A0A096NUZ3_PAPAN Loading...

XK-related protein

AlphaFold DB , UniProt , Accession A0A096NUZ3, Species PAPAN (Papio anubis, Olive baboon), Gene XKR7, Length 579 aa.

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(Predicted Aligned Error values between residue pairs)

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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	32.8	Very low	31.4	Very low	243 Å²	243	122.6 Å²	122.6	100%	1.197	83%	0.825	S	S	*	*				0	176.7	0	-76.5	176.4	166.6	0	0	108.7
2	A	31.7	Very low	31.2	Very low	93 Å²	93	121.3 Å²	121.3	77%	0.769	83%	0.83	S	S	*	*			trans	-51.6	146.2	178.2	0	0	0	0	0	112.5
3	A	35.3	Very low	30.9	Very low	95 Å²	95	117.8 Å²	117.8	79%	0.785	83%	0.826	S	S	*	*			cis	82.3	164	38.2	0	0	0	0	0	114.2
4	K	30.5	Very low	31.7	Very low	189 Å²	189	119 Å²	119	82%	0.822	83%	0.829	S	S	*	*			trans	83	122.2	-172.4	-133.1	160.6	-173.8	177.4	0	112.9
5	S	35.2	Very low	31.5	Very low	86 Å²	86	115.4 Å²	115.4	60%	0.601	82%	0.819	S	S	*	*			cis	79.6	148.4	44.1	93.2	0	0	0	0	113.1
6	D	32.1	Very low	32.4	Very low	147 Å²	147	116 Å²	116	79%	0.786	82%	0.818	S	S	*	*			cis	-153.5	166.3	16	-80.2	-66.6	0	0	0	112.9
7	G	31.1	Very low	32.2	Very low	79 Å²	79	119.2 Å²	119.2	81%	0.814	82%	0.817	S	S	*	*			trans	76	166.9	145.2	0	0	0	0	0	120.2
8	A	28.8	Very low	32.1	Very low	106 Å²	106	116.4 Å²	116.4	88%	0.876	81%	0.811	S	S	*	*			cis	-161	177	-10.3	0	0	0	0	0	112.4
9	A	29.3	Very low	31.9	Very low	99 Å²	99	116.5 Å²	116.5	82%	0.818	81%	0.806	S	S	*	*			trans	-85.2	179.8	176.6	0	0	0	0	0	113
10	A	30.2	Very low	31.7	Very low	97 Å²	97	115.9 Å²	115.9	80%	0.802	81%	0.809	S	S	*	*			cis	-178.4	158.9	-32.2	0	0	0	0	0	110.2
11	S	28.1	Very low	31.6	Very low	115 Å²	115	114.3 Å²	114.3	80%	0.804	81%	0.811	S	S	*	*			trans	-169.4	130	164.7	43.7	0	0	0	0	111.8
12	A	29.6	Very low	31.3	Very low	107 Å²	107	106.4 Å²	106.4	88%	0.884	79%	0.792	S	S	*	*				50.7	132.6	100.8	0	0	0	0	0	115.2
13	G	26.6	Very low	31.1	Very low	76 Å²	76	106.6 Å²	106.6	78%	0.784	79%	0.793	S	S	*	*			cis	137.6	167.4	26.6	0	0	0	0	0	107.3
14	P	42.5	Very low	30.7	Very low	134 Å²	134	114.6 Å²	114.6	87%	0.87	80%	0.803	S	S	*	*			cis	-129.7	-164.9	8.6	43.4	-25.5	0	0	0	114.5
15	G	28.2	Very low	30.5	Very low	65 Å²	65	109.1 Å²	109.1	67%	0.67	80%	0.801	S	S	*	*			trans	-96.8	-144.2	168.2	0	0	0	0	0	112.9
16	P	46.5	Very low	30	Very low	125 Å²	125	111.1 Å²	111.1	81%	0.812	82%	0.815	S	S	*	*			cis	-113.6	-156.1	6.3	44.6	-32.4	0	0	0	111.8
17	E	29.7	Very low	29.8	Very low	170 Å²	170	109 Å²	109	79%	0.794	82%	0.818	S	S	*	*			cis	-152.3	-147.6	-1.4	-150.6	-166.9	-86.4	0	0	110.5	V19	E17-V19 WeakPolarHBondContact OE2-CG2 3.49Å
18	G	28.8	Very low	29.5	Very low	69 Å²	69	108.8 Å²	108.8	71%	0.711	82%	0.815	S	S	*	*			trans	149.6	13.2	165.7	0	0	0	0	0	121.9
19	V	29.8	Very low	29.3	Very low	118 Å²	118	107.6 Å²	107.6	72%	0.715	81%	0.813	S	S	*	*			trans	37.8	107	163.5	-173.8	0	0	0	0	121	E17	E17-V19 WeakPolarHBondContact OE2-CG2 3.49Å
20	A	28	Very low	29.2	Very low	104 Å²	104	109.8 Å²	109.8	86%	0.86	82%	0.821	S	S	*	*			trans	61.2	135.2	141.1	0	0	0	0	0	123.3
21	G	28.6	Very low	28.9	Very low	84 Å²	84	108.3 Å²	108.3	87%	0.866	82%	0.816	S	S	*	*			trans	170.8	43.9	171.9	0	0	0	0	0	117
22	G	27.4	Very low	29	Very low	76 Å²	76	112.7 Å²	112.7	78%	0.784	82%	0.823	S	S	*	*			trans	-90.3	173.7	176.9	0	0	0	0	0	114.1
23	A	27.1	Very low	28.8	Very low	97 Å²	97	112.2 Å²	112.2	80%	0.802	82%	0.819	S	S	*	*			cis	-171.3	148.5	-14.7	0	0	0	0	0	109.8
24	R	26.6	Very low	28.8	Very low	263 Å²	263	113.4 Å²	113.4	99%	0.992	82%	0.822	S	S	*	*			trans	-171.3	97	148.6	-110.1	169.6	-173.6	-166.2	1	111.3
25	G	25.7	Very low	28.1	Very low	75 Å²	75	112 Å²	112	77%	0.773	82%	0.821	S	S	*	*			trans	-162.9	95	178.3	0	0	0	0	0	112.4
26	S	26	Very low	28	Very low	128 Å²	128	113.7 Å²	113.7	90%	0.895	83%	0.829	S	S	*	*			trans	-178.1	147.3	173.4	-91.3	0	0	0	0	107.6
27	A	26.1	Very low	27	Very low	102 Å²	102	112.7 Å²	112.7	84%	0.843	83%	0.831	S	S	*	*			cis	-150.9	175.6	-11.9	0	0	0	0	0	105.8
28	G	25.5	Very low	26.7	Very low	74 Å²	74	107.6 Å²	107.6	76%	0.763	82%	0.824	S	S	*	*			cis	165.7	-166.1	4.9	0	0	0	0	0	108.2
29	G	25.2	Very low	26.6	Very low	81 Å²	81	110.2 Å²	110.2	84%	0.835	83%	0.829	S	S	*	*			trans	77.3	79	165.6	0	0	0	0	0	116.2	G31	G29-G31 PolarHBondContact O-N 2.91Å
30	C	26.5	Very low	26.7	Very low	145 Å²	145	110.9 Å²	110.9	98%	0.98	84%	0.835	S	S	*	*			trans	-78.8	114.8	157.6	-165.3	0	0	0	0	108.1
31	G	25.1	Very low	26.6	Very low	67 Å²	67	109.1 Å²	109.1	69%	0.691	83%	0.827	S	S	*	*			trans	-122.9	128.4	-178.4	0	0	0	0	0	111.7	G29 A33	G29-G31 PolarHBondContact O-N 2.91Å; G31-A33 PolarHBondContact O-N 3.22Å
32	E	29.6	Very low	26.6	Very low	207 Å²	207	110.9 Å²	110.9	97%	0.967	83%	0.827	S	S	*	*			trans	-70.1	115.7	175	-71.1	176.9	83.3	0	0	110.9
33	A	25.8	Very low	26.9	Very low	97 Å²	97	114.2 Å²	114.2	80%	0.802	83%	0.832	S	S	*	*			trans	-98.4	105.1	170.2	0	0	0	0	0	109.6	G31 A35	G31-A33 PolarHBondContact O-N 3.22Å; A33-A35 PolarHBondContact O-N 3.31Å
34	A	26.6	Very low	27	Very low	101 Å²	101	112.1 Å²	112.1	84%	0.835	82%	0.819	S	S	*	*			trans	-65.8	113.3	179.3	0	0	0	0	0	111.3	A36	A34-A36 PolarHBondContact O-N 3.31Å
35	A	27	Very low	27.5	Very low	104 Å²	104	103.9 Å²	103.9	86%	0.86	81%	0.807	S	S	*	*			trans	-73.9	92.5	176.3	0	0	0	0	0	110.8	A33 A37	A33-A35 PolarHBondContact O-N 3.31Å; A35-A37 PolarHBondContact O-N 3.35Å
36	A	25.5	Very low	27.8	Very low	100 Å²	100	104 Å²	104	83%	0.826	81%	0.809	S	S	*	*			trans	-59.3	130.2	176.3	0	0	0	0	0	111.4	A34 G38	A34-A36 PolarHBondContact O-N 3.31Å; A36-G38 PolarHBondContact O-N 2.87Å
37	A	27.4	Very low	28.4	Very low	104 Å²	104	100.6 Å²	100.6	86%	0.86	79%	0.793	S	S	*	*			trans	-82.6	110.6	-176.4	0	0	0	0	0	111.7	A35	A35-A37 PolarHBondContact O-N 3.35Å
38	G	22.9	Very low	29.4	Very low	63 Å²	63	100.2 Å²	100.2	65%	0.649	78%	0.782	S	S	*	*			trans	-71.7	164.3	166.7	0	0	0	0	0	113	A36	A36-G38 PolarHBondContact O-N 2.87Å
39	P	25.8	Very low	30.8	Very low	124 Å²	124	97.5 Å²	97.5	81%	0.805	75%	0.754	S	S	*	*			trans	-64.6	157.6	179.5	27.6	-34.9	0	0	0	112.8	G41	P39-G41 PolarHBondContact O-N 3.3Å
40	P	33.3	Very low	32.7	Very low	132 Å²	132	96.2 Å²	96.2	86%	0.857	73%	0.731	S	S	*	*			trans	-76.3	85.3	-168.9	31.3	-36.4	0	0	0	113
41	G	24.2	Very low	34.9	Very low	67 Å²	67	97 Å²	97	69%	0.691	71%	0.714	S	S	*	*			trans	-58	147.7	166.2	0	0	0	0	0	112.4	P39 V43	P39-G41 PolarHBondContact O-N 3.3Å; G41-V43 PolarHBondContact O-N 3.29Å
42	S	29.3	Very low	37.5	Very low	122 Å²	122	94.4 Å²	94.4	85%	0.853	68%	0.683	S	S	*	*			trans	-58.9	133.3	-177.5	54.6	0	0	0	0	112.2	G44	S42-G44 PolarHBondContact O-N 3.01Å
43	V	34.3	Very low	40.1	Very low	146 Å²	146	88.6 Å²	88.6	89%	0.885	66%	0.656	S	S	*	*			trans	-64.6	109.9	-173.3	179.8	0	0	0	0	110.6	G41	G41-V43 PolarHBondContact O-N 3.29Å
44	G	27.9	Very low	42.9	Very low	52 Å²	52	89.8 Å²	89.8	54%	0.536	65%	0.648	S	S	.	*			trans	-63.3	135.4	172.9	0	0	0	0	0	111.8	S42 G46	S42-G44 PolarHBondContact O-N 3.01Å; G44-G46 PolarHBondContact O-N 3.5Å; G44-G46 VanDerWaalsContact O-N 3.08Å
45	A	38.3	Very low	45.8	Very low	90 Å²	90	92.1 Å²	92.1	74%	0.744	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	110.7	171.1	0	0	0	0	0	109.6
46	G	31.1	Very low	48.6	Very low	79 Å²	79	88.5 Å²	88.5	81%	0.814	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	159.5	-20.4	-174.1	0	0	0	0	0	114.6	G44	G44-G46 PolarHBondContact O-N 3.5Å; G44-G46 VanDerWaalsContact O-N 3.08Å
47	G	38.3	Very low	51.6	Low	55 Å²	55	85.1 Å²	85.1	57%	0.567	57%	0.572	S	S	*	*	S	Bend	trans	-63.7	146.7	171.4	0	0	0	0	0	112.6	G49	G47-G49 PolarHBondContact O-N 2.99Å; G47-G49 VanDerWaalsContact O-N 3.1Å
48	P	47.2	Very low	54.5	Low	94 Å²	94	83.6 Å²	83.6	61%	0.61	55%	0.554	S	S	*	*			trans	-62	115.9	179.1	25.5	-33.7	0	0	0	110.2
49	G	56.5	Low	57.7	Low	17 Å²	17	82 Å²	82	18%	0.175	53%	0.528	C	S	.	.			trans	-57.2	154.7	-178.3	0	0	0	0	0	113	G47	G47-G49 PolarHBondContact O-N 2.99Å; G47-G49 VanDerWaalsContact O-N 3.1Å
50	P	64.6	Low	60.7	Low	54 Å²	54	77.5 Å²	77.5	35%	0.351	50%	0.498	S	S	.	.			trans	-50.8	140.7	-169.5	20	-33.3	0	0	0	112.6	Y218	P50-Y218 HydrophobicContact CB-CD1 4.29Å; P50-Y218 HydrophobicContact CB-CE1 3.79Å; P50-Y218 HydrophobicContact CB-CE2 4.16Å; P50-Y218 HydrophobicContact CG-CD1 3.73Å; P50-Y218 HydrophobicContact CG-CE1 3.51Å; P50-Y218 HydrophobicContact CG-CG 4.38Å
51	R	72.6	Confident	63.4	Low	161 Å²	161	75.4 Å²	75.4	61%	0.608	48%	0.479	S	S	*	.			trans	-111.8	128.9	-173.7	-63.7	179.2	176	-179.8	-3.1	108.9	E53	R51-E53 PolarHBondContact O-N 3.32Å
52	Y	79.5	Confident	66.5	Low	14 Å²	14	74.3 Å²	74.3	6%	0.055	46%	0.461	C	S	.	.			trans	-71.3	113	171.1	-176	-110.5	0	0	0	109.8	D56 C57 G203 L204 S206 M221	Y52-D56 HydrophobicContact CD2-CB 3.57Å; Y52-D56 HydrophobicContact CE2-CB 3.41Å; Y52-D56 VanDerWaalsContact CE2-CB 3.41Å; Y52-D56 HydrophobicContact CG-CB 4.47Å; Y52-C57 HydrophobicContact CE1-CB 3.95Å; Y52-C57 VanDerWaalsContact OH-CA 3.23Å; Y52-C57 WeakPolarHBondContact OH-CA 3.03Å; Y52-G203 VanDerWaalsContact CD1-O 3.25Å; Y52-G203 WeakPolarHBondContact CD1-O 3.34Å; Y52-G203 VanDerWaalsContact CE1-C 3.46Å; Y52-L204 HydrophobicContact CE1-CD1 4.19Å; Y52-S206 WeakPolarHBondContact CB-OG 3.25Å; Y52-M221 HydrophobicContact CD2-CE 3.96Å; Y52-M221 HydrophobicContact CD2-SD 3.33Å; Y52-M221 WeakPolarHBondContact CD2-SD 3.4Å; Y52-M221 HydrophobicContact CE2-CE 4.37Å; Y52-M221 HydrophobicContact CE2-SD 3.34Å; Y52-M221 WeakPolarHBondContact CE2-SD 3.17Å; Y52-M221 HydrophobicContact CG-SD 4.27Å
53	E	84.1	Confident	69.3	Low	85 Å²	85	68.9 Å²	68.9	40%	0.397	42%	0.423	S	S	.	.			trans	-85.5	161.6	177.4	-66.5	-162.6	163.2	0	0	111.7	R51 R55 D56 C57	R51-E53 PolarHBondContact O-N 3.32Å; E53-R55 HydrophobicContact CB-CB 4.21Å; E53-R55 PolarHBondContact O-N 3.5Å; E53-R55 VanDerWaalsContact O-N 3.16Å; E53-R55 IonicContact OE1-NH1 3.88Å; E53-R55 WeakPolarHBondContact OE2-CD 3.45Å; E53-R55 IonicContact OE2-CZ 2.76Å; E53-R55 IonicContact OE2-NE 2.73Å; E53-R55 IonicContact OE2-NH1 3.52Å; E53-R55 PolarHBondContact OE2-NH1 2.84Å; E53-D56 WeakPolarHBondContact CB-OD2 3.32Å; E53-D56 PolarHBondContact N-OD2 3.23Å; E53-D56 PolarHBondContact O-N 3.09Å; E53-D56 VanDerWaalsContact O-N 3.08Å; E53-C57 PolarHBondContact O-N 3.43Å
54	L	85.3	Confident	71.9	Confident	121 Å²	121	62.9 Å²	62.9	63%	0.634	39%	0.386	S	S	*	.	H	α-helix	trans	-59.4	-23.1	167	-173.5	62.2	0	0	0	111.9	C57 C58	L54-C57 HydrophobicContact CD1-CB 4.41Å; L54-C57 WeakPolarHBondContact O-CB 3.39Å; L54-C58 WeakPolarHBondContact O-CB 3.39Å; L54-C58 PolarHBondContact O-N 3.21Å
55	R	86.7	Confident	74.8	Confident	150 Å²	150	65.5 Å²	65.5	57%	0.566	39%	0.387	S	S	*	.	H	α-helix	trans	-68.4	-37.5	173.9	-61.3	-174.6	-177.6	121.6	-8.2	112.7	E53 C58 W59 Y296	E53-R55 HydrophobicContact CB-CB 4.21Å; E53-R55 PolarHBondContact O-N 3.5Å; E53-R55 VanDerWaalsContact O-N 3.16Å; E53-R55 IonicContact OE1-NH1 3.88Å; E53-R55 WeakPolarHBondContact OE2-CD 3.45Å; E53-R55 IonicContact OE2-CZ 2.76Å; E53-R55 IonicContact OE2-NE 2.73Å; E53-R55 IonicContact OE2-NH1 3.52Å; E53-R55 PolarHBondContact OE2-NH1 2.84Å; R55-C58 PolarHBondContact O-N 2.82Å; R55-W59 PolarHBondContact O-N 3.22Å; R55-Y296 VanDerWaalsContact C-OH 3.26Å; R55-Y296 HydrophobicContact CB-CE1 3.99Å; R55-Y296 HydrophobicContact CB-CE2 3.79Å; R55-Y296 VanDerWaalsContact CB-CZ 3.43Å; R55-Y296 VanDerWaalsContact CB-OH 3.27Å; R55-Y296 WeakPolarHBondContact CB-OH 3.34Å; R55-Y296 HydrophobicContact CG-CE2 4.49Å
56	D	86.9	Confident	77.2	Confident	29 Å²	29	62.7 Å²	62.7	16%	0.155	36%	0.361	C	S	.	.	H	α-helix	trans	-67.9	-41.3	175.6	-60.6	-74.8	0	0	0	109.9	Y52 E53 C58 W59 V60 Y296	Y52-D56 HydrophobicContact CD2-CB 3.57Å; Y52-D56 HydrophobicContact CE2-CB 3.41Å; Y52-D56 VanDerWaalsContact CE2-CB 3.41Å; Y52-D56 HydrophobicContact CG-CB 4.47Å; E53-D56 WeakPolarHBondContact CB-OD2 3.32Å; E53-D56 PolarHBondContact N-OD2 3.23Å; E53-D56 PolarHBondContact O-N 3.09Å; E53-D56 VanDerWaalsContact O-N 3.08Å; D56-C58 VanDerWaalsContact C-N 3.33Å; D56-C58 PolarHBondContact O-N 3.46Å; D56-W59 PolarHBondContact O-N 2.84Å; D56-V60 WeakPolarHBondContact O-CG2 3.34Å; D56-V60 PolarHBondContact O-N 3.28Å; D56-Y296 WeakPolarHBondContact CA-OH 3.44Å; D56-Y296 PolarHBondContact N-OH 3.45Å; D56-Y296 PolarHBondContact OD1-OH 3.31Å; D56-Y296 PolarHBondContact OD2-OH 3.03Å
57	C	87.5	Confident	79.9	Confident	29 Å²	29	60.2 Å²	60.2	20%	0.196	33%	0.328	C	S	.	.	H	α-helix	trans	-58.4	-43	172.4	-173.2	0	0	0	0	112.3	Y52 E53 L54 L61 L200	Y52-C57 HydrophobicContact CE1-CB 3.95Å; Y52-C57 VanDerWaalsContact OH-CA 3.23Å; Y52-C57 WeakPolarHBondContact OH-CA 3.03Å; E53-C57 PolarHBondContact O-N 3.43Å; L54-C57 HydrophobicContact CD1-CB 4.41Å; L54-C57 WeakPolarHBondContact O-CB 3.39Å; C57-L61 WeakPolarHBondContact O-CB 3.35Å; C57-L61 PolarHBondContact O-N 3.33Å; C57-L200 VanDerWaalsContact SG-CD1 3.6Å
58	C	89.3	Confident	82.3	Confident	71 Å²	71	62.2 Å²	62.2	48%	0.48	32%	0.321	S	S	.	.	H	α-helix	trans	-64.7	-45.4	174.9	-168.1	0	0	0	0	111.5	L54 R55 D56 V60 L61 C62	L54-C58 WeakPolarHBondContact O-CB 3.39Å; L54-C58 PolarHBondContact O-N 3.21Å; R55-C58 PolarHBondContact O-N 2.82Å; D56-C58 VanDerWaalsContact C-N 3.33Å; D56-C58 PolarHBondContact O-N 3.46Å; C58-V60 PolarHBondContact O-N 2.84Å; C58-L61 PolarHBondContact O-N 3.27Å; C58-C62 PolarHBondContact O-N 3.43Å; C58-C62 PolarHBondContact O-SG 3.47Å; C58-C62 VanDerWaalsContact O-SG 3.34Å
59	W	89.1	Confident	84.1	Confident	31 Å²	31	60.3 Å²	60.3	12%	0.117	31%	0.31	C	S	.	.	H	α-helix	trans	-59.4	-44.3	177.8	-169.5	-76.8	0	0	0	112.5	R55 D56 C62 A63 W275 S279 Y296 A299	R55-W59 PolarHBondContact O-N 3.22Å; D56-W59 PolarHBondContact O-N 2.84Å; W59-C62 PolarHBondContact O-N 3.22Å; W59-A63 WeakPolarHBondContact O-CB 3.4Å; W59-A63 PolarHBondContact O-N 3.4Å; W59-W275 AromaticContact CD2-CH2 3.68Å; W59-W275 HydrophobicContact CD2-CH2 3.68Å; W59-W275 AromaticContact CD2-CZ2 3.63Å; W59-W275 HydrophobicContact CD2-CZ2 3.63Å; W59-W275 AromaticContact CE2-CH2 3.84Å; W59-W275 AromaticContact CE2-CZ2 3.56Å; W59-W275 AromaticContact CE3-CH2 3.54Å; W59-W275 HydrophobicContact CE3-CH2 3.54Å; W59-W275 HydrophobicContact CE3-CZ2 4.02Å; W59-W275 HydrophobicContact CE3-CZ3 4.33Å; W59-W275 HydrophobicContact CG-CH2 4.38Å; W59-W275 AromaticContact CG-CZ2 3.99Å; W59-W275 HydrophobicContact CG-CZ2 3.99Å; W59-W275 HydrophobicContact CH2-CE3 4.39Å; W59-W275 AromaticContact CH2-CH2 3.78Å; W59-W275 HydrophobicContact CH2-CH2 3.78Å; W59-W275 HydrophobicContact CH2-CZ2 4.27Å; W59-W275 AromaticContact CH2-CZ3 3.85Å; W59-W275 HydrophobicContact CH2-CZ3 3.85Å; W59-W275 AromaticContact CZ2-CH2 3.91Å; W59-W275 HydrophobicContact CZ2-CH2 3.91Å; W59-W275 AromaticContact CZ2-CZ2 3.91Å; W59-W275 HydrophobicContact CZ2-CZ2 3.91Å; W59-W275 HydrophobicContact CZ2-CZ3 4.22Å; W59-W275 AromaticContact CZ3-CH2 3.59Å; W59-W275 HydrophobicContact CZ3-CH2 3.59Å; W59-W275 HydrophobicContact CZ3-CZ2 4.32Å; W59-W275 AromaticContact CZ3-CZ3 3.92Å; W59-W275 HydrophobicContact CZ3-CZ3 3.92Å; W59-W275 AromaticContact NE1-CZ2 3.85Å; W59-S279 PolarHBondContact NE1-OG 3.38Å; W59-Y296 AromaticContact CE3-CD1 3.99Å; W59-Y296 HydrophobicContact CE3-CD1 3.99Å; W59-Y296 HydrophobicContact CE3-CE1 4.22Å; W59-Y296 HydrophobicContact CZ3-CD1 4.39Å; W59-A299 HydrophobicContact CH2-CB 3.7Å; W59-A299 HydrophobicContact CZ2-CB 4.43Å; W59-A299 HydrophobicContact CZ3-CB 4.08Å
60	V	88.3	Confident	85.6	Confident	29 Å²	29	59.9 Å²	59.9	18%	0.176	30%	0.304	C	S	.	.	H	α-helix	trans	-65.4	-39.4	176.4	172.8	0	0	0	0	111.4	D56 C58 A63 L64 Y196 L200	D56-V60 WeakPolarHBondContact O-CG2 3.34Å; D56-V60 PolarHBondContact O-N 3.28Å; C58-V60 PolarHBondContact O-N 2.84Å; V60-A63 PolarHBondContact O-N 2.9Å; V60-L64 PolarHBondContact O-N 3.21Å; V60-Y196 HydrophobicContact CG1-CD1 4.29Å; V60-L200 HydrophobicContact CG1-CB 4.31Å
61	L	89.8	Confident	86.6	Confident	87 Å²	87	58.7 Å²	58.7	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-66.4	-43.7	175.9	-177	61.7	0	0	0	112	C57 C58 A63 L64 L65	C57-L61 WeakPolarHBondContact O-CB 3.35Å; C57-L61 PolarHBondContact O-N 3.33Å; C58-L61 PolarHBondContact O-N 3.27Å; L61-A63 VanDerWaalsContact C-N 3.35Å; L61-A63 PolarHBondContact O-N 3.4Å; L61-L64 PolarHBondContact O-N 3.25Å; L61-L64 VanDerWaalsContact O-N 3.14Å; L61-L65 HydrophobicContact CG-CD1 4.31Å; L61-L65 WeakPolarHBondContact O-CG 3.29Å; L61-L65 PolarHBondContact O-N 3.28Å
62	C	89.7	Confident	87.2	Confident	45 Å²	45	53.9 Å²	53.9	30%	0.304	30%	0.295	S	S	.	.	H	α-helix	trans	-58.8	-44.9	173.3	-70	0	0	0	0	111.5	C58 W59 L64 L65 V66 W275	C58-C62 PolarHBondContact O-N 3.43Å; C58-C62 PolarHBondContact O-SG 3.47Å; C58-C62 VanDerWaalsContact O-SG 3.34Å; W59-C62 PolarHBondContact O-N 3.22Å; C62-L64 PolarHBondContact O-N 3.47Å; C62-L65 PolarHBondContact O-N 2.82Å; C62-V66 WeakPolarHBondContact O-CB 3.49Å; C62-V66 VanDerWaalsContact O-CG2 3.24Å; C62-V66 WeakPolarHBondContact O-CG2 3.19Å; C62-V66 PolarHBondContact O-N 2.97Å; C62-W275 HydrophobicContact CB-CH2 4.05Å; C62-W275 HydrophobicContact CB-CZ2 3.6Å
63	A	88.2	Confident	87.5	Confident	8 Å²	8	54.5 Å²	54.5	7%	0.066	30%	0.301	C	S	.	.	H	α-helix	trans	-63.1	-28.4	176.2	0	0	0	0	0	113.7	W59 V60 L61 F67 Y196	W59-A63 WeakPolarHBondContact O-CB 3.4Å; W59-A63 PolarHBondContact O-N 3.4Å; V60-A63 PolarHBondContact O-N 2.9Å; L61-A63 VanDerWaalsContact C-N 3.35Å; L61-A63 PolarHBondContact O-N 3.4Å; A63-F67 PolarHBondContact O-N 2.87Å; A63-Y196 HydrophobicContact CB-CE1 3.8Å
64	L	89.4	Confident	87.5	Confident	19 Å²	19	50.6 Å²	50.6	10%	0.099	28%	0.283	C	S	.	.	H	α-helix	trans	-78.5	-40.1	174.4	-177.4	61.3	0	0	0	112.3	V60 L61 C62 F67 F68 V193 Y196	V60-L64 PolarHBondContact O-N 3.21Å; L61-L64 PolarHBondContact O-N 3.25Å; L61-L64 VanDerWaalsContact O-N 3.14Å; C62-L64 PolarHBondContact O-N 3.47Å; L64-F67 PolarHBondContact O-N 3.39Å; L64-F68 HydrophobicContact CD1-CD2 4.16Å; L64-F68 HydrophobicContact CD1-CE2 3.61Å; L64-F68 HydrophobicContact CD1-CZ 4.33Å; L64-F68 HydrophobicContact CD2-CE2 4.4Å; L64-F68 HydrophobicContact CG-CD2 4.14Å; L64-F68 HydrophobicContact CG-CE2 3.79Å; L64-F68 VanDerWaalsContact O-CD2 3.24Å; L64-F68 WeakPolarHBondContact O-CD2 3.48Å; L64-F68 PolarHBondContact O-N 2.84Å; L64-V193 HydrophobicContact CD1-CG1 4.39Å; L64-Y196 HydrophobicContact CB-CD1 4.41Å; L64-Y196 HydrophobicContact CD1-CD2 4.23Å; L64-Y196 HydrophobicContact CD1-CG 4.1Å
65	L	89.6	Confident	87.5	Confident	108 Å²	108	50.7 Å²	50.7	57%	0.565	28%	0.283	S	S	*	.	H	α-helix	trans	-63.3	-42.4	173.8	-70.9	170.6	0	0	0	111.5	L61 C62 F67 F68 S69	L61-L65 HydrophobicContact CG-CD1 4.31Å; L61-L65 WeakPolarHBondContact O-CG 3.29Å; L61-L65 PolarHBondContact O-N 3.28Å; C62-L65 PolarHBondContact O-N 2.82Å; L65-F67 VanDerWaalsContact C-N 3.33Å; L65-F67 PolarHBondContact O-N 3.39Å; L65-F68 PolarHBondContact O-N 2.85Å; L65-S69 WeakPolarHBondContact O-CB 3.36Å; L65-S69 PolarHBondContact O-N 2.94Å
66	V	88.5	Confident	87.6	Confident	31 Å²	31	52.7 Å²	52.7	19%	0.188	29%	0.291	C	S	.	.	H	α-helix	trans	-57.1	-44.9	174.2	164.8	0	0	0	0	111.2	C62 F68 S69 D70 S272	C62-V66 WeakPolarHBondContact O-CB 3.49Å; C62-V66 VanDerWaalsContact O-CG2 3.24Å; C62-V66 WeakPolarHBondContact O-CG2 3.19Å; C62-V66 PolarHBondContact O-N 2.97Å; V66-F68 PolarHBondContact O-N 3.47Å; V66-S69 WeakPolarHBondContact O-CB 3.34Å; V66-S69 PolarHBondContact O-N 2.92Å; V66-D70 PolarHBondContact O-N 2.88Å; V66-S272 WeakPolarHBondContact CG1-OG 3.39Å
67	F	86.9	Confident	87.4	Confident	26 Å²	26	52.7 Å²	52.7	11%	0.114	29%	0.29	C	S	.	.	H	α-helix	trans	-60.3	-46.4	175.9	170.2	-114	0	0	0	113.4	A63 L64 L65 S69 D70 G71 Q192 V193 R232	A63-F67 PolarHBondContact O-N 2.87Å; L64-F67 PolarHBondContact O-N 3.39Å; L65-F67 VanDerWaalsContact C-N 3.33Å; L65-F67 PolarHBondContact O-N 3.39Å; F67-S69 VanDerWaalsContact C-N 3.27Å; F67-S69 PolarHBondContact O-N 2.7Å; F67-D70 PolarHBondContact O-N 3.02Å; F67-G71 PolarHBondContact O-N 3.22Å; F67-Q192 VanDerWaalsContact CE2-OE1 3.23Å; F67-V193 HydrophobicContact CD1-CG2 4.01Å; F67-V193 HydrophobicContact CE1-CG2 3.47Å; F67-V193 VanDerWaalsContact CE1-CG2 3.47Å; F67-V193 HydrophobicContact CZ-CG2 4.47Å; F67-R232 VanDerWaalsContact CD2-NH1 3.33Å
68	F	87.8	Confident	87.3	Confident	98 Å²	98	51.5 Å²	51.5	43%	0.43	28%	0.283	S	S	.	.	H	α-helix	trans	-66.9	-31.8	177.2	-73.1	-61.5	0	0	0	112.1	L64 L65 V66 A72 V193	L64-F68 HydrophobicContact CD1-CD2 4.16Å; L64-F68 HydrophobicContact CD1-CE2 3.61Å; L64-F68 HydrophobicContact CD1-CZ 4.33Å; L64-F68 HydrophobicContact CD2-CE2 4.4Å; L64-F68 HydrophobicContact CG-CD2 4.14Å; L64-F68 HydrophobicContact CG-CE2 3.79Å; L64-F68 VanDerWaalsContact O-CD2 3.24Å; L64-F68 WeakPolarHBondContact O-CD2 3.48Å; L64-F68 PolarHBondContact O-N 2.84Å; L65-F68 PolarHBondContact O-N 2.85Å; V66-F68 PolarHBondContact O-N 3.47Å; F68-A72 VanDerWaalsContact O-CB 3.3Å; F68-A72 WeakPolarHBondContact O-CB 3.31Å; F68-A72 PolarHBondContact O-N 3.08Å; F68-V193 HydrophobicContact CE1-CG2 4.08Å; F68-V193 HydrophobicContact CZ-CG1 3.98Å; F68-V193 HydrophobicContact CZ-CG2 3.76Å
69	S	86.9	Confident	87.2	Confident	53 Å²	53	50.2 Å²	50.2	37%	0.371	28%	0.277	S	S	.	.	H	α-helix	trans	-61.8	-52.8	172.5	-169.7	0	0	0	0	111.2	L65 V66 F67 G71 A72 T73	L65-S69 WeakPolarHBondContact O-CB 3.36Å; L65-S69 PolarHBondContact O-N 2.94Å; V66-S69 WeakPolarHBondContact O-CB 3.34Å; V66-S69 PolarHBondContact O-N 2.92Å; F67-S69 VanDerWaalsContact C-N 3.27Å; F67-S69 PolarHBondContact O-N 2.7Å; S69-G71 VanDerWaalsContact C-N 3.32Å; S69-G71 PolarHBondContact O-N 3.37Å; S69-A72 PolarHBondContact O-N 3.07Å; S69-A72 VanDerWaalsContact O-N 3.15Å; S69-T73 WeakPolarHBondContact O-CG2 3.3Å; S69-T73 PolarHBondContact O-N 3.26Å; S69-T73 PolarHBondContact O-OG1 3.37Å
70	D	87.1	Confident	87	Confident	9 Å²	9	50 Å²	50	5%	0.048	28%	0.281	C	S	.	.	H	α-helix	trans	-58.3	-44	177.9	-64.2	-21.8	0	0	0	111.7	V66 F67 A72 T73 D74 R239 S272	V66-D70 PolarHBondContact O-N 2.88Å; F67-D70 PolarHBondContact O-N 3.02Å; D70-A72 VanDerWaalsContact C-N 3.33Å; D70-A72 PolarHBondContact O-N 3.27Å; D70-T73 PolarHBondContact O-OG1 3.3Å; D70-D74 WeakPolarHBondContact O-CB 3.42Å; D70-D74 PolarHBondContact O-N 3.22Å; D70-D74 VanDerWaalsContact O-N 3.1Å; D70-R239 PolarHBondContact O-NH2 2.91Å; D70-S272 VanDerWaalsContact CG-OG 3.28Å; D70-S272 WeakPolarHBondContact OD1-CB 3.41Å; D70-S272 PolarHBondContact OD1-OG 3.4Å; D70-S272 WeakPolarHBondContact OD2-CB 3.46Å; D70-S272 PolarHBondContact OD2-OG 2.98Å
71	G	84.6	Confident	86.8	Confident	28 Å²	28	49 Å²	49	29%	0.289	27%	0.273	S	S	.	.	H	α-helix	trans	-57.9	-43.1	175.5	0	0	0	0	0	113.1	F67 S69 L75	F67-G71 PolarHBondContact O-N 3.22Å; S69-G71 VanDerWaalsContact C-N 3.32Å; S69-G71 PolarHBondContact O-N 3.37Å; G71-L75 WeakPolarHBondContact O-CB 3.38Å; G71-L75 PolarHBondContact O-N 2.87Å
72	A	86.4	Confident	86.7	Confident	60 Å²	60	51.4 Å²	51.4	50%	0.496	28%	0.278	S	S	.	.	H	α-helix	trans	-76.1	-42.9	-179	0	0	0	0	0	113	F68 S69 D70 W76	F68-A72 VanDerWaalsContact O-CB 3.3Å; F68-A72 WeakPolarHBondContact O-CB 3.31Å; F68-A72 PolarHBondContact O-N 3.08Å; S69-A72 PolarHBondContact O-N 3.07Å; S69-A72 VanDerWaalsContact O-N 3.15Å; D70-A72 VanDerWaalsContact C-N 3.33Å; D70-A72 PolarHBondContact O-N 3.27Å; A72-W76 WeakPolarHBondContact O-CB 3.43Å; A72-W76 PolarHBondContact O-N 2.94Å
73	T	85.5	Confident	86.7	Confident	27 Å²	27	56.4 Å²	56.4	17%	0.166	30%	0.301	C	S	.	.	H	α-helix	trans	-66.3	-38.6	-179.8	49.8	0	0	0	0	111.8	S69 D70 L77	S69-T73 WeakPolarHBondContact O-CG2 3.3Å; S69-T73 PolarHBondContact O-N 3.26Å; S69-T73 PolarHBondContact O-OG1 3.37Å; D70-T73 PolarHBondContact O-OG1 3.3Å; T73-L77 VanDerWaalsContact O-CB 3.24Å; T73-L77 WeakPolarHBondContact O-CB 3.43Å; T73-L77 PolarHBondContact O-N 2.99Å
74	D	84.3	Confident	86.5	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-69.6	-42.3	178.6	-65.9	-10.7	0	0	0	112	D70 L77 A78 V97 R239 Q243	D70-D74 WeakPolarHBondContact O-CB 3.42Å; D70-D74 PolarHBondContact O-N 3.22Å; D70-D74 VanDerWaalsContact O-N 3.1Å; D74-L77 PolarHBondContact O-N 3.25Å; D74-A78 WeakPolarHBondContact O-CB 3.28Å; D74-A78 PolarHBondContact O-N 3.47Å; D74-V97 HydrophobicContact CB-CG2 3.71Å; D74-R239 IonicContact OD2-CZ 3.47Å; D74-R239 IonicContact OD2-NE 3.98Å; D74-R239 PolarHBondContact OD2-NE 3.36Å; D74-R239 IonicContact OD2-NH2 3.71Å; D74-R239 PolarHBondContact OD2-NH2 3.5Å; D74-Q243 VanDerWaalsContact CG-NE2 3.29Å; D74-Q243 PolarHBondContact OD1-NE2 3.11Å
75	L	85.7	Confident	86.3	Confident	123 Å²	123	62 Å²	62	64%	0.644	34%	0.336	S	S	*	.	H	α-helix	trans	-67.4	-40.5	176.7	-177.3	60.9	0	0	0	111.6	G71 A78 A79	G71-L75 WeakPolarHBondContact O-CB 3.38Å; G71-L75 PolarHBondContact O-N 2.87Å; L75-A78 PolarHBondContact O-N 2.87Å; L75-A79 WeakPolarHBondContact O-CB 3.46Å; L75-A79 PolarHBondContact O-N 2.98Å
76	W	87.8	Confident	86.1	Confident	192 Å²	192	59.9 Å²	59.9	73%	0.727	32%	0.324	S	S	*	.	H	α-helix	trans	-60.8	-44.3	172.2	175	-94.1	0	0	0	111.7	A72 A79 S80	A72-W76 WeakPolarHBondContact O-CB 3.43Å; A72-W76 PolarHBondContact O-N 2.94Å; W76-A79 PolarHBondContact O-N 3.36Å; W76-S80 WeakPolarHBondContact O-CB 3.48Å; W76-S80 PolarHBondContact O-N 2.84Å
77	L	83.5	Confident	86	Confident	28 Å²	28	63.9 Å²	63.9	15%	0.147	34%	0.34	C	S	.	.	H	α-helix	trans	-64.9	-44.3	178.9	-174.7	63.9	0	0	0	111.4	T73 D74 A79 S80 Y81 Q247	T73-L77 VanDerWaalsContact O-CB 3.24Å; T73-L77 WeakPolarHBondContact O-CB 3.43Å; T73-L77 PolarHBondContact O-N 2.99Å; D74-L77 PolarHBondContact O-N 3.25Å; L77-A79 PolarHBondContact O-N 2.94Å; L77-S80 PolarHBondContact O-N 3.37Å; L77-S80 VanDerWaalsContact O-N 3.15Å; L77-S80 PolarHBondContact O-OG 3.34Å; L77-Y81 HydrophobicContact CD1-CE1 4.11Å; L77-Y81 HydrophobicContact CD1-CE2 3.98Å; L77-Y81 HydrophobicContact CD2-CE2 4Å; L77-Y81 HydrophobicContact CG-CD2 4.23Å; L77-Y81 HydrophobicContact CG-CE2 3.57Å; L77-Y81 WeakPolarHBondContact O-CD2 3.44Å; L77-Y81 PolarHBondContact O-N 2.93Å; L77-Q247 HydrophobicContact CD2-CG 3.8Å; L77-Q247 VanDerWaalsContact CD2-NE2 3.28Å
78	A	85.1	Confident	86	Confident	5 Å²	5	67.6 Å²	67.6	4%	0.041	37%	0.365	C	S	.	.	H	α-helix	trans	-58.9	-46.6	173.6	0	0	0	0	0	111.7	D74 L75 S80 Y81 Y82 F90 T93	D74-A78 WeakPolarHBondContact O-CB 3.28Å; D74-A78 PolarHBondContact O-N 3.47Å; L75-A78 PolarHBondContact O-N 2.87Å; A78-S80 VanDerWaalsContact C-N 3.3Å; A78-S80 PolarHBondContact O-N 3.37Å; A78-Y81 PolarHBondContact O-N 2.74Å; A78-Y82 PolarHBondContact O-N 3.47Å; A78-F90 HydrophobicContact CB-CD2 4.22Å; A78-F90 HydrophobicContact CB-CE2 4.4Å; A78-F90 WeakPolarHBondContact O-CD2 3.32Å; A78-T93 HydrophobicContact CB-CG2 4.16Å
79	A	87.1	Confident	85.6	Confident	43 Å²	43	64.2 Å²	64.2	36%	0.355	35%	0.353	S	S	.	.	H	α-helix	trans	-59.3	-39.7	174.3	0	0	0	0	0	112.1	L75 W76 L77 Y82 L83	L75-A79 WeakPolarHBondContact O-CB 3.46Å; L75-A79 PolarHBondContact O-N 2.98Å; W76-A79 PolarHBondContact O-N 3.36Å; L77-A79 PolarHBondContact O-N 2.94Å; A79-Y82 PolarHBondContact O-N 3.46Å; A79-L83 WeakPolarHBondContact O-CG 3.43Å; A79-L83 PolarHBondContact O-N 3.42Å
80	S	84.4	Confident	85.7	Confident	27 Å²	27	64.1 Å²	64.1	19%	0.189	35%	0.346	C	S	.	.	H	α-helix	trans	-64.9	-38.7	176.7	82.1	0	0	0	0	112.8	W76 L77 A78 L83 Q84	W76-S80 WeakPolarHBondContact O-CB 3.48Å; W76-S80 PolarHBondContact O-N 2.84Å; L77-S80 PolarHBondContact O-N 3.37Å; L77-S80 VanDerWaalsContact O-N 3.15Å; L77-S80 PolarHBondContact O-OG 3.34Å; A78-S80 VanDerWaalsContact C-N 3.3Å; A78-S80 PolarHBondContact O-N 3.37Å; S80-L83 PolarHBondContact O-N 3.14Å; S80-Q84 WeakPolarHBondContact O-CB 3.33Å; S80-Q84 WeakPolarHBondContact O-CG 3.31Å; S80-Q84 PolarHBondContact O-N 3.44Å
81	Y	84.9	Confident	85.7	Confident	7 Å²	7	67 Å²	67	3%	0.027	37%	0.367	C	S	.	.	H	α-helix	trans	-68.8	-36.1	174.7	-65.7	-38	0	0	0	112.5	L77 A78 Q84 G85 Q86 C89 T93 L250	L77-Y81 HydrophobicContact CD1-CE1 4.11Å; L77-Y81 HydrophobicContact CD1-CE2 3.98Å; L77-Y81 HydrophobicContact CD2-CE2 4Å; L77-Y81 HydrophobicContact CG-CD2 4.23Å; L77-Y81 HydrophobicContact CG-CE2 3.57Å; L77-Y81 WeakPolarHBondContact O-CD2 3.44Å; L77-Y81 PolarHBondContact O-N 2.93Å; A78-Y81 PolarHBondContact O-N 2.74Å; Y81-Q84 PolarHBondContact O-N 2.95Å; Y81-G85 PolarHBondContact O-N 3.31Å; Y81-Q86 PolarHBondContact O-N 3.34Å; Y81-C89 HydrophobicContact CD1-CB 3.99Å; Y81-C89 HydrophobicContact CD2-CB 3.82Å; Y81-C89 HydrophobicContact CE1-CB 4.29Å; Y81-C89 HydrophobicContact CE2-CB 4.12Å; Y81-C89 HydrophobicContact CG-CB 3.75Å; Y81-T93 VanDerWaalsContact CE2-OG1 3.29Å; Y81-T93 WeakPolarHBondContact CE2-OG1 3.09Å; Y81-L250 HydrophobicContact CE1-CD2 3.55Å; Y81-L250 WeakPolarHBondContact OH-CD2 3.27Å
82	Y	88	Confident	85.8	Confident	139 Å²	139	69.5 Å²	69.5	55%	0.545	37%	0.373	S	S	.	.	H	α-helix	trans	-62.8	-48.3	173.6	-176.1	-93.3	0	0	0	111.3	A78 A79 Q84 G85 F90	A78-Y82 PolarHBondContact O-N 3.47Å; A79-Y82 PolarHBondContact O-N 3.46Å; Y82-Q84 VanDerWaalsContact C-N 3.27Å; Y82-Q84 PolarHBondContact O-N 3.36Å; Y82-G85 PolarHBondContact O-N 3.14Å; Y82-F90 HydrophobicContact CD2-CD1 4.3Å; Y82-F90 HydrophobicContact CD2-CE1 4.1Å; Y82-F90 HydrophobicContact CD2-CE2 4.32Å; Y82-F90 HydrophobicContact CD2-CG 4.5Å; Y82-F90 HydrophobicContact CD2-CZ 4.1Å
83	L	88.6	Confident	85.7	Confident	150 Å²	150	66.7 Å²	66.7	79%	0.785	35%	0.35	S	S	*	.	H	α-helix	trans	-65.3	-27.4	176.5	-67.7	172.1	0	0	0	113.3	A79 S80 G85	A79-L83 WeakPolarHBondContact O-CG 3.43Å; A79-L83 PolarHBondContact O-N 3.42Å; S80-L83 PolarHBondContact O-N 3.14Å; L83-G85 VanDerWaalsContact C-N 3.29Å
84	Q	85.1	Confident	85.8	Confident	101 Å²	101	68.3 Å²	68.3	47%	0.472	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	3.8	173.4	-70.7	169.8	21.3	0	0	113.6	S80 Y81 Y82 Q86	S80-Q84 WeakPolarHBondContact O-CB 3.33Å; S80-Q84 WeakPolarHBondContact O-CG 3.31Å; S80-Q84 PolarHBondContact O-N 3.44Å; Y81-Q84 PolarHBondContact O-N 2.95Å; Y82-Q84 VanDerWaalsContact C-N 3.27Å; Y82-Q84 PolarHBondContact O-N 3.36Å; Q84-Q86 HydrophobicContact CB-CG 4.12Å; Q84-Q86 PolarHBondContact O-N 2.9Å
85	G	85.6	Confident	86	Confident	43 Å²	43	72.7 Å²	72.7	44%	0.443	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	10.7	-177.3	0	0	0	0	0	114.7	Y81 Y82 L83 H87	Y81-G85 PolarHBondContact O-N 3.31Å; Y82-G85 PolarHBondContact O-N 3.14Å; L83-G85 VanDerWaalsContact C-N 3.29Å; G85-H87 VanDerWaalsContact C-N 3.26Å; G85-H87 PolarHBondContact O-CD2 3.3Å; G85-H87 PolarHBondContact O-N 3.12Å
86	Q	84.4	Confident	86.1	Confident	64 Å²	64	69.7 Å²	69.7	30%	0.299	36%	0.362	S	S	.	.			trans	-84.8	65.3	-176.4	-62	-161.3	-7	0	0	111.2	Y81 Q84 T88 C89 F90	Y81-Q86 PolarHBondContact O-N 3.34Å; Q84-Q86 HydrophobicContact CB-CG 4.12Å; Q84-Q86 PolarHBondContact O-N 2.9Å; Q86-T88 PolarHBondContact O-N 3.47Å; Q86-T88 VanDerWaalsContact O-N 3.1Å; Q86-C89 HydrophobicContact CB-CB 3.98Å; Q86-C89 PolarHBondContact O-N 3.06Å; Q86-C89 VanDerWaalsContact O-N 3.09Å; Q86-C89 PolarHBondContact OE1-SG 3.35Å; Q86-C89 VanDerWaalsContact OE1-SG 3.41Å; Q86-F90 WeakPolarHBondContact O-CB 3.23Å; Q86-F90 PolarHBondContact O-N 2.99Å
87	H	86.7	Confident	86	Confident	114 Å²	114	61.7 Å²	61.7	53%	0.528	33%	0.334	S	S	.	.	H	α-helix	trans	-55.3	-30.4	-173.9	-62.3	-69.2	0	0	0	114.3	G85 S91	G85-H87 VanDerWaalsContact C-N 3.26Å; G85-H87 PolarHBondContact O-CD2 3.3Å; G85-H87 PolarHBondContact O-N 3.12Å; H87-S91 VanDerWaalsContact O-CB 3.29Å; H87-S91 WeakPolarHBondContact O-CB 3.28Å; H87-S91 PolarHBondContact O-N 3.41Å; H87-S91 PolarHBondContact O-OG 3.13Å
88	T	85.9	Confident	86.2	Confident	104 Å²	104	64.1 Å²	64.1	64%	0.638	35%	0.347	S	S	*	.	H	α-helix	trans	-70.3	-50.9	174.5	47.7	0	0	0	0	112	Q86 F90 S91 L92	Q86-T88 PolarHBondContact O-N 3.47Å; Q86-T88 VanDerWaalsContact O-N 3.1Å; T88-F90 VanDerWaalsContact C-N 3.32Å; T88-F90 PolarHBondContact O-N 2.82Å; T88-S91 PolarHBondContact O-N 2.92Å; T88-L92 WeakPolarHBondContact O-CB 3.25Å; T88-L92 WeakPolarHBondContact O-CG 3.48Å; T88-L92 PolarHBondContact O-N 3.21Å
89	C	81.3	Confident	86.4	Confident	28 Å²	28	68.6 Å²	68.6	19%	0.189	37%	0.37	C	S	.	.	H	α-helix	trans	-59.4	-43.1	175.4	-59.6	0	0	0	0	111.5	Y81 Q86 T93	Y81-C89 HydrophobicContact CD1-CB 3.99Å; Y81-C89 HydrophobicContact CD2-CB 3.82Å; Y81-C89 HydrophobicContact CE1-CB 4.29Å; Y81-C89 HydrophobicContact CE2-CB 4.12Å; Y81-C89 HydrophobicContact CG-CB 3.75Å; Q86-C89 HydrophobicContact CB-CB 3.98Å; Q86-C89 PolarHBondContact O-N 3.06Å; Q86-C89 VanDerWaalsContact O-N 3.09Å; Q86-C89 PolarHBondContact OE1-SG 3.35Å; Q86-C89 VanDerWaalsContact OE1-SG 3.41Å; C89-T93 WeakPolarHBondContact O-CB 3.24Å; C89-T93 PolarHBondContact O-N 2.88Å; C89-T93 PolarHBondContact O-OG1 3.12Å
90	F	87.8	Confident	86.6	Confident	51 Å²	51	66.9 Å²	66.9	22%	0.224	36%	0.355	C	S	.	.	H	α-helix	trans	-57.4	-53.5	173.1	169.6	-111	0	0	0	111.9	A78 Y82 Q86 T88 L92 T93 L94	A78-F90 HydrophobicContact CB-CD2 4.22Å; A78-F90 HydrophobicContact CB-CE2 4.4Å; A78-F90 WeakPolarHBondContact O-CD2 3.32Å; Y82-F90 HydrophobicContact CD2-CD1 4.3Å; Y82-F90 HydrophobicContact CD2-CE1 4.1Å; Y82-F90 HydrophobicContact CD2-CE2 4.32Å; Y82-F90 HydrophobicContact CD2-CG 4.5Å; Y82-F90 HydrophobicContact CD2-CZ 4.1Å; Q86-F90 WeakPolarHBondContact O-CB 3.23Å; Q86-F90 PolarHBondContact O-N 2.99Å; T88-F90 VanDerWaalsContact C-N 3.32Å; T88-F90 PolarHBondContact O-N 2.82Å; F90-L92 PolarHBondContact O-N 2.75Å; F90-T93 PolarHBondContact O-N 3.32Å; F90-L94 HydrophobicContact CE1-CD2 4.39Å; F90-L94 HydrophobicContact CZ-CD2 4.03Å; F90-L94 WeakPolarHBondContact O-CB 3.47Å; F90-L94 PolarHBondContact O-N 3.03Å
91	S	87.7	Confident	86.8	Confident	68 Å²	68	66 Å²	66	48%	0.476	35%	0.349	S	S	.	.	H	α-helix	trans	-63.8	-39.8	-177.2	-57.9	0	0	0	0	112.6	H87 T88 L95	H87-S91 VanDerWaalsContact O-CB 3.29Å; H87-S91 WeakPolarHBondContact O-CB 3.28Å; H87-S91 PolarHBondContact O-N 3.41Å; H87-S91 PolarHBondContact O-OG 3.13Å; T88-S91 PolarHBondContact O-N 2.92Å; S91-L95 WeakPolarHBondContact O-CB 3.4Å; S91-L95 PolarHBondContact O-N 2.88Å
92	L	85.4	Confident	87	Confident	81 Å²	81	70.4 Å²	70.4	42%	0.424	37%	0.372	S	S	.	.	H	α-helix	trans	-66.5	-44.2	176.1	-71.4	170.9	0	0	0	111.8	T88 F90 L95 F96	T88-L92 WeakPolarHBondContact O-CB 3.25Å; T88-L92 WeakPolarHBondContact O-CG 3.48Å; T88-L92 PolarHBondContact O-N 3.21Å; F90-L92 PolarHBondContact O-N 2.75Å; L92-L95 PolarHBondContact O-N 2.86Å; L92-F96 WeakPolarHBondContact O-CD2 3.35Å; L92-F96 PolarHBondContact O-N 3.04Å
93	T	85	Confident	87	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.006	36%	0.362	C	S	.	.	H	α-helix	trans	-63	-45.8	177.2	-52.9	0	0	0	0	110.6	A78 Y81 C89 F90 L95 F96 V97	A78-T93 HydrophobicContact CB-CG2 4.16Å; Y81-T93 VanDerWaalsContact CE2-OG1 3.29Å; Y81-T93 WeakPolarHBondContact CE2-OG1 3.09Å; C89-T93 WeakPolarHBondContact O-CB 3.24Å; C89-T93 PolarHBondContact O-N 2.88Å; C89-T93 PolarHBondContact O-OG1 3.12Å; F90-T93 PolarHBondContact O-N 3.32Å; T93-L95 VanDerWaalsContact C-N 3.3Å; T93-L95 PolarHBondContact O-N 3.32Å; T93-F96 PolarHBondContact O-N 2.7Å; T93-V97 WeakPolarHBondContact O-CG2 3.4Å; T93-V97 PolarHBondContact O-N 2.8Å
94	L	87.6	Confident	87.1	Confident	62 Å²	62	59.2 Å²	59.2	33%	0.325	32%	0.324	S	S	.	.	H	α-helix	trans	-62.4	-36.9	177.2	-172.1	64.2	0	0	0	112.1	F90 V97 L98	F90-L94 HydrophobicContact CE1-CD2 4.39Å; F90-L94 HydrophobicContact CZ-CD2 4.03Å; F90-L94 WeakPolarHBondContact O-CB 3.47Å; F90-L94 PolarHBondContact O-N 3.03Å; L94-V97 PolarHBondContact O-N 3.31Å; L94-L98 HydrophobicContact CD1-CD1 3.81Å; L94-L98 HydrophobicContact CD1-CG 3.95Å; L94-L98 HydrophobicContact CD2-CD1 4.38Å; L94-L98 HydrophobicContact CG-CD1 3.78Å; L94-L98 HydrophobicContact CG-CG 4.22Å; L94-L98 WeakPolarHBondContact O-CB 3.22Å; L94-L98 WeakPolarHBondContact O-CG 3.39Å; L94-L98 PolarHBondContact O-N 3.05Å
95	L	88.8	Confident	87.4	Confident	95 Å²	95	55.3 Å²	55.3	50%	0.497	31%	0.306	S	S	.	.	H	α-helix	trans	-64.2	-47	173.9	-179.5	64	0	0	0	112	S91 L92 T93 V97 L98 L99	S91-L95 WeakPolarHBondContact O-CB 3.4Å; S91-L95 PolarHBondContact O-N 2.88Å; L92-L95 PolarHBondContact O-N 2.86Å; T93-L95 VanDerWaalsContact C-N 3.3Å; T93-L95 PolarHBondContact O-N 3.32Å; L95-V97 VanDerWaalsContact C-N 3.27Å; L95-V97 PolarHBondContact O-N 3.25Å; L95-L98 PolarHBondContact O-N 3.33Å; L95-L99 HydrophobicContact CD1-CB 4.19Å; L95-L99 HydrophobicContact CD1-CD2 4.39Å; L95-L99 WeakPolarHBondContact O-CB 3.44Å; L95-L99 PolarHBondContact O-N 3.08Å
96	F	86.7	Confident	87.6	Confident	60 Å²	60	58.4 Å²	58.4	26%	0.263	31%	0.312	S	S	.	.	H	α-helix	trans	-65.9	-25.8	176.7	-73.6	-59.5	0	0	0	113.3	L92 T93 P100 R239 P242	L92-F96 WeakPolarHBondContact O-CD2 3.35Å; L92-F96 PolarHBondContact O-N 3.04Å; T93-F96 PolarHBondContact O-N 2.7Å; F96-P100 WeakPolarHBondContact O-CD 3.22Å; F96-P100 WeakPolarHBondContact O-CG 3.19Å; F96-R239 WeakPolarHBondContact O-CB 3.25Å; F96-R239 VanDerWaalsContact O-CG 3.24Å; F96-R239 WeakPolarHBondContact O-CG 3.43Å; F96-P242 HydrophobicContact CD1-CB 4.12Å; F96-P242 HydrophobicContact CE1-CB 3.67Å; F96-P242 HydrophobicContact CE1-CG 4.25Å; F96-P242 HydrophobicContact CZ-CB 3.98Å
97	V	87.1	Confident	87.8	Confident	24 Å²	24	57.6 Å²	57.6	15%	0.145	31%	0.31	C	S	.	.	H	α-helix	trans	-77.7	-52.1	171.8	172	0	0	0	0	111.4	D74 T93 L94 L95 S101	D74-V97 HydrophobicContact CB-CG2 3.71Å; T93-V97 WeakPolarHBondContact O-CG2 3.4Å; T93-V97 PolarHBondContact O-N 2.8Å; L94-V97 PolarHBondContact O-N 3.31Å; L95-V97 VanDerWaalsContact C-N 3.27Å; L95-V97 PolarHBondContact O-N 3.25Å; V97-S101 WeakPolarHBondContact O-CB 3.33Å; V97-S101 PolarHBondContact O-N 3.32Å
98	L	87.8	Confident	87.9	Confident	80 Å²	80	52.2 Å²	52.2	42%	0.419	29%	0.285	S	S	.	.	H	α-helix	trans	-76.2	-42.7	-169.4	-68.4	-179	0	0	0	113.9	L94 L95 L102	L94-L98 HydrophobicContact CD1-CD1 3.81Å; L94-L98 HydrophobicContact CD1-CG 3.95Å; L94-L98 HydrophobicContact CD2-CD1 4.38Å; L94-L98 HydrophobicContact CG-CD1 3.78Å; L94-L98 HydrophobicContact CG-CG 4.22Å; L94-L98 WeakPolarHBondContact O-CB 3.22Å; L94-L98 WeakPolarHBondContact O-CG 3.39Å; L94-L98 PolarHBondContact O-N 3.05Å; L95-L98 PolarHBondContact O-N 3.33Å; L98-L102 VanDerWaalsContact O-CB 3.29Å; L98-L102 WeakPolarHBondContact O-CB 3.39Å; L98-L102 PolarHBondContact O-N 2.94Å
99	L	89.4	Confident	88	Confident	99 Å²	99	50.2 Å²	50.2	52%	0.518	27%	0.267	S	S	.	.	H	α-helix	trans	-66.8	-48.4	-173.9	174.5	66.6	0	0	0	112.3	L95 L102 V103	L95-L99 HydrophobicContact CD1-CB 4.19Å; L95-L99 HydrophobicContact CD1-CD2 4.39Å; L95-L99 WeakPolarHBondContact O-CB 3.44Å; L95-L99 PolarHBondContact O-N 3.08Å; L99-L102 PolarHBondContact O-N 3.39Å; L99-V103 WeakPolarHBondContact O-CG2 3.31Å; L99-V103 PolarHBondContact O-N 3.17Å
