A0A087XV72_POEFO Loading...

Leukocyte receptor cluster (LRC) member 8

AlphaFold DB , UniProt , Accession A0A087XV72, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 761 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.2	Very low	28.6	Very low	239 Å²	239	136 Å²	136	100%	1.177	87%	0.867	S	S	*	*				0	111.6	0	-58.6	174.6	-170	0	0	105.3
2	A	28.8	Very low	28.5	Very low	102 Å²	102	137 Å²	137	84%	0.843	87%	0.87	S	S	*	*				74.6	129.3	73.4	0	0	0	0	0	110.9
3	A	29.6	Very low	28.4	Very low	98 Å²	98	136.6 Å²	136.6	81%	0.81	86%	0.858	S	S	*	*			cis	-152	-177	6.9	0	0	0	0	0	114.2
4	N	27.4	Very low	28	Very low	153 Å²	153	141.2 Å²	141.2	82%	0.818	85%	0.851	S	S	*	*			trans	-56.5	168.1	174	-53.5	-40.8	0	0	0	114.7
5	T	30.8	Very low	27.7	Very low	132 Å²	132	140.2 Å²	140.2	81%	0.81	85%	0.853	S	S	*	*				169.1	102.6	121.1	-69.5	0	0	0	0	106.9
6	A	30	Very low	27.5	Very low	91 Å²	91	143.7 Å²	143.7	75%	0.752	85%	0.848	S	S	*	*				77.5	132.9	64.9	0	0	0	0	0	113.7
7	Q	28.8	Very low	27.5	Very low	201 Å²	201	139.4 Å²	139.4	94%	0.939	84%	0.841	S	S	*	*			trans	-82.4	156.1	178	-64.1	165.6	-53	0	0	110.9
8	A	27.6	Very low	28	Very low	103 Å²	103	139.5 Å²	139.5	85%	0.851	85%	0.845	S	S	*	*			trans	-131.3	149.3	170.3	0	0	0	0	0	110.8
9	T	26.1	Very low	28.2	Very low	143 Å²	143	137.6 Å²	137.6	88%	0.877	85%	0.845	S	S	*	*			trans	-111.1	159.1	-174.3	47.1	0	0	0	0	112
10	A	26.7	Very low	28.2	Very low	104 Å²	104	135.7 Å²	135.7	86%	0.86	84%	0.844	S	S	*	*			trans	-151.3	148.4	160.4	0	0	0	0	0	109.9
11	T	25.4	Very low	28.3	Very low	130 Å²	130	137.4 Å²	137.4	80%	0.798	85%	0.848	S	S	*	*			trans	-139.1	145.3	-171.2	51.3	0	0	0	0	111.5
12	T	28	Very low	28.3	Very low	148 Å²	148	129.6 Å²	129.6	91%	0.908	83%	0.828	S	S	*	*			trans	-142.4	154.1	166.9	-36.8	0	0	0	0	110.5
13	N	26.8	Very low	28.4	Very low	132 Å²	132	133.9 Å²	133.9	71%	0.706	83%	0.83	S	S	*	*			trans	-120.3	144.4	-158.5	-93.9	-7.3	0	0	0	115.7
14	W	22.6	Very low	28.8	Very low	201 Å²	201	134.9 Å²	134.9	76%	0.761	83%	0.827	S	S	*	*			trans	57.2	137	133.3	-68.8	52.4	0	0	0	123.3	Y16	W14-Y16 HydrophobicContact CE3-CD2 4.02Å; W14-Y16 HydrophobicContact CE3-CE2 4.21Å; W14-Y16 HydrophobicContact CH2-CE2 4.32Å; W14-Y16 AromaticContact CZ3-CD2 3.87Å; W14-Y16 HydrophobicContact CZ3-CD2 3.87Å; W14-Y16 AromaticContact CZ3-CE2 3.6Å; W14-Y16 HydrophobicContact CZ3-CE2 3.6Å
15	S	23.6	Very low	29.4	Very low	126 Å²	126	136.5 Å²	136.5	88%	0.881	83%	0.829	S	S	*	*				-158.6	-179.4	126.1	-160.3	0	0	0	0	111.1
16	Y	25.5	Very low	30	Very low	196 Å²	196	136.3 Å²	136.3	77%	0.769	82%	0.818	S	S	*	*			trans	-140	129.3	-150.4	-136.4	-103.4	0	0	0	116.1	W14	W14-Y16 HydrophobicContact CE3-CD2 4.02Å; W14-Y16 HydrophobicContact CE3-CE2 4.21Å; W14-Y16 HydrophobicContact CH2-CE2 4.32Å; W14-Y16 AromaticContact CZ3-CD2 3.87Å; W14-Y16 HydrophobicContact CZ3-CD2 3.87Å; W14-Y16 AromaticContact CZ3-CE2 3.6Å; W14-Y16 HydrophobicContact CZ3-CE2 3.6Å
17	G	26.2	Very low	30.6	Very low	71 Å²	71	137.3 Å²	137.3	73%	0.732	81%	0.811	S	S	*	*			trans	66.1	179	158.5	0	0	0	0	0	119.4
18	P	36.7	Very low	31.8	Very low	141 Å²	141	131.6 Å²	131.6	92%	0.916	79%	0.792	S	S	*	*			cis	-118.5	-159	-7.6	42.2	-27.8	0	0	0	113.2
19	A	31.6	Very low	32.4	Very low	103 Å²	103	131.9 Å²	131.9	85%	0.851	78%	0.775	S	S	*	*			trans	-114.8	166.4	-173.1	0	0	0	0	0	114.7
20	A	28.8	Very low	33.4	Very low	99 Å²	99	129.3 Å²	129.3	82%	0.818	75%	0.75	S	S	*	*			trans	-156.3	158.2	166.8	0	0	0	0	0	111.1
21	D	29.7	Very low	34.4	Very low	173 Å²	173	129.1 Å²	129.1	93%	0.925	73%	0.731	S	S	*	*			trans	-74.6	166.7	-172.5	-60.8	-82.6	0	0	0	115.6
22	G	33.7	Very low	35.6	Very low	75 Å²	75	128.8 Å²	128.8	77%	0.773	72%	0.719	S	S	*	*			trans	-117.5	-177.6	-179	0	0	0	0	0	114.5
23	H	31.3	Very low	36.3	Very low	191 Å²	191	124.9 Å²	124.9	88%	0.884	70%	0.701	S	S	*	*			trans	-147.6	159.5	167	-159	44.8	0	0	0	111.6
24	V	38	Very low	37.2	Very low	120 Å²	120	125.4 Å²	125.4	73%	0.727	69%	0.693	S	S	*	*			trans	-88	136.3	-174.4	-174.7	0	0	0	0	110
25	H	39.4	Very low	38.4	Very low	187 Å²	187	122.2 Å²	122.2	87%	0.866	69%	0.687	S	S	*	*			trans	-103.1	105.5	168.3	-166	56.4	0	0	0	110.1
26	E	44.6	Very low	39.5	Very low	127 Å²	127	119.4 Å²	119.4	59%	0.593	67%	0.672	S	S	*	*			trans	-75	126	-176	-133.2	-176.9	-179.5	0	0	111.3	W30	E26-W30 VanDerWaalsContact CD-NE1 3.31Å; E26-W30 PolarHBondContact OE2-NE1 2.61Å
27	N	41.7	Very low	40.4	Very low	113 Å²	113	113.7 Å²	113.7	60%	0.604	65%	0.654	S	S	*	*			trans	-82.7	125.4	178.6	-178.9	7.2	0	0	0	110.2	E29	N27-E29 PolarHBondContact O-N 3.02Å
28	P	53	Low	41.4	Very low	81 Å²	81	113.3 Å²	113.3	53%	0.526	64%	0.644	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.6	7.2	-172.1	22	-35.2	0	0	0	117.9	W30 E31	P28-W30 PolarHBondContact O-N 3.38Å; P28-E31 PolarHBondContact O-N 2.83Å
29	E	42	Very low	41.8	Very low	109 Å²	109	111.8 Å²	111.8	51%	0.509	64%	0.636	S	S	.	*	H	α-helix	trans	-55.6	-28.5	167.1	-68.5	-71	96.3	0	0	112.4	N27 E31 K32 A33	N27-E29 PolarHBondContact O-N 3.02Å; E29-E31 PolarHBondContact O-N 3.33Å; E29-K32 PolarHBondContact O-N 2.63Å; E29-K32 WeakPolarHBondContact OE1-CD 3.37Å; E29-K32 WeakPolarHBondContact OE1-CE 3.31Å; E29-K32 IonicContact OE1-NZ 2.7Å; E29-K32 PolarHBondContact OE1-NZ 2.7Å; E29-A33 PolarHBondContact O-N 3.47Å
30	W	46.4	Very low	42.3	Very low	88 Å²	88	110.3 Å²	110.3	33%	0.333	61%	0.613	S	S	.	*	H	α-helix	trans	-63.1	-23.2	175.1	61.7	-107.5	0	0	0	113.6	E26 P28 R34	E26-W30 VanDerWaalsContact CD-NE1 3.31Å; E26-W30 PolarHBondContact OE2-NE1 2.61Å; P28-W30 PolarHBondContact O-N 3.38Å; W30-R34 VanDerWaalsContact CZ3-CZ 3.5Å
31	E	48.5	Very low	42.8	Very low	100 Å²	100	111.6 Å²	111.6	47%	0.467	61%	0.607	S	S	.	*	H	α-helix	trans	-81.6	-30.4	179.1	-163.3	163.8	-140.3	0	0	111.6	P28 E29 A33 R34 Q35	P28-E31 PolarHBondContact O-N 2.83Å; E29-E31 PolarHBondContact O-N 3.33Å; E31-A33 VanDerWaalsContact C-N 3.31Å; E31-A33 PolarHBondContact O-N 3.05Å; E31-R34 WeakPolarHBondContact O-CB 3.48Å; E31-R34 PolarHBondContact O-N 3.27Å; E31-R34 VanDerWaalsContact O-N 3.13Å; E31-Q35 PolarHBondContact O-N 2.77Å
32	K	50.1	Low	43.1	Very low	124 Å²	124	112.6 Å²	112.6	54%	0.539	60%	0.603	S	S	.	*	H	α-helix	trans	-63	-36.3	171	-69.7	178.3	-178.6	166.1	0	112.4	E29 R34 Q35 A36	E29-K32 PolarHBondContact O-N 2.63Å; E29-K32 WeakPolarHBondContact OE1-CD 3.37Å; E29-K32 WeakPolarHBondContact OE1-CE 3.31Å; E29-K32 IonicContact OE1-NZ 2.7Å; E29-K32 PolarHBondContact OE1-NZ 2.7Å; K32-R34 PolarHBondContact O-N 2.99Å; K32-Q35 PolarHBondContact O-N 3.02Å; K32-Q35 VanDerWaalsContact O-N 3.07Å; K32-A36 PolarHBondContact O-N 2.84Å
33	A	42.6	Very low	43.1	Very low	66 Å²	66	115.5 Å²	115.5	55%	0.545	61%	0.606	S	S	.	*	H	α-helix	trans	-59.4	-33.5	175	0	0	0	0	0	112.1	E29 E31	E29-A33 PolarHBondContact O-N 3.47Å; E31-A33 VanDerWaalsContact C-N 3.31Å; E31-A33 PolarHBondContact O-N 3.05Å
34	R	46.3	Very low	43	Very low	142 Å²	142	111.7 Å²	111.7	54%	0.536	60%	0.601	S	S	.	*	H	α-helix	trans	-71.8	-38.4	173.8	-54.2	-178	-171.2	-168.1	5.5	111.7	W30 E31 K32 A36 L37	W30-R34 VanDerWaalsContact CZ3-CZ 3.5Å; E31-R34 WeakPolarHBondContact O-CB 3.48Å; E31-R34 PolarHBondContact O-N 3.27Å; E31-R34 VanDerWaalsContact O-N 3.13Å; K32-R34 PolarHBondContact O-N 2.99Å; R34-A36 PolarHBondContact O-N 3.2Å; R34-L37 PolarHBondContact O-N 3.12Å
35	Q	47.9	Very low	42.7	Very low	134 Å²	134	115 Å²	115	63%	0.626	61%	0.605	S	S	*	*	H	α-helix	trans	-67.5	-32.1	177.4	-66.2	-174.7	4.1	0	0	113.4	E31 K32 L37 A38 S39	E31-Q35 PolarHBondContact O-N 2.77Å; K32-Q35 PolarHBondContact O-N 3.02Å; K32-Q35 VanDerWaalsContact O-N 3.07Å; Q35-L37 PolarHBondContact O-N 3.03Å; Q35-L37 VanDerWaalsContact O-N 3.16Å; Q35-A38 WeakPolarHBondContact O-CB 3.06Å; Q35-A38 PolarHBondContact O-N 3.3Å; Q35-S39 PolarHBondContact O-N 2.86Å
36	A	45.7	Very low	42	Very low	68 Å²	68	113.3 Å²	113.3	56%	0.562	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-19.8	175.2	0	0	0	0	0	113.7	K32 R34 S39	K32-A36 PolarHBondContact O-N 2.84Å; R34-A36 PolarHBondContact O-N 3.2Å; A36-S39 PolarHBondContact O-OG 3.42Å
37	L	44.4	Very low	41.2	Very low	75 Å²	75	111.6 Å²	111.6	39%	0.393	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.5	-8.1	174.7	-62.2	175.9	0	0	0	113.6	R34 Q35 K267	R34-L37 PolarHBondContact O-N 3.12Å; Q35-L37 PolarHBondContact O-N 3.03Å; Q35-L37 VanDerWaalsContact O-N 3.16Å; L37-K267 HydrophobicContact CD2-CD 4.14Å; L37-K267 HydrophobicContact CD2-CG 4.43Å; L37-K267 PolarHBondContact O-NZ 3.01Å
38	A	46.2	Very low	40.6	Very low	64 Å²	64	114.2 Å²	114.2	53%	0.529	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.9	-21.2	-173.9	0	0	0	0	0	114.3	Q35 I40 N41	Q35-A38 WeakPolarHBondContact O-CB 3.06Å; Q35-A38 PolarHBondContact O-N 3.3Å; A38-I40 PolarHBondContact O-N 2.87Å; A38-N41 PolarHBondContact O-N 2.83Å
39	S	45.3	Very low	39.3	Very low	108 Å²	108	116.4 Å²	116.4	76%	0.755	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-1.9	176.1	51.9	0	0	0	0	114.9	Q35 A36	Q35-S39 PolarHBondContact O-N 2.86Å; A36-S39 PolarHBondContact O-OG 3.42Å
40	I	42.8	Very low	38.6	Very low	72 Å²	72	117 Å²	117	37%	0.369	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.3	-20.9	173.4	-86.2	165.7	0	0	0	113	A38 D261	A38-I40 PolarHBondContact O-N 2.87Å; I40-D261 WeakPolarHBondContact CG1-OD1 3.49Å; I40-D261 VanDerWaalsContact CG2-CG 3.49Å; I40-D261 WeakPolarHBondContact CG2-OD1 3.32Å; I40-D261 WeakPolarHBondContact CG2-OD2 3.28Å
41	N	39.5	Very low	37.6	Very low	127 Å²	127	123.3 Å²	123.3	68%	0.679	65%	0.651	S	S	*	*			trans	-126	79.6	-158.7	-166.8	-3.5	0	0	0	116.3	A38	A38-N41 PolarHBondContact O-N 2.83Å
42	K	35.6	Very low	36.6	Very low	194 Å²	194	126 Å²	126	84%	0.843	67%	0.668	S	S	*	*			trans	168.6	148.6	132.9	-96.9	168.4	-177.1	174.3	0	115.6
43	T	34.8	Very low	35.5	Very low	135 Å²	135	126.8 Å²	126.8	83%	0.828	68%	0.684	S	S	*	*			trans	-145.2	133.8	169.4	-36.3	0	0	0	0	110
44	S	29.4	Very low	34.8	Very low	112 Å²	112	127.6 Å²	127.6	78%	0.783	69%	0.691	S	S	*	*			trans	145.4	154.7	150.8	-69.8	0	0	0	0	115.7
45	K	29.6	Very low	33.9	Very low	189 Å²	189	129.8 Å²	129.8	82%	0.822	71%	0.707	S	S	*	*			trans	74.4	112.6	172	-62.4	-174	179.5	-176	0	115.1
46	N	26.4	Very low	32.8	Very low	151 Å²	151	127.9 Å²	127.9	81%	0.807	71%	0.714	S	S	*	*				91.7	142.6	68.3	-80.9	32.7	0	0	0	111.9
47	S	27.1	Very low	31.9	Very low	92 Å²	92	128.3 Å²	128.3	64%	0.643	73%	0.725	S	S	*	*			cis	-170.5	162.9	-14.7	-92.2	0	0	0	0	111.6
48	Q	28.3	Very low	31	Very low	168 Å²	168	133.1 Å²	133.1	79%	0.785	75%	0.745	S	S	*	*			trans	87.2	149.1	148.8	-94.6	-176.1	-101.1	0	0	124.2
49	D	26.4	Very low	29.9	Very low	127 Å²	127	139.4 Å²	139.4	68%	0.679	76%	0.761	S	S	*	*			trans	69.4	143	154.5	-69.7	20.3	0	0	0	121.6
50	N	26.7	Very low	29	Very low	121 Å²	121	143 Å²	143	65%	0.647	77%	0.766	S	S	*	*			cis	-166.1	160.2	-25.2	-155.8	-9.7	0	0	0	112.5
51	R	27.1	Very low	28.3	Very low	220 Å²	220	144.3 Å²	144.3	83%	0.83	79%	0.788	S	S	*	*			trans	75.2	152.3	154.9	-87.4	168.5	-178.1	158.3	1.4	123.7
52	N	26.3	Very low	27.7	Very low	156 Å²	156	143.1 Å²	143.1	83%	0.834	80%	0.795	S	S	*	*			trans	-93.3	172.6	-179.4	-41.4	-25.1	0	0	0	112.1
53	T	28.2	Very low	27.2	Very low	141 Å²	141	141.3 Å²	141.3	87%	0.865	80%	0.795	S	S	*	*				-154.4	169.2	127.8	-66.9	0	0	0	0	108.4
54	A	26.1	Very low	26.8	Very low	83 Å²	83	140.3 Å²	140.3	69%	0.686	79%	0.793	S	S	*	*			trans	-129.6	-157.5	-175.8	0	0	0	0	0	112.3
55	E	27.8	Very low	26.6	Very low	189 Å²	189	139.4 Å²	139.4	88%	0.883	79%	0.793	S	S	*	*			trans	79.7	156.5	174.9	-54	-175.1	120	0	0	117.5
56	A	24.9	Very low	26.8	Very low	94 Å²	94	135.3 Å²	135.3	78%	0.777	79%	0.794	S	S	*	*			cis	-172.5	144	-35.2	0	0	0	0	0	112
57	G	27	Very low	26.9	Very low	76 Å²	76	136.2 Å²	136.2	78%	0.784	80%	0.798	S	S	*	*			trans	80.2	172.4	162	0	0	0	0	0	117.7
58	Q	24.7	Very low	27.5	Very low	176 Å²	176	140 Å²	140	82%	0.822	81%	0.805	S	S	*	*			cis	-174.5	125.1	-17.2	-122.3	-173.7	-4.7	0	0	110
59	F	24.6	Very low	27.5	Very low	196 Å²	196	140.2 Å²	140.2	86%	0.86	81%	0.807	S	S	*	*			trans	59.4	169.3	170.7	-73.1	-95.8	0	0	0	115.7
60	Q	26.1	Very low	28.1	Very low	185 Å²	185	142.5 Å²	142.5	86%	0.864	81%	0.813	S	S	*	*			cis	-149.4	162.1	13.8	-158.7	166.9	-9.9	0	0	110.9
61	A	27.2	Very low	28.1	Very low	99 Å²	99	144 Å²	144	82%	0.818	82%	0.817	S	S	*	*			trans	-99.7	154.4	-175.8	0	0	0	0	0	114.9
62	A	26.7	Very low	28.1	Very low	102 Å²	102	141.6 Å²	141.6	84%	0.843	81%	0.809	S	S	*	*			trans	-157.4	148.7	166.3	0	0	0	0	0	112.2
63	D	25.9	Very low	28.5	Very low	155 Å²	155	142 Å²	142	83%	0.829	80%	0.8	S	S	*	*			trans	-82.3	155.1	-179.1	-65.5	-80.9	0	0	0	114.6
64	S	25.8	Very low	28.7	Very low	114 Å²	114	140.6 Å²	140.6	80%	0.797	79%	0.793	S	S	*	*				152.8	136.8	116.2	-70.7	0	0	0	0	116.5
65	A	26.6	Very low	28.8	Very low	94 Å²	94	146.5 Å²	146.5	78%	0.777	80%	0.797	S	S	*	*			trans	60.8	102.1	141.6	0	0	0	0	0	121.8
66	A	32.9	Very low	29.2	Very low	102 Å²	102	141 Å²	141	84%	0.843	77%	0.769	S	S	*	*				49.3	109.1	127.9	0	0	0	0	0	120.7
67	L	28.3	Very low	29.4	Very low	171 Å²	171	145 Å²	145	90%	0.895	77%	0.771	S	S	*	*			trans	-144	130.9	144.2	-124.8	156.4	0	0	0	112.5
68	Q	40.4	Very low	29.7	Very low	170 Å²	170	149.5 Å²	149.5	79%	0.794	77%	0.772	S	S	*	*			trans	-83.6	132.8	-175.1	175.4	-175.1	50.1	0	0	111.3
69	Q	27.8	Very low	30.3	Very low	174 Å²	174	146.4 Å²	146.4	81%	0.813	77%	0.765	S	S	*	*			trans	-154.2	143.9	159.5	-122.1	169.7	109.5	0	0	113.8
70	Q	38.7	Very low	30.6	Very low	174 Å²	174	143.1 Å²	143.1	81%	0.813	75%	0.753	S	S	*	*			trans	-91.3	139	178.3	-61.7	175.7	3.8	0	0	110.2
71	Q	27.8	Very low	30.7	Very low	154 Å²	154	141.1 Å²	141.1	72%	0.72	74%	0.743	S	S	*	*			trans	-130.2	141.6	167	-73.1	-67.3	-77.4	0	0	109.1
72	Y	27	Very low	30.6	Very low	169 Å²	169	144.2 Å²	144.2	66%	0.663	74%	0.741	S	S	*	*			trans	-126.8	109.7	-164.5	-172.5	-84.7	0	0	0	110.2
73	Y	35	Very low	30.7	Very low	164 Å²	164	150.6 Å²	150.6	64%	0.643	75%	0.745	S	S	*	*			trans	-90	134.5	-176.6	-83.4	-81.1	0	0	0	112.8	W75	Y73-W75 PolarHBondContact O-N 2.98Å
74	P	30.6	Very low	31	Very low	111 Å²	111	148.5 Å²	148.5	72%	0.721	74%	0.74	S	S	*	*			trans	-98	20.7	-159.9	39.1	-40	0	0	0	116.4	Y76	P74-Y76 VanDerWaalsContact C-N 3.35Å; P74-Y76 PolarHBondContact O-N 3.3Å
75	W	28.4	Very low	31	Very low	207 Å²	207	146.7 Å²	146.7	78%	0.784	74%	0.739	S	S	*	*			trans	-72.5	-18.8	-166.3	-141.5	89.5	0	0	0	115.7	Y73 Q77	Y73-W75 PolarHBondContact O-N 2.98Å; W75-Q77 PolarHBondContact O-N 3.25Å
76	Y	36.7	Very low	31.1	Very low	74 Å²	74	153.1 Å²	153.1	29%	0.29	75%	0.745	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.1	58.8	-166.2	-129.3	-64.4	0	0	0	115.6	P74 L525 Q569	P74-Y76 VanDerWaalsContact C-N 3.35Å; P74-Y76 PolarHBondContact O-N 3.3Å; Y76-L525 HydrophobicContact CD1-CB 3.83Å; Y76-L525 WeakPolarHBondContact CD1-O 3.44Å; Y76-L525 HydrophobicContact CD2-CB 3.92Å; Y76-L525 HydrophobicContact CD2-CD1 4.16Å; Y76-L525 HydrophobicContact CE1-CB 3.71Å; Y76-L525 WeakPolarHBondContact CE1-O 3.34Å; Y76-L525 HydrophobicContact CE2-CB 3.79Å; Y76-L525 HydrophobicContact CE2-CD1 3.5Å; Y76-L525 HydrophobicContact CE2-CG 4.26Å; Y76-L525 HydrophobicContact CG-CB 3.94Å; Y76-Q569 PolarHBondContact OH-NE2 3.41Å
77	Q	29.8	Very low	30.7	Very low	177 Å²	177	154.3 Å²	154.3	83%	0.827	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.3	22.7	172.5	-144.8	166.4	106.5	0	0	117.9	W75	W75-Q77 PolarHBondContact O-N 3.25Å
78	Q	32.8	Very low	30.7	Very low	171 Å²	171	156.8 Å²	156.8	80%	0.799	74%	0.741	S	S	*	*			trans	-124.5	37.4	-175.5	-149	-179.1	-0.6	0	0	117.2
79	T	36.3	Very low	30.3	Very low	111 Å²	111	153.9 Å²	153.9	68%	0.681	74%	0.737	S	S	*	*	S	Bend	trans	-138.4	38.3	171.7	51.4	0	0	0	0	115
80	Q	31.8	Very low	30.3	Very low	127 Å²	127	156.6 Å²	156.6	59%	0.593	74%	0.741	S	S	*	*	S	Bend	trans	-143.2	143.9	165.4	-75.1	-60.3	-52.1	0	0	112.4
81	Q	27.2	Very low	29.6	Very low	143 Å²	143	154.7 Å²	154.7	67%	0.668	74%	0.737	S	S	*	*	S	Bend	trans	77.6	114.6	172.8	-50.5	-58.5	-17.6	0	0	119.2
82	H	26.2	Very low	29.6	Very low	164 Å²	164	155.1 Å²	155.1	76%	0.759	73%	0.733	S	S	*	*			trans	47.3	113.7	141.4	-67.9	83.2	0	0	0	120.5	P84	H82-P84 VanDerWaalsContact O-CD 3.23Å; H82-P84 WeakPolarHBondContact O-CD 3.36Å
83	Y	29.6	Very low	29.5	Very low	237 Å²	237	156.1 Å²	156.1	93%	0.929	74%	0.736	S	S	*	*			trans	-74.5	127.8	156.4	-98	-89.7	0	0	0	111.8
84	P	30.8	Very low	29.1	Very low	111 Å²	111	158.7 Å²	158.7	72%	0.721	75%	0.747	S	S	*	*			trans	-113.1	146.9	141.5	35.7	-29.6	0	0	0	110.4	H82	H82-P84 VanDerWaalsContact O-CD 3.23Å; H82-P84 WeakPolarHBondContact O-CD 3.36Å
85	G	26.1	Very low	29.3	Very low	76 Å²	76	158.3 Å²	158.3	78%	0.784	74%	0.744	S	S	*	*			trans	-61.2	159.5	-160.5	0	0	0	0	0	118.2
86	Y	28.8	Very low	29.2	Very low	228 Å²	228	157.3 Å²	157.3	89%	0.894	75%	0.751	S	S	*	*			trans	-106.7	137.7	156.6	-102.1	-86.7	0	0	0	110
87	T	25.1	Very low	28.9	Very low	128 Å²	128	156.9 Å²	156.9	79%	0.785	77%	0.768	S	S	*	*			trans	-88.3	139.2	-179.8	43.3	0	0	0	0	111.1
88	Y	27.7	Very low	29.3	Very low	223 Å²	223	153.6 Å²	153.6	88%	0.875	76%	0.762	S	S	*	*			trans	-133.1	143.6	157.6	-103	-95	0	0	0	109.1
89	P	31.7	Very low	29.1	Very low	109 Å²	109	156.3 Å²	156.3	71%	0.708	77%	0.767	S	S	*	*			trans	-87.1	140.9	-168.2	33.6	-34.4	0	0	0	112.3
90	Y	27.6	Very low	28.8	Very low	230 Å²	230	154.3 Å²	154.3	90%	0.902	77%	0.768	S	S	*	*			trans	-141.3	123.9	155.8	-115.3	-88.5	0	0	0	109
91	N	25	Very low	28.8	Very low	135 Å²	135	152.7 Å²	152.7	72%	0.722	78%	0.777	S	S	*	*			trans	-126	101.8	-174.1	-174.1	3.2	0	0	0	109.4
92	Y	26.9	Very low	29.2	Very low	162 Å²	162	151.5 Å²	151.5	64%	0.635	78%	0.782	S	S	*	*			trans	-142.4	154.3	168.4	-107.8	-79.9	0	0	0	111.7	K288 E292	Y92-K288 VanDerWaalsContact CZ-NZ 3.33Å; Y92-K288 PolarHBondContact OH-NZ 2.93Å; Y92-E292 PolarHBondContact OH-OE1 3.49Å; Y92-E292 VanDerWaalsContact OH-OE1 3.11Å
93	Y	24.8	Very low	29.3	Very low	190 Å²	190	154.6 Å²	154.6	75%	0.745	79%	0.788	S	S	*	*			trans	-136.1	128.5	-148.4	-179.3	-80.7	0	0	0	110.7
94	Y	26.7	Very low	29.7	Very low	218 Å²	218	148.8 Å²	148.8	86%	0.855	78%	0.78	S	S	*	*			trans	-153.2	160.8	170.9	-95	-65.6	0	0	0	108.8
95	P	34.7	Very low	29.9	Very low	103 Å²	103	149.2 Å²	149.2	67%	0.669	78%	0.782	S	S	*	*				-116.7	159.1	-128.3	12.3	12.4	0	0	0	113.5
96	M	27.8	Very low	30	Very low	187 Å²	187	152.4 Å²	152.4	92%	0.921	78%	0.781	S	S	*	*			trans	-107	131.7	168.5	-87.2	-69	-179.3	0	0	111.3
97	G	30.5	Very low	30	Very low	64 Å²	64	149.8 Å²	149.8	66%	0.66	78%	0.777	S	S	*	*			trans	-78.3	149.7	165.4	0	0	0	0	0	111.1
98	P	36.7	Very low	30.2	Very low	108 Å²	108	154.8 Å²	154.8	70%	0.701	78%	0.783	S	S	*	*			trans	-82.6	156.2	-177	34.5	-36.1	0	0	0	112.6
99	Y	30.1	Very low	30.3	Very low	228 Å²	228	147.6 Å²	147.6	89%	0.894	78%	0.777	S	S	*	*				177.2	138.1	117.7	-96.6	-68.1	0	0	0	111.2
100	G	29.1	Very low	30.3	Very low	69 Å²	69	148.5 Å²	148.5	71%	0.711	78%	0.78	S	S	*	*			trans	-100.6	-170.1	158.8	0	0	0	0	0	110.6
101	A	30.7	Very low	30.9	Very low	94 Å²	94	143.3 Å²	143.3	78%	0.777	78%	0.775	S	S	*	*			cis	-147.6	-114.1	-1.8	0	0	0	0	0	111.6
102	P	35.8	Very low	31	Very low	118 Å²	118	146.3 Å²	146.3	77%	0.766	78%	0.784	S	S	*	*				-106.8	170.4	-99.4	37.6	-30.6	0	0	0	114.9
103	Y	29.5	Very low	31.1	Very low	229 Å²	229	142.4 Å²	142.4	90%	0.898	79%	0.793	S	S	*	*			trans	-117.6	135.1	166.2	-84.7	-80.9	0	0	0	111.7
104	P	37.2	Very low	31.3	Very low	115 Å²	115	138.3 Å²	138.3	75%	0.747	80%	0.799	S	S	*	*			trans	-87.3	170.3	174.1	36.5	-35.3	0	0	0	112.7
105	P	35.4	Very low	31.4	Very low	119 Å²	119	138.8 Å²	138.8	77%	0.773	80%	0.801	S	S	*	*			trans	-104	171.1	-167.6	39.5	-35.9	0	0	0	116.1
106	N	27.6	Very low	32	Very low	143 Å²	143	140.2 Å²	140.2	77%	0.765	81%	0.81	S	S	*	*			trans	103.4	151.4	135.4	-126.5	0.2	0	0	0	121.6
107	Q	30	Very low	32.1	Very low	173 Å²	173	134.8 Å²	134.8	81%	0.808	80%	0.802	S	S	*	*			trans	76.2	135.4	159.4	-69.2	177.5	-3.5	0	0	122.2
108	Y	28.7	Very low	32.2	Very low	233 Å²	233	138 Å²	138	91%	0.914	81%	0.809	S	S	*	*			trans	-104.2	153.1	171.1	-103	-100.2	0	0	0	109.9
109	G	29	Very low	32.6	Very low	72 Å²	72	139 Å²	139	74%	0.742	82%	0.816	S	S	*	*			trans	-155.1	150.8	168.6	0	0	0	0	0	111.7
110	V	32.2	Very low	32.8	Very low	128 Å²	128	134.3 Å²	134.3	78%	0.776	81%	0.811	S	S	*	*			trans	-139.5	128.3	-171.3	179.1	0	0	0	0	111.3
111	P	40.6	Very low	32.9	Very low	122 Å²	122	136.5 Å²	136.5	79%	0.792	82%	0.815	S	S	*	*				-136.4	151.8	127	15.2	6.8	0	0	0	111.3
112	Q	27.4	Very low	33	Very low	197 Å²	197	140 Å²	140	92%	0.921	82%	0.82	S	S	*	*			cis	103.5	137.9	36.6	-101	-151.6	-1.1	0	0	115
113	G	28.4	Very low	32.8	Very low	80 Å²	80	137.7 Å²	137.7	83%	0.825	82%	0.818	S	S	*	*			trans	91.3	151	172.3	0	0	0	0	0	116.6
114	A	28.5	Very low	33	Very low	104 Å²	104	136.3 Å²	136.3	86%	0.86	82%	0.82	S	S	*	*			cis	-162.3	170	-14.2	0	0	0	0	0	111.2
115	Y	30.1	Very low	33.3	Very low	229 Å²	229	136.4 Å²	136.4	90%	0.898	82%	0.821	S	S	*	*			trans	-98.1	156.3	174.8	-77.2	-85	0	0	0	111.8
116	P	46.9	Very low	33.7	Very low	132 Å²	132	136.4 Å²	136.4	86%	0.857	82%	0.821	S	S	*	*				-142.4	-172.4	81.2	34.3	-13.4	0	0	0	113
117	G	30.2	Very low	34.6	Very low	73 Å²	73	135.6 Å²	135.6	75%	0.753	82%	0.823	S	S	*	*			cis	-176.8	174.9	-1.3	0	0	0	0	0	111
