232	C	C	.	.	H	α-helix	trans	-61.8	-35.8	173.8	-75.1	174	-173.6	170.6	0	112.4	F88 M235 E236 K237 V242 N243	F88-K239 HydrophobicContact CE1-CG 4.45Å; M235-K239 VanDerWaalsContact O-CG 3.31Å; M235-K239 WeakPolarHBondContact O-CG 3.36Å; M235-K239 PolarHBondContact O-N 3.15Å; E236-K239 PolarHBondContact O-N 2.87Å; E236-K239 IonicContact OE1-NZ 3.98Å; E236-K239 PolarHBondContact OE1-NZ 3.34Å; K237-K239 VanDerWaalsContact C-N 3.35Å; K239-V242 WeakPolarHBondContact O-CB 3.49Å; K239-V242 PolarHBondContact O-N 3.13Å; K239-N243 PolarHBondContact O-N 3.43Å; K239-N243 PolarHBondContact O-ND2 3.22Å
240	S	96.1	Very high	94.8	Very high	61 Å²	61	46.1 Å²	46.1	43%	0.427	24%	0.24	S	C	.	.	H	α-helix	trans	-61.3	-43.6	172.2	-63.4	0	0	0	0	111.9	E236 K237 I238 N243 Y244	E236-S240 PolarHBondContact O-N 3.46Å; E236-S240 PolarHBondContact O-OG 2.96Å; K237-S240 WeakPolarHBondContact O-CB 3.4Å; K237-S240 PolarHBondContact O-N 3.2Å; I238-S240 VanDerWaalsContact C-N 3.29Å; I238-S240 PolarHBondContact O-N 2.97Å; S240-N243 WeakPolarHBondContact O-CB 3.39Å; S240-N243 PolarHBondContact O-N 3.47Å; S240-Y244 PolarHBondContact O-N 3.39Å
241	Y	95.5	Very high	94.6	Very high	11 Å²	11	48.3 Å²	48.3	4%	0.043	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-42.6	171.9	170.6	-103.1	0	0	0	112.1	W156 I159 I170 K237 I238 N243 Y244 V245	W156-Y241 AromaticContact CH2-CD1 3.79Å; W156-Y241 HydrophobicContact CH2-CD1 3.79Å; W156-Y241 AromaticContact CH2-CD2 3.7Å; W156-Y241 HydrophobicContact CH2-CD2 3.7Å; W156-Y241 AromaticContact CH2-CE1 3.97Å; W156-Y241 HydrophobicContact CH2-CE1 3.97Å; W156-Y241 AromaticContact CH2-CE2 3.87Å; W156-Y241 HydrophobicContact CH2-CE2 3.87Å; W156-Y241 AromaticContact CH2-CG 3.65Å; W156-Y241 HydrophobicContact CH2-CG 3.65Å; W156-Y241 AromaticContact CZ3-CD1 3.79Å; W156-Y241 HydrophobicContact CZ3-CD1 3.79Å; W156-Y241 HydrophobicContact CZ3-CD2 4.38Å; W156-Y241 AromaticContact CZ3-CE1 3.66Å; W156-Y241 HydrophobicContact CZ3-CE1 3.66Å; W156-Y241 HydrophobicContact CZ3-CE2 4.26Å; W156-Y241 HydrophobicContact CZ3-CG 4.15Å; W156-Y241 AromaticContact CZ3-CZ 3.91Å; I159-Y241 VanDerWaalsContact CG2-OH 3.24Å; I159-Y241 WeakPolarHBondContact CG2-OH 3.46Å; I170-Y241 HydrophobicContact CD1-CG 4.47Å; K237-Y241 PolarHBondContact O-N 3.12Å; I238-Y241 WeakPolarHBondContact O-CB 3.35Å; I238-Y241 PolarHBondContact O-N 3.18Å; I238-Y241 VanDerWaalsContact O-N 3.14Å; Y241-N243 VanDerWaalsContact C-N 3.28Å; Y241-N243 PolarHBondContact O-N 2.9Å; Y241-Y244 HydrophobicContact CD2-CD1 4.45Å; Y241-Y244 HydrophobicContact CE2-CD1 4.33Å; Y241-Y244 WeakPolarHBondContact O-CA 3.34Å; Y241-Y244 VanDerWaalsContact O-CB 3.31Å; Y241-Y244 WeakPolarHBondContact O-CB 3.19Å; Y241-Y244 PolarHBondContact O-N 2.93Å; Y241-V245 HydrophobicContact CD1-CG2 4.27Å; Y241-V245 HydrophobicContact CE1-CG2 3.68Å; Y241-V245 HydrophobicContact CE2-CG2 4.02Å; Y241-V245 PolarHBondContact O-N 3.17Å
242	V	96.9	Very high	94.5	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-59.2	-40.2	175.4	171	0	0	0	0	111.1	C85 F88 R89 L127 I238 K239 Y244 V245 L246	C85-V242 HydrophobicContact CB-CG1 3.76Å; C85-V242 WeakPolarHBondContact O-CG1 3.43Å; F88-V242 HydrophobicContact CD1-CG2 4Å; F88-V242 HydrophobicContact CE1-CG2 4.26Å; R89-V242 HydrophobicContact CB-CG1 4.24Å; L127-V242 HydrophobicContact CD1-CG2 4.34Å; L127-V242 HydrophobicContact CD2-CG2 3.63Å; I238-V242 HydrophobicContact CG2-CG2 4.42Å; I238-V242 WeakPolarHBondContact O-CG2 3.4Å; I238-V242 PolarHBondContact O-N 3.37Å; K239-V242 WeakPolarHBondContact O-CB 3.49Å; K239-V242 PolarHBondContact O-N 3.13Å; V242-Y244 VanDerWaalsContact C-N 3.3Å; V242-Y244 PolarHBondContact O-N 3.32Å; V242-V245 PolarHBondContact O-N 3.08Å; V242-L246 HydrophobicContact CG1-CD1 4.14Å; V242-L246 HydrophobicContact CG1-CG 4.17Å; V242-L246 WeakPolarHBondContact O-CB 3.39Å; V242-L246 VanDerWaalsContact O-CG 3.24Å; V242-L246 WeakPolarHBondContact O-CG 3.22Å; V242-L246 PolarHBondContact O-N 3.46Å
243	N	96.1	Very high	94.5	Very high	73 Å²	73	47.5 Å²	47.5	39%	0.39	25%	0.248	S	C	.	.	H	α-helix	trans	-62.4	-36.9	175.6	-71.8	-32.4	0	0	0	112.4	R89 K239 S240 Y241 L246 S247	R89-N243 WeakPolarHBondContact CD-OD1 3.46Å; K239-N243 PolarHBondContact O-N 3.43Å; K239-N243 PolarHBondContact O-ND2 3.22Å; S240-N243 WeakPolarHBondContact O-CB 3.39Å; S240-N243 PolarHBondContact O-N 3.47Å; Y241-N243 VanDerWaalsContact C-N 3.28Å; Y241-N243 PolarHBondContact O-N 2.9Å; N243-L246 PolarHBondContact O-N 2.81Å; N243-S247 PolarHBondContact O-N 3.1Å
244	Y	93.6	Very high	94.5	Very high	119 Å²	119	46.8 Å²	46.8	47%	0.467	25%	0.247	S	C	.	.	H	α-helix	trans	-61.1	-50.7	171.5	168.8	-99.7	0	0	0	111.2	S240 Y241 V242 L246 S247 E248	S240-Y244 PolarHBondContact O-N 3.39Å; Y241-Y244 HydrophobicContact CD2-CD1 4.45Å; Y241-Y244 HydrophobicContact CE2-CD1 4.33Å; Y241-Y244 WeakPolarHBondContact O-CA 3.34Å; Y241-Y244 VanDerWaalsContact O-CB 3.31Å; Y241-Y244 WeakPolarHBondContact O-CB 3.19Å; Y241-Y244 PolarHBondContact O-N 2.93Å; V242-Y244 VanDerWaalsContact C-N 3.3Å; V242-Y244 PolarHBondContact O-N 3.32Å; Y244-L246 VanDerWaalsContact C-N 3.3Å; Y244-L246 PolarHBondContact O-N 2.97Å; Y244-S247 PolarHBondContact O-N 3.39Å; Y244-S247 PolarHBondContact O-OG 2.87Å; Y244-E248 PolarHBondContact O-N 2.75Å
245	V	93.4	Very high	94.3	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-58.7	-41.5	176.4	177	0	0	0	0	111.9	I123 Y241 V242 S247 E248 K249	I123-V245 HydrophobicContact CD1-CG1 4.09Å; I123-V245 HydrophobicContact CD1-CG2 4.12Å; I123-V245 HydrophobicContact CG2-CG1 4.28Å; Y241-V245 HydrophobicContact CD1-CG2 4.27Å; Y241-V245 HydrophobicContact CE1-CG2 3.68Å; Y241-V245 HydrophobicContact CE2-CG2 4.02Å; Y241-V245 PolarHBondContact O-N 3.17Å; V242-V245 PolarHBondContact O-N 3.08Å; V245-S247 VanDerWaalsContact C-N 3.32Å; V245-S247 PolarHBondContact O-N 3.16Å; V245-E248 PolarHBondContact O-N 2.94Å; V245-K249 HydrophobicContact CG1-CD 4.02Å; V245-K249 WeakPolarHBondContact O-CB 3.43Å; V245-K249 PolarHBondContact O-N 3.37Å
246	L	94.7	Very high	94.2	Very high	14 Å²	14	52.1 Å²	52.1	7%	0.073	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-41.1	176.5	-72.4	178.3	0	0	0	111.3	L82 C85 R86 V242 N243 Y244 S250	L82-L246 HydrophobicContact CD1-CD2 3.54Å; L82-L246 HydrophobicContact CG-CD2 4.34Å; C85-L246 HydrophobicContact CB-CD2 3.4Å; C85-L246 VanDerWaalsContact CB-CD2 3.4Å; C85-L246 HydrophobicContact CB-CG 4Å; R86-L246 HydrophobicContact CG-CD1 4.28Å; R86-L246 HydrophobicContact CG-CD2 3.65Å; V242-L246 HydrophobicContact CG1-CD1 4.14Å; V242-L246 HydrophobicContact CG1-CG 4.17Å; V242-L246 WeakPolarHBondContact O-CB 3.39Å; V242-L246 VanDerWaalsContact O-CG 3.24Å; V242-L246 WeakPolarHBondContact O-CG 3.22Å; V242-L246 PolarHBondContact O-N 3.46Å; N243-L246 PolarHBondContact O-N 2.81Å; Y244-L246 VanDerWaalsContact C-N 3.3Å; Y244-L246 PolarHBondContact O-N 2.97Å; L246-S250 WeakPolarHBondContact O-CA 3.45Å; L246-S250 WeakPolarHBondContact O-CB 3.24Å; L246-S250 PolarHBondContact O-N 3.24Å
247	S	92.8	Very high	94.2	Very high	73 Å²	73	49.1 Å²	49.1	51%	0.51	26%	0.262	S	S	.	.	H	α-helix	trans	-65.9	-44.4	177.7	72.1	0	0	0	0	111.6	N243 Y244 V245 S250	N243-S247 PolarHBondContact O-N 3.1Å; Y244-S247 PolarHBondContact O-N 3.39Å; Y244-S247 PolarHBondContact O-OG 2.87Å; V245-S247 VanDerWaalsContact C-N 3.32Å; V245-S247 PolarHBondContact O-N 3.16Å; S247-S250 PolarHBondContact O-OG 2.8Å
248	E	90.9	Very high	94.1	Very high	61 Å²	61	48.6 Å²	48.6	29%	0.285	27%	0.268	S	S	.	.	H	α-helix	trans	-60.8	-48.2	177.9	-171.2	-158.6	124.2	0	0	111.7	R119 Y244 V245	R119-E248 IonicContact CZ-OE2 3.45Å; R119-E248 VanDerWaalsContact NH1-CD 3.29Å; R119-E248 IonicContact NH1-OE1 2.69Å; R119-E248 PolarHBondContact NH1-OE1 3Å; R119-E248 IonicContact NH1-OE2 3.4Å; R119-E248 PolarHBondContact NH1-OE2 3.32Å; R119-E248 IonicContact NH2-OE2 2.76Å; R119-E248 PolarHBondContact NH2-OE2 3.2Å; Y244-E248 PolarHBondContact O-N 2.75Å; V245-E248 PolarHBondContact O-N 2.94Å
249	K	89.9	Confident	93.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-90.8	-3.7	-173.7	-68.6	-176.1	172.6	-73.1	0	114.7	D78 L82 Y116 T120 V245 S251 T252	D78-K249 IonicContact OD1-NZ 2.82Å; D78-K249 PolarHBondContact OD1-NZ 2.93Å; L82-K249 HydrophobicContact CD1-CB 4.01Å; Y116-K249 PolarHBondContact OH-NZ 3.03Å; T120-K249 PolarHBondContact OG1-NZ 2.93Å; V245-K249 HydrophobicContact CG1-CD 4.02Å; V245-K249 WeakPolarHBondContact O-CB 3.43Å; V245-K249 PolarHBondContact O-N 3.37Å; K249-S251 PolarHBondContact O-N 3.05Å; K249-S251 VanDerWaalsContact O-N 3.16Å; K249-T252 HydrophobicContact CB-CG2 4.11Å; K249-T252 HydrophobicContact CG-CG2 4.49Å; K249-T252 WeakPolarHBondContact O-CB 3.38Å; K249-T252 WeakPolarHBondContact O-CG2 3.35Å; K249-T252 PolarHBondContact O-N 3.28Å; K249-T252 PolarHBondContact O-OG1 3.19Å
250	S	84.9	Confident	93.8	Very high	58 Å²	58	54 Å²	54	41%	0.406	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-25.5	-177.7	60.1	0	0	0	0	113.9	L246 S247	L246-S250 WeakPolarHBondContact O-CA 3.45Å; L246-S250 WeakPolarHBondContact O-CB 3.24Å; L246-S250 PolarHBondContact O-N 3.24Å; S247-S250 PolarHBondContact O-OG 2.8Å
251	S	90	Very high	93.8	Very high	79 Å²	79	54.7 Å²	54.7	55%	0.552	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	3	-177.8	60.6	0	0	0	0	114.2	K249	K249-S251 PolarHBondContact O-N 3.05Å; K249-S251 VanDerWaalsContact O-N 3.16Å
252	T	93.4	Very high	93.7	Very high	16 Å²	16	58.8 Å²	58.8	10%	0.098	33%	0.327	C	S	.	.			trans	-58.7	147.8	179.3	50.7	0	0	0	0	111.8	D78 K249 L254 M255 K256	D78-T252 HydrophobicContact CB-CG2 3.9Å; K249-T252 HydrophobicContact CB-CG2 4.11Å; K249-T252 HydrophobicContact CG-CG2 4.49Å; K249-T252 WeakPolarHBondContact O-CB 3.38Å; K249-T252 WeakPolarHBondContact O-CG2 3.35Å; K249-T252 PolarHBondContact O-N 3.28Å; K249-T252 PolarHBondContact O-OG1 3.19Å; T252-L254 PolarHBondContact O-N 3.27Å; T252-M255 PolarHBondContact O-N 3.14Å; T252-K256 WeakPolarHBondContact O-CB 3.37Å; T252-K256 PolarHBondContact O-N 3.4Å
