A0A087XMV9_POEFO Loading...

HMG box domain containing 4a

AlphaFold DB , UniProt , Accession A0A087XMV9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 592 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.1	Very low	39.2	Very low	243 Å²	243	168.1 Å²	168.1	100%	1.197	89%	0.889	S	S	*	*				0	108.7	0	-60.7	-169.6	-82.9	0	0	106.8
2	A	42.2	Very low	39.4	Very low	94 Å²	94	167.9 Å²	167.9	78%	0.777	89%	0.889	S	S	*	*			cis	-144.9	140.5	-2.5	0	0	0	0	0	105.1
3	Y	29.1	Very low	39.3	Very low	211 Å²	211	161.1 Å²	161.1	83%	0.827	88%	0.883	S	S	*	*			cis	62.8	119.1	24	-84.4	-77.9	0	0	0	116.3
4	E	41.1	Very low	38.8	Very low	170 Å²	170	154 Å²	154	79%	0.794	87%	0.866	S	S	*	*			trans	83.7	149.5	166.3	-64.8	-57.1	145.9	0	0	121.1
5	E	44.7	Very low	39	Very low	176 Å²	176	155.5 Å²	155.5	82%	0.822	87%	0.869	S	S	*	*			trans	86.4	130.9	162.1	-117.2	170	170.2	0	0	121.5
6	L	42.5	Very low	39.2	Very low	167 Å²	167	155 Å²	155	87%	0.874	87%	0.871	S	S	*	*	S	Bend	trans	80.5	44.9	169	-56.4	175.5	0	0	0	120.2
7	K	37.1	Very low	39.5	Very low	214 Å²	214	152.3 Å²	152.3	93%	0.93	87%	0.873	S	S	*	*	S	Bend	trans	-142.7	27	144.6	-145.8	177.4	178.4	173.1	0	116.5
8	E	38.5	Very low	39.4	Very low	189 Å²	189	147.6 Å²	147.6	88%	0.883	86%	0.863	S	S	*	*			trans	-132.7	83.2	173.6	-167.6	169.4	-138.9	0	0	111.7
9	M	39.3	Very low	39.3	Very low	202 Å²	202	151.2 Å²	151.2	100%	0.995	86%	0.861	S	S	*	*			trans	-164.1	84.5	152.5	-104.3	-172.3	-162.5	0	0	108.1
10	G	31.6	Very low	39.4	Very low	81 Å²	81	149.9 Å²	149.9	84%	0.835	86%	0.862	S	S	*	*			trans	-160	25.2	-177.5	0	0	0	0	0	112.8
11	A	41	Very low	39.5	Very low	102 Å²	102	151.9 Å²	151.9	84%	0.843	86%	0.863	S	S	*	*			trans	-114.9	55.8	-175.7	0	0	0	0	0	111.3
12	D	41.1	Very low	39.2	Very low	166 Å²	166	151.3 Å²	151.3	89%	0.888	85%	0.848	S	S	*	*			trans	-154.8	131.1	146.6	-135.2	-30.3	0	0	0	110.5
13	G	38.7	Very low	39.2	Very low	79 Å²	79	152.9 Å²	152.9	81%	0.814	84%	0.839	S	S	*	*			trans	151.9	9.6	-165.6	0	0	0	0	0	115.7
14	G	32.5	Very low	40.2	Very low	62 Å²	62	152.9 Å²	152.9	64%	0.639	84%	0.843	S	S	*	*			trans	-80.7	157.8	167.1	0	0	0	0	0	112.3
15	L	41.2	Very low	40.8	Very low	176 Å²	176	156.4 Å²	156.4	92%	0.921	85%	0.849	S	S	*	*			trans	79.6	58.7	164.2	-46.9	180	0	0	0	118.9
16	V	43.2	Very low	41.3	Very low	148 Å²	148	153.7 Å²	153.7	90%	0.897	83%	0.832	S	S	*	*			trans	-111.3	-8.4	150.1	138.4	0	0	0	0	114	G18	V16-G18 PolarHBondContact O-N 3.17Å; V16-G18 VanDerWaalsContact O-N 3.08Å
17	A	42.9	Very low	42.4	Very low	109 Å²	109	148.9 Å²	148.9	90%	0.901	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	73.9	171.4	0	0	0	0	0	112.1
18	G	38	Very low	43.2	Very low	68 Å²	68	147.6 Å²	147.6	70%	0.701	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.9	-0.4	-174.4	0	0	0	0	0	120.3	V16	V16-G18 PolarHBondContact O-N 3.17Å; V16-G18 VanDerWaalsContact O-N 3.08Å
19	R	37.4	Very low	44.3	Very low	215 Å²	215	146 Å²	146	81%	0.811	79%	0.793	S	S	*	*			trans	-92.2	-14.2	-174.9	-71.5	-168.9	178.2	-170.5	1.3	116.4	Q21	R19-Q21 VanDerWaalsContact C-N 3.29Å; R19-Q21 PolarHBondContact O-N 3.03Å; R19-Q21 VanDerWaalsContact O-N 3.12Å
20	S	42.5	Very low	45.9	Very low	126 Å²	126	140.1 Å²	140.1	88%	0.881	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-14.9	-170	-164.1	0	0	0	0	116.1
21	Q	40.1	Very low	47.9	Very low	191 Å²	191	141 Å²	141	89%	0.893	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	3.6	-173.9	-149.6	173.2	-2.9	0	0	116	R19	R19-Q21 VanDerWaalsContact C-N 3.29Å; R19-Q21 PolarHBondContact O-N 3.03Å; R19-Q21 VanDerWaalsContact O-N 3.12Å
22	R	38.9	Very low	49.5	Very low	231 Å²	231	139.9 Å²	139.9	87%	0.872	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-10.9	176.1	-173.4	170.9	-98.2	-135.2	1.3	114.1	K24	R22-K24 PolarHBondContact O-N 2.98Å
23	E	42.4	Very low	51.3	Low	127 Å²	127	139.6 Å²	139.6	59%	0.593	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-80.1	-15.2	-168.9	-162.9	152.3	-129	0	0	115.2	R25 R26	E23-R25 PolarHBondContact O-N 3.48Å; E23-R26 PolarHBondContact O-N 3.2Å; E23-R26 IonicContact OE1-NH1 3.1Å
24	K	50	Low	53.1	Low	211 Å²	211	138.4 Å²	138.4	92%	0.917	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-67.1	0.4	-170.9	-86.6	179.7	176.3	171.2	0	116.9	R22	R22-K24 PolarHBondContact O-N 2.98Å
25	R	52.9	Low	55.2	Low	244 Å²	244	141.3 Å²	141.3	92%	0.921	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-143.8	40.8	170.8	-56.9	-155.2	83.6	-177.3	3	115.2	E23	E23-R25 PolarHBondContact O-N 3.48Å
26	R	55.3	Low	57.2	Low	120 Å²	120	139.9 Å²	139.9	45%	0.453	68%	0.675	S	S	.	*			trans	-72.6	138.7	165.3	-82.8	178.8	162.2	-173.8	-20.6	111.1	E23 E34	E23-R26 PolarHBondContact O-N 3.2Å; E23-R26 IonicContact OE1-NH1 3.1Å; R26-E34 IonicContact CZ-OE1 2.66Å; R26-E34 VanDerWaalsContact CZ-OE1 3.24Å; R26-E34 IonicContact CZ-OE2 3.35Å; R26-E34 IonicContact NH1-OE1 2.68Å; R26-E34 PolarHBondContact NH1-OE1 3.42Å; R26-E34 IonicContact NH1-OE2 3.58Å; R26-E34 PolarHBondContact NH1-OE2 3.11Å; R26-E34 IonicContact NH2-OE1 3.87Å; R26-E34 PolarHBondContact NH2-OE1 3.35Å; R26-E34 IonicContact NH2-OE2 2.67Å
27	S	66	Low	59	Low	66 Å²	66	139.1 Å²	139.1	46%	0.462	66%	0.661	S	S	.	*			trans	-78.6	149.8	175.7	-174.9	0	0	0	0	110.2	K29 D30 L31	S27-K29 PolarHBondContact O-N 3.03Å; S27-D30 VanDerWaalsContact CB-OD2 3.25Å; S27-D30 WeakPolarHBondContact CB-OD2 3.48Å; S27-D30 PolarHBondContact N-OD2 3.21Å; S27-D30 VanDerWaalsContact N-OD2 3.11Å; S27-D30 WeakPolarHBondContact O-CB 3.49Å; S27-D30 PolarHBondContact O-N 3.18Å; S27-L31 PolarHBondContact O-N 3.43Å
28	Y	53.2	Low	61	Low	187 Å²	187	139 Å²	139	73%	0.733	64%	0.644	S	S	*	*	H	α-helix	trans	-54.3	-28.7	173.5	-176.9	-102.6	0	0	0	112.5	L32	Y28-L32 HydrophobicContact CD1-CD1 3.92Å; Y28-L32 HydrophobicContact CE1-CD1 3.39Å; Y28-L32 HydrophobicContact CE1-CG 4.44Å; Y28-L32 PolarHBondContact O-N 2.89Å
29	K	62.1	Low	62.9	Low	156 Å²	156	137.3 Å²	137.3	68%	0.678	62%	0.624	S	S	*	*	H	α-helix	trans	-75.4	-20.5	177.7	-155.8	177.6	-175.9	-177.5	0	114	S27	S27-K29 PolarHBondContact O-N 3.03Å
30	D	73.9	Confident	64.8	Low	77 Å²	77	129 Å²	129	41%	0.412	60%	0.601	S	S	.	*	H	α-helix	trans	-85	-39.6	174.9	-53.1	-38.3	0	0	0	110	S27 L32 R33 E34	S27-D30 VanDerWaalsContact CB-OD2 3.25Å; S27-D30 WeakPolarHBondContact CB-OD2 3.48Å; S27-D30 PolarHBondContact N-OD2 3.21Å; S27-D30 VanDerWaalsContact N-OD2 3.11Å; S27-D30 WeakPolarHBondContact O-CB 3.49Å; S27-D30 PolarHBondContact O-N 3.18Å; D30-L32 PolarHBondContact O-N 2.89Å; D30-R33 WeakPolarHBondContact O-CB 3.43Å; D30-R33 PolarHBondContact O-N 2.76Å; D30-E34 PolarHBondContact O-N 2.97Å
31	L	73.6	Confident	66.4	Low	99 Å²	99	127.8 Å²	127.8	52%	0.518	58%	0.582	S	S	.	*	H	α-helix	trans	-62.1	-42.6	178	-139.4	162.1	0	0	0	111.5	S27 R33 E34 E35	S27-L31 PolarHBondContact O-N 3.43Å; L31-R33 VanDerWaalsContact C-N 3.29Å; L31-R33 PolarHBondContact O-N 3.2Å; L31-E34 PolarHBondContact O-N 3.39Å; L31-E35 WeakPolarHBondContact O-CB 3.37Å; L31-E35 PolarHBondContact O-N 2.95Å
32	L	73.1	Confident	67.8	Low	80 Å²	80	122.7 Å²	122.7	42%	0.419	56%	0.564	S	S	.	*	H	α-helix	trans	-61.7	-32.3	171.8	-100	161.1	0	0	0	113.8	Y28 D30 E36	Y28-L32 HydrophobicContact CD1-CD1 3.92Å; Y28-L32 HydrophobicContact CE1-CD1 3.39Å; Y28-L32 HydrophobicContact CE1-CG 4.44Å; Y28-L32 PolarHBondContact O-N 2.89Å; D30-L32 PolarHBondContact O-N 2.89Å; L32-E36 WeakPolarHBondContact O-CB 3.43Å; L32-E36 PolarHBondContact O-N 3.45Å; L32-E36 VanDerWaalsContact O-N 3.07Å
33	R	78.5	Confident	69.2	Low	159 Å²	159	120.3 Å²	120.3	60%	0.6	56%	0.555	S	S	*	*	H	α-helix	trans	-76.3	-40.2	178.2	-170.4	-174.8	-57.9	-151.5	-0.4	111.2	D30 L31 E35 E36 E37	D30-R33 WeakPolarHBondContact O-CB 3.43Å; D30-R33 PolarHBondContact O-N 2.76Å; L31-R33 VanDerWaalsContact C-N 3.29Å; L31-R33 PolarHBondContact O-N 3.2Å; R33-E35 VanDerWaalsContact C-N 3.33Å; R33-E36 PolarHBondContact O-N 2.91Å; R33-E37 VanDerWaalsContact O-CB 3.29Å; R33-E37 WeakPolarHBondContact O-CB 3.38Å; R33-E37 PolarHBondContact O-N 3.22Å
34	E	78.1	Confident	70.4	Confident	55 Å²	55	120.1 Å²	120.1	26%	0.257	55%	0.552	S	S	.	*	H	α-helix	trans	-64.4	-38.8	174.8	-163.9	166.1	-141.4	0	0	110.6	R26 D30 L31 E37 I38	R26-E34 IonicContact CZ-OE1 2.66Å; R26-E34 VanDerWaalsContact CZ-OE1 3.24Å; R26-E34 IonicContact CZ-OE2 3.35Å; R26-E34 IonicContact NH1-OE1 2.68Å; R26-E34 PolarHBondContact NH1-OE1 3.42Å; R26-E34 IonicContact NH1-OE2 3.58Å; R26-E34 PolarHBondContact NH1-OE2 3.11Å; R26-E34 IonicContact NH2-OE1 3.87Å; R26-E34 PolarHBondContact NH2-OE1 3.35Å; R26-E34 IonicContact NH2-OE2 2.67Å; D30-E34 PolarHBondContact O-N 2.97Å; L31-E34 PolarHBondContact O-N 3.39Å; E34-E37 PolarHBondContact O-N 3.36Å; E34-I38 HydrophobicContact CG-CD1 4.33Å; E34-I38 WeakPolarHBondContact O-CB 3.46Å; E34-I38 WeakPolarHBondContact O-CD1 3.35Å; E34-I38 WeakPolarHBondContact O-CG1 3.33Å; E34-I38 PolarHBondContact O-N 2.87Å
35	E	76.1	Confident	70.7	Confident	123 Å²	123	113.5 Å²	113.5	58%	0.575	53%	0.532	S	S	*	.	H	α-helix	trans	-63.4	-44.7	171.7	-172.9	177	-164.3	0	0	112.5	L31 R33 A39	L31-E35 WeakPolarHBondContact O-CB 3.37Å; L31-E35 PolarHBondContact O-N 2.95Å; R33-E35 VanDerWaalsContact C-N 3.33Å; E35-A39 VanDerWaalsContact O-CB 3.27Å; E35-A39 WeakPolarHBondContact O-CB 3.33Å; E35-A39 PolarHBondContact O-N 2.81Å
36	E	82.6	Confident	70.6	Confident	146 Å²	146	106.6 Å²	106.6	68%	0.682	52%	0.521	S	S	*	.	H	α-helix	trans	-64.7	-38.8	175.5	-173.7	172.7	-158.4	0	0	112.3	L32 R33 A39 A40	L32-E36 WeakPolarHBondContact O-CB 3.43Å; L32-E36 PolarHBondContact O-N 3.45Å; L32-E36 VanDerWaalsContact O-N 3.07Å; R33-E36 PolarHBondContact O-N 2.91Å; E36-A39 PolarHBondContact O-N 2.78Å; E36-A40 WeakPolarHBondContact O-CB 3.32Å; E36-A40 PolarHBondContact O-N 2.97Å
37	E	82.1	Confident	70.2	Confident	131 Å²	131	109.8 Å²	109.8	61%	0.612	54%	0.539	S	S	*	.	H	α-helix	trans	-66.8	-45.7	177.2	-174	168.9	-167.1	0	0	111.8	R33 E34 A39 A40 E41	R33-E37 VanDerWaalsContact O-CB 3.29Å; R33-E37 WeakPolarHBondContact O-CB 3.38Å; R33-E37 PolarHBondContact O-N 3.22Å; E34-E37 PolarHBondContact O-N 3.36Å; E37-A39 VanDerWaalsContact C-N 3.33Å; E37-A39 PolarHBondContact O-N 3.15Å; E37-A40 WeakPolarHBondContact O-CB 3.38Å; E37-A40 PolarHBondContact O-N 3.17Å; E37-A40 VanDerWaalsContact O-N 3.15Å; E37-E41 PolarHBondContact O-N 3.36Å
38	I	83.3	Confident	69.5	Low	106 Å²	106	115.3 Å²	115.3	54%	0.544	55%	0.554	S	S	.	*	H	α-helix	trans	-60.4	-44.1	172.8	-67.9	162.3	0	0	0	110.3	E34 A40 E41 V42	E34-I38 HydrophobicContact CG-CD1 4.33Å; E34-I38 WeakPolarHBondContact O-CB 3.46Å; E34-I38 WeakPolarHBondContact O-CD1 3.35Å; E34-I38 WeakPolarHBondContact O-CG1 3.33Å; E34-I38 PolarHBondContact O-N 2.87Å; I38-A40 VanDerWaalsContact C-N 3.27Å; I38-A40 PolarHBondContact O-N 3.49Å; I38-E41 PolarHBondContact O-N 3.43Å; I38-V42 HydrophobicContact CG2-CG2 4.49Å; I38-V42 WeakPolarHBondContact O-CG2 3.2Å; I38-V42 PolarHBondContact O-N 2.87Å
39	A	79.5	Confident	68.8	Low	34 Å²	34	118 Å²	118	28%	0.281	56%	0.563	S	S	.	*	H	α-helix	trans	-67.8	-25.2	177.9	0	0	0	0	0	113	E35 E36 E37 R43	E35-A39 VanDerWaalsContact O-CB 3.27Å; E35-A39 WeakPolarHBondContact O-CB 3.33Å; E35-A39 PolarHBondContact O-N 2.81Å; E36-A39 PolarHBondContact O-N 2.78Å; E37-A39 VanDerWaalsContact C-N 3.33Å; E37-A39 PolarHBondContact O-N 3.15Å; A39-R43 WeakPolarHBondContact O-CG 3.25Å; A39-R43 PolarHBondContact O-NH1 3.13Å
40	A	77.4	Confident	67.8	Low	39 Å²	39	116.1 Å²	116.1	32%	0.322	57%	0.567	S	S	.	*	H	α-helix	trans	-75	-40.6	170	0	0	0	0	0	111.4	E36 E37 I38 R43 K44	E36-A40 WeakPolarHBondContact O-CB 3.32Å; E36-A40 PolarHBondContact O-N 2.97Å; E37-A40 WeakPolarHBondContact O-CB 3.38Å; E37-A40 PolarHBondContact O-N 3.17Å; E37-A40 VanDerWaalsContact O-N 3.15Å; I38-A40 VanDerWaalsContact C-N 3.27Å; I38-A40 PolarHBondContact O-N 3.49Å; A40-R43 PolarHBondContact O-N 2.84Å; A40-K44 WeakPolarHBondContact O-CG 3.24Å; A40-K44 PolarHBondContact O-N 3.07Å
41	E	74.7	Confident	66.4	Low	101 Å²	101	122 Å²	122	47%	0.472	59%	0.588	S	S	.	*	H	α-helix	trans	-69.5	-37.8	-178.7	-152.8	53.8	-134.4	0	0	112.5	E37 I38 R43 K44 S45	E37-E41 PolarHBondContact O-N 3.36Å; I38-E41 PolarHBondContact O-N 3.43Å; E41-R43 VanDerWaalsContact C-N 3.29Å; E41-R43 PolarHBondContact O-N 3.4Å; E41-K44 PolarHBondContact O-N 2.79Å; E41-K44 WeakPolarHBondContact OE2-CD 3.45Å; E41-K44 IonicContact OE2-NZ 3.09Å; E41-K44 PolarHBondContact OE2-NZ 2.96Å; E41-S45 WeakPolarHBondContact O-CB 3.37Å; E41-S45 PolarHBondContact O-N 3.38Å; E41-S45 PolarHBondContact O-OG 2.93Å
42	V	69.1	Low	64.6	Low	85 Å²	85	125 Å²	125	52%	0.515	61%	0.605	S	S	.	*	H	α-helix	trans	-61.6	-35.5	170.8	172.3	0	0	0	0	112	I38 S45 S46	I38-V42 HydrophobicContact CG2-CG2 4.49Å; I38-V42 WeakPolarHBondContact O-CG2 3.2Å; I38-V42 PolarHBondContact O-N 2.87Å; V42-S45 WeakPolarHBondContact CA-OG 3.19Å; V42-S45 PolarHBondContact O-OG 3.44Å; V42-S46 WeakPolarHBondContact O-CB 3.45Å; V42-S46 PolarHBondContact O-N 3.39Å; V42-S46 PolarHBondContact O-OG 3.07Å
43	R	69.9	Low	62.9	Low	180 Å²	180	126.9 Å²	126.9	68%	0.679	63%	0.625	S	S	*	*	H	α-helix	trans	-74.6	-31.7	175.7	-72.4	179.5	-174.7	100.9	-9.1	112.9	A39 A40 E41	A39-R43 WeakPolarHBondContact O-CG 3.25Å; A39-R43 PolarHBondContact O-NH1 3.13Å; A40-R43 PolarHBondContact O-N 2.84Å; E41-R43 VanDerWaalsContact C-N 3.29Å; E41-R43 PolarHBondContact O-N 3.4Å
44	K	66.3	Low	61	Low	124 Å²	124	128.5 Å²	128.5	54%	0.539	64%	0.639	S	S	.	*	H	α-helix	trans	-73	-46.4	174.3	-71.1	173	-166.3	161.5	0	112.1	A40 E41 S46 K47	A40-K44 WeakPolarHBondContact O-CG 3.24Å; A40-K44 PolarHBondContact O-N 3.07Å; E41-K44 PolarHBondContact O-N 2.79Å; E41-K44 WeakPolarHBondContact OE2-CD 3.45Å; E41-K44 IonicContact OE2-NZ 3.09Å; E41-K44 PolarHBondContact OE2-NZ 2.96Å; K44-S46 VanDerWaalsContact C-N 3.31Å; K44-S46 PolarHBondContact O-N 2.95Å; K44-K47 PolarHBondContact O-N 3.33Å
45	S	56.6	Low	59	Low	72 Å²	72	133.8 Å²	133.8	50%	0.503	67%	0.669	S	S	.	*	H	α-helix	trans	-63.9	-36.6	179.7	58.7	0	0	0	0	112	E41 V42 K47 K48	E41-S45 WeakPolarHBondContact O-CB 3.37Å; E41-S45 PolarHBondContact O-N 3.38Å; E41-S45 PolarHBondContact O-OG 2.93Å; V42-S45 WeakPolarHBondContact CA-OG 3.19Å; V42-S45 PolarHBondContact O-OG 3.44Å; S45-K47 PolarHBondContact O-N 2.86Å; S45-K48 PolarHBondContact O-N 3.38Å; S45-K48 VanDerWaalsContact O-N 3.17Å
46	S	50.5	Low	56.9	Low	99 Å²	99	137.5 Å²	137.5	69%	0.692	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-12.4	171.1	-61.2	0	0	0	0	114.5	V42 K44	V42-S46 WeakPolarHBondContact O-CB 3.45Å; V42-S46 PolarHBondContact O-N 3.39Å; V42-S46 PolarHBondContact O-OG 3.07Å; K44-S46 VanDerWaalsContact C-N 3.31Å; K44-S46 PolarHBondContact O-N 2.95Å
47	K	47.7	Very low	54.8	Low	187 Å²	187	138.5 Å²	138.5	81%	0.813	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	1.4	-179.8	-154.9	157.9	-174.9	170.9	0	114.1	K44 S45	K44-K47 PolarHBondContact O-N 3.33Å; S45-K47 PolarHBondContact O-N 2.86Å
48	K	52	Low	52.6	Low	181 Å²	181	141.1 Å²	141.1	79%	0.787	71%	0.707	S	S	*	*			trans	-120	88.3	170.1	-85.7	-171.7	172.4	-176.2	0	110.9	S45	S45-K48 PolarHBondContact O-N 3.38Å; S45-K48 VanDerWaalsContact O-N 3.17Å
49	R	38.8	Very low	50	Low	244 Å²	244	140 Å²	140	92%	0.921	72%	0.722	S	S	*	*			trans	-118.9	110.3	151.6	-83.5	-160.9	157.9	-155.2	-8.4	109.2
50	P	40.1	Very low	47.7	Very low	116 Å²	116	141.9 Å²	141.9	75%	0.753	74%	0.744	S	S	*	*			trans	-71.9	149.5	160.3	1	16.2	0	0	0	109.4
51	K	44.5	Very low	45.6	Very low	200 Å²	200	146.1 Å²	146.1	87%	0.87	76%	0.762	S	S	*	*			trans	-77	121.8	161.1	-67.2	166.2	171.9	178.5	0	106.9
52	D	35.9	Very low	43.6	Very low	162 Å²	162	149.7 Å²	149.7	87%	0.866	78%	0.783	S	S	*	*			trans	-173.7	86	158.5	-91.1	-31	0	0	0	108.8
53	S	37.6	Very low	42	Very low	120 Å²	120	153.3 Å²	153.3	84%	0.839	79%	0.794	S	S	*	*			trans	-164.8	30.4	168.6	62.9	0	0	0	0	113.8
54	E	37.5	Very low	40.2	Very low	193 Å²	193	153.7 Å²	153.7	90%	0.902	80%	0.801	S	S	*	*			trans	-120.3	60.8	163.8	-77.5	-160.2	162.6	0	0	109.9
55	L	36.6	Very low	38.8	Very low	167 Å²	167	156.8 Å²	156.8	87%	0.874	81%	0.814	S	S	*	*	S	Bend	trans	-151	45.9	168.5	-158.4	72.6	0	0	0	112.7
56	F	33.4	Very low	37.8	Very low	200 Å²	200	162.2 Å²	162.2	88%	0.877	83%	0.829	S	S	*	*	S	Bend	trans	-157.1	157.2	158.7	-135.9	-105.9	0	0	0	108.5
57	M	37.2	Very low	37	Very low	167 Å²	167	165.4 Å²	165.4	82%	0.823	83%	0.83	S	S	*	*	S	Bend	trans	78.6	52.6	-176.4	-50.9	-59.7	-67	0	0	117.3
58	L	35.9	Very low	36.4	Very low	186 Å²	186	164.6 Å²	164.6	97%	0.974	83%	0.826	S	S	*	*			trans	-155.5	90.7	146.1	-108.6	169	0	0	0	109.9
59	G	28.4	Very low	35.4	Very low	84 Å²	84	163.5 Å²	163.5	87%	0.866	82%	0.824	S	S	*	*			trans	-147	107.4	176.7	0	0	0	0	0	110.1
60	G	31.8	Very low	35	Very low	72 Å²	72	156 Å²	156	74%	0.742	81%	0.808	S	S	*	*			trans	177.4	90.9	-175.8	0	0	0	0	0	111.5
61	D	33.3	Very low	34.6	Very low	129 Å²	129	157 Å²	157	69%	0.69	81%	0.808	S	S	*	*			trans	40	120.7	161.9	-86.8	-76.1	0	0	0	121.8	H63	D61-H63 IonicContact OD1-CD2 3.6Å; D61-H63 IonicContact OD1-NE2 3.95Å
62	L	33.7	Very low	34	Very low	176 Å²	176	153 Å²	153	92%	0.921	80%	0.796	S	S	*	*				-155	110.6	126.5	-135.7	83.2	0	0	0	112.4
63	H	34.2	Very low	34	Very low	161 Å²	161	152.1 Å²	152.1	75%	0.745	79%	0.786	S	S	*	*			trans	-75.3	122.7	168.7	-71.1	-89.1	0	0	0	111.7	D61	D61-H63 IonicContact OD1-CD2 3.6Å; D61-H63 IonicContact OD1-NE2 3.95Å
64	K	33.5	Very low	33.9	Very low	188 Å²	188	156 Å²	156	82%	0.817	78%	0.784	S	S	*	*				171.8	133.5	121.8	-94.1	157.5	-172.9	169.2	0	115.5
65	K	36	Very low	33.6	Very low	189 Å²	189	155.5 Å²	155.5	82%	0.822	78%	0.775	S	S	*	*			trans	72	122.4	143.8	-71.8	-179.6	174.7	177.7	0	121.1
66	K	35.2	Very low	33.4	Very low	186 Å²	186	154.6 Å²	154.6	81%	0.809	76%	0.76	S	S	*	*			trans	82.6	105.5	135.2	-92.1	-170.2	169.3	176.6	0	119.8
67	K	33.4	Very low	33.4	Very low	166 Å²	166	150.4 Å²	150.4	72%	0.722	75%	0.747	S	S	*	*				110.4	108.5	98.7	-169.6	-178.1	177.7	-171.7	0	117.1
68	K	35.2	Very low	33.4	Very low	169 Å²	169	149.6 Å²	149.6	74%	0.735	74%	0.741	S	S	*	*			trans	75.2	124.3	150.8	-78	-160.6	170.3	-152.4	0	117
69	H	30.9	Very low	33.4	Very low	159 Å²	159	147.8 Å²	147.8	74%	0.736	73%	0.732	S	S	*	*				81.6	126.4	81.6	-150	-70.8	0	0	0	108.5
70	S	31	Very low	33.5	Very low	85 Å²	85	146.9 Å²	146.9	59%	0.594	72%	0.723	S	S	*	*			cis	-142.5	163.2	25.2	-119.9	0	0	0	0	109.1
71	D	31.5	Very low	33.7	Very low	138 Å²	138	152 Å²	152	74%	0.738	73%	0.733	S	S	*	*				57.9	123.2	76.1	-135.8	-97.7	0	0	0	110.5
72	D	33.1	Very low	33.6	Very low	117 Å²	117	149.3 Å²	149.3	63%	0.626	74%	0.735	S	S	*	*			cis	-162.3	-173.2	5.7	-143.7	7	0	0	0	113.1
73	H	35.2	Very low	34.1	Very low	142 Å²	142	147 Å²	147	66%	0.657	73%	0.73	S	S	*	*			trans	-30.8	175.3	171.4	-55	-70.4	0	0	0	120.8
74	Y	35.1	Very low	35	Very low	202 Å²	202	144.6 Å²	144.6	79%	0.792	73%	0.729	S	S	*	*			cis	-151.1	135.2	19.7	-108.2	-92	0	0	0	108.7
75	Y	31.7	Very low	35.7	Very low	182 Å²	182	140.1 Å²	140.1	71%	0.714	72%	0.719	S	S	*	*				71.4	124.3	96.7	-155.1	-112.3	0	0	0	120.7
76	R	32.6	Very low	35.5	Very low	148 Å²	148	138 Å²	138	56%	0.558	71%	0.712	S	S	*	*			trans	67.7	126.8	153.3	-94.5	-157	-173.8	-108	27	125.4
77	D	32.1	Very low	35.3	Very low	112 Å²	112	136.9 Å²	136.9	60%	0.599	71%	0.707	S	S	*	*				26.6	135.4	116	-43.2	-21.7	0	0	0	119.2
78	H	38.2	Very low	35.2	Very low	150 Å²	150	138.4 Å²	138.4	69%	0.694	71%	0.714	S	S	*	*				-166.5	156.7	64.1	-107	-83.6	0	0	0	114.4
79	D	35	Very low	35	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	72%	0.715	S	S	*	*			trans	52.5	142.5	149.2	-70.8	-56.4	0	0	0	123.7
80	G	30.5	Very low	35.1	Very low	66 Å²	66	139 Å²	139	68%	0.68	72%	0.716	S	S	*	*			trans	144.1	84.7	140.8	0	0	0	0	0	119.3
81	L	37.1	Very low	35	Very low	180 Å²	180	142.9 Å²	142.9	94%	0.942	72%	0.722	S	S	*	*			trans	49.4	122.4	137.9	-51.2	173.3	0	0	0	120.7
82	G	30	Very low	34.9	Very low	72 Å²	72	140.7 Å²	140.7	74%	0.742	72%	0.718	S	S	*	*			trans	-93.3	-157.9	161.3	0	0	0	0	0	113
83	P	44.8	Very low	34.8	Very low	127 Å²	127	141.4 Å²	141.4	83%	0.825	73%	0.727	S	S	*	*			cis	-129.2	-125.5	-7.1	27	-0.2	0	0	0	113.4
84	P	53.8	Low	34.5	Very low	111 Å²	111	142.6 Å²	142.6	72%	0.721	73%	0.732	S	S	*	*				-107.2	-151.8	-125.8	42.2	-22.3	0	0	0	111.6
85	P	47.9	Very low	34.2	Very low	93 Å²	93	144.4 Å²	144.4	60%	0.604	74%	0.738	S	S	*	*			cis	-144.3	-172	0.3	28.6	-0.8	0	0	0	117.7
86	H	31.2	Very low	34.1	Very low	145 Å²	145	141 Å²	141	67%	0.671	74%	0.74	S	S	*	*			trans	98.7	111	145.5	-68.2	-36	0	0	0	123.4
87	K	30.7	Very low	35.1	Very low	163 Å²	163	139.4 Å²	139.4	71%	0.709	75%	0.749	S	S	*	*				84	131.3	120.9	-72.7	174.4	-177.6	166.9	0	120.8
88	K	32.8	Very low	35.5	Very low	197 Å²	197	139.9 Å²	139.9	86%	0.857	76%	0.759	S	S	*	*			trans	76.4	154.6	156.7	-64.9	166.6	-177.8	178.4	0	116.5
89	K	29.9	Very low	35.2	Very low	177 Å²	177	140.5 Å²	140.5	77%	0.77	77%	0.766	S	S	*	*			cis	179	127.7	-25.4	-176.1	-170.5	-173.5	-172.4	0	106.4
90	H	32.2	Very low	34.9	Very low	163 Å²	163	139.4 Å²	139.4	76%	0.755	77%	0.77	S	S	*	*			trans	139.4	164	161.3	-91.5	-130.4	0	0	0	110.9
91	K	30.7	Very low	34.9	Very low	167 Å²	167	141.8 Å²	141.8	73%	0.726	78%	0.776	S	S	*	*			cis	176.3	141.2	-40.5	172.2	169.8	178.9	-175.2	0	107.5
92	S	28.7	Very low	34.8	Very low	92 Å²	92	139 Å²	139	64%	0.643	77%	0.769	S	S	*	*			trans	81.1	136.3	159.6	-81.2	0	0	0	0	121.3
93	V	30.6	Very low	34.9	Very low	133 Å²	133	141.9 Å²	141.9	81%	0.806	78%	0.778	S	S	*	*			trans	71.5	139.6	137.9	167.7	0	0	0	0	117.3