118	T	31.7	Very low	35.1	Very low	133 Å²	133	133.8 Å²	133.8	82%	0.816	82%	0.824	S	S	*	*			trans	-110.7	169.4	-177.1	53.2	0	0	0	0	113.8
119	P	45.8	Very low	36	Very low	129 Å²	129	128.7 Å²	128.7	84%	0.838	82%	0.819	S	S	*	*				-141.4	-169.2	113.1	38.8	-24.7	0	0	0	114.8
120	T	33.4	Very low	36.1	Very low	129 Å²	129	128.4 Å²	128.4	79%	0.791	82%	0.817	S	S	*	*			trans	-141.4	158	-157.1	-45.3	0	0	0	0	113.3
121	S	31.7	Very low	36.2	Very low	114 Å²	114	130.6 Å²	130.6	80%	0.797	82%	0.82	S	S	*	*			trans	-151.3	161.7	160.3	61.2	0	0	0	0	114
122	N	33	Very low	35.6	Very low	167 Å²	167	132.9 Å²	132.9	89%	0.893	82%	0.82	S	S	*	*			trans	-101.5	173.2	-177.9	-59.7	-30.1	0	0	0	111.2
123	G	32.3	Very low	35.7	Very low	70 Å²	70	129.9 Å²	129.9	72%	0.722	81%	0.811	S	S	*	*			cis	165.6	170.2	-4.8	0	0	0	0	0	113
124	Q	31.9	Very low	35.9	Very low	201 Å²	201	133.2 Å²	133.2	94%	0.939	81%	0.805	S	S	*	*			trans	59.4	141.3	170.3	-69.8	-168.2	-89.9	0	0	122.4
125	P	44.3	Very low	36.1	Very low	116 Å²	116	132.9 Å²	132.9	75%	0.753	80%	0.796	S	S	*	*			trans	-125.4	164.2	169.3	42.3	-31.2	0	0	0	115.8
126	P	44.2	Very low	36	Very low	120 Å²	120	130.2 Å²	130.2	78%	0.779	79%	0.792	S	S	*	*			trans	-132	-162.5	157	47.1	-32.9	0	0	0	111.7
127	P	46.8	Very low	35.1	Very low	126 Å²	126	134.7 Å²	134.7	82%	0.818	79%	0.793	S	S	*	*				-130.6	-165.2	-116.8	32.5	-6.2	0	0	0	117.4
128	V	40.7	Very low	35	Very low	134 Å²	134	135 Å²	135	81%	0.812	79%	0.789	S	S	*	*			trans	-95.4	160.5	-167.2	-146	0	0	0	0	114.7
129	P	46.8	Very low	36.3	Very low	126 Å²	126	134.5 Å²	134.5	82%	0.818	79%	0.787	S	S	*	*				-140.1	162.1	126.7	37.5	-25.1	0	0	0	113.7
130	G	31.8	Very low	36.5	Very low	67 Å²	67	133.6 Å²	133.6	69%	0.691	78%	0.782	S	S	*	*			cis	171.1	174	-4.7	0	0	0	0	0	112.5
131	M	33.2	Very low	36.6	Very low	173 Å²	173	132 Å²	132	85%	0.852	78%	0.781	S	S	*	*			trans	71.1	134.5	172.7	-49	-177.9	103.6	0	0	116
132	E	29.2	Very low	36.8	Very low	170 Å²	170	131.6 Å²	131.6	79%	0.794	78%	0.779	S	S	*	*			cis	81	137.6	39.6	-58.6	164.2	147.5	0	0	111.6
133	D	28.8	Very low	36.8	Very low	135 Å²	135	131.6 Å²	131.6	72%	0.722	77%	0.773	S	S	*	*			cis	-157.9	175.8	29.1	-159.9	40.1	0	0	0	117.3
134	H	32.9	Very low	36.6	Very low	150 Å²	150	135 Å²	135	69%	0.694	78%	0.775	S	S	*	*			trans	-17	136.6	177	-77.7	68.2	0	0	0	127
135	S	31.4	Very low	36.4	Very low	96 Å²	96	129.2 Å²	129.2	67%	0.671	76%	0.757	S	S	*	*				45.7	119.1	118	-53.7	0	0	0	0	126.9
136	Q	28.4	Very low	35.8	Very low	174 Å²	174	135 Å²	135	81%	0.813	77%	0.765	S	S	*	*			trans	68	148	130.8	-68.6	-164.8	9.1	0	0	125.6
137	Y	27.8	Very low	35	Very low	226 Å²	226	134.7 Å²	134.7	89%	0.886	77%	0.766	S	S	*	*			trans	85	151.4	159.8	-102.8	-89.9	0	0	0	121.6
138	A	29.1	Very low	34.2	Very low	80 Å²	80	134.2 Å²	134.2	66%	0.661	76%	0.761	S	S	*	*			trans	-113.6	-175.4	-178.8	0	0	0	0	0	109.5
139	P	58.4	Low	33.8	Very low	121 Å²	121	134.6 Å²	134.6	79%	0.786	76%	0.758	S	S	*	*			cis	-127.1	-135.9	13.1	35.3	-9.4	0	0	0	110.1
140	P	50	Low	33	Very low	111 Å²	111	135 Å²	135	72%	0.721	75%	0.753	S	S	*	*			cis	-137.4	178.3	-17.7	41.6	-23.6	0	0	0	117.1
141	A	35.4	Very low	33	Very low	94 Å²	94	136 Å²	136	78%	0.777	75%	0.75	S	S	*	*			trans	63.6	153.1	144.1	0	0	0	0	0	121.1
142	S	37	Very low	32.9	Very low	107 Å²	107	136.4 Å²	136.4	75%	0.748	75%	0.752	S	S	*	*			cis	-168.6	156.8	-17	52	0	0	0	0	111.3
143	Q	31.6	Very low	32.7	Very low	167 Å²	167	134.1 Å²	134.1	78%	0.78	76%	0.755	S	S	*	*				172.8	135	121.6	-94.9	-170.1	17.2	0	0	113.6
144	N	29.3	Very low	32.6	Very low	140 Å²	140	138.4 Å²	138.4	75%	0.749	76%	0.762	S	S	*	*			trans	42.8	148.5	138.1	-63.1	-0.3	0	0	0	123.1
145	S	28.4	Very low	33.9	Very low	81 Å²	81	136.4 Å²	136.4	57%	0.566	76%	0.763	S	S	*	*			cis	176.4	137.1	-19.9	52.2	0	0	0	0	109.3
146	Y	29.9	Very low	34.9	Very low	238 Å²	238	137.1 Å²	137.1	93%	0.933	77%	0.765	S	S	*	*			trans	-163.5	160.5	147.9	-66.6	-54.5	0	0	0	109.6
147	S	28.9	Very low	34.9	Very low	112 Å²	112	134.8 Å²	134.8	78%	0.783	77%	0.768	S	S	*	*			trans	-118.8	174	-164.2	-45.8	0	0	0	0	112.6
148	T	29.9	Very low	35.1	Very low	116 Å²	116	131 Å²	131	71%	0.712	76%	0.763	S	S	*	*			cis	-166.3	145.5	6.4	-11	0	0	0	0	111.6
149	N	32.1	Very low	36.1	Very low	143 Å²	143	132 Å²	132	77%	0.765	76%	0.762	S	S	*	*			trans	47.8	159.4	144.6	-65.7	4.1	0	0	0	122.8
150	N	29.7	Very low	34.7	Very low	133 Å²	133	132.4 Å²	132.4	71%	0.711	76%	0.758	S	S	*	*			cis	-154	143.9	13.2	-143.4	16.6	0	0	0	117.4
151	S	31.8	Very low	34	Very low	89 Å²	89	134 Å²	134	62%	0.622	76%	0.756	S	S	*	*			trans	35.6	113.4	140.3	68	0	0	0	0	126.9
152	M	30.3	Very low	33.7	Very low	182 Å²	182	136.1 Å²	136.1	90%	0.897	75%	0.751	S	S	*	*				33.5	133.5	112.9	-137.1	74.8	163.4	0	0	124.1
153	S	26.4	Very low	33.4	Very low	121 Å²	121	137.7 Å²	137.7	85%	0.846	75%	0.747	S	S	*	*			trans	172.4	171.3	132.2	-79.1	0	0	0	0	116
154	Y	26.6	Very low	33.2	Very low	226 Å²	226	134.9 Å²	134.9	89%	0.886	74%	0.741	S	S	*	*			trans	-118.9	-168.5	-177.6	-100.5	-92.7	0	0	0	111.4
155	P	59.4	Low	33.1	Very low	108 Å²	108	138.4 Å²	138.4	70%	0.701	75%	0.745	S	S	*	*				-105.5	-142.8	-97.8	43	-21.2	0	0	0	111.8
156	P	52.5	Low	33.1	Very low	111 Å²	111	140.5 Å²	140.5	72%	0.721	75%	0.75	S	S	*	*			cis	-127.5	-160.3	-28.1	42.3	-25.3	0	0	0	113.4
157	S	28.9	Very low	33.2	Very low	125 Å²	125	137 Å²	137	87%	0.874	74%	0.742	S	S	*	*			trans	117.6	153.1	149.4	75.2	0	0	0	0	120.7
158	D	32.3	Very low	33.1	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	73%	0.733	S	S	*	*			trans	-103.8	179.4	-167.5	-135.2	-28.3	0	0	0	110.6
159	P	49.8	Very low	33.1	Very low	99 Å²	99	139.2 Å²	139.2	64%	0.643	74%	0.741	S	S	*	*				-155.4	175.6	54.6	42.8	-20.7	0	0	0	120.3
160	N	29.7	Very low	32.9	Very low	130 Å²	130	136.2 Å²	136.2	70%	0.695	74%	0.744	S	S	*	*			trans	75.4	146.5	155.7	-68.7	-21.2	0	0	0	118.9
161	Q	35.2	Very low	32.7	Very low	145 Å²	145	141.3 Å²	141.3	68%	0.678	75%	0.753	S	S	*	*			cis	-176.2	171.7	-11.9	-110.3	-178.8	55.1	0	0	106.2
162	M	28.5	Very low	33.1	Very low	138 Å²	138	142 Å²	142	68%	0.68	76%	0.756	S	S	*	*			cis	-169.4	162.6	-21.3	-124.3	178.8	19.4	0	0	105.1
163	Q	30.2	Very low	32.8	Very low	141 Å²	141	140.9 Å²	140.9	66%	0.659	75%	0.753	S	S	*	*			cis	-134.9	151.8	-2.3	-98.9	-168.3	12.7	0	0	107.7
164	V	27.1	Very low	32.9	Very low	108 Å²	108	145.6 Å²	145.6	66%	0.655	75%	0.754	S	S	*	*				58.2	101.2	75.4	-167.8	0	0	0	0	115.6
165	Y	28.6	Very low	32.9	Very low	213 Å²	213	137.7 Å²	137.7	84%	0.835	74%	0.742	S	S	*	*				-162.3	161.6	107.4	-120	-83.1	0	0	0	112.7
166	N	28.1	Very low	31.7	Very low	125 Å²	125	141 Å²	141	67%	0.668	75%	0.748	S	S	*	*			trans	-138.6	140.6	-175.6	164.7	20.8	0	0	0	107.8
167	H	31.8	Very low	30.3	Very low	164 Å²	164	139.2 Å²	139.2	76%	0.759	74%	0.738	S	S	*	*			trans	-163.9	155	137.7	-111.3	72.3	0	0	0	114.9
168	S	26.8	Very low	30.3	Very low	85 Å²	85	141.6 Å²	141.6	59%	0.594	73%	0.732	S	S	*	*			trans	-74.5	165.7	-179.7	51.1	0	0	0	0	115.1
169	Q	29.8	Very low	30	Very low	191 Å²	191	143 Å²	143	89%	0.893	73%	0.734	S	S	*	*				168.8	170.3	108.8	-87.2	-166.7	42.1	0	0	112.4
170	G	27.6	Very low	29	Very low	79 Å²	79	142.6 Å²	142.6	81%	0.814	74%	0.74	S	S	*	*			trans	109.2	83.3	151.7	0	0	0	0	0	119.5
171	R	24.7	Very low	29.4	Very low	241 Å²	241	142.3 Å²	142.3	91%	0.909	75%	0.745	S	S	*	*			trans	-106.2	170.7	145.9	-114.5	-167	174.9	-132.4	1.4	107.3
172	P	40.7	Very low	29.2	Very low	104 Å²	104	142.9 Å²	142.9	68%	0.675	75%	0.753	S	S	*	*			cis	-129.3	-165.7	0.8	41.8	-24.8	0	0	0	113.4
173	N	24.1	Very low	29	Very low	158 Å²	158	140.3 Å²	140.3	85%	0.845	75%	0.748	S	S	*	*			trans	-134.6	153.4	157	-164.5	13.8	0	0	0	110.9
174	Y	28.6	Very low	28.7	Very low	219 Å²	219	144.9 Å²	144.9	86%	0.859	76%	0.761	S	S	*	*			trans	-115.9	-179.7	175	-118.2	-91.4	0	0	0	109
175	G	27.3	Very low	28.6	Very low	61 Å²	61	148.1 Å²	148.1	63%	0.629	77%	0.769	S	S	*	*			trans	-178.2	151.8	163.4	0	0	0	0	0	113.8
176	Q	32.8	Very low	29.4	Very low	178 Å²	178	143.1 Å²	143.1	83%	0.832	76%	0.763	S	S	*	*			trans	-172.8	135	156.7	-121.3	-167.3	86.4	0	0	116
177	S	24	Very low	29.2	Very low	73 Å²	73	143.1 Å²	143.1	51%	0.51	77%	0.773	S	S	.	*			trans	71.1	160	130.5	69.1	0	0	0	0	124.7
178	F	28.7	Very low	28.9	Very low	174 Å²	174	143.6 Å²	143.6	76%	0.763	78%	0.775	S	S	*	*			trans	75.4	152.3	167	-57.4	-61.9	0	0	0	117.3
179	Q	26.1	Very low	28.8	Very low	176 Å²	176	149.3 Å²	149.3	82%	0.822	79%	0.789	S	S	*	*			cis	-153.3	-175.2	-3.7	-133.5	155.4	27.8	0	0	111.8
180	A	28.3	Very low	28.6	Very low	92 Å²	92	149.6 Å²	149.6	76%	0.76	79%	0.787	S	S	*	*			trans	-153.5	155	175.3	0	0	0	0	0	113.1
181	P	39.6	Very low	29	Very low	124 Å²	124	152.2 Å²	152.2	81%	0.805	79%	0.79	S	S	*	*			trans	-145.4	150.4	151.1	36.9	-19.8	0	0	0	117.8
182	N	29.9	Very low	29	Very low	156 Å²	156	143.8 Å²	143.8	83%	0.834	78%	0.779	S	S	*	*			trans	11.5	161.4	135	-78	-0.1	0	0	0	122.6
183	S	24.3	Very low	28.3	Very low	84 Å²	84	147.2 Å²	147.2	59%	0.587	79%	0.786	S	S	*	*			cis	178	157.9	-6.6	50.1	0	0	0	0	111.3
184	Y	23.5	Very low	28.5	Very low	237 Å²	237	146.7 Å²	146.7	93%	0.929	78%	0.778	S	S	*	*			trans	176.1	-177.7	134.8	-104.8	-68.9	0	0	0	114.3
185	Q	25.4	Very low	28.5	Very low	177 Å²	177	143.2 Å²	143.2	83%	0.827	77%	0.773	S	S	*	*			trans	-141.7	-161	-161.3	-144.6	-162.1	-2.4	0	0	113.7
186	P	45.9	Very low	28.4	Very low	108 Å²	108	151.2 Å²	151.2	70%	0.701	78%	0.784	S	S	*	*				-116.5	177.9	-119.8	43	-27.2	0	0	0	117.4
187	S	22.5	Very low	28.1	Very low	125 Å²	125	151.1 Å²	151.1	87%	0.874	78%	0.783	S	S	*	*			trans	-150.9	172.6	163.6	-165.9	0	0	0	0	112.8
188	Q	25.8	Very low	28.2	Very low	173 Å²	173	159.9 Å²	159.9	81%	0.808	81%	0.805	S	S	*	*			trans	-121.1	153.5	-165.8	-55.7	175	-6.4	0	0	114.1
189	K	24.9	Very low	28.1	Very low	205 Å²	205	158.6 Å²	158.6	89%	0.891	80%	0.803	S	S	*	*				-179.5	156.8	125.3	-98.8	159.9	-173.6	179.5	0	115.2
190	K	25.2	Very low	28.2	Very low	197 Å²	197	157.6 Å²	157.6	86%	0.857	80%	0.796	S	S	*	*			trans	-120	-178.1	158.5	-68.8	-174.5	176.6	-177.6	0	106.6
191	P	36.3	Very low	28.2	Very low	134 Å²	134	161.2 Å²	161.2	87%	0.87	80%	0.797	S	S	*	*			cis	-134.5	-168.8	0.5	43.7	-25.7	0	0	0	114.9
192	G	24.6	Very low	27.4	Very low	65 Å²	65	159.7 Å²	159.7	67%	0.67	80%	0.795	S	S	*	*			trans	135.5	106.5	171.8	0	0	0	0	0	110.3
193	Q	26.6	Very low	27.3	Very low	176 Å²	176	158.5 Å²	158.5	82%	0.822	80%	0.796	S	S	*	*				43.1	111.1	77.7	-69.4	-163	8.8	0	0	114.2
194	Q	27.5	Very low	27.4	Very low	147 Å²	147	158.4 Å²	158.4	69%	0.687	81%	0.808	S	S	*	*				-177.7	155.3	100.7	-90.2	-54.6	-11	0	0	112.9
195	I	29.1	Very low	27.5	Very low	145 Å²	145	153.1 Å²	153.1	74%	0.744	81%	0.806	S	S	*	*			trans	47.7	107.4	148	-69.7	156.7	0	0	0	119.1
196	W	24.5	Very low	27.6	Very low	230 Å²	230	148.7 Å²	148.7	87%	0.871	80%	0.8	S	S	*	*			trans	-66.1	145.1	143.8	-79.5	71.9	0	0	0	110.1
197	H	27.9	Very low	26.8	Very low	175 Å²	175	149.1 Å²	149.1	81%	0.81	80%	0.802	S	S	*	*			trans	147.5	100.2	131.5	-79.7	96.5	0	0	0	112.9
198	R	24.6	Very low	27.1	Very low	258 Å²	258	149.6 Å²	149.6	97%	0.974	80%	0.799	S	S	*	*			trans	-144.5	145.3	138	-140.5	170.9	-169.2	172	3.8	109.9
199	M	26.7	Very low	27.2	Very low	147 Å²	147	150.6 Å²	150.6	72%	0.724	80%	0.801	S	S	*	*			trans	-133.5	142.8	-162.8	-147.2	-153	-161.8	0	0	109.1
200	K	29.9	Very low	27.2	Very low	154 Å²	154	150.3 Å²	150.3	67%	0.67	80%	0.8	S	S	*	*			trans	65.3	160.2	160	-66.1	172.4	173.9	172.5	0	116.5
201	Q	28.4	Very low	27.3	Very low	169 Å²	169	147.6 Å²	147.6	79%	0.79	80%	0.795	S	S	*	*			cis	-157.9	161.9	-21.3	-115.4	163.8	-23.9	0	0	108.3
202	A	22.5	Very low	27.1	Very low	91 Å²	91	148.7 Å²	148.7	75%	0.752	79%	0.792	S	S	*	*			trans	-109.6	152.9	167.5	0	0	0	0	0	111.2
203	P	27.3	Very low	27.3	Very low	132 Å²	132	150.4 Å²	150.4	86%	0.857	79%	0.794	S	S	*	*			trans	-99.6	170.9	-173.5	39	-36.2	0	0	0	114.8
204	G	26	Very low	27.4	Very low	81 Å²	81	151.8 Å²	151.8	84%	0.835	80%	0.797	S	S	*	*			trans	96.3	150	177.6	0	0	0	0	0	113.4
205	S	26.5	Very low	27.5	Very low	126 Å²	126	156.6 Å²	156.6	88%	0.881	81%	0.809	S	S	*	*			cis	-137.6	172.7	2.4	-171.8	0	0	0	0	111.2
206	A	27.3	Very low	27.7	Very low	85 Å²	85	155.3 Å²	155.3	70%	0.702	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-96.4	145.2	-169.9	0	0	0	0	0	114.6
207	P	28.7	Very low	27.8	Very low	116 Å²	116	155.5 Å²	155.5	75%	0.753	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-89.6	136.8	175	34.1	-33.3	0	0	0	113.3
208	V	28.5	Very low	27.7	Very low	135 Å²	135	155.4 Å²	155.4	82%	0.818	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-74.2	143.9	174.9	-178.8	0	0	0	0	111
209	K	28.6	Very low	27.8	Very low	194 Å²	194	149.1 Å²	149.1	84%	0.843	80%	0.802	S	S	*	*			trans	-111.6	132.6	179	-65.9	177.3	-178.4	172.6	0	111.7
210	F	25.1	Very low	27.7	Very low	200 Å²	200	150.2 Å²	150.2	88%	0.877	81%	0.805	S	S	*	*			trans	-100	143.7	158.6	-81.2	-88.3	0	0	0	110.1
211	N	26.3	Very low	27.4	Very low	140 Å²	140	149 Å²	149	75%	0.749	82%	0.815	S	S	*	*			trans	-129.4	126	-179.5	179.8	13.7	0	0	0	109.4
212	I	33	Very low	27.4	Very low	157 Å²	157	146.6 Å²	146.6	81%	0.805	82%	0.817	S	S	*	*			trans	-131.7	111.3	174.5	-59	179.1	0	0	0	107.7
213	S	29.2	Very low	28.2	Very low	101 Å²	101	148.2 Å²	148.2	71%	0.706	82%	0.82	S	S	*	*			trans	-80	143.1	179.9	-63.7	0	0	0	0	112
214	K	28.2	Very low	28.2	Very low	205 Å²	205	149.4 Å²	149.4	89%	0.891	82%	0.824	S	S	*	*			trans	-103.8	143.1	168.5	-67.2	-175.8	178.4	-178.7	0	110.4
215	R	28.8	Very low	28.4	Very low	247 Å²	247	150.3 Å²	150.3	93%	0.932	82%	0.818	S	S	*	*			trans	-129.8	141.3	155.3	-83	-169.8	172.8	-167.3	-1.1	109.3
216	P	33.9	Very low	28.4	Very low	119 Å²	119	149 Å²	149	77%	0.773	81%	0.809	S	S	*	*			trans	-96.4	165.4	175.2	38.3	-34.3	0	0	0	112
217	Y	25.7	Very low	28.6	Very low	233 Å²	233	154 Å²	154	91%	0.914	82%	0.818	S	S	*	*			trans	-154.8	160.2	143.5	-126.8	-87.4	0	0	0	110.7
218	Q	25.8	Very low	28.5	Very low	174 Å²	174	152.8 Å²	152.8	81%	0.813	82%	0.817	S	S	*	*			trans	-101	169.2	176.7	-58.5	175.4	-84.3	0	0	111.1
219	V	27.6	Very low	28.5	Very low	125 Å²	125	155.2 Å²	155.2	76%	0.758	82%	0.817	S	S	*	*				176	168.1	116.3	151.9	0	0	0	0	111.1
220	Q	25.1	Very low	28.6	Very low	170 Å²	170	154 Å²	154	79%	0.794	81%	0.814	S	S	*	*			trans	-64.1	167.8	-168.6	-58.5	138.4	-73.5	0	0	116.5
221	C	22.8	Very low	29.4	Very low	130 Å²	130	150.2 Å²	150.2	88%	0.878	81%	0.81	S	S	*	*			trans	-116.7	141.2	155.6	-67.8	0	0	0	0	110.6
222	S	28.6	Very low	29.4	Very low	117 Å²	117	146.7 Å²	146.7	82%	0.818	81%	0.806	S	S	*	*			trans	-149.3	142.7	160.9	-77.5	0	0	0	0	108.8
223	P	38.6	Very low	29.3	Very low	126 Å²	126	149.1 Å²	149.1	82%	0.818	81%	0.814	S	S	*	*			trans	-98.8	146.3	-170.6	36.6	-34.2	0	0	0	114.5
224	V	27.8	Very low	29.1	Very low	156 Å²	156	153 Å²	153	95%	0.945	82%	0.822	S	S	*	*			trans	-158.4	170.4	154	125.1	0	0	0	0	109.2
225	S	30.1	Very low	30	Very low	101 Å²	101	147.6 Å²	147.6	71%	0.706	81%	0.807	S	S	*	*			trans	-106	168.1	-158.1	-161.6	0	0	0	0	116.2
226	S	27.3	Very low	30	Very low	98 Å²	98	142.5 Å²	142.5	69%	0.685	80%	0.804	S	S	*	*			trans	73.8	123.4	149.2	41.2	0	0	0	0	123
227	Q	31	Very low	29.6	Very low	191 Å²	191	139.9 Å²	139.9	89%	0.893	80%	0.798	S	S	*	*			trans	80	119.7	139.7	-72.2	-178.6	-28.6	0	0	123.5
228	A	26.6	Very low	29.7	Very low	90 Å²	90	137 Å²	137	74%	0.744	80%	0.798	S	S	*	*				84.2	111.6	129.1	0	0	0	0	0	123.7
229	F	27.7	Very low	29.8	Very low	185 Å²	185	135.1 Å²	135.1	81%	0.811	79%	0.793	S	S	*	*			trans	64.9	107.8	131.8	-86.7	-99	0	0	0	124.1
230	Q	31.5	Very low	29.8	Very low	169 Å²	169	137.6 Å²	137.6	79%	0.79	80%	0.797	S	S	*	*				84.7	161.1	125	-85.3	-156.3	15.6	0	0	121.6
231	P	42.9	Very low	29.9	Very low	120 Å²	120	133.7 Å²	133.7	78%	0.779	79%	0.793	S	S	*	*			trans	-125.5	179.6	-131.7	46	-35.5	0	0	0	116.5
232	G	26.2	Very low	30.5	Very low	66 Å²	66	133.2 Å²	133.2	68%	0.68	79%	0.789	S	S	*	*			trans	-170.3	100.6	168.7	0	0	0	0	0	116.3
233	E	30.3	Very low	30.5	Very low	208 Å²	208	133.4 Å²	133.4	97%	0.972	79%	0.79	S	S	*	*			trans	62.3	174.5	138.5	-60.5	-170.7	114.4	0	0	123.6
234	Q	25.2	Very low	30.1	Very low	184 Å²	184	132.8 Å²	132.8	86%	0.86	79%	0.789	S	S	*	*			trans	-134.9	-167.2	-156.8	-126.1	-176.3	4.2	0	0	107.7
235	P	46.9	Very low	30.6	Very low	91 Å²	91	131.7 Å²	131.7	59%	0.591	79%	0.785	S	S	*	*			cis	-135.8	-159	-23.5	36.6	-15.2	0	0	0	113.1
236	T	27.5	Very low	30.3	Very low	140 Å²	140	131.3 Å²	131.3	86%	0.859	79%	0.788	S	S	*	*			trans	68.8	145.3	153.8	45.8	0	0	0	0	121
237	G	26.9	Very low	30.2	Very low	63 Å²	63	133.5 Å²	133.5	65%	0.649	80%	0.797	S	S	*	*			cis	164.7	157.4	-11.2	0	0	0	0	0	115.5
238	L	28	Very low	30	Very low	173 Å²	173	128.3 Å²	128.3	91%	0.906	79%	0.787	S	S	*	*			trans	67.4	165.6	166.6	-53.3	173.5	0	0	0	118.3
239	N	27.4	Very low	29.9	Very low	135 Å²	135	129.3 Å²	129.3	72%	0.722	79%	0.788	S	S	*	*			cis	-164.6	171	-50	-164.5	8.9	0	0	0	110
240	Q	27.2	Very low	29.8	Very low	177 Å²	177	127.2 Å²	127.2	83%	0.827	79%	0.791	S	S	*	*			trans	83	156.6	163.6	-50.6	-172.5	32.4	0	0	119.9
241	A	26.4	Very low	29.5	Very low	88 Å²	88	123.3 Å²	123.3	73%	0.727	79%	0.787	S	S	*	*			trans	-143.4	167.4	173.6	0	0	0	0	0	108.3
242	P	36.9	Very low	29	Very low	120 Å²	120	124 Å²	124	78%	0.779	79%	0.792	S	S	*	*				-156.3	169.4	105.2	40	-21.9	0	0	0	117.6
243	S	27.1	Very low	28.9	Very low	120 Å²	120	124.3 Å²	124.3	84%	0.839	80%	0.795	S	S	*	*			trans	53	134.4	146.2	-59.6	0	0	0	0	124
244	S	30.4	Very low	28.9	Very low	114 Å²	114	119.3 Å²	119.3	80%	0.797	79%	0.789	S	S	*	*			trans	-88.3	169.2	170	-39.1	0	0	0	0	113.7
245	P	38.3	Very low	29	Very low	133 Å²	133	115.4 Å²	115.4	86%	0.864	79%	0.789	S	S	*	*				-134.8	-168.7	112.8	37.6	-26.7	0	0	0	113.4
246	A	25.5	Very low	28.3	Very low	93 Å²	93	120.2 Å²	120.2	77%	0.769	80%	0.803	S	S	*	*			trans	-139	149.4	-163.4	0	0	0	0	0	116.1
247	T	25.1	Very low	28.6	Very low	144 Å²	144	120.3 Å²	120.3	88%	0.883	80%	0.804	S	S	*	*			trans	-178.8	156.8	161.4	34.8	0	0	0	0	108.2
248	A	26.1	Very low	28.8	Very low	81 Å²	81	128.5 Å²	128.5	67%	0.669	82%	0.815	S	S	*	*			cis	-167.6	162.5	-24.6	0	0	0	0	0	109
249	S	24.6	Very low	29.5	Very low	112 Å²	112	126.4 Å²	126.4	78%	0.783	81%	0.812	S	S	*	*			trans	61.8	124.8	159.1	-56.7	0	0	0	0	121.4
250	T	26.1	Very low	30.6	Very low	141 Å²	141	128.3 Å²	128.3	87%	0.865	82%	0.816	S	S	*	*				152.8	139.9	124.4	-62	0	0	0	0	111.8
251	A	24.3	Very low	31.7	Very low	86 Å²	86	124.1 Å²	124.1	71%	0.711	80%	0.799	S	S	*	*			trans	-117.7	164.2	175.1	0	0	0	0	0	108.5
252	P	32.4	Very low	33	Very low	135 Å²	135	125.2 Å²	125.2	88%	0.877	79%	0.785	S	S	*	*			cis	-142.8	178.8	36.4	42.3	-23.4	0	0	0	116.8
253	G	24.1	Very low	34.3	Very low	72 Å²	72	121.2 Å²	121.2	74%	0.742	76%	0.759	S	S	*	*			trans	156.6	133.7	161.3	0	0	0	0	0	115.8
254	A	29.5	Very low	35.6	Very low	103 Å²	103	120.6 Å²	120.6	85%	0.851	74%	0.743	S	S	*	*			trans	40	103.4	161.6	0	0	0	0	0	119.1
255	A	27.7	Very low	36.8	Very low	103 Å²	103	116.5 Å²	116.5	85%	0.851	72%	0.716	S	S	*	*			trans	-76.7	131.7	164.6	0	0	0	0	0	111.4
256	Q	32.7	Very low	37.6	Very low	192 Å²	192	110.8 Å²	110.8	90%	0.897	68%	0.678	S	S	*	*			trans	-111.8	114.9	162	-73.8	-172.5	-18.5	0	0	109.3
257	T	33.8	Very low	39.6	Very low	141 Å²	141	107.7 Å²	107.7	87%	0.865	65%	0.647	S	S	*	*			trans	-76.9	151.8	173.7	40.1	0	0	0	0	111.1
258	R	30.5	Very low	41.3	Very low	236 Å²	236	104.7 Å²	104.7	89%	0.891	62%	0.623	S	S	*	*			trans	-78.1	146.6	-179.9	-65.2	177.1	-179.3	164.6	0	110.8	Q260	R258-Q260 VanDerWaalsContact C-N 3.34Å; R258-Q260 PolarHBondContact O-N 2.95Å
259	P	43.9	Very low	43.1	Very low	129 Å²	129	101.5 Å²	101.5	84%	0.838	59%	0.594	S	S	*	*	S	Bend	trans	-78.5	79	178.8	32.7	-35.9	0	0	0	112.1
260	Q	50.1	Low	45.2	Very low	175 Å²	175	98 Å²	98	82%	0.818	57%	0.568	S	S	*	*			trans	-146.1	86.1	156.9	-81.5	-163.7	-19.7	0	0	108.9	R258	R258-Q260 VanDerWaalsContact C-N 3.34Å; R258-Q260 PolarHBondContact O-N 2.95Å
261	D	49.7	Very low	47	Very low	88 Å²	88	95.7 Å²	95.7	47%	0.471	55%	0.547	S	S	.	.			trans	-172.8	148.2	148.7	-99.8	-44.7	0	0	0	111.5	I40	I40-D261 WeakPolarHBondContact CG1-OD1 3.49Å; I40-D261 VanDerWaalsContact CG2-CG 3.49Å; I40-D261 WeakPolarHBondContact CG2-OD1 3.32Å; I40-D261 WeakPolarHBondContact CG2-OD2 3.28Å
262	W	54.1	Low	48.9	Very low	111 Å²	111	96 Å²	96	42%	0.42	53%	0.53	S	S	.	.			trans	-90.9	142.7	-176.3	-66.4	83.6	0	0	0	112.3	M266 L298	W262-M266 HydrophobicContact CB-CE 4.46Å; W262-M266 HydrophobicContact CD2-CE 4.03Å; W262-M266 HydrophobicContact CD2-SD 4.49Å; W262-M266 HydrophobicContact CE3-CE 3.39Å; W262-M266 HydrophobicContact CE3-SD 3.39Å; W262-M266 HydrophobicContact CZ3-CE 3.71Å; W262-M266 HydrophobicContact CZ3-SD 3.6Å; W262-L298 HydrophobicContact CE3-CD1 4.49Å; W262-L298 HydrophobicContact CH2-CB 4.42Å; W262-L298 HydrophobicContact CH2-CD1 4.01Å; W262-L298 HydrophobicContact CH2-CD2 3.68Å; W262-L298 HydrophobicContact CH2-CG 4.24Å; W262-L298 HydrophobicContact CZ2-CD2 4.09Å; W262-L298 HydrophobicContact CZ3-CD1 3.9Å; W262-L298 HydrophobicContact CZ3-CD2 4.39Å; W262-L298 HydrophobicContact CZ3-CG 4.49Å
263	P	64.2	Low	50.3	Low	37 Å²	37	89.7 Å²	89.7	24%	0.24	49%	0.489	C	S	.	.			trans	-69.1	141.4	-174.7	27.6	-33.7	0	0	0	113.1	A265 M266 Y304	P263-A265 PolarHBondContact O-N 3.25Å; P263-M266 HydrophobicContact CG-CB 4.2Å; P263-M266 VanDerWaalsContact O-CB 3.32Å; P263-M266 WeakPolarHBondContact O-CB 3.3Å; P263-M266 PolarHBondContact O-N 3.44Å; P263-M266 VanDerWaalsContact O-N 3.17Å; P263-Y304 HydrophobicContact CG-CD1 4.2Å; P263-Y304 HydrophobicContact CG-CE1 4.31Å