253	F	96.6	Very high	93.6	Very high	111 Å²	111	64.6 Å²	64.6	49%	0.487	35%	0.354	S	S	.	.	H	α-helix	trans	-50.5	-55.6	-167	175.5	-98.5	0	0	0	113.2	W75 M255 K256 A257	W75-F253 HydrophobicContact CD2-CB 4.44Å; W75-F253 AromaticContact CD2-CD1 3.49Å; W75-F253 HydrophobicContact CD2-CD1 3.49Å; W75-F253 VanDerWaalsContact CD2-CD1 3.49Å; W75-F253 HydrophobicContact CD2-CE1 4.02Å; W75-F253 HydrophobicContact CD2-CG 4.17Å; W75-F253 AromaticContact CE2-CD1 3.74Å; W75-F253 AromaticContact CE3-CD1 3.56Å; W75-F253 HydrophobicContact CE3-CD1 3.56Å; W75-F253 AromaticContact CE3-CE1 3.62Å; W75-F253 HydrophobicContact CE3-CE1 3.62Å; W75-F253 HydrophobicContact CG-CB 4.33Å; W75-F253 HydrophobicContact CG-CD1 4.01Å; W75-F253 HydrophobicContact CH2-CD1 4.12Å; W75-F253 AromaticContact CH2-CE1 3.82Å; W75-F253 HydrophobicContact CH2-CE1 3.82Å; W75-F253 HydrophobicContact CH2-CZ 4.14Å; W75-F253 HydrophobicContact CZ2-CD1 4.06Å; W75-F253 HydrophobicContact CZ2-CE1 4.2Å; W75-F253 HydrophobicContact CZ2-CG 4.29Å; W75-F253 AromaticContact CZ3-CD1 3.89Å; W75-F253 HydrophobicContact CZ3-CD1 3.89Å; W75-F253 AromaticContact CZ3-CE1 3.51Å; W75-F253 HydrophobicContact CZ3-CE1 3.51Å; W75-F253 HydrophobicContact CZ3-CZ 4.2Å; F253-M255 PolarHBondContact O-N 3.47Å; F253-K256 PolarHBondContact O-N 3.12Å; F253-A257 VanDerWaalsContact O-CB 3.31Å; F253-A257 WeakPolarHBondContact O-CB 3.41Å; F253-A257 PolarHBondContact O-N 2.89Å
254	L	96.1	Very high	93.4	Very high	62 Å²	62	64.1 Å²	64.1	33%	0.325	36%	0.356	S	S	.	.	H	α-helix	trans	-66.3	-38.6	-173	-166	62.2	0	0	0	112.2	W75 F79 T252 A258	W75-L254 HydrophobicContact CB-CB 4.48Å; F79-L254 HydrophobicContact CB-CB 4.23Å; F79-L254 HydrophobicContact CB-CD2 3.78Å; F79-L254 HydrophobicContact CB-CG 4.4Å; F79-L254 HydrophobicContact CD1-CD2 4.37Å; F79-L254 HydrophobicContact CD2-CB 4.43Å; F79-L254 HydrophobicContact CD2-CD2 4.19Å; F79-L254 HydrophobicContact CD2-CG 4.24Å; F79-L254 HydrophobicContact CG-CD2 3.87Å; F79-L254 HydrophobicContact CG-CG 4.4Å; T252-L254 PolarHBondContact O-N 3.27Å; L254-A258 VanDerWaalsContact O-CB 3.26Å; L254-A258 WeakPolarHBondContact O-CB 3.33Å; L254-A258 PolarHBondContact O-N 2.82Å
255	M	93.9	Very high	93.3	Very high	30 Å²	30	64.9 Å²	64.9	15%	0.148	36%	0.362	C	S	.	.	H	α-helix	trans	-65.8	-45.1	174.9	-178.7	58.7	46	0	0	111.3	F79 L82 R86 T252 F253 A258 A259	F79-M255 HydrophobicContact CD2-CE 3.55Å; F79-M255 HydrophobicContact CE2-CE 3.31Å; F79-M255 HydrophobicContact CZ-CE 4.36Å; L82-M255 HydrophobicContact CD2-CB 3.84Å; L82-M255 HydrophobicContact CD2-CE 3.72Å; L82-M255 HydrophobicContact CD2-CG 3.57Å; L82-M255 HydrophobicContact CD2-SD 4.18Å; R86-M255 PolarHBondContact NH1-SD 3.36Å; R86-M255 VanDerWaalsContact NH1-SD 3.37Å; T252-M255 PolarHBondContact O-N 3.14Å; F253-M255 PolarHBondContact O-N 3.47Å; M255-A258 PolarHBondContact O-N 2.89Å; M255-A259 WeakPolarHBondContact O-CB 3.49Å; M255-A259 PolarHBondContact O-N 3.13Å
256	K	95.1	Very high	93.1	Very high	114 Å²	114	73.4 Å²	73.4	50%	0.496	39%	0.394	S	S	.	.	H	α-helix	trans	-66	-41.8	180	-172.2	177.2	-176.7	178.7	0	112	T252 F253 A259 K260	T252-K256 WeakPolarHBondContact O-CB 3.37Å; T252-K256 PolarHBondContact O-N 3.4Å; F253-K256 PolarHBondContact O-N 3.12Å; K256-A259 PolarHBondContact O-N 3.33Å; K256-K260 WeakPolarHBondContact O-CG 3.28Å; K256-K260 PolarHBondContact O-N 3.32Å; K256-K260 VanDerWaalsContact O-N 3.08Å
257	A	96.3	Very high	92.7	Very high	37 Å²	37	76.7 Å²	76.7	31%	0.306	42%	0.415	S	S	.	.	H	α-helix	trans	-63.1	-47.9	175.7	0	0	0	0	0	111	F253 A259 K260 V261	F253-A257 VanDerWaalsContact O-CB 3.31Å; F253-A257 WeakPolarHBondContact O-CB 3.41Å; F253-A257 PolarHBondContact O-N 2.89Å; A257-A259 PolarHBondContact O-N 2.82Å; A257-K260 PolarHBondContact O-N 3.31Å; A257-V261 WeakPolarHBondContact O-CG2 3.26Å; A257-V261 PolarHBondContact O-N 3.06Å; A257-V261 VanDerWaalsContact O-N 3.13Å
258	A	94.4	Very high	92.3	Very high	45 Å²	45	82.6 Å²	82.6	37%	0.372	43%	0.426	S	S	.	.	H	α-helix	trans	-60.5	-43	176.5	0	0	0	0	0	112.2	L254 M255 K260 V261 V262	L254-A258 VanDerWaalsContact O-CB 3.26Å; L254-A258 WeakPolarHBondContact O-CB 3.33Å; L254-A258 PolarHBondContact O-N 2.82Å; M255-A258 PolarHBondContact O-N 2.89Å; A258-K260 PolarHBondContact O-N 3.46Å; A258-V261 PolarHBondContact O-N 3.05Å; A258-V262 WeakPolarHBondContact O-CG2 3.48Å; A258-V262 PolarHBondContact O-N 3.11Å; A258-V262 VanDerWaalsContact O-N 3.08Å
259	A	93.7	Very high	91.8	Very high	40 Å²	40	83.3 Å²	83.3	33%	0.331	44%	0.435	S	S	.	.	H	α-helix	trans	-59.9	-45.9	177.4	0	0	0	0	0	112.1	M255 K256 A257 V261 V262 E263	M255-A259 WeakPolarHBondContact O-CB 3.49Å; M255-A259 PolarHBondContact O-N 3.13Å; K256-A259 PolarHBondContact O-N 3.33Å; A257-A259 PolarHBondContact O-N 2.82Å; A259-V261 VanDerWaalsContact C-N 3.32Å; A259-V261 PolarHBondContact O-N 3.39Å; A259-V262 PolarHBondContact O-N 3.47Å; A259-V262 VanDerWaalsContact O-N 3.12Å; A259-E263 WeakPolarHBondContact O-CG 3.39Å; A259-E263 PolarHBondContact O-N 3.1Å
260	K	95.3	Very high	91.2	Very high	127 Å²	127	87.3 Å²	87.3	55%	0.552	46%	0.455	S	S	*	.	H	α-helix	trans	-59.9	-39.5	176.3	-75.1	179.9	175.5	-171.3	0	113	K256 A257 A258 V262 E263 S264	K256-K260 WeakPolarHBondContact O-CG 3.28Å; K256-K260 PolarHBondContact O-N 3.32Å; K256-K260 VanDerWaalsContact O-N 3.08Å; A257-K260 PolarHBondContact O-N 3.31Å; A258-K260 PolarHBondContact O-N 3.46Å; K260-V262 VanDerWaalsContact C-N 3.31Å; K260-E263 PolarHBondContact O-N 3.08Å; K260-S264 PolarHBondContact O-N 3.39Å; K260-S264 PolarHBondContact O-OG 3.38Å
261	V	95.9	Very high	90.6	Very high	77 Å²	77	89.6 Å²	89.6	47%	0.467	47%	0.466	S	S	.	.	H	α-helix	trans	-65.5	-36.9	176.6	173.1	0	0	0	0	111.3	A257 A258 A259 S264 K265	A257-V261 WeakPolarHBondContact O-CG2 3.26Å; A257-V261 PolarHBondContact O-N 3.06Å; A257-V261 VanDerWaalsContact O-N 3.13Å; A258-V261 PolarHBondContact O-N 3.05Å; A259-V261 VanDerWaalsContact C-N 3.32Å; A259-V261 PolarHBondContact O-N 3.39Å; V261-S264 PolarHBondContact O-OG 2.99Å; V261-S264 VanDerWaalsContact O-OG 3.05Å; V261-K265 HydrophobicContact CG1-CD 4.47Å; V261-K265 WeakPolarHBondContact O-CG 3.43Å; V261-K265 PolarHBondContact O-N 3.34Å
262	V	94.6	Very high	89.3	Confident	96 Å²	96	89.5 Å²	89.5	58%	0.582	47%	0.466	S	S	*	.	H	α-helix	trans	-69.2	-42.7	175.6	173.2	0	0	0	0	110.9	A258 A259 K260 K265 R266	A258-V262 WeakPolarHBondContact O-CG2 3.48Å; A258-V262 PolarHBondContact O-N 3.11Å; A258-V262 VanDerWaalsContact O-N 3.08Å; A259-V262 PolarHBondContact O-N 3.47Å; A259-V262 VanDerWaalsContact O-N 3.12Å; K260-V262 VanDerWaalsContact C-N 3.31Å; V262-K265 PolarHBondContact O-N 3.31Å; V262-R266 WeakPolarHBondContact O-CB 3.31Å; V262-R266 PolarHBondContact O-N 3.3Å
263	E	93.3	Very high	87.7	Confident	124 Å²	124	96.2 Å²	96.2	58%	0.579	50%	0.496	S	S	*	.	H	α-helix	trans	-60.9	-45.5	177.2	-73.4	169.4	-172	0	0	111.9	A259 K260 K265 R266 T267	A259-E263 WeakPolarHBondContact O-CG 3.39Å; A259-E263 PolarHBondContact O-N 3.1Å; K260-E263 PolarHBondContact O-N 3.08Å; E263-K265 VanDerWaalsContact C-N 3.34Å; E263-K265 PolarHBondContact O-N 2.92Å; E263-R266 WeakPolarHBondContact O-CB 3.35Å; E263-R266 PolarHBondContact O-N 3.41Å; E263-R266 VanDerWaalsContact O-N 3.14Å; E263-T267 WeakPolarHBondContact O-CG2 3.45Å; E263-T267 PolarHBondContact O-N 2.86Å; E263-T267 PolarHBondContact O-OG1 3.32Å
264	S	93.3	Very high	85.7	Confident	62 Å²	62	97.3 Å²	97.3	43%	0.434	51%	0.507	S	S	.	.	H	α-helix	trans	-66.1	-33.8	179.3	69.8	0	0	0	0	113.3	K260 V261 T267 R268	K260-S264 PolarHBondContact O-N 3.39Å; K260-S264 PolarHBondContact O-OG 3.38Å; V261-S264 PolarHBondContact O-OG 2.99Å; V261-S264 VanDerWaalsContact O-OG 3.05Å; S264-T267 WeakPolarHBondContact CA-OG1 3.31Å; S264-T267 PolarHBondContact O-OG1 3.16Å; S264-R268 PolarHBondContact O-N 3.41Å
265	K	91.4	Very high	83.5	Confident	136 Å²	136	102.5 Å²	102.5	59%	0.591	53%	0.527	S	S	*	.	H	α-helix	trans	-67.6	-39.4	171.9	-73.6	178	-179.6	-175	0	111.5	V261 V262 E263 R268 T269	V261-K265 HydrophobicContact CG1-CD 4.47Å; V261-K265 WeakPolarHBondContact O-CG 3.43Å; V261-K265 PolarHBondContact O-N 3.34Å; V262-K265 PolarHBondContact O-N 3.31Å; E263-K265 VanDerWaalsContact C-N 3.34Å; E263-K265 PolarHBondContact O-N 2.92Å; K265-R268 PolarHBondContact O-N 2.87Å; K265-T269 PolarHBondContact O-N 3.43Å; K265-T269 VanDerWaalsContact O-N 3.08Å; K265-T269 PolarHBondContact O-OG1 3.39Å
266	R	89.3	Confident	81.2	Confident	180 Å²	180	106.9 Å²	106.9	68%	0.679	56%	0.558	S	S	*	*	H	α-helix	trans	-66.3	-43.7	178.9	-171	176.9	-177	169.5	1.1	111.7	V262 E263 R268 T269 I270	V262-R266 WeakPolarHBondContact O-CB 3.31Å; V262-R266 PolarHBondContact O-N 3.3Å; E263-R266 WeakPolarHBondContact O-CB 3.35Å; E263-R266 PolarHBondContact O-N 3.41Å; E263-R266 VanDerWaalsContact O-N 3.14Å; R266-R268 PolarHBondContact O-N 2.89Å; R266-T269 PolarHBondContact O-N 3.47Å; R266-I270 HydrophobicContact CG-CD1 3.97Å; R266-I270 WeakPolarHBondContact O-CG1 3.48Å; R266-I270 PolarHBondContact O-N 2.8Å
267	T	85.8	Confident	79	Confident	83 Å²	83	109.4 Å²	109.4	51%	0.509	58%	0.577	S	S	.	*	H	α-helix	trans	-62.3	-43.5	177	53.9	0	0	0	0	111.6	E263 S264 T269 I270 T271	E263-T267 WeakPolarHBondContact O-CG2 3.45Å; E263-T267 PolarHBondContact O-N 2.86Å; E263-T267 PolarHBondContact O-OG1 3.32Å; S264-T267 WeakPolarHBondContact CA-OG1 3.31Å; S264-T267 PolarHBondContact O-OG1 3.16Å; T267-T269 VanDerWaalsContact C-N 3.3Å; T267-T269 PolarHBondContact O-N 2.84Å; T267-I270 PolarHBondContact O-N 3.05Å; T267-T271 PolarHBondContact O-N 3.24Å; T267-T271 PolarHBondContact O-OG1 3.12Å; T267-T271 VanDerWaalsContact O-OG1 3.04Å
268	R	85.1	Confident	76.3	Confident	196 Å²	196	110.8 Å²	110.8	74%	0.74	59%	0.594	S	S	*	*	H	α-helix	trans	-60.5	-37.1	175.4	-169.9	-177.9	-67	177.2	-2.6	113.1	S264 K265 R266 S272	S264-R268 PolarHBondContact O-N 3.41Å; K265-R268 PolarHBondContact O-N 2.87Å; R266-R268 PolarHBondContact O-N 2.89Å; R268-S272 PolarHBondContact O-N 3.3Å; R268-S272 PolarHBondContact O-OG 3.3Å
269	T	79.1	Confident	73.7	Confident	77 Å²	77	115.8 Å²	115.8	47%	0.472	62%	0.615	S	S	.	*	H	α-helix	trans	-71	-38.3	178.6	-51.6	0	0	0	0	111.7	K265 R266 T267 S272 Q273	K265-T269 PolarHBondContact O-N 3.43Å; K265-T269 VanDerWaalsContact O-N 3.08Å; K265-T269 PolarHBondContact O-OG1 3.39Å; R266-T269 PolarHBondContact O-N 3.47Å; T267-T269 VanDerWaalsContact C-N 3.3Å; T267-T269 PolarHBondContact O-N 2.84Å; T269-S272 WeakPolarHBondContact CA-OG 3.46Å; T269-S272 PolarHBondContact O-N 3.29Å; T269-S272 PolarHBondContact O-OG 3.11Å; T269-Q273 PolarHBondContact O-N 2.69Å