94	E	28.4	Very low	34.5	Very low	167 Å²	167	139.4 Å²	139.4	78%	0.78	76%	0.763	S	S	*	*			cis	-174.7	134	-18.3	171.3	-173.8	-132.7	0	0	106.3
95	R	30.1	Very low	33.8	Very low	239 Å²	239	139.7 Å²	139.7	90%	0.902	77%	0.768	S	S	*	*			trans	164.2	145.5	146.6	-98.3	169.8	166.4	160.8	-3.9	113.6
96	S	29.6	Very low	33.7	Very low	110 Å²	110	141.2 Å²	141.2	77%	0.769	77%	0.767	S	S	*	*			trans	-134.4	171.3	163	-54	0	0	0	0	107.6
97	P	53.3	Low	34.7	Very low	115 Å²	115	139.1 Å²	139.1	75%	0.747	77%	0.766	S	S	*	*			cis	-119	-163.5	-36.7	35.1	-16.6	0	0	0	109.9
98	P	40.4	Very low	35.5	Very low	123 Å²	123	133.7 Å²	133.7	80%	0.799	75%	0.752	S	S	*	*				-145.4	169	86.4	37.6	-19.5	0	0	0	116.8
99	L	31	Very low	36.4	Very low	163 Å²	163	131 Å²	131	85%	0.853	75%	0.746	S	S	*	*			trans	-42.5	143.3	176.1	-56.5	156	0	0	0	117.2
100	S	28.5	Very low	38.4	Very low	124 Å²	124	126.7 Å²	126.7	87%	0.867	74%	0.735	S	S	*	*				-176.3	145.3	124.2	-78.7	0	0	0	0	113.4
101	S	30.4	Very low	39.3	Very low	117 Å²	117	122.3 Å²	122.3	82%	0.818	73%	0.727	S	S	*	*			trans	-50	148	-166.4	-43.8	0	0	0	0	120
102	P	36.3	Very low	40.7	Very low	120 Å²	120	120.7 Å²	120.7	78%	0.779	72%	0.724	S	S	*	*			trans	-89.7	134.8	154.2	34.6	-28	0	0	0	111.3
103	S	32.7	Very low	42.5	Very low	133 Å²	133	116.9 Å²	116.9	93%	0.93	70%	0.7	S	S	*	*			trans	-87	115.1	162.3	-177.6	0	0	0	0	108.7
104	S	36	Very low	44.2	Very low	75 Å²	75	114.4 Å²	114.4	52%	0.524	68%	0.681	S	S	.	*			trans	-123.7	108.5	171.3	61.1	0	0	0	0	110.1	H106	S104-H106 PolarHBondContact O-CD2 3.36Å; S104-H106 PolarHBondContact O-N 3.32Å
105	S	38.4	Very low	45.5	Very low	117 Å²	117	110.3 Å²	110.3	82%	0.818	66%	0.664	S	S	*	*			trans	-59.4	116.5	164.3	51.8	0	0	0	0	109.1
106	H	46.8	Very low	47	Very low	125 Å²	125	105.3 Å²	105.3	58%	0.579	65%	0.651	S	S	*	*			trans	-72.6	141.9	179.6	-75	-90.9	0	0	0	110.3	S104 A108	S104-H106 PolarHBondContact O-CD2 3.36Å; S104-H106 PolarHBondContact O-N 3.32Å; H106-A108 HydrophobicContact CB-CB 4.46Å; H106-A108 PolarHBondContact O-N 3.11Å; H106-A108 VanDerWaalsContact O-N 3.11Å
107	P	51.3	Low	48.5	Very low	102 Å²	102	103.2 Å²	103.2	66%	0.662	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-67.1	-9.4	175.2	27.8	-34.6	0	0	0	113.2	D109 G113	P107-D109 VanDerWaalsContact C-N 3.28Å; P107-D109 PolarHBondContact O-N 3.11Å; P107-G113 WeakPolarHBondContact O-CA 3.27Å
108	A	48.1	Very low	48.7	Very low	48 Å²	48	101 Å²	101	40%	0.397	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-67.4	-20.7	-178.6	0	0	0	0	0	114.3	H106 T110 L114	H106-A108 HydrophobicContact CB-CB 4.46Å; H106-A108 PolarHBondContact O-N 3.11Å; H106-A108 VanDerWaalsContact O-N 3.11Å; A108-T110 VanDerWaalsContact C-N 3.3Å; A108-T110 PolarHBondContact O-N 3.09Å; A108-L114 WeakPolarHBondContact O-CD2 3.39Å; A108-L114 VanDerWaalsContact O-CG 3.25Å; A108-L114 WeakPolarHBondContact O-CG 3.16Å
109	D	51.1	Low	49.3	Very low	140 Å²	140	99.5 Å²	99.5	75%	0.749	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-82.9	-5.8	-175.1	-59	-41.4	0	0	0	113.7	P107	P107-D109 VanDerWaalsContact C-N 3.28Å; P107-D109 PolarHBondContact O-N 3.11Å
110	T	72.4	Confident	50	Low	88 Å²	88	94.6 Å²	94.6	54%	0.54	59%	0.593	S	S	.	*	S	Bend	trans	-100.2	137.7	176.2	-54.7	0	0	0	0	110.2	A108 M112 G113 L114	A108-T110 VanDerWaalsContact C-N 3.3Å; A108-T110 PolarHBondContact O-N 3.09Å; T110-M112 HydrophobicContact CG2-CB 4.3Å; T110-M112 PolarHBondContact O-N 3.12Å; T110-M112 VanDerWaalsContact O-N 3.13Å; T110-G113 CarbonylContact O-C 3.59Å; T110-G113 WeakPolarHBondContact O-CA 3.44Å; T110-G113 PolarHBondContact O-N 3Å; T110-L114 PolarHBondContact O-N 3Å
111	A	49.4	Very low	51.2	Low	71 Å²	71	94.7 Å²	94.7	59%	0.587	59%	0.591	S	S	*	*	H	α-helix	trans	-52.1	-39.1	178.9	0	0	0	0	0	113.5	G113 L114 L115	A111-G113 PolarHBondContact O-N 2.89Å; A111-L114 PolarHBondContact O-N 3.2Å; A111-L115 WeakPolarHBondContact O-CG 3.29Å; A111-L115 PolarHBondContact O-N 3.23Å
112	M	61.3	Low	51.7	Low	132 Å²	132	97.9 Å²	97.9	65%	0.65	60%	0.595	S	S	*	*	H	α-helix	trans	-64	-35.8	172.9	-72.3	-60.8	-61.2	0	0	113.4	T110 L115 Q116	T110-M112 HydrophobicContact CG2-CB 4.3Å; T110-M112 PolarHBondContact O-N 3.12Å; T110-M112 VanDerWaalsContact O-N 3.13Å; M112-L115 PolarHBondContact O-N 3.18Å; M112-L115 HydrophobicContact SD-CD1 4.4Å; M112-Q116 VanDerWaalsContact O-CB 3.24Å; M112-Q116 WeakPolarHBondContact O-CB 3.45Å; M112-Q116 PolarHBondContact O-N 3.49Å
113	G	67.3	Low	51.6	Low	13 Å²	13	96.2 Å²	96.2	13%	0.134	59%	0.592	C	S	.	*	H	α-helix	trans	-74.3	-34.1	177.2	0	0	0	0	0	113	P107 T110 A111 Q116 A117	P107-G113 WeakPolarHBondContact O-CA 3.27Å; T110-G113 CarbonylContact O-C 3.59Å; T110-G113 WeakPolarHBondContact O-CA 3.44Å; T110-G113 PolarHBondContact O-N 3Å; A111-G113 PolarHBondContact O-N 2.89Å; G113-Q116 PolarHBondContact O-N 2.74Å; G113-A117 WeakPolarHBondContact O-CB 3.38Å; G113-A117 PolarHBondContact O-N 3.06Å
114	L	66.1	Low	51.7	Low	80 Å²	80	96.4 Å²	96.4	42%	0.419	59%	0.588	S	S	.	*	H	α-helix	trans	-62.1	-49.9	166.6	-68.5	176.7	0	0	0	111.1	A108 T110 A111 Q116 A117 I118	A108-L114 WeakPolarHBondContact O-CD2 3.39Å; A108-L114 VanDerWaalsContact O-CG 3.25Å; A108-L114 WeakPolarHBondContact O-CG 3.16Å; T110-L114 PolarHBondContact O-N 3Å; A111-L114 PolarHBondContact O-N 3.2Å; L114-Q116 VanDerWaalsContact C-N 3.26Å; L114-Q116 PolarHBondContact O-N 3.49Å; L114-A117 PolarHBondContact O-N 2.86Å; L114-I118 WeakPolarHBondContact O-CB 3.17Å; L114-I118 WeakPolarHBondContact O-CD1 3.37Å; L114-I118 WeakPolarHBondContact O-CG1 3.35Å; L114-I118 PolarHBondContact O-N 3.31Å
115	L	55.9	Low	51.5	Low	81 Å²	81	96.9 Å²	96.9	42%	0.424	60%	0.604	S	S	.	*	H	α-helix	trans	-58.7	-38	175.9	-71.5	169.8	0	0	0	112.1	A111 M112 S119	A111-L115 WeakPolarHBondContact O-CG 3.29Å; A111-L115 PolarHBondContact O-N 3.23Å; M112-L115 PolarHBondContact O-N 3.18Å; M112-L115 HydrophobicContact SD-CD1 4.4Å; L115-S119 WeakPolarHBondContact O-CB 3.32Å; L115-S119 PolarHBondContact O-N 3.43Å; L115-S119 PolarHBondContact O-OG 3.11Å
116	Q	60.4	Low	51.4	Low	134 Å²	134	96.9 Å²	96.9	63%	0.626	60%	0.604	S	S	*	*	H	α-helix	trans	-72.5	-35.5	177.3	-166.5	163.9	15.4	0	0	112.7	M112 G113 L114 S119 S120	M112-Q116 VanDerWaalsContact O-CB 3.24Å; M112-Q116 WeakPolarHBondContact O-CB 3.45Å; M112-Q116 PolarHBondContact O-N 3.49Å; G113-Q116 PolarHBondContact O-N 2.74Å; L114-Q116 VanDerWaalsContact C-N 3.26Å; L114-Q116 PolarHBondContact O-N 3.49Å; Q116-S119 PolarHBondContact O-OG 3.33Å; Q116-S120 WeakPolarHBondContact O-CB 3.43Å; Q116-S120 PolarHBondContact O-N 3.45Å; Q116-S120 VanDerWaalsContact O-N 3.11Å; Q116-S120 PolarHBondContact O-OG 2.69Å
117	A	61.5	Low	50.7	Low	67 Å²	67	98.5 Å²	98.5	55%	0.554	62%	0.617	S	S	*	*	H	α-helix	trans	-67.8	-42.7	172.4	0	0	0	0	0	111.8	G113 L114 S119 S120	G113-A117 WeakPolarHBondContact O-CB 3.38Å; G113-A117 PolarHBondContact O-N 3.06Å; L114-A117 PolarHBondContact O-N 2.86Å; A117-S119 VanDerWaalsContact C-N 3.32Å; A117-S119 PolarHBondContact O-N 2.66Å; A117-S120 PolarHBondContact O-N 3.43Å
118	I	56.5	Low	50.2	Low	68 Å²	68	99.1 Å²	99.1	35%	0.349	62%	0.621	S	S	.	*	H	α-helix	trans	-64.9	-34.1	178.3	-69.6	163.8	0	0	0	111.9	L114	L114-I118 WeakPolarHBondContact O-CB 3.17Å; L114-I118 WeakPolarHBondContact O-CD1 3.37Å; L114-I118 WeakPolarHBondContact O-CG1 3.35Å; L114-I118 PolarHBondContact O-N 3.31Å
119	S	54.8	Low	49.4	Very low	92 Å²	92	102.3 Å²	102.3	64%	0.643	64%	0.64	S	S	*	*	H	α-helix	trans	-93	-6.2	179.9	57.2	0	0	0	0	115.7	L115 Q116 A117	L115-S119 WeakPolarHBondContact O-CB 3.32Å; L115-S119 PolarHBondContact O-N 3.43Å; L115-S119 PolarHBondContact O-OG 3.11Å; Q116-S119 PolarHBondContact O-OG 3.33Å; A117-S119 VanDerWaalsContact C-N 3.32Å; A117-S119 PolarHBondContact O-N 2.66Å
120	S	45.2	Very low	49.2	Very low	59 Å²	59	101.5 Å²	101.5	41%	0.413	64%	0.643	S	S	.	*			trans	-87.5	132	179.1	-66.9	0	0	0	0	112.5	Q116 A117 M122	Q116-S120 WeakPolarHBondContact O-CB 3.43Å; Q116-S120 PolarHBondContact O-N 3.45Å; Q116-S120 VanDerWaalsContact O-N 3.11Å; Q116-S120 PolarHBondContact O-OG 2.69Å; A117-S120 PolarHBondContact O-N 3.43Å; S120-M122 PolarHBondContact O-N 3.05Å
121	P	53.3	Low	47.3	Very low	126 Å²	126	105.2 Å²	105.2	82%	0.818	65%	0.654	S	S	*	*			trans	-88.5	96	175.3	33.9	-31.7	0	0	0	110.9
122	M	40.4	Very low	46.6	Very low	184 Å²	184	107.6 Å²	107.6	91%	0.906	66%	0.656	S	S	*	*			trans	-122	147.7	162	-72	-156.9	70.8	0	0	111.3	S120	S120-M122 PolarHBondContact O-N 3.05Å
123	A	33.8	Very low	45.2	Very low	85 Å²	85	110 Å²	110	70%	0.702	67%	0.665	S	S	*	*			trans	-115.7	168.4	-167.7	0	0	0	0	0	112.5
124	T	36.4	Very low	43.6	Very low	138 Å²	138	118.9 Å²	118.9	85%	0.847	70%	0.7	S	S	*	*			trans	70.3	105.3	168	70.7	0	0	0	0	117.4
125	G	31.4	Very low	42	Very low	85 Å²	85	124.5 Å²	124.5	88%	0.876	72%	0.721	S	S	*	*			trans	-89.2	142.4	144	0	0	0	0	0	109.1
126	S	35.3	Very low	41.4	Very low	116 Å²	116	126.2 Å²	126.2	81%	0.811	74%	0.737	S	S	*	*			trans	-108.1	136.2	-176.3	54.2	0	0	0	0	112.1
127	D	31.9	Very low	40	Very low	160 Å²	160	125.4 Å²	125.4	86%	0.856	75%	0.746	S	S	*	*			trans	-61.6	147.5	172.8	-115.9	-32.2	0	0	0	112.6
128	P	41.3	Very low	38.5	Very low	115 Å²	115	132.5 Å²	132.5	75%	0.747	76%	0.76	S	S	*	*			trans	-90	149.8	179.6	35.3	-31.8	0	0	0	113.1
129	S	30.8	Very low	38.1	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	78%	0.784	S	S	*	*			trans	-118.5	132.7	173.7	175.2	0	0	0	0	111
130	P	47.7	Very low	36.9	Very low	123 Å²	123	136 Å²	136	80%	0.799	78%	0.784	S	S	*	*			trans	-93.2	148.5	169.4	35.4	-30.9	0	0	0	112.1
131	H	31.6	Very low	36.2	Very low	167 Å²	167	143.4 Å²	143.4	77%	0.773	81%	0.809	S	S	*	*			trans	-135.7	164.4	176.3	-175.9	-89.5	0	0	0	111.3
132	L	34.8	Very low	35	Very low	121 Å²	121	141.9 Å²	141.9	63%	0.634	80%	0.801	S	S	*	*			trans	89.5	132	-175.5	-50.5	168.5	0	0	0	111.6
133	H	33.6	Very low	34.6	Very low	183 Å²	183	137.2 Å²	137.2	85%	0.847	79%	0.787	S	S	*	*			cis	-134.3	-175.2	41.5	-77.2	-99.6	0	0	0	116.4
134	K	32	Very low	34.5	Very low	198 Å²	198	141.9 Å²	141.9	86%	0.861	79%	0.794	S	S	*	*			trans	-81.8	158.1	-163	-62.5	165.6	176.3	173.1	0	115.1
135	K	32.7	Very low	34.3	Very low	198 Å²	198	140.8 Å²	140.8	86%	0.861	79%	0.791	S	S	*	*			trans	-79	167.1	166.7	-60.5	-177	177.2	-177.6	0	112.3
136	P	43.4	Very low	34.4	Very low	118 Å²	118	141.7 Å²	141.7	77%	0.766	78%	0.784	S	S	*	*				-145.9	165.7	99.1	38.9	-24.2	0	0	0	117.7
137	S	30.8	Very low	34.3	Very low	116 Å²	116	146.3 Å²	146.3	81%	0.811	79%	0.79	S	S	*	*			trans	65.9	136.3	154.2	47.3	0	0	0	0	123.6
138	Y	31	Very low	34.3	Very low	216 Å²	216	145.8 Å²	145.8	85%	0.847	79%	0.787	S	S	*	*			trans	-86	168.7	171.8	-86.5	-88.2	0	0	0	112.5
139	P	47.7	Very low	34	Very low	131 Å²	131	151.5 Å²	151.5	85%	0.851	79%	0.794	S	S	*	*				-136.3	176.7	88.3	23.7	-1.9	0	0	0	116.5
140	T	29.8	Very low	34.1	Very low	104 Å²	104	155.1 Å²	155.1	64%	0.638	80%	0.795	S	S	*	*			trans	-98.2	147.7	-164.3	-55.6	0	0	0	0	114.8
141	F	30.3	Very low	33.4	Very low	213 Å²	213	158.7 Å²	158.7	93%	0.934	79%	0.793	S	S	*	*			trans	-163.3	117.7	136.6	-79.9	-66.1	0	0	0	107
142	S	28.4	Very low	33.3	Very low	95 Å²	95	157.3 Å²	157.3	66%	0.664	79%	0.787	S	S	*	*				87.4	123.9	62.2	-159.3	0	0	0	0	115
143	S	31.9	Very low	33.1	Very low	86 Å²	86	154.4 Å²	154.4	60%	0.601	79%	0.786	S	S	*	*			trans	111.8	116.3	139.1	-62.8	0	0	0	0	122.3
144	H	32.7	Very low	33.1	Very low	182 Å²	182	151.8 Å²	151.8	84%	0.843	79%	0.788	S	S	*	*			trans	67.4	152.6	145.4	-58.2	-53.6	0	0	0	119.9
145	S	31.5	Very low	33	Very low	115 Å²	115	146.5 Å²	146.5	80%	0.804	79%	0.79	S	S	*	*			cis	-151.4	159.7	4.2	-165.7	0	0	0	0	112.6
146	S	32.8	Very low	32.9	Very low	104 Å²	104	141 Å²	141	73%	0.727	79%	0.79	S	S	*	*			trans	-77.9	160.6	-179.2	-39.4	0	0	0	0	115.7
147	K	33.9	Very low	32.3	Very low	213 Å²	213	139 Å²	139	93%	0.926	79%	0.79	S	S	*	*				-166.5	133.6	119.7	-113.6	168.6	-176.9	168.8	0	116.2
148	D	32.1	Very low	32.4	Very low	149 Å²	149	138.7 Å²	138.7	80%	0.797	79%	0.788	S	S	*	*			trans	-87	156.3	170.5	-91.2	-87.7	0	0	0	114.4
149	R	35	Very low	32.6	Very low	236 Å²	236	138.2 Å²	138.2	89%	0.891	79%	0.79	S	S	*	*			trans	158.8	118.3	134.5	-85.1	158.6	-172.8	-127.2	1.3	109.4
150	K	33	Very low	31.7	Very low	189 Å²	189	135.9 Å²	135.9	82%	0.822	79%	0.79	S	S	*	*				67.2	128.1	64.3	-168	-177.3	-176.2	178.9	0	111.2
151	R	32.1	Very low	31.9	Very low	198 Å²	198	135 Å²	135	75%	0.747	79%	0.788	S	S	*	*			cis	177.9	160.7	-1.5	173.2	-167.4	-174.6	-131.5	8	105.1
152	E	29.2	Very low	32.2	Very low	138 Å²	138	133.1 Å²	133.1	65%	0.645	78%	0.782	S	S	*	*			trans	91.2	147.3	171.2	-51.5	-56.2	161.2	0	0	116.4
153	G	31.7	Very low	32.3	Very low	60 Å²	60	133.5 Å²	133.5	62%	0.619	79%	0.785	S	S	*	*			cis	161.7	131.9	-7.3	0	0	0	0	0	113.7
154	S	34.1	Very low	32.2	Very low	128 Å²	128	134.9 Å²	134.9	90%	0.895	79%	0.794	S	S	*	*			trans	70.6	124.8	156.1	-57.1	0	0	0	0	123.4
155	G	29.4	Very low	32	Very low	88 Å²	88	132 Å²	132	91%	0.907	80%	0.795	S	S	*	*			trans	76.1	151.5	149.1	0	0	0	0	0	118.4
156	G	30.1	Very low	32.1	Very low	82 Å²	82	136 Å²	136	85%	0.845	80%	0.8	S	S	*	*			cis	160.8	134.3	-9.9	0	0	0	0	0	112.7
157	G	30	Very low	32.1	Very low	76 Å²	76	136.5 Å²	136.5	78%	0.784	80%	0.804	S	S	*	*			trans	94.3	109.8	153.8	0	0	0	0	0	121.6
158	S	33.8	Very low	32.1	Very low	109 Å²	109	137.5 Å²	137.5	76%	0.762	80%	0.802	S	S	*	*				69.9	115.1	127.8	-61.6	0	0	0	0	124.6
159	K	34.8	Very low	33.3	Very low	206 Å²	206	135.3 Å²	135.3	90%	0.896	80%	0.795	S	S	*	*			trans	66.2	134.4	133	-58.6	177	-178.3	178.8	0	120.8
160	G	29.5	Very low	33.1	Very low	82 Å²	82	132.2 Å²	132.2	85%	0.845	79%	0.793	S	S	*	*			trans	154	94.2	157.6	0	0	0	0	0	115.9
161	S	34.3	Very low	33.2	Very low	85 Å²	85	127.6 Å²	127.6	59%	0.594	79%	0.785	S	S	*	*			trans	-75.3	176	-174.4	38.1	0	0	0	0	117.9
162	H	35.2	Very low	33.2	Very low	175 Å²	175	125.6 Å²	125.6	81%	0.81	79%	0.788	S	S	*	*			trans	62.7	149.7	163.4	13.8	-106.9	0	0	0	119.1
163	S	30.9	Very low	33.3	Very low	103 Å²	103	123.8 Å²	123.8	72%	0.72	79%	0.791	S	S	*	*			cis	-168.7	142.6	-8	44.9	0	0	0	0	112.8
164	S	30.8	Very low	33.3	Very low	114 Å²	114	126.2 Å²	126.2	80%	0.797	80%	0.798	S	S	*	*			trans	36	129.6	146.9	64	0	0	0	0	123.3
165	S	28.1	Very low	33.1	Very low	123 Å²	123	125 Å²	125	86%	0.86	79%	0.79	S	S	*	*			trans	-158.8	137.3	131.5	53.7	0	0	0	0	112.5
166	H	33.9	Very low	33.2	Very low	198 Å²	198	125.4 Å²	125.4	92%	0.917	78%	0.779	S	S	*	*			trans	-131.3	134.6	167.3	-112.2	-59	0	0	0	107.5
167	S	32.1	Very low	33.5	Very low	114 Å²	114	125.6 Å²	125.6	80%	0.797	77%	0.767	S	S	*	*			trans	-90.5	146.1	-180	36.4	0	0	0	0	112.9
168	R	34.4	Very low	33.6	Very low	235 Å²	235	131 Å²	131	89%	0.887	77%	0.769	S	S	*	*			trans	-90.9	-162.5	163.7	-50	171.2	132.2	-146.6	-0.4	108.3
169	P	56.7	Low	33.6	Very low	102 Å²	102	136 Å²	136	66%	0.662	78%	0.777	S	S	*	*			cis	-133.4	-179.1	-17.3	33.4	-13.1	0	0	0	113.8
170	M	30.2	Very low	33.5	Very low	171 Å²	171	134.4 Å²	134.4	84%	0.842	77%	0.77	S	S	*	*				-170	165.9	114.7	-93.4	-91.4	88.4	0	0	109.8
171	S	36.4	Very low	33.8	Very low	92 Å²	92	138.6 Å²	138.6	64%	0.643	77%	0.767	S	S	*	*			trans	-140.8	167.2	-158.2	53.6	0	0	0	0	111.8
172	L	31.2	Very low	33.7	Very low	157 Å²	157	139.3 Å²	139.3	82%	0.822	77%	0.772	S	S	*	*			trans	-169.5	135	131.3	-102.3	160.1	0	0	0	112.2
173	S	31.9	Very low	33.6	Very low	100 Å²	100	136.1 Å²	136.1	70%	0.699	77%	0.77	S	S	*	*			trans	40.7	141.2	146.3	56.4	0	0	0	0	121.4
174	S	32.1	Very low	33.7	Very low	111 Å²	111	136.5 Å²	136.5	78%	0.776	77%	0.773	S	S	*	*			cis	-177.8	168.3	7	36.7	0	0	0	0	108.2
175	S	30.4	Very low	33.6	Very low	102 Å²	102	136.4 Å²	136.4	71%	0.713	77%	0.772	S	S	*	*			cis	-163.9	163	-17.4	48.3	0	0	0	0	112.6
176	S	31.2	Very low	33.8	Very low	97 Å²	97	135.9 Å²	135.9	68%	0.678	77%	0.768	S	S	*	*			trans	67.4	89.7	138.8	64.2	0	0	0	0	124
177	S	35.3	Very low	33.7	Very low	85 Å²	85	132.3 Å²	132.3	59%	0.594	77%	0.766	S	S	*	*				61.6	105.4	111.4	61	0	0	0	0	125
178	F	32.8	Very low	33.9	Very low	191 Å²	191	132.4 Å²	132.4	84%	0.838	77%	0.766	S	S	*	*				50.3	124.2	126.3	-26.6	-61.1	0	0	0	123.8
179	K	33.5	Very low	34.1	Very low	213 Å²	213	131.4 Å²	131.4	93%	0.926	77%	0.768	S	S	*	*				174.6	173.7	102.9	-95.6	176.5	-177.8	174.9	0	113.8
180	K	33.2	Very low	33	Very low	173 Å²	173	131.4 Å²	131.4	75%	0.752	77%	0.771	S	S	*	*			trans	-88.6	154.6	-165.7	-55	170.2	179.5	177.4	0	114.6
181	H	34.6	Very low	33.2	Very low	169 Å²	169	127.6 Å²	127.6	78%	0.782	76%	0.761	S	S	*	*				166.4	-171.3	113.5	-87.6	-68.3	0	0	0	112.6
182	S	33.3	Very low	33.1	Very low	100 Å²	100	130.4 Å²	130.4	70%	0.699	77%	0.768	S	S	*	*			trans	-101	165	-143.2	-44.6	0	0	0	0	118.5
183	S	31.7	Very low	33.3	Very low	108 Å²	108	130.6 Å²	130.6	76%	0.755	76%	0.762	S	S	*	*			trans	72.2	109.1	147.1	51.6	0	0	0	0	123.6
184	S	32.9	Very low	33.4	Very low	112 Å²	112	134 Å²	134	78%	0.783	77%	0.767	S	S	*	*				55.8	118.5	129.7	64.9	0	0	0	0	124.5
185	S	29	Very low	33.3	Very low	111 Å²	111	132.5 Å²	132.5	78%	0.776	77%	0.769	S	S	*	*			trans	179.4	113.4	135	38.6	0	0	0	0	108.8
186	S	33.2	Very low	33.2	Very low	113 Å²	113	131.9 Å²	131.9	79%	0.79	78%	0.778	S	S	*	*				72.5	114.1	85.8	75.2	0	0	0	0	117.1
187	S	30.9	Very low	33.3	Very low	123 Å²	123	131.9 Å²	131.9	86%	0.86	78%	0.784	S	S	*	*			trans	-149.2	145.8	145.2	77.7	0	0	0	0	110.6
188	S	37.6	Very low	34.2	Very low	115 Å²	115	133.2 Å²	133.2	80%	0.804	79%	0.791	S	S	*	*			trans	-148.8	151.4	-173.4	-54.2	0	0	0	0	111.4
189	K	38.3	Very low	34.3	Very low	214 Å²	214	132.5 Å²	132.5	93%	0.93	79%	0.788	S	S	*	*			trans	157.9	146.5	144.9	-88.2	161.1	-175.4	-176.5	0	108.5
190	S	34	Very low	34.2	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	78%	0.781	S	S	*	*			cis	-153	175.4	12.8	95.9	0	0	0	0	108.7
191	S	34.6	Very low	34.4	Very low	91 Å²	91	130.6 Å²	130.6	64%	0.636	79%	0.785	S	S	*	*			cis	-172.9	-176.3	-17.3	46.6	0	0	0	0	109.3
192	L	32.7	Very low	34.8	Very low	150 Å²	150	127.2 Å²	127.2	79%	0.785	78%	0.778	S	S	*	*			trans	71.2	138.2	171.1	-47.4	173	0	0	0	117.8
193	F	36.8	Very low	34.8	Very low	161 Å²	161	129.9 Å²	129.9	71%	0.706	78%	0.783	S	S	*	*			cis	-165.9	138	-43.4	-123.8	-43.4	0	0	0	110.1
194	H	34.4	Very low	34.9	Very low	172 Å²	172	131.9 Å²	131.9	80%	0.796	79%	0.791	S	S	*	*			trans	58.2	141.2	166.2	-50.1	108.6	0	0	0	118.8
195	G	28.9	Very low	35.1	Very low	80 Å²	80	134 Å²	134	83%	0.825	79%	0.793	S	S	*	*			cis	168.7	154.8	-6.8	0	0	0	0	0	111
196	G	28.5	Very low	35.4	Very low	88 Å²	88	139.2 Å²	139.2	91%	0.907	80%	0.795	S	S	*	*			trans	120.6	137	167.9	0	0	0	0	0	117.3
197	A	34.2	Very low	35.4	Very low	97 Å²	97	142.5 Å²	142.5	80%	0.802	80%	0.799	S	S	*	*			trans	-150.2	178.3	170.1	0	0	0	0	0	107.4
198	P	54	Low	35.8	Very low	114 Å²	114	141.8 Å²	141.8	74%	0.74	80%	0.8	S	S	*	*			cis	-124.1	-178.3	-19.5	39.4	-25	0	0	0	112.1
199	K	34.4	Very low	35.9	Very low	176 Å²	176	142.9 Å²	142.9	77%	0.765	80%	0.797	S	S	*	*			trans	168.3	129.9	131.9	-95.3	178.6	175.9	-168.8	0	115.7
200	E	32.2	Very low	35.8	Very low	170 Å²	170	135 Å²	135	79%	0.794	78%	0.776	S	S	*	*			trans	62.8	149.9	135.7	-63.2	174.5	-130.3	0	0	123.9
201	E	36.5	Very low	36	Very low	176 Å²	176	138.5 Å²	138.5	82%	0.822	79%	0.786	S	S	*	*			trans	-73.5	-179.1	173.7	-114.4	-169.3	146	0	0	112.4
202	P	42.8	Very low	36.3	Very low	97 Å²	97	141.9 Å²	141.9	63%	0.63	79%	0.789	S	S	*	*			cis	-136.5	171.8	-10.8	35.4	-15.5	0	0	0	116.3
203	L	33.3	Very low	36.7	Very low	157 Å²	157	143.6 Å²	143.6	82%	0.822	80%	0.795	S	S	*	*			trans	17.6	114.9	144.3	-60.9	163.8	0	0	0	120.7
204	T	32.9	Very low	36.9	Very low	150 Å²	150	145.2 Å²	145.2	92%	0.92	80%	0.802	S	S	*	*			trans	-140	149.8	136.2	54.7	0	0	0	0	111.8
205	L	37.9	Very low	36.9	Very low	156 Å²	156	144.4 Å²	144.4	82%	0.817	80%	0.803	S	S	*	*			trans	-122.1	103.3	-173.3	-171.2	160.6	0	0	0	111.1
206	R	35.6	Very low	37.4	Very low	220 Å²	220	147.7 Å²	147.7	83%	0.83	80%	0.8	S	S	*	*			trans	-138.1	142.4	160.4	-58	-87.5	85.2	166.1	-1.6	103.2
207	E	33.5	Very low	37.6	Very low	183 Å²	183	151.1 Å²	151.1	86%	0.855	79%	0.794	S	S	*	*			cis	-147.8	168.1	37.9	-68.2	162.4	156.5	0	0	111.1
208	A	39.9	Very low	37.7	Very low	107 Å²	107	151.8 Å²	151.8	88%	0.884	79%	0.793	S	S	*	*			trans	-145.7	89.4	157.5	0	0	0	0	0	106.7
209	D	38.1	Very low	37.5	Very low	138 Å²	138	152.1 Å²	152.1	74%	0.738	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-75.9	143.7	-179	-163.4	14.9	0	0	0	111	K212	D209-K212 IonicContact OD2-NZ 3.15Å
210	G	37.4	Very low	37.4	Very low	48 Å²	48	153.2 Å²	153.2	50%	0.495	80%	0.803	S	S	.	*	P	Polyproline II helix	trans	-79	137.8	-165	0	0	0	0	0	113.7	K212	G210-K212 WeakPolarHBondContact O-CE 3.46Å; G210-K212 WeakPolarHBondContact O-CG 3.42Å; G210-K212 PolarHBondContact O-N 3.42Å
211	L	36.7	Very low	37.6	Very low	177 Å²	177	155.1 Å²	155.1	93%	0.927	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-71.4	117	174	-162	72.1	0	0	0	110.3
212	K	40.9	Very low	37.4	Very low	162 Å²	162	155.4 Å²	155.4	70%	0.704	81%	0.81	S	S	*	*			trans	-99.3	108.6	-168.9	-45.9	-179.8	-175.6	168.1	0	109.8	D209 G210	D209-K212 IonicContact OD2-NZ 3.15Å; G210-K212 WeakPolarHBondContact O-CE 3.46Å; G210-K212 WeakPolarHBondContact O-CG 3.42Å; G210-K212 PolarHBondContact O-N 3.42Å
213	M	42.6	Very low	37	Very low	187 Å²	187	158.8 Å²	158.8	92%	0.921	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-82.5	120.7	173.8	-69.2	-179.3	69.5	0	0	110.2
214	K	40.8	Very low	37.8	Very low	195 Å²	195	156.6 Å²	156.6	85%	0.848	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-84.6	116.5	178.2	-69.1	177.8	66.8	178.3	0	110.2