264	Q	54.2	Low	52.1	Low	106 Å²	106	89.4 Å²	89.4	50%	0.495	47%	0.467	S	S	.	.	H	α-helix	trans	-60.6	-42.9	-171.3	179.8	60.2	23.3	0	0	113.8	M266 K267 E268	Q264-M266 PolarHBondContact O-N 3.32Å; Q264-M266 VanDerWaalsContact O-N 3.09Å; Q264-K267 WeakPolarHBondContact O-CB 3.41Å; Q264-K267 PolarHBondContact O-N 3.17Å; Q264-E268 VanDerWaalsContact CG-OE1 3.3Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.47Å; Q264-E268 PolarHBondContact NE2-OE1 2.96Å; Q264-E268 PolarHBondContact O-N 2.76Å
265	A	56.7	Low	53.7	Low	28 Å²	28	89.8 Å²	89.8	23%	0.231	46%	0.459	C	S	.	.	H	α-helix	trans	-58.2	-27.2	179.4	0	0	0	0	0	113.3	P263 E268 Y269 W308 T309	P263-A265 PolarHBondContact O-N 3.25Å; A265-E268 PolarHBondContact O-N 3.47Å; A265-Y269 PolarHBondContact O-N 3.06Å; A265-W308 HydrophobicContact CB-CB 4.04Å; A265-T309 HydrophobicContact CB-CG2 4.41Å
266	M	55.4	Low	55.2	Low	14 Å²	14	87.7 Å²	87.7	7%	0.069	44%	0.442	C	S	.	.	H	α-helix	trans	-73.8	-35.4	176.4	-161.9	-157.8	85.8	0	0	112	W262 P263 Q264 E268 Y269 V270 L294 W308	W262-M266 HydrophobicContact CB-CE 4.46Å; W262-M266 HydrophobicContact CD2-CE 4.03Å; W262-M266 HydrophobicContact CD2-SD 4.49Å; W262-M266 HydrophobicContact CE3-CE 3.39Å; W262-M266 HydrophobicContact CE3-SD 3.39Å; W262-M266 HydrophobicContact CZ3-CE 3.71Å; W262-M266 HydrophobicContact CZ3-SD 3.6Å; P263-M266 HydrophobicContact CG-CB 4.2Å; P263-M266 VanDerWaalsContact O-CB 3.32Å; P263-M266 WeakPolarHBondContact O-CB 3.3Å; P263-M266 PolarHBondContact O-N 3.44Å; P263-M266 VanDerWaalsContact O-N 3.17Å; Q264-M266 PolarHBondContact O-N 3.32Å; Q264-M266 VanDerWaalsContact O-N 3.09Å; M266-E268 VanDerWaalsContact C-N 3.32Å; M266-Y269 PolarHBondContact O-N 3.32Å; M266-V270 WeakPolarHBondContact O-CG2 3.37Å; M266-V270 PolarHBondContact O-N 3.39Å; M266-V270 VanDerWaalsContact O-N 3.12Å; M266-L294 HydrophobicContact CE-CD1 4.39Å; M266-L294 HydrophobicContact CE-CD2 3.98Å; M266-L294 HydrophobicContact CG-CD2 3.6Å; M266-L294 HydrophobicContact SD-CD2 3.57Å; M266-L294 VanDerWaalsContact SD-CD2 3.57Å; M266-W308 HydrophobicContact CB-CG 4.38Å; M266-W308 HydrophobicContact CG-CD2 4.31Å; M266-W308 HydrophobicContact CG-CZ2 4.43Å
267	K	65.8	Low	56.5	Low	28 Å²	28	79.1 Å²	79.1	12%	0.122	40%	0.403	C	S	.	.	H	α-helix	trans	-64.7	-38.9	172.1	-62.3	174.6	178.8	176.8	0	110.8	L37 Q264 V270 Q271	L37-K267 HydrophobicContact CD2-CD 4.14Å; L37-K267 HydrophobicContact CD2-CG 4.43Å; L37-K267 PolarHBondContact O-NZ 3.01Å; Q264-K267 WeakPolarHBondContact O-CB 3.41Å; Q264-K267 PolarHBondContact O-N 3.17Å; K267-V270 PolarHBondContact O-N 3Å; K267-Q271 WeakPolarHBondContact O-CB 3.36Å; K267-Q271 PolarHBondContact O-N 3.09Å
268	E	61.9	Low	57.6	Low	81 Å²	81	81.1 Å²	81.1	38%	0.379	40%	0.403	S	S	.	.	H	α-helix	trans	-74.1	-26.3	178.7	-71.5	161.6	-168.6	0	0	113.3	Q264 A265 M266 R272	Q264-E268 VanDerWaalsContact CG-OE1 3.3Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.47Å; Q264-E268 PolarHBondContact NE2-OE1 2.96Å; Q264-E268 PolarHBondContact O-N 2.76Å; A265-E268 PolarHBondContact O-N 3.47Å; M266-E268 VanDerWaalsContact C-N 3.32Å; E268-R272 WeakPolarHBondContact O-CB 3.43Å; E268-R272 WeakPolarHBondContact O-CG 3.33Å; E268-R272 PolarHBondContact O-N 3.18Å; E268-R272 VanDerWaalsContact O-N 3.14Å; E268-R272 PolarHBondContact O-NE 3.24Å
269	Y	64.4	Low	58.9	Low	13 Å²	13	72.6 Å²	72.6	5%	0.051	38%	0.377	C	S	.	.	H	α-helix	trans	-68.7	-49	167.2	-177.8	-115.9	0	0	0	111.7	A265 M266 Q271 R272 C273 L290 W308 E311	A265-Y269 PolarHBondContact O-N 3.06Å; M266-Y269 PolarHBondContact O-N 3.32Å; Y269-Q271 VanDerWaalsContact C-N 3.3Å; Y269-Q271 PolarHBondContact O-N 3Å; Y269-R272 PolarHBondContact O-N 3.43Å; Y269-C273 PolarHBondContact O-N 3.12Å; Y269-C273 VanDerWaalsContact O-N 3.14Å; Y269-C273 PolarHBondContact O-SG 3Å; Y269-L290 HydrophobicContact CD1-CD2 4.01Å; Y269-L290 HydrophobicContact CE1-CD2 3.87Å; Y269-W308 HydrophobicContact CD1-CE3 4.02Å; Y269-W308 HydrophobicContact CD1-CZ3 4.31Å; Y269-W308 HydrophobicContact CE1-CE3 4.39Å; Y269-W308 HydrophobicContact CE1-CZ3 4.37Å; Y269-W308 HydrophobicContact CG-CE3 4.42Å; Y269-E311 HydrophobicContact CE2-CB 4.31Å
270	V	67.6	Low	59.7	Low	39 Å²	39	74 Å²	74	24%	0.236	37%	0.372	C	S	.	.	H	α-helix	trans	-52.8	-48.7	173.3	169.8	0	0	0	0	111.1	M266 K267 R272 C273 F274 L290 L294	M266-V270 WeakPolarHBondContact O-CG2 3.37Å; M266-V270 PolarHBondContact O-N 3.39Å; M266-V270 VanDerWaalsContact O-N 3.12Å; K267-V270 PolarHBondContact O-N 3Å; V270-R272 PolarHBondContact O-N 3.14Å; V270-C273 PolarHBondContact O-N 3.35Å; V270-F274 HydrophobicContact CG1-CD2 3.87Å; V270-F274 HydrophobicContact CG1-CE2 3.86Å; V270-F274 WeakPolarHBondContact O-CD2 3.47Å; V270-F274 PolarHBondContact O-N 3.5Å; V270-L290 HydrophobicContact CB-CD1 4.42Å; V270-L290 HydrophobicContact CG1-CD1 4.23Å; V270-L290 HydrophobicContact CG2-CD1 4.36Å; V270-L290 HydrophobicContact CG2-CD2 4.13Å; V270-L294 HydrophobicContact CG2-CD1 3.76Å
271	Q	63.6	Low	60	Low	92 Å²	92	71.9 Å²	71.9	43%	0.43	36%	0.362	S	S	.	.	H	α-helix	trans	-63.6	-42.8	-178.6	-170.8	170	-20.3	0	0	112.5	K267 Y269 C273 F274 T275	K267-Q271 WeakPolarHBondContact O-CB 3.36Å; K267-Q271 PolarHBondContact O-N 3.09Å; Y269-Q271 VanDerWaalsContact C-N 3.3Å; Y269-Q271 PolarHBondContact O-N 3Å; Q271-C273 PolarHBondContact O-N 2.96Å; Q271-F274 PolarHBondContact O-N 3.34Å; Q271-T275 PolarHBondContact O-N 3.44Å; Q271-T275 PolarHBondContact O-OG1 3.21Å; Q271-T275 VanDerWaalsContact O-OG1 3.12Å
272	R	64.7	Low	60.5	Low	93 Å²	93	68.9 Å²	68.9	35%	0.351	35%	0.346	S	S	.	.	H	α-helix	trans	-59.6	-42.6	176.7	-81.8	177.6	-69.1	162.7	1.6	112.7	E268 Y269 V270 T275 A276 W308 T309 L313	E268-R272 WeakPolarHBondContact O-CB 3.43Å; E268-R272 WeakPolarHBondContact O-CG 3.33Å; E268-R272 PolarHBondContact O-N 3.18Å; E268-R272 VanDerWaalsContact O-N 3.14Å; E268-R272 PolarHBondContact O-NE 3.24Å; Y269-R272 PolarHBondContact O-N 3.43Å; V270-R272 PolarHBondContact O-N 3.14Å; R272-T275 WeakPolarHBondContact CA-OG1 3.32Å; R272-T275 PolarHBondContact O-N 3.42Å; R272-T275 PolarHBondContact O-OG1 3.43Å; R272-A276 PolarHBondContact O-N 3.14Å; R272-W308 PolarHBondContact NH2-O 3.49Å; R272-T309 PolarHBondContact NH1-O 2.57Å; R272-L313 HydrophobicContact CB-CD2 4.47Å
273	C	62.5	Low	60.9	Low	3 Å²	3	67.4 Å²	67.4	2%	0.02	34%	0.343	C	S	.	.	H	α-helix	trans	-62.6	-44.5	177.4	-69	0	0	0	0	112.4	Y269 V270 Q271 A276 C277 T286 L290 L313	Y269-C273 PolarHBondContact O-N 3.12Å; Y269-C273 VanDerWaalsContact O-N 3.14Å; Y269-C273 PolarHBondContact O-SG 3Å; V270-C273 PolarHBondContact O-N 3.35Å; Q271-C273 PolarHBondContact O-N 2.96Å; C273-A276 PolarHBondContact O-N 3.47Å; C273-C277 PolarHBondContact O-SG 3.12Å; C273-C277 VanDerWaalsContact O-SG 3.37Å; C273-T286 HydrophobicContact CB-CG2 3.8Å; C273-L290 HydrophobicContact CB-CD1 3.82Å; C273-L290 HydrophobicContact CB-CG 4.45Å; C273-L313 HydrophobicContact CB-CD2 4.38Å
274	F	60.7	Low	61.3	Low	65 Å²	65	71.2 Å²	71.2	29%	0.285	36%	0.361	S	S	.	.	H	α-helix	trans	-69.9	-33.3	177.9	-79.2	-68.3	0	0	0	113.4	V270 Q271 A276 C277 K283 E287 L290	V270-F274 HydrophobicContact CG1-CD2 3.87Å; V270-F274 HydrophobicContact CG1-CE2 3.86Å; V270-F274 WeakPolarHBondContact O-CD2 3.47Å; V270-F274 PolarHBondContact O-N 3.5Å; Q271-F274 PolarHBondContact O-N 3.34Å; F274-A276 PolarHBondContact O-N 3.37Å; F274-C277 PolarHBondContact O-N 3.32Å; F274-K283 HydrophobicContact CD1-CB 4.48Å; F274-E287 HydrophobicContact CE1-CB 3.94Å; F274-E287 HydrophobicContact CZ-CB 3.65Å; F274-E287 HydrophobicContact CZ-CG 3.98Å; F274-L290 HydrophobicContact CD2-CD1 4.18Å; F274-L290 HydrophobicContact CE2-CD1 3.83Å; F274-L290 HydrophobicContact CZ-CD1 4.45Å
275	T	62.8	Low	61.7	Low	111 Å²	111	72 Å²	72	68%	0.681	36%	0.36	S	S	*	.	H	α-helix	trans	-68.5	-15.5	173.5	49.1	0	0	0	0	114	Q271 R272	Q271-T275 PolarHBondContact O-N 3.44Å; Q271-T275 PolarHBondContact O-OG1 3.21Å; Q271-T275 VanDerWaalsContact O-OG1 3.12Å; R272-T275 WeakPolarHBondContact CA-OG1 3.32Å; R272-T275 PolarHBondContact O-N 3.42Å; R272-T275 PolarHBondContact O-OG1 3.43Å
276	A	59.9	Low	62.2	Low	60 Å²	60	71.1 Å²	71.1	50%	0.496	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	1.9	177	0	0	0	0	0	113.8	R272 C273 F274 L313	R272-A276 PolarHBondContact O-N 3.14Å; C273-A276 PolarHBondContact O-N 3.47Å; F274-A276 PolarHBondContact O-N 3.37Å; A276-L313 HydrophobicContact CB-CD1 4.35Å; A276-L313 HydrophobicContact CB-CD2 4.45Å
277	C	59.4	Low	63.1	Low	11 Å²	11	74.1 Å²	74.1	7%	0.074	37%	0.366	C	S	.	.			trans	-114.6	114.2	-175.3	-61.7	0	0	0	0	111.2	C273 F274 D282 K283 T286	C273-C277 PolarHBondContact O-SG 3.12Å; C273-C277 VanDerWaalsContact O-SG 3.37Å; F274-C277 PolarHBondContact O-N 3.32Å; C277-D282 HydrophobicContact CB-CB 4.07Å; C277-K283 HydrophobicContact CB-CG 3.68Å; C277-K283 WeakPolarHBondContact O-CE 3.41Å; C277-T286 PolarHBondContact SG-OG1 3.27Å
278	E	57.5	Low	63.6	Low	183 Å²	183	77 Å²	77	86%	0.855	38%	0.378	S	S	*	.			trans	-84	-46.3	-179.6	-63.5	-175.4	147.1	0	0	112.3	K283	E278-K283 WeakPolarHBondContact O-CE 3.48Å; E278-K283 PolarHBondContact O-NZ 2.89Å
279	T	58	Low	63.9	Low	57 Å²	57	76.4 Å²	76.4	35%	0.35	38%	0.379	S	S	.	.	S	Bend	trans	-77.9	163.6	-178.8	77.4	0	0	0	0	113.1	D282 K283	T279-D282 VanDerWaalsContact OG1-CB 3.3Å; T279-D282 WeakPolarHBondContact OG1-CB 3.3Å; T279-D282 PolarHBondContact OG1-N 3.37Å; T279-D282 PolarHBondContact OG1-OD2 2.73Å; T279-K283 VanDerWaalsContact O-CD 3.25Å; T279-K283 WeakPolarHBondContact O-CD 3.43Å; T279-K283 WeakPolarHBondContact O-CE 3.15Å; T279-K283 VanDerWaalsContact O-CG 3.28Å; T279-K283 WeakPolarHBondContact O-CG 3.38Å; T279-K283 PolarHBondContact O-N 2.68Å
280	E	59.6	Low	64.2	Low	159 Å²	159	76.2 Å²	76.2	74%	0.743	38%	0.38	S	S	*	.	H	α-helix	trans	-73.9	-38.2	174.5	-162	165.8	-178.5	0	0	110.8	D282 K283 D284	E280-D282 VanDerWaalsContact C-N 3.34Å; E280-D282 PolarHBondContact O-N 3.15Å; E280-K283 WeakPolarHBondContact O-CB 3.27Å; E280-K283 PolarHBondContact O-N 2.96Å; E280-K283 VanDerWaalsContact O-N 3.15Å; E280-D284 PolarHBondContact O-N 3.19Å; E280-D284 VanDerWaalsContact O-N 3.1Å
281	E	57.3	Low	64.5	Low	130 Å²	130	80.2 Å²	80.2	61%	0.607	39%	0.394	S	S	*	.	H	α-helix	trans	-70.9	-24.1	178.7	-55.9	93.6	148.3	0	0	113.7	R285	E281-R285 VanDerWaalsContact C-NH2 3.32Å; E281-R285 WeakPolarHBondContact O-CG 2.86Å; E281-R285 VanDerWaalsContact O-CZ 3.26Å; E281-R285 PolarHBondContact O-N 3.06Å; E281-R285 PolarHBondContact O-NE 3.3Å; E281-R285 PolarHBondContact O-NH2 3.31Å
282	D	60.7	Low	64.7	Low	25 Å²	25	80.1 Å²	80.1	13%	0.134	39%	0.393	C	S	.	.	H	α-helix	trans	-75.8	-33.8	169.9	-72.2	-55.6	0	0	0	111.7	C277 T279 E280 R285 T286 L316	C277-D282 HydrophobicContact CB-CB 4.07Å; T279-D282 VanDerWaalsContact OG1-CB 3.3Å; T279-D282 WeakPolarHBondContact OG1-CB 3.3Å; T279-D282 PolarHBondContact OG1-N 3.37Å; T279-D282 PolarHBondContact OG1-OD2 2.73Å; E280-D282 VanDerWaalsContact C-N 3.34Å; E280-D282 PolarHBondContact O-N 3.15Å; D282-R285 VanDerWaalsContact CG-NH2 3.27Å; D282-R285 PolarHBondContact O-N 3.21Å; D282-R285 IonicContact OD1-CZ 2.63Å; D282-R285 IonicContact OD1-NH1 2.84Å; D282-R285 PolarHBondContact OD1-NH1 2.79Å; D282-R285 IonicContact OD1-NH2 3.56Å; D282-R285 PolarHBondContact OD1-NH2 2.6Å; D282-R285 IonicContact OD2-NH2 2.64Å; D282-T286 WeakPolarHBondContact O-CB 3.23Å; D282-T286 PolarHBondContact O-N 3.41Å; D282-T286 PolarHBondContact O-OG1 3.35Å; D282-L316 HydrophobicContact CB-CD1 4.31Å
283	K	61.2	Low	64.8	Low	80 Å²	80	77.5 Å²	77.5	35%	0.348	39%	0.388	S	S	.	.	H	α-helix	trans	-66.6	-46.4	176.7	-69.1	160.4	-161	156.8	0	111	F274 C277 E278 T279 E280 R285 T286 E287	F274-K283 HydrophobicContact CD1-CB 4.48Å; C277-K283 HydrophobicContact CB-CG 3.68Å; C277-K283 WeakPolarHBondContact O-CE 3.41Å; E278-K283 WeakPolarHBondContact O-CE 3.48Å; E278-K283 PolarHBondContact O-NZ 2.89Å; T279-K283 VanDerWaalsContact O-CD 3.25Å; T279-K283 WeakPolarHBondContact O-CD 3.43Å; T279-K283 WeakPolarHBondContact O-CE 3.15Å; T279-K283 VanDerWaalsContact O-CG 3.28Å; T279-K283 WeakPolarHBondContact O-CG 3.38Å; T279-K283 PolarHBondContact O-N 2.68Å; E280-K283 WeakPolarHBondContact O-CB 3.27Å; E280-K283 PolarHBondContact O-N 2.96Å; E280-K283 VanDerWaalsContact O-N 3.15Å; K283-R285 VanDerWaalsContact C-N 3.32Å; K283-R285 PolarHBondContact O-N 2.97Å; K283-T286 PolarHBondContact O-N 2.98Å; K283-E287 WeakPolarHBondContact O-CB 3.14Å; K283-E287 PolarHBondContact O-N 3.02Å
284	D	72.7	Confident	64.9	Low	118 Å²	118	78.6 Å²	78.6	63%	0.631	39%	0.393	S	S	*	.	H	α-helix	trans	-57.4	-43.1	175.2	-108.6	26.6	0	0	0	112.5	E280 K288	E280-D284 PolarHBondContact O-N 3.19Å; E280-D284 VanDerWaalsContact O-N 3.1Å; D284-K288 PolarHBondContact O-N 3.34Å; D284-K288 VanDerWaalsContact O-N 3.13Å
285	R	63.9	Low	65.3	Low	121 Å²	121	81.5 Å²	81.5	46%	0.457	41%	0.407	S	S	.	.	H	α-helix	trans	-66.4	-41.1	176.9	-79.3	178.5	-82	127.7	-4.1	111.9	E281 D282 K283 K288 V289	E281-R285 VanDerWaalsContact C-NH2 3.32Å; E281-R285 WeakPolarHBondContact O-CG 2.86Å; E281-R285 VanDerWaalsContact O-CZ 3.26Å; E281-R285 PolarHBondContact O-N 3.06Å; E281-R285 PolarHBondContact O-NE 3.3Å; E281-R285 PolarHBondContact O-NH2 3.31Å; D282-R285 VanDerWaalsContact CG-NH2 3.27Å; D282-R285 PolarHBondContact O-N 3.21Å; D282-R285 IonicContact OD1-CZ 2.63Å; D282-R285 IonicContact OD1-NH1 2.84Å; D282-R285 PolarHBondContact OD1-NH1 2.79Å; D282-R285 IonicContact OD1-NH2 3.56Å; D282-R285 PolarHBondContact OD1-NH2 2.6Å; D282-R285 IonicContact OD2-NH2 2.64Å; K283-R285 VanDerWaalsContact C-N 3.32Å; K283-R285 PolarHBondContact O-N 2.97Å; R285-K288 PolarHBondContact O-N 2.89Å; R285-V289 WeakPolarHBondContact O-CG2 3.35Å; R285-V289 PolarHBondContact O-N 3Å; R285-V289 VanDerWaalsContact O-N 3.15Å
286	T	66.8	Low	65.2	Low	11 Å²	11	81.8 Å²	81.8	7%	0.067	40%	0.401	C	S	.	.	H	α-helix	trans	-70	-39.4	179.1	-59.5	0	0	0	0	112	C273 C277 D282 K283 K288 V289 L290	C273-T286 HydrophobicContact CB-CG2 3.8Å; C277-T286 PolarHBondContact SG-OG1 3.27Å; D282-T286 WeakPolarHBondContact O-CB 3.23Å; D282-T286 PolarHBondContact O-N 3.41Å; D282-T286 PolarHBondContact O-OG1 3.35Å; K283-T286 PolarHBondContact O-N 2.98Å; T286-K288 PolarHBondContact O-N 3.47Å; T286-V289 PolarHBondContact O-N 3.43Å; T286-L290 HydrophobicContact CG2-CD1 4.26Å; T286-L290 WeakPolarHBondContact O-CB 3.42Å; T286-L290 PolarHBondContact O-N 3.31Å
287	E	73.9	Confident	65.1	Low	77 Å²	77	82.2 Å²	82.2	36%	0.36	39%	0.39	S	S	.	.	H	α-helix	trans	-59.7	-45.9	173.6	-174	172.8	127.4	0	0	111.4	F274 K283 L290 K291	F274-E287 HydrophobicContact CE1-CB 3.94Å; F274-E287 HydrophobicContact CZ-CB 3.65Å; F274-E287 HydrophobicContact CZ-CG 3.98Å; K283-E287 WeakPolarHBondContact O-CB 3.14Å; K283-E287 PolarHBondContact O-N 3.02Å; E287-L290 PolarHBondContact O-N 3.45Å; E287-K291 HydrophobicContact CG-CD 4.02Å; E287-K291 WeakPolarHBondContact O-CB 3.42Å; E287-K291 WeakPolarHBondContact O-CG 3.39Å; E287-K291 PolarHBondContact O-N 2.91Å; E287-K291 WeakPolarHBondContact OE1-CE 3.44Å; E287-K291 IonicContact OE1-NZ 2.63Å; E287-K291 PolarHBondContact OE1-NZ 3.11Å
288	K	77.1	Confident	65.2	Low	89 Å²	89	85.2 Å²	85.2	39%	0.387	41%	0.405	S	S	.	.	H	α-helix	trans	-61.3	-47.9	178.6	-174.3	179.4	171.9	-174.9	0	111.6	Y92 D284 R285 T286 K291 E292	Y92-K288 VanDerWaalsContact CZ-NZ 3.33Å; Y92-K288 PolarHBondContact OH-NZ 2.93Å; D284-K288 PolarHBondContact O-N 3.34Å; D284-K288 VanDerWaalsContact O-N 3.13Å; R285-K288 PolarHBondContact O-N 2.89Å; T286-K288 PolarHBondContact O-N 3.47Å; K288-K291 PolarHBondContact O-N 3.07Å; K288-E292 WeakPolarHBondContact CE-OE1 3.25Å; K288-E292 IonicContact NZ-OE1 3.5Å; K288-E292 PolarHBondContact O-N 3Å
289	V	67.8	Low	65.3	Low	67 Å²	67	84.4 Å²	84.4	41%	0.406	40%	0.398	S	S	.	.	H	α-helix	trans	-64	-43.5	179.9	172.7	0	0	0	0	111.3	R285 T286 K291 E292 V293	R285-V289 WeakPolarHBondContact O-CG2 3.35Å; R285-V289 PolarHBondContact O-N 3Å; R285-V289 VanDerWaalsContact O-N 3.15Å; T286-V289 PolarHBondContact O-N 3.43Å; V289-K291 PolarHBondContact O-N 3.44Å; V289-E292 PolarHBondContact O-N 2.93Å; V289-V293 HydrophobicContact CG1-CG2 4.39Å; V289-V293 WeakPolarHBondContact O-CG2 3.28Å; V289-V293 PolarHBondContact O-N 3.13Å
290	L	71.3	Confident	64.9	Low	10 Å²	10	87.3 Å²	87.3	5%	0.052	41%	0.412	C	S	.	.	H	α-helix	trans	-59.8	-44.9	174.5	-89.3	170.2	0	0	0	112.1	Y269 V270 C273 F274 T286 E287 E292 V293 L294	Y269-L290 HydrophobicContact CD1-CD2 4.01Å; Y269-L290 HydrophobicContact CE1-CD2 3.87Å; V270-L290 HydrophobicContact CB-CD1 4.42Å; V270-L290 HydrophobicContact CG1-CD1 4.23Å; V270-L290 HydrophobicContact CG2-CD1 4.36Å; V270-L290 HydrophobicContact CG2-CD2 4.13Å; C273-L290 HydrophobicContact CB-CD1 3.82Å; C273-L290 HydrophobicContact CB-CG 4.45Å; F274-L290 HydrophobicContact CD2-CD1 4.18Å; F274-L290 HydrophobicContact CE2-CD1 3.83Å; F274-L290 HydrophobicContact CZ-CD1 4.45Å; T286-L290 HydrophobicContact CG2-CD1 4.26Å; T286-L290 WeakPolarHBondContact O-CB 3.42Å; T286-L290 PolarHBondContact O-N 3.31Å; E287-L290 PolarHBondContact O-N 3.45Å; L290-E292 VanDerWaalsContact C-N 3.34Å; L290-E292 PolarHBondContact O-N 3.46Å; L290-V293 PolarHBondContact O-N 3.47Å; L290-L294 HydrophobicContact CB-CD1 4.49Å; L290-L294 HydrophobicContact CD2-CD1 4.36Å; L290-L294 VanDerWaalsContact O-CB 3.23Å; L290-L294 WeakPolarHBondContact O-CB 3.48Å; L290-L294 WeakPolarHBondContact O-CD1 3.16Å; L290-L294 WeakPolarHBondContact O-CG 3.45Å; L290-L294 PolarHBondContact O-N 2.81Å
291	K	72.2	Confident	64.7	Low	122 Å²	122	82.1 Å²	82.1	53%	0.53	40%	0.401	S	S	.	.	H	α-helix	trans	-61.4	-41.6	178.8	-78.4	175.4	174.9	175.3	0	112.1	E287 K288 V289 Q295	E287-K291 HydrophobicContact CG-CD 4.02Å; E287-K291 WeakPolarHBondContact O-CB 3.42Å; E287-K291 WeakPolarHBondContact O-CG 3.39Å; E287-K291 PolarHBondContact O-N 2.91Å; E287-K291 WeakPolarHBondContact OE1-CE 3.44Å; E287-K291 IonicContact OE1-NZ 2.63Å; E287-K291 PolarHBondContact OE1-NZ 3.11Å; K288-K291 PolarHBondContact O-N 3.07Å; V289-K291 PolarHBondContact O-N 3.44Å; K291-Q295 WeakPolarHBondContact O-CB 2.83Å; K291-Q295 PolarHBondContact O-N 3.18Å
292	E	69.5	Low	64.6	Low	91 Å²	91	77.5 Å²	77.5	43%	0.425	38%	0.383	S	S	.	.	H	α-helix	trans	-66.5	-49	177.4	-72.5	176.1	-176.7	0	0	111.5	Y92 K288 V289 L290 L294 Q295 E296	Y92-E292 PolarHBondContact OH-OE1 3.49Å; Y92-E292 VanDerWaalsContact OH-OE1 3.11Å; K288-E292 WeakPolarHBondContact CE-OE1 3.25Å; K288-E292 IonicContact NZ-OE1 3.5Å; K288-E292 PolarHBondContact O-N 3Å; V289-E292 PolarHBondContact O-N 2.93Å; L290-E292 VanDerWaalsContact C-N 3.34Å; L290-E292 PolarHBondContact O-N 3.46Å; E292-L294 PolarHBondContact O-N 3.4Å; E292-Q295 PolarHBondContact O-N 2.96Å; E292-E296 WeakPolarHBondContact O-CB 3.46Å; E292-E296 PolarHBondContact O-N 3.15Å
293	V	65.6	Low	64.3	Low	38 Å²	38	76.4 Å²	76.4	23%	0.23	38%	0.378	C	S	.	.	H	α-helix	trans	-61.1	-45.6	178.2	172.5	0	0	0	0	112.1	V289 L290 E296 R297	V289-V293 HydrophobicContact CG1-CG2 4.39Å; V289-V293 WeakPolarHBondContact O-CG2 3.28Å; V289-V293 PolarHBondContact O-N 3.13Å; L290-V293 PolarHBondContact O-N 3.47Å; V293-E296 PolarHBondContact O-N 3.23Å; V293-R297 HydrophobicContact CG1-CG 4.41Å; V293-R297 VanDerWaalsContact O-CG 3.28Å; V293-R297 WeakPolarHBondContact O-CG 3.37Å; V293-R297 PolarHBondContact O-N 3.38Å
294	L	65.4	Low	63.9	Low	26 Å²	26	79.1 Å²	79.1	14%	0.136	39%	0.387	C	S	.	.	H	α-helix	trans	-68.2	-36.5	-179.9	-68.6	171.8	0	0	0	112.2	M266 V270 L290 E292 L298 W308	M266-L294 HydrophobicContact CE-CD1 4.39Å; M266-L294 HydrophobicContact CE-CD2 3.98Å; M266-L294 HydrophobicContact CG-CD2 3.6Å; M266-L294 HydrophobicContact SD-CD2 3.57Å; M266-L294 VanDerWaalsContact SD-CD2 3.57Å; V270-L294 HydrophobicContact CG2-CD1 3.76Å; L290-L294 HydrophobicContact CB-CD1 4.49Å; L290-L294 HydrophobicContact CD2-CD1 4.36Å; L290-L294 VanDerWaalsContact O-CB 3.23Å; L290-L294 WeakPolarHBondContact O-CB 3.48Å; L290-L294 WeakPolarHBondContact O-CD1 3.16Å; L290-L294 WeakPolarHBondContact O-CG 3.45Å; L290-L294 PolarHBondContact O-N 2.81Å; E292-L294 PolarHBondContact O-N 3.4Å; L294-L298 VanDerWaalsContact O-CB 3.27Å; L294-L298 WeakPolarHBondContact O-CB 3.21Å; L294-L298 PolarHBondContact O-N 3.47Å; L294-W308 HydrophobicContact CD2-CH2 4.31Å
295	Q	68.2	Low	62.9	Low	125 Å²	125	79.5 Å²	79.5	58%	0.584	39%	0.393	S	S	*	.	H	α-helix	trans	-74	-29.2	178.1	-168.9	173.9	35.1	0	0	112.6	K291 E292 K299	K291-Q295 WeakPolarHBondContact O-CB 2.83Å; K291-Q295 PolarHBondContact O-N 3.18Å; E292-Q295 PolarHBondContact O-N 2.96Å; Q295-K299 WeakPolarHBondContact O-CG 3.46Å; Q295-K299 PolarHBondContact O-N 3.1Å
296	E	61.6	Low	62.5	Low	118 Å²	118	76 Å²	76	55%	0.551	38%	0.383	S	S	*	.	H	α-helix	trans	-70.2	-54.9	171.7	-171.8	170.2	-117.7	0	0	111	E292 V293 L298 K299 D300	E292-E296 WeakPolarHBondContact O-CB 3.46Å; E292-E296 PolarHBondContact O-N 3.15Å; V293-E296 PolarHBondContact O-N 3.23Å; E296-L298 VanDerWaalsContact C-N 3.25Å; E296-L298 PolarHBondContact O-N 3.48Å; E296-K299 WeakPolarHBondContact O-CB 3.42Å; E296-K299 PolarHBondContact O-N 3.15Å; E296-D300 PolarHBondContact O-N 3.47Å