100	P	89.6	Confident	88.3	Confident	6 Å²	6	56 Å²	56	4%	0.039	29%	0.285	C	S	.	.	H	α-helix	trans	-66.2	-39.6	175.6	-25.4	40.3	0	0	0	112.8	F96 L102 V103 V104 E235 L238 R239	F96-P100 WeakPolarHBondContact O-CD 3.22Å; F96-P100 WeakPolarHBondContact O-CG 3.19Å; P100-L102 VanDerWaalsContact C-N 3.35Å; P100-L102 PolarHBondContact O-N 2.95Å; P100-V103 PolarHBondContact O-N 3.29Å; P100-V104 WeakPolarHBondContact O-CB 3.26Å; P100-V104 VanDerWaalsContact O-CG2 3.29Å; P100-V104 WeakPolarHBondContact O-CG2 3.45Å; P100-V104 PolarHBondContact O-N 2.72Å; P100-E235 HydrophobicContact CB-CG 4.39Å; P100-L238 HydrophobicContact CB-CB 3.75Å; P100-L238 HydrophobicContact CG-CB 3.77Å; P100-L238 WeakPolarHBondContact CG-O 3.43Å; P100-R239 HydrophobicContact CB-CB 3.98Å; P100-R239 HydrophobicContact CG-CB 3.91Å
101	S	88.7	Confident	88.3	Confident	8 Å²	8	54.9 Å²	54.9	6%	0.056	28%	0.279	C	S	.	.	H	α-helix	trans	-56	-50.1	173.5	179	0	0	0	0	110.5	V97 V103 V104 Q105 Q189	V97-S101 WeakPolarHBondContact O-CB 3.33Å; V97-S101 PolarHBondContact O-N 3.32Å; S101-V103 PolarHBondContact O-N 3.16Å; S101-V104 PolarHBondContact O-N 3.39Å; S101-Q105 WeakPolarHBondContact O-CB 3.37Å; S101-Q105 PolarHBondContact O-N 3.07Å; S101-Q189 PolarHBondContact OG-OE1 2.93Å
102	L	89.4	Confident	88.1	Confident	100 Å²	100	52.1 Å²	52.1	52%	0.524	26%	0.259	S	S	.	.	H	α-helix	trans	-60.2	-44.9	177.7	-179.1	145.6	0	0	0	112.8	L98 L99 P100 Q105 L106	L98-L102 VanDerWaalsContact O-CB 3.29Å; L98-L102 WeakPolarHBondContact O-CB 3.39Å; L98-L102 PolarHBondContact O-N 2.94Å; L99-L102 PolarHBondContact O-N 3.39Å; P100-L102 VanDerWaalsContact C-N 3.35Å; P100-L102 PolarHBondContact O-N 2.95Å; L102-Q105 PolarHBondContact O-N 3.14Å; L102-L106 HydrophobicContact CD2-CD1 3.63Å; L102-L106 HydrophobicContact CD2-CG 4.37Å; L102-L106 HydrophobicContact CG-CD1 4.35Å; L102-L106 WeakPolarHBondContact O-CB 3.47Å; L102-L106 VanDerWaalsContact O-CG 3.3Å; L102-L106 WeakPolarHBondContact O-CG 3.33Å; L102-L106 PolarHBondContact O-N 3.14Å
103	V	89.5	Confident	88.1	Confident	53 Å²	53	50.3 Å²	50.3	32%	0.321	25%	0.251	S	S	.	.	H	α-helix	trans	-59.7	-49.2	177	168.3	0	0	0	0	111.3	L99 P100 S101 Q105 L106 L107 L234	L99-V103 WeakPolarHBondContact O-CG2 3.31Å; L99-V103 PolarHBondContact O-N 3.17Å; P100-V103 PolarHBondContact O-N 3.29Å; S101-V103 PolarHBondContact O-N 3.16Å; V103-Q105 VanDerWaalsContact C-N 3.31Å; V103-Q105 PolarHBondContact O-N 3.23Å; V103-L106 PolarHBondContact O-N 2.82Å; V103-L107 HydrophobicContact CG1-CD1 4.25Å; V103-L107 WeakPolarHBondContact O-CG 3.43Å; V103-L107 PolarHBondContact O-N 3.15Å; V103-L234 HydrophobicContact CG1-CD2 4.41Å
104	V	90.4	Very high	88	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-68.1	-34.3	-179.3	174.5	0	0	0	0	111.2	P100 S101 L107 S108 Q192 L231 L234 E235	P100-V104 WeakPolarHBondContact O-CB 3.26Å; P100-V104 VanDerWaalsContact O-CG2 3.29Å; P100-V104 WeakPolarHBondContact O-CG2 3.45Å; P100-V104 PolarHBondContact O-N 2.72Å; S101-V104 PolarHBondContact O-N 3.39Å; V104-L107 PolarHBondContact O-N 2.9Å; V104-S108 PolarHBondContact O-N 3.48Å; V104-Q192 HydrophobicContact CG1-CG 4.45Å; V104-Q192 VanDerWaalsContact CG1-NE2 3.35Å; V104-L231 HydrophobicContact CG1-CB 3.76Å; V104-L231 HydrophobicContact CG1-CD2 3.82Å; V104-L231 HydrophobicContact CG1-CG 4.25Å; V104-L234 HydrophobicContact CG2-CB 4.35Å; V104-L234 HydrophobicContact CG2-CD2 4.16Å; V104-L234 HydrophobicContact CG2-CG 4.17Å; V104-E235 HydrophobicContact CG2-CB 4.07Å
105	Q	90.3	Very high	87.7	Confident	19 Å²	19	52.6 Å²	52.6	9%	0.089	26%	0.259	C	S	.	.	H	α-helix	trans	-72.9	-36.2	179.2	-166.3	51.2	93.7	0	0	112.2	S101 L102 V103 F109 H186 Q189 G191	S101-Q105 WeakPolarHBondContact O-CB 3.37Å; S101-Q105 PolarHBondContact O-N 3.07Å; L102-Q105 PolarHBondContact O-N 3.14Å; V103-Q105 VanDerWaalsContact C-N 3.31Å; V103-Q105 PolarHBondContact O-N 3.23Å; Q105-F109 PolarHBondContact O-N 3.27Å; Q105-H186 VanDerWaalsContact CD-O 3.3Å; Q105-H186 HydrophobicContact CG-CB 4.45Å; Q105-H186 WeakPolarHBondContact CG-O 3.12Å; Q105-H186 PolarHBondContact NE2-CD2 3.22Å; Q105-H186 PolarHBondContact NE2-NE2 3.16Å; Q105-Q189 VanDerWaalsContact OE1-C 3.24Å; Q105-Q189 VanDerWaalsContact OE1-CA 3.28Å; Q105-Q189 PolarHBondContact OE1-O 2.96Å; Q105-G191 VanDerWaalsContact OE1-N 3.08Å
106	L	89.2	Confident	87.2	Confident	109 Å²	109	52.9 Å²	52.9	57%	0.571	25%	0.254	S	S	*	.	H	α-helix	trans	-65.4	-41.9	169.1	-74.8	174.7	0	0	0	112.2	L102 V103 F109 R110	L102-L106 HydrophobicContact CD2-CD1 3.63Å; L102-L106 HydrophobicContact CD2-CG 4.37Å; L102-L106 HydrophobicContact CG-CD1 4.35Å; L102-L106 WeakPolarHBondContact O-CB 3.47Å; L102-L106 VanDerWaalsContact O-CG 3.3Å; L102-L106 WeakPolarHBondContact O-CG 3.33Å; L102-L106 PolarHBondContact O-N 3.14Å; V103-L106 PolarHBondContact O-N 2.82Å; L106-F109 PolarHBondContact O-N 2.84Å; L106-R110 WeakPolarHBondContact O-CB 3.34Å; L106-R110 PolarHBondContact O-N 3.28Å
107	L	88.8	Confident	86.6	Confident	47 Å²	47	53.5 Å²	53.5	25%	0.246	27%	0.266	C	S	.	.	H	α-helix	trans	-63.1	-45.4	175.5	-73.1	170.4	0	0	0	111.7	V103 V104 F109 R110 W111 L231 L234	V103-L107 HydrophobicContact CG1-CD1 4.25Å; V103-L107 WeakPolarHBondContact O-CG 3.43Å; V103-L107 PolarHBondContact O-N 3.15Å; V104-L107 PolarHBondContact O-N 2.9Å; L107-F109 VanDerWaalsContact C-N 3.29Å; L107-F109 PolarHBondContact O-N 3.39Å; L107-R110 PolarHBondContact O-N 3.43Å; L107-W111 VanDerWaalsContact O-CG 3.23Å; L107-W111 PolarHBondContact O-N 2.71Å; L107-L231 HydrophobicContact CB-CD2 3.91Å; L107-L234 HydrophobicContact CD1-CD2 3.42Å; L107-L234 VanDerWaalsContact CD1-CD2 3.42Å
108	S	89.9	Confident	85.2	Confident	1 Å²	1	56 Å²	56	1%	0.007	28%	0.277	C	S	.	.	H	α-helix	trans	-60.4	-37.7	173.9	-178.3	0	0	0	0	112.4	V104 F112 H186 R195	V104-S108 PolarHBondContact O-N 3.48Å; S108-F112 PolarHBondContact O-N 3.25Å; S108-H186 PolarHBondContact OG-NE2 3.27Å; S108-R195 PolarHBondContact OG-NE 3.17Å; S108-R195 VanDerWaalsContact OG-NE 3.08Å
109	F	87.9	Confident	83.5	Confident	61 Å²	61	56.8 Å²	56.8	27%	0.268	29%	0.286	S	S	.	.	H	α-helix	trans	-67.4	-48.7	176.2	-170.2	-108.5	0	0	0	111.7	Q105 L106 L107 W111 F112 V113 H186	Q105-F109 PolarHBondContact O-N 3.27Å; L106-F109 PolarHBondContact O-N 2.84Å; L107-F109 VanDerWaalsContact C-N 3.29Å; L107-F109 PolarHBondContact O-N 3.39Å; F109-W111 PolarHBondContact O-N 3.27Å; F109-F112 PolarHBondContact O-N 3.21Å; F109-V113 HydrophobicContact CD1-CG2 3.9Å; F109-V113 HydrophobicContact CE1-CG2 3.57Å; F109-V113 HydrophobicContact CE2-CG2 4.41Å; F109-V113 HydrophobicContact CG-CG2 4.46Å; F109-V113 HydrophobicContact CZ-CG2 3.85Å; F109-V113 WeakPolarHBondContact O-CG2 3.42Å; F109-V113 PolarHBondContact O-N 2.93Å; F109-H186 HydrophobicContact CD2-CB 4.28Å; F109-H186 AromaticContact CD2-CD2 3.91Å; F109-H186 PolarHBondContact N-CD2 2.92Å
110	R	88.3	Confident	81.5	Confident	150 Å²	150	57.1 Å²	57.1	57%	0.566	30%	0.303	S	S	*	.	H	α-helix	trans	-54.7	-39.4	176.2	-172.9	174.4	75.8	109.9	-6.9	111.5	L106 L107 Y114	L106-R110 WeakPolarHBondContact O-CB 3.34Å; L106-R110 PolarHBondContact O-N 3.28Å; L107-R110 PolarHBondContact O-N 3.43Å; R110-Y114 WeakPolarHBondContact O-CB 3.23Å; R110-Y114 PolarHBondContact O-N 2.88Å
111	W	85.8	Confident	79.3	Confident	27 Å²	27	60 Å²	60	10%	0.102	34%	0.335	C	S	.	.	H	α-helix	trans	-67.6	-42.4	174.5	-69.1	-6.4	0	0	0	113.4	L107 F109 Y114 D115 D227 M230 L231	L107-W111 VanDerWaalsContact O-CG 3.23Å; L107-W111 PolarHBondContact O-N 2.71Å; F109-W111 PolarHBondContact O-N 3.27Å; W111-Y114 WeakPolarHBondContact O-CB 3.35Å; W111-Y114 PolarHBondContact O-N 3.27Å; W111-D115 PolarHBondContact O-N 2.92Å; W111-D227 HydrophobicContact CE3-CB 4.21Å; W111-D227 HydrophobicContact CZ3-CB 3.75Å; W111-M230 HydrophobicContact CH2-CE 3.46Å; W111-M230 VanDerWaalsContact CH2-CE 3.46Å; W111-M230 HydrophobicContact CZ2-CE 3.54Å; W111-L231 HydrophobicContact CE3-CD1 3.97Å; W111-L231 HydrophobicContact CE3-CD2 4.33Å; W111-L231 HydrophobicContact CE3-CG 4.27Å; W111-L231 HydrophobicContact CH2-CD1 4.28Å; W111-L231 HydrophobicContact CH2-CD2 3.67Å; W111-L231 HydrophobicContact CH2-CG 3.68Å; W111-L231 HydrophobicContact CZ2-CD2 4.34Å; W111-L231 HydrophobicContact CZ3-CD1 3.49Å; W111-L231 VanDerWaalsContact CZ3-CD1 3.49Å; W111-L231 HydrophobicContact CZ3-CD2 3.7Å; W111-L231 HydrophobicContact CZ3-CG 3.4Å; W111-L231 VanDerWaalsContact CZ3-CG 3.4Å
112	F	85.2	Confident	76.5	Confident	10 Å²	10	64.4 Å²	64.4	4%	0.044	37%	0.365	C	S	.	.	H	α-helix	trans	-62.7	-44.9	173.9	168.6	-93.8	0	0	0	112.1	S108 F109 Y114 D115 Y116 I178 W179 Q182	S108-F112 PolarHBondContact O-N 3.25Å; F109-F112 PolarHBondContact O-N 3.21Å; F112-Y114 VanDerWaalsContact C-N 3.29Å; F112-Y114 PolarHBondContact O-N 3.4Å; F112-D115 PolarHBondContact O-N 3.46Å; F112-D115 VanDerWaalsContact O-N 3.13Å; F112-Y116 AromaticContact CD2-CD2 3.75Å; F112-Y116 HydrophobicContact CD2-CD2 3.75Å; F112-Y116 HydrophobicContact CD2-CE2 4.18Å; F112-Y116 AromaticContact CE2-CD2 3.21Å; F112-Y116 HydrophobicContact CE2-CD2 3.21Å; F112-Y116 AromaticContact CE2-CE2 3.46Å; F112-Y116 HydrophobicContact CE2-CE2 3.46Å; F112-Y116 VanDerWaalsContact CE2-CE2 3.46Å; F112-Y116 AromaticContact CE2-CG 3.95Å; F112-Y116 HydrophobicContact CE2-CG 3.95Å; F112-Y116 AromaticContact CZ-CD2 3.66Å; F112-Y116 HydrophobicContact CZ-CD2 3.66Å; F112-Y116 HydrophobicContact CZ-CE2 4.11Å; F112-Y116 AromaticContact CZ-CG 3.89Å; F112-Y116 HydrophobicContact CZ-CG 3.89Å; F112-Y116 PolarHBondContact O-N 3.06Å; F112-I178 HydrophobicContact CZ-CG2 4.32Å; F112-W179 AromaticContact CE1-CD2 3.9Å; F112-W179 HydrophobicContact CE1-CD2 3.9Å; F112-W179 HydrophobicContact CE1-CE3 4.04Å; F112-W179 HydrophobicContact CE1-CG 4.35Å; F112-W179 HydrophobicContact CE1-CZ2 4.36Å; F112-W179 HydrophobicContact CE1-CZ3 4.35Å; F112-W179 HydrophobicContact CZ-CD2 4.47Å; F112-Q182 HydrophobicContact CB-CG 4.33Å; F112-Q182 HydrophobicContact CD1-CB 4.37Å; F112-Q182 HydrophobicContact CD1-CG 3.71Å; F112-Q182 HydrophobicContact CD2-CB 4.31Å; F112-Q182 HydrophobicContact CD2-CG 3.47Å; F112-Q182 VanDerWaalsContact CD2-CG 3.47Å; F112-Q182 VanDerWaalsContact CD2-NE2 3.25Å; F112-Q182 HydrophobicContact CE1-CB 3.92Å; F112-Q182 HydrophobicContact CE1-CG 3.77Å; F112-Q182 HydrophobicContact CE2-CB 3.82Å; F112-Q182 HydrophobicContact CE2-CG 3.5Å; F112-Q182 HydrophobicContact CG-CG 3.55Å; F112-Q182 HydrophobicContact CZ-CB 3.62Å; F112-Q182 HydrophobicContact CZ-CG 3.67Å
113	V	85.8	Confident	74.1	Confident	43 Å²	43	65.4 Å²	65.4	26%	0.261	38%	0.378	S	S	.	.	H	α-helix	trans	-55.9	-47.2	174.3	170	0	0	0	0	109.7	F109 D115 Y116 S117 W179	F109-V113 HydrophobicContact CD1-CG2 3.9Å; F109-V113 HydrophobicContact CE1-CG2 3.57Å; F109-V113 HydrophobicContact CE2-CG2 4.41Å; F109-V113 HydrophobicContact CG-CG2 4.46Å; F109-V113 HydrophobicContact CZ-CG2 3.85Å; F109-V113 WeakPolarHBondContact O-CG2 3.42Å; F109-V113 PolarHBondContact O-N 2.93Å; V113-D115 VanDerWaalsContact C-N 3.34Å; V113-D115 PolarHBondContact O-N 2.97Å; V113-Y116 PolarHBondContact O-N 3.11Å; V113-S117 WeakPolarHBondContact O-CB 3.43Å; V113-S117 PolarHBondContact O-N 3.07Å; V113-S117 PolarHBondContact O-OG 3.27Å; V113-S117 VanDerWaalsContact O-OG 3.07Å; V113-W179 HydrophobicContact CB-CH2 4.25Å; V113-W179 HydrophobicContact CG1-CH2 4.19Å; V113-W179 HydrophobicContact CG2-CH2 3.87Å; V113-W179 HydrophobicContact CG2-CZ3 3.91Å
114	Y	81.9	Confident	71.5	Confident	64 Å²	64	65.3 Å²	65.3	25%	0.251	39%	0.387	S	S	.	.	H	α-helix	trans	-58.1	-45.1	175.7	-164	-80	0	0	0	112.5	R110 W111 F112 E118 R542 R543 K546	R110-Y114 WeakPolarHBondContact O-CB 3.23Å; R110-Y114 PolarHBondContact O-N 2.88Å; W111-Y114 WeakPolarHBondContact O-CB 3.35Å; W111-Y114 PolarHBondContact O-N 3.27Å; F112-Y114 VanDerWaalsContact C-N 3.29Å; F112-Y114 PolarHBondContact O-N 3.4Å; Y114-E118 VanDerWaalsContact CE1-OE2 3.3Å; Y114-E118 WeakPolarHBondContact CE1-OE2 3.31Å; Y114-E118 VanDerWaalsContact CZ-OE2 3.26Å; Y114-E118 PolarHBondContact OH-OE1 3.22Å; Y114-E118 VanDerWaalsContact OH-OE1 3.1Å; Y114-E118 PolarHBondContact OH-OE2 3.22Å; Y114-R542 HydrophobicContact CD1-CB 3.7Å; Y114-R542 HydrophobicContact CD1-CG 4.45Å; Y114-R542 HydrophobicContact CE1-CB 3.88Å; Y114-R543 HydrophobicContact CE1-CG 4.24Å; Y114-R543 WeakPolarHBondContact OH-CG 3.06Å; Y114-R543 PolarHBondContact OH-NE 3.29Å; Y114-K546 PolarHBondContact O-NZ 3.13Å
115	D	81.2	Confident	68.8	Low	48 Å²	48	71.2 Å²	71.2	26%	0.257	43%	0.425	S	S	.	.	H	α-helix	trans	-67.5	-36.6	-177.7	-67.2	-11.8	0	0	0	112.4	W111 F112 V113 R542	W111-D115 PolarHBondContact O-N 2.92Å; F112-D115 PolarHBondContact O-N 3.46Å; F112-D115 VanDerWaalsContact O-N 3.13Å; V113-D115 VanDerWaalsContact C-N 3.34Å; V113-D115 PolarHBondContact O-N 2.97Å; D115-R542 IonicContact OD1-CZ 2.78Å; D115-R542 IonicContact OD1-NH1 3.19Å; D115-R542 PolarHBondContact OD1-NH1 3.16Å; D115-R542 IonicContact OD2-NH1 3.48Å; D115-R542 PolarHBondContact OD2-NH1 2.78Å
116	Y	77.4	Confident	66.2	Low	100 Å²	100	74.6 Å²	74.6	39%	0.392	46%	0.457	S	S	.	.	H	α-helix	trans	-95	-22.1	-175.1	-101.2	-93.2	0	0	0	116.3	F112 V113 I178 W179	F112-Y116 AromaticContact CD2-CD2 3.75Å; F112-Y116 HydrophobicContact CD2-CD2 3.75Å; F112-Y116 HydrophobicContact CD2-CE2 4.18Å; F112-Y116 AromaticContact CE2-CD2 3.21Å; F112-Y116 HydrophobicContact CE2-CD2 3.21Å; F112-Y116 AromaticContact CE2-CE2 3.46Å; F112-Y116 HydrophobicContact CE2-CE2 3.46Å; F112-Y116 VanDerWaalsContact CE2-CE2 3.46Å; F112-Y116 AromaticContact CE2-CG 3.95Å; F112-Y116 HydrophobicContact CE2-CG 3.95Å; F112-Y116 AromaticContact CZ-CD2 3.66Å; F112-Y116 HydrophobicContact CZ-CD2 3.66Å; F112-Y116 HydrophobicContact CZ-CE2 4.11Å; F112-Y116 AromaticContact CZ-CG 3.89Å; F112-Y116 HydrophobicContact CZ-CG 3.89Å; F112-Y116 PolarHBondContact O-N 3.06Å; V113-Y116 PolarHBondContact O-N 3.11Å; Y116-I178 HydrophobicContact CE1-CG2 3.9Å; Y116-I178 HydrophobicContact CE2-CG2 4.41Å; Y116-W179 AromaticContact CD1-NE1 3.92Å
117	S	74.7	Confident	63.6	Low	73 Å²	73	74.8 Å²	74.8	51%	0.51	46%	0.462	S	S	.	.	H	α-helix	trans	-80.3	-29.4	-175.4	-71.8	0	0	0	0	114.3	V113 P119	V113-S117 WeakPolarHBondContact O-CB 3.43Å; V113-S117 PolarHBondContact O-N 3.07Å; V113-S117 PolarHBondContact O-OG 3.27Å; V113-S117 VanDerWaalsContact O-OG 3.07Å; S117-P119 WeakPolarHBondContact O-CD 3.24Å
118	E	58.8	Low	60.7	Low	78 Å²	78	77.3 Å²	77.3	36%	0.364	48%	0.484	S	S	.	.	S	Bend	trans	-92.3	117.1	173.2	-60.2	177.8	133.6	0	0	110.6	Y114 K546	Y114-E118 VanDerWaalsContact CE1-OE2 3.3Å; Y114-E118 WeakPolarHBondContact CE1-OE2 3.31Å; Y114-E118 VanDerWaalsContact CZ-OE2 3.26Å; Y114-E118 PolarHBondContact OH-OE1 3.22Å; Y114-E118 VanDerWaalsContact OH-OE1 3.1Å; Y114-E118 PolarHBondContact OH-OE2 3.22Å; E118-K546 IonicContact OE2-NZ 2.78Å; E118-K546 PolarHBondContact OE2-NZ 2.88Å
119	P	51.2	Low	58	Low	96 Å²	96	84.2 Å²	84.2	62%	0.623	53%	0.526	S	S	*	.			trans	-66.9	145.2	166.5	30.2	-33.7	0	0	0	110	S117 G121	S117-P119 WeakPolarHBondContact O-CD 3.24Å; P119-G121 PolarHBondContact O-N 3.35Å
120	A	46.6	Very low	55.2	Low	106 Å²	106	89.7 Å²	89.7	88%	0.876	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	50.1	-177.7	0	0	0	0	0	113.5
121	G	43.5	Very low	52.2	Low	67 Å²	67	90.4 Å²	90.4	69%	0.691	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.7	-8.1	-174.2	0	0	0	0	0	115.6	P119	P119-G121 PolarHBondContact O-N 3.35Å
122	S	31.3	Very low	49.4	Very low	99 Å²	99	94.2 Å²	94.2	69%	0.692	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-88.6	118.2	160.6	-74.6	0	0	0	0	108.9	G124	S122-G124 PolarHBondContact O-N 3.09Å
123	P	38.5	Very low	46.7	Very low	122 Å²	122	100.4 Å²	100.4	79%	0.792	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-60.8	127	157.3	27.5	-31.4	0	0	0	107.6
124	G	33.9	Very low	43.9	Very low	51 Å²	51	103.2 Å²	103.2	53%	0.526	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-57.9	157.7	163.7	0	0	0	0	0	109.7	S122 A126	S122-G124 PolarHBondContact O-N 3.09Å; G124-A126 PolarHBondContact O-N 3.47Å
125	P	34.6	Very low	41.2	Very low	124 Å²	124	103.5 Å²	103.5	81%	0.805	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-52.8	120	-177.7	22.8	-33.7	0	0	0	109.8	V127	P125-V127 PolarHBondContact O-N 2.85Å
126	A	35.4	Very low	38.5	Very low	91 Å²	91	111.1 Å²	111.1	75%	0.752	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-58.3	135.7	-178.9	0	0	0	0	0	109.5	G124 S128	G124-A126 PolarHBondContact O-N 3.47Å; A126-S128 PolarHBondContact O-N 2.97Å; A126-S128 VanDerWaalsContact O-N 3.15Å
127	V	34.9	Very low	36	Very low	112 Å²	112	111.1 Å²	111.1	68%	0.679	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-57.8	121.9	170.8	175.3	0	0	0	0	107.1	P125 T129	P125-V127 PolarHBondContact O-N 2.85Å; V127-T129 PolarHBondContact O-N 3.38Å; V127-T129 VanDerWaalsContact O-N 3.12Å
128	S	28.6	Very low	33.6	Very low	100 Å²	100	112.7 Å²	112.7	70%	0.699	76%	0.756	S	S	*	*			trans	-72.7	109.2	-159.4	-169.2	0	0	0	0	112.2	A126 K130	A126-S128 PolarHBondContact O-N 2.97Å; A126-S128 VanDerWaalsContact O-N 3.15Å; S128-K130 VanDerWaalsContact C-N 3.28Å; S128-K130 PolarHBondContact O-N 3.46Å; S128-K130 VanDerWaalsContact O-N 3.11Å
129	T	32.1	Very low	32	Very low	146 Å²	146	117 Å²	117	90%	0.896	78%	0.78	S	S	*	*			trans	-80.1	77	162.8	39.1	0	0	0	0	110.2	V127	V127-T129 PolarHBondContact O-N 3.38Å; V127-T129 VanDerWaalsContact O-N 3.12Å
130	K	29.3	Very low	30.7	Very low	176 Å²	176	118 Å²	118	77%	0.765	79%	0.789	S	S	*	*			trans	-134.9	97.7	165.9	-102.7	-166.3	172	-171.3	0	110.7	S128	S128-K130 VanDerWaalsContact C-N 3.28Å; S128-K130 PolarHBondContact O-N 3.46Å; S128-K130 VanDerWaalsContact O-N 3.11Å
131	D	25.5	Very low	29.7	Very low	166 Å²	166	118.7 Å²	118.7	89%	0.888	78%	0.783	S	S	*	*			trans	178.6	123.7	157.6	-86.6	-27.2	0	0	0	104.7
132	S	27.1	Very low	28.7	Very low	106 Å²	106	123.8 Å²	123.8	74%	0.741	79%	0.786	S	S	*	*			cis	-130.8	171.1	-2.9	-51	0	0	0	0	108.2
133	V	28.5	Very low	28.3	Very low	140 Å²	140	125.1 Å²	125.1	85%	0.848	79%	0.785	S	S	*	*				-159.4	151.9	67.5	161.7	0	0	0	0	109
134	A	27.7	Very low	27.8	Very low	102 Å²	102	125.2 Å²	125.2	84%	0.843	79%	0.789	S	S	*	*			trans	-79.2	144.8	177.4	0	0	0	0	0	112.7
135	G	24	Very low	27.4	Very low	70 Å²	70	128.1 Å²	128.1	72%	0.722	81%	0.808	S	S	*	*			trans	178.6	73.4	-179.4	0	0	0	0	0	114.6
136	E	24.6	Very low	27	Very low	208 Å²	208	126.1 Å²	126.1	97%	0.972	81%	0.809	S	S	*	*			trans	58.2	169.6	162.6	-61.4	-172.6	121.5	0	0	118.8
137	A	25.1	Very low	26.5	Very low	101 Å²	101	126.6 Å²	126.6	84%	0.835	81%	0.813	S	S	*	*			trans	-137	137.3	-172.4	0	0	0	0	0	111.4
138	A	25	Very low	26	Very low	105 Å²	105	130.4 Å²	130.4	87%	0.868	82%	0.821	S	S	*	*			trans	-145.2	131.3	164.1	0	0	0	0	0	109.6
139	I	25.5	Very low	25.9	Very low	170 Å²	170	136.8 Å²	136.8	87%	0.872	83%	0.83	S	S	*	*			trans	-96	129	171.3	-64	167.3	0	0	0	107.4
140	S	23.4	Very low	25.6	Very low	116 Å²	116	135.9 Å²	135.9	81%	0.811	82%	0.824	S	S	*	*			trans	-150.9	148.6	151	-163	0	0	0	0	110.7
141	T	25.2	Very low	25.5	Very low	121 Å²	121	136.9 Å²	136.9	74%	0.742	83%	0.829	S	S	*	*			trans	-107.7	173.9	175.6	49.4	0	0	0	0	110.4
142	K	23.4	Very low	25.6	Very low	173 Å²	173	138.5 Å²	138.5	75%	0.752	83%	0.831	S	S	*	*			trans	95.3	117.7	146.1	-161.4	169.5	179.4	176.4	0	119.1
143	D	23	Very low	25.8	Very low	128 Å²	128	136.9 Å²	136.9	68%	0.684	83%	0.831	S	S	*	*			trans	66.2	156	147	-61	-5.3	0	0	0	123.6
144	S	26.8	Very low	25.7	Very low	123 Å²	123	135.6 Å²	135.6	86%	0.86	83%	0.828	S	S	*	*			trans	95.1	114.6	159.9	-51.1	0	0	0	0	117.4
145	A	26	Very low	26	Very low	113 Å²	113	136.8 Å²	136.8	93%	0.934	83%	0.827	S	S	*	*			trans	-80.2	140.6	169.3	0	0	0	0	0	111
146	G	25.4	Very low	26.2	Very low	81 Å²	81	142.1 Å²	142.1	84%	0.835	83%	0.833	S	S	*	*			trans	-138	124	169.7	0	0	0	0	0	109.1
147	A	25.8	Very low	26.7	Very low	101 Å²	101	138.4 Å²	138.4	84%	0.835	83%	0.828	S	S	*	*			trans	-89.4	137.4	-171.2	0	0	0	0	0	112.6
148	F	24.6	Very low	27	Very low	193 Å²	193	136.2 Å²	136.2	85%	0.846	82%	0.815	S	S	*	*			trans	-135.6	124.6	149.1	-146.4	-100.5	0	0	0	109.4	T150	F148-T150 HydrophobicContact CE1-CG2 4.29Å
149	R	25.8	Very low	27.8	Very low	234 Å²	234	137.6 Å²	137.6	88%	0.883	82%	0.815	S	S	*	*			trans	-135.5	78.1	-168.1	-167.7	-175	-168.3	-176.7	6	110.5	K151	R149-K151 PolarHBondContact O-N 3.32Å
150	T	26.9	Very low	28.6	Very low	126 Å²	126	138.2 Å²	138.2	77%	0.773	81%	0.814	S	S	*	*			trans	-65.9	123.1	167.4	25.7	0	0	0	0	109.6	F148	F148-T150 HydrophobicContact CE1-CG2 4.29Å
151	K	26.3	Very low	29.7	Very low	198 Å²	198	138.6 Å²	138.6	86%	0.861	81%	0.814	S	S	*	*			trans	-79.4	130.7	170.8	-74.3	176.8	173.1	178	0	109.1	R149	R149-K151 PolarHBondContact O-N 3.32Å
152	E	28.1	Very low	31	Very low	200 Å²	200	137.1 Å²	137.1	94%	0.935	81%	0.814	S	S	*	*			trans	-151.9	159.5	136	-121.4	165.4	-159.7	0	0	110.3
153	G	30.7	Very low	32.4	Very low	72 Å²	72	132.8 Å²	132.8	74%	0.742	80%	0.803	S	S	*	*			trans	-90.3	134.1	-154.5	0	0	0	0	0	115.9
154	S	26.8	Very low	34.2	Very low	113 Å²	113	130.1 Å²	130.1	79%	0.79	80%	0.795	S	S	*	*			trans	-156.5	145.4	156.7	-77.9	0	0	0	0	109.3	E156	S154-E156 PolarHBondContact O-N 3.41Å
155	P	33	Very low	36.2	Very low	127 Å²	127	129.4 Å²	129.4	83%	0.825	79%	0.79	S	S	*	*			trans	-75.2	123.1	-179.6	29.4	-33.1	0	0	0	111.1
156	E	29.1	Very low	38.2	Very low	181 Å²	181	127 Å²	127	85%	0.846	77%	0.769	S	S	*	*			trans	-67.7	140	172.3	-73.3	-169	120.4	0	0	111.7	S154 G158	S154-E156 PolarHBondContact O-N 3.41Å; E156-G158 PolarHBondContact O-N 2.92Å; E156-G158 VanDerWaalsContact O-N 3.14Å
157	P	35.5	Very low	40.5	Very low	131 Å²	131	124.6 Å²	124.6	85%	0.851	74%	0.74	S	S	*	*			trans	-71.1	104.8	162.2	30.3	-31.1	0	0	0	108.8
158	G	30.4	Very low	42.6	Very low	55 Å²	55	121.4 Å²	121.4	57%	0.567	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-55.8	154.4	-178.7	0	0	0	0	0	113.8	E156 Q160	E156-G158 PolarHBondContact O-N 2.92Å; E156-G158 VanDerWaalsContact O-N 3.14Å; G158-Q160 PolarHBondContact O-N 3.24Å
159	P	42.5	Very low	44.9	Very low	133 Å²	133	120.3 Å²	120.3	86%	0.864	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-59.3	126.2	-173.9	24.3	-34.3	0	0	0	111.4
160	Q	42.6	Very low	47.5	Very low	184 Å²	184	117.8 Å²	117.8	86%	0.86	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-61.6	136.1	178.9	-67.9	-169.2	2.6	0	0	110.5	G158 A162	G158-Q160 PolarHBondContact O-N 3.24Å; Q160-A162 PolarHBondContact O-N 3.11Å
161	P	45	Very low	50	Low	123 Å²	123	118.2 Å²	118.2	80%	0.799	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-62	134.9	-178.7	25	-33.9	0	0	0	110.8
162	A	52.5	Low	52.6	Low	91 Å²	91	117.1 Å²	117.1	75%	0.752	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-54.5	137.5	179.7	0	0	0	0	0	110.8	Q160 S164	Q160-A162 PolarHBondContact O-N 3.11Å; A162-S164 PolarHBondContact O-N 3.14Å
163	P	53.6	Low	55.2	Low	81 Å²	81	110.1 Å²	110.1	53%	0.526	65%	0.646	S	S	.	*			trans	-65.7	112.8	-172.2	27	-35.5	0	0	0	110.6
164	S	61.8	Low	57.8	Low	72 Å²	72	109.9 Å²	109.9	50%	0.503	63%	0.633	S	S	.	*			trans	-50.3	146	179.2	66.9	0	0	0	0	111.7	A162 A166 S167 A168	A162-S164 PolarHBondContact O-N 3.14Å; S164-A166 PolarHBondContact O-N 3.36Å; S164-A166 VanDerWaalsContact O-N 3.14Å; S164-S167 PolarHBondContact N-OG 3.38Å; S164-S167 CarbonylContact O-C 3.5Å; S164-S167 WeakPolarHBondContact O-CA 3.06Å; S164-S167 WeakPolarHBondContact O-CB 3.43Å; S164-S167 PolarHBondContact O-N 3.23Å; S164-S167 PolarHBondContact O-OG 3Å; S164-S167 WeakPolarHBondContact OG-CB 3.44Å; S164-S167 PolarHBondContact OG-N 3.02Å; S164-S167 PolarHBondContact OG-OG 3.2Å; S164-A168 PolarHBondContact O-N 2.97Å
165	S	68	Low	60.5	Low	109 Å²	109	111.4 Å²	111.4	76%	0.762	62%	0.621	S	S	*	*	H	α-helix	trans	-51.1	-41.3	-176.4	54.8	0	0	0	0	112.6	S167 A168 Y169	S165-S167 PolarHBondContact O-N 2.9Å; S165-A168 PolarHBondContact O-N 3.4Å; S165-Y169 VanDerWaalsContact O-CB 3.32Å; S165-Y169 WeakPolarHBondContact O-CB 3.46Å; S165-Y169 PolarHBondContact O-N 2.66Å
166	A	68.3	Low	63	Low	61 Å²	61	110.7 Å²	110.7	50%	0.504	61%	0.61	S	S	.	*	H	α-helix	trans	-62.9	-38	173.7	0	0	0	0	0	113.6	S164 R170	S164-A166 PolarHBondContact O-N 3.36Å; S164-A166 VanDerWaalsContact O-N 3.14Å; A166-R170 VanDerWaalsContact O-CB 3.3Å; A166-R170 WeakPolarHBondContact O-CB 3.29Å; A166-R170 PolarHBondContact O-N 3.46Å
167	S	72.6	Confident	65.8	Low	31 Å²	31	105.4 Å²	105.4	22%	0.217	59%	0.592	C	S	.	*	H	α-helix	trans	-73.8	-29.5	175.6	83.3	0	0	0	0	112.9	S164 S165 R171	S164-S167 PolarHBondContact N-OG 3.38Å; S164-S167 CarbonylContact O-C 3.5Å; S164-S167 WeakPolarHBondContact O-CA 3.06Å; S164-S167 WeakPolarHBondContact O-CB 3.43Å; S164-S167 PolarHBondContact O-N 3.23Å; S164-S167 PolarHBondContact O-OG 3Å; S164-S167 WeakPolarHBondContact OG-CB 3.44Å; S164-S167 PolarHBondContact OG-N 3.02Å; S164-S167 PolarHBondContact OG-OG 3.2Å; S165-S167 PolarHBondContact O-N 2.9Å; S167-R171 WeakPolarHBondContact O-CB 3.45Å; S167-R171 WeakPolarHBondContact O-CG 3.31Å; S167-R171 PolarHBondContact O-N 3.48Å; S167-R171 VanDerWaalsContact O-N 3.13Å; S167-R171 PolarHBondContact O-NE 3.28Å; S167-R171 PolarHBondContact OG-NH2 3.39Å
168	A	70.6	Confident	68.3	Low	35 Å²	35	102.2 Å²	102.2	29%	0.289	57%	0.567	S	S	.	*	H	α-helix	trans	-73.4	-44.1	173.2	0	0	0	0	0	110.8	S164 S165 R171 R172	S164-A168 PolarHBondContact O-N 2.97Å; S165-A168 PolarHBondContact O-N 3.4Å; A168-R171 CarbonylContact O-C 3.56Å; A168-R171 PolarHBondContact O-N 2.68Å; A168-R172 WeakPolarHBondContact O-CG 3.16Å; A168-R172 PolarHBondContact O-N 2.93Å
169	Y	73.7	Confident	71	Confident	170 Å²	170	103.3 Å²	103.3	67%	0.667	55%	0.554	S	S	*	*	H	α-helix	trans	-59	-50.2	172.6	179.4	-102.1	0	0	0	111.4	S165 R171 R172 C173	S165-Y169 VanDerWaalsContact O-CB 3.32Å; S165-Y169 WeakPolarHBondContact O-CB 3.46Å; S165-Y169 PolarHBondContact O-N 2.66Å; Y169-R171 VanDerWaalsContact C-N 3.3Å; Y169-R171 PolarHBondContact O-N 3.26Å; Y169-R172 WeakPolarHBondContact O-CA 3.32Å; Y169-R172 WeakPolarHBondContact O-CB 3.36Å; Y169-R172 PolarHBondContact O-N 3.42Å; Y169-C173 WeakPolarHBondContact O-CB 3.4Å; Y169-C173 PolarHBondContact O-N 3.38Å
170	R	78.6	Confident	73.2	Confident	181 Å²	181	102.7 Å²	102.7	68%	0.683	54%	0.543	S	S	*	.	H	α-helix	trans	-57.7	-42	176.1	-162	178.6	-61.5	-153.7	1.7	111.5	A166 R172 C173 C174	A166-R170 VanDerWaalsContact O-CB 3.3Å; A166-R170 WeakPolarHBondContact O-CB 3.29Å; A166-R170 PolarHBondContact O-N 3.46Å; R170-R172 PolarHBondContact O-N 3.04Å; R170-C173 PolarHBondContact O-N 3Å; R170-C174 WeakPolarHBondContact O-CB 3.46Å; R170-C174 PolarHBondContact O-N 3.49Å; R170-C174 PolarHBondContact O-SG 2.85Å
171	R	80.4	Confident	75.3	Confident	134 Å²	134	98.6 Å²	98.6	51%	0.506	53%	0.526	S	S	.	.	H	α-helix	trans	-71	-19.6	174.1	-79.5	179.4	-82.8	-162.3	-9.9	115	S167 A168 Y169 R175	S167-R171 WeakPolarHBondContact O-CB 3.45Å; S167-R171 WeakPolarHBondContact O-CG 3.31Å; S167-R171 PolarHBondContact O-N 3.48Å; S167-R171 VanDerWaalsContact O-N 3.13Å; S167-R171 PolarHBondContact O-NE 3.28Å; S167-R171 PolarHBondContact OG-NH2 3.39Å; A168-R171 CarbonylContact O-C 3.56Å; A168-R171 PolarHBondContact O-N 2.68Å; Y169-R171 VanDerWaalsContact C-N 3.3Å; Y169-R171 PolarHBondContact O-N 3.26Å; R171-R175 PolarHBondContact O-NE 3.4Å; R171-R175 PolarHBondContact O-NH2 3.06Å
172	R	81.4	Confident	77.3	Confident	175 Å²	175	93.4 Å²	93.4	66%	0.66	49%	0.492	S	S	*	.	H	α-helix	trans	-79.3	-49.7	168.2	-74.9	179.7	-180	176.6	0.7	110	A168 Y169 R170 C174 R175 L176	A168-R172 WeakPolarHBondContact O-CG 3.16Å; A168-R172 PolarHBondContact O-N 2.93Å; Y169-R172 WeakPolarHBondContact O-CA 3.32Å; Y169-R172 WeakPolarHBondContact O-CB 3.36Å; Y169-R172 PolarHBondContact O-N 3.42Å; R170-R172 PolarHBondContact O-N 3.04Å; R172-C174 PolarHBondContact O-N 2.96Å; R172-R175 PolarHBondContact O-N 3.41Å; R172-R175 VanDerWaalsContact O-N 3.15Å; R172-L176 WeakPolarHBondContact O-CG 3.41Å; R172-L176 PolarHBondContact O-N 3.23Å
173	C	82.4	Confident	78.9	Confident	53 Å²	53	92 Å²	92	36%	0.358	47%	0.474	S	S	.	.	H	α-helix	trans	-55.1	-53.7	176.9	-174	0	0	0	0	111.9	Y169 R170 R175 L176 C177	Y169-C173 WeakPolarHBondContact O-CB 3.4Å; Y169-C173 PolarHBondContact O-N 3.38Å; R170-C173 PolarHBondContact O-N 3Å; C173-R175 VanDerWaalsContact C-N 3.27Å; C173-R175 PolarHBondContact O-N 3.31Å; C173-L176 WeakPolarHBondContact O-CB 3.31Å; C173-L176 PolarHBondContact O-N 3.2Å; C173-L176 VanDerWaalsContact O-N 3.08Å; C173-C177 PolarHBondContact O-N 3.37Å; C173-C177 PolarHBondContact O-SG 2.72Å
174	C	84.3	Confident	80.6	Confident	68 Å²	68	92.6 Å²	92.6	46%	0.459	47%	0.472	S	S	.	.	H	α-helix	trans	-59.2	-35.2	177.8	-64	0	0	0	0	113.2	R170 R172 I178	R170-C174 WeakPolarHBondContact O-CB 3.46Å; R170-C174 PolarHBondContact O-N 3.49Å; R170-C174 PolarHBondContact O-SG 2.85Å; R172-C174 PolarHBondContact O-N 2.96Å; C174-I178 WeakPolarHBondContact O-CD1 3.17Å; C174-I178 VanDerWaalsContact O-CG1 3.22Å; C174-I178 WeakPolarHBondContact O-CG1 3.46Å; C174-I178 PolarHBondContact O-N 3.29Å
175	R	85.1	Confident	81.9	Confident	144 Å²	144	90.1 Å²	90.1	54%	0.543	45%	0.454	S	S	.	.	H	α-helix	trans	-69.3	-43.1	174.6	-83.9	-177.4	-76	-170.2	-1.7	111.8	R171 R172 C173 I178 W179	R171-R175 PolarHBondContact O-NE 3.4Å; R171-R175 PolarHBondContact O-NH2 3.06Å; R172-R175 PolarHBondContact O-N 3.41Å; R172-R175 VanDerWaalsContact O-N 3.15Å; C173-R175 VanDerWaalsContact C-N 3.27Å; C173-R175 PolarHBondContact O-N 3.31Å; R175-I178 PolarHBondContact O-N 3.13Å; R175-W179 VanDerWaalsContact O-CD1 3.29Å; R175-W179 PolarHBondContact O-N 3.05Å
176	L	85.6	Confident	82.7	Confident	112 Å²	112	85.5 Å²	85.5	59%	0.586	42%	0.42	S	S	*	.	H	α-helix	trans	-59.5	-46	173.5	-69.9	166.6	0	0	0	111.1	R172 C173 I178 W179 L180	R172-L176 WeakPolarHBondContact O-CG 3.41Å; R172-L176 PolarHBondContact O-N 3.23Å; C173-L176 WeakPolarHBondContact O-CB 3.31Å; C173-L176 PolarHBondContact O-N 3.2Å; C173-L176 VanDerWaalsContact O-N 3.08Å; L176-I178 VanDerWaalsContact C-N 3.35Å; L176-I178 PolarHBondContact O-N 2.83Å; L176-W179 PolarHBondContact O-N 3.4Å; L176-L180 WeakPolarHBondContact O-CB 3.32Å; L176-L180 VanDerWaalsContact O-CG 3.26Å; L176-L180 WeakPolarHBondContact O-CG 3.33Å; L176-L180 PolarHBondContact O-N 3.31Å
177	C	87.6	Confident	83.5	Confident	70 Å²	70	89.3 Å²	89.3	47%	0.473	43%	0.431	S	S	.	.	H	α-helix	trans	-59.3	-41.6	175.5	-63.6	0	0	0	0	112.7	C173 L181	C173-C177 PolarHBondContact O-N 3.37Å; C173-C177 PolarHBondContact O-SG 2.72Å; C177-L181 WeakPolarHBondContact O-CB 3.26Å; C177-L181 PolarHBondContact O-N 3.04Å
178	I	86.9	Confident	84.1	Confident	65 Å²	65	92.7 Å²	92.7	33%	0.333	45%	0.446	S	S	.	.	H	α-helix	trans	-65.8	-44.1	176.3	-70.6	162.8	0	0	0	111.2	F112 Y116 C174 R175 L176 L181 Q182	F112-I178 HydrophobicContact CZ-CG2 4.32Å; Y116-I178 HydrophobicContact CE1-CG2 3.9Å; Y116-I178 HydrophobicContact CE2-CG2 4.41Å; C174-I178 WeakPolarHBondContact O-CD1 3.17Å; C174-I178 VanDerWaalsContact O-CG1 3.22Å; C174-I178 WeakPolarHBondContact O-CG1 3.46Å; C174-I178 PolarHBondContact O-N 3.29Å; R175-I178 PolarHBondContact O-N 3.13Å; L176-I178 VanDerWaalsContact C-N 3.35Å; L176-I178 PolarHBondContact O-N 2.83Å; I178-L181 PolarHBondContact O-N 2.89Å; I178-Q182 VanDerWaalsContact O-CB 3.3Å; I178-Q182 WeakPolarHBondContact O-CB 3.14Å; I178-Q182 PolarHBondContact O-N 3.01Å
179	W	87.8	Confident	84.7	Confident	78 Å²	78	95 Å²	95	30%	0.295	45%	0.451	S	S	.	.	H	α-helix	trans	-65	-41.9	177.3	-88.3	78.3	0	0	0	112.3	F112 V113 Y116 R175 L176 T183	F112-W179 AromaticContact CE1-CD2 3.9Å; F112-W179 HydrophobicContact CE1-CD2 3.9Å; F112-W179 HydrophobicContact CE1-CE3 4.04Å; F112-W179 HydrophobicContact CE1-CG 4.35Å; F112-W179 HydrophobicContact CE1-CZ2 4.36Å; F112-W179 HydrophobicContact CE1-CZ3 4.35Å; F112-W179 HydrophobicContact CZ-CD2 4.47Å; V113-W179 HydrophobicContact CB-CH2 4.25Å; V113-W179 HydrophobicContact CG1-CH2 4.19Å; V113-W179 HydrophobicContact CG2-CH2 3.87Å; V113-W179 HydrophobicContact CG2-CZ3 3.91Å; Y116-W179 AromaticContact CD1-NE1 3.92Å; R175-W179 VanDerWaalsContact O-CD1 3.29Å; R175-W179 PolarHBondContact O-N 3.05Å; L176-W179 PolarHBondContact O-N 3.4Å; W179-T183 VanDerWaalsContact O-CB 3.27Å; W179-T183 WeakPolarHBondContact O-CB 3.43Å; W179-T183 PolarHBondContact O-N 3.42Å; W179-T183 PolarHBondContact O-OG1 3.48Å
180	L	87.6	Confident	85.3	Confident	120 Å²	120	90.2 Å²	90.2	63%	0.628	44%	0.437	S	S	*	.	H	α-helix	trans	-63.9	-48.8	174.7	-71.7	169.9	0	0	0	111.3	L176 Q182 T183 L184	L176-L180 WeakPolarHBondContact O-CB 3.32Å; L176-L180 VanDerWaalsContact O-CG 3.26Å; L176-L180 WeakPolarHBondContact O-CG 3.33Å; L176-L180 PolarHBondContact O-N 3.31Å; L180-Q182 PolarHBondContact O-N 2.7Å; L180-T183 PolarHBondContact O-N 2.97Å; L180-L184 VanDerWaalsContact O-CB 3.3Å; L180-L184 WeakPolarHBondContact O-CB 3.12Å; L180-L184 PolarHBondContact O-N 3.31Å
181	L	87.1	Confident	85.7	Confident	97 Å²	97	81.6 Å²	81.6	51%	0.508	40%	0.404	S	S	.	.	H	α-helix	trans	-61.1	-43.6	178.1	178.6	62.2	0	0	0	111.8	C177 I178 L184 V185	C177-L181 WeakPolarHBondContact O-CB 3.26Å; C177-L181 PolarHBondContact O-N 3.04Å; I178-L181 PolarHBondContact O-N 2.89Å; L181-L184 PolarHBondContact O-N 3.46Å; L181-V185 HydrophobicContact CD1-CG2 4.48Å; L181-V185 WeakPolarHBondContact O-CB 3.33Å; L181-V185 VanDerWaalsContact O-CG2 3.3Å; L181-V185 WeakPolarHBondContact O-CG2 3.47Å; L181-V185 PolarHBondContact O-N 3.26Å
182	Q	87.3	Confident	86	Confident	15 Å²	15	75.8 Å²	75.8	7%	0.07	38%	0.383	C	S	.	.	H	α-helix	trans	-66.4	-42.7	177.4	-171.6	87.6	-4.3	0	0	111.4	F112 I178 L180 L184 V185 H186 W194	F112-Q182 HydrophobicContact CB-CG 4.33Å; F112-Q182 HydrophobicContact CD1-CB 4.37Å; F112-Q182 HydrophobicContact CD1-CG 3.71Å; F112-Q182 HydrophobicContact CD2-CB 4.31Å; F112-Q182 HydrophobicContact CD2-CG 3.47Å; F112-Q182 VanDerWaalsContact CD2-CG 3.47Å; F112-Q182 VanDerWaalsContact CD2-NE2 3.25Å; F112-Q182 HydrophobicContact CE1-CB 3.92Å; F112-Q182 HydrophobicContact CE1-CG 3.77Å; F112-Q182 HydrophobicContact CE2-CB 3.82Å; F112-Q182 HydrophobicContact CE2-CG 3.5Å; F112-Q182 HydrophobicContact CG-CG 3.55Å; F112-Q182 HydrophobicContact CZ-CB 3.62Å; F112-Q182 HydrophobicContact CZ-CG 3.67Å; I178-Q182 VanDerWaalsContact O-CB 3.3Å; I178-Q182 WeakPolarHBondContact O-CB 3.14Å; I178-Q182 PolarHBondContact O-N 3.01Å; L180-Q182 PolarHBondContact O-N 2.7Å; Q182-L184 VanDerWaalsContact C-N 3.31Å; Q182-L184 PolarHBondContact O-N 3.46Å; Q182-V185 PolarHBondContact O-N 2.91Å; Q182-H186 PolarHBondContact NE2-CE1 3.5Å; Q182-H186 PolarHBondContact O-N 3.4Å; Q182-H186 PolarHBondContact O-ND1 3.35Å; Q182-W194 VanDerWaalsContact OE1-NE1 3.1Å
183	T	86.3	Confident	86.4	Confident	61 Å²	61	68.1 Å²	68.1	37%	0.374	36%	0.355	S	S	.	.	H	α-helix	trans	-61.9	-41.6	177	-55.4	0	0	0	0	110.5	W179 L180 H186 L187	W179-T183 VanDerWaalsContact O-CB 3.27Å; W179-T183 WeakPolarHBondContact O-CB 3.43Å; W179-T183 PolarHBondContact O-N 3.42Å; W179-T183 PolarHBondContact O-OG1 3.48Å; L180-T183 PolarHBondContact O-N 2.97Å; T183-H186 CarbonylContact O-C 3.57Å; T183-H186 PolarHBondContact O-N 3.48Å; T183-L187 WeakPolarHBondContact O-CB 3.29Å; T183-L187 PolarHBondContact O-N 3.43Å
184	L	88.6	Confident	86.8	Confident	93 Å²	93	70.8 Å²	70.8	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-61.4	-47.6	173	-177.4	65.5	0	0	0	111.7	L180 L181 Q182 H186 L187 L188	L180-L184 VanDerWaalsContact O-CB 3.3Å; L180-L184 WeakPolarHBondContact O-CB 3.12Å; L180-L184 PolarHBondContact O-N 3.31Å; L181-L184 PolarHBondContact O-N 3.46Å; Q182-L184 VanDerWaalsContact C-N 3.31Å; Q182-L184 PolarHBondContact O-N 3.46Å; L184-H186 PolarHBondContact O-N 3.42Å; L184-L187 PolarHBondContact O-N 3.48Å; L184-L187 VanDerWaalsContact O-N 3.14Å; L184-L188 HydrophobicContact CD1-CD1 3.52Å; L184-L188 HydrophobicContact CG-CD1 3.96Å; L184-L188 WeakPolarHBondContact O-CD1 3.45Å; L184-L188 PolarHBondContact O-N 2.92Å
185	V	89.1	Confident	87.1	Confident	21 Å²	21	67.9 Å²	67.9	13%	0.127	34%	0.337	C	S	.	.	H	α-helix	trans	-57.8	-35	174	162.5	0	0	0	0	111.9	L181 Q182 L190 G191 W194	L181-V185 HydrophobicContact CD1-CG2 4.48Å; L181-V185 WeakPolarHBondContact O-CB 3.33Å; L181-V185 VanDerWaalsContact O-CG2 3.3Å; L181-V185 WeakPolarHBondContact O-CG2 3.47Å; L181-V185 PolarHBondContact O-N 3.26Å; Q182-V185 PolarHBondContact O-N 2.91Å; V185-L190 HydrophobicContact CG1-CB 4.14Å; V185-L190 CarbonylContact O-C 3.56Å; V185-L190 WeakPolarHBondContact O-CA 3.28Å; V185-L190 PolarHBondContact O-N 2.96Å; V185-G191 PolarHBondContact O-N 3.34Å; V185-W194 HydrophobicContact CG1-CB 3.8Å; V185-W194 HydrophobicContact CG1-CG 4.21Å
186	H	85.8	Confident	87.3	Confident	12 Å²	12	61.9 Å²	61.9	6%	0.056	32%	0.315	C	S	.	.	H	α-helix	trans	-78.9	-33.1	177.5	-72.1	45.1	0	0	0	111.8	Q105 S108 F109 Q182 T183 L184 Q189	Q105-H186 VanDerWaalsContact CD-O 3.3Å; Q105-H186 HydrophobicContact CG-CB 4.45Å; Q105-H186 WeakPolarHBondContact CG-O 3.12Å; Q105-H186 PolarHBondContact NE2-CD2 3.22Å; Q105-H186 PolarHBondContact NE2-NE2 3.16Å; S108-H186 PolarHBondContact OG-NE2 3.27Å; F109-H186 HydrophobicContact CD2-CB 4.28Å; F109-H186 AromaticContact CD2-CD2 3.91Å; F109-H186 PolarHBondContact N-CD2 2.92Å; Q182-H186 PolarHBondContact NE2-CE1 3.5Å; Q182-H186 PolarHBondContact O-N 3.4Å; Q182-H186 PolarHBondContact O-ND1 3.35Å; T183-H186 CarbonylContact O-C 3.57Å; T183-H186 PolarHBondContact O-N 3.48Å; L184-H186 PolarHBondContact O-N 3.42Å; H186-Q189 PolarHBondContact O-N 2.94Å
187	L	84.3	Confident	87.5	Confident	140 Å²	140	60.4 Å²	60.4	73%	0.733	31%	0.307	S	S	*	.	H	α-helix	trans	-67.5	-37	173.8	-173.4	65.1	0	0	0	112.2	T183 L184 Q189	T183-L187 WeakPolarHBondContact O-CB 3.29Å; T183-L187 PolarHBondContact O-N 3.43Å; L184-L187 PolarHBondContact O-N 3.48Å; L184-L187 VanDerWaalsContact O-N 3.14Å; L187-Q189 PolarHBondContact O-N 3.17Å
188	L	85.8	Confident	87.6	Confident	102 Å²	102	61.6 Å²	61.6	53%	0.534	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	6.8	173.9	-85.7	78.9	0	0	0	113.8	L184 L190	L184-L188 HydrophobicContact CD1-CD1 3.52Å; L184-L188 HydrophobicContact CG-CD1 3.96Å; L184-L188 WeakPolarHBondContact O-CD1 3.45Å; L184-L188 PolarHBondContact O-N 2.92Å; L188-L190 HydrophobicContact CB-CD1 4.04Å; L188-L190 HydrophobicContact CB-CG 4.07Å; L188-L190 HydrophobicContact CD2-CD1 4.19Å; L188-L190 PolarHBondContact O-N 2.82Å; L188-L190 VanDerWaalsContact O-N 3.1Å
189	Q	83.8	Confident	87.8	Confident	83 Å²	83	58.7 Å²	58.7	39%	0.388	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	13.5	-174.5	-52.7	-174.3	7	0	0	114.9	S101 Q105 H186 L187 G191	S101-Q189 PolarHBondContact OG-OE1 2.93Å; Q105-Q189 VanDerWaalsContact OE1-C 3.24Å; Q105-Q189 VanDerWaalsContact OE1-CA 3.28Å; Q105-Q189 PolarHBondContact OE1-O 2.96Å; H186-Q189 PolarHBondContact O-N 2.94Å; L187-Q189 PolarHBondContact O-N 3.17Å; Q189-G191 VanDerWaalsContact C-N 3.27Å; Q189-G191 PolarHBondContact O-N 3Å