270	I	78.5	Confident	71.1	Confident	84 Å²	84	121 Å²	121	43%	0.431	64%	0.637	S	S	.	*	H	α-helix	trans	-68.9	-45.6	177.6	-65.5	165	0	0	0	110.6	R266 T267 S272 Q273 D274	R266-I270 HydrophobicContact CG-CD1 3.97Å; R266-I270 WeakPolarHBondContact O-CG1 3.48Å; R266-I270 PolarHBondContact O-N 2.8Å; T267-I270 PolarHBondContact O-N 3.05Å; I270-S272 PolarHBondContact O-N 3.18Å; I270-Q273 PolarHBondContact O-N 3.5Å; I270-Q273 VanDerWaalsContact O-N 3.08Å; I270-D274 PolarHBondContact O-N 3.25Å
271	T	70.9	Confident	68.5	Low	105 Å²	105	120.7 Å²	120.7	64%	0.644	65%	0.645	S	S	*	*	H	α-helix	trans	-63.9	-23.7	179	-53	0	0	0	0	113.6	T267	T267-T271 PolarHBondContact O-N 3.24Å; T267-T271 PolarHBondContact O-OG1 3.12Å; T267-T271 VanDerWaalsContact O-OG1 3.04Å
272	S	63.8	Low	66.1	Low	78 Å²	78	125.6 Å²	125.6	55%	0.545	66%	0.663	S	S	.	*	H	α-helix	trans	-85.2	-21.1	175.1	44.5	0	0	0	0	113.7	R268 T269 I270	R268-S272 PolarHBondContact O-N 3.3Å; R268-S272 PolarHBondContact O-OG 3.3Å; T269-S272 WeakPolarHBondContact CA-OG 3.46Å; T269-S272 PolarHBondContact O-N 3.29Å; T269-S272 PolarHBondContact O-OG 3.11Å; I270-S272 PolarHBondContact O-N 3.18Å
273	Q	59.5	Low	63.4	Low	157 Å²	157	129.8 Å²	129.8	73%	0.734	68%	0.679	S	S	*	*	H	α-helix	trans	-87.5	-20.8	175.8	-74.8	-170.2	-28.2	0	0	114	T269 I270 K275	T269-Q273 PolarHBondContact O-N 2.69Å; I270-Q273 PolarHBondContact O-N 3.5Å; I270-Q273 VanDerWaalsContact O-N 3.08Å; Q273-K275 VanDerWaalsContact C-N 3.33Å; Q273-K275 PolarHBondContact O-N 2.88Å
274	D	54.7	Low	60.8	Low	134 Å²	134	132.5 Å²	132.5	72%	0.717	69%	0.692	S	S	*	*	S	Bend	trans	-85.5	6.5	178.1	-87.4	-22.3	0	0	0	114.6	I270	I270-D274 PolarHBondContact O-N 3.25Å
275	K	50.4	Low	58.1	Low	171 Å²	171	136.1 Å²	136.1	74%	0.743	71%	0.711	S	S	*	*	S	Bend	trans	-77.1	121.7	167.7	-81.4	-171.1	175.9	-176.3	0	109.1	Q273 N277	Q273-K275 VanDerWaalsContact C-N 3.33Å; Q273-K275 PolarHBondContact O-N 2.88Å; K275-N277 PolarHBondContact O-N 2.86Å
276	P	44.9	Very low	55.5	Low	122 Å²	122	137.2 Å²	137.2	79%	0.792	72%	0.718	S	S	*	*			trans	-64.2	136.7	174.9	28.1	-30.9	0	0	0	108	G278	P276-G278 VanDerWaalsContact C-N 3.29Å; P276-G278 PolarHBondContact O-N 2.83Å
277	N	48.5	Very low	52.8	Low	167 Å²	167	133.1 Å²	133.1	89%	0.893	72%	0.723	S	S	*	*			trans	-59.2	91.2	176.9	-153.6	45.5	0	0	0	109.2	K275	K275-N277 PolarHBondContact O-N 2.86Å
278	G	39.1	Very low	50.2	Low	65 Å²	65	135.3 Å²	135.3	67%	0.67	73%	0.732	S	S	*	*			trans	-118.2	108.1	171.7	0	0	0	0	0	107.3	P276 D280	P276-G278 VanDerWaalsContact C-N 3.29Å; P276-G278 PolarHBondContact O-N 2.83Å; G278-D280 PolarHBondContact O-N 3.1Å
279	N	40.3	Very low	48	Very low	151 Å²	151	133.9 Å²	133.9	81%	0.807	74%	0.738	S	S	*	*			trans	-50.8	127.1	170.9	-56.4	-27.1	0	0	0	109
280	D	40.4	Very low	45.7	Very low	150 Å²	150	136.5 Å²	136.5	80%	0.802	75%	0.749	S	S	*	*				-176.5	147.3	105.7	-130.6	-17.3	0	0	0	114	G278	G278-D280 PolarHBondContact O-N 3.1Å
281	V	40.2	Very low	43.9	Very low	119 Å²	119	138.8 Å²	138.8	72%	0.721	77%	0.767	S	S	*	*			trans	60.5	115.8	159.9	-158.2	0	0	0	0	121.6
282	E	45.1	Very low	41.9	Very low	180 Å²	180	143.7 Å²	143.7	84%	0.841	77%	0.774	S	S	*	*			trans	-25	128.6	154.8	-63.4	169.3	158.2	0	0	117
283	M	37.7	Very low	40.7	Very low	184 Å²	184	149.2 Å²	149.2	91%	0.906	79%	0.788	S	S	*	*				-155.1	106.2	123.5	-114.6	-161.5	-161.9	0	0	108.5	T285	M283-T285 PolarHBondContact O-N 3.04Å
284	E	39.8	Very low	39.3	Very low	182 Å²	182	146.8 Å²	146.8	85%	0.85	79%	0.789	S	S	*	*			trans	-66.4	119.5	166.3	-63.2	-169.4	151.4	0	0	108.8
285	T	35.2	Very low	38.1	Very low	138 Å²	138	146.8 Å²	146.8	85%	0.847	79%	0.793	S	S	*	*			trans	-113	96.3	150.6	26.7	0	0	0	0	107.4	M283 A287	M283-T285 PolarHBondContact O-N 3.04Å; T285-A287 PolarHBondContact O-N 3.39Å
286	E	37.5	Very low	37.3	Very low	158 Å²	158	143.1 Å²	143.1	74%	0.738	79%	0.789	S	S	*	*			trans	-60.1	112.4	172.5	-167	-179.8	-176	0	0	110
287	A	32.2	Very low	36.7	Very low	95 Å²	95	144.1 Å²	144.1	79%	0.785	79%	0.787	S	S	*	*			trans	-127.2	93	160.8	0	0	0	0	0	108	T285 L289	T285-A287 PolarHBondContact O-N 3.39Å; A287-L289 PolarHBondContact O-N 3.47Å
288	N	31.1	Very low	36	Very low	128 Å²	128	146.2 Å²	146.2	68%	0.684	79%	0.789	S	S	*	*			trans	-42.4	118.7	-180	-87.1	-75.8	0	0	0	114.2
289	L	39.7	Very low	35.5	Very low	167 Å²	167	152.4 Å²	152.4	87%	0.874	80%	0.8	S	S	*	*			trans	-96.5	91.7	156.7	-74.6	174.4	0	0	0	108.1	A287 T291	A287-L289 PolarHBondContact O-N 3.47Å; L289-T291 PolarHBondContact O-N 2.99Å
290	D	31.1	Very low	34.9	Very low	132 Å²	132	151.1 Å²	151.1	71%	0.706	80%	0.803	S	S	*	*			trans	-79	94.9	176.9	-155.3	2.4	0	0	0	110.1	R292	D290-R292 VanDerWaalsContact C-N 3.25Å; D290-R292 PolarHBondContact O-N 3.38Å
291	T	39.9	Very low	34.3	Very low	132 Å²	132	148.3 Å²	148.3	81%	0.81	80%	0.801	S	S	*	*			trans	-74.9	81.6	165.2	-61.5	0	0	0	0	108	L289 K293	L289-T291 PolarHBondContact O-N 2.99Å; T291-K293 PolarHBondContact O-N 2.91Å
292	R	29.8	Very low	33.5	Very low	208 Å²	208	149.4 Å²	149.4	79%	0.785	81%	0.807	S	S	*	*			trans	-85.5	92.4	173.5	-157.6	172.3	-167.4	172.1	4.6	111.2	D290 S294	D290-R292 VanDerWaalsContact C-N 3.25Å; D290-R292 PolarHBondContact O-N 3.38Å; R292-S294 PolarHBondContact O-N 3.24Å
293	K	38	Very low	32.6	Very low	193 Å²	193	146 Å²	146	84%	0.839	80%	0.799	S	S	*	*			trans	-51	117.4	155.6	-172.3	178.6	-173.7	178.9	0	108.8	T291	T291-K293 PolarHBondContact O-N 2.91Å
294	S	29.1	Very low	32.2	Very low	107 Å²	107	145.5 Å²	145.5	75%	0.748	80%	0.795	S	S	*	*			trans	-136.5	134.9	165.8	65.9	0	0	0	0	110.9	R292	R292-S294 PolarHBondContact O-N 3.24Å
295	V	30.9	Very low	31.7	Very low	133 Å²	133	142.3 Å²	142.3	81%	0.806	79%	0.792	S	S	*	*			trans	-126.9	145	176.6	168.7	0	0	0	0	106.5
296	S	33.1	Very low	31.5	Very low	94 Å²	94	139.6 Å²	139.6	66%	0.657	78%	0.779	S	S	*	*			trans	102.7	106.4	157.8	-163.3	0	0	0	0	118.2
297	D	31.9	Very low	31.2	Very low	143 Å²	143	141.1 Å²	141.1	77%	0.765	79%	0.786	S	S	*	*				38.5	119.8	126.3	-48.4	-54.6	0	0	0	120.4
298	K	33.9	Very low	30.8	Very low	211 Å²	211	139.8 Å²	139.8	92%	0.917	78%	0.782	S	S	*	*				-166.8	145.6	116	-104	167	-174.6	-179.1	0	112.6
299	Q	28.9	Very low	30.7	Very low	196 Å²	196	140.4 Å²	140.4	92%	0.916	79%	0.79	S	S	*	*			trans	-59.7	146.8	177.8	-70.6	162.1	-46.4	0	0	113.5
300	S	26.7	Very low	30.2	Very low	123 Å²	123	139 Å²	139	86%	0.86	79%	0.788	S	S	*	*			trans	-138.4	122.7	146.2	68.3	0	0	0	0	110
301	A	27.7	Very low	30	Very low	92 Å²	92	137 Å²	137	76%	0.76	78%	0.784	S	S	*	*			trans	-81.6	149.6	164.4	0	0	0	0	0	109.4
302	V	24.9	Very low	29.6	Very low	141 Å²	141	139 Å²	139	86%	0.855	79%	0.789	S	S	*	*				-177.3	140.5	128.7	151.4	0	0	0	0	109.1
303	T	26.3	Very low	29.8	Very low	110 Å²	110	136.7 Å²	136.7	68%	0.675	79%	0.792	S	S	*	*			trans	-65.2	163.1	176.3	43.2	0	0	0	0	111.8
304	E	29.5	Very low	29.5	Very low	173 Å²	173	137 Å²	137	81%	0.808	79%	0.788	S	S	*	*			cis	177.4	152.5	49.3	-142.1	159.7	-117.4	0	0	111
305	S	28.3	Very low	29.7	Very low	114 Å²	114	135.7 Å²	135.7	80%	0.797	78%	0.778	S	S	*	*			trans	68.7	142.9	147.9	140	0	0	0	0	119.9
306	S	30.6	Very low	30.3	Very low	81 Å²	81	134.5 Å²	134.5	57%	0.566	76%	0.764	S	S	*	*			cis	-170.5	152.7	6.5	-178.3	0	0	0	0	110
307	E	31.3	Very low	30.6	Very low	191 Å²	191	138.3 Å²	138.3	89%	0.893	77%	0.768	S	S	*	*			trans	44	131.3	150.3	-70.6	164.2	167.6	0	0	121
308	G	25.1	Very low	31.5	Very low	67 Å²	67	132.7 Å²	132.7	69%	0.691	74%	0.738	S	S	*	*			cis	150.5	138.6	6.9	0	0	0	0	0	108.6
309	T	28.2	Very low	32.8	Very low	140 Å²	140	123.6 Å²	123.6	86%	0.859	70%	0.7	S	S	*	*			trans	-170.2	115.6	152.4	-68.8	0	0	0	0	111.3
310	V	28.1	Very low	34	Very low	138 Å²	138	114.3 Å²	114.3	84%	0.836	66%	0.656	S	S	*	*			trans	51.9	109.6	148.9	-169.6	0	0	0	0	120.7
311	S	28.1	Very low	35.1	Very low	89 Å²	89	111.1 Å²	111.1	62%	0.622	63%	0.632	S	S	*	*			trans	-76.1	132.7	175.8	80.3	0	0	0	0	113.9	L313	S311-L313 PolarHBondContact O-N 3.23Å
312	L	30.9	Very low	36.1	Very low	174 Å²	174	108.4 Å²	108.4	91%	0.911	61%	0.607	S	S	*	*			trans	-85.5	97.7	161.5	-130.2	155.2	0	0	0	108.6	R314	L312-R314 PolarHBondContact O-N 3.42Å
313	L	33.6	Very low	37.1	Very low	161 Å²	161	106.9 Å²	106.9	84%	0.843	59%	0.589	S	S	*	*			trans	-76.7	90.4	-175.4	-142.2	85.5	0	0	0	110.9	S311	S311-L313 PolarHBondContact O-N 3.23Å
314	R	32.4	Very low	37.6	Very low	200 Å²	200	105.5 Å²	105.5	76%	0.755	58%	0.577	S	S	*	*			trans	-131.4	124.1	150	-159.8	172.3	-161.5	150.2	1.7	107	L312 H316	L312-R314 PolarHBondContact O-N 3.42Å; R314-H316 PolarHBondContact O-CD2 2.88Å; R314-H316 PolarHBondContact O-N 2.81Å
315	S	34.2	Very low	37.8	Very low	79 Å²	79	105.2 Å²	105.2	55%	0.552	58%	0.576	S	S	*	*			trans	-65.3	98	-177	173.8	0	0	0	0	110.4	K317	S315-K317 VanDerWaalsContact C-N 3.35Å
316	H	43.2	Very low	37.9	Very low	107 Å²	107	107.1 Å²	107.1	50%	0.495	57%	0.571	S	S	.	*			trans	-92.6	24.5	177.4	-75.7	-81.9	0	0	0	113.3	H108 R314 N318	H108-H316 PolarHBondContact CE1-O 2.84Å; R314-H316 PolarHBondContact O-CD2 2.88Å; R314-H316 PolarHBondContact O-N 2.81Å; H316-N318 VanDerWaalsContact C-N 3.27Å; H316-N318 PolarHBondContact O-N 3.41Å; H316-N318 VanDerWaalsContact O-N 3.08Å
317	K	38.5	Very low	37.6	Very low	174 Å²	174	106.8 Å²	106.8	76%	0.757	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-4.9	-164.6	-70.9	-170.3	174.4	-174.2	0	116.8	S315	S315-K317 VanDerWaalsContact C-N 3.35Å
318	N	51.9	Low	37.5	Very low	26 Å²	26	103.8 Å²	103.8	14%	0.139	58%	0.576	C	S	.	*	T	Hydrogen-bonded Turn	trans	-145.5	60.1	-176.3	-63.4	-19.2	0	0	0	112	H316 V321 K323	H316-N318 VanDerWaalsContact C-N 3.27Å; H316-N318 PolarHBondContact O-N 3.41Å; H316-N318 VanDerWaalsContact O-N 3.08Å; N318-V321 WeakPolarHBondContact CB-O 3.39Å; N318-K323 WeakPolarHBondContact OD1-CE 3.22Å
319	L	59.4	Low	37.5	Very low	20 Å²	20	108.9 Å²	108.9	11%	0.105	58%	0.581	C	S	.	*	S	Bend	trans	-68.2	-39.7	-176.8	-145.6	78.8	0	0	0	111.5	E104 I107 I121 R129	E104-L319 HydrophobicContact CG-CB 4.47Å; E104-L319 PolarHBondContact OE1-N 3.21Å; I107-L319 HydrophobicContact CB-CD2 3.99Å; I107-L319 HydrophobicContact CD1-CD2 4.38Å; I107-L319 HydrophobicContact CG2-CD2 3.31Å; I121-L319 HydrophobicContact CG2-CD2 4.38Å; R129-L319 PolarHBondContact NH1-O 3.38Å
