A0A096N7T5_PAPAN Loading...

non-specific serine/threonine protein kinase

AlphaFold DB (A0A2I3LTD7), UniProt , Accession A0A096N7T5, Species PAPAN (Papio anubis, Olive baboon), Gene MKNK1, Length 465 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	T	36.1	Very low	31.1	Very low	184 Å²	184	148.8 Å²	148.8	100%	1.129	80%	0.797	S	S	*	*				0	85.1	0	30.8	0	0	0	0	107
2	V	28.6	Very low	31.1	Very low	137 Å²	137	150.2 Å²	150.2	83%	0.83	80%	0.795	S	S	*	*				64.5	119.4	100.8	-179.6	0	0	0	0	109.3
3	S	29.1	Very low	31	Very low	94 Å²	94	152.5 Å²	152.5	66%	0.657	80%	0.802	S	S	*	*			cis	-161.3	138	19.8	-106.9	0	0	0	0	106.9
4	S	29.2	Very low	30.9	Very low	102 Å²	102	146.3 Å²	146.3	71%	0.713	79%	0.793	S	S	*	*				70.4	134.8	70.7	-66	0	0	0	0	115.7
5	Q	32.3	Very low	30.8	Very low	187 Å²	187	144.3 Å²	144.3	87%	0.874	80%	0.795	S	S	*	*			trans	105.1	102.2	161.6	-58.7	-178.6	5.1	0	0	114.6
6	K	29.5	Very low	30.7	Very low	191 Å²	191	141.7 Å²	141.7	83%	0.83	79%	0.79	S	S	*	*			cis	83	136.1	33.3	-147.1	-162.5	-177.7	-174.2	0	112.7
7	L	29.8	Very low	30.7	Very low	124 Å²	124	144.4 Å²	144.4	65%	0.649	80%	0.795	S	S	*	*			trans	98.4	135.9	164.8	-79.2	83.6	0	0	0	116.2
8	E	29.2	Very low	31	Very low	167 Å²	167	142.8 Å²	142.8	78%	0.78	79%	0.793	S	S	*	*			cis	-163.1	162.3	-2.5	-126	163.2	-160.4	0	0	111.4
9	K	28.6	Very low	31.2	Very low	193 Å²	193	144.1 Å²	144.1	84%	0.839	80%	0.797	S	S	*	*			trans	-61.5	-179.8	174.7	-77.1	178.1	167.9	-178.7	0	112.4
10	P	40.5	Very low	31.4	Very low	105 Å²	105	143 Å²	143	68%	0.682	80%	0.797	S	S	*	*			cis	-162.4	178.3	34.8	42.3	-16.9	0	0	0	122.3
11	I	29.8	Very low	31.5	Very low	153 Å²	153	144.2 Å²	144.2	79%	0.785	80%	0.8	S	S	*	*			trans	74.2	144	149.7	-70	150.1	0	0	0	118.7
12	E	30.6	Very low	31.2	Very low	165 Å²	165	139.7 Å²	139.7	77%	0.771	78%	0.781	S	S	*	*			cis	-179.5	168.2	-28.9	-155.4	176.9	-158.7	0	0	106.3
13	M	30.3	Very low	31.3	Very low	181 Å²	181	141.4 Å²	141.4	89%	0.892	79%	0.786	S	S	*	*			trans	93.5	124.6	163.5	-54.3	-149	-67.4	0	0	117.5
14	G	29.5	Very low	31.3	Very low	65 Å²	65	140.3 Å²	140.3	67%	0.67	79%	0.789	S	S	*	*			cis	-176.7	167.5	7.5	0	0	0	0	0	114.2
15	S	28.5	Very low	31.4	Very low	117 Å²	117	143.1 Å²	143.1	82%	0.818	80%	0.796	S	S	*	*			trans	32.9	143.5	143.5	65	0	0	0	0	120.6
16	S	29.6	Very low	31.5	Very low	102 Å²	102	146 Å²	146	71%	0.713	80%	0.799	S	S	*	*			cis	176	131.9	-3.7	43.9	0	0	0	0	106.6
17	E	30.1	Very low	31.7	Very low	187 Å²	187	148.4 Å²	148.4	87%	0.874	80%	0.803	S	S	*	*			trans	49.1	-174.8	155.2	-51.8	-163.1	149	0	0	121.2
18	P	36.1	Very low	32	Very low	117 Å²	117	153.8 Å²	153.8	76%	0.76	82%	0.815	S	S	*	*				-122.4	172.9	-87.6	37.1	-19.5	0	0	0	114.7
19	L	35	Very low	32.3	Very low	167 Å²	167	156 Å²	156	87%	0.874	82%	0.822	S	S	*	*			trans	-62.4	148	174.9	-67.1	162.2	0	0	0	112.7
20	P	35.6	Very low	32.5	Very low	122 Å²	122	156.3 Å²	156.3	79%	0.792	82%	0.823	S	S	*	*				-155.5	158.7	85.8	36.7	-14.4	0	0	0	119.3
21	I	34.6	Very low	32.4	Very low	168 Å²	168	160.8 Å²	160.8	86%	0.862	83%	0.832	S	S	*	*			trans	-10.5	132.5	162.8	-54.6	157.1	0	0	0	120.2
22	A	29.8	Very low	32.6	Very low	89 Å²	89	165.2 Å²	165.2	74%	0.736	84%	0.839	S	S	*	*				-175.9	136.2	116.9	0	0	0	0	0	114.5
23	D	30.2	Very low	32.8	Very low	174 Å²	174	168.8 Å²	168.8	93%	0.93	85%	0.845	S	S	*	*			trans	43.3	133.8	152.9	-90	-47.5	0	0	0	123.8
24	G	29.5	Very low	33	Very low	71 Å²	71	164.8 Å²	164.8	73%	0.732	84%	0.841	S	S	*	*			trans	156.1	90.8	161.3	0	0	0	0	0	116.3
25	D	30.2	Very low	33.3	Very low	161 Å²	161	172.2 Å²	172.2	86%	0.861	85%	0.848	S	S	*	*			trans	31	113	151.2	-86.2	-35.4	0	0	0	121.6	R27	D25-R27 PolarHBondContact O-N 3.23Å
26	R	34.8	Very low	33.9	Very low	247 Å²	247	171.7 Å²	171.7	93%	0.932	85%	0.851	S	S	*	*			trans	-66.6	91.7	163.1	-72.8	177.9	170.6	-175.8	-2.7	111.7	R28	R26-R28 PolarHBondContact O-N 3.44Å
27	R	33.8	Very low	34.5	Very low	242 Å²	242	172.1 Å²	172.1	91%	0.913	85%	0.85	S	S	*	*			trans	-79.8	94.3	156.4	-89.8	-178.1	173.2	179.9	-0.8	110.6	D25 K29	D25-R27 PolarHBondContact O-N 3.23Å; R27-K29 PolarHBondContact O-N 3.16Å
28	R	36.5	Very low	34.7	Very low	236 Å²	236	170.8 Å²	170.8	89%	0.891	85%	0.848	S	S	*	*			trans	-52.3	116.7	162.5	-80.9	175	165.6	172.8	-4.7	109.3	R26 K30	R26-R28 PolarHBondContact O-N 3.44Å; R28-K30 PolarHBondContact O-N 3.36Å
29	K	35.3	Very low	35	Very low	215 Å²	215	171.2 Å²	171.2	94%	0.935	85%	0.853	S	S	*	*			trans	-59.8	99.3	164.3	-82.4	178.2	177.6	173.2	0	108.1	R27 K31	R27-K29 PolarHBondContact O-N 3.16Å; K29-K31 PolarHBondContact O-N 3.01Å; K29-K31 VanDerWaalsContact O-N 3.09Å
30	K	33.4	Very low	35.8	Very low	199 Å²	199	170.7 Å²	170.7	87%	0.865	85%	0.85	S	S	*	*			trans	-63.8	108	176	-154.8	172.5	-173.6	175.2	0	107.3	R28 R32	R28-K30 PolarHBondContact O-N 3.36Å; K30-R32 PolarHBondContact O-N 3.04Å; K30-R32 VanDerWaalsContact O-N 3.11Å
31	K	36.7	Very low	36.9	Very low	199 Å²	199	170.5 Å²	170.5	87%	0.865	85%	0.849	S	S	*	*			trans	-45.5	116.3	169	-145.5	174.6	-174.4	-179.9	0	106.9	K29 R33	K29-K31 PolarHBondContact O-N 3.01Å; K29-K31 VanDerWaalsContact O-N 3.09Å; K31-R33 PolarHBondContact O-N 3.03Å
32	R	33.7	Very low	39	Very low	246 Å²	246	163.8 Å²	163.8	93%	0.928	82%	0.821	S	S	*	*			trans	-57.4	104.1	176.6	-87.4	172.2	62.6	-175.9	-1.2	107.3	K30 A34	K30-R32 PolarHBondContact O-N 3.04Å; K30-R32 VanDerWaalsContact O-N 3.11Å; R32-A34 PolarHBondContact O-N 3.47Å
33	R	36.2	Very low	41.9	Very low	240 Å²	240	166.7 Å²	166.7	91%	0.906	82%	0.817	S	S	*	*			trans	-68.5	113.5	171.4	-147.5	174.2	176.2	-171.4	-2.5	105.1	K31 R35	K31-R33 PolarHBondContact O-N 3.03Å; R33-R35 PolarHBondContact O-N 3.02Å
34	A	34.1	Very low	44.9	Very low	96 Å²	96	158.8 Å²	158.8	79%	0.793	77%	0.774	S	S	*	*			trans	-54.1	128.9	172.2	0	0	0	0	0	108	R32	R32-A34 PolarHBondContact O-N 3.47Å
35	R	35.9	Very low	48	Very low	222 Å²	222	160 Å²	160	84%	0.838	76%	0.761	S	S	*	*			trans	-69.3	130.6	174.3	-79.9	178.5	175.7	171.6	-3.1	107.6	R33 T37	R33-R35 PolarHBondContact O-N 3.02Å; R35-T37 PolarHBondContact O-N 3.1Å
36	A	41.4	Very low	51	Low	105 Å²	105	157.5 Å²	157.5	87%	0.868	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	62.2	177.8	0	0	0	0	0	111
37	T	41	Very low	53.9	Low	112 Å²	112	147 Å²	147	69%	0.687	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.7	11.8	-179.9	43.7	0	0	0	0	115.2	R35	R35-T37 PolarHBondContact O-N 3.1Å
38	D	35.7	Very low	56.9	Low	159 Å²	159	136 Å²	136	85%	0.85	67%	0.668	S	S	*	*			trans	-124.4	67.8	171.8	-74.5	-34.2	0	0	0	110.2
39	C	40.9	Very low	59.8	Low	126 Å²	126	131.7 Å²	131.7	85%	0.851	66%	0.655	S	S	*	*			trans	-100.4	91.9	160.3	-68.1	0	0	0	0	106.6
40	L	52.4	Low	62.7	Low	156 Å²	156	124.2 Å²	124.2	82%	0.817	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-50.1	141.5	154.4	-70.4	165	0	0	0	107.1	G42	L40-G42 PolarHBondContact O-N 3Å
41	P	59.8	Low	65.7	Low	118 Å²	118	116.5 Å²	116.5	77%	0.766	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-53	120.3	173.9	20.9	-28.9	0	0	0	107.3
42	G	77.9	Confident	68.4	Low	26 Å²	26	113 Å²	113	27%	0.268	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-58.5	160.2	-179.9	0	0	0	0	0	109.9	L40 F114	L40-G42 PolarHBondContact O-N 3Å; G42-F114 WeakPolarHBondContact O-CE1 3.36Å
43	K	90.7	Very high	71.2	Confident	150 Å²	150	104.9 Å²	104.9	65%	0.652	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-62.5	158.5	170.2	-64	-174.5	175.8	-170.8	0	109	E45 D46	K43-E45 WeakPolarHBondContact CB-OE2 3.3Å; K43-E45 PolarHBondContact O-N 2.69Å; K43-D46 WeakPolarHBondContact CB-OD2 3.42Å; K43-D46 PolarHBondContact N-OD2 2.88Å; K43-D46 WeakPolarHBondContact O-CB 3.3Å; K43-D46 PolarHBondContact O-N 3.16Å
44	F	93.8	Very high	73.9	Confident	8 Å²	8	97.9 Å²	97.9	4%	0.035	55%	0.548	C	S	.	.	H	α-helix	trans	-51.3	-42.7	176.9	169.8	-99.2	0	0	0	111.5	D46 M47 Y48 L50 V77 F114 Y121 V123	F44-D46 PolarHBondContact O-N 3.08Å; F44-M47 PolarHBondContact O-N 2.7Å; F44-M47 VanDerWaalsContact O-N 3.13Å; F44-Y48 HydrophobicContact CD2-CD2 4.01Å; F44-Y48 HydrophobicContact CD2-CG 4.39Å; F44-Y48 HydrophobicContact CE2-CD2 4Å; F44-Y48 AromaticContact CE2-CG 3.95Å; F44-Y48 HydrophobicContact CE2-CG 3.95Å; F44-Y48 PolarHBondContact O-N 3.13Å; F44-L50 HydrophobicContact CE1-CD1 4.19Å; F44-L50 HydrophobicContact CE1-CD2 4Å; F44-L50 HydrophobicContact CE1-CG 3.84Å; F44-L50 HydrophobicContact CZ-CD2 3.71Å; F44-L50 HydrophobicContact CZ-CG 4.03Å; F44-V77 HydrophobicContact CE2-CG1 3.87Å; F44-V77 HydrophobicContact CE2-CG2 3.99Å; F44-V77 HydrophobicContact CZ-CG1 4.05Å; F44-V77 HydrophobicContact CZ-CG2 4.13Å; F44-F114 HydrophobicContact CB-CB 4.07Å; F44-F114 HydrophobicContact CB-CD1 4.3Å; F44-F114 HydrophobicContact CB-CD2 4.36Å; F44-F114 HydrophobicContact CB-CG 3.99Å; F44-F114 AromaticContact CD2-CD2 3.93Å; F44-F114 HydrophobicContact CD2-CD2 3.93Å; F44-F114 HydrophobicContact CD2-CE2 4.3Å; F44-F114 HydrophobicContact CD2-CG 4.41Å; F44-Y121 HydrophobicContact CB-CD2 4.02Å; F44-Y121 HydrophobicContact CB-CE2 4.27Å; F44-Y121 HydrophobicContact CB-CG 4.18Å; F44-Y121 AromaticContact CD1-CD1 3.84Å; F44-Y121 HydrophobicContact CD1-CD1 3.84Å; F44-Y121 AromaticContact CD1-CE1 3.86Å; F44-Y121 HydrophobicContact CD1-CE1 3.86Å; F44-Y121 HydrophobicContact CD1-CG 4.29Å; F44-Y121 HydrophobicContact CD2-CD1 4.1Å; F44-Y121 AromaticContact CD2-CG 3.99Å; F44-Y121 HydrophobicContact CD2-CG 3.99Å; F44-Y121 HydrophobicContact CE1-CD1 4.03Å; F44-Y121 HydrophobicContact CE1-CE1 4.14Å; F44-Y121 HydrophobicContact CE2-CD1 4.26Å; F44-Y121 HydrophobicContact CE2-CG 4.5Å; F44-Y121 AromaticContact CG-CD1 3.88Å; F44-Y121 HydrophobicContact CG-CD1 3.88Å; F44-Y121 HydrophobicContact CG-CD2 4.2Å; F44-Y121 HydrophobicContact CG-CE1 4.27Å; F44-Y121 AromaticContact CG-CG 3.87Å; F44-Y121 HydrophobicContact CG-CG 3.87Å; F44-Y121 HydrophobicContact CZ-CD1 4.24Å; F44-V123 HydrophobicContact CD2-CG2 4.39Å; F44-V123 HydrophobicContact CE2-CG2 4.12Å
45	E	94	Very high	76.4	Confident	98 Å²	98	97 Å²	97	46%	0.458	53%	0.53	S	S	.	.	H	α-helix	trans	-67.6	-21	-179.3	-60	76.5	-165.6	0	0	114	K43 M47	K43-E45 WeakPolarHBondContact CB-OE2 3.3Å; K43-E45 PolarHBondContact O-N 2.69Å; E45-M47 VanDerWaalsContact C-N 3.29Å
46	D	93.9	Very high	78.6	Confident	108 Å²	108	87.8 Å²	87.8	58%	0.578	50%	0.504	S	S	*	.	H	α-helix	trans	-77.3	-21.2	176.8	-60.5	-37.1	0	0	0	111.5	K43 F44	K43-D46 WeakPolarHBondContact CB-OD2 3.42Å; K43-D46 PolarHBondContact N-OD2 2.88Å; K43-D46 WeakPolarHBondContact O-CB 3.3Å; K43-D46 PolarHBondContact O-N 3.16Å; F44-D46 PolarHBondContact O-N 3.08Å
47	M	94.9	Very high	80.3	Confident	27 Å²	27	90.2 Å²	90.2	13%	0.133	50%	0.497	C	S	.	.	H	α-helix	trans	-115.2	-28.8	-172.7	-66.5	-177.2	59	0	0	113.5	F44 E45 S68 L69 E112 F114	F44-M47 PolarHBondContact O-N 2.7Å; F44-M47 VanDerWaalsContact O-N 3.13Å; E45-M47 VanDerWaalsContact C-N 3.29Å; M47-S68 WeakPolarHBondContact O-CA 3.48Å; M47-L69 PolarHBondContact O-N 3.3Å; M47-E112 WeakPolarHBondContact CE-OE1 3.39Å; M47-E112 WeakPolarHBondContact CE-OE2 3.46Å; M47-F114 HydrophobicContact CE-CZ 4.24Å; M47-F114 HydrophobicContact SD-CE1 3.87Å; M47-F114 HydrophobicContact SD-CZ 3.89Å
48	Y	96.9	Very high	81.6	Confident	11 Å²	11	87.1 Å²	87.1	4%	0.043	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	147.6	-174.9	-62.6	-87.1	0	0	0	112	F44 V67 Y75 E112 F114 V123	F44-Y48 HydrophobicContact CD2-CD2 4.01Å; F44-Y48 HydrophobicContact CD2-CG 4.39Å; F44-Y48 HydrophobicContact CE2-CD2 4Å; F44-Y48 AromaticContact CE2-CG 3.95Å; F44-Y48 HydrophobicContact CE2-CG 3.95Å; F44-Y48 PolarHBondContact O-N 3.13Å; Y48-V67 WeakPolarHBondContact CA-O 3.33Å; Y48-Y75 HydrophobicContact CD1-CD2 4.19Å; Y48-Y75 AromaticContact CE1-CD2 3.68Å; Y48-Y75 HydrophobicContact CE1-CD2 3.68Å; Y48-Y75 AromaticContact CE1-CE2 3.95Å; Y48-Y75 HydrophobicContact CE1-CE2 3.95Å; Y48-Y75 HydrophobicContact CE1-CG 4.15Å; Y48-E112 WeakPolarHBondContact CE2-OE2 3.39Å; Y48-E112 VanDerWaalsContact CZ-OE2 3.25Å; Y48-E112 PolarHBondContact OH-OE2 3.03Å; Y48-F114 HydrophobicContact CD2-CE2 4.07Å; Y48-F114 HydrophobicContact CD2-CZ 4.2Å; Y48-F114 AromaticContact CE2-CE2 3.69Å; Y48-F114 HydrophobicContact CE2-CE2 3.69Å; Y48-F114 AromaticContact CE2-CZ 3.75Å; Y48-F114 HydrophobicContact CE2-CZ 3.75Å; Y48-V123 HydrophobicContact CD1-CG1 4.5Å; Y48-V123 HydrophobicContact CD2-CG2 4.44Å; Y48-V123 HydrophobicContact CE1-CG1 3.9Å; Y48-V123 HydrophobicContact CE2-CG2 4.23Å
49	K	97.1	Very high	83	Confident	144 Å²	144	83.6 Å²	83.6	63%	0.626	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.7	121.5	170.5	-177.8	179.4	179.1	-177.1	0	109.7	A66 V67 L69	K49-A66 CarbonylContact O-C 3.55Å; K49-A66 VanDerWaalsContact O-CA 3.28Å; K49-A66 WeakPolarHBondContact O-CA 3.25Å; K49-V67 PolarHBondContact N-O 3.41Å; K49-V67 PolarHBondContact O-N 3.09Å; K49-L69 HydrophobicContact CB-CD2 3.99Å
50	L	97	Very high	84.4	Confident	59 Å²	59	84 Å²	84	31%	0.309	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	140.1	173.8	-64.8	170	0	0	0	110.8	F44 Q64 A66 V77 I79	F44-L50 HydrophobicContact CE1-CD1 4.19Å; F44-L50 HydrophobicContact CE1-CD2 4Å; F44-L50 HydrophobicContact CE1-CG 3.84Å; F44-L50 HydrophobicContact CZ-CD2 3.71Å; F44-L50 HydrophobicContact CZ-CG 4.03Å; L50-Q64 HydrophobicContact CD2-CB 4.34Å; L50-A66 HydrophobicContact CD2-CB 4.25Å; L50-V77 HydrophobicContact CD2-CB 4.31Å; L50-I79 HydrophobicContact CD1-CD1 3.9Å; L50-I79 HydrophobicContact CD2-CD1 3.96Å
51	T	96.1	Very high	85.9	Confident	37 Å²	37	77.8 Å²	77.8	23%	0.227	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	168.1	172.3	72.8	0	0	0	0	110	E53 Q64 G65 V67	T51-E53 PolarHBondContact O-N 3.32Å; T51-E53 WeakPolarHBondContact OG1-CB 3.48Å; T51-E53 PolarHBondContact OG1-N 3.29Å; T51-Q64 VanDerWaalsContact O-CG 3.32Å; T51-Q64 WeakPolarHBondContact O-CG 3.14Å; T51-Q64 PolarHBondContact O-NE2 2.7Å; T51-G65 PolarHBondContact N-O 3.18Å; T51-G65 VanDerWaalsContact OG1-C 3.32Å; T51-G65 WeakPolarHBondContact OG1-CA 3.47Å; T51-G65 PolarHBondContact OG1-O 2.9Å; T51-V67 HydrophobicContact CG2-CG2 3.79Å
52	S	92.8	Very high	87.3	Confident	124 Å²	124	75.6 Å²	75.6	87%	0.867	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	-2.7	174.7	55.2	0	0	0	0	113.7	L54	S52-L54 PolarHBondContact O-N 2.98Å
53	E	93.3	Very high	88	Confident	76 Å²	76	76.4 Å²	76.4	36%	0.355	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	108.8	-175.7	-174.6	-173.8	-166.8	0	0	110.4	T51 L55 Q64 G65 K126	T51-E53 PolarHBondContact O-N 3.32Å; T51-E53 WeakPolarHBondContact OG1-CB 3.48Å; T51-E53 PolarHBondContact OG1-N 3.29Å; E53-L55 HydrophobicContact CG-CD2 3.81Å; E53-L55 HydrophobicContact CG-CG 4.42Å; E53-L55 WeakPolarHBondContact OE1-CD2 3.39Å; E53-Q64 WeakPolarHBondContact O-CA 3.38Å; E53-Q64 WeakPolarHBondContact O-CG 3.24Å; E53-G65 PolarHBondContact O-N 2.95Å; E53-K126 IonicContact OE1-NZ 2.73Å; E53-K126 PolarHBondContact OE1-NZ 3.19Å; E53-K126 IonicContact OE2-NZ 3.4Å; E53-K126 PolarHBondContact OE2-NZ 2.71Å
54	L	91.7	Very high	88.2	Confident	94 Å²	94	70.8 Å²	70.8	49%	0.492	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	118.3	171.5	-173.8	68.9	0	0	0	108.9	S52 E57 K62	S52-L54 PolarHBondContact O-N 2.98Å; L54-E57 HydrophobicContact CD2-CB 4.34Å; L54-K62 HydrophobicContact CD1-CB 4.37Å
55	L	87.8	Confident	88.4	Confident	78 Å²	78	70.5 Å²	70.5	41%	0.408	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-25.4	-178.5	-61.7	175.1	0	0	0	112	E53 V63 A76	E53-L55 HydrophobicContact CG-CD2 3.81Å; E53-L55 HydrophobicContact CG-CG 4.42Å; E53-L55 WeakPolarHBondContact OE1-CD2 3.39Å; L55-V63 HydrophobicContact CB-CB 4.31Å; L55-V63 HydrophobicContact CB-CG1 4.02Å; L55-V63 HydrophobicContact CD1-CG1 4.36Å; L55-V63 PolarHBondContact N-O 2.89Å; L55-A76 HydrophobicContact CD1-CB 3.71Å
56	G	81.3	Confident	88.5	Confident	28 Å²	28	65.9 Å²	65.9	29%	0.289	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.9	155.9	176.2	0	0	0	0	0	111.6	V63	G56-V63 PolarHBondContact N-O 2.97Å; G56-V63 PolarHBondContact O-N 2.83Å
57	E	77.4	Confident	88.7	Confident	155 Å²	155	62.8 Å²	62.8	72%	0.724	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.2	131.3	178.7	-173.6	170.4	-169.1	0	0	109.2	L54	L54-E57 HydrophobicContact CD2-CB 4.34Å
58	G	68.3	Low	88.8	Confident	47 Å²	47	61.7 Å²	61.7	49%	0.485	35%	0.348	S	S	.	.			trans	-130.7	177.7	174.6	0	0	0	0	0	110.7	Y60 A61	G58-Y60 PolarHBondContact O-N 2.65Å; G58-Y60 VanDerWaalsContact O-N 3.09Å; G58-A61 CarbonylContact C-O 3.34Å; G58-A61 WeakPolarHBondContact CA-O 3.16Å; G58-A61 PolarHBondContact N-O 2.74Å
59	A	65.5	Low	88.7	Confident	86 Å²	86	66 Å²	66	71%	0.711	37%	0.371	S	S	*	.	S	Bend	trans	-58.9	-28.5	-173.2	0	0	0	0	0	114.7
60	Y	70.8	Confident	88.5	Confident	134 Å²	134	66.1 Å²	66.1	53%	0.525	37%	0.374	S	S	.	.	S	Bend	trans	-133.3	-0.8	-172.4	-50.8	-71.1	0	0	0	113.9	G58 E81 H86	G58-Y60 PolarHBondContact O-N 2.65Å; G58-Y60 VanDerWaalsContact O-N 3.09Å; Y60-E81 PolarHBondContact O-N 3.09Å; Y60-H86 VanDerWaalsContact CB-CE1 3.48Å; Y60-H86 WeakPolarHBondContact CB-CE1 3.5Å; Y60-H86 AromaticContact CD1-CE1 3.49Å; Y60-H86 VanDerWaalsContact CD1-CE1 3.49Å; Y60-H86 WeakPolarHBondContact CD1-CE1 3.49Å; Y60-H86 AromaticContact CD1-NE2 3.16Å; Y60-H86 WeakPolarHBondContact CD1-NE2 3.48Å; Y60-H86 AromaticContact CD2-CE1 3.83Å; Y60-H86 AromaticContact CE1-NE2 3.88Å; Y60-H86 AromaticContact CG-CE1 3.3Å; Y60-H86 AromaticContact CG-NE2 3.43Å
61	A	83.4	Confident	88.3	Confident	26 Å²	26	68 Å²	68	22%	0.215	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	146.6	-176.5	0	0	0	0	0	110	G58 K78 I79 I80	G58-A61 CarbonylContact C-O 3.34Å; G58-A61 WeakPolarHBondContact CA-O 3.16Å; G58-A61 PolarHBondContact N-O 2.74Å; A61-K78 HydrophobicContact CB-CG 4.37Å; A61-I79 WeakPolarHBondContact CA-O 3.49Å; A61-I80 HydrophobicContact CB-CG1 3.97Å
62	K	89.1	Confident	88.3	Confident	71 Å²	71	68.7 Å²	68.7	31%	0.309	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	146	169.9	65.8	-179.5	-177.4	-178.8	0	110	L54 I79	L54-K62 HydrophobicContact CD1-CB 4.37Å; K62-I79 HydrophobicContact CG-CB 4.06Å; K62-I79 HydrophobicContact CG-CD1 4.34Å; K62-I79 PolarHBondContact N-O 2.91Å; K62-I79 PolarHBondContact O-N 3.46Å
63	V	92.1	Very high	88.4	Confident	43 Å²	43	68.4 Å²	68.4	26%	0.261	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	121.8	176.6	-171.1	0	0	0	0	108.2	L55 G56 A76 V77 K78	L55-V63 HydrophobicContact CB-CB 4.31Å; L55-V63 HydrophobicContact CB-CG1 4.02Å; L55-V63 HydrophobicContact CD1-CG1 4.36Å; L55-V63 PolarHBondContact N-O 2.89Å; G56-V63 PolarHBondContact N-O 2.97Å; G56-V63 PolarHBondContact O-N 2.83Å; V63-A76 HydrophobicContact CG1-CB 4.33Å; V63-V77 WeakPolarHBondContact CA-O 3.44Å; V63-K78 HydrophobicContact CG2-CB 4.32Å; V63-K78 HydrophobicContact CG2-CG 4.23Å
64	Q	95.5	Very high	88.6	Confident	33 Å²	33	68.8 Å²	68.8	15%	0.154	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	148.4	-175.6	-164.7	168	25.3	0	0	110.6	L50 T51 E53 V77 I79	L50-Q64 HydrophobicContact CD2-CB 4.34Å; T51-Q64 VanDerWaalsContact O-CG 3.32Å; T51-Q64 WeakPolarHBondContact O-CG 3.14Å; T51-Q64 PolarHBondContact O-NE2 2.7Å; E53-Q64 WeakPolarHBondContact O-CA 3.38Å; E53-Q64 WeakPolarHBondContact O-CG 3.24Å; Q64-V77 PolarHBondContact N-O 2.98Å; Q64-V77 PolarHBondContact O-N 3.38Å; Q64-I79 HydrophobicContact CB-CD1 4.41Å
65	G	96.6	Very high	88.9	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.01	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	147.5	169.9	0	0	0	0	0	111.4	T51 E53 Y75	T51-G65 PolarHBondContact N-O 3.18Å; T51-G65 VanDerWaalsContact OG1-C 3.32Å; T51-G65 WeakPolarHBondContact OG1-CA 3.47Å; T51-G65 PolarHBondContact OG1-O 2.9Å; E53-G65 PolarHBondContact O-N 2.95Å; G65-Y75 CarbonylContact C-O 3.53Å; G65-Y75 WeakPolarHBondContact CA-O 3.4Å
66	A	97.4	Very high	89.3	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.008	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	155.8	172.2	0	0	0	0	0	110.9	K49 L50 E74 Y75 V77	K49-A66 CarbonylContact O-C 3.55Å; K49-A66 VanDerWaalsContact O-CA 3.28Å; K49-A66 WeakPolarHBondContact O-CA 3.25Å; L50-A66 HydrophobicContact CD2-CB 4.25Å; A66-E74 CarbonylContact O-C 3.58Å; A66-E74 WeakPolarHBondContact O-CA 3.15Å; A66-Y75 PolarHBondContact N-O 2.99Å; A66-Y75 PolarHBondContact O-N 2.99Å; A66-V77 HydrophobicContact CB-CG2 3.41Å; A66-V77 VanDerWaalsContact CB-CG2 3.41Å
67	V	97.5	Very high	90	Very high	43 Å²	43	60.6 Å²	60.6	26%	0.261	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.2	174.1	-177.8	0	0	0	0	108.4	Y48 K49 T51 L69 K73 E74	Y48-V67 WeakPolarHBondContact CA-O 3.33Å; K49-V67 PolarHBondContact N-O 3.41Å; K49-V67 PolarHBondContact O-N 3.09Å; T51-V67 HydrophobicContact CG2-CG2 3.79Å; V67-L69 PolarHBondContact O-N 3.09Å; V67-K73 WeakPolarHBondContact CA-O 3.48Å; V67-E74 HydrophobicContact CG2-CG 4.39Å
68	S	96.6	Very high	90.7	Very high	4 Å²	4	54.3 Å²	54.3	3%	0.028	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	130.6	173.3	174.2	0	0	0	0	110.4	M47 Q70 N71 G72 K73	M47-S68 WeakPolarHBondContact O-CA 3.48Å; S68-Q70 PolarHBondContact O-N 3.28Å; S68-Q70 PolarHBondContact OG-N 3.11Å; S68-N71 VanDerWaalsContact CB-OD1 3.24Å; S68-N71 WeakPolarHBondContact CB-OD1 3.49Å; S68-N71 PolarHBondContact OG-OD1 2.74Å; S68-G72 VanDerWaalsContact O-CA 3.24Å; S68-G72 WeakPolarHBondContact O-CA 3.37Å; S68-G72 PolarHBondContact O-N 3.3Å; S68-K73 PolarHBondContact N-O 3.24Å
69	L	95.5	Very high	91.8	Very high	101 Å²	101	52.1 Å²	52.1	53%	0.529	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-17.6	177.8	-63.2	178.8	0	0	0	112.6	M47 K49 V67	M47-L69 PolarHBondContact O-N 3.3Å; K49-L69 HydrophobicContact CB-CD2 3.99Å; V67-L69 PolarHBondContact O-N 3.09Å
70	Q	93.1	Very high	92.8	Very high	148 Å²	148	48.6 Å²	48.6	69%	0.692	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-43.4	-177.8	-63.2	-177	10.7	0	0	112.8	S68	S68-Q70 PolarHBondContact O-N 3.28Å; S68-Q70 PolarHBondContact OG-N 3.11Å
71	N	93.3	Very high	93.6	Very high	99 Å²	99	46.2 Å²	46.2	53%	0.529	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-3.2	-172	61.2	26.8	0	0	0	114.1	S68 K73	S68-N71 VanDerWaalsContact CB-OD1 3.24Å; S68-N71 WeakPolarHBondContact CB-OD1 3.49Å; S68-N71 PolarHBondContact OG-OD1 2.74Å; N71-K73 PolarHBondContact O-N 2.9Å; N71-K73 WeakPolarHBondContact OD1-CB 3.48Å; N71-K73 PolarHBondContact OD1-N 3.19Å
72	G	94.4	Very high	93.7	Very high	50 Å²	50	48.4 Å²	48.4	52%	0.515	25%	0.249	S	C	.	.			trans	69.8	7.9	-179.3	0	0	0	0	0	114.7	S68	S68-G72 VanDerWaalsContact O-CA 3.24Å; S68-G72 WeakPolarHBondContact O-CA 3.37Å; S68-G72 PolarHBondContact O-N 3.3Å
73	K	96.4	Very high	92.9	Very high	118 Å²	118	49.3 Å²	49.3	51%	0.513	25%	0.254	S	S	.	.			trans	-74.9	143.4	178.9	-176	172.9	169.9	-168.3	0	110.6	V67 S68 N71 Y75	V67-K73 WeakPolarHBondContact CA-O 3.48Å; S68-K73 PolarHBondContact N-O 3.24Å; N71-K73 PolarHBondContact O-N 2.9Å; N71-K73 WeakPolarHBondContact OD1-CB 3.48Å; N71-K73 PolarHBondContact OD1-N 3.19Å; K73-Y75 HydrophobicContact CB-CE2 3.79Å; K73-Y75 HydrophobicContact CD-CE2 4.42Å; K73-Y75 WeakPolarHBondContact CD-OH 3.5Å; K73-Y75 HydrophobicContact CG-CE2 3.97Å; K73-Y75 WeakPolarHBondContact O-CD2 3.34Å; K73-Y75 VanDerWaalsContact O-CE2 3.25Å; K73-Y75 WeakPolarHBondContact O-CE2 3.26Å
74	E	96.9	Very high	91.3	Very high	85 Å²	85	52.8 Å²	52.8	40%	0.397	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	145.2	176	-58.5	-167.7	160.8	0	0	112.5	A66 V67 K126 Q128	A66-E74 CarbonylContact O-C 3.58Å; A66-E74 WeakPolarHBondContact O-CA 3.15Å; V67-E74 HydrophobicContact CG2-CG 4.39Å; E74-K126 HydrophobicContact CB-CD 3.91Å; E74-K126 WeakPolarHBondContact OE2-CD 3.14Å; E74-K126 IonicContact OE2-NZ 3.71Å; E74-K126 PolarHBondContact OE2-NZ 3.28Å; E74-Q128 PolarHBondContact OE2-NE2 2.88Å; E74-Q128 VanDerWaalsContact OE2-NE2 3.15Å
75	Y	97.3	Very high	89.4	Confident	16 Å²	16	54.2 Å²	54.2	6%	0.063	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	162.7	-179.4	-65	-85.6	0	0	0	110.4	Y48 G65 A66 K73 I111 V123 F124	Y48-Y75 HydrophobicContact CD1-CD2 4.19Å; Y48-Y75 AromaticContact CE1-CD2 3.68Å; Y48-Y75 HydrophobicContact CE1-CD2 3.68Å; Y48-Y75 AromaticContact CE1-CE2 3.95Å; Y48-Y75 HydrophobicContact CE1-CE2 3.95Å; Y48-Y75 HydrophobicContact CE1-CG 4.15Å; G65-Y75 CarbonylContact C-O 3.53Å; G65-Y75 WeakPolarHBondContact CA-O 3.4Å; A66-Y75 PolarHBondContact N-O 2.99Å; A66-Y75 PolarHBondContact O-N 2.99Å; K73-Y75 HydrophobicContact CB-CE2 3.79Å; K73-Y75 HydrophobicContact CD-CE2 4.42Å; K73-Y75 WeakPolarHBondContact CD-OH 3.5Å; K73-Y75 HydrophobicContact CG-CE2 3.97Å; K73-Y75 WeakPolarHBondContact O-CD2 3.34Å; K73-Y75 VanDerWaalsContact O-CE2 3.25Å; K73-Y75 WeakPolarHBondContact O-CE2 3.26Å; Y75-I111 HydrophobicContact CD1-CG1 4.06Å; Y75-I111 HydrophobicContact CE1-CB 4.48Å; Y75-I111 HydrophobicContact CE1-CG1 3.96Å; Y75-I111 HydrophobicContact CE1-CG2 4.11Å; Y75-V123 HydrophobicContact CD1-CG1 3.96Å; Y75-V123 HydrophobicContact CG-CG1 3.94Å; Y75-F124 WeakPolarHBondContact CB-O 3.44Å; Y75-F124 WeakPolarHBondContact CD1-O 3.49Å
76	A	96.5	Very high	87.7	Confident	11 Å²	11	56.4 Å²	56.4	9%	0.091	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.3	168.7	0	0	0	0	0	108.6	L55 V63 F124	L55-A76 HydrophobicContact CD1-CB 3.71Å; V63-A76 HydrophobicContact CG1-CB 4.33Å; A76-F124 PolarHBondContact N-O 3.17Å; A76-F124 PolarHBondContact O-N 3.14Å
77	V	95.4	Very high	86.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	116.9	-176.8	-175.2	0	0	0	0	109.5	F44 L50 V63 Q64 A66 I79 Y121 L122 V123	F44-V77 HydrophobicContact CE2-CG1 3.87Å; F44-V77 HydrophobicContact CE2-CG2 3.99Å; F44-V77 HydrophobicContact CZ-CG1 4.05Å; F44-V77 HydrophobicContact CZ-CG2 4.13Å; L50-V77 HydrophobicContact CD2-CB 4.31Å; V63-V77 WeakPolarHBondContact CA-O 3.44Å; Q64-V77 PolarHBondContact N-O 2.98Å; Q64-V77 PolarHBondContact O-N 3.38Å; A66-V77 HydrophobicContact CB-CG2 3.41Å; A66-V77 VanDerWaalsContact CB-CG2 3.41Å; V77-I79 HydrophobicContact CG1-CG1 3.96Å; V77-Y121 HydrophobicContact CG1-CD1 4.13Å; V77-L122 WeakPolarHBondContact CA-O 3.49Å; V77-V123 HydrophobicContact CG1-CG2 4.5Å; V77-V123 HydrophobicContact CG2-CG1 4.37Å; V77-V123 HydrophobicContact CG2-CG2 4.17Å
78	K	92.2	Very high	85.2	Confident	23 Å²	23	63.5 Å²	63.5	10%	0.1	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	114.3	169.7	-171	-177.2	-168.5	176.6	0	107.9	A61 V63 I80 E94 Y121 L122 F124 D232	A61-K78 HydrophobicContact CB-CG 4.37Å; V63-K78 HydrophobicContact CG2-CB 4.32Å; V63-K78 HydrophobicContact CG2-CG 4.23Å; K78-I80 HydrophobicContact CD-CD1 4.42Å; K78-I80 HydrophobicContact CG-CG1 4.24Å; K78-E94 IonicContact NZ-OE1 3.28Å; K78-E94 PolarHBondContact NZ-OE1 2.94Å; K78-E94 IonicContact NZ-OE2 3.05Å; K78-Y121 WeakPolarHBondContact O-CA 3.33Å; K78-L122 HydrophobicContact CB-CB 4.3Å; K78-L122 PolarHBondContact N-O 2.96Å; K78-L122 PolarHBondContact O-N 3.34Å; K78-F124 HydrophobicContact CB-CE2 3.93Å; K78-D232 IonicContact NZ-OD1 2.63Å; K78-D232 PolarHBondContact NZ-OD1 3.07Å; K78-D232 IonicContact NZ-OD2 3.17Å
79	I	91.7	Very high	84.2	Confident	1 Å²	1	66 Å²	66	1%	0.005	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	115.8	-178.4	-53.1	169.8	0	0	0	107.3	L50 A61 K62 Q64 V77 R119 F120 Y121	L50-I79 HydrophobicContact CD1-CD1 3.9Å; L50-I79 HydrophobicContact CD2-CD1 3.96Å; A61-I79 WeakPolarHBondContact CA-O 3.49Å; K62-I79 HydrophobicContact CG-CB 4.06Å; K62-I79 HydrophobicContact CG-CD1 4.34Å; K62-I79 PolarHBondContact N-O 2.91Å; K62-I79 PolarHBondContact O-N 3.46Å; Q64-I79 HydrophobicContact CB-CD1 4.41Å; V77-I79 HydrophobicContact CG1-CG1 3.96Å; I79-R119 HydrophobicContact CG2-CB 4.5Å; I79-R119 HydrophobicContact CG2-CG 4.27Å; I79-F120 WeakPolarHBondContact CA-O 3.46Å; I79-Y121 HydrophobicContact CG1-CD1 3.96Å; I79-Y121 HydrophobicContact CG1-CE1 4.23Å; I79-Y121 HydrophobicContact CG2-CD1 4.26Å; I79-Y121 HydrophobicContact CG2-CE1 3.98Å
80	I	87.9	Confident	83.2	Confident	13 Å²	13	66.2 Å²	66.2	7%	0.067	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.1	-178.7	-52.5	173.6	0	0	0	108.3	A61 K78 V91 R119 F120 L122	A61-I80 HydrophobicContact CB-CG1 3.97Å; K78-I80 HydrophobicContact CD-CD1 4.42Å; K78-I80 HydrophobicContact CG-CG1 4.24Å; I80-V91 HydrophobicContact CD1-CG1 4.32Å; I80-V91 HydrophobicContact CD1-CG2 4.09Å; I80-R119 CarbonylContact O-C 3.56Å; I80-R119 VanDerWaalsContact O-CA 3.24Å; I80-R119 WeakPolarHBondContact O-CA 3.22Å; I80-F120 HydrophobicContact CB-CB 4.28Å; I80-F120 HydrophobicContact CB-CD2 4.45Å; I80-F120 PolarHBondContact N-O 3.32Å; I80-F120 PolarHBondContact O-N 2.9Å; I80-L122 HydrophobicContact CD1-CD1 4.22Å
81	E	86.4	Confident	82.6	Confident	83 Å²	83	59.5 Å²	59.5	39%	0.388	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	137.2	178.6	-62.5	-168.9	162.6	0	0	111.8	Y60 Q83 R119	Y60-E81 PolarHBondContact O-N 3.09Å; E81-Q83 HydrophobicContact CB-CG 4.36Å; E81-Q83 PolarHBondContact O-N 3.04Å; E81-R119 HydrophobicContact CG-CG 4.49Å; E81-R119 IonicContact OE1-NH2 3.95Å
82	K	85.6	Confident	82	Confident	72 Å²	72	58.6 Å²	58.6	31%	0.313	32%	0.324	S	S	.	.			trans	-78.8	82.1	176.1	-65.4	179.9	176.1	-168.6	0	110	E115 D116 D117 T118 F120	K82-E115 IonicContact NZ-OE1 2.69Å; K82-E115 PolarHBondContact NZ-OE1 3.35Å; K82-D116 WeakPolarHBondContact CE-O 3.5Å; K82-D116 PolarHBondContact NZ-O 3.48Å; K82-D117 WeakPolarHBondContact CD-O 3.45Å; K82-T118 VanDerWaalsContact CB-O 3.3Å; K82-T118 WeakPolarHBondContact CB-O 3.44Å; K82-T118 WeakPolarHBondContact CG-O 3.43Å; K82-T118 PolarHBondContact N-O 2.99Å; K82-F120 HydrophobicContact CD-CE2 4.24Å; K82-F120 HydrophobicContact CD-CZ 4.35Å; K82-F120 VanDerWaalsContact CE-CZ 3.48Å; K82-F120 HydrophobicContact CG-CD2 4.03Å; K82-F120 HydrophobicContact CG-CE2 3.66Å; K82-F120 HydrophobicContact CG-CZ 4.25Å
83	Q	73.1	Confident	81.2	Confident	90 Å²	90	62.5 Å²	62.5	42%	0.421	32%	0.323	S	S	.	.			trans	-92	155.6	170.4	-47.9	-179.1	1.1	0	0	111.5	E81 G85 H86	E81-Q83 HydrophobicContact CB-CG 4.36Å; E81-Q83 PolarHBondContact O-N 3.04Å; Q83-G85 PolarHBondContact O-N 3.5Å; Q83-H86 PolarHBondContact O-N 2.62Å; Q83-H86 VanDerWaalsContact O-N 3.1Å
84	A	58.1	Low	80.3	Confident	117 Å²	117	57.8 Å²	57.8	97%	0.967	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	107.5	178.2	0	0	0	0	0	110.7
85	G	56.3	Low	79.7	Confident	62 Å²	62	55 Å²	55	64%	0.639	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	118	-11.6	-178.2	0	0	0	0	0	115.1	Q83 S87	Q83-G85 PolarHBondContact O-N 3.5Å; G85-S87 PolarHBondContact O-N 3.22Å
86	H	61.2	Low	78.8	Confident	48 Å²	48	58.5 Å²	58.5	22%	0.222	31%	0.309	C	S	.	.			trans	-76.4	108.2	164.2	-71.1	-64.2	0	0	0	109	Y60 Q83 R88	Y60-H86 VanDerWaalsContact CB-CE1 3.48Å; Y60-H86 WeakPolarHBondContact CB-CE1 3.5Å; Y60-H86 AromaticContact CD1-CE1 3.49Å; Y60-H86 VanDerWaalsContact CD1-CE1 3.49Å; Y60-H86 WeakPolarHBondContact CD1-CE1 3.49Å; Y60-H86 AromaticContact CD1-NE2 3.16Å; Y60-H86 WeakPolarHBondContact CD1-NE2 3.48Å; Y60-H86 AromaticContact CD2-CE1 3.83Å; Y60-H86 AromaticContact CE1-NE2 3.88Å; Y60-H86 AromaticContact CG-CE1 3.3Å; Y60-H86 AromaticContact CG-NE2 3.43Å; Q83-H86 PolarHBondContact O-N 2.62Å; Q83-H86 VanDerWaalsContact O-N 3.1Å; H86-R88 PolarHBondContact O-N 3.04Å