190	L	86.4	Confident	87.8	Confident	70 Å²	70	56.8 Å²	56.8	37%	0.366	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	7.4	-179.5	-65	175.2	0	0	0	113.2	V185 L188 Q192 V193 W194	V185-L190 HydrophobicContact CG1-CB 4.14Å; V185-L190 CarbonylContact O-C 3.56Å; V185-L190 WeakPolarHBondContact O-CA 3.28Å; V185-L190 PolarHBondContact O-N 2.96Å; L188-L190 HydrophobicContact CB-CD1 4.04Å; L188-L190 HydrophobicContact CB-CG 4.07Å; L188-L190 HydrophobicContact CD2-CD1 4.19Å; L188-L190 PolarHBondContact O-N 2.82Å; L188-L190 VanDerWaalsContact O-N 3.1Å; L190-Q192 VanDerWaalsContact C-N 3.25Å; L190-Q192 PolarHBondContact O-N 3.46Å; L190-V193 HydrophobicContact CD2-CB 4.37Å; L190-V193 HydrophobicContact CD2-CG2 3.96Å; L190-V193 PolarHBondContact O-N 3.28Å; L190-V193 VanDerWaalsContact O-N 3.13Å; L190-W194 PolarHBondContact O-N 3.39Å
191	G	86.4	Confident	88	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.6	-33.5	-177	0	0	0	0	0	113.7	Q105 V185 Q189 R195	Q105-G191 VanDerWaalsContact OE1-N 3.08Å; V185-G191 PolarHBondContact O-N 3.34Å; Q189-G191 VanDerWaalsContact C-N 3.27Å; Q189-G191 PolarHBondContact O-N 3Å; G191-R195 WeakPolarHBondContact O-CG 3.4Å; G191-R195 PolarHBondContact O-N 3.16Å
192	Q	87.6	Confident	88	Confident	12 Å²	12	53.8 Å²	53.8	6%	0.056	26%	0.258	C	S	.	.	H	α-helix	trans	-71	-48.8	173.2	-58.8	179.6	10.8	0	0	111.7	F67 V104 L190 W194 R195 Y196 E235	F67-Q192 VanDerWaalsContact CE2-OE1 3.23Å; V104-Q192 HydrophobicContact CG1-CG 4.45Å; V104-Q192 VanDerWaalsContact CG1-NE2 3.35Å; L190-Q192 VanDerWaalsContact C-N 3.25Å; L190-Q192 PolarHBondContact O-N 3.46Å; Q192-W194 VanDerWaalsContact C-N 3.26Å; Q192-W194 PolarHBondContact O-N 3.31Å; Q192-R195 WeakPolarHBondContact O-CA 3.17Å; Q192-R195 WeakPolarHBondContact O-CB 3.5Å; Q192-R195 PolarHBondContact O-N 2.95Å; Q192-Y196 WeakPolarHBondContact O-CD2 3.23Å; Q192-Y196 PolarHBondContact O-N 3.16Å; Q192-E235 PolarHBondContact NE2-OE2 2.98Å; Q192-E235 PolarHBondContact OE1-OE2 3.06Å
193	V	89.4	Confident	88	Confident	14 Å²	14	53 Å²	53	9%	0.085	25%	0.254	C	S	.	.	H	α-helix	trans	-54.5	-45.3	179	-179.6	0	0	0	0	110.4	L64 F67 F68 L190 R195 Y196 L197	L64-V193 HydrophobicContact CD1-CG1 4.39Å; F67-V193 HydrophobicContact CD1-CG2 4.01Å; F67-V193 HydrophobicContact CE1-CG2 3.47Å; F67-V193 VanDerWaalsContact CE1-CG2 3.47Å; F67-V193 HydrophobicContact CZ-CG2 4.47Å; F68-V193 HydrophobicContact CE1-CG2 4.08Å; F68-V193 HydrophobicContact CZ-CG1 3.98Å; F68-V193 HydrophobicContact CZ-CG2 3.76Å; L190-V193 HydrophobicContact CD2-CB 4.37Å; L190-V193 HydrophobicContact CD2-CG2 3.96Å; L190-V193 PolarHBondContact O-N 3.28Å; L190-V193 VanDerWaalsContact O-N 3.13Å; V193-R195 VanDerWaalsContact C-N 3.29Å; V193-R195 PolarHBondContact O-N 2.66Å; V193-Y196 PolarHBondContact O-N 3.37Å; V193-L197 HydrophobicContact CG1-CD1 4Å; V193-L197 HydrophobicContact CG1-CG 4.34Å; V193-L197 WeakPolarHBondContact O-CB 3.47Å; V193-L197 WeakPolarHBondContact O-CG 3.3Å; V193-L197 PolarHBondContact O-N 3.47Å
194	W	90.1	Very high	88.1	Confident	109 Å²	109	52.9 Å²	52.9	41%	0.413	25%	0.251	S	S	.	.	H	α-helix	trans	-57.2	-40	176.2	-179.3	-114	0	0	0	113.1	Q182 V185 L190 Q192 R198	Q182-W194 VanDerWaalsContact OE1-NE1 3.1Å; V185-W194 HydrophobicContact CG1-CB 3.8Å; V185-W194 HydrophobicContact CG1-CG 4.21Å; L190-W194 PolarHBondContact O-N 3.39Å; Q192-W194 VanDerWaalsContact C-N 3.26Å; Q192-W194 PolarHBondContact O-N 3.31Å; W194-R198 WeakPolarHBondContact O-CB 3.48Å; W194-R198 PolarHBondContact O-N 3.46Å
195	R	89.8	Confident	88	Confident	7 Å²	7	49.6 Å²	49.6	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-73.2	-37.7	176.5	-66.9	174	170.9	-83.9	4.6	112.8	S108 G191 Q192 V193 R198 A199 E224 D227 V228	S108-R195 PolarHBondContact OG-NE 3.17Å; S108-R195 VanDerWaalsContact OG-NE 3.08Å; G191-R195 WeakPolarHBondContact O-CG 3.4Å; G191-R195 PolarHBondContact O-N 3.16Å; Q192-R195 WeakPolarHBondContact O-CA 3.17Å; Q192-R195 WeakPolarHBondContact O-CB 3.5Å; Q192-R195 PolarHBondContact O-N 2.95Å; V193-R195 VanDerWaalsContact C-N 3.29Å; V193-R195 PolarHBondContact O-N 2.66Å; R195-R198 PolarHBondContact O-N 2.98Å; R195-A199 WeakPolarHBondContact O-CB 3.44Å; R195-A199 PolarHBondContact O-N 3.34Å; R195-E224 IonicContact NH1-OE2 3.17Å; R195-E224 PolarHBondContact NH1-OE2 3.36Å; R195-E224 VanDerWaalsContact NH1-OE2 3.07Å; R195-D227 IonicContact CZ-OD2 2.71Å; R195-D227 IonicContact NH1-OD2 3.45Å; R195-D227 PolarHBondContact NH1-OD2 2.96Å; R195-V228 HydrophobicContact CB-CG2 3.28Å; R195-V228 HydrophobicContact CG-CG2 4.39Å
196	Y	89.6	Confident	87.8	Confident	18 Å²	18	48.6 Å²	48.6	7%	0.071	23%	0.227	C	C	.	.	H	α-helix	trans	-58.9	-47	169.7	-83.9	-82.5	0	0	0	111.4	V60 A63 L64 Q192 V193 R198 A199 L200 V228 R232	V60-Y196 HydrophobicContact CG1-CD1 4.29Å; A63-Y196 HydrophobicContact CB-CE1 3.8Å; L64-Y196 HydrophobicContact CB-CD1 4.41Å; L64-Y196 HydrophobicContact CD1-CD2 4.23Å; L64-Y196 HydrophobicContact CD1-CG 4.1Å; Q192-Y196 WeakPolarHBondContact O-CD2 3.23Å; Q192-Y196 PolarHBondContact O-N 3.16Å; V193-Y196 PolarHBondContact O-N 3.37Å; Y196-R198 VanDerWaalsContact C-N 3.33Å; Y196-R198 PolarHBondContact O-N 3.31Å; Y196-A199 PolarHBondContact O-N 3.34Å; Y196-L200 WeakPolarHBondContact O-CB 3.48Å; Y196-L200 PolarHBondContact O-N 2.93Å; Y196-V228 HydrophobicContact CD1-CG1 3.95Å; Y196-V228 HydrophobicContact CD2-CG1 3.67Å; Y196-V228 HydrophobicContact CE1-CG1 3.6Å; Y196-V228 HydrophobicContact CE2-CG1 3.27Å; Y196-V228 HydrophobicContact CG-CG1 3.99Å; Y196-R232 PolarHBondContact OH-NE 2.91Å
197	L	90.4	Very high	87.8	Confident	82 Å²	82	55.4 Å²	55.4	43%	0.429	25%	0.252	S	S	.	.	H	α-helix	trans	-61.9	-39.4	175.6	-68.8	172.8	0	0	0	111.7	V193 Y201	V193-L197 HydrophobicContact CG1-CD1 4Å; V193-L197 HydrophobicContact CG1-CG 4.34Å; V193-L197 WeakPolarHBondContact O-CB 3.47Å; V193-L197 WeakPolarHBondContact O-CG 3.3Å; V193-L197 PolarHBondContact O-N 3.47Å; L197-Y201 VanDerWaalsContact O-CB 3.25Å; L197-Y201 WeakPolarHBondContact O-CB 3.42Å; L197-Y201 PolarHBondContact O-N 2.9Å
198	R	90.5	Very high	87.6	Confident	94 Å²	94	58 Å²	58	36%	0.355	25%	0.253	S	S	.	.	H	α-helix	trans	-65.1	-44.8	175.7	-164.4	179.9	-164.7	-162.6	11.3	112	W194 R195 Y196 Y201 L202 E224	W194-R198 WeakPolarHBondContact O-CB 3.48Å; W194-R198 PolarHBondContact O-N 3.46Å; R195-R198 PolarHBondContact O-N 2.98Å; Y196-R198 VanDerWaalsContact C-N 3.33Å; Y196-R198 PolarHBondContact O-N 3.31Å; R198-Y201 PolarHBondContact O-N 3.41Å; R198-L202 HydrophobicContact CG-CD1 4.1Å; R198-L202 WeakPolarHBondContact O-CB 3.41Å; R198-L202 WeakPolarHBondContact O-CD1 3.3Å; R198-L202 WeakPolarHBondContact O-CG 3.43Å; R198-L202 PolarHBondContact O-N 3.38Å; R198-E224 WeakPolarHBondContact CD-OE1 3.29Å; R198-E224 HydrophobicContact CG-CG 4.42Å; R198-E224 IonicContact CZ-OE1 2.64Å; R198-E224 IonicContact NE-OE1 3.83Å; R198-E224 IonicContact NH1-OE1 3.66Å; R198-E224 PolarHBondContact NH1-OE1 2.88Å
199	A	89.4	Confident	87.3	Confident	4 Å²	4	59.1 Å²	59.1	3%	0.033	25%	0.25	C	C	.	.	H	α-helix	trans	-62.2	-47.1	175.6	0	0	0	0	0	111.3	R195 Y196 Y201 L202 G203 M221 E224	R195-A199 WeakPolarHBondContact O-CB 3.44Å; R195-A199 PolarHBondContact O-N 3.34Å; Y196-A199 PolarHBondContact O-N 3.34Å; A199-Y201 PolarHBondContact O-N 3.3Å; A199-L202 PolarHBondContact O-N 2.82Å; A199-G203 PolarHBondContact O-N 3.32Å; A199-M221 WeakPolarHBondContact O-CG 3.29Å; A199-E224 HydrophobicContact CB-CB 4.03Å
200	L	89.3	Confident	87	Confident	38 Å²	38	57.7 Å²	57.7	20%	0.199	26%	0.257	C	S	.	.	H	α-helix	trans	-58.6	-47.1	176	-179.1	61.4	0	0	0	111.8	C57 V60 Y196 L202 G203 L204	C57-L200 VanDerWaalsContact SG-CD1 3.6Å; V60-L200 HydrophobicContact CG1-CB 4.31Å; Y196-L200 WeakPolarHBondContact O-CB 3.48Å; Y196-L200 PolarHBondContact O-N 2.93Å; L200-L202 PolarHBondContact O-N 2.88Å; L200-G203 PolarHBondContact O-N 3.23Å; L200-L204 HydrophobicContact CD1-CD1 3.64Å; L200-L204 HydrophobicContact CG-CD1 4.09Å; L200-L204 WeakPolarHBondContact O-CD1 3.38Å; L200-L204 PolarHBondContact O-N 2.98Å
201	Y	90.6	Very high	86.4	Confident	149 Å²	149	60 Å²	60	58%	0.584	27%	0.266	S	S	*	.	H	α-helix	trans	-59.1	-46.3	176	174.8	-94	0	0	0	112.3	L197 R198 A199 G203 L204 Q205	L197-Y201 VanDerWaalsContact O-CB 3.25Å; L197-Y201 WeakPolarHBondContact O-CB 3.42Å; L197-Y201 PolarHBondContact O-N 2.9Å; R198-Y201 PolarHBondContact O-N 3.41Å; A199-Y201 PolarHBondContact O-N 3.3Å; Y201-G203 VanDerWaalsContact C-N 3.32Å; Y201-G203 PolarHBondContact O-N 3.04Å; Y201-L204 PolarHBondContact O-N 3.09Å; Y201-Q205 WeakPolarHBondContact O-CB 3.31Å; Y201-Q205 PolarHBondContact O-N 3.44Å
202	L	88.3	Confident	85.7	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.026	29%	0.291	C	S	.	.	H	α-helix	trans	-64.2	-37.2	177.1	-69.1	164.8	0	0	0	111.7	R198 A199 L200 Q205 S206 F217 R220 M221 E224	R198-L202 HydrophobicContact CG-CD1 4.1Å; R198-L202 WeakPolarHBondContact O-CB 3.41Å; R198-L202 WeakPolarHBondContact O-CD1 3.3Å; R198-L202 WeakPolarHBondContact O-CG 3.43Å; R198-L202 PolarHBondContact O-N 3.38Å; A199-L202 PolarHBondContact O-N 2.82Å; L200-L202 PolarHBondContact O-N 2.88Å; L202-Q205 PolarHBondContact O-N 3.08Å; L202-S206 PolarHBondContact O-N 3.46Å; L202-F217 HydrophobicContact CD2-CD1 3.74Å; L202-F217 HydrophobicContact CD2-CE1 4.3Å; L202-R220 HydrophobicContact CD1-CB 4.11Å; L202-R220 HydrophobicContact CD2-CB 4.26Å; L202-M221 HydrophobicContact CB-CB 3.88Å; L202-E224 HydrophobicContact CD1-CG 4.04Å
203	G	86.9	Confident	85.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.2	-53.7	172.7	0	0	0	0	0	112.6	Y52 A199 L200 Y201 Q205 S206 R207 M221	Y52-G203 VanDerWaalsContact CD1-O 3.25Å; Y52-G203 WeakPolarHBondContact CD1-O 3.34Å; Y52-G203 VanDerWaalsContact CE1-C 3.46Å; A199-G203 PolarHBondContact O-N 3.32Å; L200-G203 PolarHBondContact O-N 3.23Å; Y201-G203 VanDerWaalsContact C-N 3.32Å; Y201-G203 PolarHBondContact O-N 3.04Å; G203-Q205 VanDerWaalsContact C-N 3.32Å; G203-Q205 PolarHBondContact O-N 3.47Å; G203-S206 WeakPolarHBondContact O-CB 3.46Å; G203-S206 PolarHBondContact O-N 2.97Å; G203-S206 PolarHBondContact O-OG 2.88Å; G203-R207 PolarHBondContact O-N 3.46Å; G203-M221 VanDerWaalsContact CA-SD 3.6Å
204	L	87.9	Confident	84.7	Confident	57 Å²	57	69.7 Å²	69.7	30%	0.298	31%	0.311	S	S	.	.	H	α-helix	trans	-59.7	-42.1	174.7	-87.3	75.7	0	0	0	111.8	Y52 L200 Y201 S206 R207 W208	Y52-L204 HydrophobicContact CE1-CD1 4.19Å; L200-L204 HydrophobicContact CD1-CD1 3.64Å; L200-L204 HydrophobicContact CG-CD1 4.09Å; L200-L204 WeakPolarHBondContact O-CD1 3.38Å; L200-L204 PolarHBondContact O-N 2.98Å; Y201-L204 PolarHBondContact O-N 3.09Å; L204-S206 VanDerWaalsContact C-N 3.28Å; L204-S206 PolarHBondContact O-N 3.49Å; L204-R207 PolarHBondContact O-N 3.43Å; L204-R207 VanDerWaalsContact O-N 3.09Å; L204-W208 HydrophobicContact CB-CZ3 4.47Å; L204-W208 HydrophobicContact CD2-CH2 4.02Å; L204-W208 HydrophobicContact CD2-CZ2 4.44Å; L204-W208 HydrophobicContact CD2-CZ3 4.44Å; L204-W208 PolarHBondContact O-N 3.15Å
205	Q	87.4	Confident	84.1	Confident	25 Å²	25	67.8 Å²	67.8	12%	0.117	30%	0.304	C	S	.	.	H	α-helix	trans	-63.7	-31.6	177.7	-172.6	171.9	24.9	0	0	112.7	Y201 L202 G203 R209 F217	Y201-Q205 WeakPolarHBondContact O-CB 3.31Å; Y201-Q205 PolarHBondContact O-N 3.44Å; L202-Q205 PolarHBondContact O-N 3.08Å; G203-Q205 VanDerWaalsContact C-N 3.32Å; G203-Q205 PolarHBondContact O-N 3.47Å; Q205-R209 WeakPolarHBondContact O-CG 3.41Å; Q205-F217 HydrophobicContact CB-CG 4.44Å; Q205-F217 VanDerWaalsContact CD-CZ 3.49Å; Q205-F217 HydrophobicContact CG-CD1 4.04Å; Q205-F217 HydrophobicContact CG-CD2 3.87Å; Q205-F217 HydrophobicContact CG-CE1 4.08Å; Q205-F217 HydrophobicContact CG-CE2 3.93Å; Q205-F217 HydrophobicContact CG-CG 3.96Å; Q205-F217 HydrophobicContact CG-CZ 4.04Å; Q205-F217 VanDerWaalsContact NE2-CZ 3.33Å; Q205-F217 VanDerWaalsContact OE1-CE1 3.22Å
206	S	85	Confident	83.7	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-67.2	-37.9	172.3	82.4	0	0	0	0	112.1	Y52 L202 G203 L204 R214	Y52-S206 WeakPolarHBondContact CB-OG 3.25Å; L202-S206 PolarHBondContact O-N 3.46Å; G203-S206 WeakPolarHBondContact O-CB 3.46Å; G203-S206 PolarHBondContact O-N 2.97Å; G203-S206 PolarHBondContact O-OG 2.88Å; L204-S206 VanDerWaalsContact C-N 3.28Å; L204-S206 PolarHBondContact O-N 3.49Å; S206-R214 WeakPolarHBondContact O-CB 3.41Å; S206-R214 VanDerWaalsContact O-CG 3.28Å; S206-R214 WeakPolarHBondContact O-CG 3.47Å
207	R	84.3	Confident	83.4	Confident	155 Å²	155	68.4 Å²	68.4	59%	0.585	31%	0.307	S	S	*	.	H	α-helix	trans	-70.7	-30.9	-179.4	-174.9	176.3	175.8	-166.6	-2.1	113.1	G203 L204	G203-R207 PolarHBondContact O-N 3.46Å; L204-R207 PolarHBondContact O-N 3.43Å; L204-R207 VanDerWaalsContact O-N 3.09Å
208	W	81.4	Confident	83.1	Confident	195 Å²	195	65.7 Å²	65.7	74%	0.739	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	7	-176.5	-66.6	-30.4	0	0	0	115.2	L204	L204-W208 HydrophobicContact CB-CZ3 4.47Å; L204-W208 HydrophobicContact CD2-CH2 4.02Å; L204-W208 HydrophobicContact CD2-CZ2 4.44Å; L204-W208 HydrophobicContact CD2-CZ3 4.44Å; L204-W208 PolarHBondContact O-N 3.15Å
209	R	79.8	Confident	82.5	Confident	125 Å²	125	62.5 Å²	62.5	47%	0.472	28%	0.28	S	S	.	.	S	Bend	trans	-125.9	155.6	-176.6	-69	-176.7	175.4	-121.2	-1.2	112.9	Q205 L213 F217	Q205-R209 WeakPolarHBondContact O-CG 3.41Å; R209-L213 HydrophobicContact CB-CB 4.01Å; R209-F217 VanDerWaalsContact CD-CE2 3.44Å
210	G	76.5	Confident	82.4	Confident	53 Å²	53	66.1 Å²	66.1	55%	0.546	29%	0.292	S	S	.	.			trans	-59.6	159.7	-179.7	0	0	0	0	0	113.5	Q212 L213 R214	G210-Q212 PolarHBondContact O-N 3.19Å; G210-Q212 VanDerWaalsContact O-N 3.13Å; G210-L213 PolarHBondContact O-N 2.92Å; G210-R214 PolarHBondContact O-N 3.38Å
211	E	74.7	Confident	82.3	Confident	117 Å²	117	65 Å²	65	55%	0.547	29%	0.286	S	S	.	.	H	α-helix	trans	-55.8	-39.7	-157	-56.3	-136.7	106	0	0	115.9	R214 R215	E211-R214 WeakPolarHBondContact O-CB 3.49Å; E211-R214 PolarHBondContact O-N 2.72Å; E211-R214 IonicContact OE1-CZ 3.59Å; E211-R214 IonicContact OE1-NH1 3.27Å; E211-R214 PolarHBondContact OE1-NH1 3.23Å; E211-R214 IonicContact OE1-NH2 3.82Å; E211-R214 PolarHBondContact OE1-NH2 2.66Å; E211-R215 PolarHBondContact O-N 2.86Å
212	Q	71.7	Confident	82	Confident	114 Å²	114	58.2 Å²	58.2	53%	0.533	26%	0.26	S	S	.	.	H	α-helix	trans	-64.7	-48.3	176.5	-69.6	-75.2	23.8	0	0	111.6	G210 R214 R215 H216 P556	G210-Q212 PolarHBondContact O-N 3.19Å; G210-Q212 VanDerWaalsContact O-N 3.13Å; Q212-R214 VanDerWaalsContact C-N 3.32Å; Q212-R214 PolarHBondContact O-N 3.07Å; Q212-R215 PolarHBondContact O-N 3.45Å; Q212-H216 PolarHBondContact O-N 3.35Å; Q212-P556 PolarHBondContact NE2-O 3.29Å
213	L	76.1	Confident	81.8	Confident	82 Å²	82	58.4 Å²	58.4	43%	0.429	26%	0.261	S	S	.	.	H	α-helix	trans	-66.9	-34.7	177.4	-74.2	82.9	0	0	0	111.1	R209 G210 R215 H216 F217	R209-L213 HydrophobicContact CB-CB 4.01Å; G210-L213 PolarHBondContact O-N 2.92Å; L213-R215 VanDerWaalsContact C-N 3.32Å; L213-R215 PolarHBondContact O-N 3.27Å; L213-H216 PolarHBondContact O-N 2.91Å; L213-F217 HydrophobicContact CB-CD2 4.16Å; L213-F217 HydrophobicContact CB-CE2 4.04Å; L213-F217 HydrophobicContact CD2-CE2 4.18Å; L213-F217 WeakPolarHBondContact O-CD2 3Å; L213-F217 PolarHBondContact O-N 3.24Å
214	R	80	Confident	81.9	Confident	35 Å²	35	59.1 Å²	59.1	13%	0.132	26%	0.264	C	S	.	.	H	α-helix	trans	-53.7	-48.6	173.1	176	176	82.2	-128.5	-0.3	111.1	S206 G210 E211 Q212 F217 Y218	S206-R214 WeakPolarHBondContact O-CB 3.41Å; S206-R214 VanDerWaalsContact O-CG 3.28Å; S206-R214 WeakPolarHBondContact O-CG 3.47Å; G210-R214 PolarHBondContact O-N 3.38Å; E211-R214 WeakPolarHBondContact O-CB 3.49Å; E211-R214 PolarHBondContact O-N 2.72Å; E211-R214 IonicContact OE1-CZ 3.59Å; E211-R214 IonicContact OE1-NH1 3.27Å; E211-R214 PolarHBondContact OE1-NH1 3.23Å; E211-R214 IonicContact OE1-NH2 3.82Å; E211-R214 PolarHBondContact OE1-NH2 2.66Å; Q212-R214 VanDerWaalsContact C-N 3.32Å; Q212-R214 PolarHBondContact O-N 3.07Å; R214-F217 PolarHBondContact O-N 3.04Å; R214-Y218 WeakPolarHBondContact O-CB 3.45Å; R214-Y218 PolarHBondContact O-N 3.26Å
215	R	76.2	Confident	81.8	Confident	69 Å²	69	57.4 Å²	57.4	26%	0.26	26%	0.257	S	S	.	.	H	α-helix	trans	-62.3	-48.4	179.4	-175.2	168.2	-179.6	130.1	7.8	111.6	E211 Q212 L213 F217 Y218 W219	E211-R215 PolarHBondContact O-N 2.86Å; Q212-R215 PolarHBondContact O-N 3.45Å; L213-R215 VanDerWaalsContact C-N 3.32Å; L213-R215 PolarHBondContact O-N 3.27Å; R215-F217 PolarHBondContact O-N 3.16Å; R215-Y218 WeakPolarHBondContact O-CB 3.47Å; R215-Y218 PolarHBondContact O-N 3.12Å; R215-W219 PolarHBondContact O-N 3.01Å
216	H	81.4	Confident	81.8	Confident	21 Å²	21	56.3 Å²	56.3	10%	0.097	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-43.9	178.1	-178.5	72.3	0	0	0	113.1	Q212 L213 R220 E552	Q212-H216 PolarHBondContact O-N 3.35Å; L213-H216 PolarHBondContact O-N 2.91Å; H216-R220 WeakPolarHBondContact NE2-CD 3.31Å; H216-R220 PolarHBondContact NE2-NH1 2.8Å; H216-R220 WeakPolarHBondContact O-CG 3.43Å; H216-R220 PolarHBondContact O-N 3.28Å; H216-R220 VanDerWaalsContact O-N 3.09Å; H216-E552 WeakPolarHBondContact CA-OE2 3.46Å; H216-E552 IonicContact CE1-OE2 3.66Å; H216-E552 IonicContact CG-OE2 2.69Å; H216-E552 IonicContact ND1-OE2 3.16Å; H216-E552 PolarHBondContact ND1-OE2 3.08Å
217	F	83.3	Confident	81.9	Confident	17 Å²	17	56.4 Å²	56.4	8%	0.075	25%	0.253	C	S	.	.	H	α-helix	trans	-69.5	-32.8	176.8	-72.3	-59.7	0	0	0	112.7	L202 Q205 R209 L213 R214 R215 R220 M221	L202-F217 HydrophobicContact CD2-CD1 3.74Å; L202-F217 HydrophobicContact CD2-CE1 4.3Å; Q205-F217 HydrophobicContact CB-CG 4.44Å; Q205-F217 VanDerWaalsContact CD-CZ 3.49Å; Q205-F217 HydrophobicContact CG-CD1 4.04Å; Q205-F217 HydrophobicContact CG-CD2 3.87Å; Q205-F217 HydrophobicContact CG-CE1 4.08Å; Q205-F217 HydrophobicContact CG-CE2 3.93Å; Q205-F217 HydrophobicContact CG-CG 3.96Å; Q205-F217 HydrophobicContact CG-CZ 4.04Å; Q205-F217 VanDerWaalsContact NE2-CZ 3.33Å; Q205-F217 VanDerWaalsContact OE1-CE1 3.22Å; R209-F217 VanDerWaalsContact CD-CE2 3.44Å; L213-F217 HydrophobicContact CB-CD2 4.16Å; L213-F217 HydrophobicContact CB-CE2 4.04Å; L213-F217 HydrophobicContact CD2-CE2 4.18Å; L213-F217 WeakPolarHBondContact O-CD2 3Å; L213-F217 PolarHBondContact O-N 3.24Å; R214-F217 PolarHBondContact O-N 3.04Å; R215-F217 PolarHBondContact O-N 3.16Å; F217-R220 PolarHBondContact O-N 3.06Å; F217-M221 WeakPolarHBondContact O-CB 3.4Å; F217-M221 PolarHBondContact O-N 3.35Å
218	Y	83.5	Confident	82.2	Confident	25 Å²	25	49.5 Å²	49.5	10%	0.098	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-46.9	172.9	-176.7	-89.7	0	0	0	112.2	P50 R214 R215 R220 M221 L222	P50-Y218 HydrophobicContact CB-CD1 4.29Å; P50-Y218 HydrophobicContact CB-CE1 3.79Å; P50-Y218 HydrophobicContact CB-CE2 4.16Å; P50-Y218 HydrophobicContact CG-CD1 3.73Å; P50-Y218 HydrophobicContact CG-CE1 3.51Å; P50-Y218 HydrophobicContact CG-CG 4.38Å; R214-Y218 WeakPolarHBondContact O-CB 3.45Å; R214-Y218 PolarHBondContact O-N 3.26Å; R215-Y218 WeakPolarHBondContact O-CB 3.47Å; R215-Y218 PolarHBondContact O-N 3.12Å; Y218-R220 VanDerWaalsContact C-N 3.32Å; Y218-R220 PolarHBondContact O-N 3.4Å; Y218-M221 HydrophobicContact CD2-CE 3.57Å; Y218-M221 HydrophobicContact CE2-CE 3.54Å; Y218-M221 HydrophobicContact CG-CE 4.25Å; Y218-M221 WeakPolarHBondContact O-CB 3.46Å; Y218-M221 PolarHBondContact O-N 2.84Å; Y218-L222 HydrophobicContact CE1-CD2 4.01Å; Y218-L222 WeakPolarHBondContact O-CB 3.5Å; Y218-L222 PolarHBondContact O-N 3.25Å
219	W	79.9	Confident	82.5	Confident	27 Å²	27	40.7 Å²	40.7	10%	0.102	20%	0.196	C	C	.	.	H	α-helix	trans	-61.3	-40.9	175.2	-74.6	111.1	0	0	0	112.2	R215 L222 F223 D289 F539	R215-W219 PolarHBondContact O-N 3.01Å; W219-L222 HydrophobicContact CE3-CD2 4.08Å; W219-L222 HydrophobicContact CZ3-CD2 4.01Å; W219-L222 PolarHBondContact O-N 2.77Å; W219-L222 VanDerWaalsContact O-N 3.16Å; W219-F223 HydrophobicContact CB-CE2 4.23Å; W219-F223 WeakPolarHBondContact O-CD2 3.45Å; W219-F223 WeakPolarHBondContact O-CG 3.21Å; W219-F223 PolarHBondContact O-N 3.22Å; W219-D289 WeakPolarHBondContact CH2-OD2 3.37Å; W219-F539 HydrophobicContact CE3-CZ 4.15Å; W219-F539 HydrophobicContact CZ3-CE2 4.13Å; W219-F539 AromaticContact CZ3-CZ 3.84Å; W219-F539 HydrophobicContact CZ3-CZ 3.84Å
220	R	85.6	Confident	82.8	Confident	80 Å²	80	37.9 Å²	37.9	30%	0.302	19%	0.189	S	C	.	.	H	α-helix	trans	-65.9	-37.9	176.1	-71.7	176.1	58.9	176.7	-0.9	113.3	L202 H216 F217 Y218 L222 E224 L549	L202-R220 HydrophobicContact CD1-CB 4.11Å; L202-R220 HydrophobicContact CD2-CB 4.26Å; H216-R220 WeakPolarHBondContact NE2-CD 3.31Å; H216-R220 PolarHBondContact NE2-NH1 2.8Å; H216-R220 WeakPolarHBondContact O-CG 3.43Å; H216-R220 PolarHBondContact O-N 3.28Å; H216-R220 VanDerWaalsContact O-N 3.09Å; F217-R220 PolarHBondContact O-N 3.06Å; Y218-R220 VanDerWaalsContact C-N 3.32Å; Y218-R220 PolarHBondContact O-N 3.4Å; R220-L222 VanDerWaalsContact C-N 3.33Å; R220-E224 PolarHBondContact O-N 3.09Å; R220-E224 VanDerWaalsContact O-N 3.14Å; R220-L549 HydrophobicContact CG-CD1 3.91Å; R220-L549 HydrophobicContact CG-CD2 3.45Å; R220-L549 VanDerWaalsContact CG-CD2 3.45Å; R220-L549 HydrophobicContact CG-CG 4.34Å
221	M	87.9	Confident	83.4	Confident	15 Å²	15	35.5 Å²	35.5	7%	0.074	16%	0.163	C	C	.	.	H	α-helix	trans	-60.6	-44.3	169.8	174.1	-161.4	75.3	0	0	110.8	Y52 A199 L202 G203 F217 Y218 E224 S225	Y52-M221 HydrophobicContact CD2-CE 3.96Å; Y52-M221 HydrophobicContact CD2-SD 3.33Å; Y52-M221 WeakPolarHBondContact CD2-SD 3.4Å; Y52-M221 HydrophobicContact CE2-CE 4.37Å; Y52-M221 HydrophobicContact CE2-SD 3.34Å; Y52-M221 WeakPolarHBondContact CE2-SD 3.17Å; Y52-M221 HydrophobicContact CG-SD 4.27Å; A199-M221 WeakPolarHBondContact O-CG 3.29Å; L202-M221 HydrophobicContact CB-CB 3.88Å; G203-M221 VanDerWaalsContact CA-SD 3.6Å; F217-M221 WeakPolarHBondContact O-CB 3.4Å; F217-M221 PolarHBondContact O-N 3.35Å; Y218-M221 HydrophobicContact CD2-CE 3.57Å; Y218-M221 HydrophobicContact CE2-CE 3.54Å; Y218-M221 HydrophobicContact CG-CE 4.25Å; Y218-M221 WeakPolarHBondContact O-CB 3.46Å; Y218-M221 PolarHBondContact O-N 2.84Å; M221-E224 PolarHBondContact O-N 2.79Å; M221-S225 PolarHBondContact O-N 3.46Å; M221-S225 PolarHBondContact O-OG 3.5Å
222	L	84.3	Confident	84.2	Confident	6 Å²	6	30.1 Å²	30.1	3%	0.031	14%	0.138	C	C	.	.	H	α-helix	trans	-68	-34.4	-178	-165.3	56.1	0	0	0	112.5	Y218 W219 R220 S225 A226 V283 F539	Y218-L222 HydrophobicContact CE1-CD2 4.01Å; Y218-L222 WeakPolarHBondContact O-CB 3.5Å; Y218-L222 PolarHBondContact O-N 3.25Å; W219-L222 HydrophobicContact CE3-CD2 4.08Å; W219-L222 HydrophobicContact CZ3-CD2 4.01Å; W219-L222 PolarHBondContact O-N 2.77Å; W219-L222 VanDerWaalsContact O-N 3.16Å; R220-L222 VanDerWaalsContact C-N 3.33Å; L222-S225 WeakPolarHBondContact CA-OG 3.08Å; L222-S225 PolarHBondContact O-OG 3.02Å; L222-A226 VanDerWaalsContact O-CB 3.3Å; L222-A226 WeakPolarHBondContact O-CB 3.18Å; L222-A226 PolarHBondContact O-N 3.21Å; L222-V283 HydrophobicContact CD1-CG1 3.89Å; L222-F539 HydrophobicContact CD2-CZ 4.13Å; L222-F539 HydrophobicContact CG-CE1 4.04Å; L222-F539 HydrophobicContact CG-CZ 4.14Å
223	F	85.1	Confident	85	Confident	9 Å²	9	25.1 Å²	25.1	4%	0.039	12%	0.115	C	C	.	.	H	α-helix	trans	-67.6	-36.9	170.2	-69.6	-46.2	0	0	0	113	W219 D227 F539 R545 L549	W219-F223 HydrophobicContact CB-CE2 4.23Å; W219-F223 WeakPolarHBondContact O-CD2 3.45Å; W219-F223 WeakPolarHBondContact O-CG 3.21Å; W219-F223 PolarHBondContact O-N 3.22Å; F223-D227 PolarHBondContact O-N 3.3Å; F223-F539 AromaticContact CD1-CD1 3.47Å; F223-F539 HydrophobicContact CD1-CD1 3.47Å; F223-F539 VanDerWaalsContact CD1-CD1 3.47Å; F223-F539 AromaticContact CD1-CE1 3.44Å; F223-F539 HydrophobicContact CD1-CE1 3.44Å; F223-F539 VanDerWaalsContact CD1-CE1 3.44Å; F223-F539 HydrophobicContact CD1-CG 4.18Å; F223-F539 HydrophobicContact CD1-CZ 4.12Å; F223-F539 AromaticContact CE1-CD1 3.63Å; F223-F539 HydrophobicContact CE1-CD1 3.63Å; F223-F539 HydrophobicContact CE1-CD2 4.13Å; F223-F539 AromaticContact CE1-CE1 3.55Å; F223-F539 HydrophobicContact CE1-CE1 3.55Å; F223-F539 HydrophobicContact CE1-CE2 4.06Å; F223-F539 AromaticContact CE1-CG 3.92Å; F223-F539 HydrophobicContact CE1-CG 3.92Å; F223-F539 AromaticContact CE1-CZ 3.77Å; F223-F539 HydrophobicContact CE1-CZ 3.77Å; F223-F539 HydrophobicContact CG-CE1 4.46Å; F223-R545 HydrophobicContact CD1-CG 3.94Å; F223-R545 HydrophobicContact CE1-CG 3.91Å; F223-R545 HydrophobicContact CG-CG 4.36Å; F223-R545 HydrophobicContact CZ-CG 4.28Å; F223-R545 PolarHBondContact O-NH1 3.49Å; F223-L549 HydrophobicContact CD2-CD1 4.18Å; F223-L549 HydrophobicContact CD2-CD2 4.3Å; F223-L549 HydrophobicContact CD2-CG 4.46Å; F223-L549 HydrophobicContact CE2-CD1 4.38Å; F223-L549 HydrophobicContact CE2-CD2 4.01Å; F223-L549 HydrophobicContact CE2-CG 4.19Å
224	E	87.6	Confident	85.6	Confident	14 Å²	14	22.7 Å²	22.7	7%	0.065	10%	0.102	C	C	.	.	H	α-helix	trans	-73.9	-38.8	174.2	-71.6	-67.5	170.2	0	0	112.4	R195 R198 A199 L202 R220 M221 A226 D227 V228	R195-E224 IonicContact NH1-OE2 3.17Å; R195-E224 PolarHBondContact NH1-OE2 3.36Å; R195-E224 VanDerWaalsContact NH1-OE2 3.07Å; R198-E224 WeakPolarHBondContact CD-OE1 3.29Å; R198-E224 HydrophobicContact CG-CG 4.42Å; R198-E224 IonicContact CZ-OE1 2.64Å; R198-E224 IonicContact NE-OE1 3.83Å; R198-E224 IonicContact NH1-OE1 3.66Å; R198-E224 PolarHBondContact NH1-OE1 2.88Å; A199-E224 HydrophobicContact CB-CB 4.03Å; L202-E224 HydrophobicContact CD1-CG 4.04Å; R220-E224 PolarHBondContact O-N 3.09Å; R220-E224 VanDerWaalsContact O-N 3.14Å; M221-E224 PolarHBondContact O-N 2.79Å; E224-A226 VanDerWaalsContact C-N 3.3Å; E224-A226 PolarHBondContact O-N 3.13Å; E224-D227 WeakPolarHBondContact O-CB 3.47Å; E224-D227 PolarHBondContact O-N 3.39Å; E224-V228 WeakPolarHBondContact O-CB 3.37Å; E224-V228 VanDerWaalsContact O-CG2 3.25Å; E224-V228 WeakPolarHBondContact O-CG2 3.33Å; E224-V228 PolarHBondContact O-N 2.96Å
225	S	87.1	Confident	86	Confident	22 Å²	22	21.2 Å²	21.2	15%	0.154	10%	0.097	C	C	.	.	H	α-helix	trans	-69.6	-28.7	176.2	63.9	0	0	0	0	112.4	M221 L222 S229 V283	M221-S225 PolarHBondContact O-N 3.46Å; M221-S225 PolarHBondContact O-OG 3.5Å; L222-S225 WeakPolarHBondContact CA-OG 3.08Å; L222-S225 PolarHBondContact O-OG 3.02Å; S225-S229 VanDerWaalsContact O-CB 3.23Å; S225-S229 WeakPolarHBondContact O-CB 3.21Å; S225-S229 PolarHBondContact O-N 2.95Å; S225-S229 PolarHBondContact O-OG 3.07Å; S225-V283 VanDerWaalsContact OG-CG1 3.31Å; S225-V283 WeakPolarHBondContact OG-CG1 3.34Å
226	A	85.8	Confident	86.7	Confident	2 Å²	2	18 Å²	18	2%	0.017	9%	0.085	C	C	.	.	H	α-helix	trans	-59.2	-53.9	166.2	0	0	0	0	0	111.7	L222 E224 V228 S229 M230 W535 F539	L222-A226 VanDerWaalsContact O-CB 3.3Å; L222-A226 WeakPolarHBondContact O-CB 3.18Å; L222-A226 PolarHBondContact O-N 3.21Å; E224-A226 VanDerWaalsContact C-N 3.3Å; E224-A226 PolarHBondContact O-N 3.13Å; A226-V228 PolarHBondContact O-N 3.25Å; A226-S229 PolarHBondContact O-N 2.87Å; A226-S229 PolarHBondContact O-OG 3.03Å; A226-M230 WeakPolarHBondContact O-CB 3.46Å; A226-M230 PolarHBondContact O-N 3.41Å; A226-W535 HydrophobicContact CB-CE3 4.36Å; A226-W535 HydrophobicContact CB-CH2 3.18Å; A226-W535 HydrophobicContact CB-CZ2 3.66Å; A226-W535 HydrophobicContact CB-CZ3 3.54Å; A226-F539 HydrophobicContact CB-CD1 4.14Å
227	D	87.8	Confident	87.1	Confident	2 Å²	2	17.3 Å²	17.3	1%	0.011	8%	0.082	C	C	.	.	H	α-helix	trans	-57.1	-48.6	178	-72.2	2.3	0	0	0	111.8	W111 R195 F223 E224 M230 L231 R542 R545	W111-D227 HydrophobicContact CE3-CB 4.21Å; W111-D227 HydrophobicContact CZ3-CB 3.75Å; R195-D227 IonicContact CZ-OD2 2.71Å; R195-D227 IonicContact NH1-OD2 3.45Å; R195-D227 PolarHBondContact NH1-OD2 2.96Å; F223-D227 PolarHBondContact O-N 3.3Å; E224-D227 WeakPolarHBondContact O-CB 3.47Å; E224-D227 PolarHBondContact O-N 3.39Å; D227-M230 PolarHBondContact O-N 3.39Å; D227-L231 VanDerWaalsContact O-CG 3.32Å; D227-L231 WeakPolarHBondContact O-CG 3.29Å; D227-L231 PolarHBondContact O-N 2.64Å; D227-R542 IonicContact OD1-NH2 2.98Å; D227-R542 PolarHBondContact OD1-NH2 2.97Å; D227-R542 IonicContact OD2-CZ 3.84Å; D227-R542 IonicContact OD2-NH1 3.46Å; D227-R542 IonicContact OD2-NH2 2.83Å; D227-R542 PolarHBondContact OD2-NH2 3.22Å; D227-R545 IonicContact OD1-CZ 2.68Å; D227-R545 IonicContact OD1-NH1 3.22Å; D227-R545 PolarHBondContact OD1-NH1 2.87Å; D227-R545 IonicContact OD1-NH2 3.32Å; D227-R545 PolarHBondContact OD1-NH2 3.47Å; D227-R545 IonicContact OD2-NH1 2.69Å; D227-R545 PolarHBondContact OD2-NH1 3.41Å
228	V	90.1	Very high	87.3	Confident	10 Å²	10	19 Å²	19	6%	0.061	9%	0.091	C	C	.	.	H	α-helix	trans	-63.6	-48.6	-178.8	168.2	0	0	0	0	111.7	R195 Y196 E224 A226 M230 L231 R232	R195-V228 HydrophobicContact CB-CG2 3.28Å; R195-V228 HydrophobicContact CG-CG2 4.39Å; Y196-V228 HydrophobicContact CD1-CG1 3.95Å; Y196-V228 HydrophobicContact CD2-CG1 3.67Å; Y196-V228 HydrophobicContact CE1-CG1 3.6Å; Y196-V228 HydrophobicContact CE2-CG1 3.27Å; Y196-V228 HydrophobicContact CG-CG1 3.99Å; E224-V228 WeakPolarHBondContact O-CB 3.37Å; E224-V228 VanDerWaalsContact O-CG2 3.25Å; E224-V228 WeakPolarHBondContact O-CG2 3.33Å; E224-V228 PolarHBondContact O-N 2.96Å; A226-V228 PolarHBondContact O-N 3.25Å; V228-M230 VanDerWaalsContact C-N 3.3Å; V228-M230 PolarHBondContact O-N 2.79Å; V228-L231 PolarHBondContact O-N 2.78Å; V228-R232 VanDerWaalsContact O-CB 3.29Å; V228-R232 WeakPolarHBondContact O-CB 2.98Å; V228-R232 PolarHBondContact O-N 2.83Å
229	S	88.3	Confident	87.5	Confident	10 Å²	10	18.4 Å²	18.4	7%	0.07	9%	0.089	C	C	.	.	H	α-helix	trans	-65.8	-34.5	-178.4	58.4	0	0	0	0	111.9	S225 A226 L233	S225-S229 VanDerWaalsContact O-CB 3.23Å; S225-S229 WeakPolarHBondContact O-CB 3.21Å; S225-S229 PolarHBondContact O-N 2.95Å; S225-S229 PolarHBondContact O-OG 3.07Å; A226-S229 PolarHBondContact O-N 2.87Å; A226-S229 PolarHBondContact O-OG 3.03Å; S229-L233 VanDerWaalsContact O-CB 3.26Å; S229-L233 WeakPolarHBondContact O-CB 3.32Å; S229-L233 PolarHBondContact O-N 3.17Å
230	M	85.6	Confident	87.9	Confident	65 Å²	65	17.5 Å²	17.5	32%	0.32	9%	0.087	S	C	.	.	H	α-helix	trans	-70.7	-40.9	175.1	-168.5	167.4	68.9	0	0	112.9	W111 A226 D227 V228 L233 L234 Y280	W111-M230 HydrophobicContact CH2-CE 3.46Å; W111-M230 VanDerWaalsContact CH2-CE 3.46Å; W111-M230 HydrophobicContact CZ2-CE 3.54Å; A226-M230 WeakPolarHBondContact O-CB 3.46Å; A226-M230 PolarHBondContact O-N 3.41Å; D227-M230 PolarHBondContact O-N 3.39Å; V228-M230 VanDerWaalsContact C-N 3.3Å; V228-M230 PolarHBondContact O-N 2.79Å; M230-L233 PolarHBondContact O-N 3.19Å; M230-L234 PolarHBondContact O-N 2.89Å; M230-L234 VanDerWaalsContact O-N 3.09Å; M230-Y280 HydrophobicContact CB-CE2 4.15Å; M230-Y280 HydrophobicContact CG-CE2 4.41Å
231	L	89.6	Confident	88.2	Confident	3 Å²	3	13.7 Å²	13.7	2%	0.016	7%	0.073	C	C	.	.	H	α-helix	trans	-63.8	-43.2	173.3	-72.1	172	0	0	0	111.7	V104 L107 W111 D227 V228 L234 E235	V104-L231 HydrophobicContact CG1-CB 3.76Å; V104-L231 HydrophobicContact CG1-CD2 3.82Å; V104-L231 HydrophobicContact CG1-CG 4.25Å; L107-L231 HydrophobicContact CB-CD2 3.91Å; W111-L231 HydrophobicContact CE3-CD1 3.97Å; W111-L231 HydrophobicContact CE3-CD2 4.33Å; W111-L231 HydrophobicContact CE3-CG 4.27Å; W111-L231 HydrophobicContact CH2-CD1 4.28Å; W111-L231 HydrophobicContact CH2-CD2 3.67Å; W111-L231 HydrophobicContact CH2-CG 3.68Å; W111-L231 HydrophobicContact CZ2-CD2 4.34Å; W111-L231 HydrophobicContact CZ3-CD1 3.49Å; W111-L231 VanDerWaalsContact CZ3-CD1 3.49Å; W111-L231 HydrophobicContact CZ3-CD2 3.7Å; W111-L231 HydrophobicContact CZ3-CG 3.4Å; W111-L231 VanDerWaalsContact CZ3-CG 3.4Å; D227-L231 VanDerWaalsContact O-CG 3.32Å; D227-L231 WeakPolarHBondContact O-CG 3.29Å; D227-L231 PolarHBondContact O-N 2.64Å; V228-L231 PolarHBondContact O-N 2.78Å; L231-L234 PolarHBondContact O-N 2.92Å; L231-E235 PolarHBondContact O-N 2.98Å
232	R	90.7	Very high	88.2	Confident	5 Å²	5	14.7 Å²	14.7	2%	0.019	8%	0.08	C	C	.	.	H	α-helix	trans	-59.9	-47.5	175	171.8	62.3	65.8	-118.8	-14.5	111.6	F67 Y196 V228 L234 E235 T236 T276	F67-R232 VanDerWaalsContact CD2-NH1 3.33Å; Y196-R232 PolarHBondContact OH-NE 2.91Å; V228-R232 VanDerWaalsContact O-CB 3.29Å; V228-R232 WeakPolarHBondContact O-CB 2.98Å; V228-R232 PolarHBondContact O-N 2.83Å; R232-L234 VanDerWaalsContact C-N 3.34Å; R232-L234 PolarHBondContact O-N 3.09Å; R232-E235 IonicContact NH1-OE2 3.64Å; R232-E235 PolarHBondContact NH1-OE2 3.28Å; R232-E235 PolarHBondContact O-N 2.86Å; R232-T236 HydrophobicContact CG-CG2 4.5Å; R232-T236 PolarHBondContact O-N 3.49Å; R232-T236 PolarHBondContact O-OG1 3.19Å; R232-T276 VanDerWaalsContact CD-CG2 3.49Å; R232-T276 HydrophobicContact CG-CG2 3.54Å
233	L	89.3	Confident	88.5	Confident	9 Å²	9	14.6 Å²	14.6	5%	0.047	8%	0.079	C	C	.	.	H	α-helix	trans	-58.3	-46.8	178.8	-171.8	80.4	0	0	0	111	S229 M230 E235 T236 F237 L277 Y280 I367 F373	S229-L233 VanDerWaalsContact O-CB 3.26Å; S229-L233 WeakPolarHBondContact O-CB 3.32Å; S229-L233 PolarHBondContact O-N 3.17Å; M230-L233 PolarHBondContact O-N 3.19Å; L233-E235 VanDerWaalsContact C-N 3.34Å; L233-E235 PolarHBondContact O-N 3.14Å; L233-T236 PolarHBondContact O-N 3.45Å; L233-T236 PolarHBondContact O-OG1 3.4Å; L233-F237 HydrophobicContact CD1-CD2 4.17Å; L233-F237 HydrophobicContact CD1-CE2 3.74Å; L233-F237 HydrophobicContact CG-CD2 4.25Å; L233-F237 HydrophobicContact CG-CE2 4.31Å; L233-F237 WeakPolarHBondContact O-CD2 3.41Å; L233-F237 PolarHBondContact O-N 2.94Å; L233-L277 HydrophobicContact CD1-CD1 3.84Å; L233-Y280 HydrophobicContact CB-CD2 4.34Å; L233-Y280 HydrophobicContact CD1-CG 4.34Å; L233-Y280 HydrophobicContact CD2-CD1 4.22Å; L233-Y280 HydrophobicContact CD2-CD2 3.99Å; L233-Y280 HydrophobicContact CD2-CE1 4.31Å; L233-Y280 HydrophobicContact CD2-CE2 4.05Å; L233-Y280 HydrophobicContact CD2-CG 4.07Å; L233-I367 HydrophobicContact CD2-CD1 4.04Å; L233-I367 HydrophobicContact CG-CD1 4.37Å; L233-F373 HydrophobicContact CD1-CE2 4.49Å; L233-F373 HydrophobicContact CD2-CD2 4.44Å; L233-F373 HydrophobicContact CD2-CE2 3.54Å; L233-F373 HydrophobicContact CD2-CZ 3.77Å
234	L	88.1	Confident	88.8	Confident	30 Å²	30	14.3 Å²	14.3	16%	0.157	8%	0.078	C	C	.	.	H	α-helix	trans	-62.1	-41.4	177.2	-177.9	62.2	0	0	0	111.9	V103 V104 L107 M230 L231 R232 L238 V363	V103-L234 HydrophobicContact CG1-CD2 4.41Å; V104-L234 HydrophobicContact CG2-CB 4.35Å; V104-L234 HydrophobicContact CG2-CD2 4.16Å; V104-L234 HydrophobicContact CG2-CG 4.17Å; L107-L234 HydrophobicContact CD1-CD2 3.42Å; L107-L234 VanDerWaalsContact CD1-CD2 3.42Å; M230-L234 PolarHBondContact O-N 2.89Å; M230-L234 VanDerWaalsContact O-N 3.09Å; L231-L234 PolarHBondContact O-N 2.92Å; R232-L234 VanDerWaalsContact C-N 3.34Å; R232-L234 PolarHBondContact O-N 3.09Å; L234-L238 HydrophobicContact CD1-CD1 3.69Å; L234-L238 HydrophobicContact CD1-CG 4.17Å; L234-L238 HydrophobicContact CG-CD1 3.94Å; L234-L238 WeakPolarHBondContact O-CB 3.3Å; L234-L238 VanDerWaalsContact O-CG 3.3Å; L234-L238 WeakPolarHBondContact O-CG 3.5Å; L234-L238 PolarHBondContact O-N 3.42Å; L234-V363 HydrophobicContact CD1-CG1 3.79Å; L234-V363 HydrophobicContact CD1-CG2 4.3Å
235	E	89.9	Confident	89	Confident	5 Å²	5	14.1 Å²	14.1	2%	0.023	8%	0.078	C	C	.	.	H	α-helix	trans	-61.7	-50	174.8	-163.3	-178.2	175.9	0	0	111.4	P100 V104 Q192 L231 R232 L233 F237 L238 R239	P100-E235 HydrophobicContact CB-CG 4.39Å; V104-E235 HydrophobicContact CG2-CB 4.07Å; Q192-E235 PolarHBondContact NE2-OE2 2.98Å; Q192-E235 PolarHBondContact OE1-OE2 3.06Å; L231-E235 PolarHBondContact O-N 2.98Å; R232-E235 IonicContact NH1-OE2 3.64Å; R232-E235 PolarHBondContact NH1-OE2 3.28Å; R232-E235 PolarHBondContact O-N 2.86Å; L233-E235 VanDerWaalsContact C-N 3.34Å; L233-E235 PolarHBondContact O-N 3.14Å; E235-F237 VanDerWaalsContact C-N 3.31Å; E235-F237 PolarHBondContact O-N 3.15Å; E235-L238 PolarHBondContact O-N 3.42Å; E235-L238 VanDerWaalsContact O-N 3.13Å; E235-R239 HydrophobicContact CG-CB 4.35Å; E235-R239 VanDerWaalsContact O-CB 3.29Å; E235-R239 WeakPolarHBondContact O-CB 3.29Å; E235-R239 PolarHBondContact O-N 3.44Å; E235-R239 IonicContact OE1-CZ 2.91Å; E235-R239 IonicContact OE1-NE 2.71Å; E235-R239 IonicContact OE1-NH1 3.96Å; E235-R239 PolarHBondContact OE1-NH1 2.98Å
236	T	90.3	Very high	89	Confident	2 Å²	2	15.3 Å²	15.3	1%	0.012	8%	0.082	C	C	.	.	H	α-helix	trans	-66.6	-28.6	-171.8	52	0	0	0	0	113.8	R232 L233 S240 A241 T276	R232-T236 HydrophobicContact CG-CG2 4.5Å; R232-T236 PolarHBondContact O-N 3.49Å; R232-T236 PolarHBondContact O-OG1 3.19Å; L233-T236 PolarHBondContact O-N 3.45Å; L233-T236 PolarHBondContact O-OG1 3.4Å; T236-S240 CarbonylContact O-C 3.5Å; T236-S240 WeakPolarHBondContact O-CA 3.11Å; T236-S240 WeakPolarHBondContact O-CB 3.49Å; T236-S240 PolarHBondContact O-N 3.08Å; T236-S240 VanDerWaalsContact O-N 3.09Å; T236-A241 PolarHBondContact O-N 3.29Å; T236-T276 HydrophobicContact CG2-CG2 4.2Å
237	F	89.5	Confident	89.1	Confident	5 Å²	5	15.7 Å²	15.7	2%	0.022	8%	0.084	C	C	.	.	H	α-helix	trans	-85.2	-20.6	173.8	-73.8	-75.7	0	0	0	114.6	L233 E235 A241 P242 L273 L277 I367 F370 C371	L233-F237 HydrophobicContact CD1-CD2 4.17Å; L233-F237 HydrophobicContact CD1-CE2 3.74Å; L233-F237 HydrophobicContact CG-CD2 4.25Å; L233-F237 HydrophobicContact CG-CE2 4.31Å; L233-F237 WeakPolarHBondContact O-CD2 3.41Å; L233-F237 PolarHBondContact O-N 2.94Å; E235-F237 VanDerWaalsContact C-N 3.31Å; E235-F237 PolarHBondContact O-N 3.15Å; F237-A241 HydrophobicContact CD1-CB 4.09Å; F237-P242 WeakPolarHBondContact O-CD 3.29Å; F237-L273 HydrophobicContact CE1-CD2 4.14Å; F237-L273 HydrophobicContact CZ-CD2 3.88Å; F237-L277 HydrophobicContact CE2-CD1 4.49Å; F237-L277 HydrophobicContact CZ-CD2 4.44Å; F237-I367 HydrophobicContact CB-CG1 4.15Å; F237-I367 HydrophobicContact CD1-CB 4.44Å; F237-I367 HydrophobicContact CD1-CG1 4.34Å; F237-I367 HydrophobicContact CD1-CG2 4.3Å; F237-I367 HydrophobicContact CD2-CB 4.49Å; F237-I367 HydrophobicContact CD2-CD1 4.27Å; F237-I367 HydrophobicContact CD2-CG1 3.78Å; F237-I367 HydrophobicContact CD2-CG2 4.2Å; F237-I367 HydrophobicContact CE1-CG2 4.03Å; F237-I367 HydrophobicContact CE2-CG1 4.33Å; F237-I367 HydrophobicContact CE2-CG2 3.92Å; F237-I367 HydrophobicContact CG-CB 4.39Å; F237-I367 HydrophobicContact CG-CG1 3.8Å; F237-I367 HydrophobicContact CG-CG2 4.4Å; F237-I367 HydrophobicContact CZ-CG2 3.84Å; F237-F370 HydrophobicContact CD1-CB 4.37Å; F237-F370 HydrophobicContact CD1-CD2 4.1Å; F237-F370 HydrophobicContact CE1-CB 3.95Å; F237-C371 WeakPolarHBondContact CZ-SG 3.39Å
238	L	87.6	Confident	89.2	Confident	52 Å²	52	16.9 Å²	16.9	27%	0.272	9%	0.09	S	C	.	.	H	α-helix	trans	-90.3	-27	174.3	-68.3	179.1	0	0	0	113.5	P100 L234 E235 I366	P100-L238 HydrophobicContact CB-CB 3.75Å; P100-L238 HydrophobicContact CG-CB 3.77Å; P100-L238 WeakPolarHBondContact CG-O 3.43Å; L234-L238 HydrophobicContact CD1-CD1 3.69Å; L234-L238 HydrophobicContact CD1-CG 4.17Å; L234-L238 HydrophobicContact CG-CD1 3.94Å; L234-L238 WeakPolarHBondContact O-CB 3.3Å; L234-L238 VanDerWaalsContact O-CG 3.3Å; L234-L238 WeakPolarHBondContact O-CG 3.5Å; L234-L238 PolarHBondContact O-N 3.42Å; E235-L238 PolarHBondContact O-N 3.42Å; E235-L238 VanDerWaalsContact O-N 3.13Å; L238-I366 HydrophobicContact CD2-CD1 4.17Å