215	L	33.4	Very low	37.6	Very low	154 Å²	154	157.5 Å²	157.5	81%	0.806	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-73.1	128.8	165.3	-176.5	66.8	0	0	0	108.7	M217	L215-M217 HydrophobicContact CD2-SD 4.45Å
216	I	39	Very low	37.1	Very low	150 Å²	150	155.7 Å²	155.7	77%	0.769	81%	0.807	S	S	*	*			trans	-102.5	111.8	172.9	-59.4	175.5	0	0	0	107.6
217	M	34.3	Very low	37	Very low	160 Å²	160	154.6 Å²	154.6	79%	0.788	81%	0.808	S	S	*	*			trans	-114.8	132	159.9	-73.8	179.5	63.8	0	0	107.4	L215	L215-M217 HydrophobicContact CD2-SD 4.45Å
218	S	36.4	Very low	37.5	Very low	111 Å²	111	151.4 Å²	151.4	78%	0.776	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-84.3	148	173.9	-63.4	0	0	0	0	110.7
219	P	49.1	Very low	36.8	Very low	120 Å²	120	151.6 Å²	151.6	78%	0.779	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-94.6	150.2	-177.8	36.4	-34	0	0	0	113.2
220	E	31.1	Very low	36.6	Very low	200 Å²	200	150.8 Å²	150.8	94%	0.935	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-91.3	163.2	156.2	-68.4	-158	116.4	0	0	110.9
221	K	36.8	Very low	37	Very low	209 Å²	209	152.8 Å²	152.8	91%	0.909	80%	0.798	S	S	*	*			trans	-105.9	159.6	-170.6	-73.4	178.4	172.2	179.6	0	113
222	E	33.2	Very low	36.6	Very low	183 Å²	183	151.9 Å²	151.9	86%	0.855	79%	0.788	S	S	*	*			trans	-98.2	148.4	-177.8	-58	-179.9	138.3	0	0	114.1
223	E	33.5	Very low	36.1	Very low	167 Å²	167	151.2 Å²	151.2	78%	0.78	79%	0.792	S	S	*	*			trans	61.5	165.2	135.5	-71.5	-62.7	121.2	0	0	120.2
224	P	50	Low	35.5	Very low	111 Å²	111	147.1 Å²	147.1	72%	0.721	78%	0.782	S	S	*	*			cis	-148	-180	26.1	43.1	-20.9	0	0	0	121.6
225	E	30	Very low	35	Very low	170 Å²	170	147 Å²	147	79%	0.794	78%	0.781	S	S	*	*			trans	92.4	104.2	151.5	-63.3	-159.2	154.6	0	0	121.8
226	S	26.7	Very low	34.9	Very low	118 Å²	118	146.1 Å²	146.1	83%	0.825	78%	0.782	S	S	*	*				163.3	142.2	91.9	51.6	0	0	0	0	114.6
227	F	32.7	Very low	34.4	Very low	197 Å²	197	143.6 Å²	143.6	86%	0.864	78%	0.777	S	S	*	*			trans	-97.5	162.4	178.2	-91.3	-79.5	0	0	0	110.5
228	P	44.5	Very low	34.3	Very low	115 Å²	115	142.6 Å²	142.6	75%	0.747	78%	0.78	S	S	*	*				-152.6	140.2	65.1	42.5	-20.2	0	0	0	118.1
229	V	26.6	Very low	34	Very low	111 Å²	111	146.5 Å²	146.5	67%	0.673	78%	0.783	S	S	*	*				96.4	93.8	99.1	163.5	0	0	0	0	115.1
230	T	32.7	Very low	33	Very low	122 Å²	122	148.6 Å²	148.6	75%	0.748	78%	0.78	S	S	*	*				105.1	177	97.8	71.7	0	0	0	0	113.9
231	P	45.3	Very low	32.9	Very low	89 Å²	89	145.8 Å²	145.8	58%	0.578	77%	0.767	S	S	*	*				-137.2	-174	-93.3	40.7	-19.9	0	0	0	114.8
232	H	28.9	Very low	32.5	Very low	158 Å²	158	143.3 Å²	143.3	73%	0.731	76%	0.756	S	S	*	*				151.4	139	126.5	-83.1	-66.2	0	0	0	114.4
233	L	30.5	Very low	32.4	Very low	148 Å²	148	139.5 Å²	139.5	78%	0.775	74%	0.742	S	S	*	*			trans	46.5	153	143.2	-81.3	77.7	0	0	0	120.8
234	S	31.1	Very low	32.4	Very low	102 Å²	102	141.4 Å²	141.4	71%	0.713	74%	0.742	S	S	*	*			cis	-165.2	165.6	-13.7	45.1	0	0	0	0	110
235	K	30.3	Very low	31.4	Very low	193 Å²	193	142.3 Å²	142.3	84%	0.839	74%	0.74	S	S	*	*			trans	-47.6	154.1	170.9	-56.1	161.3	-179.1	172.1	0	113.3
236	V	29.8	Very low	31.5	Very low	134 Å²	134	143.9 Å²	143.9	81%	0.812	74%	0.739	S	S	*	*				171.2	131.1	115.7	153.8	0	0	0	0	114.7
237	S	29.7	Very low	31.8	Very low	97 Å²	97	145.1 Å²	145.1	68%	0.678	73%	0.733	S	S	*	*			trans	28.9	124.9	155.4	74.8	0	0	0	0	126.6
238	V	31.6	Very low	31.9	Very low	140 Å²	140	143.7 Å²	143.7	85%	0.848	73%	0.73	S	S	*	*				43.2	139.7	111.4	-170.3	0	0	0	0	122
239	K	29.8	Very low	31.9	Very low	192 Å²	192	143 Å²	143	84%	0.835	73%	0.725	S	S	*	*			trans	109.4	107.8	152.5	-150.3	169.8	-173.4	-177.7	0	112.8
240	K	28.4	Very low	32	Very low	164 Å²	164	142.9 Å²	142.9	71%	0.713	72%	0.724	S	S	*	*				105.2	132.8	50.2	173.2	177.4	-171.6	-114.1	0	110.5
241	E	29.5	Very low	31.9	Very low	141 Å²	141	146.7 Å²	146.7	66%	0.659	73%	0.731	S	S	*	*			trans	69.9	154.1	170.5	-78.7	-178.3	105.1	0	0	117.1
242	K	28.7	Very low	31.3	Very low	157 Å²	157	147.6 Å²	147.6	68%	0.683	74%	0.739	S	S	*	*			cis	-176.7	162.1	-18.7	164.1	174.5	168.1	-171.5	0	110.3
243	D	29.3	Very low	32	Very low	104 Å²	104	146.4 Å²	146.4	56%	0.556	75%	0.745	S	S	*	*			trans	78.2	122.1	160.4	-101.4	-129.9	0	0	0	119.8
244	R	34	Very low	32	Very low	207 Å²	207	148.8 Å²	148.8	78%	0.781	75%	0.75	S	S	*	*				51.5	145.7	117.9	-75.9	175.8	121.6	178.2	2.3	120.5
245	D	29.8	Very low	32.1	Very low	130 Å²	130	153.6 Å²	153.6	70%	0.695	76%	0.758	S	S	*	*			cis	-171.4	-179.8	-11.9	-152.6	-43.1	0	0	0	107
246	R	32	Very low	32.2	Very low	202 Å²	202	154.4 Å²	154.4	76%	0.762	76%	0.761	S	S	*	*			trans	79.5	111.2	150	-92.2	-161.9	162.2	-153.4	-5.8	123.5
247	M	32.3	Very low	32.2	Very low	144 Å²	144	153.1 Å²	153.1	71%	0.709	77%	0.765	S	S	*	*			trans	81.2	102.1	132.9	-42.1	-148.2	86.7	0	0	122.2
248	Q	34.5	Very low	32.2	Very low	168 Å²	168	153.2 Å²	153.2	79%	0.785	77%	0.771	S	S	*	*				13.3	156.6	106	-68.8	-80.2	-4.7	0	0	118.8
249	P	45.7	Very low	32.3	Very low	100 Å²	100	155.7 Å²	155.7	65%	0.649	77%	0.774	S	S	*	*			cis	-146.9	-177.1	14.5	27	0.5	0	0	0	118.7
250	T	27.8	Very low	32.2	Very low	108 Å²	108	152.1 Å²	152.1	66%	0.663	77%	0.773	S	S	*	*			trans	112.1	135.4	140.4	74.8	0	0	0	0	122.4
251	K	32	Very low	32.2	Very low	202 Å²	202	155.5 Å²	155.5	88%	0.878	78%	0.781	S	S	*	*			trans	86.5	127.2	148.2	-73.6	154.5	-175	176.8	0	121.1
252	S	30.6	Very low	32.2	Very low	109 Å²	109	157 Å²	157	76%	0.762	79%	0.788	S	S	*	*			trans	-115.1	169.1	168.4	56.3	0	0	0	0	110.5
253	P	44.3	Very low	32.8	Very low	132 Å²	132	155.2 Å²	155.2	86%	0.857	79%	0.793	S	S	*	*				-142.4	-178.2	121	32.9	-15.3	0	0	0	115.4
254	K	31.8	Very low	33	Very low	199 Å²	199	157 Å²	157	87%	0.865	80%	0.802	S	S	*	*			trans	-100.6	154.1	-159.3	-58	164	175.3	170.9	0	115.8
255	K	32.3	Very low	33.1	Very low	203 Å²	203	153.2 Å²	153.2	88%	0.883	80%	0.804	S	S	*	*			trans	-174.2	110.8	139.8	-100.3	168.5	-178.2	-178.1	0	107.7
256	K	31.8	Very low	33.3	Very low	209 Å²	209	152.8 Å²	152.8	91%	0.909	81%	0.805	S	S	*	*				79	125.8	67.1	-95.2	-159.7	174.2	-170.7	0	116.1
257	A	29.6	Very low	33.2	Very low	107 Å²	107	149.9 Å²	149.9	88%	0.884	81%	0.81	S	S	*	*			trans	108.7	138.9	171.6	0	0	0	0	0	114.5
258	A	31.3	Very low	33.2	Very low	99 Å²	99	146 Å²	146	82%	0.818	81%	0.808	S	S	*	*			cis	-155.7	167.4	-14.9	0	0	0	0	0	111.9
259	Q	32.8	Very low	33.1	Very low	192 Å²	192	146 Å²	146	90%	0.897	81%	0.805	S	S	*	*			trans	-66.5	173	-166.8	-66	161.4	-53.2	0	0	119
260	S	26.6	Very low	32.3	Very low	118 Å²	118	148 Å²	148	83%	0.825	81%	0.806	S	S	*	*			trans	108.7	139.5	154.3	-161.4	0	0	0	0	114.9
261	R	29.5	Very low	32.5	Very low	235 Å²	235	149.3 Å²	149.3	89%	0.887	81%	0.813	S	S	*	*			cis	165.6	140.2	-23.4	179.3	176.3	-170.6	-179.3	2.8	103.8
262	E	29.1	Very low	32.5	Very low	171 Å²	171	148 Å²	148	80%	0.799	81%	0.81	S	S	*	*			trans	-46.6	161.6	172.4	-92.2	178.9	138.1	0	0	115.1
263	P	40.8	Very low	32.7	Very low	121 Å²	121	149.9 Å²	149.9	79%	0.786	82%	0.817	S	S	*	*			cis	-153.9	-171.7	48.9	43.2	-20.7	0	0	0	119.8
264	L	34.2	Very low	32.2	Very low	141 Å²	141	150.9 Å²	150.9	74%	0.738	81%	0.81	S	S	*	*			trans	-51.1	163.7	170.2	-56.7	161.4	0	0	0	115.9
265	P	36.9	Very low	32.2	Very low	127 Å²	127	145.2 Å²	145.2	83%	0.825	81%	0.807	S	S	*	*			trans	-101.8	141.2	152.1	35.5	-27.4	0	0	0	113.1
266	V	33	Very low	32.3	Very low	121 Å²	121	143 Å²	143	73%	0.733	80%	0.8	S	S	*	*			trans	-140.2	151.5	171.4	-172.2	0	0	0	0	107.3
267	V	30.1	Very low	32.4	Very low	141 Å²	141	144.4 Å²	144.4	86%	0.855	80%	0.801	S	S	*	*			trans	70.7	140.6	177.4	-161.6	0	0	0	0	113.4
268	G	32.9	Very low	32.5	Very low	64 Å²	64	142.6 Å²	142.6	66%	0.66	79%	0.793	S	S	*	*			cis	144.1	150.4	-7.9	0	0	0	0	0	112.5
269	K	31.9	Very low	32.6	Very low	167 Å²	167	142.2 Å²	142.2	73%	0.726	80%	0.799	S	S	*	*			trans	80.5	146.3	151.3	-138.5	162.6	160.9	-87.1	0	120.1
270	E	29	Very low	32.5	Very low	143 Å²	143	136.9 Å²	136.9	67%	0.668	80%	0.795	S	S	*	*			trans	53.3	131.2	157.7	61.2	-134.8	125	0	0	123.3
271	V	32	Very low	33	Very low	135 Å²	135	138.7 Å²	138.7	82%	0.818	80%	0.801	S	S	*	*				-177.9	148.8	106.7	151.6	0	0	0	0	111.6
272	E	31.7	Very low	33.2	Very low	174 Å²	174	130.3 Å²	130.3	81%	0.813	79%	0.788	S	S	*	*			trans	-80.5	163	-178.5	-54	149.6	133.2	0	0	113.4
273	V	35.2	Very low	33.4	Very low	149 Å²	149	129.5 Å²	129.5	90%	0.903	79%	0.789	S	S	*	*			trans	-142.4	115.9	141.9	-179.6	0	0	0	0	109.4
274	E	34.2	Very low	33.1	Very low	153 Å²	153	130.5 Å²	130.5	72%	0.715	79%	0.788	S	S	*	*			trans	-91.6	145.7	163.7	-173.7	-176.7	149.1	0	0	109.8	H276	E274-H276 IonicContact OE1-CE1 2.89Å; E274-H276 PolarHBondContact OE1-CE1 2.84Å; E274-H276 IonicContact OE1-ND1 3.36Å; E274-H276 PolarHBondContact OE1-ND1 3.02Å
275	G	32.3	Very low	33.3	Very low	79 Å²	79	129.1 Å²	129.1	81%	0.814	79%	0.79	S	S	*	*			trans	-146.9	98.7	176.8	0	0	0	0	0	112.3
276	H	32.9	Very low	33.4	Very low	156 Å²	156	128.6 Å²	128.6	72%	0.722	79%	0.789	S	S	*	*			trans	-81.4	151.7	-176.8	-117.2	89	0	0	0	113.6	E274	E274-H276 IonicContact OE1-CE1 2.89Å; E274-H276 PolarHBondContact OE1-CE1 2.84Å; E274-H276 IonicContact OE1-ND1 3.36Å; E274-H276 PolarHBondContact OE1-ND1 3.02Å
277	Y	33.6	Very low	33.6	Very low	239 Å²	239	128.7 Å²	128.7	94%	0.937	80%	0.795	S	S	*	*			trans	129.4	134.8	163.7	-95.2	-92.8	0	0	0	111.2
278	G	31.7	Very low	34	Very low	70 Å²	70	127 Å²	127	72%	0.722	79%	0.79	S	S	*	*			cis	-172	153.6	-5.1	0	0	0	0	0	108.9
279	G	33.2	Very low	34	Very low	91 Å²	91	127.7 Å²	127.7	94%	0.938	80%	0.797	S	S	*	*			trans	-77.9	160.1	-168.7	0	0	0	0	0	116.1
280	G	32.5	Very low	34.1	Very low	79 Å²	79	123.5 Å²	123.5	81%	0.814	80%	0.801	S	S	*	*			trans	-160.3	114.1	176.6	0	0	0	0	0	112.6
281	V	35.6	Very low	34.5	Very low	156 Å²	156	125.8 Å²	125.8	95%	0.945	81%	0.811	S	S	*	*			trans	-54.1	162.2	178.3	-69.1	0	0	0	0	116.8
282	G	34.7	Very low	34.9	Very low	60 Å²	60	127.6 Å²	127.6	62%	0.619	82%	0.816	S	S	*	*			trans	131.4	84.4	145.3	0	0	0	0	0	119.4
283	D	32.9	Very low	35.2	Very low	153 Å²	153	128.4 Å²	128.4	82%	0.818	82%	0.819	S	S	*	*				53.6	138.6	129.1	-50	-48.2	0	0	0	125.4
284	D	35.4	Very low	35.6	Very low	143 Å²	143	126 Å²	126	77%	0.765	82%	0.815	S	S	*	*			trans	52.9	112.9	148.7	-76.8	-60.3	0	0	0	123.6
285	S	36.8	Very low	35.6	Very low	112 Å²	112	122.4 Å²	122.4	78%	0.783	82%	0.819	S	S	*	*				172	113.2	104.9	-76.9	0	0	0	0	116.5
286	S	39.6	Very low	35.7	Very low	115 Å²	115	126.5 Å²	126.5	80%	0.804	82%	0.817	S	S	*	*			trans	39.2	127.4	134.2	-66.6	0	0	0	0	125.6
287	S	37.2	Very low	35.8	Very low	123 Å²	123	127 Å²	127	86%	0.86	82%	0.824	S	S	*	*			trans	70	145.7	134.4	-146.8	0	0	0	0	119.5
288	S	38.4	Very low	36.1	Very low	107 Å²	107	121.8 Å²	121.8	75%	0.748	81%	0.811	S	S	*	*			cis	-139.6	155	6.2	60.2	0	0	0	0	109.2
289	G	32.7	Very low	36.5	Very low	78 Å²	78	125.7 Å²	125.7	80%	0.804	81%	0.814	S	S	*	*				93.2	106.3	52.4	0	0	0	0	0	110
290	G	34.7	Very low	36.5	Very low	78 Å²	78	127.4 Å²	127.4	80%	0.804	80%	0.802	S	S	*	*			trans	177.8	69.6	-172.9	0	0	0	0	0	114
291	E	36.9	Very low	37.1	Very low	191 Å²	191	129.4 Å²	129.4	89%	0.893	79%	0.794	S	S	*	*			trans	-77.9	135.5	174.4	-55.4	178.4	137.1	0	0	110.5
292	L	40.5	Very low	37.7	Very low	173 Å²	173	125.9 Å²	125.9	91%	0.906	78%	0.776	S	S	*	*			trans	-138.1	83.6	168.3	-73.2	179.3	0	0	0	110.9
293	E	39.2	Very low	37.8	Very low	191 Å²	191	133.4 Å²	133.4	89%	0.893	79%	0.787	S	S	*	*			trans	24.7	139.9	134.7	-157.9	165.8	-170.6	0	0	121	G295	E293-G295 PolarHBondContact O-N 3.41Å
294	A	42.6	Very low	38	Very low	99 Å²	99	130.5 Å²	130.5	82%	0.818	78%	0.775	S	S	*	*			trans	-67.3	126.9	-176.7	0	0	0	0	0	114
295	G	35.1	Very low	38.2	Very low	77 Å²	77	131.8 Å²	131.8	79%	0.794	78%	0.776	S	S	*	*			trans	-87.7	103.5	169.2	0	0	0	0	0	112.6	E293 L297	E293-G295 PolarHBondContact O-N 3.41Å; G295-L297 PolarHBondContact O-N 2.99Å
296	E	34.2	Very low	38.2	Very low	166 Å²	166	134.7 Å²	134.7	78%	0.776	78%	0.779	S	S	*	*			trans	-65.4	117.2	172.8	-173.1	-177.7	160.1	0	0	111.4	I298	E296-I298 HydrophobicContact CG-CG1 4.18Å; E296-I298 PolarHBondContact O-N 2.98Å
297	L	34.4	Very low	38.2	Very low	166 Å²	166	134.6 Å²	134.6	87%	0.869	78%	0.779	S	S	*	*			trans	-79	82.8	177.9	-97.8	169.7	0	0	0	111.7	G295 I299	G295-L297 PolarHBondContact O-N 2.99Å; L297-I299 PolarHBondContact O-N 3.29Å
298	I	40.2	Very low	38.3	Very low	129 Å²	129	138.2 Å²	138.2	66%	0.662	78%	0.779	S	S	*	*			trans	-71.9	111	170.4	-62.6	170.1	0	0	0	109.2	E296 D300	E296-I298 HydrophobicContact CG-CG1 4.18Å; E296-I298 PolarHBondContact O-N 2.98Å; I298-D300 PolarHBondContact O-N 3.08Å
299	I	38.8	Very low	38.2	Very low	152 Å²	152	142.9 Å²	142.9	78%	0.779	79%	0.786	S	S	*	*			trans	-84.2	103.1	173.2	-59.9	173.6	0	0	0	108.6	L297 D301	L297-I299 PolarHBondContact O-N 3.29Å; I299-D301 PolarHBondContact O-N 2.93Å
300	D	34.7	Very low	38.5	Very low	127 Å²	127	148.3 Å²	148.3	68%	0.679	79%	0.787	S	S	*	*			trans	-75.7	110.2	175.5	-177.1	17.6	0	0	0	111.4	I298 S302	I298-D300 PolarHBondContact O-N 3.08Å; D300-S302 PolarHBondContact O-N 2.76Å; D300-S302 WeakPolarHBondContact OD1-CB 3.47Å
301	D	44.7	Very low	38.6	Very low	122 Å²	122	154.4 Å²	154.4	65%	0.652	79%	0.792	S	S	*	*	G	3₁₀ helix	trans	-80.4	20.1	-172.4	-153.3	7.1	0	0	0	113.7	I299 Y303 T304	I299-D301 PolarHBondContact O-N 2.93Å; D301-Y303 PolarHBondContact O-N 2.97Å; D301-T304 PolarHBondContact O-OG1 3.15Å
302	S	47.6	Very low	38.7	Very low	81 Å²	81	155 Å²	155	57%	0.566	79%	0.791	S	S	*	*	G	3₁₀ helix	trans	-71.6	-23.8	-171	-172.8	0	0	0	0	114.6	D300 T304	D300-S302 PolarHBondContact O-N 2.76Å; D300-S302 WeakPolarHBondContact OD1-CB 3.47Å; S302-T304 VanDerWaalsContact C-N 3.29Å; S302-T304 PolarHBondContact O-N 2.84Å
303	Y	38.2	Very low	38.7	Very low	218 Å²	218	151.2 Å²	151.2	86%	0.855	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-77.1	-6.9	-173.5	-160.8	-108.4	0	0	0	115.1	D301 H305	D301-Y303 PolarHBondContact O-N 2.97Å; Y303-H305 VanDerWaalsContact C-N 3.29Å; Y303-H305 PolarHBondContact O-N 2.83Å
304	T	36.8	Very low	39.3	Very low	93 Å²	93	152.4 Å²	152.4	57%	0.571	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-77	-8.8	-175.4	59.7	0	0	0	0	114.7	D301 S302	D301-T304 PolarHBondContact O-OG1 3.15Å; S302-T304 VanDerWaalsContact C-N 3.29Å; S302-T304 PolarHBondContact O-N 2.84Å
305	H	38.6	Very low	39.3	Very low	169 Å²	169	156.9 Å²	156.9	78%	0.782	78%	0.783	S	S	*	*	G	3₁₀ helix	trans	-110	-1.5	-163.6	-106.7	-96	0	0	0	118.2	Y303	Y303-H305 VanDerWaalsContact C-N 3.29Å; Y303-H305 PolarHBondContact O-N 2.83Å
306	M	36.6	Very low	39.7	Very low	173 Å²	173	158 Å²	158	85%	0.852	78%	0.778	S	S	*	*	S	Bend	trans	-99.3	-11.9	-175	-69.4	-167.1	70.7	0	0	117	K308	M306-K308 VanDerWaalsContact C-N 3.33Å; M306-K308 PolarHBondContact O-N 2.93Å; M306-K308 VanDerWaalsContact O-N 3.12Å
307	S	40.3	Very low	40.4	Very low	113 Å²	113	157.8 Å²	157.8	79%	0.79	78%	0.775	S	S	*	*			trans	-87	34.3	-173	65.5	0	0	0	0	116.1
308	K	40	Very low	41	Very low	199 Å²	199	159 Å²	159	87%	0.865	77%	0.773	S	S	*	*			trans	-132.7	67.6	178.9	-74.7	179	-175.5	151.9	0	115.1	M306	M306-K308 VanDerWaalsContact C-N 3.33Å; M306-K308 PolarHBondContact O-N 2.93Å; M306-K308 VanDerWaalsContact O-N 3.12Å
309	K	35	Very low	41.4	Very low	206 Å²	206	161 Å²	161	90%	0.896	78%	0.777	S	S	*	*	S	Bend	trans	-144.7	110.7	156.8	-138.4	164.2	-174.8	173.2	0	115.1
310	K	38.6	Very low	41.6	Very low	191 Å²	191	161.4 Å²	161.4	83%	0.83	77%	0.773	S	S	*	*			trans	77	69.9	142.1	-154.1	-178.4	-175.5	-174.6	0	120
311	K	36.6	Very low	42.3	Very low	207 Å²	207	160 Å²	160	90%	0.9	77%	0.766	S	S	*	*			trans	-105.6	85.7	145.8	-158.1	167.2	-171.3	171	0	110.9	S313	K311-S313 PolarHBondContact O-N 3.37Å
312	K	40.9	Very low	42.6	Very low	202 Å²	202	161.4 Å²	161.4	88%	0.878	77%	0.766	S	S	*	*			trans	-75.8	105.1	-177.8	179.5	-175	179.3	-176.4	0	110.5
313	S	40.5	Very low	42.8	Very low	94 Å²	94	163.7 Å²	163.7	66%	0.657	77%	0.768	S	S	*	*			trans	-141.1	126.4	169.9	68.8	0	0	0	0	115	K311 K315	K311-S313 PolarHBondContact O-N 3.37Å; S313-K315 VanDerWaalsContact C-N 3.31Å; S313-K315 PolarHBondContact O-N 3.39Å
314	K	50.7	Low	43.2	Very low	216 Å²	216	160.3 Å²	160.3	94%	0.939	76%	0.757	S	S	*	*	S	Bend	trans	39.5	0.1	151.5	-67.1	-178.6	177	175.5	0	123.5
315	K	43.8	Very low	43.9	Very low	194 Å²	194	161.4 Å²	161.4	84%	0.843	76%	0.76	S	S	*	*	S	Bend	trans	-94.8	-11.9	178.4	-155.6	164.2	-175.8	173.7	0	115.9	S313	S313-K315 VanDerWaalsContact C-N 3.31Å; S313-K315 PolarHBondContact O-N 3.39Å
316	S	42.6	Very low	44.5	Very low	100 Å²	100	162 Å²	162	70%	0.699	76%	0.755	S	S	*	*	S	Bend	trans	-85.1	-15	-176.6	59.4	0	0	0	0	115.8
317	K	48	Very low	45.2	Very low	162 Å²	162	159 Å²	159	70%	0.704	74%	0.742	S	S	*	*	H	α-helix	trans	-70	-40.1	-175.6	-166.4	159.6	179.5	172.4	0	112.8	K319 K320	K317-K319 VanDerWaalsContact C-N 3.34Å; K317-K319 PolarHBondContact O-N 3.06Å; K317-K320 PolarHBondContact O-N 2.94Å
318	K	47	Very low	45.6	Very low	190 Å²	190	160.8 Å²	160.8	83%	0.826	74%	0.736	S	S	*	*	H	α-helix	trans	-74	-15.1	-177.9	-165.2	161.9	-176	169	0	115
319	K	49	Very low	46	Very low	172 Å²	172	158.4 Å²	158.4	75%	0.748	73%	0.733	S	S	*	*	H	α-helix	trans	-85	-31.7	174.9	-163.1	175.5	179.9	-174.8	0	112.3	K317	K317-K319 VanDerWaalsContact C-N 3.34Å; K317-K319 PolarHBondContact O-N 3.06Å
320	K	43.8	Very low	46.6	Very low	160 Å²	160	157.2 Å²	157.2	70%	0.696	73%	0.727	S	S	*	*	H	α-helix	trans	-73.3	-34.6	179.7	-169.3	168.6	-177.4	173	0	113.1	K317 E323 K324	K317-K320 PolarHBondContact O-N 2.94Å; K320-E323 PolarHBondContact O-N 2.97Å; K320-K324 PolarHBondContact O-N 2.85Å
321	D	49.4	Very low	46.8	Very low	98 Å²	98	152.8 Å²	152.8	52%	0.524	72%	0.721	S	S	.	*	H	α-helix	trans	-68.5	-38.9	177.4	-69.3	-35.7	0	0	0	112.5	E323 K324 D325	D321-E323 PolarHBondContact O-N 3.07Å; D321-K324 PolarHBondContact O-N 3.48Å; D321-D325 PolarHBondContact O-N 3.22Å
322	K	50.7	Low	47.1	Very low	151 Å²	151	146.2 Å²	146.2	66%	0.657	71%	0.711	S	S	*	*	H	α-helix	trans	-71.1	-16.4	179	-171.8	160.5	-175.6	166.4	0	114.2
323	E	52.2	Low	47.3	Very low	130 Å²	130	145.1 Å²	145.1	61%	0.607	71%	0.707	S	S	*	*	H	α-helix	trans	-84.6	-43.6	174.1	-164	160.3	-131.4	0	0	110.3	K320 D321 D325 R326	K320-E323 PolarHBondContact O-N 2.97Å; D321-E323 PolarHBondContact O-N 3.07Å; E323-D325 VanDerWaalsContact C-N 3.3Å; E323-D325 PolarHBondContact O-N 3.42Å; E323-R326 PolarHBondContact O-N 3.45Å; E323-R326 VanDerWaalsContact O-N 3.13Å
324	K	46.3	Very low	46.9	Very low	147 Å²	147	147 Å²	147	64%	0.639	71%	0.709	S	S	*	*	H	α-helix	trans	-63.2	-29.8	179.4	-164.5	177.9	-177.8	-174.9	0	114.3	K320 D321	K320-K324 PolarHBondContact O-N 2.85Å; D321-K324 PolarHBondContact O-N 3.48Å
325	D	50.7	Low	46.2	Very low	116 Å²	116	145.9 Å²	145.9	62%	0.62	71%	0.705	S	S	*	*	H	α-helix	trans	-67.5	-37.4	175.2	-120.6	14.6	0	0	0	112	D321 E323 D327 K328	D321-D325 PolarHBondContact O-N 3.22Å; E323-D325 VanDerWaalsContact C-N 3.3Å; E323-D325 PolarHBondContact O-N 3.42Å; D325-D327 PolarHBondContact O-N 3.16Å; D325-K328 PolarHBondContact O-N 3.1Å
326	R	52.3	Low	45.7	Very low	180 Å²	180	146.9 Å²	146.9	68%	0.679	71%	0.709	S	S	*	*	H	α-helix	trans	-71.4	-26.5	-177	-77.1	178.8	164.5	179.6	-5.6	114.2	E323	E323-R326 PolarHBondContact O-N 3.45Å; E323-R326 VanDerWaalsContact O-N 3.13Å
327	D	51	Low	45.4	Very low	110 Å²	110	149.6 Å²	149.6	59%	0.588	71%	0.71	S	S	*	*	H	α-helix	trans	-79.7	-30.8	175.9	-78.7	-40.8	0	0	0	112.2	D325 D329 K330 S331	D325-D327 PolarHBondContact O-N 3.16Å; D327-D329 PolarHBondContact O-N 3.42Å; D327-K330 PolarHBondContact O-N 2.85Å; D327-S331 PolarHBondContact O-N 3.18Å
328	K	49	Very low	44.7	Very low	152 Å²	152	147.6 Å²	147.6	66%	0.661	72%	0.717	S	S	*	*	H	α-helix	trans	-64.1	-37.4	177.6	-93.4	-170.1	167.8	-168.2	0	113.4	D325 K330	D325-K328 PolarHBondContact O-N 3.1Å; K328-K330 PolarHBondContact O-N 2.93Å
329	D	48.3	Very low	44.1	Very low	149 Å²	149	148 Å²	148	80%	0.797	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-12.6	177.2	-83.3	-37.2	0	0	0	113.9	D327	D327-D329 PolarHBondContact O-N 3.42Å
330	K	48.1	Very low	43	Very low	180 Å²	180	144.9 Å²	144.9	78%	0.783	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-16.9	-176.8	-74.8	-174.4	175.3	-177.4	0	115.2	D327 K328	D327-K330 PolarHBondContact O-N 2.85Å; K328-K330 PolarHBondContact O-N 2.93Å
331	S	41	Very low	42.3	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	73%	0.728	S	S	*	*	S	Bend	trans	-97.7	10.9	179.6	67.5	0	0	0	0	113.9	D327	D327-S331 PolarHBondContact O-N 3.18Å
332	G	43.8	Very low	41.3	Very low	68 Å²	68	145.8 Å²	145.8	70%	0.701	74%	0.739	S	S	*	*			trans	-94.2	27.2	-170.1	0	0	0	0	0	116.3
333	K	44.4	Very low	40.1	Very low	179 Å²	179	146.9 Å²	146.9	78%	0.778	75%	0.747	S	S	*	*			trans	-152.7	149.9	170.6	-130.9	170.3	-179.6	176.6	0	113.3
334	D	33.7	Very low	39.1	Very low	134 Å²	134	145 Å²	145	72%	0.717	75%	0.748	S	S	*	*			trans	72.6	85.1	168.5	-48.5	-36.7	0	0	0	118.2
335	K	35.9	Very low	38.5	Very low	193 Å²	193	142.7 Å²	142.7	84%	0.839	75%	0.75	S	S	*	*				169.8	129.3	103.5	-92	167.3	-178.6	173.7	0	113.9
336	K	33.7	Very low	37.6	Very low	215 Å²	215	148.2 Å²	148.2	94%	0.935	76%	0.762	S	S	*	*			trans	-151.1	143.5	131.8	-128.2	177.8	-176.7	-178.1	0	111.5
337	H	35.6	Very low	36.5	Very low	156 Å²	156	144.9 Å²	144.9	72%	0.722	77%	0.767	S	S	*	*			trans	-83.2	157.7	-173.8	-84.4	-107.8	0	0	0	113.5
338	S	33.6	Very low	35.6	Very low	121 Å²	121	148.2 Å²	148.2	85%	0.846	78%	0.778	S	S	*	*				-145	153.7	120.3	57	0	0	0	0	110.7
339	K	33	Very low	34.7	Very low	197 Å²	197	145.4 Å²	145.4	86%	0.857	78%	0.778	S	S	*	*			trans	-95.5	154.3	-174	-61.7	166.7	172.7	175.6	0	110.9