87	S	63.2	Low	77.8	Confident	59 Å²	59	58.4 Å²	58.4	41%	0.413	31%	0.307	S	S	.	.			trans	-71.2	118	176.5	-162	0	0	0	0	108.6	G85 S89 R90	G85-S87 PolarHBondContact O-N 3.22Å; S87-S89 WeakPolarHBondContact CB-OG 3.29Å; S87-S89 PolarHBondContact O-N 2.8Å; S87-S89 PolarHBondContact OG-N 3.29Å; S87-S89 PolarHBondContact OG-OG 2.99Å; S87-R90 WeakPolarHBondContact O-CB 3.41Å; S87-R90 PolarHBondContact O-N 2.93Å
88	R	77.6	Confident	77.2	Confident	133 Å²	133	58.7 Å²	58.7	50%	0.502	31%	0.308	S	S	.	.	H	α-helix	trans	-42.4	-37.8	165	177.2	178.5	176.8	141.1	8.3	110.6	H86 R90 V91 F92 E115 F120	H86-R88 PolarHBondContact O-N 3.04Å; R88-R90 VanDerWaalsContact C-N 3.3Å; R88-R90 PolarHBondContact O-N 2.97Å; R88-V91 PolarHBondContact O-N 2.85Å; R88-F92 HydrophobicContact CG-CD2 3.65Å; R88-F92 HydrophobicContact CG-CE2 3.57Å; R88-F92 VanDerWaalsContact O-CD2 3.26Å; R88-F92 WeakPolarHBondContact O-CD2 3.33Å; R88-F92 PolarHBondContact O-N 3.03Å; R88-E115 IonicContact CZ-OE1 3.13Å; R88-E115 VanDerWaalsContact CZ-OE1 3.23Å; R88-E115 IonicContact CZ-OE2 3.93Å; R88-E115 IonicContact NE-OE1 3.77Å; R88-E115 IonicContact NE-OE2 2.98Å; R88-E115 IonicContact NH1-OE1 3.53Å; R88-E115 PolarHBondContact NH1-OE1 3.24Å; R88-E115 IonicContact NH1-OE2 3.64Å; R88-E115 IonicContact NH2-OE1 2.71Å; R88-E115 IonicContact NH2-OE2 3.23Å; R88-E115 PolarHBondContact NH2-OE2 3.28Å; R88-F120 HydrophobicContact CB-CZ 4.11Å; R88-F120 HydrophobicContact CG-CE1 4.29Å; R88-F120 HydrophobicContact CG-CZ 3.96Å
89	S	75.4	Confident	76.7	Confident	56 Å²	56	64.7 Å²	64.7	39%	0.392	33%	0.331	S	S	.	.	H	α-helix	trans	-60.1	-31.3	176.3	64.4	0	0	0	0	114.6	S87 R93	S87-S89 WeakPolarHBondContact CB-OG 3.29Å; S87-S89 PolarHBondContact O-N 2.8Å; S87-S89 PolarHBondContact OG-N 3.29Å; S87-S89 PolarHBondContact OG-OG 2.99Å; S89-R93 WeakPolarHBondContact O-CB 3.45Å; S89-R93 PolarHBondContact O-N 3.34Å
90	R	75.5	Confident	76.1	Confident	106 Å²	106	66.9 Å²	66.9	40%	0.4	34%	0.342	S	S	.	.	H	α-helix	trans	-65.3	-46.9	175.1	-176.1	178.4	-178.2	179	5.7	111.3	S87 R88 F92 R93 E94 D234	S87-R90 WeakPolarHBondContact O-CB 3.41Å; S87-R90 PolarHBondContact O-N 2.93Å; R88-R90 VanDerWaalsContact C-N 3.3Å; R88-R90 PolarHBondContact O-N 2.97Å; R90-F92 VanDerWaalsContact C-N 3.35Å; R90-R93 PolarHBondContact O-N 2.87Å; R90-E94 PolarHBondContact O-N 3.28Å; R90-D234 IonicContact CZ-OD1 3.75Å; R90-D234 IonicContact NE-OD1 2.74Å; R90-D234 IonicContact NH2-OD1 2.81Å; R90-D234 PolarHBondContact NH2-OD1 3.25Å; R90-D234 IonicContact NH2-OD2 3.28Å; R90-D234 PolarHBondContact NH2-OD2 3.15Å
91	V	79.8	Confident	75.8	Confident	8 Å²	8	66.3 Å²	66.3	5%	0.048	34%	0.339	C	S	.	.	H	α-helix	trans	-64.9	-42.4	179.2	-178.4	0	0	0	0	110.3	I80 R88 R93 E94 V95 F113 F120 L122	I80-V91 HydrophobicContact CD1-CG1 4.32Å; I80-V91 HydrophobicContact CD1-CG2 4.09Å; R88-V91 PolarHBondContact O-N 2.85Å; V91-R93 PolarHBondContact O-N 3.05Å; V91-E94 WeakPolarHBondContact O-CB 3.46Å; V91-E94 PolarHBondContact O-N 2.82Å; V91-V95 WeakPolarHBondContact O-CG2 3.32Å; V91-V95 PolarHBondContact O-N 2.98Å; V91-F113 HydrophobicContact CG1-CE2 4.02Å; V91-F120 HydrophobicContact CB-CD2 4.46Å; V91-F120 HydrophobicContact CG1-CB 4.14Å; V91-F120 HydrophobicContact CG1-CD1 4.23Å; V91-F120 HydrophobicContact CG1-CD2 4.32Å; V91-F120 HydrophobicContact CG1-CG 3.99Å; V91-F120 HydrophobicContact CG2-CD2 3.91Å; V91-F120 HydrophobicContact CG2-CE2 4.05Å; V91-F120 HydrophobicContact CG2-CG 4.42Å; V91-L122 HydrophobicContact CG1-CD1 4.01Å
92	F	81.2	Confident	75.5	Confident	79 Å²	79	66 Å²	66	35%	0.346	34%	0.338	S	S	.	.	H	α-helix	trans	-64.2	-38.6	177.2	-87.5	-102.6	0	0	0	112.6	R88 R90 E94 V95 E96 F113 F120	R88-F92 HydrophobicContact CG-CD2 3.65Å; R88-F92 HydrophobicContact CG-CE2 3.57Å; R88-F92 VanDerWaalsContact O-CD2 3.26Å; R88-F92 WeakPolarHBondContact O-CD2 3.33Å; R88-F92 PolarHBondContact O-N 3.03Å; R90-F92 VanDerWaalsContact C-N 3.35Å; F92-E94 VanDerWaalsContact C-N 3.34Å; F92-V95 PolarHBondContact O-N 2.87Å; F92-E96 WeakPolarHBondContact O-CB 3.44Å; F92-E96 PolarHBondContact O-N 3.11Å; F92-F113 HydrophobicContact CE2-CE1 4.39Å; F92-F113 HydrophobicContact CE2-CZ 4.1Å; F92-F113 HydrophobicContact CZ-CE1 4.09Å; F92-F113 HydrophobicContact CZ-CZ 4.27Å; F92-F120 HydrophobicContact CE2-CE1 4.32Å
93	R	76.8	Confident	75.2	Confident	132 Å²	132	66.6 Å²	66.6	50%	0.498	36%	0.364	S	S	.	.	H	α-helix	trans	-63.7	-39.7	174.2	-172.9	-178.6	-176	177.2	7.5	112.3	S89 R90 V91 T97 L235	S89-R93 WeakPolarHBondContact O-CB 3.45Å; S89-R93 PolarHBondContact O-N 3.34Å; R90-R93 PolarHBondContact O-N 2.87Å; V91-R93 PolarHBondContact O-N 3.05Å; R93-T97 WeakPolarHBondContact O-CB 3.43Å; R93-T97 PolarHBondContact O-N 3.47Å; R93-T97 PolarHBondContact O-OG1 2.91Å; R93-L235 HydrophobicContact CG-CB 4.49Å; R93-L235 PolarHBondContact NH1-O 2.89Å
94	E	79.3	Confident	76	Confident	19 Å²	19	63.7 Å²	63.7	9%	0.089	35%	0.351	C	S	.	.	H	α-helix	trans	-62.4	-48.6	174.5	-172.9	-179.6	163.4	0	0	110.8	K78 R90 V91 F92 E96 T97 L98	K78-E94 IonicContact NZ-OE1 3.28Å; K78-E94 PolarHBondContact NZ-OE1 2.94Å; K78-E94 IonicContact NZ-OE2 3.05Å; R90-E94 PolarHBondContact O-N 3.28Å; V91-E94 WeakPolarHBondContact O-CB 3.46Å; V91-E94 PolarHBondContact O-N 2.82Å; F92-E94 VanDerWaalsContact C-N 3.34Å; E94-E96 PolarHBondContact O-N 2.78Å; E94-T97 PolarHBondContact O-N 2.85Å; E94-L98 HydrophobicContact CG-CD1 4.06Å; E94-L98 WeakPolarHBondContact O-CB 3.45Å; E94-L98 WeakPolarHBondContact O-CG 3.35Å; E94-L98 PolarHBondContact O-N 2.79Å
95	V	82.4	Confident	77.7	Confident	26 Å²	26	65.1 Å²	65.1	16%	0.158	34%	0.336	C	S	.	.	H	α-helix	trans	-59.5	-46	176.4	170.1	0	0	0	0	111.7	V91 F92 T97 L98 Y99 L110 F113 L122	V91-V95 WeakPolarHBondContact O-CG2 3.32Å; V91-V95 PolarHBondContact O-N 2.98Å; F92-V95 PolarHBondContact O-N 2.87Å; V95-T97 VanDerWaalsContact C-N 3.34Å; V95-T97 PolarHBondContact O-N 3.18Å; V95-L98 PolarHBondContact O-N 2.87Å; V95-Y99 WeakPolarHBondContact O-CB 3.32Å; V95-Y99 PolarHBondContact O-N 2.81Å; V95-L110 HydrophobicContact CB-CD2 4.38Å; V95-L110 HydrophobicContact CG1-CD2 3.95Å; V95-L110 HydrophobicContact CG2-CD2 4.33Å; V95-F113 HydrophobicContact CG2-CD2 3.75Å; V95-F113 HydrophobicContact CG2-CE2 4.13Å; V95-F113 HydrophobicContact CG2-CG 4.2Å; V95-L122 HydrophobicContact CG2-CD2 3.97Å; V95-L122 HydrophobicContact CG2-CG 4.14Å
96	E	79.6	Confident	79.6	Confident	91 Å²	91	62.4 Å²	62.4	43%	0.425	31%	0.306	S	S	.	.	H	α-helix	trans	-61.7	-43	178.6	-178.3	173.3	-145.6	0	0	111.6	F92 E94 Y99 Q100	F92-E96 WeakPolarHBondContact O-CB 3.44Å; F92-E96 PolarHBondContact O-N 3.11Å; E94-E96 PolarHBondContact O-N 2.78Å; E96-Y99 WeakPolarHBondContact O-CB 3.45Å; E96-Y99 PolarHBondContact O-N 2.95Å; E96-Q100 WeakPolarHBondContact O-CG 3.49Å; E96-Q100 PolarHBondContact O-N 3.3Å
97	T	76.1	Confident	81.1	Confident	8 Å²	8	60.3 Å²	60.3	5%	0.049	30%	0.297	C	S	.	.	H	α-helix	trans	-67.1	-43.6	178.6	-58	0	0	0	0	111.6	R93 E94 V95 Y99 Q100 C101 I207 F233 L235	R93-T97 WeakPolarHBondContact O-CB 3.43Å; R93-T97 PolarHBondContact O-N 3.47Å; R93-T97 PolarHBondContact O-OG1 2.91Å; E94-T97 PolarHBondContact O-N 2.85Å; V95-T97 VanDerWaalsContact C-N 3.34Å; V95-T97 PolarHBondContact O-N 3.18Å; T97-Y99 VanDerWaalsContact C-N 3.26Å; T97-Y99 PolarHBondContact O-N 3.13Å; T97-Q100 PolarHBondContact O-N 2.86Å; T97-C101 PolarHBondContact O-N 3.33Å; T97-C101 PolarHBondContact O-SG 3.16Å; T97-I207 HydrophobicContact CG2-CD1 3.62Å; T97-I207 HydrophobicContact CG2-CG2 4.34Å; T97-F233 HydrophobicContact CG2-CD2 4.37Å; T97-L235 HydrophobicContact CG2-CD1 3.52Å; T97-L235 HydrophobicContact CG2-CD2 4.18Å; T97-L235 HydrophobicContact CG2-CG 4.46Å; T97-L235 WeakPolarHBondContact OG1-CD1 3.04Å
98	L	81.9	Confident	82.5	Confident	7 Å²	7	58.2 Å²	58.2	4%	0.037	28%	0.281	C	S	.	.	H	α-helix	trans	-58.7	-40.5	174.3	-76.3	163.1	0	0	0	111.4	E94 V95 C101 Q102 L110 L122 F124 F233	E94-L98 HydrophobicContact CG-CD1 4.06Å; E94-L98 WeakPolarHBondContact O-CB 3.45Å; E94-L98 WeakPolarHBondContact O-CG 3.35Å; E94-L98 PolarHBondContact O-N 2.79Å; V95-L98 PolarHBondContact O-N 2.87Å; L98-C101 PolarHBondContact O-N 3.34Å; L98-Q102 PolarHBondContact O-N 2.81Å; L98-L110 HydrophobicContact CB-CB 4.04Å; L98-L110 HydrophobicContact CB-CD2 4.06Å; L98-L110 HydrophobicContact CD1-CB 4.38Å; L98-L110 HydrophobicContact CD1-CD2 4.24Å; L98-L122 HydrophobicContact CD1-CD2 4.42Å; L98-F124 HydrophobicContact CD1-CE1 3.7Å; L98-F124 HydrophobicContact CD1-CZ 3.79Å; L98-F124 HydrophobicContact CD2-CE1 4.11Å; L98-F233 HydrophobicContact CD2-CD2 3.9Å; L98-F233 HydrophobicContact CD2-CE2 3.64Å; L98-F233 HydrophobicContact CG-CD2 4.28Å; L98-F233 HydrophobicContact CG-CE2 4.39Å
99	Y	82.2	Confident	83.2	Confident	148 Å²	148	56 Å²	56	58%	0.58	28%	0.277	S	S	*	.	H	α-helix	trans	-63.5	-44.5	175.7	-172.4	-101.1	0	0	0	112.2	V95 E96 T97 C101 Q102	V95-Y99 WeakPolarHBondContact O-CB 3.32Å; V95-Y99 PolarHBondContact O-N 2.81Å; E96-Y99 WeakPolarHBondContact O-CB 3.45Å; E96-Y99 PolarHBondContact O-N 2.95Å; T97-Y99 VanDerWaalsContact C-N 3.26Å; T97-Y99 PolarHBondContact O-N 3.13Å; Y99-C101 PolarHBondContact O-N 3.3Å; Y99-Q102 WeakPolarHBondContact O-CB 3.28Å; Y99-Q102 PolarHBondContact O-N 2.85Å
100	Q	78.1	Confident	84	Confident	47 Å²	47	53.8 Å²	53.8	22%	0.22	26%	0.26	C	S	.	.	H	α-helix	trans	-62.9	-25.8	175.4	-70.1	176.1	11.7	0	0	112.9	E96 T97	E96-Q100 WeakPolarHBondContact O-CG 3.49Å; E96-Q100 PolarHBondContact O-N 3.3Å; T97-Q100 PolarHBondContact O-N 2.86Å
101	C	82.7	Confident	84.8	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.014	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-0.9	179.2	-61.3	0	0	0	0	114.3	T97 L98 Y99 N104 I107 F160 L161	T97-C101 PolarHBondContact O-N 3.33Å; T97-C101 PolarHBondContact O-SG 3.16Å; L98-C101 PolarHBondContact O-N 3.34Å; Y99-C101 PolarHBondContact O-N 3.3Å; C101-N104 WeakPolarHBondContact O-CB 3.28Å; C101-N104 PolarHBondContact O-N 2.9Å; C101-I107 HydrophobicContact CB-CD1 3.84Å; C101-I107 HydrophobicContact CB-CG2 3.98Å; C101-F160 HydrophobicContact CB-CE1 4Å; C101-L161 WeakPolarHBondContact SG-CD2 3.16Å
102	Q	79.8	Confident	85.4	Confident	77 Å²	77	54.2 Å²	54.2	36%	0.36	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	147.3	-178.2	-79.4	-169.1	-24.3	0	0	112.5	L98 Y99 N104 L110	L98-Q102 PolarHBondContact O-N 2.81Å; Y99-Q102 WeakPolarHBondContact O-CB 3.28Å; Y99-Q102 PolarHBondContact O-N 2.85Å; Q102-N104 VanDerWaalsContact C-N 3.28Å; Q102-N104 PolarHBondContact O-N 3.49Å; Q102-L110 PolarHBondContact NE2-O 3.39Å
103	G	79.2	Confident	86	Confident	84 Å²	84	53.3 Å²	53.3	87%	0.866	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.5	-8.4	-177.5	0	0	0	0	0	114.4	K105	G103-K105 PolarHBondContact O-N 2.85Å
104	N	89.5	Confident	86.8	Confident	28 Å²	28	47.9 Å²	47.9	15%	0.15	24%	0.243	C	C	.	.			trans	-77.2	119.7	169.8	-171.2	-59	0	0	0	110.6	C101 Q102 N106 I107 F160	C101-N104 WeakPolarHBondContact O-CB 3.28Å; C101-N104 PolarHBondContact O-N 2.9Å; Q102-N104 VanDerWaalsContact C-N 3.28Å; Q102-N104 PolarHBondContact O-N 3.49Å; N104-N106 PolarHBondContact O-N 3.05Å; N104-N106 VanDerWaalsContact O-N 3.12Å; N104-N106 WeakPolarHBondContact OD1-CA 3.32Å; N104-N106 PolarHBondContact OD1-N 3.01Å; N104-I107 HydrophobicContact CB-CB 4.14Å; N104-I107 HydrophobicContact CB-CD1 3.98Å; N104-I107 HydrophobicContact CB-CG1 4.16Å; N104-I107 PolarHBondContact O-N 3.05Å; N104-I107 PolarHBondContact OD1-N 2.99Å; N104-F160 HydrophobicContact CB-CD1 4.25Å; N104-F160 HydrophobicContact CB-CE1 4.18Å; N104-F160 HydrophobicContact CB-CZ 4.4Å; N104-F160 VanDerWaalsContact ND2-CB 3.25Å; N104-F160 WeakPolarHBondContact ND2-CB 3.35Å; N104-F160 WeakPolarHBondContact ND2-CD1 3.4Å; N104-F160 WeakPolarHBondContact ND2-CG 3.46Å
105	K	94	Very high	87.4	Confident	148 Å²	148	50 Å²	50	64%	0.643	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.1	-177.8	70.6	179.6	-177.5	176.2	0	114.8	G103 K229	G103-K105 PolarHBondContact O-N 2.85Å; K105-K229 VanDerWaalsContact O-CE 3.24Å; K105-K229 WeakPolarHBondContact O-CE 3.29Å
106	N	95.9	Very high	87.7	Confident	4 Å²	4	51 Å²	51	2%	0.021	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	11	-176.6	-63.2	117.3	0	0	0	112.5	N104 D153 A157 V228 K229 I230	N104-N106 PolarHBondContact O-N 3.05Å; N104-N106 VanDerWaalsContact O-N 3.12Å; N104-N106 WeakPolarHBondContact OD1-CA 3.32Å; N104-N106 PolarHBondContact OD1-N 3.01Å; N106-D153 WeakPolarHBondContact CB-O 3.48Å; N106-D153 WeakPolarHBondContact ND2-CB 3.48Å; N106-A157 HydrophobicContact CB-CB 3.78Å; N106-A157 WeakPolarHBondContact O-CB 3.45Å; N106-V228 PolarHBondContact ND2-O 3.36Å; N106-K229 CarbonylContact O-C 2.9Å; N106-K229 VanDerWaalsContact O-CA 3.29Å; N106-K229 WeakPolarHBondContact O-CA 3.4Å; N106-I230 PolarHBondContact O-N 3.24Å
107	I	93	Very high	88.1	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.026	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-118.2	137.2	171.9	-66.3	174.3	0	0	0	108.6	C101 N104 E109 A157 F160 L161 I230 F233	C101-I107 HydrophobicContact CB-CD1 3.84Å; C101-I107 HydrophobicContact CB-CG2 3.98Å; N104-I107 HydrophobicContact CB-CB 4.14Å; N104-I107 HydrophobicContact CB-CD1 3.98Å; N104-I107 HydrophobicContact CB-CG1 4.16Å; N104-I107 PolarHBondContact O-N 3.05Å; N104-I107 PolarHBondContact OD1-N 2.99Å; I107-E109 PolarHBondContact O-N 3.47Å; I107-A157 HydrophobicContact CG1-CB 4.01Å; I107-F160 HydrophobicContact CD1-CD1 3.57Å; I107-F160 HydrophobicContact CD1-CE1 3.85Å; I107-L161 HydrophobicContact CD1-CD1 4.41Å; I107-L161 HydrophobicContact CD1-CD2 3.9Å; I107-L161 HydrophobicContact CD1-CG 4Å; I107-I230 HydrophobicContact CG1-CG1 4.13Å; I107-F233 HydrophobicContact CD1-CZ 4.28Å; I107-F233 HydrophobicContact CG1-CZ 4.3Å; I107-F233 HydrophobicContact CG2-CE2 3.93Å; I107-F233 HydrophobicContact CG2-CZ 3.6Å
108	L	93.3	Very high	88.7	Confident	15 Å²	15	57.8 Å²	57.8	8%	0.079	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-63.2	127.3	-179.9	-172.7	71.9	0	0	0	111.3	L110 F124 E125 L127 L218 I230 C231	L108-L110 PolarHBondContact O-N 2.94Å; L108-F124 HydrophobicContact CD2-CB 3.94Å; L108-F124 HydrophobicContact CD2-CD1 3.68Å; L108-F124 HydrophobicContact CD2-CE1 4.34Å; L108-F124 HydrophobicContact CD2-CG 3.86Å; L108-F124 HydrophobicContact CG-CB 4.22Å; L108-F124 HydrophobicContact CG-CD1 3.94Å; L108-F124 HydrophobicContact CG-CG 4.38Å; L108-E125 HydrophobicContact CD1-CG 3.52Å; L108-E125 HydrophobicContact CG-CG 4.36Å; L108-L127 HydrophobicContact CD1-CD1 3.62Å; L108-L127 HydrophobicContact CD1-CG 3.85Å; L108-L218 HydrophobicContact CD2-CD1 4.4Å; L108-I230 PolarHBondContact N-O 2.71Å; L108-C231 HydrophobicContact CB-CB 3.79Å; L108-C231 HydrophobicContact CD2-CB 3.58Å; L108-C231 HydrophobicContact CG-CB 4.31Å
109	E	91.8	Very high	89.1	Confident	87 Å²	87	61.2 Å²	61.2	41%	0.407	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-79.6	120.7	-177.1	-167.6	178.5	-179.1	0	0	111.8	I107 I111 F124 E125	I107-E109 PolarHBondContact O-N 3.47Å; E109-I111 HydrophobicContact CB-CD1 4.37Å; E109-I111 HydrophobicContact CG-CD1 3.96Å; E109-F124 WeakPolarHBondContact O-CA 3.4Å; E109-E125 HydrophobicContact CB-CG 4.22Å; E109-E125 VanDerWaalsContact CB-OE1 3.26Å; E109-E125 WeakPolarHBondContact CB-OE1 3.38Å; E109-E125 PolarHBondContact N-OE1 3.29Å; E109-E125 PolarHBondContact O-N 3.36Å
110	L	92.2	Very high	89.6	Confident	9 Å²	9	54.5 Å²	54.5	5%	0.047	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	119.7	164.1	-179.8	69.5	0	0	0	108.7	V95 L98 Q102 L108 L122 F124	V95-L110 HydrophobicContact CB-CD2 4.38Å; V95-L110 HydrophobicContact CG1-CD2 3.95Å; V95-L110 HydrophobicContact CG2-CD2 4.33Å; L98-L110 HydrophobicContact CB-CB 4.04Å; L98-L110 HydrophobicContact CB-CD2 4.06Å; L98-L110 HydrophobicContact CD1-CB 4.38Å; L98-L110 HydrophobicContact CD1-CD2 4.24Å; Q102-L110 PolarHBondContact NE2-O 3.39Å; L108-L110 PolarHBondContact O-N 2.94Å; L110-L122 HydrophobicContact CD1-CB 3.83Å; L110-L122 HydrophobicContact CD1-CG 4.23Å; L110-F124 HydrophobicContact CB-CD1 4.17Å; L110-F124 HydrophobicContact CB-CE1 3.95Å; L110-F124 HydrophobicContact CD1-CD1 4.14Å; L110-F124 HydrophobicContact CD1-CE1 3.76Å; L110-F124 HydrophobicContact CD1-CE2 4.28Å; L110-F124 HydrophobicContact CD1-CZ 3.84Å; L110-F124 HydrophobicContact CG-CE1 4.46Å
111	I	92.8	Very high	90.3	Very high	55 Å²	55	52.5 Å²	52.5	28%	0.282	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-55.4	-177.6	-52.3	-62.7	0	0	0	110	Y75 E109 V123 E125	Y75-I111 HydrophobicContact CD1-CG1 4.06Å; Y75-I111 HydrophobicContact CE1-CB 4.48Å; Y75-I111 HydrophobicContact CE1-CG1 3.96Å; Y75-I111 HydrophobicContact CE1-CG2 4.11Å; E109-I111 HydrophobicContact CB-CD1 4.37Å; E109-I111 HydrophobicContact CG-CD1 3.96Å; I111-V123 WeakPolarHBondContact CA-O 3.35Å; I111-V123 HydrophobicContact CB-CG1 4.39Å; I111-V123 WeakPolarHBondContact CB-O 3.29Å; I111-V123 PolarHBondContact N-O 2.85Å; I111-E125 HydrophobicContact CD1-CB 4.49Å
112	E	92.5	Very high	90.7	Very high	67 Å²	67	52.4 Å²	52.4	31%	0.313	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	156.2	-176.2	-75.3	-179.4	155.2	0	0	111.3	M47 Y48 F114 V123	M47-E112 WeakPolarHBondContact CE-OE1 3.39Å; M47-E112 WeakPolarHBondContact CE-OE2 3.46Å; Y48-E112 WeakPolarHBondContact CE2-OE2 3.39Å; Y48-E112 VanDerWaalsContact CZ-OE2 3.25Å; Y48-E112 PolarHBondContact OH-OE2 3.03Å; E112-F114 HydrophobicContact CB-CE2 3.67Å; E112-F114 HydrophobicContact CB-CZ 4.12Å; E112-F114 WeakPolarHBondContact OE2-CZ 3.43Å; E112-V123 HydrophobicContact CB-CB 4.33Å; E112-V123 PolarHBondContact N-O 3.48Å; E112-V123 PolarHBondContact O-N 3.46Å
113	F	92.9	Very high	91.5	Very high	60 Å²	60	48.7 Å²	48.7	26%	0.263	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	134.2	176.9	166.8	-100.9	0	0	0	110.1	V91 F92 V95 E115 F120 Y121 L122	V91-F113 HydrophobicContact CG1-CE2 4.02Å; F92-F113 HydrophobicContact CE2-CE1 4.39Å; F92-F113 HydrophobicContact CE2-CZ 4.1Å; F92-F113 HydrophobicContact CZ-CE1 4.09Å; F92-F113 HydrophobicContact CZ-CZ 4.27Å; V95-F113 HydrophobicContact CG2-CD2 3.75Å; V95-F113 HydrophobicContact CG2-CE2 4.13Å; V95-F113 HydrophobicContact CG2-CG 4.2Å; F113-E115 HydrophobicContact CE1-CB 4.24Å; F113-E115 HydrophobicContact CZ-CB 4.11Å; F113-F120 HydrophobicContact CE2-CB 4.17Å; F113-F120 AromaticContact CE2-CD1 3.87Å; F113-F120 HydrophobicContact CE2-CD1 3.87Å; F113-F120 HydrophobicContact CE2-CG 4.44Å; F113-F120 AromaticContact CZ-CD1 3.69Å; F113-F120 HydrophobicContact CZ-CD1 3.69Å; F113-F120 HydrophobicContact CZ-CE1 4.26Å; F113-Y121 WeakPolarHBondContact CA-O 3.44Å; F113-L122 HydrophobicContact CD2-CD1 3.79Å; F113-L122 HydrophobicContact CD2-CG 4.05Å; F113-L122 HydrophobicContact CE2-CD1 3.95Å
114	F	93	Very high	92.2	Very high	18 Å²	18	45.5 Å²	45.5	8%	0.079	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	150.1	175.1	-54.8	-96.1	0	0	0	110.8	G42 F44 M47 Y48 E112 F120 Y121 V123	G42-F114 WeakPolarHBondContact O-CE1 3.36Å; F44-F114 HydrophobicContact CB-CB 4.07Å; F44-F114 HydrophobicContact CB-CD1 4.3Å; F44-F114 HydrophobicContact CB-CD2 4.36Å; F44-F114 HydrophobicContact CB-CG 3.99Å; F44-F114 AromaticContact CD2-CD2 3.93Å; F44-F114 HydrophobicContact CD2-CD2 3.93Å; F44-F114 HydrophobicContact CD2-CE2 4.3Å; F44-F114 HydrophobicContact CD2-CG 4.41Å; M47-F114 HydrophobicContact CE-CZ 4.24Å; M47-F114 HydrophobicContact SD-CE1 3.87Å; M47-F114 HydrophobicContact SD-CZ 3.89Å; Y48-F114 HydrophobicContact CD2-CE2 4.07Å; Y48-F114 HydrophobicContact CD2-CZ 4.2Å; Y48-F114 AromaticContact CE2-CE2 3.69Å; Y48-F114 HydrophobicContact CE2-CE2 3.69Å; Y48-F114 AromaticContact CE2-CZ 3.75Å; Y48-F114 HydrophobicContact CE2-CZ 3.75Å; E112-F114 HydrophobicContact CB-CE2 3.67Å; E112-F114 HydrophobicContact CB-CZ 4.12Å; E112-F114 WeakPolarHBondContact OE2-CZ 3.43Å; F114-F120 WeakPolarHBondContact O-CA 3.48Å; F114-Y121 HydrophobicContact CB-CD2 4.07Å; F114-Y121 PolarHBondContact N-O 3.06Å; F114-Y121 PolarHBondContact O-N 2.66Å; F114-V123 HydrophobicContact CD2-CG2 4.03Å; F114-V123 HydrophobicContact CE2-CG2 3.82Å
115	E	91.7	Very high	92.5	Very high	64 Å²	64	45.5 Å²	45.5	30%	0.299	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	124.8	175	180	179.1	-172.3	0	0	108.5	K82 R88 F113 F120	K82-E115 IonicContact NZ-OE1 2.69Å; K82-E115 PolarHBondContact NZ-OE1 3.35Å; R88-E115 IonicContact CZ-OE1 3.13Å; R88-E115 VanDerWaalsContact CZ-OE1 3.23Å; R88-E115 IonicContact CZ-OE2 3.93Å; R88-E115 IonicContact NE-OE1 3.77Å; R88-E115 IonicContact NE-OE2 2.98Å; R88-E115 IonicContact NH1-OE1 3.53Å; R88-E115 PolarHBondContact NH1-OE1 3.24Å; R88-E115 IonicContact NH1-OE2 3.64Å; R88-E115 IonicContact NH2-OE1 2.71Å; R88-E115 IonicContact NH2-OE2 3.23Å; R88-E115 PolarHBondContact NH2-OE2 3.28Å; F113-E115 HydrophobicContact CE1-CB 4.24Å; F113-E115 HydrophobicContact CZ-CB 4.11Å; E115-F120 HydrophobicContact CB-CD1 4.01Å; E115-F120 HydrophobicContact CB-CE1 4.27Å; E115-F120 VanDerWaalsContact CD-CE1 3.41Å; E115-F120 HydrophobicContact CG-CD1 3.72Å; E115-F120 HydrophobicContact CG-CE1 3.59Å; E115-F120 WeakPolarHBondContact OE1-CE1 3.35Å
116	D	90	Very high	92.5	Very high	46 Å²	46	39.7 Å²	39.7	25%	0.246	20%	0.195	C	C	.	.			trans	-112	-177.9	167.6	77.2	32.1	0	0	0	110.5	K82 T118 R119 Y121	K82-D116 WeakPolarHBondContact CE-O 3.5Å; K82-D116 PolarHBondContact NZ-O 3.48Å; D116-T118 PolarHBondContact O-N 2.96Å; D116-T118 VanDerWaalsContact O-N 3.16Å; D116-T118 WeakPolarHBondContact OD1-CA 3.41Å; D116-T118 PolarHBondContact OD1-N 3.33Å; D116-T118 PolarHBondContact OD1-OG1 3.42Å; D116-R119 PolarHBondContact N-O 3.36Å; D116-R119 PolarHBondContact OD1-N 2.79Å; D116-Y121 HydrophobicContact CB-CE2 4.34Å; D116-Y121 WeakPolarHBondContact OD2-CE2 3.44Å; D116-Y121 PolarHBondContact OD2-OH 3.25Å
117	D	88.4	Confident	92.5	Very high	161 Å²	161	40.6 Å²	40.6	86%	0.861	20%	0.199	S	C	*	.	S	Bend	trans	-62.3	-23	-177.1	-63.7	-38.4	0	0	0	114	K82	K82-D117 WeakPolarHBondContact CD-O 3.45Å
118	T	88.4	Confident	92.6	Very high	82 Å²	82	44.9 Å²	44.9	50%	0.503	22%	0.219	S	C	.	.	S	Bend	trans	-118.8	-18.9	-170.3	63.7	0	0	0	0	114.4	K82 D116	K82-T118 VanDerWaalsContact CB-O 3.3Å; K82-T118 WeakPolarHBondContact CB-O 3.44Å; K82-T118 WeakPolarHBondContact CG-O 3.43Å; K82-T118 PolarHBondContact N-O 2.99Å; D116-T118 PolarHBondContact O-N 2.96Å; D116-T118 VanDerWaalsContact O-N 3.16Å; D116-T118 WeakPolarHBondContact OD1-CA 3.41Å; D116-T118 PolarHBondContact OD1-N 3.33Å; D116-T118 PolarHBondContact OD1-OG1 3.42Å
119	R	90.5	Very high	92.5	Very high	79 Å²	79	44.4 Å²	44.4	30%	0.298	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	156.6	-166.8	-71.2	170.4	179.2	167.3	5.3	113	I79 I80 E81 D116 Y121	I79-R119 HydrophobicContact CG2-CB 4.5Å; I79-R119 HydrophobicContact CG2-CG 4.27Å; I80-R119 CarbonylContact O-C 3.56Å; I80-R119 VanDerWaalsContact O-CA 3.24Å; I80-R119 WeakPolarHBondContact O-CA 3.22Å; E81-R119 HydrophobicContact CG-CG 4.49Å; E81-R119 IonicContact OE1-NH2 3.95Å; D116-R119 PolarHBondContact N-O 3.36Å; D116-R119 PolarHBondContact OD1-N 2.79Å; R119-Y121 HydrophobicContact CB-CE2 3.82Å; R119-Y121 VanDerWaalsContact CD-OH 3.25Å; R119-Y121 WeakPolarHBondContact CD-OH 3.32Å
120	F	91.1	Very high	92.6	Very high	6 Å²	6	41.8 Å²	41.8	3%	0.026	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	140.7	162.2	-57.3	-79.4	0	0	0	109.4	I79 I80 K82 R88 V91 F92 F113 F114 E115 L122	I79-F120 WeakPolarHBondContact CA-O 3.46Å; I80-F120 HydrophobicContact CB-CB 4.28Å; I80-F120 HydrophobicContact CB-CD2 4.45Å; I80-F120 PolarHBondContact N-O 3.32Å; I80-F120 PolarHBondContact O-N 2.9Å; K82-F120 HydrophobicContact CD-CE2 4.24Å; K82-F120 HydrophobicContact CD-CZ 4.35Å; K82-F120 VanDerWaalsContact CE-CZ 3.48Å; K82-F120 HydrophobicContact CG-CD2 4.03Å; K82-F120 HydrophobicContact CG-CE2 3.66Å; K82-F120 HydrophobicContact CG-CZ 4.25Å; R88-F120 HydrophobicContact CB-CZ 4.11Å; R88-F120 HydrophobicContact CG-CE1 4.29Å; R88-F120 HydrophobicContact CG-CZ 3.96Å; V91-F120 HydrophobicContact CB-CD2 4.46Å; V91-F120 HydrophobicContact CG1-CB 4.14Å; V91-F120 HydrophobicContact CG1-CD1 4.23Å; V91-F120 HydrophobicContact CG1-CD2 4.32Å; V91-F120 HydrophobicContact CG1-CG 3.99Å; V91-F120 HydrophobicContact CG2-CD2 3.91Å; V91-F120 HydrophobicContact CG2-CE2 4.05Å; V91-F120 HydrophobicContact CG2-CG 4.42Å; F92-F120 HydrophobicContact CE2-CE1 4.32Å; F113-F120 HydrophobicContact CE2-CB 4.17Å; F113-F120 AromaticContact CE2-CD1 3.87Å; F113-F120 HydrophobicContact CE2-CD1 3.87Å; F113-F120 HydrophobicContact CE2-CG 4.44Å; F113-F120 AromaticContact CZ-CD1 3.69Å; F113-F120 HydrophobicContact CZ-CD1 3.69Å; F113-F120 HydrophobicContact CZ-CE1 4.26Å; F114-F120 WeakPolarHBondContact O-CA 3.48Å; E115-F120 HydrophobicContact CB-CD1 4.01Å; E115-F120 HydrophobicContact CB-CE1 4.27Å; E115-F120 VanDerWaalsContact CD-CE1 3.41Å; E115-F120 HydrophobicContact CG-CD1 3.72Å; E115-F120 HydrophobicContact CG-CE1 3.59Å; E115-F120 WeakPolarHBondContact OE1-CE1 3.35Å; F120-L122 HydrophobicContact CB-CD1 4.24Å
121	Y	92.9	Very high	92.6	Very high	5 Å²	5	42.5 Å²	42.5	2%	0.02	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	117.6	175.5	-51	-97.1	0	0	0	108.9	F44 V77 K78 I79 F113 F114 D116 R119	F44-Y121 HydrophobicContact CB-CD2 4.02Å; F44-Y121 HydrophobicContact CB-CE2 4.27Å; F44-Y121 HydrophobicContact CB-CG 4.18Å; F44-Y121 AromaticContact CD1-CD1 3.84Å; F44-Y121 HydrophobicContact CD1-CD1 3.84Å; F44-Y121 AromaticContact CD1-CE1 3.86Å; F44-Y121 HydrophobicContact CD1-CE1 3.86Å; F44-Y121 HydrophobicContact CD1-CG 4.29Å; F44-Y121 HydrophobicContact CD2-CD1 4.1Å; F44-Y121 AromaticContact CD2-CG 3.99Å; F44-Y121 HydrophobicContact CD2-CG 3.99Å; F44-Y121 HydrophobicContact CE1-CD1 4.03Å; F44-Y121 HydrophobicContact CE1-CE1 4.14Å; F44-Y121 HydrophobicContact CE2-CD1 4.26Å; F44-Y121 HydrophobicContact CE2-CG 4.5Å; F44-Y121 AromaticContact CG-CD1 3.88Å; F44-Y121 HydrophobicContact CG-CD1 3.88Å; F44-Y121 HydrophobicContact CG-CD2 4.2Å; F44-Y121 HydrophobicContact CG-CE1 4.27Å; F44-Y121 AromaticContact CG-CG 3.87Å; F44-Y121 HydrophobicContact CG-CG 3.87Å; F44-Y121 HydrophobicContact CZ-CD1 4.24Å; V77-Y121 HydrophobicContact CG1-CD1 4.13Å; K78-Y121 WeakPolarHBondContact O-CA 3.33Å; I79-Y121 HydrophobicContact CG1-CD1 3.96Å; I79-Y121 HydrophobicContact CG1-CE1 4.23Å; I79-Y121 HydrophobicContact CG2-CD1 4.26Å; I79-Y121 HydrophobicContact CG2-CE1 3.98Å; F113-Y121 WeakPolarHBondContact CA-O 3.44Å; F114-Y121 HydrophobicContact CB-CD2 4.07Å; F114-Y121 PolarHBondContact N-O 3.06Å; F114-Y121 PolarHBondContact O-N 2.66Å; D116-Y121 HydrophobicContact CB-CE2 4.34Å; D116-Y121 WeakPolarHBondContact OD2-CE2 3.44Å; D116-Y121 PolarHBondContact OD2-OH 3.25Å; R119-Y121 HydrophobicContact CB-CE2 3.82Å; R119-Y121 VanDerWaalsContact CD-OH 3.25Å; R119-Y121 WeakPolarHBondContact CD-OH 3.32Å
122	L	92.8	Very high	92.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	113.3	172.4	-73.8	67.5	0	0	0	107	V77 K78 I80 V91 V95 L98 L110 F113 F120 F124	V77-L122 WeakPolarHBondContact CA-O 3.49Å; K78-L122 HydrophobicContact CB-CB 4.3Å; K78-L122 PolarHBondContact N-O 2.96Å; K78-L122 PolarHBondContact O-N 3.34Å; I80-L122 HydrophobicContact CD1-CD1 4.22Å; V91-L122 HydrophobicContact CG1-CD1 4.01Å; V95-L122 HydrophobicContact CG2-CD2 3.97Å; V95-L122 HydrophobicContact CG2-CG 4.14Å; L98-L122 HydrophobicContact CD1-CD2 4.42Å; L110-L122 HydrophobicContact CD1-CB 3.83Å; L110-L122 HydrophobicContact CD1-CG 4.23Å; F113-L122 HydrophobicContact CD2-CD1 3.79Å; F113-L122 HydrophobicContact CD2-CG 4.05Å; F113-L122 HydrophobicContact CE2-CD1 3.95Å; F120-L122 HydrophobicContact CB-CD1 4.24Å; L122-F124 HydrophobicContact CB-CD2 4.28Å; L122-F124 HydrophobicContact CB-CE2 3.43Å; L122-F124 VanDerWaalsContact CB-CE2 3.43Å; L122-F124 HydrophobicContact CB-CZ 3.84Å; L122-F124 HydrophobicContact CD2-CE2 4.33Å; L122-F124 HydrophobicContact CD2-CZ 4.01Å; L122-F124 WeakPolarHBondContact O-CD2 3.32Å
123	V	94.7	Very high	92.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118.9	-178.4	-175.2	0	0	0	0	108.6	F44 Y48 Y75 V77 I111 E112 F114	F44-V123 HydrophobicContact CD2-CG2 4.39Å; F44-V123 HydrophobicContact CE2-CG2 4.12Å; Y48-V123 HydrophobicContact CD1-CG1 4.5Å; Y48-V123 HydrophobicContact CD2-CG2 4.44Å; Y48-V123 HydrophobicContact CE1-CG1 3.9Å; Y48-V123 HydrophobicContact CE2-CG2 4.23Å; Y75-V123 HydrophobicContact CD1-CG1 3.96Å; Y75-V123 HydrophobicContact CG-CG1 3.94Å; V77-V123 HydrophobicContact CG1-CG2 4.5Å; V77-V123 HydrophobicContact CG2-CG1 4.37Å; V77-V123 HydrophobicContact CG2-CG2 4.17Å; I111-V123 WeakPolarHBondContact CA-O 3.35Å; I111-V123 HydrophobicContact CB-CG1 4.39Å; I111-V123 WeakPolarHBondContact CB-O 3.29Å; I111-V123 PolarHBondContact N-O 2.85Å; E112-V123 HydrophobicContact CB-CB 4.33Å; E112-V123 PolarHBondContact N-O 3.48Å; E112-V123 PolarHBondContact O-N 3.46Å; F114-V123 HydrophobicContact CD2-CG2 4.03Å; F114-V123 HydrophobicContact CE2-CG2 3.82Å
124	F	95.2	Very high	92.5	Very high	16 Å²	16	34.9 Å²	34.9	7%	0.07	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	159.5	179.5	-62.1	-88.1	0	0	0	111.1	Y75 A76 K78 L98 L108 E109 L110 L122	Y75-F124 WeakPolarHBondContact CB-O 3.44Å; Y75-F124 WeakPolarHBondContact CD1-O 3.49Å; A76-F124 PolarHBondContact N-O 3.17Å; A76-F124 PolarHBondContact O-N 3.14Å; K78-F124 HydrophobicContact CB-CE2 3.93Å; L98-F124 HydrophobicContact CD1-CE1 3.7Å; L98-F124 HydrophobicContact CD1-CZ 3.79Å; L98-F124 HydrophobicContact CD2-CE1 4.11Å; L108-F124 HydrophobicContact CD2-CB 3.94Å; L108-F124 HydrophobicContact CD2-CD1 3.68Å; L108-F124 HydrophobicContact CD2-CE1 4.34Å; L108-F124 HydrophobicContact CD2-CG 3.86Å; L108-F124 HydrophobicContact CG-CB 4.22Å; L108-F124 HydrophobicContact CG-CD1 3.94Å; L108-F124 HydrophobicContact CG-CG 4.38Å; E109-F124 WeakPolarHBondContact O-CA 3.4Å; L110-F124 HydrophobicContact CB-CD1 4.17Å; L110-F124 HydrophobicContact CB-CE1 3.95Å; L110-F124 HydrophobicContact CD1-CD1 4.14Å; L110-F124 HydrophobicContact CD1-CE1 3.76Å; L110-F124 HydrophobicContact CD1-CE2 4.28Å; L110-F124 HydrophobicContact CD1-CZ 3.84Å; L110-F124 HydrophobicContact CG-CE1 4.46Å; L122-F124 HydrophobicContact CB-CD2 4.28Å; L122-F124 HydrophobicContact CB-CE2 3.43Å; L122-F124 VanDerWaalsContact CB-CE2 3.43Å; L122-F124 HydrophobicContact CB-CZ 3.84Å; L122-F124 HydrophobicContact CD2-CE2 4.33Å; L122-F124 HydrophobicContact CD2-CZ 4.01Å; L122-F124 WeakPolarHBondContact O-CD2 3.32Å