297	R	56.8	Low	61.8	Low	68 Å²	68	80.3 Å²	80.3	26%	0.257	41%	0.406	S	S	.	.	H	α-helix	trans	-65.8	-23.9	-178.3	-59.4	-73.6	177.6	77.5	2.9	113.5	V293 A303 I306 W308 E311	V293-R297 HydrophobicContact CG1-CG 4.41Å; V293-R297 VanDerWaalsContact O-CG 3.28Å; V293-R297 WeakPolarHBondContact O-CG 3.37Å; V293-R297 PolarHBondContact O-N 3.38Å; R297-A303 PolarHBondContact O-N 3.39Å; R297-I306 HydrophobicContact CG-CD1 4.5Å; R297-W308 HydrophobicContact CB-CH2 4.12Å; R297-W308 HydrophobicContact CB-CZ2 4.38Å; R297-W308 HydrophobicContact CG-CH2 4.06Å; R297-E311 IonicContact CZ-OE1 2.65Å; R297-E311 IonicContact NH1-OE1 3.34Å; R297-E311 PolarHBondContact NH1-OE1 3.13Å; R297-E311 IonicContact NH2-OE1 2.68Å
298	L	62.8	Low	61.1	Low	75 Å²	75	76.9 Å²	76.9	39%	0.393	39%	0.39	S	S	.	.	H	α-helix	trans	-72.9	-37	169.7	-172.3	73.9	0	0	0	112.5	W262 L294 E296 G301	W262-L298 HydrophobicContact CE3-CD1 4.49Å; W262-L298 HydrophobicContact CH2-CB 4.42Å; W262-L298 HydrophobicContact CH2-CD1 4.01Å; W262-L298 HydrophobicContact CH2-CD2 3.68Å; W262-L298 HydrophobicContact CH2-CG 4.24Å; W262-L298 HydrophobicContact CZ2-CD2 4.09Å; W262-L298 HydrophobicContact CZ3-CD1 3.9Å; W262-L298 HydrophobicContact CZ3-CD2 4.39Å; W262-L298 HydrophobicContact CZ3-CG 4.49Å; L294-L298 VanDerWaalsContact O-CB 3.27Å; L294-L298 WeakPolarHBondContact O-CB 3.21Å; L294-L298 PolarHBondContact O-N 3.47Å; E296-L298 VanDerWaalsContact C-N 3.25Å; E296-L298 PolarHBondContact O-N 3.48Å; L298-G301 PolarHBondContact O-N 3.22Å
299	K	58.8	Low	59.9	Low	165 Å²	165	75.6 Å²	75.6	72%	0.717	39%	0.389	S	S	*	.	H	α-helix	trans	-66.6	-37.9	177.8	-80.8	173.2	177.8	172.5	0	112.3	Q295 E296 G301	Q295-K299 WeakPolarHBondContact O-CG 3.46Å; Q295-K299 PolarHBondContact O-N 3.1Å; E296-K299 WeakPolarHBondContact O-CB 3.42Å; E296-K299 PolarHBondContact O-N 3.15Å; K299-G301 PolarHBondContact O-N 2.8Å
300	D	50.6	Low	58.7	Low	118 Å²	118	80 Å²	80	63%	0.631	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-5	178.8	-70.9	-10.2	0	0	0	113.3	E296 S302	E296-D300 PolarHBondContact O-N 3.47Å; D300-S302 PolarHBondContact O-N 2.76Å
301	G	55.4	Low	57.6	Low	51 Å²	51	82 Å²	82	53%	0.526	41%	0.414	S	S	.	.	S	Bend	trans	70.1	-4.1	-178.7	0	0	0	0	0	115.1	L298 K299 A303	L298-G301 PolarHBondContact O-N 3.22Å; K299-G301 PolarHBondContact O-N 2.8Å; G301-A303 VanDerWaalsContact C-N 3.32Å; G301-A303 PolarHBondContact O-N 2.94Å
302	S	54.7	Low	56.3	Low	32 Å²	32	81.3 Å²	81.3	22%	0.224	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-80	-6.7	-176	56.4	0	0	0	0	114.5	D300 Y304 T305 I306	D300-S302 PolarHBondContact O-N 2.76Å; S302-Y304 PolarHBondContact O-N 3.23Å; S302-T305 PolarHBondContact O-N 2.97Å; S302-T305 PolarHBondContact O-OG1 3.49Å; S302-I306 WeakPolarHBondContact O-CG1 3.35Å; S302-I306 PolarHBondContact O-N 2.97Å
303	A	52.9	Low	55.3	Low	2 Å²	2	81.3 Å²	81.3	2%	0.017	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-53.2	-22.6	-179.5	0	0	0	0	0	115.4	R297 G301 W308	R297-A303 PolarHBondContact O-N 3.39Å; G301-A303 VanDerWaalsContact C-N 3.32Å; G301-A303 PolarHBondContact O-N 2.94Å; A303-W308 PolarHBondContact O-NE1 3.01Å
304	Y	52.9	Low	54.4	Low	138 Å²	138	82.2 Å²	82.2	54%	0.541	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-98.2	-3.4	-179	-58.8	-88.9	0	0	0	114.4	P263 S302	P263-Y304 HydrophobicContact CG-CD1 4.2Å; P263-Y304 HydrophobicContact CG-CE1 4.31Å; S302-Y304 PolarHBondContact O-N 3.23Å
305	T	52.7	Low	53.1	Low	125 Å²	125	88 Å²	88	77%	0.767	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.9	4.5	-179.7	37.2	0	0	0	0	113.9	S302	S302-T305 PolarHBondContact O-N 2.97Å; S302-T305 PolarHBondContact O-OG1 3.49Å
306	I	55.4	Low	52	Low	49 Å²	49	85.4 Å²	85.4	25%	0.251	45%	0.447	S	S	.	.	S	Bend	trans	-97.5	132.3	176.1	-65.9	166.3	0	0	0	109.5	R297 S302 W308	R297-I306 HydrophobicContact CG-CD1 4.5Å; S302-I306 WeakPolarHBondContact O-CG1 3.35Å; S302-I306 PolarHBondContact O-N 2.97Å; I306-W308 HydrophobicContact CB-CZ2 4.38Å; I306-W308 HydrophobicContact CD1-CZ2 4.4Å; I306-W308 HydrophobicContact CG2-CD2 4.12Å; I306-W308 HydrophobicContact CG2-CE3 4.39Å; I306-W308 HydrophobicContact CG2-CZ2 4.4Å; I306-W308 PolarHBondContact O-N 3.27Å; I306-W308 VanDerWaalsContact O-N 3.12Å
307	D	52.4	Low	50.7	Low	100 Å²	100	86.8 Å²	86.8	54%	0.535	45%	0.452	S	S	.	.			trans	-82.3	86.9	174.3	-171.2	-5.8	0	0	0	111.2	T309 H310	D307-T309 VanDerWaalsContact CG-OG1 3.28Å; D307-T309 PolarHBondContact O-N 3.42Å; D307-T309 VanDerWaalsContact OD1-CB 3.31Å; D307-T309 WeakPolarHBondContact OD1-CB 3.33Å; D307-T309 WeakPolarHBondContact OD1-CG2 3.47Å; D307-T309 PolarHBondContact OD1-N 3.16Å; D307-T309 PolarHBondContact OD1-OG1 3.21Å; D307-T309 PolarHBondContact OD2-OG1 3.07Å; D307-H310 PolarHBondContact O-N 3.24Å; D307-H310 IonicContact OD2-CD2 3.98Å
308	W	58.6	Low	49.8	Very low	6 Å²	6	89.2 Å²	89.2	2%	0.023	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-6.2	177.5	-57.3	100.3	0	0	0	114.3	A265 M266 Y269 R272 L294 R297 A303 I306 E311	A265-W308 HydrophobicContact CB-CB 4.04Å; M266-W308 HydrophobicContact CB-CG 4.38Å; M266-W308 HydrophobicContact CG-CD2 4.31Å; M266-W308 HydrophobicContact CG-CZ2 4.43Å; Y269-W308 HydrophobicContact CD1-CE3 4.02Å; Y269-W308 HydrophobicContact CD1-CZ3 4.31Å; Y269-W308 HydrophobicContact CE1-CE3 4.39Å; Y269-W308 HydrophobicContact CE1-CZ3 4.37Å; Y269-W308 HydrophobicContact CG-CE3 4.42Å; R272-W308 PolarHBondContact NH2-O 3.49Å; L294-W308 HydrophobicContact CD2-CH2 4.31Å; R297-W308 HydrophobicContact CB-CH2 4.12Å; R297-W308 HydrophobicContact CB-CZ2 4.38Å; R297-W308 HydrophobicContact CG-CH2 4.06Å; A303-W308 PolarHBondContact O-NE1 3.01Å; I306-W308 HydrophobicContact CB-CZ2 4.38Å; I306-W308 HydrophobicContact CD1-CZ2 4.4Å; I306-W308 HydrophobicContact CG2-CD2 4.12Å; I306-W308 HydrophobicContact CG2-CE3 4.39Å; I306-W308 HydrophobicContact CG2-CZ2 4.4Å; I306-W308 PolarHBondContact O-N 3.27Å; I306-W308 VanDerWaalsContact O-N 3.12Å; W308-E311 WeakPolarHBondContact CZ3-OE2 3.44Å
309	T	51.8	Low	48.2	Very low	62 Å²	62	95.3 Å²	95.3	38%	0.38	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-32.7	176	67.7	0	0	0	0	112	A265 R272 D307	A265-T309 HydrophobicContact CB-CG2 4.41Å; R272-T309 PolarHBondContact NH1-O 2.57Å; D307-T309 VanDerWaalsContact CG-OG1 3.28Å; D307-T309 PolarHBondContact O-N 3.42Å; D307-T309 VanDerWaalsContact OD1-CB 3.31Å; D307-T309 WeakPolarHBondContact OD1-CB 3.33Å; D307-T309 WeakPolarHBondContact OD1-CG2 3.47Å; D307-T309 PolarHBondContact OD1-N 3.16Å; D307-T309 PolarHBondContact OD1-OG1 3.21Å; D307-T309 PolarHBondContact OD2-OG1 3.07Å
310	H	42.2	Very low	46.8	Very low	160 Å²	160	96.2 Å²	96.2	74%	0.741	50%	0.504	S	S	*	.	S	Bend	trans	-110.1	-1.3	-170	-80.2	-72.4	0	0	0	116.3	D307	D307-H310 PolarHBondContact O-N 3.24Å; D307-H310 IonicContact OD2-CD2 3.98Å
311	E	48.1	Very low	45.8	Very low	52 Å²	52	94.5 Å²	94.5	24%	0.243	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-70.1	124.2	173.9	-155.5	174.7	-132.9	0	0	109.8	Y269 R297 W308	Y269-E311 HydrophobicContact CE2-CB 4.31Å; R297-E311 IonicContact CZ-OE1 2.65Å; R297-E311 IonicContact NH1-OE1 3.34Å; R297-E311 PolarHBondContact NH1-OE1 3.13Å; R297-E311 IonicContact NH2-OE1 2.68Å; W308-E311 WeakPolarHBondContact CZ3-OE2 3.44Å
312	P	46	Very low	44.6	Very low	106 Å²	106	104 Å²	104	69%	0.688	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-75.8	150	-173.2	29.7	-35.1	0	0	0	112.9
313	L	47.4	Very low	43.4	Very low	91 Å²	91	112.8 Å²	112.8	48%	0.476	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-54	138	179.3	-71.9	164.1	0	0	0	112.3	R272 C273 A276 E315	R272-L313 HydrophobicContact CB-CD2 4.47Å; C273-L313 HydrophobicContact CB-CD2 4.38Å; A276-L313 HydrophobicContact CB-CD1 4.35Å; A276-L313 HydrophobicContact CB-CD2 4.45Å; L313-E315 PolarHBondContact O-N 3.43Å
314	P	46.9	Very low	42.5	Very low	58 Å²	58	121.7 Å²	121.7	38%	0.377	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-58.8	123.8	174.3	-24.1	34	0	0	0	112	L316	P314-L316 PolarHBondContact O-N 3.05Å
315	E	38.1	Very low	41.4	Very low	148 Å²	148	119.6 Å²	119.6	69%	0.692	60%	0.602	S	S	*	*			trans	-66.8	90.6	178.6	-77	-169	115.9	0	0	112.2	L313 K317	L313-E315 PolarHBondContact O-N 3.43Å; E315-K317 HydrophobicContact CB-CG 4.46Å; E315-K317 VanDerWaalsContact CD-CE 3.49Å; E315-K317 PolarHBondContact O-N 3.48Å; E315-K317 WeakPolarHBondContact OE1-CE 3.26Å; E315-K317 IonicContact OE1-NZ 3.97Å; E315-K317 PolarHBondContact OE1-NZ 2.79Å; E315-K317 WeakPolarHBondContact OE2-CE 3.3Å; E315-K317 IonicContact OE2-NZ 3.27Å; E315-K317 PolarHBondContact OE2-NZ 3.24Å
316	L	45	Very low	40.5	Very low	70 Å²	70	120.2 Å²	120.2	37%	0.366	61%	0.605	S	S	.	*			trans	-70.3	74.7	166.3	-67	-179.6	0	0	0	110.7	D282 P314 V318	D282-L316 HydrophobicContact CB-CD1 4.31Å; P314-L316 PolarHBondContact O-N 3.05Å; L316-V318 PolarHBondContact O-N 3.29Å
317	K	34.7	Very low	39.6	Very low	147 Å²	147	123 Å²	123	64%	0.639	63%	0.627	S	S	*	*			trans	-67.5	91.4	175.6	-84.9	168.2	172.9	152.7	0	110.9	E315 K319	E315-K317 HydrophobicContact CB-CG 4.46Å; E315-K317 VanDerWaalsContact CD-CE 3.49Å; E315-K317 PolarHBondContact O-N 3.48Å; E315-K317 WeakPolarHBondContact OE1-CE 3.26Å; E315-K317 IonicContact OE1-NZ 3.97Å; E315-K317 PolarHBondContact OE1-NZ 2.79Å; E315-K317 WeakPolarHBondContact OE2-CE 3.3Å; E315-K317 IonicContact OE2-NZ 3.27Å; E315-K317 PolarHBondContact OE2-NZ 3.24Å; K317-K319 PolarHBondContact O-N 2.65Å
318	V	38.9	Very low	38.8	Very low	118 Å²	118	124 Å²	124	72%	0.715	64%	0.639	S	S	*	*			trans	-54.4	103.4	175.3	-179.2	0	0	0	0	110	L316 Q320	L316-V318 PolarHBondContact O-N 3.29Å; V318-Q320 PolarHBondContact O-N 3.22Å
319	K	27.6	Very low	37.3	Very low	204 Å²	204	131.1 Å²	131.1	89%	0.887	67%	0.672	S	S	*	*			trans	-80	100.5	168.8	-80.6	-178.9	174.9	173.6	0	108.8	K317 S321	K317-K319 PolarHBondContact O-N 2.65Å; K319-S321 PolarHBondContact O-N 2.87Å
320	Q	30.5	Very low	36.2	Very low	184 Å²	184	137.6 Å²	137.6	86%	0.86	69%	0.689	S	S	*	*			trans	-47.5	128.4	168.6	-72.3	178	-32	0	0	110.4	V318 R322	V318-Q320 PolarHBondContact O-N 3.22Å; Q320-R322 PolarHBondContact O-N 3.2Å
321	S	28.9	Very low	35.5	Very low	82 Å²	82	135.9 Å²	135.9	57%	0.573	69%	0.69	S	S	*	*			trans	-74.8	122.1	-175.9	-172.2	0	0	0	0	111	K319 W323	K319-S321 PolarHBondContact O-N 2.87Å; S321-W323 PolarHBondContact O-N 3.03Å; S321-W323 PolarHBondContact OG-NE1 3.29Å
322	R	31.3	Very low	34.6	Very low	249 Å²	249	138.4 Å²	138.4	94%	0.94	71%	0.714	S	S	*	*	S	Bend	trans	-80.5	58.4	-177.2	-167.2	-159.9	-86.7	-155.8	-9.7	112.4	Q320	Q320-R322 PolarHBondContact O-N 3.2Å
323	W	30.1	Very low	33.7	Very low	217 Å²	217	139.8 Å²	139.8	82%	0.822	72%	0.715	S	S	*	*			trans	-157.4	48.8	169	59.9	-87.3	0	0	0	114.6	S321	S321-W323 PolarHBondContact O-N 3.03Å; S321-W323 PolarHBondContact OG-NE1 3.29Å
324	E	32.6	Very low	32.9	Very low	190 Å²	190	142.2 Å²	142.2	89%	0.888	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-98.8	142.8	161.1	-163.2	141.9	-136.3	0	0	110.7
325	A	30	Very low	32.1	Very low	94 Å²	94	143.3 Å²	143.3	78%	0.777	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-87.4	132.5	-161.5	0	0	0	0	0	113.2
326	V	34.3	Very low	31.7	Very low	137 Å²	137	144.1 Å²	144.1	83%	0.83	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-96.3	118.9	175.2	178.1	0	0	0	0	110
327	P	35.2	Very low	31	Very low	109 Å²	109	147 Å²	147	71%	0.708	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-74.1	151.4	169.8	31.5	-33.9	0	0	0	111
328	P	37.1	Very low	30.7	Very low	121 Å²	121	151.5 Å²	151.5	79%	0.786	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-91.3	134.3	-167.5	33.5	-34	0	0	0	113.8
329	Q	27.6	Very low	30.1	Very low	155 Å²	155	149.8 Å²	149.8	72%	0.724	78%	0.777	S	S	*	*				-178.6	153.4	113.3	-105.6	-169.5	6.3	0	0	116.7
330	R	27.2	Very low	30.1	Very low	198 Å²	198	143.9 Å²	143.9	75%	0.747	77%	0.774	S	S	*	*			trans	76.4	116.6	141.9	-77.5	175.3	-170.2	-135.1	-2	122.4
331	T	27.3	Very low	30	Very low	124 Å²	124	140.3 Å²	140.3	76%	0.761	77%	0.77	S	S	*	*				73.7	128.3	128.9	56.2	0	0	0	0	122.4
332	S	30.2	Very low	29.9	Very low	104 Å²	104	142.6 Å²	142.6	73%	0.727	78%	0.78	S	S	*	*			trans	101.8	122.6	134.6	-91.6	0	0	0	0	121.2
333	D	27.6	Very low	29.8	Very low	136 Å²	136	139.8 Å²	139.8	73%	0.727	78%	0.78	S	S	*	*			trans	81.4	97.7	135.9	-65.6	-57	0	0	0	123.4
334	N	29	Very low	29.7	Very low	141 Å²	141	133.5 Å²	133.5	75%	0.754	78%	0.783	S	S	*	*				87.3	92.3	106.8	-140.7	33.4	0	0	0	120.9
335	S	31.4	Very low	29.5	Very low	81 Å²	81	129.2 Å²	129.2	57%	0.566	78%	0.78	S	S	*	*				97.7	153.4	115	77.9	0	0	0	0	123.6
336	M	29.4	Very low	29.3	Very low	165 Å²	165	129.2 Å²	129.2	81%	0.813	78%	0.779	S	S	*	*			trans	73.3	145.3	151.5	-59.4	-133.8	-173	0	0	118.9
337	I	30.6	Very low	29	Very low	132 Å²	132	127.7 Å²	127.7	68%	0.677	78%	0.775	S	S	*	*			cis	-163.2	161.8	-26.4	-130.5	174.2	0	0	0	109.8
338	R	28.6	Very low	28.6	Very low	241 Å²	241	134.2 Å²	134.2	91%	0.909	79%	0.786	S	S	*	*			trans	63	149.8	173.3	-78.5	163.5	-179	-176.4	0.1	116.8
339	G	26.3	Very low	28.1	Very low	81 Å²	81	131.8 Å²	131.8	84%	0.835	78%	0.783	S	S	*	*			cis	129.5	137.7	-7	0	0	0	0	0	113.6
340	G	26.4	Very low	28	Very low	81 Å²	81	137.2 Å²	137.2	84%	0.835	80%	0.796	S	S	*	*			trans	158.6	120.1	174.7	0	0	0	0	0	113.1
341	S	28.5	Very low	27.9	Very low	109 Å²	109	130.9 Å²	130.9	76%	0.762	79%	0.793	S	S	*	*			trans	-113.3	147	-168.4	-62.7	0	0	0	0	114
342	T	28	Very low	28	Very low	130 Å²	130	133.3 Å²	133.3	80%	0.798	80%	0.799	S	S	*	*			trans	72.9	145.4	138.1	50.9	0	0	0	0	123.8
343	M	29	Very low	27.9	Very low	190 Å²	190	131.2 Å²	131.2	94%	0.936	79%	0.794	S	S	*	*			trans	80	150	156.5	-45.2	-142.8	89.3	0	0	120
344	G	27.9	Very low	28	Very low	85 Å²	85	132.2 Å²	132.2	88%	0.876	79%	0.794	S	S	*	*			trans	146.9	109.6	170.5	0	0	0	0	0	113.7
345	A	27.2	Very low	28.1	Very low	100 Å²	100	135.3 Å²	135.3	83%	0.826	80%	0.795	S	S	*	*			trans	-109	154.5	-169.3	0	0	0	0	0	115.7
346	A	27.1	Very low	28	Very low	93 Å²	93	138.6 Å²	138.6	77%	0.769	81%	0.805	S	S	*	*			trans	51.6	103.4	142.4	0	0	0	0	0	122.7
347	S	28.4	Very low	28	Very low	106 Å²	106	134.3 Å²	134.3	74%	0.741	80%	0.804	S	S	*	*				66.4	141.3	114.6	-156.3	0	0	0	0	123.1
348	R	26.7	Very low	28	Very low	246 Å²	246	133.2 Å²	133.2	93%	0.928	80%	0.8	S	S	*	*			trans	78	139	172.7	-50.3	168.5	177.1	164.4	-1.6	115.3
349	G	24.8	Very low	28.2	Very low	70 Å²	70	130.7 Å²	130.7	72%	0.722	79%	0.791	S	S	*	*			cis	158.7	165.2	-11.2	0	0	0	0	0	114.6
350	R	26.5	Very low	28.5	Very low	268 Å²	268	136 Å²	136	100%	1.011	79%	0.786	S	S	*	*			trans	94.1	151.3	175.7	-63.8	-175.2	162.9	-160.5	-2.9	118.8
351	G	25.1	Very low	28.5	Very low	65 Å²	65	140.4 Å²	140.4	67%	0.67	79%	0.79	S	S	*	*			trans	113.8	92.2	179.4	0	0	0	0	0	112
352	I	29.2	Very low	28.8	Very low	176 Å²	176	141 Å²	141	90%	0.903	78%	0.784	S	S	*	*				62.3	120.4	73.3	-54	169.6	0	0	0	111.7
353	G	27.8	Very low	28.7	Very low	60 Å²	60	142.5 Å²	142.5	62%	0.619	78%	0.779	S	S	*	*			cis	176.8	-171.1	-1.8	0	0	0	0	0	113.5
354	H	31.1	Very low	29.1	Very low	156 Å²	156	138.7 Å²	138.7	72%	0.722	77%	0.772	S	S	*	*			trans	75.9	117.1	177.1	-58.6	-51.6	0	0	0	117.8
355	R	30.7	Very low	29.2	Very low	207 Å²	207	140.1 Å²	140.1	78%	0.781	76%	0.756	S	S	*	*				84.8	106.1	94.3	-71.1	-171.4	-145.9	-103	8	112.2
356	L	29.4	Very low	29.4	Very low	149 Å²	149	145.1 Å²	145.1	78%	0.78	75%	0.753	S	S	*	*				95.1	116	68.6	-104.9	168.7	0	0	0	112
357	G	28.4	Very low	29.7	Very low	76 Å²	76	145.2 Å²	145.2	78%	0.784	75%	0.748	S	S	*	*			trans	-173	54.1	-175.9	0	0	0	0	0	112.9
358	N	32.1	Very low	30.7	Very low	109 Å²	109	145.4 Å²	145.4	58%	0.583	75%	0.747	S	S	*	*			trans	-68.7	167.5	166.5	-59	-4.6	0	0	0	108.5
359	Y	32.2	Very low	30.7	Very low	188 Å²	188	139.1 Å²	139.1	74%	0.737	74%	0.741	S	S	*	*			cis	-164.5	-176.3	42.8	-66.8	-90	0	0	0	108.1
360	R	31.3	Very low	30.8	Very low	192 Å²	192	141.1 Å²	141.1	73%	0.725	74%	0.744	S	S	*	*			cis	-161.4	145.5	5.8	-139.6	151	172.7	173.8	-2.4	108.2	I362	R360-I362 HydrophobicContact CB-CG1 4.17Å; R360-I362 HydrophobicContact CG-CD1 4.26Å; R360-I362 HydrophobicContact CG-CG1 3.7Å
361	N	28.3	Very low	30.9	Very low	173 Å²	173	133.6 Å²	133.6	93%	0.925	73%	0.732	S	S	*	*			trans	-108.6	135.2	146.9	-105.8	-31.9	0	0	0	106.9
362	I	32.8	Very low	31.1	Very low	121 Å²	121	134.7 Å²	134.7	62%	0.621	73%	0.729	S	S	*	*			trans	-110.2	128.1	-171.4	-71.8	-179.3	0	0	0	111	R360	R360-I362 HydrophobicContact CB-CG1 4.17Å; R360-I362 HydrophobicContact CG-CD1 4.26Å; R360-I362 HydrophobicContact CG-CG1 3.7Å
363	F	27.6	Very low	31.2	Very low	162 Å²	162	131.2 Å²	131.2	71%	0.711	72%	0.721	S	S	*	*			trans	52	102.4	162.4	-84.1	-152.3	0	0	0	118.6	Q365	F363-Q365 HydrophobicContact CD1-CG 3.66Å; F363-Q365 HydrophobicContact CE1-CG 3.52Å; F363-Q365 HydrophobicContact CE2-CG 4.41Å; F363-Q365 HydrophobicContact CG-CG 4.18Å; F363-Q365 HydrophobicContact CZ-CG 3.92Å
364	S	37.3	Very low	31.3	Very low	111 Å²	111	139.5 Å²	139.5	78%	0.776	73%	0.733	S	S	*	*				-94.7	143.5	109.5	174.7	0	0	0	0	109
365	Q	29.7	Very low	31.2	Very low	114 Å²	114	137.7 Å²	137.7	53%	0.533	74%	0.738	S	S	.	*			trans	-106.1	119.1	153.1	-69.4	-82.7	50.4	0	0	105	F363	F363-Q365 HydrophobicContact CD1-CG 3.66Å; F363-Q365 HydrophobicContact CE1-CG 3.52Å; F363-Q365 HydrophobicContact CE2-CG 4.41Å; F363-Q365 HydrophobicContact CG-CG 4.18Å; F363-Q365 HydrophobicContact CZ-CG 3.92Å
366	R	31.1	Very low	31.1	Very low	205 Å²	205	132.6 Å²	132.6	77%	0.774	74%	0.735	S	S	*	*				63.2	136.8	79.2	-70.8	-162.1	-177.6	-119.7	1.8	113.1
367	S	34.2	Very low	31.3	Very low	95 Å²	95	129.7 Å²	129.7	66%	0.664	73%	0.727	S	S	*	*			cis	-179	-168.6	-4.7	-99.5	0	0	0	0	107.3
368	P	48.2	Very low	31.4	Very low	110 Å²	110	137.8 Å²	137.8	71%	0.714	73%	0.734	S	S	*	*				-131.9	-170	-55.5	39.8	-23.9	0	0	0	112.9
369	S	27.5	Very low	31.3	Very low	115 Å²	115	138.1 Å²	138.1	80%	0.804	74%	0.744	S	S	*	*			trans	115.9	140.2	154.9	-50	0	0	0	0	114.6
370	S	25.8	Very low	31.7	Very low	112 Å²	112	135.1 Å²	135.1	78%	0.783	75%	0.748	S	S	*	*			cis	-144.6	172.4	3.4	54.6	0	0	0	0	113.7
371	S	29.9	Very low	31.8	Very low	110 Å²	110	131.3 Å²	131.3	77%	0.769	75%	0.751	S	S	*	*			trans	-49.8	164	171	46.8	0	0	0	0	115.3
372	S	28.4	Very low	32.4	Very low	87 Å²	87	128.6 Å²	128.6	61%	0.608	74%	0.743	S	S	*	*			cis	-154.3	150.2	35.5	77.8	0	0	0	0	112.7
373	S	31.4	Very low	32.3	Very low	103 Å²	103	127.5 Å²	127.5	72%	0.72	75%	0.745	S	S	*	*				60.5	143.1	96.8	-42.3	0	0	0	0	114.9
374	R	29.5	Very low	32.4	Very low	234 Å²	234	128.9 Å²	128.9	88%	0.883	75%	0.754	S	S	*	*			cis	-152.5	177.3	38.3	-62.5	169	-165.5	-153.5	-2.1	112.8
375	S	30	Very low	31.9	Very low	118 Å²	118	127 Å²	127	83%	0.825	75%	0.752	S	S	*	*			trans	-64.6	-179.2	179.3	-41.4	0	0	0	0	114.5
376	S	28.8	Very low	31.9	Very low	101 Å²	101	133.3 Å²	133.3	71%	0.706	77%	0.771	S	S	*	*			cis	-167.5	143.9	24.6	-157.4	0	0	0	0	117.4
377	S	32.2	Very low	31.7	Very low	88 Å²	88	131.9 Å²	131.9	62%	0.615	77%	0.772	S	S	*	*			trans	54.8	133.1	133.7	66.6	0	0	0	0	126.1
378	R	30.8	Very low	31.7	Very low	246 Å²	246	138.9 Å²	138.9	93%	0.928	78%	0.784	S	S	*	*			trans	84.4	122.2	133	-76.3	170.3	-177.9	-157.9	0.6	122.3
379	S	31.4	Very low	31	Very low	115 Å²	115	138 Å²	138	80%	0.804	77%	0.774	S	S	*	*			trans	-77.2	172.2	153.5	-22.6	0	0	0	0	111.2
380	P	38.8	Very low	31.1	Very low	126 Å²	126	142.8 Å²	142.8	82%	0.818	77%	0.774	S	S	*	*				-144.2	-178	54.8	40.5	-20.2	0	0	0	117
381	S	34.3	Very low	31.5	Very low	112 Å²	112	142.4 Å²	142.4	78%	0.783	77%	0.772	S	S	*	*			trans	-82.7	166.1	171.8	-43.4	0	0	0	0	112.6
382	P	40.4	Very low	31.6	Very low	116 Å²	116	143.7 Å²	143.7	75%	0.753	77%	0.77	S	S	*	*				-156	168	96.2	40.4	-21.7	0	0	0	119.1
383	S	30.7	Very low	31.8	Very low	97 Å²	97	147.9 Å²	147.9	68%	0.678	78%	0.78	S	S	*	*			trans	65.2	130.4	141.8	61.2	0	0	0	0	125.5
384	H	29.1	Very low	31.9	Very low	192 Å²	192	153 Å²	153	89%	0.889	78%	0.783	S	S	*	*			trans	55	117.6	141.6	-67.3	-58.5	0	0	0	124
385	G	27	Very low	32.1	Very low	71 Å²	71	147.9 Å²	147.9	73%	0.732	77%	0.769	S	S	*	*				123.4	136.6	96.1	0	0	0	0	0	121.7
386	R	30.1	Very low	32.2	Very low	247 Å²	247	151.6 Å²	151.6	93%	0.932	77%	0.765	S	S	*	*			trans	78.2	115.3	149.8	-58.7	-175.1	178.3	-166	-0.6	122.3
387	H	28.3	Very low	32.4	Very low	175 Å²	175	157.9 Å²	157.9	81%	0.81	77%	0.773	S	S	*	*			trans	10.6	129.4	135.9	-83.1	-102.2	0	0	0	121.3
388	R	32.3	Very low	32.3	Very low	242 Å²	242	158.2 Å²	158.2	91%	0.913	78%	0.775	S	S	*	*				-163.8	143.5	98.2	-96.3	177.2	161.8	153.5	-4.5	108.8
389	D	33.5	Very low	32.3	Very low	91 Å²	91	153 Å²	153	49%	0.487	77%	0.766	S	S	.	*			cis	113.4	121.2	14	-171.8	35.4	0	0	0	112.2
390	R	31.1	Very low	32.2	Very low	215 Å²	215	152.9 Å²	152.9	81%	0.811	77%	0.765	S	S	*	*			trans	61.9	161.3	168.7	-70.2	153.4	-145.5	-149.5	2.2	117.4
391	S	33.9	Very low	32	Very low	105 Å²	105	149.8 Å²	149.8	73%	0.734	76%	0.756	S	S	*	*			cis	-157.5	139.3	-9.3	29.2	0	0	0	0	107.5
392	N	30.8	Very low	31.8	Very low	137 Å²	137	150 Å²	150	73%	0.733	76%	0.757	S	S	*	*				72	90	61.3	-174.4	34.4	0	0	0	115.9
393	Q	33.3	Very low	31.2	Very low	174 Å²	174	152.6 Å²	152.6	81%	0.813	76%	0.76	S	S	*	*			trans	-174.1	133.8	146.3	-98.5	160.8	65.8	0	0	106.8
394	R	32.9	Very low	31.1	Very low	210 Å²	210	152.7 Å²	152.7	79%	0.792	76%	0.76	S	S	*	*				60.4	129.2	65.3	-66.8	-176.7	173.5	-172.7	-1.2	111.2