340	S	27.2	Very low	33.9	Very low	107 Å²	107	146.8 Å²	146.8	75%	0.748	78%	0.779	S	S	*	*			trans	-161.7	152.5	130.7	-158.2	0	0	0	0	112
341	F	28.5	Very low	33	Very low	203 Å²	203	143.8 Å²	143.8	89%	0.89	78%	0.781	S	S	*	*			trans	-19.7	140.2	170.2	-70.7	-104.1	0	0	0	116.7
342	G	28.6	Very low	32.6	Very low	74 Å²	74	147.6 Å²	147.6	76%	0.763	79%	0.787	S	S	*	*				129.1	160.8	57	0	0	0	0	0	106
343	E	26	Very low	32.9	Very low	175 Å²	175	149.2 Å²	149.2	82%	0.818	79%	0.785	S	S	*	*			cis	-158.2	167.9	-0.3	-161.8	-163.6	93.3	0	0	107.7
344	S	31.1	Very low	32.5	Very low	90 Å²	90	146.4 Å²	146.4	63%	0.629	78%	0.783	S	S	*	*			trans	64.1	122.6	150.3	-82.1	0	0	0	0	122.8
345	S	33.2	Very low	32.6	Very low	98 Å²	98	145.8 Å²	145.8	69%	0.685	78%	0.784	S	S	*	*				91	94.4	128.5	-64.3	0	0	0	0	123.2
346	R	32.6	Very low	32.4	Very low	233 Å²	233	140.9 Å²	140.9	88%	0.879	77%	0.774	S	S	*	*				73.1	150	112.8	-77.2	174.7	160	168.5	-6.3	122.5
347	S	29	Very low	32.9	Very low	110 Å²	110	138.8 Å²	138.8	77%	0.769	77%	0.767	S	S	*	*			trans	73.5	122.8	169.5	2.2	0	0	0	0	116.1
348	H	31.6	Very low	32.8	Very low	179 Å²	179	136.9 Å²	136.9	83%	0.829	77%	0.771	S	S	*	*				57.4	130.6	71.9	-97.9	56.3	0	0	0	112.3
349	S	29.8	Very low	33	Very low	93 Å²	93	135.3 Å²	135.3	65%	0.65	77%	0.766	S	S	*	*			cis	-166.9	168.8	7.5	31.8	0	0	0	0	111.6
350	H	32.3	Very low	33.1	Very low	178 Å²	178	133.1 Å²	133.1	82%	0.824	77%	0.769	S	S	*	*			trans	4	131.8	159.1	-58.6	-82.5	0	0	0	118.5
351	S	29.5	Very low	33.4	Very low	118 Å²	118	131.1 Å²	131.1	83%	0.825	77%	0.765	S	S	*	*				-179.3	164.1	83.9	38.7	0	0	0	0	113.5
352	H	31.5	Very low	34.6	Very low	179 Å²	179	126.7 Å²	126.7	83%	0.829	76%	0.757	S	S	*	*			trans	-78.4	-172	164	-60	-93.9	0	0	0	109.7
353	P	51.1	Low	35.2	Very low	101 Å²	101	130 Å²	130	66%	0.656	75%	0.754	S	S	*	*			cis	-146.7	-162.4	7.3	38.5	-13.8	0	0	0	115.8
354	T	34.9	Very low	35.8	Very low	120 Å²	120	130.8 Å²	130.8	74%	0.736	75%	0.751	S	S	*	*			trans	61.8	154.7	148.2	47.1	0	0	0	0	120.2
355	V	36.1	Very low	36.1	Very low	121 Å²	121	129.9 Å²	129.9	73%	0.733	75%	0.749	S	S	*	*			cis	168.3	137.2	-26	133.3	0	0	0	0	105.5
356	S	32.4	Very low	36.3	Very low	90 Å²	90	132.9 Å²	132.9	63%	0.629	75%	0.754	S	S	*	*			trans	75.1	159.2	157.2	-70.8	0	0	0	0	123.6
357	H	43.2	Very low	36.5	Very low	172 Å²	172	127.4 Å²	127.4	80%	0.796	75%	0.751	S	S	*	*			trans	76	114	169.6	-46	-70.5	0	0	0	115.2
358	S	33.5	Very low	36.9	Very low	115 Å²	115	131 Å²	131	80%	0.804	75%	0.753	S	S	*	*			cis	70.6	96.5	43.4	-173.5	0	0	0	0	114.3
359	A	37.9	Very low	37.6	Very low	89 Å²	89	127.5 Å²	127.5	74%	0.736	75%	0.746	S	S	*	*				-176.7	136.5	128.9	0	0	0	0	0	112.7
360	V	36.1	Very low	37.8	Very low	150 Å²	150	130 Å²	130	91%	0.909	75%	0.751	S	S	*	*			trans	-5.2	125.9	142.8	-151	0	0	0	0	115
361	G	32.9	Very low	38.2	Very low	65 Å²	65	127.3 Å²	127.3	67%	0.67	75%	0.747	S	S	*	*				162.9	165.8	98	0	0	0	0	0	114.4
362	P	53.6	Low	39.1	Very low	111 Å²	111	126.5 Å²	126.5	72%	0.721	74%	0.739	S	S	*	*			trans	-92	169.5	-162.1	37.7	-36.3	0	0	0	113
363	M	40.7	Very low	39.3	Very low	142 Å²	142	125.6 Å²	125.6	70%	0.7	74%	0.735	S	S	*	*				-171.2	159.6	121.1	-89.4	-31.3	-173.1	0	0	113.2
364	Y	38	Very low	38.6	Very low	193 Å²	193	127.5 Å²	127.5	76%	0.757	74%	0.735	S	S	*	*			trans	-48.3	176	164.9	58.8	-105.1	0	0	0	113.8
365	A	38.8	Very low	38.8	Very low	71 Å²	71	130.7 Å²	130.7	59%	0.587	74%	0.741	S	S	*	*			cis	-164.5	163.4	-3.2	0	0	0	0	0	109.3
366	M	36.7	Very low	38.7	Very low	160 Å²	160	128.7 Å²	128.7	79%	0.788	75%	0.745	S	S	*	*			trans	41.9	129.1	145.7	-51	-56.8	167.5	0	0	119.1
367	S	37.4	Very low	39.4	Very low	119 Å²	119	133.1 Å²	133.1	83%	0.832	76%	0.755	S	S	*	*				-161.7	155.1	73.5	-71.8	0	0	0	0	116
368	K	37.5	Very low	39.3	Very low	185 Å²	185	131.6 Å²	131.6	80%	0.804	75%	0.753	S	S	*	*			trans	-70.9	-171.7	176.8	-57.3	161.7	171.5	174.5	0	112.5
369	P	46.5	Very low	40	Very low	105 Å²	105	128.1 Å²	128.1	68%	0.682	74%	0.735	S	S	*	*			cis	-135.6	160.1	-19	16.8	8.7	0	0	0	117.2
370	I	32.9	Very low	40.3	Very low	146 Å²	146	129.1 Å²	129.1	75%	0.749	73%	0.732	S	S	*	*				31.7	125	126.2	-53.9	161.2	0	0	0	118.2
371	T	41	Very low	40.8	Very low	122 Å²	122	126.1 Å²	126.1	75%	0.748	72%	0.715	S	S	*	*				178.2	-175.2	67.4	-4.1	0	0	0	0	109.5
372	P	48.1	Very low	41.7	Very low	101 Å²	101	128.9 Å²	128.9	66%	0.656	71%	0.71	S	S	*	*				-130.1	161.2	-62.2	35.6	-16.7	0	0	0	115.2
373	H	35.6	Very low	41.6	Very low	159 Å²	159	132 Å²	132	74%	0.736	71%	0.712	S	S	*	*			trans	177.7	148.9	132.3	-109.8	-75.7	0	0	0	115.6
374	H	37.4	Very low	42.3	Very low	142 Å²	142	132.5 Å²	132.5	66%	0.657	71%	0.711	S	S	*	*			trans	42.4	103.1	158.5	-67.2	-49.8	0	0	0	123.1
375	Q	38	Very low	43.2	Very low	186 Å²	186	129.1 Å²	129.1	87%	0.869	70%	0.7	S	S	*	*				50.4	112.4	101.4	-157.7	162.3	14.8	0	0	119.4
376	G	34.1	Very low	44.4	Very low	79 Å²	79	133.4 Å²	133.4	81%	0.814	71%	0.705	S	S	*	*			trans	-177.6	72.6	173.3	0	0	0	0	0	112.8
377	H	46.5	Very low	45.6	Very low	183 Å²	183	132.6 Å²	132.6	85%	0.847	70%	0.697	S	S	*	*			trans	-96.4	90.6	179	-176.6	79.3	0	0	0	111.2
378	D	42	Very low	46.8	Very low	141 Å²	141	133 Å²	133	75%	0.754	69%	0.686	S	S	*	*			trans	-168.4	147.6	140.5	-149.3	-32	0	0	0	109.9
379	G	47.5	Very low	48.1	Very low	41 Å²	41	127.1 Å²	127.1	42%	0.423	66%	0.663	S	S	.	*			trans	125	-6	173.6	0	0	0	0	0	116.9	T381	G379-T381 VanDerWaalsContact C-N 3.33Å
380	T	44.3	Very low	49.2	Very low	110 Å²	110	129.2 Å²	129.2	68%	0.675	66%	0.662	S	S	*	*	H	α-helix	trans	-78.2	-18.4	174.5	53	0	0	0	0	113.2	K384	T380-K384 WeakPolarHBondContact O-CB 3.11Å; T380-K384 PolarHBondContact O-N 2.92Å
381	T	47.3	Very low	50.9	Low	88 Å²	88	126.1 Å²	126.1	54%	0.54	65%	0.647	S	S	.	*	H	α-helix	trans	-68.7	-52.9	178.1	48.9	0	0	0	0	112.1	G379 K383 K384 K385	G379-T381 VanDerWaalsContact C-N 3.33Å; T381-K383 PolarHBondContact O-N 3.34Å; T381-K384 PolarHBondContact O-N 3.32Å; T381-K385 WeakPolarHBondContact O-CB 3.42Å; T381-K385 PolarHBondContact O-N 3.48Å
382	E	51.1	Low	52.3	Low	122 Å²	122	127 Å²	127	57%	0.57	64%	0.636	S	S	*	*	H	α-helix	trans	-58.5	-44	179.1	-88.3	-67.7	109.6	0	0	112.7	K384 K385 K386	E382-K384 VanDerWaalsContact C-N 3.32Å; E382-K384 PolarHBondContact O-N 2.92Å; E382-K385 PolarHBondContact O-N 3.34Å; E382-K386 VanDerWaalsContact O-CB 3.29Å; E382-K386 WeakPolarHBondContact O-CB 3.45Å; E382-K386 PolarHBondContact O-N 3.04Å
383	K	52.6	Low	53.2	Low	178 Å²	178	126.7 Å²	126.7	77%	0.774	63%	0.629	S	S	*	*	H	α-helix	trans	-70.2	-28.8	-178.1	-145.7	173	-171.7	175.4	0	112.6	T381 K387	T381-K383 PolarHBondContact O-N 3.34Å; K383-K387 PolarHBondContact O-N 3.03Å
384	K	55.3	Low	54.7	Low	152 Å²	152	125.2 Å²	125.2	66%	0.661	62%	0.621	S	S	*	*	H	α-helix	trans	-75.3	-48.2	173.4	-170.4	176.1	178.5	-176.9	0	111	T380 T381 E382 K386 K387 E388	T380-K384 WeakPolarHBondContact O-CB 3.11Å; T380-K384 PolarHBondContact O-N 2.92Å; T381-K384 PolarHBondContact O-N 3.32Å; E382-K384 VanDerWaalsContact C-N 3.32Å; E382-K384 PolarHBondContact O-N 2.92Å; K384-K386 PolarHBondContact O-N 2.72Å; K384-K387 WeakPolarHBondContact O-CB 3.38Å; K384-K387 PolarHBondContact O-N 3.49Å; K384-K387 VanDerWaalsContact O-N 3.09Å; K384-E388 PolarHBondContact O-N 2.9Å
385	K	56.6	Low	55.7	Low	121 Å²	121	123.5 Å²	123.5	53%	0.526	61%	0.613	S	S	.	*	H	α-helix	trans	-57.8	-45	177	-170.8	177.1	179.1	-174.5	0	112.3	T381 E382 K387 E388 D389	T381-K385 WeakPolarHBondContact O-CB 3.42Å; T381-K385 PolarHBondContact O-N 3.48Å; E382-K385 PolarHBondContact O-N 3.34Å; K385-K387 VanDerWaalsContact C-N 3.28Å; K385-K387 PolarHBondContact O-N 3.44Å; K385-E388 PolarHBondContact O-N 3.17Å; K385-D389 PolarHBondContact O-N 3.21Å
386	K	62.8	Low	56.9	Low	161 Å²	161	120.6 Å²	120.6	70%	0.7	60%	0.599	S	S	*	*	H	α-helix	trans	-66.2	-24.5	176.4	-170.3	168.5	-174.2	167.8	0	114.3	E382 K384 K390	E382-K386 VanDerWaalsContact O-CB 3.29Å; E382-K386 WeakPolarHBondContact O-CB 3.45Å; E382-K386 PolarHBondContact O-N 3.04Å; K384-K386 PolarHBondContact O-N 2.72Å; K386-K390 WeakPolarHBondContact O-CB 3.47Å
387	K	62.5	Low	57.9	Low	144 Å²	144	122.4 Å²	122.4	63%	0.626	59%	0.585	S	S	*	*	H	α-helix	trans	-78.3	-44.4	171.9	-171.3	179.4	177.9	-175	0	110.5	K383 K384 K385 K390 D391	K383-K387 PolarHBondContact O-N 3.03Å; K384-K387 WeakPolarHBondContact O-CB 3.38Å; K384-K387 PolarHBondContact O-N 3.49Å; K384-K387 VanDerWaalsContact O-N 3.09Å; K385-K387 VanDerWaalsContact C-N 3.28Å; K385-K387 PolarHBondContact O-N 3.44Å; K387-K390 PolarHBondContact O-N 2.91Å; K387-D391 PolarHBondContact O-N 3.3Å
388	E	63.9	Low	58.4	Low	126 Å²	126	117.6 Å²	117.6	59%	0.589	57%	0.565	S	S	*	*	H	α-helix	trans	-64.3	-43.7	178.8	-168.4	175.1	165.3	0	0	112.8	K384 K385 K390 D391 R392	K384-E388 PolarHBondContact O-N 2.9Å; K385-E388 PolarHBondContact O-N 3.17Å; E388-K390 VanDerWaalsContact C-N 3.27Å; E388-K390 PolarHBondContact O-N 3.5Å; E388-D391 PolarHBondContact O-N 3.44Å; E388-R392 WeakPolarHBondContact O-CB 3.29Å; E388-R392 PolarHBondContact O-N 3.06Å
389	D	63.2	Low	59	Low	62 Å²	62	115.7 Å²	115.7	33%	0.332	55%	0.55	S	S	.	*	H	α-helix	trans	-60.8	-35.5	172.7	-81.1	-40.7	0	0	0	112	K385 R392 D393	K385-D389 PolarHBondContact O-N 3.21Å; D389-R392 PolarHBondContact O-N 3.3Å; D389-R392 IonicContact OD1-CZ 2.84Å; D389-R392 IonicContact OD1-NH1 3.76Å; D389-R392 PolarHBondContact OD1-NH1 2.96Å; D389-R392 IonicContact OD1-NH2 3.83Å; D389-R392 PolarHBondContact OD1-NH2 3.17Å; D389-D393 WeakPolarHBondContact O-CB 3.47Å; D389-D393 PolarHBondContact O-N 3.11Å
390	K	71.1	Confident	59.4	Low	149 Å²	149	120.6 Å²	120.6	65%	0.648	56%	0.562	S	S	*	*	H	α-helix	trans	-74.7	-36.1	179.8	-174.1	172.8	-179.5	176.7	0	113	K386 K387 E388 K394	K386-K390 WeakPolarHBondContact O-CB 3.47Å; K387-K390 PolarHBondContact O-N 2.91Å; E388-K390 VanDerWaalsContact C-N 3.27Å; E388-K390 PolarHBondContact O-N 3.5Å; K390-K394 PolarHBondContact O-N 3.32Å; K390-K394 VanDerWaalsContact O-N 3.09Å
391	D	68.8	Low	59.8	Low	82 Å²	82	122 Å²	122	44%	0.439	56%	0.559	S	S	.	*	H	α-helix	trans	-76	-29.9	172.1	-78.2	-45	0	0	0	111.6	K387 E388 H395	K387-D391 PolarHBondContact O-N 3.3Å; E388-D391 PolarHBondContact O-N 3.44Å; D391-H395 VanDerWaalsContact O-CB 3.26Å; D391-H395 WeakPolarHBondContact O-CB 3.33Å; D391-H395 PolarHBondContact O-N 2.98Å
392	R	68.8	Low	60	Low	139 Å²	139	123.3 Å²	123.3	53%	0.525	57%	0.567	S	S	.	*	H	α-helix	trans	-66.1	-44.3	169.2	-164.3	176.4	73.9	-111.9	-9.9	111.8	E388 D389 H395 E396	E388-R392 WeakPolarHBondContact O-CB 3.29Å; E388-R392 PolarHBondContact O-N 3.06Å; D389-R392 PolarHBondContact O-N 3.3Å; D389-R392 IonicContact OD1-CZ 2.84Å; D389-R392 IonicContact OD1-NH1 3.76Å; D389-R392 PolarHBondContact OD1-NH1 2.96Å; D389-R392 IonicContact OD1-NH2 3.83Å; D389-R392 PolarHBondContact OD1-NH2 3.17Å; R392-H395 PolarHBondContact O-N 3.22Å; R392-E396 VanDerWaalsContact O-CB 3.25Å; R392-E396 WeakPolarHBondContact O-CB 3.48Å; R392-E396 PolarHBondContact O-N 3.45Å
393	D	67.6	Low	60.2	Low	96 Å²	96	124.6 Å²	124.6	51%	0.513	57%	0.57	S	S	.	*	H	α-helix	trans	-61.8	-42.9	175.2	-173.4	-88.6	0	0	0	111.7	D389 E396 K397	D389-D393 WeakPolarHBondContact O-CB 3.47Å; D389-D393 PolarHBondContact O-N 3.11Å; D393-E396 PolarHBondContact O-N 2.84Å; D393-K397 WeakPolarHBondContact O-CB 3.49Å; D393-K397 PolarHBondContact O-N 3.12Å
394	K	67.4	Low	60.4	Low	128 Å²	128	121.2 Å²	121.2	56%	0.557	56%	0.556	S	S	*	*	H	α-helix	trans	-57.6	-50.8	170.5	-94	-174.3	170.4	-173.9	0	112.5	K390 E396 K397 D398	K390-K394 PolarHBondContact O-N 3.32Å; K390-K394 VanDerWaalsContact O-N 3.09Å; K394-E396 VanDerWaalsContact C-N 3.34Å; K394-E396 PolarHBondContact O-N 3.36Å; K394-K397 PolarHBondContact O-N 2.91Å; K394-D398 PolarHBondContact O-N 3.04Å
395	H	58.8	Low	60.6	Low	106 Å²	106	123 Å²	123	49%	0.491	56%	0.564	S	S	.	*	H	α-helix	trans	-69.1	-31.8	-177.4	179.7	-147.6	0	0	0	112.4	D391 R392 K399	D391-H395 VanDerWaalsContact O-CB 3.26Å; D391-H395 WeakPolarHBondContact O-CB 3.33Å; D391-H395 PolarHBondContact O-N 2.98Å; R392-H395 PolarHBondContact O-N 3.22Å; H395-K399 PolarHBondContact CE1-NZ 3.42Å; H395-K399 WeakPolarHBondContact NE2-CE 3.35Å; H395-K399 PolarHBondContact NE2-NZ 3.11Å; H395-K399 WeakPolarHBondContact O-CB 3.41Å; H395-K399 WeakPolarHBondContact O-CG 3.32Å; H395-K399 PolarHBondContact O-N 3.29Å
396	E	61.7	Low	61.4	Low	125 Å²	125	121 Å²	121	58%	0.584	56%	0.562	S	S	*	*	H	α-helix	trans	-67.6	-45.2	171.4	-176.5	165.8	-171.8	0	0	110.8	R392 D393 K394 K399 E400	R392-E396 VanDerWaalsContact O-CB 3.25Å; R392-E396 WeakPolarHBondContact O-CB 3.48Å; R392-E396 PolarHBondContact O-N 3.45Å; D393-E396 PolarHBondContact O-N 2.84Å; K394-E396 VanDerWaalsContact C-N 3.34Å; K394-E396 PolarHBondContact O-N 3.36Å; E396-K399 CarbonylContact O-C 3.47Å; E396-K399 PolarHBondContact O-N 3.33Å; E396-E400 WeakPolarHBondContact O-CB 3.36Å; E396-E400 PolarHBondContact O-N 3.22Å
397	K	56.6	Low	62.4	Low	116 Å²	116	115 Å²	115	50%	0.504	54%	0.538	S	S	.	.	H	α-helix	trans	-67.4	-34.3	177.9	-165.9	171	-165.3	163	0	113.4	D393 K394 E400 K401	D393-K397 WeakPolarHBondContact O-CB 3.49Å; D393-K397 PolarHBondContact O-N 3.12Å; K394-K397 PolarHBondContact O-N 2.91Å; K397-E400 PolarHBondContact O-N 2.91Å; K397-K401 VanDerWaalsContact O-CG 3.31Å; K397-K401 WeakPolarHBondContact O-CG 3.3Å; K397-K401 PolarHBondContact O-N 3.06Å; K397-K401 VanDerWaalsContact O-N 3.07Å
398	D	56.3	Low	63.8	Low	82 Å²	82	111.6 Å²	111.6	44%	0.439	53%	0.53	S	S	.	.	H	α-helix	trans	-79.7	-28.8	172.8	-73.1	-20.9	0	0	0	112.1	K394 K401 T402	K394-D398 PolarHBondContact O-N 3.04Å; D398-K401 IonicContact OD1-NZ 3.3Å; D398-K401 PolarHBondContact OD1-NZ 3.04Å; D398-T402 PolarHBondContact O-N 2.96Å; D398-T402 PolarHBondContact O-OG1 2.91Å
399	K	55.2	Low	65.1	Low	101 Å²	101	106.3 Å²	106.3	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-68.1	-31.8	164.7	-84.6	178.2	168.9	169.7	0	113.1	H395 E396 T402 K403	H395-K399 PolarHBondContact CE1-NZ 3.42Å; H395-K399 WeakPolarHBondContact NE2-CE 3.35Å; H395-K399 PolarHBondContact NE2-NZ 3.11Å; H395-K399 WeakPolarHBondContact O-CB 3.41Å; H395-K399 WeakPolarHBondContact O-CG 3.32Å; H395-K399 PolarHBondContact O-N 3.29Å; E396-K399 CarbonylContact O-C 3.47Å; E396-K399 PolarHBondContact O-N 3.33Å; K399-T402 WeakPolarHBondContact CA-OG1 3.29Å; K399-T402 PolarHBondContact O-OG1 2.96Å; K399-K403 VanDerWaalsContact O-CB 3.27Å; K399-K403 WeakPolarHBondContact O-CB 3.39Å; K399-K403 WeakPolarHBondContact O-CD 3.49Å; K399-K403 WeakPolarHBondContact O-CG 3.42Å; K399-K403 PolarHBondContact O-N 2.8Å
400	E	55.8	Low	66.5	Low	144 Å²	144	106.9 Å²	106.9	67%	0.673	51%	0.506	S	S	*	.	H	α-helix	trans	-69.5	-41.6	174.4	-169.8	177.9	-154.2	0	0	110.3	E396 K397 K403	E396-E400 WeakPolarHBondContact O-CB 3.36Å; E396-E400 PolarHBondContact O-N 3.22Å; K397-E400 PolarHBondContact O-N 2.91Å; E400-K403 PolarHBondContact O-N 3.16Å
401	K	52.9	Low	67.4	Low	141 Å²	141	104.4 Å²	104.4	61%	0.613	50%	0.497	S	S	*	.	H	α-helix	trans	-68.7	-30.5	172.6	-68.3	170.5	-163.3	159.3	0	114.5	K397 D398	K397-K401 VanDerWaalsContact O-CG 3.31Å; K397-K401 WeakPolarHBondContact O-CG 3.3Å; K397-K401 PolarHBondContact O-N 3.06Å; K397-K401 VanDerWaalsContact O-N 3.07Å; D398-K401 IonicContact OD1-NZ 3.3Å; D398-K401 PolarHBondContact OD1-NZ 3.04Å
402	T	50.9	Low	68.5	Low	114 Å²	114	100.9 Å²	100.9	70%	0.699	48%	0.478	S	S	*	.	H	α-helix	trans	-87.6	-16.2	176.5	43.5	0	0	0	0	113.5	D398 K399 K404	D398-T402 PolarHBondContact O-N 2.96Å; D398-T402 PolarHBondContact O-OG1 2.91Å; K399-T402 WeakPolarHBondContact CA-OG1 3.29Å; K399-T402 PolarHBondContact O-OG1 2.96Å; T402-K404 VanDerWaalsContact C-N 3.34Å; T402-K404 PolarHBondContact O-N 3.02Å
403	K	55.5	Low	69.7	Low	149 Å²	149	94.2 Å²	94.2	65%	0.648	45%	0.453	S	S	*	.	S	Bend	trans	-74.8	88.2	169.4	-81.5	170.4	-178.5	177.4	0	110.8	K399 E400	K399-K403 VanDerWaalsContact O-CB 3.27Å; K399-K403 WeakPolarHBondContact O-CB 3.39Å; K399-K403 WeakPolarHBondContact O-CD 3.49Å; K399-K403 WeakPolarHBondContact O-CG 3.42Å; K399-K403 PolarHBondContact O-N 2.8Å; E400-K403 PolarHBondContact O-N 3.16Å
404	K	56.6	Low	70.7	Confident	107 Å²	107	89.9 Å²	89.9	47%	0.465	43%	0.43	S	S	.	.			trans	73.3	103.5	162.8	-51.8	163.7	-167.9	-179.8	0	113.6	T402 T406 E467	T402-K404 VanDerWaalsContact C-N 3.34Å; T402-K404 PolarHBondContact O-N 3.02Å; K404-T406 PolarHBondContact O-N 2.95Å; K404-E467 WeakPolarHBondContact CD-OE1 3.48Å; K404-E467 WeakPolarHBondContact CD-OE2 3.31Å; K404-E467 VanDerWaalsContact CE-CD 3.43Å; K404-E467 WeakPolarHBondContact CE-OE1 3.42Å; K404-E467 VanDerWaalsContact CE-OE2 3.32Å; K404-E467 WeakPolarHBondContact CE-OE2 3.39Å; K404-E467 IonicContact NZ-OE1 3.64Å; K404-E467 PolarHBondContact NZ-OE1 3.04Å; K404-E467 IonicContact NZ-OE2 2.7Å; K404-E467 PolarHBondContact NZ-OE2 3.49Å
405	K	60.6	Low	71.8	Confident	190 Å²	190	91.4 Å²	91.4	83%	0.826	44%	0.436	S	S	*	.			trans	-59.2	105.6	160.9	-67.8	176.9	-179.4	175.8	0	107.5	T407	K405-T407 PolarHBondContact O-N 3.29Å
406	T	73.4	Confident	73.2	Confident	79 Å²	79	90.1 Å²	90.1	49%	0.485	43%	0.431	S	S	.	.			trans	-59.4	121.8	177.4	52.3	0	0	0	0	108.3	K404 T408	K404-T406 PolarHBondContact O-N 2.95Å; T406-T408 PolarHBondContact O-N 3.5Å
407	T	83.9	Confident	74.4	Confident	34 Å²	34	88.1 Å²	88.1	21%	0.209	42%	0.418	C	S	.	.			trans	-64.8	113.8	-173.3	-44.7	0	0	0	0	109.1	K405 Q411 V412	K405-T407 PolarHBondContact O-N 3.29Å; T407-Q411 HydrophobicContact CG2-CB 4.2Å; T407-Q411 HydrophobicContact CG2-CG 4.4Å; T407-V412 HydrophobicContact CG2-CG2 3.59Å
408	T	91.4	Very high	75.8	Confident	73 Å²	73	86.3 Å²	86.3	45%	0.448	41%	0.408	S	S	.	.			trans	-79.4	159.2	-175.5	67.3	0	0	0	0	111	T406 Y410 Q411 V412	T406-T408 PolarHBondContact O-N 3.5Å; T408-Y410 VanDerWaalsContact C-N 3.3Å; T408-Y410 PolarHBondContact O-N 3.26Å; T408-Q411 WeakPolarHBondContact O-CA 3Å; T408-Q411 WeakPolarHBondContact O-CB 3.19Å; T408-Q411 PolarHBondContact O-N 2.93Å; T408-Q411 WeakPolarHBondContact OG1-CB 3.3Å; T408-V412 PolarHBondContact O-N 3.38Å
409	A	90.9	Very high	77.1	Confident	15 Å²	15	87.4 Å²	87.4	12%	0.124	42%	0.418	C	S	.	.	H	α-helix	trans	-52.3	-46.5	179.6	0	0	0	0	0	112.8	Q411 V412 F413 W441 W452 R453 A456	A409-Q411 VanDerWaalsContact C-N 3.27Å; A409-Q411 PolarHBondContact O-N 3.46Å; A409-V412 PolarHBondContact O-N 2.85Å; A409-F413 WeakPolarHBondContact O-CB 3.26Å; A409-F413 PolarHBondContact O-N 3.35Å; A409-W441 HydrophobicContact CB-CH2 3.81Å; A409-W441 HydrophobicContact CB-CZ2 4.17Å; A409-W452 HydrophobicContact CB-CB 4.42Å; A409-R453 HydrophobicContact CB-CB 4.33Å; A409-R453 HydrophobicContact CB-CG 3.65Å; A409-A456 HydrophobicContact CB-CB 4.34Å
410	Y	91.4	Very high	78.4	Confident	75 Å²	75	86.3 Å²	86.3	29%	0.294	42%	0.417	S	S	.	.	H	α-helix	trans	-62	-32.9	175.5	-179.7	-120.6	0	0	0	113.1	T408 F413 C414 W441	T408-Y410 VanDerWaalsContact C-N 3.3Å; T408-Y410 PolarHBondContact O-N 3.26Å; Y410-F413 HydrophobicContact CD2-CD1 4.02Å; Y410-F413 HydrophobicContact CE2-CD1 4.17Å; Y410-F413 HydrophobicContact CE2-CE1 4.49Å; Y410-C414 WeakPolarHBondContact CE2-SG 3.29Å; Y410-C414 VanDerWaalsContact O-CB 3.3Å; Y410-C414 WeakPolarHBondContact O-CB 3.44Å; Y410-C414 PolarHBondContact O-N 3.4Å; Y410-C414 PolarHBondContact O-SG 2.94Å; Y410-W441 HydrophobicContact CD2-CB 3.8Å; Y410-W441 AromaticContact CD2-CD1 3.5Å; Y410-W441 AromaticContact CD2-CD2 3.57Å; Y410-W441 HydrophobicContact CD2-CD2 3.57Å; Y410-W441 AromaticContact CD2-CE2 3.86Å; Y410-W441 HydrophobicContact CD2-CE3 4.23Å; Y410-W441 AromaticContact CD2-CG 3.33Å; Y410-W441 HydrophobicContact CD2-CG 3.33Å; Y410-W441 AromaticContact CD2-NE1 3.81Å; Y410-W441 HydrophobicContact CE2-CB 3.64Å; Y410-W441 AromaticContact CE2-CD1 3.93Å; Y410-W441 HydrophobicContact CE2-CD2 4.35Å; Y410-W441 AromaticContact CE2-CG 3.69Å; Y410-W441 HydrophobicContact CE2-CG 3.69Å; Y410-W441 HydrophobicContact CG-CD2 4.45Å; Y410-W441 HydrophobicContact CG-CG 4.41Å
411	Q	91	Very high	79.6	Confident	97 Å²	97	80 Å²	80	45%	0.453	39%	0.388	S	S	.	.	H	α-helix	trans	-77.4	-34	-178.2	-158.2	165.4	38.4	0	0	112.2	T407 T408 A409 K415	T407-Q411 HydrophobicContact CG2-CB 4.2Å; T407-Q411 HydrophobicContact CG2-CG 4.4Å; T408-Q411 WeakPolarHBondContact O-CA 3Å; T408-Q411 WeakPolarHBondContact O-CB 3.19Å; T408-Q411 PolarHBondContact O-N 2.93Å; T408-Q411 WeakPolarHBondContact OG1-CB 3.3Å; A409-Q411 VanDerWaalsContact C-N 3.27Å; A409-Q411 PolarHBondContact O-N 3.46Å; Q411-K415 PolarHBondContact O-N 3.15Å; Q411-K415 VanDerWaalsContact O-N 3.17Å
412	V	92.1	Very high	81.1	Confident	7 Å²	7	77.4 Å²	77.4	4%	0.042	38%	0.38	C	S	.	.	H	α-helix	trans	-66.5	-48.3	167.8	-178.9	0	0	0	0	110.2	T407 T408 A409 C414 K415 E416 W452 K455 A456 L459	T407-V412 HydrophobicContact CG2-CG2 3.59Å; T408-V412 PolarHBondContact O-N 3.38Å; A409-V412 PolarHBondContact O-N 2.85Å; V412-C414 PolarHBondContact O-N 3.38Å; V412-K415 WeakPolarHBondContact O-CB 3.25Å; V412-K415 PolarHBondContact O-N 3.09Å; V412-E416 PolarHBondContact O-N 3.27Å; V412-W452 HydrophobicContact CG1-CE3 4.16Å; V412-W452 HydrophobicContact CG1-CZ3 4.13Å; V412-K455 HydrophobicContact CG1-CD 4.28Å; V412-K455 HydrophobicContact CG1-CG 4.26Å; V412-A456 HydrophobicContact CB-CB 4.48Å; V412-A456 HydrophobicContact CG2-CB 3.75Å; V412-L459 HydrophobicContact CG2-CD2 4.21Å