125	E	94.8	Very high	92.5	Very high	28 Å²	28	34.3 Å²	34.3	13%	0.131	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	141.2	162.6	66.7	-179.3	136.8	0	0	110.9	L108 E109 I111 L127 K229	L108-E125 HydrophobicContact CD1-CG 3.52Å; L108-E125 HydrophobicContact CG-CG 4.36Å; E109-E125 HydrophobicContact CB-CG 4.22Å; E109-E125 VanDerWaalsContact CB-OE1 3.26Å; E109-E125 WeakPolarHBondContact CB-OE1 3.38Å; E109-E125 PolarHBondContact N-OE1 3.29Å; E109-E125 PolarHBondContact O-N 3.36Å; I111-E125 HydrophobicContact CD1-CB 4.49Å; E125-L127 HydrophobicContact CG-CD2 4.2Å; E125-K229 WeakPolarHBondContact OE1-CD 3.47Å; E125-K229 IonicContact OE1-NZ 3.53Å; E125-K229 PolarHBondContact OE1-NZ 3.19Å; E125-K229 IonicContact OE2-NZ 2.66Å; E125-K229 PolarHBondContact OE2-NZ 2.76Å
126	K	95.1	Very high	92.6	Very high	27 Å²	27	31.2 Å²	31.2	12%	0.117	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-90.8	116.4	176.2	-173.2	177	169.3	-170.9	0	110.1	E53 E74	E53-K126 IonicContact OE1-NZ 2.73Å; E53-K126 PolarHBondContact OE1-NZ 3.19Å; E53-K126 IonicContact OE2-NZ 3.4Å; E53-K126 PolarHBondContact OE2-NZ 2.71Å; E74-K126 HydrophobicContact CB-CD 3.91Å; E74-K126 WeakPolarHBondContact OE2-CD 3.14Å; E74-K126 IonicContact OE2-NZ 3.71Å; E74-K126 PolarHBondContact OE2-NZ 3.28Å
127	L	95.2	Very high	92.6	Very high	22 Å²	22	31.3 Å²	31.3	12%	0.115	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-92.8	120.8	172.9	-57	-178.1	0	0	0	110	L108 E125 G129 L218 C219 E220 K229	L108-L127 HydrophobicContact CD1-CD1 3.62Å; L108-L127 HydrophobicContact CD1-CG 3.85Å; E125-L127 HydrophobicContact CG-CD2 4.2Å; L127-G129 VanDerWaalsContact C-N 3.34Å; L127-L218 HydrophobicContact CB-CB 4.36Å; L127-L218 HydrophobicContact CD1-CB 3.51Å; L127-L218 HydrophobicContact CD1-CD1 4.17Å; L127-L218 HydrophobicContact CD1-CG 4.49Å; L127-C219 WeakPolarHBondContact CB-O 3.25Å; L127-E220 HydrophobicContact CD2-CB 4.39Å; L127-E220 HydrophobicContact CD2-CG 4.18Å; L127-K229 HydrophobicContact CD1-CB 3.85Å; L127-K229 HydrophobicContact CD1-CD 4.13Å; L127-K229 HydrophobicContact CD1-CG 4.09Å; L127-K229 HydrophobicContact CD2-CD 4.26Å
128	Q	94.3	Very high	92.7	Very high	95 Å²	95	31.6 Å²	31.6	44%	0.444	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-13.9	-168.1	-62.2	-68.3	-15.3	0	0	112.8	E74 E220	E74-Q128 PolarHBondContact OE2-NE2 2.88Å; E74-Q128 VanDerWaalsContact OE2-NE2 3.15Å; Q128-E220 PolarHBondContact N-O 2.81Å; Q128-E220 VanDerWaalsContact N-O 3.13Å
129	G	92.8	Very high	92.7	Very high	6 Å²	6	29 Å²	29	6%	0.062	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-14.4	-179.8	0	0	0	0	0	114.9	L127 H135 C219 S221	L127-G129 VanDerWaalsContact C-N 3.34Å; G129-H135 PolarHBondContact O-ND1 3.46Å; G129-H135 VanDerWaalsContact O-ND1 3.07Å; G129-C219 WeakPolarHBondContact CA-O 3.49Å; G129-C219 PolarHBondContact N-O 2.86Å; G129-S221 VanDerWaalsContact CA-O 3.3Å; G129-S221 WeakPolarHBondContact CA-O 3.34Å
130	G	92.4	Very high	92.5	Very high	31 Å²	31	33.2 Å²	33.2	32%	0.32	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	67.8	-162.8	-177.7	0	0	0	0	0	113.3	L218 C219	G130-L218 CarbonylContact O-C 3.42Å; G130-L218 WeakPolarHBondContact O-CA 3.5Å; G130-C219 PolarHBondContact O-N 3.47Å
131	S	92.7	Very high	92.4	Very high	24 Å²	24	40 Å²	40	17%	0.168	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	151.7	178.3	67	0	0	0	0	112.8	L133 A134 H135 I217	S131-L133 PolarHBondContact O-N 2.91Å; S131-A134 PolarHBondContact O-N 3.48Å; S131-A134 WeakPolarHBondContact OG-CB 3.44Å; S131-H135 WeakPolarHBondContact O-CB 3.42Å; S131-H135 PolarHBondContact O-N 2.83Å; S131-I217 WeakPolarHBondContact CA-O 3.42Å
132	I	94.6	Very high	92.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.2	-43.8	-171	-168.5	60.8	0	0	0	113.8	H135 I136 V150 P214 I217 C219 V225 V228 M294	I132-H135 WeakPolarHBondContact O-CB 3.36Å; I132-H135 PolarHBondContact O-N 2.74Å; I132-I136 HydrophobicContact CD1-CD1 4.46Å; I132-I136 HydrophobicContact CG1-CD1 4.12Å; I132-I136 WeakPolarHBondContact O-CG1 3.47Å; I132-I136 PolarHBondContact O-N 2.94Å; I132-V150 HydrophobicContact CD1-CG1 4.01Å; I132-V150 HydrophobicContact CD1-CG2 3.95Å; I132-V150 HydrophobicContact CG1-CG1 4.22Å; I132-P214 HydrophobicContact CG2-CB 3.81Å; I132-P214 WeakPolarHBondContact CG2-O 3.49Å; I132-I217 HydrophobicContact CB-CB 4.19Å; I132-I217 HydrophobicContact CB-CG2 4.04Å; I132-I217 HydrophobicContact CG1-CG2 4.43Å; I132-I217 HydrophobicContact CG2-CB 4.08Å; I132-I217 HydrophobicContact CG2-CG2 4.37Å; I132-I217 PolarHBondContact N-O 3.27Å; I132-C219 VanDerWaalsContact CD1-SG 3.53Å; I132-V225 HydrophobicContact CD1-CG2 3.38Å; I132-V228 HydrophobicContact CD1-CG1 4.17Å; I132-M294 HydrophobicContact CG1-SD 4.07Å
133	L	91.1	Very high	92.7	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-73.7	-39.4	-179	-68.8	178.9	0	0	0	112.2	S131 H135 I136 Q137 P214 I293 L389 T395 L398	S131-L133 PolarHBondContact O-N 2.91Å; L133-H135 PolarHBondContact O-N 3.4Å; L133-I136 PolarHBondContact O-N 3.23Å; L133-Q137 WeakPolarHBondContact O-CB 3.19Å; L133-Q137 PolarHBondContact O-N 3.36Å; L133-P214 HydrophobicContact CB-CB 4.48Å; L133-P214 HydrophobicContact CD1-CB 3.5Å; L133-P214 HydrophobicContact CD1-CG 3.57Å; L133-P214 HydrophobicContact CG-CB 3.66Å; L133-P214 HydrophobicContact CG-CG 4.16Å; L133-I293 HydrophobicContact CD1-CG2 3.98Å; L133-I293 HydrophobicContact CD2-CG2 3.75Å; L133-L389 HydrophobicContact CD2-CD1 4.35Å; L133-T395 HydrophobicContact CB-CG2 4.16Å; L133-L398 HydrophobicContact CD1-CB 4.36Å
134	A	90.8	Very high	92.8	Very high	21 Å²	21	41.2 Å²	41.2	17%	0.174	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-33.3	173.5	0	0	0	0	0	111	S131 K138	S131-A134 PolarHBondContact O-N 3.48Å; S131-A134 WeakPolarHBondContact OG-CB 3.44Å; A134-K138 WeakPolarHBondContact O-CG 3.48Å; A134-K138 PolarHBondContact O-N 3.17Å
135	H	93.1	Very high	92.9	Very high	6 Å²	6	43.5 Å²	43.5	3%	0.028	21%	0.212	C	C	.	.	H	α-helix	trans	-67.5	-53.3	174.4	-167.2	95.7	0	0	0	111.7	G129 S131 I132 L133 Q137 K138 Q139 S221 P222 K224	G129-H135 PolarHBondContact O-ND1 3.46Å; G129-H135 VanDerWaalsContact O-ND1 3.07Å; S131-H135 WeakPolarHBondContact O-CB 3.42Å; S131-H135 PolarHBondContact O-N 2.83Å; I132-H135 WeakPolarHBondContact O-CB 3.36Å; I132-H135 PolarHBondContact O-N 2.74Å; L133-H135 PolarHBondContact O-N 3.4Å; H135-Q137 VanDerWaalsContact C-N 3.27Å; H135-Q137 PolarHBondContact O-N 3.12Å; H135-K138 PolarHBondContact O-N 2.8Å; H135-Q139 PolarHBondContact CD2-NE2 3.28Å; H135-Q139 PolarHBondContact NE2-NE2 2.91Å; H135-Q139 WeakPolarHBondContact O-CG 3.46Å; H135-Q139 PolarHBondContact O-N 3.24Å; H135-S221 PolarHBondContact CE1-O 2.69Å; H135-P222 VanDerWaalsContact CE1-C 3.49Å; H135-P222 PolarHBondContact CE1-O 2.8Å; H135-P222 VanDerWaalsContact CE1-O 3.23Å; H135-K224 PolarHBondContact NE2-O 3.49Å
136	I	92.8	Very high	93	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.5	-40.3	179.2	-65.9	165.8	0	0	0	110.9	I132 L133 K138 Q139 F142 V225 M294 T385 P386 L389	I132-I136 HydrophobicContact CD1-CD1 4.46Å; I132-I136 HydrophobicContact CG1-CD1 4.12Å; I132-I136 WeakPolarHBondContact O-CG1 3.47Å; I132-I136 PolarHBondContact O-N 2.94Å; L133-I136 PolarHBondContact O-N 3.23Å; I136-K138 PolarHBondContact O-N 2.84Å; I136-Q139 PolarHBondContact O-N 3.09Å; I136-Q139 VanDerWaalsContact O-N 3.1Å; I136-F142 HydrophobicContact CD1-CE1 4.02Å; I136-F142 HydrophobicContact CD1-CE2 3.99Å; I136-F142 HydrophobicContact CD1-CZ 3.7Å; I136-F142 HydrophobicContact CG1-CD2 4.12Å; I136-F142 HydrophobicContact CG1-CE2 3.98Å; I136-F142 HydrophobicContact CG1-CG 4.46Å; I136-F142 HydrophobicContact CG1-CZ 4.19Å; I136-F142 HydrophobicContact CG2-CB 4.27Å; I136-F142 HydrophobicContact CG2-CD1 4.08Å; I136-F142 HydrophobicContact CG2-CD2 4.48Å; I136-F142 HydrophobicContact CG2-CG 4.03Å; I136-V225 HydrophobicContact CG1-CG2 4.09Å; I136-M294 HydrophobicContact CD1-CB 4.36Å; I136-M294 HydrophobicContact CD1-CG 3.84Å; I136-M294 HydrophobicContact CD1-SD 4.25Å; I136-T385 HydrophobicContact CG2-CG2 3.99Å; I136-P386 HydrophobicContact CG2-CG 4.17Å; I136-P386 WeakPolarHBondContact O-CB 3.15Å; I136-L389 HydrophobicContact CB-CD1 4.09Å; I136-L389 HydrophobicContact CG2-CD1 3.8Å
137	Q	91.3	Very high	93.2	Very high	47 Å²	47	43 Å²	43	22%	0.22	21%	0.21	C	C	.	.	H	α-helix	trans	-58.6	-33	176.9	-172.7	-175.9	15.3	0	0	113	L133 H135 L389 Q390 T395	L133-Q137 WeakPolarHBondContact O-CB 3.19Å; L133-Q137 PolarHBondContact O-N 3.36Å; H135-Q137 VanDerWaalsContact C-N 3.27Å; H135-Q137 PolarHBondContact O-N 3.12Å; Q137-L389 HydrophobicContact CB-CB 4.04Å; Q137-L389 HydrophobicContact CB-CD1 4.36Å; Q137-L389 HydrophobicContact CG-CB 4.02Å; Q137-L389 PolarHBondContact NE2-O 3.2Å; Q137-Q390 HydrophobicContact CG-CG 4.07Å; Q137-Q390 WeakPolarHBondContact O-CG 3.33Å; Q137-Q390 PolarHBondContact O-NE2 3.29Å; Q137-T395 HydrophobicContact CB-CG2 3.97Å; Q137-T395 HydrophobicContact CG-CG2 4.2Å; Q137-T395 PolarHBondContact OE1-OG1 3.04Å
138	K	90.6	Very high	93.3	Very high	168 Å²	168	42.1 Å²	42.1	73%	0.73	21%	0.206	S	C	*	.	H	α-helix	trans	-81.9	-18.6	178.9	-69.5	170.3	-175	174.6	0	113.1	A134 H135 I136	A134-K138 WeakPolarHBondContact O-CG 3.48Å; A134-K138 PolarHBondContact O-N 3.17Å; H135-K138 PolarHBondContact O-N 2.8Å; I136-K138 PolarHBondContact O-N 2.84Å
139	Q	88.3	Confident	93.5	Very high	26 Å²	26	42.9 Å²	42.9	12%	0.121	21%	0.205	C	C	.	.			trans	-76.1	152.4	-177.9	-67.3	-158.7	-7.3	0	0	112.2	H135 I136 H141 P386	H135-Q139 PolarHBondContact CD2-NE2 3.28Å; H135-Q139 PolarHBondContact NE2-NE2 2.91Å; H135-Q139 WeakPolarHBondContact O-CG 3.46Å; H135-Q139 PolarHBondContact O-N 3.24Å; I136-Q139 PolarHBondContact O-N 3.09Å; I136-Q139 VanDerWaalsContact O-N 3.1Å; Q139-H141 PolarHBondContact OE1-O 2.78Å; Q139-P386 VanDerWaalsContact O-CB 3.26Å; Q139-P386 WeakPolarHBondContact O-CB 3.31Å
140	K	85.7	Confident	93.8	Very high	168 Å²	168	42.7 Å²	42.7	73%	0.73	20%	0.202	S	C	*	.	S	Bend	trans	-83.5	-33.3	173.1	-69.1	-174.9	178.6	-179	0	112.4	Q387	K140-Q387 PolarHBondContact O-NE2 3.05Å
141	H	88.9	Confident	94.1	Very high	150 Å²	150	41.2 Å²	41.2	69%	0.694	19%	0.187	S	C	*	.			trans	-134.7	138	-176.8	-53.6	97.1	0	0	0	107.6	Q139	Q139-H141 PolarHBondContact OE1-O 2.78Å
142	F	95.5	Very high	94.3	Very high	0 Å²	0	45 Å²	45	0%	0	20%	0.198	C	C	.	.			trans	-142	142	170.4	-178.2	-113.8	0	0	0	107.1	I136 E146 A147 V225 M294 L383 P386	I136-F142 HydrophobicContact CD1-CE1 4.02Å; I136-F142 HydrophobicContact CD1-CE2 3.99Å; I136-F142 HydrophobicContact CD1-CZ 3.7Å; I136-F142 HydrophobicContact CG1-CD2 4.12Å; I136-F142 HydrophobicContact CG1-CE2 3.98Å; I136-F142 HydrophobicContact CG1-CG 4.46Å; I136-F142 HydrophobicContact CG1-CZ 4.19Å; I136-F142 HydrophobicContact CG2-CB 4.27Å; I136-F142 HydrophobicContact CG2-CD1 4.08Å; I136-F142 HydrophobicContact CG2-CD2 4.48Å; I136-F142 HydrophobicContact CG2-CG 4.03Å; F142-E146 VanDerWaalsContact CA-OE2 3.24Å; F142-E146 WeakPolarHBondContact CA-OE2 3.24Å; F142-E146 HydrophobicContact CD2-CB 3.93Å; F142-E146 HydrophobicContact CE2-CB 3.73Å; F142-A147 HydrophobicContact CE1-CB 3.98Å; F142-A147 HydrophobicContact CZ-CB 3.63Å; F142-V225 HydrophobicContact CD2-CG1 4.49Å; F142-V225 HydrophobicContact CE2-CB 4.49Å; F142-V225 HydrophobicContact CE2-CG1 4.08Å; F142-V225 HydrophobicContact CE2-CG2 3.98Å; F142-M294 HydrophobicContact CE1-CB 4.16Å; F142-M294 VanDerWaalsContact CE1-O 3.29Å; F142-M294 WeakPolarHBondContact CE1-O 3.48Å; F142-M294 HydrophobicContact CZ-CB 4.33Å; F142-L383 HydrophobicContact CD1-CB 4.5Å; F142-L383 HydrophobicContact CD1-CD1 3.8Å; F142-L383 HydrophobicContact CE1-CD1 3.97Å; F142-L383 WeakPolarHBondContact O-CB 3.39Å; F142-L383 PolarHBondContact O-N 2.91Å; F142-P386 HydrophobicContact CB-CG 3.58Å
143	N	96.6	Very high	94.5	Very high	29 Å²	29	45.2 Å²	45.2	16%	0.155	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-137.1	171	-178.5	62.4	58.4	0	0	0	113.1	R145 E146 A147 K381	N143-R145 VanDerWaalsContact C-N 3.28Å; N143-R145 PolarHBondContact O-N 2.56Å; N143-R145 WeakPolarHBondContact OD1-CA 3.32Å; N143-R145 VanDerWaalsContact OD1-CB 3.31Å; N143-R145 WeakPolarHBondContact OD1-CB 3.39Å; N143-R145 PolarHBondContact OD1-N 3.02Å; N143-E146 PolarHBondContact N-OE2 2.85Å; N143-E146 PolarHBondContact ND2-OE2 3.28Å; N143-E146 VanDerWaalsContact ND2-OE2 3.16Å; N143-E146 WeakPolarHBondContact O-CB 3.24Å; N143-E146 PolarHBondContact O-N 3.31Å; N143-E146 PolarHBondContact OD1-N 2.83Å; N143-A147 PolarHBondContact O-N 2.59Å; N143-K381 WeakPolarHBondContact CA-O 3.48Å; N143-K381 WeakPolarHBondContact CB-O 3.25Å
144	E	97.6	Very high	94.8	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-61.5	-34.9	-180	-66.8	-170.9	-130.4	0	0	112.9	E146 A147 S148 L295 I343 S344 W373 A378 P379 L383	E144-E146 VanDerWaalsContact C-N 3.3Å; E144-E146 PolarHBondContact O-N 2.65Å; E144-A147 PolarHBondContact O-N 2.81Å; E144-S148 VanDerWaalsContact O-CB 3.27Å; E144-S148 WeakPolarHBondContact O-CB 3.47Å; E144-S148 PolarHBondContact O-N 3.33Å; E144-L295 HydrophobicContact CG-CD2 4.17Å; E144-I343 WeakPolarHBondContact OE1-CA 3.49Å; E144-S344 PolarHBondContact OE1-N 3.15Å; E144-S344 VanDerWaalsContact OE2-CB 3.31Å; E144-S344 WeakPolarHBondContact OE2-CB 3.42Å; E144-S344 PolarHBondContact OE2-OG 2.8Å; E144-W373 HydrophobicContact CB-CZ2 4.04Å; E144-W373 WeakPolarHBondContact O-CZ2 3.45Å; E144-W373 PolarHBondContact OE2-NE1 3.11Å; E144-A378 HydrophobicContact CB-CB 4.44Å; E144-P379 HydrophobicContact CB-CG 4.09Å; E144-P379 WeakPolarHBondContact CB-O 3.25Å; E144-P379 HydrophobicContact CG-CG 4.27Å; E144-P379 WeakPolarHBondContact OE1-CG 3.45Å; E144-L383 HydrophobicContact CG-CD1 4.29Å; E144-L383 HydrophobicContact CG-CD2 4.13Å; E144-L383 HydrophobicContact CG-CG 4.46Å
145	R	97.6	Very high	95.1	Very high	64 Å²	64	44.2 Å²	44.2	24%	0.242	19%	0.191	C	C	.	.	H	α-helix	trans	-64.6	-36.7	177.1	-179.4	155.9	-64.5	-119.9	-5.4	112.3	N143 R149 G376 A378 P379 E380	N143-R145 VanDerWaalsContact C-N 3.28Å; N143-R145 PolarHBondContact O-N 2.56Å; N143-R145 WeakPolarHBondContact OD1-CA 3.32Å; N143-R145 VanDerWaalsContact OD1-CB 3.31Å; N143-R145 WeakPolarHBondContact OD1-CB 3.39Å; N143-R145 PolarHBondContact OD1-N 3.02Å; R145-R149 WeakPolarHBondContact O-CG 3.05Å; R145-R149 PolarHBondContact O-N 3.44Å; R145-R149 VanDerWaalsContact O-N 3.17Å; R145-G376 PolarHBondContact NH1-O 2.88Å; R145-G376 PolarHBondContact NH2-O 3.43Å; R145-A378 PolarHBondContact NE-O 3.36Å; R145-A378 PolarHBondContact NH2-O 3.43Å; R145-P379 PolarHBondContact N-O 3.06Å; R145-E380 HydrophobicContact CB-CG 4.03Å; R145-E380 WeakPolarHBondContact CD-OE1 3.48Å; R145-E380 HydrophobicContact CG-CG 4.4Å
146	E	97.3	Very high	95.3	Very high	44 Å²	44	45.4 Å²	45.4	21%	0.206	20%	0.202	C	C	.	.	H	α-helix	trans	-67.3	-47.6	173.6	-77.1	173.6	140.1	0	0	111.5	F142 N143 E144 S148 R149 V150 V225	F142-E146 VanDerWaalsContact CA-OE2 3.24Å; F142-E146 WeakPolarHBondContact CA-OE2 3.24Å; F142-E146 HydrophobicContact CD2-CB 3.93Å; F142-E146 HydrophobicContact CE2-CB 3.73Å; N143-E146 PolarHBondContact N-OE2 2.85Å; N143-E146 PolarHBondContact ND2-OE2 3.28Å; N143-E146 VanDerWaalsContact ND2-OE2 3.16Å; N143-E146 WeakPolarHBondContact O-CB 3.24Å; N143-E146 PolarHBondContact O-N 3.31Å; N143-E146 PolarHBondContact OD1-N 2.83Å; E144-E146 VanDerWaalsContact C-N 3.3Å; E144-E146 PolarHBondContact O-N 2.65Å; E146-S148 VanDerWaalsContact C-N 3.27Å; E146-S148 PolarHBondContact O-N 2.9Å; E146-R149 PolarHBondContact O-N 3.17Å; E146-R149 VanDerWaalsContact O-N 3.17Å; E146-V150 PolarHBondContact O-N 3.3Å; E146-V225 HydrophobicContact CB-CG1 3.79Å; E146-V225 HydrophobicContact CG-CG1 4.13Å
147	A	97.8	Very high	95.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57	-41	173.3	0	0	0	0	0	112.2	F142 N143 E144 R149 V150 V151 L295 W373	F142-A147 HydrophobicContact CE1-CB 3.98Å; F142-A147 HydrophobicContact CZ-CB 3.63Å; N143-A147 PolarHBondContact O-N 2.59Å; E144-A147 PolarHBondContact O-N 2.81Å; A147-R149 PolarHBondContact O-N 2.78Å; A147-V150 WeakPolarHBondContact O-CB 3.4Å; A147-V150 PolarHBondContact O-N 2.92Å; A147-V151 WeakPolarHBondContact O-CG2 3.41Å; A147-V151 PolarHBondContact O-N 3.4Å; A147-L295 HydrophobicContact CB-CD2 3.73Å; A147-W373 HydrophobicContact CB-CH2 3.84Å; A147-W373 HydrophobicContact CB-CZ2 4.31Å
148	S	98.4	Very high	95.4	Very high	4 Å²	4	43.2 Å²	43.2	3%	0.028	19%	0.191	C	C	.	.	H	α-helix	trans	-62.4	-38.7	177.5	169	0	0	0	0	112.8	E144 E146 V151 R152 W373 V374	E144-S148 VanDerWaalsContact O-CB 3.27Å; E144-S148 WeakPolarHBondContact O-CB 3.47Å; E144-S148 PolarHBondContact O-N 3.33Å; E146-S148 VanDerWaalsContact C-N 3.27Å; E146-S148 PolarHBondContact O-N 2.9Å; S148-V151 PolarHBondContact O-N 3.03Å; S148-R152 WeakPolarHBondContact O-CB 3.36Å; S148-R152 PolarHBondContact O-N 3.17Å; S148-W373 VanDerWaalsContact N-CH2 3.35Å; S148-W373 PolarHBondContact OG-O 3.36Å; S148-V374 WeakPolarHBondContact OG-CA 3.19Å
149	R	98.1	Very high	95.5	Very high	111 Å²	111	37.2 Å²	37.2	42%	0.419	17%	0.168	S	C	.	.	H	α-helix	trans	-64.8	-40.6	174.2	-69.9	170.6	-177	169.8	3.6	111.9	R145 E146 A147 R152 D153	R145-R149 WeakPolarHBondContact O-CG 3.05Å; R145-R149 PolarHBondContact O-N 3.44Å; R145-R149 VanDerWaalsContact O-N 3.17Å; E146-R149 PolarHBondContact O-N 3.17Å; E146-R149 VanDerWaalsContact O-N 3.17Å; A147-R149 PolarHBondContact O-N 2.78Å; R149-R152 WeakPolarHBondContact O-CB 3.4Å; R149-R152 PolarHBondContact O-N 2.91Å; R149-D153 WeakPolarHBondContact O-CB 3.28Å; R149-D153 PolarHBondContact O-N 3.19Å
150	V	98.3	Very high	95.5	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-62.2	-48.9	174.9	177.2	0	0	0	0	110.4	I132 E146 A147 R152 D153 V154 I217 V225 V228 M294	I132-V150 HydrophobicContact CD1-CG1 4.01Å; I132-V150 HydrophobicContact CD1-CG2 3.95Å; I132-V150 HydrophobicContact CG1-CG1 4.22Å; E146-V150 PolarHBondContact O-N 3.3Å; A147-V150 WeakPolarHBondContact O-CB 3.4Å; A147-V150 PolarHBondContact O-N 2.92Å; V150-R152 VanDerWaalsContact C-N 3.3Å; V150-R152 PolarHBondContact O-N 3.35Å; V150-D153 PolarHBondContact O-N 3.02Å; V150-V154 HydrophobicContact CG1-CG2 4.42Å; V150-V154 WeakPolarHBondContact O-CG2 3.48Å; V150-V154 PolarHBondContact O-N 3.28Å; V150-I217 HydrophobicContact CG1-CG2 4.46Å; V150-V225 HydrophobicContact CG2-CG1 4.28Å; V150-V225 HydrophobicContact CG2-CG2 3.94Å; V150-V228 HydrophobicContact CG1-CG1 4.27Å; V150-V228 HydrophobicContact CG1-CG2 4.21Å; V150-V228 HydrophobicContact CG2-CG1 4.29Å; V150-M294 HydrophobicContact CB-CE 4.45Å; V150-M294 HydrophobicContact CB-SD 4.26Å; V150-M294 HydrophobicContact CG1-CE 4.2Å; V150-M294 HydrophobicContact CG1-SD 3.88Å
151	V	98.5	Very high	95.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58.6	-41.8	177.3	170	0	0	0	0	111.7	A147 S148 A155 L287 L291 M294 L350 V368 W373 V374	A147-V151 WeakPolarHBondContact O-CG2 3.41Å; A147-V151 PolarHBondContact O-N 3.4Å; S148-V151 PolarHBondContact O-N 3.03Å; V151-A155 WeakPolarHBondContact O-CB 3.2Å; V151-A155 PolarHBondContact O-N 3.11Å; V151-L287 HydrophobicContact CG1-CD2 4.33Å; V151-L287 HydrophobicContact CG2-CD1 4.35Å; V151-L291 HydrophobicContact CG2-CB 4.3Å; V151-L291 HydrophobicContact CG2-CD1 3.78Å; V151-L291 HydrophobicContact CG2-CD2 4.2Å; V151-L291 HydrophobicContact CG2-CG 4.3Å; V151-M294 HydrophobicContact CG2-CE 3.95Å; V151-L350 HydrophobicContact CG1-CD2 4.27Å; V151-V368 HydrophobicContact CG1-CG1 3.89Å; V151-W373 HydrophobicContact CB-CZ3 4.2Å; V151-W373 HydrophobicContact CG2-CZ3 3.99Å; V151-V374 HydrophobicContact CG1-CG2 3.93Å
152	R	98.5	Very high	95.3	Very high	103 Å²	103	25 Å²	25	39%	0.389	11%	0.113	S	C	.	.	H	α-helix	trans	-60.5	-46.6	176.2	-173.4	-170.7	61.7	-155.5	-7.5	111.9	S148 R149 V150 A155 A156 L369 V374	S148-R152 WeakPolarHBondContact O-CB 3.36Å; S148-R152 PolarHBondContact O-N 3.17Å; R149-R152 WeakPolarHBondContact O-CB 3.4Å; R149-R152 PolarHBondContact O-N 2.91Å; V150-R152 VanDerWaalsContact C-N 3.3Å; V150-R152 PolarHBondContact O-N 3.35Å; R152-A155 PolarHBondContact O-N 3.12Å; R152-A156 VanDerWaalsContact O-CB 3.31Å; R152-A156 WeakPolarHBondContact O-CB 3.43Å; R152-A156 PolarHBondContact O-N 3.37Å; R152-L369 HydrophobicContact CG-CD2 3.94Å; R152-L369 WeakPolarHBondContact O-CD2 3.26Å; R152-V374 HydrophobicContact CB-CG1 3.63Å; R152-V374 HydrophobicContact CG-CG1 3.94Å
153	D	98.2	Very high	94.6	Very high	6 Å²	6	27.3 Å²	27.3	3%	0.032	13%	0.126	C	C	.	.	H	α-helix	trans	-65.4	-43.1	-178.1	-71.4	-5.5	0	0	0	110.9	N106 R149 V150 A156 A157 S226 P227 V228	N106-D153 WeakPolarHBondContact CB-O 3.48Å; N106-D153 WeakPolarHBondContact ND2-CB 3.48Å; R149-D153 WeakPolarHBondContact O-CB 3.28Å; R149-D153 PolarHBondContact O-N 3.19Å; V150-D153 PolarHBondContact O-N 3.02Å; D153-A156 PolarHBondContact O-N 3.07Å; D153-A157 PolarHBondContact O-N 3.44Å; D153-A157 VanDerWaalsContact O-N 3.15Å; D153-S226 PolarHBondContact OD2-OG 2.85Å; D153-P227 WeakPolarHBondContact OD2-CA 3.27Å; D153-V228 HydrophobicContact CB-CG2 3.52Å; D153-V228 PolarHBondContact OD2-N 3.05Å
154	V	97.8	Very high	92.8	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.006	14%	0.141	C	C	.	.	H	α-helix	trans	-66.4	-45.8	174.8	177.9	0	0	0	0	111.3	V150 A156 A157 L158 L212 I217 V228 I230 L287	V150-V154 HydrophobicContact CG1-CG2 4.42Å; V150-V154 WeakPolarHBondContact O-CG2 3.48Å; V150-V154 PolarHBondContact O-N 3.28Å; V154-A156 VanDerWaalsContact C-N 3.28Å; V154-A156 PolarHBondContact O-N 3.15Å; V154-A157 PolarHBondContact O-N 3.34Å; V154-L158 HydrophobicContact CG1-CD1 4.12Å; V154-L158 HydrophobicContact CG1-CG 4.3Å; V154-L158 WeakPolarHBondContact O-CG 3.02Å; V154-L158 PolarHBondContact O-N 3.32Å; V154-L212 HydrophobicContact CG1-CD1 4.15Å; V154-L212 HydrophobicContact CG1-CD2 3.94Å; V154-I217 HydrophobicContact CG2-CD1 4.06Å; V154-I217 HydrophobicContact CG2-CG1 4.21Å; V154-I217 HydrophobicContact CG2-CG2 4.04Å; V154-V228 HydrophobicContact CG2-CG2 4.02Å; V154-I230 HydrophobicContact CG1-CG2 4.24Å; V154-I230 HydrophobicContact CG2-CG2 4.17Å; V154-L287 HydrophobicContact CB-CD1 4.07Å; V154-L287 HydrophobicContact CG1-CD1 3.81Å
155	A	97.4	Very high	90.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62	-36.2	177.6	0	0	0	0	0	111.8	V151 R152 L158 D159 L287 V368 L369	V151-A155 WeakPolarHBondContact O-CB 3.2Å; V151-A155 PolarHBondContact O-N 3.11Å; R152-A155 PolarHBondContact O-N 3.12Å; A155-L158 PolarHBondContact O-N 3Å; A155-D159 VanDerWaalsContact O-CB 3.25Å; A155-D159 WeakPolarHBondContact O-CB 3.47Å; A155-D159 PolarHBondContact O-N 2.97Å; A155-L287 HydrophobicContact CB-CD2 4.35Å; A155-V368 HydrophobicContact CB-CB 4.22Å; A155-V368 HydrophobicContact CB-CG1 3.78Å; A155-L369 HydrophobicContact CB-CD2 3.86Å; A155-L369 HydrophobicContact CB-CG 4.01Å
156	A	96.1	Very high	87.7	Confident	31 Å²	31	43.4 Å²	43.4	26%	0.256	20%	0.202	S	C	.	.	H	α-helix	trans	-65.5	-39.5	174.9	0	0	0	0	0	112.5	R152 D153 V154 F160 L369	R152-A156 VanDerWaalsContact O-CB 3.31Å; R152-A156 WeakPolarHBondContact O-CB 3.43Å; R152-A156 PolarHBondContact O-N 3.37Å; D153-A156 PolarHBondContact O-N 3.07Å; V154-A156 VanDerWaalsContact C-N 3.28Å; V154-A156 PolarHBondContact O-N 3.15Å; A156-F160 WeakPolarHBondContact O-CB 3.34Å; A156-F160 PolarHBondContact O-N 3.2Å; A156-F160 VanDerWaalsContact O-N 3.16Å; A156-L369 HydrophobicContact CB-CD2 4.3Å
157	A	93.9	Very high	85.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.3	-45.1	174	0	0	0	0	0	111.9	N106 I107 D153 V154 F160 L161 I230	N106-A157 HydrophobicContact CB-CB 3.78Å; N106-A157 WeakPolarHBondContact O-CB 3.45Å; I107-A157 HydrophobicContact CG1-CB 4.01Å; D153-A157 PolarHBondContact O-N 3.44Å; D153-A157 VanDerWaalsContact O-N 3.15Å; V154-A157 PolarHBondContact O-N 3.34Å; A157-F160 WeakPolarHBondContact O-CB 3.42Å; A157-F160 PolarHBondContact O-N 3.11Å; A157-L161 WeakPolarHBondContact O-CG 2.76Å; A157-L161 PolarHBondContact O-N 3.19Å; A157-I230 HydrophobicContact CB-CD1 3.44Å; A157-I230 VanDerWaalsContact CB-CD1 3.44Å; A157-I230 HydrophobicContact CB-CG1 3.85Å
158	L	92.4	Very high	82	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63	-43.1	176.7	-67.5	178.3	0	0	0	111.8	V154 A155 F160 L161 H162 H209 L212 I230 D283 L284 L287 A365	V154-L158 HydrophobicContact CG1-CD1 4.12Å; V154-L158 HydrophobicContact CG1-CG 4.3Å; V154-L158 WeakPolarHBondContact O-CG 3.02Å; V154-L158 PolarHBondContact O-N 3.32Å; A155-L158 PolarHBondContact O-N 3Å; L158-F160 VanDerWaalsContact C-N 3.28Å; L158-F160 PolarHBondContact O-N 2.63Å; L158-L161 PolarHBondContact O-N 2.98Å; L158-L161 VanDerWaalsContact O-N 3.13Å; L158-H162 WeakPolarHBondContact O-CB 3.47Å; L158-H162 PolarHBondContact O-CD2 3.22Å; L158-H162 PolarHBondContact O-N 3.48Å; L158-H209 HydrophobicContact CD2-CB 4.16Å; L158-L212 HydrophobicContact CD1-CD2 3.96Å; L158-L212 HydrophobicContact CD2-CD2 4.45Å; L158-I230 HydrophobicContact CD2-CD1 4.35Å; L158-D283 HydrophobicContact CD1-CB 4.07Å; L158-D283 HydrophobicContact CD2-CB 3.81Å; L158-L284 HydrophobicContact CD1-CD1 3.94Å; L158-L287 HydrophobicContact CD1-CD2 4.38Å; L158-A365 HydrophobicContact CB-CB 3.92Å
159	D	92.4	Very high	78.8	Confident	43 Å²	43	57 Å²	57	23%	0.23	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-41.4	178.8	-164.6	54.4	0	0	0	111.4	A155 H162 T163 A365 A366 L369	A155-D159 VanDerWaalsContact O-CB 3.25Å; A155-D159 WeakPolarHBondContact O-CB 3.47Å; A155-D159 PolarHBondContact O-N 2.97Å; D159-H162 PolarHBondContact O-N 2.98Å; D159-T163 WeakPolarHBondContact O-CB 3.14Å; D159-T163 PolarHBondContact O-N 3.38Å; D159-T163 PolarHBondContact O-OG1 3.17Å; D159-A365 HydrophobicContact CB-CB 3.65Å; D159-A366 WeakPolarHBondContact OD1-CA 3.28Å; D159-A366 WeakPolarHBondContact OD1-CB 3.21Å; D159-A366 PolarHBondContact OD1-N 3.01Å; D159-L369 HydrophobicContact CB-CD1 4.09Å
160	F	88.7	Confident	75.8	Confident	70 Å²	70	56.7 Å²	56.7	31%	0.307	31%	0.305	S	S	.	.	H	α-helix	trans	-62.2	-44	173.2	171.1	-93.4	0	0	0	112.8	C101 N104 I107 A156 A157 L158	C101-F160 HydrophobicContact CB-CE1 4Å; N104-F160 HydrophobicContact CB-CD1 4.25Å; N104-F160 HydrophobicContact CB-CE1 4.18Å; N104-F160 HydrophobicContact CB-CZ 4.4Å; N104-F160 VanDerWaalsContact ND2-CB 3.25Å; N104-F160 WeakPolarHBondContact ND2-CB 3.35Å; N104-F160 WeakPolarHBondContact ND2-CD1 3.4Å; N104-F160 WeakPolarHBondContact ND2-CG 3.46Å; I107-F160 HydrophobicContact CD1-CD1 3.57Å; I107-F160 HydrophobicContact CD1-CE1 3.85Å; A156-F160 WeakPolarHBondContact O-CB 3.34Å; A156-F160 PolarHBondContact O-N 3.2Å; A156-F160 VanDerWaalsContact O-N 3.16Å; A157-F160 WeakPolarHBondContact O-CB 3.42Å; A157-F160 PolarHBondContact O-N 3.11Å; L158-F160 VanDerWaalsContact C-N 3.28Å; L158-F160 PolarHBondContact O-N 2.63Å
161	L	84.7	Confident	72.5	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-66.2	-39.7	178	-69.7	169.6	0	0	0	112.2	C101 I107 A157 L158 T205 I207 I230 F233	C101-L161 WeakPolarHBondContact SG-CD2 3.16Å; I107-L161 HydrophobicContact CD1-CD1 4.41Å; I107-L161 HydrophobicContact CD1-CD2 3.9Å; I107-L161 HydrophobicContact CD1-CG 4Å; A157-L161 WeakPolarHBondContact O-CG 2.76Å; A157-L161 PolarHBondContact O-N 3.19Å; L158-L161 PolarHBondContact O-N 2.98Å; L158-L161 VanDerWaalsContact O-N 3.13Å; L161-T205 CarbonylContact O-C 3.57Å; L161-I207 CarbonylContact C-O 3.57Å; L161-I207 WeakPolarHBondContact CB-O 3.41Å; L161-I207 PolarHBondContact O-N 2.93Å; L161-I207 VanDerWaalsContact O-O 3.11Å; L161-I230 HydrophobicContact CD1-CD1 3.89Å; L161-F233 HydrophobicContact CD1-CD1 4.27Å; L161-F233 HydrophobicContact CD1-CE1 3.57Å; L161-F233 HydrophobicContact CD1-CZ 4.2Å; L161-F233 HydrophobicContact CD2-CE1 4.23Å; L161-F233 HydrophobicContact CD2-CZ 4.22Å
162	H	85.1	Confident	69.5	Low	18 Å²	18	72.7 Å²	72.7	8%	0.083	38%	0.384	C	S	.	.	H	α-helix	trans	-80.2	-32.8	-172.4	-69.1	-174.1	0	0	0	112.9	L158 D159 K164 I207 K280 D283	L158-H162 WeakPolarHBondContact O-CB 3.47Å; L158-H162 PolarHBondContact O-CD2 3.22Å; L158-H162 PolarHBondContact O-N 3.48Å; D159-H162 PolarHBondContact O-N 2.98Å; H162-K164 PolarHBondContact O-N 2.87Å; H162-I207 PolarHBondContact CD2-O 3.47Å; H162-I207 VanDerWaalsContact CD2-O 3.29Å; H162-K280 HydrophobicContact CB-CD 3.94Å; H162-K280 HydrophobicContact CB-CG 4.16Å; H162-K280 PolarHBondContact CE1-O 3.14Å; H162-K280 WeakPolarHBondContact O-CE 3.24Å; H162-K280 PolarHBondContact O-NZ 3.02Å; H162-D283 IonicContact CD2-OD2 3Å; H162-D283 IonicContact CE1-OD2 3.01Å; H162-D283 IonicContact NE2-OD2 2.74Å; H162-D283 PolarHBondContact NE2-OD2 3.28Å
163	T	80.6	Confident	66.3	Low	47 Å²	47	70.9 Å²	70.9	29%	0.288	40%	0.398	S	S	.	.			trans	-78.4	114.4	-174.9	-64.2	0	0	0	0	110.6	D159 D165 T205	D159-T163 WeakPolarHBondContact O-CB 3.14Å; D159-T163 PolarHBondContact O-N 3.38Å; D159-T163 PolarHBondContact O-OG1 3.17Å; T163-D165 HydrophobicContact CG2-CB 4.46Å; T163-D165 PolarHBondContact O-N 3.27Å; T163-T205 CarbonylContact C-O 3.59Å; T163-T205 WeakPolarHBondContact O-CB 3.27Å; T163-T205 PolarHBondContact O-OG1 2.94Å
164	K	60.4	Low	62.8	Low	109 Å²	109	81.9 Å²	81.9	47%	0.474	44%	0.439	S	S	.	.			trans	-74.4	74.1	172.7	-70.8	-177.8	-179.9	178.3	0	109	H162 K166 T205 D273	H162-K164 PolarHBondContact O-N 2.87Å; K164-K166 PolarHBondContact O-N 2.96Å; K164-T205 WeakPolarHBondContact CA-O 3.14Å; K164-T205 WeakPolarHBondContact CG-O 3.5Å; K164-T205 PolarHBondContact N-O 3.42Å; K164-D273 IonicContact NZ-OD1 3.87Å; K164-D273 PolarHBondContact NZ-OD1 3.29Å
165	D	48.4	Very low	59.7	Low	113 Å²	113	87.5 Å²	87.5	60%	0.604	48%	0.479	S	S	*	.			trans	-74.7	116.1	171.3	-93	-22.7	0	0	0	109.5	T163 V167 T205	T163-D165 HydrophobicContact CG2-CB 4.46Å; T163-D165 PolarHBondContact O-N 3.27Å; D165-V167 HydrophobicContact CB-CG2 3.92Å; D165-V167 PolarHBondContact O-N 3.47Å; D165-T205 PolarHBondContact N-OG1 2.94Å
166	K	39.8	Very low	56.5	Low	211 Å²	211	91.2 Å²	91.2	92%	0.917	51%	0.509	S	S	*	.			trans	-63.4	78.1	162.6	-67.5	178.3	178.7	177.1	0	108	K164 S168	K164-K166 PolarHBondContact O-N 2.96Å; K166-S168 PolarHBondContact O-N 3.39Å
167	V	40.9	Very low	53.5	Low	115 Å²	115	93.7 Å²	93.7	70%	0.697	54%	0.538	S	S	*	.			trans	-78.6	121.2	177.5	-177.1	0	0	0	0	109.5	D165	D165-V167 HydrophobicContact CB-CG2 3.92Å; D165-V167 PolarHBondContact O-N 3.47Å
168	S	32.8	Very low	50.5	Low	100 Å²	100	97.7 Å²	97.7	70%	0.699	57%	0.571	S	S	*	*			trans	-39.5	136.8	169.2	-65.8	0	0	0	0	112.2	K166 C170	K166-S168 PolarHBondContact O-N 3.39Å; S168-C170 VanDerWaalsContact C-N 3.32Å; S168-C170 PolarHBondContact O-N 3.26Å
169	V	32.7	Very low	47.6	Very low	119 Å²	119	103.8 Å²	103.8	72%	0.721	61%	0.611	S	S	*	*			trans	-52.9	95.3	169.2	-174.6	0	0	0	0	108.9	H171	V169-H171 VanDerWaalsContact C-N 3.26Å; V169-H171 WeakPolarHBondContact CG1-ND1 3.32Å; V169-H171 PolarHBondContact O-N 3Å; V169-H171 PolarHBondContact O-ND1 3.46Å
170	C	33.1	Very low	44.7	Very low	104 Å²	104	107.8 Å²	107.8	70%	0.703	64%	0.642	S	S	*	*			trans	-64.3	97	162.8	-65	0	0	0	0	105.8	S168 L172	S168-C170 VanDerWaalsContact C-N 3.32Å; S168-C170 PolarHBondContact O-N 3.26Å; C170-L172 PolarHBondContact O-N 2.99Å