395	H	33.8	Very low	31.1	Very low	128 Å²	128	150.1 Å²	150.1	59%	0.593	75%	0.753	S	S	*	*			cis	-166.1	157.7	45.2	-125.3	-9.5	0	0	0	114.3
396	R	33.7	Very low	31.1	Very low	196 Å²	196	151.6 Å²	151.6	74%	0.74	75%	0.753	S	S	*	*			trans	66.2	136.3	147.2	-66.9	172.9	-161.7	-136.7	5.9	118.1
397	R	31.4	Very low	31.2	Very low	233 Å²	233	144.9 Å²	144.9	88%	0.879	74%	0.743	S	S	*	*				70.7	132	55.8	-73.7	-169	-176.4	-165.3	1.3	112.7
398	S	31.8	Very low	31.2	Very low	94 Å²	94	145.3 Å²	145.3	66%	0.657	75%	0.748	S	S	*	*			cis	-131.4	-158	-3.1	-64.6	0	0	0	0	109.5
399	D	29.4	Very low	31.1	Very low	137 Å²	137	139 Å²	139	73%	0.733	74%	0.741	S	S	*	*			cis	-158.2	148.7	36.9	-93.7	-57.4	0	0	0	110.6
400	S	30.2	Very low	31.3	Very low	112 Å²	112	139.3 Å²	139.3	78%	0.783	75%	0.75	S	S	*	*				76.1	142.3	71.8	-47.1	0	0	0	0	113.6
401	G	33.2	Very low	31.4	Very low	62 Å²	62	135.8 Å²	135.8	64%	0.639	75%	0.748	S	S	*	*			cis	-142.7	175.8	0.7	0	0	0	0	0	112.3
402	S	30	Very low	31.4	Very low	115 Å²	115	137.9 Å²	137.9	80%	0.804	75%	0.75	S	S	*	*				81.8	145.4	87.8	-66.2	0	0	0	0	114.6
403	Q	29.7	Very low	31.4	Very low	171 Å²	171	139 Å²	139	80%	0.799	75%	0.75	S	S	*	*			cis	-174.4	140.6	-27.3	-123.8	177.1	11.8	0	0	109.2
404	S	28	Very low	32.1	Very low	99 Å²	99	135.4 Å²	135.4	69%	0.692	74%	0.742	S	S	*	*			trans	62.6	169.2	149.1	-41	0	0	0	0	119.3
405	D	28.2	Very low	32	Very low	138 Å²	138	132.2 Å²	132.2	74%	0.738	74%	0.736	S	S	*	*			cis	-156.4	166.6	-9.1	-138.5	-37.2	0	0	0	113.4
406	S	28.3	Very low	31.8	Very low	103 Å²	103	132.6 Å²	132.6	72%	0.72	74%	0.742	S	S	*	*			trans	56	178.5	146.2	77.3	0	0	0	0	123
407	S	32.3	Very low	31.5	Very low	105 Å²	105	128.2 Å²	128.2	73%	0.734	74%	0.741	S	S	*	*				-177.1	142.8	-84	57.6	0	0	0	0	113.9
408	M	28.3	Very low	31.4	Very low	184 Å²	184	129 Å²	129	91%	0.906	74%	0.744	S	S	*	*			trans	-174.2	138	154	44	-163.7	172.7	0	0	110.4
409	S	30.2	Very low	31.1	Very low	111 Å²	111	136.4 Å²	136.4	78%	0.776	76%	0.758	S	S	*	*			cis	87.6	140.5	41.2	-155.9	0	0	0	0	112.5
410	S	36.4	Very low	31.1	Very low	96 Å²	96	133.5 Å²	133.5	67%	0.671	76%	0.76	S	S	*	*			cis	-125.8	-144.5	11.7	-56.5	0	0	0	0	111.4
411	D	32.9	Very low	31.2	Very low	142 Å²	142	137.6 Å²	137.6	76%	0.759	77%	0.767	S	S	*	*			cis	-159.9	-164.4	0.7	-128.8	-47.1	0	0	0	107.8
412	L	34.1	Very low	31.1	Very low	149 Å²	149	144.7 Å²	144.7	78%	0.78	78%	0.78	S	S	*	*			cis	-152.6	-144.9	8.1	-137.1	179.7	0	0	0	111.6
413	Q	31.5	Very low	31	Very low	160 Å²	160	143.2 Å²	143.2	75%	0.748	78%	0.783	S	S	*	*			trans	-150.7	-172.6	-173.8	-119.6	-157.5	24.2	0	0	110.3
414	P	48.6	Very low	31	Very low	98 Å²	98	138.8 Å²	138.8	64%	0.636	78%	0.784	S	S	*	*			cis	-144.5	-175.3	16	44.5	-24.2	0	0	0	119.3
415	Q	30.7	Very low	31.3	Very low	143 Å²	143	146.6 Å²	146.6	67%	0.668	80%	0.798	S	S	*	*			trans	89.9	121	148.1	-71.3	-41	-79.5	0	0	125.1
416	L	29.2	Very low	31.4	Very low	137 Å²	137	143.8 Å²	143.8	72%	0.717	80%	0.801	S	S	*	*			trans	84.1	88.2	135.9	-63.3	172.5	0	0	0	125
417	S	27.8	Very low	31.7	Very low	104 Å²	104	151 Å²	151	73%	0.727	81%	0.813	S	S	*	*				80.9	137.2	104.9	-73	0	0	0	0	124.9
418	R	28.4	Very low	31.7	Very low	248 Å²	248	149 Å²	149	94%	0.936	81%	0.809	S	S	*	*			trans	71.4	140.2	168.6	-63.8	-174.2	176.6	-162.9	0.4	117.1
419	R	26.8	Very low	32	Very low	251 Å²	251	147.4 Å²	147.4	95%	0.947	80%	0.804	S	S	*	*			cis	141.7	107.1	-19.6	175.3	-177.8	-178	-169.5	1.4	109
420	G	27.7	Very low	32.2	Very low	75 Å²	75	146.6 Å²	146.6	77%	0.773	79%	0.791	S	S	*	*			trans	143.8	142.9	172.1	0	0	0	0	0	111.5
421	Q	33.4	Very low	32.2	Very low	198 Å²	198	152.5 Å²	152.5	93%	0.925	80%	0.799	S	S	*	*			cis	-152.5	163.1	-7.4	-158	172.7	20.5	0	0	110
422	K	30.9	Very low	32.1	Very low	211 Å²	211	151.6 Å²	151.6	92%	0.917	79%	0.794	S	S	*	*			trans	-76.5	156.3	176.7	-68.8	179.3	174.8	-179.3	0	112
423	G	28.7	Very low	32	Very low	84 Å²	84	154.6 Å²	154.6	87%	0.866	80%	0.795	S	S	*	*			trans	-161.8	91.7	165	0	0	0	0	0	113
424	G	29.2	Very low	31.9	Very low	79 Å²	79	150.8 Å²	150.8	81%	0.814	80%	0.798	S	S	*	*			trans	-96.7	166	177.8	0	0	0	0	0	113.5
425	R	33.6	Very low	30.9	Very low	263 Å²	263	157.9 Å²	157.9	99%	0.992	81%	0.812	S	S	*	*			trans	-70.3	142.4	173.7	-61.5	175.9	178.2	177.2	-1.5	111.1
426	G	30.8	Very low	30.7	Very low	79 Å²	79	154.2 Å²	154.2	81%	0.814	81%	0.812	S	S	*	*			trans	-173.8	138.4	168	0	0	0	0	0	113
427	R	35.4	Very low	30.7	Very low	254 Å²	254	154.7 Å²	154.7	96%	0.958	81%	0.811	S	S	*	*			trans	-100.6	159	162	-75.3	179.6	170.4	176.8	-4.7	108.4
428	G	30.8	Very low	30.6	Very low	64 Å²	64	160.2 Å²	160.2	66%	0.66	82%	0.816	S	S	*	*			trans	-72.6	-180	172.4	0	0	0	0	0	114.3
429	N	35.5	Very low	30.5	Very low	150 Å²	150	152 Å²	152	80%	0.802	81%	0.808	S	S	*	*			cis	-146.8	165.6	7.4	-115.2	47.3	0	0	0	112.5
430	D	33.6	Very low	30.6	Very low	93 Å²	93	151.7 Å²	151.7	50%	0.497	81%	0.807	S	S	.	*			trans	29.7	120.7	159.7	-65.4	-72.4	0	0	0	124.3
431	R	37	Very low	30.6	Very low	220 Å²	220	155.6 Å²	155.6	83%	0.83	81%	0.81	S	S	*	*				62.4	148.4	127.4	-57.1	175.4	-146.6	-164.7	7.1	119.9
432	D	30.4	Very low	30.3	Very low	123 Å²	123	154.3 Å²	154.3	66%	0.658	81%	0.806	S	S	*	*			cis	-131.2	-151.2	12.3	-163	42.6	0	0	0	114.1
433	R	31.8	Very low	30	Very low	213 Å²	213	150.5 Å²	150.5	80%	0.804	80%	0.796	S	S	*	*			trans	-104.6	158	-153.2	-65.4	158.8	175.1	101.3	-16.9	115.9
434	G	30	Very low	30	Very low	79 Å²	79	153.6 Å²	153.6	81%	0.814	79%	0.793	S	S	*	*			trans	126.4	129.7	159	0	0	0	0	0	113.8
435	R	27.5	Very low	30.1	Very low	248 Å²	248	154.5 Å²	154.5	94%	0.936	79%	0.787	S	S	*	*			cis	154.8	110.4	-21.7	173.2	-176.8	-176.9	-166.4	1.5	105.2
436	G	27.1	Very low	29.7	Very low	65 Å²	65	149.8 Å²	149.8	67%	0.67	78%	0.781	S	S	*	*			trans	147.8	125.2	177.5	0	0	0	0	0	109.2
437	E	28.3	Very low	29.4	Very low	148 Å²	148	149.7 Å²	149.7	69%	0.692	77%	0.773	S	S	*	*			cis	67.8	129.8	49.5	-69.3	-159.3	78.8	0	0	113.6
438	R	26.9	Very low	29.1	Very low	219 Å²	219	143.7 Å²	143.7	83%	0.826	76%	0.764	S	S	*	*			cis	-161.8	122.6	-1.8	-144.8	-176.8	-170.4	135.6	1.7	113.6
439	G	26.3	Very low	29	Very low	75 Å²	75	147.4 Å²	147.4	77%	0.773	77%	0.774	S	S	*	*			trans	59.4	-172	134	0	0	0	0	0	123.2
440	R	27.1	Very low	28.8	Very low	246 Å²	246	144 Å²	144	93%	0.928	78%	0.775	S	S	*	*			trans	84.6	115.6	173.1	-61.3	-173.8	174.4	-179.5	-1.2	119
441	N	27.5	Very low	28.8	Very low	157 Å²	157	149.5 Å²	149.5	84%	0.84	79%	0.794	S	S	*	*			trans	-21	152.9	139.8	-45.2	-2.6	0	0	0	113.1
442	M	27	Very low	28.5	Very low	170 Å²	170	148.2 Å²	148.2	84%	0.837	80%	0.795	S	S	*	*				-175.1	154.9	64.2	178.7	158.2	162.2	0	0	111.4
443	D	25.9	Very low	28.8	Very low	131 Å²	131	153.9 Å²	153.9	70%	0.701	81%	0.807	S	S	*	*			trans	36.2	122.7	151.8	-157.1	30.4	0	0	0	121.4
444	D	27.3	Very low	29.3	Very low	150 Å²	150	154 Å²	154	80%	0.802	81%	0.813	S	S	*	*				-166.6	166	110	-161.6	4.2	0	0	0	109.8
445	S	31.6	Very low	29.3	Very low	98 Å²	98	153.8 Å²	153.8	69%	0.685	81%	0.81	S	S	*	*			trans	-102.2	176.3	-179.4	-65.6	0	0	0	0	113.5
446	N	25.1	Very low	29.6	Very low	163 Å²	163	145.9 Å²	145.9	87%	0.872	81%	0.806	S	S	*	*			trans	113.5	154	150.1	-156.4	11.8	0	0	0	117
447	A	26.3	Very low	29.8	Very low	78 Å²	78	148.5 Å²	148.5	65%	0.645	81%	0.814	S	S	*	*			trans	67.7	134.9	178.1	0	0	0	0	0	117.2
448	T	28.1	Very low	30.2	Very low	127 Å²	127	145.5 Å²	145.5	78%	0.779	82%	0.815	S	S	*	*			cis	-159.6	154.6	-11.6	11.9	0	0	0	0	111.1
449	V	29.2	Very low	31.1	Very low	143 Å²	143	138.9 Å²	138.9	87%	0.867	82%	0.815	S	S	*	*			trans	30.4	117.8	144.3	-177.2	0	0	0	0	119.4
450	G	30	Very low	31.6	Very low	79 Å²	79	143.4 Å²	143.4	81%	0.814	82%	0.818	S	S	*	*			trans	-163.6	88.4	167.2	0	0	0	0	0	115.6
451	K	34.1	Very low	32.5	Very low	208 Å²	208	138.7 Å²	138.7	90%	0.904	81%	0.811	S	S	*	*			trans	-82.3	125	173.6	-88.5	176.7	177.5	169.1	0	112.1
452	K	31.2	Very low	33.4	Very low	193 Å²	193	140.2 Å²	140.2	84%	0.839	81%	0.811	S	S	*	*			trans	12.6	116.3	136.8	179.5	-174.3	-175.8	173.8	0	116.3
453	R	36.7	Very low	34.7	Very low	242 Å²	242	139.4 Å²	139.4	91%	0.913	80%	0.804	S	S	*	*				-163.9	132.9	125	-111.2	158.7	-176.2	175.6	0.1	115.3
454	K	42.2	Very low	36.7	Very low	216 Å²	216	135.9 Å²	135.9	94%	0.939	79%	0.786	S	S	*	*			trans	-82	119.4	161.3	176.5	178.2	179.1	177.2	0	107.8
455	G	29.3	Very low	38.5	Very low	73 Å²	73	134.2 Å²	134.2	75%	0.753	78%	0.783	S	S	*	*			trans	-142.7	148.6	165	0	0	0	0	0	106.8
456	G	35	Very low	40.3	Very low	83 Å²	83	133.6 Å²	133.6	86%	0.856	77%	0.772	S	S	*	*			cis	100.3	50.7	29.5	0	0	0	0	0	109.2
457	S	31.3	Very low	42.6	Very low	120 Å²	120	132.7 Å²	132.7	84%	0.839	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-78	125.5	-173.9	-163.7	0	0	0	0	110.6
458	A	36.5	Very low	44.6	Very low	84 Å²	84	133.3 Å²	133.3	69%	0.694	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-67.4	167.7	157.1	0	0	0	0	0	110.3	M460	A458-M460 PolarHBondContact O-N 3.31Å
459	G	45.3	Very low	46.9	Very low	80 Å²	80	129.4 Å²	129.4	83%	0.825	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-67.7	125.5	175.9	0	0	0	0	0	112.3
460	M	36.5	Very low	49.3	Very low	171 Å²	171	128.1 Å²	128.1	84%	0.842	71%	0.709	S	S	*	*			trans	-141.4	110.5	162.8	-92.5	-79.9	-154.1	0	0	104.8	A458 F462	A458-M460 PolarHBondContact O-N 3.31Å; M460-F462 VanDerWaalsContact C-N 3.29Å; M460-F462 PolarHBondContact O-N 3.03Å
461	D	47.3	Very low	51.6	Low	146 Å²	146	130.6 Å²	130.6	78%	0.781	70%	0.698	S	S	*	*			trans	-73	84.1	-178.4	-94.7	-73.6	0	0	0	110.8	H463 R467	D461-H463 PolarHBondContact O-N 3.14Å; D461-H463 VanDerWaalsContact O-N 3.13Å; D461-R467 IonicContact OD1-NH1 3.66Å
462	F	45.5	Very low	53.5	Low	190 Å²	190	126.9 Å²	126.9	83%	0.833	68%	0.684	S	S	*	*			trans	-70.8	108	174.9	-146.1	-87	0	0	0	109.2	M460 D464	M460-F462 VanDerWaalsContact C-N 3.29Å; M460-F462 PolarHBondContact O-N 3.03Å; F462-D464 PolarHBondContact O-N 3.03Å
463	H	53.7	Low	55.5	Low	153 Å²	153	121.2 Å²	121.2	71%	0.708	67%	0.668	S	S	*	*			trans	-71.2	89.5	-177.8	-173.4	79.8	0	0	0	110.8	D461 P465	D461-H463 PolarHBondContact O-N 3.14Å; D461-H463 VanDerWaalsContact O-N 3.13Å; H463-P465 WeakPolarHBondContact O-CD 3.36Å
464	D	67.5	Low	57.2	Low	57 Å²	57	118.8 Å²	118.8	31%	0.305	66%	0.659	S	S	.	*			trans	-63.7	108.8	166.2	170.6	13.4	0	0	0	108.9	F462 N466 R467 K470	F462-D464 PolarHBondContact O-N 3.03Å; D464-N466 PolarHBondContact O-N 3.1Å; D464-N466 WeakPolarHBondContact OD1-CA 3.22Å; D464-N466 WeakPolarHBondContact OD1-CB 3.43Å; D464-N466 PolarHBondContact OD1-N 3.28Å; D464-R467 HydrophobicContact CB-CB 4.23Å; D464-R467 WeakPolarHBondContact O-CB 3.43Å; D464-R467 PolarHBondContact O-N 3.07Å; D464-K470 IonicContact OD1-NZ 2.68Å; D464-K470 IonicContact OD2-NZ 2.73Å; D464-K470 PolarHBondContact OD2-NZ 2.92Å
465	P	65.5	Low	58.5	Low	115 Å²	115	111.3 Å²	111.3	75%	0.747	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-10.5	-177.2	30.2	-36.4	0	0	0	112.3	H463	H463-P465 WeakPolarHBondContact O-CD 3.36Å
466	N	69.6	Low	60.3	Low	85 Å²	85	110.1 Å²	110.1	46%	0.455	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.8	0.3	176.5	-142.2	-53.6	0	0	0	112	D464 A469 K470	D464-N466 PolarHBondContact O-N 3.1Å; D464-N466 WeakPolarHBondContact OD1-CA 3.22Å; D464-N466 WeakPolarHBondContact OD1-CB 3.43Å; D464-N466 PolarHBondContact OD1-N 3.28Å; N466-A469 PolarHBondContact O-N 3.18Å; N466-K470 WeakPolarHBondContact O-CB 3.32Å; N466-K470 WeakPolarHBondContact O-CD 3.45Å; N466-K470 WeakPolarHBondContact O-CG 3.31Å; N466-K470 PolarHBondContact O-N 3.4Å
467	R	73.8	Confident	61.6	Low	144 Å²	144	116.1 Å²	116.1	54%	0.543	62%	0.617	S	S	.	*	H	α-helix	trans	-60.5	-46.5	179.6	-172.3	173.4	-176	171.6	-2.3	111.8	D461 D464 K470 K471	D461-R467 IonicContact OD1-NH1 3.66Å; D464-R467 HydrophobicContact CB-CB 4.23Å; D464-R467 WeakPolarHBondContact O-CB 3.43Å; D464-R467 PolarHBondContact O-N 3.07Å; R467-K470 PolarHBondContact O-N 3.32Å; R467-K471 WeakPolarHBondContact O-CB 3.4Å; R467-K471 PolarHBondContact O-N 2.93Å
468	E	69.4	Low	62.9	Low	90 Å²	90	118 Å²	118	42%	0.421	61%	0.61	S	S	.	*	H	α-helix	trans	-70.5	-38.1	179.2	-123.1	52.7	-148.3	0	0	111.9	K471 Q472	E468-K471 WeakPolarHBondContact O-CB 3.42Å; E468-K471 PolarHBondContact O-N 3.33Å; E468-K471 VanDerWaalsContact OE1-CD 3.27Å; E468-K471 WeakPolarHBondContact OE1-CD 3.34Å; E468-K471 WeakPolarHBondContact OE1-CE 3.27Å; E468-K471 IonicContact OE1-NZ 3.85Å; E468-K471 PolarHBondContact OE1-NZ 3.1Å; E468-Q472 WeakPolarHBondContact O-CB 3.33Å; E468-Q472 VanDerWaalsContact O-CG 3.29Å; E468-Q472 WeakPolarHBondContact O-CG 3.49Å; E468-Q472 PolarHBondContact O-N 2.62Å
469	A	74.4	Confident	63.7	Low	46 Å²	46	120.8 Å²	120.8	38%	0.38	61%	0.609	S	S	.	*	H	α-helix	trans	-65.7	-39.2	173.8	0	0	0	0	0	112.6	N466 Q472 S473	N466-A469 PolarHBondContact O-N 3.18Å; A469-Q472 PolarHBondContact O-N 3.42Å; A469-S473 VanDerWaalsContact O-CB 3.23Å; A469-S473 WeakPolarHBondContact O-CB 3.43Å; A469-S473 PolarHBondContact O-N 3.05Å
470	K	80.5	Confident	63.9	Low	115 Å²	115	126.4 Å²	126.4	50%	0.5	61%	0.611	S	S	.	*	H	α-helix	trans	-64	-39.8	172.4	-71.6	160.8	-170.5	167.1	0	111.8	D464 N466 R467 R474	D464-K470 IonicContact OD1-NZ 2.68Å; D464-K470 IonicContact OD2-NZ 2.73Å; D464-K470 PolarHBondContact OD2-NZ 2.92Å; N466-K470 WeakPolarHBondContact O-CB 3.32Å; N466-K470 WeakPolarHBondContact O-CD 3.45Å; N466-K470 WeakPolarHBondContact O-CG 3.31Å; N466-K470 PolarHBondContact O-N 3.4Å; R467-K470 PolarHBondContact O-N 3.32Å; K470-R474 WeakPolarHBondContact O-CB 3.32Å; K470-R474 PolarHBondContact O-N 3.16Å
471	K	77.4	Confident	64.8	Low	132 Å²	132	126.7 Å²	126.7	57%	0.574	61%	0.61	S	S	*	*	H	α-helix	trans	-66.6	-46.5	175.9	179.5	-178.8	166.8	-168.4	0	111.5	R467 E468 R474 A475	R467-K471 WeakPolarHBondContact O-CB 3.4Å; R467-K471 PolarHBondContact O-N 2.93Å; E468-K471 WeakPolarHBondContact O-CB 3.42Å; E468-K471 PolarHBondContact O-N 3.33Å; E468-K471 VanDerWaalsContact OE1-CD 3.27Å; E468-K471 WeakPolarHBondContact OE1-CD 3.34Å; E468-K471 WeakPolarHBondContact OE1-CE 3.27Å; E468-K471 IonicContact OE1-NZ 3.85Å; E468-K471 PolarHBondContact OE1-NZ 3.1Å; K471-R474 PolarHBondContact O-N 2.95Å; K471-A475 PolarHBondContact O-N 3.17Å
472	Q	74.1	Confident	64.7	Low	130 Å²	130	126.2 Å²	126.2	61%	0.607	61%	0.607	S	S	*	*	H	α-helix	trans	-64	-42.1	174.2	-72.8	174.2	4.1	0	0	112.1	E468 A469 R474 A475 A476	E468-Q472 WeakPolarHBondContact O-CB 3.33Å; E468-Q472 VanDerWaalsContact O-CG 3.29Å; E468-Q472 WeakPolarHBondContact O-CG 3.49Å; E468-Q472 PolarHBondContact O-N 2.62Å; A469-Q472 PolarHBondContact O-N 3.42Å; Q472-R474 VanDerWaalsContact C-N 3.29Å; Q472-R474 PolarHBondContact O-N 2.75Å; Q472-A475 CarbonylContact O-C 3.59Å; Q472-A475 PolarHBondContact O-N 3.24Å; Q472-A475 VanDerWaalsContact O-N 3.11Å; Q472-A476 WeakPolarHBondContact O-CB 3.09Å; Q472-A476 PolarHBondContact O-N 3Å
473	S	74.8	Confident	64.8	Low	73 Å²	73	127 Å²	127	51%	0.51	60%	0.604	S	S	.	*	H	α-helix	trans	-63.8	-33.8	175.1	-171.1	0	0	0	0	112.3	A469 R477	A469-S473 VanDerWaalsContact O-CB 3.23Å; A469-S473 WeakPolarHBondContact O-CB 3.43Å; A469-S473 PolarHBondContact O-N 3.05Å; S473-R477 PolarHBondContact O-N 2.98Å
474	R	72.6	Confident	64.4	Low	192 Å²	192	125.4 Å²	125.4	73%	0.725	61%	0.61	S	S	*	*	H	α-helix	trans	-69.4	-36.4	171.2	-169.5	178.3	-70.2	-156.8	-1.3	112.3	K470 K471 Q472	K470-R474 WeakPolarHBondContact O-CB 3.32Å; K470-R474 PolarHBondContact O-N 3.16Å; K471-R474 PolarHBondContact O-N 2.95Å; Q472-R474 VanDerWaalsContact C-N 3.29Å; Q472-R474 PolarHBondContact O-N 2.75Å
475	A	68.2	Low	63.2	Low	59 Å²	59	129.6 Å²	129.6	49%	0.488	63%	0.628	S	S	.	*	H	α-helix	trans	-71.6	-41.3	174.9	0	0	0	0	0	112.9	K471 Q472 R477 F478 Q479	K471-A475 PolarHBondContact O-N 3.17Å; Q472-A475 CarbonylContact O-C 3.59Å; Q472-A475 PolarHBondContact O-N 3.24Å; Q472-A475 VanDerWaalsContact O-N 3.11Å; A475-R477 PolarHBondContact O-N 2.9Å; A475-F478 WeakPolarHBondContact O-CB 3.44Å; A475-F478 PolarHBondContact O-N 2.64Å; A475-Q479 PolarHBondContact O-N 3.27Å
476	A	68.1	Low	62	Low	47 Å²	47	129 Å²	129	39%	0.388	62%	0.624	S	S	.	*	H	α-helix	trans	-60.6	-27.2	178.6	0	0	0	0	0	113	Q472 F478 Q479 K480	Q472-A476 WeakPolarHBondContact O-CB 3.09Å; Q472-A476 PolarHBondContact O-N 3Å; A476-F478 VanDerWaalsContact C-N 3.28Å; A476-F478 PolarHBondContact O-N 3.12Å; A476-Q479 PolarHBondContact O-N 3.35Å; A476-K480 PolarHBondContact O-N 2.72Å
477	R	62.3	Low	60.5	Low	209 Å²	209	131.8 Å²	131.8	79%	0.789	64%	0.638	S	S	*	*	H	α-helix	trans	-63.7	-29.1	171.1	-76.6	175.7	170.8	-119.2	-2.2	113.6	S473 A475	S473-R477 PolarHBondContact O-N 2.98Å; A475-R477 PolarHBondContact O-N 2.9Å
478	F	57.3	Low	58.8	Low	160 Å²	160	130.7 Å²	130.7	70%	0.702	65%	0.647	S	S	*	*	H	α-helix	trans	-84.8	-36.2	170.3	-74.5	-90.7	0	0	0	111.7	A475 A476 K480 Q481	A475-F478 WeakPolarHBondContact O-CB 3.44Å; A475-F478 PolarHBondContact O-N 2.64Å; A476-F478 VanDerWaalsContact C-N 3.28Å; A476-F478 PolarHBondContact O-N 3.12Å; F478-K480 VanDerWaalsContact C-N 3.3Å; F478-K480 PolarHBondContact O-N 3.26Å; F478-Q481 PolarHBondContact O-N 3.03Å
479	Q	54.4	Low	57.3	Low	142 Å²	142	132.6 Å²	132.6	66%	0.664	66%	0.66	S	S	*	*	H	α-helix	trans	-62.2	-32.2	-176.1	-163.6	176	10.6	0	0	113.7	A475 A476 Q481 L482	A475-Q479 PolarHBondContact O-N 3.27Å; A476-Q479 PolarHBondContact O-N 3.35Å; Q479-Q481 PolarHBondContact O-N 3.18Å; Q479-Q481 VanDerWaalsContact O-N 3.12Å; Q479-L482 HydrophobicContact CG-CD1 4.45Å
480	K	49.8	Very low	55.4	Low	198 Å²	198	134.5 Å²	134.5	86%	0.861	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	0.6	-179.5	-147.9	-175.4	179.2	-176.7	0	114.6	A476 F478	A476-K480 PolarHBondContact O-N 2.72Å; F478-K480 VanDerWaalsContact C-N 3.3Å; F478-K480 PolarHBondContact O-N 3.26Å
481	Q	53.8	Low	53.6	Low	178 Å²	178	136.2 Å²	136.2	83%	0.832	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.1	23.1	-179.2	-146.8	156.7	-9.5	0	0	113.7	F478 Q479 R483	F478-Q481 PolarHBondContact O-N 3.03Å; Q479-Q481 PolarHBondContact O-N 3.18Å; Q479-Q481 VanDerWaalsContact O-N 3.12Å; Q481-R483 PolarHBondContact O-N 3.44Å
482	L	46.1	Very low	51.6	Low	136 Å²	136	137 Å²	137	71%	0.712	69%	0.694	S	S	*	*			trans	-71.9	121	166.3	-71.3	169.9	0	0	0	109.7	Q479	Q479-L482 HydrophobicContact CG-CD1 4.45Å
483	R	47	Very low	50	Low	207 Å²	207	135.5 Å²	135.5	78%	0.781	70%	0.697	S	S	*	*			trans	-65.6	145.1	164.7	-75.6	178.7	158.3	98.8	-5.7	109	Q481 E485	Q481-R483 PolarHBondContact O-N 3.44Å; R483-E485 VanDerWaalsContact C-N 3.28Å; R483-E485 PolarHBondContact O-N 3.39Å
484	S	45.8	Very low	48	Very low	119 Å²	119	139.6 Å²	139.6	83%	0.832	71%	0.713	S	S	*	*	S	Bend	trans	-75.4	-15.5	178.3	51.6	0	0	0	0	113.9
485	E	43.4	Very low	46.4	Very low	144 Å²	144	138.2 Å²	138.2	67%	0.673	72%	0.72	S	S	*	*	S	Bend	trans	-97.6	132.8	174.6	-68.8	-55.9	139	0	0	111	R483 L487	R483-E485 VanDerWaalsContact C-N 3.28Å; R483-E485 PolarHBondContact O-N 3.39Å; E485-L487 PolarHBondContact O-N 3.23Å
486	P	38.6	Very low	44.9	Very low	103 Å²	103	141.8 Å²	141.8	67%	0.669	73%	0.73	S	S	*	*			trans	-70.6	127.3	171.3	30	-32.4	0	0	0	109.9	V488	P486-V488 VanDerWaalsContact C-N 3.26Å; P486-V488 PolarHBondContact O-N 3.1Å
487	L	39.8	Very low	43.4	Very low	143 Å²	143	145.5 Å²	145.5	75%	0.749	75%	0.75	S	S	*	*			trans	-72.5	79.7	174.8	-79.8	169.7	0	0	0	111.2	E485 L489	E485-L487 PolarHBondContact O-N 3.23Å; L487-L489 PolarHBondContact O-N 3.16Å
488	V	37.9	Very low	42.2	Very low	122 Å²	122	143.4 Å²	143.4	74%	0.739	75%	0.754	S	S	*	*			trans	-72.6	99.4	158.3	-179	0	0	0	0	107.2	P486 S490	P486-V488 VanDerWaalsContact C-N 3.26Å; P486-V488 PolarHBondContact O-N 3.1Å; V488-S490 VanDerWaalsContact C-N 3.28Å; V488-S490 PolarHBondContact O-N 3.01Å
489	L	36.2	Very low	41.4	Very low	130 Å²	130	138.8 Å²	138.8	68%	0.681	75%	0.752	S	S	*	*			trans	-70	89.5	167.2	-69.7	176.1	0	0	0	108.6	L487 I491	L487-L489 PolarHBondContact O-N 3.16Å; L489-I491 PolarHBondContact O-N 2.85Å
490	S	35.3	Very low	40.5	Very low	86 Å²	86	138.3 Å²	138.3	60%	0.601	76%	0.759	S	S	*	*			trans	-71.1	97.9	171.1	-170	0	0	0	0	109.2	V488 N492	V488-S490 VanDerWaalsContact C-N 3.28Å; V488-S490 PolarHBondContact O-N 3.01Å; S490-N492 PolarHBondContact O-N 3.45Å
491	I	42.3	Very low	40	Very low	151 Å²	151	138.6 Å²	138.6	77%	0.774	76%	0.763	S	S	*	*			trans	-74.4	-14.9	177.4	-72.7	172.9	0	0	0	111.6	L489	L489-I491 PolarHBondContact O-N 2.85Å
492	N	35.5	Very low	39.2	Very low	149 Å²	149	138.2 Å²	138.2	80%	0.797	76%	0.762	S	S	*	*	S	Bend	trans	-112.7	59.6	-173.3	-64.9	19.8	0	0	0	112.3	S490	S490-N492 PolarHBondContact O-N 3.45Å
493	S	40.4	Very low	38.7	Very low	97 Å²	97	136.4 Å²	136.4	68%	0.678	76%	0.761	S	S	*	*			trans	-157.3	45.2	170.5	-167.6	0	0	0	0	114.2
494	L	33.4	Very low	38.3	Very low	159 Å²	159	133.3 Å²	133.3	83%	0.832	76%	0.759	S	S	*	*			trans	-111.8	96.6	155.3	-77.6	178.7	0	0	0	108	L496	L494-L496 HydrophobicContact CB-CD1 4.22Å; L494-L496 HydrophobicContact CD2-CD1 4.45Å; L494-L496 PolarHBondContact O-N 3.13Å
495	D	37.8	Very low	38	Very low	164 Å²	164	129.2 Å²	129.2	88%	0.877	73%	0.73	S	S	*	*			trans	-85.8	102.7	173.1	-148.6	9.5	0	0	0	107
496	L	37	Very low	38.1	Very low	133 Å²	133	133.2 Å²	133.2	70%	0.696	74%	0.739	S	S	*	*			trans	-127.5	142.4	169.9	-84.6	93.4	0	0	0	108.5	L494	L494-L496 HydrophobicContact CB-CD1 4.22Å; L494-L496 HydrophobicContact CD2-CD1 4.45Å; L494-L496 PolarHBondContact O-N 3.13Å