239	R	88.5	Confident	89.1	Confident	13 Å²	13	17.5 Å²	17.5	5%	0.049	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-70.2	-178.5	172.9	174.2	171.2	177.9	2.7	111.6	D70 D74 F96 P100 E235 A241 P242 Q243	D70-R239 PolarHBondContact O-NH2 2.91Å; D74-R239 IonicContact OD2-CZ 3.47Å; D74-R239 IonicContact OD2-NE 3.98Å; D74-R239 PolarHBondContact OD2-NE 3.36Å; D74-R239 IonicContact OD2-NH2 3.71Å; D74-R239 PolarHBondContact OD2-NH2 3.5Å; F96-R239 WeakPolarHBondContact O-CB 3.25Å; F96-R239 VanDerWaalsContact O-CG 3.24Å; F96-R239 WeakPolarHBondContact O-CG 3.43Å; P100-R239 HydrophobicContact CB-CB 3.98Å; P100-R239 HydrophobicContact CG-CB 3.91Å; E235-R239 HydrophobicContact CG-CB 4.35Å; E235-R239 VanDerWaalsContact O-CB 3.29Å; E235-R239 WeakPolarHBondContact O-CB 3.29Å; E235-R239 PolarHBondContact O-N 3.44Å; E235-R239 IonicContact OE1-CZ 2.91Å; E235-R239 IonicContact OE1-NE 2.71Å; E235-R239 IonicContact OE1-NH1 3.96Å; E235-R239 PolarHBondContact OE1-NH1 2.98Å; R239-A241 PolarHBondContact O-N 2.88Å; R239-P242 WeakPolarHBondContact O-CD 3.36Å; R239-Q243 VanDerWaalsContact O-CB 3.23Å; R239-Q243 WeakPolarHBondContact O-CB 3.22Å; R239-Q243 PolarHBondContact O-N 3.42Å; R239-Q243 VanDerWaalsContact O-N 3.1Å
240	S	88.1	Confident	88.9	Confident	9 Å²	9	18.4 Å²	18.4	6%	0.063	10%	0.099	C	C	.	.	H	α-helix	trans	-68.2	-38.7	-165	-44	0	0	0	0	112.9	T236 Q243 L244	T236-S240 CarbonylContact O-C 3.5Å; T236-S240 WeakPolarHBondContact O-CA 3.11Å; T236-S240 WeakPolarHBondContact O-CB 3.49Å; T236-S240 PolarHBondContact O-N 3.08Å; T236-S240 VanDerWaalsContact O-N 3.09Å; S240-Q243 PolarHBondContact O-N 3.22Å; S240-L244 WeakPolarHBondContact O-CB 3.36Å; S240-L244 PolarHBondContact O-N 3.43Å
241	A	90.2	Very high	88.9	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-69.1	-48.1	-177.8	0	0	0	0	0	113.4	T236 F237 R239 V245 L273 F370	T236-A241 PolarHBondContact O-N 3.29Å; F237-A241 HydrophobicContact CD1-CB 4.09Å; R239-A241 PolarHBondContact O-N 2.88Å; A241-V245 PolarHBondContact O-N 3.4Å; A241-L273 HydrophobicContact CB-CD1 3.81Å; A241-F370 HydrophobicContact CB-CD1 3.98Å; A241-F370 HydrophobicContact CB-CD2 3.95Å; A241-F370 HydrophobicContact CB-CE1 3.81Å; A241-F370 HydrophobicContact CB-CE2 3.79Å; A241-F370 HydrophobicContact CB-CG 4.04Å; A241-F370 HydrophobicContact CB-CZ 3.72Å
242	P	89.2	Confident	88.7	Confident	36 Å²	36	18.4 Å²	18.4	23%	0.234	10%	0.1	C	C	.	.	H	α-helix	trans	-61.6	-41	170	-24.2	34.6	0	0	0	113.1	F96 F237 R239 V245 L246	F96-P242 HydrophobicContact CD1-CB 4.12Å; F96-P242 HydrophobicContact CE1-CB 3.67Å; F96-P242 HydrophobicContact CE1-CG 4.25Å; F96-P242 HydrophobicContact CZ-CB 3.98Å; F237-P242 WeakPolarHBondContact O-CD 3.29Å; R239-P242 WeakPolarHBondContact O-CD 3.36Å; P242-V245 PolarHBondContact O-N 3.44Å; P242-L246 PolarHBondContact O-N 3.43Å
243	Q	89.3	Confident	88.3	Confident	3 Å²	3	24.2 Å²	24.2	1%	0.014	13%	0.127	C	C	.	.	H	α-helix	trans	-69.7	-34	-177.4	-162.5	-171.1	-63.7	0	0	112.6	D74 R239 S240 V245 L246 Q247	D74-Q243 VanDerWaalsContact CG-NE2 3.29Å; D74-Q243 PolarHBondContact OD1-NE2 3.11Å; R239-Q243 VanDerWaalsContact O-CB 3.23Å; R239-Q243 WeakPolarHBondContact O-CB 3.22Å; R239-Q243 PolarHBondContact O-N 3.42Å; R239-Q243 VanDerWaalsContact O-N 3.1Å; S240-Q243 PolarHBondContact O-N 3.22Å; Q243-V245 VanDerWaalsContact C-N 3.35Å; Q243-V245 PolarHBondContact O-N 3.03Å; Q243-L246 WeakPolarHBondContact O-CB 3.23Å; Q243-L246 PolarHBondContact O-N 3.43Å; Q243-Q247 WeakPolarHBondContact O-CB 3.47Å; Q243-Q247 VanDerWaalsContact O-CG 3.29Å; Q243-Q247 WeakPolarHBondContact O-CG 3.26Å; Q243-Q247 PolarHBondContact O-N 2.68Å
244	L	91.6	Very high	87.8	Confident	3 Å²	3	29 Å²	29	2%	0.016	15%	0.145	C	C	.	.	H	α-helix	trans	-60	-42.8	171.8	173.4	62.4	0	0	0	111.5	S240 Q247 L248 T266 L270 L273	S240-L244 WeakPolarHBondContact O-CB 3.36Å; S240-L244 PolarHBondContact O-N 3.43Å; L244-Q247 PolarHBondContact O-N 3.27Å; L244-L248 HydrophobicContact CD1-CD1 4.02Å; L244-L248 HydrophobicContact CD1-CG 4.25Å; L244-L248 HydrophobicContact CG-CD1 4.1Å; L244-L248 WeakPolarHBondContact O-CB 3.29Å; L244-L248 VanDerWaalsContact O-CG 3.31Å; L244-L248 WeakPolarHBondContact O-CG 3.46Å; L244-L248 PolarHBondContact O-N 3.43Å; L244-T266 HydrophobicContact CD1-CG2 3.67Å; L244-L270 HydrophobicContact CD1-CB 4.09Å; L244-L270 HydrophobicContact CD2-CB 4.09Å; L244-L270 HydrophobicContact CD2-CD1 3.95Å; L244-L273 HydrophobicContact CD2-CD1 4.21Å
245	V	91.9	Very high	86.5	Confident	10 Å²	10	30.7 Å²	30.7	6%	0.061	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-41.5	174.6	177.6	0	0	0	0	110.9	A241 P242 Q243 S249 F317 A318 F328 F370	A241-V245 PolarHBondContact O-N 3.4Å; P242-V245 PolarHBondContact O-N 3.44Å; Q243-V245 VanDerWaalsContact C-N 3.35Å; Q243-V245 PolarHBondContact O-N 3.03Å; V245-S249 VanDerWaalsContact O-CB 3.31Å; V245-S249 WeakPolarHBondContact O-CB 3.29Å; V245-S249 PolarHBondContact O-N 3.1Å; V245-S249 PolarHBondContact O-OG 2.97Å; V245-F317 HydrophobicContact CG1-CB 3.81Å; V245-F317 HydrophobicContact CG2-CB 4.09Å; V245-F317 HydrophobicContact CG2-CD2 4.03Å; V245-A318 HydrophobicContact CG1-CB 4.46Å; V245-F328 HydrophobicContact CG1-CZ 4.08Å; V245-F370 HydrophobicContact CG2-CE1 4Å
246	L	87.1	Confident	85.3	Confident	47 Å²	47	33.1 Å²	33.1	25%	0.246	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-48.5	176.2	-176.6	62.4	0	0	0	111.7	P242 Q243 S249 L250	P242-L246 PolarHBondContact O-N 3.43Å; Q243-L246 WeakPolarHBondContact O-CB 3.23Å; Q243-L246 PolarHBondContact O-N 3.43Å; L246-S249 PolarHBondContact O-N 2.96Å; L246-S249 PolarHBondContact O-OG 3.17Å; L246-L250 PolarHBondContact O-N 2.95Å
247	Q	88.4	Confident	83.8	Confident	11 Å²	11	37.5 Å²	37.5	5%	0.051	23%	0.232	C	C	.	.	H	α-helix	trans	-56.2	-50.4	176.1	-75.1	169.6	-11.2	0	0	111.5	L77 Q243 L244 S249 L250 L251 T266 S269	L77-Q247 HydrophobicContact CD2-CG 3.8Å; L77-Q247 VanDerWaalsContact CD2-NE2 3.28Å; Q243-Q247 WeakPolarHBondContact O-CB 3.47Å; Q243-Q247 VanDerWaalsContact O-CG 3.29Å; Q243-Q247 WeakPolarHBondContact O-CG 3.26Å; Q243-Q247 PolarHBondContact O-N 2.68Å; L244-Q247 PolarHBondContact O-N 3.27Å; Q247-S249 PolarHBondContact O-N 3.19Å; Q247-L250 PolarHBondContact O-N 2.95Å; Q247-L251 PolarHBondContact O-N 3.44Å; Q247-T266 HydrophobicContact CB-CG2 4.05Å; Q247-S269 PolarHBondContact OE1-OG 2.85Å
248	L	90.1	Very high	82.4	Confident	26 Å²	26	41.9 Å²	41.9	14%	0.136	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-42.8	176.6	-73.4	168.7	0	0	0	112.1	L244 L250 L251 V252 T266 S314 L315 A318	L244-L248 HydrophobicContact CD1-CD1 4.02Å; L244-L248 HydrophobicContact CD1-CG 4.25Å; L244-L248 HydrophobicContact CG-CD1 4.1Å; L244-L248 WeakPolarHBondContact O-CB 3.29Å; L244-L248 VanDerWaalsContact O-CG 3.31Å; L244-L248 WeakPolarHBondContact O-CG 3.46Å; L244-L248 PolarHBondContact O-N 3.43Å; L248-L250 VanDerWaalsContact C-N 3.32Å; L248-L250 PolarHBondContact O-N 3.28Å; L248-L251 PolarHBondContact O-N 2.99Å; L248-V252 WeakPolarHBondContact O-CG2 3.34Å; L248-V252 PolarHBondContact O-N 2.71Å; L248-T266 HydrophobicContact CD2-CG2 3.6Å; L248-T266 HydrophobicContact CG-CG2 3.68Å; L248-S314 WeakPolarHBondContact CD1-OG 3.44Å; L248-L315 HydrophobicContact CD2-CD1 4.41Å; L248-A318 HydrophobicContact CB-CB 3.41Å; L248-A318 VanDerWaalsContact CB-CB 3.41Å
249	S	88.6	Confident	81.6	Confident	23 Å²	23	44.7 Å²	44.7	16%	0.161	28%	0.276	C	S	.	.	H	α-helix	trans	-65.1	-36	-179.1	73.6	0	0	0	0	112.2	V245 L246 Q247 H253	V245-S249 VanDerWaalsContact O-CB 3.31Å; V245-S249 WeakPolarHBondContact O-CB 3.29Å; V245-S249 PolarHBondContact O-N 3.1Å; V245-S249 PolarHBondContact O-OG 2.97Å; L246-S249 PolarHBondContact O-N 2.96Å; L246-S249 PolarHBondContact O-OG 3.17Å; Q247-S249 PolarHBondContact O-N 3.19Å; S249-H253 WeakPolarHBondContact O-CB 3.44Å; S249-H253 PolarHBondContact O-N 2.99Å
250	L	84.5	Confident	81.1	Confident	29 Å²	29	50 Å²	50	15%	0.152	31%	0.305	C	S	.	.	H	α-helix	trans	-72.6	-36.3	175.6	-174	66.2	0	0	0	112.1	Y81 L246 Q247 L248 H253 R254	Y81-L250 HydrophobicContact CE1-CD2 3.55Å; Y81-L250 WeakPolarHBondContact OH-CD2 3.27Å; L246-L250 PolarHBondContact O-N 2.95Å; Q247-L250 PolarHBondContact O-N 2.95Å; L248-L250 VanDerWaalsContact C-N 3.32Å; L248-L250 PolarHBondContact O-N 3.28Å; L250-H253 PolarHBondContact O-N 2.89Å; L250-R254 WeakPolarHBondContact O-CG 3.21Å; L250-R254 PolarHBondContact O-N 3.25Å
251	L	85.1	Confident	80.5	Confident	54 Å²	54	55.9 Å²	55.9	28%	0.283	34%	0.335	S	S	.	.	H	α-helix	trans	-62.9	-45.9	173.8	-175.8	63.4	0	0	0	111	Q247 L248 H253 R254 P258	Q247-L251 PolarHBondContact O-N 3.44Å; L248-L251 PolarHBondContact O-N 2.99Å; L251-H253 VanDerWaalsContact C-N 3.35Å; L251-H253 PolarHBondContact O-N 3.41Å; L251-R254 PolarHBondContact O-N 3.09Å; L251-P258 HydrophobicContact CD1-CB 4.43Å
252	V	84.5	Confident	80.1	Confident	14 Å²	14	58 Å²	58	9%	0.085	35%	0.349	C	S	.	.	H	α-helix	trans	-61.1	-41.8	173.5	170.8	0	0	0	0	111.5	L248 R254 L319 M417	L248-V252 WeakPolarHBondContact O-CG2 3.34Å; L248-V252 PolarHBondContact O-N 2.71Å; V252-R254 VanDerWaalsContact C-N 3.32Å; V252-R254 PolarHBondContact O-N 3.3Å; V252-L319 HydrophobicContact CG1-CD2 4.18Å; V252-L319 HydrophobicContact CG2-CD2 4.13Å; V252-M417 HydrophobicContact CG2-CE 3.93Å
253	H	82.7	Confident	79.8	Confident	128 Å²	128	57.9 Å²	57.9	59%	0.593	35%	0.351	S	S	*	.	H	α-helix	trans	-70.5	-25	-178	-165.7	59.8	0	0	0	113.8	S249 L250 L251	S249-H253 WeakPolarHBondContact O-CB 3.44Å; S249-H253 PolarHBondContact O-N 2.99Å; L250-H253 PolarHBondContact O-N 2.89Å; L251-H253 VanDerWaalsContact C-N 3.35Å; L251-H253 PolarHBondContact O-N 3.41Å
254	R	78.1	Confident	79.5	Confident	110 Å²	110	62.1 Å²	62.1	42%	0.415	37%	0.373	S	S	.	.	H	α-helix	trans	-75.4	-22.3	179.1	-81.6	178.1	168.9	148.4	-4.2	114.3	L250 L251 V252 G256	L250-R254 WeakPolarHBondContact O-CG 3.21Å; L250-R254 PolarHBondContact O-N 3.25Å; L251-R254 PolarHBondContact O-N 3.09Å; V252-R254 VanDerWaalsContact C-N 3.32Å; V252-R254 PolarHBondContact O-N 3.3Å; R254-G256 PolarHBondContact O-N 2.89Å
255	G	61.3	Low	79.2	Confident	64 Å²	64	63.1 Å²	63.1	66%	0.66	38%	0.38	S	S	*	.			trans	63.6	-14.3	163	0	0	0	0	0	119.3
256	G	64.7	Low	79	Confident	57 Å²	57	63.1 Å²	63.1	59%	0.588	38%	0.38	S	S	*	.	S	Bend	trans	-84.5	-168.1	178.7	0	0	0	0	0	114	R254	R254-G256 PolarHBondContact O-N 2.89Å
257	A	59.3	Low	79.1	Confident	94 Å²	94	63.5 Å²	63.5	78%	0.777	39%	0.387	S	S	*	.	S	Bend	trans	-57.1	130.7	168.4	0	0	0	0	0	109.5	D259	A257-D259 PolarHBondContact O-N 3.18Å
258	P	59.8	Low	79.1	Confident	96 Å²	96	64.8 Å²	64.8	62%	0.623	40%	0.399	S	S	*	.			trans	-71.3	115.2	-174.8	27.2	-33.5	0	0	0	110.3	L251 L260	L251-P258 HydrophobicContact CD1-CB 4.43Å; P258-L260 PolarHBondContact O-N 3.18Å; P258-L260 VanDerWaalsContact O-N 3.16Å
259	D	70.1	Confident	79.1	Confident	112 Å²	112	63.8 Å²	63.8	60%	0.599	40%	0.395	S	S	*	.			trans	-52.1	123	166.3	-73	-44.1	0	0	0	109	A257 L261 P262 A263	A257-D259 PolarHBondContact O-N 3.18Å; D259-L261 PolarHBondContact O-N 3.3Å; D259-L261 VanDerWaalsContact O-N 3.14Å; D259-P262 HydrophobicContact CB-CG 3.94Å; D259-P262 WeakPolarHBondContact O-CD 3.02Å; D259-A263 PolarHBondContact O-N 3.27Å
260	L	77.9	Confident	79.3	Confident	123 Å²	123	64 Å²	64	64%	0.644	39%	0.394	S	S	*	.	H	α-helix	trans	-59.9	-31.6	-173.5	-175.5	62.8	0	0	0	111.9	P258 A263 L264	P258-L260 PolarHBondContact O-N 3.18Å; P258-L260 VanDerWaalsContact O-N 3.16Å; L260-A263 PolarHBondContact O-N 3.25Å; L260-L264 HydrophobicContact CD1-CD1 4.14Å; L260-L264 HydrophobicContact CD1-CG 4.09Å; L260-L264 HydrophobicContact CD2-CD1 4.32Å; L260-L264 HydrophobicContact CG-CD1 3.78Å; L260-L264 HydrophobicContact CG-CG 4.17Å; L260-L264 WeakPolarHBondContact O-CB 3.41Å; L260-L264 VanDerWaalsContact O-CG 3.24Å; L260-L264 WeakPolarHBondContact O-CG 3.28Å; L260-L264 PolarHBondContact O-N 3.22Å
261	L	77.3	Confident	79.6	Confident	134 Å²	134	66 Å²	66	70%	0.702	41%	0.407	S	S	*	.	H	α-helix	trans	-69.8	-53.5	-176.2	-63.8	173.8	0	0	0	113.2	D259 A263 L264 S265	D259-L261 PolarHBondContact O-N 3.3Å; D259-L261 VanDerWaalsContact O-N 3.14Å; L261-A263 VanDerWaalsContact C-N 3.3Å; L261-A263 PolarHBondContact O-N 2.81Å; L261-L264 PolarHBondContact O-N 3.44Å; L261-S265 WeakPolarHBondContact O-CB 3.41Å; L261-S265 PolarHBondContact O-N 3.09Å
262	P	80.9	Confident	79.9	Confident	45 Å²	45	63.6 Å²	63.6	29%	0.292	40%	0.395	S	S	.	.	H	α-helix	trans	-53.3	-42.1	167.9	-29.9	35.1	0	0	0	114.1	D259 S265 T266	D259-P262 HydrophobicContact CB-CG 3.94Å; D259-P262 WeakPolarHBondContact O-CD 3.02Å; P262-S265 PolarHBondContact O-N 3.13Å; P262-T266 WeakPolarHBondContact O-CB 3.18Å; P262-T266 PolarHBondContact O-N 3.13Å; P262-T266 PolarHBondContact O-OG1 3.1Å
263	A	82.3	Confident	80.3	Confident	33 Å²	33	63 Å²	63	27%	0.273	39%	0.391	S	S	.	.	H	α-helix	trans	-64.1	-44.7	179.9	0	0	0	0	0	112.2	D259 L260 L261 T266 S267	D259-A263 PolarHBondContact O-N 3.27Å; L260-A263 PolarHBondContact O-N 3.25Å; L261-A263 VanDerWaalsContact C-N 3.3Å; L261-A263 PolarHBondContact O-N 2.81Å; A263-T266 PolarHBondContact O-N 3.34Å; A263-S267 PolarHBondContact O-N 3.5Å; A263-S267 PolarHBondContact O-OG 3.46Å
264	L	82.9	Confident	80.8	Confident	92 Å²	92	56.9 Å²	56.9	48%	0.482	36%	0.363	S	S	.	.	H	α-helix	trans	-66.7	-37.6	174.8	-72.6	175.5	0	0	0	112.9	L260 L261 T266 S267 A268	L260-L264 HydrophobicContact CD1-CD1 4.14Å; L260-L264 HydrophobicContact CD1-CG 4.09Å; L260-L264 HydrophobicContact CD2-CD1 4.32Å; L260-L264 HydrophobicContact CG-CD1 3.78Å; L260-L264 HydrophobicContact CG-CG 4.17Å; L260-L264 WeakPolarHBondContact O-CB 3.41Å; L260-L264 VanDerWaalsContact O-CG 3.24Å; L260-L264 WeakPolarHBondContact O-CG 3.28Å; L260-L264 PolarHBondContact O-N 3.22Å; L261-L264 PolarHBondContact O-N 3.44Å; L264-T266 VanDerWaalsContact C-N 3.34Å; L264-S267 PolarHBondContact O-N 3.48Å; L264-S267 PolarHBondContact O-OG 2.86Å; L264-S267 VanDerWaalsContact O-OG 3.11Å; L264-A268 VanDerWaalsContact O-CB 3.28Å; L264-A268 WeakPolarHBondContact O-CB 3.48Å; L264-A268 PolarHBondContact O-N 3.11Å
265	S	84.9	Confident	81.4	Confident	23 Å²	23	53.8 Å²	53.8	16%	0.161	35%	0.351	C	S	.	.	H	α-helix	trans	-64.4	-40	175.6	-170.5	0	0	0	0	111.8	L261 P262 A268 S269	L261-S265 WeakPolarHBondContact O-CB 3.41Å; L261-S265 PolarHBondContact O-N 3.09Å; P262-S265 PolarHBondContact O-N 3.13Å; S265-A268 PolarHBondContact O-N 3.14Å; S265-S269 PolarHBondContact O-N 3.14Å; S265-S269 PolarHBondContact O-OG 2.91Å
266	T	88.3	Confident	82.9	Confident	11 Å²	11	51 Å²	51	7%	0.067	32%	0.321	C	S	.	.	H	α-helix	trans	-72.6	-33.2	179.9	-49.5	0	0	0	0	112.2	L244 Q247 L248 P262 A263 L264 S269 L270	L244-T266 HydrophobicContact CD1-CG2 3.67Å; Q247-T266 HydrophobicContact CB-CG2 4.05Å; L248-T266 HydrophobicContact CD2-CG2 3.6Å; L248-T266 HydrophobicContact CG-CG2 3.68Å; P262-T266 WeakPolarHBondContact O-CB 3.18Å; P262-T266 PolarHBondContact O-N 3.13Å; P262-T266 PolarHBondContact O-OG1 3.1Å; A263-T266 PolarHBondContact O-N 3.34Å; L264-T266 VanDerWaalsContact C-N 3.34Å; T266-S269 PolarHBondContact O-OG 3.46Å; T266-S269 VanDerWaalsContact O-OG 3.14Å; T266-L270 WeakPolarHBondContact O-CB 3.43Å; T266-L270 PolarHBondContact O-N 2.68Å
267	S	89.3	Confident	84.1	Confident	55 Å²	55	48.2 Å²	48.2	39%	0.385	29%	0.293	S	S	.	.	H	α-helix	trans	-76.2	-33	172.8	64.9	0	0	0	0	112.4	A263 L264 V271	A263-S267 PolarHBondContact O-N 3.5Å; A263-S267 PolarHBondContact O-OG 3.46Å; L264-S267 PolarHBondContact O-N 3.48Å; L264-S267 PolarHBondContact O-OG 2.86Å; L264-S267 VanDerWaalsContact O-OG 3.11Å; S267-V271 VanDerWaalsContact O-CG2 3.29Å; S267-V271 WeakPolarHBondContact O-CG2 3.36Å; S267-V271 PolarHBondContact O-N 3.49Å
268	A	88	Confident	85.5	Confident	37 Å²	37	43.8 Å²	43.8	31%	0.306	26%	0.256	S	S	.	.	H	α-helix	trans	-64	-45.8	173.7	0	0	0	0	0	112.6	L264 S265 L270 V271 S272	L264-A268 VanDerWaalsContact O-CB 3.28Å; L264-A268 WeakPolarHBondContact O-CB 3.48Å; L264-A268 PolarHBondContact O-N 3.11Å; S265-A268 PolarHBondContact O-N 3.14Å; A268-L270 PolarHBondContact O-N 2.69Å; A268-V271 PolarHBondContact O-N 3.06Å; A268-S272 PolarHBondContact O-N 3.05Å
269	S	90.5	Very high	86.8	Confident	6 Å²	6	39.8 Å²	39.8	4%	0.042	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-37.7	177.9	62.6	0	0	0	0	112.4	Q247 S265 T266 S272 L273	Q247-S269 PolarHBondContact OE1-OG 2.85Å; S265-S269 PolarHBondContact O-N 3.14Å; S265-S269 PolarHBondContact O-OG 2.91Å; T266-S269 PolarHBondContact O-OG 3.46Å; T266-S269 VanDerWaalsContact O-OG 3.14Å; S269-S272 WeakPolarHBondContact O-CB 3.33Å; S269-S272 PolarHBondContact O-N 3.38Å; S269-L273 PolarHBondContact O-N 3.17Å
270	L	92.4	Very high	87.6	Confident	27 Å²	27	34.7 Å²	34.7	14%	0.141	20%	0.203	C	C	.	.	H	α-helix	trans	-61.7	-42.9	170.4	169.4	65.8	0	0	0	112.5	L244 T266 A268 L273 A274 L307 I310 A311	L244-L270 HydrophobicContact CD1-CB 4.09Å; L244-L270 HydrophobicContact CD2-CB 4.09Å; L244-L270 HydrophobicContact CD2-CD1 3.95Å; T266-L270 WeakPolarHBondContact O-CB 3.43Å; T266-L270 PolarHBondContact O-N 2.68Å; A268-L270 PolarHBondContact O-N 2.69Å; L270-L273 PolarHBondContact O-N 2.91Å; L270-A274 PolarHBondContact O-N 3.16Å; L270-A274 VanDerWaalsContact O-N 3.08Å; L270-L307 HydrophobicContact CD1-CD1 4.37Å; L270-L307 HydrophobicContact CD2-CD1 4.32Å; L270-L307 HydrophobicContact CG-CD1 3.79Å; L270-I310 HydrophobicContact CD1-CB 4.45Å; L270-I310 HydrophobicContact CD1-CG2 4.19Å; L270-A311 HydrophobicContact CD1-CB 4.06Å; L270-A311 HydrophobicContact CD2-CB 3.72Å
271	V	92.1	Very high	88	Confident	71 Å²	71	30.2 Å²	30.2	43%	0.43	18%	0.179	S	C	.	.	H	α-helix	trans	-65.5	-38.8	175.7	168.3	0	0	0	0	111.6	S267 A268 A274 W275 L307	S267-V271 VanDerWaalsContact O-CG2 3.29Å; S267-V271 WeakPolarHBondContact O-CG2 3.36Å; S267-V271 PolarHBondContact O-N 3.49Å; A268-V271 PolarHBondContact O-N 3.06Å; V271-A274 PolarHBondContact O-N 3.46Å; V271-W275 VanDerWaalsContact O-CB 3.27Å; V271-W275 WeakPolarHBondContact O-CB 3.46Å; V271-W275 PolarHBondContact O-N 3.08Å; V271-L307 HydrophobicContact CB-CD1 4.3Å; V271-L307 HydrophobicContact CG2-CD1 3.65Å
272	S	91.2	Very high	88.4	Confident	3 Å²	3	24.4 Å²	24.4	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-58.5	-50.9	172.1	175.3	0	0	0	0	111.8	V66 D70 A268 S269 A274 W275 T276	V66-S272 WeakPolarHBondContact CG1-OG 3.39Å; D70-S272 VanDerWaalsContact CG-OG 3.28Å; D70-S272 WeakPolarHBondContact OD1-CB 3.41Å; D70-S272 PolarHBondContact OD1-OG 3.4Å; D70-S272 WeakPolarHBondContact OD2-CB 3.46Å; D70-S272 PolarHBondContact OD2-OG 2.98Å; A268-S272 PolarHBondContact O-N 3.05Å; S269-S272 WeakPolarHBondContact O-CB 3.33Å; S269-S272 PolarHBondContact O-N 3.38Å; S272-A274 VanDerWaalsContact C-N 3.31Å; S272-A274 PolarHBondContact O-N 3.33Å; S272-W275 PolarHBondContact O-N 3.18Å; S272-W275 VanDerWaalsContact O-N 3.11Å; S272-T276 WeakPolarHBondContact O-CB 3.13Å; S272-T276 WeakPolarHBondContact O-CG2 3.45Å; S272-T276 PolarHBondContact O-N 2.96Å; S272-T276 PolarHBondContact O-OG1 3.48Å
273	L	91.9	Very high	88.6	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-57.5	-44.8	-179.4	-159.4	175.5	0	0	0	110.9	F237 A241 L244 S269 L270 T276 L277 I310	F237-L273 HydrophobicContact CE1-CD2 4.14Å; F237-L273 HydrophobicContact CZ-CD2 3.88Å; A241-L273 HydrophobicContact CB-CD1 3.81Å; L244-L273 HydrophobicContact CD2-CD1 4.21Å; S269-L273 PolarHBondContact O-N 3.17Å; L270-L273 PolarHBondContact O-N 2.91Å; L273-T276 PolarHBondContact O-OG1 3.04Å; L273-L277 WeakPolarHBondContact O-CB 3.41Å; L273-L277 PolarHBondContact O-N 3.48Å; L273-L277 VanDerWaalsContact O-N 3.16Å; L273-I310 HydrophobicContact CD1-CG2 4.11Å; L273-I310 HydrophobicContact CD2-CD1 3.63Å; L273-I310 HydrophobicContact CD2-CG2 4.26Å
274	A	92.9	Very high	88.5	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-65.1	-42.9	174.5	0	0	0	0	0	113.3	L270 V271 S272 T276 A278 V303 L307	L270-A274 PolarHBondContact O-N 3.16Å; L270-A274 VanDerWaalsContact O-N 3.08Å; V271-A274 PolarHBondContact O-N 3.46Å; S272-A274 VanDerWaalsContact C-N 3.31Å; S272-A274 PolarHBondContact O-N 3.33Å; A274-T276 VanDerWaalsContact C-N 3.34Å; A274-T276 PolarHBondContact O-N 3.46Å; A274-A278 WeakPolarHBondContact O-CB 3.35Å; A274-A278 PolarHBondContact O-N 3.33Å; A274-V303 HydrophobicContact CB-CG1 4.22Å; A274-L307 HydrophobicContact CB-CB 3.76Å; A274-L307 HydrophobicContact CB-CD1 3.84Å; A274-L307 HydrophobicContact CB-CG 4.47Å
275	W	92.1	Very high	88.3	Confident	44 Å²	44	18.8 Å²	18.8	17%	0.167	11%	0.111	C	C	.	.	H	α-helix	trans	-62.6	-39	177.9	178.8	-91.7	0	0	0	112.6	W59 C62 V271 S272 S279 V303	W59-W275 AromaticContact CD2-CH2 3.68Å; W59-W275 HydrophobicContact CD2-CH2 3.68Å; W59-W275 AromaticContact CD2-CZ2 3.63Å; W59-W275 HydrophobicContact CD2-CZ2 3.63Å; W59-W275 AromaticContact CE2-CH2 3.84Å; W59-W275 AromaticContact CE2-CZ2 3.56Å; W59-W275 AromaticContact CE3-CH2 3.54Å; W59-W275 HydrophobicContact CE3-CH2 3.54Å; W59-W275 HydrophobicContact CE3-CZ2 4.02Å; W59-W275 HydrophobicContact CE3-CZ3 4.33Å; W59-W275 HydrophobicContact CG-CH2 4.38Å; W59-W275 AromaticContact CG-CZ2 3.99Å; W59-W275 HydrophobicContact CG-CZ2 3.99Å; W59-W275 HydrophobicContact CH2-CE3 4.39Å; W59-W275 AromaticContact CH2-CH2 3.78Å; W59-W275 HydrophobicContact CH2-CH2 3.78Å; W59-W275 HydrophobicContact CH2-CZ2 4.27Å; W59-W275 AromaticContact CH2-CZ3 3.85Å; W59-W275 HydrophobicContact CH2-CZ3 3.85Å; W59-W275 AromaticContact CZ2-CH2 3.91Å; W59-W275 HydrophobicContact CZ2-CH2 3.91Å; W59-W275 AromaticContact CZ2-CZ2 3.91Å; W59-W275 HydrophobicContact CZ2-CZ2 3.91Å; W59-W275 HydrophobicContact CZ2-CZ3 4.22Å; W59-W275 AromaticContact CZ3-CH2 3.59Å; W59-W275 HydrophobicContact CZ3-CH2 3.59Å; W59-W275 HydrophobicContact CZ3-CZ2 4.32Å; W59-W275 AromaticContact CZ3-CZ3 3.92Å; W59-W275 HydrophobicContact CZ3-CZ3 3.92Å; W59-W275 AromaticContact NE1-CZ2 3.85Å; C62-W275 HydrophobicContact CB-CH2 4.05Å; C62-W275 HydrophobicContact CB-CZ2 3.6Å; V271-W275 VanDerWaalsContact O-CB 3.27Å; V271-W275 WeakPolarHBondContact O-CB 3.46Å; V271-W275 PolarHBondContact O-N 3.08Å; S272-W275 PolarHBondContact O-N 3.18Å; S272-W275 VanDerWaalsContact O-N 3.11Å; W275-S279 PolarHBondContact NE1-OG 3.38Å; W275-S279 WeakPolarHBondContact O-CB 3.39Å; W275-S279 PolarHBondContact O-N 2.97Å; W275-S279 PolarHBondContact O-OG 3.32Å; W275-V303 HydrophobicContact CE3-CG2 4.21Å
276	T	91.6	Very high	88.1	Confident	5 Å²	5	19 Å²	19	3%	0.031	11%	0.11	C	C	.	.	H	α-helix	trans	-75.6	-41.5	-176.2	57	0	0	0	0	111.8	R232 T236 S272 L273 A274 S279 Y280	R232-T276 VanDerWaalsContact CD-CG2 3.49Å; R232-T276 HydrophobicContact CG-CG2 3.54Å; T236-T276 HydrophobicContact CG2-CG2 4.2Å; S272-T276 WeakPolarHBondContact O-CB 3.13Å; S272-T276 WeakPolarHBondContact O-CG2 3.45Å; S272-T276 PolarHBondContact O-N 2.96Å; S272-T276 PolarHBondContact O-OG1 3.48Å; L273-T276 PolarHBondContact O-OG1 3.04Å; A274-T276 VanDerWaalsContact C-N 3.34Å; A274-T276 PolarHBondContact O-N 3.46Å; T276-S279 PolarHBondContact O-N 3.39Å; T276-Y280 PolarHBondContact O-N 3.34Å
277	L	89.6	Confident	87.5	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.1	-45.7	172	179.1	60.3	0	0	0	111.8	L233 F237 L273 Y280 Q281 H306 I310 C371 F373	L233-L277 HydrophobicContact CD1-CD1 3.84Å; F237-L277 HydrophobicContact CE2-CD1 4.49Å; F237-L277 HydrophobicContact CZ-CD2 4.44Å; L273-L277 WeakPolarHBondContact O-CB 3.41Å; L273-L277 PolarHBondContact O-N 3.48Å; L273-L277 VanDerWaalsContact O-N 3.16Å; L277-Y280 PolarHBondContact O-N 2.68Å; L277-Q281 WeakPolarHBondContact O-CG 3.29Å; L277-Q281 PolarHBondContact O-N 3.42Å; L277-H306 HydrophobicContact CD2-CB 3.97Å; L277-I310 HydrophobicContact CD2-CD1 3.94Å; L277-C371 HydrophobicContact CD2-CB 4.24Å; L277-C371 VanDerWaalsContact CD2-SG 3.6Å; L277-F373 HydrophobicContact CD1-CD2 4.07Å
278	A	88.8	Confident	86.7	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-67.3	-35.9	175.5	0	0	0	0	0	112.5	A274 Q281 K282 Q302 V303	A274-A278 WeakPolarHBondContact O-CB 3.35Å; A274-A278 PolarHBondContact O-N 3.33Å; A278-Q281 PolarHBondContact O-N 3.47Å; A278-K282 WeakPolarHBondContact O-CB 3.45Å; A278-K282 PolarHBondContact O-N 3.14Å; A278-Q302 HydrophobicContact CB-CB 4.07Å; A278-V303 HydrophobicContact CB-CB 4.32Å; A278-V303 HydrophobicContact CB-CG2 3.42Å; A278-V303 VanDerWaalsContact CB-CG2 3.42Å
279	S	87.8	Confident	85.7	Confident	13 Å²	13	19.9 Å²	19.9	9%	0.091	10%	0.104	C	C	.	.	H	α-helix	trans	-62.3	-45.8	173.3	-69.6	0	0	0	0	111.6	W59 W275 T276 K282 V283	W59-S279 PolarHBondContact NE1-OG 3.38Å; W275-S279 PolarHBondContact NE1-OG 3.38Å; W275-S279 WeakPolarHBondContact O-CB 3.39Å; W275-S279 PolarHBondContact O-N 2.97Å; W275-S279 PolarHBondContact O-OG 3.32Å; T276-S279 PolarHBondContact O-N 3.39Å; S279-K282 PolarHBondContact O-N 3.17Å; S279-V283 WeakPolarHBondContact O-CG2 3.4Å; S279-V283 PolarHBondContact O-N 2.96Å
280	Y	87.4	Confident	84.3	Confident	4 Å²	4	24 Å²	24	2%	0.016	13%	0.125	C	C	.	.	H	α-helix	trans	-58.5	-48.2	173.2	177.7	-87	0	0	0	111.2	M230 L233 T276 L277 K282 V283 L284 F373 W535	M230-Y280 HydrophobicContact CB-CE2 4.15Å; M230-Y280 HydrophobicContact CG-CE2 4.41Å; L233-Y280 HydrophobicContact CB-CD2 4.34Å; L233-Y280 HydrophobicContact CD1-CG 4.34Å; L233-Y280 HydrophobicContact CD2-CD1 4.22Å; L233-Y280 HydrophobicContact CD2-CD2 3.99Å; L233-Y280 HydrophobicContact CD2-CE1 4.31Å; L233-Y280 HydrophobicContact CD2-CE2 4.05Å; L233-Y280 HydrophobicContact CD2-CG 4.07Å; T276-Y280 PolarHBondContact O-N 3.34Å; L277-Y280 PolarHBondContact O-N 2.68Å; Y280-K282 VanDerWaalsContact C-N 3.29Å; Y280-K282 PolarHBondContact O-N 3.01Å; Y280-V283 PolarHBondContact O-N 2.72Å; Y280-L284 HydrophobicContact CD1-CD2 4.44Å; Y280-L284 HydrophobicContact CE1-CB 4.43Å; Y280-L284 HydrophobicContact CE1-CD2 3.61Å; Y280-L284 VanDerWaalsContact O-CB 3.22Å; Y280-L284 WeakPolarHBondContact O-CB 3.39Å; Y280-L284 PolarHBondContact O-N 3.41Å; Y280-F373 AromaticContact CD1-CE2 3.72Å; Y280-F373 HydrophobicContact CD1-CE2 3.72Å; Y280-F373 HydrophobicContact CD1-CZ 4.21Å; Y280-F373 AromaticContact CE1-CE2 3.43Å; Y280-F373 HydrophobicContact CE1-CE2 3.43Å; Y280-F373 VanDerWaalsContact CE1-CE2 3.43Å; Y280-F373 AromaticContact CE1-CZ 3.44Å; Y280-F373 HydrophobicContact CE1-CZ 3.44Å; Y280-F373 VanDerWaalsContact CE1-CZ 3.44Å; Y280-F373 AromaticContact CZ-CZ 3.84Å; Y280-W535 HydrophobicContact CE2-CZ2 4.32Å; Y280-W535 AromaticContact CE2-NE1 3.91Å; Y280-W535 AromaticContact CZ-NE1 3.83Å; Y280-W535 PolarHBondContact OH-NE1 3.41Å; Y280-W535 VanDerWaalsContact OH-NE1 3.16Å
281	Q	85.4	Confident	83.1	Confident	30 Å²	30	25.5 Å²	25.5	14%	0.14	13%	0.13	C	C	.	.	H	α-helix	trans	-62.3	-34.2	178.1	-71	178	18.4	0	0	112.5	L277 A278 R285 H306	L277-Q281 WeakPolarHBondContact O-CG 3.29Å; L277-Q281 PolarHBondContact O-N 3.42Å; A278-Q281 PolarHBondContact O-N 3.47Å; Q281-R285 WeakPolarHBondContact O-CB 3.35Å; Q281-R285 PolarHBondContact O-N 3.49Å; Q281-H306 PolarHBondContact NE2-NE2 2.93Å; Q281-H306 VanDerWaalsContact NE2-NE2 3.17Å; Q281-H306 PolarHBondContact OE1-NE2 3.25Å
282	K	86.6	Confident	82	Confident	12 Å²	12	31.6 Å²	31.6	5%	0.052	15%	0.146	C	C	.	.	H	α-helix	trans	-66.3	-55.6	172.3	175.8	161.5	170	52.6	0	112	A278 S279 Y280 L284 R285 D286 L294 A299	A278-K282 WeakPolarHBondContact O-CB 3.45Å; A278-K282 PolarHBondContact O-N 3.14Å; S279-K282 PolarHBondContact O-N 3.17Å; Y280-K282 VanDerWaalsContact C-N 3.29Å; Y280-K282 PolarHBondContact O-N 3.01Å; K282-L284 VanDerWaalsContact C-N 3.26Å; K282-L284 PolarHBondContact O-N 3.36Å; K282-R285 CarbonylContact O-C 3.6Å; K282-R285 WeakPolarHBondContact O-CA 3.29Å; K282-R285 PolarHBondContact O-N 2.97Å; K282-D286 WeakPolarHBondContact CE-OD2 3.06Å; K282-D286 VanDerWaalsContact CG-OD2 3.27Å; K282-D286 WeakPolarHBondContact CG-OD2 3.33Å; K282-D286 IonicContact NZ-OD1 3.65Å; K282-D286 IonicContact NZ-OD2 2.74Å; K282-D286 PolarHBondContact NZ-OD2 3.3Å; K282-D286 WeakPolarHBondContact O-CB 3.35Å; K282-D286 VanDerWaalsContact O-CG 3.23Å; K282-D286 PolarHBondContact O-N 2.94Å; K282-L294 HydrophobicContact CB-CD2 3.99Å; K282-L294 HydrophobicContact CG-CB 4.4Å; K282-L294 HydrophobicContact CG-CD2 4.37Å; K282-L294 PolarHBondContact NZ-O 2.99Å; K282-A299 HydrophobicContact CD-CB 4.06Å
283	V	84.9	Confident	81.3	Confident	21 Å²	21	35.6 Å²	35.6	13%	0.127	17%	0.172	C	C	.	.	H	α-helix	trans	-60.6	-39.5	-177.8	-173.5	0	0	0	0	110.8	L222 S225 S279 Y280 R285 D286 S287 W535	L222-V283 HydrophobicContact CD1-CG1 3.89Å; S225-V283 VanDerWaalsContact OG-CG1 3.31Å; S225-V283 WeakPolarHBondContact OG-CG1 3.34Å; S279-V283 WeakPolarHBondContact O-CG2 3.4Å; S279-V283 PolarHBondContact O-N 2.96Å; Y280-V283 PolarHBondContact O-N 2.72Å; V283-R285 VanDerWaalsContact C-N 3.28Å; V283-R285 PolarHBondContact O-N 3.22Å; V283-D286 PolarHBondContact O-N 3.45Å; V283-S287 WeakPolarHBondContact O-CB 3.2Å; V283-S287 PolarHBondContact O-N 3.11Å; V283-W535 HydrophobicContact CG1-CH2 3.92Å
284	L	80.1	Confident	80.5	Confident	13 Å²	13	35.8 Å²	35.8	7%	0.068	17%	0.173	C	C	.	.	H	α-helix	trans	-67.2	-25.6	174.5	179.1	55.2	0	0	0	114.2	Y280 K282 S287 R288 P533 A534 W535	Y280-L284 HydrophobicContact CD1-CD2 4.44Å; Y280-L284 HydrophobicContact CE1-CB 4.43Å; Y280-L284 HydrophobicContact CE1-CD2 3.61Å; Y280-L284 VanDerWaalsContact O-CB 3.22Å; Y280-L284 WeakPolarHBondContact O-CB 3.39Å; Y280-L284 PolarHBondContact O-N 3.41Å; K282-L284 VanDerWaalsContact C-N 3.26Å; K282-L284 PolarHBondContact O-N 3.36Å; L284-S287 PolarHBondContact O-OG 2.9Å; L284-S287 VanDerWaalsContact O-OG 3.06Å; L284-R288 PolarHBondContact O-NE 3.15Å; L284-P533 VanDerWaalsContact CD1-O 3.28Å; L284-P533 WeakPolarHBondContact CD1-O 3.21Å; L284-P533 WeakPolarHBondContact CD2-O 3.23Å; L284-P533 WeakPolarHBondContact CG-O 3.25Å; L284-A534 VanDerWaalsContact CD1-C 3.47Å; L284-A534 WeakPolarHBondContact CD1-O 3.28Å; L284-A534 VanDerWaalsContact CD2-O 3.27Å; L284-A534 WeakPolarHBondContact CD2-O 3.4Å; L284-W535 HydrophobicContact CB-CH2 4.49Å; L284-W535 HydrophobicContact CB-CZ2 4.31Å; L284-W535 HydrophobicContact CD1-CB 4.4Å; L284-W535 HydrophobicContact CD1-CD2 3.62Å; L284-W535 HydrophobicContact CD1-CE3 3.87Å; L284-W535 HydrophobicContact CD1-CG 3.92Å; L284-W535 HydrophobicContact CD1-CZ2 4.3Å; L284-W535 HydrophobicContact CD1-CZ3 4.35Å
285	R	78.9	Confident	80.1	Confident	18 Å²	18	38.9 Å²	38.9	7%	0.068	20%	0.195	C	C	.	.	H	α-helix	trans	-86.1	-24.7	177	-170.2	61.4	-169.9	65.7	7.6	112.2	Q281 K282 V283 K291 R292 L294 P441 N442	Q281-R285 WeakPolarHBondContact O-CB 3.35Å; Q281-R285 PolarHBondContact O-N 3.49Å; K282-R285 CarbonylContact O-C 3.6Å; K282-R285 WeakPolarHBondContact O-CA 3.29Å; K282-R285 PolarHBondContact O-N 2.97Å; V283-R285 VanDerWaalsContact C-N 3.28Å; V283-R285 PolarHBondContact O-N 3.22Å; R285-K291 VanDerWaalsContact NH1-CB 3.26Å; R285-K291 PolarHBondContact NH1-O 2.96Å; R285-R292 PolarHBondContact NH1-O 3.16Å; R285-R292 PolarHBondContact NH2-O 2.94Å; R285-L294 HydrophobicContact CB-CB 4.16Å; R285-L294 HydrophobicContact CG-CB 3.94Å; R285-P441 VanDerWaalsContact NH2-CG 3.33Å; R285-N442 PolarHBondContact NH2-OD1 2.94Å
286	D	79.7	Confident	79.8	Confident	27 Å²	27	39.5 Å²	39.5	14%	0.144	20%	0.197	C	C	.	.	H	α-helix	trans	-86.5	-17.6	175.1	-63.3	-19.9	0	0	0	112.9	K282 V283 R288 P293 L294	K282-D286 WeakPolarHBondContact CE-OD2 3.06Å; K282-D286 VanDerWaalsContact CG-OD2 3.27Å; K282-D286 WeakPolarHBondContact CG-OD2 3.33Å; K282-D286 IonicContact NZ-OD1 3.65Å; K282-D286 IonicContact NZ-OD2 2.74Å; K282-D286 PolarHBondContact NZ-OD2 3.3Å; K282-D286 WeakPolarHBondContact O-CB 3.35Å; K282-D286 VanDerWaalsContact O-CG 3.23Å; K282-D286 PolarHBondContact O-N 2.94Å; V283-D286 PolarHBondContact O-N 3.45Å; D286-R288 VanDerWaalsContact C-N 3.29Å; D286-R288 PolarHBondContact O-N 3.39Å; D286-P293 HydrophobicContact CB-CB 4.48Å; D286-P293 WeakPolarHBondContact OD1-CA 3.24Å; D286-P293 WeakPolarHBondContact OD1-CB 3.4Å; D286-L294 PolarHBondContact OD1-N 3.46Å
287	S	76.6	Confident	79.6	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.007	23%	0.229	C	C	.	.	S	Bend	trans	-77.9	-1.8	-179.3	68.7	0	0	0	0	116.1	V283 L284 W535 F539	V283-S287 WeakPolarHBondContact O-CB 3.2Å; V283-S287 PolarHBondContact O-N 3.11Å; L284-S287 PolarHBondContact O-OG 2.9Å; L284-S287 VanDerWaalsContact O-OG 3.06Å; S287-W535 VanDerWaalsContact OG-CZ3 3.28Å; S287-W535 WeakPolarHBondContact OG-CZ3 3.44Å; S287-F539 WeakPolarHBondContact O-CE2 3.37Å
288	R	72.1	Confident	79.4	Confident	17 Å²	17	46.9 Å²	46.9	6%	0.064	23%	0.229	C	C	.	.			trans	-119.4	107.3	-169.8	-66.6	-165.1	-85.5	148	-7.6	112.2	L284 D286 D290 K291 E377 P533	L284-R288 PolarHBondContact O-NE 3.15Å; D286-R288 VanDerWaalsContact C-N 3.29Å; D286-R288 PolarHBondContact O-N 3.39Å; R288-D290 PolarHBondContact O-N 3.42Å; R288-D290 VanDerWaalsContact O-N 3.12Å; R288-K291 PolarHBondContact O-N 3.42Å; R288-E377 IonicContact CZ-OE1 3.07Å; R288-E377 IonicContact CZ-OE2 2.73Å; R288-E377 IonicContact NH1-OE1 2.99Å; R288-E377 PolarHBondContact NH1-OE1 3.45Å; R288-E377 IonicContact NH1-OE2 2.67Å; R288-E377 PolarHBondContact NH1-OE2 3.37Å; R288-E377 IonicContact NH2-OE1 3.97Å; R288-E377 PolarHBondContact NH2-OE1 2.74Å; R288-E377 IonicContact NH2-OE2 2.96Å; R288-P533 PolarHBondContact NH2-O 3.33Å; R288-P533 VanDerWaalsContact NH2-O 3.14Å
289	D	66.1	Low	79.4	Confident	104 Å²	104	46.9 Å²	46.9	56%	0.556	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-30.7	-177.2	-75.8	-67.8	0	0	0	114.3	W219 K291	W219-D289 WeakPolarHBondContact CH2-OD2 3.37Å; D289-K291 PolarHBondContact O-N 3.12Å
290	D	62.3	Low	79.5	Confident	92 Å²	92	49.8 Å²	49.8	49%	0.492	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-14.9	-176.5	-48.3	-82.5	0	0	0	114.4	R288 R529	R288-D290 PolarHBondContact O-N 3.42Å; R288-D290 VanDerWaalsContact O-N 3.12Å; D290-R529 VanDerWaalsContact CG-NH2 3.34Å; D290-R529 IonicContact OD1-CZ 2.7Å; D290-R529 VanDerWaalsContact OD1-CZ 3.22Å; D290-R529 IonicContact OD1-NH1 3.7Å; D290-R529 PolarHBondContact OD1-NH1 3.34Å; D290-R529 IonicContact OD1-NH2 3.04Å; D290-R529 PolarHBondContact OD1-NH2 2.82Å; D290-R529 IonicContact OD2-CZ 3.2Å; D290-R529 IonicContact OD2-NH1 2.8Å; D290-R529 PolarHBondContact OD2-NH1 3.41Å; D290-R529 IonicContact OD2-NH2 2.75Å; D290-R529 PolarHBondContact OD2-NH2 2.81Å
291	K	66.2	Low	79.7	Confident	58 Å²	58	49.8 Å²	49.8	25%	0.252	25%	0.247	S	C	.	.	S	Bend	trans	-135	133.4	-167.8	-53.5	-171.9	-169.8	-177.7	0	111.3	R285 R288 D289 E377	R285-K291 VanDerWaalsContact NH1-CB 3.26Å; R285-K291 PolarHBondContact NH1-O 2.96Å; R288-K291 PolarHBondContact O-N 3.42Å; D289-K291 PolarHBondContact O-N 3.12Å; K291-E377 IonicContact NZ-OE1 3.21Å; K291-E377 PolarHBondContact NZ-OE1 3.03Å; K291-E377 IonicContact NZ-OE2 3.68Å; K291-E377 PolarHBondContact NZ-OE2 2.73Å
292	R	69.1	Low	79.9	Confident	199 Å²	199	48.9 Å²	48.9	75%	0.751	24%	0.243	S	C	*	.			trans	-50.1	135.3	177.3	-62.8	179.9	179.9	-175.4	-0.3	111.6	R285	R285-R292 PolarHBondContact NH1-O 3.16Å; R285-R292 PolarHBondContact NH2-O 2.94Å
293	P	76.1	Confident	80.2	Confident	88 Å²	88	49.2 Å²	49.2	57%	0.571	25%	0.246	S	C	*	.			trans	-63.3	162.9	-177	26	-35.3	0	0	0	112.6	D286 S295	D286-P293 HydrophobicContact CB-CB 4.48Å; D286-P293 WeakPolarHBondContact OD1-CA 3.24Å; D286-P293 WeakPolarHBondContact OD1-CB 3.4Å; P293-S295 PolarHBondContact O-N 3.43Å
294	L	76.2	Confident	80.6	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	25%	0.254	C	S	.	.			trans	-79.1	113.8	-176.5	-171.8	66.4	0	0	0	111.7	K282 R285 D286 A299 Y435 P441	K282-L294 HydrophobicContact CB-CD2 3.99Å; K282-L294 HydrophobicContact CG-CB 4.4Å; K282-L294 HydrophobicContact CG-CD2 4.37Å; K282-L294 PolarHBondContact NZ-O 2.99Å; R285-L294 HydrophobicContact CB-CB 4.16Å; R285-L294 HydrophobicContact CG-CB 3.94Å; D286-L294 PolarHBondContact OD1-N 3.46Å; L294-A299 HydrophobicContact CD2-CB 4.02Å; L294-A299 HydrophobicContact CG-CB 4.48Å; L294-Y435 HydrophobicContact CD1-CE2 4.12Å; L294-P441 HydrophobicContact CD1-CG 4Å
295	S	84.4	Confident	81.2	Confident	67 Å²	67	50.5 Å²	50.5	47%	0.469	25%	0.251	S	S	.	.			trans	-56.9	137.9	170.5	176.5	0	0	0	0	111.6	P293 K297 G298 A299	P293-S295 PolarHBondContact O-N 3.43Å; S295-K297 PolarHBondContact O-N 3.34Å; S295-K297 VanDerWaalsContact O-N 3.11Å; S295-G298 WeakPolarHBondContact O-CA 3.33Å; S295-G298 PolarHBondContact O-N 3.37Å; S295-A299 PolarHBondContact O-N 2.95Å
296	Y	85.7	Confident	81.9	Confident	57 Å²	57	49.7 Å²	49.7	22%	0.224	25%	0.249	C	C	.	.	H	α-helix	trans	-52.4	-33.8	177	-65.9	-82.3	0	0	0	113.4	R55 D56 W59 G298 A299 V300	R55-Y296 VanDerWaalsContact C-OH 3.26Å; R55-Y296 HydrophobicContact CB-CE1 3.99Å; R55-Y296 HydrophobicContact CB-CE2 3.79Å; R55-Y296 VanDerWaalsContact CB-CZ 3.43Å; R55-Y296 VanDerWaalsContact CB-OH 3.27Å; R55-Y296 WeakPolarHBondContact CB-OH 3.34Å; R55-Y296 HydrophobicContact CG-CE2 4.49Å; D56-Y296 WeakPolarHBondContact CA-OH 3.44Å; D56-Y296 PolarHBondContact N-OH 3.45Å; D56-Y296 PolarHBondContact OD1-OH 3.31Å; D56-Y296 PolarHBondContact OD2-OH 3.03Å; W59-Y296 AromaticContact CE3-CD1 3.99Å; W59-Y296 HydrophobicContact CE3-CD1 3.99Å; W59-Y296 HydrophobicContact CE3-CE1 4.22Å; W59-Y296 HydrophobicContact CZ3-CD1 4.39Å; Y296-G298 VanDerWaalsContact C-N 3.35Å; Y296-G298 PolarHBondContact O-N 3.01Å; Y296-A299 PolarHBondContact O-N 2.91Å; Y296-V300 WeakPolarHBondContact O-CG2 3.36Å; Y296-V300 PolarHBondContact O-N 3.38Å
297	K	87.4	Confident	82.6	Confident	158 Å²	158	49.6 Å²	49.6	69%	0.687	25%	0.248	S	C	*	.	H	α-helix	trans	-62	-42	174.5	-65.5	-172.1	177.9	-174.6	0	111.9	S295 A301 L439	S295-K297 PolarHBondContact O-N 3.34Å; S295-K297 VanDerWaalsContact O-N 3.11Å; K297-A301 PolarHBondContact O-N 3.38Å; K297-A301 VanDerWaalsContact O-N 3.11Å; K297-L439 HydrophobicContact CB-CD2 3.99Å
298	G	86.1	Confident	83.5	Confident	1 Å²	1	52 Å²	52	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-68.1	-37.6	174.7	0	0	0	0	0	112.6	S295 Y296 A301 Q302	S295-G298 WeakPolarHBondContact O-CA 3.33Å; S295-G298 PolarHBondContact O-N 3.37Å; Y296-G298 VanDerWaalsContact C-N 3.35Å; Y296-G298 PolarHBondContact O-N 3.01Å; G298-A301 PolarHBondContact O-N 3.3Å; G298-Q302 PolarHBondContact O-N 3.41Å