171	H	30.3	Very low	42	Very low	167 Å²	167	107.7 Å²	107.7	77%	0.773	66%	0.66	S	S	*	*			trans	-62.5	92.1	162.7	-77.8	56.2	0	0	0	106.1	V169 G173	V169-H171 VanDerWaalsContact C-N 3.26Å; V169-H171 WeakPolarHBondContact CG1-ND1 3.32Å; V169-H171 PolarHBondContact O-N 3Å; V169-H171 PolarHBondContact O-ND1 3.46Å; H171-G173 PolarHBondContact O-N 3.31Å
172	L	35.5	Very low	39.4	Very low	169 Å²	169	115.4 Å²	115.4	89%	0.885	70%	0.701	S	S	*	*			trans	-65.6	88.6	158.8	-76.1	170	0	0	0	105.8	C170 W174	C170-L172 PolarHBondContact O-N 2.99Å; L172-W174 PolarHBondContact O-N 3.48Å
173	G	30.4	Very low	36.8	Very low	66 Å²	66	120.9 Å²	120.9	68%	0.68	74%	0.735	S	S	*	*			trans	-60.5	102.2	172	0	0	0	0	0	108.5	H171 S175	H171-G173 PolarHBondContact O-N 3.31Å; G173-S175 PolarHBondContact O-N 3.09Å; G173-S175 VanDerWaalsContact O-N 3.12Å
174	W	26.2	Very low	34.5	Very low	236 Å²	236	123.7 Å²	123.7	89%	0.894	76%	0.764	S	S	*	*			trans	-71.7	100.6	163.1	-164.6	-82.7	0	0	0	107.4	L172 A176	L172-W174 PolarHBondContact O-N 3.48Å; W174-A176 PolarHBondContact O-N 2.87Å
175	S	31.2	Very low	33.1	Very low	120 Å²	120	123.2 Å²	123.2	84%	0.839	78%	0.78	S	S	*	*			trans	-67.1	82.9	167.3	-73.7	0	0	0	0	109.2	G173 G177	G173-S175 PolarHBondContact O-N 3.09Å; G173-S175 VanDerWaalsContact O-N 3.12Å; S175-G177 PolarHBondContact O-N 2.79Å; S175-G177 VanDerWaalsContact O-N 3.15Å
176	A	31.5	Very low	32.4	Very low	77 Å²	77	123.8 Å²	123.8	64%	0.636	79%	0.79	S	S	*	*			trans	-74.8	94	159.9	0	0	0	0	0	107.5	W174 A178	W174-A176 PolarHBondContact O-N 2.87Å; A176-A178 PolarHBondContact O-N 3Å; A176-A178 VanDerWaalsContact O-N 3.15Å
177	G	33	Very low	32.2	Very low	83 Å²	83	118.6 Å²	118.6	86%	0.856	79%	0.787	S	S	*	*			trans	-60.9	113.3	160.7	0	0	0	0	0	108.8	S175	S175-G177 PolarHBondContact O-N 2.79Å; S175-G177 VanDerWaalsContact O-N 3.15Å
178	A	29.6	Very low	31.7	Very low	85 Å²	85	118.9 Å²	118.9	70%	0.702	79%	0.794	S	S	*	*			trans	-123.4	137.1	163.9	0	0	0	0	0	108.9	A176	A176-A178 PolarHBondContact O-N 3Å; A176-A178 VanDerWaalsContact O-N 3.15Å
179	P	32.1	Very low	31.9	Very low	128 Å²	128	123 Å²	123	83%	0.831	81%	0.807	S	S	*	*			trans	-75.1	147	-174.4	32.3	-34.2	0	0	0	111.1
180	S	31.6	Very low	31.7	Very low	127 Å²	127	120.9 Å²	120.9	89%	0.888	81%	0.809	S	S	*	*			trans	-58.1	127.9	172.4	42.1	0	0	0	0	113
181	G	31.7	Very low	31.9	Very low	67 Å²	67	122.1 Å²	122.1	69%	0.691	82%	0.818	S	S	*	*			trans	161.3	119.3	160.1	0	0	0	0	0	115.5
182	L	30.9	Very low	31.9	Very low	163 Å²	163	119.3 Å²	119.3	85%	0.853	82%	0.818	S	S	*	*			trans	92.2	102	149.9	-62.5	153	0	0	0	119.9
183	T	30.8	Very low	31.8	Very low	132 Å²	132	118.8 Å²	118.8	81%	0.81	82%	0.816	S	S	*	*				50	129.1	127.9	55.8	0	0	0	0	122
184	A	31.8	Very low	32	Very low	107 Å²	107	121.2 Å²	121.2	88%	0.884	82%	0.82	S	S	*	*			trans	-68.4	150.8	179.4	0	0	0	0	0	116.5
185	A	30.7	Very low	32.5	Very low	99 Å²	99	115.3 Å²	115.3	82%	0.818	81%	0.811	S	S	*	*			trans	-160.5	148.8	148	0	0	0	0	0	110.5
186	P	34.3	Very low	32.6	Very low	125 Å²	125	115.8 Å²	115.8	81%	0.812	81%	0.809	S	S	*	*			trans	-97.4	148.2	-173.6	36.2	-30.9	0	0	0	114.8
187	A	34.9	Very low	32.8	Very low	102 Å²	102	116.7 Å²	116.7	84%	0.843	81%	0.811	S	S	*	*			trans	42.4	114.2	147.2	0	0	0	0	0	121.2
188	S	29.9	Very low	32.7	Very low	121 Å²	121	117.3 Å²	117.3	85%	0.846	81%	0.808	S	S	*	*			trans	-153.6	147.7	139.1	56.9	0	0	0	0	111.4
189	L	37	Very low	32.9	Very low	187 Å²	187	121 Å²	121	98%	0.979	81%	0.809	S	S	*	*			trans	-63.9	145.2	-168.8	-73.1	106.4	0	0	0	114.8
190	G	29.7	Very low	32.8	Very low	74 Å²	74	123.5 Å²	123.5	76%	0.763	81%	0.809	S	S	*	*			trans	-166.6	109.7	165	0	0	0	0	0	111.8	S192	G190-S192 PolarHBondContact O-N 3.47Å
191	S	37.9	Very low	33	Very low	129 Å²	129	122.3 Å²	122.3	90%	0.902	80%	0.797	S	S	*	*			trans	-60.2	125.4	174.3	122.3	0	0	0	0	111.3
192	S	28.7	Very low	33.2	Very low	108 Å²	108	122.1 Å²	122.1	76%	0.755	79%	0.789	S	S	*	*			trans	-165.4	130.2	146.4	50.7	0	0	0	0	109.3	G190	G190-S192 PolarHBondContact O-N 3.47Å
193	N	34	Very low	33.7	Very low	159 Å²	159	117.7 Å²	117.7	85%	0.85	78%	0.782	S	S	*	*			trans	-53.1	135.1	177.6	-72.1	-26.7	0	0	0	111.4
194	P	33.6	Very low	34.4	Very low	117 Å²	117	115.5 Å²	115.5	76%	0.76	77%	0.768	S	S	*	*			trans	-75.6	136.8	164	30	-28.5	0	0	0	109.7
195	P	38.3	Very low	35.5	Very low	111 Å²	111	111.6 Å²	111.6	72%	0.721	73%	0.734	S	S	*	*			trans	-77.1	177.4	162.8	34.3	-30.4	0	0	0	109.4
196	T	33.1	Very low	37.1	Very low	130 Å²	130	107.6 Å²	107.6	80%	0.798	70%	0.702	S	S	*	*			trans	81.9	93	174.1	13.8	0	0	0	0	116.4	A198	T196-A198 PolarHBondContact O-N 3.3Å
197	S	35.3	Very low	39	Very low	96 Å²	96	102.8 Å²	102.8	67%	0.671	67%	0.67	S	S	*	*			trans	-41	96.5	152.3	49.1	0	0	0	0	112.1	F199	S197-F199 PolarHBondContact O-N 2.94Å
198	A	30.6	Very low	41	Very low	96 Å²	96	98.3 Å²	98.3	79%	0.793	63%	0.633	S	S	*	*			trans	-75.6	100.3	154.9	0	0	0	0	0	106.6	T196 Q200	T196-A198 PolarHBondContact O-N 3.3Å; A198-Q200 PolarHBondContact O-N 3.29Å
199	F	35	Very low	43.5	Very low	162 Å²	162	92.6 Å²	92.6	71%	0.711	59%	0.592	S	S	*	*			trans	-62.4	103.1	165	-87	-94.9	0	0	0	107	S197 V201	S197-F199 PolarHBondContact O-N 2.94Å; F199-V201 PolarHBondContact O-N 2.78Å; F199-V201 VanDerWaalsContact O-N 3.07Å
200	Q	29.3	Very low	45.6	Very low	181 Å²	181	86.5 Å²	86.5	85%	0.846	56%	0.557	S	S	*	*			trans	-65.1	106.5	166.5	-174.2	126.1	19.1	0	0	106.5	A198 A202	A198-Q200 PolarHBondContact O-N 3.29Å; Q200-A202 VanDerWaalsContact C-N 3.27Å; Q200-A202 PolarHBondContact O-N 3.44Å
201	V	36.1	Very low	48.1	Very low	103 Å²	103	84.5 Å²	84.5	62%	0.624	53%	0.528	S	S	*	.			trans	-65.7	92.7	175	-178.9	0	0	0	0	107.3	F199 G203	F199-V201 PolarHBondContact O-N 2.78Å; F199-V201 VanDerWaalsContact O-N 3.07Å; V201-G203 PolarHBondContact O-N 2.95Å
202	A	35.6	Very low	50.4	Low	63 Å²	63	78.4 Å²	78.4	52%	0.521	49%	0.485	S	S	.	.			trans	-70.9	105.9	167.4	0	0	0	0	0	106.6	Q200 T204	Q200-A202 VanDerWaalsContact C-N 3.27Å; Q200-A202 PolarHBondContact O-N 3.44Å; A202-T204 PolarHBondContact O-N 3.38Å
203	G	40.3	Very low	53.2	Low	69 Å²	69	74.8 Å²	74.8	71%	0.711	46%	0.456	S	S	*	.			trans	-64.5	128.9	-179	0	0	0	0	0	111.3	V201	V201-G203 PolarHBondContact O-N 2.95Å
204	T	45.3	Very low	55.8	Low	86 Å²	86	67.2 Å²	67.2	53%	0.528	42%	0.416	S	S	.	.			trans	-153.7	100.1	166.3	50.1	0	0	0	0	111.5	A202 G206	A202-T204 PolarHBondContact O-N 3.38Å; T204-G206 PolarHBondContact O-N 3.4Å
205	T	55.6	Low	58.4	Low	25 Å²	25	63.9 Å²	63.9	15%	0.153	39%	0.39	C	S	.	.			trans	-97.4	76.3	156.5	44.9	0	0	0	0	109	L161 T163 K164 D165	L161-T205 CarbonylContact O-C 3.57Å; T163-T205 CarbonylContact C-O 3.59Å; T163-T205 WeakPolarHBondContact O-CB 3.27Å; T163-T205 PolarHBondContact O-OG1 2.94Å; K164-T205 WeakPolarHBondContact CA-O 3.14Å; K164-T205 WeakPolarHBondContact CG-O 3.5Å; K164-T205 PolarHBondContact N-O 3.42Å; D165-T205 PolarHBondContact N-OG1 2.94Å
206	G	64	Low	61	Low	16 Å²	16	59 Å²	59	17%	0.165	36%	0.358	C	S	.	.			trans	-126.5	33.2	170.3	0	0	0	0	0	110.1	T204 K280	T204-G206 PolarHBondContact O-N 3.4Å; G206-K280 WeakPolarHBondContact O-CE 3.4Å
207	I	74.6	Confident	63.9	Low	24 Å²	24	52.9 Å²	52.9	12%	0.123	32%	0.32	C	S	.	.			trans	-100.8	131.2	-161.9	-58.9	177.5	0	0	0	108.1	T97 L161 H162 L235	T97-I207 HydrophobicContact CG2-CD1 3.62Å; T97-I207 HydrophobicContact CG2-CG2 4.34Å; L161-I207 CarbonylContact C-O 3.57Å; L161-I207 WeakPolarHBondContact CB-O 3.41Å; L161-I207 PolarHBondContact O-N 2.93Å; L161-I207 VanDerWaalsContact O-O 3.11Å; H162-I207 PolarHBondContact CD2-O 3.47Å; H162-I207 VanDerWaalsContact CD2-O 3.29Å; I207-L235 HydrophobicContact CG2-CD2 3.45Å; I207-L235 VanDerWaalsContact CG2-CD2 3.45Å
208	A	77.8	Confident	66.8	Low	8 Å²	8	50 Å²	50	7%	0.066	30%	0.297	C	S	.	.			trans	-94.2	146.7	167.3	0	0	0	0	0	109.7	R210 D279 K280 D283	A208-R210 HydrophobicContact CB-CG 3.92Å; A208-D279 HydrophobicContact CB-CB 3.63Å; A208-K280 HydrophobicContact CB-CG 4.21Å; A208-D283 WeakPolarHBondContact CA-OD2 3.26Å
209	H	82.6	Confident	70	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.259	C	S	.	.			trans	-69.9	-42.9	178	-173.6	-64.2	0	0	0	111.6	L158 D211 L212 C231 D232 F233 D283	L158-H209 HydrophobicContact CD2-CB 4.16Å; H209-D211 VanDerWaalsContact CE1-C 3.44Å; H209-D211 PolarHBondContact CE1-O 3.21Å; H209-D211 VanDerWaalsContact CE1-O 3.29Å; H209-D211 PolarHBondContact ND1-N 2.77Å; H209-D211 PolarHBondContact O-N 3.29Å; H209-L212 PolarHBondContact ND1-N 3.47Å; H209-L212 VanDerWaalsContact ND1-N 3.11Å; H209-C231 PolarHBondContact CE1-O 2.93Å; H209-C231 PolarHBondContact NE2-O 3.4Å; H209-D232 PolarHBondContact CE1-O 2.97Å; H209-D232 VanDerWaalsContact CE1-O 3.28Å; H209-F233 AromaticContact CD2-CD1 3.39Å; H209-F233 WeakPolarHBondContact CD2-CD1 3.4Å; H209-F233 AromaticContact CD2-CE1 3.53Å; H209-F233 AromaticContact CG-CD1 3.99Å; H209-F233 AromaticContact NE2-CD1 3.78Å; H209-D283 WeakPolarHBondContact CB-OD1 3.26Å; H209-D283 PolarHBondContact N-OD1 3.11Å; H209-D283 PolarHBondContact N-OD2 3.23Å
210	R	79.8	Confident	72.9	Confident	60 Å²	60	42.2 Å²	42.2	23%	0.226	25%	0.246	C	C	.	.	S	Bend	trans	66.2	-17	175.9	-62	171.3	166.2	178.1	1.8	117.1	A208 D279 D283	A208-R210 HydrophobicContact CB-CG 3.92Å; R210-D279 IonicContact CZ-OD2 2.87Å; R210-D279 IonicContact NE-OD1 3.85Å; R210-D279 IonicContact NE-OD2 3.11Å; R210-D279 PolarHBondContact NE-OD2 3.19Å; R210-D279 IonicContact NH2-OD2 3.42Å; R210-D279 PolarHBondContact NH2-OD2 2.73Å; R210-D283 PolarHBondContact N-OD1 3.18Å
211	D	82	Confident	75.9	Confident	32 Å²	32	34.9 Å²	34.9	17%	0.171	22%	0.215	C	C	.	.			trans	-129.8	38.6	174.6	-165.6	38	0	0	0	112.8	H209 K213 N216 D234	H209-D211 VanDerWaalsContact CE1-C 3.44Å; H209-D211 PolarHBondContact CE1-O 3.21Å; H209-D211 VanDerWaalsContact CE1-O 3.29Å; H209-D211 PolarHBondContact ND1-N 2.77Å; H209-D211 PolarHBondContact O-N 3.29Å; D211-K213 PolarHBondContact O-N 2.92Å; D211-K213 IonicContact OD1-NZ 2.73Å; D211-K213 PolarHBondContact OD1-NZ 3.18Å; D211-K213 IonicContact OD2-NZ 2.76Å; D211-K213 PolarHBondContact OD2-NZ 3.28Å; D211-N216 PolarHBondContact O-ND2 3.27Å; D211-N216 PolarHBondContact OD2-ND2 2.92Å; D211-D234 HydrophobicContact CB-CB 3.97Å
212	L	86.9	Confident	78.6	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.208	C	C	.	.			trans	-71.9	116.5	179.4	-175.3	73.8	0	0	0	109.3	V154 L158 H209 I217 I230 D283 S286 L287 I406	V154-L212 HydrophobicContact CG1-CD1 4.15Å; V154-L212 HydrophobicContact CG1-CD2 3.94Å; L158-L212 HydrophobicContact CD1-CD2 3.96Å; L158-L212 HydrophobicContact CD2-CD2 4.45Å; H209-L212 PolarHBondContact ND1-N 3.47Å; H209-L212 VanDerWaalsContact ND1-N 3.11Å; L212-I217 HydrophobicContact CD1-CD1 4.37Å; L212-I217 HydrophobicContact CD1-CG1 4.16Å; L212-I230 HydrophobicContact CD1-CG2 4.09Å; L212-D283 WeakPolarHBondContact CD2-O 3.33Å; L212-S286 VanDerWaalsContact O-CB 3.23Å; L212-S286 WeakPolarHBondContact O-CB 3.32Å; L212-L287 HydrophobicContact CD2-CB 4.18Å; L212-I406 WeakPolarHBondContact O-CD1 3.33Å
213	K	87.6	Confident	81.3	Confident	33 Å²	33	37.2 Å²	37.2	14%	0.143	22%	0.215	C	C	.	.			trans	-150.3	167	-179.5	67.7	-165.2	-178.8	-151.4	0	110.2	D211 E215 N216 A403 I406	D211-K213 PolarHBondContact O-N 2.92Å; D211-K213 IonicContact OD1-NZ 2.73Å; D211-K213 PolarHBondContact OD1-NZ 3.18Å; D211-K213 IonicContact OD2-NZ 2.76Å; D211-K213 PolarHBondContact OD2-NZ 3.28Å; K213-E215 VanDerWaalsContact CD-OE1 3.27Å; K213-E215 WeakPolarHBondContact CD-OE1 3.4Å; K213-E215 WeakPolarHBondContact CE-OE1 3.33Å; K213-E215 HydrophobicContact CG-CB 4.31Å; K213-E215 PolarHBondContact O-N 2.91Å; K213-E215 VanDerWaalsContact O-N 3.16Å; K213-N216 WeakPolarHBondContact CE-ND2 3.29Å; K213-N216 HydrophobicContact CG-CB 4.19Å; K213-N216 PolarHBondContact O-N 3.37Å; K213-A403 HydrophobicContact CD-CB 4.09Å; K213-I406 HydrophobicContact CB-CD1 4.1Å
214	P	89.3	Confident	83.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-55.5	-34.2	-176.1	-24.3	31.9	0	0	0	115.6	I132 L133 N216 I217 V290 A402	I132-P214 HydrophobicContact CG2-CB 3.81Å; I132-P214 WeakPolarHBondContact CG2-O 3.49Å; L133-P214 HydrophobicContact CB-CB 4.48Å; L133-P214 HydrophobicContact CD1-CB 3.5Å; L133-P214 HydrophobicContact CD1-CG 3.57Å; L133-P214 HydrophobicContact CG-CB 3.66Å; L133-P214 HydrophobicContact CG-CG 4.16Å; P214-N216 PolarHBondContact O-N 3.41Å; P214-I217 PolarHBondContact O-N 3.39Å; P214-V290 HydrophobicContact CG-CG2 4.1Å; P214-A402 HydrophobicContact CG-CB 4.3Å
215	E	88.3	Confident	86.1	Confident	46 Å²	46	36.7 Å²	36.7	22%	0.215	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-65.3	-29.5	178.5	-54.5	87.5	92.1	0	0	112.5	K213 I217 T399	K213-E215 VanDerWaalsContact CD-OE1 3.27Å; K213-E215 WeakPolarHBondContact CD-OE1 3.4Å; K213-E215 WeakPolarHBondContact CE-OE1 3.33Å; K213-E215 HydrophobicContact CG-CB 4.31Å; K213-E215 PolarHBondContact O-N 2.91Å; K213-E215 VanDerWaalsContact O-N 3.16Å; E215-I217 VanDerWaalsContact C-N 3.3Å; E215-T399 VanDerWaalsContact CD-CB 3.47Å; E215-T399 HydrophobicContact CG-CG2 3.39Å; E215-T399 WeakPolarHBondContact CG-OG1 3.42Å; E215-T399 WeakPolarHBondContact OE1-CG2 3.38Å; E215-T399 VanDerWaalsContact OE2-CB 3.29Å; E215-T399 WeakPolarHBondContact OE2-CB 3.45Å; E215-T399 WeakPolarHBondContact OE2-CG2 3.33Å; E215-T399 PolarHBondContact OE2-OG1 2.72Å
216	N	91.7	Very high	87.9	Confident	10 Å²	10	36.5 Å²	36.5	5%	0.053	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-91.3	6.9	-178	-69.5	-7	0	0	0	112.1	D211 K213 P214 I230 C231	D211-N216 PolarHBondContact O-ND2 3.27Å; D211-N216 PolarHBondContact OD2-ND2 2.92Å; K213-N216 WeakPolarHBondContact CE-ND2 3.29Å; K213-N216 HydrophobicContact CG-CB 4.19Å; K213-N216 PolarHBondContact O-N 3.37Å; P214-N216 PolarHBondContact O-N 3.41Å; N216-I230 CarbonylContact O-C 3.52Å; N216-I230 VanDerWaalsContact O-CA 3.24Å; N216-I230 WeakPolarHBondContact O-CA 3.37Å; N216-C231 WeakPolarHBondContact CB-O 3.47Å; N216-C231 PolarHBondContact O-N 2.93Å
217	I	95.2	Very high	89.5	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	107.9	173.4	-58.2	165.3	0	0	0	107.7	S131 I132 V150 V154 L212 P214 E215 V228 I230 V290	S131-I217 WeakPolarHBondContact CA-O 3.42Å; I132-I217 HydrophobicContact CB-CB 4.19Å; I132-I217 HydrophobicContact CB-CG2 4.04Å; I132-I217 HydrophobicContact CG1-CG2 4.43Å; I132-I217 HydrophobicContact CG2-CB 4.08Å; I132-I217 HydrophobicContact CG2-CG2 4.37Å; I132-I217 PolarHBondContact N-O 3.27Å; V150-I217 HydrophobicContact CG1-CG2 4.46Å; V154-I217 HydrophobicContact CG2-CD1 4.06Å; V154-I217 HydrophobicContact CG2-CG1 4.21Å; V154-I217 HydrophobicContact CG2-CG2 4.04Å; L212-I217 HydrophobicContact CD1-CD1 4.37Å; L212-I217 HydrophobicContact CD1-CG1 4.16Å; P214-I217 PolarHBondContact O-N 3.39Å; E215-I217 VanDerWaalsContact C-N 3.3Å; I217-V228 HydrophobicContact CG2-CB 3.91Å; I217-V228 HydrophobicContact CG2-CG1 4.16Å; I217-V228 HydrophobicContact CG2-CG2 3.98Å; I217-I230 HydrophobicContact CG1-CG2 4.24Å; I217-V290 HydrophobicContact CD1-CG1 3.87Å; I217-V290 HydrophobicContact CD1-CG2 4.35Å
218	L	95.9	Very high	90.6	Very high	35 Å²	35	37.1 Å²	37.1	18%	0.183	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.8	-172.7	-59.8	-176.7	0	0	0	111.5	L108 L127 G130 V228 K229 C231	L108-L218 HydrophobicContact CD2-CD1 4.4Å; L127-L218 HydrophobicContact CB-CB 4.36Å; L127-L218 HydrophobicContact CD1-CB 3.51Å; L127-L218 HydrophobicContact CD1-CD1 4.17Å; L127-L218 HydrophobicContact CD1-CG 4.49Å; G130-L218 CarbonylContact O-C 3.42Å; G130-L218 WeakPolarHBondContact O-CA 3.5Å; L218-V228 CarbonylContact O-C 3.54Å; L218-V228 VanDerWaalsContact O-CA 3.22Å; L218-V228 WeakPolarHBondContact O-CA 3.48Å; L218-V228 WeakPolarHBondContact O-CB 3.38Å; L218-K229 PolarHBondContact N-O 2.9Å; L218-K229 PolarHBondContact O-N 3.17Å; L218-C231 HydrophobicContact CD1-CB 4.47Å
219	C	96.9	Very high	91.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	132.1	174.8	-63.3	0	0	0	0	110.6	L127 G129 G130 I132	L127-C219 WeakPolarHBondContact CB-O 3.25Å; G129-C219 WeakPolarHBondContact CA-O 3.49Å; G129-C219 PolarHBondContact N-O 2.86Å; G130-C219 PolarHBondContact O-N 3.47Å; I132-C219 VanDerWaalsContact CD1-SG 3.53Å
220	E	95.3	Very high	92.1	Very high	94 Å²	94	37.8 Å²	37.8	44%	0.439	19%	0.19	S	C	.	.	S	Bend	trans	-65.3	-44.1	-179.8	-173.3	177.2	154	0	0	112.3	L127 Q128 P227	L127-E220 HydrophobicContact CD2-CB 4.39Å; L127-E220 HydrophobicContact CD2-CG 4.18Å; Q128-E220 PolarHBondContact N-O 2.81Å; Q128-E220 VanDerWaalsContact N-O 3.13Å; E220-P227 HydrophobicContact CB-CG 4.03Å; E220-P227 PolarHBondContact N-O 2.67Å; E220-P227 VanDerWaalsContact N-O 3.1Å; E220-P227 WeakPolarHBondContact OE2-CG 3.17Å
221	S	93.8	Very high	92.5	Very high	28 Å²	28	35.7 Å²	35.7	20%	0.196	18%	0.184	C	C	.	.			trans	-116.2	150.3	-174.4	121.4	0	0	0	0	111.2	G129 H135 E223 K224	G129-S221 VanDerWaalsContact CA-O 3.3Å; G129-S221 WeakPolarHBondContact CA-O 3.34Å; H135-S221 PolarHBondContact CE1-O 2.69Å; S221-E223 VanDerWaalsContact C-N 3.32Å; S221-E223 WeakPolarHBondContact CB-OE2 3.39Å; S221-E223 PolarHBondContact OG-N 3.47Å; S221-E223 PolarHBondContact OG-OE2 3.4Å; S221-K224 VanDerWaalsContact O-O 3.09Å; S221-K224 PolarHBondContact OG-N 3.46Å; S221-K224 VanDerWaalsContact OG-N 3.16Å
222	P	92.4	Very high	92.4	Very high	73 Å²	73	36.9 Å²	36.9	47%	0.474	19%	0.191	S	C	.	.	S	Bend	trans	-77.9	-14.6	175.1	29.9	-32.9	0	0	0	113.4	H135	H135-P222 VanDerWaalsContact CE1-C 3.49Å; H135-P222 PolarHBondContact CE1-O 2.8Å; H135-P222 VanDerWaalsContact CE1-O 3.23Å
223	E	91.1	Very high	91.6	Very high	141 Å²	141	37 Å²	37	66%	0.659	19%	0.191	S	C	*	.	S	Bend	trans	-91.6	-25.1	-179.3	-51.2	78.7	-170.4	0	0	113.8	S221	S221-E223 VanDerWaalsContact C-N 3.32Å; S221-E223 WeakPolarHBondContact CB-OE2 3.39Å; S221-E223 PolarHBondContact OG-N 3.47Å; S221-E223 PolarHBondContact OG-OE2 3.4Å
224	K	93	Very high	90.5	Very high	140 Å²	140	37.3 Å²	37.3	61%	0.609	19%	0.194	S	C	*	.			trans	-129.1	140.8	-175.9	-63.7	-179.5	-177.2	174.4	0	110.6	H135 S221 S226	H135-K224 PolarHBondContact NE2-O 3.49Å; S221-K224 VanDerWaalsContact O-O 3.09Å; S221-K224 PolarHBondContact OG-N 3.46Å; S221-K224 VanDerWaalsContact OG-N 3.16Å; K224-S226 VanDerWaalsContact C-N 3.3Å; K224-S226 WeakPolarHBondContact CB-O 3.46Å; K224-S226 PolarHBondContact O-N 2.96Å
225	V	93.8	Very high	88.6	Confident	5 Å²	5	37.9 Å²	37.9	3%	0.03	20%	0.197	C	C	.	.	S	Bend	trans	-77.8	-13.8	179.4	71.3	0	0	0	0	113.8	I132 I136 F142 E146 V150 V228	I132-V225 HydrophobicContact CD1-CG2 3.38Å; I136-V225 HydrophobicContact CG1-CG2 4.09Å; F142-V225 HydrophobicContact CD2-CG1 4.49Å; F142-V225 HydrophobicContact CE2-CB 4.49Å; F142-V225 HydrophobicContact CE2-CG1 4.08Å; F142-V225 HydrophobicContact CE2-CG2 3.98Å; E146-V225 HydrophobicContact CB-CG1 3.79Å; E146-V225 HydrophobicContact CG-CG1 4.13Å; V150-V225 HydrophobicContact CG2-CG1 4.28Å; V150-V225 HydrophobicContact CG2-CG2 3.94Å; V225-V228 WeakPolarHBondContact O-CG1 3.31Å
226	S	94.3	Very high	86.3	Confident	20 Å²	20	37 Å²	37	14%	0.14	20%	0.2	C	C	.	.			trans	-140.1	144.9	173.6	160.1	0	0	0	0	108.3	D153 K224	D153-S226 PolarHBondContact OD2-OG 2.85Å; K224-S226 VanDerWaalsContact C-N 3.3Å; K224-S226 WeakPolarHBondContact CB-O 3.46Å; K224-S226 PolarHBondContact O-N 2.96Å
227	P	97.1	Very high	83.9	Confident	52 Å²	52	37.3 Å²	37.3	34%	0.338	20%	0.204	S	C	.	.	S	Bend	cis	-71.4	151	10.3	30.1	-37.1	0	0	0	115.2	D153 E220	D153-P227 WeakPolarHBondContact OD2-CA 3.27Å; E220-P227 HydrophobicContact CB-CG 4.03Å; E220-P227 PolarHBondContact N-O 2.67Å; E220-P227 VanDerWaalsContact N-O 3.1Å; E220-P227 WeakPolarHBondContact OE2-CG 3.17Å
228	V	97.9	Very high	81	Confident	1 Å²	1	40 Å²	40	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	154.6	171.8	-58.4	0	0	0	0	111.8	N106 I132 V150 D153 V154 I217 L218 V225	N106-V228 PolarHBondContact ND2-O 3.36Å; I132-V228 HydrophobicContact CD1-CG1 4.17Å; V150-V228 HydrophobicContact CG1-CG1 4.27Å; V150-V228 HydrophobicContact CG1-CG2 4.21Å; V150-V228 HydrophobicContact CG2-CG1 4.29Å; D153-V228 HydrophobicContact CB-CG2 3.52Å; D153-V228 PolarHBondContact OD2-N 3.05Å; V154-V228 HydrophobicContact CG2-CG2 4.02Å; I217-V228 HydrophobicContact CG2-CB 3.91Å; I217-V228 HydrophobicContact CG2-CG1 4.16Å; I217-V228 HydrophobicContact CG2-CG2 3.98Å; L218-V228 CarbonylContact O-C 3.54Å; L218-V228 VanDerWaalsContact O-CA 3.22Å; L218-V228 WeakPolarHBondContact O-CA 3.48Å; L218-V228 WeakPolarHBondContact O-CB 3.38Å; V225-V228 WeakPolarHBondContact O-CG1 3.31Å
229	K	96.8	Very high	78	Confident	22 Å²	22	42.1 Å²	42.1	10%	0.096	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	140.8	170.5	-54.3	-168.7	177.2	-174.4	0	110.6	K105 N106 E125 L127 L218	K105-K229 VanDerWaalsContact O-CE 3.24Å; K105-K229 WeakPolarHBondContact O-CE 3.29Å; N106-K229 CarbonylContact O-C 2.9Å; N106-K229 VanDerWaalsContact O-CA 3.29Å; N106-K229 WeakPolarHBondContact O-CA 3.4Å; E125-K229 WeakPolarHBondContact OE1-CD 3.47Å; E125-K229 IonicContact OE1-NZ 3.53Å; E125-K229 PolarHBondContact OE1-NZ 3.19Å; E125-K229 IonicContact OE2-NZ 2.66Å; E125-K229 PolarHBondContact OE2-NZ 2.76Å; L127-K229 HydrophobicContact CD1-CB 3.85Å; L127-K229 HydrophobicContact CD1-CD 4.13Å; L127-K229 HydrophobicContact CD1-CG 4.09Å; L127-K229 HydrophobicContact CD2-CD 4.26Å; L218-K229 PolarHBondContact N-O 2.9Å; L218-K229 PolarHBondContact O-N 3.17Å
230	I	94.2	Very high	74.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	149.3	173.8	69.1	-179.2	0	0	0	111.2	N106 I107 L108 V154 A157 L158 L161 L212 N216 I217 F233	N106-I230 PolarHBondContact O-N 3.24Å; I107-I230 HydrophobicContact CG1-CG1 4.13Å; L108-I230 PolarHBondContact N-O 2.71Å; V154-I230 HydrophobicContact CG1-CG2 4.24Å; V154-I230 HydrophobicContact CG2-CG2 4.17Å; A157-I230 HydrophobicContact CB-CD1 3.44Å; A157-I230 VanDerWaalsContact CB-CD1 3.44Å; A157-I230 HydrophobicContact CB-CG1 3.85Å; L158-I230 HydrophobicContact CD2-CD1 4.35Å; L161-I230 HydrophobicContact CD1-CD1 3.89Å; L212-I230 HydrophobicContact CD1-CG2 4.09Å; N216-I230 CarbonylContact O-C 3.52Å; N216-I230 VanDerWaalsContact O-CA 3.24Å; N216-I230 WeakPolarHBondContact O-CA 3.37Å; I217-I230 HydrophobicContact CG1-CG2 4.24Å; I230-F233 HydrophobicContact CD1-CE1 4.2Å; I230-F233 HydrophobicContact CG1-CE1 4.24Å
231	C	89.9	Confident	71.5	Confident	16 Å²	16	53.2 Å²	53.2	11%	0.108	30%	0.299	C	S	.	.			trans	-143	174.1	-179.2	66.5	0	0	0	0	112.3	L108 H209 N216 L218	L108-C231 HydrophobicContact CB-CB 3.79Å; L108-C231 HydrophobicContact CD2-CB 3.58Å; L108-C231 HydrophobicContact CG-CB 4.31Å; H209-C231 PolarHBondContact CE1-O 2.93Å; H209-C231 PolarHBondContact NE2-O 3.4Å; N216-C231 WeakPolarHBondContact CB-O 3.47Å; N216-C231 PolarHBondContact O-N 2.93Å; L218-C231 HydrophobicContact CD1-CB 4.47Å
232	D	78.6	Confident	68.3	Low	58 Å²	58	57.9 Å²	57.9	31%	0.31	32%	0.322	S	S	.	.			trans	60.5	67.4	174.6	-149.8	12	0	0	0	113.8	K78 H209 D234	K78-D232 IonicContact NZ-OD1 2.63Å; K78-D232 PolarHBondContact NZ-OD1 3.07Å; K78-D232 IonicContact NZ-OD2 3.17Å; H209-D232 PolarHBondContact CE1-O 2.97Å; H209-D232 VanDerWaalsContact CE1-O 3.28Å; D232-D234 PolarHBondContact O-N 3.16Å
233	F	71.1	Confident	65.2	Low	3 Å²	3	61.9 Å²	61.9	1%	0.013	34%	0.339	C	S	.	.			trans	-71.9	106.3	171.9	-50.6	-60.1	0	0	0	109.3	T97 L98 I107 L161 H209 I230 L235	T97-F233 HydrophobicContact CG2-CD2 4.37Å; L98-F233 HydrophobicContact CD2-CD2 3.9Å; L98-F233 HydrophobicContact CD2-CE2 3.64Å; L98-F233 HydrophobicContact CG-CD2 4.28Å; L98-F233 HydrophobicContact CG-CE2 4.39Å; I107-F233 HydrophobicContact CD1-CZ 4.28Å; I107-F233 HydrophobicContact CG1-CZ 4.3Å; I107-F233 HydrophobicContact CG2-CE2 3.93Å; I107-F233 HydrophobicContact CG2-CZ 3.6Å; L161-F233 HydrophobicContact CD1-CD1 4.27Å; L161-F233 HydrophobicContact CD1-CE1 3.57Å; L161-F233 HydrophobicContact CD1-CZ 4.2Å; L161-F233 HydrophobicContact CD2-CE1 4.23Å; L161-F233 HydrophobicContact CD2-CZ 4.22Å; H209-F233 AromaticContact CD2-CD1 3.39Å; H209-F233 WeakPolarHBondContact CD2-CD1 3.4Å; H209-F233 AromaticContact CD2-CE1 3.53Å; H209-F233 AromaticContact CG-CD1 3.99Å; H209-F233 AromaticContact NE2-CD1 3.78Å; I230-F233 HydrophobicContact CD1-CE1 4.2Å; I230-F233 HydrophobicContact CG1-CE1 4.24Å; F233-L235 HydrophobicContact CB-CD1 3.65Å; F233-L235 HydrophobicContact CB-CD2 4.24Å; F233-L235 HydrophobicContact CB-CG 3.67Å; F233-L235 WeakPolarHBondContact O-CG 3.23Å; F233-L235 PolarHBondContact O-N 2.94Å
234	D	63.2	Low	62.3	Low	39 Å²	39	60.8 Å²	60.8	21%	0.209	35%	0.347	C	S	.	.			trans	-77.2	70.5	175.6	-166.1	0.8	0	0	0	112.2	R90 D211 D232 G236 S237	R90-D234 IonicContact CZ-OD1 3.75Å; R90-D234 IonicContact NE-OD1 2.74Å; R90-D234 IonicContact NH2-OD1 2.81Å; R90-D234 PolarHBondContact NH2-OD1 3.25Å; R90-D234 IonicContact NH2-OD2 3.28Å; R90-D234 PolarHBondContact NH2-OD2 3.15Å; D211-D234 HydrophobicContact CB-CB 3.97Å; D232-D234 PolarHBondContact O-N 3.16Å; D234-G236 PolarHBondContact O-N 3.23Å; D234-G236 PolarHBondContact OD1-N 3.17Å; D234-S237 PolarHBondContact O-OG 3.35Å; D234-S237 PolarHBondContact OD1-N 3.46Å; D234-S237 WeakPolarHBondContact OD2-CB 2.95Å
235	L	50.7	Low	59.1	Low	11 Å²	11	59.7 Å²	59.7	6%	0.058	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-6.1	-179.3	-59.3	154.5	0	0	0	112.7	R93 T97 I207 F233	R93-L235 HydrophobicContact CG-CB 4.49Å; R93-L235 PolarHBondContact NH1-O 2.89Å; T97-L235 HydrophobicContact CG2-CD1 3.52Å; T97-L235 HydrophobicContact CG2-CD2 4.18Å; T97-L235 HydrophobicContact CG2-CG 4.46Å; T97-L235 WeakPolarHBondContact OG1-CD1 3.04Å; I207-L235 HydrophobicContact CG2-CD2 3.45Å; I207-L235 VanDerWaalsContact CG2-CD2 3.45Å; F233-L235 HydrophobicContact CB-CD1 3.65Å; F233-L235 HydrophobicContact CB-CD2 4.24Å; F233-L235 HydrophobicContact CB-CG 3.67Å; F233-L235 WeakPolarHBondContact O-CG 3.23Å; F233-L235 PolarHBondContact O-N 2.94Å
236	G	40.1	Very low	55.9	Low	27 Å²	27	65.6 Å²	65.6	28%	0.278	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-4.3	-179.6	0	0	0	0	0	114.5	D234 G238	D234-G236 PolarHBondContact O-N 3.23Å; D234-G236 PolarHBondContact OD1-N 3.17Å; G236-G238 PolarHBondContact O-N 2.94Å
237	S	40.3	Very low	53.2	Low	18 Å²	18	69.9 Å²	69.9	13%	0.126	42%	0.42	C	S	.	.			trans	-81.2	44.3	176.7	64	0	0	0	0	112.9	D234 V239 R410	D234-S237 PolarHBondContact O-OG 3.35Å; D234-S237 PolarHBondContact OD1-N 3.46Å; D234-S237 WeakPolarHBondContact OD2-CB 2.95Å; S237-V239 VanDerWaalsContact C-N 3.31Å; S237-V239 PolarHBondContact O-N 3.34Å; S237-R410 PolarHBondContact O-NH2 3.47Å; S237-R410 VanDerWaalsContact OG-CZ 3.29Å; S237-R410 PolarHBondContact OG-NH1 3.08Å; S237-R410 PolarHBondContact OG-NH2 3.37Å
238	G	35.2	Very low	49.9	Very low	56 Å²	56	74.5 Å²	74.5	58%	0.577	44%	0.44	S	S	*	.	S	Bend	trans	-60	107.4	147.2	0	0	0	0	0	105.3	G236 K240	G236-G238 PolarHBondContact O-N 2.94Å; G238-K240 PolarHBondContact O-N 3.12Å
239	V	32	Very low	46.6	Very low	81 Å²	81	79.9 Å²	79.9	49%	0.491	47%	0.473	S	S	.	.			trans	-50.3	116.2	-171.5	174.5	0	0	0	0	108.6	S237 L241	S237-V239 VanDerWaalsContact C-N 3.31Å; S237-V239 PolarHBondContact O-N 3.34Å; V239-L241 VanDerWaalsContact C-N 3.28Å; V239-L241 HydrophobicContact CG1-CG 4.44Å; V239-L241 PolarHBondContact O-N 3.21Å
240	K	27.3	Very low	43.4	Very low	162 Å²	162	85.1 Å²	85.1	70%	0.704	51%	0.507	S	S	*	.			trans	-67.1	99.6	159	-72.6	-174.2	178.2	178.7	0	105.5	G238 N242	G238-K240 PolarHBondContact O-N 3.12Å; K240-N242 VanDerWaalsContact C-N 3.29Å; K240-N242 WeakPolarHBondContact CB-OD1 3.31Å; K240-N242 PolarHBondContact O-N 3.03Å; K240-N242 PolarHBondContact O-OD1 3.41Å
241	L	28.6	Very low	41	Very low	164 Å²	164	90.1 Å²	90.1	86%	0.859	54%	0.539	S	S	*	.			trans	-60.6	96.3	167.6	-78.9	160.5	0	0	0	107.5	V239	V239-L241 VanDerWaalsContact C-N 3.28Å; V239-L241 HydrophobicContact CG1-CG 4.44Å; V239-L241 PolarHBondContact O-N 3.21Å
242	N	26.4	Very low	38.8	Very low	126 Å²	126	96.8 Å²	96.8	67%	0.674	57%	0.569	S	S	*	*			trans	-108.5	91.5	171.2	-57.8	-1	0	0	0	107.4	K240	K240-N242 VanDerWaalsContact C-N 3.29Å; K240-N242 WeakPolarHBondContact CB-OD1 3.31Å; K240-N242 PolarHBondContact O-N 3.03Å; K240-N242 PolarHBondContact O-OD1 3.41Å
243	N	27.7	Very low	36.4	Very low	158 Å²	158	100.9 Å²	100.9	85%	0.845	59%	0.59	S	S	*	*	S	Bend	trans	-147.4	93.1	143.6	-103.5	5.1	0	0	0	108.7
244	S	29.8	Very low	34.6	Very low	117 Å²	117	106.7 Å²	106.7	82%	0.818	63%	0.626	S	S	*	*			trans	34.4	99.3	157.3	60	0	0	0	0	118.8
245	C	26.3	Very low	33.1	Very low	118 Å²	118	110.5 Å²	110.5	80%	0.797	65%	0.651	S	S	*	*				173.6	138.5	112.5	-150.9	0	0	0	0	111.6
246	T	25.7	Very low	32.3	Very low	129 Å²	129	114.8 Å²	114.8	79%	0.791	68%	0.679	S	S	*	*			trans	81.8	133.9	167.2	70.5	0	0	0	0	119.7
247	P	39.5	Very low	31.7	Very low	110 Å²	110	120 Å²	120	71%	0.714	71%	0.71	S	S	*	*			trans	-90.7	160.6	178.9	37	-31	0	0	0	111.2
248	I	27.2	Very low	31.3	Very low	149 Å²	149	122.1 Å²	122.1	76%	0.764	74%	0.735	S	S	*	*			trans	151.3	106.9	137.3	-75.7	155.8	0	0	0	111.2
249	T	27.4	Very low	31.2	Very low	113 Å²	113	123.1 Å²	123.1	69%	0.693	73%	0.733	S	S	*	*			trans	45	110.4	143.4	65.9	0	0	0	0	121.9
250	T	31.4	Very low	31.3	Very low	132 Å²	132	123 Å²	123	81%	0.81	74%	0.74	S	S	*	*				38.9	160.8	125.3	53	0	0	0	0	122.4
251	P	43.3	Very low	31.5	Very low	106 Å²	106	122 Å²	122	69%	0.688	74%	0.738	S	S	*	*			cis	-139.9	180	0	21.8	5.6	0	0	0	116.4
252	E	42.9	Very low	32.1	Very low	155 Å²	155	123.1 Å²	123.1	72%	0.724	73%	0.732	S	S	*	*			trans	-13.2	134.5	157.1	-65.2	172	143	0	0	118.3
253	L	28.6	Very low	32.7	Very low	144 Å²	144	120.5 Å²	120.5	75%	0.754	72%	0.717	S	S	*	*			trans	-121.5	100.8	163.3	-77	166.4	0	0	0	110.5	V267	L253-V267 HydrophobicContact CD1-CG1 4.38Å; L253-V267 HydrophobicContact CD1-CG2 4.37Å
254	T	33.7	Very low	33.2	Very low	126 Å²	126	114.8 Å²	114.8	77%	0.773	69%	0.691	S	S	*	*			trans	-60.3	152.1	152	46.6	0	0	0	0	110.7
255	T	31.2	Very low	33.7	Very low	118 Å²	118	114.1 Å²	114.1	72%	0.724	68%	0.684	S	S	*	*	S	Bend	trans	-45.5	163	-177.8	-0.8	0	0	0	0	116.3
256	P	33.6	Very low	34.5	Very low	101 Å²	101	114.1 Å²	114.1	66%	0.656	67%	0.673	S	S	*	*			trans	-92	144.8	-132.7	37.3	-25.3	0	0	0	114
257	C	28.7	Very low	35.2	Very low	137 Å²	137	109.6 Å²	109.6	93%	0.926	65%	0.645	S	S	*	*			trans	-143.5	98.4	160.8	-65.5	0	0	0	0	108.1
258	G	30.8	Very low	35.3	Very low	63 Å²	63	107.1 Å²	107.1	65%	0.649	63%	0.627	S	S	*	*	S	Bend	trans	136.7	141.1	170.6	0	0	0	0	0	114.7
259	S	32.7	Very low	36	Very low	77 Å²	77	103.5 Å²	103.5	54%	0.538	61%	0.607	S	S	.	*			trans	-45.1	134.8	-171.9	-50.3	0	0	0	0	115.6	E261	S259-E261 PolarHBondContact O-N 3.34Å
260	A	33.8	Very low	36.8	Very low	77 Å²	77	103 Å²	103	64%	0.636	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-61.9	-10.9	-176.3	0	0	0	0	0	115.7	Y262	A260-Y262 VanDerWaalsContact C-N 3.26Å; A260-Y262 PolarHBondContact O-N 3.26Å