497	P	37.6	Very low	38.5	Very low	125 Å²	125	136.3 Å²	136.3	81%	0.812	75%	0.745	S	S	*	*			trans	-74.1	141.9	-165	28.6	-35.5	0	0	0	114.1
498	D	36.5	Very low	38.7	Very low	165 Å²	165	134.2 Å²	134.2	88%	0.882	73%	0.734	S	S	*	*			trans	0.9	126.5	149	-158.3	44.7	0	0	0	117.9
499	G	40.9	Very low	39.3	Very low	63 Å²	63	133.4 Å²	133.4	65%	0.649	73%	0.733	S	S	*	*			cis	176.9	109.9	-2.1	0	0	0	0	0	114.2
500	T	34.9	Very low	40.4	Very low	133 Å²	133	130.6 Å²	130.6	82%	0.816	72%	0.723	S	S	*	*			trans	-133.4	104	163.6	47.3	0	0	0	0	108.6	E502	T500-E502 PolarHBondContact O-N 3.38Å
501	Q	39.1	Very low	41.7	Very low	203 Å²	203	130.1 Å²	130.1	95%	0.949	71%	0.712	S	S	*	*			trans	-80.5	56.6	-174.7	-160.8	-175.4	13.6	0	0	112.3	S503	Q501-S503 PolarHBondContact O-N 3.01Å
502	E	37	Very low	43.1	Very low	170 Å²	170	127.6 Å²	127.6	79%	0.794	70%	0.704	S	S	*	*			trans	-71.8	107	158.8	-74.1	-167.8	155.4	0	0	108.1	T500 L504	T500-E502 PolarHBondContact O-N 3.38Å; E502-L504 VanDerWaalsContact C-N 3.26Å; E502-L504 PolarHBondContact O-N 3.25Å
503	S	36.3	Very low	45	Very low	99 Å²	99	120.6 Å²	120.6	69%	0.692	67%	0.667	S	S	*	*			trans	-63.2	90.8	165	163.9	0	0	0	0	108.1	Q501 S505	Q501-S503 PolarHBondContact O-N 3.01Å; S503-S505 VanDerWaalsContact C-N 3.31Å; S503-S505 PolarHBondContact O-N 3.27Å
504	L	38.6	Very low	47	Very low	142 Å²	142	119.7 Å²	119.7	74%	0.743	66%	0.66	S	S	*	*			trans	-53.5	96.8	167.3	-72.8	173.7	0	0	0	108.6	E502	E502-L504 VanDerWaalsContact C-N 3.26Å; E502-L504 PolarHBondContact O-N 3.25Å
505	S	39.3	Very low	49.3	Very low	32 Å²	32	112.6 Å²	112.6	22%	0.224	62%	0.624	C	S	.	*			trans	-75.5	156.6	177.2	78.3	0	0	0	0	108.4	S503 E507 D508	S503-S505 VanDerWaalsContact C-N 3.31Å; S503-S505 PolarHBondContact O-N 3.27Å; S505-E507 PolarHBondContact O-N 3.35Å; S505-E507 VanDerWaalsContact O-N 3.07Å; S505-E507 WeakPolarHBondContact OG-CA 3.27Å; S505-E507 VanDerWaalsContact OG-CB 3.3Å; S505-E507 WeakPolarHBondContact OG-CB 3.46Å; S505-E507 PolarHBondContact OG-N 3.19Å; S505-E507 VanDerWaalsContact OG-N 3.1Å; S505-D508 WeakPolarHBondContact CA-OD2 3.43Å; S505-D508 WeakPolarHBondContact CB-OD2 3.34Å; S505-D508 PolarHBondContact N-OD2 3.19Å; S505-D508 PolarHBondContact O-N 3.45Å; S505-D508 VanDerWaalsContact O-N 3.14Å; S505-D508 PolarHBondContact OG-N 3.4Å; S505-D508 VanDerWaalsContact OG-N 3.14Å; S505-D508 PolarHBondContact OG-OD2 2.95Å
506	W	45.2	Very low	51.5	Low	228 Å²	228	112.6 Å²	112.6	86%	0.864	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	4	169.7	-60.7	86.8	0	0	0	112.1
507	E	47.3	Very low	53.8	Low	168 Å²	168	111 Å²	111	79%	0.785	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-20.2	174.6	-40.9	-176.7	132.5	0	0	111	S505 P510	S505-E507 PolarHBondContact O-N 3.35Å; S505-E507 VanDerWaalsContact O-N 3.07Å; S505-E507 WeakPolarHBondContact OG-CA 3.27Å; S505-E507 VanDerWaalsContact OG-CB 3.3Å; S505-E507 WeakPolarHBondContact OG-CB 3.46Å; S505-E507 PolarHBondContact OG-N 3.19Å; S505-E507 VanDerWaalsContact OG-N 3.1Å; E507-P510 WeakPolarHBondContact O-CD 3.2Å
508	D	43.3	Very low	56.1	Low	99 Å²	99	109.2 Å²	109.2	53%	0.529	59%	0.594	S	S	.	*	S	Bend	trans	-85	-7.5	-179.5	-62.1	-55.5	0	0	0	114.2	S505 P510	S505-D508 WeakPolarHBondContact CA-OD2 3.43Å; S505-D508 WeakPolarHBondContact CB-OD2 3.34Å; S505-D508 PolarHBondContact N-OD2 3.19Å; S505-D508 PolarHBondContact O-N 3.45Å; S505-D508 VanDerWaalsContact O-N 3.14Å; S505-D508 PolarHBondContact OG-N 3.4Å; S505-D508 VanDerWaalsContact OG-N 3.14Å; S505-D508 PolarHBondContact OG-OD2 2.95Å; D508-P510 WeakPolarHBondContact O-CD 3.21Å
509	C	50.3	Low	58.4	Low	105 Å²	105	104.7 Å²	104.7	71%	0.709	57%	0.572	S	S	*	*			trans	-119	60	171.6	-79.6	0	0	0	0	111.7	I511	C509-I511 PolarHBondContact O-N 3.45Å
510	P	59.6	Low	60.6	Low	72 Å²	72	103.1 Å²	103.1	47%	0.468	55%	0.547	S	S	.	.			trans	-62.1	128.6	168.1	29.6	-32.2	0	0	0	108	E507 D508 V512	E507-P510 WeakPolarHBondContact O-CD 3.2Å; D508-P510 WeakPolarHBondContact O-CD 3.21Å; P510-V512 VanDerWaalsContact C-N 3.28Å; P510-V512 HydrophobicContact CG-CG2 4.24Å; P510-V512 PolarHBondContact O-N 2.83Å
511	I	64	Low	63	Low	76 Å²	76	101 Å²	101	39%	0.39	54%	0.536	S	S	.	.			trans	-66.9	93	170.7	-64.8	172.2	0	0	0	106.7	C509 G513 P531 Q574	C509-I511 PolarHBondContact O-N 3.45Å; I511-G513 PolarHBondContact O-N 3.18Å; I511-P531 HydrophobicContact CG2-CB 4.19Å; I511-P531 HydrophobicContact CG2-CG 3.94Å; I511-Q574 WeakPolarHBondContact O-CG 3.39Å
512	V	71.6	Confident	65.2	Low	98 Å²	98	95.3 Å²	95.3	59%	0.594	51%	0.506	S	S	*	.			trans	-78.2	114.9	176.2	-178	0	0	0	0	108.1	P510 P536	P510-V512 VanDerWaalsContact C-N 3.28Å; P510-V512 HydrophobicContact CG-CG2 4.24Å; P510-V512 PolarHBondContact O-N 2.83Å; V512-P536 HydrophobicContact CG1-CB 4.47Å
513	G	75.4	Confident	67.3	Low	2 Å²	2	92.3 Å²	92.3	2%	0.021	50%	0.495	C	S	.	.			trans	-66.2	144.6	177.9	0	0	0	0	0	112.6	I511 P531 V534 P536 Q574	I511-G513 PolarHBondContact O-N 3.18Å; G513-P531 WeakPolarHBondContact CA-O 3.2Å; G513-V534 CarbonylContact C-O 3.09Å; G513-V534 WeakPolarHBondContact CA-O 3.26Å; G513-P536 WeakPolarHBondContact O-CB 3.17Å; G513-P536 WeakPolarHBondContact O-CD 3.48Å; G513-P536 VanDerWaalsContact O-CG 3.28Å; G513-P536 WeakPolarHBondContact O-CG 3.29Å; G513-Q574 VanDerWaalsContact N-OE1 3.11Å
514	S	81.3	Confident	69.3	Low	77 Å²	77	95.3 Å²	95.3	54%	0.538	49%	0.491	S	S	.	.			trans	-112.6	-2.4	179.8	59.5	0	0	0	0	115.1	Q516 P531 S532 V534	S514-Q516 PolarHBondContact O-N 2.93Å; S514-P531 PolarHBondContact N-O 2.83Å; S514-S532 WeakPolarHBondContact OG-CA 3.48Å; S514-V534 PolarHBondContact N-O 3.3Å
515	C	82.8	Confident	71.2	Confident	10 Å²	10	89.8 Å²	89.8	7%	0.068	46%	0.462	C	S	.	.			trans	-61.3	125.3	175.2	173.7	0	0	0	0	111.1	D517 S532 V534 R535 P536	C515-D517 PolarHBondContact SG-OD2 3.4Å; C515-S532 WeakPolarHBondContact CB-O 3.43Å; C515-V534 WeakPolarHBondContact CB-O 3.43Å; C515-V534 PolarHBondContact N-O 3.31Å; C515-R535 HydrophobicContact CB-CG 3.82Å; C515-R535 VanDerWaalsContact SG-CG 3.53Å; C515-P536 WeakPolarHBondContact O-CD 3.35Å
516	Q	84.5	Confident	72.7	Confident	164 Å²	164	93.1 Å²	93.1	77%	0.766	48%	0.482	S	S	*	.			trans	-95.4	-1.8	178.2	-60.6	-163.6	18.1	0	0	114.1	S514 I518	S514-Q516 PolarHBondContact O-N 2.93Å; Q516-I518 PolarHBondContact O-N 3.44Å
517	D	85	Confident	73.8	Confident	101 Å²	101	85.5 Å²	85.5	54%	0.54	46%	0.462	S	S	.	.			trans	-65.9	128.4	-175.3	-57.2	-54.3	0	0	0	111.6	C515 T519 R535 V539	C515-D517 PolarHBondContact SG-OD2 3.4Å; D517-T519 VanDerWaalsContact C-N 3.29Å; D517-T519 PolarHBondContact O-N 3.49Å; D517-R535 WeakPolarHBondContact O-CD 3.26Å; D517-V539 WeakPolarHBondContact O-CG1 3.42Å
518	I	84.3	Confident	74.8	Confident	87 Å²	87	80.6 Å²	80.6	45%	0.446	45%	0.451	S	S	.	.	S	Bend	trans	-68.8	-34.9	179.9	-58.9	176.2	0	0	0	110.1	Q516 R535 S543 A546	Q516-I518 PolarHBondContact O-N 3.44Å; I518-R535 PolarHBondContact O-NH1 2.93Å; I518-S543 WeakPolarHBondContact O-CB 3.24Å; I518-S543 PolarHBondContact O-OG 3Å; I518-A546 HydrophobicContact CG2-CB 3.73Å
519	T	86.3	Confident	76	Confident	70 Å²	70	77.1 Å²	77.1	43%	0.429	43%	0.433	S	S	.	.			trans	-123.4	140.1	-177.3	58.9	0	0	0	0	109.6	D517 Y559	D517-T519 VanDerWaalsContact C-N 3.29Å; D517-T519 PolarHBondContact O-N 3.49Å; T519-Y559 WeakPolarHBondContact CG2-OH 3.19Å
520	K	86.9	Confident	77.1	Confident	29 Å²	29	76.3 Å²	76.3	13%	0.126	42%	0.422	C	S	.	.			trans	-152.9	128.7	-172.7	174.4	-170.8	160.9	-177.2	0	109.4	T533 Q563 S566 D570	K520-T533 WeakPolarHBondContact CE-O 3.37Å; K520-T533 PolarHBondContact NZ-O 3.19Å; K520-Q563 PolarHBondContact O-NE2 2.68Å; K520-Q563 VanDerWaalsContact O-NE2 3.08Å; K520-Q563 PolarHBondContact O-OE1 3.45Å; K520-S566 WeakPolarHBondContact O-CB 3.19Å; K520-S566 PolarHBondContact O-OG 3.49Å; K520-D570 IonicContact NZ-OD1 2.67Å; K520-D570 PolarHBondContact NZ-OD1 3.33Å; K520-D570 IonicContact NZ-OD2 3.64Å
521	P	84.6	Confident	77.8	Confident	89 Å²	89	75.6 Å²	75.6	58%	0.578	42%	0.417	S	S	*	.			trans	-62.8	154.6	178.1	27.7	-35.3	0	0	0	112	L523 E562	P521-L523 PolarHBondContact O-N 3.31Å; P521-E562 WeakPolarHBondContact CA-OE1 3.47Å; P521-E562 VanDerWaalsContact CB-OE1 3.29Å; P521-E562 WeakPolarHBondContact CB-OE1 3.28Å
522	Y	85.1	Confident	78.5	Confident	84 Å²	84	74.8 Å²	74.8	33%	0.329	42%	0.418	S	S	.	.			trans	-83.7	105.9	179.9	171.3	-118.7	0	0	0	111.1	R524 E562 K565 Q569	Y522-R524 HydrophobicContact CE1-CG 4.16Å; Y522-E562 PolarHBondContact N-OE1 3.46Å; Y522-K565 HydrophobicContact CD1-CB 3.96Å; Y522-K565 HydrophobicContact CD1-CD 4.18Å; Y522-K565 HydrophobicContact CD1-CG 4.49Å; Y522-K565 HydrophobicContact CD2-CB 3.71Å; Y522-K565 HydrophobicContact CE1-CB 4.38Å; Y522-K565 HydrophobicContact CE1-CD 4.41Å; Y522-K565 HydrophobicContact CE2-CB 4.17Å; Y522-K565 HydrophobicContact CG-CB 3.59Å; Y522-Q569 HydrophobicContact CD2-CB 4.4Å; Y522-Q569 HydrophobicContact CE2-CB 4.17Å
523	L	81.8	Confident	79	Confident	106 Å²	106	72.9 Å²	72.9	56%	0.555	41%	0.407	S	S	*	.			trans	-91.9	120	179.3	-179.3	59.4	0	0	0	110.9	P521 L525 Q569	P521-L523 PolarHBondContact O-N 3.31Å; L523-L525 VanDerWaalsContact C-N 3.35Å; L523-L525 HydrophobicContact CD2-CD2 3.92Å; L523-L525 HydrophobicContact CG-CD2 4.28Å; L523-L525 PolarHBondContact O-N 2.76Å; L523-Q569 PolarHBondContact O-NE2 3.32Å; L523-Q569 PolarHBondContact O-OE1 3.02Å; L523-Q569 VanDerWaalsContact O-OE1 3.09Å
524	R	79.1	Confident	79.4	Confident	163 Å²	163	72.8 Å²	72.8	62%	0.615	41%	0.406	S	S	*	.			trans	-68.5	96	162.9	-70.8	-178.5	179.9	168.2	-1.3	108.7	Y522	Y522-R524 HydrophobicContact CE1-CG 4.16Å
525	L	77.6	Confident	79.7	Confident	25 Å²	25	69.1 Å²	69.1	13%	0.131	38%	0.381	C	S	.	.			trans	-59.6	142.5	176.2	-62.6	165.6	0	0	0	109.9	Y76 L523 P529 Q569 V573	Y76-L525 HydrophobicContact CD1-CB 3.83Å; Y76-L525 WeakPolarHBondContact CD1-O 3.44Å; Y76-L525 HydrophobicContact CD2-CB 3.92Å; Y76-L525 HydrophobicContact CD2-CD1 4.16Å; Y76-L525 HydrophobicContact CE1-CB 3.71Å; Y76-L525 WeakPolarHBondContact CE1-O 3.34Å; Y76-L525 HydrophobicContact CE2-CB 3.79Å; Y76-L525 HydrophobicContact CE2-CD1 3.5Å; Y76-L525 HydrophobicContact CE2-CG 4.26Å; Y76-L525 HydrophobicContact CG-CB 3.94Å; L523-L525 VanDerWaalsContact C-N 3.35Å; L523-L525 HydrophobicContact CD2-CD2 3.92Å; L523-L525 HydrophobicContact CG-CD2 4.28Å; L523-L525 PolarHBondContact O-N 2.76Å; L525-P529 HydrophobicContact CD1-CB 3.8Å; L525-P529 HydrophobicContact CD1-CG 4.04Å; L525-P529 HydrophobicContact CD2-CB 4.09Å; L525-Q569 HydrophobicContact CD1-CG 4.43Å; L525-V573 HydrophobicContact CD1-CG2 3.9Å
526	T	71.1	Confident	80	Confident	103 Å²	103	70.1 Å²	70.1	63%	0.632	39%	0.387	S	S	*	.			trans	-133.6	2	175.5	51.7	0	0	0	0	112.1
527	C	67.8	Low	80.2	Confident	68 Å²	68	64.2 Å²	64.2	46%	0.459	36%	0.362	S	S	.	.	S	Bend	trans	-134.5	171.9	177.4	-66	0	0	0	0	107.8
528	A	67.4	Low	80.3	Confident	65 Å²	65	65.9 Å²	65.9	54%	0.537	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-57.9	131.2	166	0	0	0	0	0	110
529	P	69.8	Low	80.6	Confident	25 Å²	25	62.5 Å²	62.5	16%	0.162	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-70.3	132.5	175.2	26.4	-30.8	0	0	0	110.7	L525 V534 V573	L525-P529 HydrophobicContact CD1-CB 3.8Å; L525-P529 HydrophobicContact CD1-CG 4.04Å; L525-P529 HydrophobicContact CD2-CB 4.09Å; P529-V534 HydrophobicContact CB-CG2 4.21Å; P529-V573 HydrophobicContact CB-CG1 4.07Å; P529-V573 HydrophobicContact CG-CB 4.37Å; P529-V573 HydrophobicContact CG-CG1 3.38Å; P529-V573 HydrophobicContact CG-CG2 4.02Å
530	D	72.1	Confident	80.8	Confident	88 Å²	88	59.1 Å²	59.1	47%	0.471	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-70.2	128.7	169.8	173.4	-1.2	0	0	0	109.4	S532 T533	D530-S532 PolarHBondContact O-N 3.49Å; D530-S532 VanDerWaalsContact O-N 3.08Å; D530-S532 WeakPolarHBondContact OD1-CB 3.49Å; D530-S532 PolarHBondContact OD1-N 3.15Å; D530-S532 PolarHBondContact OD1-OG 3Å; D530-S532 PolarHBondContact OD2-OG 2.96Å; D530-T533 HydrophobicContact CB-CG2 4.16Å; D530-T533 PolarHBondContact O-N 2.98Å; D530-T533 PolarHBondContact O-OG1 3.38Å
531	P	74.9	Confident	81	Confident	57 Å²	57	63 Å²	63	37%	0.37	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-48.6	-31.7	173.5	-25	30.6	0	0	0	114.2	I511 G513 S514 T533 V534	I511-P531 HydrophobicContact CG2-CB 4.19Å; I511-P531 HydrophobicContact CG2-CG 3.94Å; G513-P531 WeakPolarHBondContact CA-O 3.2Å; S514-P531 PolarHBondContact N-O 2.83Å; P531-T533 PolarHBondContact O-N 3.37Å; P531-V534 PolarHBondContact O-N 2.93Å
532	S	79.1	Confident	81.4	Confident	60 Å²	60	65.2 Å²	65.2	42%	0.42	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-59.6	-26.9	176.2	82.4	0	0	0	0	113.5	S514 C515 D530	S514-S532 WeakPolarHBondContact OG-CA 3.48Å; C515-S532 WeakPolarHBondContact CB-O 3.43Å; D530-S532 PolarHBondContact O-N 3.49Å; D530-S532 VanDerWaalsContact O-N 3.08Å; D530-S532 WeakPolarHBondContact OD1-CB 3.49Å; D530-S532 PolarHBondContact OD1-N 3.15Å; D530-S532 PolarHBondContact OD1-OG 3Å; D530-S532 PolarHBondContact OD2-OG 2.96Å
533	T	81.6	Confident	81.7	Confident	57 Å²	57	61.2 Å²	61.2	35%	0.35	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-91.8	-11.7	-177.7	69.4	0	0	0	0	113.4	K520 D530 P531	K520-T533 WeakPolarHBondContact CE-O 3.37Å; K520-T533 PolarHBondContact NZ-O 3.19Å; D530-T533 HydrophobicContact CB-CG2 4.16Å; D530-T533 PolarHBondContact O-N 2.98Å; D530-T533 PolarHBondContact O-OG1 3.38Å; P531-T533 PolarHBondContact O-N 3.37Å
534	V	84.9	Confident	82.2	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.006	30%	0.302	C	S	.	.	S	Bend	trans	-100.1	137.8	-173.2	-177.5	0	0	0	0	109.1	G513 S514 C515 P529 P531 D570 V573 Q574	G513-V534 CarbonylContact C-O 3.09Å; G513-V534 WeakPolarHBondContact CA-O 3.26Å; S514-V534 PolarHBondContact N-O 3.3Å; C515-V534 WeakPolarHBondContact CB-O 3.43Å; C515-V534 PolarHBondContact N-O 3.31Å; P529-V534 HydrophobicContact CB-CG2 4.21Å; P531-V534 PolarHBondContact O-N 2.93Å; V534-D570 HydrophobicContact CG1-CB 4.09Å; V534-V573 HydrophobicContact CG1-CG1 4.34Å; V534-V573 HydrophobicContact CG2-CG1 3.83Å; V534-Q574 HydrophobicContact CG1-CG 3.51Å
535	R	87.1	Confident	82.9	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-90.6	133.4	-178.8	-67.8	169.5	-63.6	-167.8	-10	111.5	C515 D517 I518 V539 L540 S543 S566 D570 Q574	C515-R535 HydrophobicContact CB-CG 3.82Å; C515-R535 VanDerWaalsContact SG-CG 3.53Å; D517-R535 WeakPolarHBondContact O-CD 3.26Å; I518-R535 PolarHBondContact O-NH1 2.93Å; R535-V539 HydrophobicContact CB-CB 4.22Å; R535-V539 HydrophobicContact CB-CG1 4.05Å; R535-V539 HydrophobicContact CG-CG1 3.99Å; R535-L540 HydrophobicContact CB-CD2 3.78Å; R535-L540 HydrophobicContact CB-CG 3.88Å; R535-L540 WeakPolarHBondContact O-CD1 3.43Å; R535-L540 WeakPolarHBondContact O-CG 3.26Å; R535-S543 PolarHBondContact NH1-OG 3.06Å; R535-S566 VanDerWaalsContact NH2-C 3.28Å; R535-S566 PolarHBondContact NH2-O 3.42Å; R535-S566 PolarHBondContact NH2-OG 2.81Å; R535-D570 IonicContact CZ-OD2 3.2Å; R535-D570 IonicContact NE-OD2 2.76Å; R535-D570 PolarHBondContact NE-OD2 2.86Å; R535-D570 IonicContact NH2-OD2 2.75Å; R535-D570 PolarHBondContact NH2-OD2 3.49Å; R535-Q574 PolarHBondContact O-NE2 2.75Å; R535-Q574 PolarHBondContact O-OE1 3.06Å
536	P	88.4	Confident	83.6	Confident	30 Å²	30	54.5 Å²	54.5	20%	0.195	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-71.8	162.5	174.7	27.3	-28.3	0	0	0	111.6	V512 G513 C515 Q538 V539 L540	V512-P536 HydrophobicContact CG1-CB 4.47Å; G513-P536 WeakPolarHBondContact O-CB 3.17Å; G513-P536 WeakPolarHBondContact O-CD 3.48Å; G513-P536 VanDerWaalsContact O-CG 3.28Å; G513-P536 WeakPolarHBondContact O-CG 3.29Å; C515-P536 WeakPolarHBondContact O-CD 3.35Å; P536-Q538 PolarHBondContact O-N 3.23Å; P536-Q538 VanDerWaalsContact O-N 3.08Å; P536-V539 HydrophobicContact CG-CB 4.31Å; P536-V539 HydrophobicContact CG-CG2 3.83Å; P536-V539 PolarHBondContact O-N 2.98Å; P536-L540 PolarHBondContact O-N 3.48Å
537	V	88.6	Confident	84.6	Confident	41 Å²	41	49.7 Å²	49.7	25%	0.248	28%	0.28	C	S	.	.	H	α-helix	trans	-48.3	-41.5	-177.6	-178	0	0	0	0	113.5	V539 L540 R541 I576 F580	V537-V539 VanDerWaalsContact C-N 3.31Å; V537-V539 PolarHBondContact O-N 3.12Å; V537-L540 PolarHBondContact O-N 3.4Å; V537-R541 HydrophobicContact CG1-CG 4.43Å; V537-R541 WeakPolarHBondContact O-CG 3.36Å; V537-R541 PolarHBondContact O-N 3.32Å; V537-I576 HydrophobicContact CG2-CD1 3.48Å; V537-I576 VanDerWaalsContact CG2-CD1 3.48Å; V537-F580 HydrophobicContact CG1-CD1 4.19Å
538	Q	88.6	Confident	85.8	Confident	136 Å²	136	49.3 Å²	49.3	64%	0.636	27%	0.27	S	S	*	.	H	α-helix	trans	-67.6	-30.3	-178.3	-57.6	-61.2	-3.8	0	0	113.1	P536 K542	P536-Q538 PolarHBondContact O-N 3.23Å; P536-Q538 VanDerWaalsContact O-N 3.08Å; Q538-K542 WeakPolarHBondContact O-CG 3.24Å
539	V	89.8	Confident	86.9	Confident	15 Å²	15	48.8 Å²	48.8	9%	0.091	27%	0.266	C	S	.	.	H	α-helix	trans	-79.6	-45.3	173.6	178.3	0	0	0	0	109.2	D517 R535 P536 V537 R541 K542 S543	D517-V539 WeakPolarHBondContact O-CG1 3.42Å; R535-V539 HydrophobicContact CB-CB 4.22Å; R535-V539 HydrophobicContact CB-CG1 4.05Å; R535-V539 HydrophobicContact CG-CG1 3.99Å; P536-V539 HydrophobicContact CG-CB 4.31Å; P536-V539 HydrophobicContact CG-CG2 3.83Å; P536-V539 PolarHBondContact O-N 2.98Å; V537-V539 VanDerWaalsContact C-N 3.31Å; V537-V539 PolarHBondContact O-N 3.12Å; V539-R541 VanDerWaalsContact C-N 3.27Å; V539-R541 PolarHBondContact O-N 2.84Å; V539-K542 CarbonylContact O-C 3.54Å; V539-K542 WeakPolarHBondContact O-CA 3.46Å; V539-K542 WeakPolarHBondContact O-CB 3.06Å; V539-K542 PolarHBondContact O-N 3.13Å; V539-S543 PolarHBondContact O-N 2.98Å; V539-S543 PolarHBondContact O-OG 2.94Å; V539-S543 VanDerWaalsContact O-OG 3.12Å
540	L	90.6	Very high	87.9	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-57.4	-36.7	177.2	-67.9	170.1	0	0	0	113.1	R535 P536 V537 S543 L544 I567 D570 L571 F580	R535-L540 HydrophobicContact CB-CD2 3.78Å; R535-L540 HydrophobicContact CB-CG 3.88Å; R535-L540 WeakPolarHBondContact O-CD1 3.43Å; R535-L540 WeakPolarHBondContact O-CG 3.26Å; P536-L540 PolarHBondContact O-N 3.48Å; V537-L540 PolarHBondContact O-N 3.4Å; L540-S543 WeakPolarHBondContact O-CB 3.33Å; L540-S543 PolarHBondContact O-N 2.84Å; L540-L544 PolarHBondContact O-N 3.4Å; L540-I567 HydrophobicContact CD2-CB 4.3Å; L540-I567 HydrophobicContact CD2-CG1 4.24Å; L540-I567 HydrophobicContact CD2-CG2 4Å; L540-D570 HydrophobicContact CD1-CB 4.21Å; L540-D570 HydrophobicContact CD2-CB 3.82Å; L540-L571 HydrophobicContact CD1-CD2 3.76Å; L540-L571 HydrophobicContact CD1-CG 3.96Å; L540-F580 HydrophobicContact CB-CE1 3.76Å; L540-F580 HydrophobicContact CB-CZ 4.01Å
541	R	91.3	Very high	88.9	Confident	110 Å²	110	46.7 Å²	46.7	42%	0.415	25%	0.25	S	S	.	.	H	α-helix	trans	-61.5	-42.4	172.2	-76.6	-179.9	-178.2	-79.3	9.3	111.9	V537 V539 L544 L545 F580	V537-R541 HydrophobicContact CG1-CG 4.43Å; V537-R541 WeakPolarHBondContact O-CG 3.36Å; V537-R541 PolarHBondContact O-N 3.32Å; V539-R541 VanDerWaalsContact C-N 3.27Å; V539-R541 PolarHBondContact O-N 2.84Å; R541-L544 PolarHBondContact O-N 3.07Å; R541-L545 WeakPolarHBondContact O-CG 3.36Å; R541-L545 PolarHBondContact O-N 2.7Å; R541-F580 HydrophobicContact CB-CE2 4.26Å; R541-F580 HydrophobicContact CB-CZ 4.34Å; R541-F580 HydrophobicContact CG-CD1 4.38Å; R541-F580 HydrophobicContact CG-CD2 3.78Å; R541-F580 HydrophobicContact CG-CE1 4.16Å; R541-F580 HydrophobicContact CG-CE2 3.52Å; R541-F580 HydrophobicContact CG-CG 4.21Å; R541-F580 HydrophobicContact CG-CZ 3.74Å
542	K	92.1	Very high	89.6	Confident	135 Å²	135	52.3 Å²	52.3	59%	0.587	27%	0.269	S	S	*	.	H	α-helix	trans	-66.2	-41.7	173.4	-63.7	173.2	-176.8	-179.8	0	111.4	Q538 V539 L544 L545 A546	Q538-K542 WeakPolarHBondContact O-CG 3.24Å; V539-K542 CarbonylContact O-C 3.54Å; V539-K542 WeakPolarHBondContact O-CA 3.46Å; V539-K542 WeakPolarHBondContact O-CB 3.06Å; V539-K542 PolarHBondContact O-N 3.13Å; K542-L544 PolarHBondContact O-N 2.97Å; K542-L545 PolarHBondContact O-N 3.09Å; K542-A546 WeakPolarHBondContact O-CB 3.22Å; K542-A546 PolarHBondContact O-N 2.85Å
543	S	92.3	Very high	90.3	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.8	-45.9	174.3	-55	0	0	0	0	112	I518 R535 V539 L540 L545 A546 V547	I518-S543 WeakPolarHBondContact O-CB 3.24Å; I518-S543 PolarHBondContact O-OG 3Å; R535-S543 PolarHBondContact NH1-OG 3.06Å; V539-S543 PolarHBondContact O-N 2.98Å; V539-S543 PolarHBondContact O-OG 2.94Å; V539-S543 VanDerWaalsContact O-OG 3.12Å; L540-S543 WeakPolarHBondContact O-CB 3.33Å; L540-S543 PolarHBondContact O-N 2.84Å; S543-L545 PolarHBondContact O-N 2.9Å; S543-A546 PolarHBondContact O-N 2.82Å; S543-V547 WeakPolarHBondContact O-CG2 3.49Å; S543-V547 PolarHBondContact O-N 2.66Å