413	F	93.1	Very high	82.6	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-54.3	-51.6	175.2	167.4	-101.6	0	0	0	111.8	A409 Y410 K415 E416 Y417 L437 V440 W441 M444 W452	A409-F413 WeakPolarHBondContact O-CB 3.26Å; A409-F413 PolarHBondContact O-N 3.35Å; Y410-F413 HydrophobicContact CD2-CD1 4.02Å; Y410-F413 HydrophobicContact CE2-CD1 4.17Å; Y410-F413 HydrophobicContact CE2-CE1 4.49Å; F413-K415 PolarHBondContact O-N 3.35Å; F413-E416 PolarHBondContact O-N 2.87Å; F413-Y417 HydrophobicContact CD2-CD2 4.35Å; F413-Y417 HydrophobicContact CD2-CG 4.3Å; F413-Y417 AromaticContact CE2-CD1 4Å; F413-Y417 HydrophobicContact CE2-CD1 4Å; F413-Y417 AromaticContact CE2-CD2 3.61Å; F413-Y417 HydrophobicContact CE2-CD2 3.61Å; F413-Y417 HydrophobicContact CE2-CE2 4.22Å; F413-Y417 AromaticContact CE2-CG 3.48Å; F413-Y417 HydrophobicContact CE2-CG 3.48Å; F413-Y417 VanDerWaalsContact CE2-CG 3.48Å; F413-Y417 AromaticContact CZ-CD1 3.82Å; F413-Y417 HydrophobicContact CZ-CD1 3.82Å; F413-Y417 HydrophobicContact CZ-CD2 4.29Å; F413-Y417 HydrophobicContact CZ-CE1 4.41Å; F413-Y417 AromaticContact CZ-CG 3.74Å; F413-Y417 HydrophobicContact CZ-CG 3.74Å; F413-Y417 VanDerWaalsContact O-CB 3.22Å; F413-Y417 WeakPolarHBondContact O-CB 3.46Å; F413-Y417 PolarHBondContact O-N 3.23Å; F413-L437 HydrophobicContact CE1-CB 4.41Å; F413-L437 HydrophobicContact CE1-CD2 3.97Å; F413-L437 HydrophobicContact CZ-CD2 4.21Å; F413-V440 HydrophobicContact CE2-CG1 4.41Å; F413-V440 HydrophobicContact CZ-CB 4.28Å; F413-V440 HydrophobicContact CZ-CG1 3.8Å; F413-W441 HydrophobicContact CB-CE3 3.76Å; F413-W441 HydrophobicContact CB-CZ3 3.6Å; F413-W441 HydrophobicContact CD1-CB 4.1Å; F413-W441 HydrophobicContact CD1-CD2 4.16Å; F413-W441 AromaticContact CD1-CE3 3.52Å; F413-W441 HydrophobicContact CD1-CE3 3.52Å; F413-W441 HydrophobicContact CD1-CG 4.43Å; F413-W441 HydrophobicContact CD1-CZ3 4.27Å; F413-W441 HydrophobicContact CD2-CE3 4.05Å; F413-W441 HydrophobicContact CD2-CZ3 4.33Å; F413-W441 HydrophobicContact CE1-CB 3.81Å; F413-W441 HydrophobicContact CE1-CE3 4.15Å; F413-W441 HydrophobicContact CG-CD2 4.5Å; F413-W441 AromaticContact CG-CE3 3.47Å; F413-W441 HydrophobicContact CG-CE3 3.47Å; F413-W441 VanDerWaalsContact CG-CE3 3.47Å; F413-W441 AromaticContact CG-CZ3 3.8Å; F413-W441 HydrophobicContact CG-CZ3 3.8Å; F413-M444 HydrophobicContact CD2-CE 3.77Å; F413-M444 HydrophobicContact CE2-CE 3.42Å; F413-M444 VanDerWaalsContact CE2-CE 3.42Å; F413-M444 HydrophobicContact CZ-CE 4.1Å; F413-W452 HydrophobicContact CB-CD2 4.02Å; F413-W452 HydrophobicContact CB-CE3 4Å; F413-W452 HydrophobicContact CB-CG 4.37Å; F413-W452 HydrophobicContact CB-CZ3 4.42Å; F413-W452 HydrophobicContact CD2-CD2 4.21Å; F413-W452 AromaticContact CD2-CE2 3.78Å; F413-W452 HydrophobicContact CD2-CH2 4.42Å; F413-W452 AromaticContact CD2-CZ2 3.92Å; F413-W452 HydrophobicContact CD2-CZ2 3.92Å; F413-W452 AromaticContact CD2-NE1 3.99Å
414	C	90.3	Very high	83.8	Confident	5 Å²	5	74.8 Å²	74.8	3%	0.034	38%	0.376	C	S	.	.	H	α-helix	trans	-58.9	-30.7	176.7	-76	0	0	0	0	113.2	Y410 V412 R418	Y410-C414 WeakPolarHBondContact CE2-SG 3.29Å; Y410-C414 VanDerWaalsContact O-CB 3.3Å; Y410-C414 WeakPolarHBondContact O-CB 3.44Å; Y410-C414 PolarHBondContact O-N 3.4Å; Y410-C414 PolarHBondContact O-SG 2.94Å; V412-C414 PolarHBondContact O-N 3.38Å; C414-R418 WeakPolarHBondContact O-CB 3.21Å; C414-R418 WeakPolarHBondContact O-CD 3.35Å; C414-R418 WeakPolarHBondContact O-CG 3.4Å; C414-R418 PolarHBondContact O-N 3.08Å
415	K	89.2	Confident	84.7	Confident	160 Å²	160	74.7 Å²	74.7	70%	0.696	38%	0.377	S	S	*	.	H	α-helix	trans	-71.6	-48.5	-179.2	-170.5	-173.4	175.5	-166.8	0	111.3	Q411 V412 F413	Q411-K415 PolarHBondContact O-N 3.15Å; Q411-K415 VanDerWaalsContact O-N 3.17Å; V412-K415 WeakPolarHBondContact O-CB 3.25Å; V412-K415 PolarHBondContact O-N 3.09Å; F413-K415 PolarHBondContact O-N 3.35Å
416	E	89.3	Confident	85.6	Confident	79 Å²	79	70.8 Å²	70.8	37%	0.369	37%	0.371	S	S	.	.	H	α-helix	trans	-69.3	-55.9	179.4	-51.1	-74.9	-147.7	0	0	109.9	V412 F413 R418 V419 N420 W452 K455	V412-E416 PolarHBondContact O-N 3.27Å; F413-E416 PolarHBondContact O-N 2.87Å; E416-R418 VanDerWaalsContact C-N 3.25Å; E416-R418 PolarHBondContact O-N 3.46Å; E416-R418 VanDerWaalsContact O-N 3.17Å; E416-V419 WeakPolarHBondContact O-CB 3.49Å; E416-V419 PolarHBondContact O-N 3.22Å; E416-N420 PolarHBondContact O-OD1 2.97Å; E416-W452 HydrophobicContact CB-CH2 4.08Å; E416-W452 HydrophobicContact CB-CZ3 4.36Å; E416-W452 HydrophobicContact CG-CH2 4.01Å; E416-W452 HydrophobicContact CG-CZ3 3.85Å; E416-K455 WeakPolarHBondContact OE1-CE 3.25Å; E416-K455 IonicContact OE1-NZ 2.71Å; E416-K455 PolarHBondContact OE1-NZ 3.13Å
417	Y	86.3	Confident	85.7	Confident	82 Å²	82	70.8 Å²	70.8	32%	0.322	39%	0.387	S	S	.	.	H	α-helix	trans	-72.7	-15.3	-167.7	-142	-94.3	0	0	0	113.7	F413 V419 I421 L437 V440	F413-Y417 HydrophobicContact CD2-CD2 4.35Å; F413-Y417 HydrophobicContact CD2-CG 4.3Å; F413-Y417 AromaticContact CE2-CD1 4Å; F413-Y417 HydrophobicContact CE2-CD1 4Å; F413-Y417 AromaticContact CE2-CD2 3.61Å; F413-Y417 HydrophobicContact CE2-CD2 3.61Å; F413-Y417 HydrophobicContact CE2-CE2 4.22Å; F413-Y417 AromaticContact CE2-CG 3.48Å; F413-Y417 HydrophobicContact CE2-CG 3.48Å; F413-Y417 VanDerWaalsContact CE2-CG 3.48Å; F413-Y417 AromaticContact CZ-CD1 3.82Å; F413-Y417 HydrophobicContact CZ-CD1 3.82Å; F413-Y417 HydrophobicContact CZ-CD2 4.29Å; F413-Y417 HydrophobicContact CZ-CE1 4.41Å; F413-Y417 AromaticContact CZ-CG 3.74Å; F413-Y417 HydrophobicContact CZ-CG 3.74Å; F413-Y417 VanDerWaalsContact O-CB 3.22Å; F413-Y417 WeakPolarHBondContact O-CB 3.46Å; F413-Y417 PolarHBondContact O-N 3.23Å; Y417-V419 VanDerWaalsContact C-N 3.34Å; Y417-I421 HydrophobicContact CD1-CD1 3.68Å; Y417-I421 HydrophobicContact CD1-CG1 3.86Å; Y417-I421 HydrophobicContact CE1-CD1 3.88Å; Y417-I421 HydrophobicContact CE1-CG1 3.97Å; Y417-I421 WeakPolarHBondContact O-CG1 3.42Å; Y417-I421 PolarHBondContact O-N 3.32Å; Y417-I421 VanDerWaalsContact O-N 3.11Å; Y417-L437 HydrophobicContact CD1-CD2 3.9Å; Y417-L437 HydrophobicContact CG-CD2 4.35Å; Y417-V440 HydrophobicContact CE1-CG1 4Å
418	R	85.2	Confident	85.3	Confident	78 Å²	78	71.7 Å²	71.7	29%	0.294	39%	0.39	S	S	.	.	H	α-helix	trans	-63.3	-39.8	166.6	-87.4	173.3	-175.2	156.2	0.2	112.1	C414 E416 N422 L433 L437	C414-R418 WeakPolarHBondContact O-CB 3.21Å; C414-R418 WeakPolarHBondContact O-CD 3.35Å; C414-R418 WeakPolarHBondContact O-CG 3.4Å; C414-R418 PolarHBondContact O-N 3.08Å; E416-R418 VanDerWaalsContact C-N 3.25Å; E416-R418 PolarHBondContact O-N 3.46Å; E416-R418 VanDerWaalsContact O-N 3.17Å; R418-N422 WeakPolarHBondContact O-CB 3.49Å; R418-N422 PolarHBondContact O-N 3.09Å; R418-L433 HydrophobicContact CG-CD2 4.09Å; R418-L433 HydrophobicContact CG-CG 4.3Å; R418-L437 HydrophobicContact CG-CD1 3.28Å
419	V	83.9	Confident	85	Confident	105 Å²	105	73.4 Å²	73.4	64%	0.636	40%	0.396	S	S	*	.	H	α-helix	trans	-67.7	-43	-178.5	-175.3	0	0	0	0	109.5	E416 Y417 A423	E416-V419 WeakPolarHBondContact O-CB 3.49Å; E416-V419 PolarHBondContact O-N 3.22Å; Y417-V419 VanDerWaalsContact C-N 3.34Å; V419-A423 WeakPolarHBondContact O-CB 3.25Å; V419-A423 PolarHBondContact O-N 3.3Å
420	N	83.8	Confident	84.6	Confident	79 Å²	79	79 Å²	79	42%	0.422	42%	0.418	S	S	.	.	H	α-helix	trans	-57.8	-58.7	173.8	-66	79.7	0	0	0	112.5	E416 N422 A423 E424	E416-N420 PolarHBondContact O-OD1 2.97Å; N420-N422 VanDerWaalsContact C-N 3.29Å; N420-N422 PolarHBondContact O-N 2.89Å; N420-A423 WeakPolarHBondContact O-CB 3.42Å; N420-A423 PolarHBondContact O-N 3.28Å; N420-E424 PolarHBondContact O-N 2.67Å
421	I	80.9	Confident	84.4	Confident	12 Å²	12	76.9 Å²	76.9	6%	0.062	42%	0.419	C	S	.	.	H	α-helix	trans	-64.1	-34.3	-177.3	-61.8	176.5	0	0	0	111.5	Y417 A423 E424 H425 L428 L433 K436 L437	Y417-I421 HydrophobicContact CD1-CD1 3.68Å; Y417-I421 HydrophobicContact CD1-CG1 3.86Å; Y417-I421 HydrophobicContact CE1-CD1 3.88Å; Y417-I421 HydrophobicContact CE1-CG1 3.97Å; Y417-I421 WeakPolarHBondContact O-CG1 3.42Å; Y417-I421 PolarHBondContact O-N 3.32Å; Y417-I421 VanDerWaalsContact O-N 3.11Å; I421-A423 VanDerWaalsContact C-N 3.27Å; I421-A423 PolarHBondContact O-N 3.2Å; I421-E424 PolarHBondContact O-N 2.89Å; I421-H425 WeakPolarHBondContact O-CB 3.45Å; I421-H425 PolarHBondContact O-N 2.88Å; I421-L428 HydrophobicContact CG2-CD1 4.32Å; I421-L433 HydrophobicContact CB-CD1 3.63Å; I421-L433 HydrophobicContact CD1-CD1 4.33Å; I421-L433 HydrophobicContact CG2-CD1 3.47Å; I421-L433 VanDerWaalsContact CG2-CD1 3.47Å; I421-K436 HydrophobicContact CD1-CB 4.5Å; I421-L437 HydrophobicContact CD1-CD2 3.92Å; I421-L437 HydrophobicContact CD1-CG 4.19Å
422	N	84.1	Confident	84.3	Confident	85 Å²	85	77.1 Å²	77.1	46%	0.455	42%	0.42	S	S	.	.	H	α-helix	trans	-71.2	-21.4	176.5	-167.6	94.1	0	0	0	113	R418 N420 P426	R418-N422 WeakPolarHBondContact O-CB 3.49Å; R418-N422 PolarHBondContact O-N 3.09Å; N420-N422 VanDerWaalsContact C-N 3.29Å; N420-N422 PolarHBondContact O-N 2.89Å; N422-P426 WeakPolarHBondContact O-CA 3.41Å
423	A	82.3	Confident	84	Confident	78 Å²	78	77.3 Å²	77.3	65%	0.645	42%	0.421	S	S	*	.	H	α-helix	trans	-82.4	-38.2	171.8	0	0	0	0	0	112.1	V419 N420 I421	V419-A423 WeakPolarHBondContact O-CB 3.25Å; V419-A423 PolarHBondContact O-N 3.3Å; N420-A423 WeakPolarHBondContact O-CB 3.42Å; N420-A423 PolarHBondContact O-N 3.28Å; I421-A423 VanDerWaalsContact C-N 3.27Å; I421-A423 PolarHBondContact O-N 3.2Å
424	E	80.9	Confident	83.9	Confident	130 Å²	130	79.1 Å²	79.1	61%	0.607	43%	0.434	S	S	*	.	H	α-helix	trans	-72.2	-31.1	175.4	-69.8	170.5	-169.2	0	0	112.6	N420 I421	N420-E424 PolarHBondContact O-N 2.67Å; I421-E424 PolarHBondContact O-N 2.89Å
425	H	75.9	Confident	83.9	Confident	105 Å²	105	86.1 Å²	86.1	49%	0.486	46%	0.464	S	S	.	.	S	Bend	trans	-132.7	70.1	-178.8	-63.8	-33.1	0	0	0	111.5	I421 G427 L428	I421-H425 WeakPolarHBondContact O-CB 3.45Å; I421-H425 PolarHBondContact O-N 2.88Å; H425-G427 PolarHBondContact O-N 3.1Å; H425-G427 VanDerWaalsContact O-N 3.07Å; H425-L428 HydrophobicContact CB-CD1 3.47Å; H425-L428 VanDerWaalsContact CB-CD1 3.47Å; H425-L428 HydrophobicContact CB-CG 3.9Å; H425-L428 PolarHBondContact O-N 2.92Å
426	P	78.5	Confident	83.9	Confident	109 Å²	109	83.5 Å²	83.5	71%	0.708	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	111.1	177	27.2	-33.9	0	0	0	110.2	N422	N422-P426 WeakPolarHBondContact O-CA 3.41Å
427	G	74.8	Confident	84	Confident	79 Å²	79	79.8 Å²	79.8	81%	0.814	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.4	-0.7	178.2	0	0	0	0	0	116.2	H425	H425-G427 PolarHBondContact O-N 3.1Å; H425-G427 VanDerWaalsContact O-N 3.07Å
428	L	76.8	Confident	84.2	Confident	52 Å²	52	78 Å²	78	27%	0.272	44%	0.437	S	S	.	.			trans	-63.9	135.1	168.3	-82.6	174	0	0	0	111.3	I421 H425 E432	I421-L428 HydrophobicContact CG2-CD1 4.32Å; H425-L428 HydrophobicContact CB-CD1 3.47Å; H425-L428 VanDerWaalsContact CB-CD1 3.47Å; H425-L428 HydrophobicContact CB-CG 3.9Å; H425-L428 PolarHBondContact O-N 2.92Å; L428-E432 HydrophobicContact CD2-CB 4.24Å; L428-E432 WeakPolarHBondContact CD2-OE2 3.32Å
429	D	84.1	Confident	84.6	Confident	109 Å²	109	79.5 Å²	79.5	58%	0.583	45%	0.447	S	S	*	.			trans	-65.3	149.5	173.6	176.2	48.4	0	0	0	111.4	G431 E432 L433	D429-G431 PolarHBondContact O-N 3.44Å; D429-G431 VanDerWaalsContact O-N 3.15Å; D429-G431 PolarHBondContact OD2-N 3.2Å; D429-E432 PolarHBondContact O-N 3.35Å; D429-L433 PolarHBondContact O-N 3.2Å
430	F	82.6	Confident	85	Confident	132 Å²	132	76.7 Å²	76.7	58%	0.579	43%	0.43	S	S	*	.	H	α-helix	trans	-55	-34.4	178.9	178	-96.7	0	0	0	112.5	S434	F430-S434 VanDerWaalsContact O-CB 3.29Å; F430-S434 WeakPolarHBondContact O-CB 3.42Å; F430-S434 PolarHBondContact O-N 3.48Å
431	G	88.4	Confident	85.4	Confident	31 Å²	31	75.3 Å²	75.3	32%	0.32	42%	0.419	S	S	.	.	H	α-helix	trans	-65.2	-37	176	0	0	0	0	0	113.4	D429 K435	D429-G431 PolarHBondContact O-N 3.44Å; D429-G431 VanDerWaalsContact O-N 3.15Å; D429-G431 PolarHBondContact OD2-N 3.2Å; G431-K435 WeakPolarHBondContact O-CG 3.32Å; G431-K435 PolarHBondContact O-N 3.15Å
432	E	88.4	Confident	86	Confident	103 Å²	103	83 Å²	83	48%	0.481	45%	0.452	S	S	.	.	H	α-helix	trans	-80.5	-43.7	179.6	-59.5	-167.7	151.7	0	0	111.4	L428 D429 S434 K435 K436	L428-E432 HydrophobicContact CD2-CB 4.24Å; L428-E432 WeakPolarHBondContact CD2-OE2 3.32Å; D429-E432 PolarHBondContact O-N 3.35Å; E432-S434 VanDerWaalsContact C-N 3.27Å; E432-S434 PolarHBondContact O-N 3.28Å; E432-K435 WeakPolarHBondContact O-CB 3.22Å; E432-K435 PolarHBondContact O-N 3.41Å; E432-K436 PolarHBondContact O-N 3.3Å
433	L	86.5	Confident	86.4	Confident	11 Å²	11	83 Å²	83	6%	0.058	46%	0.463	C	S	.	.	H	α-helix	trans	-53.9	-44.8	171.1	176.9	58.4	0	0	0	111.2	R418 I421 D429 K435 K436 L437	R418-L433 HydrophobicContact CG-CD2 4.09Å; R418-L433 HydrophobicContact CG-CG 4.3Å; I421-L433 HydrophobicContact CB-CD1 3.63Å; I421-L433 HydrophobicContact CD1-CD1 4.33Å; I421-L433 HydrophobicContact CG2-CD1 3.47Å; I421-L433 VanDerWaalsContact CG2-CD1 3.47Å; D429-L433 PolarHBondContact O-N 3.2Å; L433-K435 VanDerWaalsContact C-N 3.34Å; L433-K435 PolarHBondContact O-N 3.04Å; L433-K436 PolarHBondContact O-N 2.93Å; L433-L437 HydrophobicContact CD1-CD1 4.04Å; L433-L437 HydrophobicContact CD1-CG 4.4Å; L433-L437 HydrophobicContact CG-CD1 3.99Å; L433-L437 VanDerWaalsContact O-CD1 3.3Å; L433-L437 WeakPolarHBondContact O-CD1 3.46Å; L433-L437 VanDerWaalsContact O-CG 3.26Å; L433-L437 WeakPolarHBondContact O-CG 3.33Å; L433-L437 PolarHBondContact O-N 3.17Å
434	S	89.3	Confident	86.8	Confident	38 Å²	38	80.3 Å²	80.3	27%	0.266	44%	0.438	S	S	.	.	H	α-helix	trans	-69.1	-27.9	177.6	-164.8	0	0	0	0	113.9	F430 E432 A438	F430-S434 VanDerWaalsContact O-CB 3.29Å; F430-S434 WeakPolarHBondContact O-CB 3.42Å; F430-S434 PolarHBondContact O-N 3.48Å; E432-S434 VanDerWaalsContact C-N 3.27Å; E432-S434 PolarHBondContact O-N 3.28Å; S434-A438 PolarHBondContact O-N 3.49Å
435	K	91.1	Very high	87.5	Confident	152 Å²	152	77.5 Å²	77.5	66%	0.661	43%	0.431	S	S	*	.	H	α-helix	trans	-70.8	-46.3	171.5	-73.5	168.2	-174.9	171.8	0	110.7	G431 E432 L433 L437 A438 E439	G431-K435 WeakPolarHBondContact O-CG 3.32Å; G431-K435 PolarHBondContact O-N 3.15Å; E432-K435 WeakPolarHBondContact O-CB 3.22Å; E432-K435 PolarHBondContact O-N 3.41Å; L433-K435 VanDerWaalsContact C-N 3.34Å; L433-K435 PolarHBondContact O-N 3.04Å; K435-L437 VanDerWaalsContact C-N 3.33Å; K435-L437 PolarHBondContact O-N 3.4Å; K435-A438 PolarHBondContact O-N 2.9Å; K435-A438 VanDerWaalsContact O-N 3.15Å; K435-E439 PolarHBondContact O-N 3.1Å
436	K	88.7	Confident	88.2	Confident	105 Å²	105	77.9 Å²	77.9	46%	0.457	43%	0.433	S	S	.	.	H	α-helix	trans	-59.2	-41.9	177.3	-76.9	-73.8	165.9	-157.5	0	112.3	I421 E432 L433 A438 E439 V440	I421-K436 HydrophobicContact CD1-CB 4.5Å; E432-K436 PolarHBondContact O-N 3.3Å; L433-K436 PolarHBondContact O-N 2.93Å; K436-A438 PolarHBondContact O-N 3.01Å; K436-E439 IonicContact NZ-OE2 2.82Å; K436-E439 PolarHBondContact NZ-OE2 3.02Å; K436-E439 WeakPolarHBondContact O-CB 3.48Å; K436-E439 PolarHBondContact O-N 2.91Å; K436-V440 WeakPolarHBondContact O-CG2 3.19Å; K436-V440 PolarHBondContact O-N 3.5Å
437	L	90.9	Very high	88.7	Confident	0 Å²	0	80.9 Å²	80.9	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-64.3	-39.2	174.8	-70.5	158	0	0	0	113.2	F413 Y417 R418 I421 L433 K435 W441	F413-L437 HydrophobicContact CE1-CB 4.41Å; F413-L437 HydrophobicContact CE1-CD2 3.97Å; F413-L437 HydrophobicContact CZ-CD2 4.21Å; Y417-L437 HydrophobicContact CD1-CD2 3.9Å; Y417-L437 HydrophobicContact CG-CD2 4.35Å; R418-L437 HydrophobicContact CG-CD1 3.28Å; I421-L437 HydrophobicContact CD1-CD2 3.92Å; I421-L437 HydrophobicContact CD1-CG 4.19Å; L433-L437 HydrophobicContact CD1-CD1 4.04Å; L433-L437 HydrophobicContact CD1-CG 4.4Å; L433-L437 HydrophobicContact CG-CD1 3.99Å; L433-L437 VanDerWaalsContact O-CD1 3.3Å; L433-L437 WeakPolarHBondContact O-CD1 3.46Å; L433-L437 VanDerWaalsContact O-CG 3.26Å; L433-L437 WeakPolarHBondContact O-CG 3.33Å; L433-L437 PolarHBondContact O-N 3.17Å; K435-L437 VanDerWaalsContact C-N 3.33Å; K435-L437 PolarHBondContact O-N 3.4Å; L437-W441 WeakPolarHBondContact O-CB 3.49Å; L437-W441 PolarHBondContact O-N 2.94Å
438	A	92.4	Very high	89.6	Confident	44 Å²	44	80.7 Å²	80.7	36%	0.364	42%	0.415	S	S	.	.	H	α-helix	trans	-67.7	-37.3	176.1	0	0	0	0	0	111.8	S434 K435 K436 K442	S434-A438 PolarHBondContact O-N 3.49Å; K435-A438 PolarHBondContact O-N 2.9Å; K435-A438 VanDerWaalsContact O-N 3.15Å; K436-A438 PolarHBondContact O-N 3.01Å; A438-K442 VanDerWaalsContact O-CB 3.31Å; A438-K442 WeakPolarHBondContact O-CB 3.5Å; A438-K442 PolarHBondContact O-N 3.13Å
439	E	92.8	Very high	90.3	Very high	110 Å²	110	79.8 Å²	79.8	51%	0.514	41%	0.409	S	S	.	.	H	α-helix	trans	-64	-53.8	174.3	-177.9	174	-145.8	0	0	111.3	K435 K436 W441 K442 A443	K435-E439 PolarHBondContact O-N 3.1Å; K436-E439 IonicContact NZ-OE2 2.82Å; K436-E439 PolarHBondContact NZ-OE2 3.02Å; K436-E439 WeakPolarHBondContact O-CB 3.48Å; K436-E439 PolarHBondContact O-N 2.91Å; E439-W441 PolarHBondContact O-N 3.37Å; E439-K442 WeakPolarHBondContact O-CB 3.16Å; E439-K442 PolarHBondContact O-N 2.93Å; E439-K442 VanDerWaalsContact O-N 3.1Å; E439-A443 WeakPolarHBondContact O-CB 3.3Å; E439-A443 PolarHBondContact O-N 3.49Å
440	V	91.2	Very high	90.7	Very high	46 Å²	46	78.1 Å²	78.1	28%	0.279	40%	0.4	S	S	.	.	H	α-helix	trans	-58.9	-46.1	176.7	174	0	0	0	0	111	F413 Y417 K436 K442 A443 M444	F413-V440 HydrophobicContact CE2-CG1 4.41Å; F413-V440 HydrophobicContact CZ-CB 4.28Å; F413-V440 HydrophobicContact CZ-CG1 3.8Å; Y417-V440 HydrophobicContact CE1-CG1 4Å; K436-V440 WeakPolarHBondContact O-CG2 3.19Å; K436-V440 PolarHBondContact O-N 3.5Å; V440-K442 VanDerWaalsContact C-N 3.28Å; V440-K442 PolarHBondContact O-N 3.09Å; V440-A443 PolarHBondContact O-N 2.89Å; V440-M444 VanDerWaalsContact O-CB 3.29Å; V440-M444 WeakPolarHBondContact O-CB 3.46Å; V440-M444 PolarHBondContact O-N 3.42Å
441	W	92.9	Very high	91.3	Very high	50 Å²	50	75.7 Å²	75.7	19%	0.189	40%	0.396	C	S	.	.	H	α-helix	trans	-62	-34.4	176.3	-179.4	-104	0	0	0	113	A409 Y410 F413 L437 E439 M444 K449 W452	A409-W441 HydrophobicContact CB-CH2 3.81Å; A409-W441 HydrophobicContact CB-CZ2 4.17Å; Y410-W441 HydrophobicContact CD2-CB 3.8Å; Y410-W441 AromaticContact CD2-CD1 3.5Å; Y410-W441 AromaticContact CD2-CD2 3.57Å; Y410-W441 HydrophobicContact CD2-CD2 3.57Å; Y410-W441 AromaticContact CD2-CE2 3.86Å; Y410-W441 HydrophobicContact CD2-CE3 4.23Å; Y410-W441 AromaticContact CD2-CG 3.33Å; Y410-W441 HydrophobicContact CD2-CG 3.33Å; Y410-W441 AromaticContact CD2-NE1 3.81Å; Y410-W441 HydrophobicContact CE2-CB 3.64Å; Y410-W441 AromaticContact CE2-CD1 3.93Å; Y410-W441 HydrophobicContact CE2-CD2 4.35Å; Y410-W441 AromaticContact CE2-CG 3.69Å; Y410-W441 HydrophobicContact CE2-CG 3.69Å; Y410-W441 HydrophobicContact CG-CD2 4.45Å; Y410-W441 HydrophobicContact CG-CG 4.41Å; F413-W441 HydrophobicContact CB-CE3 3.76Å; F413-W441 HydrophobicContact CB-CZ3 3.6Å; F413-W441 HydrophobicContact CD1-CB 4.1Å; F413-W441 HydrophobicContact CD1-CD2 4.16Å; F413-W441 AromaticContact CD1-CE3 3.52Å; F413-W441 HydrophobicContact CD1-CE3 3.52Å; F413-W441 HydrophobicContact CD1-CG 4.43Å; F413-W441 HydrophobicContact CD1-CZ3 4.27Å; F413-W441 HydrophobicContact CD2-CE3 4.05Å; F413-W441 HydrophobicContact CD2-CZ3 4.33Å; F413-W441 HydrophobicContact CE1-CB 3.81Å; F413-W441 HydrophobicContact CE1-CE3 4.15Å; F413-W441 HydrophobicContact CG-CD2 4.5Å; F413-W441 AromaticContact CG-CE3 3.47Å; F413-W441 HydrophobicContact CG-CE3 3.47Å; F413-W441 VanDerWaalsContact CG-CE3 3.47Å; F413-W441 AromaticContact CG-CZ3 3.8Å; F413-W441 HydrophobicContact CG-CZ3 3.8Å; L437-W441 WeakPolarHBondContact O-CB 3.49Å; L437-W441 PolarHBondContact O-N 2.94Å; E439-W441 PolarHBondContact O-N 3.37Å; W441-M444 HydrophobicContact CE3-CE 4.34Å; W441-M444 HydrophobicContact CE3-SD 3.95Å; W441-M444 HydrophobicContact CZ3-SD 3.99Å; W441-K449 HydrophobicContact CH2-CG 4.36Å; W441-K449 HydrophobicContact CZ2-CG 4.39Å; W441-K449 WeakPolarHBondContact O-CE 3.49Å; W441-K449 PolarHBondContact O-NZ 2.88Å; W441-W452 HydrophobicContact CH2-CB 3.79Å; W441-W452 HydrophobicContact CH2-CG 4.39Å; W441-W452 HydrophobicContact CZ3-CB 3.73Å; W441-W452 AromaticContact CZ3-CD1 3.88Å; W441-W452 AromaticContact CZ3-CG 3.83Å; W441-W452 HydrophobicContact CZ3-CG 3.83Å
442	K	92.6	Very high	91.6	Very high	174 Å²	174	76.2 Å²	76.2	76%	0.757	39%	0.388	S	S	*	.	H	α-helix	trans	-69.8	-47.2	176.3	-171.7	-177.9	178.2	-171	0	110.8	A438 E439 V440 K449	A438-K442 VanDerWaalsContact O-CB 3.31Å; A438-K442 WeakPolarHBondContact O-CB 3.5Å; A438-K442 PolarHBondContact O-N 3.13Å; E439-K442 WeakPolarHBondContact O-CB 3.16Å; E439-K442 PolarHBondContact O-N 2.93Å; E439-K442 VanDerWaalsContact O-N 3.1Å; V440-K442 VanDerWaalsContact C-N 3.28Å; V440-K442 PolarHBondContact O-N 3.09Å; K442-K449 PolarHBondContact O-NZ 2.92Å
443	A	93	Very high	91.8	Very high	84 Å²	84	75.9 Å²	75.9	69%	0.694	38%	0.382	S	S	*	.	H	α-helix	trans	-69.4	-27.8	-178.9	0	0	0	0	0	114	E439 V440	E439-A443 WeakPolarHBondContact O-CB 3.3Å; E439-A443 PolarHBondContact O-N 3.49Å; V440-A443 PolarHBondContact O-N 2.89Å