320	F	55.8	Low	37.6	Very low	1 Å²	1	110 Å²	110	0%	0.004	58%	0.577	C	S	.	*	S	Bend	trans	-134.9	-18.5	177.9	-58.6	-74.4	0	0	0	114.8	R100 E104 I107 C124 Q125 T128	R100-F320 HydrophobicContact CG-CB 3.62Å; R100-F320 HydrophobicContact CG-CG 4.14Å; E104-F320 HydrophobicContact CB-CD2 3.51Å; E104-F320 HydrophobicContact CB-CE2 4.1Å; E104-F320 HydrophobicContact CB-CG 4.49Å; E104-F320 HydrophobicContact CG-CD2 3.71Å; E104-F320 HydrophobicContact CG-CE2 4.45Å; E104-F320 PolarHBondContact OE1-N 3.11Å; I107-F320 HydrophobicContact CD1-CE2 3.42Å; I107-F320 VanDerWaalsContact CD1-CE2 3.42Å; I107-F320 HydrophobicContact CD1-CZ 3.37Å; C124-F320 VanDerWaalsContact C-CE1 3.49Å; C124-F320 HydrophobicContact CB-CD1 4.49Å; C124-F320 HydrophobicContact CB-CE1 3.4Å; C124-F320 HydrophobicContact CB-CZ 3.67Å; Q125-F320 HydrophobicContact CB-CE1 4.2Å; Q125-F320 HydrophobicContact CG-CD1 4.13Å; Q125-F320 HydrophobicContact CG-CE1 3.56Å; Q125-F320 HydrophobicContact CG-CZ 4.07Å; T128-F320 HydrophobicContact CG2-CB 4.24Å; T128-F320 HydrophobicContact CG2-CD1 3.66Å; T128-F320 HydrophobicContact CG2-CG 4.35Å
321	V	49.4	Very low	37.5	Very low	56 Å²	56	111.6 Å²	111.6	34%	0.339	58%	0.575	S	S	.	*			trans	-94	127.7	-178.7	174.5	0	0	0	0	111	E104 N318	E104-V321 PolarHBondContact OE1-N 3.44Å; E104-V321 WeakPolarHBondContact OE2-CG2 3.2Å; N318-V321 WeakPolarHBondContact CB-O 3.39Å
322	S	48.7	Very low	37.4	Very low	34 Å²	34	114.6 Å²	114.6	24%	0.238	58%	0.584	C	S	.	*			trans	-82.5	142.5	171.2	56.7	0	0	0	0	111.6	A138 Q139 L324	A138-S322 VanDerWaalsContact CB-CB 3.5Å; A138-S322 WeakPolarHBondContact CB-OG 3.4Å; Q139-S322 VanDerWaalsContact O-CA 3.3Å; Q139-S322 WeakPolarHBondContact O-CA 3.35Å; S322-L324 PolarHBondContact O-N 3.02Å
323	K	46.3	Very low	37.1	Very low	109 Å²	109	115.9 Å²	115.9	47%	0.474	58%	0.583	S	S	.	*	B	Isolated β-bridge	trans	-76.5	105.1	169.6	-67.7	178.2	-175.9	168.3	0	108.7	Q139 N318	Q139-K323 HydrophobicContact CB-CB 4.46Å; Q139-K323 PolarHBondContact O-N 2.98Å; N318-K323 WeakPolarHBondContact OD1-CE 3.22Å
324	L	36.1	Very low	36.8	Very low	81 Å²	81	115.9 Å²	115.9	42%	0.424	58%	0.584	S	S	.	*			trans	-83.2	121.3	173.2	-169.8	59.5	0	0	0	109.2	D137 S322 H326	D137-L324 WeakPolarHBondContact OD2-CD1 3.28Å; S322-L324 PolarHBondContact O-N 3.02Å; L324-H326 VanDerWaalsContact C-N 3.31Å; L324-H326 WeakPolarHBondContact CD2-NE2 3.28Å; L324-H326 PolarHBondContact O-N 3.28Å
325	Q	33.6	Very low	36.5	Very low	168 Å²	168	113.4 Å²	113.4	79%	0.785	59%	0.585	S	S	*	*			trans	-76.9	83	172.7	-67.5	-160.9	8.2	0	0	110	G327	Q325-G327 PolarHBondContact O-N 2.91Å
326	H	29.9	Very low	36.1	Very low	153 Å²	153	119.3 Å²	119.3	71%	0.708	60%	0.601	S	S	*	*			trans	-77.9	101.3	166.6	-84.4	-57.5	0	0	0	110.2	L324 T328	L324-H326 VanDerWaalsContact C-N 3.31Å; L324-H326 WeakPolarHBondContact CD2-NE2 3.28Å; L324-H326 PolarHBondContact O-N 3.28Å; H326-T328 PolarHBondContact O-N 3.04Å
327	G	25.6	Very low	35.2	Very low	74 Å²	74	123.7 Å²	123.7	76%	0.763	62%	0.619	S	S	*	*			trans	-62.3	112.7	155.4	0	0	0	0	0	108.9	Q325 Q329	Q325-G327 PolarHBondContact O-N 2.91Å; G327-Q329 PolarHBondContact O-N 3.31Å; G327-Q329 VanDerWaalsContact O-N 3.14Å
328	T	27.6	Very low	34.7	Very low	128 Å²	128	124 Å²	124	79%	0.785	62%	0.623	S	S	*	*			trans	-67	107.9	176.8	-41	0	0	0	0	109.3	H326	H326-T328 PolarHBondContact O-N 3.04Å
329	Q	26.9	Very low	33.4	Very low	174 Å²	174	134.7 Å²	134.7	81%	0.813	66%	0.661	S	S	*	*			trans	-131.4	99.7	153.8	-131.7	178.4	42.7	0	0	107.4	G327 Q331	G327-Q329 PolarHBondContact O-N 3.31Å; G327-Q329 VanDerWaalsContact O-N 3.14Å; Q329-Q331 PolarHBondContact O-N 3.01Å
330	Q	29.4	Very low	31.9	Very low	165 Å²	165	144.2 Å²	144.2	77%	0.771	70%	0.696	S	S	*	*			trans	-54.8	126.3	165	-77.1	173.1	-63.1	0	0	108.5
331	Q	26.8	Very low	30.4	Very low	170 Å²	170	151.8 Å²	151.8	79%	0.794	74%	0.735	S	S	*	*			trans	-131.7	107.4	154	-79.7	-160.2	-21.5	0	0	108.7	Q329	Q329-Q331 PolarHBondContact O-N 3.01Å
332	D	24.3	Very low	29.3	Very low	152 Å²	152	152.7 Å²	152.7	81%	0.813	76%	0.756	S	S	*	*			trans	-63.3	132.1	166.6	-70.3	-46.7	0	0	0	109.9
333	F	25.6	Very low	28.1	Very low	201 Å²	201	157 Å²	157	88%	0.882	78%	0.781	S	S	*	*			trans	-79.6	128.5	164.4	-77.2	-83.3	0	0	0	109.5
334	N	26.6	Very low	27.1	Very low	162 Å²	162	159.7 Å²	159.7	87%	0.866	80%	0.799	S	S	*	*			trans	-145	143.3	148.4	-125.9	-18	0	0	0	112.9
335	N	26.3	Very low	26.6	Very low	147 Å²	147	164 Å²	164	79%	0.786	82%	0.817	S	S	*	*			trans	-85.1	167.8	-160.2	-90	-39.4	0	0	0	116
336	K	25.4	Very low	26.1	Very low	203 Å²	203	160.5 Å²	160.5	88%	0.883	81%	0.811	S	S	*	*			trans	80.7	134.3	165.7	-72.1	172.7	173	170.5	0	114.8
337	K	25.5	Very low	25.9	Very low	199 Å²	199	158.5 Å²	158.5	87%	0.865	81%	0.81	S	S	*	*			cis	-166.3	151.3	39.5	-153.9	173.7	-175.2	177.4	0	111
338	E	27.1	Very low	26	Very low	180 Å²	180	163.4 Å²	163.4	84%	0.841	81%	0.81	S	S	*	*			trans	-52.3	143.6	168.8	-69.1	167.7	111.2	0	0	114
339	R	25.8	Very low	26.1	Very low	251 Å²	251	166.4 Å²	166.4	95%	0.947	81%	0.812	S	S	*	*				-170.3	139	119.2	-106.5	178.4	-177.9	-161.8	1.1	114.6
340	R	27.6	Very low	26.2	Very low	220 Å²	220	165.7 Å²	165.7	83%	0.83	81%	0.806	S	S	*	*			trans	-41.9	148.7	173.9	-75.5	174.5	-175.9	177	0.6	119.8
341	I	24.8	Very low	26.2	Very low	161 Å²	161	164.8 Å²	164.8	83%	0.826	80%	0.8	S	S	*	*			trans	66.6	127.1	134.5	-59.3	163.3	0	0	0	119.1
342	G	24.6	Very low	26.3	Very low	75 Å²	75	162.2 Å²	162.2	77%	0.773	79%	0.788	S	S	*	*			trans	175.3	83.7	161.4	0	0	0	0	0	114.4
343	T	23.8	Very low	26.6	Very low	125 Å²	125	159.6 Å²	159.6	77%	0.767	78%	0.782	S	S	*	*			trans	-59.9	136.8	162.8	-55.5	0	0	0	0	111
344	L	25.5	Very low	26.8	Very low	165 Å²	165	159.5 Å²	159.5	86%	0.864	78%	0.776	S	S	*	*				179.9	144.4	120.1	-114.9	105.6	0	0	0	113.8
345	Q	25.3	Very low	27	Very low	172 Å²	172	163.8 Å²	163.8	80%	0.804	78%	0.78	S	S	*	*			trans	-65.8	161.5	173.2	-61.7	168.8	-29.8	0	0	112.5
346	S	24.7	Very low	27.1	Very low	93 Å²	93	161 Å²	161	65%	0.65	78%	0.777	S	S	*	*				142.6	130.1	106.5	-159.1	0	0	0	0	115.8
347	T	24.2	Very low	27.2	Very low	112 Å²	112	157.4 Å²	157.4	69%	0.687	77%	0.772	S	S	*	*			trans	88.9	130.7	136.8	49	0	0	0	0	124.9
348	K	28.8	Very low	27.4	Very low	177 Å²	177	156.7 Å²	156.7	77%	0.77	77%	0.772	S	S	*	*			trans	87	107.9	141.8	-76.2	165.3	-177.3	175.7	0	116.3
349	K	28.5	Very low	27.5	Very low	191 Å²	191	152.5 Å²	152.5	83%	0.83	76%	0.762	S	S	*	*				67.6	132.5	88.2	-81.8	-171.4	177.3	176.4	0	110.1
350	K	29.1	Very low	27.6	Very low	158 Å²	158	151.9 Å²	151.9	69%	0.687	76%	0.76	S	S	*	*			cis	-177.6	149.5	31.7	-144.8	-171.3	-179.6	-177	0	108.4
351	K	29.8	Very low	27.8	Very low	147 Å²	147	148.3 Å²	148.3	64%	0.639	76%	0.756	S	S	*	*			trans	64.5	151	133.9	-97.4	-172.9	166.9	-143.9	0	119.2
352	E	29.6	Very low	28	Very low	115 Å²	115	146.9 Å²	146.9	54%	0.537	76%	0.757	S	S	.	*			cis	-175.7	123.4	5.3	-171.7	155.7	-156.8	0	0	103.8	R354	E352-R354 IonicContact OE1-NH2 3.43Å
353	S	29.1	Very low	28	Very low	98 Å²	98	149.3 Å²	149.3	69%	0.685	76%	0.757	S	S	*	*				91.9	155.2	81.4	-165.3	0	0	0	0	116
354	R	31.1	Very low	28.3	Very low	199 Å²	199	148.1 Å²	148.1	75%	0.751	75%	0.753	S	S	*	*			trans	92	105.8	160.8	-51.1	-174.4	-173.9	174.3	2.4	114.7	E352	E352-R354 IonicContact OE1-NH2 3.43Å
355	R	30.9	Very low	28.4	Very low	252 Å²	252	149.2 Å²	149.2	95%	0.951	75%	0.751	S	S	*	*				58.4	117.3	56.3	-77.3	-167.9	-178	180	1.1	115.3
356	A	27.6	Very low	28.6	Very low	89 Å²	89	146.7 Å²	146.7	74%	0.736	75%	0.753	S	S	*	*				178.2	117.7	118.9	0	0	0	0	0	108.8
357	T	28.8	Very low	28.8	Very low	127 Å²	127	150.2 Å²	150.2	78%	0.779	76%	0.759	S	S	*	*				78.6	125.4	85.9	-30.5	0	0	0	0	115.7
358	E	29	Very low	29.2	Very low	184 Å²	184	151.2 Å²	151.2	86%	0.86	77%	0.767	S	S	*	*			trans	110.2	152	138.8	-113.9	166.3	-143.2	0	0	121.7
359	S	29.1	Very low	29.5	Very low	91 Å²	91	147.9 Å²	147.9	64%	0.636	76%	0.761	S	S	*	*			trans	-76.8	162.6	-147.9	61.3	0	0	0	0	118.8
360	R	27.3	Very low	29.6	Very low	239 Å²	239	145 Å²	145	90%	0.902	76%	0.76	S	S	*	*				175.5	145.1	117.8	-94.7	167.8	-167.6	-173	4.4	114.3
361	I	32	Very low	30.1	Very low	145 Å²	145	143.4 Å²	143.4	74%	0.744	77%	0.766	S	S	*	*			trans	-75.9	155.7	171.1	-62.1	161.7	0	0	0	110.5	V363	I361-V363 HydrophobicContact CG2-CG2 4Å
362	P	28.1	Very low	30.3	Very low	130 Å²	130	145.5 Å²	145.5	84%	0.844	78%	0.778	S	S	*	*				-136.7	158.3	125.3	17.7	4.3	0	0	0	114.9
363	V	26.5	Very low	30.4	Very low	127 Å²	127	149 Å²	149	77%	0.77	79%	0.791	S	S	*	*			trans	-108.9	136.7	-172.7	162.4	0	0	0	0	111.8	I361	I361-V363 HydrophobicContact CG2-CG2 4Å
364	S	29	Very low	30.7	Very low	99 Å²	99	154 Å²	154	69%	0.692	80%	0.803	S	S	*	*			trans	65.1	121.7	144.1	-148.1	0	0	0	0	123.5
365	K	27.6	Very low	31	Very low	189 Å²	189	155.7 Å²	155.7	82%	0.822	81%	0.81	S	S	*	*				165.3	152.4	98.3	-87.9	-169.5	-178.6	176	0	113.9
366	S	28.8	Very low	31.3	Very low	119 Å²	119	148.2 Å²	148.2	83%	0.832	80%	0.802	S	S	*	*			trans	76.5	122.6	156.5	43.1	0	0	0	0	122.4
367	Q	30.1	Very low	32.3	Very low	166 Å²	166	155.6 Å²	155.6	78%	0.776	81%	0.811	S	S	*	*			trans	-59.5	163.1	163	-67.1	177.6	-67.8	0	0	112.5
368	P	33	Very low	33.3	Very low	133 Å²	133	159 Å²	159	86%	0.864	82%	0.815	S	S	*	*				-131	154	95.3	9.5	12.5	0	0	0	114.8
369	V	34.5	Very low	34.4	Very low	108 Å²	108	160.3 Å²	160.3	66%	0.655	82%	0.818	S	S	*	*			trans	-75.6	136.5	179.8	176.8	0	0	0	0	111.4
370	T	31	Very low	36.1	Very low	131 Å²	131	161 Å²	161	80%	0.804	81%	0.811	S	S	*	*			trans	-140.3	151.2	147.5	45.6	0	0	0	0	110.6
371	P	38.6	Very low	38.4	Very low	123 Å²	123	153.5 Å²	153.5	80%	0.799	80%	0.8	S	S	*	*			trans	-94.2	112.2	-153.7	33.8	-28.7	0	0	0	112.1	K373	P371-K373 PolarHBondContact O-N 3.05Å
372	E	33.5	Very low	40.7	Very low	192 Å²	192	149.1 Å²	149.1	90%	0.897	77%	0.774	S	S	*	*			trans	-93.6	100.9	178.6	-146.8	173.2	-169.7	0	0	111.2
373	K	31.9	Very low	43.3	Very low	189 Å²	189	146.5 Å²	146.5	82%	0.822	75%	0.753	S	S	*	*			trans	31	110.5	151.8	-66.8	177.7	179.3	176.4	0	116.9	P371 R375	P371-K373 PolarHBondContact O-N 3.05Å; K373-R375 PolarHBondContact O-N 2.94Å
374	H	35.2	Very low	45.8	Very low	203 Å²	203	147.4 Å²	147.4	94%	0.94	74%	0.742	S	S	*	*			trans	-49.1	94.1	164.2	-77.7	-89.7	0	0	0	111.8	A376	H374-A376 PolarHBondContact O-N 3.12Å
375	R	37.7	Very low	48.4	Very low	233 Å²	233	145.4 Å²	145.4	88%	0.879	72%	0.722	S	S	*	*			trans	-66.2	123.6	158.1	-71.7	-174.2	179.9	-173.2	0.5	106.9	K373 R377	K373-R375 PolarHBondContact O-N 2.94Å; R375-R377 PolarHBondContact O-N 3.47Å