544	L	92.9	Very high	90.5	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-61	-43.6	177.9	-179.5	62.2	0	0	0	111.6	L540 R541 K542 V547 K548 M564 F580 E583 V584 C587	L540-L544 PolarHBondContact O-N 3.4Å; R541-L544 PolarHBondContact O-N 3.07Å; K542-L544 PolarHBondContact O-N 2.97Å; L544-V547 PolarHBondContact O-N 2.85Å; L544-K548 HydrophobicContact CD1-CD 4.45Å; L544-K548 HydrophobicContact CD1-CG 4.44Å; L544-K548 HydrophobicContact CG-CD 4.18Å; L544-K548 WeakPolarHBondContact O-CB 3.25Å; L544-K548 VanDerWaalsContact O-CG 3.27Å; L544-K548 WeakPolarHBondContact O-CG 3.39Å; L544-K548 PolarHBondContact O-N 3.22Å; L544-M564 HydrophobicContact CD1-CE 3.64Å; L544-M564 HydrophobicContact CD1-SD 3.67Å; L544-F580 HydrophobicContact CB-CE2 4.28Å; L544-F580 HydrophobicContact CB-CZ 4.38Å; L544-F580 HydrophobicContact CD2-CD2 4.42Å; L544-F580 HydrophobicContact CD2-CE2 3.63Å; L544-F580 HydrophobicContact CD2-CZ 4.38Å; L544-E583 HydrophobicContact CD2-CG 4.38Å; L544-E583 WeakPolarHBondContact CD2-OE1 3.48Å; L544-V584 HydrophobicContact CD1-CG2 4.25Å; L544-V584 HydrophobicContact CD2-CG2 3.86Å; L544-V584 HydrophobicContact CG-CG2 4.46Å; L544-C587 HydrophobicContact CD1-CB 4.14Å
545	L	93	Very high	90.6	Very high	114 Å²	114	62.3 Å²	62.3	60%	0.597	32%	0.316	S	S	*	.	H	α-helix	trans	-64.9	-42.2	176.3	-68	173.2	0	0	0	112	R541 K542 S543 K548 A549	R541-L545 WeakPolarHBondContact O-CG 3.36Å; R541-L545 PolarHBondContact O-N 2.7Å; K542-L545 PolarHBondContact O-N 3.09Å; S543-L545 PolarHBondContact O-N 2.9Å; L545-K548 PolarHBondContact O-N 3.5Å; L545-A549 WeakPolarHBondContact O-CB 3.47Å; L545-A549 PolarHBondContact O-N 3.13Å
546	A	92	Very high	90.9	Very high	37 Å²	37	65.6 Å²	65.6	31%	0.306	33%	0.334	S	S	.	.	H	α-helix	trans	-62.4	-42.6	176.2	0	0	0	0	0	112.2	I518 K542 S543 A549 H550	I518-A546 HydrophobicContact CG2-CB 3.73Å; K542-A546 WeakPolarHBondContact O-CB 3.22Å; K542-A546 PolarHBondContact O-N 2.85Å; S543-A546 PolarHBondContact O-N 2.82Å; A546-A549 PolarHBondContact O-N 3.02Å; A546-H550 WeakPolarHBondContact O-CB 3.25Å; A546-H550 PolarHBondContact O-N 3.47Å
547	V	92.4	Very high	91	Very high	2 Å²	2	66.3 Å²	66.3	1%	0.012	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-42.2	175.7	176.6	0	0	0	0	111.3	S543 L544 A549 H550 W551 A560 Q563 M564 I567	S543-V547 WeakPolarHBondContact O-CG2 3.49Å; S543-V547 PolarHBondContact O-N 2.66Å; L544-V547 PolarHBondContact O-N 2.85Å; V547-A549 VanDerWaalsContact C-N 3.29Å; V547-A549 PolarHBondContact O-N 2.91Å; V547-H550 PolarHBondContact O-N 3.27Å; V547-W551 VanDerWaalsContact O-CB 3.28Å; V547-W551 WeakPolarHBondContact O-CB 3.27Å; V547-W551 PolarHBondContact O-N 2.85Å; V547-A560 HydrophobicContact CG1-CB 4.3Å; V547-Q563 HydrophobicContact CG2-CB 3.5Å; V547-Q563 VanDerWaalsContact CG2-CB 3.5Å; V547-Q563 HydrophobicContact CG2-CG 4.21Å; V547-M564 HydrophobicContact CB-CE 4.24Å; V547-M564 HydrophobicContact CG1-CE 3.62Å; V547-I567 HydrophobicContact CG2-CD1 4.22Å
548	K	92.5	Very high	91.1	Very high	60 Å²	60	67.9 Å²	67.9	26%	0.261	35%	0.35	S	S	.	.	H	α-helix	trans	-60.3	-36.4	173.8	-76.6	173.1	178.8	178.9	0	112.6	L544 L545 K552 E583 C587	L544-K548 HydrophobicContact CD1-CD 4.45Å; L544-K548 HydrophobicContact CD1-CG 4.44Å; L544-K548 HydrophobicContact CG-CD 4.18Å; L544-K548 WeakPolarHBondContact O-CB 3.25Å; L544-K548 VanDerWaalsContact O-CG 3.27Å; L544-K548 WeakPolarHBondContact O-CG 3.39Å; L544-K548 PolarHBondContact O-N 3.22Å; L545-K548 PolarHBondContact O-N 3.5Å; K548-K552 WeakPolarHBondContact O-CG 3.3Å; K548-K552 PolarHBondContact O-N 2.93Å; K548-E583 IonicContact NZ-OE1 2.56Å; K548-E583 PolarHBondContact NZ-OE1 2.95Å; K548-C587 WeakPolarHBondContact CE-SG 3.34Å
549	A	91.8	Very high	91.3	Very high	54 Å²	54	64.1 Å²	64.1	45%	0.446	33%	0.33	S	S	.	.	H	α-helix	trans	-71.6	-51.4	175.6	0	0	0	0	0	111.5	L545 A546 V547 W551 K552 T553	L545-A549 WeakPolarHBondContact O-CB 3.47Å; L545-A549 PolarHBondContact O-N 3.13Å; A546-A549 PolarHBondContact O-N 3.02Å; V547-A549 VanDerWaalsContact C-N 3.29Å; V547-A549 PolarHBondContact O-N 2.91Å; A549-W551 PolarHBondContact O-N 2.99Å; A549-K552 PolarHBondContact O-N 3.38Å; A549-K552 VanDerWaalsContact O-N 3.09Å; A549-T553 PolarHBondContact O-N 2.76Å; A549-T553 VanDerWaalsContact O-N 3.1Å; A549-T553 PolarHBondContact O-OG1 3.35Å
550	H	90.8	Very high	91.4	Very high	49 Å²	49	63.4 Å²	63.4	23%	0.227	33%	0.326	C	S	.	.	H	α-helix	trans	-56.9	-36.8	177.2	-171.1	-82.5	0	0	0	112.3	A546 V547 N554 Y559	A546-H550 WeakPolarHBondContact O-CB 3.25Å; A546-H550 PolarHBondContact O-N 3.47Å; V547-H550 PolarHBondContact O-N 3.27Å; H550-N554 PolarHBondContact CD2-ND2 3.3Å; H550-N554 VanDerWaalsContact CD2-ND2 3.26Å; H550-N554 PolarHBondContact NE2-ND2 3.23Å; H550-N554 WeakPolarHBondContact O-CB 3.43Å; H550-N554 PolarHBondContact O-N 3.33Å; H550-Y559 HydrophobicContact CB-CE1 4.07Å; H550-Y559 AromaticContact CD2-CE1 3.83Å; H550-Y559 AromaticContact CE1-CD1 3.36Å; H550-Y559 WeakPolarHBondContact CE1-CD1 3.42Å; H550-Y559 AromaticContact CE1-CE1 3.78Å; H550-Y559 AromaticContact CE1-CG 3.91Å; H550-Y559 AromaticContact CG-CD1 3.83Å; H550-Y559 AromaticContact CG-CE1 3.56Å; H550-Y559 AromaticContact ND1-CD1 3.28Å; H550-Y559 VanDerWaalsContact ND1-CD1 3.28Å; H550-Y559 WeakPolarHBondContact ND1-CD1 3.32Å; H550-Y559 AromaticContact ND1-CE1 3.54Å; H550-Y559 AromaticContact NE2-CD1 3.97Å; H550-Y559 AromaticContact NE2-CE1 3.99Å
551	W	92.6	Very high	91.5	Very high	20 Å²	20	63.7 Å²	63.7	8%	0.076	33%	0.328	C	S	.	.	H	α-helix	trans	-60.2	-48.7	175	-175.7	-118.9	0	0	0	112.7	V547 A549 T553 Q555 Y557 A560 I591 E594 K595	V547-W551 VanDerWaalsContact O-CB 3.28Å; V547-W551 WeakPolarHBondContact O-CB 3.27Å; V547-W551 PolarHBondContact O-N 2.85Å; A549-W551 PolarHBondContact O-N 2.99Å; W551-T553 PolarHBondContact O-N 3.18Å; W551-Q555 WeakPolarHBondContact CZ3-O 3.38Å; W551-Q555 VanDerWaalsContact O-CA 3.27Å; W551-Q555 WeakPolarHBondContact O-CA 3.15Å; W551-Q555 PolarHBondContact O-N 2.95Å; W551-Y557 AromaticContact CH2-CD2 3.82Å; W551-Y557 HydrophobicContact CH2-CD2 3.82Å; W551-Y557 HydrophobicContact CH2-CG 4.47Å; W551-Y557 HydrophobicContact CZ3-CD2 4.13Å; W551-A560 HydrophobicContact CE3-CB 3.65Å; W551-A560 HydrophobicContact CZ3-CB 3.98Å; W551-I591 HydrophobicContact CD2-CG1 4.41Å; W551-I591 HydrophobicContact CD2-CG2 4.2Å; W551-I591 HydrophobicContact CE3-CG2 4.34Å; W551-I591 HydrophobicContact CG-CD1 4.42Å; W551-I591 HydrophobicContact CG-CG1 4.34Å; W551-I591 HydrophobicContact CH2-CG2 3.84Å; W551-I591 HydrophobicContact CZ2-CB 4.46Å; W551-I591 HydrophobicContact CZ2-CG2 3.77Å; W551-I591 HydrophobicContact CZ3-CG2 4.19Å; W551-E594 HydrophobicContact CZ2-CB 4.28Å; W551-E594 PolarHBondContact NE1-OE2 3.5Å; W551-K595 HydrophobicContact CH2-CD 3.99Å; W551-K595 HydrophobicContact CH2-CG 3.56Å; W551-K595 HydrophobicContact CZ2-CG 4.14Å
552	K	90.3	Very high	91.6	Very high	174 Å²	174	61.9 Å²	61.9	76%	0.757	32%	0.324	S	S	*	.	H	α-helix	trans	-65.3	-38.4	-179.5	-71.7	177.5	177.3	-172.6	0	112.7	K548 A549	K548-K552 WeakPolarHBondContact O-CG 3.3Å; K548-K552 PolarHBondContact O-N 2.93Å; A549-K552 PolarHBondContact O-N 3.38Å; A549-K552 VanDerWaalsContact O-N 3.09Å
553	T	92.6	Very high	91.7	Very high	115 Å²	115	55.8 Å²	55.8	71%	0.706	30%	0.298	S	S	*	.	H	α-helix	trans	-82	-47.3	-177.5	-48.6	0	0	0	0	112.7	A549 W551	A549-T553 PolarHBondContact O-N 2.76Å; A549-T553 VanDerWaalsContact O-N 3.1Å; A549-T553 PolarHBondContact O-OG1 3.35Å; W551-T553 PolarHBondContact O-N 3.18Å
554	N	85.9	Confident	91.8	Very high	94 Å²	94	55.8 Å²	55.8	50%	0.503	30%	0.298	S	S	.	.	H	α-helix	trans	-107.1	-18.4	-166.8	-62.2	-11.3	0	0	0	113.7	H550 D556	H550-N554 PolarHBondContact CD2-ND2 3.3Å; H550-N554 VanDerWaalsContact CD2-ND2 3.26Å; H550-N554 PolarHBondContact NE2-ND2 3.23Å; H550-N554 WeakPolarHBondContact O-CB 3.43Å; H550-N554 PolarHBondContact O-N 3.33Å; N554-D556 PolarHBondContact O-N 3.34Å
555	Q	87.6	Confident	91.8	Very high	120 Å²	120	57.8 Å²	57.8	56%	0.561	31%	0.306	S	S	*	.			trans	50.3	16.8	-176.7	-60.6	-162.9	9.9	0	0	117	W551 Y557 K595	W551-Q555 WeakPolarHBondContact CZ3-O 3.38Å; W551-Q555 VanDerWaalsContact O-CA 3.27Å; W551-Q555 WeakPolarHBondContact O-CA 3.15Å; W551-Q555 PolarHBondContact O-N 2.95Å; Q555-Y557 PolarHBondContact O-N 2.86Å; Q555-K595 VanDerWaalsContact O-CE 3.32Å; Q555-K595 WeakPolarHBondContact O-CE 3.37Å; Q555-K595 PolarHBondContact O-NZ 2.84Å
556	D	91.9	Very high	91.8	Very high	69 Å²	69	52.4 Å²	52.4	37%	0.369	28%	0.278	S	S	.	.			trans	-70.6	113.5	177	176.9	7.1	0	0	0	110.9	N554 A558 Y559 A560	N554-D556 PolarHBondContact O-N 3.34Å; D556-A558 WeakPolarHBondContact OD1-CB 3.47Å; D556-A558 PolarHBondContact OD1-N 2.79Å; D556-Y559 PolarHBondContact OD1-N 3.39Å; D556-Y559 WeakPolarHBondContact OD2-CB 3.25Å; D556-A560 WeakPolarHBondContact O-CB 3.46Å; D556-A560 PolarHBondContact O-N 2.65Å
557	Y	91.6	Very high	91.8	Very high	45 Å²	45	50.6 Å²	50.6	18%	0.176	26%	0.263	C	S	.	.	H	α-helix	trans	-81.3	-29.3	-179.7	-174.5	-111.5	0	0	0	113.6	W551 Q555 C561 I591 K595 D597	W551-Y557 AromaticContact CH2-CD2 3.82Å; W551-Y557 HydrophobicContact CH2-CD2 3.82Å; W551-Y557 HydrophobicContact CH2-CG 4.47Å; W551-Y557 HydrophobicContact CZ3-CD2 4.13Å; Q555-Y557 PolarHBondContact O-N 2.86Å; Y557-C561 HydrophobicContact CD1-CB 4.49Å; Y557-C561 HydrophobicContact CD2-CB 4.35Å; Y557-C561 HydrophobicContact CE1-CB 4.09Å; Y557-C561 HydrophobicContact CE2-CB 3.94Å; Y557-C561 WeakPolarHBondContact O-CB 3.44Å; Y557-C561 PolarHBondContact O-N 2.85Å; Y557-C561 PolarHBondContact OH-SG 2.85Å; Y557-I591 HydrophobicContact CD2-CG2 4.1Å; Y557-I591 HydrophobicContact CE2-CG2 4.03Å; Y557-K595 HydrophobicContact CD2-CB 4.23Å; Y557-K595 HydrophobicContact CD2-CG 3.81Å; Y557-K595 HydrophobicContact CG-CB 4.27Å; Y557-K595 HydrophobicContact CG-CG 3.9Å; Y557-D597 HydrophobicContact CE1-CB 4.13Å; Y557-D597 WeakPolarHBondContact OH-CB 3.21Å; Y557-D597 PolarHBondContact OH-OD2 3.47Å
558	A	91.4	Very high	91.8	Very high	73 Å²	73	51.4 Å²	51.4	60%	0.603	27%	0.266	S	S	*	.	H	α-helix	trans	-64.4	-51.8	179.4	0	0	0	0	0	109.4	D556 E562	D556-A558 WeakPolarHBondContact OD1-CB 3.47Å; D556-A558 PolarHBondContact OD1-N 2.79Å; A558-E562 WeakPolarHBondContact O-CB 3.34Å; A558-E562 PolarHBondContact O-N 2.92Å
559	Y	91.6	Very high	91.7	Very high	57 Å²	57	49 Å²	49	22%	0.224	26%	0.256	C	S	.	.	H	α-helix	trans	-62.2	-49.8	174.3	176.5	-94.1	0	0	0	112.6	T519 H550 D556 C561 E562 Q563	T519-Y559 WeakPolarHBondContact CG2-OH 3.19Å; H550-Y559 HydrophobicContact CB-CE1 4.07Å; H550-Y559 AromaticContact CD2-CE1 3.83Å; H550-Y559 AromaticContact CE1-CD1 3.36Å; H550-Y559 WeakPolarHBondContact CE1-CD1 3.42Å; H550-Y559 AromaticContact CE1-CE1 3.78Å; H550-Y559 AromaticContact CE1-CG 3.91Å; H550-Y559 AromaticContact CG-CD1 3.83Å; H550-Y559 AromaticContact CG-CE1 3.56Å; H550-Y559 AromaticContact ND1-CD1 3.28Å; H550-Y559 VanDerWaalsContact ND1-CD1 3.28Å; H550-Y559 WeakPolarHBondContact ND1-CD1 3.32Å; H550-Y559 AromaticContact ND1-CE1 3.54Å; H550-Y559 AromaticContact NE2-CD1 3.97Å; H550-Y559 AromaticContact NE2-CE1 3.99Å; D556-Y559 PolarHBondContact OD1-N 3.39Å; D556-Y559 WeakPolarHBondContact OD2-CB 3.25Å; Y559-C561 PolarHBondContact O-N 2.9Å; Y559-E562 PolarHBondContact O-N 3.34Å; Y559-Q563 HydrophobicContact CD1-CG 4.18Å; Y559-Q563 HydrophobicContact CD2-CG 4.01Å; Y559-Q563 HydrophobicContact CE1-CG 3.85Å; Y559-Q563 HydrophobicContact CE2-CG 3.65Å; Y559-Q563 HydrophobicContact CG-CG 4.27Å; Y559-Q563 WeakPolarHBondContact O-CB 3.43Å; Y559-Q563 WeakPolarHBondContact O-CG 3.4Å; Y559-Q563 PolarHBondContact O-N 3.06Å
560	A	92.3	Very high	91.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63	-41.6	-176.5	0	0	0	0	0	112.5	V547 W551 D556 M564 I591	V547-A560 HydrophobicContact CG1-CB 4.3Å; W551-A560 HydrophobicContact CE3-CB 3.65Å; W551-A560 HydrophobicContact CZ3-CB 3.98Å; D556-A560 WeakPolarHBondContact O-CB 3.46Å; D556-A560 PolarHBondContact O-N 2.65Å; A560-M564 WeakPolarHBondContact O-CB 3.45Å; A560-M564 PolarHBondContact O-N 3.24Å; A560-I591 HydrophobicContact CB-CG2 4.43Å
561	C	92.5	Very high	91.6	Very high	7 Å²	7	44.2 Å²	44.2	5%	0.047	23%	0.225	C	C	.	.	H	α-helix	trans	-67	-40.9	176.5	-173.2	0	0	0	0	111.8	Y557 Y559 K565	Y557-C561 HydrophobicContact CD1-CB 4.49Å; Y557-C561 HydrophobicContact CD2-CB 4.35Å; Y557-C561 HydrophobicContact CE1-CB 4.09Å; Y557-C561 HydrophobicContact CE2-CB 3.94Å; Y557-C561 WeakPolarHBondContact O-CB 3.44Å; Y557-C561 PolarHBondContact O-N 2.85Å; Y557-C561 PolarHBondContact OH-SG 2.85Å; Y559-C561 PolarHBondContact O-N 2.9Å; C561-K565 WeakPolarHBondContact O-CB 3.49Å; C561-K565 WeakPolarHBondContact O-CD 3.31Å; C561-K565 VanDerWaalsContact O-CG 3.28Å; C561-K565 WeakPolarHBondContact O-CG 3.09Å; C561-K565 PolarHBondContact O-N 2.85Å; C561-K565 WeakPolarHBondContact SG-CE 3.42Å; C561-K565 PolarHBondContact SG-NZ 3.23Å
562	E	93.1	Very high	91.4	Very high	71 Å²	71	47.4 Å²	47.4	33%	0.332	25%	0.246	S	C	.	.	H	α-helix	trans	-64.4	-51.5	176.2	-165.9	-156.9	-169.1	0	0	111.9	P521 Y522 A558 Y559 M564 K565 S566	P521-E562 WeakPolarHBondContact CA-OE1 3.47Å; P521-E562 VanDerWaalsContact CB-OE1 3.29Å; P521-E562 WeakPolarHBondContact CB-OE1 3.28Å; Y522-E562 PolarHBondContact N-OE1 3.46Å; A558-E562 WeakPolarHBondContact O-CB 3.34Å; A558-E562 PolarHBondContact O-N 2.92Å; Y559-E562 PolarHBondContact O-N 3.34Å; E562-M564 VanDerWaalsContact C-N 3.26Å; E562-M564 PolarHBondContact O-N 3.48Å; E562-K565 WeakPolarHBondContact O-CB 3.2Å; E562-K565 PolarHBondContact O-N 2.71Å; E562-K565 VanDerWaalsContact O-N 3.1Å; E562-S566 WeakPolarHBondContact O-CB 3.42Å; E562-S566 PolarHBondContact O-N 3.26Å
563	Q	93.8	Very high	91.3	Very high	8 Å²	8	40.4 Å²	40.4	4%	0.037	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-37.8	179.5	-66.8	-53.1	-58.8	0	0	111.4	K520 V547 Y559 S566 I567	K520-Q563 PolarHBondContact O-NE2 2.68Å; K520-Q563 VanDerWaalsContact O-NE2 3.08Å; K520-Q563 PolarHBondContact O-OE1 3.45Å; V547-Q563 HydrophobicContact CG2-CB 3.5Å; V547-Q563 VanDerWaalsContact CG2-CB 3.5Å; V547-Q563 HydrophobicContact CG2-CG 4.21Å; Y559-Q563 HydrophobicContact CD1-CG 4.18Å; Y559-Q563 HydrophobicContact CD2-CG 4.01Å; Y559-Q563 HydrophobicContact CE1-CG 3.85Å; Y559-Q563 HydrophobicContact CE2-CG 3.65Å; Y559-Q563 HydrophobicContact CG-CG 4.27Å; Y559-Q563 WeakPolarHBondContact O-CB 3.43Å; Y559-Q563 WeakPolarHBondContact O-CG 3.4Å; Y559-Q563 PolarHBondContact O-N 3.06Å; Q563-S566 WeakPolarHBondContact O-CB 3.32Å; Q563-S566 PolarHBondContact O-N 2.92Å; Q563-I567 VanDerWaalsContact O-CG1 3.26Å; Q563-I567 WeakPolarHBondContact O-CG1 3.44Å; Q563-I567 PolarHBondContact O-N 3.08Å
564	M	94.3	Very high	91	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-75.8	-25	177.2	-151.8	70.3	80.2	0	0	113.1	L544 V547 A560 E562 I567 R568 V584 C587 H588 I591	L544-M564 HydrophobicContact CD1-CE 3.64Å; L544-M564 HydrophobicContact CD1-SD 3.67Å; V547-M564 HydrophobicContact CB-CE 4.24Å; V547-M564 HydrophobicContact CG1-CE 3.62Å; A560-M564 WeakPolarHBondContact O-CB 3.45Å; A560-M564 PolarHBondContact O-N 3.24Å; E562-M564 VanDerWaalsContact C-N 3.26Å; E562-M564 PolarHBondContact O-N 3.48Å; M564-I567 HydrophobicContact SD-CD1 4.11Å; M564-R568 WeakPolarHBondContact O-CB 3.44Å; M564-R568 VanDerWaalsContact O-CG 3.24Å; M564-R568 WeakPolarHBondContact O-CG 3.29Å; M564-R568 PolarHBondContact O-N 3.12Å; M564-R568 VanDerWaalsContact O-N 3.12Å; M564-V584 HydrophobicContact SD-CG1 4.12Å; M564-C587 HydrophobicContact CE-CB 4.46Å; M564-H588 HydrophobicContact CB-CB 4.36Å; M564-H588 HydrophobicContact CG-CB 3.44Å; M564-H588 VanDerWaalsContact CG-CB 3.44Å; M564-H588 WeakPolarHBondContact CG-ND1 3.16Å; M564-I591 HydrophobicContact CE-CD1 3.81Å
565	K	92.8	Very high	90.9	Very high	45 Å²	45	33.7 Å²	33.7	20%	0.196	19%	0.191	C	C	.	.	H	α-helix	trans	-64.8	-46.4	164.4	-81.2	159.6	177.7	168.6	0	111.3	Y522 C561 E562 R568 Q569 E600	Y522-K565 HydrophobicContact CD1-CB 3.96Å; Y522-K565 HydrophobicContact CD1-CD 4.18Å; Y522-K565 HydrophobicContact CD1-CG 4.49Å; Y522-K565 HydrophobicContact CD2-CB 3.71Å; Y522-K565 HydrophobicContact CE1-CB 4.38Å; Y522-K565 HydrophobicContact CE1-CD 4.41Å; Y522-K565 HydrophobicContact CE2-CB 4.17Å; Y522-K565 HydrophobicContact CG-CB 3.59Å; C561-K565 WeakPolarHBondContact O-CB 3.49Å; C561-K565 WeakPolarHBondContact O-CD 3.31Å; C561-K565 VanDerWaalsContact O-CG 3.28Å; C561-K565 WeakPolarHBondContact O-CG 3.09Å; C561-K565 PolarHBondContact O-N 2.85Å; C561-K565 WeakPolarHBondContact SG-CE 3.42Å; C561-K565 PolarHBondContact SG-NZ 3.23Å; E562-K565 WeakPolarHBondContact O-CB 3.2Å; E562-K565 PolarHBondContact O-N 2.71Å; E562-K565 VanDerWaalsContact O-N 3.1Å; K565-R568 VanDerWaalsContact CG-NH2 3.35Å; K565-R568 PolarHBondContact O-N 3.03Å; K565-Q569 WeakPolarHBondContact O-CB 3.3Å; K565-Q569 PolarHBondContact O-N 3Å; K565-E600 WeakPolarHBondContact CE-OE1 3.14Å; K565-E600 WeakPolarHBondContact CE-OE2 3.41Å; K565-E600 IonicContact NZ-OE1 2.74Å; K565-E600 PolarHBondContact NZ-OE1 3.36Å; K565-E600 IonicContact NZ-OE2 3.74Å
566	S	93.4	Very high	90.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.8	-45.3	177.1	-178.8	0	0	0	0	112.2	K520 R535 E562 Q563 Q569 D570	K520-S566 WeakPolarHBondContact O-CB 3.19Å; K520-S566 PolarHBondContact O-OG 3.49Å; R535-S566 VanDerWaalsContact NH2-C 3.28Å; R535-S566 PolarHBondContact NH2-O 3.42Å; R535-S566 PolarHBondContact NH2-OG 2.81Å; E562-S566 WeakPolarHBondContact O-CB 3.42Å; E562-S566 PolarHBondContact O-N 3.26Å; Q563-S566 WeakPolarHBondContact O-CB 3.32Å; Q563-S566 PolarHBondContact O-N 2.92Å; S566-Q569 PolarHBondContact O-N 3.47Å; S566-D570 PolarHBondContact O-N 2.93Å
567	I	92.9	Very high	90.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.4	-46.3	176.2	-64.9	164.5	0	0	0	111.3	L540 V547 Q563 M564 Q569 D570 L571 V584	L540-I567 HydrophobicContact CD2-CB 4.3Å; L540-I567 HydrophobicContact CD2-CG1 4.24Å; L540-I567 HydrophobicContact CD2-CG2 4Å; V547-I567 HydrophobicContact CG2-CD1 4.22Å; Q563-I567 VanDerWaalsContact O-CG1 3.26Å; Q563-I567 WeakPolarHBondContact O-CG1 3.44Å; Q563-I567 PolarHBondContact O-N 3.08Å; M564-I567 HydrophobicContact SD-CD1 4.11Å; I567-Q569 VanDerWaalsContact C-N 3.29Å; I567-Q569 PolarHBondContact O-N 3.35Å; I567-D570 PolarHBondContact O-N 3.37Å; I567-L571 HydrophobicContact CG2-CD1 4.27Å; I567-L571 WeakPolarHBondContact O-CG 3.34Å; I567-L571 PolarHBondContact O-N 3.2Å; I567-L571 VanDerWaalsContact O-N 3.07Å; I567-V584 HydrophobicContact CB-CG1 4.44Å; I567-V584 HydrophobicContact CG2-CB 4.44Å; I567-V584 HydrophobicContact CG2-CG1 3.68Å; I567-V584 HydrophobicContact CG2-CG2 3.84Å
568	R	92.8	Very high	90.3	Very high	19 Å²	19	32.3 Å²	32.3	7%	0.072	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-38.9	175.9	-73.4	-176.5	-51.1	179.3	7.2	112.1	M564 K565 T572 V584 Y585 H588 E600 C604	M564-R568 WeakPolarHBondContact O-CB 3.44Å; M564-R568 VanDerWaalsContact O-CG 3.24Å; M564-R568 WeakPolarHBondContact O-CG 3.29Å; M564-R568 PolarHBondContact O-N 3.12Å; M564-R568 VanDerWaalsContact O-N 3.12Å; K565-R568 VanDerWaalsContact CG-NH2 3.35Å; K565-R568 PolarHBondContact O-N 3.03Å; R568-T572 WeakPolarHBondContact O-CB 3.48Å; R568-T572 PolarHBondContact O-N 3.1Å; R568-T572 PolarHBondContact O-OG1 3.35Å; R568-V584 HydrophobicContact CG-CG1 3.81Å; R568-Y585 HydrophobicContact CB-CE2 4.31Å; R568-Y585 HydrophobicContact CG-CD1 4.49Å; R568-Y585 HydrophobicContact CG-CD2 4.19Å; R568-Y585 HydrophobicContact CG-CE1 4.25Å; R568-Y585 HydrophobicContact CG-CE2 3.95Å; R568-Y585 HydrophobicContact CG-CG 4.46Å; R568-H588 VanDerWaalsContact CZ-CE1 3.43Å; R568-H588 PolarHBondContact NE-ND1 2.69Å; R568-H588 VanDerWaalsContact NE-ND1 3.18Å; R568-H588 PolarHBondContact NH1-ND1 3.45Å; R568-H588 PolarHBondContact NH2-CE1 2.82Å; R568-E600 IonicContact CZ-OE2 3.69Å; R568-E600 IonicContact NH1-OE2 2.66Å; R568-E600 IonicContact NH2-OE2 2.79Å; R568-E600 PolarHBondContact NH2-OE2 3.42Å; R568-C604 PolarHBondContact NH1-SG 3.41Å
569	Q	90.1	Very high	90.2	Very high	10 Å²	10	33.9 Å²	33.9	5%	0.047	18%	0.182	C	C	.	.	H	α-helix	trans	-63.7	-50.3	176.5	169.2	170.2	59.7	0	0	111.5	Y76 Y522 L523 L525 K565 S566 I567 L571 T572 V573	Y76-Q569 PolarHBondContact OH-NE2 3.41Å; Y522-Q569 HydrophobicContact CD2-CB 4.4Å; Y522-Q569 HydrophobicContact CE2-CB 4.17Å; L523-Q569 PolarHBondContact O-NE2 3.32Å; L523-Q569 PolarHBondContact O-OE1 3.02Å; L523-Q569 VanDerWaalsContact O-OE1 3.09Å; L525-Q569 HydrophobicContact CD1-CG 4.43Å; K565-Q569 WeakPolarHBondContact O-CB 3.3Å; K565-Q569 PolarHBondContact O-N 3Å; S566-Q569 PolarHBondContact O-N 3.47Å; I567-Q569 VanDerWaalsContact C-N 3.29Å; I567-Q569 PolarHBondContact O-N 3.35Å; Q569-L571 VanDerWaalsContact C-N 3.26Å; Q569-L571 PolarHBondContact O-N 3.02Å; Q569-T572 WeakPolarHBondContact O-CB 3.34Å; Q569-T572 PolarHBondContact O-N 2.89Å; Q569-V573 HydrophobicContact CG-CG2 4.26Å; Q569-V573 WeakPolarHBondContact O-CG2 3.27Å; Q569-V573 PolarHBondContact O-N 3.32Å
570	D	90.6	Very high	90.2	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-38.4	179.2	-70	-26	0	0	0	111.3	K520 V534 R535 L540 S566 I567 Q574	K520-D570 IonicContact NZ-OD1 2.67Å; K520-D570 PolarHBondContact NZ-OD1 3.33Å; K520-D570 IonicContact NZ-OD2 3.64Å; V534-D570 HydrophobicContact CG1-CB 4.09Å; R535-D570 IonicContact CZ-OD2 3.2Å; R535-D570 IonicContact NE-OD2 2.76Å; R535-D570 PolarHBondContact NE-OD2 2.86Å; R535-D570 IonicContact NH2-OD2 2.75Å; R535-D570 PolarHBondContact NH2-OD2 3.49Å; L540-D570 HydrophobicContact CD1-CB 4.21Å; L540-D570 HydrophobicContact CD2-CB 3.82Å; S566-D570 PolarHBondContact O-N 2.93Å; I567-D570 PolarHBondContact O-N 3.37Å; D570-Q574 WeakPolarHBondContact O-CG 3.43Å; D570-Q574 PolarHBondContact O-N 3.37Å; D570-Q574 PolarHBondContact O-NE2 3.34Å