299	A	88.1	Confident	84.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-42.4	174.8	0	0	0	0	0	112.3	W59 K282 L294 S295 Y296 A301 Q302 V303	W59-A299 HydrophobicContact CH2-CB 3.7Å; W59-A299 HydrophobicContact CZ2-CB 4.43Å; W59-A299 HydrophobicContact CZ3-CB 4.08Å; K282-A299 HydrophobicContact CD-CB 4.06Å; L294-A299 HydrophobicContact CD2-CB 4.02Å; L294-A299 HydrophobicContact CG-CB 4.48Å; S295-A299 PolarHBondContact O-N 2.95Å; Y296-A299 PolarHBondContact O-N 2.91Å; A299-A301 VanDerWaalsContact C-N 3.35Å; A299-A301 PolarHBondContact O-N 3.44Å; A299-Q302 WeakPolarHBondContact O-CB 3.49Å; A299-Q302 PolarHBondContact O-N 2.89Å; A299-V303 WeakPolarHBondContact O-CG2 3.47Å; A299-V303 PolarHBondContact O-N 2.85Å
300	V	90.6	Very high	86	Confident	74 Å²	74	46.8 Å²	46.8	45%	0.448	23%	0.232	S	C	.	.	H	α-helix	trans	-63.5	-39.5	173.3	174.9	0	0	0	0	111.6	Y296 Q302 V303 L304	Y296-V300 WeakPolarHBondContact O-CG2 3.36Å; Y296-V300 PolarHBondContact O-N 3.38Å; V300-Q302 VanDerWaalsContact C-N 3.32Å; V300-Q302 PolarHBondContact O-N 3.13Å; V300-V303 PolarHBondContact O-N 2.99Å; V300-L304 HydrophobicContact CG1-CD1 4.2Å; V300-L304 HydrophobicContact CG1-CG 4.5Å; V300-L304 WeakPolarHBondContact O-CG 3.45Å; V300-L304 PolarHBondContact O-N 3.42Å
301	A	90.8	Very high	87.5	Confident	5 Å²	5	43.2 Å²	43.2	4%	0.041	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-34.6	174.3	0	0	0	0	0	112.9	K297 G298 A299 W305 Y435 L439	K297-A301 PolarHBondContact O-N 3.38Å; K297-A301 VanDerWaalsContact O-N 3.11Å; G298-A301 PolarHBondContact O-N 3.3Å; A299-A301 VanDerWaalsContact C-N 3.35Å; A299-A301 PolarHBondContact O-N 3.44Å; A301-W305 VanDerWaalsContact O-CB 3.29Å; A301-W305 WeakPolarHBondContact O-CB 3.32Å; A301-W305 PolarHBondContact O-N 2.88Å; A301-Y435 HydrophobicContact CB-CD2 4.36Å; A301-L439 HydrophobicContact CB-CD1 3.5Å
302	Q	89.7	Confident	89	Confident	11 Å²	11	40.5 Å²	40.5	5%	0.051	20%	0.203	C	C	.	.	H	α-helix	trans	-65.3	-43.1	170.1	-74.6	-177.7	-33.2	0	0	112.2	A278 G298 A299 V300 L304 W305 H306 Y435	A278-Q302 HydrophobicContact CB-CB 4.07Å; G298-Q302 PolarHBondContact O-N 3.41Å; A299-Q302 WeakPolarHBondContact O-CB 3.49Å; A299-Q302 PolarHBondContact O-N 2.89Å; V300-Q302 VanDerWaalsContact C-N 3.32Å; V300-Q302 PolarHBondContact O-N 3.13Å; Q302-L304 PolarHBondContact O-N 3.43Å; Q302-W305 PolarHBondContact O-N 3.38Å; Q302-H306 WeakPolarHBondContact O-CB 3.24Å; Q302-H306 PolarHBondContact O-CD2 3.3Å; Q302-H306 PolarHBondContact O-N 3.05Å; Q302-Y435 HydrophobicContact CG-CD2 3.86Å; Q302-Y435 HydrophobicContact CG-CE2 3.71Å; Q302-Y435 HydrophobicContact CG-CG 4.36Å; Q302-Y435 PolarHBondContact NE2-OH 3.31Å
303	V	92.5	Very high	90.3	Very high	19 Å²	19	31 Å²	31	12%	0.115	17%	0.168	C	C	.	.	H	α-helix	trans	-56.4	-52	174.2	175.6	0	0	0	0	109.9	A274 W275 A278 A299 V300 H306 L307	A274-V303 HydrophobicContact CB-CG1 4.22Å; W275-V303 HydrophobicContact CE3-CG2 4.21Å; A278-V303 HydrophobicContact CB-CB 4.32Å; A278-V303 HydrophobicContact CB-CG2 3.42Å; A278-V303 VanDerWaalsContact CB-CG2 3.42Å; A299-V303 WeakPolarHBondContact O-CG2 3.47Å; A299-V303 PolarHBondContact O-N 2.85Å; V300-V303 PolarHBondContact O-N 2.99Å; V303-H306 PolarHBondContact O-N 3.27Å; V303-L307 WeakPolarHBondContact O-CB 3.4Å; V303-L307 PolarHBondContact O-N 2.9Å
304	L	93.9	Very high	91.2	Very high	56 Å²	56	26.9 Å²	26.9	29%	0.293	14%	0.141	S	C	.	.	H	α-helix	trans	-63.8	-44.4	-177.8	-67.8	172.6	0	0	0	112.7	V300 Q302 F308 F431	V300-L304 HydrophobicContact CG1-CD1 4.2Å; V300-L304 HydrophobicContact CG1-CG 4.5Å; V300-L304 WeakPolarHBondContact O-CG 3.45Å; V300-L304 PolarHBondContact O-N 3.42Å; Q302-L304 PolarHBondContact O-N 3.43Å; L304-F308 HydrophobicContact CD2-CE2 4.28Å; L304-F308 WeakPolarHBondContact O-CD2 3.5Å; L304-F308 PolarHBondContact O-N 2.97Å; L304-F308 VanDerWaalsContact O-N 3.15Å; L304-F431 HydrophobicContact CB-CB 4.41Å; L304-F431 HydrophobicContact CB-CD1 4.06Å; L304-F431 HydrophobicContact CB-CD2 3.95Å; L304-F431 HydrophobicContact CB-CE1 4.31Å; L304-F431 HydrophobicContact CB-CE2 4.2Å; L304-F431 HydrophobicContact CB-CG 3.88Å; L304-F431 HydrophobicContact CB-CZ 4.39Å; L304-F431 HydrophobicContact CD1-CD1 4.16Å; L304-F431 HydrophobicContact CD1-CE1 3.74Å; L304-F431 HydrophobicContact CD1-CZ 3.95Å
305	W	93.2	Very high	92	Very high	4 Å²	4	27.5 Å²	27.5	2%	0.015	14%	0.144	C	C	.	.	H	α-helix	trans	-56	-57.1	174.5	164	22.1	0	0	0	111.1	A301 Q302 L307 F308 T309 M384 F431 M432 Y435 Y436	A301-W305 VanDerWaalsContact O-CB 3.29Å; A301-W305 WeakPolarHBondContact O-CB 3.32Å; A301-W305 PolarHBondContact O-N 2.88Å; Q302-W305 PolarHBondContact O-N 3.38Å; W305-L307 VanDerWaalsContact C-N 3.35Å; W305-L307 PolarHBondContact O-N 3.08Å; W305-F308 PolarHBondContact O-N 3.22Å; W305-T309 PolarHBondContact O-N 3Å; W305-T309 PolarHBondContact O-OG1 3.21Å; W305-T309 VanDerWaalsContact O-OG1 3.14Å; W305-M384 HydrophobicContact CH2-CE 3.33Å; W305-M384 HydrophobicContact CZ2-CE 3.24Å; W305-F431 HydrophobicContact CB-CB 3.83Å; W305-M432 HydrophobicContact CD2-CB 3.68Å; W305-M432 HydrophobicContact CD2-CG 3.87Å; W305-M432 HydrophobicContact CE3-CB 4.27Å; W305-M432 HydrophobicContact CE3-CG 4.18Å; W305-M432 HydrophobicContact CG-CB 3.79Å; W305-M432 HydrophobicContact CG-CG 4.49Å; W305-M432 HydrophobicContact CH2-CG 4.1Å; W305-M432 HydrophobicContact CZ2-CB 4.39Å; W305-M432 HydrophobicContact CZ2-CG 3.76Å; W305-M432 HydrophobicContact CZ2-SD 4.01Å; W305-M432 HydrophobicContact CZ3-CG 4.27Å; W305-Y435 HydrophobicContact CE3-CD1 4.35Å; W305-Y435 HydrophobicContact CZ3-CD1 4.09Å; W305-Y436 AromaticContact CH2-CE2 3.91Å; W305-Y436 HydrophobicContact CH2-CE2 3.91Å; W305-Y436 AromaticContact CZ3-CE2 3.89Å; W305-Y436 HydrophobicContact CZ3-CE2 3.89Å
306	H	92.9	Very high	92.6	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.009	12%	0.122	C	C	.	.	H	α-helix	trans	-63.5	-40.3	-177.1	-69.4	-50	0	0	0	112.1	L277 Q281 Q302 V303 F308 T309 I310	L277-H306 HydrophobicContact CD2-CB 3.97Å; Q281-H306 PolarHBondContact NE2-NE2 2.93Å; Q281-H306 VanDerWaalsContact NE2-NE2 3.17Å; Q281-H306 PolarHBondContact OE1-NE2 3.25Å; Q302-H306 WeakPolarHBondContact O-CB 3.24Å; Q302-H306 PolarHBondContact O-CD2 3.3Å; Q302-H306 PolarHBondContact O-N 3.05Å; V303-H306 PolarHBondContact O-N 3.27Å; H306-F308 VanDerWaalsContact C-N 3.35Å; H306-F308 PolarHBondContact O-N 3.36Å; H306-T309 WeakPolarHBondContact CA-OG1 3.34Å; H306-T309 PolarHBondContact O-N 3.37Å; H306-T309 PolarHBondContact O-OG1 3.36Å; H306-I310 HydrophobicContact CB-CD1 4.22Å; H306-I310 WeakPolarHBondContact O-CB 3.5Å; H306-I310 WeakPolarHBondContact O-CG1 3.38Å; H306-I310 PolarHBondContact O-N 2.97Å
307	L	94.9	Very high	93	Very high	24 Å²	24	21.6 Å²	21.6	13%	0.126	11%	0.111	C	C	.	.	H	α-helix	trans	-50.2	-54.1	174.3	-175.4	81.5	0	0	0	111	L270 V271 A274 V303 W305 A311	L270-L307 HydrophobicContact CD1-CD1 4.37Å; L270-L307 HydrophobicContact CD2-CD1 4.32Å; L270-L307 HydrophobicContact CG-CD1 3.79Å; V271-L307 HydrophobicContact CB-CD1 4.3Å; V271-L307 HydrophobicContact CG2-CD1 3.65Å; A274-L307 HydrophobicContact CB-CB 3.76Å; A274-L307 HydrophobicContact CB-CD1 3.84Å; A274-L307 HydrophobicContact CB-CG 4.47Å; V303-L307 WeakPolarHBondContact O-CB 3.4Å; V303-L307 PolarHBondContact O-N 2.9Å; W305-L307 VanDerWaalsContact C-N 3.35Å; W305-L307 PolarHBondContact O-N 3.08Å; L307-A311 WeakPolarHBondContact O-CB 3.19Å; L307-A311 PolarHBondContact O-N 2.84Å
308	F	95.8	Very high	93.3	Very high	53 Å²	53	14.1 Å²	14.1	23%	0.232	8%	0.079	C	C	.	.	H	α-helix	trans	-75.6	-35.4	-174.3	-72.3	-59	0	0	0	113.4	L304 W305 H306 A312 S424 L427 F431	L304-F308 HydrophobicContact CD2-CE2 4.28Å; L304-F308 WeakPolarHBondContact O-CD2 3.5Å; L304-F308 PolarHBondContact O-N 2.97Å; L304-F308 VanDerWaalsContact O-N 3.15Å; W305-F308 PolarHBondContact O-N 3.22Å; H306-F308 VanDerWaalsContact C-N 3.35Å; H306-F308 PolarHBondContact O-N 3.36Å; F308-A312 PolarHBondContact O-N 2.91Å; F308-A312 VanDerWaalsContact O-N 3.17Å; F308-S424 WeakPolarHBondContact CB-O 3.27Å; F308-L427 HydrophobicContact CD1-CD2 3.96Å; F308-L427 HydrophobicContact CD1-CG 4.44Å; F308-L427 HydrophobicContact CD2-CD2 3.9Å; F308-L427 HydrophobicContact CD2-CG 3.82Å; F308-L427 HydrophobicContact CE1-CD2 3.72Å; F308-L427 HydrophobicContact CE2-CD2 3.67Å; F308-L427 HydrophobicContact CE2-CG 4Å; F308-L427 HydrophobicContact CG-CB 4.35Å; F308-L427 HydrophobicContact CG-CD2 4.06Å; F308-L427 HydrophobicContact CG-CG 4.08Å; F308-L427 HydrophobicContact CZ-CD2 3.58Å; F308-L427 HydrophobicContact CZ-CG 4.39Å; F308-F431 AromaticContact CD2-CD2 3.72Å; F308-F431 HydrophobicContact CD2-CD2 3.72Å; F308-F431 AromaticContact CD2-CE2 3.81Å; F308-F431 HydrophobicContact CD2-CE2 3.81Å; F308-F431 AromaticContact CE2-CD2 4Å; F308-F431 HydrophobicContact CE2-CD2 4Å; F308-F431 AromaticContact CE2-CE2 3.59Å; F308-F431 HydrophobicContact CE2-CE2 3.59Å
309	T	94.9	Very high	93.6	Very high	10 Å²	10	14 Å²	14	6%	0.061	8%	0.078	C	C	.	.	H	α-helix	trans	-67.7	-39.5	173.1	48.7	0	0	0	0	112.7	W305 H306 R313	W305-T309 PolarHBondContact O-N 3Å; W305-T309 PolarHBondContact O-OG1 3.21Å; W305-T309 VanDerWaalsContact O-OG1 3.14Å; H306-T309 WeakPolarHBondContact CA-OG1 3.34Å; H306-T309 PolarHBondContact O-N 3.37Å; H306-T309 PolarHBondContact O-OG1 3.36Å; T309-R313 WeakPolarHBondContact O-CB 3.36Å; T309-R313 PolarHBondContact O-N 3.48Å; T309-R313 VanDerWaalsContact O-N 3.16Å
310	I	94.7	Very high	93.9	Very high	1 Å²	1	15 Å²	15	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-74.8	-37.7	-178.5	-65.2	171.8	0	0	0	110.2	L270 L273 L277 H306 A312 R313 S314 C371	L270-I310 HydrophobicContact CD1-CB 4.45Å; L270-I310 HydrophobicContact CD1-CG2 4.19Å; L273-I310 HydrophobicContact CD1-CG2 4.11Å; L273-I310 HydrophobicContact CD2-CD1 3.63Å; L273-I310 HydrophobicContact CD2-CG2 4.26Å; L277-I310 HydrophobicContact CD2-CD1 3.94Å; H306-I310 HydrophobicContact CB-CD1 4.22Å; H306-I310 WeakPolarHBondContact O-CB 3.5Å; H306-I310 WeakPolarHBondContact O-CG1 3.38Å; H306-I310 PolarHBondContact O-N 2.97Å; I310-A312 PolarHBondContact O-N 3.16Å; I310-R313 PolarHBondContact O-N 3.05Å; I310-S314 WeakPolarHBondContact O-CB 3.23Å; I310-S314 PolarHBondContact O-N 2.92Å; I310-S314 PolarHBondContact O-OG 3.4Å; I310-S314 VanDerWaalsContact O-OG 3.09Å; I310-C371 HydrophobicContact CD1-CB 3.76Å; I310-C371 HydrophobicContact CG1-CB 3.78Å
311	A	95.2	Very high	93.9	Very high	17 Å²	17	12.1 Å²	12.1	14%	0.14	7%	0.066	C	C	.	.	H	α-helix	trans	-57	-48.1	171.9	0	0	0	0	0	112.3	L270 L307 R313 S314 L315	L270-A311 HydrophobicContact CD1-CB 4.06Å; L270-A311 HydrophobicContact CD2-CB 3.72Å; L307-A311 WeakPolarHBondContact O-CB 3.19Å; L307-A311 PolarHBondContact O-N 2.84Å; A311-R313 VanDerWaalsContact C-N 3.32Å; A311-R313 PolarHBondContact O-N 3.42Å; A311-S314 PolarHBondContact O-OG 2.74Å; A311-L315 WeakPolarHBondContact O-CB 3.07Å; A311-L315 PolarHBondContact O-N 3.02Å
312	A	96.3	Very high	93.8	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-60.4	-43.2	177.8	0	0	0	0	0	111.8	F308 I310 A316 V421 S424 F425	F308-A312 PolarHBondContact O-N 2.91Å; F308-A312 VanDerWaalsContact O-N 3.17Å; I310-A312 PolarHBondContact O-N 3.16Å; A312-A316 VanDerWaalsContact O-CB 3.31Å; A312-A316 WeakPolarHBondContact O-CB 3.48Å; A312-A316 PolarHBondContact O-N 3.35Å; A312-V421 HydrophobicContact CB-CG1 4.46Å; A312-S424 WeakPolarHBondContact CB-OG 3.28Å; A312-F425 HydrophobicContact CB-CB 3.74Å; A312-F425 HydrophobicContact CB-CD2 4.13Å; A312-F425 HydrophobicContact CB-CG 4.46Å
313	R	96.2	Very high	93.7	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-67.6	-48.1	179.7	-173.7	57.3	160.5	-175.5	1.3	112.5	T309 I310 A311 L315 A316 F317 H335 I369 E394 N395	T309-R313 WeakPolarHBondContact O-CB 3.36Å; T309-R313 PolarHBondContact O-N 3.48Å; T309-R313 VanDerWaalsContact O-N 3.16Å; I310-R313 PolarHBondContact O-N 3.05Å; A311-R313 VanDerWaalsContact C-N 3.32Å; A311-R313 PolarHBondContact O-N 3.42Å; R313-L315 VanDerWaalsContact C-N 3.33Å; R313-L315 PolarHBondContact O-N 3.42Å; R313-A316 PolarHBondContact O-N 3.09Å; R313-F317 HydrophobicContact CG-CD2 4.5Å; R313-F317 HydrophobicContact CG-CE2 4.03Å; R313-F317 HydrophobicContact CG-CZ 4.08Å; R313-F317 VanDerWaalsContact CZ-CZ 3.5Å; R313-F317 WeakPolarHBondContact O-CG 3.4Å; R313-F317 PolarHBondContact O-N 2.93Å; R313-H335 PolarHBondContact NH2-CE1 3.33Å; R313-H335 PolarHBondContact NH2-NE2 2.98Å; R313-H335 VanDerWaalsContact NH2-NE2 3.13Å; R313-I369 PolarHBondContact NE-O 3.1Å; R313-I369 PolarHBondContact NH2-O 3.46Å; R313-E394 IonicContact CZ-OE2 3.62Å; R313-E394 IonicContact NH1-OE2 2.78Å; R313-E394 PolarHBondContact NH1-OE2 2.79Å; R313-E394 IonicContact NH2-OE2 3.2Å; R313-E394 PolarHBondContact NH2-OE2 3.13Å; R313-N395 WeakPolarHBondContact CD-OD1 3.22Å; R313-N395 PolarHBondContact NH1-OD1 3.48Å
314	S	94.8	Very high	93.5	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.007	9%	0.093	C	C	.	.	H	α-helix	trans	-68	-33.9	179.6	65.9	0	0	0	0	112.1	L248 I310 A311 A318	L248-S314 WeakPolarHBondContact CD1-OG 3.44Å; I310-S314 WeakPolarHBondContact O-CB 3.23Å; I310-S314 PolarHBondContact O-N 2.92Å; I310-S314 PolarHBondContact O-OG 3.4Å; I310-S314 VanDerWaalsContact O-OG 3.09Å; A311-S314 PolarHBondContact O-OG 2.74Å; S314-A318 VanDerWaalsContact O-CB 3.26Å; S314-A318 WeakPolarHBondContact O-CB 3.16Å; S314-A318 PolarHBondContact O-N 2.88Å
315	L	94.6	Very high	93.1	Very high	18 Å²	18	21.5 Å²	21.5	9%	0.094	11%	0.108	C	C	.	.	H	α-helix	trans	-71.7	-41.1	174.9	-174.1	59	0	0	0	111.9	L248 A311 R313 F317 A318 L319 M417 V420 V421	L248-L315 HydrophobicContact CD2-CD1 4.41Å; A311-L315 WeakPolarHBondContact O-CB 3.07Å; A311-L315 PolarHBondContact O-N 3.02Å; R313-L315 VanDerWaalsContact C-N 3.33Å; R313-L315 PolarHBondContact O-N 3.42Å; L315-F317 VanDerWaalsContact C-N 3.34Å; L315-F317 PolarHBondContact O-N 3.23Å; L315-A318 PolarHBondContact O-N 3.22Å; L315-L319 HydrophobicContact CD1-CD1 4.47Å; L315-L319 HydrophobicContact CD1-CG 4.37Å; L315-L319 HydrophobicContact CG-CD1 4.15Å; L315-L319 WeakPolarHBondContact O-CB 3.12Å; L315-L319 VanDerWaalsContact O-CG 3.26Å; L315-L319 WeakPolarHBondContact O-CG 3.47Å; L315-L319 PolarHBondContact O-N 2.78Å; L315-M417 HydrophobicContact CD1-CE 3.88Å; L315-V420 HydrophobicContact CD2-CB 4.48Å; L315-V420 HydrophobicContact CD2-CG1 3.74Å; L315-V421 HydrophobicContact CB-CG2 4.02Å; L315-V421 HydrophobicContact CD2-CG2 3.61Å; L315-V421 HydrophobicContact CG-CG2 3.63Å
316	A	95.8	Very high	92.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-59.8	-43	172.7	0	0	0	0	0	112	A312 R313 F320 N395 T399 V421	A312-A316 VanDerWaalsContact O-CB 3.31Å; A312-A316 WeakPolarHBondContact O-CB 3.48Å; A312-A316 PolarHBondContact O-N 3.35Å; R313-A316 PolarHBondContact O-N 3.09Å; A316-F320 PolarHBondContact O-N 3.03Å; A316-F320 VanDerWaalsContact O-N 3.08Å; A316-N395 HydrophobicContact CB-CB 4.14Å; A316-T399 HydrophobicContact CB-CG2 4.01Å; A316-V421 HydrophobicContact CB-CG1 4.24Å
317	F	95.4	Very high	92.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.6	-47.6	172.4	-71.3	-12.3	0	0	0	112.4	V245 R313 L315 L319 F320 A321 F328 F331 I332 I369 F370 L398	V245-F317 HydrophobicContact CG1-CB 3.81Å; V245-F317 HydrophobicContact CG2-CB 4.09Å; V245-F317 HydrophobicContact CG2-CD2 4.03Å; R313-F317 HydrophobicContact CG-CD2 4.5Å; R313-F317 HydrophobicContact CG-CE2 4.03Å; R313-F317 HydrophobicContact CG-CZ 4.08Å; R313-F317 VanDerWaalsContact CZ-CZ 3.5Å; R313-F317 WeakPolarHBondContact O-CG 3.4Å; R313-F317 PolarHBondContact O-N 2.93Å; L315-F317 VanDerWaalsContact C-N 3.34Å; L315-F317 PolarHBondContact O-N 3.23Å; F317-L319 PolarHBondContact O-N 2.7Å; F317-F320 PolarHBondContact O-N 2.7Å; F317-A321 WeakPolarHBondContact O-CB 3.5Å; F317-A321 PolarHBondContact O-N 2.91Å; F317-F328 HydrophobicContact CB-CE2 3.72Å; F317-F328 HydrophobicContact CB-CZ 4.03Å; F317-F328 HydrophobicContact CD1-CE2 4.06Å; F317-F328 HydrophobicContact CD2-CE2 4.46Å; F317-F328 AromaticContact CG-CE2 3.85Å; F317-F328 HydrophobicContact CG-CE2 3.85Å; F317-F328 HydrophobicContact CG-CZ 4.29Å; F317-F331 AromaticContact CE1-CE1 3.75Å; F317-F331 HydrophobicContact CE1-CE1 3.75Å; F317-F331 HydrophobicContact CZ-CE1 4.36Å; F317-I332 HydrophobicContact CD2-CD1 4.28Å; F317-I332 HydrophobicContact CE1-CD1 4.18Å; F317-I332 HydrophobicContact CE2-CD1 3.84Å; F317-I332 HydrophobicContact CZ-CD1 3.75Å; F317-I369 HydrophobicContact CE2-CG2 3.87Å; F317-I369 HydrophobicContact CZ-CG2 3.81Å; F317-F370 HydrophobicContact CD2-CD1 4.47Å; F317-F370 HydrophobicContact CD2-CE1 4.1Å; F317-F370 HydrophobicContact CE2-CD1 4.11Å; F317-F370 AromaticContact CE2-CE1 3.99Å; F317-F370 HydrophobicContact CE2-CE1 3.99Å; F317-L398 HydrophobicContact CD1-CD1 3.9Å; F317-L398 HydrophobicContact CE1-CD1 3.96Å
318	A	93.6	Very high	92.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63	-39.8	-178.9	0	0	0	0	0	113.1	V245 L248 S314 L315 S322	V245-A318 HydrophobicContact CG1-CB 4.46Å; L248-A318 HydrophobicContact CB-CB 3.41Å; L248-A318 VanDerWaalsContact CB-CB 3.41Å; S314-A318 VanDerWaalsContact O-CB 3.26Å; S314-A318 WeakPolarHBondContact O-CB 3.16Å; S314-A318 PolarHBondContact O-N 2.88Å; L315-A318 PolarHBondContact O-N 3.22Å; A318-S322 PolarHBondContact O-N 2.98Å; A318-S322 VanDerWaalsContact O-N 3.12Å
319	L	92.4	Very high	92.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.6	-56.7	173.3	-70	166.3	0	0	0	110.2	V252 L315 F317 A321 S322 T399 W402 M417 V421	V252-L319 HydrophobicContact CG1-CD2 4.18Å; V252-L319 HydrophobicContact CG2-CD2 4.13Å; L315-L319 HydrophobicContact CD1-CD1 4.47Å; L315-L319 HydrophobicContact CD1-CG 4.37Å; L315-L319 HydrophobicContact CG-CD1 4.15Å; L315-L319 WeakPolarHBondContact O-CB 3.12Å; L315-L319 VanDerWaalsContact O-CG 3.26Å; L315-L319 WeakPolarHBondContact O-CG 3.47Å; L315-L319 PolarHBondContact O-N 2.78Å; F317-L319 PolarHBondContact O-N 2.7Å; L319-A321 VanDerWaalsContact C-N 3.33Å; L319-A321 PolarHBondContact O-N 3.15Å; L319-S322 WeakPolarHBondContact O-CB 3.43Å; L319-S322 PolarHBondContact O-N 2.55Å; L319-S322 PolarHBondContact O-OG 2.71Å; L319-T399 HydrophobicContact CD1-CG2 4Å; L319-W402 VanDerWaalsContact C-CD1 3.44Å; L319-W402 HydrophobicContact CB-CD2 4.09Å; L319-W402 HydrophobicContact CB-CG 4Å; L319-W402 HydrophobicContact CD2-CD2 3.98Å; L319-W402 HydrophobicContact CD2-CE3 4.19Å; L319-W402 HydrophobicContact CD2-CH2 3.8Å; L319-W402 HydrophobicContact CD2-CZ2 3.54Å; L319-W402 HydrophobicContact CD2-CZ3 4.11Å; L319-W402 PolarHBondContact O-NE1 2.98Å; L319-M417 HydrophobicContact CD1-CB 4.46Å; L319-M417 HydrophobicContact CD2-CB 4.32Å; L319-M417 HydrophobicContact CD2-CE 4.04Å; L319-V421 HydrophobicContact CD1-CG2 3.9Å
320	F	93.3	Very high	92.3	Very high	19 Å²	19	40.7 Å²	40.7	8%	0.083	21%	0.208	C	C	.	.	H	α-helix	trans	-59	-42.9	-179.1	-174.8	-97.6	0	0	0	112.8	A316 F317 S322 V323 Y324 F328 L398 F401	A316-F320 PolarHBondContact O-N 3.03Å; A316-F320 VanDerWaalsContact O-N 3.08Å; F317-F320 PolarHBondContact O-N 2.7Å; F320-S322 VanDerWaalsContact C-N 3.26Å; F320-S322 PolarHBondContact O-N 3.45Å; F320-V323 PolarHBondContact O-N 3.47Å; F320-Y324 AromaticContact CD2-CD2 3.76Å; F320-Y324 HydrophobicContact CD2-CD2 3.76Å; F320-Y324 HydrophobicContact CD2-CE2 4.5Å; F320-Y324 AromaticContact CE2-CD2 3.47Å; F320-Y324 HydrophobicContact CE2-CD2 3.47Å; F320-Y324 VanDerWaalsContact CE2-CD2 3.47Å; F320-Y324 HydrophobicContact CE2-CE2 4.2Å; F320-Y324 HydrophobicContact CE2-CG 4.11Å; F320-Y324 HydrophobicContact CG-CD2 4.45Å; F320-Y324 AromaticContact CZ-CD2 3.95Å; F320-Y324 HydrophobicContact CZ-CD2 3.95Å; F320-Y324 HydrophobicContact CZ-CG 4.12Å; F320-Y324 PolarHBondContact O-N 3.06Å; F320-F328 HydrophobicContact CD1-CB 4.03Å; F320-F328 HydrophobicContact CD1-CD2 4.1Å; F320-F328 HydrophobicContact CE1-CB 4.17Å; F320-L398 HydrophobicContact CB-CB 4.18Å; F320-L398 HydrophobicContact CB-CD2 3.97Å; F320-L398 HydrophobicContact CD1-CD2 3.73Å; F320-L398 HydrophobicContact CD2-CB 4.4Å; F320-L398 HydrophobicContact CD2-CD2 3.68Å; F320-L398 HydrophobicContact CE1-CD2 4.09Å; F320-L398 HydrophobicContact CE2-CD2 4.05Å; F320-L398 HydrophobicContact CG-CB 4.43Å; F320-L398 HydrophobicContact CG-CD2 3.51Å; F320-L398 HydrophobicContact CZ-CD2 4.24Å; F320-F401 HydrophobicContact CD2-CB 4.38Å; F320-F401 HydrophobicContact CE2-CB 4.15Å; F320-F401 HydrophobicContact CE2-CD2 4.41Å
321	A	91.7	Very high	92.3	Very high	14 Å²	14	42.9 Å²	42.9	12%	0.116	22%	0.217	C	C	.	.	H	α-helix	trans	-65	-24.1	177	0	0	0	0	0	113.6	F317 L319 V323 K325 F328	F317-A321 WeakPolarHBondContact O-CB 3.5Å; F317-A321 PolarHBondContact O-N 2.91Å; L319-A321 VanDerWaalsContact C-N 3.33Å; L319-A321 PolarHBondContact O-N 3.15Å; A321-V323 PolarHBondContact O-N 3.29Å; A321-K325 VanDerWaalsContact O-CG 3.28Å; A321-K325 WeakPolarHBondContact O-CG 3.39Å; A321-F328 HydrophobicContact CB-CB 4.25Å; A321-F328 HydrophobicContact CB-CD1 3.75Å; A321-F328 HydrophobicContact CB-CD2 4.16Å; A321-F328 HydrophobicContact CB-CE1 4.12Å; A321-F328 HydrophobicContact CB-CE2 4.5Å; A321-F328 HydrophobicContact CB-CG 3.78Å; A321-F328 HydrophobicContact CB-CZ 4.48Å
322	S	88.8	Confident	92.2	Very high	27 Å²	27	44 Å²	44	19%	0.189	22%	0.22	C	C	.	.	H	α-helix	trans	-65.8	-25.3	177.4	88.4	0	0	0	0	112.6	A318 L319 F320 W402	A318-S322 PolarHBondContact O-N 2.98Å; A318-S322 VanDerWaalsContact O-N 3.12Å; L319-S322 WeakPolarHBondContact O-CB 3.43Å; L319-S322 PolarHBondContact O-N 2.55Å; L319-S322 PolarHBondContact O-OG 2.71Å; F320-S322 VanDerWaalsContact C-N 3.26Å; F320-S322 PolarHBondContact O-N 3.45Å; S322-W402 PolarHBondContact OG-NE1 2.97Å; S322-W402 VanDerWaalsContact OG-NE1 3.17Å
323	V	87.4	Confident	92.1	Very high	53 Å²	53	48.1 Å²	48.1	32%	0.321	25%	0.246	S	C	.	.	H	α-helix	trans	-106.8	-56.8	178.2	-179.4	0	0	0	0	110.8	F320 A321 K325	F320-V323 PolarHBondContact O-N 3.47Å; A321-V323 PolarHBondContact O-N 3.29Å; V323-K325 PolarHBondContact O-N 2.92Å
324	Y	88.4	Confident	92	Very high	65 Å²	65	50.7 Å²	50.7	26%	0.255	27%	0.267	S	S	.	.			trans	-101.1	52.5	-165	-60.8	-66.7	0	0	0	113.5	F320 L326 Y327 F328 F401 N405	F320-Y324 AromaticContact CD2-CD2 3.76Å; F320-Y324 HydrophobicContact CD2-CD2 3.76Å; F320-Y324 HydrophobicContact CD2-CE2 4.5Å; F320-Y324 AromaticContact CE2-CD2 3.47Å; F320-Y324 HydrophobicContact CE2-CD2 3.47Å; F320-Y324 VanDerWaalsContact CE2-CD2 3.47Å; F320-Y324 HydrophobicContact CE2-CE2 4.2Å; F320-Y324 HydrophobicContact CE2-CG 4.11Å; F320-Y324 HydrophobicContact CG-CD2 4.45Å; F320-Y324 AromaticContact CZ-CD2 3.95Å; F320-Y324 HydrophobicContact CZ-CD2 3.95Å; F320-Y324 HydrophobicContact CZ-CG 4.12Å; F320-Y324 PolarHBondContact O-N 3.06Å; Y324-L326 VanDerWaalsContact C-N 3.33Å; Y324-L326 PolarHBondContact O-N 3.34Å; Y324-L326 VanDerWaalsContact O-N 3.12Å; Y324-Y327 HydrophobicContact CD1-CD2 4.25Å; Y324-Y327 PolarHBondContact O-N 3.01Å; Y324-Y327 VanDerWaalsContact O-N 3.09Å; Y324-F328 PolarHBondContact O-N 3.03Å; Y324-F401 HydrophobicContact CE2-CB 4.37Å; Y324-N405 WeakPolarHBondContact OH-CB 3.11Å; Y324-N405 PolarHBondContact OH-OD1 2.73Å
325	K	85.8	Confident	92	Very high	143 Å²	143	51 Å²	51	62%	0.622	27%	0.268	S	S	*	.	H	α-helix	trans	-46	-45.3	-171.2	-65.7	175.2	-177.6	176.4	0	115.3	A321 V323	A321-K325 VanDerWaalsContact O-CG 3.28Å; A321-K325 WeakPolarHBondContact O-CG 3.39Å; V323-K325 PolarHBondContact O-N 2.92Å
326	L	88.1	Confident	91.9	Very high	148 Å²	148	53.8 Å²	53.8	78%	0.775	28%	0.277	S	S	*	.	H	α-helix	trans	-74.6	-45.6	179.3	-69.5	174.7	0	0	0	112.6	Y324 F328 G329 I330	Y324-L326 VanDerWaalsContact C-N 3.33Å; Y324-L326 PolarHBondContact O-N 3.34Å; Y324-L326 VanDerWaalsContact O-N 3.12Å; L326-F328 VanDerWaalsContact C-N 3.25Å; L326-F328 PolarHBondContact O-N 3.38Å; L326-G329 PolarHBondContact O-N 3.12Å; L326-G329 VanDerWaalsContact O-N 3.14Å; L326-I330 PolarHBondContact O-N 3.2Å
327	Y	91.1	Very high	91.8	Very high	158 Å²	158	57 Å²	57	62%	0.62	30%	0.299	S	S	*	.	H	α-helix	trans	-64.9	-29.6	179	-62	-73.7	0	0	0	112.4	Y324 G329 I330 F331	Y324-Y327 HydrophobicContact CD1-CD2 4.25Å; Y324-Y327 PolarHBondContact O-N 3.01Å; Y324-Y327 VanDerWaalsContact O-N 3.09Å; Y327-G329 VanDerWaalsContact C-N 3.35Å; Y327-G329 PolarHBondContact O-N 2.96Å; Y327-I330 HydrophobicContact CD1-CD1 4.4Å; Y327-I330 PolarHBondContact O-N 2.56Å; Y327-F331 WeakPolarHBondContact O-CB 3.2Å; Y327-F331 PolarHBondContact O-N 3.25Å
328	F	91.6	Very high	91.7	Very high	42 Å²	42	61.2 Å²	61.2	18%	0.184	33%	0.325	C	S	.	.	H	α-helix	trans	-60	-43	172.3	177.8	-112.9	0	0	0	112.1	V245 F317 F320 A321 Y324 L326 F331 I332	V245-F328 HydrophobicContact CG1-CZ 4.08Å; F317-F328 HydrophobicContact CB-CE2 3.72Å; F317-F328 HydrophobicContact CB-CZ 4.03Å; F317-F328 HydrophobicContact CD1-CE2 4.06Å; F317-F328 HydrophobicContact CD2-CE2 4.46Å; F317-F328 AromaticContact CG-CE2 3.85Å; F317-F328 HydrophobicContact CG-CE2 3.85Å; F317-F328 HydrophobicContact CG-CZ 4.29Å; F320-F328 HydrophobicContact CD1-CB 4.03Å; F320-F328 HydrophobicContact CD1-CD2 4.1Å; F320-F328 HydrophobicContact CE1-CB 4.17Å; A321-F328 HydrophobicContact CB-CB 4.25Å; A321-F328 HydrophobicContact CB-CD1 3.75Å; A321-F328 HydrophobicContact CB-CD2 4.16Å; A321-F328 HydrophobicContact CB-CE1 4.12Å; A321-F328 HydrophobicContact CB-CE2 4.5Å; A321-F328 HydrophobicContact CB-CG 3.78Å; A321-F328 HydrophobicContact CB-CZ 4.48Å; Y324-F328 PolarHBondContact O-N 3.03Å; L326-F328 VanDerWaalsContact C-N 3.25Å; L326-F328 PolarHBondContact O-N 3.38Å; F328-F331 PolarHBondContact O-N 3.37Å; F328-I332 HydrophobicContact CD2-CG1 4.07Å; F328-I332 HydrophobicContact CE1-CG1 4.13Å; F328-I332 HydrophobicContact CE2-CD1 3.75Å; F328-I332 HydrophobicContact CE2-CG1 3.61Å; F328-I332 HydrophobicContact CZ-CD1 3.87Å; F328-I332 HydrophobicContact CZ-CG1 3.64Å; F328-I332 WeakPolarHBondContact O-CG1 3.44Å; F328-I332 PolarHBondContact O-N 2.96Å
329	G	90.8	Very high	91.6	Very high	37 Å²	37	61.5 Å²	61.5	38%	0.381	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-44.7	175	0	0	0	0	0	112.5	L326 Y327 I332 V333	L326-G329 PolarHBondContact O-N 3.12Å; L326-G329 VanDerWaalsContact O-N 3.14Å; Y327-G329 VanDerWaalsContact C-N 3.35Å; Y327-G329 PolarHBondContact O-N 2.96Å; G329-I332 PolarHBondContact O-N 3.32Å; G329-V333 WeakPolarHBondContact O-CG2 3.29Å; G329-V333 PolarHBondContact O-N 2.88Å; G329-V333 VanDerWaalsContact O-N 3.14Å
330	I	93.1	Very high	91.5	Very high	111 Å²	111	61.8 Å²	61.8	57%	0.569	33%	0.328	S	S	*	.	H	α-helix	trans	-62	-45.7	176.5	-61	167.9	0	0	0	110.7	L326 Y327 V333 A334	L326-I330 PolarHBondContact O-N 3.2Å; Y327-I330 HydrophobicContact CD1-CD1 4.4Å; Y327-I330 PolarHBondContact O-N 2.56Å; I330-V333 PolarHBondContact O-N 3.39Å; I330-A334 WeakPolarHBondContact O-CB 3.37Å; I330-A334 PolarHBondContact O-N 3.06Å
331	F	94.2	Very high	91.3	Very high	48 Å²	48	67.2 Å²	67.2	21%	0.211	35%	0.352	C	S	.	.	H	α-helix	trans	-59.4	-48	177.7	173.4	-89.2	0	0	0	112	F317 Y327 F328 V333 A334 H335 E394 L398	F317-F331 AromaticContact CE1-CE1 3.75Å; F317-F331 HydrophobicContact CE1-CE1 3.75Å; F317-F331 HydrophobicContact CZ-CE1 4.36Å; Y327-F331 WeakPolarHBondContact O-CB 3.2Å; Y327-F331 PolarHBondContact O-N 3.25Å; F328-F331 PolarHBondContact O-N 3.37Å; F331-V333 PolarHBondContact O-N 2.94Å; F331-A334 PolarHBondContact O-N 3.3Å; F331-H335 HydrophobicContact CE1-CB 4.28Å; F331-H335 HydrophobicContact CZ-CB 4.31Å; F331-H335 VanDerWaalsContact O-CB 3.24Å; F331-H335 WeakPolarHBondContact O-CB 3.27Å; F331-H335 PolarHBondContact O-N 3.35Å; F331-E394 HydrophobicContact CZ-CG 4.41Å; F331-L398 HydrophobicContact CE1-CD1 4.14Å; F331-L398 HydrophobicContact CE2-CD2 4.5Å; F331-L398 HydrophobicContact CZ-CD1 4.05Å
332	I	93.2	Very high	91.1	Very high	39 Å²	39	71.4 Å²	71.4	20%	0.2	36%	0.364	C	S	.	.	H	α-helix	trans	-62.7	-42.4	-179.2	-69.8	-68.6	0	0	0	111.3	F317 F328 G329 W336 I369	F317-I332 HydrophobicContact CD2-CD1 4.28Å; F317-I332 HydrophobicContact CE1-CD1 4.18Å; F317-I332 HydrophobicContact CE2-CD1 3.84Å; F317-I332 HydrophobicContact CZ-CD1 3.75Å; F328-I332 HydrophobicContact CD2-CG1 4.07Å; F328-I332 HydrophobicContact CE1-CG1 4.13Å; F328-I332 HydrophobicContact CE2-CD1 3.75Å; F328-I332 HydrophobicContact CE2-CG1 3.61Å; F328-I332 HydrophobicContact CZ-CD1 3.87Å; F328-I332 HydrophobicContact CZ-CG1 3.64Å; F328-I332 WeakPolarHBondContact O-CG1 3.44Å; F328-I332 PolarHBondContact O-N 2.96Å; G329-I332 PolarHBondContact O-N 3.32Å; I332-W336 VanDerWaalsContact O-CB 3.25Å; I332-W336 WeakPolarHBondContact O-CB 3.28Å; I332-W336 PolarHBondContact O-N 3.43Å; I332-I369 HydrophobicContact CD1-CG2 3.87Å; I332-I369 HydrophobicContact CG2-CD1 4.48Å
333	V	94.1	Very high	90.9	Very high	88 Å²	88	70.4 Å²	70.4	53%	0.533	36%	0.357	S	S	.	.	H	α-helix	trans	-66.4	-45.3	176.6	174.7	0	0	0	0	111.3	G329 I330 F331 W336 C337	G329-V333 WeakPolarHBondContact O-CG2 3.29Å; G329-V333 PolarHBondContact O-N 2.88Å; G329-V333 VanDerWaalsContact O-N 3.14Å; I330-V333 PolarHBondContact O-N 3.39Å; F331-V333 PolarHBondContact O-N 2.94Å; V333-W336 PolarHBondContact O-N 2.75Å; V333-C337 PolarHBondContact O-N 2.88Å; V333-C337 PolarHBondContact O-SG 2.9Å; V333-C337 VanDerWaalsContact O-SG 3.37Å
334	A	94.3	Very high	90.7	Very high	53 Å²	53	71.4 Å²	71.4	44%	0.438	36%	0.36	S	S	.	.	H	α-helix	trans	-62.8	-46.3	178.6	0	0	0	0	0	112.1	I330 F331 W336 C337 V338	I330-A334 WeakPolarHBondContact O-CB 3.37Å; I330-A334 PolarHBondContact O-N 3.06Å; F331-A334 PolarHBondContact O-N 3.3Å; A334-W336 PolarHBondContact O-N 2.93Å; A334-C337 PolarHBondContact O-N 3.35Å; A334-V338 WeakPolarHBondContact O-CG2 3.17Å; A334-V338 PolarHBondContact O-N 2.95Å
335	H	93.6	Very high	90.4	Very high	7 Å²	7	74.5 Å²	74.5	3%	0.032	38%	0.377	C	S	.	.	H	α-helix	trans	-64.4	-39	177.2	-177.5	94.5	0	0	0	111.7	R313 F331 V338 M339 E394	R313-H335 PolarHBondContact NH2-CE1 3.33Å; R313-H335 PolarHBondContact NH2-NE2 2.98Å; R313-H335 VanDerWaalsContact NH2-NE2 3.13Å; F331-H335 HydrophobicContact CE1-CB 4.28Å; F331-H335 HydrophobicContact CZ-CB 4.31Å; F331-H335 VanDerWaalsContact O-CB 3.24Å; F331-H335 WeakPolarHBondContact O-CB 3.27Å; F331-H335 PolarHBondContact O-N 3.35Å; H335-V338 PolarHBondContact O-N 3.06Å; H335-M339 WeakPolarHBondContact CE1-CE 3.35Å; H335-M339 WeakPolarHBondContact O-CB 3.27Å; H335-M339 WeakPolarHBondContact O-CG 3.24Å; H335-M339 PolarHBondContact O-N 3.42Å; H335-E394 IonicContact CE1-OE1 2.69Å; H335-E394 PolarHBondContact CE1-OE1 2.96Å; H335-E394 VanDerWaalsContact CE1-OE1 3.23Å; H335-E394 IonicContact CE1-OE2 2.81Å; H335-E394 PolarHBondContact CE1-OE2 2.92Å; H335-E394 IonicContact ND1-OE1 3.59Å; H335-E394 PolarHBondContact ND1-OE1 3.27Å; H335-E394 IonicContact ND1-OE2 3.23Å; H335-E394 PolarHBondContact ND1-OE2 2.82Å
336	W	94.3	Very high	89.6	Confident	77 Å²	77	68.7 Å²	68.7	29%	0.292	36%	0.358	S	S	.	.	H	α-helix	trans	-61.1	-44.9	172.7	173.9	61.7	0	0	0	112.5	I332 V333 A334 M339 T340 M362 I369	I332-W336 VanDerWaalsContact O-CB 3.25Å; I332-W336 WeakPolarHBondContact O-CB 3.28Å; I332-W336 PolarHBondContact O-N 3.43Å; V333-W336 PolarHBondContact O-N 2.75Å; A334-W336 PolarHBondContact O-N 2.93Å; W336-M339 PolarHBondContact O-N 2.83Å; W336-T340 PolarHBondContact NE1-OG1 3.37Å; W336-T340 VanDerWaalsContact O-CB 3.23Å; W336-T340 WeakPolarHBondContact O-CB 3.39Å; W336-T340 PolarHBondContact O-N 2.93Å; W336-T340 PolarHBondContact O-OG1 2.84Å; W336-M362 HydrophobicContact CH2-SD 3.86Å; W336-M362 HydrophobicContact CZ2-CB 4.49Å; W336-M362 HydrophobicContact CZ2-SD 3.51Å; W336-M362 VanDerWaalsContact CZ2-SD 3.51Å; W336-M362 PolarHBondContact NE1-O 3.11Å; W336-I369 HydrophobicContact CB-CD1 3.86Å; W336-I369 HydrophobicContact CB-CG1 4.32Å; W336-I369 HydrophobicContact CG-CD1 4.25Å
337	C	93.5	Very high	88.4	Confident	67 Å²	67	68 Å²	68	45%	0.453	35%	0.35	S	S	.	.	H	α-helix	trans	-59.9	-46	175	-72.6	0	0	0	0	111.8	V333 A334 T340 F341	V333-C337 PolarHBondContact O-N 2.88Å; V333-C337 PolarHBondContact O-SG 2.9Å; V333-C337 VanDerWaalsContact O-SG 3.37Å; A334-C337 PolarHBondContact O-N 3.35Å; C337-T340 PolarHBondContact O-N 2.92Å; C337-F341 WeakPolarHBondContact O-CB 3.42Å; C337-F341 PolarHBondContact O-N 3.23Å
338	V	92.6	Very high	86.8	Confident	90 Å²	90	60.8 Å²	60.8	55%	0.545	32%	0.323	S	S	.	.	H	α-helix	trans	-62.5	-48.1	178.1	170.2	0	0	0	0	111.5	A334 H335 F341 W342	A334-V338 WeakPolarHBondContact O-CG2 3.17Å; A334-V338 PolarHBondContact O-N 2.95Å; H335-V338 PolarHBondContact O-N 3.06Å; V338-F341 PolarHBondContact O-N 2.74Å; V338-W342 WeakPolarHBondContact O-CB 3.46Å; V338-W342 PolarHBondContact O-N 3.49Å
339	M	90.9	Very high	85	Confident	6 Å²	6	62.7 Å²	62.7	3%	0.03	34%	0.335	C	S	.	.	H	α-helix	trans	-67.8	-36.2	179.6	-71.3	-61.2	171.7	0	0	112.5	H335 W336 W342 V343 Y368 Y387 I390	H335-M339 WeakPolarHBondContact CE1-CE 3.35Å; H335-M339 WeakPolarHBondContact O-CB 3.27Å; H335-M339 WeakPolarHBondContact O-CG 3.24Å; H335-M339 PolarHBondContact O-N 3.42Å; W336-M339 PolarHBondContact O-N 2.83Å; M339-W342 PolarHBondContact O-N 3.01Å; M339-V343 VanDerWaalsContact O-CG2 3.25Å; M339-V343 WeakPolarHBondContact O-CG2 3.46Å; M339-V343 PolarHBondContact O-N 3.46Å; M339-Y368 HydrophobicContact SD-CD1 3.96Å; M339-Y387 HydrophobicContact CE-CD2 4.11Å; M339-Y387 HydrophobicContact CE-CE2 4.07Å; M339-Y387 HydrophobicContact SD-CD2 4.24Å; M339-Y387 HydrophobicContact SD-CE2 4.2Å; M339-I390 HydrophobicContact CE-CG2 4.14Å
340	T	90.4	Very high	83.2	Confident	6 Å²	6	62.9 Å²	62.9	4%	0.037	33%	0.325	C	S	.	.	H	α-helix	trans	-65.6	-44	174.3	-58.1	0	0	0	0	111.3	W336 C337 W342 V343 I344 M362	W336-T340 PolarHBondContact NE1-OG1 3.37Å; W336-T340 VanDerWaalsContact O-CB 3.23Å; W336-T340 WeakPolarHBondContact O-CB 3.39Å; W336-T340 PolarHBondContact O-N 2.93Å; W336-T340 PolarHBondContact O-OG1 2.84Å; C337-T340 PolarHBondContact O-N 2.92Å; T340-W342 PolarHBondContact O-N 3.11Å; T340-V343 PolarHBondContact O-N 2.9Å; T340-I344 HydrophobicContact CG2-CD1 3.93Å; T340-I344 WeakPolarHBondContact O-CG1 3.35Å; T340-I344 PolarHBondContact O-N 3.35Å; T340-M362 HydrophobicContact CG2-CE 3.93Å; T340-M362 HydrophobicContact CG2-CG 4.23Å; T340-M362 HydrophobicContact CG2-SD 3.78Å
341	F	89.4	Confident	81.4	Confident	133 Å²	133	58.6 Å²	58.6	58%	0.583	31%	0.305	S	S	*	.	H	α-helix	trans	-61.7	-43.4	174.6	-177.7	-98.7	0	0	0	111.7	C337 V338 V343 I344 Q345	C337-F341 WeakPolarHBondContact O-CB 3.42Å; C337-F341 PolarHBondContact O-N 3.23Å; V338-F341 PolarHBondContact O-N 2.74Å; F341-V343 VanDerWaalsContact C-N 3.3Å; F341-V343 PolarHBondContact O-N 3.22Å; F341-I344 PolarHBondContact O-N 2.88Å; F341-Q345 VanDerWaalsContact O-CB 3.31Å; F341-Q345 WeakPolarHBondContact O-CB 3.3Å; F341-Q345 PolarHBondContact O-N 3.11Å
342	W	88.3	Confident	79.5	Confident	101 Å²	101	63.1 Å²	63.1	38%	0.383	33%	0.328	S	S	.	.	H	α-helix	trans	-59	-38.1	174.8	-178.1	-79.8	0	0	0	113	V338 M339 T340 G346 L386	V338-W342 WeakPolarHBondContact O-CB 3.46Å; V338-W342 PolarHBondContact O-N 3.49Å; M339-W342 PolarHBondContact O-N 3.01Å; T340-W342 PolarHBondContact O-N 3.11Å; W342-G346 PolarHBondContact O-N 2.93Å; W342-L386 HydrophobicContact CH2-CD1 4.25Å
343	V	84.3	Confident	78.4	Confident	7 Å²	7	63.8 Å²	63.8	4%	0.042	34%	0.337	C	S	.	.	H	α-helix	trans	-68.7	-46.9	175.6	169.6	0	0	0	0	111.2	M339 T340 F341 G346 T348 N361 V364 Y368	M339-V343 VanDerWaalsContact O-CG2 3.25Å; M339-V343 WeakPolarHBondContact O-CG2 3.46Å; M339-V343 PolarHBondContact O-N 3.46Å; T340-V343 PolarHBondContact O-N 2.9Å; F341-V343 VanDerWaalsContact C-N 3.3Å; F341-V343 PolarHBondContact O-N 3.22Å; V343-G346 WeakPolarHBondContact O-CA 3.15Å; V343-G346 PolarHBondContact O-N 3.27Å; V343-T348 HydrophobicContact CG1-CG2 4.46Å; V343-N361 HydrophobicContact CG1-CB 4Å; V343-N361 WeakPolarHBondContact CG1-OD1 3.41Å; V343-V364 HydrophobicContact CB-CG1 4.48Å; V343-V364 HydrophobicContact CG1-CB 4.26Å; V343-V364 HydrophobicContact CG1-CG1 3.89Å; V343-V364 HydrophobicContact CG2-CG1 3.73Å; V343-Y368 HydrophobicContact CG2-CD1 4.45Å; V343-Y368 HydrophobicContact CG2-CD2 4.3Å; V343-Y368 HydrophobicContact CG2-CE1 4.34Å; V343-Y368 HydrophobicContact CG2-CE2 4.16Å; V343-Y368 HydrophobicContact CG2-CG 4.44Å
344	I	83	Confident	77.3	Confident	73 Å²	73	67.9 Å²	67.9	37%	0.374	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-45.8	178.5	-67.7	166.6	0	0	0	111.1	T340 F341 G346 E347 N361	T340-I344 HydrophobicContact CG2-CD1 3.93Å; T340-I344 WeakPolarHBondContact O-CG1 3.35Å; T340-I344 PolarHBondContact O-N 3.35Å; F341-I344 PolarHBondContact O-N 2.88Å; I344-G346 PolarHBondContact O-N 3.48Å; I344-E347 PolarHBondContact O-N 3.02Å; I344-E347 VanDerWaalsContact O-N 3.08Å; I344-N361 HydrophobicContact CG1-CB 3.87Å
345	Q	81.2	Confident	76.4	Confident	131 Å²	131	74.9 Å²	74.9	61%	0.612	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-10.5	177	-162	61.8	68.8	0	0	112.8	F341 E347	F341-Q345 VanDerWaalsContact O-CB 3.31Å; F341-Q345 WeakPolarHBondContact O-CB 3.3Å; F341-Q345 PolarHBondContact O-N 3.11Å; Q345-E347 VanDerWaalsContact C-N 3.26Å; Q345-E347 PolarHBondContact O-N 3.17Å
346	G	69.9	Low	75.4	Confident	21 Å²	21	78.7 Å²	78.7	22%	0.216	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-3.2	171.6	0	0	0	0	0	115.2	W342 V343 I344 K376	W342-G346 PolarHBondContact O-N 2.93Å; V343-G346 WeakPolarHBondContact O-CA 3.15Å; V343-G346 PolarHBondContact O-N 3.27Å; I344-G346 PolarHBondContact O-N 3.48Å; G346-K376 WeakPolarHBondContact O-CD 3.3Å; G346-K376 WeakPolarHBondContact O-CE 3.45Å; G346-K376 PolarHBondContact O-NZ 3.01Å
347	E	62.5	Low	74.6	Confident	132 Å²	132	77 Å²	77	62%	0.617	38%	0.376	S	S	*	.			trans	53.5	83.3	-174.7	-62.6	171.3	156.7	0	0	111.7	I344 Q345 K376 Y532	I344-E347 PolarHBondContact O-N 3.02Å; I344-E347 VanDerWaalsContact O-N 3.08Å; Q345-E347 VanDerWaalsContact C-N 3.26Å; Q345-E347 PolarHBondContact O-N 3.17Å; E347-K376 PolarHBondContact O-NZ 3.15Å; E347-K376 IonicContact OE2-NZ 2.89Å; E347-Y532 PolarHBondContact O-OH 3.19Å
348	T	58.8	Low	74	Confident	7 Å²	7	77.3 Å²	77.3	4%	0.043	37%	0.372	C	S	.	.			trans	-109.1	62.5	-170.2	43.9	0	0	0	0	112.3	V343 F350 E357 N361 V375	V343-T348 HydrophobicContact CG1-CG2 4.46Å; T348-F350 PolarHBondContact O-N 3.04Å; T348-E357 VanDerWaalsContact O-CG 3.3Å; T348-E357 WeakPolarHBondContact O-CG 3.45Å; T348-N361 WeakPolarHBondContact CB-OD1 3.4Å; T348-N361 PolarHBondContact OG1-ND2 3.01Å; T348-N361 PolarHBondContact OG1-OD1 3.37Å; T348-V375 HydrophobicContact CG2-CG1 3.77Å
349	D	52.9	Low	73.5	Confident	82 Å²	82	78.4 Å²	78.4	44%	0.439	37%	0.374	S	S	.	.			trans	-57.1	71.2	178.1	-52.1	-30.3	0	0	0	113.2	E357 K530	D349-E357 VanDerWaalsContact CA-OE2 3.31Å; D349-E357 WeakPolarHBondContact CA-OE2 3.39Å; D349-K530 HydrophobicContact CB-CD 4.4Å; D349-K530 WeakPolarHBondContact O-CD 3.43Å; D349-K530 WeakPolarHBondContact O-CE 3.46Å; D349-K530 PolarHBondContact O-NZ 3.26Å