444	M	91.2	Very high	92.1	Very high	23 Å²	23	80.6 Å²	80.6	11%	0.113	40%	0.404	C	S	.	.	S	Bend	trans	-53.1	133.7	179.2	-179.2	-180	-69.8	0	0	112.2	F413 V440 W441 D448 K449	F413-M444 HydrophobicContact CD2-CE 3.77Å; F413-M444 HydrophobicContact CE2-CE 3.42Å; F413-M444 VanDerWaalsContact CE2-CE 3.42Å; F413-M444 HydrophobicContact CZ-CE 4.1Å; V440-M444 VanDerWaalsContact O-CB 3.29Å; V440-M444 WeakPolarHBondContact O-CB 3.46Å; V440-M444 PolarHBondContact O-N 3.42Å; W441-M444 HydrophobicContact CE3-CE 4.34Å; W441-M444 HydrophobicContact CE3-SD 3.95Å; W441-M444 HydrophobicContact CZ3-SD 3.99Å; M444-D448 HydrophobicContact CG-CB 3.52Å; M444-D448 HydrophobicContact SD-CB 3.8Å; M444-K449 HydrophobicContact CB-CG 4.42Å; M444-K449 HydrophobicContact CG-CG 4.12Å; M444-K449 WeakPolarHBondContact O-CE 3.37Å; M444-K449 PolarHBondContact O-NZ 3.19Å; M444-K449 HydrophobicContact SD-CG 4.1Å
445	P	94.6	Very high	92.3	Very high	70 Å²	70	82.9 Å²	82.9	46%	0.455	41%	0.409	S	S	.	.			trans	-67.3	158.4	-179.3	28	-34.9	0	0	0	112	K447 D448 K449	P445-K447 PolarHBondContact O-N 3.44Å; P445-D448 WeakPolarHBondContact CD-OD2 3.38Å; P445-D448 HydrophobicContact CG-CB 4.24Å; P445-D448 VanDerWaalsContact CG-OD2 3.24Å; P445-D448 WeakPolarHBondContact CG-OD2 3.26Å; P445-D448 PolarHBondContact O-N 2.81Å; P445-D448 VanDerWaalsContact O-N 3.14Å; P445-K449 PolarHBondContact O-N 2.85Å; P445-K449 VanDerWaalsContact O-N 3.07Å
446	E	91.4	Very high	92.4	Very high	113 Å²	113	75.8 Å²	75.8	53%	0.528	38%	0.379	S	S	.	.	H	α-helix	trans	-66.6	-22.4	-174.5	-160.7	55.1	-133.8	0	0	113.2	K449 L450 R453	E446-K449 WeakPolarHBondContact OE2-CD 3.36Å; E446-L450 WeakPolarHBondContact O-CB 3.39Å; E446-L450 PolarHBondContact O-N 3.46Å; E446-R453 IonicContact OE1-CZ 3.24Å; E446-R453 IonicContact OE1-NE 2.83Å; E446-R453 IonicContact OE1-NH2 2.84Å; E446-R453 PolarHBondContact OE1-NH2 3.08Å
447	K	89.4	Confident	92.6	Very high	173 Å²	173	77 Å²	77	75%	0.752	39%	0.386	S	S	*	.	H	α-helix	trans	-62.5	-50	171.4	-65.5	-177.1	178.5	-179.2	0	111.1	P445 L450 V451	P445-K447 PolarHBondContact O-N 3.44Å; K447-L450 WeakPolarHBondContact O-CA 3.41Å; K447-L450 VanDerWaalsContact O-CB 3.27Å; K447-L450 WeakPolarHBondContact O-CB 3.34Å; K447-L450 PolarHBondContact O-N 3.06Å; K447-L450 VanDerWaalsContact O-N 3.1Å; K447-V451 PolarHBondContact O-N 3.4Å; K447-V451 VanDerWaalsContact O-N 3.12Å
448	D	92.9	Very high	92.7	Very high	74 Å²	74	84 Å²	84	40%	0.396	41%	0.414	S	S	.	.	H	α-helix	trans	-71.2	-40	-179	-56.5	-3.6	0	0	0	110.6	M444 P445 L450 V451 W452	M444-D448 HydrophobicContact CG-CB 3.52Å; M444-D448 HydrophobicContact SD-CB 3.8Å; P445-D448 WeakPolarHBondContact CD-OD2 3.38Å; P445-D448 HydrophobicContact CG-CB 4.24Å; P445-D448 VanDerWaalsContact CG-OD2 3.24Å; P445-D448 WeakPolarHBondContact CG-OD2 3.26Å; P445-D448 PolarHBondContact O-N 2.81Å; P445-D448 VanDerWaalsContact O-N 3.14Å; D448-L450 PolarHBondContact O-N 2.91Å; D448-V451 WeakPolarHBondContact O-CA 3.42Å; D448-V451 WeakPolarHBondContact O-CB 3.43Å; D448-V451 PolarHBondContact O-N 2.93Å; D448-W452 PolarHBondContact O-N 2.93Å
449	K	92.4	Very high	92.5	Very high	34 Å²	34	85.1 Å²	85.1	15%	0.148	41%	0.413	C	S	.	.	H	α-helix	trans	-55.7	-33.8	169.8	-73.3	167	173.8	148.7	0	112	W441 K442 M444 P445 E446 R453	W441-K449 HydrophobicContact CH2-CG 4.36Å; W441-K449 HydrophobicContact CZ2-CG 4.39Å; W441-K449 WeakPolarHBondContact O-CE 3.49Å; W441-K449 PolarHBondContact O-NZ 2.88Å; K442-K449 PolarHBondContact O-NZ 2.92Å; M444-K449 HydrophobicContact CB-CG 4.42Å; M444-K449 HydrophobicContact CG-CG 4.12Å; M444-K449 WeakPolarHBondContact O-CE 3.37Å; M444-K449 PolarHBondContact O-NZ 3.19Å; M444-K449 HydrophobicContact SD-CG 4.1Å; P445-K449 PolarHBondContact O-N 2.85Å; P445-K449 VanDerWaalsContact O-N 3.07Å; E446-K449 WeakPolarHBondContact OE2-CD 3.36Å; K449-R453 WeakPolarHBondContact O-CB 3.44Å; K449-R453 VanDerWaalsContact O-CG 3.27Å; K449-R453 WeakPolarHBondContact O-CG 3.28Å; K449-R453 PolarHBondContact O-N 2.96Å; K449-R453 PolarHBondContact O-NE 3.39Å
450	L	92.8	Very high	92.3	Very high	73 Å²	73	82.5 Å²	82.5	38%	0.382	40%	0.401	S	S	.	.	H	α-helix	trans	-69.1	-41.5	173.6	-178.3	66.5	0	0	0	111.7	E446 K447 D448 W452 R453 Q454	E446-L450 WeakPolarHBondContact O-CB 3.39Å; E446-L450 PolarHBondContact O-N 3.46Å; K447-L450 WeakPolarHBondContact O-CA 3.41Å; K447-L450 VanDerWaalsContact O-CB 3.27Å; K447-L450 WeakPolarHBondContact O-CB 3.34Å; K447-L450 PolarHBondContact O-N 3.06Å; K447-L450 VanDerWaalsContact O-N 3.1Å; D448-L450 PolarHBondContact O-N 2.91Å; L450-W452 PolarHBondContact O-N 3.19Å; L450-R453 VanDerWaalsContact CD1-NH1 3.3Å; L450-R453 WeakPolarHBondContact O-CB 3.07Å; L450-R453 PolarHBondContact O-N 3.31Å; L450-R453 VanDerWaalsContact O-N 3.16Å; L450-Q454 WeakPolarHBondContact O-CG 3.45Å; L450-Q454 PolarHBondContact O-N 2.93Å
451	V	94.4	Very high	92.2	Very high	82 Å²	82	86.4 Å²	86.4	50%	0.497	42%	0.416	S	S	.	.	H	α-helix	trans	-58.9	-45.6	172.9	179.1	0	0	0	0	110.8	K447 D448 R453 Q454 K455	K447-V451 PolarHBondContact O-N 3.4Å; K447-V451 VanDerWaalsContact O-N 3.12Å; D448-V451 WeakPolarHBondContact O-CA 3.42Å; D448-V451 WeakPolarHBondContact O-CB 3.43Å; D448-V451 PolarHBondContact O-N 2.93Å; V451-R453 VanDerWaalsContact C-N 3.34Å; V451-R453 PolarHBondContact O-N 3.32Å; V451-Q454 PolarHBondContact O-N 2.96Å; V451-K455 WeakPolarHBondContact O-CB 3.22Å; V451-K455 PolarHBondContact O-N 3.43Å
452	W	93.8	Very high	92	Very high	41 Å²	41	90 Å²	90	16%	0.155	43%	0.433	C	S	.	.	H	α-helix	trans	-65.4	-34.2	175.1	-69.2	107.2	0	0	0	113.2	A409 V412 F413 E416 W441 D448 L450 K455 A456	A409-W452 HydrophobicContact CB-CB 4.42Å; V412-W452 HydrophobicContact CG1-CE3 4.16Å; V412-W452 HydrophobicContact CG1-CZ3 4.13Å; F413-W452 HydrophobicContact CB-CD2 4.02Å; F413-W452 HydrophobicContact CB-CE3 4Å; F413-W452 HydrophobicContact CB-CG 4.37Å; F413-W452 HydrophobicContact CB-CZ3 4.42Å; F413-W452 HydrophobicContact CD2-CD2 4.21Å; F413-W452 AromaticContact CD2-CE2 3.78Å; F413-W452 HydrophobicContact CD2-CH2 4.42Å; F413-W452 AromaticContact CD2-CZ2 3.92Å; F413-W452 HydrophobicContact CD2-CZ2 3.92Å; F413-W452 AromaticContact CD2-NE1 3.99Å; E416-W452 HydrophobicContact CB-CH2 4.08Å; E416-W452 HydrophobicContact CB-CZ3 4.36Å; E416-W452 HydrophobicContact CG-CH2 4.01Å; E416-W452 HydrophobicContact CG-CZ3 3.85Å; W441-W452 HydrophobicContact CH2-CB 3.79Å; W441-W452 HydrophobicContact CH2-CG 4.39Å; W441-W452 HydrophobicContact CZ3-CB 3.73Å; W441-W452 AromaticContact CZ3-CD1 3.88Å; W441-W452 AromaticContact CZ3-CG 3.83Å; W441-W452 HydrophobicContact CZ3-CG 3.83Å; D448-W452 PolarHBondContact O-N 2.93Å; L450-W452 PolarHBondContact O-N 3.19Å; W452-K455 HydrophobicContact CE3-CD 4.14Å; W452-K455 HydrophobicContact CZ3-CD 3.95Å; W452-A456 VanDerWaalsContact O-CB 3.29Å; W452-A456 WeakPolarHBondContact O-CB 3.5Å; W452-A456 PolarHBondContact O-N 2.85Å
453	R	92.4	Very high	91.6	Very high	96 Å²	96	86.1 Å²	86.1	36%	0.362	42%	0.417	S	S	.	.	H	α-helix	trans	-64.5	-42.7	171.2	-78.3	-178.2	-77.9	134.9	-12	111.8	A409 E446 K449 L450 V451 Q457	A409-R453 HydrophobicContact CB-CB 4.33Å; A409-R453 HydrophobicContact CB-CG 3.65Å; E446-R453 IonicContact OE1-CZ 3.24Å; E446-R453 IonicContact OE1-NE 2.83Å; E446-R453 IonicContact OE1-NH2 2.84Å; E446-R453 PolarHBondContact OE1-NH2 3.08Å; K449-R453 WeakPolarHBondContact O-CB 3.44Å; K449-R453 VanDerWaalsContact O-CG 3.27Å; K449-R453 WeakPolarHBondContact O-CG 3.28Å; K449-R453 PolarHBondContact O-N 2.96Å; K449-R453 PolarHBondContact O-NE 3.39Å; L450-R453 VanDerWaalsContact CD1-NH1 3.3Å; L450-R453 WeakPolarHBondContact O-CB 3.07Å; L450-R453 PolarHBondContact O-N 3.31Å; L450-R453 VanDerWaalsContact O-N 3.16Å; V451-R453 VanDerWaalsContact C-N 3.34Å; V451-R453 PolarHBondContact O-N 3.32Å; R453-Q457 WeakPolarHBondContact O-CB 3.46Å; R453-Q457 WeakPolarHBondContact O-CG 3.38Å; R453-Q457 PolarHBondContact O-N 2.99Å
454	Q	94.5	Very high	91.2	Very high	111 Å²	111	85.6 Å²	85.6	52%	0.519	40%	0.403	S	S	.	.	H	α-helix	trans	-66.3	-46.5	175.5	-71.3	175.4	-3.1	0	0	111.7	L450 V451 A456 Q457 Y458	L450-Q454 WeakPolarHBondContact O-CG 3.45Å; L450-Q454 PolarHBondContact O-N 2.93Å; V451-Q454 PolarHBondContact O-N 2.96Å; Q454-A456 VanDerWaalsContact C-N 3.31Å; Q454-A456 PolarHBondContact O-N 3.34Å; Q454-Q457 PolarHBondContact O-N 3.4Å; Q454-Y458 WeakPolarHBondContact O-CB 3.24Å; Q454-Y458 PolarHBondContact O-N 2.91Å
455	K	93.1	Very high	90.9	Very high	85 Å²	85	91.6 Å²	91.6	37%	0.37	43%	0.428	S	S	.	.	H	α-helix	trans	-58.2	-42	176.3	-172.2	172.5	175.4	177.3	0	111.6	V412 E416 V451 W452 L459	V412-K455 HydrophobicContact CG1-CD 4.28Å; V412-K455 HydrophobicContact CG1-CG 4.26Å; E416-K455 WeakPolarHBondContact OE1-CE 3.25Å; E416-K455 IonicContact OE1-NZ 2.71Å; E416-K455 PolarHBondContact OE1-NZ 3.13Å; V451-K455 WeakPolarHBondContact O-CB 3.22Å; V451-K455 PolarHBondContact O-N 3.43Å; W452-K455 HydrophobicContact CE3-CD 4.14Å; W452-K455 HydrophobicContact CZ3-CD 3.95Å; K455-L459 VanDerWaalsContact O-CB 3.32Å; K455-L459 WeakPolarHBondContact O-CB 3.43Å; K455-L459 PolarHBondContact O-N 3Å
456	A	93.2	Very high	90.1	Very high	4 Å²	4	90.9 Å²	90.9	3%	0.033	43%	0.429	C	S	.	.	H	α-helix	trans	-66.9	-43.3	174.5	0	0	0	0	0	113.3	A409 V412 W452 Q454 L459 Q460	A409-A456 HydrophobicContact CB-CB 4.34Å; V412-A456 HydrophobicContact CB-CB 4.48Å; V412-A456 HydrophobicContact CG2-CB 3.75Å; W452-A456 VanDerWaalsContact O-CB 3.29Å; W452-A456 WeakPolarHBondContact O-CB 3.5Å; W452-A456 PolarHBondContact O-N 2.85Å; Q454-A456 VanDerWaalsContact C-N 3.31Å; Q454-A456 PolarHBondContact O-N 3.34Å; A456-L459 PolarHBondContact O-N 3.34Å; A456-Q460 VanDerWaalsContact O-CB 3.25Å; A456-Q460 WeakPolarHBondContact O-CB 3.42Å; A456-Q460 PolarHBondContact O-N 3.17Å
457	Q	92.9	Very high	89.3	Confident	129 Å²	129	88.6 Å²	88.6	60%	0.603	42%	0.418	S	S	*	.	H	α-helix	trans	-62.4	-42.3	174.6	-76.4	179.9	2.7	0	0	112.3	R453 Q454 Q460 H461	R453-Q457 WeakPolarHBondContact O-CB 3.46Å; R453-Q457 WeakPolarHBondContact O-CG 3.38Å; R453-Q457 PolarHBondContact O-N 2.99Å; Q454-Q457 PolarHBondContact O-N 3.4Å; Q457-Q460 PolarHBondContact O-N 2.9Å; Q457-H461 VanDerWaalsContact O-CB 3.28Å; Q457-H461 WeakPolarHBondContact O-CB 3.44Å; Q457-H461 PolarHBondContact O-N 3.3Å
458	Y	92.4	Very high	88.3	Confident	149 Å²	149	83.7 Å²	83.7	58%	0.584	41%	0.41	S	S	*	.	H	α-helix	trans	-61.7	-47.9	175.4	175	-91.1	0	0	0	111.3	Q454 Q460 H461 K462	Q454-Y458 WeakPolarHBondContact O-CB 3.24Å; Q454-Y458 PolarHBondContact O-N 2.91Å; Y458-Q460 PolarHBondContact O-N 2.95Å; Y458-H461 PolarHBondContact O-N 3.44Å; Y458-K462 HydrophobicContact CE1-CD 4.09Å; Y458-K462 WeakPolarHBondContact O-CB 3.29Å; Y458-K462 PolarHBondContact O-N 3.37Å
459	L	89.1	Confident	86.7	Confident	66 Å²	66	85 Å²	85	35%	0.346	42%	0.421	S	S	.	.	H	α-helix	trans	-63.8	-42.2	179.7	-167.5	66.8	0	0	0	111.7	V412 K455 A456 K462 Q463	V412-L459 HydrophobicContact CG2-CD2 4.21Å; K455-L459 VanDerWaalsContact O-CB 3.32Å; K455-L459 WeakPolarHBondContact O-CB 3.43Å; K455-L459 PolarHBondContact O-N 3Å; A456-L459 PolarHBondContact O-N 3.34Å; L459-K462 PolarHBondContact O-N 2.91Å; L459-Q463 WeakPolarHBondContact O-CG 2.85Å; L459-Q463 PolarHBondContact O-N 3.02Å
460	Q	88.9	Confident	85	Confident	55 Å²	55	87.9 Å²	87.9	26%	0.257	44%	0.441	S	S	.	.	H	α-helix	trans	-61.7	-42.5	173.2	-173.6	-168.4	-0.6	0	0	111.7	A456 Q457 Y458 Q463 N464	A456-Q460 VanDerWaalsContact O-CB 3.25Å; A456-Q460 WeakPolarHBondContact O-CB 3.42Å; A456-Q460 PolarHBondContact O-N 3.17Å; Q457-Q460 PolarHBondContact O-N 2.9Å; Y458-Q460 PolarHBondContact O-N 2.95Å; Q460-Q463 PolarHBondContact O-N 3.36Å; Q460-N464 WeakPolarHBondContact O-CB 3.45Å; Q460-N464 VanDerWaalsContact O-CG 3.22Å; Q460-N464 PolarHBondContact O-N 3.11Å; Q460-N464 PolarHBondContact O-ND2 2.82Å
461	H	87.9	Confident	83.1	Confident	129 Å²	129	89.2 Å²	89.2	60%	0.597	45%	0.452	S	S	*	.	H	α-helix	trans	-66.1	-41.1	177	-176.3	-99.1	0	0	0	111.8	Q457 Y458 N464 K465	Q457-H461 VanDerWaalsContact O-CB 3.28Å; Q457-H461 WeakPolarHBondContact O-CB 3.44Å; Q457-H461 PolarHBondContact O-N 3.3Å; Y458-H461 PolarHBondContact O-N 3.44Å; H461-N464 PolarHBondContact O-N 2.92Å; H461-K465 VanDerWaalsContact O-CB 3.31Å; H461-K465 WeakPolarHBondContact O-CB 3.31Å; H461-K465 PolarHBondContact O-N 3.37Å
462	K	89.4	Confident	80.7	Confident	125 Å²	125	94.2 Å²	94.2	54%	0.543	47%	0.467	S	S	.	.	H	α-helix	trans	-61.4	-45	175.1	-171.8	170.5	-178.7	171.3	0	111.4	Y458 L459 K465 A466	Y458-K462 HydrophobicContact CE1-CD 4.09Å; Y458-K462 WeakPolarHBondContact O-CB 3.29Å; Y458-K462 PolarHBondContact O-N 3.37Å; L459-K462 PolarHBondContact O-N 2.91Å; K462-K465 PolarHBondContact O-N 3.17Å; K462-A466 PolarHBondContact O-N 3.31Å; K462-A466 VanDerWaalsContact O-N 3.13Å
463	Q	84.1	Confident	78.3	Confident	92 Å²	92	100.5 Å²	100.5	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-62.9	-52.3	174.4	-74.4	178.1	-16.4	0	0	112	L459 Q460 K465 A466 E467	L459-Q463 WeakPolarHBondContact O-CG 2.85Å; L459-Q463 PolarHBondContact O-N 3.02Å; Q460-Q463 PolarHBondContact O-N 3.36Å; Q463-K465 VanDerWaalsContact C-N 3.25Å; Q463-K465 PolarHBondContact O-N 3.21Å; Q463-A466 PolarHBondContact O-N 3.29Å; Q463-A466 VanDerWaalsContact O-N 3.1Å; Q463-E467 WeakPolarHBondContact O-CG 3.37Å; Q463-E467 PolarHBondContact O-N 2.93Å
464	N	85	Confident	75.7	Confident	74 Å²	74	104.8 Å²	104.8	40%	0.396	52%	0.52	S	S	.	.	H	α-helix	trans	-57.5	-37.4	178.5	-74.8	-18.1	0	0	0	112.5	Q460 H461 E467 A468	Q460-N464 WeakPolarHBondContact O-CB 3.45Å; Q460-N464 VanDerWaalsContact O-CG 3.22Å; Q460-N464 PolarHBondContact O-N 3.11Å; Q460-N464 PolarHBondContact O-ND2 2.82Å; H461-N464 PolarHBondContact O-N 2.92Å; N464-E467 PolarHBondContact O-N 2.93Å; N464-A468 WeakPolarHBondContact O-CB 3.46Å; N464-A468 PolarHBondContact O-N 3.49Å
465	K	84.4	Confident	72.9	Confident	148 Å²	148	104.4 Å²	104.4	64%	0.643	53%	0.529	S	S	*	.	H	α-helix	trans	-65.5	-44.4	176.4	-174.1	-179.9	177.5	-173	0	111.6	H461 K462 Q463 A468 T469	H461-K465 VanDerWaalsContact O-CB 3.31Å; H461-K465 WeakPolarHBondContact O-CB 3.31Å; H461-K465 PolarHBondContact O-N 3.37Å; K462-K465 PolarHBondContact O-N 3.17Å; Q463-K465 VanDerWaalsContact C-N 3.25Å; Q463-K465 PolarHBondContact O-N 3.21Å; K465-A468 PolarHBondContact O-N 3.13Å; K465-T469 PolarHBondContact O-N 2.96Å
466	A	77.8	Confident	70.3	Confident	56 Å²	56	105.9 Å²	105.9	46%	0.463	55%	0.55	S	S	.	.	H	α-helix	trans	-65.8	-37.6	176.4	0	0	0	0	0	112.5	K462 Q463 T469 T470	K462-A466 PolarHBondContact O-N 3.31Å; K462-A466 VanDerWaalsContact O-N 3.13Å; Q463-A466 PolarHBondContact O-N 3.29Å; Q463-A466 VanDerWaalsContact O-N 3.1Å; A466-T469 PolarHBondContact O-N 3.35Å; A466-T469 PolarHBondContact O-OG1 2.81Å; A466-T470 PolarHBondContact O-N 3.17Å
467	E	73.7	Confident	67.4	Low	64 Å²	64	110.9 Å²	110.9	30%	0.299	59%	0.585	S	S	.	*	H	α-helix	trans	-74.2	-27.2	178.9	-64.3	172.3	120.4	0	0	112.7	K404 Q463 N464 T469 T470 V471	K404-E467 WeakPolarHBondContact CD-OE1 3.48Å; K404-E467 WeakPolarHBondContact CD-OE2 3.31Å; K404-E467 VanDerWaalsContact CE-CD 3.43Å; K404-E467 WeakPolarHBondContact CE-OE1 3.42Å; K404-E467 VanDerWaalsContact CE-OE2 3.32Å; K404-E467 WeakPolarHBondContact CE-OE2 3.39Å; K404-E467 IonicContact NZ-OE1 3.64Å; K404-E467 PolarHBondContact NZ-OE1 3.04Å; K404-E467 IonicContact NZ-OE2 2.7Å; K404-E467 PolarHBondContact NZ-OE2 3.49Å; Q463-E467 WeakPolarHBondContact O-CG 3.37Å; Q463-E467 PolarHBondContact O-N 2.93Å; N464-E467 PolarHBondContact O-N 2.93Å; E467-T469 VanDerWaalsContact C-N 3.32Å; E467-T470 PolarHBondContact O-N 2.8Å; E467-T470 PolarHBondContact O-OG1 2.88Å; E467-V471 WeakPolarHBondContact O-CG2 3.43Å; E467-V471 PolarHBondContact O-N 2.95Å
468	A	69.3	Low	64.6	Low	70 Å²	70	113.2 Å²	113.2	58%	0.579	60%	0.601	S	S	*	*	H	α-helix	trans	-67.3	-31.1	173.4	0	0	0	0	0	112.8	N464 K465	N464-A468 WeakPolarHBondContact O-CB 3.46Å; N464-A468 PolarHBondContact O-N 3.49Å; K465-A468 PolarHBondContact O-N 3.13Å
469	T	58.9	Low	61.7	Low	102 Å²	102	109.8 Å²	109.8	63%	0.626	61%	0.612	S	S	*	*	H	α-helix	trans	-77	-29.4	177.4	58.9	0	0	0	0	112.7	K465 A466 E467	K465-T469 PolarHBondContact O-N 2.96Å; A466-T469 PolarHBondContact O-N 3.35Å; A466-T469 PolarHBondContact O-OG1 2.81Å; E467-T469 VanDerWaalsContact C-N 3.32Å
470	T	57.1	Low	59.3	Low	94 Å²	94	116.3 Å²	116.3	58%	0.577	64%	0.637	S	S	*	*	H	α-helix	trans	-83.2	-24.4	-178.3	57.4	0	0	0	0	114.5	A466 E467 K472	A466-T470 PolarHBondContact O-N 3.17Å; E467-T470 PolarHBondContact O-N 2.8Å; E467-T470 PolarHBondContact O-OG1 2.88Å; T470-K472 VanDerWaalsContact C-N 3.32Å; T470-K472 PolarHBondContact O-N 3.03Å
471	V	52.8	Low	56.7	Low	102 Å²	102	121 Å²	121	62%	0.618	67%	0.67	S	S	*	*	H	α-helix	trans	-69.5	-26.4	-179.1	168.3	0	0	0	0	113.2	E467 Q473 K474	E467-V471 WeakPolarHBondContact O-CG2 3.43Å; E467-V471 PolarHBondContact O-N 2.95Å; V471-Q473 PolarHBondContact O-N 3.25Å; V471-Q473 VanDerWaalsContact O-N 3.1Å; V471-K474 PolarHBondContact O-N 2.95Å
472	K	43.1	Very low	54.1	Low	186 Å²	186	124 Å²	124	81%	0.809	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-9.3	-176.6	-150.1	177.1	-178.1	-173.7	0	114.3	T470	T470-K472 VanDerWaalsContact C-N 3.32Å; T470-K472 PolarHBondContact O-N 3.03Å
473	Q	44.4	Very low	51.4	Low	174 Å²	174	125 Å²	125	81%	0.813	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	6.4	179.3	-72.5	-74.6	-22.8	0	0	113.7	V471	V471-Q473 PolarHBondContact O-N 3.25Å; V471-Q473 VanDerWaalsContact O-N 3.1Å
474	K	38.4	Very low	49.1	Very low	186 Å²	186	127 Å²	127	81%	0.809	72%	0.716	S	S	*	*	S	Bend	trans	-131.1	36.5	-172.5	-159.1	88.4	-176.1	-176.5	0	114	V471	V471-K474 PolarHBondContact O-N 2.95Å
475	S	36	Very low	46.6	Very low	102 Å²	102	126.4 Å²	126.4	71%	0.713	73%	0.727	S	S	*	*	S	Bend	trans	-139.3	50.7	177.8	67	0	0	0	0	113.5
476	S	37.1	Very low	44.1	Very low	116 Å²	116	126 Å²	126	81%	0.811	74%	0.738	S	S	*	*	S	Bend	trans	-165.9	56.4	172.8	48.4	0	0	0	0	112.9
477	S	32.7	Very low	42	Very low	110 Å²	110	128 Å²	128	77%	0.769	75%	0.754	S	S	*	*			trans	-162.7	79.3	166.8	65.8	0	0	0	0	113.1
478	D	34.8	Very low	40	Very low	177 Å²	177	130.3 Å²	130.3	95%	0.947	78%	0.784	S	S	*	*			trans	-158	133.1	148.7	-122.9	-43.8	0	0	0	110
479	G	31.4	Very low	38.1	Very low	78 Å²	78	130.6 Å²	130.6	80%	0.804	79%	0.793	S	S	*	*			trans	148.6	94.2	-171.2	0	0	0	0	0	112.7
480	K	39.1	Very low	36.9	Very low	202 Å²	202	133.6 Å²	133.6	88%	0.878	81%	0.805	S	S	*	*			trans	-121.2	110	-175.3	176	-177.8	178.6	177.7	0	110.9
481	T	32.8	Very low	36	Very low	155 Å²	155	135.2 Å²	135.2	95%	0.951	81%	0.814	S	S	*	*			trans	-155.8	161.8	156.8	20.6	0	0	0	0	110.7
482	K	34.9	Very low	34.7	Very low	190 Å²	190	135.3 Å²	135.3	83%	0.826	82%	0.819	S	S	*	*			trans	-126.9	125.5	-157.2	164.6	-160.8	175.7	-172.8	0	110.9
483	V	31.8	Very low	34.6	Very low	146 Å²	146	132.7 Å²	132.7	89%	0.885	82%	0.821	S	S	*	*			trans	-145.9	152.1	155.7	175.6	0	0	0	0	109.6
484	V	36.4	Very low	34	Very low	135 Å²	135	130.3 Å²	130.3	82%	0.818	82%	0.819	S	S	*	*			trans	-91.9	150.8	-174.4	167.1	0	0	0	0	111.8
485	G	31.7	Very low	33.9	Very low	61 Å²	61	133.1 Å²	133.1	63%	0.629	82%	0.824	S	S	*	*			trans	157.9	87.3	161.2	0	0	0	0	0	118
486	T	32.8	Very low	33.9	Very low	141 Å²	141	133.6 Å²	133.6	87%	0.865	82%	0.823	S	S	*	*			trans	29.7	124.2	145.9	46.9	0	0	0	0	123.5
487	A	32.9	Very low	34.5	Very low	98 Å²	98	134.2 Å²	134.2	81%	0.81	83%	0.825	S	S	*	*			trans	87.9	129.8	132.3	0	0	0	0	0	122.7
488	A	31.6	Very low	34.9	Very low	112 Å²	112	132.8 Å²	132.8	93%	0.926	83%	0.827	S	S	*	*			trans	64.5	126.8	154.8	0	0	0	0	0	120.7
489	G	30.4	Very low	34.9	Very low	75 Å²	75	130.5 Å²	130.5	77%	0.773	82%	0.819	S	S	*	*			trans	144.8	90.3	156.2	0	0	0	0	0	117.9
490	L	33.7	Very low	35.5	Very low	166 Å²	166	136.1 Å²	136.1	87%	0.869	83%	0.827	S	S	*	*			trans	52.2	114.9	147.4	-102.5	71.4	0	0	0	122.5
491	V	36.6	Very low	35	Very low	127 Å²	127	131 Å²	131	77%	0.77	82%	0.816	S	S	*	*			trans	58.2	114.1	138.1	77.6	0	0	0	0	121.1
492	S	26.9	Very low	35.9	Very low	105 Å²	105	131.9 Å²	131.9	73%	0.734	82%	0.815	S	S	*	*			trans	-141.4	137.6	146.4	-76	0	0	0	0	108.5	T494	S492-T494 PolarHBondContact O-N 3.48Å; S492-T494 VanDerWaalsContact O-N 3.15Å
493	P	40.3	Very low	35.7	Very low	131 Å²	131	127.4 Å²	127.4	85%	0.851	81%	0.807	S	S	*	*			trans	-79.9	98.9	-177.7	30.8	-33	0	0	0	111	R495	P493-R495 PolarHBondContact O-N 2.93Å
494	T	31.2	Very low	36.4	Very low	123 Å²	123	126.4 Å²	126.4	76%	0.755	80%	0.804	S	S	*	*			trans	-72.6	103.4	170.3	-51.2	0	0	0	0	109.8	S492 T496	S492-T494 PolarHBondContact O-N 3.48Å; S492-T494 VanDerWaalsContact O-N 3.15Å; T494-T496 HydrophobicContact CG2-CG2 4.25Å; T494-T496 PolarHBondContact O-N 3.21Å; T494-T496 VanDerWaalsContact O-N 3.16Å
495	R	37.6	Very low	36.9	Very low	245 Å²	245	124.6 Å²	124.6	93%	0.925	80%	0.803	S	S	*	*			trans	-78.9	93.8	170.9	-169.7	177.3	-178.9	-176.8	1	109.5	P493	P493-R495 PolarHBondContact O-N 2.93Å
496	T	36.4	Very low	37.4	Very low	113 Å²	113	133 Å²	133	69%	0.693	82%	0.815	S	S	*	*			trans	-72.3	146.7	170.8	46.6	0	0	0	0	111.1	T494	T494-T496 HydrophobicContact CG2-CG2 4.25Å; T494-T496 PolarHBondContact O-N 3.21Å; T494-T496 VanDerWaalsContact O-N 3.16Å
497	P	48.5	Very low	38.5	Very low	129 Å²	129	130.6 Å²	130.6	84%	0.838	80%	0.801	S	S	*	*			trans	-93.2	135	169.8	34.7	-29.5	0	0	0	110.6
498	G	41.2	Very low	39.6	Very low	79 Å²	79	129.4 Å²	129.4	81%	0.814	79%	0.785	S	S	*	*			trans	141.7	85.8	166.1	0	0	0	0	0	115.9
499	T	34.6	Very low	41	Very low	129 Å²	129	131.8 Å²	131.8	79%	0.791	78%	0.782	S	S	*	*			trans	-168.7	106.1	140.7	171	0	0	0	0	108.5	S501	T499-S501 PolarHBondContact O-N 2.81Å
500	M	43.8	Very low	42.9	Very low	196 Å²	196	130.5 Å²	130.5	97%	0.966	76%	0.759	S	S	*	*			trans	-81	90.4	170.8	-74.9	-69.9	158.3	0	0	107.8