261	E	33.3	Very low	37.3	Very low	141 Å²	141	103.2 Å²	103.2	66%	0.659	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-73	-7.8	-176.5	31.3	174.1	-153.2	0	0	114.7	S259	S259-E261 PolarHBondContact O-N 3.34Å
262	Y	40.7	Very low	37.5	Very low	189 Å²	189	100.2 Å²	100.2	74%	0.741	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-121.7	10.9	-178.2	-54.4	-80.7	0	0	0	114.1	A260	A260-Y262 VanDerWaalsContact C-N 3.26Å; A260-Y262 PolarHBondContact O-N 3.26Å
263	M	37.9	Very low	38	Very low	71 Å²	71	98.2 Å²	98.2	35%	0.35	57%	0.568	S	S	.	*			trans	-75.3	135	179.2	-69.3	-179.5	174.1	0	0	110.3	V267 V268	M263-V267 HydrophobicContact CB-CB 4.41Å; M263-V267 HydrophobicContact CB-CG1 4.31Å; M263-V267 HydrophobicContact CG-CG1 4.31Å; M263-V267 HydrophobicContact SD-CG1 4.43Å; M263-V268 HydrophobicContact CB-CG2 3.39Å
264	A	39.1	Very low	39	Very low	37 Å²	37	98.1 Å²	98.1	31%	0.306	56%	0.564	S	S	.	*			trans	-65.8	148.5	173	0	0	0	0	0	110	E266 V267 V268	A264-E266 VanDerWaalsContact C-N 3.26Å; A264-E266 VanDerWaalsContact CB-CD 3.47Å; A264-E266 WeakPolarHBondContact CB-OE1 3.48Å; A264-E266 VanDerWaalsContact CB-OE2 3.28Å; A264-E266 WeakPolarHBondContact CB-OE2 3.48Å; A264-E266 PolarHBondContact O-N 2.97Å; A264-E266 VanDerWaalsContact O-N 3.17Å; A264-V267 HydrophobicContact CB-CG2 4.14Å; A264-V267 WeakPolarHBondContact O-CA 3.39Å; A264-V267 WeakPolarHBondContact O-CB 3.45Å; A264-V267 PolarHBondContact O-N 3.09Å; A264-V268 PolarHBondContact O-N 3.22Å
265	P	40.7	Very low	39.9	Very low	104 Å²	104	92.7 Å²	92.7	68%	0.675	53%	0.531	S	S	*	.	H	α-helix	trans	-50.6	-42.1	-175	-27.6	34.8	0	0	0	113.9	V267 V268 E269	P265-V267 VanDerWaalsContact C-N 3.28Å; P265-V267 PolarHBondContact O-N 3.21Å; P265-V268 PolarHBondContact O-N 3.26Å; P265-E269 WeakPolarHBondContact O-CB 3.37Å; P265-E269 PolarHBondContact O-N 3.33Å
266	E	42.7	Very low	41.4	Very low	118 Å²	118	88.7 Å²	88.7	55%	0.551	51%	0.507	S	S	*	.	H	α-helix	trans	-67.2	-25.3	177.3	70.6	-81	-166.6	0	0	113.6	A264	A264-E266 VanDerWaalsContact C-N 3.26Å; A264-E266 VanDerWaalsContact CB-CD 3.47Å; A264-E266 WeakPolarHBondContact CB-OE1 3.48Å; A264-E266 VanDerWaalsContact CB-OE2 3.28Å; A264-E266 WeakPolarHBondContact CB-OE2 3.48Å; A264-E266 PolarHBondContact O-N 2.97Å; A264-E266 VanDerWaalsContact O-N 3.17Å
267	V	41.2	Very low	42.8	Very low	34 Å²	34	87.3 Å²	87.3	21%	0.206	49%	0.491	C	S	.	.	H	α-helix	trans	-78.2	-41.4	174.3	179.7	0	0	0	0	109.3	L253 M263 A264 P265 F271	L253-V267 HydrophobicContact CD1-CG1 4.38Å; L253-V267 HydrophobicContact CD1-CG2 4.37Å; M263-V267 HydrophobicContact CB-CB 4.41Å; M263-V267 HydrophobicContact CB-CG1 4.31Å; M263-V267 HydrophobicContact CG-CG1 4.31Å; M263-V267 HydrophobicContact SD-CG1 4.43Å; A264-V267 HydrophobicContact CB-CG2 4.14Å; A264-V267 WeakPolarHBondContact O-CA 3.39Å; A264-V267 WeakPolarHBondContact O-CB 3.45Å; A264-V267 PolarHBondContact O-N 3.09Å; P265-V267 VanDerWaalsContact C-N 3.28Å; P265-V267 PolarHBondContact O-N 3.21Å; V267-F271 HydrophobicContact CG1-CD2 4.33Å; V267-F271 HydrophobicContact CG1-CE2 4.1Å; V267-F271 WeakPolarHBondContact O-CD2 3.33Å
268	V	39.8	Very low	44.5	Very low	57 Å²	57	81.6 Å²	81.6	35%	0.345	45%	0.45	S	S	.	.	H	α-helix	trans	-65.8	-39.6	177	-179.6	0	0	0	0	111.3	M263 A264 P265 V270 F271 T272	M263-V268 HydrophobicContact CB-CG2 3.39Å; A264-V268 PolarHBondContact O-N 3.22Å; P265-V268 PolarHBondContact O-N 3.26Å; V268-V270 VanDerWaalsContact C-N 3.32Å; V268-V270 PolarHBondContact O-N 2.89Å; V268-F271 CarbonylContact O-C 3.33Å; V268-F271 WeakPolarHBondContact O-CA 3.49Å; V268-F271 PolarHBondContact O-N 3.27Å; V268-T272 HydrophobicContact CG1-CG2 4.06Å; V268-T272 VanDerWaalsContact O-CG2 3.29Å; V268-T272 WeakPolarHBondContact O-CG2 3.47Å; V268-T272 PolarHBondContact O-N 3.33Å
269	E	42	Very low	46.5	Very low	73 Å²	73	79.3 Å²	79.3	34%	0.341	42%	0.422	S	S	.	.	H	α-helix	trans	-54.9	-44.1	180	-160.2	-175.4	149.6	0	0	112	P265 F271 T272 A275 N418	P265-E269 WeakPolarHBondContact O-CB 3.37Å; P265-E269 PolarHBondContact O-N 3.33Å; E269-F271 PolarHBondContact O-N 3.02Å; E269-T272 PolarHBondContact O-N 3.18Å; E269-T272 PolarHBondContact O-OG1 3.27Å; E269-A275 VanDerWaalsContact O-CB 3.23Å; E269-A275 WeakPolarHBondContact O-CB 3.45Å; E269-N418 PolarHBondContact OE1-OD1 3.12Å
270	V	45	Very low	48.9	Very low	104 Å²	104	77 Å²	77	63%	0.63	40%	0.403	S	S	*	.	H	α-helix	trans	-63.6	-24.2	175.2	178.3	0	0	0	0	112.9	V268	V268-V270 VanDerWaalsContact C-N 3.32Å; V268-V270 PolarHBondContact O-N 2.89Å
271	F	41.7	Very low	51.5	Low	135 Å²	135	74.8 Å²	74.8	59%	0.592	38%	0.378	S	S	*	.	H	α-helix	trans	-104	-3.1	-177.9	-68.5	-67.2	0	0	0	114.4	V267 V268 E269	V267-F271 HydrophobicContact CG1-CD2 4.33Å; V267-F271 HydrophobicContact CG1-CE2 4.1Å; V267-F271 WeakPolarHBondContact O-CD2 3.33Å; V268-F271 CarbonylContact O-C 3.33Å; V268-F271 WeakPolarHBondContact O-CA 3.49Å; V268-F271 PolarHBondContact O-N 3.27Å; E269-F271 PolarHBondContact O-N 3.02Å
272	T	48.5	Very low	54	Low	44 Å²	44	68.4 Å²	68.4	27%	0.27	35%	0.349	S	S	.	.			trans	-72.8	134.6	173.5	72.1	0	0	0	0	110.3	V268 E269 Q274 A275	V268-T272 HydrophobicContact CG1-CG2 4.06Å; V268-T272 VanDerWaalsContact O-CG2 3.29Å; V268-T272 WeakPolarHBondContact O-CG2 3.47Å; V268-T272 PolarHBondContact O-N 3.33Å; E269-T272 PolarHBondContact O-N 3.18Å; E269-T272 PolarHBondContact O-OG1 3.27Å; T272-Q274 PolarHBondContact O-N 3.42Å; T272-Q274 VanDerWaalsContact O-N 3.09Å; T272-A275 PolarHBondContact O-N 3.3Å; T272-A275 PolarHBondContact OG1-N 3.3Å
273	D	53	Low	56.4	Low	113 Å²	113	59.4 Å²	59.4	60%	0.604	31%	0.314	S	S	*	.	H	α-helix	trans	-61.2	-17.3	172.7	-79.8	-45.6	0	0	0	111.9	K164 T276 F277	K164-D273 IonicContact NZ-OD1 3.87Å; K164-D273 PolarHBondContact NZ-OD1 3.29Å; D273-T276 PolarHBondContact O-OG1 2.89Å; D273-T276 VanDerWaalsContact O-OG1 3.06Å; D273-F277 PolarHBondContact O-N 3.47Å
274	Q	48.8	Very low	59.1	Low	142 Å²	142	56.1 Å²	56.1	66%	0.664	30%	0.297	S	S	*	.	H	α-helix	trans	-73.7	-47.6	178.2	-64.2	-173.2	-1.2	0	0	112.4	T272 T276 F277 Y278	T272-Q274 PolarHBondContact O-N 3.42Å; T272-Q274 VanDerWaalsContact O-N 3.09Å; Q274-T276 VanDerWaalsContact C-N 3.28Å; Q274-T276 PolarHBondContact O-N 3.48Å; Q274-F277 WeakPolarHBondContact O-CA 3.05Å; Q274-F277 VanDerWaalsContact O-CB 3.29Å; Q274-F277 WeakPolarHBondContact O-CB 3.42Å; Q274-F277 PolarHBondContact O-N 3.1Å; Q274-Y278 VanDerWaalsContact O-CD2 3.32Å; Q274-Y278 WeakPolarHBondContact O-CD2 3.43Å; Q274-Y278 PolarHBondContact O-N 3.46Å
275	A	52.3	Low	61.7	Low	11 Å²	11	54.4 Å²	54.4	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-55.5	-44.7	175.2	0	0	0	0	0	112.3	E269 T272 F277 Y278 D279 E417	E269-A275 VanDerWaalsContact O-CB 3.23Å; E269-A275 WeakPolarHBondContact O-CB 3.45Å; T272-A275 PolarHBondContact O-N 3.3Å; T272-A275 PolarHBondContact OG1-N 3.3Å; A275-F277 PolarHBondContact O-N 3.37Å; A275-Y278 PolarHBondContact O-N 3.09Å; A275-D279 PolarHBondContact O-N 2.84Å; A275-E417 WeakPolarHBondContact CA-OE1 3.31Å; A275-E417 WeakPolarHBondContact CB-OE1 3.42Å; A275-E417 PolarHBondContact N-OE1 2.99Å
276	T	62.1	Low	64.2	Low	35 Å²	35	49.6 Å²	49.6	22%	0.215	25%	0.252	C	S	.	.	H	α-helix	trans	-68.9	-22	177.9	71.7	0	0	0	0	113.1	D273 Q274 K280	D273-T276 PolarHBondContact O-OG1 2.89Å; D273-T276 VanDerWaalsContact O-OG1 3.06Å; Q274-T276 VanDerWaalsContact C-N 3.28Å; Q274-T276 PolarHBondContact O-N 3.48Å; T276-K280 WeakPolarHBondContact O-CD 3.21Å; T276-K280 WeakPolarHBondContact O-CE 3.23Å; T276-K280 WeakPolarHBondContact O-CG 3.35Å; T276-K280 PolarHBondContact O-N 3.43Å
277	F	64.5	Low	66.8	Low	71 Å²	71	44 Å²	44	31%	0.311	23%	0.226	S	C	.	.	H	α-helix	trans	-73.8	-47.6	177.4	176	-89.9	0	0	0	111.2	D273 Q274 A275 K280 R281 K360	D273-F277 PolarHBondContact O-N 3.47Å; Q274-F277 WeakPolarHBondContact O-CA 3.05Å; Q274-F277 VanDerWaalsContact O-CB 3.29Å; Q274-F277 WeakPolarHBondContact O-CB 3.42Å; Q274-F277 PolarHBondContact O-N 3.1Å; A275-F277 PolarHBondContact O-N 3.37Å; F277-K280 PolarHBondContact O-N 3.5Å; F277-R281 HydrophobicContact CD1-CG 4.26Å; F277-R281 HydrophobicContact CE1-CG 3.93Å; F277-R281 HydrophobicContact CZ-CG 4.16Å; F277-R281 VanDerWaalsContact CZ-NE 3.31Å; F277-R281 WeakPolarHBondContact O-CG 3.39Å; F277-R281 PolarHBondContact O-N 3.23Å; F277-R281 VanDerWaalsContact O-N 3.14Å; F277-K360 HydrophobicContact CE1-CG 3.96Å
278	Y	64.3	Low	69.4	Low	18 Å²	18	42.4 Å²	42.4	7%	0.071	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-41.2	-178.3	-77.1	-84.7	0	0	0	112.3	Q274 A275 K280 R281 C282 A359 K360	Q274-Y278 VanDerWaalsContact O-CD2 3.32Å; Q274-Y278 WeakPolarHBondContact O-CD2 3.43Å; Q274-Y278 PolarHBondContact O-N 3.46Å; A275-Y278 PolarHBondContact O-N 3.09Å; Y278-K280 VanDerWaalsContact C-N 3.32Å; Y278-K280 PolarHBondContact O-N 3.4Å; Y278-R281 PolarHBondContact O-N 3.21Å; Y278-R281 VanDerWaalsContact O-N 3.14Å; Y278-C282 PolarHBondContact O-N 2.83Å; Y278-C282 PolarHBondContact O-SG 3.11Å; Y278-A359 HydrophobicContact CD1-CB 3.48Å; Y278-A359 VanDerWaalsContact CD1-CB 3.48Å; Y278-A359 HydrophobicContact CE1-CB 3.76Å; Y278-K360 WeakPolarHBondContact OH-CE 3.4Å; Y278-K360 PolarHBondContact OH-NZ 3.4Å; Y278-K360 VanDerWaalsContact OH-NZ 3.1Å
279	D	72.4	Confident	72	Confident	14 Å²	14	39.7 Å²	39.7	8%	0.075	20%	0.199	C	C	.	.	H	α-helix	trans	-59	-42.6	174.8	-87.8	-25	0	0	0	112.4	A208 R210 A275 R281 C282	A208-D279 HydrophobicContact CB-CB 3.63Å; R210-D279 IonicContact CZ-OD2 2.87Å; R210-D279 IonicContact NE-OD1 3.85Å; R210-D279 IonicContact NE-OD2 3.11Å; R210-D279 PolarHBondContact NE-OD2 3.19Å; R210-D279 IonicContact NH2-OD2 3.42Å; R210-D279 PolarHBondContact NH2-OD2 2.73Å; A275-D279 PolarHBondContact O-N 2.84Å; D279-R281 VanDerWaalsContact C-N 3.32Å; D279-R281 PolarHBondContact O-N 3.07Å; D279-C282 WeakPolarHBondContact O-CB 3.35Å; D279-C282 PolarHBondContact O-N 3.31Å
280	K	83.4	Confident	74.5	Confident	28 Å²	28	36.2 Å²	36.2	12%	0.122	18%	0.184	C	C	.	.	H	α-helix	trans	-62.6	-40.8	176.4	-71.4	169	-169.7	-173.6	0	111.2	H162 G206 A208 T276 F277 Y278 C282 D283 L284	H162-K280 HydrophobicContact CB-CD 3.94Å; H162-K280 HydrophobicContact CB-CG 4.16Å; H162-K280 PolarHBondContact CE1-O 3.14Å; H162-K280 WeakPolarHBondContact O-CE 3.24Å; H162-K280 PolarHBondContact O-NZ 3.02Å; G206-K280 WeakPolarHBondContact O-CE 3.4Å; A208-K280 HydrophobicContact CB-CG 4.21Å; T276-K280 WeakPolarHBondContact O-CD 3.21Å; T276-K280 WeakPolarHBondContact O-CE 3.23Å; T276-K280 WeakPolarHBondContact O-CG 3.35Å; T276-K280 PolarHBondContact O-N 3.43Å; F277-K280 PolarHBondContact O-N 3.5Å; Y278-K280 VanDerWaalsContact C-N 3.32Å; Y278-K280 PolarHBondContact O-N 3.4Å; K280-C282 VanDerWaalsContact C-N 3.28Å; K280-C282 PolarHBondContact O-N 3.43Å; K280-D283 WeakPolarHBondContact O-CB 3.32Å; K280-D283 PolarHBondContact O-N 3.44Å; K280-L284 WeakPolarHBondContact O-CD2 3.28Å
281	R	87.8	Confident	77.1	Confident	32 Å²	32	31.3 Å²	31.3	12%	0.121	15%	0.153	C	C	.	.	H	α-helix	trans	-68.9	-26.4	177.3	-61.7	-66.6	-175.4	162.9	10.5	112.6	F277 Y278 D279 D283 L284 W285 A359 R362 L363 S364	F277-R281 HydrophobicContact CD1-CG 4.26Å; F277-R281 HydrophobicContact CE1-CG 3.93Å; F277-R281 HydrophobicContact CZ-CG 4.16Å; F277-R281 VanDerWaalsContact CZ-NE 3.31Å; F277-R281 WeakPolarHBondContact O-CG 3.39Å; F277-R281 PolarHBondContact O-N 3.23Å; F277-R281 VanDerWaalsContact O-N 3.14Å; Y278-R281 PolarHBondContact O-N 3.21Å; Y278-R281 VanDerWaalsContact O-N 3.14Å; D279-R281 VanDerWaalsContact C-N 3.32Å; D279-R281 PolarHBondContact O-N 3.07Å; R281-D283 VanDerWaalsContact C-N 3.3Å; R281-D283 PolarHBondContact O-N 3.05Å; R281-L284 PolarHBondContact O-N 3.25Å; R281-W285 PolarHBondContact O-N 3.02Å; R281-A359 HydrophobicContact CB-CB 3.81Å; R281-A359 WeakPolarHBondContact CD-O 3.07Å; R281-A359 HydrophobicContact CG-CB 4.23Å; R281-A359 WeakPolarHBondContact CG-O 3.09Å; R281-R362 VanDerWaalsContact C-NH1 3.3Å; R281-R362 PolarHBondContact NH1-O 2.82Å; R281-R362 VanDerWaalsContact O-CD 3.28Å; R281-R362 WeakPolarHBondContact O-CD 3.48Å; R281-R362 PolarHBondContact O-NH1 2.84Å; R281-L363 PolarHBondContact NH1-O 3.42Å; R281-S364 VanDerWaalsContact NH1-CB 3.28Å
282	C	86.7	Confident	79.7	Confident	7 Å²	7	25.1 Å²	25.1	5%	0.047	13%	0.126	C	C	.	.	H	α-helix	trans	-61.4	-39.3	173.2	-68	0	0	0	0	111.5	Y278 D279 K280 L284 W285 S286 S413	Y278-C282 PolarHBondContact O-N 2.83Å; Y278-C282 PolarHBondContact O-SG 3.11Å; D279-C282 WeakPolarHBondContact O-CB 3.35Å; D279-C282 PolarHBondContact O-N 3.31Å; K280-C282 VanDerWaalsContact C-N 3.28Å; K280-C282 PolarHBondContact O-N 3.43Å; C282-L284 PolarHBondContact O-N 3.22Å; C282-W285 WeakPolarHBondContact O-CB 3.34Å; C282-W285 PolarHBondContact O-N 3.2Å; C282-W285 VanDerWaalsContact O-N 3.11Å; C282-S286 PolarHBondContact O-N 3.18Å; C282-S286 PolarHBondContact O-OG 2.8Å; C282-S413 PolarHBondContact SG-OG 3.5Å
283	D	90.4	Very high	81.8	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.1	-34.6	176.2	-61.3	-28.8	0	0	0	112.1	L158 H162 A208 H209 R210 L212 K280 R281 S286 L287	L158-D283 HydrophobicContact CD1-CB 4.07Å; L158-D283 HydrophobicContact CD2-CB 3.81Å; H162-D283 IonicContact CD2-OD2 3Å; H162-D283 IonicContact CE1-OD2 3.01Å; H162-D283 IonicContact NE2-OD2 2.74Å; H162-D283 PolarHBondContact NE2-OD2 3.28Å; A208-D283 WeakPolarHBondContact CA-OD2 3.26Å; H209-D283 WeakPolarHBondContact CB-OD1 3.26Å; H209-D283 PolarHBondContact N-OD1 3.11Å; H209-D283 PolarHBondContact N-OD2 3.23Å; R210-D283 PolarHBondContact N-OD1 3.18Å; L212-D283 WeakPolarHBondContact CD2-O 3.33Å; K280-D283 WeakPolarHBondContact O-CB 3.32Å; K280-D283 PolarHBondContact O-N 3.44Å; R281-D283 VanDerWaalsContact C-N 3.3Å; R281-D283 PolarHBondContact O-N 3.05Å; D283-S286 WeakPolarHBondContact O-CB 3.39Å; D283-S286 PolarHBondContact O-N 3.01Å; D283-L287 PolarHBondContact O-N 2.94Å
284	L	94.9	Very high	83.8	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-74.7	-31.2	178.5	-72.9	-47.2	0	0	0	112.2	L158 K280 R281 C282 L287 G288 L354 L363 A365 V368	L158-L284 HydrophobicContact CD1-CD1 3.94Å; K280-L284 WeakPolarHBondContact O-CD2 3.28Å; R281-L284 PolarHBondContact O-N 3.25Å; C282-L284 PolarHBondContact O-N 3.22Å; L284-L287 HydrophobicContact CD1-CD2 4.08Å; L284-L287 PolarHBondContact O-N 2.89Å; L284-G288 PolarHBondContact O-N 3.33Å; L284-L354 HydrophobicContact CB-CD2 3.98Å; L284-L354 HydrophobicContact CD1-CD2 4.44Å; L284-L354 WeakPolarHBondContact O-CD2 3.47Å; L284-L363 WeakPolarHBondContact CG-O 3.26Å; L284-A365 HydrophobicContact CD1-CB 4.21Å; L284-V368 HydrophobicContact CD1-CG2 4.27Å
285	W	93.6	Very high	86.1	Confident	1 Å²	1	11 Å²	11	0%	0.004	5%	0.053	C	C	.	.	H	α-helix	trans	-62.3	-47.6	168.6	176.9	-81.4	0	0	0	110.5	R281 C282 L287 G288 V289 F301 I328 L355 V356	R281-W285 PolarHBondContact O-N 3.02Å; C282-W285 WeakPolarHBondContact O-CB 3.34Å; C282-W285 PolarHBondContact O-N 3.2Å; C282-W285 VanDerWaalsContact O-N 3.11Å; W285-L287 VanDerWaalsContact C-N 3.3Å; W285-L287 PolarHBondContact O-N 3.16Å; W285-G288 WeakPolarHBondContact O-CA 3.48Å; W285-G288 PolarHBondContact O-N 3.24Å; W285-V289 PolarHBondContact O-N 2.99Å; W285-F301 HydrophobicContact CH2-CE2 4.23Å; W285-F301 AromaticContact CH2-CZ 3.75Å; W285-F301 HydrophobicContact CH2-CZ 3.75Å; W285-F301 HydrophobicContact CZ2-CE1 4.48Å; W285-F301 AromaticContact CZ2-CE2 3.48Å; W285-F301 HydrophobicContact CZ2-CE2 3.48Å; W285-F301 VanDerWaalsContact CZ2-CE2 3.48Å; W285-F301 AromaticContact CZ2-CZ 3.46Å; W285-F301 HydrophobicContact CZ2-CZ 3.46Å; W285-F301 VanDerWaalsContact CZ2-CZ 3.46Å; W285-I328 HydrophobicContact CZ2-CG2 4.25Å; W285-L355 HydrophobicContact CD2-CD2 3.98Å; W285-L355 HydrophobicContact CE3-CD2 4.27Å; W285-L355 HydrophobicContact CG-CD2 4.33Å; W285-L355 HydrophobicContact CZ2-CD2 4.45Å; W285-L355 VanDerWaalsContact CZ3-C 3.42Å; W285-L355 HydrophobicContact CZ3-CB 4.35Å; W285-V356 WeakPolarHBondContact CZ3-O 3.33Å
286	S	92.6	Very high	88	Confident	3 Å²	3	10.6 Å²	10.6	2%	0.021	5%	0.05	C	C	.	.	H	α-helix	trans	-57.5	-43.1	176	-56.7	0	0	0	0	112.2	L212 C282 D283 G288 V289 V290 I406	L212-S286 VanDerWaalsContact O-CB 3.23Å; L212-S286 WeakPolarHBondContact O-CB 3.32Å; C282-S286 PolarHBondContact O-N 3.18Å; C282-S286 PolarHBondContact O-OG 2.8Å; D283-S286 WeakPolarHBondContact O-CB 3.39Å; D283-S286 PolarHBondContact O-N 3.01Å; S286-G288 VanDerWaalsContact C-N 3.27Å; S286-G288 PolarHBondContact O-N 2.87Å; S286-V289 PolarHBondContact O-N 2.91Å; S286-V290 WeakPolarHBondContact O-CG2 3.19Å; S286-V290 PolarHBondContact O-N 2.66Å; S286-I406 WeakPolarHBondContact OG-CG1 3.48Å; S286-I406 WeakPolarHBondContact OG-CG2 3.45Å
287	L	96.9	Very high	89.4	Confident	1 Å²	1	9 Å²	9	1%	0.005	4%	0.04	C	C	.	.	H	α-helix	trans	-59.3	-38.2	173.6	-179.3	58.1	0	0	0	112	V151 V154 A155 L158 L212 D283 L284 W285 V290 L291 L354 V368	V151-L287 HydrophobicContact CG1-CD2 4.33Å; V151-L287 HydrophobicContact CG2-CD1 4.35Å; V154-L287 HydrophobicContact CB-CD1 4.07Å; V154-L287 HydrophobicContact CG1-CD1 3.81Å; A155-L287 HydrophobicContact CB-CD2 4.35Å; L158-L287 HydrophobicContact CD1-CD2 4.38Å; L212-L287 HydrophobicContact CD2-CB 4.18Å; D283-L287 PolarHBondContact O-N 2.94Å; L284-L287 HydrophobicContact CD1-CD2 4.08Å; L284-L287 PolarHBondContact O-N 2.89Å; W285-L287 VanDerWaalsContact C-N 3.3Å; W285-L287 PolarHBondContact O-N 3.16Å; L287-V290 PolarHBondContact O-N 3.39Å; L287-L291 VanDerWaalsContact O-CB 3.27Å; L287-L291 WeakPolarHBondContact O-CB 3.37Å; L287-L291 PolarHBondContact O-N 3.28Å; L287-L354 HydrophobicContact CG-CD1 4.48Å; L287-V368 HydrophobicContact CD2-CG1 4.42Å
288	G	97.4	Very high	90.5	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-62.2	-43.7	173.6	0	0	0	0	0	113.1	L284 W285 S286 L291 Y292	L284-G288 PolarHBondContact O-N 3.33Å; W285-G288 WeakPolarHBondContact O-CA 3.48Å; W285-G288 PolarHBondContact O-N 3.24Å; S286-G288 VanDerWaalsContact C-N 3.27Å; S286-G288 PolarHBondContact O-N 2.87Å; G288-L291 PolarHBondContact O-N 3.35Å; G288-Y292 WeakPolarHBondContact O-CB 3.46Å; G288-Y292 PolarHBondContact O-N 2.93Å
289	V	94.3	Very high	91.6	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-63.4	-48	175.8	175.5	0	0	0	0	110.6	W285 S286 L291 Y292 I293 P300 F301 L355	W285-V289 PolarHBondContact O-N 2.99Å; S286-V289 PolarHBondContact O-N 2.91Å; V289-L291 VanDerWaalsContact C-N 3.34Å; V289-L291 PolarHBondContact O-N 3.34Å; V289-Y292 PolarHBondContact O-N 3.32Å; V289-I293 HydrophobicContact CG1-CD1 3.97Å; V289-I293 WeakPolarHBondContact O-CG1 3.17Å; V289-I293 PolarHBondContact O-N 2.87Å; V289-P300 HydrophobicContact CG1-CG 4.29Å; V289-P300 HydrophobicContact CG2-CG 4.23Å; V289-F301 HydrophobicContact CG2-CE2 4.42Å; V289-L355 HydrophobicContact CG2-CD2 3.85Å
290	V	94.8	Very high	92.4	Very high	1 Å²	1	7.5 Å²	7.5	1%	0.006	4%	0.035	C	C	.	.	H	α-helix	trans	-59.6	-44.9	177.2	174.1	0	0	0	0	110.8	P214 I217 S286 L287 Y292 I293 M294	P214-V290 HydrophobicContact CG-CG2 4.1Å; I217-V290 HydrophobicContact CD1-CG1 3.87Å; I217-V290 HydrophobicContact CD1-CG2 4.35Å; S286-V290 WeakPolarHBondContact O-CG2 3.19Å; S286-V290 PolarHBondContact O-N 2.66Å; L287-V290 PolarHBondContact O-N 3.39Å; V290-Y292 PolarHBondContact O-N 2.95Å; V290-I293 PolarHBondContact O-N 2.98Å; V290-M294 HydrophobicContact CG1-CE 4.24Å; V290-M294 HydrophobicContact CG1-CG 4.36Å; V290-M294 HydrophobicContact CG1-SD 4.37Å; V290-M294 WeakPolarHBondContact O-CG 3.33Å; V290-M294 PolarHBondContact O-N 3.46Å
291	L	97.8	Very high	92.6	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-60.3	-45	177	175.3	55.6	0	0	0	111.9	V151 L287 G288 V289 I293 M294 L295 L350 I351 L354 W373	V151-L291 HydrophobicContact CG2-CB 4.3Å; V151-L291 HydrophobicContact CG2-CD1 3.78Å; V151-L291 HydrophobicContact CG2-CD2 4.2Å; V151-L291 HydrophobicContact CG2-CG 4.3Å; L287-L291 VanDerWaalsContact O-CB 3.27Å; L287-L291 WeakPolarHBondContact O-CB 3.37Å; L287-L291 PolarHBondContact O-N 3.28Å; G288-L291 PolarHBondContact O-N 3.35Å; V289-L291 VanDerWaalsContact C-N 3.34Å; V289-L291 PolarHBondContact O-N 3.34Å; L291-I293 VanDerWaalsContact C-N 3.31Å; L291-I293 PolarHBondContact O-N 3.17Å; L291-M294 HydrophobicContact CB-CE 4.4Å; L291-M294 HydrophobicContact CD1-CE 4.06Å; L291-M294 PolarHBondContact O-N 3.03Å; L291-L295 HydrophobicContact CD1-CD1 3.87Å; L291-L295 HydrophobicContact CD1-CD2 4.36Å; L291-L295 HydrophobicContact CD1-CG 3.86Å; L291-L295 HydrophobicContact CG-CD1 4.32Å; L291-L295 WeakPolarHBondContact O-CG 3.5Å; L291-L295 PolarHBondContact O-N 2.89Å; L291-L350 HydrophobicContact CD2-CD2 3.85Å; L291-L350 HydrophobicContact CD2-CG 4.08Å; L291-I351 HydrophobicContact CD2-CD1 4.42Å; L291-I351 HydrophobicContact CD2-CG1 3.67Å; L291-I351 HydrophobicContact CG-CD1 4.13Å; L291-I351 HydrophobicContact CG-CG1 3.83Å; L291-L354 HydrophobicContact CD2-CD1 4.39Å; L291-W373 HydrophobicContact CD1-CH2 3.5Å; L291-W373 HydrophobicContact CD1-CZ2 4.42Å; L291-W373 HydrophobicContact CD1-CZ3 3.86Å; L291-W373 HydrophobicContact CD2-CZ3 4.21Å
292	Y	96.3	Very high	92.2	Very high	5 Å²	5	8.1 Å²	8.1	2%	0.02	4%	0.044	C	C	.	.	H	α-helix	trans	-57.8	-45.6	176.7	-170.2	-74.4	0	0	0	111.6	G288 V289 V290 L295 S296 Y298 P300 Y333 E334 F335 W340 I351	G288-Y292 WeakPolarHBondContact O-CB 3.46Å; G288-Y292 PolarHBondContact O-N 2.93Å; V289-Y292 PolarHBondContact O-N 3.32Å; V290-Y292 PolarHBondContact O-N 2.95Å; Y292-L295 PolarHBondContact O-N 3.33Å; Y292-S296 WeakPolarHBondContact CD1-OG 3.46Å; Y292-S296 WeakPolarHBondContact CE1-OG 3.33Å; Y292-S296 PolarHBondContact O-N 2.84Å; Y292-S296 PolarHBondContact O-OG 3.03Å; Y292-Y298 WeakPolarHBondContact CD1-O 3.49Å; Y292-Y298 AromaticContact CE1-CD2 3.76Å; Y292-Y298 HydrophobicContact CE1-CD2 3.76Å; Y292-Y298 AromaticContact CE1-CE2 3.62Å; Y292-Y298 HydrophobicContact CE1-CE2 3.62Å; Y292-Y298 WeakPolarHBondContact CE1-O 3.3Å; Y292-Y298 AromaticContact CZ-CE2 3.94Å; Y292-Y298 WeakPolarHBondContact OH-CE2 3.32Å; Y292-P300 HydrophobicContact CD1-CB 3.86Å; Y292-P300 HydrophobicContact CD1-CG 4.21Å; Y292-P300 HydrophobicContact CD2-CB 3.69Å; Y292-P300 HydrophobicContact CD2-CG 4.44Å; Y292-P300 HydrophobicContact CE1-CB 4.09Å; Y292-P300 HydrophobicContact CE2-CB 3.9Å; Y292-P300 HydrophobicContact CG-CB 3.68Å; Y292-P300 HydrophobicContact CG-CG 4.02Å; Y292-Y333 HydrophobicContact CE2-CD2 4.13Å; Y292-E334 WeakPolarHBondContact CE2-O 3.04Å; Y292-E334 PolarHBondContact OH-O 2.89Å; Y292-F335 HydrophobicContact CD2-CD1 4.43Å; Y292-F335 AromaticContact CD2-CE1 3.96Å; Y292-F335 HydrophobicContact CD2-CE1 3.96Å; Y292-F335 AromaticContact CE2-CD1 3.78Å; Y292-F335 HydrophobicContact CE2-CD1 3.78Å; Y292-F335 AromaticContact CE2-CE1 3.74Å; Y292-F335 HydrophobicContact CE2-CE1 3.74Å; Y292-W340 AromaticContact CD1-CZ2 3.88Å; Y292-W340 HydrophobicContact CD1-CZ2 3.88Å; Y292-W340 AromaticContact CD2-CH2 3.78Å; Y292-W340 HydrophobicContact CD2-CH2 3.78Å; Y292-W340 AromaticContact CD2-CZ2 3.56Å; Y292-W340 HydrophobicContact CD2-CZ2 3.56Å; Y292-W340 AromaticContact CE1-CZ2 3.69Å; Y292-W340 HydrophobicContact CE1-CZ2 3.69Å; Y292-W340 AromaticContact CE2-CE2 3.95Å; Y292-W340 AromaticContact CE2-CH2 3.99Å; Y292-W340 HydrophobicContact CE2-CH2 3.99Å; Y292-W340 AromaticContact CE2-CZ2 3.38Å; Y292-W340 HydrophobicContact CE2-CZ2 3.38Å; Y292-W340 HydrophobicContact CG-CH2 4.1Å; Y292-W340 AromaticContact CG-CZ2 3.81Å; Y292-W340 HydrophobicContact CG-CZ2 3.81Å; Y292-W340 AromaticContact CZ-CE2 3.8Å; Y292-W340 AromaticContact CZ-CZ2 3.44Å; Y292-W340 VanDerWaalsContact CZ-CZ2 3.44Å; Y292-W340 AromaticContact CZ-NE1 3.78Å; Y292-W340 PolarHBondContact OH-NE1 2.86Å; Y292-I351 HydrophobicContact CD2-CD1 4.31Å; Y292-I351 HydrophobicContact CD2-CG2 4.17Å
293	I	93.4	Very high	91.8	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-65.1	-41.9	178.2	-62.1	164.4	0	0	0	111	L133 V289 V290 L291 L295 S296 G297 Y298 P299 L398 A402	L133-I293 HydrophobicContact CD1-CG2 3.98Å; L133-I293 HydrophobicContact CD2-CG2 3.75Å; V289-I293 HydrophobicContact CG1-CD1 3.97Å; V289-I293 WeakPolarHBondContact O-CG1 3.17Å; V289-I293 PolarHBondContact O-N 2.87Å; V290-I293 PolarHBondContact O-N 2.98Å; L291-I293 VanDerWaalsContact C-N 3.31Å; L291-I293 PolarHBondContact O-N 3.17Å; I293-L295 VanDerWaalsContact C-N 3.28Å; I293-L295 PolarHBondContact O-N 3.08Å; I293-S296 PolarHBondContact O-N 3.3Å; I293-G297 VanDerWaalsContact O-CA 3.26Å; I293-G297 WeakPolarHBondContact O-CA 3.29Å; I293-G297 PolarHBondContact O-N 3.34Å; I293-Y298 WeakPolarHBondContact CA-O 3.09Å; I293-P299 HydrophobicContact CD1-CB 4.34Å; I293-P299 HydrophobicContact CG1-CB 4.23Å; I293-L398 HydrophobicContact CG2-CD1 4.44Å; I293-A402 HydrophobicContact CD1-CB 4.05Å
294	M	95.3	Very high	91.4	Very high	1 Å²	1	12.6 Å²	12.6	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-61	-37.4	177.2	-72.6	-169.3	-59.9	0	0	112.2	I132 I136 F142 V150 V151 V290 L291 T385	I132-M294 HydrophobicContact CG1-SD 4.07Å; I136-M294 HydrophobicContact CD1-CB 4.36Å; I136-M294 HydrophobicContact CD1-CG 3.84Å; I136-M294 HydrophobicContact CD1-SD 4.25Å; F142-M294 HydrophobicContact CE1-CB 4.16Å; F142-M294 VanDerWaalsContact CE1-O 3.29Å; F142-M294 WeakPolarHBondContact CE1-O 3.48Å; F142-M294 HydrophobicContact CZ-CB 4.33Å; V150-M294 HydrophobicContact CB-CE 4.45Å; V150-M294 HydrophobicContact CB-SD 4.26Å; V150-M294 HydrophobicContact CG1-CE 4.2Å; V150-M294 HydrophobicContact CG1-SD 3.88Å; V151-M294 HydrophobicContact CG2-CE 3.95Å; V290-M294 HydrophobicContact CG1-CE 4.24Å; V290-M294 HydrophobicContact CG1-CG 4.36Å; V290-M294 HydrophobicContact CG1-SD 4.37Å; V290-M294 WeakPolarHBondContact O-CG 3.33Å; V290-M294 PolarHBondContact O-N 3.46Å; L291-M294 HydrophobicContact CB-CE 4.4Å; L291-M294 HydrophobicContact CD1-CE 4.06Å; L291-M294 PolarHBondContact O-N 3.03Å; M294-T385 WeakPolarHBondContact O-CB 3.41Å; M294-T385 WeakPolarHBondContact O-CG2 3.45Å; M294-T385 PolarHBondContact O-OG1 2.77Å
295	L	96.1	Very high	90.9	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-81.4	-29.6	-177.2	-63.9	-174.9	0	0	0	114	E144 A147 L291 Y292 I293 W340 I343 A347 I351 W373 L383 T385	E144-L295 HydrophobicContact CG-CD2 4.17Å; A147-L295 HydrophobicContact CB-CD2 3.73Å; L291-L295 HydrophobicContact CD1-CD1 3.87Å; L291-L295 HydrophobicContact CD1-CD2 4.36Å; L291-L295 HydrophobicContact CD1-CG 3.86Å; L291-L295 HydrophobicContact CG-CD1 4.32Å; L291-L295 WeakPolarHBondContact O-CG 3.5Å; L291-L295 PolarHBondContact O-N 2.89Å; Y292-L295 PolarHBondContact O-N 3.33Å; I293-L295 VanDerWaalsContact C-N 3.28Å; I293-L295 PolarHBondContact O-N 3.08Å; L295-W340 HydrophobicContact CB-CH2 3.89Å; L295-W340 HydrophobicContact CB-CZ3 4.21Å; L295-W340 HydrophobicContact CD1-CH2 4.29Å; L295-W340 HydrophobicContact CD1-CZ3 4.1Å; L295-I343 HydrophobicContact CB-CD1 4.11Å; L295-I343 HydrophobicContact CD1-CG2 4.21Å; L295-A347 HydrophobicContact CD1-CB 3.75Å; L295-I351 HydrophobicContact CD1-CD1 4.03Å; L295-W373 HydrophobicContact CD1-CZ2 4.44Å; L295-W373 HydrophobicContact CD2-CZ2 4.24Å; L295-L383 HydrophobicContact CD2-CD1 3.64Å; L295-T385 PolarHBondContact O-OG1 2.88Å
296	S	93.2	Very high	90.5	Very high	4 Å²	4	17 Å²	17	3%	0.028	11%	0.105	C	C	.	.	H	α-helix	trans	-115.7	-24.9	-172	66.4	0	0	0	0	115	Y292 I293 Y298	Y292-S296 WeakPolarHBondContact CD1-OG 3.46Å; Y292-S296 WeakPolarHBondContact CE1-OG 3.33Å; Y292-S296 PolarHBondContact O-N 2.84Å; Y292-S296 PolarHBondContact O-OG 3.03Å; I293-S296 PolarHBondContact O-N 3.3Å; S296-Y298 WeakPolarHBondContact O-CD1 3.33Å; S296-Y298 PolarHBondContact OG-N 3.44Å; S296-Y298 PolarHBondContact OG-O 3.25Å
297	G	90.4	Very high	90.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	81.5	9.2	-173.8	0	0	0	0	0	114.6	I293 L398	I293-G297 VanDerWaalsContact O-CA 3.26Å; I293-G297 WeakPolarHBondContact O-CA 3.29Å; I293-G297 PolarHBondContact O-N 3.34Å; G297-L398 WeakPolarHBondContact O-CD1 3.24Å
298	Y	87.8	Confident	89.5	Confident	48 Å²	48	26.3 Å²	26.3	19%	0.188	16%	0.163	C	C	.	.	S	Bend	trans	-143.1	161.6	176.1	58.4	-96.2	0	0	0	111	Y292 I293 S296 P336 D339 W340	Y292-Y298 WeakPolarHBondContact CD1-O 3.49Å; Y292-Y298 AromaticContact CE1-CD2 3.76Å; Y292-Y298 HydrophobicContact CE1-CD2 3.76Å; Y292-Y298 AromaticContact CE1-CE2 3.62Å; Y292-Y298 HydrophobicContact CE1-CE2 3.62Å; Y292-Y298 WeakPolarHBondContact CE1-O 3.3Å; Y292-Y298 AromaticContact CZ-CE2 3.94Å; Y292-Y298 WeakPolarHBondContact OH-CE2 3.32Å; I293-Y298 WeakPolarHBondContact CA-O 3.09Å; S296-Y298 WeakPolarHBondContact O-CD1 3.33Å; S296-Y298 PolarHBondContact OG-N 3.44Å; S296-Y298 PolarHBondContact OG-O 3.25Å; Y298-P336 WeakPolarHBondContact OH-CD 3.17Å; Y298-D339 HydrophobicContact CE1-CB 4.1Å; Y298-D339 WeakPolarHBondContact CE1-OD2 3.39Å; Y298-D339 PolarHBondContact OH-OD2 3.29Å; Y298-D339 VanDerWaalsContact OH-OD2 3.09Å; Y298-W340 AromaticContact CZ-NE1 3.7Å; Y298-W340 VanDerWaalsContact OH-CD1 3.29Å; Y298-W340 PolarHBondContact OH-NE1 3.07Å; Y298-W340 VanDerWaalsContact OH-NE1 3.08Å
299	P	88.7	Confident	88.8	Confident	13 Å²	13	28.2 Å²	28.2	8%	0.084	18%	0.175	C	C	.	.			trans	-83.6	155.4	-175.9	31.3	-28.6	0	0	0	112.8	I293 V302 L398 F401	I293-P299 HydrophobicContact CD1-CB 4.34Å; I293-P299 HydrophobicContact CG1-CB 4.23Å; P299-V302 HydrophobicContact CG-CG2 4.13Å; P299-L398 HydrophobicContact CG-CD2 4.32Å; P299-F401 HydrophobicContact CB-CD1 3.32Å; P299-F401 HydrophobicContact CB-CE1 3.23Å; P299-F401 HydrophobicContact CB-CG 4.31Å; P299-F401 HydrophobicContact CB-CZ 4.12Å; P299-F401 HydrophobicContact CG-CD1 3.47Å; P299-F401 VanDerWaalsContact CG-CD1 3.47Å; P299-F401 HydrophobicContact CG-CD2 4.45Å; P299-F401 HydrophobicContact CG-CE1 3.58Å; P299-F401 HydrophobicContact CG-CE2 4.48Å; P299-F401 HydrophobicContact CG-CG 3.99Å; P299-F401 HydrophobicContact CG-CZ 4.11Å
300	P	89.4	Confident	87.9	Confident	12 Å²	12	28.3 Å²	28.3	8%	0.078	18%	0.177	C	C	.	.	S	Bend	trans	-72.3	-29.1	-177.2	24	-30.3	0	0	0	114.2	V289 Y292 Y333 L355	V289-P300 HydrophobicContact CG1-CG 4.29Å; V289-P300 HydrophobicContact CG2-CG 4.23Å; Y292-P300 HydrophobicContact CD1-CB 3.86Å; Y292-P300 HydrophobicContact CD1-CG 4.21Å; Y292-P300 HydrophobicContact CD2-CB 3.69Å; Y292-P300 HydrophobicContact CD2-CG 4.44Å; Y292-P300 HydrophobicContact CE1-CB 4.09Å; Y292-P300 HydrophobicContact CE2-CB 3.9Å; Y292-P300 HydrophobicContact CG-CB 3.68Å; Y292-P300 HydrophobicContact CG-CG 4.02Å; P300-Y333 HydrophobicContact CB-CG 4.36Å; P300-Y333 WeakPolarHBondContact O-CB 3.47Å; P300-L355 HydrophobicContact CB-CD1 4.03Å; P300-L355 HydrophobicContact CG-CD1 4.07Å