350	F	53.8	Low	72.9	Confident	41 Å²	41	79.8 Å²	79.8	18%	0.18	38%	0.379	C	S	.	.			trans	-98.9	-35	-170	-171.9	-109.5	0	0	0	112.2	T348 E357 Y360 A534 I540	T348-F350 PolarHBondContact O-N 3.04Å; F350-E357 PolarHBondContact N-OE2 3.44Å; F350-Y360 HydrophobicContact CB-CD1 3.97Å; F350-Y360 HydrophobicContact CB-CE1 4.06Å; F350-Y360 AromaticContact CD1-CD1 3.78Å; F350-Y360 HydrophobicContact CD1-CD1 3.78Å; F350-Y360 AromaticContact CD1-CD2 3.69Å; F350-Y360 HydrophobicContact CD1-CD2 3.69Å; F350-Y360 AromaticContact CD1-CE1 3.92Å; F350-Y360 HydrophobicContact CD1-CE1 3.92Å; F350-Y360 AromaticContact CD1-CE2 3.85Å; F350-Y360 HydrophobicContact CD1-CE2 3.85Å; F350-Y360 AromaticContact CD1-CG 3.66Å; F350-Y360 HydrophobicContact CD1-CG 3.66Å; F350-Y360 AromaticContact CD1-CZ 3.96Å; F350-Y360 HydrophobicContact CD2-CE1 4.28Å; F350-Y360 AromaticContact CE1-CD2 3.69Å; F350-Y360 HydrophobicContact CE1-CD2 3.69Å; F350-Y360 HydrophobicContact CE1-CE1 4.48Å; F350-Y360 AromaticContact CE1-CE2 3.63Å; F350-Y360 HydrophobicContact CE1-CE2 3.63Å; F350-Y360 HydrophobicContact CE1-CG 4.16Å; F350-Y360 AromaticContact CG-CD1 3.96Å; F350-Y360 HydrophobicContact CG-CD1 3.96Å; F350-Y360 AromaticContact CG-CE1 3.83Å; F350-Y360 HydrophobicContact CG-CE1 3.83Å; F350-Y360 HydrophobicContact CG-CE2 4.43Å; F350-Y360 HydrophobicContact CG-CG 4.32Å; F350-Y360 HydrophobicContact CZ-CE2 4.02Å; F350-A534 HydrophobicContact CD2-CB 4.1Å; F350-A534 HydrophobicContact CE2-CB 3.71Å; F350-I540 HydrophobicContact CD2-CD1 3.92Å; F350-I540 HydrophobicContact CE1-CD1 4.34Å; F350-I540 HydrophobicContact CE1-CG2 4.26Å; F350-I540 HydrophobicContact CE2-CD1 3.3Å; F350-I540 HydrophobicContact CE2-CG1 4.04Å; F350-I540 HydrophobicContact CZ-CD1 3.54Å; F350-I540 HydrophobicContact CZ-CG1 3.83Å; F350-I540 HydrophobicContact CZ-CG2 4.21Å
351	C	54.1	Low	72.6	Confident	22 Å²	22	79.7 Å²	79.7	15%	0.149	38%	0.378	C	S	.	.	S	Bend	trans	-110.8	161.9	-168.8	-59.7	0	0	0	0	113.2	S353 E356 E357	C351-S353 WeakPolarHBondContact CB-O 3.06Å; C351-S353 PolarHBondContact O-N 3.31Å; C351-E356 HydrophobicContact CB-CB 3.76Å; C351-E356 HydrophobicContact CB-CG 3.97Å; C351-E356 VanDerWaalsContact SG-C 3.5Å; C351-E356 VanDerWaalsContact SG-CG 3.56Å; C351-E357 HydrophobicContact CB-CB 4.01Å; C351-E357 PolarHBondContact SG-N 3.34Å
352	M	55.1	Low	72.5	Confident	142 Å²	142	76.5 Å²	76.5	70%	0.7	37%	0.366	S	S	*	.	S	Bend	trans	-78.5	-8.9	172.6	-61	-64.7	-176.2	0	0	112.4	L527	M352-L527 HydrophobicContact CE-CD1 3.99Å; M352-L527 HydrophobicContact CE-CD2 3.7Å; M352-L527 HydrophobicContact SD-CD1 4.49Å; M352-L527 HydrophobicContact SD-CD2 4.32Å
353	S	69.8	Low	72.3	Confident	54 Å²	54	74 Å²	74	38%	0.378	36%	0.362	S	S	.	.	S	Bend	trans	-135.2	139.7	176.4	75.1	0	0	0	0	111.4	C351 W355 E356 E357	C351-S353 WeakPolarHBondContact CB-O 3.06Å; C351-S353 PolarHBondContact O-N 3.31Å; S353-W355 PolarHBondContact O-N 2.76Å; S353-E356 PolarHBondContact O-N 3.01Å; S353-E356 VanDerWaalsContact OG-CB 3.29Å; S353-E356 WeakPolarHBondContact OG-CB 3.45Å; S353-E356 PolarHBondContact OG-N 2.89Å; S353-E357 PolarHBondContact O-N 2.86Å; S353-E357 VanDerWaalsContact O-N 3.15Å
354	K	71.8	Confident	72.3	Confident	173 Å²	173	73.8 Å²	73.8	75%	0.752	36%	0.36	S	S	*	.	H	α-helix	trans	-57.6	-34.6	-179.9	-64.7	-173.9	176	-174.2	0	112.7	E357 I358	K354-E357 PolarHBondContact O-N 3.38Å; K354-I358 WeakPolarHBondContact O-CD1 3.42Å; K354-I358 VanDerWaalsContact O-CG1 3.24Å; K354-I358 WeakPolarHBondContact O-CG1 3.32Å; K354-I358 PolarHBondContact O-N 2.94Å
355	W	74.6	Confident	72.7	Confident	200 Å²	200	70.3 Å²	70.3	76%	0.758	34%	0.342	S	S	*	.	H	α-helix	trans	-66.5	-42.7	178.5	-64.1	117.3	0	0	0	113	S353 E357 I358 I359	S353-W355 PolarHBondContact O-N 2.76Å; W355-E357 VanDerWaalsContact C-N 3.32Å; W355-I358 HydrophobicContact CE3-CD1 4.23Å; W355-I358 HydrophobicContact CZ3-CD1 4.5Å; W355-I358 PolarHBondContact O-N 3.4Å; W355-I359 WeakPolarHBondContact O-CD1 3.06Å; W355-I359 VanDerWaalsContact O-CG1 3.29Å; W355-I359 WeakPolarHBondContact O-CG1 3.34Å; W355-I359 PolarHBondContact O-N 2.8Å; W355-I359 VanDerWaalsContact O-N 3.07Å
356	E	72.8	Confident	73.1	Confident	88 Å²	88	66.1 Å²	66.1	41%	0.411	32%	0.324	S	S	.	.	H	α-helix	trans	-68	-34.9	177.2	-168.3	-177.4	-153.1	0	0	111.1	C351 S353 I359 Y360	C351-E356 HydrophobicContact CB-CB 3.76Å; C351-E356 HydrophobicContact CB-CG 3.97Å; C351-E356 VanDerWaalsContact SG-C 3.5Å; C351-E356 VanDerWaalsContact SG-CG 3.56Å; S353-E356 PolarHBondContact O-N 3.01Å; S353-E356 VanDerWaalsContact OG-CB 3.29Å; S353-E356 WeakPolarHBondContact OG-CB 3.45Å; S353-E356 PolarHBondContact OG-N 2.89Å; E356-I359 PolarHBondContact O-N 3.23Å; E356-Y360 WeakPolarHBondContact O-CB 3.27Å; E356-Y360 PolarHBondContact O-N 2.96Å
357	E	77.5	Confident	74	Confident	42 Å²	42	65.4 Å²	65.4	20%	0.196	32%	0.315	C	S	.	.	H	α-helix	trans	-67.3	-43.1	174.8	-166.2	176.7	107.2	0	0	112.6	T348 D349 F350 C351 S353 K354 W355 I359 Y360 N361	T348-E357 VanDerWaalsContact O-CG 3.3Å; T348-E357 WeakPolarHBondContact O-CG 3.45Å; D349-E357 VanDerWaalsContact CA-OE2 3.31Å; D349-E357 WeakPolarHBondContact CA-OE2 3.39Å; F350-E357 PolarHBondContact N-OE2 3.44Å; C351-E357 HydrophobicContact CB-CB 4.01Å; C351-E357 PolarHBondContact SG-N 3.34Å; S353-E357 PolarHBondContact O-N 2.86Å; S353-E357 VanDerWaalsContact O-N 3.15Å; K354-E357 PolarHBondContact O-N 3.38Å; W355-E357 VanDerWaalsContact C-N 3.32Å; E357-I359 VanDerWaalsContact C-N 3.32Å; E357-I359 PolarHBondContact O-N 3.46Å; E357-Y360 PolarHBondContact O-N 3.27Å; E357-N361 WeakPolarHBondContact O-CB 3.29Å; E357-N361 VanDerWaalsContact O-CG 3.27Å; E357-N361 PolarHBondContact O-N 3.01Å; E357-N361 PolarHBondContact O-ND2 3.05Å
358	I	80.6	Confident	75.3	Confident	73 Å²	73	59.6 Å²	59.6	37%	0.374	29%	0.288	S	S	.	.	H	α-helix	trans	-58.5	-45.9	172.9	-70	161.6	0	0	0	110.1	K354 W355 N361 M362	K354-I358 WeakPolarHBondContact O-CD1 3.42Å; K354-I358 VanDerWaalsContact O-CG1 3.24Å; K354-I358 WeakPolarHBondContact O-CG1 3.32Å; K354-I358 PolarHBondContact O-N 2.94Å; W355-I358 HydrophobicContact CE3-CD1 4.23Å; W355-I358 HydrophobicContact CZ3-CD1 4.5Å; W355-I358 PolarHBondContact O-N 3.4Å; I358-N361 PolarHBondContact O-N 2.9Å; I358-M362 HydrophobicContact CG2-CE 4.27Å; I358-M362 HydrophobicContact CG2-CG 4.3Å; I358-M362 WeakPolarHBondContact O-CB 3.21Å; I358-M362 WeakPolarHBondContact O-CG 3.13Å; I358-M362 PolarHBondContact O-N 3.34Å
359	I	81.4	Confident	76.9	Confident	113 Å²	113	59.8 Å²	59.8	58%	0.579	29%	0.288	S	S	*	.	H	α-helix	trans	-63.2	-42.7	177.8	-68	164.2	0	0	0	111.2	W355 E356 E357 M362 V363	W355-I359 WeakPolarHBondContact O-CD1 3.06Å; W355-I359 VanDerWaalsContact O-CG1 3.29Å; W355-I359 WeakPolarHBondContact O-CG1 3.34Å; W355-I359 PolarHBondContact O-N 2.8Å; W355-I359 VanDerWaalsContact O-N 3.07Å; E356-I359 PolarHBondContact O-N 3.23Å; E357-I359 VanDerWaalsContact C-N 3.32Å; E357-I359 PolarHBondContact O-N 3.46Å; I359-M362 PolarHBondContact O-N 3.04Å; I359-V363 WeakPolarHBondContact O-CG2 3.35Å; I359-V363 PolarHBondContact O-N 3.35Å
360	Y	79.1	Confident	78.8	Confident	35 Å²	35	56.6 Å²	56.6	14%	0.137	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-48.4	174.9	175.6	-102.7	0	0	0	111.8	F350 E356 E357 M362 V363 V364 V375	F350-Y360 HydrophobicContact CB-CD1 3.97Å; F350-Y360 HydrophobicContact CB-CE1 4.06Å; F350-Y360 AromaticContact CD1-CD1 3.78Å; F350-Y360 HydrophobicContact CD1-CD1 3.78Å; F350-Y360 AromaticContact CD1-CD2 3.69Å; F350-Y360 HydrophobicContact CD1-CD2 3.69Å; F350-Y360 AromaticContact CD1-CE1 3.92Å; F350-Y360 HydrophobicContact CD1-CE1 3.92Å; F350-Y360 AromaticContact CD1-CE2 3.85Å; F350-Y360 HydrophobicContact CD1-CE2 3.85Å; F350-Y360 AromaticContact CD1-CG 3.66Å; F350-Y360 HydrophobicContact CD1-CG 3.66Å; F350-Y360 AromaticContact CD1-CZ 3.96Å; F350-Y360 HydrophobicContact CD2-CE1 4.28Å; F350-Y360 AromaticContact CE1-CD2 3.69Å; F350-Y360 HydrophobicContact CE1-CD2 3.69Å; F350-Y360 HydrophobicContact CE1-CE1 4.48Å; F350-Y360 AromaticContact CE1-CE2 3.63Å; F350-Y360 HydrophobicContact CE1-CE2 3.63Å; F350-Y360 HydrophobicContact CE1-CG 4.16Å; F350-Y360 AromaticContact CG-CD1 3.96Å; F350-Y360 HydrophobicContact CG-CD1 3.96Å; F350-Y360 AromaticContact CG-CE1 3.83Å; F350-Y360 HydrophobicContact CG-CE1 3.83Å; F350-Y360 HydrophobicContact CG-CE2 4.43Å; F350-Y360 HydrophobicContact CG-CG 4.32Å; F350-Y360 HydrophobicContact CZ-CE2 4.02Å; E356-Y360 WeakPolarHBondContact O-CB 3.27Å; E356-Y360 PolarHBondContact O-N 2.96Å; E357-Y360 PolarHBondContact O-N 3.27Å; Y360-M362 VanDerWaalsContact C-N 3.34Å; Y360-M362 PolarHBondContact O-N 3.33Å; Y360-V363 PolarHBondContact O-N 2.94Å; Y360-V364 HydrophobicContact CD1-CG2 4.35Å; Y360-V364 HydrophobicContact CE1-CG2 3.97Å; Y360-V364 HydrophobicContact CE2-CG2 4.17Å; Y360-V364 WeakPolarHBondContact O-CG2 3.49Å; Y360-V364 PolarHBondContact O-N 3.5Å; Y360-V375 HydrophobicContact CE1-CG1 3.78Å
361	N	83.5	Confident	80.5	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-63.3	-37	178.4	-71.4	-28.6	0	0	0	112.6	V343 I344 T348 E357 I358 V364 G365	V343-N361 HydrophobicContact CG1-CB 4Å; V343-N361 WeakPolarHBondContact CG1-OD1 3.41Å; I344-N361 HydrophobicContact CG1-CB 3.87Å; T348-N361 WeakPolarHBondContact CB-OD1 3.4Å; T348-N361 PolarHBondContact OG1-ND2 3.01Å; T348-N361 PolarHBondContact OG1-OD1 3.37Å; E357-N361 WeakPolarHBondContact O-CB 3.29Å; E357-N361 VanDerWaalsContact O-CG 3.27Å; E357-N361 PolarHBondContact O-N 3.01Å; E357-N361 PolarHBondContact O-ND2 3.05Å; I358-N361 PolarHBondContact O-N 2.9Å; N361-V364 PolarHBondContact O-N 3.34Å; N361-G365 PolarHBondContact O-N 3.36Å
362	M	86.8	Confident	82.1	Confident	67 Å²	67	54.4 Å²	54.4	33%	0.33	26%	0.258	S	S	.	.	H	α-helix	trans	-64.5	-42.7	174.5	-68.7	-89.4	167.3	0	0	111.9	W336 T340 I358 I359 Y360 G365 I366	W336-M362 HydrophobicContact CH2-SD 3.86Å; W336-M362 HydrophobicContact CZ2-CB 4.49Å; W336-M362 HydrophobicContact CZ2-SD 3.51Å; W336-M362 VanDerWaalsContact CZ2-SD 3.51Å; W336-M362 PolarHBondContact NE1-O 3.11Å; T340-M362 HydrophobicContact CG2-CE 3.93Å; T340-M362 HydrophobicContact CG2-CG 4.23Å; T340-M362 HydrophobicContact CG2-SD 3.78Å; I358-M362 HydrophobicContact CG2-CE 4.27Å; I358-M362 HydrophobicContact CG2-CG 4.3Å; I358-M362 WeakPolarHBondContact O-CB 3.21Å; I358-M362 WeakPolarHBondContact O-CG 3.13Å; I358-M362 PolarHBondContact O-N 3.34Å; I359-M362 PolarHBondContact O-N 3.04Å; Y360-M362 VanDerWaalsContact C-N 3.34Å; Y360-M362 PolarHBondContact O-N 3.33Å; M362-G365 PolarHBondContact O-N 3.14Å; M362-I366 PolarHBondContact O-N 3.27Å; M362-I366 VanDerWaalsContact O-N 3.16Å
363	V	84.9	Confident	83.2	Confident	49 Å²	49	48.1 Å²	48.1	30%	0.297	23%	0.227	S	C	.	.	H	α-helix	trans	-65.3	-44.5	175.3	168.6	0	0	0	0	111.1	L234 I359 Y360 G365 I366 I367	L234-V363 HydrophobicContact CD1-CG1 3.79Å; L234-V363 HydrophobicContact CD1-CG2 4.3Å; I359-V363 WeakPolarHBondContact O-CG2 3.35Å; I359-V363 PolarHBondContact O-N 3.35Å; Y360-V363 PolarHBondContact O-N 2.94Å; V363-G365 VanDerWaalsContact C-N 3.27Å; V363-G365 PolarHBondContact O-N 2.81Å; V363-I366 WeakPolarHBondContact O-CB 3.36Å; V363-I366 PolarHBondContact O-N 2.75Å; V363-I366 VanDerWaalsContact O-N 3.13Å; V363-I367 PolarHBondContact O-N 2.69Å
364	V	85	Confident	83.3	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-58.7	-41.3	172.6	171.3	0	0	0	0	110.6	V343 Y360 N361 I366 I367 Y368 F373 V375	V343-V364 HydrophobicContact CB-CG1 4.48Å; V343-V364 HydrophobicContact CG1-CB 4.26Å; V343-V364 HydrophobicContact CG1-CG1 3.89Å; V343-V364 HydrophobicContact CG2-CG1 3.73Å; Y360-V364 HydrophobicContact CD1-CG2 4.35Å; Y360-V364 HydrophobicContact CE1-CG2 3.97Å; Y360-V364 HydrophobicContact CE2-CG2 4.17Å; Y360-V364 WeakPolarHBondContact O-CG2 3.49Å; Y360-V364 PolarHBondContact O-N 3.5Å; N361-V364 PolarHBondContact O-N 3.34Å; V364-I366 VanDerWaalsContact C-N 3.27Å; V364-I366 PolarHBondContact O-N 3.34Å; V364-I367 WeakPolarHBondContact O-CB 3.3Å; V364-I367 PolarHBondContact O-N 2.89Å; V364-Y368 HydrophobicContact CG1-CD2 3.65Å; V364-Y368 HydrophobicContact CG1-CE2 3.51Å; V364-Y368 VanDerWaalsContact O-CD2 3.31Å; V364-Y368 WeakPolarHBondContact O-CD2 3.31Å; V364-Y368 PolarHBondContact O-N 3.49Å; V364-F373 HydrophobicContact CG1-CD1 4.32Å; V364-F373 HydrophobicContact CG2-CD1 4.27Å; V364-F373 HydrophobicContact CG2-CE1 4.24Å; V364-V375 HydrophobicContact CB-CG2 4.46Å; V364-V375 HydrophobicContact CG1-CG2 3.67Å; V364-V375 HydrophobicContact CG2-CG2 3.88Å
365	G	89.7	Confident	82.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-56.1	-37.1	174.7	0	0	0	0	0	113.5	N361 M362 V363 Y368 I369	N361-G365 PolarHBondContact O-N 3.36Å; M362-G365 PolarHBondContact O-N 3.14Å; V363-G365 VanDerWaalsContact C-N 3.27Å; V363-G365 PolarHBondContact O-N 2.81Å; G365-Y368 PolarHBondContact O-N 2.94Å; G365-I369 WeakPolarHBondContact O-CG1 3.45Å
366	I	89.6	Confident	81.8	Confident	44 Å²	44	32.2 Å²	32.2	23%	0.226	16%	0.159	C	C	.	.	H	α-helix	trans	-66.9	-43.1	173.9	-62	170.2	0	0	0	111	L238 M362 V363 V364 Y368 I369	L238-I366 HydrophobicContact CD2-CD1 4.17Å; M362-I366 PolarHBondContact O-N 3.27Å; M362-I366 VanDerWaalsContact O-N 3.16Å; V363-I366 WeakPolarHBondContact O-CB 3.36Å; V363-I366 PolarHBondContact O-N 2.75Å; V363-I366 VanDerWaalsContact O-N 3.13Å; V364-I366 VanDerWaalsContact C-N 3.27Å; V364-I366 PolarHBondContact O-N 3.34Å; I366-Y368 VanDerWaalsContact C-N 3.29Å; I366-Y368 PolarHBondContact O-N 2.96Å; I366-I369 HydrophobicContact CG2-CD1 4.45Å; I366-I369 WeakPolarHBondContact O-CB 3.4Å; I366-I369 VanDerWaalsContact O-CG1 3.32Å; I366-I369 WeakPolarHBondContact O-CG1 3.46Å; I366-I369 PolarHBondContact O-N 3.34Å
367	I	89.3	Confident	80.7	Confident	6 Å²	6	30.7 Å²	30.7	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-61.4	-41	177.9	-59.1	173.2	0	0	0	110.5	L233 F237 V363 V364 I369 F370 C371 F373	L233-I367 HydrophobicContact CD2-CD1 4.04Å; L233-I367 HydrophobicContact CG-CD1 4.37Å; F237-I367 HydrophobicContact CB-CG1 4.15Å; F237-I367 HydrophobicContact CD1-CB 4.44Å; F237-I367 HydrophobicContact CD1-CG1 4.34Å; F237-I367 HydrophobicContact CD1-CG2 4.3Å; F237-I367 HydrophobicContact CD2-CB 4.49Å; F237-I367 HydrophobicContact CD2-CD1 4.27Å; F237-I367 HydrophobicContact CD2-CG1 3.78Å; F237-I367 HydrophobicContact CD2-CG2 4.2Å; F237-I367 HydrophobicContact CE1-CG2 4.03Å; F237-I367 HydrophobicContact CE2-CG1 4.33Å; F237-I367 HydrophobicContact CE2-CG2 3.92Å; F237-I367 HydrophobicContact CG-CB 4.39Å; F237-I367 HydrophobicContact CG-CG1 3.8Å; F237-I367 HydrophobicContact CG-CG2 4.4Å; F237-I367 HydrophobicContact CZ-CG2 3.84Å; V363-I367 PolarHBondContact O-N 2.69Å; V364-I367 WeakPolarHBondContact O-CB 3.3Å; V364-I367 PolarHBondContact O-N 2.89Å; I367-I369 PolarHBondContact O-N 2.87Å; I367-F370 PolarHBondContact O-N 2.78Å; I367-C371 VanDerWaalsContact CG2-SG 3.6Å; I367-C371 PolarHBondContact O-N 3.02Å; I367-F373 HydrophobicContact CB-CB 4.45Å; I367-F373 HydrophobicContact CD1-CD1 4.43Å; I367-F373 HydrophobicContact CD1-CG 4.4Å; I367-F373 HydrophobicContact CG2-CB 3.64Å; I367-F373 HydrophobicContact CG2-CD2 4.31Å; I367-F373 HydrophobicContact CG2-CG 4.06Å
368	Y	90.8	Very high	79.3	Confident	10 Å²	10	31.1 Å²	31.1	4%	0.039	17%	0.167	C	C	.	.	H	α-helix	trans	-62.3	-21.5	179.3	-92.6	-118	0	0	0	114.3	M339 V343 V364 G365 I366 F370 C371 W372 F373 Y387	M339-Y368 HydrophobicContact SD-CD1 3.96Å; V343-Y368 HydrophobicContact CG2-CD1 4.45Å; V343-Y368 HydrophobicContact CG2-CD2 4.3Å; V343-Y368 HydrophobicContact CG2-CE1 4.34Å; V343-Y368 HydrophobicContact CG2-CE2 4.16Å; V343-Y368 HydrophobicContact CG2-CG 4.44Å; V364-Y368 HydrophobicContact CG1-CD2 3.65Å; V364-Y368 HydrophobicContact CG1-CE2 3.51Å; V364-Y368 VanDerWaalsContact O-CD2 3.31Å; V364-Y368 WeakPolarHBondContact O-CD2 3.31Å; V364-Y368 PolarHBondContact O-N 3.49Å; G365-Y368 PolarHBondContact O-N 2.94Å; I366-Y368 VanDerWaalsContact C-N 3.29Å; I366-Y368 PolarHBondContact O-N 2.96Å; Y368-F370 PolarHBondContact O-N 2.75Å; Y368-C371 WeakPolarHBondContact CA-O 3.24Å; Y368-W372 AromaticContact CE1-CE3 3.66Å; Y368-W372 HydrophobicContact CE1-CE3 3.66Å; Y368-W372 HydrophobicContact CE1-CH2 4.49Å; Y368-W372 AromaticContact CE1-CZ3 3.61Å; Y368-W372 HydrophobicContact CE1-CZ3 3.61Å; Y368-W372 AromaticContact CZ-CE3 3.9Å; Y368-W372 AromaticContact CZ-CZ3 3.9Å; Y368-W372 WeakPolarHBondContact OH-CZ3 3.49Å; Y368-F373 HydrophobicContact CD2-CB 4.28Å; Y368-F373 HydrophobicContact CE2-CB 4Å; Y368-F373 WeakPolarHBondContact CE2-O 3.5Å; Y368-F373 PolarHBondContact OH-O 3.48Å; Y368-F373 VanDerWaalsContact OH-O 3.05Å; Y368-Y387 AromaticContact CD1-CD2 3.92Å; Y368-Y387 HydrophobicContact CD1-CD2 3.92Å; Y368-Y387 AromaticContact CD1-CE2 3.77Å; Y368-Y387 HydrophobicContact CD1-CE2 3.77Å; Y368-Y387 HydrophobicContact CE1-CD2 4.22Å; Y368-Y387 HydrophobicContact CE1-CE2 4.44Å; Y368-Y387 HydrophobicContact CG-CE2 4.36Å; Y368-Y387 WeakPolarHBondContact O-CE2 3.44Å; Y368-Y387 PolarHBondContact O-OH 3.35Å
369	I	92.1	Very high	77.9	Confident	10 Å²	10	37.3 Å²	37.3	5%	0.051	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-33.3	173.1	-50.9	173	0	0	0	110.9	R313 F317 I332 W336 G365 I366 I367	R313-I369 PolarHBondContact NE-O 3.1Å; R313-I369 PolarHBondContact NH2-O 3.46Å; F317-I369 HydrophobicContact CE2-CG2 3.87Å; F317-I369 HydrophobicContact CZ-CG2 3.81Å; I332-I369 HydrophobicContact CD1-CG2 3.87Å; I332-I369 HydrophobicContact CG2-CD1 4.48Å; W336-I369 HydrophobicContact CB-CD1 3.86Å; W336-I369 HydrophobicContact CB-CG1 4.32Å; W336-I369 HydrophobicContact CG-CD1 4.25Å; G365-I369 WeakPolarHBondContact O-CG1 3.45Å; I366-I369 HydrophobicContact CG2-CD1 4.45Å; I366-I369 WeakPolarHBondContact O-CB 3.4Å; I366-I369 VanDerWaalsContact O-CG1 3.32Å; I366-I369 WeakPolarHBondContact O-CG1 3.46Å; I366-I369 PolarHBondContact O-N 3.34Å; I367-I369 PolarHBondContact O-N 2.87Å
370	F	92	Very high	76.9	Confident	16 Å²	16	33.6 Å²	33.6	7%	0.07	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-38.9	-172.2	-64.8	-83.8	0	0	0	114	F237 A241 V245 F317 I367 Y368	F237-F370 HydrophobicContact CD1-CB 4.37Å; F237-F370 HydrophobicContact CD1-CD2 4.1Å; F237-F370 HydrophobicContact CE1-CB 3.95Å; A241-F370 HydrophobicContact CB-CD1 3.98Å; A241-F370 HydrophobicContact CB-CD2 3.95Å; A241-F370 HydrophobicContact CB-CE1 3.81Å; A241-F370 HydrophobicContact CB-CE2 3.79Å; A241-F370 HydrophobicContact CB-CG 4.04Å; A241-F370 HydrophobicContact CB-CZ 3.72Å; V245-F370 HydrophobicContact CG2-CE1 4Å; F317-F370 HydrophobicContact CD2-CD1 4.47Å; F317-F370 HydrophobicContact CD2-CE1 4.1Å; F317-F370 HydrophobicContact CE2-CD1 4.11Å; F317-F370 AromaticContact CE2-CE1 3.99Å; F317-F370 HydrophobicContact CE2-CE1 3.99Å; I367-F370 PolarHBondContact O-N 2.78Å; Y368-F370 PolarHBondContact O-N 2.75Å
371	C	90.8	Very high	76.6	Confident	3 Å²	3	40.1 Å²	40.1	2%	0.02	20%	0.195	C	C	.	.	S	Bend	trans	-154.6	157.8	-176.1	67.4	0	0	0	0	114	F237 L277 I310 I367 Y368 F373 Y387	F237-C371 WeakPolarHBondContact CZ-SG 3.39Å; L277-C371 HydrophobicContact CD2-CB 4.24Å; L277-C371 VanDerWaalsContact CD2-SG 3.6Å; I310-C371 HydrophobicContact CD1-CB 3.76Å; I310-C371 HydrophobicContact CG1-CB 3.78Å; I367-C371 VanDerWaalsContact CG2-SG 3.6Å; I367-C371 PolarHBondContact O-N 3.02Å; Y368-C371 WeakPolarHBondContact CA-O 3.24Å; C371-F373 PolarHBondContact O-N 3.42Å; C371-Y387 VanDerWaalsContact CA-OH 3.32Å; C371-Y387 WeakPolarHBondContact CA-OH 3.38Å; C371-Y387 PolarHBondContact N-OH 3.45Å; C371-Y387 PolarHBondContact O-OH 3.24Å
372	W	86.6	Confident	76.3	Confident	13 Å²	13	46.2 Å²	46.2	5%	0.049	22%	0.223	C	C	.	.			trans	-70.3	124.4	171.6	175.6	-94.2	0	0	0	112	Y368 R383 M384 Y387	Y368-W372 AromaticContact CE1-CE3 3.66Å; Y368-W372 HydrophobicContact CE1-CE3 3.66Å; Y368-W372 HydrophobicContact CE1-CH2 4.49Å; Y368-W372 AromaticContact CE1-CZ3 3.61Å; Y368-W372 HydrophobicContact CE1-CZ3 3.61Å; Y368-W372 AromaticContact CZ-CE3 3.9Å; Y368-W372 AromaticContact CZ-CZ3 3.9Å; Y368-W372 WeakPolarHBondContact OH-CZ3 3.49Å; W372-R383 HydrophobicContact CH2-CB 4.07Å; W372-M384 HydrophobicContact CB-SD 4.16Å; W372-M384 HydrophobicContact CD2-SD 3.61Å; W372-M384 VanDerWaalsContact CE2-SD 3.56Å; W372-M384 HydrophobicContact CE3-SD 4.46Å; W372-M384 HydrophobicContact CG-CE 4.1Å; W372-M384 HydrophobicContact CG-SD 3.41Å; W372-M384 HydrophobicContact CZ2-SD 4.36Å; W372-M384 PolarHBondContact NE1-SD 3.35Å; W372-M384 VanDerWaalsContact NE1-SD 3.35Å; W372-Y387 HydrophobicContact CB-CD1 3.76Å; W372-Y387 HydrophobicContact CB-CE1 3.71Å; W372-Y387 HydrophobicContact CB-CG 4.5Å; W372-Y387 HydrophobicContact CD2-CG 4.49Å; W372-Y387 AromaticContact CE3-CD1 3.96Å; W372-Y387 HydrophobicContact CE3-CD1 3.96Å; W372-Y387 AromaticContact CE3-CD2 3.95Å; W372-Y387 HydrophobicContact CE3-CD2 3.95Å; W372-Y387 AromaticContact CE3-CG 3.53Å; W372-Y387 HydrophobicContact CE3-CG 3.53Å; W372-Y387 HydrophobicContact CZ3-CD2 4.49Å; W372-Y387 HydrophobicContact CZ3-CG 4.19Å
373	F	77.7	Confident	76.2	Confident	10 Å²	10	46.2 Å²	46.2	4%	0.044	22%	0.219	C	C	.	.			trans	-122.3	110	177.1	-177.5	-100.1	0	0	0	110.7	L233 L277 Y280 V364 I367 Y368 C371 V375	L233-F373 HydrophobicContact CD1-CE2 4.49Å; L233-F373 HydrophobicContact CD2-CD2 4.44Å; L233-F373 HydrophobicContact CD2-CE2 3.54Å; L233-F373 HydrophobicContact CD2-CZ 3.77Å; L277-F373 HydrophobicContact CD1-CD2 4.07Å; Y280-F373 AromaticContact CD1-CE2 3.72Å; Y280-F373 HydrophobicContact CD1-CE2 3.72Å; Y280-F373 HydrophobicContact CD1-CZ 4.21Å; Y280-F373 AromaticContact CE1-CE2 3.43Å; Y280-F373 HydrophobicContact CE1-CE2 3.43Å; Y280-F373 VanDerWaalsContact CE1-CE2 3.43Å; Y280-F373 AromaticContact CE1-CZ 3.44Å; Y280-F373 HydrophobicContact CE1-CZ 3.44Å; Y280-F373 VanDerWaalsContact CE1-CZ 3.44Å; Y280-F373 AromaticContact CZ-CZ 3.84Å; V364-F373 HydrophobicContact CG1-CD1 4.32Å; V364-F373 HydrophobicContact CG2-CD1 4.27Å; V364-F373 HydrophobicContact CG2-CE1 4.24Å; I367-F373 HydrophobicContact CB-CB 4.45Å; I367-F373 HydrophobicContact CD1-CD1 4.43Å; I367-F373 HydrophobicContact CD1-CG 4.4Å; I367-F373 HydrophobicContact CG2-CB 3.64Å; I367-F373 HydrophobicContact CG2-CD2 4.31Å; I367-F373 HydrophobicContact CG2-CG 4.06Å; Y368-F373 HydrophobicContact CD2-CB 4.28Å; Y368-F373 HydrophobicContact CE2-CB 4Å; Y368-F373 WeakPolarHBondContact CE2-O 3.5Å; Y368-F373 PolarHBondContact OH-O 3.48Å; Y368-F373 VanDerWaalsContact OH-O 3.05Å; C371-F373 PolarHBondContact O-N 3.42Å; F373-V375 HydrophobicContact CD1-CG2 3.55Å; F373-V375 HydrophobicContact CE1-CG2 3.79Å; F373-V375 PolarHBondContact O-N 3.43Å; F373-V375 VanDerWaalsContact O-N 3.13Å
374	N	71.8	Confident	76.1	Confident	44 Å²	44	44.5 Å²	44.5	24%	0.235	21%	0.208	C	C	.	.			trans	-76.1	105.4	-169.4	-174.4	18	0	0	0	113.2	K376 P533	N374-K376 PolarHBondContact OD1-O 2.89Å; N374-P533 WeakPolarHBondContact O-CG 3.39Å
375	V	60.8	Low	76.2	Confident	9 Å²	9	48.3 Å²	48.3	6%	0.055	23%	0.231	C	C	.	.			trans	-98.6	-17.6	-179.8	178.9	0	0	0	0	114.9	T348 Y360 V364 F373 P533	T348-V375 HydrophobicContact CG2-CG1 3.77Å; Y360-V375 HydrophobicContact CE1-CG1 3.78Å; V364-V375 HydrophobicContact CB-CG2 4.46Å; V364-V375 HydrophobicContact CG1-CG2 3.67Å; V364-V375 HydrophobicContact CG2-CG2 3.88Å; F373-V375 HydrophobicContact CD1-CG2 3.55Å; F373-V375 HydrophobicContact CE1-CG2 3.79Å; F373-V375 PolarHBondContact O-N 3.43Å; F373-V375 VanDerWaalsContact O-N 3.13Å; V375-P533 WeakPolarHBondContact O-CD 3.44Å
376	K	55	Low	76.3	Confident	41 Å²	41	51.2 Å²	51.2	18%	0.178	25%	0.246	C	C	.	.			trans	-138.1	118.6	-177.7	-169.4	163.3	-177.1	166.9	0	113.3	G346 E347 N374 G378 R383 Y532	G346-K376 WeakPolarHBondContact O-CD 3.3Å; G346-K376 WeakPolarHBondContact O-CE 3.45Å; G346-K376 PolarHBondContact O-NZ 3.01Å; E347-K376 PolarHBondContact O-NZ 3.15Å; E347-K376 IonicContact OE2-NZ 2.89Å; N374-K376 PolarHBondContact OD1-O 2.89Å; K376-G378 PolarHBondContact O-N 3.27Å; K376-R383 PolarHBondContact O-NH2 3.28Å; K376-Y532 HydrophobicContact CB-CD1 4.14Å; K376-Y532 HydrophobicContact CB-CE1 4.27Å; K376-Y532 HydrophobicContact CD-CD1 4.21Å; K376-Y532 HydrophobicContact CD-CE1 3.52Å; K376-Y532 VanDerWaalsContact CE-OH 3.29Å; K376-Y532 WeakPolarHBondContact CE-OH 3.46Å; K376-Y532 HydrophobicContact CG-CD1 3.79Å; K376-Y532 HydrophobicContact CG-CE1 3.62Å; K376-Y532 PolarHBondContact NZ-OH 2.94Å
377	E	50.4	Low	76.3	Confident	56 Å²	56	49.4 Å²	49.4	26%	0.262	24%	0.237	S	C	.	.			trans	-93.4	85.3	-169.1	-125.2	175.8	-151.9	0	0	111.1	R288 K291 K531 P533	R288-E377 IonicContact CZ-OE1 3.07Å; R288-E377 IonicContact CZ-OE2 2.73Å; R288-E377 IonicContact NH1-OE1 2.99Å; R288-E377 PolarHBondContact NH1-OE1 3.45Å; R288-E377 IonicContact NH1-OE2 2.67Å; R288-E377 PolarHBondContact NH1-OE2 3.37Å; R288-E377 IonicContact NH2-OE1 3.97Å; R288-E377 PolarHBondContact NH2-OE1 2.74Å; R288-E377 IonicContact NH2-OE2 2.96Å; K291-E377 IonicContact NZ-OE1 3.21Å; K291-E377 PolarHBondContact NZ-OE1 3.03Å; K291-E377 IonicContact NZ-OE2 3.68Å; K291-E377 PolarHBondContact NZ-OE2 2.73Å; E377-K531 VanDerWaalsContact O-O 3.13Å; E377-P533 HydrophobicContact CB-CB 4.02Å; E377-P533 HydrophobicContact CB-CG 3.66Å; E377-P533 HydrophobicContact CG-CB 3.74Å; E377-P533 HydrophobicContact CG-CG 3.8Å
378	G	48.6	Very low	76.5	Confident	50 Å²	50	49.8 Å²	49.8	52%	0.515	24%	0.238	S	C	.	.	S	Bend	trans	-138.3	-142.7	176.9	0	0	0	0	0	111.6	K376 S380	K376-G378 PolarHBondContact O-N 3.27Å; G378-S380 PolarHBondContact O-N 3.49Å
379	R	50	Low	76.6	Confident	204 Å²	204	52.6 Å²	52.6	77%	0.77	26%	0.259	S	S	*	.	S	Bend	trans	-65.6	68.2	168.3	-73.9	178.8	166.8	138.1	-3	110.7	Y575	R379-Y575 VanDerWaalsContact CZ-OH 3.24Å; R379-Y575 PolarHBondContact NH1-OH 2.73Å; R379-Y575 PolarHBondContact NH2-OH 2.8Å; R379-Y575 VanDerWaalsContact NH2-OH 3.16Å
380	S	60.2	Low	76.7	Confident	35 Å²	35	54.9 Å²	54.9	25%	0.245	27%	0.271	C	S	.	.	H	α-helix	trans	-79.7	-24.3	-170.9	62	0	0	0	0	113.8	G378 H382 R383 M384	G378-S380 PolarHBondContact O-N 3.49Å; S380-H382 VanDerWaalsContact C-N 3.33Å; S380-H382 PolarHBondContact O-N 3.41Å; S380-R383 PolarHBondContact O-N 2.98Å; S380-R383 VanDerWaalsContact O-N 3.15Å; S380-M384 WeakPolarHBondContact O-CB 3.49Å; S380-M384 PolarHBondContact O-N 3.15Å
381	R	72.8	Confident	76.8	Confident	172 Å²	172	54.4 Å²	54.4	65%	0.649	27%	0.269	S	S	*	.	H	α-helix	trans	-49.2	-49.2	-176.6	-65.2	-171.6	-171.4	164.8	2.9	112.6	M384 T385 M445	R381-M384 WeakPolarHBondContact O-CB 3.19Å; R381-M384 PolarHBondContact O-N 3.1Å; R381-T385 PolarHBondContact O-N 2.87Å; R381-T385 PolarHBondContact O-OG1 3.37Å; R381-T385 VanDerWaalsContact O-OG1 3.06Å; R381-M445 PolarHBondContact NH2-SD 2.89Å
382	H	78.4	Confident	77	Confident	131 Å²	131	58.4 Å²	58.4	61%	0.606	29%	0.29	S	S	*	.	H	α-helix	trans	-67.9	-45.4	-179.2	-172.8	41.9	0	0	0	112.7	S380 M384 T385 L386	S380-H382 VanDerWaalsContact C-N 3.33Å; S380-H382 PolarHBondContact O-N 3.41Å; H382-M384 VanDerWaalsContact C-N 3.26Å; H382-M384 PolarHBondContact O-N 3.36Å; H382-T385 PolarHBondContact O-N 3.4Å; H382-L386 WeakPolarHBondContact O-CB 3.39Å; H382-L386 VanDerWaalsContact O-CG 3.3Å; H382-L386 WeakPolarHBondContact O-CG 3.09Å; H382-L386 PolarHBondContact O-N 3.02Å
383	R	82.9	Confident	77.5	Confident	67 Å²	67	63.9 Å²	63.9	25%	0.253	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-36.2	175.6	-63.9	-174	-65.3	157.1	8	112.3	W372 K376 S380 Y387	W372-R383 HydrophobicContact CH2-CB 4.07Å; K376-R383 PolarHBondContact O-NH2 3.28Å; S380-R383 PolarHBondContact O-N 2.98Å; S380-R383 VanDerWaalsContact O-N 3.15Å; R383-Y387 PolarHBondContact O-N 3.02Å
384	M	84.6	Confident	78.3	Confident	13 Å²	13	65.2 Å²	65.2	6%	0.064	33%	0.325	C	S	.	.	H	α-helix	trans	-65.4	-49.3	175.6	-178.4	63.7	159.1	0	0	111.9	W305 W372 S380 R381 H382 Y387 H388 M432 Y436	W305-M384 HydrophobicContact CH2-CE 3.33Å; W305-M384 HydrophobicContact CZ2-CE 3.24Å; W372-M384 HydrophobicContact CB-SD 4.16Å; W372-M384 HydrophobicContact CD2-SD 3.61Å; W372-M384 VanDerWaalsContact CE2-SD 3.56Å; W372-M384 HydrophobicContact CE3-SD 4.46Å; W372-M384 HydrophobicContact CG-CE 4.1Å; W372-M384 HydrophobicContact CG-SD 3.41Å; W372-M384 HydrophobicContact CZ2-SD 4.36Å; W372-M384 PolarHBondContact NE1-SD 3.35Å; W372-M384 VanDerWaalsContact NE1-SD 3.35Å; S380-M384 WeakPolarHBondContact O-CB 3.49Å; S380-M384 PolarHBondContact O-N 3.15Å; R381-M384 WeakPolarHBondContact O-CB 3.19Å; R381-M384 PolarHBondContact O-N 3.1Å; H382-M384 VanDerWaalsContact C-N 3.26Å; H382-M384 PolarHBondContact O-N 3.36Å; M384-Y387 PolarHBondContact O-N 3.27Å; M384-H388 PolarHBondContact O-N 3.4Å; M384-H388 VanDerWaalsContact O-N 3.14Å; M384-H388 PolarHBondContact O-ND1 2.91Å; M384-H388 PolarHBondContact SD-CE1 2.89Å; M384-M432 HydrophobicContact CE-CG 4.5Å; M384-M432 HydrophobicContact CE-SD 3.76Å; M384-Y436 HydrophobicContact CE-CE2 4.24Å
385	T	87.1	Confident	79.5	Confident	81 Å²	81	63.3 Å²	63.3	50%	0.497	32%	0.315	S	S	.	.	H	α-helix	trans	-62.3	-46.7	175.4	-59.9	0	0	0	0	110.9	R381 H382 Y387 H388 C389	R381-T385 PolarHBondContact O-N 2.87Å; R381-T385 PolarHBondContact O-OG1 3.37Å; R381-T385 VanDerWaalsContact O-OG1 3.06Å; H382-T385 PolarHBondContact O-N 3.4Å; T385-Y387 PolarHBondContact O-N 2.91Å; T385-H388 PolarHBondContact O-N 3.34Å; T385-H388 VanDerWaalsContact O-N 3.14Å; T385-C389 WeakPolarHBondContact O-CB 3.46Å; T385-C389 PolarHBondContact O-N 3.45Å; T385-C389 PolarHBondContact O-SG 3.48Å
386	L	90.3	Very high	81.1	Confident	60 Å²	60	65.5 Å²	65.5	31%	0.314	34%	0.335	S	S	.	.	H	α-helix	trans	-55	-48.1	177.2	-75.9	169.9	0	0	0	112	W342 H382 H388 C389 I390	W342-L386 HydrophobicContact CH2-CD1 4.25Å; H382-L386 WeakPolarHBondContact O-CB 3.39Å; H382-L386 VanDerWaalsContact O-CG 3.3Å; H382-L386 WeakPolarHBondContact O-CG 3.09Å; H382-L386 PolarHBondContact O-N 3.02Å; L386-H388 PolarHBondContact O-N 2.99Å; L386-C389 PolarHBondContact O-N 3.49Å; L386-I390 VanDerWaalsContact O-CG1 3.29Å; L386-I390 WeakPolarHBondContact O-CG1 3.42Å; L386-I390 PolarHBondContact O-N 3.21Å
387	Y	91	Very high	83.1	Confident	6 Å²	6	65.6 Å²	65.6	2%	0.024	34%	0.343	C	S	.	.	H	α-helix	trans	-58.5	-47.4	175.7	175.2	-89.7	0	0	0	112.2	M339 Y368 C371 W372 R383 M384 T385 C389 I390 V391	M339-Y387 HydrophobicContact CE-CD2 4.11Å; M339-Y387 HydrophobicContact CE-CE2 4.07Å; M339-Y387 HydrophobicContact SD-CD2 4.24Å; M339-Y387 HydrophobicContact SD-CE2 4.2Å; Y368-Y387 AromaticContact CD1-CD2 3.92Å; Y368-Y387 HydrophobicContact CD1-CD2 3.92Å; Y368-Y387 AromaticContact CD1-CE2 3.77Å; Y368-Y387 HydrophobicContact CD1-CE2 3.77Å; Y368-Y387 HydrophobicContact CE1-CD2 4.22Å; Y368-Y387 HydrophobicContact CE1-CE2 4.44Å; Y368-Y387 HydrophobicContact CG-CE2 4.36Å; Y368-Y387 WeakPolarHBondContact O-CE2 3.44Å; Y368-Y387 PolarHBondContact O-OH 3.35Å; C371-Y387 VanDerWaalsContact CA-OH 3.32Å; C371-Y387 WeakPolarHBondContact CA-OH 3.38Å; C371-Y387 PolarHBondContact N-OH 3.45Å; C371-Y387 PolarHBondContact O-OH 3.24Å; W372-Y387 HydrophobicContact CB-CD1 3.76Å; W372-Y387 HydrophobicContact CB-CE1 3.71Å; W372-Y387 HydrophobicContact CB-CG 4.5Å; W372-Y387 HydrophobicContact CD2-CG 4.49Å; W372-Y387 AromaticContact CE3-CD1 3.96Å; W372-Y387 HydrophobicContact CE3-CD1 3.96Å; W372-Y387 AromaticContact CE3-CD2 3.95Å; W372-Y387 HydrophobicContact CE3-CD2 3.95Å; W372-Y387 AromaticContact CE3-CG 3.53Å; W372-Y387 HydrophobicContact CE3-CG 3.53Å; W372-Y387 HydrophobicContact CZ3-CD2 4.49Å; W372-Y387 HydrophobicContact CZ3-CG 4.19Å; R383-Y387 PolarHBondContact O-N 3.02Å; M384-Y387 PolarHBondContact O-N 3.27Å; T385-Y387 PolarHBondContact O-N 2.91Å; Y387-C389 VanDerWaalsContact C-N 3.32Å; Y387-C389 PolarHBondContact O-N 3.2Å; Y387-I390 PolarHBondContact O-N 2.85Å; Y387-V391 HydrophobicContact CD1-CG2 4.19Å; Y387-V391 HydrophobicContact CD2-CG2 4.45Å; Y387-V391 HydrophobicContact CE1-CG2 3.69Å; Y387-V391 HydrophobicContact CE2-CG2 3.98Å; Y387-V391 WeakPolarHBondContact O-CG2 3.39Å; Y387-V391 PolarHBondContact O-N 3.45Å
388	H	91.8	Very high	85.2	Confident	14 Å²	14	63.3 Å²	63.3	7%	0.065	33%	0.332	C	S	.	.	H	α-helix	trans	-68.4	-30.6	179.9	-72.2	82	0	0	0	112.6	M384 T385 L386 L392 F425 I429	M384-H388 PolarHBondContact O-N 3.4Å; M384-H388 VanDerWaalsContact O-N 3.14Å; M384-H388 PolarHBondContact O-ND1 2.91Å; M384-H388 PolarHBondContact SD-CE1 2.89Å; T385-H388 PolarHBondContact O-N 3.34Å; T385-H388 VanDerWaalsContact O-N 3.14Å; L386-H388 PolarHBondContact O-N 2.99Å; H388-L392 WeakPolarHBondContact O-CB 3.43Å; H388-L392 PolarHBondContact O-N 3.31Å; H388-F425 HydrophobicContact CB-CZ 4.48Å; H388-I429 HydrophobicContact CB-CD1 4.13Å
389	C	94.2	Very high	87.3	Confident	69 Å²	69	61.3 Å²	61.3	47%	0.466	31%	0.31	S	S	.	.	H	α-helix	trans	-68.3	-41.5	171.2	-69.2	0	0	0	0	112.2	T385 L386 Y387 L392 L393	T385-C389 WeakPolarHBondContact O-CB 3.46Å; T385-C389 PolarHBondContact O-N 3.45Å; T385-C389 PolarHBondContact O-SG 3.48Å; L386-C389 PolarHBondContact O-N 3.49Å; Y387-C389 VanDerWaalsContact C-N 3.32Å; Y387-C389 PolarHBondContact O-N 3.2Å; C389-L392 PolarHBondContact O-N 2.97Å; C389-L393 WeakPolarHBondContact O-CB 3.3Å; C389-L393 PolarHBondContact O-N 3.01Å
390	I	94.1	Very high	89.3	Confident	59 Å²	59	53.2 Å²	53.2	30%	0.303	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-50.3	174.7	-69	162.8	0	0	0	110	M339 L386 Y387 L392 L393 E394	M339-I390 HydrophobicContact CE-CG2 4.14Å; L386-I390 VanDerWaalsContact O-CG1 3.29Å; L386-I390 WeakPolarHBondContact O-CG1 3.42Å; L386-I390 PolarHBondContact O-N 3.21Å; Y387-I390 PolarHBondContact O-N 2.85Å; I390-L392 VanDerWaalsContact C-N 3.33Å; I390-L392 PolarHBondContact O-N 2.9Å; I390-L393 PolarHBondContact O-N 2.67Å; I390-E394 HydrophobicContact CG2-CG 4.39Å; I390-E394 WeakPolarHBondContact O-CB 3.11Å; I390-E394 WeakPolarHBondContact O-CG 3.46Å; I390-E394 PolarHBondContact O-N 2.96Å
391	V	94.1	Very high	90.8	Very high	6 Å²	6	57.5 Å²	57.5	4%	0.036	31%	0.305	C	S	.	.	H	α-helix	trans	-64.1	-36.2	179.1	173.3	0	0	0	0	111.9	Y387 N395 F425	Y387-V391 HydrophobicContact CD1-CG2 4.19Å; Y387-V391 HydrophobicContact CD2-CG2 4.45Å; Y387-V391 HydrophobicContact CE1-CG2 3.69Å; Y387-V391 HydrophobicContact CE2-CG2 3.98Å; Y387-V391 WeakPolarHBondContact O-CG2 3.39Å; Y387-V391 PolarHBondContact O-N 3.45Å; V391-N395 WeakPolarHBondContact O-CB 3.5Å; V391-N395 PolarHBondContact O-N 3.42Å; V391-N395 PolarHBondContact O-ND2 3.31Å; V391-N395 PolarHBondContact O-OD1 2.93Å; V391-F425 HydrophobicContact CG1-CE2 3.91Å
392	L	95.4	Very high	91.7	Very high	87 Å²	87	49.4 Å²	49.4	46%	0.455	28%	0.275	S	S	.	.	H	α-helix	trans	-62	-48.8	172.5	175.4	58.5	0	0	0	111.6	H388 C389 I390 N395 A396 F425	H388-L392 WeakPolarHBondContact O-CB 3.43Å; H388-L392 PolarHBondContact O-N 3.31Å; C389-L392 PolarHBondContact O-N 2.97Å; I390-L392 VanDerWaalsContact C-N 3.33Å; I390-L392 PolarHBondContact O-N 2.9Å; L392-N395 PolarHBondContact O-N 3.1Å; L392-A396 VanDerWaalsContact O-CB 3.31Å; L392-A396 WeakPolarHBondContact O-CB 3.18Å; L392-A396 PolarHBondContact O-N 2.87Å; L392-F425 HydrophobicContact CB-CD1 4.47Å; L392-F425 HydrophobicContact CB-CE1 3.75Å; L392-F425 HydrophobicContact CB-CZ 3.97Å; L392-F425 HydrophobicContact CD1-CD1 3.81Å; L392-F425 HydrophobicContact CD1-CE1 3.93Å; L392-F425 HydrophobicContact CD2-CE1 4.4Å; L392-F425 HydrophobicContact CG-CE1 4.23Å
393	L	96.1	Very high	92.2	Very high	128 Å²	128	46.6 Å²	46.6	67%	0.67	26%	0.259	S	S	*	.	H	α-helix	trans	-63.2	-43.9	179.7	179.8	61.2	0	0	0	111.7	C389 I390 A396 A397	C389-L393 WeakPolarHBondContact O-CB 3.3Å; C389-L393 PolarHBondContact O-N 3.01Å; I390-L393 PolarHBondContact O-N 2.67Å; L393-A396 PolarHBondContact O-N 3.02Å; L393-A397 WeakPolarHBondContact O-CB 3.14Å; L393-A397 PolarHBondContact O-N 3.07Å
394	E	95.7	Very high	92.4	Very high	37 Å²	37	47.1 Å²	47.1	17%	0.173	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-45.3	175.2	-73.4	-179.3	165.7	0	0	112.1	R313 F331 H335 I390 A396 A397 L398	R313-E394 IonicContact CZ-OE2 3.62Å; R313-E394 IonicContact NH1-OE2 2.78Å; R313-E394 PolarHBondContact NH1-OE2 2.79Å; R313-E394 IonicContact NH2-OE2 3.2Å; R313-E394 PolarHBondContact NH2-OE2 3.13Å; F331-E394 HydrophobicContact CZ-CG 4.41Å; H335-E394 IonicContact CE1-OE1 2.69Å; H335-E394 PolarHBondContact CE1-OE1 2.96Å; H335-E394 VanDerWaalsContact CE1-OE1 3.23Å; H335-E394 IonicContact CE1-OE2 2.81Å; H335-E394 PolarHBondContact CE1-OE2 2.92Å; H335-E394 IonicContact ND1-OE1 3.59Å; H335-E394 PolarHBondContact ND1-OE1 3.27Å; H335-E394 IonicContact ND1-OE2 3.23Å; H335-E394 PolarHBondContact ND1-OE2 2.82Å; I390-E394 HydrophobicContact CG2-CG 4.39Å; I390-E394 WeakPolarHBondContact O-CB 3.11Å; I390-E394 WeakPolarHBondContact O-CG 3.46Å; I390-E394 PolarHBondContact O-N 2.96Å; E394-A396 VanDerWaalsContact C-N 3.31Å; E394-A396 PolarHBondContact O-N 2.91Å; E394-A397 PolarHBondContact O-N 3.37Å; E394-L398 WeakPolarHBondContact O-CB 3.37Å; E394-L398 WeakPolarHBondContact O-CD1 3.25Å; E394-L398 WeakPolarHBondContact O-CG 3.4Å; E394-L398 PolarHBondContact O-N 3.4Å
395	N	95.8	Very high	92.3	Very high	4 Å²	4	50.7 Å²	50.7	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-39.8	178.5	-70.4	-4.2	0	0	0	111.2	R313 A316 V391 L392 T399	R313-N395 WeakPolarHBondContact CD-OD1 3.22Å; R313-N395 PolarHBondContact NH1-OD1 3.48Å; A316-N395 HydrophobicContact CB-CB 4.14Å; V391-N395 WeakPolarHBondContact O-CB 3.5Å; V391-N395 PolarHBondContact O-N 3.42Å; V391-N395 PolarHBondContact O-ND2 3.31Å; V391-N395 PolarHBondContact O-OD1 2.93Å; L392-N395 PolarHBondContact O-N 3.1Å; N395-T399 WeakPolarHBondContact O-CB 3.5Å; N395-T399 WeakPolarHBondContact O-CG2 3.36Å; N395-T399 PolarHBondContact O-N 2.88Å; N395-T399 PolarHBondContact O-OG1 2.87Å
396	A	95.8	Very high	92	Very high	56 Å²	56	51.7 Å²	51.7	46%	0.463	29%	0.287	S	S	.	.	H	α-helix	trans	-64.7	-40.9	173.2	0	0	0	0	0	112.4	L392 L393 E394 T399 G400	L392-A396 VanDerWaalsContact O-CB 3.31Å; L392-A396 WeakPolarHBondContact O-CB 3.18Å; L392-A396 PolarHBondContact O-N 2.87Å; L393-A396 PolarHBondContact O-N 3.02Å; E394-A396 VanDerWaalsContact C-N 3.31Å; E394-A396 PolarHBondContact O-N 2.91Å; A396-T399 PolarHBondContact O-OG1 3.14Å; A396-G400 WeakPolarHBondContact O-CA 3.36Å; A396-G400 PolarHBondContact O-N 3.03Å
397	A	95.3	Very high	91	Very high	43 Å²	43	55.1 Å²	55.1	36%	0.355	31%	0.306	S	S	.	.	H	α-helix	trans	-66.3	-49.2	175.9	0	0	0	0	0	112	L393 E394 T399 G400 F401	L393-A397 WeakPolarHBondContact O-CB 3.14Å; L393-A397 PolarHBondContact O-N 3.07Å; E394-A397 PolarHBondContact O-N 3.37Å; A397-T399 PolarHBondContact O-N 2.95Å; A397-G400 PolarHBondContact O-N 3.48Å; A397-F401 HydrophobicContact CB-CD2 4.49Å; A397-F401 HydrophobicContact CB-CE2 4.21Å; A397-F401 WeakPolarHBondContact O-CD2 3.38Å; A397-F401 WeakPolarHBondContact O-CG 3.4Å; A397-F401 PolarHBondContact O-N 3.14Å