376	A	38.2	Very low	51.2	Low	96 Å²	96	136.5 Å²	136.5	79%	0.793	68%	0.684	S	S	*	*			trans	-49.8	113	173	0	0	0	0	0	108.9	H374 K378	H374-A376 PolarHBondContact O-N 3.12Å; A376-K378 PolarHBondContact O-N 3.17Å
377	R	47.4	Very low	54	Low	244 Å²	244	131.5 Å²	131.5	92%	0.921	65%	0.647	S	S	*	*			trans	-62.9	109.7	179.9	-76.7	178.8	177.7	166.3	-1	107.8	R375 K379	R375-R377 PolarHBondContact O-N 3.47Å; R377-K379 PolarHBondContact O-N 2.68Å
378	K	50.1	Low	56.7	Low	199 Å²	199	128.7 Å²	128.7	87%	0.865	63%	0.632	S	S	*	*			trans	-51.7	128.7	166.7	-66.2	-176.8	178.7	-176.5	0	107.4	A376 Q380	A376-K378 PolarHBondContact O-N 3.17Å; K378-Q380 PolarHBondContact O-N 3.37Å
379	K	52.3	Low	59.4	Low	210 Å²	210	124.3 Å²	124.3	91%	0.913	60%	0.602	S	S	*	*			trans	-60.5	103.5	176.2	-69.9	-178.8	180	177.6	0	107.9	R377 A381	R377-K379 PolarHBondContact O-N 2.68Å; K379-A381 PolarHBondContact O-N 3.41Å
380	Q	64.9	Low	62	Low	106 Å²	106	119.2 Å²	119.2	50%	0.495	57%	0.571	S	S	.	*			trans	-74	107.7	-179.7	-170.4	-178.7	-20.6	0	0	108.7	K378 N412 R414	K378-Q380 PolarHBondContact O-N 3.37Å; Q380-N412 PolarHBondContact NE2-O 2.85Å; Q380-R414 PolarHBondContact O-NH1 3.33Å; Q380-R414 PolarHBondContact O-NH2 2.76Å
381	A	75.5	Confident	64.7	Low	82 Å²	82	117 Å²	117	68%	0.678	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-57.3	145.3	176.5	0	0	0	0	0	110.6	K379 R414	K379-A381 PolarHBondContact O-N 3.41Å; A381-R414 PolarHBondContact O-NH2 3.43Å
382	W	81	Confident	67	Low	53 Å²	53	113.3 Å²	113.3	20%	0.201	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-77.2	127	175.7	-76.4	83.5	0	0	0	109.4	E386 R414 M418 L419 R422	W382-E386 HydrophobicContact CE3-CB 3.8Å; W382-E386 HydrophobicContact CZ3-CB 4.17Å; W382-R414 HydrophobicContact CH2-CG 4.26Å; W382-R414 HydrophobicContact CZ3-CG 4.43Å; W382-M418 HydrophobicContact CH2-CB 4.31Å; W382-M418 HydrophobicContact CZ2-CB 3.97Å; W382-M418 WeakPolarHBondContact CZ2-O 3.38Å; W382-L419 HydrophobicContact CH2-CD1 4.12Å; W382-L419 HydrophobicContact CH2-CG 4.47Å; W382-R422 VanDerWaalsContact CB-CZ 3.42Å; W382-R422 HydrophobicContact CD2-CB 3.96Å; W382-R422 HydrophobicContact CD2-CG 3.48Å; W382-R422 VanDerWaalsContact CD2-CG 3.48Å; W382-R422 HydrophobicContact CE3-CB 4.16Å; W382-R422 HydrophobicContact CE3-CG 3.6Å; W382-R422 HydrophobicContact CG-CG 4.05Å; W382-R422 VanDerWaalsContact CG-NE 3.28Å; W382-R422 HydrophobicContact CH2-CB 3.56Å; W382-R422 HydrophobicContact CH2-CG 3.96Å; W382-R422 HydrophobicContact CZ2-CB 3.33Å; W382-R422 HydrophobicContact CZ2-CG 3.87Å; W382-R422 HydrophobicContact CZ3-CB 3.97Å; W382-R422 HydrophobicContact CZ3-CG 3.83Å
383	L	81.9	Confident	69.7	Low	75 Å²	75	104.2 Å²	104.2	39%	0.393	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-78.4	153.7	175.3	-70.8	162.6	0	0	0	110.3	E385 E386 D387 N412	L383-E385 WeakPolarHBondContact CB-OE2 3.36Å; L383-E385 PolarHBondContact O-N 3.47Å; L383-E386 HydrophobicContact CB-CG 4.13Å; L383-E386 PolarHBondContact N-OE2 3.33Å; L383-E386 VanDerWaalsContact N-OE2 3.11Å; L383-E386 WeakPolarHBondContact O-CB 3.3Å; L383-E386 PolarHBondContact O-N 3.16Å; L383-E386 VanDerWaalsContact O-N 3.08Å; L383-D387 PolarHBondContact O-N 3.03Å; L383-D387 VanDerWaalsContact O-N 3.1Å; L383-N412 WeakPolarHBondContact CD1-ND2 3.33Å
384	W	79.5	Confident	72.4	Confident	145 Å²	145	95.8 Å²	95.8	55%	0.549	45%	0.447	S	S	.	.	H	α-helix	trans	-64.2	-32.2	-179.2	72.6	-93.7	0	0	0	111.5	E386 D387 K388	W384-E386 VanDerWaalsContact C-N 3.33Å; W384-D387 PolarHBondContact O-N 2.88Å; W384-K388 HydrophobicContact CE3-CB 4.5Å; W384-K388 HydrophobicContact CE3-CD 4.42Å; W384-K388 HydrophobicContact CZ3-CD 3.8Å; W384-K388 WeakPolarHBondContact O-CB 3.47Å; W384-K388 PolarHBondContact O-N 3.43Å
385	E	83.7	Confident	74.9	Confident	57 Å²	57	96.8 Å²	96.8	27%	0.266	44%	0.443	S	S	.	.	H	α-helix	trans	-64.3	-38.5	174.4	-61.1	87.2	163.6	0	0	111.2	R145 L383 K388 N389	R145-E385 IonicContact NH2-OE1 3.93Å; L383-E385 WeakPolarHBondContact CB-OE2 3.36Å; L383-E385 PolarHBondContact O-N 3.47Å; E385-K388 PolarHBondContact O-N 3.05Å; E385-N389 VanDerWaalsContact O-CB 3.26Å; E385-N389 WeakPolarHBondContact O-CB 3.46Å; E385-N389 PolarHBondContact O-N 3Å; E385-N389 PolarHBondContact O-ND2 3.24Å
386	E	86.1	Confident	77.2	Confident	3 Å²	3	92.4 Å²	92.4	1%	0.014	43%	0.43	C	S	.	.	H	α-helix	trans	-66.1	-42.8	175.7	-64.4	-177.3	120.9	0	0	110.4	W382 L383 W384 N389 L390 F411 N412 R414	W382-E386 HydrophobicContact CE3-CB 3.8Å; W382-E386 HydrophobicContact CZ3-CB 4.17Å; L383-E386 HydrophobicContact CB-CG 4.13Å; L383-E386 PolarHBondContact N-OE2 3.33Å; L383-E386 VanDerWaalsContact N-OE2 3.11Å; L383-E386 WeakPolarHBondContact O-CB 3.3Å; L383-E386 PolarHBondContact O-N 3.16Å; L383-E386 VanDerWaalsContact O-N 3.08Å; W384-E386 VanDerWaalsContact C-N 3.33Å; E386-N389 PolarHBondContact O-N 3.16Å; E386-L390 VanDerWaalsContact O-CB 3.28Å; E386-L390 WeakPolarHBondContact O-CB 3.33Å; E386-L390 PolarHBondContact O-N 2.83Å; E386-F411 HydrophobicContact CB-CD1 4.15Å; E386-F411 HydrophobicContact CG-CD1 4.34Å; E386-F411 WeakPolarHBondContact O-CE1 3.46Å; E386-N412 PolarHBondContact OE1-N 3.18Å; E386-N412 VanDerWaalsContact OE1-N 3.13Å; E386-R414 WeakPolarHBondContact OE1-CG 3.5Å; E386-R414 IonicContact OE1-CZ 3.9Å; E386-R414 IonicContact OE1-NE 2.74Å; E386-R414 PolarHBondContact OE1-NE 3.41Å; E386-R414 IonicContact OE1-NH2 3.41Å; E386-R414 IonicContact OE2-CZ 3.21Å; E386-R414 IonicContact OE2-NE 3.91Å; E386-R414 PolarHBondContact OE2-NE 3.06Å; E386-R414 IonicContact OE2-NH2 3.9Å; E386-R414 PolarHBondContact OE2-NH2 3.09Å
387	D	87.6	Confident	79.6	Confident	13 Å²	13	89.6 Å²	89.6	7%	0.07	40%	0.399	C	S	.	.	H	α-helix	trans	-69.1	-33.6	177.2	-71.2	-17.4	0	0	0	112.7	L383 W384 R391 R422 M426	L383-D387 PolarHBondContact O-N 3.03Å; L383-D387 VanDerWaalsContact O-N 3.1Å; W384-D387 PolarHBondContact O-N 2.88Å; D387-R391 WeakPolarHBondContact O-CB 3.27Å; D387-R391 WeakPolarHBondContact O-CG 3.45Å; D387-R391 PolarHBondContact O-N 3.11Å; D387-R391 PolarHBondContact O-NE 3.47Å; D387-R391 VanDerWaalsContact O-NE 3.16Å; D387-R422 IonicContact OD1-CZ 3.31Å; D387-R422 IonicContact OD1-NE 3.96Å; D387-R422 PolarHBondContact OD1-NE 3.31Å; D387-R422 IonicContact OD1-NH2 3.76Å; D387-R422 PolarHBondContact OD1-NH2 2.84Å; D387-R422 IonicContact OD2-CZ 2.73Å; D387-R422 IonicContact OD2-NE 2.93Å; D387-R422 IonicContact OD2-NH2 3.78Å; D387-R422 PolarHBondContact OD2-NH2 2.71Å; D387-M426 HydrophobicContact CB-CE 4.01Å; D387-M426 HydrophobicContact CB-SD 4.31Å
388	K	87	Confident	81.5	Confident	107 Å²	107	79.6 Å²	79.6	47%	0.465	37%	0.371	S	S	.	.	H	α-helix	trans	-66.1	-49	172.7	-175.7	176	178.1	-179.7	0	110.3	W384 E385 L390 R391 S392	W384-K388 HydrophobicContact CE3-CB 4.5Å; W384-K388 HydrophobicContact CE3-CD 4.42Å; W384-K388 HydrophobicContact CZ3-CD 3.8Å; W384-K388 WeakPolarHBondContact O-CB 3.47Å; W384-K388 PolarHBondContact O-N 3.43Å; E385-K388 PolarHBondContact O-N 3.05Å; K388-L390 VanDerWaalsContact C-N 3.3Å; K388-L390 PolarHBondContact O-N 2.87Å; K388-R391 PolarHBondContact O-N 2.9Å; K388-S392 PolarHBondContact O-N 3.47Å; K388-S392 PolarHBondContact O-OG 3.14Å
389	N	89	Confident	83.3	Confident	42 Å²	42	75 Å²	75	23%	0.225	35%	0.353	C	S	.	.	H	α-helix	trans	-60.7	-39	176.7	-74.5	-11.7	0	0	0	112.1	E385 E386 G393 Y409 K410 F411	E385-N389 VanDerWaalsContact O-CB 3.26Å; E385-N389 WeakPolarHBondContact O-CB 3.46Å; E385-N389 PolarHBondContact O-N 3Å; E385-N389 PolarHBondContact O-ND2 3.24Å; E386-N389 PolarHBondContact O-N 3.16Å; N389-G393 WeakPolarHBondContact O-CA 3.47Å; N389-G393 PolarHBondContact O-N 3.03Å; N389-Y409 HydrophobicContact CB-CD1 3.97Å; N389-Y409 HydrophobicContact CB-CG 4.23Å; N389-K410 PolarHBondContact ND2-O 2.92Å; N389-F411 HydrophobicContact CB-CE1 3.88Å; N389-F411 HydrophobicContact CB-CZ 3.89Å
390	L	89.4	Confident	84.8	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-66.7	-43.7	176.5	-173.4	57.7	0	0	0	111.6	E386 K388 G393 V394 W402 I405 F411 L419 R422 W423 M426	E386-L390 VanDerWaalsContact O-CB 3.28Å; E386-L390 WeakPolarHBondContact O-CB 3.33Å; E386-L390 PolarHBondContact O-N 2.83Å; K388-L390 VanDerWaalsContact C-N 3.3Å; K388-L390 PolarHBondContact O-N 2.87Å; L390-G393 PolarHBondContact O-N 3.3Å; L390-V394 HydrophobicContact CD1-CG2 4.3Å; L390-V394 WeakPolarHBondContact O-CG2 3.25Å; L390-V394 PolarHBondContact O-N 2.97Å; L390-W402 HydrophobicContact CD1-CE3 4.27Å; L390-W402 HydrophobicContact CD1-CZ3 3.97Å; L390-I405 HydrophobicContact CD1-CG2 4.37Å; L390-F411 HydrophobicContact CB-CE1 4.11Å; L390-F411 HydrophobicContact CB-CZ 4.34Å; L390-L419 HydrophobicContact CD1-CB 3.91Å; L390-L419 HydrophobicContact CD1-CD2 4.04Å; L390-L419 HydrophobicContact CD1-CG 3.87Å; L390-R422 HydrophobicContact CD2-CB 3.89Å; L390-R422 HydrophobicContact CD2-CG 3.77Å; L390-W423 HydrophobicContact CD2-CB 4.31Å; L390-W423 HydrophobicContact CD2-CE3 4.23Å; L390-W423 HydrophobicContact CG-CE3 3.94Å; L390-M426 HydrophobicContact CD2-SD 4.02Å
391	R	88.6	Confident	86	Confident	85 Å²	85	66.1 Å²	66.1	32%	0.321	33%	0.329	S	S	.	.	H	α-helix	trans	-60.7	-48.9	173.8	-83.5	177.4	-81.9	-130.2	3.4	112.4	D387 K388 G393 V394 R395 W423 M426 L431	D387-R391 WeakPolarHBondContact O-CB 3.27Å; D387-R391 WeakPolarHBondContact O-CG 3.45Å; D387-R391 PolarHBondContact O-N 3.11Å; D387-R391 PolarHBondContact O-NE 3.47Å; D387-R391 VanDerWaalsContact O-NE 3.16Å; K388-R391 PolarHBondContact O-N 2.9Å; R391-G393 VanDerWaalsContact C-N 3.28Å; R391-G393 PolarHBondContact O-N 3.24Å; R391-V394 PolarHBondContact O-N 3.28Å; R391-R395 WeakPolarHBondContact O-CB 3.35Å; R391-R395 PolarHBondContact O-N 3.44Å; R391-W423 HydrophobicContact CB-CZ3 4.44Å; R391-W423 HydrophobicContact CG-CH2 4.3Å; R391-W423 HydrophobicContact CG-CZ3 3.78Å; R391-M426 HydrophobicContact CG-CE 3.71Å; R391-M426 VanDerWaalsContact NH1-CE 3.25Å; R391-L431 PolarHBondContact NH1-O 2.94Å
392	S	87	Confident	86.7	Confident	46 Å²	46	63.5 Å²	63.5	32%	0.322	30%	0.302	S	S	.	.	H	α-helix	trans	-62.9	-37.4	176.2	-64.4	0	0	0	0	111.9	K388 K396 Y409	K388-S392 PolarHBondContact O-N 3.47Å; K388-S392 PolarHBondContact O-OG 3.14Å; S392-K396 VanDerWaalsContact O-CB 3.25Å; S392-K396 WeakPolarHBondContact O-CB 3.48Å; S392-K396 PolarHBondContact O-N 3.33Å; S392-Y409 PolarHBondContact O-OH 3.31Å