301	F	86.9	Confident	87.1	Confident	1 Å²	1	29.6 Å²	29.6	0%	0.004	18%	0.181	C	C	.	.			trans	-110.6	142.4	177.8	-52.3	-74.7	0	0	0	107.3	W285 V289 L324 I328 Y333 L355 F401	W285-F301 HydrophobicContact CH2-CE2 4.23Å; W285-F301 AromaticContact CH2-CZ 3.75Å; W285-F301 HydrophobicContact CH2-CZ 3.75Å; W285-F301 HydrophobicContact CZ2-CE1 4.48Å; W285-F301 AromaticContact CZ2-CE2 3.48Å; W285-F301 HydrophobicContact CZ2-CE2 3.48Å; W285-F301 VanDerWaalsContact CZ2-CE2 3.48Å; W285-F301 AromaticContact CZ2-CZ 3.46Å; W285-F301 HydrophobicContact CZ2-CZ 3.46Å; W285-F301 VanDerWaalsContact CZ2-CZ 3.46Å; V289-F301 HydrophobicContact CG2-CE2 4.42Å; F301-L324 HydrophobicContact CB-CD1 3.79Å; F301-I328 HydrophobicContact CB-CG1 3.88Å; F301-I328 HydrophobicContact CD1-CG1 4.2Å; F301-I328 HydrophobicContact CD2-CG1 3.94Å; F301-I328 HydrophobicContact CG-CG1 3.72Å; F301-Y333 HydrophobicContact CE1-CD1 4.14Å; F301-Y333 HydrophobicContact CE1-CG 4.47Å; F301-Y333 HydrophobicContact CZ-CD1 4.07Å; F301-L355 HydrophobicContact CE2-CD1 4.38Å; F301-L355 HydrophobicContact CE2-CD2 4.42Å; F301-L355 HydrophobicContact CZ-CD1 4.44Å; F301-F401 HydrophobicContact CB-CZ 4.42Å; F301-F401 VanDerWaalsContact O-CE1 3.32Å; F301-F401 WeakPolarHBondContact O-CE1 3.4Å; F301-F401 WeakPolarHBondContact O-CZ 3.44Å
302	V	78.9	Confident	85.7	Confident	71 Å²	71	34.9 Å²	34.9	43%	0.43	21%	0.21	S	C	.	.			trans	-149.5	136.3	175.1	-169.7	0	0	0	0	108.5	P299	P299-V302 HydrophobicContact CG-CG2 4.13Å
303	G	78.9	Confident	84.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.233	C	C	.	.			trans	-93	125.3	170.7	0	0	0	0	0	111.6	C320	G303-C320 WeakPolarHBondContact CA-O 3.28Å; G303-C320 WeakPolarHBondContact O-CB 3.37Å; G303-C320 PolarHBondContact O-SG 2.73Å
304	H	81.6	Confident	83.2	Confident	102 Å²	102	43 Å²	43	47%	0.472	26%	0.255	S	S	.	.			trans	-128	114.1	178.4	-167.8	73.7	0	0	0	112.3	G306 K323	H304-G306 VanDerWaalsContact C-N 3.29Å; H304-G306 PolarHBondContact CD2-N 2.93Å; H304-G306 VanDerWaalsContact NE2-CA 3.33Å; H304-G306 WeakPolarHBondContact NE2-CA 3.18Å; H304-G306 PolarHBondContact NE2-N 3.25Å; H304-G306 PolarHBondContact O-N 3.13Å; H304-K323 WeakPolarHBondContact O-CD 3.46Å; H304-K323 WeakPolarHBondContact O-CE 3.49Å; H304-K323 PolarHBondContact O-NZ 3.04Å
305	C	84.4	Confident	82.3	Confident	34 Å²	34	47.5 Å²	47.5	23%	0.23	28%	0.275	C	S	.	.			trans	-77.5	-10.7	179.7	70.2	0	0	0	0	114.1	C309 V319 C320	C305-C309 PolarHBondContact SG-SG 2.64Å; C305-V319 HydrophobicContact CB-CB 3.81Å; C305-V319 HydrophobicContact CB-CG1 3.54Å; C305-C320 PolarHBondContact N-SG 3.34Å; C305-C320 VanDerWaalsContact SG-SG 3.66Å
306	G	84.9	Confident	81.3	Confident	61 Å²	61	53.5 Å²	53.5	63%	0.629	31%	0.312	S	S	*	.	S	Bend	trans	90.1	4.1	-177.9	0	0	0	0	0	114.5	H304	H304-G306 VanDerWaalsContact C-N 3.29Å; H304-G306 PolarHBondContact CD2-N 2.93Å; H304-G306 VanDerWaalsContact NE2-CA 3.33Å; H304-G306 WeakPolarHBondContact NE2-CA 3.18Å; H304-G306 PolarHBondContact NE2-N 3.25Å; H304-G306 PolarHBondContact O-N 3.13Å
307	A	85.6	Confident	80.6	Confident	60 Å²	60	54.1 Å²	54.1	50%	0.496	32%	0.316	S	S	.	.	S	Bend	trans	-131.5	157.9	179.8	0	0	0	0	0	111.1	C309	A307-C309 PolarHBondContact O-N 3.25Å
308	D	84.4	Confident	80.1	Confident	138 Å²	138	63.7 Å²	63.7	74%	0.738	35%	0.352	S	S	*	.			trans	-74.2	79.9	169.9	-176	8.5	0	0	0	109.8	R313	D308-R313 IonicContact OD1-CZ 2.98Å; D308-R313 IonicContact OD1-NH1 3.88Å; D308-R313 PolarHBondContact OD1-NH1 3.06Å; D308-R313 IonicContact OD1-NH2 3.65Å; D308-R313 IonicContact OD2-NH1 2.65Å
309	C	82	Confident	80	Confident	40 Å²	40	65.1 Å²	65.1	27%	0.27	37%	0.366	S	S	.	.			trans	-96.7	4.6	-177.7	62.3	0	0	0	0	113.4	C305 A307 W311 C317	C305-C309 PolarHBondContact SG-SG 2.64Å; A307-C309 PolarHBondContact O-N 3.25Å; C309-W311 PolarHBondContact O-N 2.7Å; C309-W311 VanDerWaalsContact SG-CB 3.57Å; C309-C317 HydrophobicContact CB-CB 4.26Å; C309-C317 VanDerWaalsContact SG-SG 3.65Å
310	G	76	Confident	79.5	Confident	3 Å²	3	64.6 Å²	64.6	3%	0.031	36%	0.362	C	S	.	.	S	Bend	trans	73.8	2.3	-177.1	0	0	0	0	0	116.4	D312 R313 G314 E315	G310-D312 VanDerWaalsContact C-N 3.27Å; G310-D312 PolarHBondContact O-N 3.36Å; G310-R313 CarbonylContact O-C 3.59Å; G310-R313 WeakPolarHBondContact O-CA 2.93Å; G310-R313 WeakPolarHBondContact O-CB 3.43Å; G310-R313 PolarHBondContact O-N 3.12Å; G310-G314 PolarHBondContact O-N 3.17Å; G310-E315 VanDerWaalsContact O-CB 3.29Å; G310-E315 WeakPolarHBondContact O-CB 3.35Å; G310-E315 PolarHBondContact O-N 3.31Å
311	W	76.6	Confident	79	Confident	27 Å²	27	67.8 Å²	67.8	10%	0.102	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-52.7	-44.1	176.9	-179	-100	0	0	0	112.9	C309 R313 G314 E315 C317 C320 Q321 L324	C309-W311 PolarHBondContact O-N 2.7Å; C309-W311 VanDerWaalsContact SG-CB 3.57Å; W311-R313 PolarHBondContact O-N 2.96Å; W311-R313 VanDerWaalsContact O-N 3.12Å; W311-G314 PolarHBondContact O-N 3.39Å; W311-G314 VanDerWaalsContact O-N 3.09Å; W311-E315 WeakPolarHBondContact CA-O 3.37Å; W311-C317 HydrophobicContact CB-CB 4.18Å; W311-C317 HydrophobicContact CD2-CB 4.41Å; W311-C317 HydrophobicContact CE3-CB 3.73Å; W311-C317 WeakPolarHBondContact CZ3-O 3.45Å; W311-C320 HydrophobicContact CB-CB 3.97Å; W311-C320 HydrophobicContact CD2-CB 3.29Å; W311-C320 HydrophobicContact CE3-CB 3.74Å; W311-C320 HydrophobicContact CG-CB 3.39Å; W311-C320 HydrophobicContact CZ2-CB 4.31Å; W311-C320 HydrophobicContact CZ3-CB 4.4Å; W311-Q321 HydrophobicContact CH2-CB 3.72Å; W311-Q321 HydrophobicContact CH2-CG 4.21Å; W311-Q321 HydrophobicContact CZ3-CB 4Å; W311-L324 HydrophobicContact CZ2-CD2 4.14Å
312	D	67.9	Low	78.6	Confident	112 Å²	112	72.4 Å²	72.4	60%	0.599	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-69.7	-7.7	179.1	-56	-41	0	0	0	113.4	G310	G310-D312 VanDerWaalsContact C-N 3.27Å; G310-D312 PolarHBondContact O-N 3.36Å
313	R	71.3	Confident	78.6	Confident	131 Å²	131	73 Å²	73	49%	0.494	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-107.2	13.2	175.4	-57	-173.8	-64.5	-91	2.1	112.7	D308 G310 W311 E315	D308-R313 IonicContact OD1-CZ 2.98Å; D308-R313 IonicContact OD1-NH1 3.88Å; D308-R313 PolarHBondContact OD1-NH1 3.06Å; D308-R313 IonicContact OD1-NH2 3.65Å; D308-R313 IonicContact OD2-NH1 2.65Å; G310-R313 CarbonylContact O-C 3.59Å; G310-R313 WeakPolarHBondContact O-CA 2.93Å; G310-R313 WeakPolarHBondContact O-CB 3.43Å; G310-R313 PolarHBondContact O-N 3.12Å; W311-R313 PolarHBondContact O-N 2.96Å; W311-R313 VanDerWaalsContact O-N 3.12Å; R313-E315 IonicContact CZ-OE1 3.69Å; R313-E315 IonicContact NE-OE1 2.8Å; R313-E315 PolarHBondContact NE-OE1 3.42Å; R313-E315 VanDerWaalsContact NE-OE1 3.11Å; R313-E315 IonicContact NH2-OE1 3.89Å; R313-E315 PolarHBondContact NH2-OE1 3.14Å
314	G	67.1	Low	78.7	Confident	45 Å²	45	73.1 Å²	73.1	46%	0.464	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	11.2	-178.3	0	0	0	0	0	114.7	G310 W311 D397	G310-G314 PolarHBondContact O-N 3.17Å; W311-G314 PolarHBondContact O-N 3.39Å; W311-G314 VanDerWaalsContact O-N 3.09Å; G314-D397 WeakPolarHBondContact CA-OD1 3.4Å
315	E	75.4	Confident	78.5	Confident	94 Å²	94	71.4 Å²	71.4	44%	0.439	39%	0.389	S	S	.	.			trans	-79.7	148	174.2	-55.6	174.7	-140.3	0	0	111.1	G310 W311 R313 C317	G310-E315 VanDerWaalsContact O-CB 3.29Å; G310-E315 WeakPolarHBondContact O-CB 3.35Å; G310-E315 PolarHBondContact O-N 3.31Å; W311-E315 WeakPolarHBondContact CA-O 3.37Å; R313-E315 IonicContact CZ-OE1 3.69Å; R313-E315 IonicContact NE-OE1 2.8Å; R313-E315 PolarHBondContact NE-OE1 3.42Å; R313-E315 VanDerWaalsContact NE-OE1 3.11Å; R313-E315 IonicContact NH2-OE1 3.89Å; R313-E315 PolarHBondContact NH2-OE1 3.14Å; E315-C317 PolarHBondContact O-N 3.14Å
316	V	75.3	Confident	78.2	Confident	128 Å²	128	74.7 Å²	74.7	78%	0.776	40%	0.402	S	S	*	.			trans	-76.6	119.3	-177.7	-178.6	0	0	0	0	110.8
317	C	78.1	Confident	78	Confident	17 Å²	17	73 Å²	73	12%	0.115	38%	0.38	C	S	.	.			trans	-129.6	109.9	172.4	178.3	0	0	0	0	110.5	C309 W311 E315 V319 C320 Q321	C309-C317 HydrophobicContact CB-CB 4.26Å; C309-C317 VanDerWaalsContact SG-SG 3.65Å; W311-C317 HydrophobicContact CB-CB 4.18Å; W311-C317 HydrophobicContact CD2-CB 4.41Å; W311-C317 HydrophobicContact CE3-CB 3.73Å; W311-C317 WeakPolarHBondContact CZ3-O 3.45Å; E315-C317 PolarHBondContact O-N 3.14Å; C317-V319 VanDerWaalsContact C-N 3.25Å; C317-V319 PolarHBondContact O-N 2.81Å; C317-C320 HydrophobicContact CB-CB 4Å; C317-C320 PolarHBondContact O-N 3.5Å; C317-C320 VanDerWaalsContact SG-SG 3.66Å; C317-Q321 WeakPolarHBondContact O-CB 3.48Å; C317-Q321 PolarHBondContact O-N 3.25Å
318	R	80.9	Confident	77.8	Confident	201 Å²	201	70.3 Å²	70.3	76%	0.758	36%	0.357	S	S	*	.	H	α-helix	trans	-59.6	-34.1	-178.6	-67	-175.4	-178.2	-172.8	-0.2	113.3	N322	R318-N322 WeakPolarHBondContact O-CB 3.14Å; R318-N322 PolarHBondContact O-N 2.97Å; R318-N322 PolarHBondContact O-OD1 3.25Å
319	V	84.7	Confident	77.4	Confident	78 Å²	78	67.5 Å²	67.5	47%	0.473	34%	0.34	S	S	.	.	H	α-helix	trans	-70.6	-43.2	179.4	-177.5	0	0	0	0	110.6	C305 C317 N322 K323	C305-V319 HydrophobicContact CB-CB 3.81Å; C305-V319 HydrophobicContact CB-CG1 3.54Å; C317-V319 VanDerWaalsContact C-N 3.25Å; C317-V319 PolarHBondContact O-N 2.81Å; V319-N322 PolarHBondContact O-N 3.42Å; V319-K323 WeakPolarHBondContact O-CG 3.38Å; V319-K323 PolarHBondContact O-N 3.22Å
320	C	79.9	Confident	77.4	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.007	35%	0.351	C	S	.	.	H	α-helix	trans	-65	-43.9	174.4	-68.1	0	0	0	0	110.9	G303 C305 W311 C317 N322 K323 L324	G303-C320 WeakPolarHBondContact CA-O 3.28Å; G303-C320 WeakPolarHBondContact O-CB 3.37Å; G303-C320 PolarHBondContact O-SG 2.73Å; C305-C320 PolarHBondContact N-SG 3.34Å; C305-C320 VanDerWaalsContact SG-SG 3.66Å; W311-C320 HydrophobicContact CB-CB 3.97Å; W311-C320 HydrophobicContact CD2-CB 3.29Å; W311-C320 HydrophobicContact CE3-CB 3.74Å; W311-C320 HydrophobicContact CG-CB 3.39Å; W311-C320 HydrophobicContact CZ2-CB 4.31Å; W311-C320 HydrophobicContact CZ3-CB 4.4Å; C317-C320 HydrophobicContact CB-CB 4Å; C317-C320 PolarHBondContact O-N 3.5Å; C317-C320 VanDerWaalsContact SG-SG 3.66Å; C320-N322 VanDerWaalsContact C-N 3.35Å; C320-N322 PolarHBondContact O-N 3.11Å; C320-K323 PolarHBondContact O-N 3.49Å; C320-L324 WeakPolarHBondContact O-CB 3.06Å; C320-L324 PolarHBondContact O-N 2.87Å
321	Q	78.1	Confident	77.6	Confident	80 Å²	80	71.3 Å²	71.3	37%	0.374	36%	0.357	S	S	.	.	H	α-helix	trans	-57.6	-44.5	175.9	-170.2	176.5	37.1	0	0	112.6	W311 C317 L324 F325	W311-Q321 HydrophobicContact CH2-CB 3.72Å; W311-Q321 HydrophobicContact CH2-CG 4.21Å; W311-Q321 HydrophobicContact CZ3-CB 4Å; C317-Q321 WeakPolarHBondContact O-CB 3.48Å; C317-Q321 PolarHBondContact O-N 3.25Å; Q321-L324 WeakPolarHBondContact O-CB 3.5Å; Q321-L324 PolarHBondContact O-N 2.78Å; Q321-F325 PolarHBondContact O-N 2.83Å
322	N	77.8	Confident	77.8	Confident	97 Å²	97	76.7 Å²	76.7	52%	0.519	38%	0.381	S	S	.	.	H	α-helix	trans	-66.1	-40.7	176.4	-71.8	-7.5	0	0	0	112.3	R318 V319 C320 L324 F325 E326	R318-N322 WeakPolarHBondContact O-CB 3.14Å; R318-N322 PolarHBondContact O-N 2.97Å; R318-N322 PolarHBondContact O-OD1 3.25Å; V319-N322 PolarHBondContact O-N 3.42Å; C320-N322 VanDerWaalsContact C-N 3.35Å; C320-N322 PolarHBondContact O-N 3.11Å; N322-L324 VanDerWaalsContact C-N 3.31Å; N322-L324 PolarHBondContact O-N 3.18Å; N322-F325 VanDerWaalsContact O-CB 3.28Å; N322-F325 WeakPolarHBondContact O-CB 3.38Å; N322-F325 PolarHBondContact O-N 2.76Å; N322-F325 VanDerWaalsContact O-N 3.17Å; N322-E326 WeakPolarHBondContact O-CG 3.5Å; N322-E326 PolarHBondContact O-N 3.2Å
323	K	80.6	Confident	78.9	Confident	85 Å²	85	73.6 Å²	73.6	37%	0.37	36%	0.362	S	S	.	.	H	α-helix	trans	-67.3	-32.8	175.7	-74.9	-175.1	177	-164.2	0	112.9	H304 V319 C320 F325 E326 S327	H304-K323 WeakPolarHBondContact O-CD 3.46Å; H304-K323 WeakPolarHBondContact O-CE 3.49Å; H304-K323 PolarHBondContact O-NZ 3.04Å; V319-K323 WeakPolarHBondContact O-CG 3.38Å; V319-K323 PolarHBondContact O-N 3.22Å; C320-K323 PolarHBondContact O-N 3.49Å; K323-F325 VanDerWaalsContact C-N 3.32Å; K323-E326 PolarHBondContact O-N 3.43Å; K323-S327 WeakPolarHBondContact O-CB 3.34Å; K323-S327 PolarHBondContact O-N 3.28Å
324	L	79.5	Confident	79.9	Confident	2 Å²	2	74.5 Å²	74.5	1%	0.01	37%	0.371	C	S	.	.	H	α-helix	trans	-61.2	-44.8	170.4	169.5	60	0	0	0	110.3	F301 W311 C320 Q321 N322 S327 I328 F401	F301-L324 HydrophobicContact CB-CD1 3.79Å; W311-L324 HydrophobicContact CZ2-CD2 4.14Å; C320-L324 WeakPolarHBondContact O-CB 3.06Å; C320-L324 PolarHBondContact O-N 2.87Å; Q321-L324 WeakPolarHBondContact O-CB 3.5Å; Q321-L324 PolarHBondContact O-N 2.78Å; N322-L324 VanDerWaalsContact C-N 3.31Å; N322-L324 PolarHBondContact O-N 3.18Å; L324-S327 PolarHBondContact O-N 3.24Å; L324-I328 HydrophobicContact CD1-CD1 3.63Å; L324-I328 HydrophobicContact CD1-CG1 4.09Å; L324-I328 HydrophobicContact CG-CD1 3.9Å; L324-I328 WeakPolarHBondContact O-CG1 3.48Å; L324-I328 PolarHBondContact O-N 3.42Å; L324-F401 HydrophobicContact CD1-CE1 4.48Å; L324-F401 HydrophobicContact CD1-CE2 3.6Å; L324-F401 HydrophobicContact CD1-CZ 3.32Å; L324-F401 HydrophobicContact CD2-CD2 4.28Å; L324-F401 HydrophobicContact CD2-CE2 3.55Å; L324-F401 HydrophobicContact CD2-CZ 3.94Å; L324-F401 HydrophobicContact CG-CE2 4.17Å; L324-F401 HydrophobicContact CG-CZ 4.27Å
325	F	78.1	Confident	81.3	Confident	65 Å²	65	74.9 Å²	74.9	29%	0.285	36%	0.36	S	S	.	.	H	α-helix	trans	-57.9	-50.3	175	-178.8	-122.2	0	0	0	112.4	Q321 N322 K323 S327 I328 Q329 L408 L412	Q321-F325 PolarHBondContact O-N 2.83Å; N322-F325 VanDerWaalsContact O-CB 3.28Å; N322-F325 WeakPolarHBondContact O-CB 3.38Å; N322-F325 PolarHBondContact O-N 2.76Å; N322-F325 VanDerWaalsContact O-N 3.17Å; K323-F325 VanDerWaalsContact C-N 3.32Å; F325-S327 VanDerWaalsContact C-N 3.3Å; F325-S327 PolarHBondContact O-N 3.04Å; F325-I328 PolarHBondContact O-N 3.29Å; F325-Q329 HydrophobicContact CD1-CG 4.45Å; F325-Q329 HydrophobicContact CD2-CG 4.14Å; F325-Q329 HydrophobicContact CE1-CG 4.27Å; F325-Q329 HydrophobicContact CE2-CG 4.05Å; F325-Q329 HydrophobicContact CG-CG 4.45Å; F325-Q329 VanDerWaalsContact CZ-CD 3.47Å; F325-Q329 HydrophobicContact CZ-CG 4.12Å; F325-Q329 WeakPolarHBondContact O-CB 3.08Å; F325-Q329 WeakPolarHBondContact O-CG 3.48Å; F325-Q329 PolarHBondContact O-N 2.95Å; F325-L408 HydrophobicContact CB-CD2 3.75Å; F325-L408 HydrophobicContact CD2-CD1 3.34Å; F325-L408 HydrophobicContact CD2-CD2 3.41Å; F325-L408 VanDerWaalsContact CD2-CD2 3.41Å; F325-L408 HydrophobicContact CD2-CG 3.41Å; F325-L408 VanDerWaalsContact CD2-CG 3.41Å; F325-L408 HydrophobicContact CE2-CD1 3.53Å; F325-L408 HydrophobicContact CE2-CD2 4.38Å; F325-L408 HydrophobicContact CE2-CG 3.91Å; F325-L408 HydrophobicContact CG-CD1 4.33Å; F325-L408 HydrophobicContact CG-CD2 4.05Å; F325-L408 HydrophobicContact CG-CG 4.46Å; F325-L412 HydrophobicContact CD2-CD1 4.28Å; F325-L412 HydrophobicContact CE2-CD1 3.86Å; F325-L412 HydrophobicContact CE2-CD2 3.47Å; F325-L412 VanDerWaalsContact CE2-CD2 3.47Å; F325-L412 HydrophobicContact CE2-CG 3.76Å; F325-L412 HydrophobicContact CZ-CD2 3.62Å; F325-L412 HydrophobicContact CZ-CG 4.41Å
326	E	78.5	Confident	82.2	Confident	104 Å²	104	72.6 Å²	72.6	49%	0.486	35%	0.354	S	S	.	.	H	α-helix	trans	-56.9	-44.8	176.4	-70	169.3	-176.1	0	0	111	N322 K323 I328 Q329 E330	N322-E326 WeakPolarHBondContact O-CG 3.5Å; N322-E326 PolarHBondContact O-N 3.2Å; K323-E326 PolarHBondContact O-N 3.43Å; E326-I328 PolarHBondContact O-N 2.82Å; E326-Q329 PolarHBondContact O-N 2.98Å; E326-E330 WeakPolarHBondContact O-CB 3.33Å; E326-E330 VanDerWaalsContact O-CG 3.31Å; E326-E330 WeakPolarHBondContact O-CG 3.47Å; E326-E330 PolarHBondContact O-N 3.04Å
327	S	80.9	Confident	83.1	Confident	25 Å²	25	72.6 Å²	72.6	18%	0.175	35%	0.35	C	S	.	.	H	α-helix	trans	-61.5	-41.6	178.5	179.1	0	0	0	0	112.9	K323 L324 F325 G331 K332	K323-S327 WeakPolarHBondContact O-CB 3.34Å; K323-S327 PolarHBondContact O-N 3.28Å; L324-S327 PolarHBondContact O-N 3.24Å; F325-S327 VanDerWaalsContact C-N 3.3Å; F325-S327 PolarHBondContact O-N 3.04Å; S327-G331 PolarHBondContact O-N 2.82Å; S327-G331 VanDerWaalsContact O-N 3.14Å; S327-K332 PolarHBondContact O-N 2.56Å
328	I	80.3	Confident	83.7	Confident	3 Å²	3	80.8 Å²	80.8	2%	0.015	38%	0.383	C	S	.	.	H	α-helix	trans	-68.4	-45	176.5	-70.3	165.2	0	0	0	110.7	W285 F301 L324 F325 E326 E330 G331 A405 L408 N409 L412	W285-I328 HydrophobicContact CZ2-CG2 4.25Å; F301-I328 HydrophobicContact CB-CG1 3.88Å; F301-I328 HydrophobicContact CD1-CG1 4.2Å; F301-I328 HydrophobicContact CD2-CG1 3.94Å; F301-I328 HydrophobicContact CG-CG1 3.72Å; L324-I328 HydrophobicContact CD1-CD1 3.63Å; L324-I328 HydrophobicContact CD1-CG1 4.09Å; L324-I328 HydrophobicContact CG-CD1 3.9Å; L324-I328 WeakPolarHBondContact O-CG1 3.48Å; L324-I328 PolarHBondContact O-N 3.42Å; F325-I328 PolarHBondContact O-N 3.29Å; E326-I328 PolarHBondContact O-N 2.82Å; I328-E330 PolarHBondContact O-N 3Å; I328-G331 WeakPolarHBondContact O-CA 3.4Å; I328-G331 PolarHBondContact O-N 2.98Å; I328-A405 HydrophobicContact CD1-CB 3.68Å; I328-L408 HydrophobicContact CD1-CD2 3.87Å; I328-N409 HydrophobicContact CG2-CB 4.26Å; I328-L412 HydrophobicContact CG2-CD1 4.13Å
329	Q	77.4	Confident	84.1	Confident	79 Å²	79	73.2 Å²	73.2	37%	0.369	36%	0.358	S	S	.	.	H	α-helix	trans	-62.3	-41.2	177.8	-77	-172.4	-41.4	0	0	112.6	F325 E326 G331 R357 L412	F325-Q329 HydrophobicContact CD1-CG 4.45Å; F325-Q329 HydrophobicContact CD2-CG 4.14Å; F325-Q329 HydrophobicContact CE1-CG 4.27Å; F325-Q329 HydrophobicContact CE2-CG 4.05Å; F325-Q329 HydrophobicContact CG-CG 4.45Å; F325-Q329 VanDerWaalsContact CZ-CD 3.47Å; F325-Q329 HydrophobicContact CZ-CG 4.12Å; F325-Q329 WeakPolarHBondContact O-CB 3.08Å; F325-Q329 WeakPolarHBondContact O-CG 3.48Å; F325-Q329 PolarHBondContact O-N 2.95Å; E326-Q329 PolarHBondContact O-N 2.98Å; Q329-G331 PolarHBondContact O-N 3.37Å; Q329-R357 WeakPolarHBondContact O-CD 3.34Å; Q329-L412 HydrophobicContact CG-CD1 3.49Å; Q329-L412 VanDerWaalsContact CG-CD1 3.49Å; Q329-L412 HydrophobicContact CG-CD2 3.78Å; Q329-L412 HydrophobicContact CG-CG 4.29Å; Q329-L412 VanDerWaalsContact NE2-CD2 3.27Å
330	E	80.4	Confident	84.7	Confident	107 Å²	107	69.5 Å²	69.5	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-67.6	-22.1	174.6	-73.1	-171.8	-170.8	0	0	112	E326 I328 K332	E326-E330 WeakPolarHBondContact O-CB 3.33Å; E326-E330 VanDerWaalsContact O-CG 3.31Å; E326-E330 WeakPolarHBondContact O-CG 3.47Å; E326-E330 PolarHBondContact O-N 3.04Å; I328-E330 PolarHBondContact O-N 3Å; E330-K332 HydrophobicContact CB-CB 4.43Å; E330-K332 HydrophobicContact CB-CD 4.37Å; E330-K332 HydrophobicContact CB-CG 4.13Å; E330-K332 PolarHBondContact O-N 3.37Å; E330-K332 WeakPolarHBondContact OE2-CD 3.42Å; E330-K332 WeakPolarHBondContact OE2-CE 3.22Å; E330-K332 IonicContact OE2-NZ 3.42Å; E330-K332 PolarHBondContact OE2-NZ 3.44Å
331	G	80.3	Confident	85.4	Confident	17 Å²	17	72.9 Å²	72.9	18%	0.175	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	19.5	-176.7	0	0	0	0	0	112.9	S327 I328 Q329	S327-G331 PolarHBondContact O-N 2.82Å; S327-G331 VanDerWaalsContact O-N 3.14Å; I328-G331 WeakPolarHBondContact O-CA 3.4Å; I328-G331 PolarHBondContact O-N 2.98Å; Q329-G331 PolarHBondContact O-N 3.37Å
332	K	82.3	Confident	86.1	Confident	139 Å²	139	71.6 Å²	71.6	60%	0.604	36%	0.357	S	S	*	.			trans	-92.4	120.7	-178.9	-68.4	-177.9	-162.9	148.7	0	109.8	S327 E330	S327-K332 PolarHBondContact O-N 2.56Å; E330-K332 HydrophobicContact CB-CB 4.43Å; E330-K332 HydrophobicContact CB-CD 4.37Å; E330-K332 HydrophobicContact CB-CG 4.13Å; E330-K332 PolarHBondContact O-N 3.37Å; E330-K332 WeakPolarHBondContact OE2-CD 3.42Å; E330-K332 WeakPolarHBondContact OE2-CE 3.22Å; E330-K332 IonicContact OE2-NZ 3.42Å; E330-K332 PolarHBondContact OE2-NZ 3.44Å
333	Y	90.7	Very high	87	Confident	48 Å²	48	67.3 Å²	67.3	19%	0.188	33%	0.334	C	S	.	.			trans	-139.3	160.8	170.3	66.1	-85.7	0	0	0	108	Y292 P300 F301 F335 I351 S352 L355	Y292-Y333 HydrophobicContact CE2-CD2 4.13Å; P300-Y333 HydrophobicContact CB-CG 4.36Å; P300-Y333 WeakPolarHBondContact O-CB 3.47Å; F301-Y333 HydrophobicContact CE1-CD1 4.14Å; F301-Y333 HydrophobicContact CE1-CG 4.47Å; F301-Y333 HydrophobicContact CZ-CD1 4.07Å; Y333-F335 HydrophobicContact CD2-CZ 4.47Å; Y333-F335 HydrophobicContact CE2-CE1 4.01Å; Y333-F335 AromaticContact CE2-CE2 3.87Å; Y333-F335 HydrophobicContact CE2-CE2 3.87Å; Y333-F335 AromaticContact CE2-CZ 3.58Å; Y333-F335 HydrophobicContact CE2-CZ 3.58Å; Y333-I351 HydrophobicContact CE2-CG2 4.1Å; Y333-S352 WeakPolarHBondContact OH-CA 3.5Å; Y333-S352 WeakPolarHBondContact OH-CB 3.36Å; Y333-L355 HydrophobicContact CD1-CB 4.22Å; Y333-L355 HydrophobicContact CD1-CD1 4.11Å; Y333-L355 HydrophobicContact CD2-CD1 4.41Å; Y333-L355 HydrophobicContact CE1-CB 3.63Å; Y333-L355 HydrophobicContact CE1-CD1 4.07Å; Y333-L355 HydrophobicContact CE2-CD1 4.38Å; Y333-L355 HydrophobicContact CG-CD1 4.3Å
334	E	92.8	Very high	87.8	Confident	149 Å²	149	64.1 Å²	64.1	70%	0.696	32%	0.323	S	S	*	.			trans	-122.3	164.8	-177.6	-64.3	-171.7	169	0	0	111.6	Y292 P336	Y292-E334 WeakPolarHBondContact CE2-O 3.04Å; Y292-E334 PolarHBondContact OH-O 2.89Å; E334-P336 VanDerWaalsContact C-CD 3.49Å; E334-P336 WeakPolarHBondContact O-CD 3.27Å
335	F	96.3	Very high	88.6	Confident	53 Å²	53	67.9 Å²	67.9	23%	0.232	35%	0.349	C	S	.	.			trans	-115.5	80.3	168	-64	-59.9	0	0	0	109.1	Y292 Y333 D337 W340 K348 I351	Y292-F335 HydrophobicContact CD2-CD1 4.43Å; Y292-F335 AromaticContact CD2-CE1 3.96Å; Y292-F335 HydrophobicContact CD2-CE1 3.96Å; Y292-F335 AromaticContact CE2-CD1 3.78Å; Y292-F335 HydrophobicContact CE2-CD1 3.78Å; Y292-F335 AromaticContact CE2-CE1 3.74Å; Y292-F335 HydrophobicContact CE2-CE1 3.74Å; Y333-F335 HydrophobicContact CD2-CZ 4.47Å; Y333-F335 HydrophobicContact CE2-CE1 4.01Å; Y333-F335 AromaticContact CE2-CE2 3.87Å; Y333-F335 HydrophobicContact CE2-CE2 3.87Å; Y333-F335 AromaticContact CE2-CZ 3.58Å; Y333-F335 HydrophobicContact CE2-CZ 3.58Å; F335-D337 PolarHBondContact O-N 2.93Å; F335-W340 HydrophobicContact CB-CB 3.82Å; F335-W340 HydrophobicContact CB-CD2 4.11Å; F335-W340 HydrophobicContact CB-CG 3.8Å; F335-W340 AromaticContact CD1-CD2 3.49Å; F335-W340 HydrophobicContact CD1-CD2 3.49Å; F335-W340 VanDerWaalsContact CD1-CD2 3.49Å; F335-W340 AromaticContact CD1-CE2 3.74Å; F335-W340 AromaticContact CD1-CE3 3.45Å; F335-W340 HydrophobicContact CD1-CE3 3.45Å; F335-W340 VanDerWaalsContact CD1-CE3 3.45Å; F335-W340 HydrophobicContact CD1-CG 4.1Å; F335-W340 AromaticContact CD1-CH2 3.96Å; F335-W340 HydrophobicContact CD1-CH2 3.96Å; F335-W340 AromaticContact CD1-CZ2 3.97Å; F335-W340 HydrophobicContact CD1-CZ2 3.97Å; F335-W340 AromaticContact CD1-CZ3 3.7Å; F335-W340 HydrophobicContact CD1-CZ3 3.7Å; F335-W340 HydrophobicContact CE1-CD2 4.32Å; F335-W340 AromaticContact CE1-CE3 3.92Å; F335-W340 HydrophobicContact CE1-CE3 3.92Å; F335-W340 AromaticContact CE1-CH2 3.85Å; F335-W340 HydrophobicContact CE1-CH2 3.85Å; F335-W340 HydrophobicContact CE1-CZ2 4.23Å; F335-W340 AromaticContact CE1-CZ3 3.68Å; F335-W340 HydrophobicContact CE1-CZ3 3.68Å; F335-W340 HydrophobicContact CG-CD2 4.22Å; F335-W340 HydrophobicContact CG-CE3 4.26Å; F335-W340 HydrophobicContact CG-CG 4.43Å; F335-K348 HydrophobicContact CD1-CG 4.36Å; F335-K348 HydrophobicContact CD2-CB 4.33Å; F335-K348 HydrophobicContact CD2-CD 4.26Å; F335-K348 HydrophobicContact CD2-CG 4.21Å; F335-K348 HydrophobicContact CE1-CG 4.28Å; F335-K348 HydrophobicContact CE2-CB 3.85Å; F335-K348 HydrophobicContact CE2-CG 4.14Å; F335-K348 HydrophobicContact CG-CD 4.37Å; F335-K348 HydrophobicContact CG-CG 4.3Å; F335-K348 HydrophobicContact CZ-CB 3.94Å; F335-K348 HydrophobicContact CZ-CG 4.15Å; F335-I351 HydrophobicContact CE1-CB 4.37Å; F335-I351 HydrophobicContact CE1-CD1 4.07Å; F335-I351 HydrophobicContact CE1-CG2 3.98Å; F335-I351 HydrophobicContact CZ-CB 4.03Å; F335-I351 HydrophobicContact CZ-CG2 3.78Å
336	P	93.9	Very high	89.6	Confident	47 Å²	47	68.4 Å²	68.4	31%	0.305	35%	0.352	S	S	.	.			trans	-54.1	123.4	-175.8	-27.7	34.3	0	0	0	112.4	Y298 E334 K338 D339 W340	Y298-P336 WeakPolarHBondContact OH-CD 3.17Å; E334-P336 VanDerWaalsContact C-CD 3.49Å; E334-P336 WeakPolarHBondContact O-CD 3.27Å; P336-K338 PolarHBondContact O-N 3.37Å; P336-D339 PolarHBondContact O-N 3.37Å; P336-W340 WeakPolarHBondContact O-CB 3.41Å; P336-W340 PolarHBondContact O-N 3.13Å
337	D	92.9	Very high	90.5	Very high	128 Å²	128	63.4 Å²	63.4	68%	0.684	33%	0.329	S	S	*	.	H	α-helix	trans	-54.2	-32.9	-174.5	-79.6	-27.4	0	0	0	113.2	F335 D339 A341	F335-D337 PolarHBondContact O-N 2.93Å; D337-D339 PolarHBondContact O-N 3.43Å; D337-A341 HydrophobicContact CB-CB 4.47Å; D337-A341 WeakPolarHBondContact O-CB 3.49Å; D337-A341 PolarHBondContact O-N 3.12Å
338	K	91.4	Very high	91.4	Very high	188 Å²	188	64.5 Å²	64.5	82%	0.817	33%	0.33	S	S	*	.	H	α-helix	trans	-50.9	-41.9	176.1	-176.9	-173	171.8	-166.6	0	112.6	P336	P336-K338 PolarHBondContact O-N 3.37Å
339	D	90.3	Very high	92.2	Very high	43 Å²	43	67.1 Å²	67.1	23%	0.23	34%	0.344	C	S	.	.	H	α-helix	trans	-110.7	-21.8	-175	-48.3	-55.6	0	0	0	112	Y298 P336 D337 H342	Y298-D339 HydrophobicContact CE1-CB 4.1Å; Y298-D339 WeakPolarHBondContact CE1-OD2 3.39Å; Y298-D339 PolarHBondContact OH-OD2 3.29Å; Y298-D339 VanDerWaalsContact OH-OD2 3.09Å; P336-D339 PolarHBondContact O-N 3.37Å; D337-D339 PolarHBondContact O-N 3.43Å; D339-H342 PolarHBondContact O-CE1 3.15Å; D339-H342 PolarHBondContact O-ND1 2.91Å; D339-H342 VanDerWaalsContact O-ND1 3.08Å
340	W	96	Very high	93.2	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-109.9	-10.8	-172.5	-71.2	85.8	0	0	0	114.7	Y292 L295 Y298 F335 P336 H342 I343 K348 I351	Y292-W340 AromaticContact CD1-CZ2 3.88Å; Y292-W340 HydrophobicContact CD1-CZ2 3.88Å; Y292-W340 AromaticContact CD2-CH2 3.78Å; Y292-W340 HydrophobicContact CD2-CH2 3.78Å; Y292-W340 AromaticContact CD2-CZ2 3.56Å; Y292-W340 HydrophobicContact CD2-CZ2 3.56Å; Y292-W340 AromaticContact CE1-CZ2 3.69Å; Y292-W340 HydrophobicContact CE1-CZ2 3.69Å; Y292-W340 AromaticContact CE2-CE2 3.95Å; Y292-W340 AromaticContact CE2-CH2 3.99Å; Y292-W340 HydrophobicContact CE2-CH2 3.99Å; Y292-W340 AromaticContact CE2-CZ2 3.38Å; Y292-W340 HydrophobicContact CE2-CZ2 3.38Å; Y292-W340 HydrophobicContact CG-CH2 4.1Å; Y292-W340 AromaticContact CG-CZ2 3.81Å; Y292-W340 HydrophobicContact CG-CZ2 3.81Å; Y292-W340 AromaticContact CZ-CE2 3.8Å; Y292-W340 AromaticContact CZ-CZ2 3.44Å; Y292-W340 VanDerWaalsContact CZ-CZ2 3.44Å; Y292-W340 AromaticContact CZ-NE1 3.78Å; Y292-W340 PolarHBondContact OH-NE1 2.86Å; L295-W340 HydrophobicContact CB-CH2 3.89Å; L295-W340 HydrophobicContact CB-CZ3 4.21Å; L295-W340 HydrophobicContact CD1-CH2 4.29Å; L295-W340 HydrophobicContact CD1-CZ3 4.1Å; Y298-W340 AromaticContact CZ-NE1 3.7Å; Y298-W340 VanDerWaalsContact OH-CD1 3.29Å; Y298-W340 PolarHBondContact OH-NE1 3.07Å; Y298-W340 VanDerWaalsContact OH-NE1 3.08Å; F335-W340 HydrophobicContact CB-CB 3.82Å; F335-W340 HydrophobicContact CB-CD2 4.11Å; F335-W340 HydrophobicContact CB-CG 3.8Å; F335-W340 AromaticContact CD1-CD2 3.49Å; F335-W340 HydrophobicContact CD1-CD2 3.49Å; F335-W340 VanDerWaalsContact CD1-CD2 3.49Å; F335-W340 AromaticContact CD1-CE2 3.74Å; F335-W340 AromaticContact CD1-CE3 3.45Å; F335-W340 HydrophobicContact CD1-CE3 3.45Å; F335-W340 VanDerWaalsContact CD1-CE3 3.45Å; F335-W340 HydrophobicContact CD1-CG 4.1Å; F335-W340 AromaticContact CD1-CH2 3.96Å; F335-W340 HydrophobicContact CD1-CH2 3.96Å; F335-W340 AromaticContact CD1-CZ2 3.97Å; F335-W340 HydrophobicContact CD1-CZ2 3.97Å; F335-W340 AromaticContact CD1-CZ3 3.7Å; F335-W340 HydrophobicContact CD1-CZ3 3.7Å; F335-W340 HydrophobicContact CE1-CD2 4.32Å; F335-W340 AromaticContact CE1-CE3 3.92Å; F335-W340 HydrophobicContact CE1-CE3 3.92Å; F335-W340 AromaticContact CE1-CH2 3.85Å; F335-W340 HydrophobicContact CE1-CH2 3.85Å; F335-W340 HydrophobicContact CE1-CZ2 4.23Å; F335-W340 AromaticContact CE1-CZ3 3.68Å; F335-W340 HydrophobicContact CE1-CZ3 3.68Å; F335-W340 HydrophobicContact CG-CD2 4.22Å; F335-W340 HydrophobicContact CG-CE3 4.26Å; F335-W340 HydrophobicContact CG-CG 4.43Å; P336-W340 WeakPolarHBondContact O-CB 3.41Å; P336-W340 PolarHBondContact O-N 3.13Å; W340-H342 PolarHBondContact O-N 3.36Å; W340-H342 VanDerWaalsContact O-N 3.1Å; W340-I343 HydrophobicContact CD2-CD1 3.67Å; W340-I343 HydrophobicContact CE3-CB 3.98Å; W340-I343 HydrophobicContact CE3-CD1 3.39Å; W340-I343 HydrophobicContact CE3-CG1 4.26Å; W340-I343 HydrophobicContact CE3-CG2 3.85Å; W340-I343 HydrophobicContact CG-CD1 4.22Å; W340-I343 HydrophobicContact CH2-CD1 4.36Å; W340-I343 HydrophobicContact CZ3-CD1 3.78Å; W340-I343 HydrophobicContact CZ3-CG2 3.94Å; W340-I343 PolarHBondContact O-N 3.03Å; W340-I343 VanDerWaalsContact O-N 3.12Å; W340-K348 HydrophobicContact CE3-CG 4.1Å; W340-K348 HydrophobicContact CZ3-CG 4.39Å; W340-K348 WeakPolarHBondContact O-CE 3.48Å; W340-K348 PolarHBondContact O-NZ 2.87Å; W340-I351 HydrophobicContact CH2-CD1 3.53Å; W340-I351 HydrophobicContact CZ3-CD1 3.74Å
341	A	95.1	Very high	94.1	Very high	71 Å²	71	58.2 Å²	58.2	59%	0.587	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.9	178.2	0	0	0	0	0	112.5	D337	D337-A341 HydrophobicContact CB-CB 4.47Å; D337-A341 WeakPolarHBondContact O-CB 3.49Å; D337-A341 PolarHBondContact O-N 3.12Å
342	H	93.1	Very high	94.9	Very high	53 Å²	53	59.7 Å²	59.7	25%	0.245	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-10.1	-178.1	70.8	-91	0	0	0	114.3	D339 W340 K381 P384	D339-H342 PolarHBondContact O-CE1 3.15Å; D339-H342 PolarHBondContact O-ND1 2.91Å; D339-H342 VanDerWaalsContact O-ND1 3.08Å; W340-H342 PolarHBondContact O-N 3.36Å; W340-H342 VanDerWaalsContact O-N 3.1Å; H342-K381 WeakPolarHBondContact O-CD 3.29Å; H342-K381 WeakPolarHBondContact O-CE 3.38Å; H342-K381 PolarHBondContact O-NZ 2.83Å; H342-P384 WeakPolarHBondContact NE2-CD 3.43Å
343	I	96.7	Very high	95.6	Very high	7 Å²	7	56.9 Å²	56.9	4%	0.036	30%	0.298	C	S	.	.	S	Bend	trans	-85.9	140.5	179.5	-66.2	170	0	0	0	109.8	E144 L295 W340 A347 K348 L383	E144-I343 WeakPolarHBondContact OE1-CA 3.49Å; L295-I343 HydrophobicContact CB-CD1 4.11Å; L295-I343 HydrophobicContact CD1-CG2 4.21Å; W340-I343 HydrophobicContact CD2-CD1 3.67Å; W340-I343 HydrophobicContact CE3-CB 3.98Å; W340-I343 HydrophobicContact CE3-CD1 3.39Å; W340-I343 HydrophobicContact CE3-CG1 4.26Å; W340-I343 HydrophobicContact CE3-CG2 3.85Å; W340-I343 HydrophobicContact CG-CD1 4.22Å; W340-I343 HydrophobicContact CH2-CD1 4.36Å; W340-I343 HydrophobicContact CZ3-CD1 3.78Å; W340-I343 HydrophobicContact CZ3-CG2 3.94Å; W340-I343 PolarHBondContact O-N 3.03Å; W340-I343 VanDerWaalsContact O-N 3.12Å; I343-A347 HydrophobicContact CG2-CB 3.78Å; I343-K348 WeakPolarHBondContact O-CE 3.4Å; I343-L383 HydrophobicContact CD1-CD2 4.32Å; I343-L383 HydrophobicContact CG1-CD2 3.93Å