398	L	94.6	Very high	89.4	Confident	7 Å²	7	61.8 Å²	61.8	4%	0.037	34%	0.335	C	S	.	.	H	α-helix	trans	-60.9	-44.6	-179.8	-69.9	166.4	0	0	0	111.9	F317 F320 F331 E394 W402	F317-L398 HydrophobicContact CD1-CD1 3.9Å; F317-L398 HydrophobicContact CE1-CD1 3.96Å; F320-L398 HydrophobicContact CB-CB 4.18Å; F320-L398 HydrophobicContact CB-CD2 3.97Å; F320-L398 HydrophobicContact CD1-CD2 3.73Å; F320-L398 HydrophobicContact CD2-CB 4.4Å; F320-L398 HydrophobicContact CD2-CD2 3.68Å; F320-L398 HydrophobicContact CE1-CD2 4.09Å; F320-L398 HydrophobicContact CE2-CD2 4.05Å; F320-L398 HydrophobicContact CG-CB 4.43Å; F320-L398 HydrophobicContact CG-CD2 3.51Å; F320-L398 HydrophobicContact CZ-CD2 4.24Å; F331-L398 HydrophobicContact CE1-CD1 4.14Å; F331-L398 HydrophobicContact CE2-CD2 4.5Å; F331-L398 HydrophobicContact CZ-CD1 4.05Å; E394-L398 WeakPolarHBondContact O-CB 3.37Å; E394-L398 WeakPolarHBondContact O-CD1 3.25Å; E394-L398 WeakPolarHBondContact O-CG 3.4Å; E394-L398 PolarHBondContact O-N 3.4Å; L398-W402 PolarHBondContact O-N 3.29Å
399	T	93.4	Very high	87.6	Confident	8 Å²	8	66.7 Å²	66.7	5%	0.049	37%	0.371	C	S	.	.	H	α-helix	trans	-72.8	-33.6	175	53.4	0	0	0	0	112.7	A316 L319 N395 A396 A397 W402 Y403 V421	A316-T399 HydrophobicContact CB-CG2 4.01Å; L319-T399 HydrophobicContact CD1-CG2 4Å; N395-T399 WeakPolarHBondContact O-CB 3.5Å; N395-T399 WeakPolarHBondContact O-CG2 3.36Å; N395-T399 PolarHBondContact O-N 2.88Å; N395-T399 PolarHBondContact O-OG1 2.87Å; A396-T399 PolarHBondContact O-OG1 3.14Å; A397-T399 PolarHBondContact O-N 2.95Å; T399-W402 PolarHBondContact O-N 3.45Å; T399-Y403 VanDerWaalsContact O-CB 3.28Å; T399-Y403 WeakPolarHBondContact O-CB 3.42Å; T399-Y403 PolarHBondContact O-N 3.43Å; T399-V421 HydrophobicContact CG2-CB 4.18Å; T399-V421 HydrophobicContact CG2-CG1 3.95Å; T399-V421 HydrophobicContact CG2-CG2 4Å
400	G	91.7	Very high	85.7	Confident	35 Å²	35	68 Å²	68	36%	0.361	38%	0.377	S	S	.	.	H	α-helix	trans	-65.3	-44.1	175.3	0	0	0	0	0	113	A396 A397 Y403 S404	A396-G400 WeakPolarHBondContact O-CA 3.36Å; A396-G400 PolarHBondContact O-N 3.03Å; A397-G400 PolarHBondContact O-N 3.48Å; G400-Y403 PolarHBondContact O-N 2.82Å; G400-S404 VanDerWaalsContact O-CB 3.32Å; G400-S404 WeakPolarHBondContact O-CB 3.39Å; G400-S404 PolarHBondContact O-N 3.25Å
401	F	91.9	Very high	84.7	Confident	125 Å²	125	67.6 Å²	67.6	55%	0.548	38%	0.375	S	S	.	.	H	α-helix	trans	-63.2	-41.4	173.4	-71.5	-55.3	0	0	0	111.8	F320 Y324 A397 N405	F320-F401 HydrophobicContact CD2-CB 4.38Å; F320-F401 HydrophobicContact CE2-CB 4.15Å; F320-F401 HydrophobicContact CE2-CD2 4.41Å; Y324-F401 HydrophobicContact CE2-CB 4.37Å; A397-F401 HydrophobicContact CB-CD2 4.49Å; A397-F401 HydrophobicContact CB-CE2 4.21Å; A397-F401 WeakPolarHBondContact O-CD2 3.38Å; A397-F401 WeakPolarHBondContact O-CG 3.4Å; A397-F401 PolarHBondContact O-N 3.14Å; F401-N405 PolarHBondContact O-N 3.07Å
402	W	91.3	Very high	84.1	Confident	1 Å²	1	75.7 Å²	75.7	0%	0.004	41%	0.41	C	S	.	.	H	α-helix	trans	-62.4	-44.8	174.4	179.4	85.6	0	0	0	112.4	L319 S322 L398 T399 N405 M417	L319-W402 VanDerWaalsContact C-CD1 3.44Å; L319-W402 HydrophobicContact CB-CD2 4.09Å; L319-W402 HydrophobicContact CB-CG 4Å; L319-W402 HydrophobicContact CD2-CD2 3.98Å; L319-W402 HydrophobicContact CD2-CE3 4.19Å; L319-W402 HydrophobicContact CD2-CH2 3.8Å; L319-W402 HydrophobicContact CD2-CZ2 3.54Å; L319-W402 HydrophobicContact CD2-CZ3 4.11Å; L319-W402 PolarHBondContact O-NE1 2.98Å; S322-W402 PolarHBondContact OG-NE1 2.97Å; S322-W402 VanDerWaalsContact OG-NE1 3.17Å; L398-W402 PolarHBondContact O-N 3.29Å; T399-W402 PolarHBondContact O-N 3.45Å; W402-N405 PolarHBondContact O-N 2.99Å; W402-M417 HydrophobicContact CH2-CB 4.32Å; W402-M417 HydrophobicContact CZ3-CB 4.35Å
403	Y	89	Confident	83.5	Confident	73 Å²	73	76.8 Å²	76.8	29%	0.286	41%	0.409	S	S	.	.	H	α-helix	trans	-66.5	-41.2	178.9	-177.9	-98.1	0	0	0	112.3	T399 G400 N405 R406 F408 L415 V418	T399-Y403 VanDerWaalsContact O-CB 3.28Å; T399-Y403 WeakPolarHBondContact O-CB 3.42Å; T399-Y403 PolarHBondContact O-N 3.43Å; G400-Y403 PolarHBondContact O-N 2.82Å; Y403-N405 PolarHBondContact O-N 3.08Å; Y403-R406 WeakPolarHBondContact O-CB 3.24Å; Y403-R406 PolarHBondContact O-N 3.46Å; Y403-F408 HydrophobicContact CE1-CD1 4.18Å; Y403-F408 HydrophobicContact CE1-CE1 4.26Å; Y403-L415 HydrophobicContact CE2-CB 4.47Å; Y403-V418 HydrophobicContact CD2-CG2 4.03Å; Y403-V418 HydrophobicContact CG-CG2 4.33Å
404	S	87.4	Confident	83.1	Confident	77 Å²	77	70.8 Å²	70.8	54%	0.538	38%	0.378	S	S	.	.	H	α-helix	trans	-64.8	-19.9	176.7	-164.7	0	0	0	0	113.5	G400 R406	G400-S404 VanDerWaalsContact O-CB 3.32Å; G400-S404 WeakPolarHBondContact O-CB 3.39Å; G400-S404 PolarHBondContact O-N 3.25Å; S404-R406 VanDerWaalsContact C-N 3.32Å
405	N	83.4	Confident	82.7	Confident	89 Å²	89	73.3 Å²	73.3	48%	0.476	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	1.5	172.9	-160.8	101.7	0	0	0	112.6	Y324 F401 W402 Y403	Y324-N405 WeakPolarHBondContact OH-CB 3.11Å; Y324-N405 PolarHBondContact OH-OD1 2.73Å; F401-N405 PolarHBondContact O-N 3.07Å; W402-N405 PolarHBondContact O-N 2.99Å; Y403-N405 PolarHBondContact O-N 3.08Å
406	R	78.9	Confident	82.4	Confident	101 Å²	101	77.6 Å²	77.6	38%	0.381	41%	0.414	S	S	.	.	S	Bend	trans	-105.3	145	170.1	-74.6	-72.2	-171.2	133.4	-4.1	109.6	Y403 S404 F408 D411	Y403-R406 WeakPolarHBondContact O-CB 3.24Å; Y403-R406 PolarHBondContact O-N 3.46Å; S404-R406 VanDerWaalsContact C-N 3.32Å; R406-F408 PolarHBondContact O-N 3.24Å; R406-D411 WeakPolarHBondContact CD-OD2 3.3Å; R406-D411 IonicContact CZ-OD2 2.75Å; R406-D411 IonicContact NE-OD2 2.74Å; R406-D411 IonicContact NH1-OD2 3.42Å; R406-D411 PolarHBondContact NH1-OD2 3.41Å
407	N	69.9	Low	82.1	Confident	132 Å²	132	76.1 Å²	76.1	71%	0.706	40%	0.398	S	S	*	.			trans	-66.1	124.9	179	-71.2	-48.9	0	0	0	110.3	S409	N407-S409 PolarHBondContact O-N 3.37Å
408	F	56.8	Low	82	Confident	146 Å²	146	76 Å²	76	64%	0.64	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-21	-171	-65.1	-82.6	0	0	0	115.4	Y403 R406	Y403-F408 HydrophobicContact CE1-CD1 4.18Å; Y403-F408 HydrophobicContact CE1-CE1 4.26Å; R406-F408 PolarHBondContact O-N 3.24Å
409	S	54.3	Low	82	Confident	118 Å²	118	78.9 Å²	78.9	83%	0.825	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-3.2	-162.1	-48.7	0	0	0	0	116.3	N407	N407-S409 PolarHBondContact O-N 3.37Å
410	T	55.8	Low	82	Confident	95 Å²	95	81.5 Å²	81.5	58%	0.583	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.8	-31.4	-171	52.8	0	0	0	0	115.7	F412	T410-F412 PolarHBondContact O-N 3.1Å
411	D	72.1	Confident	82.2	Confident	51 Å²	51	80.1 Å²	80.1	27%	0.273	41%	0.413	S	S	.	.			trans	-98.7	78	-160.9	-69.1	19.2	0	0	0	113.1	R406 Y413 S414	R406-D411 WeakPolarHBondContact CD-OD2 3.3Å; R406-D411 IonicContact CZ-OD2 2.75Å; R406-D411 IonicContact NE-OD2 2.74Å; R406-D411 IonicContact NH1-OD2 3.42Å; R406-D411 PolarHBondContact NH1-OD2 3.41Å; D411-Y413 PolarHBondContact O-N 2.97Å; D411-Y413 VanDerWaalsContact O-N 3.11Å; D411-S414 WeakPolarHBondContact CB-OG 3.33Å; D411-S414 WeakPolarHBondContact O-CB 3.47Å; D411-S414 PolarHBondContact O-N 3.02Å
412	F	82.2	Confident	82.4	Confident	176 Å²	176	77.1 Å²	77.1	77%	0.772	41%	0.411	S	S	*	.	H	α-helix	trans	-49.1	-36.8	170.3	-78.7	-86.3	0	0	0	112.8	T410 S414 L415 I416	T410-F412 PolarHBondContact O-N 3.1Å; F412-S414 VanDerWaalsContact C-N 3.33Å; F412-S414 PolarHBondContact O-N 3.41Å; F412-L415 PolarHBondContact O-N 2.88Å; F412-I416 WeakPolarHBondContact O-CG1 3.33Å; F412-I416 PolarHBondContact O-N 3.4Å
413	Y	82.9	Confident	82.6	Confident	111 Å²	111	80.4 Å²	80.4	44%	0.435	44%	0.435	S	S	.	.	H	α-helix	trans	-57.6	-41.3	175.5	179.1	-94.3	0	0	0	112.8	D411 L415 I416 M417	D411-Y413 PolarHBondContact O-N 2.97Å; D411-Y413 VanDerWaalsContact O-N 3.11Å; Y413-L415 VanDerWaalsContact C-N 3.34Å; Y413-L415 PolarHBondContact O-N 3.24Å; Y413-I416 PolarHBondContact O-N 3.43Å; Y413-M417 HydrophobicContact CD1-CG 4.09Å; Y413-M417 HydrophobicContact CE1-CG 3.67Å; Y413-M417 HydrophobicContact CE1-SD 4.38Å; Y413-M417 HydrophobicContact CE2-CG 4.32Å; Y413-M417 HydrophobicContact CE2-SD 4.28Å; Y413-M417 WeakPolarHBondContact O-CG 3.48Å; Y413-M417 PolarHBondContact O-N 3.14Å
414	S	86.3	Confident	83	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.007	43%	0.426	C	S	.	.	H	α-helix	trans	-65.7	-38.8	-179	-61.3	0	0	0	0	111.6	D411 F412 M417 V418	D411-S414 WeakPolarHBondContact CB-OG 3.33Å; D411-S414 WeakPolarHBondContact O-CB 3.47Å; D411-S414 PolarHBondContact O-N 3.02Å; F412-S414 VanDerWaalsContact C-N 3.33Å; F412-S414 PolarHBondContact O-N 3.41Å; S414-M417 PolarHBondContact O-N 3.47Å; S414-V418 WeakPolarHBondContact O-CG2 3.36Å; S414-V418 PolarHBondContact O-N 2.86Å
415	L	87.9	Confident	83.4	Confident	90 Å²	90	74.6 Å²	74.6	47%	0.471	40%	0.403	S	S	.	.	H	α-helix	trans	-66.9	-42.9	173.3	-174.9	149.7	0	0	0	111.5	Y403 F412 Y413 M417 V418 C419	Y403-L415 HydrophobicContact CE2-CB 4.47Å; F412-L415 PolarHBondContact O-N 2.88Å; Y413-L415 VanDerWaalsContact C-N 3.34Å; Y413-L415 PolarHBondContact O-N 3.24Å; L415-M417 VanDerWaalsContact C-N 3.32Å; L415-M417 PolarHBondContact O-N 2.95Å; L415-V418 PolarHBondContact O-N 2.98Å; L415-C419 PolarHBondContact O-N 2.67Å; L415-C419 PolarHBondContact O-SG 3.41Å; L415-C419 VanDerWaalsContact O-SG 3.36Å
416	I	90.1	Very high	84	Confident	95 Å²	95	73.1 Å²	73.1	49%	0.487	40%	0.403	S	S	.	.	H	α-helix	trans	-56.5	-45.7	175	-69.6	165.1	0	0	0	110.9	F412 Y413 V418 C419 V420	F412-I416 WeakPolarHBondContact O-CG1 3.33Å; F412-I416 PolarHBondContact O-N 3.4Å; Y413-I416 PolarHBondContact O-N 3.43Å; I416-V418 PolarHBondContact O-N 3.33Å; I416-C419 PolarHBondContact O-N 3.09Å; I416-V420 HydrophobicContact CG2-CG2 4.33Å; I416-V420 WeakPolarHBondContact O-CG2 3.34Å; I416-V420 PolarHBondContact O-N 3.21Å
417	M	89.8	Confident	84.8	Confident	25 Å²	25	71.4 Å²	71.4	12%	0.123	40%	0.401	C	S	.	.	H	α-helix	trans	-64.1	-39.5	-179.7	-66.3	-62.7	-79.5	0	0	112.7	V252 L315 L319 W402 Y413 S414 L415 V420 V421	V252-M417 HydrophobicContact CG2-CE 3.93Å; L315-M417 HydrophobicContact CD1-CE 3.88Å; L319-M417 HydrophobicContact CD1-CB 4.46Å; L319-M417 HydrophobicContact CD2-CB 4.32Å; L319-M417 HydrophobicContact CD2-CE 4.04Å; W402-M417 HydrophobicContact CH2-CB 4.32Å; W402-M417 HydrophobicContact CZ3-CB 4.35Å; Y413-M417 HydrophobicContact CD1-CG 4.09Å; Y413-M417 HydrophobicContact CE1-CG 3.67Å; Y413-M417 HydrophobicContact CE1-SD 4.38Å; Y413-M417 HydrophobicContact CE2-CG 4.32Å; Y413-M417 HydrophobicContact CE2-SD 4.28Å; Y413-M417 WeakPolarHBondContact O-CG 3.48Å; Y413-M417 PolarHBondContact O-N 3.14Å; S414-M417 PolarHBondContact O-N 3.47Å; L415-M417 VanDerWaalsContact C-N 3.32Å; L415-M417 PolarHBondContact O-N 2.95Å; M417-V420 PolarHBondContact O-N 3.21Å; M417-V421 PolarHBondContact O-N 3.26Å; M417-V421 VanDerWaalsContact O-N 3.09Å
418	V	92.6	Very high	86	Confident	41 Å²	41	65.1 Å²	65.1	25%	0.248	37%	0.367	C	S	.	.	H	α-helix	trans	-64.2	-44.4	172.9	174.9	0	0	0	0	110.9	Y403 S414 L415 I416 V420 V421 A422	Y403-V418 HydrophobicContact CD2-CG2 4.03Å; Y403-V418 HydrophobicContact CG-CG2 4.33Å; S414-V418 WeakPolarHBondContact O-CG2 3.36Å; S414-V418 PolarHBondContact O-N 2.86Å; L415-V418 PolarHBondContact O-N 2.98Å; I416-V418 PolarHBondContact O-N 3.33Å; V418-V420 VanDerWaalsContact C-N 3.32Å; V418-V420 PolarHBondContact O-N 3.31Å; V418-V421 PolarHBondContact O-N 3.06Å; V418-A422 PolarHBondContact O-N 2.85Å
419	C	93.3	Very high	87.8	Confident	67 Å²	67	60.3 Å²	60.3	45%	0.453	35%	0.348	S	S	.	.	H	α-helix	trans	-61.9	-35.9	175.4	-70.5	0	0	0	0	112.7	L415 I416 S423	L415-C419 PolarHBondContact O-N 2.67Å; L415-C419 PolarHBondContact O-SG 3.41Å; L415-C419 VanDerWaalsContact O-SG 3.36Å; I416-C419 PolarHBondContact O-N 3.09Å; C419-S423 VanDerWaalsContact O-CB 3.23Å; C419-S423 WeakPolarHBondContact O-CB 3.41Å; C419-S423 PolarHBondContact O-N 3.26Å; C419-S423 PolarHBondContact O-OG 3.48Å
420	V	94.4	Very high	89.7	Confident	63 Å²	63	60.2 Å²	60.2	38%	0.382	33%	0.333	S	S	.	.	H	α-helix	trans	-66.6	-42.7	175	170	0	0	0	0	111.4	L315 I416 M417 V418 S423 S424	L315-V420 HydrophobicContact CD2-CB 4.48Å; L315-V420 HydrophobicContact CD2-CG1 3.74Å; I416-V420 HydrophobicContact CG2-CG2 4.33Å; I416-V420 WeakPolarHBondContact O-CG2 3.34Å; I416-V420 PolarHBondContact O-N 3.21Å; M417-V420 PolarHBondContact O-N 3.21Å; V418-V420 VanDerWaalsContact C-N 3.32Å; V418-V420 PolarHBondContact O-N 3.31Å; V420-S423 PolarHBondContact O-OG 2.88Å; V420-S424 VanDerWaalsContact O-CB 3.28Å; V420-S424 WeakPolarHBondContact O-CB 3.45Å; V420-S424 PolarHBondContact O-N 3.16Å; V420-S424 PolarHBondContact O-OG 2.87Å
421	V	95.9	Very high	91.5	Very high	5 Å²	5	57.7 Å²	57.7	3%	0.03	31%	0.314	C	S	.	.	H	α-helix	trans	-63.2	-46.4	174.4	174.7	0	0	0	0	111.5	A312 L315 A316 L319 T399 M417 V418 S424 F425	A312-V421 HydrophobicContact CB-CG1 4.46Å; L315-V421 HydrophobicContact CB-CG2 4.02Å; L315-V421 HydrophobicContact CD2-CG2 3.61Å; L315-V421 HydrophobicContact CG-CG2 3.63Å; A316-V421 HydrophobicContact CB-CG1 4.24Å; L319-V421 HydrophobicContact CD1-CG2 3.9Å; T399-V421 HydrophobicContact CG2-CB 4.18Å; T399-V421 HydrophobicContact CG2-CG1 3.95Å; T399-V421 HydrophobicContact CG2-CG2 4Å; M417-V421 PolarHBondContact O-N 3.26Å; M417-V421 VanDerWaalsContact O-N 3.09Å; V418-V421 PolarHBondContact O-N 3.06Å; V421-S424 PolarHBondContact O-OG 2.96Å; V421-S424 VanDerWaalsContact O-OG 3.11Å; V421-F425 PolarHBondContact O-N 2.91Å
422	A	95.9	Very high	92.4	Very high	62 Å²	62	56.5 Å²	56.5	51%	0.512	31%	0.307	S	S	.	.	H	α-helix	trans	-65.4	-45.8	-179	0	0	0	0	0	112.5	V418 F425 A426	V418-A422 PolarHBondContact O-N 2.85Å; A422-F425 PolarHBondContact O-N 2.81Å; A422-A426 WeakPolarHBondContact O-CB 3.48Å; A422-A426 PolarHBondContact O-N 2.9Å
423	S	96.3	Very high	92.7	Very high	71 Å²	71	50.9 Å²	50.9	50%	0.497	29%	0.289	S	S	.	.	H	α-helix	trans	-70.1	-38.6	-179.6	57.7	0	0	0	0	112.9	C419 V420 A426 L427	C419-S423 VanDerWaalsContact O-CB 3.23Å; C419-S423 WeakPolarHBondContact O-CB 3.41Å; C419-S423 PolarHBondContact O-N 3.26Å; C419-S423 PolarHBondContact O-OG 3.48Å; V420-S423 PolarHBondContact O-OG 2.88Å; S423-A426 PolarHBondContact O-N 3.45Å; S423-L427 VanDerWaalsContact O-CB 3.3Å; S423-L427 WeakPolarHBondContact O-CB 3.47Å; S423-L427 PolarHBondContact O-N 3.3Å
424	S	96.1	Very high	93	Very high	14 Å²	14	47.3 Å²	47.3	10%	0.098	28%	0.279	C	S	.	.	H	α-helix	trans	-64.4	-42.4	173.2	54.4	0	0	0	0	111.7	F308 A312 V420 V421 A426 L427 G428	F308-S424 WeakPolarHBondContact CB-O 3.27Å; A312-S424 WeakPolarHBondContact CB-OG 3.28Å; V420-S424 VanDerWaalsContact O-CB 3.28Å; V420-S424 WeakPolarHBondContact O-CB 3.45Å; V420-S424 PolarHBondContact O-N 3.16Å; V420-S424 PolarHBondContact O-OG 2.87Å; V421-S424 PolarHBondContact O-OG 2.96Å; V421-S424 VanDerWaalsContact O-OG 3.11Å; S424-A426 PolarHBondContact O-N 3.19Å; S424-L427 PolarHBondContact O-N 3.28Å; S424-G428 PolarHBondContact O-N 2.89Å
425	F	96.5	Very high	93	Very high	13 Å²	13	47.7 Å²	47.7	6%	0.057	28%	0.28	C	S	.	.	H	α-helix	trans	-61.5	-46.8	174.7	-168.3	-94.6	0	0	0	111.9	A312 H388 V391 L392 V421 A422 L427 G428 I429	A312-F425 HydrophobicContact CB-CB 3.74Å; A312-F425 HydrophobicContact CB-CD2 4.13Å; A312-F425 HydrophobicContact CB-CG 4.46Å; H388-F425 HydrophobicContact CB-CZ 4.48Å; V391-F425 HydrophobicContact CG1-CE2 3.91Å; L392-F425 HydrophobicContact CB-CD1 4.47Å; L392-F425 HydrophobicContact CB-CE1 3.75Å; L392-F425 HydrophobicContact CB-CZ 3.97Å; L392-F425 HydrophobicContact CD1-CD1 3.81Å; L392-F425 HydrophobicContact CD1-CE1 3.93Å; L392-F425 HydrophobicContact CD2-CE1 4.4Å; L392-F425 HydrophobicContact CG-CE1 4.23Å; V421-F425 PolarHBondContact O-N 2.91Å; A422-F425 PolarHBondContact O-N 2.81Å; F425-L427 VanDerWaalsContact C-N 3.32Å; F425-L427 PolarHBondContact O-N 2.95Å; F425-G428 PolarHBondContact O-N 3.41Å; F425-G428 VanDerWaalsContact O-N 3.16Å; F425-I429 HydrophobicContact CD1-CG1 4Å; F425-I429 HydrophobicContact CE1-CD1 3.95Å; F425-I429 HydrophobicContact CE1-CG1 3.66Å; F425-I429 HydrophobicContact CZ-CD1 4.07Å; F425-I429 HydrophobicContact CZ-CG1 4.24Å; F425-I429 WeakPolarHBondContact O-CG1 3.27Å; F425-I429 PolarHBondContact O-N 2.98Å
426	A	96.6	Very high	92.7	Very high	59 Å²	59	46.7 Å²	46.7	49%	0.488	27%	0.27	S	S	.	.	H	α-helix	trans	-59.7	-40.1	177.5	0	0	0	0	0	112.5	A422 S423 S424 I429 F430	A422-A426 WeakPolarHBondContact O-CB 3.48Å; A422-A426 PolarHBondContact O-N 2.9Å; S423-A426 PolarHBondContact O-N 3.45Å; S424-A426 PolarHBondContact O-N 3.19Å; A426-I429 PolarHBondContact O-N 3.41Å; A426-F430 PolarHBondContact O-N 2.85Å
427	L	96	Very high	92.2	Very high	64 Å²	64	44 Å²	44	34%	0.335	26%	0.259	S	S	.	.	H	α-helix	trans	-67.9	-35.4	176.4	-172.9	57.6	0	0	0	112.2	F308 S423 S424 F425 F430 F431	F308-L427 HydrophobicContact CD1-CD2 3.96Å; F308-L427 HydrophobicContact CD1-CG 4.44Å; F308-L427 HydrophobicContact CD2-CD2 3.9Å; F308-L427 HydrophobicContact CD2-CG 3.82Å; F308-L427 HydrophobicContact CE1-CD2 3.72Å; F308-L427 HydrophobicContact CE2-CD2 3.67Å; F308-L427 HydrophobicContact CE2-CG 4Å; F308-L427 HydrophobicContact CG-CB 4.35Å; F308-L427 HydrophobicContact CG-CD2 4.06Å; F308-L427 HydrophobicContact CG-CG 4.08Å; F308-L427 HydrophobicContact CZ-CD2 3.58Å; F308-L427 HydrophobicContact CZ-CG 4.39Å; S423-L427 VanDerWaalsContact O-CB 3.3Å; S423-L427 WeakPolarHBondContact O-CB 3.47Å; S423-L427 PolarHBondContact O-N 3.3Å; S424-L427 PolarHBondContact O-N 3.28Å; F425-L427 VanDerWaalsContact C-N 3.32Å; F425-L427 PolarHBondContact O-N 2.95Å; L427-F430 HydrophobicContact CD1-CD1 4.09Å; L427-F430 WeakPolarHBondContact O-CB 3.33Å; L427-F430 PolarHBondContact O-N 2.89Å; L427-F431 HydrophobicContact CD1-CD2 3.98Å; L427-F431 HydrophobicContact CD1-CE2 3.53Å; L427-F431 HydrophobicContact CD1-CZ 4.35Å; L427-F431 HydrophobicContact CD2-CE2 4.31Å; L427-F431 HydrophobicContact CG-CD2 3.98Å; L427-F431 HydrophobicContact CG-CE2 3.72Å; L427-F431 VanDerWaalsContact O-CD2 3.23Å; L427-F431 WeakPolarHBondContact O-CD2 3.47Å; L427-F431 PolarHBondContact O-N 3.14Å
428	G	95.4	Very high	91.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.1	-46.9	170.4	0	0	0	0	0	112.5	S424 F425 F430 F431 M432	S424-G428 PolarHBondContact O-N 2.89Å; F425-G428 PolarHBondContact O-N 3.41Å; F425-G428 VanDerWaalsContact O-N 3.16Å; G428-F430 VanDerWaalsContact C-N 3.33Å; G428-F430 PolarHBondContact O-N 3.18Å; G428-F431 PolarHBondContact O-N 3.06Å; G428-M432 PolarHBondContact O-N 3.46Å
429	I	93.9	Very high	90.9	Very high	45 Å²	45	49.3 Å²	49.3	23%	0.231	29%	0.286	C	S	.	.	H	α-helix	trans	-62.7	-37.9	174	-62	-60.5	0	0	0	111.5	H388 F425 A426 M432 C433	H388-I429 HydrophobicContact CB-CD1 4.13Å; F425-I429 HydrophobicContact CD1-CG1 4Å; F425-I429 HydrophobicContact CE1-CD1 3.95Å; F425-I429 HydrophobicContact CE1-CG1 3.66Å; F425-I429 HydrophobicContact CZ-CD1 4.07Å; F425-I429 HydrophobicContact CZ-CG1 4.24Å; F425-I429 WeakPolarHBondContact O-CG1 3.27Å; F425-I429 PolarHBondContact O-N 2.98Å; A426-I429 PolarHBondContact O-N 3.41Å; I429-M432 HydrophobicContact CD1-CE 4.14Å; I429-M432 HydrophobicContact CG2-CE 4.25Å; I429-M432 WeakPolarHBondContact O-CB 3.3Å; I429-M432 PolarHBondContact O-N 3.26Å; I429-C433 PolarHBondContact O-N 3.33Å; I429-C433 PolarHBondContact O-SG 3.01Å; I429-C433 VanDerWaalsContact O-SG 3.36Å
430	F	94.8	Very high	90	Very high	117 Å²	117	47.9 Å²	47.9	51%	0.513	27%	0.273	S	S	.	.	H	α-helix	trans	-60.5	-49.3	173.9	172	-97.7	0	0	0	112	A426 L427 G428 M432 C433 V434	A426-F430 PolarHBondContact O-N 2.85Å; L427-F430 HydrophobicContact CD1-CD1 4.09Å; L427-F430 WeakPolarHBondContact O-CB 3.33Å; L427-F430 PolarHBondContact O-N 2.89Å; G428-F430 VanDerWaalsContact C-N 3.33Å; G428-F430 PolarHBondContact O-N 3.18Å; F430-M432 VanDerWaalsContact C-N 3.33Å; F430-M432 PolarHBondContact O-N 3.1Å; F430-C433 WeakPolarHBondContact O-CB 3.44Å; F430-C433 PolarHBondContact O-N 3.35Å; F430-C433 VanDerWaalsContact O-N 3.16Å; F430-V434 HydrophobicContact CD1-CG2 4.29Å; F430-V434 HydrophobicContact CE1-CG2 3.83Å; F430-V434 HydrophobicContact CE2-CG2 4.08Å; F430-V434 HydrophobicContact CZ-CG2 3.72Å; F430-V434 WeakPolarHBondContact O-CG2 3.39Å; F430-V434 PolarHBondContact O-N 3.02Å
431	F	93.4	Very high	88.4	Confident	41 Å²	41	46.2 Å²	46.2	18%	0.18	26%	0.263	C	S	.	.	H	α-helix	trans	-66.8	-32.2	177.5	-77	-64.4	0	0	0	113.1	L304 W305 F308 L427 G428 V434 Y435	L304-F431 HydrophobicContact CB-CB 4.41Å; L304-F431 HydrophobicContact CB-CD1 4.06Å; L304-F431 HydrophobicContact CB-CD2 3.95Å; L304-F431 HydrophobicContact CB-CE1 4.31Å; L304-F431 HydrophobicContact CB-CE2 4.2Å; L304-F431 HydrophobicContact CB-CG 3.88Å; L304-F431 HydrophobicContact CB-CZ 4.39Å; L304-F431 HydrophobicContact CD1-CD1 4.16Å; L304-F431 HydrophobicContact CD1-CE1 3.74Å; L304-F431 HydrophobicContact CD1-CZ 3.95Å; W305-F431 HydrophobicContact CB-CB 3.83Å; F308-F431 AromaticContact CD2-CD2 3.72Å; F308-F431 HydrophobicContact CD2-CD2 3.72Å; F308-F431 AromaticContact CD2-CE2 3.81Å; F308-F431 HydrophobicContact CD2-CE2 3.81Å; F308-F431 AromaticContact CE2-CD2 4Å; F308-F431 HydrophobicContact CE2-CD2 4Å; F308-F431 AromaticContact CE2-CE2 3.59Å; F308-F431 HydrophobicContact CE2-CE2 3.59Å; L427-F431 HydrophobicContact CD1-CD2 3.98Å; L427-F431 HydrophobicContact CD1-CE2 3.53Å; L427-F431 HydrophobicContact CD1-CZ 4.35Å; L427-F431 HydrophobicContact CD2-CE2 4.31Å; L427-F431 HydrophobicContact CG-CD2 3.98Å; L427-F431 HydrophobicContact CG-CE2 3.72Å; L427-F431 VanDerWaalsContact O-CD2 3.23Å; L427-F431 WeakPolarHBondContact O-CD2 3.47Å; L427-F431 PolarHBondContact O-N 3.14Å; G428-F431 PolarHBondContact O-N 3.06Å; F431-V434 PolarHBondContact O-N 3.08Å; F431-Y435 WeakPolarHBondContact O-CB 3.21Å; F431-Y435 PolarHBondContact O-N 2.84Å
432	M	89.8	Confident	86.7	Confident	27 Å²	27	50.9 Å²	50.9	13%	0.133	29%	0.288	C	S	.	.	H	α-helix	trans	-58.3	-48.2	168.7	-174.9	-171.3	69.5	0	0	111.2	W305 M384 G428 I429 F430 Y435 Y436	W305-M432 HydrophobicContact CD2-CB 3.68Å; W305-M432 HydrophobicContact CD2-CG 3.87Å; W305-M432 HydrophobicContact CE3-CB 4.27Å; W305-M432 HydrophobicContact CE3-CG 4.18Å; W305-M432 HydrophobicContact CG-CB 3.79Å; W305-M432 HydrophobicContact CG-CG 4.49Å; W305-M432 HydrophobicContact CH2-CG 4.1Å; W305-M432 HydrophobicContact CZ2-CB 4.39Å; W305-M432 HydrophobicContact CZ2-CG 3.76Å; W305-M432 HydrophobicContact CZ2-SD 4.01Å; W305-M432 HydrophobicContact CZ3-CG 4.27Å; M384-M432 HydrophobicContact CE-CG 4.5Å; M384-M432 HydrophobicContact CE-SD 3.76Å; G428-M432 PolarHBondContact O-N 3.46Å; I429-M432 HydrophobicContact CD1-CE 4.14Å; I429-M432 HydrophobicContact CG2-CE 4.25Å; I429-M432 WeakPolarHBondContact O-CB 3.3Å; I429-M432 PolarHBondContact O-N 3.26Å; F430-M432 VanDerWaalsContact C-N 3.33Å; F430-M432 PolarHBondContact O-N 3.1Å; M432-Y435 WeakPolarHBondContact O-CB 3.41Å; M432-Y435 PolarHBondContact O-N 3.08Å; M432-Y436 HydrophobicContact CG-CD2 3.81Å; M432-Y436 HydrophobicContact CG-CE2 3.81Å; M432-Y436 VanDerWaalsContact O-CD2 3.29Å; M432-Y436 WeakPolarHBondContact O-CD2 3.31Å; M432-Y436 PolarHBondContact O-N 2.95Å
433	C	88.4	Confident	84.9	Confident	58 Å²	58	49.3 Å²	49.3	39%	0.392	28%	0.278	S	S	.	.	H	α-helix	trans	-64.3	-43.7	177.7	-71.6	0	0	0	0	111.9	I429 F430 Y435 Y436 C437	I429-C433 PolarHBondContact O-N 3.33Å; I429-C433 PolarHBondContact O-SG 3.01Å; I429-C433 VanDerWaalsContact O-SG 3.36Å; F430-C433 WeakPolarHBondContact O-CB 3.44Å; F430-C433 PolarHBondContact O-N 3.35Å; F430-C433 VanDerWaalsContact O-N 3.16Å; C433-Y435 VanDerWaalsContact C-N 3.3Å; C433-Y435 PolarHBondContact O-N 3.26Å; C433-Y436 PolarHBondContact O-N 3.31Å; C433-C437 WeakPolarHBondContact O-CB 3.5Å; C433-C437 PolarHBondContact O-N 2.87Å; C433-C437 PolarHBondContact O-SG 2.74Å; C433-C437 VanDerWaalsContact O-SG 3.38Å
434	V	88.7	Confident	83	Confident	36 Å²	36	49.6 Å²	49.6	22%	0.218	28%	0.278	C	S	.	.	H	α-helix	trans	-58.4	-42.6	173.4	169.8	0	0	0	0	111.3	F430 F431 L438 L439	F430-V434 HydrophobicContact CD1-CG2 4.29Å; F430-V434 HydrophobicContact CE1-CG2 3.83Å; F430-V434 HydrophobicContact CE2-CG2 4.08Å; F430-V434 HydrophobicContact CZ-CG2 3.72Å; F430-V434 WeakPolarHBondContact O-CG2 3.39Å; F430-V434 PolarHBondContact O-N 3.02Å; F431-V434 PolarHBondContact O-N 3.08Å; V434-L438 WeakPolarHBondContact O-CB 3.2Å; V434-L438 PolarHBondContact O-N 3.15Å; V434-L439 HydrophobicContact CG1-CD1 4.18Å
435	Y	86.3	Confident	81	Confident	9 Å²	9	53.3 Å²	53.3	4%	0.035	30%	0.295	C	S	.	.	I	π-helix	trans	-59.9	-54.6	176	173.9	-101.3	0	0	0	111.8	L294 A301 Q302 W305 F431 M432 C433 L439 H440	L294-Y435 HydrophobicContact CD1-CE2 4.12Å; A301-Y435 HydrophobicContact CB-CD2 4.36Å; Q302-Y435 HydrophobicContact CG-CD2 3.86Å; Q302-Y435 HydrophobicContact CG-CE2 3.71Å; Q302-Y435 HydrophobicContact CG-CG 4.36Å; Q302-Y435 PolarHBondContact NE2-OH 3.31Å; W305-Y435 HydrophobicContact CE3-CD1 4.35Å; W305-Y435 HydrophobicContact CZ3-CD1 4.09Å; F431-Y435 WeakPolarHBondContact O-CB 3.21Å; F431-Y435 PolarHBondContact O-N 2.84Å; M432-Y435 WeakPolarHBondContact O-CB 3.41Å; M432-Y435 PolarHBondContact O-N 3.08Å; C433-Y435 VanDerWaalsContact C-N 3.3Å; C433-Y435 PolarHBondContact O-N 3.26Å; Y435-L439 HydrophobicContact CD2-CB 4.43Å; Y435-L439 CarbonylContact O-C 3.41Å; Y435-L439 PolarHBondContact O-N 2.9Å; Y435-L439 VanDerWaalsContact O-N 3.08Å; Y435-H440 PolarHBondContact O-N 3.46Å
436	Y	82.8	Confident	78.8	Confident	68 Å²	68	59.5 Å²	59.5	27%	0.267	33%	0.328	S	S	.	.	I	π-helix	trans	-72.2	-33.4	-176.9	-75.9	-67.9	0	0	0	114.1	W305 M384 M432 C433 M445	W305-Y436 AromaticContact CH2-CE2 3.91Å; W305-Y436 HydrophobicContact CH2-CE2 3.91Å; W305-Y436 AromaticContact CZ3-CE2 3.89Å; W305-Y436 HydrophobicContact CZ3-CE2 3.89Å; M384-Y436 HydrophobicContact CE-CE2 4.24Å; M432-Y436 HydrophobicContact CG-CD2 3.81Å; M432-Y436 HydrophobicContact CG-CE2 3.81Å; M432-Y436 VanDerWaalsContact O-CD2 3.29Å; M432-Y436 WeakPolarHBondContact O-CD2 3.31Å; M432-Y436 PolarHBondContact O-N 2.95Å; C433-Y436 PolarHBondContact O-N 3.31Å; Y436-M445 WeakPolarHBondContact O-CG 3.5Å; Y436-M445 PolarHBondContact O-N 3.34Å
437	C	80.4	Confident	76	Confident	38 Å²	38	59.2 Å²	59.2	26%	0.257	33%	0.331	S	S	.	.	I	π-helix	trans	-83.3	-31.1	-177.4	-67.2	0	0	0	0	113.7	C433 P444	C433-C437 WeakPolarHBondContact O-CB 3.5Å; C433-C437 PolarHBondContact O-N 2.87Å; C433-C437 PolarHBondContact O-SG 2.74Å; C433-C437 VanDerWaalsContact O-SG 3.38Å; C437-P444 WeakPolarHBondContact O-CA 3.35Å; C437-P444 WeakPolarHBondContact O-CB 3.32Å
438	L	78.7	Confident	73.1	Confident	129 Å²	129	61.3 Å²	61.3	68%	0.675	35%	0.351	S	S	*	.	I	π-helix	trans	-124.3	-28.3	-171.5	-58.8	178	0	0	0	115.2	V434	V434-L438 WeakPolarHBondContact O-CB 3.2Å; V434-L438 PolarHBondContact O-N 3.15Å
439	L	75.9	Confident	70.4	Confident	50 Å²	50	69.4 Å²	69.4	26%	0.262	39%	0.389	S	S	.	.	I	π-helix	trans	-116.4	-0.9	-168.5	-61.1	171.1	0	0	0	114	K297 A301 V434 Y435 P441	K297-L439 HydrophobicContact CB-CD2 3.99Å; A301-L439 HydrophobicContact CB-CD1 3.5Å; V434-L439 HydrophobicContact CG1-CD1 4.18Å; Y435-L439 HydrophobicContact CD2-CB 4.43Å; Y435-L439 CarbonylContact O-C 3.41Å; Y435-L439 PolarHBondContact O-N 2.9Å; Y435-L439 VanDerWaalsContact O-N 3.08Å; L439-P441 WeakPolarHBondContact O-CD 3.33Å
440	H	73.3	Confident	67.2	Low	37 Å²	37	71.1 Å²	71.1	17%	0.171	41%	0.41	C	S	.	.			trans	-70.5	123	-177.9	-172.5	-112.5	0	0	0	111	Y435 N442 G443	Y435-H440 PolarHBondContact O-N 3.46Å; H440-N442 PolarHBondContact O-N 2.66Å; H440-G443 PolarHBondContact O-N 3.5Å
441	P	60.8	Low	64.4	Low	27 Å²	27	71.7 Å²	71.7	18%	0.175	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-3.7	-171.5	21.4	-33.3	0	0	0	116.4	R285 L294 L439	R285-P441 VanDerWaalsContact NH2-CG 3.33Å; L294-P441 HydrophobicContact CD1-CG 4Å; L439-P441 WeakPolarHBondContact O-CD 3.33Å
442	N	60.7	Low	61.3	Low	103 Å²	103	73 Å²	73	55%	0.551	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	6.2	171	-61.8	27.6	0	0	0	113	R285 H440	R285-N442 PolarHBondContact NH2-OD1 2.94Å; H440-N442 PolarHBondContact O-N 2.66Å
443	G	57.9	Low	58.3	Low	30 Å²	30	78.1 Å²	78.1	31%	0.309	49%	0.487	S	S	.	.			trans	104.6	160.4	-175.9	0	0	0	0	0	113	H440 M445	H440-G443 PolarHBondContact O-N 3.5Å; G443-M445 PolarHBondContact O-N 2.77Å
444	P	56.7	Low	55.8	Low	77 Å²	77	83.3 Å²	83.3	50%	0.5	51%	0.509	S	S	.	.			trans	-65.1	128.1	179.7	27.8	-34.8	0	0	0	110.9	C437 L446 G447	C437-P444 WeakPolarHBondContact O-CA 3.35Å; C437-P444 WeakPolarHBondContact O-CB 3.32Å; P444-L446 PolarHBondContact O-N 3.26Å; P444-L446 VanDerWaalsContact O-N 3.09Å; P444-G447 PolarHBondContact O-N 2.92Å
445	M	55.2	Low	52.8	Low	91 Å²	91	91.1 Å²	91.1	45%	0.448	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-12.4	175.9	-64.5	-90.6	69.6	0	0	113.4	R381 Y436 G443	R381-M445 PolarHBondContact NH2-SD 2.89Å; Y436-M445 WeakPolarHBondContact O-CG 3.5Å; Y436-M445 PolarHBondContact O-N 3.34Å; G443-M445 PolarHBondContact O-N 2.77Å
446	L	48.4	Very low	50.3	Low	143 Å²	143	102.1 Å²	102.1	75%	0.749	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	23.1	179.3	-143.9	76.1	0	0	0	113	P444 S448	P444-L446 PolarHBondContact O-N 3.26Å; P444-L446 VanDerWaalsContact O-N 3.09Å; L446-S448 PolarHBondContact O-N 3.47Å
447	G	38.6	Very low	47.6	Very low	54 Å²	54	102 Å²	102	56%	0.557	60%	0.602	S	S	*	*			trans	-59	131.4	166.7	0	0	0	0	0	110.4	P444 Q449	P444-G447 PolarHBondContact O-N 2.92Å; G447-Q449 PolarHBondContact O-N 3.2Å
448	S	35.7	Very low	45.1	Very low	107 Å²	107	105 Å²	105	75%	0.748	63%	0.629	S	S	*	*			trans	-59.7	117.6	-168.3	-170.9	0	0	0	0	113.2	L446 A450	L446-S448 PolarHBondContact O-N 3.47Å; S448-A450 PolarHBondContact O-N 3.28Å; S448-A450 VanDerWaalsContact O-N 3.08Å; S448-A450 PolarHBondContact OG-N 3.34Å
449	Q	37.4	Very low	42.6	Very low	171 Å²	171	104.2 Å²	104.2	80%	0.799	64%	0.635	S	S	*	*			trans	-70.1	89.8	147.6	-86.1	-173.5	-32.7	0	0	107.1	G447 P451	G447-Q449 PolarHBondContact O-N 3.2Å; Q449-P451 VanDerWaalsContact O-CD 3.31Å; Q449-P451 WeakPolarHBondContact O-CD 3.42Å
450	A	27.2	Very low	40.3	Very low	80 Å²	80	110.3 Å²	110.3	66%	0.661	66%	0.662	S	S	*	*			trans	-67.8	117.9	172.7	0	0	0	0	0	109	S448 G452	S448-A450 PolarHBondContact O-N 3.28Å; S448-A450 VanDerWaalsContact O-N 3.08Å; S448-A450 PolarHBondContact OG-N 3.34Å; A450-G452 PolarHBondContact O-N 2.92Å
451	P	36.3	Very low	38.2	Very low	130 Å²	130	114.6 Å²	114.6	84%	0.844	69%	0.693	S	S	*	*			trans	-77.3	111.4	-177.5	30.2	-32.7	0	0	0	110.4	Q449	Q449-P451 VanDerWaalsContact O-CD 3.31Å; Q449-P451 WeakPolarHBondContact O-CD 3.42Å
452	G	28.7	Very low	36.7	Very low	69 Å²	69	119.4 Å²	119.4	71%	0.711	73%	0.726	S	S	*	*			trans	92.8	111.3	164.3	0	0	0	0	0	115.8	A450	A450-G452 PolarHBondContact O-N 2.92Å
453	C	25.7	Very low	35.4	Very low	134 Å²	134	117.5 Å²	117.5	91%	0.905	73%	0.731	S	S	*	*				-153.6	110.6	121.5	-125.1	0	0	0	0	108.9	F455	C453-F455 PolarHBondContact O-N 2.88Å
454	I	35.7	Very low	34.3	Very low	166 Å²	166	121.9 Å²	121.9	85%	0.851	75%	0.754	S	S	*	*			trans	-78.5	104.4	176.8	-61.7	171	0	0	0	107.7
455	F	27.3	Very low	33.1	Very low	200 Å²	200	124 Å²	124	88%	0.877	77%	0.768	S	S	*	*			trans	-137.2	108.4	157.8	-132.7	-89.6	0	0	0	110.9	C453 G457	C453-F455 PolarHBondContact O-N 2.88Å; F455-G457 VanDerWaalsContact C-N 3.26Å; F455-G457 PolarHBondContact O-N 3.41Å
456	R	32.6	Very low	32.4	Very low	240 Å²	240	124.5 Å²	124.5	91%	0.906	79%	0.786	S	S	*	*			trans	-80.6	73.9	-179.5	-171.9	177.5	-177.3	158.9	0.5	109.5	A458	R456-A458 PolarHBondContact O-N 2.92Å
457	G	26.8	Very low	31.9	Very low	66 Å²	66	125.1 Å²	125.1	68%	0.68	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-57.3	123.9	168.5	0	0	0	0	0	109.6	F455	F455-G457 VanDerWaalsContact C-N 3.26Å; F455-G457 PolarHBondContact O-N 3.41Å
458	A	27.6	Very low	31.5	Very low	100 Å²	100	126.3 Å²	126.3	83%	0.826	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-70.4	134	179.7	0	0	0	0	0	110.1	R456 E460	R456-A458 PolarHBondContact O-N 2.92Å; A458-E460 PolarHBondContact O-N 2.64Å
459	S	26.6	Very low	31.4	Very low	114 Å²	114	128.7 Å²	128.7	80%	0.797	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-76	119.2	173.5	52.2	0	0	0	0	110.3
460	E	28.2	Very low	31	Very low	177 Å²	177	126.4 Å²	126.4	83%	0.827	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-63.7	140.1	161.9	-67.6	-168.2	127.7	0	0	109.9	A458 C462	A458-E460 PolarHBondContact O-N 2.64Å; E460-C462 PolarHBondContact O-N 2.94Å
461	P	28.9	Very low	31.2	Very low	127 Å²	127	127.4 Å²	127.4	83%	0.825	80%	0.797	S	S	*	*			trans	-77.7	92.5	-178.8	30.9	-34.1	0	0	0	111.2	G463	P461-G463 PolarHBondContact O-N 3.13Å
462	C	29.1	Very low	31	Very low	129 Å²	129	126.4 Å²	126.4	87%	0.872	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-57.8	125.3	165.8	-80.5	0	0	0	0	110.6	E460	E460-C462 PolarHBondContact O-N 2.94Å
463	G	32.8	Very low	31.1	Very low	63 Å²	63	129.1 Å²	129.1	65%	0.649	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-68.8	167.1	178.7	0	0	0	0	0	114	P461	P461-G463 PolarHBondContact O-N 3.13Å
464	P	34.7	Very low	31.2	Very low	122 Å²	122	134.4 Å²	134.4	79%	0.792	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-65.7	155.5	179.4	29	-35.8	0	0	0	112.3	A466	P464-A466 PolarHBondContact O-N 2.93Å
465	P	32.6	Very low	30.8	Very low	122 Å²	122	131.8 Å²	131.8	79%	0.792	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-65.5	130.5	-178.1	26.9	-34.9	0	0	0	112	D467	P465-D467 PolarHBondContact O-N 2.86Å
466	A	40.4	Very low	31	Very low	100 Å²	100	130.2 Å²	130.2	83%	0.826	79%	0.793	S	S	*	*	S	Bend	trans	-77.8	81.3	175.1	0	0	0	0	0	111.4	P464	P464-A466 PolarHBondContact O-N 2.93Å
467	D	37.2	Very low	30.8	Very low	157 Å²	157	124.8 Å²	124.8	84%	0.84	79%	0.789	S	S	*	*			trans	-157.8	55.6	159.1	-106.9	-25.8	0	0	0	110.9	P465	P465-D467 PolarHBondContact O-N 2.86Å
468	A	31.2	Very low	30.8	Very low	78 Å²	78	133.2 Å²	133.2	65%	0.645	80%	0.8	S	S	*	*			trans	-115	83.3	174.8	0	0	0	0	0	110.3	T470	A468-T470 PolarHBondContact O-N 3.5Å
469	I	32.2	Very low	30.9	Very low	158 Å²	158	134.2 Å²	134.2	81%	0.81	80%	0.796	S	S	*	*			trans	-77.2	75.1	171.1	-54.1	179.4	0	0	0	108.8	S471	I469-S471 PolarHBondContact O-N 3.11Å; I469-S471 VanDerWaalsContact O-N 3.11Å
470	T	28.6	Very low	31	Very low	123 Å²	123	135.7 Å²	135.7	76%	0.755	80%	0.801	S	S	*	*			trans	-75.1	89.9	168.4	39.3	0	0	0	0	109.6	A468	A468-T470 PolarHBondContact O-N 3.5Å
471	S	31.2	Very low	30.8	Very low	101 Å²	101	130.6 Å²	130.6	71%	0.706	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-62.3	126.8	163.8	44.2	0	0	0	0	109.2	I469	I469-S471 PolarHBondContact O-N 3.11Å; I469-S471 VanDerWaalsContact O-N 3.11Å
472	P	34.1	Very low	30.7	Very low	109 Å²	109	129.2 Å²	129.2	71%	0.708	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-68.2	145.3	179.4	27.7	-34.1	0	0	0	110.3	R474	P472-R474 PolarHBondContact O-N 3.31Å
473	P	29.9	Very low	30.6	Very low	126 Å²	126	130.8 Å²	130.8	82%	0.818	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-65.4	118.3	179.2	26.9	-33.7	0	0	0	110.2	S475	P473-S475 PolarHBondContact O-N 3.06Å; P473-S475 VanDerWaalsContact O-N 3.12Å
474	R	27.7	Very low	30.4	Very low	244 Å²	244	136.3 Å²	136.3	92%	0.921	79%	0.79	S	S	*	*			trans	-69	106.2	170.1	-78.7	-175	168.9	121.3	-4	109.3	P472	P472-R474 PolarHBondContact O-N 3.31Å
475	S	27.1	Very low	30	Very low	112 Å²	112	137 Å²	137	78%	0.783	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-64.5	141.9	163.1	43.5	0	0	0	0	110.2	P473	P473-S475 PolarHBondContact O-N 3.06Å; P473-S475 VanDerWaalsContact O-N 3.12Å
476	L	30.6	Very low	29.8	Very low	166 Å²	166	134.4 Å²	134.4	87%	0.869	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-78.6	129.5	179.8	-67.5	164.5	0	0	0	110.2	R478	L476-R478 PolarHBondContact O-N 3.2Å
477	P	29.4	Very low	29.1	Very low	127 Å²	127	134.6 Å²	134.6	83%	0.825	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-72.5	123.4	165.9	29.9	-31.5	0	0	0	109.4
478	R	26.2	Very low	28.5	Very low	242 Å²	242	132.2 Å²	132.2	91%	0.913	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-99	159.5	166.2	-145.1	173.9	-175.7	114.7	-1.9	109.1	L476	L476-R478 PolarHBondContact O-N 3.2Å
479	T	30.9	Very low	28.2	Very low	121 Å²	121	133.7 Å²	133.7	74%	0.742	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-77.1	173.6	-164.7	46.3	0	0	0	0	115.4
480	T	27.4	Very low	28	Very low	146 Å²	146	129.5 Å²	129.5	90%	0.896	79%	0.788	S	S	*	*			trans	77.4	144.1	178.4	73.1	0	0	0	0	115.8
481	G	25	Very low	27.9	Very low	69 Å²	69	131 Å²	131	71%	0.711	79%	0.786	S	S	*	*			cis	151.5	133	-13.1	0	0	0	0	0	112.9
482	A	26.4	Very low	27.7	Very low	98 Å²	98	137.1 Å²	137.1	81%	0.81	79%	0.794	S	S	*	*			trans	61.7	162.9	-173.2	0	0	0	0	0	113.4
483	E	26.7	Very low	27.3	Very low	162 Å²	162	137 Å²	137	76%	0.757	80%	0.802	S	S	*	*			cis	-163.8	166.4	-16.1	-108.8	-164.2	132.6	0	0	105.2
484	R	29.4	Very low	27.2	Very low	180 Å²	180	134.7 Å²	134.7	68%	0.679	80%	0.801	S	S	*	*			cis	-179.9	165.8	-8.7	-178.1	-178.6	142.7	154.1	2.5	110.2
485	D	26.8	Very low	27.3	Very low	137 Å²	137	130 Å²	130	73%	0.733	80%	0.8	S	S	*	*			trans	62.2	153.1	168.3	-61.6	-38.1	0	0	0	116.4
486	G	26.4	Very low	27.6	Very low	67 Å²	67	130.3 Å²	130.3	69%	0.691	80%	0.799	S	S	*	*			cis	171.2	151.4	-12.2	0	0	0	0	0	113.2
487	A	26.4	Very low	27.6	Very low	103 Å²	103	129.1 Å²	129.1	85%	0.851	80%	0.799	S	S	*	*			trans	63.9	159.5	164.8	0	0	0	0	0	119.4
488	S	24.5	Very low	28.2	Very low	108 Å²	108	128.2 Å²	128.2	76%	0.755	79%	0.793	S	S	*	*			cis	-172.8	148.2	-25.9	54.9	0	0	0	0	112.3
489	A	26.3	Very low	28.9	Very low	108 Å²	108	122.4 Å²	122.4	89%	0.893	79%	0.787	S	S	*	*			trans	63.2	158.6	162.3	0	0	0	0	0	118.8
490	G	26.5	Very low	28.8	Very low	71 Å²	71	122 Å²	122	73%	0.732	78%	0.784	S	S	*	*			cis	179.6	160.5	-8.7	0	0	0	0	0	115.4
491	E	26.5	Very low	29	Very low	154 Å²	154	124.4 Å²	124.4	72%	0.72	78%	0.782	S	S	*	*			trans	59.8	131.5	157.5	-72.2	-154.7	73.3	0	0	126.4
492	R	28.3	Very low	29.2	Very low	229 Å²	229	129.7 Å²	129.7	86%	0.864	79%	0.789	S	S	*	*			trans	80	164.1	141.2	-82.5	178.3	162.7	126.7	-9.1	121
493	A	25.5	Very low	29.5	Very low	107 Å²	107	131.3 Å²	131.3	88%	0.884	79%	0.788	S	S	*	*			trans	-144	160.1	-149.3	0	0	0	0	0	114
494	G	28	Very low	29.7	Very low	77 Å²	77	134.4 Å²	134.4	79%	0.794	79%	0.793	S	S	*	*			trans	-148.9	146.9	174.3	0	0	0	0	0	111.9
495	T	28.7	Very low	29.7	Very low	145 Å²	145	132 Å²	132	89%	0.89	80%	0.801	S	S	*	*			trans	-67.5	155.4	-165.9	36	0	0	0	0	117.1
496	P	33.9	Very low	29.8	Very low	119 Å²	119	128.9 Å²	128.9	77%	0.773	80%	0.8	S	S	*	*			trans	-104.2	159.5	-177.6	40	-34.9	0	0	0	115.5
497	T	31.5	Very low	30.3	Very low	142 Å²	142	133.5 Å²	133.5	87%	0.871	81%	0.808	S	S	*	*			trans	-144.7	159.5	163.1	31.6	0	0	0	0	111.8
498	P	41.9	Very low	30.7	Very low	107 Å²	107	133.6 Å²	133.6	70%	0.695	80%	0.8	S	S	*	*			trans	-116.2	-170.8	-156.4	46.9	-35.6	0	0	0	113.2
499	P	39.8	Very low	31.2	Very low	121 Å²	121	134.3 Å²	134.3	79%	0.786	80%	0.802	S	S	*	*				-132.5	163.1	69.6	36.2	-21.1	0	0	0	115.1