393	G	88.7	Confident	87	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.7	-46.9	176.9	0	0	0	0	0	113.3	N389 L390 R391 K396 Y397	N389-G393 WeakPolarHBondContact O-CA 3.47Å; N389-G393 PolarHBondContact O-N 3.03Å; L390-G393 PolarHBondContact O-N 3.3Å; R391-G393 VanDerWaalsContact C-N 3.28Å; R391-G393 PolarHBondContact O-N 3.24Å; G393-K396 PolarHBondContact O-N 2.94Å; G393-Y397 WeakPolarHBondContact O-CB 3.38Å; G393-Y397 WeakPolarHBondContact O-CD2 3.43Å; G393-Y397 PolarHBondContact O-N 3.42Å
394	V	90.2	Very high	87.3	Confident	13 Å²	13	66.8 Å²	66.8	8%	0.079	33%	0.325	C	S	.	.	H	α-helix	trans	-67.8	-37.6	176.8	176.4	0	0	0	0	111.2	L390 R391 K396 G398 E399 W402 I405 W423	L390-V394 HydrophobicContact CD1-CG2 4.3Å; L390-V394 WeakPolarHBondContact O-CG2 3.25Å; L390-V394 PolarHBondContact O-N 2.97Å; R391-V394 PolarHBondContact O-N 3.28Å; V394-K396 VanDerWaalsContact C-N 3.33Å; V394-K396 PolarHBondContact O-N 3.43Å; V394-G398 CarbonylContact O-C 3.41Å; V394-G398 WeakPolarHBondContact O-CA 3.42Å; V394-G398 PolarHBondContact O-N 2.97Å; V394-E399 HydrophobicContact CG1-CB 3.99Å; V394-W402 HydrophobicContact CG2-CH2 3.91Å; V394-W402 HydrophobicContact CG2-CZ3 3.49Å; V394-W402 VanDerWaalsContact CG2-CZ3 3.49Å; V394-I405 HydrophobicContact CG2-CD1 3.86Å; V394-W423 HydrophobicContact CB-CD2 4.45Å; V394-W423 HydrophobicContact CB-CE3 4.38Å; V394-W423 HydrophobicContact CB-CH2 3.67Å; V394-W423 HydrophobicContact CB-CZ2 3.75Å; V394-W423 HydrophobicContact CB-CZ3 4.01Å; V394-W423 HydrophobicContact CG1-CD2 4.45Å; V394-W423 HydrophobicContact CG1-CH2 3.75Å; V394-W423 HydrophobicContact CG1-CZ2 3.3Å; V394-W423 HydrophobicContact CG1-CZ3 4.48Å; V394-W423 HydrophobicContact CG2-CD2 3.83Å; V394-W423 HydrophobicContact CG2-CE3 3.85Å; V394-W423 HydrophobicContact CG2-CG 4.46Å; V394-W423 HydrophobicContact CG2-CH2 4.06Å; V394-W423 HydrophobicContact CG2-CZ2 4.06Å; V394-W423 HydrophobicContact CG2-CZ3 3.95Å
395	R	87.3	Confident	87.8	Confident	224 Å²	224	59.9 Å²	59.9	85%	0.845	30%	0.299	S	S	*	.	H	α-helix	trans	-61.5	-40.2	173.9	-173.9	-178	-66.8	178.9	-3.7	112.3	R391	R391-R395 WeakPolarHBondContact O-CB 3.35Å; R391-R395 PolarHBondContact O-N 3.44Å
396	K	85.4	Confident	88	Confident	141 Å²	141	59.7 Å²	59.7	61%	0.613	30%	0.3	S	S	*	.	H	α-helix	trans	-85	-37.8	-174.8	-173.5	174.4	-178.3	179.5	0	113.8	S392 G393 V394	S392-K396 VanDerWaalsContact O-CB 3.25Å; S392-K396 WeakPolarHBondContact O-CB 3.48Å; S392-K396 PolarHBondContact O-N 3.33Å; G393-K396 PolarHBondContact O-N 2.94Å; V394-K396 VanDerWaalsContact C-N 3.33Å; V394-K396 PolarHBondContact O-N 3.43Å
397	Y	88.9	Confident	88.1	Confident	37 Å²	37	66.6 Å²	66.6	15%	0.145	34%	0.336	C	S	.	.	H	α-helix	trans	-110.2	-6.8	-173.5	-62.4	-72.1	0	0	0	113.3	G393 N401 K404 I405 H408 Y409	G393-Y397 WeakPolarHBondContact O-CB 3.38Å; G393-Y397 WeakPolarHBondContact O-CD2 3.43Å; G393-Y397 PolarHBondContact O-N 3.42Å; Y397-N401 PolarHBondContact O-ND2 2.84Å; Y397-K404 HydrophobicContact CD1-CD 3.64Å; Y397-K404 HydrophobicContact CD1-CG 3.88Å; Y397-K404 HydrophobicContact CE1-CD 4.05Å; Y397-K404 HydrophobicContact CE1-CG 4.1Å; Y397-K404 HydrophobicContact CG-CD 4.36Å; Y397-K404 HydrophobicContact CG-CG 4.31Å; Y397-I405 HydrophobicContact CD2-CG1 3.99Å; Y397-I405 HydrophobicContact CG-CG1 4.37Å; Y397-H408 AromaticContact CE1-CD2 3.9Å; Y397-H408 HydrophobicContact CE2-CB 3.85Å; Y397-H408 AromaticContact CZ-CD2 3.44Å; Y397-H408 VanDerWaalsContact CZ-CD2 3.44Å; Y397-H408 AromaticContact CZ-CG 3.67Å; Y397-H408 AromaticContact CZ-NE2 3.93Å; Y397-H408 PolarHBondContact OH-CD2 2.82Å; Y397-H408 PolarHBondContact OH-ND1 3.26Å; Y397-H408 PolarHBondContact OH-NE2 3.48Å; Y397-Y409 HydrophobicContact CD2-CE2 4.12Å; Y397-Y409 AromaticContact CE2-CE2 3.73Å; Y397-Y409 HydrophobicContact CE2-CE2 3.73Å
398	G	87.1	Confident	88	Confident	33 Å²	33	71 Å²	71	34%	0.34	36%	0.355	S	S	.	.			trans	82.1	155.7	-175.9	0	0	0	0	0	113.3	V394	V394-G398 CarbonylContact O-C 3.41Å; V394-G398 WeakPolarHBondContact O-CA 3.42Å; V394-G398 PolarHBondContact O-N 2.97Å
399	E	88.6	Confident	87.9	Confident	103 Å²	103	68.2 Å²	68.2	48%	0.481	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	135.2	176.5	-177.4	167.4	174.9	0	0	110.8	V394 W402 W423 K427	V394-E399 HydrophobicContact CG1-CB 3.99Å; E399-W402 HydrophobicContact CG-CH2 3.97Å; E399-W402 HydrophobicContact CG-CZ2 3.86Å; E399-W423 PolarHBondContact OE1-NE1 2.9Å; E399-W423 PolarHBondContact OE2-NE1 3.13Å; E399-W423 VanDerWaalsContact OE2-NE1 3.17Å; E399-K427 IonicContact OE1-NZ 2.57Å; E399-K427 PolarHBondContact OE1-NZ 3.36Å; E399-K427 WeakPolarHBondContact OE2-CE 3.49Å; E399-K427 IonicContact OE2-NZ 3.65Å; E399-K427 PolarHBondContact OE2-NZ 2.71Å
400	G	83.6	Confident	87.8	Confident	43 Å²	43	75 Å²	75	44%	0.443	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.2	-22	-176.5	0	0	0	0	0	114.2	W402	G400-W402 VanDerWaalsContact O-CD1 3.28Å; G400-W402 PolarHBondContact O-N 3.42Å
401	N	89.4	Confident	87.5	Confident	86 Å²	86	76 Å²	76	46%	0.46	37%	0.374	S	S	.	.			trans	-85.1	44.9	-178.6	-74.1	-34.5	0	0	0	113.6	Y397 S403 K404 I405	Y397-N401 PolarHBondContact O-ND2 2.84Å; N401-S403 PolarHBondContact O-N 3.06Å; N401-K404 HydrophobicContact CB-CB 4.41Å; N401-K404 WeakPolarHBondContact O-CB 3.48Å; N401-K404 PolarHBondContact O-N 3.25Å; N401-K404 VanDerWaalsContact O-N 3.11Å; N401-I405 WeakPolarHBondContact O-CG1 3.44Å; N401-I405 PolarHBondContact O-N 3.43Å
402	W	91.3	Very high	87.1	Confident	28 Å²	28	76 Å²	76	11%	0.106	38%	0.381	C	S	.	.	H	α-helix	trans	-60.6	-39.4	-170.8	-49.5	115.3	0	0	0	114.1	L390 V394 E399 G400 K404 I405 L406 S416 L419 K420 W423	L390-W402 HydrophobicContact CD1-CE3 4.27Å; L390-W402 HydrophobicContact CD1-CZ3 3.97Å; V394-W402 HydrophobicContact CG2-CH2 3.91Å; V394-W402 HydrophobicContact CG2-CZ3 3.49Å; V394-W402 VanDerWaalsContact CG2-CZ3 3.49Å; E399-W402 HydrophobicContact CG-CH2 3.97Å; E399-W402 HydrophobicContact CG-CZ2 3.86Å; G400-W402 VanDerWaalsContact O-CD1 3.28Å; G400-W402 PolarHBondContact O-N 3.42Å; W402-K404 VanDerWaalsContact C-N 3.33Å; W402-I405 HydrophobicContact CE3-CD1 4.08Å; W402-I405 HydrophobicContact CZ3-CD1 4.27Å; W402-I405 PolarHBondContact O-N 2.93Å; W402-L406 VanDerWaalsContact O-CB 3.28Å; W402-L406 WeakPolarHBondContact O-CB 3.3Å; W402-L406 PolarHBondContact O-N 3.42Å; W402-S416 WeakPolarHBondContact CB-O 3.48Å; W402-L419 HydrophobicContact CE3-CB 4.13Å; W402-K420 HydrophobicContact CD2-CB 4.06Å; W402-K420 HydrophobicContact CG-CB 4.17Å; W402-K420 HydrophobicContact CZ2-CB 4.37Å; W402-K420 HydrophobicContact CZ2-CG 4.31Å; W402-W423 HydrophobicContact CH2-CB 3.62Å; W402-W423 AromaticContact CH2-CD1 3.52Å; W402-W423 HydrophobicContact CH2-CD2 4.31Å; W402-W423 AromaticContact CH2-CG 3.54Å; W402-W423 HydrophobicContact CH2-CG 3.54Å; W402-W423 HydrophobicContact CZ2-CB 4.48Å; W402-W423 HydrophobicContact CZ3-CB 3.96Å; W402-W423 HydrophobicContact CZ3-CG 4.1Å
403	S	87.8	Confident	86.8	Confident	86 Å²	86	81.3 Å²	81.3	60%	0.601	41%	0.406	S	S	*	.	H	α-helix	trans	-67.1	-35.9	178.4	-55.6	0	0	0	0	111.9	N401 L407	N401-S403 PolarHBondContact O-N 3.06Å; S403-L407 PolarHBondContact O-N 2.9Å; S403-L407 VanDerWaalsContact O-N 3.16Å
404	K	86.3	Confident	86.6	Confident	111 Å²	111	82 Å²	82	48%	0.483	41%	0.408	S	S	.	.	H	α-helix	trans	-71.8	-39.9	176.7	-166.5	169.6	-173.4	177.1	0	111	Y397 N401 W402 L407 H408	Y397-K404 HydrophobicContact CD1-CD 3.64Å; Y397-K404 HydrophobicContact CD1-CG 3.88Å; Y397-K404 HydrophobicContact CE1-CD 4.05Å; Y397-K404 HydrophobicContact CE1-CG 4.1Å; Y397-K404 HydrophobicContact CG-CD 4.36Å; Y397-K404 HydrophobicContact CG-CG 4.31Å; N401-K404 HydrophobicContact CB-CB 4.41Å; N401-K404 WeakPolarHBondContact O-CB 3.48Å; N401-K404 PolarHBondContact O-N 3.25Å; N401-K404 VanDerWaalsContact O-N 3.11Å; W402-K404 VanDerWaalsContact C-N 3.33Å; K404-L407 PolarHBondContact O-N 3.19Å; K404-H408 PolarHBondContact O-CD2 2.85Å; K404-H408 VanDerWaalsContact O-CD2 3.29Å; K404-H408 PolarHBondContact O-N 3.48Å; K404-H408 VanDerWaalsContact O-N 3.12Å
405	I	90.4	Very high	86.6	Confident	0 Å²	0	84.6 Å²	84.6	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-64	-45.7	174.7	-65.3	165	0	0	0	110.6	L390 V394 Y397 N401 W402 L407 H408 Y409 F411 L419	L390-I405 HydrophobicContact CD1-CG2 4.37Å; V394-I405 HydrophobicContact CG2-CD1 3.86Å; Y397-I405 HydrophobicContact CD2-CG1 3.99Å; Y397-I405 HydrophobicContact CG-CG1 4.37Å; N401-I405 WeakPolarHBondContact O-CG1 3.44Å; N401-I405 PolarHBondContact O-N 3.43Å; W402-I405 HydrophobicContact CE3-CD1 4.08Å; W402-I405 HydrophobicContact CZ3-CD1 4.27Å; W402-I405 PolarHBondContact O-N 2.93Å; I405-L407 VanDerWaalsContact C-N 3.25Å; I405-L407 PolarHBondContact O-N 3.07Å; I405-H408 PolarHBondContact O-N 3.24Å; I405-Y409 HydrophobicContact CG2-CD2 4.08Å; I405-Y409 WeakPolarHBondContact O-CD2 3.45Å; I405-Y409 PolarHBondContact O-N 2.96Å; I405-F411 HydrophobicContact CG2-CE2 3.87Å; I405-F411 HydrophobicContact CG2-CZ 3.89Å; I405-L419 HydrophobicContact CB-CD2 4.38Å; I405-L419 HydrophobicContact CG2-CD2 3.9Å
406	L	89	Confident	86.6	Confident	53 Å²	53	75.7 Å²	75.7	28%	0.277	40%	0.396	S	S	.	.	H	α-helix	trans	-60.1	-34.9	178	-178.9	62.6	0	0	0	112.7	W402 Y409 F411 R414 L419	W402-L406 VanDerWaalsContact O-CB 3.28Å; W402-L406 WeakPolarHBondContact O-CB 3.3Å; W402-L406 PolarHBondContact O-N 3.42Å; L406-Y409 VanDerWaalsContact O-O 3.08Å; L406-F411 HydrophobicContact CD1-CB 4.03Å; L406-F411 HydrophobicContact CD1-CD2 3.8Å; L406-F411 HydrophobicContact CD1-CG 4.26Å; L406-R414 VanDerWaalsContact CD1-O 3.28Å; L406-R414 WeakPolarHBondContact CD1-O 3.5Å; L406-L419 HydrophobicContact CB-CD2 4.15Å; L406-L419 HydrophobicContact CD1-CD1 4.23Å
407	L	87.7	Confident	86.6	Confident	147 Å²	147	73.1 Å²	73.1	77%	0.77	39%	0.392	S	S	*	.	H	α-helix	trans	-75.3	-35.6	178.7	-172.7	65.7	0	0	0	112.7	S403 K404 I405	S403-L407 PolarHBondContact O-N 2.9Å; S403-L407 VanDerWaalsContact O-N 3.16Å; K404-L407 PolarHBondContact O-N 3.19Å; I405-L407 VanDerWaalsContact C-N 3.25Å; I405-L407 PolarHBondContact O-N 3.07Å