344	S	97.2	Very high	95.9	Very high	19 Å²	19	54.6 Å²	54.6	13%	0.133	29%	0.289	C	S	.	.			trans	-57.3	150.5	-176.7	71.3	0	0	0	0	114.1	E144 E346 A347 K348 W373	E144-S344 PolarHBondContact OE1-N 3.15Å; E144-S344 VanDerWaalsContact OE2-CB 3.31Å; E144-S344 WeakPolarHBondContact OE2-CB 3.42Å; E144-S344 PolarHBondContact OE2-OG 2.8Å; S344-E346 PolarHBondContact O-N 2.69Å; S344-A347 PolarHBondContact O-N 3.25Å; S344-A347 WeakPolarHBondContact OG-CB 3.5Å; S344-A347 PolarHBondContact OG-N 2.96Å; S344-A347 VanDerWaalsContact OG-N 3.14Å; S344-K348 PolarHBondContact O-N 3.48Å; S344-W373 PolarHBondContact OG-NE1 3.03Å
345	S	97.2	Very high	96	Very high	80 Å²	80	47.8 Å²	47.8	56%	0.559	26%	0.258	S	S	*	.	H	α-helix	trans	-61.3	-34.9	172.6	30.8	0	0	0	0	111.9	K348 D349	S345-K348 PolarHBondContact O-N 3.43Å; S345-D349 WeakPolarHBondContact O-CB 3.48Å; S345-D349 PolarHBondContact O-N 3.49Å
346	E	97.9	Very high	95.7	Very high	76 Å²	76	47 Å²	47	36%	0.355	26%	0.257	S	S	.	.	H	α-helix	trans	-69.7	-34.9	-177.8	-65	72.9	-165.8	0	0	111.6	S344 L350 H371 W373	S344-E346 PolarHBondContact O-N 2.69Å; E346-L350 PolarHBondContact O-N 3.17Å; E346-H371 PolarHBondContact O-CE1 3.43Å; E346-H371 VanDerWaalsContact O-CE1 3.31Å; E346-W373 HydrophobicContact CB-CB 3.99Å; E346-W373 HydrophobicContact CB-CG 4.28Å
347	A	98.1	Very high	95.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64.9	-46.6	171.5	0	0	0	0	0	111.4	L295 I343 S344 D349 L350 I351 W373	L295-A347 HydrophobicContact CD1-CB 3.75Å; I343-A347 HydrophobicContact CG2-CB 3.78Å; S344-A347 PolarHBondContact O-N 3.25Å; S344-A347 WeakPolarHBondContact OG-CB 3.5Å; S344-A347 PolarHBondContact OG-N 2.96Å; S344-A347 VanDerWaalsContact OG-N 3.14Å; A347-D349 VanDerWaalsContact C-N 3.34Å; A347-D349 PolarHBondContact O-N 2.91Å; A347-L350 PolarHBondContact O-N 3.36Å; A347-I351 WeakPolarHBondContact O-CG1 3.34Å; A347-I351 PolarHBondContact O-N 3.45Å; A347-W373 HydrophobicContact CB-CD2 4.47Å; A347-W373 HydrophobicContact CB-CZ2 4.19Å
348	K	98.3	Very high	94.9	Very high	47 Å²	47	49.3 Å²	49.3	20%	0.204	26%	0.255	C	S	.	.	H	α-helix	trans	-63.2	-41	178.4	-65	175.2	-171.3	178.7	0	111.5	F335 W340 I343 S344 S345 I351 S352	F335-K348 HydrophobicContact CD1-CG 4.36Å; F335-K348 HydrophobicContact CD2-CB 4.33Å; F335-K348 HydrophobicContact CD2-CD 4.26Å; F335-K348 HydrophobicContact CD2-CG 4.21Å; F335-K348 HydrophobicContact CE1-CG 4.28Å; F335-K348 HydrophobicContact CE2-CB 3.85Å; F335-K348 HydrophobicContact CE2-CG 4.14Å; F335-K348 HydrophobicContact CG-CD 4.37Å; F335-K348 HydrophobicContact CG-CG 4.3Å; F335-K348 HydrophobicContact CZ-CB 3.94Å; F335-K348 HydrophobicContact CZ-CG 4.15Å; W340-K348 HydrophobicContact CE3-CG 4.1Å; W340-K348 HydrophobicContact CZ3-CG 4.39Å; W340-K348 WeakPolarHBondContact O-CE 3.48Å; W340-K348 PolarHBondContact O-NZ 2.87Å; I343-K348 WeakPolarHBondContact O-CE 3.4Å; S344-K348 PolarHBondContact O-N 3.48Å; S345-K348 PolarHBondContact O-N 3.43Å; K348-I351 PolarHBondContact O-N 3.42Å; K348-S352 WeakPolarHBondContact O-CB 3.46Å; K348-S352 PolarHBondContact O-N 3.45Å; K348-S352 PolarHBondContact O-OG 3.49Å
349	D	98.4	Very high	94.6	Very high	58 Å²	58	40.4 Å²	40.4	31%	0.31	22%	0.217	S	C	.	.	H	α-helix	trans	-59.6	-48.6	175.3	-179.6	61.2	0	0	0	111	S345 A347 I351 S352 K353 H371	S345-D349 WeakPolarHBondContact O-CB 3.48Å; S345-D349 PolarHBondContact O-N 3.49Å; A347-D349 VanDerWaalsContact C-N 3.34Å; A347-D349 PolarHBondContact O-N 2.91Å; D349-I351 PolarHBondContact O-N 3.06Å; D349-S352 PolarHBondContact O-N 2.83Å; D349-S352 PolarHBondContact O-OG 3.39Å; D349-K353 WeakPolarHBondContact O-CG 3.22Å; D349-K353 PolarHBondContact O-N 3.08Å; D349-K353 VanDerWaalsContact O-N 3.08Å; D349-K353 WeakPolarHBondContact OD1-CE 3.26Å; D349-K353 IonicContact OD1-NZ 2.67Å; D349-K353 PolarHBondContact OD1-NZ 3.17Å; D349-K353 IonicContact OD2-NZ 2.74Å; D349-K353 PolarHBondContact OD2-NZ 2.76Å; D349-H371 IonicContact OD2-CE1 3.72Å; D349-H371 IonicContact OD2-NE2 3.8Å; D349-H371 PolarHBondContact OD2-NE2 3.38Å
350	L	98.6	Very high	94.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.2	-47.9	176.3	-179.7	57	0	0	0	112.2	V151 L291 E346 A347 S352 K353 L354 L363 V368 H371 W373 V374	V151-L350 HydrophobicContact CG1-CD2 4.27Å; L291-L350 HydrophobicContact CD2-CD2 3.85Å; L291-L350 HydrophobicContact CD2-CG 4.08Å; E346-L350 PolarHBondContact O-N 3.17Å; A347-L350 PolarHBondContact O-N 3.36Å; L350-S352 VanDerWaalsContact C-N 3.29Å; L350-S352 PolarHBondContact O-N 3.12Å; L350-K353 PolarHBondContact O-N 3.09Å; L350-K353 VanDerWaalsContact O-N 3.17Å; L350-L354 HydrophobicContact CD1-CD1 4.05Å; L350-L354 HydrophobicContact CD1-CG 4.22Å; L350-L354 HydrophobicContact CG-CD1 3.97Å; L350-L354 WeakPolarHBondContact O-CG 3.24Å; L350-L354 PolarHBondContact O-N 3.06Å; L350-L354 VanDerWaalsContact O-N 3.09Å; L350-L363 HydrophobicContact CD1-CD1 3.96Å; L350-V368 HydrophobicContact CD1-CG1 4.36Å; L350-V368 HydrophobicContact CD1-CG2 4.37Å; L350-H371 HydrophobicContact CD1-CB 4.13Å; L350-W373 HydrophobicContact CD2-CD2 4.45Å; L350-W373 HydrophobicContact CD2-CE3 3.56Å; L350-W373 HydrophobicContact CD2-CZ3 4.04Å; L350-V374 HydrophobicContact CD2-CG2 3.7Å
351	I	98.4	Very high	93.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.3	-45.1	176.7	-70.3	170.2	0	0	0	110.3	L291 Y292 L295 Y333 F335 W340 A347 K348 D349 K353 L354 L355	L291-I351 HydrophobicContact CD2-CD1 4.42Å; L291-I351 HydrophobicContact CD2-CG1 3.67Å; L291-I351 HydrophobicContact CG-CD1 4.13Å; L291-I351 HydrophobicContact CG-CG1 3.83Å; Y292-I351 HydrophobicContact CD2-CD1 4.31Å; Y292-I351 HydrophobicContact CD2-CG2 4.17Å; L295-I351 HydrophobicContact CD1-CD1 4.03Å; Y333-I351 HydrophobicContact CE2-CG2 4.1Å; F335-I351 HydrophobicContact CE1-CB 4.37Å; F335-I351 HydrophobicContact CE1-CD1 4.07Å; F335-I351 HydrophobicContact CE1-CG2 3.98Å; F335-I351 HydrophobicContact CZ-CB 4.03Å; F335-I351 HydrophobicContact CZ-CG2 3.78Å; W340-I351 HydrophobicContact CH2-CD1 3.53Å; W340-I351 HydrophobicContact CZ3-CD1 3.74Å; A347-I351 WeakPolarHBondContact O-CG1 3.34Å; A347-I351 PolarHBondContact O-N 3.45Å; K348-I351 PolarHBondContact O-N 3.42Å; D349-I351 PolarHBondContact O-N 3.06Å; I351-K353 PolarHBondContact O-N 3.23Å; I351-L354 PolarHBondContact O-N 3.48Å; I351-L355 HydrophobicContact CG2-CD1 3.71Å; I351-L355 HydrophobicContact CG2-CG 4.14Å; I351-L355 PolarHBondContact O-N 3.31Å
352	S	97.7	Very high	93.8	Very high	47 Å²	47	47.1 Å²	47.1	33%	0.329	23%	0.233	S	C	.	.	H	α-helix	trans	-65.1	-23.8	-179.3	74.6	0	0	0	0	115	Y333 K348 D349 L350 V356	Y333-S352 WeakPolarHBondContact OH-CA 3.5Å; Y333-S352 WeakPolarHBondContact OH-CB 3.36Å; K348-S352 WeakPolarHBondContact O-CB 3.46Å; K348-S352 PolarHBondContact O-N 3.45Å; K348-S352 PolarHBondContact O-OG 3.49Å; D349-S352 PolarHBondContact O-N 2.83Å; D349-S352 PolarHBondContact O-OG 3.39Å; L350-S352 VanDerWaalsContact C-N 3.29Å; L350-S352 PolarHBondContact O-N 3.12Å; S352-V356 WeakPolarHBondContact O-CG2 3.11Å
353	K	97.8	Very high	93.9	Very high	80 Å²	80	45.9 Å²	45.9	35%	0.348	23%	0.227	S	C	.	.	H	α-helix	trans	-91.4	-11.5	175.4	-66.5	173.6	177.5	159.8	0	113.2	D349 L350 I351 L363	D349-K353 WeakPolarHBondContact O-CG 3.22Å; D349-K353 PolarHBondContact O-N 3.08Å; D349-K353 VanDerWaalsContact O-N 3.08Å; D349-K353 WeakPolarHBondContact OD1-CE 3.26Å; D349-K353 IonicContact OD1-NZ 2.67Å; D349-K353 PolarHBondContact OD1-NZ 3.17Å; D349-K353 IonicContact OD2-NZ 2.74Å; D349-K353 PolarHBondContact OD2-NZ 2.76Å; L350-K353 PolarHBondContact O-N 3.09Å; L350-K353 VanDerWaalsContact O-N 3.17Å; I351-K353 PolarHBondContact O-N 3.23Å; K353-L363 HydrophobicContact CB-CD1 3.41Å; K353-L363 VanDerWaalsContact CB-CD1 3.41Å; K353-L363 HydrophobicContact CB-CG 3.69Å; K353-L363 HydrophobicContact CD-CD1 4.04Å; K353-L363 HydrophobicContact CG-CD1 4.36Å; K353-L363 PolarHBondContact O-N 3.02Å; K353-L363 VanDerWaalsContact O-N 3.08Å
354	L	96.4	Very high	93.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-94	-42.7	172.6	-70.2	172.5	0	0	0	112.1	L284 L287 L291 L350 I351 V356 R362 L363 V368	L284-L354 HydrophobicContact CB-CD2 3.98Å; L284-L354 HydrophobicContact CD1-CD2 4.44Å; L284-L354 WeakPolarHBondContact O-CD2 3.47Å; L287-L354 HydrophobicContact CG-CD1 4.48Å; L291-L354 HydrophobicContact CD2-CD1 4.39Å; L350-L354 HydrophobicContact CD1-CD1 4.05Å; L350-L354 HydrophobicContact CD1-CG 4.22Å; L350-L354 HydrophobicContact CG-CD1 3.97Å; L350-L354 WeakPolarHBondContact O-CG 3.24Å; L350-L354 PolarHBondContact O-N 3.06Å; L350-L354 VanDerWaalsContact O-N 3.09Å; I351-L354 PolarHBondContact O-N 3.48Å; L354-V356 PolarHBondContact O-N 2.89Å; L354-R362 WeakPolarHBondContact O-CD 3.45Å; L354-R362 VanDerWaalsContact O-CG 3.23Å; L354-R362 WeakPolarHBondContact O-CG 3.43Å; L354-R362 PolarHBondContact O-NE 2.74Å; L354-L363 HydrophobicContact CD2-CB 4.4Å; L354-V368 HydrophobicContact CD2-CG2 3.65Å
355	L	94.6	Very high	93.7	Very high	7 Å²	7	46 Å²	46	4%	0.037	23%	0.229	C	C	.	.	S	Bend	trans	-86.2	47.5	178.5	-60	-175.1	0	0	0	111.7	W285 V289 P300 F301 Y333 I351	W285-L355 HydrophobicContact CD2-CD2 3.98Å; W285-L355 HydrophobicContact CE3-CD2 4.27Å; W285-L355 HydrophobicContact CG-CD2 4.33Å; W285-L355 HydrophobicContact CZ2-CD2 4.45Å; W285-L355 VanDerWaalsContact CZ3-C 3.42Å; W285-L355 HydrophobicContact CZ3-CB 4.35Å; V289-L355 HydrophobicContact CG2-CD2 3.85Å; P300-L355 HydrophobicContact CB-CD1 4.03Å; P300-L355 HydrophobicContact CG-CD1 4.07Å; F301-L355 HydrophobicContact CE2-CD1 4.38Å; F301-L355 HydrophobicContact CE2-CD2 4.42Å; F301-L355 HydrophobicContact CZ-CD1 4.44Å; Y333-L355 HydrophobicContact CD1-CB 4.22Å; Y333-L355 HydrophobicContact CD1-CD1 4.11Å; Y333-L355 HydrophobicContact CD2-CD1 4.41Å; Y333-L355 HydrophobicContact CE1-CB 3.63Å; Y333-L355 HydrophobicContact CE1-CD1 4.07Å; Y333-L355 HydrophobicContact CE2-CD1 4.38Å; Y333-L355 HydrophobicContact CG-CD1 4.3Å; I351-L355 HydrophobicContact CG2-CD1 3.71Å; I351-L355 HydrophobicContact CG2-CG 4.14Å; I351-L355 PolarHBondContact O-N 3.31Å
356	V	90.8	Very high	93.6	Very high	35 Å²	35	44.1 Å²	44.1	21%	0.212	22%	0.218	C	C	.	.			trans	-95.2	129.8	176.8	-177.8	0	0	0	0	109.2	W285 S352 L354 Q361 R362	W285-V356 WeakPolarHBondContact CZ3-O 3.33Å; S352-V356 WeakPolarHBondContact O-CG2 3.11Å; L354-V356 PolarHBondContact O-N 2.89Å; V356-Q361 HydrophobicContact CG1-CB 3.89Å; V356-R362 HydrophobicContact CB-CB 4.26Å; V356-R362 HydrophobicContact CB-CG 4.47Å; V356-R362 VanDerWaalsContact O-CZ 3.29Å; V356-R362 PolarHBondContact O-NE 3.29Å; V356-R362 PolarHBondContact O-NH2 3.1Å
357	R	85.9	Confident	93.6	Very high	158 Å²	158	45 Å²	45	60%	0.596	22%	0.222	S	C	*	.	S	Bend	trans	-58.6	-55.1	179.5	-167.5	-177.9	112.5	-177.2	4	111.5	Q329 A359 R362	Q329-R357 WeakPolarHBondContact O-CD 3.34Å; R357-A359 PolarHBondContact O-N 3.24Å; R357-A359 VanDerWaalsContact O-N 3.12Å; R357-R362 PolarHBondContact O-NH2 3.35Å; R357-R362 VanDerWaalsContact O-NH2 3.17Å
358	D	82.4	Confident	93.6	Very high	67 Å²	67	45 Å²	45	36%	0.358	22%	0.222	S	C	.	.	S	Bend	trans	-69.4	109.3	176.1	-177	-1.2	0	0	0	110.8	K360 Q361 R362	D358-K360 PolarHBondContact O-N 2.78Å; D358-K360 VanDerWaalsContact O-N 3.15Å; D358-K360 VanDerWaalsContact OD1-CB 3.3Å; D358-K360 WeakPolarHBondContact OD1-CB 3.43Å; D358-K360 PolarHBondContact OD1-N 3.27Å; D358-Q361 HydrophobicContact CB-CB 4.35Å; D358-Q361 HydrophobicContact CB-CG 4.1Å; D358-Q361 PolarHBondContact O-N 2.88Å; D358-Q361 WeakPolarHBondContact OD2-CG 3.29Å; D358-R362 PolarHBondContact O-N 2.97Å; D358-R362 VanDerWaalsContact O-N 3.11Å
359	A	84.8	Confident	93.6	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.008	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.9	177.9	0	0	0	0	0	113.5	Y278 R281 R357 R362	Y278-A359 HydrophobicContact CD1-CB 3.48Å; Y278-A359 VanDerWaalsContact CD1-CB 3.48Å; Y278-A359 HydrophobicContact CE1-CB 3.76Å; R281-A359 HydrophobicContact CB-CB 3.81Å; R281-A359 WeakPolarHBondContact CD-O 3.07Å; R281-A359 HydrophobicContact CG-CB 4.23Å; R281-A359 WeakPolarHBondContact CG-O 3.09Å; R357-A359 PolarHBondContact O-N 3.24Å; R357-A359 VanDerWaalsContact O-N 3.12Å; A359-R362 WeakPolarHBondContact O-CB 3.42Å
360	K	84.1	Confident	93.6	Very high	113 Å²	113	48.2 Å²	48.2	49%	0.491	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-32	176.7	-67.4	168.2	169.8	154.8	0	112.3	F277 Y278 D358	F277-K360 HydrophobicContact CE1-CG 3.96Å; Y278-K360 WeakPolarHBondContact OH-CE 3.4Å; Y278-K360 PolarHBondContact OH-NZ 3.4Å; Y278-K360 VanDerWaalsContact OH-NZ 3.1Å; D358-K360 PolarHBondContact O-N 2.78Å; D358-K360 VanDerWaalsContact O-N 3.15Å; D358-K360 VanDerWaalsContact OD1-CB 3.3Å; D358-K360 WeakPolarHBondContact OD1-CB 3.43Å; D358-K360 PolarHBondContact OD1-N 3.27Å
361	Q	88	Confident	93.6	Very high	139 Å²	139	48.8 Å²	48.8	65%	0.65	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-19.3	177.9	-59.2	-56	-39.9	0	0	112.7	V356 D358	V356-Q361 HydrophobicContact CG1-CB 3.89Å; D358-Q361 HydrophobicContact CB-CB 4.35Å; D358-Q361 HydrophobicContact CB-CG 4.1Å; D358-Q361 PolarHBondContact O-N 2.88Å; D358-Q361 WeakPolarHBondContact OD2-CG 3.29Å
362	R	94	Very high	93.6	Very high	3 Å²	3	51.2 Å²	51.2	1%	0.011	26%	0.256	C	S	.	.	S	Bend	trans	-60.5	146.8	176.2	-161.3	177.6	-61.2	152.2	2.9	110.9	R281 L354 V356 R357 D358 A359	R281-R362 VanDerWaalsContact C-NH1 3.3Å; R281-R362 PolarHBondContact NH1-O 2.82Å; R281-R362 VanDerWaalsContact O-CD 3.28Å; R281-R362 WeakPolarHBondContact O-CD 3.48Å; R281-R362 PolarHBondContact O-NH1 2.84Å; L354-R362 WeakPolarHBondContact O-CD 3.45Å; L354-R362 VanDerWaalsContact O-CG 3.23Å; L354-R362 WeakPolarHBondContact O-CG 3.43Å; L354-R362 PolarHBondContact O-NE 2.74Å; V356-R362 HydrophobicContact CB-CB 4.26Å; V356-R362 HydrophobicContact CB-CG 4.47Å; V356-R362 VanDerWaalsContact O-CZ 3.29Å; V356-R362 PolarHBondContact O-NE 3.29Å; V356-R362 PolarHBondContact O-NH2 3.1Å; R357-R362 PolarHBondContact O-NH2 3.35Å; R357-R362 VanDerWaalsContact O-NH2 3.17Å; D358-R362 PolarHBondContact O-N 2.97Å; D358-R362 VanDerWaalsContact O-N 3.11Å; A359-R362 WeakPolarHBondContact O-CB 3.42Å
363	L	95.3	Very high	93.6	Very high	26 Å²	26	49 Å²	49	14%	0.136	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-66.1	153	175.4	-67.9	172.7	0	0	0	112.7	R281 L284 L350 K353 L354 Q367 V368	R281-L363 PolarHBondContact NH1-O 3.42Å; L284-L363 WeakPolarHBondContact CG-O 3.26Å; L350-L363 HydrophobicContact CD1-CD1 3.96Å; K353-L363 HydrophobicContact CB-CD1 3.41Å; K353-L363 VanDerWaalsContact CB-CD1 3.41Å; K353-L363 HydrophobicContact CB-CG 3.69Å; K353-L363 HydrophobicContact CD-CD1 4.04Å; K353-L363 HydrophobicContact CG-CD1 4.36Å; K353-L363 PolarHBondContact O-N 3.02Å; K353-L363 VanDerWaalsContact O-N 3.08Å; L354-L363 HydrophobicContact CD2-CB 4.4Å; L363-Q367 HydrophobicContact CB-CB 4.27Å; L363-Q367 HydrophobicContact CD2-CB 3.82Å; L363-V368 HydrophobicContact CB-CG2 3.97Å; L363-V368 HydrophobicContact CD1-CG2 4.37Å
364	S	94.7	Very high	93.6	Very high	29 Å²	29	45.4 Å²	45.4	20%	0.203	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-94.3	164.3	172.6	71.1	0	0	0	0	109.2	R281 A366 Q367 V368	R281-S364 VanDerWaalsContact NH1-CB 3.28Å; S364-A366 VanDerWaalsContact C-N 3.34Å; S364-A366 PolarHBondContact O-N 3.14Å; S364-Q367 PolarHBondContact O-N 3.28Å; S364-Q367 VanDerWaalsContact OG-CG 3.32Å; S364-Q367 WeakPolarHBondContact OG-CG 3.41Å; S364-Q367 PolarHBondContact OG-N 3.04Å; S364-Q367 PolarHBondContact OG-OE1 2.85Å; S364-V368 WeakPolarHBondContact O-CG2 3.37Å; S364-V368 PolarHBondContact O-N 2.96Å
365	A	95.3	Very high	93.6	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.008	25%	0.249	C	C	.	.	H	α-helix	trans	-55.7	-47.3	175.7	0	0	0	0	0	112.1	L158 D159 L284 Q367 V368 L369	L158-A365 HydrophobicContact CB-CB 3.92Å; D159-A365 HydrophobicContact CB-CB 3.65Å; L284-A365 HydrophobicContact CD1-CB 4.21Å; A365-Q367 VanDerWaalsContact C-N 3.33Å; A365-Q367 PolarHBondContact O-N 3.24Å; A365-V368 WeakPolarHBondContact O-CB 3.32Å; A365-V368 PolarHBondContact O-N 3.22Å; A365-V368 VanDerWaalsContact O-N 3.17Å; A365-L369 WeakPolarHBondContact O-CG 3.45Å; A365-L369 PolarHBondContact O-N 3.44Å
366	A	95.3	Very high	93.4	Very high	40 Å²	40	51.8 Å²	51.8	33%	0.331	26%	0.264	S	S	.	.	H	α-helix	trans	-52.8	-45.2	170.2	0	0	0	0	0	113.5	D159 S364 L369 Q370	D159-A366 WeakPolarHBondContact OD1-CA 3.28Å; D159-A366 WeakPolarHBondContact OD1-CB 3.21Å; D159-A366 PolarHBondContact OD1-N 3.01Å; S364-A366 VanDerWaalsContact C-N 3.34Å; S364-A366 PolarHBondContact O-N 3.14Å; A366-L369 PolarHBondContact O-N 3.16Å; A366-Q370 WeakPolarHBondContact O-CG 3.3Å; A366-Q370 PolarHBondContact O-N 3.05Å
367	Q	97.4	Very high	93.5	Very high	94 Å²	94	55.9 Å²	55.9	44%	0.439	28%	0.281	S	S	.	.	H	α-helix	trans	-69	-35.3	179.6	-68.4	171.4	-45.3	0	0	112.3	L363 S364 A365 L369 Q370 H371	L363-Q367 HydrophobicContact CB-CB 4.27Å; L363-Q367 HydrophobicContact CD2-CB 3.82Å; S364-Q367 PolarHBondContact O-N 3.28Å; S364-Q367 VanDerWaalsContact OG-CG 3.32Å; S364-Q367 WeakPolarHBondContact OG-CG 3.41Å; S364-Q367 PolarHBondContact OG-N 3.04Å; S364-Q367 PolarHBondContact OG-OE1 2.85Å; A365-Q367 VanDerWaalsContact C-N 3.33Å; A365-Q367 PolarHBondContact O-N 3.24Å; Q367-L369 VanDerWaalsContact C-N 3.34Å; Q367-Q370 PolarHBondContact O-N 3.1Å; Q367-H371 PolarHBondContact O-N 2.99Å
368	V	98.4	Very high	93.9	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-42.9	173.8	172	0	0	0	0	110.8	V151 A155 L284 L287 L350 L354 L363 S364 A365 Q370 H371 V374	V151-V368 HydrophobicContact CG1-CG1 3.89Å; A155-V368 HydrophobicContact CB-CB 4.22Å; A155-V368 HydrophobicContact CB-CG1 3.78Å; L284-V368 HydrophobicContact CD1-CG2 4.27Å; L287-V368 HydrophobicContact CD2-CG1 4.42Å; L350-V368 HydrophobicContact CD1-CG1 4.36Å; L350-V368 HydrophobicContact CD1-CG2 4.37Å; L354-V368 HydrophobicContact CD2-CG2 3.65Å; L363-V368 HydrophobicContact CB-CG2 3.97Å; L363-V368 HydrophobicContact CD1-CG2 4.37Å; S364-V368 WeakPolarHBondContact O-CG2 3.37Å; S364-V368 PolarHBondContact O-N 2.96Å; A365-V368 WeakPolarHBondContact O-CB 3.32Å; A365-V368 PolarHBondContact O-N 3.22Å; A365-V368 VanDerWaalsContact O-N 3.17Å; V368-Q370 PolarHBondContact O-N 3.23Å; V368-H371 WeakPolarHBondContact O-CB 3.47Å; V368-H371 PolarHBondContact O-N 2.66Å; V368-V374 HydrophobicContact CG1-CG2 4.22Å; V368-V374 WeakPolarHBondContact O-CB 3.44Å; V368-V374 WeakPolarHBondContact O-CG2 3.39Å
369	L	98.1	Very high	94.5	Very high	41 Å²	41	47.3 Å²	47.3	22%	0.215	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-26.9	176.4	-69.3	170.2	0	0	0	112.9	R152 A155 A156 D159 A365 A366 Q367 Q375	R152-L369 HydrophobicContact CG-CD2 3.94Å; R152-L369 WeakPolarHBondContact O-CD2 3.26Å; A155-L369 HydrophobicContact CB-CD2 3.86Å; A155-L369 HydrophobicContact CB-CG 4.01Å; A156-L369 HydrophobicContact CB-CD2 4.3Å; D159-L369 HydrophobicContact CB-CD1 4.09Å; A365-L369 WeakPolarHBondContact O-CG 3.45Å; A365-L369 PolarHBondContact O-N 3.44Å; A366-L369 PolarHBondContact O-N 3.16Å; Q367-L369 VanDerWaalsContact C-N 3.34Å; L369-Q375 WeakPolarHBondContact O-CG 3.12Å
370	Q	98.2	Very high	95	Very high	131 Å²	131	54.1 Å²	54.1	61%	0.612	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-5.1	175.7	-58.3	-59.1	-16.1	0	0	113.6	A366 Q367 V368 Q375	A366-Q370 WeakPolarHBondContact O-CG 3.3Å; A366-Q370 PolarHBondContact O-N 3.05Å; Q367-Q370 PolarHBondContact O-N 3.1Å; V368-Q370 PolarHBondContact O-N 3.23Å; Q370-Q375 PolarHBondContact O-NE2 3.13Å
371	H	98.6	Very high	95.2	Very high	13 Å²	13	53.7 Å²	53.7	6%	0.06	28%	0.279	C	S	.	.	S	Bend	trans	-67.4	133.9	-178	-166	-88.9	0	0	0	111	E346 D349 L350 Q367 V368 W373 V374 Q375	E346-H371 PolarHBondContact O-CE1 3.43Å; E346-H371 VanDerWaalsContact O-CE1 3.31Å; D349-H371 IonicContact OD2-CE1 3.72Å; D349-H371 IonicContact OD2-NE2 3.8Å; D349-H371 PolarHBondContact OD2-NE2 3.38Å; L350-H371 HydrophobicContact CD1-CB 4.13Å; Q367-H371 PolarHBondContact O-N 2.99Å; V368-H371 WeakPolarHBondContact O-CB 3.47Å; V368-H371 PolarHBondContact O-N 2.66Å; H371-W373 VanDerWaalsContact C-N 3.27Å; H371-W373 WeakPolarHBondContact ND1-CB 3.15Å; H371-W373 PolarHBondContact ND1-N 2.88Å; H371-W373 PolarHBondContact O-N 3.1Å; H371-W373 VanDerWaalsContact O-N 3.14Å; H371-V374 HydrophobicContact CB-CB 4.41Å; H371-V374 HydrophobicContact CB-CG2 4.14Å; H371-V374 WeakPolarHBondContact O-CA 3.32Å; H371-V374 WeakPolarHBondContact O-CB 3.11Å; H371-V374 PolarHBondContact O-N 3.15Å; H371-Q375 PolarHBondContact O-N 3.18Å
372	P	97.8	Very high	95.4	Very high	51 Å²	51	49.5 Å²	49.5	33%	0.331	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-41.9	-176.8	-29.8	35.7	0	0	0	114	V374 Q375 Q377	P372-V374 VanDerWaalsContact C-N 3.25Å; P372-V374 PolarHBondContact O-N 2.96Å; P372-Q375 PolarHBondContact O-N 2.65Å; P372-Q377 HydrophobicContact CB-CG 4.37Å; P372-Q377 VanDerWaalsContact O-CB 3.23Å; P372-Q377 WeakPolarHBondContact O-CB 3.18Å; P372-Q377 WeakPolarHBondContact O-CG 3.23Å; P372-Q377 PolarHBondContact O-N 3.25Å; P372-Q377 VanDerWaalsContact O-N 3.1Å
373	W	98.3	Very high	95.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.275	C	S	.	.	I	π-helix	trans	-58.1	-36.6	176.5	-167.3	80.5	0	0	0	112.8	E144 A147 S148 V151 L291 L295 S344 E346 A347 L350 H371 A378	E144-W373 HydrophobicContact CB-CZ2 4.04Å; E144-W373 WeakPolarHBondContact O-CZ2 3.45Å; E144-W373 PolarHBondContact OE2-NE1 3.11Å; A147-W373 HydrophobicContact CB-CH2 3.84Å; A147-W373 HydrophobicContact CB-CZ2 4.31Å; S148-W373 VanDerWaalsContact N-CH2 3.35Å; S148-W373 PolarHBondContact OG-O 3.36Å; V151-W373 HydrophobicContact CB-CZ3 4.2Å; V151-W373 HydrophobicContact CG2-CZ3 3.99Å; L291-W373 HydrophobicContact CD1-CH2 3.5Å; L291-W373 HydrophobicContact CD1-CZ2 4.42Å; L291-W373 HydrophobicContact CD1-CZ3 3.86Å; L291-W373 HydrophobicContact CD2-CZ3 4.21Å; L295-W373 HydrophobicContact CD1-CZ2 4.44Å; L295-W373 HydrophobicContact CD2-CZ2 4.24Å; S344-W373 PolarHBondContact OG-NE1 3.03Å; E346-W373 HydrophobicContact CB-CB 3.99Å; E346-W373 HydrophobicContact CB-CG 4.28Å; A347-W373 HydrophobicContact CB-CD2 4.47Å; A347-W373 HydrophobicContact CB-CZ2 4.19Å; L350-W373 HydrophobicContact CD2-CD2 4.45Å; L350-W373 HydrophobicContact CD2-CE3 3.56Å; L350-W373 HydrophobicContact CD2-CZ3 4.04Å; H371-W373 VanDerWaalsContact C-N 3.27Å; H371-W373 WeakPolarHBondContact ND1-CB 3.15Å; H371-W373 PolarHBondContact ND1-N 2.88Å; H371-W373 PolarHBondContact O-N 3.1Å; H371-W373 VanDerWaalsContact O-N 3.14Å; W373-A378 HydrophobicContact CD2-CB 4.06Å; W373-A378 HydrophobicContact CG-CB 4.06Å; W373-A378 HydrophobicContact CZ2-CB 4.33Å; W373-A378 WeakPolarHBondContact O-CB 3.36Å; W373-A378 PolarHBondContact O-N 2.85Å
374	V	98	Very high	95.1	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.03	28%	0.284	C	S	.	.	I	π-helix	trans	-81.9	-31.6	179.8	-177.2	0	0	0	0	111.7	S148 V151 R152 L350 V368 H371 P372 G376	S148-V374 WeakPolarHBondContact OG-CA 3.19Å; V151-V374 HydrophobicContact CG1-CG2 3.93Å; R152-V374 HydrophobicContact CB-CG1 3.63Å; R152-V374 HydrophobicContact CG-CG1 3.94Å; L350-V374 HydrophobicContact CD2-CG2 3.7Å; V368-V374 HydrophobicContact CG1-CG2 4.22Å; V368-V374 WeakPolarHBondContact O-CB 3.44Å; V368-V374 WeakPolarHBondContact O-CG2 3.39Å; H371-V374 HydrophobicContact CB-CB 4.41Å; H371-V374 HydrophobicContact CB-CG2 4.14Å; H371-V374 WeakPolarHBondContact O-CA 3.32Å; H371-V374 WeakPolarHBondContact O-CB 3.11Å; H371-V374 PolarHBondContact O-N 3.15Å; P372-V374 VanDerWaalsContact C-N 3.25Å; P372-V374 PolarHBondContact O-N 2.96Å; V374-G376 PolarHBondContact O-N 3.42Å
375	Q	96	Very high	94.9	Very high	107 Å²	107	49.5 Å²	49.5	50%	0.5	27%	0.274	S	S	.	.	I	π-helix	trans	-73.7	12	176.2	-68.3	-171	-19.1	0	0	114.4	L369 Q370 H371 P372	L369-Q375 WeakPolarHBondContact O-CG 3.12Å; Q370-Q375 PolarHBondContact O-NE2 3.13Å; H371-Q375 PolarHBondContact O-N 3.18Å; P372-Q375 PolarHBondContact O-N 2.65Å
376	G	90.4	Very high	94.7	Very high	34 Å²	34	49.5 Å²	49.5	35%	0.351	27%	0.274	S	S	.	.	I	π-helix	trans	92.2	24	176.3	0	0	0	0	0	114.2	R145 V374	R145-G376 PolarHBondContact NH1-O 2.88Å; R145-G376 PolarHBondContact NH2-O 3.43Å; V374-G376 PolarHBondContact O-N 3.42Å
377	Q	92	Very high	94.4	Very high	120 Å²	120	51 Å²	51	56%	0.561	27%	0.274	S	S	*	.	I	π-helix	trans	-92	-4.3	165.6	-55.6	-175.4	18.6	0	0	113.1	P372	P372-Q377 HydrophobicContact CB-CG 4.37Å; P372-Q377 VanDerWaalsContact O-CB 3.23Å; P372-Q377 WeakPolarHBondContact O-CB 3.18Å; P372-Q377 WeakPolarHBondContact O-CG 3.23Å; P372-Q377 PolarHBondContact O-N 3.25Å; P372-Q377 VanDerWaalsContact O-N 3.1Å
378	A	95.5	Very high	93.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.261	C	S	.	.			trans	-61.3	130.1	174.9	0	0	0	0	0	112.3	E144 R145 W373	E144-A378 HydrophobicContact CB-CB 4.44Å; R145-A378 PolarHBondContact NE-O 3.36Å; R145-A378 PolarHBondContact NH2-O 3.43Å; W373-A378 HydrophobicContact CD2-CB 4.06Å; W373-A378 HydrophobicContact CG-CB 4.06Å; W373-A378 HydrophobicContact CZ2-CB 4.33Å; W373-A378 WeakPolarHBondContact O-CB 3.36Å; W373-A378 PolarHBondContact O-N 2.85Å
379	P	95.6	Very high	93.4	Very high	46 Å²	46	47.9 Å²	47.9	30%	0.299	26%	0.261	S	S	.	.			trans	-70.7	157.2	-177.8	29.4	-35.3	0	0	0	112.5	E144 R145 K381	E144-P379 HydrophobicContact CB-CG 4.09Å; E144-P379 WeakPolarHBondContact CB-O 3.25Å; E144-P379 HydrophobicContact CG-CG 4.27Å; E144-P379 WeakPolarHBondContact OE1-CG 3.45Å; R145-P379 PolarHBondContact N-O 3.06Å; P379-K381 HydrophobicContact CB-CB 4.34Å; P379-K381 PolarHBondContact O-N 3.08Å
380	E	94.1	Very high	92.8	Very high	143 Å²	143	50.9 Å²	50.9	67%	0.668	27%	0.274	S	S	*	.			trans	-85.9	23.1	173.2	-66	-171.9	166.9	0	0	112.6	R145 G382	R145-E380 HydrophobicContact CB-CG 4.03Å; R145-E380 WeakPolarHBondContact CD-OE1 3.48Å; R145-E380 HydrophobicContact CG-CG 4.4Å; E380-G382 PolarHBondContact O-N 2.73Å
381	K	88.5	Confident	91.9	Very high	104 Å²	104	54 Å²	54	45%	0.452	28%	0.28	S	S	.	.			trans	-71.8	122.8	-178.1	-168.8	175.2	-178.4	179.7	0	109.8	N143 H342 P379	N143-K381 WeakPolarHBondContact CA-O 3.48Å; N143-K381 WeakPolarHBondContact CB-O 3.25Å; H342-K381 WeakPolarHBondContact O-CD 3.29Å; H342-K381 WeakPolarHBondContact O-CE 3.38Å; H342-K381 PolarHBondContact O-NZ 2.83Å; P379-K381 HydrophobicContact CB-CB 4.34Å; P379-K381 PolarHBondContact O-N 3.08Å
382	G	91.6	Very high	90.3	Very high	51 Å²	51	57.7 Å²	57.7	53%	0.526	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-60.1	139.7	178.1	0	0	0	0	0	112.2	E380	E380-G382 PolarHBondContact O-N 2.73Å
383	L	93	Very high	88.3	Confident	10 Å²	10	60.5 Å²	60.5	5%	0.052	32%	0.321	C	S	.	.			trans	-106.3	144.9	178.7	-63.7	166.9	0	0	0	109.7	F142 E144 L295 I343 T385 P386	F142-L383 HydrophobicContact CD1-CB 4.5Å; F142-L383 HydrophobicContact CD1-CD1 3.8Å; F142-L383 HydrophobicContact CE1-CD1 3.97Å; F142-L383 WeakPolarHBondContact O-CB 3.39Å; F142-L383 PolarHBondContact O-N 2.91Å; E144-L383 HydrophobicContact CG-CD1 4.29Å; E144-L383 HydrophobicContact CG-CD2 4.13Å; E144-L383 HydrophobicContact CG-CG 4.46Å; L295-L383 HydrophobicContact CD2-CD1 3.64Å; I343-L383 HydrophobicContact CD1-CD2 4.32Å; I343-L383 HydrophobicContact CG1-CD2 3.93Å; L383-T385 PolarHBondContact O-N 2.99Å; L383-P386 WeakPolarHBondContact O-CD 3.4Å
384	P	90.6	Very high	86.4	Confident	49 Å²	49	61.8 Å²	61.8	32%	0.318	33%	0.33	S	S	.	.	S	Bend	trans	-75	0.6	174.6	33.1	-35.8	0	0	0	113	H342 P386 Q387 V388	H342-P384 WeakPolarHBondContact NE2-CD 3.43Å; P384-P386 VanDerWaalsContact C-CD 3.49Å; P384-Q387 VanDerWaalsContact C-OE1 3.3Å; P384-Q387 PolarHBondContact O-N 2.82Å; P384-Q387 PolarHBondContact O-OE1 3.09Å; P384-Q387 VanDerWaalsContact O-OE1 3.05Å; P384-V388 HydrophobicContact CB-CG2 4.38Å; P384-V388 WeakPolarHBondContact O-CG2 3.45Å; P384-V388 PolarHBondContact O-N 3.24Å
385	T	90.1	Very high	84.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-48.7	-49.1	-174.4	-44.7	0	0	0	0	113.1	I136 M294 L295 L383 Q387 V388 L389	I136-T385 HydrophobicContact CG2-CG2 3.99Å; M294-T385 WeakPolarHBondContact O-CB 3.41Å; M294-T385 WeakPolarHBondContact O-CG2 3.45Å; M294-T385 PolarHBondContact O-OG1 2.77Å; L295-T385 PolarHBondContact O-OG1 2.88Å; L383-T385 PolarHBondContact O-N 2.99Å; T385-Q387 VanDerWaalsContact C-N 3.28Å; T385-Q387 PolarHBondContact O-N 2.84Å; T385-V388 PolarHBondContact O-N 3.16Å; T385-V388 VanDerWaalsContact O-N 3.14Å; T385-L389 HydrophobicContact CG2-CD1 3.96Å; T385-L389 HydrophobicContact CG2-CG 4.1Å; T385-L389 WeakPolarHBondContact O-CG 3.5Å; T385-L389 PolarHBondContact O-N 2.82Å
386	P	90.8	Very high	83	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-58.8	-40.9	-179.3	-24.1	35.9	0	0	0	112.5	I136 Q139 F142 L383 P384 Q390	I136-P386 HydrophobicContact CG2-CG 4.17Å; I136-P386 WeakPolarHBondContact O-CB 3.15Å; Q139-P386 VanDerWaalsContact O-CB 3.26Å; Q139-P386 WeakPolarHBondContact O-CB 3.31Å; F142-P386 HydrophobicContact CB-CG 3.58Å; L383-P386 WeakPolarHBondContact O-CD 3.4Å; P384-P386 VanDerWaalsContact C-CD 3.49Å; P386-Q390 WeakPolarHBondContact O-CB 3.48Å; P386-Q390 WeakPolarHBondContact O-CG 3.42Å; P386-Q390 PolarHBondContact O-N 2.82Å
387	Q	89.7	Confident	82	Confident	72 Å²	72	62.5 Å²	62.5	34%	0.336	33%	0.327	S	S	.	.	H	α-helix	trans	-70.6	-36.1	178.2	-62.4	80.1	12	0	0	112.1	K140 P384 T385 Q390 R391	K140-Q387 PolarHBondContact O-NE2 3.05Å; P384-Q387 VanDerWaalsContact C-OE1 3.3Å; P384-Q387 PolarHBondContact O-N 2.82Å; P384-Q387 PolarHBondContact O-OE1 3.09Å; P384-Q387 VanDerWaalsContact O-OE1 3.05Å; T385-Q387 VanDerWaalsContact C-N 3.28Å; T385-Q387 PolarHBondContact O-N 2.84Å; Q387-Q390 PolarHBondContact O-N 3.47Å; Q387-R391 WeakPolarHBondContact O-CG 3.49Å; Q387-R391 PolarHBondContact O-N 3.15Å; Q387-R391 VanDerWaalsContact O-N 3.08Å
388	V	88	Confident	81.1	Confident	28 Å²	28	57.6 Å²	57.6	17%	0.17	31%	0.305	C	S	.	.	H	α-helix	trans	-64.5	-47.8	175.1	175.4	0	0	0	0	110.4	P384 T385 Q390 R391 N392	P384-V388 HydrophobicContact CB-CG2 4.38Å; P384-V388 WeakPolarHBondContact O-CG2 3.45Å; P384-V388 PolarHBondContact O-N 3.24Å; T385-V388 PolarHBondContact O-N 3.16Å; T385-V388 VanDerWaalsContact O-N 3.14Å; V388-Q390 VanDerWaalsContact C-N 3.28Å; V388-Q390 PolarHBondContact O-N 2.95Å; V388-R391 PolarHBondContact O-N 3.44Å; V388-R391 VanDerWaalsContact O-N 3.17Å; V388-N392 PolarHBondContact O-N 2.96Å; V388-N392 VanDerWaalsContact O-N 3.07Å
389	L	86.6	Confident	79.9	Confident	1 Å²	1	58 Å²	58	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-63.9	-31.3	177.5	-65.4	180	0	0	0	112.9	L133 I136 Q137 T385 T395 L398	L133-L389 HydrophobicContact CD2-CD1 4.35Å; I136-L389 HydrophobicContact CB-CD1 4.09Å; I136-L389 HydrophobicContact CG2-CD1 3.8Å; Q137-L389 HydrophobicContact CB-CB 4.04Å; Q137-L389 HydrophobicContact CB-CD1 4.36Å; Q137-L389 HydrophobicContact CG-CB 4.02Å; Q137-L389 PolarHBondContact NE2-O 3.2Å; T385-L389 HydrophobicContact CG2-CD1 3.96Å; T385-L389 HydrophobicContact CG2-CG 4.1Å; T385-L389 WeakPolarHBondContact O-CG 3.5Å; T385-L389 PolarHBondContact O-N 2.82Å; L389-T395 HydrophobicContact CB-CG2 4.36Å; L389-T395 HydrophobicContact CD1-CG2 4.49Å; L389-T395 HydrophobicContact CD2-CG2 4.35Å; L389-L398 HydrophobicContact CD2-CD1 3.25Å