501	S	29.1	Very low	45.1	Very low	94 Å²	94	127.5 Å²	127.5	66%	0.657	74%	0.744	S	S	*	*			trans	-100.2	114	169.8	-174.1	0	0	0	0	109	T499 S503	T499-S501 PolarHBondContact O-N 2.81Å; S501-S503 PolarHBondContact O-N 3.43Å
502	L	52.6	Low	47.2	Very low	175 Å²	175	123.9 Å²	123.9	92%	0.916	72%	0.723	S	S	*	*			trans	-76.1	106.1	176.8	-69.6	167.4	0	0	0	109.1
503	S	29.2	Very low	49.9	Very low	96 Å²	96	125.4 Å²	125.4	67%	0.671	72%	0.721	S	S	*	*			trans	-157.1	147.9	170.3	-77.1	0	0	0	0	109.5	S501	S501-S503 PolarHBondContact O-N 3.43Å
504	P	47.9	Very low	52.1	Low	124 Å²	124	123.7 Å²	123.7	81%	0.805	71%	0.705	S	S	*	*	S	Bend	trans	-79.4	160.6	-155.7	30.8	-36.9	0	0	0	114.6
505	A	45.3	Very low	54.5	Low	97 Å²	97	117.9 Å²	117.9	80%	0.802	67%	0.67	S	S	*	*			trans	57.1	53.3	164.6	0	0	0	0	0	116.8	V507	A505-V507 PolarHBondContact O-N 3Å
506	R	42.9	Very low	56.6	Low	237 Å²	237	108.8 Å²	108.8	89%	0.894	65%	0.647	S	S	*	*			trans	-73.5	107.2	148.6	-71	-69.3	174.7	124.4	-0.6	107.6	P508	R506-P508 WeakPolarHBondContact O-CD 3.46Å
507	V	55.3	Low	59.1	Low	91 Å²	91	106.2 Å²	106.2	55%	0.552	64%	0.637	S	S	*	*			trans	-48.4	125.5	170.7	177.3	0	0	0	0	108	A505 D509	A505-V507 PolarHBondContact O-N 3Å; V507-D509 PolarHBondContact O-N 3.12Å
508	P	56.2	Low	60.9	Low	74 Å²	74	104.2 Å²	104.2	48%	0.481	62%	0.616	S	S	.	*			trans	-54.4	122.6	173.7	-28.3	37	0	0	0	110.2	R506 V510	R506-P508 WeakPolarHBondContact O-CD 3.46Å; P508-V510 HydrophobicContact CB-CG2 3.71Å; P508-V510 PolarHBondContact O-N 3.21Å
509	D	61.7	Low	63.1	Low	161 Å²	161	102.4 Å²	102.4	86%	0.861	59%	0.588	S	S	*	*			trans	-75.7	66.3	175.6	-159.8	25.5	0	0	0	108.4	V507	V507-D509 PolarHBondContact O-N 3.12Å
510	V	70.2	Confident	65.6	Low	49 Å²	49	101.8 Å²	101.8	30%	0.297	58%	0.576	S	S	.	*			trans	-91.5	112.6	178.7	176.5	0	0	0	0	106.7	P508 D514 A515 Q566	P508-V510 HydrophobicContact CB-CG2 3.71Å; P508-V510 PolarHBondContact O-N 3.21Å; V510-D514 HydrophobicContact CG1-CB 4.14Å; V510-A515 HydrophobicContact CG1-CB 3.79Å; V510-Q566 PolarHBondContact O-NE2 2.7Å; V510-Q566 PolarHBondContact O-OE1 3.2Å
511	D	80.3	Confident	67.8	Low	103 Å²	103	98 Å²	98	55%	0.551	56%	0.559	S	S	*	*			trans	-53.2	139.2	174.3	-89.3	-40	0	0	0	109.7	I513 D514 A515	D511-I513 PolarHBondContact O-N 2.98Å; D511-D514 HydrophobicContact CB-CB 4.48Å; D511-D514 PolarHBondContact O-N 3.1Å; D511-A515 PolarHBondContact O-N 3.07Å
512	P	79.4	Confident	70.6	Confident	50 Å²	50	94.7 Å²	94.7	33%	0.325	53%	0.534	S	S	.	.	H	α-helix	trans	-56.4	-23.4	179.7	-29.5	35.8	0	0	0	114.4	A516 L563	P512-A516 VanDerWaalsContact O-CB 3.27Å; P512-A516 WeakPolarHBondContact O-CB 3.3Å; P512-A516 PolarHBondContact O-N 3.19Å; P512-L563 HydrophobicContact CB-CD2 3.73Å; P512-L563 HydrophobicContact CG-CD2 4.29Å
513	I	83.9	Confident	72.4	Confident	137 Å²	137	88.2 Å²	88.2	70%	0.703	51%	0.509	S	S	*	.	H	α-helix	trans	-70.9	-40.2	174.5	-61.1	172.8	0	0	0	111.3	D511 A516 A517	D511-I513 PolarHBondContact O-N 2.98Å; I513-A516 PolarHBondContact O-N 2.69Å; I513-A517 WeakPolarHBondContact O-CB 3.42Å; I513-A517 PolarHBondContact O-N 2.97Å
514	D	86	Confident	75.3	Confident	95 Å²	95	88.9 Å²	88.9	51%	0.508	50%	0.502	S	S	.	.	H	α-helix	trans	-75.9	-38.3	179.7	-70.7	-19	0	0	0	110.8	V510 D511 A516 A517 H518	V510-D514 HydrophobicContact CG1-CB 4.14Å; D511-D514 HydrophobicContact CB-CB 4.48Å; D511-D514 PolarHBondContact O-N 3.1Å; D514-A516 VanDerWaalsContact C-N 3.35Å; D514-A516 PolarHBondContact O-N 2.95Å; D514-A517 PolarHBondContact O-N 3.37Å; D514-H518 WeakPolarHBondContact O-CB 3.4Å; D514-H518 PolarHBondContact O-N 2.95Å
515	A	82.8	Confident	77.1	Confident	2 Å²	2	85.3 Å²	85.3	2%	0.017	48%	0.48	C	S	.	.	H	α-helix	trans	-61.1	-42.4	170.1	0	0	0	0	0	111.7	V510 D511 H518 L519 P559 L563	V510-A515 HydrophobicContact CG1-CB 3.79Å; D511-A515 PolarHBondContact O-N 3.07Å; A515-H518 PolarHBondContact O-N 3.14Å; A515-L519 WeakPolarHBondContact O-CB 3.47Å; A515-L519 VanDerWaalsContact O-CG 3.31Å; A515-L519 WeakPolarHBondContact O-CG 3.27Å; A515-L519 PolarHBondContact O-N 3.36Å; A515-P559 HydrophobicContact CB-CB 4.47Å; A515-L563 HydrophobicContact CB-CD1 3.74Å; A515-L563 HydrophobicContact CB-CD2 3.85Å; A515-L563 HydrophobicContact CB-CG 3.7Å
516	A	82.1	Confident	79	Confident	54 Å²	54	83.3 Å²	83.3	45%	0.446	46%	0.455	S	S	.	.	H	α-helix	trans	-64.1	-39	174.3	0	0	0	0	0	112.5	P512 I513 D514 Q520	P512-A516 VanDerWaalsContact O-CB 3.27Å; P512-A516 WeakPolarHBondContact O-CB 3.3Å; P512-A516 PolarHBondContact O-N 3.19Å; I513-A516 PolarHBondContact O-N 2.69Å; D514-A516 VanDerWaalsContact C-N 3.35Å; D514-A516 PolarHBondContact O-N 2.95Å; A516-Q520 VanDerWaalsContact O-CB 3.3Å; A516-Q520 WeakPolarHBondContact O-CB 3.45Å; A516-Q520 PolarHBondContact O-N 3.39Å
517	A	87.9	Confident	81.1	Confident	58 Å²	58	76.2 Å²	76.2	48%	0.479	44%	0.442	S	S	.	.	H	α-helix	trans	-66.5	-38	175.3	0	0	0	0	0	112.5	I513 D514 L521	I513-A517 WeakPolarHBondContact O-CB 3.42Å; I513-A517 PolarHBondContact O-N 2.97Å; D514-A517 PolarHBondContact O-N 3.37Å; A517-L521 PolarHBondContact O-N 2.89Å; A517-L521 VanDerWaalsContact O-N 3.08Å
518	H	87.1	Confident	82.4	Confident	87 Å²	87	76.6 Å²	76.6	40%	0.403	44%	0.441	S	S	.	.	H	α-helix	trans	-65.9	-47.8	175	-176.3	-94	0	0	0	111.9	D514 A515 Q520 L521 L522 P559	D514-H518 WeakPolarHBondContact O-CB 3.4Å; D514-H518 PolarHBondContact O-N 2.95Å; A515-H518 PolarHBondContact O-N 3.14Å; H518-Q520 VanDerWaalsContact C-N 3.32Å; H518-Q520 PolarHBondContact O-N 3.39Å; H518-L521 PolarHBondContact O-N 2.95Å; H518-L522 VanDerWaalsContact CE1-CD1 3.43Å; H518-L522 WeakPolarHBondContact CE1-CD1 3.09Å; H518-L522 PolarHBondContact O-N 3.47Å; H518-P559 WeakPolarHBondContact ND1-CG 3.42Å
519	L	86.6	Confident	83.7	Confident	41 Å²	41	74.8 Å²	74.8	22%	0.215	43%	0.426	C	S	.	.	H	α-helix	trans	-63.5	-36.1	176.7	-69.9	170.6	0	0	0	112.3	A515 G523 A556 P559 L560 L563	A515-L519 WeakPolarHBondContact O-CB 3.47Å; A515-L519 VanDerWaalsContact O-CG 3.31Å; A515-L519 WeakPolarHBondContact O-CG 3.27Å; A515-L519 PolarHBondContact O-N 3.36Å; L519-G523 PolarHBondContact O-N 3.03Å; L519-A556 HydrophobicContact CD2-CB 3.96Å; L519-P559 HydrophobicContact CD2-CB 4.29Å; L519-P559 HydrophobicContact CG-CB 4.29Å; L519-L560 HydrophobicContact CD1-CD2 3.82Å; L519-L560 HydrophobicContact CD1-CG 4.02Å; L519-L560 HydrophobicContact CD2-CD1 4.44Å; L519-L560 HydrophobicContact CD2-CG 4.12Å; L519-L563 HydrophobicContact CD1-CD1 3.86Å
520	Q	88.2	Confident	84.7	Confident	117 Å²	117	68.7 Å²	68.7	55%	0.547	40%	0.402	S	S	.	.	H	α-helix	trans	-62.3	-44.8	172.6	-179.6	63.6	39.4	0	0	111.6	A516 H518 G523 E524	A516-Q520 VanDerWaalsContact O-CB 3.3Å; A516-Q520 WeakPolarHBondContact O-CB 3.45Å; A516-Q520 PolarHBondContact O-N 3.39Å; H518-Q520 VanDerWaalsContact C-N 3.32Å; H518-Q520 PolarHBondContact O-N 3.39Å; Q520-G523 PolarHBondContact O-N 3.5Å; Q520-E524 PolarHBondContact NE2-OE1 2.85Å; Q520-E524 WeakPolarHBondContact O-CG 3.48Å; Q520-E524 PolarHBondContact O-N 3.38Å
521	L	89.8	Confident	85.2	Confident	117 Å²	117	71.8 Å²	71.8	61%	0.613	41%	0.413	S	S	*	.	H	α-helix	trans	-66.8	-40.2	178.9	-172.6	64.9	0	0	0	112	A517 H518 E524 S525	A517-L521 PolarHBondContact O-N 2.89Å; A517-L521 VanDerWaalsContact O-N 3.08Å; H518-L521 PolarHBondContact O-N 2.95Å; L521-E524 PolarHBondContact O-N 3.29Å; L521-S525 PolarHBondContact O-N 3.28Å; L521-S525 PolarHBondContact O-OG 3.45Å
522	L	87.9	Confident	85	Confident	24 Å²	24	71.8 Å²	71.8	13%	0.126	41%	0.405	C	S	.	.	H	α-helix	trans	-61.1	-41.9	171.9	-94.6	168.9	0	0	0	112.3	H518 S525 L526 C555 A556	H518-L522 VanDerWaalsContact CE1-CD1 3.43Å; H518-L522 WeakPolarHBondContact CE1-CD1 3.09Å; H518-L522 PolarHBondContact O-N 3.47Å; L522-S525 WeakPolarHBondContact CA-OG 3.42Å; L522-S525 PolarHBondContact O-N 3.16Å; L522-S525 PolarHBondContact O-OG 3.22Å; L522-L526 WeakPolarHBondContact O-CB 3.32Å; L522-L526 WeakPolarHBondContact O-CG 3.29Å; L522-L526 PolarHBondContact O-N 3.36Å; L522-C555 HydrophobicContact CD1-CB 4.04Å; L522-C555 WeakPolarHBondContact CD1-O 3.34Å; L522-C555 HydrophobicContact CD2-CB 4.17Å; L522-A556 HydrophobicContact CD1-CB 4.26Å
523	G	89.2	Confident	84.7	Confident	39 Å²	39	72.5 Å²	72.5	40%	0.402	41%	0.406	S	S	.	.	H	α-helix	trans	-63.6	-40.3	175.2	0	0	0	0	0	112.5	L519 Q520 S527	L519-G523 PolarHBondContact O-N 3.03Å; Q520-G523 PolarHBondContact O-N 3.5Å; G523-S527 WeakPolarHBondContact O-CB 3.27Å; G523-S527 PolarHBondContact O-N 3.25Å
524	E	89.9	Confident	84.4	Confident	109 Å²	109	74 Å²	74	51%	0.509	41%	0.41	S	S	.	.	H	α-helix	trans	-65.5	-41.7	174.7	-75.2	173	-156	0	0	112.1	Q520 L521 L528	Q520-E524 PolarHBondContact NE2-OE1 2.85Å; Q520-E524 WeakPolarHBondContact O-CG 3.48Å; Q520-E524 PolarHBondContact O-N 3.38Å; L521-E524 PolarHBondContact O-N 3.29Å; E524-L528 PolarHBondContact O-N 3.06Å; E524-L528 VanDerWaalsContact O-N 3.09Å
525	S	87.3	Confident	84	Confident	50 Å²	50	74.6 Å²	74.6	35%	0.35	41%	0.41	S	S	.	.	H	α-helix	trans	-68.4	-42.1	175.6	56.1	0	0	0	0	112.8	L521 L522 L528 I529	L521-S525 PolarHBondContact O-N 3.28Å; L521-S525 PolarHBondContact O-OG 3.45Å; L522-S525 WeakPolarHBondContact CA-OG 3.42Å; L522-S525 PolarHBondContact O-N 3.16Å; L522-S525 PolarHBondContact O-OG 3.22Å; S525-L528 PolarHBondContact O-N 3.43Å; S525-I529 VanDerWaalsContact O-CG1 3.29Å; S525-I529 WeakPolarHBondContact O-CG1 3.44Å; S525-I529 PolarHBondContact O-N 2.85Å
526	L	84.3	Confident	83.4	Confident	54 Å²	54	78.1 Å²	78.1	28%	0.283	43%	0.431	S	S	.	.	H	α-helix	trans	-64.1	-39.4	176.3	-81.9	173.1	0	0	0	112.2	L522 I529 G530 L549	L522-L526 WeakPolarHBondContact O-CB 3.32Å; L522-L526 WeakPolarHBondContact O-CG 3.29Å; L522-L526 PolarHBondContact O-N 3.36Å; L526-I529 PolarHBondContact O-N 3.04Å; L526-G530 PolarHBondContact O-N 3.16Å; L526-L549 HydrophobicContact CD2-CD2 4.08Å
527	S	86.6	Confident	82.1	Confident	88 Å²	88	85 Å²	85	62%	0.615	45%	0.454	S	S	*	.	H	α-helix	trans	-64.3	-40.6	175.7	-171.3	0	0	0	0	111.9	G523 G530 H531	G523-S527 WeakPolarHBondContact O-CB 3.27Å; G523-S527 PolarHBondContact O-N 3.25Å; S527-G530 PolarHBondContact O-N 2.84Å; S527-H531 PolarHBondContact O-N 3.2Å
528	L	83.7	Confident	81	Confident	100 Å²	100	85.1 Å²	85.1	52%	0.524	46%	0.46	S	S	.	.	H	α-helix	trans	-63.5	-44	173.8	-175.3	68.7	0	0	0	112.1	E524 S525 H531 R532	E524-L528 PolarHBondContact O-N 3.06Å; E524-L528 VanDerWaalsContact O-N 3.09Å; S525-L528 PolarHBondContact O-N 3.43Å; L528-H531 PolarHBondContact O-N 3.48Å; L528-R532 WeakPolarHBondContact O-CG 3.41Å; L528-R532 PolarHBondContact O-N 3.18Å
529	I	83	Confident	79.7	Confident	35 Å²	35	90.7 Å²	90.7	18%	0.179	49%	0.489	C	S	.	.	H	α-helix	trans	-61.3	-46.4	175.5	-67.9	162.4	0	0	0	110	S525 L526 H531 R532 L533 V548	S525-I529 VanDerWaalsContact O-CG1 3.29Å; S525-I529 WeakPolarHBondContact O-CG1 3.44Å; S525-I529 PolarHBondContact O-N 2.85Å; L526-I529 PolarHBondContact O-N 3.04Å; I529-H531 PolarHBondContact O-N 2.95Å; I529-R532 PolarHBondContact O-N 2.84Å; I529-L533 HydrophobicContact CG2-CD1 3.85Å; I529-L533 HydrophobicContact CG2-CG 4.3Å; I529-L533 WeakPolarHBondContact O-CG 3.25Å; I529-L533 PolarHBondContact O-N 2.85Å; I529-V548 HydrophobicContact CD1-CG1 4.21Å
530	G	81.6	Confident	78.6	Confident	34 Å²	34	91.7 Å²	91.7	35%	0.351	50%	0.497	S	S	.	.	H	α-helix	trans	-57.5	-45.6	176.6	0	0	0	0	0	112.7	L526 S527 R532 L533 Q534	L526-G530 PolarHBondContact O-N 3.16Å; S527-G530 PolarHBondContact O-N 2.84Å; G530-R532 VanDerWaalsContact C-N 3.35Å; G530-R532 PolarHBondContact O-N 2.98Å; G530-L533 PolarHBondContact O-N 2.66Å; G530-Q534 WeakPolarHBondContact O-CB 3.38Å; G530-Q534 PolarHBondContact O-N 3.1Å
531	H	82.2	Confident	77.5	Confident	113 Å²	113	89.5 Å²	89.5	52%	0.523	50%	0.498	S	S	.	.	H	α-helix	trans	-59.6	-44.2	175.2	-163.4	-80.8	0	0	0	111.9	S527 L528 I529 L533 Q534 E535	S527-H531 PolarHBondContact O-N 3.2Å; L528-H531 PolarHBondContact O-N 3.48Å; I529-H531 PolarHBondContact O-N 2.95Å; H531-L533 PolarHBondContact O-N 2.88Å; H531-Q534 WeakPolarHBondContact O-CB 3.43Å; H531-Q534 PolarHBondContact O-N 3.43Å; H531-E535 IonicContact CE1-OE1 3.33Å; H531-E535 PolarHBondContact CE1-OE1 2.86Å; H531-E535 IonicContact CE1-OE2 2.78Å; H531-E535 IonicContact ND1-OE1 2.76Å; H531-E535 PolarHBondContact ND1-OE1 2.82Å; H531-E535 IonicContact ND1-OE2 3.62Å; H531-E535 PolarHBondContact ND1-OE2 3.5Å; H531-E535 VanDerWaalsContact ND1-OE2 3.09Å; H531-E535 WeakPolarHBondContact O-CG 3.33Å; H531-E535 PolarHBondContact O-N 3.48Å
532	R	74.9	Confident	76.1	Confident	103 Å²	103	89.1 Å²	89.1	39%	0.389	50%	0.501	S	S	.	.	H	α-helix	trans	-67.3	-34.8	178.3	-69.3	-137.5	172.6	-72.9	12.1	113.6	L528 I529 G530 Q534 E535 T536	L528-R532 WeakPolarHBondContact O-CG 3.41Å; L528-R532 PolarHBondContact O-N 3.18Å; I529-R532 PolarHBondContact O-N 2.84Å; G530-R532 VanDerWaalsContact C-N 3.35Å; G530-R532 PolarHBondContact O-N 2.98Å; R532-Q534 VanDerWaalsContact C-N 3.32Å; R532-E535 IonicContact NH1-OE2 3.02Å; R532-E535 PolarHBondContact NH1-OE2 3.48Å; R532-T536 PolarHBondContact O-N 3.23Å; R532-T536 PolarHBondContact O-OG1 2.91Å
533	L	73.4	Confident	75.1	Confident	66 Å²	66	92.5 Å²	92.5	35%	0.346	53%	0.527	S	S	.	.	H	α-helix	trans	-69.8	-29.7	172.6	-69.7	173.1	0	0	0	112	I529 G530 H531 T536 V540	I529-L533 HydrophobicContact CG2-CD1 3.85Å; I529-L533 HydrophobicContact CG2-CG 4.3Å; I529-L533 WeakPolarHBondContact O-CG 3.25Å; I529-L533 PolarHBondContact O-N 2.85Å; G530-L533 PolarHBondContact O-N 2.66Å; H531-L533 PolarHBondContact O-N 2.88Å; L533-T536 WeakPolarHBondContact CA-OG1 3.47Å; L533-T536 PolarHBondContact O-OG1 3.13Å; L533-V540 HydrophobicContact CD2-CG1 4.03Å; L533-V540 HydrophobicContact CD2-CG2 4.49Å
534	Q	77.4	Confident	74.3	Confident	167 Å²	167	92 Å²	92	78%	0.78	52%	0.521	S	S	*	.	H	α-helix	trans	-75.4	-36.7	174.2	-160.4	82.5	63.5	0	0	112.2	G530 H531 R532 T536	G530-Q534 WeakPolarHBondContact O-CB 3.38Å; G530-Q534 PolarHBondContact O-N 3.1Å; H531-Q534 WeakPolarHBondContact O-CB 3.43Å; H531-Q534 PolarHBondContact O-N 3.43Å; R532-Q534 VanDerWaalsContact C-N 3.32Å; Q534-T536 VanDerWaalsContact C-N 3.32Å
535	E	77.4	Confident	73.5	Confident	108 Å²	108	88.3 Å²	88.3	51%	0.505	51%	0.507	S	S	.	.	H	α-helix	trans	-73.8	-17.8	177	-73.3	174.6	135.4	0	0	113.6	H531 R532 E537	H531-E535 IonicContact CE1-OE1 3.33Å; H531-E535 PolarHBondContact CE1-OE1 2.86Å; H531-E535 IonicContact CE1-OE2 2.78Å; H531-E535 IonicContact ND1-OE1 2.76Å; H531-E535 PolarHBondContact ND1-OE1 2.82Å; H531-E535 IonicContact ND1-OE2 3.62Å; H531-E535 PolarHBondContact ND1-OE2 3.5Å; H531-E535 VanDerWaalsContact ND1-OE2 3.09Å; H531-E535 WeakPolarHBondContact O-CG 3.33Å; H531-E535 PolarHBondContact O-N 3.48Å; R532-E535 IonicContact NH1-OE2 3.02Å; R532-E535 PolarHBondContact NH1-OE2 3.48Å; E535-E537 PolarHBondContact O-N 3.46Å
536	T	71.6	Confident	73	Confident	76 Å²	76	90.3 Å²	90.3	47%	0.466	51%	0.514	S	S	.	.			trans	-87.1	81.9	177.6	26.7	0	0	0	0	111	R532 L533 Q534 G538	R532-T536 PolarHBondContact O-N 3.23Å; R532-T536 PolarHBondContact O-OG1 2.91Å; L533-T536 WeakPolarHBondContact CA-OG1 3.47Å; L533-T536 PolarHBondContact O-OG1 3.13Å; Q534-T536 VanDerWaalsContact C-N 3.32Å; T536-G538 VanDerWaalsContact C-N 3.35Å; T536-G538 PolarHBondContact O-N 2.9Å
537	E	53.7	Low	72.8	Confident	200 Å²	200	90.7 Å²	90.7	94%	0.935	52%	0.521	S	S	*	.			trans	-62.6	94.3	164.9	-72.7	-169.1	147.1	0	0	110.2	E535	E535-E537 PolarHBondContact O-N 3.46Å
538	G	65.6	Low	72.4	Confident	59 Å²	59	88.7 Å²	88.7	61%	0.608	51%	0.505	S	S	*	.	S	Bend	trans	171.2	171.4	179.3	0	0	0	0	0	113	T536 V540	T536-G538 VanDerWaalsContact C-N 3.35Å; T536-G538 PolarHBondContact O-N 2.9Å; G538-V540 PolarHBondContact O-N 3.43Å
539	M	59.1	Low	72.1	Confident	204 Å²	204	87.5 Å²	87.5	100%	1.005	50%	0.498	S	S	*	.			trans	-72.7	92	173.1	-76.4	-176.5	138.8	0	0	110.6
540	V	64.4	Low	72	Confident	63 Å²	63	87.8 Å²	87.8	38%	0.382	50%	0.5	S	S	.	.			trans	-71.3	131.8	168.8	-179.2	0	0	0	0	109.5	L533 G538 V542	L533-V540 HydrophobicContact CD2-CG1 4.03Å; L533-V540 HydrophobicContact CD2-CG2 4.49Å; G538-V540 PolarHBondContact O-N 3.43Å; V540-V542 PolarHBondContact O-N 3.18Å
541	A	64.4	Low	72	Confident	70 Å²	70	90.6 Å²	90.6	58%	0.579	51%	0.507	S	S	*	.			trans	-62.7	105.8	176.1	0	0	0	0	0	111.2	S543 G544	A541-S543 PolarHBondContact O-N 3.49Å; A541-S543 VanDerWaalsContact O-N 3.11Å; A541-G544 PolarHBondContact O-N 3.37Å; A541-G544 VanDerWaalsContact O-N 3.11Å
542	V	60.3	Low	72.1	Confident	109 Å²	109	85.9 Å²	85.9	66%	0.661	49%	0.487	S	S	*	.	H	α-helix	trans	-56.3	-30.8	-172.8	-177.8	0	0	0	0	113.2	V540 S545 L546	V540-V542 PolarHBondContact O-N 3.18Å; V542-S545 PolarHBondContact O-OG 3.5Å; V542-L546 WeakPolarHBondContact O-CB 3.39Å; V542-L546 PolarHBondContact O-N 3.19Å; V542-L546 VanDerWaalsContact O-N 3.09Å
543	S	67.3	Low	72.5	Confident	96 Å²	96	85.1 Å²	85.1	67%	0.671	49%	0.49	S	S	*	.	H	α-helix	trans	-65.9	-36.8	179.4	52.6	0	0	0	0	113.6	A541 S547	A541-S543 PolarHBondContact O-N 3.49Å; A541-S543 VanDerWaalsContact O-N 3.11Å; S543-S547 PolarHBondContact O-N 3.48Å; S543-S547 PolarHBondContact O-OG 3.4Å
544	G	73	Confident	73	Confident	27 Å²	27	83.4 Å²	83.4	28%	0.278	48%	0.481	S	S	.	.	H	α-helix	trans	-79.7	-36.1	-177.6	0	0	0	0	0	113.4	A541 S547 V548	A541-G544 PolarHBondContact O-N 3.37Å; A541-G544 VanDerWaalsContact O-N 3.11Å; G544-S547 PolarHBondContact O-OG 2.94Å; G544-S547 VanDerWaalsContact O-OG 3.12Å; G544-V548 WeakPolarHBondContact O-CG2 3.27Å; G544-V548 PolarHBondContact O-N 3.02Å
545	S	73.3	Confident	73.2	Confident	32 Å²	32	78 Å²	78	22%	0.224	46%	0.46	C	S	.	.	H	α-helix	trans	-74.1	-37.7	175.5	52.5	0	0	0	0	112	V542 V548 L549	V542-S545 PolarHBondContact O-OG 3.5Å; S545-V548 PolarHBondContact O-N 2.68Å; S545-L549 WeakPolarHBondContact O-CB 3.42Å; S545-L549 WeakPolarHBondContact O-CG 3.28Å; S545-L549 PolarHBondContact O-N 3.25Å
546	L	76.4	Confident	73.5	Confident	93 Å²	93	73.8 Å²	73.8	49%	0.487	45%	0.445	S	S	.	.	H	α-helix	trans	-63.9	-41.9	177.4	-177.7	61.6	0	0	0	112.5	V542 L549 L550	V542-L546 WeakPolarHBondContact O-CB 3.39Å; V542-L546 PolarHBondContact O-N 3.19Å; V542-L546 VanDerWaalsContact O-N 3.09Å; L546-L549 PolarHBondContact O-N 3.4Å; L546-L550 HydrophobicContact CD1-CD1 4.29Å; L546-L550 HydrophobicContact CD1-CG 4.32Å; L546-L550 HydrophobicContact CG-CD1 4.03Å; L546-L550 HydrophobicContact CG-CG 4.49Å; L546-L550 WeakPolarHBondContact O-CB 3.42Å; L546-L550 WeakPolarHBondContact O-CG 3.5Å; L546-L550 PolarHBondContact O-N 3.47Å
547	S	80	Confident	74	Confident	61 Å²	61	72 Å²	72	43%	0.427	43%	0.432	S	S	.	.	H	α-helix	trans	-65.9	-41	178.7	62.6	0	0	0	0	112.4	S543 G544 L549 L550 D551	S543-S547 PolarHBondContact O-N 3.48Å; S543-S547 PolarHBondContact O-OG 3.4Å; G544-S547 PolarHBondContact O-OG 2.94Å; G544-S547 VanDerWaalsContact O-OG 3.12Å; S547-L549 VanDerWaalsContact C-N 3.34Å; S547-L549 PolarHBondContact O-N 3.02Å; S547-L550 PolarHBondContact O-N 2.91Å; S547-D551 WeakPolarHBondContact O-CB 3.4Å; S547-D551 PolarHBondContact O-N 2.99Å
548	V	78	Confident	75.4	Confident	47 Å²	47	64.1 Å²	64.1	29%	0.285	40%	0.404	S	S	.	.	H	α-helix	trans	-64.8	-37.4	175.3	173.4	0	0	0	0	111.7	I529 G544 S545 S552	I529-V548 HydrophobicContact CD1-CG1 4.21Å; G544-V548 WeakPolarHBondContact O-CG2 3.27Å; G544-V548 PolarHBondContact O-N 3.02Å; S545-V548 PolarHBondContact O-N 2.68Å; V548-S552 VanDerWaalsContact O-CB 3.3Å; V548-S552 WeakPolarHBondContact O-CB 3.44Å; V548-S552 PolarHBondContact O-N 2.97Å; V548-S552 PolarHBondContact O-OG 3.15Å
549	L	77.6	Confident	76.2	Confident	74 Å²	74	62.5 Å²	62.5	39%	0.387	38%	0.383	S	S	.	.	H	α-helix	trans	-66.6	-43.8	174	-75	166.5	0	0	0	111.9	L526 S545 L546 S547 S552 I553	L526-L549 HydrophobicContact CD2-CD2 4.08Å; S545-L549 WeakPolarHBondContact O-CB 3.42Å; S545-L549 WeakPolarHBondContact O-CG 3.28Å; S545-L549 PolarHBondContact O-N 3.25Å; L546-L549 PolarHBondContact O-N 3.4Å; S547-L549 VanDerWaalsContact C-N 3.34Å; S547-L549 PolarHBondContact O-N 3.02Å; L549-S552 PolarHBondContact O-N 2.95Å; L549-I553 WeakPolarHBondContact O-CD1 3.31Å; L549-I553 VanDerWaalsContact O-CG1 3.25Å; L549-I553 WeakPolarHBondContact O-CG1 3.35Å; L549-I553 PolarHBondContact O-N 3.38Å
550	L	79.9	Confident	77.2	Confident	41 Å²	41	56.5 Å²	56.5	22%	0.215	35%	0.354	C	S	.	.	H	α-helix	trans	-64.5	-44	177.7	-73.8	170.3	0	0	0	112.5	L546 S547 S552 I553 L554 I588 M589	L546-L550 HydrophobicContact CD1-CD1 4.29Å; L546-L550 HydrophobicContact CD1-CG 4.32Å; L546-L550 HydrophobicContact CG-CD1 4.03Å; L546-L550 HydrophobicContact CG-CG 4.49Å; L546-L550 WeakPolarHBondContact O-CB 3.42Å; L546-L550 WeakPolarHBondContact O-CG 3.5Å; L546-L550 PolarHBondContact O-N 3.47Å; S547-L550 PolarHBondContact O-N 2.91Å; L550-S552 VanDerWaalsContact C-N 3.35Å; L550-S552 PolarHBondContact O-N 2.96Å; L550-I553 PolarHBondContact O-N 2.71Å; L550-L554 PolarHBondContact O-N 3.1Å; L550-I588 HydrophobicContact CD1-CG2 4.33Å; L550-M589 HydrophobicContact CB-CE 3.87Å; L550-M589 HydrophobicContact CB-SD 3.97Å; L550-M589 HydrophobicContact CD1-SD 4.17Å
551	D	82.9	Confident	77.8	Confident	94 Å²	94	55.4 Å²	55.4	50%	0.503	35%	0.348	S	S	.	.	H	α-helix	trans	-61.8	-41.8	174.8	-176.3	52	0	0	0	111.7	S547 I553 L554 C555	S547-D551 WeakPolarHBondContact O-CB 3.4Å; S547-D551 PolarHBondContact O-N 2.99Å; D551-I553 PolarHBondContact O-N 3.4Å; D551-L554 PolarHBondContact O-N 3.49Å; D551-C555 WeakPolarHBondContact O-CB 3.34Å; D551-C555 PolarHBondContact O-N 3.28Å; D551-C555 PolarHBondContact O-SG 3.24Å