408	H	85	Confident	86.6	Confident	105 Å²	105	74.6 Å²	74.6	49%	0.486	40%	0.401	S	S	.	.	H	α-helix	trans	-89.4	-15.6	-174.5	-83.4	-71.7	0	0	0	114.8	Y397 K404 I405	Y397-H408 AromaticContact CE1-CD2 3.9Å; Y397-H408 HydrophobicContact CE2-CB 3.85Å; Y397-H408 AromaticContact CZ-CD2 3.44Å; Y397-H408 VanDerWaalsContact CZ-CD2 3.44Å; Y397-H408 AromaticContact CZ-CG 3.67Å; Y397-H408 AromaticContact CZ-NE2 3.93Å; Y397-H408 PolarHBondContact OH-CD2 2.82Å; Y397-H408 PolarHBondContact OH-ND1 3.26Å; Y397-H408 PolarHBondContact OH-NE2 3.48Å; K404-H408 PolarHBondContact O-CD2 2.85Å; K404-H408 VanDerWaalsContact O-CD2 3.29Å; K404-H408 PolarHBondContact O-N 3.48Å; K404-H408 VanDerWaalsContact O-N 3.12Å; I405-H408 PolarHBondContact O-N 3.24Å
409	Y	86.2	Confident	86.8	Confident	50 Å²	50	73 Å²	73	20%	0.196	39%	0.385	C	S	.	.	S	Bend	trans	-126.2	151.2	179.6	-64.4	-93	0	0	0	111.2	N389 S392 Y397 I405 L406 F411	N389-Y409 HydrophobicContact CB-CD1 3.97Å; N389-Y409 HydrophobicContact CB-CG 4.23Å; S392-Y409 PolarHBondContact O-OH 3.31Å; Y397-Y409 HydrophobicContact CD2-CE2 4.12Å; Y397-Y409 AromaticContact CE2-CE2 3.73Å; Y397-Y409 HydrophobicContact CE2-CE2 3.73Å; I405-Y409 HydrophobicContact CG2-CD2 4.08Å; I405-Y409 WeakPolarHBondContact O-CD2 3.45Å; I405-Y409 PolarHBondContact O-N 2.96Å; L406-Y409 VanDerWaalsContact O-O 3.08Å; Y409-F411 WeakPolarHBondContact O-CD2 3.38Å; Y409-F411 PolarHBondContact O-N 3.04Å
410	K	85.1	Confident	86.9	Confident	184 Å²	184	72.1 Å²	72.1	80%	0.8	38%	0.379	S	S	*	.			trans	-78.6	117.9	177.3	-67.3	-175.5	179	178.9	0	109.7	N389	N389-K410 PolarHBondContact ND2-O 2.92Å
411	F	83.9	Confident	87	Confident	20 Å²	20	74 Å²	74	9%	0.088	38%	0.379	C	S	.	.			trans	-124.6	133.3	169.5	-61.3	-83.1	0	0	0	109	E386 N389 L390 I405 L406 Y409 N413 R414 L419	E386-F411 HydrophobicContact CB-CD1 4.15Å; E386-F411 HydrophobicContact CG-CD1 4.34Å; E386-F411 WeakPolarHBondContact O-CE1 3.46Å; N389-F411 HydrophobicContact CB-CE1 3.88Å; N389-F411 HydrophobicContact CB-CZ 3.89Å; L390-F411 HydrophobicContact CB-CE1 4.11Å; L390-F411 HydrophobicContact CB-CZ 4.34Å; I405-F411 HydrophobicContact CG2-CE2 3.87Å; I405-F411 HydrophobicContact CG2-CZ 3.89Å; L406-F411 HydrophobicContact CD1-CB 4.03Å; L406-F411 HydrophobicContact CD1-CD2 3.8Å; L406-F411 HydrophobicContact CD1-CG 4.26Å; Y409-F411 WeakPolarHBondContact O-CD2 3.38Å; Y409-F411 PolarHBondContact O-N 3.04Å; F411-N413 VanDerWaalsContact C-N 3.33Å; F411-N413 PolarHBondContact O-N 3.37Å; F411-R414 HydrophobicContact CB-CB 3.79Å; F411-R414 HydrophobicContact CB-CG 3.9Å; F411-L419 HydrophobicContact CD1-CD1 4.22Å; F411-L419 HydrophobicContact CD1-CG 4.47Å; F411-L419 HydrophobicContact CD2-CD1 4.39Å; F411-L419 HydrophobicContact CD2-CD2 4.04Å; F411-L419 HydrophobicContact CE1-CD2 4.29Å; F411-L419 HydrophobicContact CE1-CG 4.29Å; F411-L419 HydrophobicContact CE2-CD2 3.62Å; F411-L419 HydrophobicContact CE2-CG 4.42Å; F411-L419 HydrophobicContact CG-CD1 4.14Å; F411-L419 HydrophobicContact CZ-CD2 3.78Å; F411-L419 HydrophobicContact CZ-CG 4.27Å
412	N	80.6	Confident	87	Confident	86 Å²	86	72 Å²	72	46%	0.46	37%	0.365	S	S	.	.	S	Bend	trans	-75.3	82.9	-168.9	-74.1	-32.9	0	0	0	111.2	Q380 L383 E386 R414	Q380-N412 PolarHBondContact NE2-O 2.85Å; L383-N412 WeakPolarHBondContact CD1-ND2 3.33Å; E386-N412 PolarHBondContact OE1-N 3.18Å; E386-N412 VanDerWaalsContact OE1-N 3.13Å; N412-R414 PolarHBondContact O-N 3.49Å
413	N	81.3	Confident	86.9	Confident	158 Å²	158	71.4 Å²	71.4	85%	0.845	36%	0.363	S	S	*	.	S	Bend	trans	58.2	29.9	-175.8	-59	-40.6	0	0	0	113.9	F411	F411-N413 VanDerWaalsContact C-N 3.33Å; F411-N413 PolarHBondContact O-N 3.37Å
414	R	84.6	Confident	86.9	Confident	13 Å²	13	74.5 Å²	74.5	5%	0.049	36%	0.362	C	S	.	.			trans	-82.2	154.1	175.9	-55.8	-64	-173.5	166.3	4.5	111	Q380 A381 W382 E386 L406 F411 N412 M418 L419	Q380-R414 PolarHBondContact O-NH1 3.33Å; Q380-R414 PolarHBondContact O-NH2 2.76Å; A381-R414 PolarHBondContact O-NH2 3.43Å; W382-R414 HydrophobicContact CH2-CG 4.26Å; W382-R414 HydrophobicContact CZ3-CG 4.43Å; E386-R414 WeakPolarHBondContact OE1-CG 3.5Å; E386-R414 IonicContact OE1-CZ 3.9Å; E386-R414 IonicContact OE1-NE 2.74Å; E386-R414 PolarHBondContact OE1-NE 3.41Å; E386-R414 IonicContact OE1-NH2 3.41Å; E386-R414 IonicContact OE2-CZ 3.21Å; E386-R414 IonicContact OE2-NE 3.91Å; E386-R414 PolarHBondContact OE2-NE 3.06Å; E386-R414 IonicContact OE2-NH2 3.9Å; E386-R414 PolarHBondContact OE2-NH2 3.09Å; L406-R414 VanDerWaalsContact CD1-O 3.28Å; L406-R414 WeakPolarHBondContact CD1-O 3.5Å; F411-R414 HydrophobicContact CB-CB 3.79Å; F411-R414 HydrophobicContact CB-CG 3.9Å; N412-R414 PolarHBondContact O-N 3.49Å; R414-M418 HydrophobicContact CB-CB 4.49Å; R414-M418 HydrophobicContact CB-SD 4.46Å; R414-M418 VanDerWaalsContact NH1-CE 3.35Å; R414-L419 HydrophobicContact CB-CD1 3.69Å
415	T	89.4	Confident	86.9	Confident	69 Å²	69	72.1 Å²	72.1	42%	0.423	36%	0.356	S	S	.	.			trans	-105.1	161.4	174.5	66.1	0	0	0	0	111.2	V417 M418 L419	T415-V417 PolarHBondContact O-N 3.18Å; T415-M418 WeakPolarHBondContact O-CB 3.37Å; T415-M418 PolarHBondContact O-N 3.48Å; T415-M418 WeakPolarHBondContact OG1-CG 3.48Å; T415-M418 PolarHBondContact OG1-N 3.33Å; T415-L419 WeakPolarHBondContact O-CD1 3.47Å; T415-L419 PolarHBondContact O-N 3.32Å; T415-L419 VanDerWaalsContact O-N 3.12Å
416	S	86.4	Confident	86.6	Confident	36 Å²	36	72.1 Å²	72.1	25%	0.252	36%	0.356	S	S	.	.	H	α-helix	trans	-56.7	-32.9	178.5	54.4	0	0	0	0	112.4	W402 L419 K420	W402-S416 WeakPolarHBondContact CB-O 3.48Å; S416-L419 PolarHBondContact O-N 2.97Å; S416-K420 PolarHBondContact O-N 3.38Å
417	V	87.1	Confident	86.3	Confident	88 Å²	88	74.3 Å²	74.3	53%	0.533	36%	0.364	S	S	.	.	H	α-helix	trans	-66.2	-42.2	173.9	-177.8	0	0	0	0	111.5	T415 L419 K420 D421	T415-V417 PolarHBondContact O-N 3.18Å; V417-L419 VanDerWaalsContact C-N 3.33Å; V417-L419 PolarHBondContact O-N 2.99Å; V417-K420 WeakPolarHBondContact O-CB 3.36Å; V417-K420 PolarHBondContact O-N 3.23Å; V417-D421 PolarHBondContact O-N 3.47Å
418	M	88.7	Confident	85.9	Confident	68 Å²	68	76.1 Å²	76.1	34%	0.335	37%	0.365	S	S	.	.	H	α-helix	trans	-64.3	-38.2	177.7	-65.7	174.9	85	0	0	111.9	W382 R414 T415 D421 R422	W382-M418 HydrophobicContact CH2-CB 4.31Å; W382-M418 HydrophobicContact CZ2-CB 3.97Å; W382-M418 WeakPolarHBondContact CZ2-O 3.38Å; R414-M418 HydrophobicContact CB-CB 4.49Å; R414-M418 HydrophobicContact CB-SD 4.46Å; R414-M418 VanDerWaalsContact NH1-CE 3.35Å; T415-M418 WeakPolarHBondContact O-CB 3.37Å; T415-M418 PolarHBondContact O-N 3.48Å; T415-M418 WeakPolarHBondContact OG1-CG 3.48Å; T415-M418 PolarHBondContact OG1-N 3.33Å; M418-D421 PolarHBondContact O-N 2.93Å; M418-R422 WeakPolarHBondContact O-CB 3.14Å; M418-R422 PolarHBondContact O-N 3.13Å
419	L	89.8	Confident	85.4	Confident	0 Å²	0	76 Å²	76	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-61.8	-43.7	175	-86.7	65.9	0	0	0	111.4	W382 L390 W402 I405 L406 F411 R414 T415 S416 V417 R422 W423	W382-L419 HydrophobicContact CH2-CD1 4.12Å; W382-L419 HydrophobicContact CH2-CG 4.47Å; L390-L419 HydrophobicContact CD1-CB 3.91Å; L390-L419 HydrophobicContact CD1-CD2 4.04Å; L390-L419 HydrophobicContact CD1-CG 3.87Å; W402-L419 HydrophobicContact CE3-CB 4.13Å; I405-L419 HydrophobicContact CB-CD2 4.38Å; I405-L419 HydrophobicContact CG2-CD2 3.9Å; L406-L419 HydrophobicContact CB-CD2 4.15Å; L406-L419 HydrophobicContact CD1-CD1 4.23Å; F411-L419 HydrophobicContact CD1-CD1 4.22Å; F411-L419 HydrophobicContact CD1-CG 4.47Å; F411-L419 HydrophobicContact CD2-CD1 4.39Å; F411-L419 HydrophobicContact CD2-CD2 4.04Å; F411-L419 HydrophobicContact CE1-CD2 4.29Å; F411-L419 HydrophobicContact CE1-CG 4.29Å; F411-L419 HydrophobicContact CE2-CD2 3.62Å; F411-L419 HydrophobicContact CE2-CG 4.42Å; F411-L419 HydrophobicContact CG-CD1 4.14Å; F411-L419 HydrophobicContact CZ-CD2 3.78Å; F411-L419 HydrophobicContact CZ-CG 4.27Å; R414-L419 HydrophobicContact CB-CD1 3.69Å; T415-L419 WeakPolarHBondContact O-CD1 3.47Å; T415-L419 PolarHBondContact O-N 3.32Å; T415-L419 VanDerWaalsContact O-N 3.12Å; S416-L419 PolarHBondContact O-N 2.97Å; V417-L419 VanDerWaalsContact C-N 3.33Å; V417-L419 PolarHBondContact O-N 2.99Å; L419-R422 PolarHBondContact O-N 3.17Å; L419-W423 WeakPolarHBondContact O-CB 3.26Å; L419-W423 PolarHBondContact O-N 3.14Å
420	K	90.8	Very high	84.7	Confident	83 Å²	83	82.7 Å²	82.7	36%	0.361	40%	0.398	S	S	.	.	H	α-helix	trans	-59.4	-48.9	176	-179.7	-174.9	173.9	-177.2	0	111.8	W402 S416 V417 R422 W423 R424	W402-K420 HydrophobicContact CD2-CB 4.06Å; W402-K420 HydrophobicContact CG-CB 4.17Å; W402-K420 HydrophobicContact CZ2-CB 4.37Å; W402-K420 HydrophobicContact CZ2-CG 4.31Å; S416-K420 PolarHBondContact O-N 3.38Å; V417-K420 WeakPolarHBondContact O-CB 3.36Å; V417-K420 PolarHBondContact O-N 3.23Å; K420-R422 VanDerWaalsContact C-N 3.33Å; K420-R422 PolarHBondContact O-N 2.94Å; K420-W423 PolarHBondContact O-N 3.25Å; K420-R424 WeakPolarHBondContact O-CG 3.49Å; K420-R424 PolarHBondContact O-N 3.49Å; K420-R424 VanDerWaalsContact O-N 3.09Å
421	D	86.3	Confident	83.6	Confident	82 Å²	82	77.8 Å²	77.8	44%	0.439	38%	0.38	S	S	.	.	H	α-helix	trans	-69.3	-33.2	-178.3	-74.1	-18.9	0	0	0	112.2	V417 M418 T425	V417-D421 PolarHBondContact O-N 3.47Å; M418-D421 PolarHBondContact O-N 2.93Å; D421-T425 PolarHBondContact O-N 3.47Å; D421-T425 PolarHBondContact O-OG1 3.09Å
422	R	89.2	Confident	82.3	Confident	45 Å²	45	78.6 Å²	78.6	17%	0.17	39%	0.385	C	S	.	.	H	α-helix	trans	-65.8	-45.1	171.5	-176.7	58.3	169.6	177.9	1.9	112.1	W382 D387 L390 M418 L419 K420 R424 T425 M426	W382-R422 VanDerWaalsContact CB-CZ 3.42Å; W382-R422 HydrophobicContact CD2-CB 3.96Å; W382-R422 HydrophobicContact CD2-CG 3.48Å; W382-R422 VanDerWaalsContact CD2-CG 3.48Å; W382-R422 HydrophobicContact CE3-CB 4.16Å; W382-R422 HydrophobicContact CE3-CG 3.6Å; W382-R422 HydrophobicContact CG-CG 4.05Å; W382-R422 VanDerWaalsContact CG-NE 3.28Å; W382-R422 HydrophobicContact CH2-CB 3.56Å; W382-R422 HydrophobicContact CH2-CG 3.96Å; W382-R422 HydrophobicContact CZ2-CB 3.33Å; W382-R422 HydrophobicContact CZ2-CG 3.87Å; W382-R422 HydrophobicContact CZ3-CB 3.97Å; W382-R422 HydrophobicContact CZ3-CG 3.83Å; D387-R422 IonicContact OD1-CZ 3.31Å; D387-R422 IonicContact OD1-NE 3.96Å; D387-R422 PolarHBondContact OD1-NE 3.31Å; D387-R422 IonicContact OD1-NH2 3.76Å; D387-R422 PolarHBondContact OD1-NH2 2.84Å; D387-R422 IonicContact OD2-CZ 2.73Å; D387-R422 IonicContact OD2-NE 2.93Å; D387-R422 IonicContact OD2-NH2 3.78Å; D387-R422 PolarHBondContact OD2-NH2 2.71Å; L390-R422 HydrophobicContact CD2-CB 3.89Å; L390-R422 HydrophobicContact CD2-CG 3.77Å; M418-R422 WeakPolarHBondContact O-CB 3.14Å; M418-R422 PolarHBondContact O-N 3.13Å; L419-R422 PolarHBondContact O-N 3.17Å; K420-R422 VanDerWaalsContact C-N 3.33Å; K420-R422 PolarHBondContact O-N 2.94Å; R422-R424 VanDerWaalsContact C-N 3.29Å; R422-R424 PolarHBondContact O-N 3Å; R422-T425 CarbonylContact O-C 3.54Å; R422-T425 WeakPolarHBondContact O-CA 3.38Å; R422-T425 WeakPolarHBondContact O-CB 3.49Å; R422-T425 PolarHBondContact O-N 3.34Å; R422-M426 HydrophobicContact CG-CG 4.27Å; R422-M426 HydrophobicContact CG-SD 4.04Å; R422-M426 WeakPolarHBondContact O-CG 3.33Å; R422-M426 PolarHBondContact O-N 3.33Å