390	Q	84.9	Confident	78.7	Confident	103 Å²	103	60.3 Å²	60.3	48%	0.481	32%	0.317	S	S	.	.	H	α-helix	trans	-71.5	-37.2	174.2	-75.5	168.7	9.7	0	0	112.6	Q137 P386 Q387 V388	Q137-Q390 HydrophobicContact CG-CG 4.07Å; Q137-Q390 WeakPolarHBondContact O-CG 3.33Å; Q137-Q390 PolarHBondContact O-NE2 3.29Å; P386-Q390 WeakPolarHBondContact O-CB 3.48Å; P386-Q390 WeakPolarHBondContact O-CG 3.42Å; P386-Q390 PolarHBondContact O-N 2.82Å; Q387-Q390 PolarHBondContact O-N 3.47Å; V388-Q390 VanDerWaalsContact C-N 3.28Å; V388-Q390 PolarHBondContact O-N 2.95Å
391	R	79.8	Confident	77.7	Confident	197 Å²	197	54.5 Å²	54.5	74%	0.743	29%	0.29	S	S	*	.	H	α-helix	trans	-74.4	-34.4	-179.2	-76.1	175.9	-175.9	163.9	2.6	113.1	Q387 V388 S393	Q387-R391 WeakPolarHBondContact O-CG 3.49Å; Q387-R391 PolarHBondContact O-N 3.15Å; Q387-R391 VanDerWaalsContact O-N 3.08Å; V388-R391 PolarHBondContact O-N 3.44Å; V388-R391 VanDerWaalsContact O-N 3.17Å; R391-S393 PolarHBondContact O-N 2.88Å; R391-S393 VanDerWaalsContact O-N 3.16Å
392	N	66.2	Low	76.8	Confident	91 Å²	91	49.6 Å²	49.6	49%	0.487	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	15	-174.2	-68.4	-10	0	0	0	113.9	V388 S394	V388-N392 PolarHBondContact O-N 2.96Å; V388-N392 VanDerWaalsContact O-N 3.07Å; N392-S394 PolarHBondContact O-N 3.03Å
393	S	54	Low	75.9	Confident	109 Å²	109	48.2 Å²	48.2	76%	0.762	25%	0.252	S	S	*	.	S	Bend	trans	50.8	-11.7	171.7	-71.3	0	0	0	0	119.8	R391	R391-S393 PolarHBondContact O-N 2.88Å; R391-S393 VanDerWaalsContact O-N 3.16Å
394	S	59.9	Low	75	Confident	28 Å²	28	51.4 Å²	51.4	20%	0.196	27%	0.267	C	S	.	.			trans	-154.6	107.4	170.6	118.6	0	0	0	0	111.9	N392 M396 D397	N392-S394 PolarHBondContact O-N 3.03Å; S394-M396 PolarHBondContact O-N 2.83Å; S394-D397 WeakPolarHBondContact CB-OD2 3.44Å; S394-D397 PolarHBondContact O-N 3.21Å; S394-D397 VanDerWaalsContact O-N 3.17Å; S394-D397 WeakPolarHBondContact OG-CB 3.46Å; S394-D397 PolarHBondContact OG-N 3.17Å; S394-D397 PolarHBondContact OG-OD1 3.39Å; S394-D397 PolarHBondContact OG-OD2 2.91Å
395	T	60.1	Low	73.9	Confident	11 Å²	11	49.1 Å²	49.1	7%	0.067	25%	0.251	C	S	.	.	H	α-helix	trans	-55.2	-25.4	159.7	36.2	0	0	0	0	111	L133 Q137 L389 L398 T399	L133-T395 HydrophobicContact CB-CG2 4.16Å; Q137-T395 HydrophobicContact CB-CG2 3.97Å; Q137-T395 HydrophobicContact CG-CG2 4.2Å; Q137-T395 PolarHBondContact OE1-OG1 3.04Å; L389-T395 HydrophobicContact CB-CG2 4.36Å; L389-T395 HydrophobicContact CD1-CG2 4.49Å; L389-T395 HydrophobicContact CD2-CG2 4.35Å; T395-L398 PolarHBondContact O-N 3.39Å; T395-T399 VanDerWaalsContact O-CB 3.26Å; T395-T399 WeakPolarHBondContact O-CB 3.32Å; T395-T399 PolarHBondContact O-N 3.19Å
396	M	61.9	Low	73.2	Confident	107 Å²	107	49.3 Å²	49.3	53%	0.527	25%	0.253	S	S	.	.	H	α-helix	trans	-57.9	-42.5	172.9	-63.9	-67.9	114.5	0	0	112.5	S394 T399 L400	S394-M396 PolarHBondContact O-N 2.83Å; M396-T399 WeakPolarHBondContact O-CB 3.36Å; M396-T399 WeakPolarHBondContact O-CG2 3.36Å; M396-T399 PolarHBondContact O-N 3.45Å; M396-L400 WeakPolarHBondContact O-CB 3.4Å; M396-L400 VanDerWaalsContact O-CG 3.29Å; M396-L400 WeakPolarHBondContact O-CG 3.42Å; M396-L400 PolarHBondContact O-N 2.92Å
397	D	69.9	Low	72.4	Confident	42 Å²	42	51.8 Å²	51.8	23%	0.225	27%	0.273	C	S	.	.	H	α-helix	trans	-68	-40.4	-179.5	-65.7	-35.4	0	0	0	110.9	G314 S394 T399 L400 F401	G314-D397 WeakPolarHBondContact CA-OD1 3.4Å; S394-D397 WeakPolarHBondContact CB-OD2 3.44Å; S394-D397 PolarHBondContact O-N 3.21Å; S394-D397 VanDerWaalsContact O-N 3.17Å; S394-D397 WeakPolarHBondContact OG-CB 3.46Å; S394-D397 PolarHBondContact OG-N 3.17Å; S394-D397 PolarHBondContact OG-OD1 3.39Å; S394-D397 PolarHBondContact OG-OD2 2.91Å; D397-T399 VanDerWaalsContact C-N 3.31Å; D397-T399 PolarHBondContact O-N 3.03Å; D397-L400 PolarHBondContact O-N 3.35Å; D397-F401 WeakPolarHBondContact O-CB 3.44Å; D397-F401 PolarHBondContact O-N 2.79Å
398	L	71.6	Confident	71.5	Confident	18 Å²	18	49.7 Å²	49.7	9%	0.094	26%	0.264	C	S	.	.	H	α-helix	trans	-65.1	-38.4	174.9	-69.6	172.2	0	0	0	112.1	L133 I293 G297 P299 L389 T395 A402	L133-L398 HydrophobicContact CD1-CB 4.36Å; I293-L398 HydrophobicContact CG2-CD1 4.44Å; G297-L398 WeakPolarHBondContact O-CD1 3.24Å; P299-L398 HydrophobicContact CG-CD2 4.32Å; L389-L398 HydrophobicContact CD2-CD1 3.25Å; T395-L398 PolarHBondContact O-N 3.39Å; L398-A402 VanDerWaalsContact O-CB 3.28Å; L398-A402 WeakPolarHBondContact O-CB 3.45Å; L398-A402 PolarHBondContact O-N 3.19Å
399	T	71.4	Confident	70.8	Confident	8 Å²	8	48.9 Å²	48.9	5%	0.049	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-50.4	176.1	-100.4	0	0	0	0	110.9	E215 T395 M396 D397 F401 A402 A403	E215-T399 VanDerWaalsContact CD-CB 3.47Å; E215-T399 HydrophobicContact CG-CG2 3.39Å; E215-T399 WeakPolarHBondContact CG-OG1 3.42Å; E215-T399 WeakPolarHBondContact OE1-CG2 3.38Å; E215-T399 VanDerWaalsContact OE2-CB 3.29Å; E215-T399 WeakPolarHBondContact OE2-CB 3.45Å; E215-T399 WeakPolarHBondContact OE2-CG2 3.33Å; E215-T399 PolarHBondContact OE2-OG1 2.72Å; T395-T399 VanDerWaalsContact O-CB 3.26Å; T395-T399 WeakPolarHBondContact O-CB 3.32Å; T395-T399 PolarHBondContact O-N 3.19Å; M396-T399 WeakPolarHBondContact O-CB 3.36Å; M396-T399 WeakPolarHBondContact O-CG2 3.36Å; M396-T399 PolarHBondContact O-N 3.45Å; D397-T399 VanDerWaalsContact C-N 3.31Å; D397-T399 PolarHBondContact O-N 3.03Å; T399-F401 VanDerWaalsContact C-N 3.35Å; T399-F401 PolarHBondContact O-N 3.08Å; T399-A402 PolarHBondContact O-N 3.33Å; T399-A403 WeakPolarHBondContact O-CB 3.17Å; T399-A403 PolarHBondContact O-N 3.06Å
400	L	70.8	Confident	70.1	Confident	95 Å²	95	50.2 Å²	50.2	50%	0.497	26%	0.264	S	S	.	.	H	α-helix	trans	-60.8	-45.8	176.7	-73.4	169.3	0	0	0	111.1	M396 D397 A402 A403 E404	M396-L400 WeakPolarHBondContact O-CB 3.4Å; M396-L400 VanDerWaalsContact O-CG 3.29Å; M396-L400 WeakPolarHBondContact O-CG 3.42Å; M396-L400 PolarHBondContact O-N 2.92Å; D397-L400 PolarHBondContact O-N 3.35Å; L400-A402 PolarHBondContact O-N 3.34Å; L400-A403 WeakPolarHBondContact O-CB 3.46Å; L400-A403 PolarHBondContact O-N 3.2Å; L400-E404 PolarHBondContact O-N 3.44Å
401	F	71.8	Confident	69.5	Low	21 Å²	21	51.2 Å²	51.2	9%	0.092	27%	0.268	C	S	.	.	H	α-helix	trans	-58.2	-48.7	176.2	177.6	-81.6	0	0	0	111.7	P299 F301 L324 D397 T399 A403 E404 A405	P299-F401 HydrophobicContact CB-CD1 3.32Å; P299-F401 HydrophobicContact CB-CE1 3.23Å; P299-F401 HydrophobicContact CB-CG 4.31Å; P299-F401 HydrophobicContact CB-CZ 4.12Å; P299-F401 HydrophobicContact CG-CD1 3.47Å; P299-F401 VanDerWaalsContact CG-CD1 3.47Å; P299-F401 HydrophobicContact CG-CD2 4.45Å; P299-F401 HydrophobicContact CG-CE1 3.58Å; P299-F401 HydrophobicContact CG-CE2 4.48Å; P299-F401 HydrophobicContact CG-CG 3.99Å; P299-F401 HydrophobicContact CG-CZ 4.11Å; F301-F401 HydrophobicContact CB-CZ 4.42Å; F301-F401 VanDerWaalsContact O-CE1 3.32Å; F301-F401 WeakPolarHBondContact O-CE1 3.4Å; F301-F401 WeakPolarHBondContact O-CZ 3.44Å; L324-F401 HydrophobicContact CD1-CE1 4.48Å; L324-F401 HydrophobicContact CD1-CE2 3.6Å; L324-F401 HydrophobicContact CD1-CZ 3.32Å; L324-F401 HydrophobicContact CD2-CD2 4.28Å; L324-F401 HydrophobicContact CD2-CE2 3.55Å; L324-F401 HydrophobicContact CD2-CZ 3.94Å; L324-F401 HydrophobicContact CG-CE2 4.17Å; L324-F401 HydrophobicContact CG-CZ 4.27Å; D397-F401 WeakPolarHBondContact O-CB 3.44Å; D397-F401 PolarHBondContact O-N 2.79Å; T399-F401 VanDerWaalsContact C-N 3.35Å; T399-F401 PolarHBondContact O-N 3.08Å; F401-A403 VanDerWaalsContact C-N 3.29Å; F401-A403 PolarHBondContact O-N 3.34Å; F401-E404 PolarHBondContact O-N 2.76Å; F401-A405 HydrophobicContact CE1-CB 4Å; F401-A405 HydrophobicContact CZ-CB 4.34Å; F401-A405 WeakPolarHBondContact O-CB 3.14Å; F401-A405 PolarHBondContact O-N 3.16Å
402	A	70.1	Confident	68.9	Low	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60	-43.6	179	0	0	0	0	0	110.5	P214 I293 L398 T399 L400 E404 A405 I406	P214-A402 HydrophobicContact CG-CB 4.3Å; I293-A402 HydrophobicContact CD1-CB 4.05Å; L398-A402 VanDerWaalsContact O-CB 3.28Å; L398-A402 WeakPolarHBondContact O-CB 3.45Å; L398-A402 PolarHBondContact O-N 3.19Å; T399-A402 PolarHBondContact O-N 3.33Å; L400-A402 PolarHBondContact O-N 3.34Å; A402-E404 PolarHBondContact O-N 2.94Å; A402-A405 PolarHBondContact O-N 3.42Å; A402-I406 HydrophobicContact CB-CD1 4.41Å; A402-I406 VanDerWaalsContact O-CB 3.28Å; A402-I406 WeakPolarHBondContact O-CB 3.43Å; A402-I406 WeakPolarHBondContact O-CD1 3.47Å; A402-I406 WeakPolarHBondContact O-CG1 3.47Å; A402-I406 PolarHBondContact O-N 3.18Å
403	A	73.8	Confident	69	Low	22 Å²	22	39.3 Å²	39.3	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-58.7	-45.5	176	0	0	0	0	0	112.1	K213 T399 L400 F401 A407	K213-A403 HydrophobicContact CD-CB 4.09Å; T399-A403 WeakPolarHBondContact O-CB 3.17Å; T399-A403 PolarHBondContact O-N 3.06Å; L400-A403 WeakPolarHBondContact O-CB 3.46Å; L400-A403 PolarHBondContact O-N 3.2Å; F401-A403 VanDerWaalsContact C-N 3.29Å; F401-A403 PolarHBondContact O-N 3.34Å; A403-A407 VanDerWaalsContact O-CB 3.27Å; A403-A407 WeakPolarHBondContact O-CB 3.38Å; A403-A407 PolarHBondContact O-N 2.86Å
404	E	73	Confident	69.5	Low	78 Å²	78	36.4 Å²	36.4	36%	0.364	19%	0.194	S	C	.	.	H	α-helix	trans	-63.9	-47.5	177.3	-72.8	-172	179.1	0	0	112.3	L400 F401 A402 I406 A407 L408	L400-E404 PolarHBondContact O-N 3.44Å; F401-E404 PolarHBondContact O-N 2.76Å; A402-E404 PolarHBondContact O-N 2.94Å; E404-I406 VanDerWaalsContact C-N 3.33Å; E404-I406 PolarHBondContact O-N 3.02Å; E404-A407 PolarHBondContact O-N 3.4Å; E404-L408 VanDerWaalsContact O-CB 3.26Å; E404-L408 WeakPolarHBondContact O-CB 3.27Å; E404-L408 PolarHBondContact O-N 2.74Å
405	A	68.5	Low	69.6	Low	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.8	-40.8	179.5	0	0	0	0	0	112.2	I328 F401 A402 L408 N409	I328-A405 HydrophobicContact CD1-CB 3.68Å; F401-A405 HydrophobicContact CE1-CB 4Å; F401-A405 HydrophobicContact CZ-CB 4.34Å; F401-A405 WeakPolarHBondContact O-CB 3.14Å; F401-A405 PolarHBondContact O-N 3.16Å; A402-A405 PolarHBondContact O-N 3.42Å; A405-L408 PolarHBondContact O-N 2.9Å; A405-N409 WeakPolarHBondContact O-CB 3.42Å; A405-N409 PolarHBondContact O-N 3.17Å
406	I	73.8	Confident	69.7	Low	5 Å²	5	42.7 Å²	42.7	3%	0.026	22%	0.219	C	C	.	.	H	α-helix	trans	-68.3	-46.2	178.4	-71.6	160.8	0	0	0	110.8	L212 K213 S286 A402 E404 L408 N409 R410	L212-I406 WeakPolarHBondContact O-CD1 3.33Å; K213-I406 HydrophobicContact CB-CD1 4.1Å; S286-I406 WeakPolarHBondContact OG-CG1 3.48Å; S286-I406 WeakPolarHBondContact OG-CG2 3.45Å; A402-I406 HydrophobicContact CB-CD1 4.41Å; A402-I406 VanDerWaalsContact O-CB 3.28Å; A402-I406 WeakPolarHBondContact O-CB 3.43Å; A402-I406 WeakPolarHBondContact O-CD1 3.47Å; A402-I406 WeakPolarHBondContact O-CG1 3.47Å; A402-I406 PolarHBondContact O-N 3.18Å; E404-I406 VanDerWaalsContact C-N 3.33Å; E404-I406 PolarHBondContact O-N 3.02Å; I406-L408 PolarHBondContact O-N 3.38Å; I406-N409 PolarHBondContact O-N 3.08Å; I406-R410 PolarHBondContact O-N 3.34Å; I406-R410 VanDerWaalsContact O-N 3.09Å
407	A	74.1	Confident	69.5	Low	51 Å²	51	38.7 Å²	38.7	42%	0.421	20%	0.199	S	C	.	.	H	α-helix	trans	-58.4	-38.4	176.7	0	0	0	0	0	111.5	A403 E404 R410 Q411	A403-A407 VanDerWaalsContact O-CB 3.27Å; A403-A407 WeakPolarHBondContact O-CB 3.38Å; A403-A407 PolarHBondContact O-N 2.86Å; E404-A407 PolarHBondContact O-N 3.4Å; A407-R410 WeakPolarHBondContact O-CB 3.31Å; A407-R410 PolarHBondContact O-N 3.44Å; A407-Q411 WeakPolarHBondContact O-CG 3.02Å; A407-Q411 PolarHBondContact O-N 3.02Å
408	L	70.8	Confident	68.9	Low	29 Å²	29	40.1 Å²	40.1	15%	0.152	21%	0.207	C	C	.	.	H	α-helix	trans	-72.2	-45.6	-179.5	-168.5	60	0	0	0	113.2	F325 I328 E404 A405 I406 R410 Q411 L412	F325-L408 HydrophobicContact CB-CD2 3.75Å; F325-L408 HydrophobicContact CD2-CD1 3.34Å; F325-L408 HydrophobicContact CD2-CD2 3.41Å; F325-L408 VanDerWaalsContact CD2-CD2 3.41Å; F325-L408 HydrophobicContact CD2-CG 3.41Å; F325-L408 VanDerWaalsContact CD2-CG 3.41Å; F325-L408 HydrophobicContact CE2-CD1 3.53Å; F325-L408 HydrophobicContact CE2-CD2 4.38Å; F325-L408 HydrophobicContact CE2-CG 3.91Å; F325-L408 HydrophobicContact CG-CD1 4.33Å; F325-L408 HydrophobicContact CG-CD2 4.05Å; F325-L408 HydrophobicContact CG-CG 4.46Å; I328-L408 HydrophobicContact CD1-CD2 3.87Å; E404-L408 VanDerWaalsContact O-CB 3.26Å; E404-L408 WeakPolarHBondContact O-CB 3.27Å; E404-L408 PolarHBondContact O-N 2.74Å; A405-L408 PolarHBondContact O-N 2.9Å; I406-L408 PolarHBondContact O-N 3.38Å; L408-R410 PolarHBondContact O-N 3.19Å; L408-Q411 PolarHBondContact O-N 3.17Å; L408-Q411 VanDerWaalsContact O-N 3.11Å; L408-L412 PolarHBondContact O-N 3.18Å; L408-L412 VanDerWaalsContact O-N 3.07Å
409	N	73.2	Confident	68.2	Low	11 Å²	11	44.7 Å²	44.7	6%	0.059	23%	0.228	C	C	.	.	H	α-helix	trans	-58.8	-34.3	174.7	-179.5	71.2	0	0	0	111.9	I328 A405 I406 S413	I328-N409 HydrophobicContact CG2-CB 4.26Å; A405-N409 WeakPolarHBondContact O-CB 3.42Å; A405-N409 PolarHBondContact O-N 3.17Å; I406-N409 PolarHBondContact O-N 3.08Å; N409-S413 PolarHBondContact O-N 2.84Å; N409-S413 VanDerWaalsContact O-N 3.1Å; N409-S413 PolarHBondContact O-OG 3.38Å
410	R	73.4	Confident	67.4	Low	29 Å²	29	49.1 Å²	49.1	11%	0.109	25%	0.251	C	S	.	.	H	α-helix	trans	-65.7	-44.6	174.4	-175.4	178.6	173.3	-143.9	-8.1	112.4	S237 I406 A407 L408 L412 S413 Q414	S237-R410 PolarHBondContact O-NH2 3.47Å; S237-R410 VanDerWaalsContact OG-CZ 3.29Å; S237-R410 PolarHBondContact OG-NH1 3.08Å; S237-R410 PolarHBondContact OG-NH2 3.37Å; I406-R410 PolarHBondContact O-N 3.34Å; I406-R410 VanDerWaalsContact O-N 3.09Å; A407-R410 WeakPolarHBondContact O-CB 3.31Å; A407-R410 PolarHBondContact O-N 3.44Å; L408-R410 PolarHBondContact O-N 3.19Å; R410-L412 VanDerWaalsContact C-N 3.31Å; R410-L412 PolarHBondContact O-N 3.25Å; R410-S413 PolarHBondContact O-N 3.45Å; R410-Q414 WeakPolarHBondContact O-CG 3.37Å; R410-Q414 PolarHBondContact O-N 3.31Å
411	Q	70.5	Confident	66.5	Low	123 Å²	123	48.4 Å²	48.4	58%	0.575	26%	0.258	S	S	*	.	H	α-helix	trans	-60.8	-40.4	176.7	-72.1	175.8	-6.8	0	0	112.1	A407 L408 Q414 H415	A407-Q411 WeakPolarHBondContact O-CG 3.02Å; A407-Q411 PolarHBondContact O-N 3.02Å; L408-Q411 PolarHBondContact O-N 3.17Å; L408-Q411 VanDerWaalsContact O-N 3.11Å; Q411-Q414 PolarHBondContact O-N 3.35Å; Q411-H415 PolarHBondContact O-N 3.34Å; Q411-H415 VanDerWaalsContact O-N 3.12Å
412	L	69.2	Low	65.3	Low	31 Å²	31	55.1 Å²	55.1	16%	0.162	29%	0.29	C	S	.	.	H	α-helix	trans	-63.2	-45.1	176.8	-71.3	170.5	0	0	0	112.4	F325 I328 Q329 L408 R410 Q414 H415 E416	F325-L412 HydrophobicContact CD2-CD1 4.28Å; F325-L412 HydrophobicContact CE2-CD1 3.86Å; F325-L412 HydrophobicContact CE2-CD2 3.47Å; F325-L412 VanDerWaalsContact CE2-CD2 3.47Å; F325-L412 HydrophobicContact CE2-CG 3.76Å; F325-L412 HydrophobicContact CZ-CD2 3.62Å; F325-L412 HydrophobicContact CZ-CG 4.41Å; I328-L412 HydrophobicContact CG2-CD1 4.13Å; Q329-L412 HydrophobicContact CG-CD1 3.49Å; Q329-L412 VanDerWaalsContact CG-CD1 3.49Å; Q329-L412 HydrophobicContact CG-CD2 3.78Å; Q329-L412 HydrophobicContact CG-CG 4.29Å; Q329-L412 VanDerWaalsContact NE2-CD2 3.27Å; L408-L412 PolarHBondContact O-N 3.18Å; L408-L412 VanDerWaalsContact O-N 3.07Å; R410-L412 VanDerWaalsContact C-N 3.31Å; R410-L412 PolarHBondContact O-N 3.25Å; L412-Q414 VanDerWaalsContact C-N 3.25Å; L412-Q414 PolarHBondContact O-N 3.33Å; L412-H415 PolarHBondContact O-N 3.07Å; L412-H415 VanDerWaalsContact O-N 3.11Å; L412-E416 PolarHBondContact O-N 3.31Å
413	S	68	Low	63.7	Low	7 Å²	7	62 Å²	62	5%	0.049	32%	0.322	C	S	.	.	H	α-helix	trans	-63.2	-33.8	-179.4	-57.1	0	0	0	0	112	C282 N409 R410 E417	C282-S413 PolarHBondContact SG-OG 3.5Å; N409-S413 PolarHBondContact O-N 2.84Å; N409-S413 VanDerWaalsContact O-N 3.1Å; N409-S413 PolarHBondContact O-OG 3.38Å; R410-S413 PolarHBondContact O-N 3.45Å; S413-E417 PolarHBondContact O-N 2.76Å
414	Q	64.3	Low	62.1	Low	48 Å²	48	65.3 Å²	65.3	22%	0.224	34%	0.342	C	S	.	.	H	α-helix	trans	-71.4	-35.8	174.5	-69.7	173.6	-10.4	0	0	112.5	R410 Q411 L412 E417 N418	R410-Q414 WeakPolarHBondContact O-CG 3.37Å; R410-Q414 PolarHBondContact O-N 3.31Å; Q411-Q414 PolarHBondContact O-N 3.35Å; L412-Q414 VanDerWaalsContact C-N 3.25Å; L412-Q414 PolarHBondContact O-N 3.33Å; Q414-E417 WeakPolarHBondContact O-CB 3.38Å; Q414-E417 PolarHBondContact O-N 3.02Å; Q414-N418 PolarHBondContact O-N 3.1Å; Q414-N418 VanDerWaalsContact O-N 3.09Å
415	H	62.4	Low	60.4	Low	108 Å²	108	71.4 Å²	71.4	50%	0.5	37%	0.371	S	S	.	.	H	α-helix	trans	-68.9	-42.2	177	-163.7	-80.1	0	0	0	112	Q411 L412 E417 N418 E419	Q411-H415 PolarHBondContact O-N 3.34Å; Q411-H415 VanDerWaalsContact O-N 3.12Å; L412-H415 PolarHBondContact O-N 3.07Å; L412-H415 VanDerWaalsContact O-N 3.11Å; H415-E417 PolarHBondContact O-N 3.14Å; H415-N418 PolarHBondContact O-N 3.41Å; H415-E419 IonicContact CE1-OE1 2.66Å; H415-E419 PolarHBondContact CE1-OE1 2.71Å; H415-E419 IonicContact ND1-OE1 2.7Å; H415-E419 PolarHBondContact ND1-OE1 2.56Å; H415-E419 WeakPolarHBondContact O-CG 3.13Å; H415-E419 PolarHBondContact O-N 2.9Å
416	E	60.4	Low	59	Low	64 Å²	64	75 Å²	75	30%	0.299	40%	0.4	S	S	.	.	H	α-helix	trans	-60.2	-33.8	174.1	-70.3	-176.7	153	0	0	111.7	L412 L420	L412-E416 PolarHBondContact O-N 3.31Å; E416-L420 WeakPolarHBondContact O-CB 3.47Å; E416-L420 WeakPolarHBondContact O-CD1 3.39Å; E416-L420 VanDerWaalsContact O-CG 3.31Å; E416-L420 WeakPolarHBondContact O-CG 3.46Å; E416-L420 PolarHBondContact O-N 2.83Å; E416-L420 VanDerWaalsContact O-N 3.12Å
417	E	59	Low	57.3	Low	22 Å²	22	83.2 Å²	83.2	10%	0.103	44%	0.443	C	S	.	.	H	α-helix	trans	-67.4	-47	175	179	168.9	-162.4	0	0	112.4	A275 S413 Q414 H415 E419 L420 A421	A275-E417 WeakPolarHBondContact CA-OE1 3.31Å; A275-E417 WeakPolarHBondContact CB-OE1 3.42Å; A275-E417 PolarHBondContact N-OE1 2.99Å; S413-E417 PolarHBondContact O-N 2.76Å; Q414-E417 WeakPolarHBondContact O-CB 3.38Å; Q414-E417 PolarHBondContact O-N 3.02Å; H415-E417 PolarHBondContact O-N 3.14Å; E417-E419 VanDerWaalsContact C-N 3.31Å; E417-E419 PolarHBondContact O-N 3.04Å; E417-L420 PolarHBondContact O-N 3.34Å; E417-A421 WeakPolarHBondContact O-CB 3.41Å; E417-A421 PolarHBondContact O-N 3.17Å
418	N	57	Low	55.7	Low	72 Å²	72	85 Å²	85	39%	0.385	46%	0.457	S	S	.	.	H	α-helix	trans	-61.3	-40.3	177.3	-73.2	-7.7	0	0	0	112	E269 Q414 H415 A421 E422	E269-N418 PolarHBondContact OE1-OD1 3.12Å; Q414-N418 PolarHBondContact O-N 3.1Å; Q414-N418 VanDerWaalsContact O-N 3.09Å; H415-N418 PolarHBondContact O-N 3.41Å; N418-A421 PolarHBondContact O-N 3.17Å; N418-E422 WeakPolarHBondContact O-CG 3.12Å; N418-E422 PolarHBondContact O-N 2.81Å; N418-E422 VanDerWaalsContact O-N 3.08Å
419	E	57.6	Low	53.9	Low	114 Å²	114	90.6 Å²	90.6	53%	0.533	49%	0.488	S	S	.	.	H	α-helix	trans	-65.1	-39.5	176.2	-72	-176.6	166.5	0	0	112.3	H415 E417 A421 E422 E423	H415-E419 IonicContact CE1-OE1 2.66Å; H415-E419 PolarHBondContact CE1-OE1 2.71Å; H415-E419 IonicContact ND1-OE1 2.7Å; H415-E419 PolarHBondContact ND1-OE1 2.56Å; H415-E419 WeakPolarHBondContact O-CG 3.13Å; H415-E419 PolarHBondContact O-N 2.9Å; E417-E419 VanDerWaalsContact C-N 3.31Å; E417-E419 PolarHBondContact O-N 3.04Å; E419-A421 VanDerWaalsContact C-N 3.35Å; E419-E422 PolarHBondContact O-N 3.5Å; E419-E423 PolarHBondContact O-N 3.25Å
420	L	53.3	Low	52.4	Low	101 Å²	101	93.7 Å²	93.7	53%	0.529	52%	0.522	S	S	.	.	H	α-helix	trans	-70	-30.1	176.2	-77	162.9	0	0	0	112.9	E416 E417 E422	E416-L420 WeakPolarHBondContact O-CB 3.47Å; E416-L420 WeakPolarHBondContact O-CD1 3.39Å; E416-L420 VanDerWaalsContact O-CG 3.31Å; E416-L420 WeakPolarHBondContact O-CG 3.46Å; E416-L420 PolarHBondContact O-N 2.83Å; E416-L420 VanDerWaalsContact O-N 3.12Å; E417-L420 PolarHBondContact O-N 3.34Å; L420-E422 VanDerWaalsContact C-N 3.35Å
421	A	53.4	Low	50.6	Low	80 Å²	80	99.7 Å²	99.7	66%	0.661	56%	0.556	S	S	*	*	H	α-helix	trans	-76.4	-22.3	175.1	0	0	0	0	0	112.9	E417 N418 E419	E417-A421 WeakPolarHBondContact O-CB 3.41Å; E417-A421 PolarHBondContact O-N 3.17Å; N418-A421 PolarHBondContact O-N 3.17Å; E419-A421 VanDerWaalsContact C-N 3.35Å
422	E	45.4	Very low	48.8	Very low	162 Å²	162	98.5 Å²	98.5	76%	0.757	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	4.2	177.5	-73.6	-163	165.8	0	0	114.6	N418 E419 L420 P424	N418-E422 WeakPolarHBondContact O-CG 3.12Å; N418-E422 PolarHBondContact O-N 2.81Å; N418-E422 VanDerWaalsContact O-N 3.08Å; E419-E422 PolarHBondContact O-N 3.5Å; L420-E422 VanDerWaalsContact C-N 3.35Å; E422-P424 WeakPolarHBondContact O-CD 3.33Å; E422-P424 VanDerWaalsContact O-N 3.09Å
423	E	35.8	Very low	47.1	Very low	145 Å²	145	102.1 Å²	102.1	68%	0.678	59%	0.587	S	S	*	*			trans	-56.1	118.9	173	-88.4	-71.4	134.4	0	0	109.9	E419 E425	E419-E423 PolarHBondContact O-N 3.25Å; E423-E425 PolarHBondContact O-N 3.02Å
424	P	41.7	Very low	45.7	Very low	92 Å²	92	109.4 Å²	109.4	60%	0.597	62%	0.623	S	S	*	*			trans	-66.6	139.7	-177.3	26	-30.1	0	0	0	108.7	E422 A426	E422-P424 WeakPolarHBondContact O-CD 3.33Å; E422-P424 VanDerWaalsContact O-N 3.09Å; P424-A426 HydrophobicContact CB-CB 4.22Å; P424-A426 HydrophobicContact CG-CB 4.23Å; P424-A426 PolarHBondContact O-N 3.45Å
425	E	37.7	Very low	44.5	Very low	206 Å²	206	116.3 Å²	116.3	96%	0.963	65%	0.652	S	S	*	*	S	Bend	trans	-59.5	62	164.6	-65.8	175.3	140.5	0	0	111.2	E423	E423-E425 PolarHBondContact O-N 3.02Å
426	A	38.5	Very low	43.6	Very low	74 Å²	74	119.2 Å²	119.2	61%	0.612	67%	0.67	S	S	*	*			trans	-114.8	40.6	-175	0	0	0	0	0	110.3	P424	P424-A426 HydrophobicContact CB-CB 4.22Å; P424-A426 HydrophobicContact CG-CB 4.23Å; P424-A426 PolarHBondContact O-N 3.45Å
427	L	38.5	Very low	42.7	Very low	179 Å²	179	120.3 Å²	120.3	94%	0.937	69%	0.685	S	S	*	*	S	Bend	trans	-155.9	38.2	167.4	-107.7	140.5	0	0	0	112.5
428	A	39.1	Very low	42.1	Very low	87 Å²	87	123 Å²	123	72%	0.719	70%	0.704	S	S	*	*	S	Bend	trans	-158.5	62.5	164.9	0	0	0	0	0	111.8
429	D	33.8	Very low	41.6	Very low	148 Å²	148	125.3 Å²	125.3	79%	0.791	72%	0.723	S	S	*	*			trans	-161.8	75	152.2	-121.7	-0.3	0	0	0	113	L431	D429-L431 VanDerWaalsContact C-N 3.3Å; D429-L431 PolarHBondContact O-N 2.87Å
430	G	41	Very low	41	Very low	76 Å²	76	124.8 Å²	124.8	78%	0.784	73%	0.731	S	S	*	*			trans	-83.7	77.1	153.8	0	0	0	0	0	109.4
431	L	36.6	Very low	40.8	Very low	155 Å²	155	127.3 Å²	127.3	81%	0.812	74%	0.738	S	S	*	*	S	Bend	trans	166.1	121.7	146.9	-92.1	147.1	0	0	0	111.9	D429	D429-L431 VanDerWaalsContact C-N 3.3Å; D429-L431 PolarHBondContact O-N 2.87Å
432	C	32	Very low	41	Very low	98 Å²	98	126 Å²	126	66%	0.662	72%	0.724	S	S	*	*			trans	78.2	81.8	164.1	-148.1	0	0	0	0	118.1	M434	C432-M434 PolarHBondContact O-N 3.04Å; C432-M434 VanDerWaalsContact O-N 3.17Å
433	S	34.6	Very low	41.3	Very low	106 Å²	106	128.7 Å²	128.7	74%	0.741	73%	0.727	S	S	*	*			trans	-66	107.7	160.3	-170.6	0	0	0	0	111.1
434	M	37.3	Very low	42.3	Very low	161 Å²	161	126.6 Å²	126.6	79%	0.793	72%	0.72	S	S	*	*			trans	-125.6	83	153.1	-67.1	-151.2	-150.1	0	0	109.5	C432 L436	C432-M434 PolarHBondContact O-N 3.04Å; C432-M434 VanDerWaalsContact O-N 3.17Å; M434-L436 PolarHBondContact O-N 3.01Å; M434-L436 VanDerWaalsContact O-N 3.17Å
435	K	40.4	Very low	43	Very low	192 Å²	192	124.3 Å²	124.3	84%	0.835	71%	0.709	S	S	*	*			trans	-67.6	107.2	168	-76.5	-177.8	174.5	179.7	0	109.5	S437	K435-S437 PolarHBondContact O-N 3.34Å
436	L	42.5	Very low	44.1	Very low	170 Å²	170	122.7 Å²	122.7	89%	0.89	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-71.3	122.4	165.4	-68.9	173.2	0	0	0	108.9	M434	M434-L436 PolarHBondContact O-N 3.01Å; M434-L436 VanDerWaalsContact O-N 3.17Å
437	S	42.1	Very low	45	Very low	86 Å²	86	128.2 Å²	128.2	60%	0.601	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-72.6	152.6	175.3	-42.1	0	0	0	0	110.8	K435	K435-S437 PolarHBondContact O-N 3.34Å
438	P	45.8	Very low	46	Very low	79 Å²	79	127.9 Å²	127.9	51%	0.513	69%	0.685	S	S	.	*	P	Polyproline II helix	trans	-51.5	145.5	175.8	-26	33	0	0	0	112.6	C440 K441	P438-C440 PolarHBondContact O-N 3Å; P438-K441 PolarHBondContact O-N 2.67Å
439	P	46.5	Very low	47	Very low	120 Å²	120	126.6 Å²	126.6	78%	0.779	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-54.4	-25	-171.6	-25.6	32.5	0	0	0	114.8	K441	P439-K441 VanDerWaalsContact C-N 3.3Å; P439-K441 PolarHBondContact O-N 2.98Å
440	C	44.8	Very low	48.2	Very low	104 Å²	104	126.6 Å²	126.6	70%	0.703	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-75.2	-8.2	-179.9	53	0	0	0	0	115.1	P438	P438-C440 PolarHBondContact O-N 3Å
441	K	50.6	Low	48.9	Very low	153 Å²	153	126.5 Å²	126.5	67%	0.665	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-116.1	4.9	179.5	-66.9	-176.1	-179.7	176.4	0	114.7	P438 P439	P438-K441 PolarHBondContact O-N 2.67Å; P439-K441 VanDerWaalsContact C-N 3.3Å; P439-K441 PolarHBondContact O-N 2.98Å
442	S	55.8	Low	49.9	Very low	52 Å²	52	127 Å²	127	36%	0.364	66%	0.66	S	S	.	*			trans	-66	135.8	178.7	173.5	0	0	0	0	112.6	L444 A445 R446	S442-L444 PolarHBondContact O-N 3.47Å; S442-L444 VanDerWaalsContact O-N 3.14Å; S442-L444 WeakPolarHBondContact OG-CB 3.5Å; S442-L444 PolarHBondContact OG-N 3.23Å; S442-L444 VanDerWaalsContact OG-N 3.17Å; S442-A445 WeakPolarHBondContact O-CB 3.4Å; S442-A445 PolarHBondContact O-N 3.4Å; S442-R446 PolarHBondContact O-N 2.87Å; S442-R446 VanDerWaalsContact O-N 3.09Å
443	R	52.4	Low	50.8	Low	219 Å²	219	126.4 Å²	126.4	83%	0.826	66%	0.662	S	S	*	*	H	α-helix	trans	-53.9	-29.1	170.5	-90.9	178.7	154.1	-175.8	-5.1	112.5	R447	R443-R447 WeakPolarHBondContact O-CG 3.36Å; R443-R447 PolarHBondContact O-N 3.29Å; R443-R447 VanDerWaalsContact O-N 3.13Å
444	L	57.3	Low	51.5	Low	101 Å²	101	124.4 Å²	124.4	53%	0.529	66%	0.659	S	S	.	*	H	α-helix	trans	-71.9	-38.9	176.2	-164.7	74.3	0	0	0	111.8	S442 R447 R448	S442-L444 PolarHBondContact O-N 3.47Å; S442-L444 VanDerWaalsContact O-N 3.14Å; S442-L444 WeakPolarHBondContact OG-CB 3.5Å; S442-L444 PolarHBondContact OG-N 3.23Å; S442-L444 VanDerWaalsContact OG-N 3.17Å; L444-R447 PolarHBondContact O-N 3.31Å; L444-R448 WeakPolarHBondContact O-CG 3.38Å; L444-R448 PolarHBondContact O-N 3.14Å; L444-R448 VanDerWaalsContact O-N 3.08Å
445	A	56.2	Low	52.3	Low	45 Å²	45	128.1 Å²	128.1	37%	0.372	66%	0.664	S	S	.	*	H	α-helix	trans	-67.2	-40.3	175.8	0	0	0	0	0	111.6	S442 R448 A449	S442-A445 WeakPolarHBondContact O-CB 3.4Å; S442-A445 PolarHBondContact O-N 3.4Å; A445-R448 PolarHBondContact O-N 2.96Å; A445-A449 PolarHBondContact O-N 3.23Å
446	R	60.2	Low	52.5	Low	171 Å²	171	121.8 Å²	121.8	65%	0.645	65%	0.653	S	S	*	*	H	α-helix	trans	-63.1	-39.8	173.4	-79	-179	168.4	175.7	-4.6	113	S442 A449 Q450	S442-R446 PolarHBondContact O-N 2.87Å; S442-R446 VanDerWaalsContact O-N 3.09Å; R446-A449 PolarHBondContact O-N 3.4Å; R446-Q450 WeakPolarHBondContact O-CG 3.23Å; R446-Q450 PolarHBondContact O-N 3.1Å
447	R	58.1	Low	52.4	Low	190 Å²	190	123.2 Å²	123.2	72%	0.717	66%	0.655	S	S	*	*	H	α-helix	trans	-65.9	-37.2	175	-79.1	-176.4	178.4	-174.8	-0.4	112.7	R443 L444 A451	R443-R447 WeakPolarHBondContact O-CG 3.36Å; R443-R447 PolarHBondContact O-N 3.29Å; R443-R447 VanDerWaalsContact O-N 3.13Å; L444-R447 PolarHBondContact O-N 3.31Å; R447-A451 VanDerWaalsContact O-CB 3.3Å; R447-A451 WeakPolarHBondContact O-CB 3.41Å; R447-A451 PolarHBondContact O-N 3.04Å
448	R	59.8	Low	52.2	Low	172 Å²	172	126 Å²	126	65%	0.649	66%	0.663	S	S	*	*	H	α-helix	trans	-68.1	-40.9	175.8	-73.9	179.3	178	169.6	-0.6	112.3	L444 A445 A451 Q452	L444-R448 WeakPolarHBondContact O-CG 3.38Å; L444-R448 PolarHBondContact O-N 3.14Å; L444-R448 VanDerWaalsContact O-N 3.08Å; A445-R448 PolarHBondContact O-N 2.96Å; R448-A451 PolarHBondContact O-N 2.69Å; R448-Q452 PolarHBondContact O-N 2.9Å; R448-Q452 VanDerWaalsContact O-N 3.16Å
449	A	59.8	Low	51.9	Low	61 Å²	61	134.1 Å²	134.1	50%	0.504	68%	0.684	S	S	.	*	H	α-helix	trans	-65.1	-40.5	175.8	0	0	0	0	0	112.6	A445 R446 Q452 A453	A445-A449 PolarHBondContact O-N 3.23Å; R446-A449 PolarHBondContact O-N 3.4Å; A449-Q452 PolarHBondContact O-N 2.65Å; A449-A453 PolarHBondContact O-N 3.37Å
450	Q	58.7	Low	51.9	Low	148 Å²	148	133.3 Å²	133.3	69%	0.692	68%	0.681	S	S	*	*	H	α-helix	trans	-71.7	-30.1	176.3	-73	175.7	-23.1	0	0	112.9	R446	R446-Q450 WeakPolarHBondContact O-CG 3.23Å; R446-Q450 PolarHBondContact O-N 3.1Å
451	A	55.7	Low	51.8	Low	73 Å²	73	133.9 Å²	133.9	60%	0.603	68%	0.683	S	S	*	*	H	α-helix	trans	-74.2	-24.6	175.3	0	0	0	0	0	113.5	R447 R448	R447-A451 VanDerWaalsContact O-CB 3.3Å; R447-A451 WeakPolarHBondContact O-CB 3.41Å; R447-A451 PolarHBondContact O-N 3.04Å; R448-A451 PolarHBondContact O-N 2.69Å
452	Q	56.9	Low	51.7	Low	166 Å²	166	132.8 Å²	132.8	78%	0.776	69%	0.692	S	S	*	*	H	α-helix	trans	-85.6	-20.6	173.7	-83.5	178.8	-33.2	0	0	113.6	R448 A449 G454	R448-Q452 PolarHBondContact O-N 2.9Å; R448-Q452 VanDerWaalsContact O-N 3.16Å; A449-Q452 PolarHBondContact O-N 2.65Å; Q452-G454 VanDerWaalsContact C-N 3.34Å
453	A	51.4	Low	51.2	Low	85 Å²	85	137.4 Å²	137.4	70%	0.702	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-6.2	175.2	0	0	0	0	0	114.3	A449	A449-A453 PolarHBondContact O-N 3.37Å
454	G	50.4	Low	50.8	Low	65 Å²	65	131.4 Å²	131.4	67%	0.67	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	13.2	-178.2	0	0	0	0	0	115.6	Q452	Q452-G454 VanDerWaalsContact C-N 3.34Å
455	R	53.3	Low	49.8	Very low	238 Å²	238	138.4 Å²	138.4	90%	0.898	75%	0.752	S	S	*	*	S	Bend	trans	-131.9	69.7	175.4	-73.1	-170.5	-179.6	-160.9	0.7	110.7
456	G	45	Very low	49.4	Very low	59 Å²	59	143.1 Å²	143.1	61%	0.608	77%	0.771	S	S	*	*	S	Bend	trans	-169.9	121.1	168.3	0	0	0	0	0	108.1
457	E	40.7	Very low	48.9	Very low	200 Å²	200	141.6 Å²	141.6	94%	0.935	78%	0.777	S	S	*	*			trans	82.3	89.5	174.8	-52	-173.2	142.2	0	0	116.6
458	D	37.9	Very low	48.4	Very low	146 Å²	146	138.9 Å²	138.9	78%	0.781	78%	0.781	S	S	*	*				-162.6	113.9	114	-146.4	-7.5	0	0	0	111.4
459	R	38.3	Very low	47.7	Very low	249 Å²	249	137 Å²	137	94%	0.94	79%	0.789	S	S	*	*			trans	-177.8	93.7	151.3	-102.7	174.1	-169.6	-151.8	1.8	109.4
460	S	45.8	Very low	46.9	Very low	102 Å²	102	141.8 Å²	141.8	71%	0.713	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-72.2	153.4	168.7	-7.7	0	0	0	0	111.4
461	P	44.1	Very low	46.2	Very low	117 Å²	117	141.3 Å²	141.3	76%	0.76	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-88.8	154	168.2	34.1	-29.4	0	0	0	111.9
462	P	48.9	Very low	45.5	Very low	130 Å²	130	146.2 Å²	146.2	84%	0.844	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-88	150.7	-178.3	35.1	-31.5	0	0	0	112.5
463	T	45.6	Very low	44.6	Very low	148 Å²	148	144.7 Å²	144.7	91%	0.908	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-80.3	151.6	177.8	-25.1	0	0	0	0	111.7
464	A	43.1	Very low	44	Very low	93 Å²	93	149.7 Å²	149.7	77%	0.769	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-68.9	140.5	-175.7	0	0	0	0	0	115.2
465	L	35.4	Very low	43.5	Very low	249 Å²	249	157.4 Å²	157.4	100%	1.304	86%	0.86	S	S	*	*				-160.5	0	129	-105.3	166.8	0	0	0	109.6

Retrieved 465 of 465 residues in 167.1 ms (Link to these results)

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