552	S	83.8	Confident	78.3	Confident	13 Å²	13	53 Å²	53	9%	0.091	33%	0.327	C	S	.	.	H	α-helix	trans	-65.1	-37.1	175.4	-59.4	0	0	0	0	112.9	V548 L549 L550 C555 A556	V548-S552 VanDerWaalsContact O-CB 3.3Å; V548-S552 WeakPolarHBondContact O-CB 3.44Å; V548-S552 PolarHBondContact O-N 2.97Å; V548-S552 PolarHBondContact O-OG 3.15Å; L549-S552 PolarHBondContact O-N 2.95Å; L550-S552 VanDerWaalsContact C-N 3.35Å; L550-S552 PolarHBondContact O-N 2.96Å; S552-C555 PolarHBondContact O-N 3.24Å; S552-A556 PolarHBondContact O-N 3.36Å; S552-A556 VanDerWaalsContact O-N 3.08Å
553	I	83.3	Confident	78.9	Confident	88 Å²	88	49 Å²	49	45%	0.451	30%	0.302	S	S	.	.	H	α-helix	trans	-65.7	-44.2	174.4	-72.7	163.6	0	0	0	110.2	L549 L550 D551 A556 L557	L549-I553 WeakPolarHBondContact O-CD1 3.31Å; L549-I553 VanDerWaalsContact O-CG1 3.25Å; L549-I553 WeakPolarHBondContact O-CG1 3.35Å; L549-I553 PolarHBondContact O-N 3.38Å; L550-I553 PolarHBondContact O-N 2.71Å; D551-I553 PolarHBondContact O-N 3.4Å; I553-A556 PolarHBondContact O-N 2.88Å; I553-A556 VanDerWaalsContact O-N 3.13Å; I553-L557 HydrophobicContact CG2-CD1 3.9Å; I553-L557 HydrophobicContact CG2-CG 4.29Å; I553-L557 WeakPolarHBondContact O-CG 3.34Å; I553-L557 PolarHBondContact O-N 3.02Å
554	L	82.8	Confident	79.2	Confident	30 Å²	30	46.3 Å²	46.3	16%	0.157	28%	0.281	C	S	.	.	H	α-helix	trans	-60.7	-44.4	173.9	-83.2	177.2	0	0	0	112.5	L550 D551 A556 L557 G558 I585 M589 L592	L550-L554 PolarHBondContact O-N 3.1Å; D551-L554 PolarHBondContact O-N 3.49Å; L554-A556 PolarHBondContact O-N 3.07Å; L554-L557 HydrophobicContact CD2-CD1 4.35Å; L554-L557 PolarHBondContact O-N 3.5Å; L554-L557 VanDerWaalsContact O-N 3.13Å; L554-G558 PolarHBondContact O-N 2.72Å; L554-I585 HydrophobicContact CD1-CG2 4.01Å; L554-I585 HydrophobicContact CD2-CD1 4.22Å; L554-I585 HydrophobicContact CD2-CG2 3.85Å; L554-I585 HydrophobicContact CG-CG2 4.11Å; L554-M589 HydrophobicContact CD1-CE 3.41Å; L554-M589 VanDerWaalsContact CD1-CE 3.41Å; L554-M589 HydrophobicContact CG-CE 4.3Å; L554-L592 HydrophobicContact CD1-CD1 3.37Å; L554-L592 HydrophobicContact CD1-CD2 3.85Å; L554-L592 HydrophobicContact CD1-CG 4.26Å
555	C	82.8	Confident	79.1	Confident	52 Å²	52	48 Å²	48	35%	0.351	29%	0.292	S	S	.	.	H	α-helix	trans	-62	-23.7	175	-72	0	0	0	0	113.3	L522 D551 S552 P559	L522-C555 HydrophobicContact CD1-CB 4.04Å; L522-C555 WeakPolarHBondContact CD1-O 3.34Å; L522-C555 HydrophobicContact CD2-CB 4.17Å; D551-C555 WeakPolarHBondContact O-CB 3.34Å; D551-C555 PolarHBondContact O-N 3.28Å; D551-C555 PolarHBondContact O-SG 3.24Å; S552-C555 PolarHBondContact O-N 3.24Å; C555-P559 WeakPolarHBondContact O-CD 3.42Å; C555-P559 WeakPolarHBondContact O-CG 3.33Å
556	A	83	Confident	79	Confident	21 Å²	21	49.7 Å²	49.7	17%	0.174	30%	0.297	C	S	.	.	H	α-helix	trans	-85.5	-36.8	171.5	0	0	0	0	0	113	L519 L522 S552 I553 L554 G558 P559 L560	L519-A556 HydrophobicContact CD2-CB 3.96Å; L522-A556 HydrophobicContact CD1-CB 4.26Å; S552-A556 PolarHBondContact O-N 3.36Å; S552-A556 VanDerWaalsContact O-N 3.08Å; I553-A556 PolarHBondContact O-N 2.88Å; I553-A556 VanDerWaalsContact O-N 3.13Å; L554-A556 PolarHBondContact O-N 3.07Å; A556-G558 PolarHBondContact O-N 2.82Å; A556-P559 WeakPolarHBondContact O-CD 3.32Å; A556-L560 HydrophobicContact CB-CD1 4.4Å; A556-L560 WeakPolarHBondContact O-CB 3.39Å; A556-L560 WeakPolarHBondContact O-CD1 3.47Å; A556-L560 VanDerWaalsContact O-CG 3.28Å; A556-L560 WeakPolarHBondContact O-CG 2.95Å; A556-L560 PolarHBondContact O-N 2.9Å
557	L	82.8	Confident	78.8	Confident	39 Å²	39	47.8 Å²	47.8	20%	0.204	29%	0.286	C	S	.	.	H	α-helix	trans	-63.1	-38	-179.4	-77.5	169.8	0	0	0	112.8	I553 L554 L560 T561 I585	I553-L557 HydrophobicContact CG2-CD1 3.9Å; I553-L557 HydrophobicContact CG2-CG 4.29Å; I553-L557 WeakPolarHBondContact O-CG 3.34Å; I553-L557 PolarHBondContact O-N 3.02Å; L554-L557 HydrophobicContact CD2-CD1 4.35Å; L554-L557 PolarHBondContact O-N 3.5Å; L554-L557 VanDerWaalsContact O-N 3.13Å; L557-L560 PolarHBondContact O-N 2.87Å; L557-T561 WeakPolarHBondContact O-CB 3.16Å; L557-T561 VanDerWaalsContact O-CG2 3.26Å; L557-T561 WeakPolarHBondContact O-CG2 3.27Å; L557-T561 PolarHBondContact O-N 3.29Å; L557-T561 PolarHBondContact O-OG1 3.49Å; L557-I585 HydrophobicContact CD1-CD1 3.74Å
558	G	82.1	Confident	78	Confident	33 Å²	33	50 Å²	50	34%	0.34	30%	0.299	S	S	.	.	H	α-helix	trans	-57.2	-58	175.8	0	0	0	0	0	113.5	L554 A556 L560 T561 C562	L554-G558 PolarHBondContact O-N 2.72Å; A556-G558 PolarHBondContact O-N 2.82Å; G558-L560 PolarHBondContact O-N 3.05Å; G558-T561 PolarHBondContact O-N 3.43Å; G558-T561 PolarHBondContact O-OG1 3.28Å; G558-C562 PolarHBondContact O-N 2.88Å; G558-C562 VanDerWaalsContact O-N 3.09Å; G558-C562 PolarHBondContact O-SG 3.45Å
559	P	82	Confident	77.6	Confident	25 Å²	25	56.8 Å²	56.8	16%	0.162	33%	0.328	C	S	.	.	H	α-helix	trans	-59.2	-39.8	173.7	-25.1	32.8	0	0	0	114	A515 H518 L519 C555 A556 C562 L563	A515-P559 HydrophobicContact CB-CB 4.47Å; H518-P559 WeakPolarHBondContact ND1-CG 3.42Å; L519-P559 HydrophobicContact CD2-CB 4.29Å; L519-P559 HydrophobicContact CG-CB 4.29Å; C555-P559 WeakPolarHBondContact O-CD 3.42Å; C555-P559 WeakPolarHBondContact O-CG 3.33Å; A556-P559 WeakPolarHBondContact O-CD 3.32Å; P559-C562 PolarHBondContact O-N 2.83Å; P559-L563 WeakPolarHBondContact O-CB 3.17Å; P559-L563 WeakPolarHBondContact O-CG 3.4Å; P559-L563 PolarHBondContact O-N 2.76Å
560	L	80.3	Confident	77	Confident	78 Å²	78	58.2 Å²	58.2	41%	0.408	34%	0.335	S	S	.	.	H	α-helix	trans	-65.6	-41.8	178.9	-77.5	166.6	0	0	0	112.5	L519 A556 L557 G558 C562 L563 T564	L519-L560 HydrophobicContact CD1-CD2 3.82Å; L519-L560 HydrophobicContact CD1-CG 4.02Å; L519-L560 HydrophobicContact CD2-CD1 4.44Å; L519-L560 HydrophobicContact CD2-CG 4.12Å; A556-L560 HydrophobicContact CB-CD1 4.4Å; A556-L560 WeakPolarHBondContact O-CB 3.39Å; A556-L560 WeakPolarHBondContact O-CD1 3.47Å; A556-L560 VanDerWaalsContact O-CG 3.28Å; A556-L560 WeakPolarHBondContact O-CG 2.95Å; A556-L560 PolarHBondContact O-N 2.9Å; L557-L560 PolarHBondContact O-N 2.87Å; G558-L560 PolarHBondContact O-N 3.05Å; L560-C562 VanDerWaalsContact C-N 3.35Å; L560-L563 PolarHBondContact O-N 3.25Å; L560-T564 WeakPolarHBondContact O-CG2 3.49Å; L560-T564 PolarHBondContact O-N 2.92Å; L560-T564 PolarHBondContact O-OG1 3.09Å; L560-T564 VanDerWaalsContact O-OG1 3.13Å
561	T	78.5	Confident	76.3	Confident	40 Å²	40	60.4 Å²	60.4	25%	0.245	35%	0.347	C	S	.	.	H	α-helix	trans	-68.7	-32.7	176.1	52	0	0	0	0	112.4	L557 G558 T564 A565 L578	L557-T561 WeakPolarHBondContact O-CB 3.16Å; L557-T561 VanDerWaalsContact O-CG2 3.26Å; L557-T561 WeakPolarHBondContact O-CG2 3.27Å; L557-T561 PolarHBondContact O-N 3.29Å; L557-T561 PolarHBondContact O-OG1 3.49Å; G558-T561 PolarHBondContact O-N 3.43Å; G558-T561 PolarHBondContact O-OG1 3.28Å; T561-T564 WeakPolarHBondContact CA-OG1 3.36Å; T561-T564 PolarHBondContact O-OG1 2.86Å; T561-A565 WeakPolarHBondContact O-CB 3.31Å; T561-A565 PolarHBondContact O-N 3.48Å; T561-A565 VanDerWaalsContact O-N 3.17Å; T561-L578 HydrophobicContact CG2-CD1 3.57Å; T561-L578 HydrophobicContact CG2-CD2 3.64Å; T561-L578 HydrophobicContact CG2-CG 4.25Å
562	C	73.7	Confident	75.4	Confident	20 Å²	20	59.5 Å²	59.5	14%	0.135	36%	0.36	C	S	.	.	H	α-helix	trans	-66.1	-44	170.4	-64.7	0	0	0	0	111.7	G558 P559 L560 A565 Q566	G558-C562 PolarHBondContact O-N 2.88Å; G558-C562 VanDerWaalsContact O-N 3.09Å; G558-C562 PolarHBondContact O-SG 3.45Å; P559-C562 PolarHBondContact O-N 2.83Å; L560-C562 VanDerWaalsContact C-N 3.35Å; C562-A565 PolarHBondContact O-N 3.26Å; C562-Q566 WeakPolarHBondContact O-CG 3.35Å; C562-Q566 PolarHBondContact O-N 2.71Å
563	L	73.7	Confident	74.7	Confident	26 Å²	26	61.5 Å²	61.5	14%	0.136	37%	0.374	C	S	.	.	H	α-helix	trans	-62.4	-45.2	177.4	-81.2	171.3	0	0	0	113	P512 A515 L519 P559 L560 A565 Q566 I567	P512-L563 HydrophobicContact CB-CD2 3.73Å; P512-L563 HydrophobicContact CG-CD2 4.29Å; A515-L563 HydrophobicContact CB-CD1 3.74Å; A515-L563 HydrophobicContact CB-CD2 3.85Å; A515-L563 HydrophobicContact CB-CG 3.7Å; L519-L563 HydrophobicContact CD1-CD1 3.86Å; P559-L563 WeakPolarHBondContact O-CB 3.17Å; P559-L563 WeakPolarHBondContact O-CG 3.4Å; P559-L563 PolarHBondContact O-N 2.76Å; L560-L563 PolarHBondContact O-N 3.25Å; L563-A565 VanDerWaalsContact C-N 3.29Å; L563-A565 PolarHBondContact O-N 3.31Å; L563-Q566 PolarHBondContact O-N 2.98Å; L563-I567 PolarHBondContact O-N 3.38Å
564	T	74.3	Confident	74.4	Confident	38 Å²	38	60.9 Å²	60.9	23%	0.233	38%	0.375	C	S	.	.	H	α-helix	trans	-69.3	-27	178.9	54.2	0	0	0	0	112.7	L560 T561 L570	L560-T564 WeakPolarHBondContact O-CG2 3.49Å; L560-T564 PolarHBondContact O-N 2.92Å; L560-T564 PolarHBondContact O-OG1 3.09Å; L560-T564 VanDerWaalsContact O-OG1 3.13Å; T561-T564 WeakPolarHBondContact CA-OG1 3.36Å; T561-T564 PolarHBondContact O-OG1 2.86Å; T564-L570 WeakPolarHBondContact CG2-O 3.26Å
565	A	70.7	Confident	74.1	Confident	62 Å²	62	69.6 Å²	69.6	51%	0.512	41%	0.406	S	S	.	.	H	α-helix	trans	-72.7	-35.6	170.6	0	0	0	0	0	113.3	T561 C562 L563	T561-A565 WeakPolarHBondContact O-CB 3.31Å; T561-A565 PolarHBondContact O-N 3.48Å; T561-A565 VanDerWaalsContact O-N 3.17Å; C562-A565 PolarHBondContact O-N 3.26Å; L563-A565 VanDerWaalsContact C-N 3.29Å; L563-A565 PolarHBondContact O-N 3.31Å
566	Q	70.4	Confident	73.9	Confident	69 Å²	69	72.9 Å²	72.9	32%	0.322	42%	0.42	S	S	.	.	H	α-helix	trans	-79	-28.4	179.8	-72.2	-179.8	29.7	0	0	114	V510 C562 L563 P568	V510-Q566 PolarHBondContact O-NE2 2.7Å; V510-Q566 PolarHBondContact O-OE1 3.2Å; C562-Q566 WeakPolarHBondContact O-CG 3.35Å; C562-Q566 PolarHBondContact O-N 2.71Å; L563-Q566 PolarHBondContact O-N 2.98Å; Q566-P568 WeakPolarHBondContact O-CD 3.21Å
567	I	73.3	Confident	73.9	Confident	53 Å²	53	75.2 Å²	75.2	27%	0.272	43%	0.432	S	S	.	.			trans	-115.7	97.1	-176.3	-56.7	171.9	0	0	0	109	L563 Q569 L570	L563-I567 PolarHBondContact O-N 3.38Å; I567-Q569 HydrophobicContact CG2-CB 4.34Å; I567-Q569 PolarHBondContact O-N 3.36Å; I567-L570 HydrophobicContact CB-CB 4.26Å; I567-L570 HydrophobicContact CB-CD1 4.03Å; I567-L570 HydrophobicContact CB-CG 4.15Å; I567-L570 HydrophobicContact CD1-CD1 3.8Å; I567-L570 HydrophobicContact CG2-CB 4.2Å; I567-L570 HydrophobicContact CG2-CD1 3.93Å; I567-L570 HydrophobicContact CG2-CG 3.72Å; I567-L570 PolarHBondContact O-N 2.84Å
568	P	63.2	Low	73.7	Confident	108 Å²	108	75.4 Å²	75.4	70%	0.701	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-56.9	-26.1	-177	-27.9	35.4	0	0	0	114.5	Q566 L570 N571	Q566-P568 WeakPolarHBondContact O-CD 3.21Å; P568-L570 VanDerWaalsContact C-N 3.31Å; P568-N571 WeakPolarHBondContact O-CB 3.42Å; P568-N571 PolarHBondContact O-N 2.97Å
569	Q	68.9	Low	73.6	Confident	188 Å²	188	76.6 Å²	76.6	88%	0.879	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-75.4	-15.5	177.2	-62.8	178.1	1.2	0	0	113.8	I567	I567-Q569 HydrophobicContact CG2-CB 4.34Å; I567-Q569 PolarHBondContact O-N 3.36Å
570	L	64.1	Low	73.7	Confident	104 Å²	104	80.1 Å²	80.1	55%	0.545	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-101.5	2.8	174.4	-62.9	179.7	0	0	0	112.3	T564 I567 P568 G572	T564-L570 WeakPolarHBondContact CG2-O 3.26Å; I567-L570 HydrophobicContact CB-CB 4.26Å; I567-L570 HydrophobicContact CB-CD1 4.03Å; I567-L570 HydrophobicContact CB-CG 4.15Å; I567-L570 HydrophobicContact CD1-CD1 3.8Å; I567-L570 HydrophobicContact CG2-CB 4.2Å; I567-L570 HydrophobicContact CG2-CD1 3.93Å; I567-L570 HydrophobicContact CG2-CG 3.72Å; I567-L570 PolarHBondContact O-N 2.84Å; P568-L570 VanDerWaalsContact C-N 3.31Å; L570-G572 PolarHBondContact O-N 3.21Å
571	N	65.1	Low	73.8	Confident	87 Å²	87	79.1 Å²	79.1	47%	0.465	45%	0.451	S	S	.	.			trans	-80.8	54.2	-176.1	-149.7	-4	0	0	0	111.3	P568 C573	P568-N571 WeakPolarHBondContact O-CB 3.42Å; P568-N571 PolarHBondContact O-N 2.97Å; N571-C573 VanDerWaalsContact C-N 3.34Å
572	G	65.3	Low	74	Confident	76 Å²	76	80.9 Å²	80.9	78%	0.784	46%	0.458	S	S	*	.			trans	-83.3	-3.4	-177.3	0	0	0	0	0	114.7	L570	L570-G572 PolarHBondContact O-N 3.21Å
573	C	68.1	Low	74.4	Confident	55 Å²	55	84.2 Å²	84.2	37%	0.372	48%	0.475	S	S	.	.	S	Bend	trans	-103.5	119.9	176.6	-171.5	0	0	0	0	110	N571	N571-C573 VanDerWaalsContact C-N 3.34Å
574	P	77.2	Confident	74.9	Confident	74 Å²	74	87.8 Å²	87.8	48%	0.481	49%	0.494	S	S	.	.			trans	-60.6	138.3	173.1	-17.8	29	0	0	0	110.8	N576 V577 L578	P574-N576 PolarHBondContact O-N 3.49Å; P574-V577 HydrophobicContact CB-CG2 4.11Å; P574-V577 HydrophobicContact CG-CG2 3.95Å; P574-V577 PolarHBondContact O-N 3.32Å; P574-L578 PolarHBondContact O-N 3.12Å; P574-L578 VanDerWaalsContact O-N 3.11Å
575	R	76	Confident	75.1	Confident	214 Å²	214	87.2 Å²	87.2	81%	0.808	49%	0.489	S	S	*	.	H	α-helix	trans	-45.8	-39.2	174.7	-76.2	-85.1	-168	124.1	2.4	112.7	L578 S579	R575-L578 PolarHBondContact O-N 2.92Å; R575-S579 PolarHBondContact O-N 3.43Å
576	N	80.1	Confident	75.5	Confident	120 Å²	120	86.4 Å²	86.4	64%	0.642	48%	0.482	S	S	*	.	H	α-helix	trans	-63.5	-42.3	-179	-39	-1.9	0	0	0	111.6	P574 S579 N580	P574-N576 PolarHBondContact O-N 3.49Å; N576-S579 PolarHBondContact O-N 3.43Å; N576-N580 WeakPolarHBondContact O-CB 3.36Å; N576-N580 VanDerWaalsContact O-CG 3.29Å; N576-N580 PolarHBondContact O-N 2.93Å; N576-N580 PolarHBondContact O-OD1 3.25Å
577	V	81.8	Confident	75.9	Confident	71 Å²	71	92.8 Å²	92.8	43%	0.43	51%	0.505	S	S	.	.	H	α-helix	trans	-70.4	-41.2	178.2	177.2	0	0	0	0	109.7	P574 N580 T581	P574-V577 HydrophobicContact CB-CG2 4.11Å; P574-V577 HydrophobicContact CG-CG2 3.95Å; P574-V577 PolarHBondContact O-N 3.32Å; V577-N580 PolarHBondContact O-N 3.41Å; V577-T581 WeakPolarHBondContact O-CB 3.25Å; V577-T581 PolarHBondContact O-N 3.37Å; V577-T581 PolarHBondContact O-OG1 3.09Å
578	L	78.5	Confident	76	Confident	43 Å²	43	95.5 Å²	95.5	23%	0.225	52%	0.519	C	S	.	.	H	α-helix	trans	-62.2	-43.2	174.6	180	61.6	0	0	0	112.3	T561 P574 R575 T581 L582	T561-L578 HydrophobicContact CG2-CD1 3.57Å; T561-L578 HydrophobicContact CG2-CD2 3.64Å; T561-L578 HydrophobicContact CG2-CG 4.25Å; P574-L578 PolarHBondContact O-N 3.12Å; P574-L578 VanDerWaalsContact O-N 3.11Å; R575-L578 PolarHBondContact O-N 2.92Å; L578-T581 PolarHBondContact O-N 3.41Å; L578-L582 HydrophobicContact CD1-CD1 4.28Å; L578-L582 HydrophobicContact CD1-CG 4.32Å; L578-L582 HydrophobicContact CG-CD1 4.22Å; L578-L582 WeakPolarHBondContact O-CG 3.16Å; L578-L582 PolarHBondContact O-N 3.32Å
579	S	80.8	Confident	76.3	Confident	58 Å²	58	92.4 Å²	92.4	41%	0.406	50%	0.496	S	S	.	.	H	α-helix	trans	-58.4	-58.1	174.7	-164.1	0	0	0	0	110.1	R575 N576 T581 L582 D583	R575-S579 PolarHBondContact O-N 3.43Å; N576-S579 PolarHBondContact O-N 3.43Å; S579-T581 PolarHBondContact O-N 3.36Å; S579-T581 VanDerWaalsContact O-N 3.1Å; S579-L582 CarbonylContact O-C 3.57Å; S579-L582 WeakPolarHBondContact O-CA 3.33Å; S579-L582 PolarHBondContact O-N 2.75Å; S579-D583 VanDerWaalsContact O-CG 3.23Å; S579-D583 PolarHBondContact O-N 3.35Å; S579-D583 PolarHBondContact OG-OD2 3.29Å
580	N	84.3	Confident	75.9	Confident	99 Å²	99	89 Å²	89	53%	0.529	49%	0.49	S	S	.	.	H	α-helix	trans	-54.3	-36.9	179.6	-70.8	-3.2	0	0	0	112.5	N576 V577 N584	N576-N580 WeakPolarHBondContact O-CB 3.36Å; N576-N580 VanDerWaalsContact O-CG 3.29Å; N576-N580 PolarHBondContact O-N 2.93Å; N576-N580 PolarHBondContact O-OD1 3.25Å; V577-N580 PolarHBondContact O-N 3.41Å; N580-N584 VanDerWaalsContact O-CB 3.25Å; N580-N584 WeakPolarHBondContact O-CB 3.39Å; N580-N584 PolarHBondContact O-N 3.33Å; N580-N584 PolarHBondContact O-ND2 3.29Å
581	T	82.7	Confident	75.7	Confident	56 Å²	56	88.3 Å²	88.3	34%	0.344	51%	0.508	S	S	.	.	H	α-helix	trans	-65.3	-44.5	174.6	-63.1	0	0	0	0	112.1	V577 L578 S579 I585	V577-T581 WeakPolarHBondContact O-CB 3.25Å; V577-T581 PolarHBondContact O-N 3.37Å; V577-T581 PolarHBondContact O-OG1 3.09Å; L578-T581 PolarHBondContact O-N 3.41Å; S579-T581 PolarHBondContact O-N 3.36Å; S579-T581 VanDerWaalsContact O-N 3.1Å; T581-I585 HydrophobicContact CG2-CD1 3.97Å; T581-I585 WeakPolarHBondContact O-CD1 3.43Å; T581-I585 WeakPolarHBondContact O-CG1 3.29Å; T581-I585 PolarHBondContact O-N 3.26Å
582	L	81.2	Confident	75.1	Confident	77 Å²	77	91.7 Å²	91.7	40%	0.403	53%	0.525	S	S	.	.	H	α-helix	trans	-67.9	-40.4	176.6	-67.1	172.3	0	0	0	111.9	L578 S579 I585 A586	L578-L582 HydrophobicContact CD1-CD1 4.28Å; L578-L582 HydrophobicContact CD1-CG 4.32Å; L578-L582 HydrophobicContact CG-CD1 4.22Å; L578-L582 WeakPolarHBondContact O-CG 3.16Å; L578-L582 PolarHBondContact O-N 3.32Å; S579-L582 CarbonylContact O-C 3.57Å; S579-L582 WeakPolarHBondContact O-CA 3.33Å; S579-L582 PolarHBondContact O-N 2.75Å; L582-I585 PolarHBondContact O-N 3.4Å; L582-I585 VanDerWaalsContact O-N 3.16Å; L582-A586 WeakPolarHBondContact O-CB 3.47Å; L582-A586 PolarHBondContact O-N 3.3Å
583	D	83.5	Confident	75.6	Confident	90 Å²	90	92.5 Å²	92.5	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-62.4	-42.2	176	-63.2	-46.1	0	0	0	110.9	S579 A586 Y587	S579-D583 VanDerWaalsContact O-CG 3.23Å; S579-D583 PolarHBondContact O-N 3.35Å; S579-D583 PolarHBondContact OG-OD2 3.29Å; D583-A586 PolarHBondContact O-N 3.13Å; D583-Y587 WeakPolarHBondContact O-CB 3.47Å; D583-Y587 PolarHBondContact O-N 3.46Å
584	N	82.8	Confident	76	Confident	101 Å²	101	94.5 Å²	94.5	54%	0.54	52%	0.52	S	S	.	.	H	α-helix	trans	-63.5	-38.9	172.3	-74.5	-28.6	0	0	0	112.5	N580 Y587 I588	N580-N584 VanDerWaalsContact O-CB 3.25Å; N580-N584 WeakPolarHBondContact O-CB 3.39Å; N580-N584 PolarHBondContact O-N 3.33Å; N580-N584 PolarHBondContact O-ND2 3.29Å; N584-Y587 PolarHBondContact O-N 3.36Å; N584-I588 WeakPolarHBondContact O-CD1 3.46Å; N584-I588 VanDerWaalsContact O-CG1 3.29Å; N584-I588 WeakPolarHBondContact O-CG1 3.21Å; N584-I588 PolarHBondContact O-N 3.29Å; N584-I588 VanDerWaalsContact O-N 3.1Å
585	I	79.1	Confident	76	Confident	26 Å²	26	95.6 Å²	95.6	13%	0.133	52%	0.522	C	S	.	.	H	α-helix	trans	-69.4	-41.3	177.3	-65.9	160.4	0	0	0	110.8	L554 L557 T581 L582 Y587 I588 M589	L554-I585 HydrophobicContact CD1-CG2 4.01Å; L554-I585 HydrophobicContact CD2-CD1 4.22Å; L554-I585 HydrophobicContact CD2-CG2 3.85Å; L554-I585 HydrophobicContact CG-CG2 4.11Å; L557-I585 HydrophobicContact CD1-CD1 3.74Å; T581-I585 HydrophobicContact CG2-CD1 3.97Å; T581-I585 WeakPolarHBondContact O-CD1 3.43Å; T581-I585 WeakPolarHBondContact O-CG1 3.29Å; T581-I585 PolarHBondContact O-N 3.26Å; L582-I585 PolarHBondContact O-N 3.4Å; L582-I585 VanDerWaalsContact O-N 3.16Å; I585-Y587 VanDerWaalsContact C-N 3.29Å; I585-Y587 PolarHBondContact O-N 3.43Å; I585-I588 PolarHBondContact O-N 3.19Å; I585-I588 VanDerWaalsContact O-N 3.16Å; I585-M589 HydrophobicContact CG2-CE 3.71Å; I585-M589 PolarHBondContact O-N 3.45Å
586	A	78.7	Confident	76	Confident	45 Å²	45	88.6 Å²	88.6	37%	0.372	51%	0.505	S	S	.	.	H	α-helix	trans	-64.2	-32.5	175.3	0	0	0	0	0	112.5	L582 D583 M589	L582-A586 WeakPolarHBondContact O-CB 3.47Å; L582-A586 PolarHBondContact O-N 3.3Å; D583-A586 PolarHBondContact O-N 3.13Å; A586-M589 CarbonylContact O-C 3.27Å; A586-M589 VanDerWaalsContact O-C 3.27Å
587	Y	80.2	Confident	75.7	Confident	203 Å²	203	86.7 Å²	86.7	80%	0.796	50%	0.496	S	S	*	.	H	α-helix	trans	-67.6	-39	171.5	-178.8	-96.8	0	0	0	112.7	D583 N584 I585	D583-Y587 WeakPolarHBondContact O-CB 3.47Å; D583-Y587 PolarHBondContact O-N 3.46Å; N584-Y587 PolarHBondContact O-N 3.36Å; I585-Y587 VanDerWaalsContact C-N 3.29Å; I585-Y587 PolarHBondContact O-N 3.43Å
588	I	73.9	Confident	75.3	Confident	110 Å²	110	87.7 Å²	87.7	56%	0.564	50%	0.501	S	S	*	.	H	α-helix	trans	-75.2	-30.7	177.9	-67.1	165.3	0	0	0	111.7	L550 N584 I585	L550-I588 HydrophobicContact CD1-CG2 4.33Å; N584-I588 WeakPolarHBondContact O-CD1 3.46Å; N584-I588 VanDerWaalsContact O-CG1 3.29Å; N584-I588 WeakPolarHBondContact O-CG1 3.21Å; N584-I588 PolarHBondContact O-N 3.29Å; N584-I588 VanDerWaalsContact O-N 3.1Å; I585-I588 PolarHBondContact O-N 3.19Å; I585-I588 VanDerWaalsContact O-N 3.16Å
589	M	69.3	Low	75.1	Confident	44 Å²	44	90.9 Å²	90.9	22%	0.217	52%	0.521	C	S	.	.	S	Bend	trans	-127.4	78.7	179.5	-66.4	-167.8	-67.7	0	0	111.2	L550 L554 I585 A586 G591 L592	L550-M589 HydrophobicContact CB-CE 3.87Å; L550-M589 HydrophobicContact CB-SD 3.97Å; L550-M589 HydrophobicContact CD1-SD 4.17Å; L554-M589 HydrophobicContact CD1-CE 3.41Å; L554-M589 VanDerWaalsContact CD1-CE 3.41Å; L554-M589 HydrophobicContact CG-CE 4.3Å; I585-M589 HydrophobicContact CG2-CE 3.71Å; I585-M589 PolarHBondContact O-N 3.45Å; A586-M589 CarbonylContact O-C 3.27Å; A586-M589 VanDerWaalsContact O-C 3.27Å; M589-G591 PolarHBondContact O-N 3.45Å; M589-L592 HydrophobicContact CB-CD1 4.38Å; M589-L592 HydrophobicContact CE-CD1 4.09Å
590	P	62.1	Low	74.6	Confident	116 Å²	116	93.5 Å²	93.5	75%	0.753	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	119.5	178.2	25.4	-33.9	0	0	0	111.2
591	G	59.2	Low	73.8	Confident	89 Å²	89	93 Å²	93	92%	0.918	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	127.8	7.1	-179.2	0	0	0	0	0	115.6	M589	M589-G591 PolarHBondContact O-N 3.45Å
592	L	52.9	Low	73	Confident	159 Å²	159	96.4 Å²	96.4	83%	0.832	55%	0.546	S	S	*	.			trans	-103.2	0	-178.3	-132.3	140.9	0	0	0	112.8	L554 M589	L554-L592 HydrophobicContact CD1-CD1 3.37Å; L554-L592 HydrophobicContact CD1-CD2 3.85Å; L554-L592 HydrophobicContact CD1-CG 4.26Å; M589-L592 HydrophobicContact CB-CD1 4.38Å; M589-L592 HydrophobicContact CE-CD1 4.09Å

Retrieved 592 of 592 residues in 205.6 ms (Link to these results)

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