423	W	89.4	Confident	80.5	Confident	15 Å²	15	79.6 Å²	79.6	6%	0.057	40%	0.398	C	S	.	.	H	α-helix	trans	-58.3	-42.7	177.6	-171.2	-111.3	0	0	0	111.9	L390 R391 V394 E399 W402 L419 K420 T425 M426 K427 I432	L390-W423 HydrophobicContact CD2-CB 4.31Å; L390-W423 HydrophobicContact CD2-CE3 4.23Å; L390-W423 HydrophobicContact CG-CE3 3.94Å; R391-W423 HydrophobicContact CB-CZ3 4.44Å; R391-W423 HydrophobicContact CG-CH2 4.3Å; R391-W423 HydrophobicContact CG-CZ3 3.78Å; V394-W423 HydrophobicContact CB-CD2 4.45Å; V394-W423 HydrophobicContact CB-CE3 4.38Å; V394-W423 HydrophobicContact CB-CH2 3.67Å; V394-W423 HydrophobicContact CB-CZ2 3.75Å; V394-W423 HydrophobicContact CB-CZ3 4.01Å; V394-W423 HydrophobicContact CG1-CD2 4.45Å; V394-W423 HydrophobicContact CG1-CH2 3.75Å; V394-W423 HydrophobicContact CG1-CZ2 3.3Å; V394-W423 HydrophobicContact CG1-CZ3 4.48Å; V394-W423 HydrophobicContact CG2-CD2 3.83Å; V394-W423 HydrophobicContact CG2-CE3 3.85Å; V394-W423 HydrophobicContact CG2-CG 4.46Å; V394-W423 HydrophobicContact CG2-CH2 4.06Å; V394-W423 HydrophobicContact CG2-CZ2 4.06Å; V394-W423 HydrophobicContact CG2-CZ3 3.95Å; E399-W423 PolarHBondContact OE1-NE1 2.9Å; E399-W423 PolarHBondContact OE2-NE1 3.13Å; E399-W423 VanDerWaalsContact OE2-NE1 3.17Å; W402-W423 HydrophobicContact CH2-CB 3.62Å; W402-W423 AromaticContact CH2-CD1 3.52Å; W402-W423 HydrophobicContact CH2-CD2 4.31Å; W402-W423 AromaticContact CH2-CG 3.54Å; W402-W423 HydrophobicContact CH2-CG 3.54Å; W402-W423 HydrophobicContact CZ2-CB 4.48Å; W402-W423 HydrophobicContact CZ3-CB 3.96Å; W402-W423 HydrophobicContact CZ3-CG 4.1Å; L419-W423 WeakPolarHBondContact O-CB 3.26Å; L419-W423 PolarHBondContact O-N 3.14Å; K420-W423 PolarHBondContact O-N 3.25Å; W423-T425 VanDerWaalsContact C-N 3.33Å; W423-T425 PolarHBondContact O-N 3.42Å; W423-M426 HydrophobicContact CE3-SD 4.32Å; W423-M426 PolarHBondContact O-N 2.82Å; W423-K427 PolarHBondContact O-N 2.97Å; W423-I432 HydrophobicContact CD2-CD1 3.9Å; W423-I432 HydrophobicContact CE3-CD1 3.79Å; W423-I432 HydrophobicContact CH2-CD1 3.53Å; W423-I432 HydrophobicContact CH2-CG1 4Å; W423-I432 HydrophobicContact CH2-CG2 4.26Å; W423-I432 HydrophobicContact CZ2-CD1 3.61Å; W423-I432 HydrophobicContact CZ2-CG1 4.45Å; W423-I432 HydrophobicContact CZ2-CG2 4.42Å; W423-I432 HydrophobicContact CZ3-CD1 3.62Å; W423-I432 HydrophobicContact CZ3-CG1 4.14Å
424	R	88.6	Confident	78.5	Confident	151 Å²	151	77 Å²	77	57%	0.57	39%	0.391	S	S	*	.	H	α-helix	trans	-59.3	-42.8	172.8	-74.3	176.6	157.8	-168.7	-10.8	112.5	K420 R422 K427 K428	K420-R424 WeakPolarHBondContact O-CG 3.49Å; K420-R424 PolarHBondContact O-N 3.49Å; K420-R424 VanDerWaalsContact O-N 3.09Å; R422-R424 VanDerWaalsContact C-N 3.29Å; R422-R424 PolarHBondContact O-N 3Å; R424-K427 PolarHBondContact O-N 3Å; R424-K428 PolarHBondContact O-N 3Å
425	T	85.8	Confident	76.5	Confident	61 Å²	61	83.6 Å²	83.6	37%	0.374	43%	0.428	S	S	.	.	H	α-helix	trans	-65.2	-41.6	176.4	-53.6	0	0	0	0	111.4	D421 R422 W423 K427 K428 L429	D421-T425 PolarHBondContact O-N 3.47Å; D421-T425 PolarHBondContact O-OG1 3.09Å; R422-T425 CarbonylContact O-C 3.54Å; R422-T425 WeakPolarHBondContact O-CA 3.38Å; R422-T425 WeakPolarHBondContact O-CB 3.49Å; R422-T425 PolarHBondContact O-N 3.34Å; W423-T425 VanDerWaalsContact C-N 3.33Å; W423-T425 PolarHBondContact O-N 3.42Å; T425-K427 VanDerWaalsContact C-N 3.35Å; T425-K427 PolarHBondContact O-N 3.44Å; T425-K428 PolarHBondContact O-N 3.46Å; T425-L429 HydrophobicContact CG2-CD1 3.9Å; T425-L429 HydrophobicContact CG2-CG 4.4Å; T425-L429 WeakPolarHBondContact O-CB 3.46Å; T425-L429 VanDerWaalsContact O-CG 3.3Å; T425-L429 WeakPolarHBondContact O-CG 3.32Å; T425-L429 PolarHBondContact O-N 3.49Å
426	M	83.5	Confident	74.2	Confident	0 Å²	0	84.8 Å²	84.8	0%	0	44%	0.439	C	S	.	.	H	α-helix	trans	-64.1	-38.2	177.1	-68.9	176.4	72.7	0	0	112.2	D387 L390 R391 R422 W423 L429 K430 L431 I432	D387-M426 HydrophobicContact CB-CE 4.01Å; D387-M426 HydrophobicContact CB-SD 4.31Å; L390-M426 HydrophobicContact CD2-SD 4.02Å; R391-M426 HydrophobicContact CG-CE 3.71Å; R391-M426 VanDerWaalsContact NH1-CE 3.25Å; R422-M426 HydrophobicContact CG-CG 4.27Å; R422-M426 HydrophobicContact CG-SD 4.04Å; R422-M426 WeakPolarHBondContact O-CG 3.33Å; R422-M426 PolarHBondContact O-N 3.33Å; W423-M426 HydrophobicContact CE3-SD 4.32Å; W423-M426 PolarHBondContact O-N 2.82Å; M426-L429 PolarHBondContact O-N 2.57Å; M426-K430 PolarHBondContact O-N 3.22Å; M426-L431 HydrophobicContact CB-CB 4.45Å; M426-L431 PolarHBondContact O-N 2.94Å; M426-I432 HydrophobicContact CB-CD1 3.71Å; M426-I432 HydrophobicContact CB-CG1 4.16Å
427	K	82.7	Confident	72	Confident	99 Å²	99	92.2 Å²	92.2	43%	0.43	47%	0.47	S	S	.	.	H	α-helix	trans	-63.9	-46.5	171.8	-77	-172.5	165.7	-178.6	0	111.9	E399 W423 R424 T425 L429 K430 I432	E399-K427 IonicContact OE1-NZ 2.57Å; E399-K427 PolarHBondContact OE1-NZ 3.36Å; E399-K427 WeakPolarHBondContact OE2-CE 3.49Å; E399-K427 IonicContact OE2-NZ 3.65Å; E399-K427 PolarHBondContact OE2-NZ 2.71Å; W423-K427 PolarHBondContact O-N 2.97Å; R424-K427 PolarHBondContact O-N 3Å; T425-K427 VanDerWaalsContact C-N 3.35Å; T425-K427 PolarHBondContact O-N 3.44Å; K427-L429 VanDerWaalsContact C-N 3.26Å; K427-L429 PolarHBondContact O-N 2.67Å; K427-K430 PolarHBondContact O-N 2.79Å; K427-K430 VanDerWaalsContact O-N 3.09Å; K427-I432 HydrophobicContact CG-CD1 3.65Å
428	K	79.3	Confident	69.6	Low	185 Å²	185	99.6 Å²	99.6	80%	0.804	51%	0.506	S	S	*	.	H	α-helix	trans	-61.9	-34.1	178.9	-171.8	177.3	179.7	-179.8	0	112.6	R424 T425 K430	R424-K428 PolarHBondContact O-N 3Å; T425-K428 PolarHBondContact O-N 3.46Å; K428-K430 VanDerWaalsContact C-N 3.29Å; K428-K430 PolarHBondContact O-N 3.33Å
429	L	75.2	Confident	68.6	Low	103 Å²	103	101.2 Å²	101.2	54%	0.539	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	7	178.1	-65.8	174.9	0	0	0	113.8	T425 M426 K427 L431	T425-L429 HydrophobicContact CG2-CD1 3.9Å; T425-L429 HydrophobicContact CG2-CG 4.4Å; T425-L429 WeakPolarHBondContact O-CB 3.46Å; T425-L429 VanDerWaalsContact O-CG 3.3Å; T425-L429 WeakPolarHBondContact O-CG 3.32Å; T425-L429 PolarHBondContact O-N 3.49Å; M426-L429 PolarHBondContact O-N 2.57Å; K427-L429 VanDerWaalsContact C-N 3.26Å; K427-L429 PolarHBondContact O-N 2.67Å; L429-L431 HydrophobicContact CB-CD1 3.79Å; L429-L431 HydrophobicContact CB-CG 3.8Å; L429-L431 HydrophobicContact CD1-CD1 3.95Å; L429-L431 PolarHBondContact O-N 3.03Å; L429-L431 VanDerWaalsContact O-N 3.13Å
430	K	70.8	Confident	67.5	Low	190 Å²	190	106.5 Å²	106.5	83%	0.826	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	31	-174.8	-60.5	-175.9	178	-177.8	0	113.6	M426 K427 K428 I432	M426-K430 PolarHBondContact O-N 3.22Å; K427-K430 PolarHBondContact O-N 2.79Å; K427-K430 VanDerWaalsContact O-N 3.09Å; K428-K430 VanDerWaalsContact C-N 3.29Å; K428-K430 PolarHBondContact O-N 3.33Å; K430-I432 PolarHBondContact O-N 3.01Å
431	L	61.6	Low	66.2	Low	82 Å²	82	107.8 Å²	107.8	43%	0.429	55%	0.552	S	S	.	*			trans	-85	10.4	179	-66.4	172.6	0	0	0	113.1	R391 M426 L429	R391-L431 PolarHBondContact NH1-O 2.94Å; M426-L431 HydrophobicContact CB-CB 4.45Å; M426-L431 PolarHBondContact O-N 2.94Å; L429-L431 HydrophobicContact CB-CD1 3.79Å; L429-L431 HydrophobicContact CB-CG 3.8Å; L429-L431 HydrophobicContact CD1-CD1 3.95Å; L429-L431 PolarHBondContact O-N 3.03Å; L429-L431 VanDerWaalsContact O-N 3.13Å
432	I	57.8	Low	65	Low	37 Å²	37	109.4 Å²	109.4	19%	0.19	56%	0.559	C	S	.	*	S	Bend	trans	-131	116	178.1	-59.6	159.8	0	0	0	104.8	W423 M426 K427 K430 S434	W423-I432 HydrophobicContact CD2-CD1 3.9Å; W423-I432 HydrophobicContact CE3-CD1 3.79Å; W423-I432 HydrophobicContact CH2-CD1 3.53Å; W423-I432 HydrophobicContact CH2-CG1 4Å; W423-I432 HydrophobicContact CH2-CG2 4.26Å; W423-I432 HydrophobicContact CZ2-CD1 3.61Å; W423-I432 HydrophobicContact CZ2-CG1 4.45Å; W423-I432 HydrophobicContact CZ2-CG2 4.42Å; W423-I432 HydrophobicContact CZ3-CD1 3.62Å; W423-I432 HydrophobicContact CZ3-CG1 4.14Å; M426-I432 HydrophobicContact CB-CD1 3.71Å; M426-I432 HydrophobicContact CB-CG1 4.16Å; K427-I432 HydrophobicContact CG-CD1 3.65Å; K430-I432 PolarHBondContact O-N 3.01Å; I432-S434 PolarHBondContact O-N 2.77Å
433	C	42.3	Very low	63.5	Low	107 Å²	107	113.4 Å²	113.4	72%	0.723	58%	0.583	S	S	*	*			trans	-66.9	119	171	-161.5	0	0	0	0	107.4	D435	C433-D435 VanDerWaalsContact C-N 3.32Å; C433-D435 PolarHBondContact O-N 2.68Å; C433-D435 VanDerWaalsContact O-N 3.14Å
434	S	40.3	Very low	61.8	Low	102 Å²	102	119.9 Å²	119.9	71%	0.713	62%	0.618	S	S	*	*			trans	-77.9	87.3	170.1	-62.1	0	0	0	0	107.8	I432 S436	I432-S434 PolarHBondContact O-N 2.77Å; S434-S436 PolarHBondContact O-N 3.13Å
435	D	42.3	Very low	59.9	Low	152 Å²	152	117.7 Å²	117.7	81%	0.813	62%	0.622	S	S	*	*			trans	-82.5	84.8	155.7	-68.2	-19.8	0	0	0	106.3	C433	C433-D435 VanDerWaalsContact C-N 3.32Å; C433-D435 PolarHBondContact O-N 2.68Å; C433-D435 VanDerWaalsContact O-N 3.14Å
436	S	41.6	Very low	57.9	Low	94 Å²	94	122.1 Å²	122.1	66%	0.657	64%	0.641	S	S	*	*			trans	-158.7	74.7	165.3	66.2	0	0	0	0	109.4	S434	S434-S436 PolarHBondContact O-N 3.13Å
437	E	39.6	Very low	55.7	Low	192 Å²	192	132.3 Å²	132.3	90%	0.897	69%	0.694	S	S	*	*			trans	-137.4	114.1	146.6	-71.6	-169.5	156	0	0	106.9
438	D	35.7	Very low	53.3	Low	244 Å²	244	135.3 Å²	135.3	100%	1.305	72%	0.718	S	S	*	*			trans	57	0	168.1	-57.4	-23.7	0	0	0	122.4

Retrieved 438 of 438 residues in 76.2 ms (Link to these results)

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