500	V	30.1	Very low	31.4	Very low	112 Å²	112	134.8 Å²	134.8	68%	0.679	79%	0.794	S	S	*	*			trans	-97	130.5	178	173.1	0	0	0	0	110.7	Q502	V500-Q502 HydrophobicContact CG1-CG 3.85Å
501	F	30.5	Very low	31.7	Very low	197 Å²	197	137.3 Å²	137.3	86%	0.864	80%	0.798	S	S	*	*			trans	-107.8	110.4	156.1	-101.1	-87	0	0	0	109.3
502	Q	29.7	Very low	32.1	Very low	180 Å²	180	136 Å²	136	84%	0.841	80%	0.8	S	S	*	*			trans	-77.9	127.3	172.4	-72.8	-177.9	-14.2	0	0	110.1	V500	V500-Q502 HydrophobicContact CG1-CG 3.85Å
503	V	31.6	Very low	32.2	Very low	132 Å²	132	129.2 Å²	129.2	80%	0.8	79%	0.793	S	S	*	*			trans	-108.9	134.3	162.4	-179.2	0	0	0	0	107.6
504	R	30.8	Very low	32.5	Very low	227 Å²	227	135.5 Å²	135.5	86%	0.857	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-57	139	177.5	-80.4	179.1	168.5	141.7	-4.3	110.5	G506	R504-G506 PolarHBondContact O-N 3.34Å; R504-G506 VanDerWaalsContact O-N 3.15Å
505	P	31.1	Very low	32.4	Very low	130 Å²	130	138 Å²	138	84%	0.844	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-55.7	120	161.6	-22.3	33.6	0	0	0	109.4
506	G	28.8	Very low	32.5	Very low	70 Å²	70	136.1 Å²	136.1	72%	0.722	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.7	134.8	173	0	0	0	0	0	110.1	R504	R504-G506 PolarHBondContact O-N 3.34Å; R504-G506 VanDerWaalsContact O-N 3.15Å
507	L	35.2	Very low	32.5	Very low	164 Å²	164	139.7 Å²	139.7	86%	0.859	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-59.6	134.8	171.8	-149.9	72.8	0	0	0	108.5
508	P	36.3	Very low	32.8	Very low	106 Å²	106	138.3 Å²	138.3	69%	0.688	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-58.5	133.2	176.5	23.8	-33.9	0	0	0	109.4	T510	P508-T510 PolarHBondContact O-N 3.25Å
509	P	34.7	Very low	33	Very low	123 Å²	123	140.3 Å²	140.3	80%	0.799	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-62	126.1	-179.9	25.5	-33.3	0	0	0	109.1
510	T	31	Very low	33.7	Very low	117 Å²	117	135 Å²	135	72%	0.718	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-57.2	132.8	173.9	37.7	0	0	0	0	109	P508 V512	P508-T510 PolarHBondContact O-N 3.25Å; T510-V512 VanDerWaalsContact C-N 3.29Å; T510-V512 PolarHBondContact O-N 2.89Å
511	P	32.6	Very low	35.2	Very low	125 Å²	125	131.8 Å²	131.8	81%	0.812	73%	0.725	S	S	*	*			trans	-70.3	90.3	179.4	28.3	-33.8	0	0	0	109	A513	P511-A513 PolarHBondContact O-N 3.46Å
512	V	34.4	Very low	36.5	Very low	125 Å²	125	125.7 Å²	125.7	76%	0.758	70%	0.704	S	S	*	*			trans	-56	111.4	166.7	177.3	0	0	0	0	106.3	T510 R514	T510-V512 VanDerWaalsContact C-N 3.29Å; T510-V512 PolarHBondContact O-N 2.89Å; V512-R514 VanDerWaalsContact C-N 3.33Å; V512-R514 PolarHBondContact O-N 2.88Å
513	A	29.8	Very low	38.1	Very low	87 Å²	87	118 Å²	118	72%	0.719	67%	0.668	S	S	*	*			trans	-62	97.4	178	0	0	0	0	0	108.4	P511 T515	P511-A513 PolarHBondContact O-N 3.46Å; A513-T515 PolarHBondContact O-N 3.29Å
514	R	31.2	Very low	39.3	Very low	239 Å²	239	120.3 Å²	120.3	90%	0.902	66%	0.662	S	S	*	*			trans	-55.3	107.6	162.3	-76.6	-175.5	170.6	117.1	-6.1	105.5	V512 S516	V512-R514 VanDerWaalsContact C-N 3.33Å; V512-R514 PolarHBondContact O-N 2.88Å; R514-S516 PolarHBondContact O-N 3.16Å
515	T	27.2	Very low	40.8	Very low	130 Å²	130	110 Å²	110	80%	0.798	63%	0.625	S	S	*	*			trans	-53.7	120.2	173.5	38.9	0	0	0	0	107	A513 R517	A513-T515 PolarHBondContact O-N 3.29Å; T515-R517 PolarHBondContact O-N 3.43Å
516	S	29.6	Very low	41.8	Very low	106 Å²	106	108.1 Å²	108.1	74%	0.741	61%	0.607	S	S	*	*			trans	-59.2	107.8	178.7	38.5	0	0	0	0	106.9	R514 T518	R514-S516 PolarHBondContact O-N 3.16Å; S516-T518 VanDerWaalsContact C-N 3.28Å; S516-T518 PolarHBondContact O-N 2.76Å; S516-T518 PolarHBondContact O-OG1 2.93Å
517	R	35.1	Very low	43	Very low	193 Å²	193	107.4 Å²	107.4	73%	0.728	59%	0.586	S	S	*	*			trans	-67.7	94.2	179.7	-172.3	-173.4	-158	172.3	9.9	106.4	T515 E519	T515-R517 PolarHBondContact O-N 3.43Å; R517-E519 WeakPolarHBondContact O-CG 3.42Å; R517-E519 PolarHBondContact O-N 3.47Å
518	T	36.8	Very low	43.8	Very low	114 Å²	114	102.3 Å²	102.3	70%	0.699	56%	0.563	S	S	*	*			trans	-58.7	99.6	-173.3	-39.9	0	0	0	0	109.2	S516 G520	S516-T518 VanDerWaalsContact C-N 3.28Å; S516-T518 PolarHBondContact O-N 2.76Å; S516-T518 PolarHBondContact O-OG1 2.93Å; T518-G520 PolarHBondContact O-N 3.29Å
519	E	47	Very low	44.6	Very low	149 Å²	149	102.8 Å²	102.8	70%	0.696	55%	0.551	S	S	*	*			trans	-68.6	110.2	179.7	-63.4	-146.1	115.2	0	0	107.9	R517	R517-E519 WeakPolarHBondContact O-CG 3.42Å; R517-E519 PolarHBondContact O-N 3.47Å
520	G	54.4	Low	45.4	Very low	8 Å²	8	100.8 Å²	100.8	8%	0.082	53%	0.53	C	S	.	.			trans	-59.4	149.3	179.8	0	0	0	0	0	111.2	T518 V522	T518-G520 PolarHBondContact O-N 3.29Å; G520-V522 PolarHBondContact O-N 2.96Å; G520-V522 VanDerWaalsContact O-N 3.1Å
521	P	60.6	Low	46.3	Very low	46 Å²	46	103.7 Å²	103.7	30%	0.299	53%	0.533	S	S	.	.			trans	-52.5	119.3	-172.2	19.8	-32	0	0	0	111.2	I523 S555 P559 R560	P521-I523 PolarHBondContact O-N 3.5Å; P521-S555 WeakPolarHBondContact CD-OG 3.47Å; P521-P559 HydrophobicContact CG-CB 4.27Å; P521-P559 CarbonylContact O-C 3.54Å; P521-P559 WeakPolarHBondContact O-CA 3.19Å; P521-P559 WeakPolarHBondContact O-CB 3.44Å; P521-R560 PolarHBondContact O-N 3.32Å
522	V	58.4	Low	47.1	Very low	69 Å²	69	99.9 Å²	99.9	42%	0.418	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	108.6	-178.5	-175.8	0	0	0	0	108.8	G520 R524 R560 Q562	G520-V522 PolarHBondContact O-N 2.96Å; G520-V522 VanDerWaalsContact O-N 3.1Å; V522-R524 HydrophobicContact CG1-CG 4.14Å; V522-R524 PolarHBondContact O-N 2.87Å; V522-R560 CarbonylContact C-O 3.54Å; V522-R560 WeakPolarHBondContact CA-O 3.25Å; V522-R560 HydrophobicContact CG2-CB 4.28Å; V522-Q562 HydrophobicContact CG1-CB 3.64Å
523	I	63.8	Low	47.9	Very low	18 Å²	18	94.1 Å²	94.1	9%	0.092	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	99.8	170.6	-60	172.7	0	0	0	106.6	P521 I525 L544 I548 L551 P559 R560 L561 Q562	P521-I523 PolarHBondContact O-N 3.5Å; I523-I525 HydrophobicContact CG2-CG1 4.32Å; I523-L544 HydrophobicContact CG2-CD1 4.04Å; I523-I548 HydrophobicContact CD1-CB 4.4Å; I523-I548 HydrophobicContact CD1-CG1 3.6Å; I523-L551 HydrophobicContact CD1-CD1 3.54Å; I523-L551 HydrophobicContact CG1-CD1 3.63Å; I523-P559 HydrophobicContact CD1-CB 3.55Å; I523-P559 HydrophobicContact CD1-CG 3.99Å; I523-P559 HydrophobicContact CG1-CB 3.9Å; I523-R560 PolarHBondContact N-O 3.48Å; I523-L561 HydrophobicContact CB-CD2 3.98Å; I523-L561 HydrophobicContact CD1-CD2 4.22Å; I523-L561 HydrophobicContact CG2-CD2 4.03Å; I523-L561 WeakPolarHBondContact O-CA 3.33Å; I523-Q562 PolarHBondContact O-N 3.45Å
524	R	57.2	Low	49	Very low	180 Å²	180	90.1 Å²	90.1	68%	0.679	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	130.3	169.5	-71.5	-174.8	173.6	164.4	3.4	109.4	V522 Q562	V522-R524 HydrophobicContact CG1-CG 4.14Å; V522-R524 PolarHBondContact O-N 2.87Å; R524-Q562 WeakPolarHBondContact CA-O 3.44Å; R524-Q562 HydrophobicContact CG-CB 4.3Å
525	I	62.5	Low	50.4	Low	12 Å²	12	79.7 Å²	79.7	6%	0.062	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	109.5	174.6	-60.5	166.7	0	0	0	106	I523 L527 L544 L561 Q562 Y563 R564	I523-I525 HydrophobicContact CG2-CG1 4.32Å; I525-L527 HydrophobicContact CG2-CB 4.08Å; I525-L527 PolarHBondContact O-N 2.91Å; I525-L527 VanDerWaalsContact O-N 3.17Å; I525-L527 VanDerWaalsContact O-O 3.07Å; I525-L544 HydrophobicContact CD1-CD2 3.82Å; I525-L544 HydrophobicContact CG1-CD2 4.06Å; I525-L561 HydrophobicContact CD1-CB 4.44Å; I525-L561 HydrophobicContact CD1-CD2 3.82Å; I525-Q562 PolarHBondContact N-O 2.88Å; I525-Y563 HydrophobicContact CB-CD1 3.91Å; I525-Y563 HydrophobicContact CB-CE1 4.24Å; I525-Y563 HydrophobicContact CD1-CD1 3.92Å; I525-Y563 HydrophobicContact CD1-CE1 3.49Å; I525-Y563 VanDerWaalsContact CD1-CE1 3.49Å; I525-Y563 HydrophobicContact CG1-CE1 4.48Å; I525-Y563 HydrophobicContact CG2-CD1 3.91Å; I525-Y563 HydrophobicContact CG2-CE1 4.05Å; I525-R564 PolarHBondContact O-N 2.88Å; I525-R564 VanDerWaalsContact O-N 3.13Å
526	D	51.5	Low	52.2	Low	90 Å²	90	74.6 Å²	74.6	48%	0.481	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-8	-173.6	-64.9	-51.6	0	0	0	114.2	R564	D526-R564 WeakPolarHBondContact O-CD 3.46Å
527	L	54.5	Low	53.9	Low	54 Å²	54	70.8 Å²	70.8	28%	0.283	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	139.5	165.5	-88.7	68.5	0	0	0	110.3	M352 I525 R564	M352-L527 HydrophobicContact CE-CD1 3.99Å; M352-L527 HydrophobicContact CE-CD2 3.7Å; M352-L527 HydrophobicContact SD-CD1 4.49Å; M352-L527 HydrophobicContact SD-CD2 4.32Å; I525-L527 HydrophobicContact CG2-CB 4.08Å; I525-L527 PolarHBondContact O-N 2.91Å; I525-L527 VanDerWaalsContact O-N 3.17Å; I525-L527 VanDerWaalsContact O-O 3.07Å; L527-R564 PolarHBondContact O-N 3.02Å
528	P	52	Low	55.5	Low	58 Å²	58	61.8 Å²	61.8	38%	0.377	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	147.5	170.9	27.4	-34.8	0	0	0	110.5	K530 R564 V566	P528-K530 VanDerWaalsContact C-N 3.28Å; P528-K530 PolarHBondContact O-N 2.89Å; P528-R564 CarbonylContact C-O 3.57Å; P528-R564 VanDerWaalsContact CA-O 3.25Å; P528-R564 WeakPolarHBondContact CA-O 3.47Å; P528-V566 HydrophobicContact CB-CG2 4Å
529	R	52.2	Low	57	Low	115 Å²	115	56.4 Å²	56.4	43%	0.434	27%	0.271	S	S	.	.			trans	-68.1	88.5	174.7	-158.2	-180	-155.9	-164.6	-172.9	111	D290 K531 Y563 R564	D290-R529 VanDerWaalsContact CG-NH2 3.34Å; D290-R529 IonicContact OD1-CZ 2.7Å; D290-R529 VanDerWaalsContact OD1-CZ 3.22Å; D290-R529 IonicContact OD1-NH1 3.7Å; D290-R529 PolarHBondContact OD1-NH1 3.34Å; D290-R529 IonicContact OD1-NH2 3.04Å; D290-R529 PolarHBondContact OD1-NH2 2.82Å; D290-R529 IonicContact OD2-CZ 3.2Å; D290-R529 IonicContact OD2-NH1 2.8Å; D290-R529 PolarHBondContact OD2-NH1 3.41Å; D290-R529 IonicContact OD2-NH2 2.75Å; D290-R529 PolarHBondContact OD2-NH2 2.81Å; R529-K531 PolarHBondContact O-N 3.27Å; R529-K531 VanDerWaalsContact O-N 3.09Å; R529-Y563 HydrophobicContact CB-CD2 4.47Å; R529-Y563 HydrophobicContact CB-CG 4.04Å; R529-Y563 HydrophobicContact CG-CD1 4.46Å; R529-Y563 HydrophobicContact CG-CD2 3.77Å; R529-Y563 HydrophobicContact CG-CE2 4.4Å; R529-Y563 HydrophobicContact CG-CG 3.79Å; R529-R564 PolarHBondContact N-O 3.47Å
530	K	50.7	Low	58	Low	82 Å²	82	52.5 Å²	52.5	36%	0.357	26%	0.255	S	S	.	.			trans	-56.7	113.1	178.2	-81.6	177	178.2	175.6	0	109.6	D349 P528 Y532	D349-K530 HydrophobicContact CB-CD 4.4Å; D349-K530 WeakPolarHBondContact O-CD 3.43Å; D349-K530 WeakPolarHBondContact O-CE 3.46Å; D349-K530 PolarHBondContact O-NZ 3.26Å; P528-K530 VanDerWaalsContact C-N 3.28Å; P528-K530 PolarHBondContact O-N 2.89Å; K530-Y532 HydrophobicContact CB-CD2 3.52Å; K530-Y532 HydrophobicContact CB-CE2 4.02Å; K530-Y532 HydrophobicContact CB-CG 4.34Å; K530-Y532 HydrophobicContact CG-CD2 4.13Å; K530-Y532 HydrophobicContact CG-CE2 4.11Å; K530-Y532 PolarHBondContact O-N 3.44Å
531	K	51.2	Low	58.9	Low	177 Å²	177	54.7 Å²	54.7	77%	0.77	26%	0.264	S	S	*	.			trans	-67.1	61	170.3	-65.5	177.6	-179.6	171.8	0	111.2	E377 R529	E377-K531 VanDerWaalsContact O-O 3.13Å; R529-K531 PolarHBondContact O-N 3.27Å; R529-K531 VanDerWaalsContact O-N 3.09Å
532	Y	47.9	Very low	59.6	Low	46 Å²	46	53.7 Å²	53.7	18%	0.18	26%	0.255	C	S	.	.			trans	-127.9	154	-173.4	-70.1	-113.3	0	0	0	110.3	E347 K376 K530	E347-Y532 PolarHBondContact O-OH 3.19Å; K376-Y532 HydrophobicContact CB-CD1 4.14Å; K376-Y532 HydrophobicContact CB-CE1 4.27Å; K376-Y532 HydrophobicContact CD-CD1 4.21Å; K376-Y532 HydrophobicContact CD-CE1 3.52Å; K376-Y532 VanDerWaalsContact CE-OH 3.29Å; K376-Y532 WeakPolarHBondContact CE-OH 3.46Å; K376-Y532 HydrophobicContact CG-CD1 3.79Å; K376-Y532 HydrophobicContact CG-CE1 3.62Å; K376-Y532 PolarHBondContact NZ-OH 2.94Å; K530-Y532 HydrophobicContact CB-CD2 3.52Å; K530-Y532 HydrophobicContact CB-CE2 4.02Å; K530-Y532 HydrophobicContact CB-CG 4.34Å; K530-Y532 HydrophobicContact CG-CD2 4.13Å; K530-Y532 HydrophobicContact CG-CE2 4.11Å; K530-Y532 PolarHBondContact O-N 3.44Å
533	P	51.5	Low	60.4	Low	4 Å²	4	56.9 Å²	56.9	3%	0.026	26%	0.259	C	S	.	.	S	Bend	trans	-89.4	-17.9	-173.6	11	7.9	0	0	0	112.5	L284 R288 N374 V375 E377	L284-P533 VanDerWaalsContact CD1-O 3.28Å; L284-P533 WeakPolarHBondContact CD1-O 3.21Å; L284-P533 WeakPolarHBondContact CD2-O 3.23Å; L284-P533 WeakPolarHBondContact CG-O 3.25Å; R288-P533 PolarHBondContact NH2-O 3.33Å; R288-P533 VanDerWaalsContact NH2-O 3.14Å; N374-P533 WeakPolarHBondContact O-CG 3.39Å; V375-P533 WeakPolarHBondContact O-CD 3.44Å; E377-P533 HydrophobicContact CB-CB 4.02Å; E377-P533 HydrophobicContact CB-CG 3.66Å; E377-P533 HydrophobicContact CG-CB 3.74Å; E377-P533 HydrophobicContact CG-CG 3.8Å
534	A	53.8	Low	60.8	Low	3 Å²	3	57.3 Å²	57.3	3%	0.025	26%	0.261	C	S	.	.	S	Bend	trans	-77.2	-40	-144.5	0	0	0	0	0	113.5	L284 F350	L284-A534 VanDerWaalsContact CD1-C 3.47Å; L284-A534 WeakPolarHBondContact CD1-O 3.28Å; L284-A534 VanDerWaalsContact CD2-O 3.27Å; L284-A534 WeakPolarHBondContact CD2-O 3.4Å; F350-A534 HydrophobicContact CD2-CB 4.1Å; F350-A534 HydrophobicContact CE2-CB 3.71Å
535	W	59.3	Low	61.9	Low	19 Å²	19	49.8 Å²	49.8	7%	0.072	23%	0.233	C	C	.	.			trans	-170.4	155.5	159.7	-81.9	103.4	0	0	0	106.7	A226 Y280 V283 L284 S287 F539 I540	A226-W535 HydrophobicContact CB-CE3 4.36Å; A226-W535 HydrophobicContact CB-CH2 3.18Å; A226-W535 HydrophobicContact CB-CZ2 3.66Å; A226-W535 HydrophobicContact CB-CZ3 3.54Å; Y280-W535 HydrophobicContact CE2-CZ2 4.32Å; Y280-W535 AromaticContact CE2-NE1 3.91Å; Y280-W535 AromaticContact CZ-NE1 3.83Å; Y280-W535 PolarHBondContact OH-NE1 3.41Å; Y280-W535 VanDerWaalsContact OH-NE1 3.16Å; V283-W535 HydrophobicContact CG1-CH2 3.92Å; L284-W535 HydrophobicContact CB-CH2 4.49Å; L284-W535 HydrophobicContact CB-CZ2 4.31Å; L284-W535 HydrophobicContact CD1-CB 4.4Å; L284-W535 HydrophobicContact CD1-CD2 3.62Å; L284-W535 HydrophobicContact CD1-CE3 3.87Å; L284-W535 HydrophobicContact CD1-CG 3.92Å; L284-W535 HydrophobicContact CD1-CZ2 4.3Å; L284-W535 HydrophobicContact CD1-CZ3 4.35Å; S287-W535 VanDerWaalsContact OG-CZ3 3.28Å; S287-W535 WeakPolarHBondContact OG-CZ3 3.44Å; W535-F539 HydrophobicContact CB-CB 4.12Å; W535-F539 HydrophobicContact CD2-CB 4.04Å; W535-F539 HydrophobicContact CE3-CB 3.45Å; W535-F539 VanDerWaalsContact CE3-CB 3.45Å; W535-F539 AromaticContact CE3-CD1 3.54Å; W535-F539 HydrophobicContact CE3-CD1 3.54Å; W535-F539 HydrophobicContact CE3-CD2 4.29Å; W535-F539 HydrophobicContact CE3-CE1 4.36Å; W535-F539 AromaticContact CE3-CG 3.51Å; W535-F539 HydrophobicContact CE3-CG 3.51Å; W535-F539 HydrophobicContact CG-CB 4.3Å; W535-F539 HydrophobicContact CZ3-CB 4.25Å; W535-F539 AromaticContact CZ3-CD1 3.43Å; W535-F539 HydrophobicContact CZ3-CD1 3.43Å; W535-F539 VanDerWaalsContact CZ3-CD1 3.43Å; W535-F539 AromaticContact CZ3-CE1 3.9Å; W535-F539 HydrophobicContact CZ3-CE1 3.9Å; W535-F539 AromaticContact CZ3-CG 3.9Å; W535-F539 HydrophobicContact CZ3-CG 3.9Å; W535-I540 HydrophobicContact CB-CD1 4.09Å; W535-I540 HydrophobicContact CB-CG1 3.55Å; W535-I540 HydrophobicContact CG-CG1 4.39Å
536	D	65.3	Low	62.7	Low	24 Å²	24	51.7 Å²	51.7	13%	0.128	24%	0.241	C	C	.	.			trans	-67.8	147.9	164.2	-106	49.9	0	0	0	109.6	H538 F539 I540 Y563	D536-H538 PolarHBondContact O-N 3.2Å; D536-H538 VanDerWaalsContact O-N 3.08Å; D536-H538 IonicContact OD2-CE1 2.64Å; D536-H538 PolarHBondContact OD2-CE1 2.68Å; D536-H538 IonicContact OD2-ND1 3.77Å; D536-F539 HydrophobicContact CB-CD2 4.08Å; D536-F539 WeakPolarHBondContact O-CA 3.26Å; D536-F539 WeakPolarHBondContact O-CB 3.3Å; D536-F539 PolarHBondContact O-N 3.17Å; D536-I540 PolarHBondContact O-N 3.42Å; D536-Y563 VanDerWaalsContact CG-OH 3.29Å; D536-Y563 WeakPolarHBondContact OD2-CE2 3.38Å; D536-Y563 VanDerWaalsContact OD2-CZ 3.3Å; D536-Y563 PolarHBondContact OD2-OH 3.27Å
537	A	66.4	Low	63.9	Low	26 Å²	26	50.8 Å²	50.8	22%	0.215	24%	0.238	C	C	.	.	H	α-helix	trans	-57.4	-33.5	-172.5	0	0	0	0	0	113.2	F539 I540 D541 Y563	A537-F539 VanDerWaalsContact C-N 3.27Å; A537-F539 PolarHBondContact O-N 3.41Å; A537-I540 PolarHBondContact O-N 3.24Å; A537-D541 PolarHBondContact O-N 3.06Å; A537-Y563 HydrophobicContact CB-CE1 4.24Å
538	H	67.6	Low	64.9	Low	4 Å²	4	48.9 Å²	48.9	2%	0.019	23%	0.228	C	C	.	.	H	α-helix	trans	-73.8	-12.1	176.9	70.8	-94.2	0	0	0	114.8	D536 L544 R545 I548 Y563	D536-H538 PolarHBondContact O-N 3.2Å; D536-H538 VanDerWaalsContact O-N 3.08Å; D536-H538 IonicContact OD2-CE1 2.64Å; D536-H538 PolarHBondContact OD2-CE1 2.68Å; D536-H538 IonicContact OD2-ND1 3.77Å; H538-L544 HydrophobicContact CB-CB 4.49Å; H538-L544 HydrophobicContact CB-CD2 3.62Å; H538-L544 HydrophobicContact CB-CG 3.66Å; H538-R545 WeakPolarHBondContact O-CG 3.5Å; H538-I548 HydrophobicContact CB-CD1 3.52Å; H538-Y563 PolarHBondContact ND1-OH 3.4Å
539	F	69.3	Low	66	Low	1 Å²	1	47.9 Å²	47.9	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-85.2	-33	166.4	-84	-93.3	0	0	0	112	W219 L222 F223 A226 S287 W535 D536 A537 R545	W219-F539 HydrophobicContact CE3-CZ 4.15Å; W219-F539 HydrophobicContact CZ3-CE2 4.13Å; W219-F539 AromaticContact CZ3-CZ 3.84Å; W219-F539 HydrophobicContact CZ3-CZ 3.84Å; L222-F539 HydrophobicContact CD2-CZ 4.13Å; L222-F539 HydrophobicContact CG-CE1 4.04Å; L222-F539 HydrophobicContact CG-CZ 4.14Å; F223-F539 AromaticContact CD1-CD1 3.47Å; F223-F539 HydrophobicContact CD1-CD1 3.47Å; F223-F539 VanDerWaalsContact CD1-CD1 3.47Å; F223-F539 AromaticContact CD1-CE1 3.44Å; F223-F539 HydrophobicContact CD1-CE1 3.44Å; F223-F539 VanDerWaalsContact CD1-CE1 3.44Å; F223-F539 HydrophobicContact CD1-CG 4.18Å; F223-F539 HydrophobicContact CD1-CZ 4.12Å; F223-F539 AromaticContact CE1-CD1 3.63Å; F223-F539 HydrophobicContact CE1-CD1 3.63Å; F223-F539 HydrophobicContact CE1-CD2 4.13Å; F223-F539 AromaticContact CE1-CE1 3.55Å; F223-F539 HydrophobicContact CE1-CE1 3.55Å; F223-F539 HydrophobicContact CE1-CE2 4.06Å; F223-F539 AromaticContact CE1-CG 3.92Å; F223-F539 HydrophobicContact CE1-CG 3.92Å; F223-F539 AromaticContact CE1-CZ 3.77Å; F223-F539 HydrophobicContact CE1-CZ 3.77Å; F223-F539 HydrophobicContact CG-CE1 4.46Å; A226-F539 HydrophobicContact CB-CD1 4.14Å; S287-F539 WeakPolarHBondContact O-CE2 3.37Å; W535-F539 HydrophobicContact CB-CB 4.12Å; W535-F539 HydrophobicContact CD2-CB 4.04Å; W535-F539 HydrophobicContact CE3-CB 3.45Å; W535-F539 VanDerWaalsContact CE3-CB 3.45Å; W535-F539 AromaticContact CE3-CD1 3.54Å; W535-F539 HydrophobicContact CE3-CD1 3.54Å; W535-F539 HydrophobicContact CE3-CD2 4.29Å; W535-F539 HydrophobicContact CE3-CE1 4.36Å; W535-F539 AromaticContact CE3-CG 3.51Å; W535-F539 HydrophobicContact CE3-CG 3.51Å; W535-F539 HydrophobicContact CG-CB 4.3Å; W535-F539 HydrophobicContact CZ3-CB 4.25Å; W535-F539 AromaticContact CZ3-CD1 3.43Å; W535-F539 HydrophobicContact CZ3-CD1 3.43Å; W535-F539 VanDerWaalsContact CZ3-CD1 3.43Å; W535-F539 AromaticContact CZ3-CE1 3.9Å; W535-F539 HydrophobicContact CZ3-CE1 3.9Å; W535-F539 AromaticContact CZ3-CG 3.9Å; W535-F539 HydrophobicContact CZ3-CG 3.9Å; D536-F539 HydrophobicContact CB-CD2 4.08Å; D536-F539 WeakPolarHBondContact O-CA 3.26Å; D536-F539 WeakPolarHBondContact O-CB 3.3Å; D536-F539 PolarHBondContact O-N 3.17Å; A537-F539 VanDerWaalsContact C-N 3.27Å; A537-F539 PolarHBondContact O-N 3.41Å; F539-R545 PolarHBondContact O-NE 3.24Å; F539-R545 PolarHBondContact O-NH2 2.88Å
540	I	68.7	Low	67.1	Low	67 Å²	67	44.9 Å²	44.9	34%	0.344	22%	0.22	S	C	.	.	H	α-helix	trans	-74.7	-50	-179.8	-50.9	164.2	0	0	0	110	F350 W535 D536 A537 R542	F350-I540 HydrophobicContact CD2-CD1 3.92Å; F350-I540 HydrophobicContact CE1-CD1 4.34Å; F350-I540 HydrophobicContact CE1-CG2 4.26Å; F350-I540 HydrophobicContact CE2-CD1 3.3Å; F350-I540 HydrophobicContact CE2-CG1 4.04Å; F350-I540 HydrophobicContact CZ-CD1 3.54Å; F350-I540 HydrophobicContact CZ-CG1 3.83Å; F350-I540 HydrophobicContact CZ-CG2 4.21Å; W535-I540 HydrophobicContact CB-CD1 4.09Å; W535-I540 HydrophobicContact CB-CG1 3.55Å; W535-I540 HydrophobicContact CG-CG1 4.39Å; D536-I540 PolarHBondContact O-N 3.42Å; A537-I540 PolarHBondContact O-N 3.24Å; I540-R542 PolarHBondContact O-N 2.96Å
541	D	72	Confident	68.2	Low	53 Å²	53	43.5 Å²	43.5	28%	0.283	22%	0.216	S	C	.	.			trans	-82.2	114.5	-175.3	177.9	23.4	0	0	0	112.8	A537 R543 L544 R545	A537-D541 PolarHBondContact O-N 3.06Å; D541-R543 VanDerWaalsContact C-N 3.26Å; D541-R543 PolarHBondContact O-N 2.84Å; D541-R543 WeakPolarHBondContact OD1-CB 3.3Å; D541-R543 PolarHBondContact OD1-N 2.8Å; D541-R543 WeakPolarHBondContact OD2-CB 3.44Å; D541-L544 HydrophobicContact CB-CB 4.09Å; D541-L544 PolarHBondContact O-N 2.84Å; D541-L544 WeakPolarHBondContact OD2-CB 3.39Å; D541-L544 PolarHBondContact OD2-N 2.92Å; D541-L544 VanDerWaalsContact OD2-N 3.13Å; D541-R545 PolarHBondContact O-N 2.89Å
542	R	76.8	Confident	69.2	Low	26 Å²	26	36.4 Å²	36.4	10%	0.098	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-27.7	174.8	-69.2	-175.6	170.2	-75.9	-21	113.5	Y114 D115 D227 I540 K546	Y114-R542 HydrophobicContact CD1-CB 3.7Å; Y114-R542 HydrophobicContact CD1-CG 4.45Å; Y114-R542 HydrophobicContact CE1-CB 3.88Å; D115-R542 IonicContact OD1-CZ 2.78Å; D115-R542 IonicContact OD1-NH1 3.19Å; D115-R542 PolarHBondContact OD1-NH1 3.16Å; D115-R542 IonicContact OD2-NH1 3.48Å; D115-R542 PolarHBondContact OD2-NH1 2.78Å; D227-R542 IonicContact OD1-NH2 2.98Å; D227-R542 PolarHBondContact OD1-NH2 2.97Å; D227-R542 IonicContact OD2-CZ 3.84Å; D227-R542 IonicContact OD2-NH1 3.46Å; D227-R542 IonicContact OD2-NH2 2.83Å; D227-R542 PolarHBondContact OD2-NH2 3.22Å; I540-R542 PolarHBondContact O-N 2.96Å; R542-K546 WeakPolarHBondContact O-CG 3.22Å; R542-K546 PolarHBondContact O-N 2.73Å; R542-K546 VanDerWaalsContact O-N 3.14Å
543	R	73.8	Confident	70.2	Confident	136 Å²	136	43.8 Å²	43.8	51%	0.513	21%	0.214	S	C	.	.	H	α-helix	trans	-67.1	-53.2	175.6	-62.8	170	167.5	-174.3	-7.6	109.7	Y114 D541 R545 K546 T547	Y114-R543 HydrophobicContact CE1-CG 4.24Å; Y114-R543 WeakPolarHBondContact OH-CG 3.06Å; Y114-R543 PolarHBondContact OH-NE 3.29Å; D541-R543 VanDerWaalsContact C-N 3.26Å; D541-R543 PolarHBondContact O-N 2.84Å; D541-R543 WeakPolarHBondContact OD1-CB 3.3Å; D541-R543 PolarHBondContact OD1-N 2.8Å; D541-R543 WeakPolarHBondContact OD2-CB 3.44Å; R543-R545 VanDerWaalsContact C-N 3.32Å; R543-R545 PolarHBondContact O-N 2.93Å; R543-K546 WeakPolarHBondContact O-CB 3.21Å; R543-K546 PolarHBondContact O-N 3.25Å; R543-T547 PolarHBondContact O-N 3.27Å; R543-T547 PolarHBondContact O-OG1 3.46Å
544	L	73.3	Confident	71	Confident	26 Å²	26	47.8 Å²	47.8	14%	0.136	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-39	178.2	-169.7	49.1	0	0	0	112.3	I523 I525 H538 D541 K546 T547 I548	I523-L544 HydrophobicContact CG2-CD1 4.04Å; I525-L544 HydrophobicContact CD1-CD2 3.82Å; I525-L544 HydrophobicContact CG1-CD2 4.06Å; H538-L544 HydrophobicContact CB-CB 4.49Å; H538-L544 HydrophobicContact CB-CD2 3.62Å; H538-L544 HydrophobicContact CB-CG 3.66Å; D541-L544 HydrophobicContact CB-CB 4.09Å; D541-L544 PolarHBondContact O-N 2.84Å; D541-L544 WeakPolarHBondContact OD2-CB 3.39Å; D541-L544 PolarHBondContact OD2-N 2.92Å; D541-L544 VanDerWaalsContact OD2-N 3.13Å; L544-K546 PolarHBondContact O-N 2.83Å; L544-T547 PolarHBondContact O-N 3.4Å; L544-I548 HydrophobicContact CD1-CD1 4.22Å; L544-I548 HydrophobicContact CD1-CG1 4.38Å; L544-I548 HydrophobicContact CG-CD1 4.05Å; L544-I548 WeakPolarHBondContact O-CD1 3.4Å; L544-I548 VanDerWaalsContact O-CG1 3.27Å; L544-I548 WeakPolarHBondContact O-CG1 3.2Å; L544-I548 PolarHBondContact O-N 3.03Å
545	R	80.1	Confident	71.4	Confident	23 Å²	23	48.7 Å²	48.7	9%	0.087	25%	0.249	C	C	.	.	H	α-helix	trans	-55.3	-50	168.8	-70.1	-169.7	-169.2	-178.9	5.4	112.9	F223 D227 H538 F539 D541 R543 T547 I548 L549	F223-R545 HydrophobicContact CD1-CG 3.94Å; F223-R545 HydrophobicContact CE1-CG 3.91Å; F223-R545 HydrophobicContact CG-CG 4.36Å; F223-R545 HydrophobicContact CZ-CG 4.28Å; F223-R545 PolarHBondContact O-NH1 3.49Å; D227-R545 IonicContact OD1-CZ 2.68Å; D227-R545 IonicContact OD1-NH1 3.22Å; D227-R545 PolarHBondContact OD1-NH1 2.87Å; D227-R545 IonicContact OD1-NH2 3.32Å; D227-R545 PolarHBondContact OD1-NH2 3.47Å; D227-R545 IonicContact OD2-NH1 2.69Å; D227-R545 PolarHBondContact OD2-NH1 3.41Å; H538-R545 WeakPolarHBondContact O-CG 3.5Å; F539-R545 PolarHBondContact O-NE 3.24Å; F539-R545 PolarHBondContact O-NH2 2.88Å; D541-R545 PolarHBondContact O-N 2.89Å; R543-R545 VanDerWaalsContact C-N 3.32Å; R543-R545 PolarHBondContact O-N 2.93Å; R545-T547 VanDerWaalsContact C-N 3.34Å; R545-T547 PolarHBondContact O-N 3.42Å; R545-I548 PolarHBondContact O-N 3.09Å; R545-L549 WeakPolarHBondContact O-CB 3.48Å; R545-L549 VanDerWaalsContact O-CG 3.3Å; R545-L549 WeakPolarHBondContact O-CG 3.49Å; R545-L549 PolarHBondContact O-N 2.84Å
546	K	79.1	Confident	71.4	Confident	51 Å²	51	52.8 Å²	52.8	22%	0.222	28%	0.277	C	S	.	.	H	α-helix	trans	-59.2	-45.2	179.2	-72.8	177	-172.5	-179.4	0	111	Y114 E118 R542 R543 L544 L549 A550	Y114-K546 PolarHBondContact O-NZ 3.13Å; E118-K546 IonicContact OE2-NZ 2.78Å; E118-K546 PolarHBondContact OE2-NZ 2.88Å; R542-K546 WeakPolarHBondContact O-CG 3.22Å; R542-K546 PolarHBondContact O-N 2.73Å; R542-K546 VanDerWaalsContact O-N 3.14Å; R543-K546 WeakPolarHBondContact O-CB 3.21Å; R543-K546 PolarHBondContact O-N 3.25Å; L544-K546 PolarHBondContact O-N 2.83Å; K546-L549 PolarHBondContact O-N 2.85Å; K546-A550 WeakPolarHBondContact O-CB 3.49Å; K546-A550 PolarHBondContact O-N 2.98Å
547	T	76.8	Confident	71.1	Confident	71 Å²	71	52.9 Å²	52.9	44%	0.436	28%	0.282	S	S	.	.	H	α-helix	trans	-64	-43.5	179.4	-60.7	0	0	0	0	112.3	R543 L544 R545 A550 L551	R543-T547 PolarHBondContact O-N 3.27Å; R543-T547 PolarHBondContact O-OG1 3.46Å; L544-T547 PolarHBondContact O-N 3.4Å; R545-T547 VanDerWaalsContact C-N 3.34Å; R545-T547 PolarHBondContact O-N 3.42Å; T547-A550 PolarHBondContact O-N 3.36Å; T547-L551 HydrophobicContact CG2-CD1 3.86Å; T547-L551 WeakPolarHBondContact O-CB 3.35Å; T547-L551 WeakPolarHBondContact O-CG 3.49Å; T547-L551 PolarHBondContact O-N 3.19Å
548	I	74.7	Confident	70.6	Confident	14 Å²	14	54 Å²	54	7%	0.072	29%	0.286	C	S	.	.	H	α-helix	trans	-60.9	-48.8	175.7	-70.6	162.6	0	0	0	111.1	I523 H538 L544 R545 A550 L551 E552 P559 L561	I523-I548 HydrophobicContact CD1-CB 4.4Å; I523-I548 HydrophobicContact CD1-CG1 3.6Å; H538-I548 HydrophobicContact CB-CD1 3.52Å; L544-I548 HydrophobicContact CD1-CD1 4.22Å; L544-I548 HydrophobicContact CD1-CG1 4.38Å; L544-I548 HydrophobicContact CG-CD1 4.05Å; L544-I548 WeakPolarHBondContact O-CD1 3.4Å; L544-I548 VanDerWaalsContact O-CG1 3.27Å; L544-I548 WeakPolarHBondContact O-CG1 3.2Å; L544-I548 PolarHBondContact O-N 3.03Å; R545-I548 PolarHBondContact O-N 3.09Å; I548-A550 VanDerWaalsContact C-N 3.31Å; I548-A550 PolarHBondContact O-N 2.69Å; I548-L551 PolarHBondContact O-N 3.5Å; I548-E552 WeakPolarHBondContact O-CB 3.44Å; I548-E552 PolarHBondContact O-N 3.46Å; I548-P559 HydrophobicContact CG2-CG 4.29Å; I548-L561 HydrophobicContact CD1-CD1 4.21Å; I548-L561 HydrophobicContact CD1-CD2 3.65Å; I548-L561 HydrophobicContact CG1-CD2 3.98Å
549	L	76.5	Confident	70.3	Confident	38 Å²	38	54.5 Å²	54.5	20%	0.199	29%	0.29	C	S	.	.	H	α-helix	trans	-67.8	-29.9	-178	-68.5	174.9	0	0	0	113	R220 F223 R545 K546 Y553	R220-L549 HydrophobicContact CG-CD1 3.91Å; R220-L549 HydrophobicContact CG-CD2 3.45Å; R220-L549 VanDerWaalsContact CG-CD2 3.45Å; R220-L549 HydrophobicContact CG-CG 4.34Å; F223-L549 HydrophobicContact CD2-CD1 4.18Å; F223-L549 HydrophobicContact CD2-CD2 4.3Å; F223-L549 HydrophobicContact CD2-CG 4.46Å; F223-L549 HydrophobicContact CE2-CD1 4.38Å; F223-L549 HydrophobicContact CE2-CD2 4.01Å; F223-L549 HydrophobicContact CE2-CG 4.19Å; R545-L549 WeakPolarHBondContact O-CB 3.48Å; R545-L549 VanDerWaalsContact O-CG 3.3Å; R545-L549 WeakPolarHBondContact O-CG 3.49Å; R545-L549 PolarHBondContact O-N 2.84Å; K546-L549 PolarHBondContact O-N 2.85Å; L549-Y553 PolarHBondContact O-N 2.9Å
550	A	75.4	Confident	69.7	Low	52 Å²	52	60.9 Å²	60.9	43%	0.43	31%	0.314	S	S	.	.	H	α-helix	trans	-70.6	-44.8	171.4	0	0	0	0	0	111.6	K546 T547 I548 Y553 S554	K546-A550 WeakPolarHBondContact O-CB 3.49Å; K546-A550 PolarHBondContact O-N 2.98Å; T547-A550 PolarHBondContact O-N 3.36Å; I548-A550 VanDerWaalsContact C-N 3.31Å; I548-A550 PolarHBondContact O-N 2.69Å; A550-Y553 WeakPolarHBondContact O-CB 3.38Å; A550-Y553 PolarHBondContact O-N 3.22Å; A550-S554 PolarHBondContact O-N 3.49Å; A550-S554 PolarHBondContact O-OG 3.27Å
551	L	72.6	Confident	69.5	Low	53 Å²	53	60 Å²	60	28%	0.277	31%	0.31	S	S	.	.	H	α-helix	trans	-67.1	-41.8	-180	-74.8	167.7	0	0	0	112.3	I523 T547 I548 Y553 S554 S555 P559	I523-L551 HydrophobicContact CD1-CD1 3.54Å; I523-L551 HydrophobicContact CG1-CD1 3.63Å; T547-L551 HydrophobicContact CG2-CD1 3.86Å; T547-L551 WeakPolarHBondContact O-CB 3.35Å; T547-L551 WeakPolarHBondContact O-CG 3.49Å; T547-L551 PolarHBondContact O-N 3.19Å; I548-L551 PolarHBondContact O-N 3.5Å; L551-Y553 PolarHBondContact O-N 3.15Å; L551-S554 WeakPolarHBondContact CA-OG 3.3Å; L551-S554 PolarHBondContact O-N 2.89Å; L551-S554 VanDerWaalsContact O-N 3.11Å; L551-S554 PolarHBondContact O-OG 3.43Å; L551-S555 VanDerWaalsContact O-CB 3.31Å; L551-S555 WeakPolarHBondContact O-CB 3.32Å; L551-S555 PolarHBondContact O-N 3.39Å; L551-P559 HydrophobicContact CB-CB 4.46Å; L551-P559 HydrophobicContact CB-CG 4.39Å
552	E	72.1	Confident	68.7	Low	27 Å²	27	62 Å²	62	13%	0.126	32%	0.317	C	S	.	.	H	α-helix	trans	-63.6	-25	173.5	-165.3	-173.6	-142.8	0	0	112.6	H216 I548	H216-E552 WeakPolarHBondContact CA-OE2 3.46Å; H216-E552 IonicContact CE1-OE2 3.66Å; H216-E552 IonicContact CG-OE2 2.69Å; H216-E552 IonicContact ND1-OE2 3.16Å; H216-E552 PolarHBondContact ND1-OE2 3.08Å; I548-E552 WeakPolarHBondContact O-CB 3.44Å; I548-E552 PolarHBondContact O-N 3.46Å
553	Y	68.7	Low	68	Low	202 Å²	202	62.1 Å²	62.1	79%	0.792	32%	0.318	S	S	*	.	H	α-helix	trans	-79.3	-32.4	172	-171.6	-99.5	0	0	0	112.8	L549 A550 L551	L549-Y553 PolarHBondContact O-N 2.9Å; A550-Y553 WeakPolarHBondContact O-CB 3.38Å; A550-Y553 PolarHBondContact O-N 3.22Å; L551-Y553 PolarHBondContact O-N 3.15Å
554	S	68.6	Low	67	Low	87 Å²	87	63 Å²	63	61%	0.608	32%	0.321	S	S	*	.	H	α-helix	trans	-83.5	-20.7	178.7	65.4	0	0	0	0	115.1	A550 L551	A550-S554 PolarHBondContact O-N 3.49Å; A550-S554 PolarHBondContact O-OG 3.27Å; L551-S554 WeakPolarHBondContact CA-OG 3.3Å; L551-S554 PolarHBondContact O-N 2.89Å; L551-S554 VanDerWaalsContact O-N 3.11Å; L551-S554 PolarHBondContact O-OG 3.43Å
555	S	63.3	Low	65.7	Low	23 Å²	23	66.8 Å²	66.8	16%	0.161	35%	0.35	C	S	.	.			trans	-118.6	132.4	-170	174.4	0	0	0	0	111.8	P521 L551 A557	P521-S555 WeakPolarHBondContact CD-OG 3.47Å; L551-S555 VanDerWaalsContact O-CB 3.31Å; L551-S555 WeakPolarHBondContact O-CB 3.32Å; L551-S555 PolarHBondContact O-N 3.39Å; S555-A557 WeakPolarHBondContact CB-O 3.37Å; S555-A557 PolarHBondContact O-N 2.92Å; S555-A557 PolarHBondContact OG-N 3.49Å; S555-A557 VanDerWaalsContact OG-N 3.16Å; S555-A557 PolarHBondContact OG-O 2.81Å
556	P	58.5	Low	63.9	Low	104 Å²	104	71.4 Å²	71.4	68%	0.675	38%	0.38	S	S	*	.	S	Bend	trans	-70.7	-13.1	172.9	31.7	-36	0	0	0	112.9	Q212	Q212-P556 PolarHBondContact NE2-O 3.29Å
557	A	58.1	Low	61.9	Low	27 Å²	27	71 Å²	71	22%	0.223	39%	0.39	C	S	.	.	S	Bend	trans	-108.6	130.6	173.5	0	0	0	0	0	110	S555	S555-A557 WeakPolarHBondContact CB-O 3.37Å; S555-A557 PolarHBondContact O-N 2.92Å; S555-A557 PolarHBondContact OG-N 3.49Å; S555-A557 VanDerWaalsContact OG-N 3.16Å; S555-A557 PolarHBondContact OG-O 2.81Å
558	T	57.8	Low	60	Low	48 Å²	48	72.5 Å²	72.5	29%	0.294	40%	0.399	S	S	.	.			trans	-58	131.5	178.6	53	0	0	0	0	110.5	R560	T558-R560 PolarHBondContact O-N 2.98Å
559	P	59.9	Low	58.2	Low	16 Å²	16	77.6 Å²	77.6	10%	0.104	43%	0.432	C	S	.	.			trans	-60.6	132.8	-178	23.1	-32.4	0	0	0	111.2	P521 I523 I548 L551 L561	P521-P559 HydrophobicContact CG-CB 4.27Å; P521-P559 CarbonylContact O-C 3.54Å; P521-P559 WeakPolarHBondContact O-CA 3.19Å; P521-P559 WeakPolarHBondContact O-CB 3.44Å; I523-P559 HydrophobicContact CD1-CB 3.55Å; I523-P559 HydrophobicContact CD1-CG 3.99Å; I523-P559 HydrophobicContact CG1-CB 3.9Å; I548-P559 HydrophobicContact CG2-CG 4.29Å; L551-P559 HydrophobicContact CB-CB 4.46Å; L551-P559 HydrophobicContact CB-CG 4.39Å; P559-L561 PolarHBondContact O-N 2.83Å
560	R	57	Low	55.9	Low	134 Å²	134	83 Å²	83	51%	0.506	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	113.2	178.4	-86.2	-179.2	156.9	-173.1	-9.9	109.6	P521 V522 I523 T558 Q562	P521-R560 PolarHBondContact O-N 3.32Å; V522-R560 CarbonylContact C-O 3.54Å; V522-R560 WeakPolarHBondContact CA-O 3.25Å; V522-R560 HydrophobicContact CG2-CB 4.28Å; I523-R560 PolarHBondContact N-O 3.48Å; T558-R560 PolarHBondContact O-N 2.98Å; R560-Q562 PolarHBondContact O-N 3.29Å
561	L	63.9	Low	53.9	Low	50 Å²	50	86.4 Å²	86.4	26%	0.262	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	106.2	176.4	-65.7	161.2	0	0	0	109.2	I523 I525 I548 P559	I523-L561 HydrophobicContact CB-CD2 3.98Å; I523-L561 HydrophobicContact CD1-CD2 4.22Å; I523-L561 HydrophobicContact CG2-CD2 4.03Å; I523-L561 WeakPolarHBondContact O-CA 3.33Å; I525-L561 HydrophobicContact CD1-CB 4.44Å; I525-L561 HydrophobicContact CD1-CD2 3.82Å; I548-L561 HydrophobicContact CD1-CD1 4.21Å; I548-L561 HydrophobicContact CD1-CD2 3.65Å; I548-L561 HydrophobicContact CG1-CD2 3.98Å; P559-L561 PolarHBondContact O-N 2.83Å
562	Q	56.2	Low	51.9	Low	94 Å²	94	89.8 Å²	89.8	44%	0.439	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	97.4	178.8	-172.3	174.8	40.2	0	0	109.6	V522 I523 R524 I525 R560	V522-Q562 HydrophobicContact CG1-CB 3.64Å; I523-Q562 PolarHBondContact O-N 3.45Å; R524-Q562 WeakPolarHBondContact CA-O 3.44Å; R524-Q562 HydrophobicContact CG-CB 4.3Å; I525-Q562 PolarHBondContact N-O 2.88Å; R560-Q562 PolarHBondContact O-N 3.29Å
563	Y	61.7	Low	49.8	Very low	28 Å²	28	94.2 Å²	94.2	11%	0.11	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	150.6	170.5	-66	-78.2	0	0	0	111.5	I525 R529 D536 A537 H538 S565	I525-Y563 HydrophobicContact CB-CD1 3.91Å; I525-Y563 HydrophobicContact CB-CE1 4.24Å; I525-Y563 HydrophobicContact CD1-CD1 3.92Å; I525-Y563 HydrophobicContact CD1-CE1 3.49Å; I525-Y563 VanDerWaalsContact CD1-CE1 3.49Å; I525-Y563 HydrophobicContact CG1-CE1 4.48Å; I525-Y563 HydrophobicContact CG2-CD1 3.91Å; I525-Y563 HydrophobicContact CG2-CE1 4.05Å; R529-Y563 HydrophobicContact CB-CD2 4.47Å; R529-Y563 HydrophobicContact CB-CG 4.04Å; R529-Y563 HydrophobicContact CG-CD1 4.46Å; R529-Y563 HydrophobicContact CG-CD2 3.77Å; R529-Y563 HydrophobicContact CG-CE2 4.4Å; R529-Y563 HydrophobicContact CG-CG 3.79Å; D536-Y563 VanDerWaalsContact CG-OH 3.29Å; D536-Y563 WeakPolarHBondContact OD2-CE2 3.38Å; D536-Y563 VanDerWaalsContact OD2-CZ 3.3Å; D536-Y563 PolarHBondContact OD2-OH 3.27Å; A537-Y563 HydrophobicContact CB-CE1 4.24Å; H538-Y563 PolarHBondContact ND1-OH 3.4Å; Y563-S565 PolarHBondContact O-N 3.13Å
564	R	53.1	Low	47.7	Very low	155 Å²	155	91.5 Å²	91.5	59%	0.585	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.4	120.9	171.4	-169.4	171.7	-177.8	165.6	0.3	110.2	I525 D526 L527 P528 R529	I525-R564 PolarHBondContact O-N 2.88Å; I525-R564 VanDerWaalsContact O-N 3.13Å; D526-R564 WeakPolarHBondContact O-CD 3.46Å; L527-R564 PolarHBondContact O-N 3.02Å; P528-R564 CarbonylContact C-O 3.57Å; P528-R564 VanDerWaalsContact CA-O 3.25Å; P528-R564 WeakPolarHBondContact CA-O 3.47Å; R529-R564 PolarHBondContact N-O 3.47Å
565	S	45.3	Very low	45.6	Very low	106 Å²	106	94.5 Å²	94.5	74%	0.741	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-84.9	118.4	169.9	51.3	0	0	0	0	109.6	Y563	Y563-S565 PolarHBondContact O-N 3.13Å
566	V	42.5	Very low	44	Very low	120 Å²	120	100.9 Å²	100.9	73%	0.727	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-100.4	132.7	164.4	-178.8	0	0	0	0	106.8	P528	P528-V566 HydrophobicContact CB-CG2 4Å
567	G	38.1	Very low	42.4	Very low	41 Å²	41	101 Å²	101	42%	0.423	52%	0.524	S	S	.	.	S	Bend	trans	111.3	123.1	-169.7	0	0	0	0	0	111.3
568	T	35.3	Very low	40.9	Very low	103 Å²	103	104.7 Å²	104.7	63%	0.632	54%	0.544	S	S	*	.			trans	-70.2	160.3	170.6	37.2	0	0	0	0	110.5	Q570 E571	T568-Q570 PolarHBondContact O-N 3.24Å; T568-E571 PolarHBondContact O-N 3.14Å
569	T	37.7	Very low	39.4	Very low	122 Å²	122	111 Å²	111	75%	0.748	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-11.8	179.2	39.4	0	0	0	0	114.8
570	Q	29.2	Very low	38.3	Very low	152 Å²	152	115.7 Å²	115.7	71%	0.71	61%	0.606	S	S	*	*	H	α-helix	trans	-75.8	-35.2	-179.5	-164	165.6	-9.6	0	0	113	T568 L572 L573	T568-Q570 PolarHBondContact O-N 3.24Å; Q570-L572 PolarHBondContact O-N 3.46Å; Q570-L573 PolarHBondContact O-N 2.9Å
571	E	31.4	Very low	37.3	Very low	123 Å²	123	114.7 Å²	114.7	58%	0.575	61%	0.611	S	S	*	*	H	α-helix	trans	-66.1	-19.4	175.7	-68.3	-172.9	166.7	0	0	113.2	T568	T568-E571 PolarHBondContact O-N 3.14Å
572	L	31	Very low	35.9	Very low	124 Å²	124	118.3 Å²	118.3	65%	0.649	63%	0.63	S	S	*	*	H	α-helix	trans	-74	-35.8	177.7	-104.2	163.7	0	0	0	112.3	Q570	Q570-L572 PolarHBondContact O-N 3.46Å
573	L	27.6	Very low	34.7	Very low	119 Å²	119	119.8 Å²	119.8	62%	0.623	64%	0.642	S	S	*	*	H	α-helix	trans	-73	-40.8	179.7	-82.4	158.4	0	0	0	111.9	Q570 Y575 E576 T577	Q570-L573 PolarHBondContact O-N 2.9Å; L573-Y575 PolarHBondContact O-N 2.8Å; L573-E576 PolarHBondContact O-N 3.04Å; L573-T577 PolarHBondContact O-N 3.26Å; L573-T577 PolarHBondContact O-OG1 3.49Å; L573-T577 VanDerWaalsContact O-OG1 3.14Å
574	E	25.7	Very low	33	Very low	146 Å²	146	125.5 Å²	125.5	68%	0.682	68%	0.675	S	S	*	*	H	α-helix	trans	-66.2	-25.7	-176.8	-143.7	166.5	-145.3	0	0	112.5	T577	E574-T577 PolarHBondContact O-OG1 3.14Å
575	Y	25.3	Very low	31.6	Very low	150 Å²	150	123.5 Å²	123.5	59%	0.588	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-12.5	178.6	-122.7	-80.1	0	0	0	115.1	R379 L573	R379-Y575 VanDerWaalsContact CZ-OH 3.24Å; R379-Y575 PolarHBondContact NH1-OH 2.73Å; R379-Y575 PolarHBondContact NH2-OH 2.8Å; R379-Y575 VanDerWaalsContact NH2-OH 3.16Å; L573-Y575 PolarHBondContact O-N 2.8Å
576	E	28.1	Very low	30.7	Very low	156 Å²	156	124.8 Å²	124.8	73%	0.729	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-18	170.4	-68.8	-166.9	147	0	0	112.2	L573	L573-E576 PolarHBondContact O-N 3.04Å
577	T	25.5	Very low	29.8	Very low	107 Å²	107	125.2 Å²	125.2	66%	0.656	67%	0.673	S	S	*	*	S	Bend	trans	-93	-3.3	-177.2	48.4	0	0	0	0	115.8	L573 E574	L573-T577 PolarHBondContact O-N 3.26Å; L573-T577 PolarHBondContact O-OG1 3.49Å; L573-T577 VanDerWaalsContact O-OG1 3.14Å; E574-T577 PolarHBondContact O-OG1 3.14Å
578	T	26.7	Very low	29.1	Very low	105 Å²	105	132.2 Å²	132.2	64%	0.644	69%	0.694	S	S	*	*			trans	-127.1	91.5	173.1	67.1	0	0	0	0	111.6
579	V	25.4	Very low	28.5	Very low	179 Å²	179	134.8 Å²	134.8	100%	1.085	70%	0.699	S	S	*	*			trans	-127	0	176.2	178.1	0	0	0	0	109.8

Retrieved 579 of 579 residues in 1107.4 ms (Link to these results)

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