571	L	89.9	Confident	90.1	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-41	173.1	-71.5	166.8	0	0	0	112.9	L540 I567 Q569 Q574 G575 I576 F580 T581 V584	L540-L571 HydrophobicContact CD1-CD2 3.76Å; L540-L571 HydrophobicContact CD1-CG 3.96Å; I567-L571 HydrophobicContact CG2-CD1 4.27Å; I567-L571 WeakPolarHBondContact O-CG 3.34Å; I567-L571 PolarHBondContact O-N 3.2Å; I567-L571 VanDerWaalsContact O-N 3.07Å; Q569-L571 VanDerWaalsContact C-N 3.26Å; Q569-L571 PolarHBondContact O-N 3.02Å; L571-Q574 PolarHBondContact O-N 3.31Å; L571-G575 PolarHBondContact O-N 3.03Å; L571-I576 HydrophobicContact CD2-CB 4.14Å; L571-I576 HydrophobicContact CD2-CG2 4.09Å; L571-I576 PolarHBondContact O-N 2.64Å; L571-F580 HydrophobicContact CD1-CE1 4.28Å; L571-F580 HydrophobicContact CD2-CD1 4.05Å; L571-F580 HydrophobicContact CD2-CE1 4.06Å; L571-T581 HydrophobicContact CB-CG2 4.41Å; L571-T581 HydrophobicContact CD1-CG2 4.25Å; L571-V584 HydrophobicContact CD1-CB 4.02Å; L571-V584 HydrophobicContact CD1-CG1 4.06Å; L571-V584 HydrophobicContact CD1-CG2 3.93Å
572	T	88.2	Confident	90.1	Very high	87 Å²	87	31.4 Å²	31.4	53%	0.534	17%	0.172	S	C	.	.	H	α-helix	trans	-67.3	-40.6	179.5	-54.5	0	0	0	0	111.7	R568 Q569 Q574 G575	R568-T572 WeakPolarHBondContact O-CB 3.48Å; R568-T572 PolarHBondContact O-N 3.1Å; R568-T572 PolarHBondContact O-OG1 3.35Å; Q569-T572 WeakPolarHBondContact O-CB 3.34Å; Q569-T572 PolarHBondContact O-N 2.89Å; T572-Q574 VanDerWaalsContact C-N 3.34Å; T572-Q574 PolarHBondContact O-N 2.86Å; T572-G575 PolarHBondContact O-N 3.15Å
573	V	88.1	Confident	90.1	Very high	27 Å²	27	31.4 Å²	31.4	16%	0.164	17%	0.172	C	C	.	.	H	α-helix	trans	-64.3	-38	178.5	164.9	0	0	0	0	112	L525 P529 V534 Q569 G575	L525-V573 HydrophobicContact CD1-CG2 3.9Å; P529-V573 HydrophobicContact CB-CG1 4.07Å; P529-V573 HydrophobicContact CG-CB 4.37Å; P529-V573 HydrophobicContact CG-CG1 3.38Å; P529-V573 HydrophobicContact CG-CG2 4.02Å; V534-V573 HydrophobicContact CG1-CG1 4.34Å; V534-V573 HydrophobicContact CG2-CG1 3.83Å; Q569-V573 HydrophobicContact CG-CG2 4.26Å; Q569-V573 WeakPolarHBondContact O-CG2 3.27Å; Q569-V573 PolarHBondContact O-N 3.32Å; V573-G575 PolarHBondContact O-N 3.46Å
574	Q	85.6	Confident	90.1	Very high	12 Å²	12	31 Å²	31	6%	0.056	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-0.2	178.9	-57.8	175.6	93.5	0	0	112.8	I511 G513 V534 R535 D570 L571 T572 I576	I511-Q574 WeakPolarHBondContact O-CG 3.39Å; G513-Q574 VanDerWaalsContact N-OE1 3.11Å; V534-Q574 HydrophobicContact CG1-CG 3.51Å; R535-Q574 PolarHBondContact O-NE2 2.75Å; R535-Q574 PolarHBondContact O-OE1 3.06Å; D570-Q574 WeakPolarHBondContact O-CG 3.43Å; D570-Q574 PolarHBondContact O-N 3.37Å; D570-Q574 PolarHBondContact O-NE2 3.34Å; L571-Q574 PolarHBondContact O-N 3.31Å; T572-Q574 VanDerWaalsContact C-N 3.34Å; T572-Q574 PolarHBondContact O-N 2.86Å; Q574-I576 HydrophobicContact CB-CD1 3.59Å; Q574-I576 HydrophobicContact CB-CG1 3.65Å; Q574-I576 HydrophobicContact CG-CD1 4.38Å; Q574-I576 PolarHBondContact O-N 2.85Å
575	G	83.8	Confident	90.1	Very high	56 Å²	56	31.9 Å²	31.9	58%	0.577	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.9	9.7	-176.4	0	0	0	0	0	115	L571 T572 V573 R577	L571-G575 PolarHBondContact O-N 3.03Å; T572-G575 PolarHBondContact O-N 3.15Å; V573-G575 PolarHBondContact O-N 3.46Å; G575-R577 PolarHBondContact O-N 3.1Å
576	I	85.3	Confident	90.1	Very high	35 Å²	35	30.1 Å²	30.1	18%	0.179	17%	0.166	C	C	.	.			trans	-77.3	110.4	-165	-61.6	176.7	0	0	0	110.9	V537 L571 Q574 T578 T581	V537-I576 HydrophobicContact CG2-CD1 3.48Å; V537-I576 VanDerWaalsContact CG2-CD1 3.48Å; L571-I576 HydrophobicContact CD2-CB 4.14Å; L571-I576 HydrophobicContact CD2-CG2 4.09Å; L571-I576 PolarHBondContact O-N 2.64Å; Q574-I576 HydrophobicContact CB-CD1 3.59Å; Q574-I576 HydrophobicContact CB-CG1 3.65Å; Q574-I576 HydrophobicContact CG-CD1 4.38Å; Q574-I576 PolarHBondContact O-N 2.85Å; I576-T578 HydrophobicContact CG2-CG2 4.05Å; I576-T581 WeakPolarHBondContact O-CG2 3.19Å; I576-T581 PolarHBondContact O-OG1 3.32Å
577	R	86.3	Confident	90.2	Very high	111 Å²	111	30.9 Å²	30.9	42%	0.419	17%	0.171	S	C	.	.			trans	-116.4	76.6	177.2	-59.1	179.5	73.6	78	-2.2	110.1	G575 L611 D614 N615	G575-R577 PolarHBondContact O-N 3.1Å; R577-L611 HydrophobicContact CB-CD2 4.27Å; R577-L611 HydrophobicContact CG-CD2 4.28Å; R577-D614 IonicContact CZ-OD2 2.7Å; R577-D614 IonicContact NE-OD2 3.87Å; R577-D614 PolarHBondContact NE-OD2 2.82Å; R577-D614 IonicContact NH2-OD2 3.62Å; R577-D614 PolarHBondContact NH2-OD2 3.47Å; R577-N615 PolarHBondContact O-ND2 3.39Å
578	T	87.6	Confident	90.2	Very high	58 Å²	58	30.9 Å²	30.9	36%	0.356	17%	0.171	S	C	.	.	S	Bend	trans	-124.1	174.8	179.2	60.2	0	0	0	0	111.1	I576 F580 T581 V582	I576-T578 HydrophobicContact CG2-CG2 4.05Å; T578-F580 PolarHBondContact O-N 3.16Å; T578-F580 VanDerWaalsContact O-N 3.14Å; T578-T581 PolarHBondContact N-OG1 2.98Å; T578-T581 WeakPolarHBondContact O-CA 3.47Å; T578-T581 VanDerWaalsContact O-CB 3.23Å; T578-T581 WeakPolarHBondContact O-CB 3.28Å; T578-T581 PolarHBondContact O-N 3.39Å; T578-V582 PolarHBondContact O-N 3.18Å; T578-V582 VanDerWaalsContact O-N 3.15Å
579	D	89.4	Confident	90.3	Very high	106 Å²	106	30 Å²	30	57%	0.567	17%	0.168	S	C	*	.	H	α-helix	trans	-54.9	-31.5	175.6	-48.9	-52.9	0	0	0	113.1	T581 V582 E583	D579-T581 VanDerWaalsContact C-N 3.35Å; D579-V582 WeakPolarHBondContact O-CB 3.3Å; D579-V582 PolarHBondContact O-N 3.21Å; D579-E583 WeakPolarHBondContact O-CB 3.38Å; D579-E583 PolarHBondContact O-N 2.8Å
580	F	90.4	Very high	90.4	Very high	3 Å²	3	32.1 Å²	32.1	1%	0.013	18%	0.176	C	C	.	.	H	α-helix	trans	-67.2	-35.8	174	176.2	-112.5	0	0	0	112.4	V537 L540 R541 L544 L571 T578 V582 E583 V584	V537-F580 HydrophobicContact CG1-CD1 4.19Å; L540-F580 HydrophobicContact CB-CE1 3.76Å; L540-F580 HydrophobicContact CB-CZ 4.01Å; R541-F580 HydrophobicContact CB-CE2 4.26Å; R541-F580 HydrophobicContact CB-CZ 4.34Å; R541-F580 HydrophobicContact CG-CD1 4.38Å; R541-F580 HydrophobicContact CG-CD2 3.78Å; R541-F580 HydrophobicContact CG-CE1 4.16Å; R541-F580 HydrophobicContact CG-CE2 3.52Å; R541-F580 HydrophobicContact CG-CG 4.21Å; R541-F580 HydrophobicContact CG-CZ 3.74Å; L544-F580 HydrophobicContact CB-CE2 4.28Å; L544-F580 HydrophobicContact CB-CZ 4.38Å; L544-F580 HydrophobicContact CD2-CD2 4.42Å; L544-F580 HydrophobicContact CD2-CE2 3.63Å; L544-F580 HydrophobicContact CD2-CZ 4.38Å; L571-F580 HydrophobicContact CD1-CE1 4.28Å; L571-F580 HydrophobicContact CD2-CD1 4.05Å; L571-F580 HydrophobicContact CD2-CE1 4.06Å; T578-F580 PolarHBondContact O-N 3.16Å; T578-F580 VanDerWaalsContact O-N 3.14Å; F580-V582 VanDerWaalsContact C-N 3.33Å; F580-E583 PolarHBondContact O-N 3.27Å; F580-V584 HydrophobicContact CD2-CG2 4.4Å; F580-V584 HydrophobicContact CE1-CG2 4.04Å; F580-V584 HydrophobicContact CE2-CG2 3.83Å; F580-V584 HydrophobicContact CZ-CG2 3.62Å; F580-V584 WeakPolarHBondContact O-CG2 2.93Å; F580-V584 PolarHBondContact O-N 3.29Å
581	T	91.4	Very high	90.6	Very high	6 Å²	6	32.3 Å²	32.3	4%	0.037	18%	0.177	C	C	.	.	H	α-helix	trans	-63	-44.1	172.5	-51.8	0	0	0	0	110.1	L571 I576 T578 D579 V584 Y585 L611	L571-T581 HydrophobicContact CB-CG2 4.41Å; L571-T581 HydrophobicContact CD1-CG2 4.25Å; I576-T581 WeakPolarHBondContact O-CG2 3.19Å; I576-T581 PolarHBondContact O-OG1 3.32Å; T578-T581 PolarHBondContact N-OG1 2.98Å; T578-T581 WeakPolarHBondContact O-CA 3.47Å; T578-T581 VanDerWaalsContact O-CB 3.23Å; T578-T581 WeakPolarHBondContact O-CB 3.28Å; T578-T581 PolarHBondContact O-N 3.39Å; D579-T581 VanDerWaalsContact C-N 3.35Å; T581-V584 PolarHBondContact O-N 2.99Å; T581-Y585 HydrophobicContact CG2-CD2 4.03Å; T581-Y585 HydrophobicContact CG2-CE2 4.06Å; T581-Y585 WeakPolarHBondContact O-CD2 3.35Å; T581-Y585 PolarHBondContact O-N 2.82Å; T581-Y585 VanDerWaalsContact O-N 3.11Å; T581-L611 HydrophobicContact CG2-CD1 4.07Å; T581-L611 HydrophobicContact CG2-CD2 4.02Å
582	V	92.3	Very high	90.7	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.024	18%	0.177	C	C	.	.	H	α-helix	trans	-57.3	-51.3	172.6	176.5	0	0	0	0	110.5	T578 D579 F580 V584 Y585 E586 L608 L611 Y612 N615	T578-V582 PolarHBondContact O-N 3.18Å; T578-V582 VanDerWaalsContact O-N 3.15Å; D579-V582 WeakPolarHBondContact O-CB 3.3Å; D579-V582 PolarHBondContact O-N 3.21Å; F580-V582 VanDerWaalsContact C-N 3.33Å; V582-V584 VanDerWaalsContact C-N 3.32Å; V582-V584 PolarHBondContact O-N 3.43Å; V582-Y585 PolarHBondContact O-N 3.4Å; V582-Y585 VanDerWaalsContact O-N 3.09Å; V582-E586 HydrophobicContact CG1-CG 4.06Å; V582-E586 VanDerWaalsContact CG1-OE1 3.32Å; V582-E586 WeakPolarHBondContact CG1-OE1 3.27Å; V582-E586 WeakPolarHBondContact O-CG 3.38Å; V582-E586 PolarHBondContact O-N 3.5Å; V582-L608 HydrophobicContact CG1-CD2 4.21Å; V582-L611 HydrophobicContact CG2-CB 4.03Å; V582-Y612 HydrophobicContact CG1-CD1 4.22Å; V582-Y612 HydrophobicContact CG1-CE1 3.52Å; V582-N615 HydrophobicContact CG2-CB 4.39Å
583	E	92.8	Very high	90.9	Very high	71 Å²	71	28.4 Å²	28.4	33%	0.332	15%	0.152	S	C	.	.	H	α-helix	trans	-54.6	-43.5	179.7	-161.1	-150.6	148.3	0	0	112.9	L544 K548 D579 F580 C587	L544-E583 HydrophobicContact CD2-CG 4.38Å; L544-E583 WeakPolarHBondContact CD2-OE1 3.48Å; K548-E583 IonicContact NZ-OE1 2.56Å; K548-E583 PolarHBondContact NZ-OE1 2.95Å; D579-E583 WeakPolarHBondContact O-CB 3.38Å; D579-E583 PolarHBondContact O-N 2.8Å; F580-E583 PolarHBondContact O-N 3.27Å; E583-C587 WeakPolarHBondContact O-CB 3.23Å; E583-C587 PolarHBondContact O-N 3.48Å
584	V	94	Very high	91	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.3	-46.6	176.1	167	0	0	0	0	111.5	L544 M564 I567 R568 L571 F580 T581 V582 C587 H588	L544-V584 HydrophobicContact CD1-CG2 4.25Å; L544-V584 HydrophobicContact CD2-CG2 3.86Å; L544-V584 HydrophobicContact CG-CG2 4.46Å; M564-V584 HydrophobicContact SD-CG1 4.12Å; I567-V584 HydrophobicContact CB-CG1 4.44Å; I567-V584 HydrophobicContact CG2-CB 4.44Å; I567-V584 HydrophobicContact CG2-CG1 3.68Å; I567-V584 HydrophobicContact CG2-CG2 3.84Å; R568-V584 HydrophobicContact CG-CG1 3.81Å; L571-V584 HydrophobicContact CD1-CB 4.02Å; L571-V584 HydrophobicContact CD1-CG1 4.06Å; L571-V584 HydrophobicContact CD1-CG2 3.93Å; F580-V584 HydrophobicContact CD2-CG2 4.4Å; F580-V584 HydrophobicContact CE1-CG2 4.04Å; F580-V584 HydrophobicContact CE2-CG2 3.83Å; F580-V584 HydrophobicContact CZ-CG2 3.62Å; F580-V584 WeakPolarHBondContact O-CG2 2.93Å; F580-V584 PolarHBondContact O-N 3.29Å; T581-V584 PolarHBondContact O-N 2.99Å; V582-V584 VanDerWaalsContact C-N 3.32Å; V582-V584 PolarHBondContact O-N 3.43Å; V584-C587 PolarHBondContact O-N 3Å; V584-H588 PolarHBondContact O-N 2.86Å
585	Y	94.6	Very high	91.2	Very high	18 Å²	18	35.1 Å²	35.1	7%	0.071	18%	0.181	C	C	.	.	H	α-helix	trans	-66.6	-40.6	179.6	-91.2	-89.9	0	0	0	112.2	R568 T581 V582 H588 A589 C604 Q607 L611	R568-Y585 HydrophobicContact CB-CE2 4.31Å; R568-Y585 HydrophobicContact CG-CD1 4.49Å; R568-Y585 HydrophobicContact CG-CD2 4.19Å; R568-Y585 HydrophobicContact CG-CE1 4.25Å; R568-Y585 HydrophobicContact CG-CE2 3.95Å; R568-Y585 HydrophobicContact CG-CG 4.46Å; T581-Y585 HydrophobicContact CG2-CD2 4.03Å; T581-Y585 HydrophobicContact CG2-CE2 4.06Å; T581-Y585 WeakPolarHBondContact O-CD2 3.35Å; T581-Y585 PolarHBondContact O-N 2.82Å; T581-Y585 VanDerWaalsContact O-N 3.11Å; V582-Y585 PolarHBondContact O-N 3.4Å; V582-Y585 VanDerWaalsContact O-N 3.09Å; Y585-H588 PolarHBondContact O-N 2.63Å; Y585-A589 WeakPolarHBondContact O-CB 3.37Å; Y585-A589 PolarHBondContact O-N 2.92Å; Y585-C604 HydrophobicContact CD1-CB 4.43Å; Y585-Q607 HydrophobicContact CD1-CB 3.87Å; Y585-Q607 HydrophobicContact CE1-CB 3.37Å; Y585-Q607 HydrophobicContact CE1-CG 3.73Å; Y585-L611 HydrophobicContact CD2-CD1 3.74Å; Y585-L611 HydrophobicContact CE2-CD1 4.13Å; Y585-L611 HydrophobicContact CG-CD1 4.1Å
586	E	93.6	Very high	91.5	Very high	7 Å²	7	33.3 Å²	33.3	3%	0.033	16%	0.162	C	C	.	.	H	α-helix	trans	-65.1	-42.8	174.2	-68.2	-170	-171	0	0	112	V582 H588 A589 R590 L608 Y612 S617 N619 F623	V582-E586 HydrophobicContact CG1-CG 4.06Å; V582-E586 VanDerWaalsContact CG1-OE1 3.32Å; V582-E586 WeakPolarHBondContact CG1-OE1 3.27Å; V582-E586 WeakPolarHBondContact O-CG 3.38Å; V582-E586 PolarHBondContact O-N 3.5Å; E586-H588 VanDerWaalsContact C-N 3.34Å; E586-H588 PolarHBondContact O-N 2.67Å; E586-A589 PolarHBondContact O-N 3.39Å; E586-R590 WeakPolarHBondContact O-CG 3.29Å; E586-R590 PolarHBondContact O-N 3.43Å; E586-R590 IonicContact OE2-CZ 3.73Å; E586-R590 IonicContact OE2-NH1 3.13Å; E586-R590 PolarHBondContact OE2-NH1 3.17Å; E586-R590 VanDerWaalsContact OE2-NH1 3.13Å; E586-R590 IonicContact OE2-NH2 3.45Å; E586-R590 PolarHBondContact OE2-NH2 3.3Å; E586-L608 HydrophobicContact CG-CD1 4.22Å; E586-L608 HydrophobicContact CG-CD2 3.86Å; E586-Y612 WeakPolarHBondContact CG-OH 3.44Å; E586-Y612 PolarHBondContact OE1-OH 3.5Å; E586-S617 PolarHBondContact OE1-OG 3.21Å; E586-S617 VanDerWaalsContact OE1-OG 3.07Å; E586-N619 WeakPolarHBondContact OE1-CB 3.34Å; E586-N619 WeakPolarHBondContact OE2-CB 3.42Å; E586-N619 PolarHBondContact OE2-ND2 2.87Å; E586-F623 HydrophobicContact CB-CE2 3.67Å; E586-F623 HydrophobicContact CB-CZ 3.73Å; E586-F623 HydrophobicContact CG-CD2 3.9Å; E586-F623 HydrophobicContact CG-CE2 3.39Å; E586-F623 HydrophobicContact CG-CZ 3.89Å
587	C	93.8	Very high	91.8	Very high	16 Å²	16	33.8 Å²	33.8	11%	0.108	16%	0.164	C	C	.	.	H	α-helix	trans	-62	-42.3	176.9	-171.3	0	0	0	0	111.4	L544 K548 M564 E583 V584 R590 I591	L544-C587 HydrophobicContact CD1-CB 4.14Å; K548-C587 WeakPolarHBondContact CE-SG 3.34Å; M564-C587 HydrophobicContact CE-CB 4.46Å; E583-C587 WeakPolarHBondContact O-CB 3.23Å; E583-C587 PolarHBondContact O-N 3.48Å; V584-C587 PolarHBondContact O-N 3Å; C587-R590 PolarHBondContact O-N 2.96Å; C587-I591 WeakPolarHBondContact O-CG1 3.23Å; C587-I591 PolarHBondContact O-N 3.13Å; C587-I591 VanDerWaalsContact O-N 3.12Å
588	H	94.8	Very high	91.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.2	-44.3	175.5	-158.5	165.9	0	0	0	111.4	M564 R568 V584 Y585 E586 R590 I591 A592 E600	M564-H588 HydrophobicContact CB-CB 4.36Å; M564-H588 HydrophobicContact CG-CB 3.44Å; M564-H588 VanDerWaalsContact CG-CB 3.44Å; M564-H588 WeakPolarHBondContact CG-ND1 3.16Å; R568-H588 VanDerWaalsContact CZ-CE1 3.43Å; R568-H588 PolarHBondContact NE-ND1 2.69Å; R568-H588 VanDerWaalsContact NE-ND1 3.18Å; R568-H588 PolarHBondContact NH1-ND1 3.45Å; R568-H588 PolarHBondContact NH2-CE1 2.82Å; V584-H588 PolarHBondContact O-N 2.86Å; Y585-H588 PolarHBondContact O-N 2.63Å; E586-H588 VanDerWaalsContact C-N 3.34Å; E586-H588 PolarHBondContact O-N 2.67Å; H588-R590 VanDerWaalsContact C-N 3.29Å; H588-R590 PolarHBondContact O-N 3.38Å; H588-I591 PolarHBondContact O-N 3.04Å; H588-A592 WeakPolarHBondContact O-CB 3.2Å; H588-A592 PolarHBondContact O-N 3.1Å; H588-E600 IonicContact CE1-OE2 3.97Å
589	A	94.3	Very high	92.1	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-57.6	-42.4	179.2	0	0	0	0	0	111.8	Y585 E586 A592 L593 F601 C604 L608 F623	Y585-A589 WeakPolarHBondContact O-CB 3.37Å; Y585-A589 PolarHBondContact O-N 2.92Å; E586-A589 PolarHBondContact O-N 3.39Å; A589-A592 PolarHBondContact O-N 2.81Å; A589-L593 WeakPolarHBondContact O-CG 3.42Å; A589-L593 PolarHBondContact O-N 2.88Å; A589-F601 HydrophobicContact CB-CD2 3.96Å; A589-F601 HydrophobicContact CB-CE2 4.18Å; A589-C604 HydrophobicContact CB-CB 3.71Å; A589-L608 HydrophobicContact CB-CD1 4.44Å; A589-F623 HydrophobicContact CB-CD1 4.37Å; A589-F623 HydrophobicContact CB-CE1 3.51Å; A589-F623 HydrophobicContact CB-CZ 4.2Å
590	R	92.8	Very high	92.2	Very high	55 Å²	55	30.6 Å²	30.6	21%	0.208	15%	0.147	C	C	.	.	H	α-helix	trans	-64.7	-48.4	175.7	-66.2	179.3	-177.4	116.2	-11.2	111.9	E586 C587 H588 A592 L593 E594 N619 E622 F623 M685	E586-R590 WeakPolarHBondContact O-CG 3.29Å; E586-R590 PolarHBondContact O-N 3.43Å; E586-R590 IonicContact OE2-CZ 3.73Å; E586-R590 IonicContact OE2-NH1 3.13Å; E586-R590 PolarHBondContact OE2-NH1 3.17Å; E586-R590 VanDerWaalsContact OE2-NH1 3.13Å; E586-R590 IonicContact OE2-NH2 3.45Å; E586-R590 PolarHBondContact OE2-NH2 3.3Å; C587-R590 PolarHBondContact O-N 2.96Å; H588-R590 VanDerWaalsContact C-N 3.29Å; H588-R590 PolarHBondContact O-N 3.38Å; R590-A592 VanDerWaalsContact C-N 3.29Å; R590-A592 PolarHBondContact O-N 3.34Å; R590-L593 WeakPolarHBondContact O-CB 3.4Å; R590-L593 PolarHBondContact O-N 3.48Å; R590-L593 VanDerWaalsContact O-N 3.07Å; R590-E594 PolarHBondContact O-N 2.84Å; R590-N619 VanDerWaalsContact NH2-CG 3.32Å; R590-N619 PolarHBondContact NH2-ND2 3.23Å; R590-E622 IonicContact CZ-OE1 3.42Å; R590-E622 IonicContact CZ-OE2 2.74Å; R590-E622 IonicContact NE-OE1 3.66Å; R590-E622 PolarHBondContact NE-OE1 3.49Å; R590-E622 IonicContact NE-OE2 3.57Å; R590-E622 VanDerWaalsContact NH2-CD 3.29Å; R590-E622 IonicContact NH2-OE1 2.92Å; R590-E622 PolarHBondContact NH2-OE1 3.27Å; R590-E622 IonicContact NH2-OE2 3.68Å; R590-E622 PolarHBondContact NH2-OE2 3.24Å; R590-F623 HydrophobicContact CG-CZ 4.09Å; R590-M685 HydrophobicContact CB-CE 3.98Å; R590-M685 HydrophobicContact CB-SD 3.76Å; R590-M685 HydrophobicContact CG-CE 4.47Å; R590-M685 HydrophobicContact CG-SD 3.63Å; R590-M685 WeakPolarHBondContact O-CE 3.4Å
591	I	92.9	Very high	92.4	Very high	6 Å²	6	30.5 Å²	30.5	3%	0.031	15%	0.146	C	C	.	.	H	α-helix	trans	-57.2	-40.2	175.7	-70	168.7	0	0	0	112	W551 Y557 A560 M564 C587 H588 E594	W551-I591 HydrophobicContact CD2-CG1 4.41Å; W551-I591 HydrophobicContact CD2-CG2 4.2Å; W551-I591 HydrophobicContact CE3-CG2 4.34Å; W551-I591 HydrophobicContact CG-CD1 4.42Å; W551-I591 HydrophobicContact CG-CG1 4.34Å; W551-I591 HydrophobicContact CH2-CG2 3.84Å; W551-I591 HydrophobicContact CZ2-CB 4.46Å; W551-I591 HydrophobicContact CZ2-CG2 3.77Å; W551-I591 HydrophobicContact CZ3-CG2 4.19Å; Y557-I591 HydrophobicContact CD2-CG2 4.1Å; Y557-I591 HydrophobicContact CE2-CG2 4.03Å; A560-I591 HydrophobicContact CB-CG2 4.43Å; M564-I591 HydrophobicContact CE-CD1 3.81Å; C587-I591 WeakPolarHBondContact O-CG1 3.23Å; C587-I591 PolarHBondContact O-N 3.13Å; C587-I591 VanDerWaalsContact O-N 3.12Å; H588-I591 PolarHBondContact O-N 3.04Å; I591-E594 PolarHBondContact O-N 2.84Å
592	A	93.4	Very high	92.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-67.4	-38.4	176.4	0	0	0	0	0	112.2	H588 A589 R590 G596 D597 E600 F601	H588-A592 WeakPolarHBondContact O-CB 3.2Å; H588-A592 PolarHBondContact O-N 3.1Å; A589-A592 PolarHBondContact O-N 2.81Å; R590-A592 VanDerWaalsContact C-N 3.29Å; R590-A592 PolarHBondContact O-N 3.34Å; A592-G596 CarbonylContact O-C 3.53Å; A592-G596 WeakPolarHBondContact O-CA 3.15Å; A592-G596 PolarHBondContact O-N 2.75Å; A592-D597 HydrophobicContact CB-CB 4.44Å; A592-D597 PolarHBondContact O-N 2.75Å; A592-E600 HydrophobicContact CB-CB 4.16Å; A592-F601 HydrophobicContact CB-CB 4.26Å
593	L	91.6	Very high	92.4	Very high	5 Å²	5	36.8 Å²	36.8	3%	0.026	18%	0.177	C	C	.	.	H	α-helix	trans	-64.4	-40.2	174.2	-72.2	179.6	0	0	0	112.9	A589 R590 K595 G596 F601 Y626 M685 L689	A589-L593 WeakPolarHBondContact O-CG 3.42Å; A589-L593 PolarHBondContact O-N 2.88Å; R590-L593 WeakPolarHBondContact O-CB 3.4Å; R590-L593 PolarHBondContact O-N 3.48Å; R590-L593 VanDerWaalsContact O-N 3.07Å; L593-K595 PolarHBondContact O-N 2.79Å; L593-G596 WeakPolarHBondContact O-CA 3.42Å; L593-G596 PolarHBondContact O-N 3.25Å; L593-F601 HydrophobicContact CD1-CD2 3.96Å; L593-F601 HydrophobicContact CD1-CE2 3.87Å; L593-F601 HydrophobicContact CD2-CB 4.19Å; L593-F601 HydrophobicContact CD2-CD1 4.14Å; L593-F601 HydrophobicContact CD2-CD2 3.66Å; L593-F601 HydrophobicContact CD2-CE2 4.13Å; L593-F601 HydrophobicContact CD2-CG 3.68Å; L593-F601 HydrophobicContact CG-CD2 3.61Å; L593-F601 HydrophobicContact CG-CE2 4.05Å; L593-F601 HydrophobicContact CG-CG 4.12Å; L593-Y626 HydrophobicContact CD1-CD2 3.84Å; L593-Y626 HydrophobicContact CD1-CE2 3.88Å; L593-Y626 HydrophobicContact CD1-CG 4.44Å; L593-M685 HydrophobicContact CB-CE 4.08Å; L593-M685 HydrophobicContact CD1-CB 4.45Å; L593-L689 HydrophobicContact CD1-CD1 4.27Å; L593-L689 HydrophobicContact CD2-CD1 4.03Å; L593-L689 HydrophobicContact CD2-CD2 3.7Å; L593-L689 HydrophobicContact CD2-CG 3.65Å
594	E	91.3	Very high	92.4	Very high	85 Å²	85	33.4 Å²	33.4	40%	0.397	16%	0.161	S	C	.	.	H	α-helix	trans	-60.8	-38.7	-178.7	-73.4	172.2	-157.7	0	0	113.5	W551 R590 I591 M685	W551-E594 HydrophobicContact CZ2-CB 4.28Å; W551-E594 PolarHBondContact NE1-OE2 3.5Å; R590-E594 PolarHBondContact O-N 2.84Å; I591-E594 PolarHBondContact O-N 2.84Å; E594-M685 HydrophobicContact CG-CE 3.5Å
595	K	89.9	Confident	92.3	Very high	96 Å²	96	33.7 Å²	33.7	42%	0.417	16%	0.162	S	C	.	.	H	α-helix	trans	-90.5	-6	172.1	-58.4	-68	-173.9	174	0	112.9	W551 Q555 Y557 L593	W551-K595 HydrophobicContact CH2-CD 3.99Å; W551-K595 HydrophobicContact CH2-CG 3.56Å; W551-K595 HydrophobicContact CZ2-CG 4.14Å; Q555-K595 VanDerWaalsContact O-CE 3.32Å; Q555-K595 WeakPolarHBondContact O-CE 3.37Å; Q555-K595 PolarHBondContact O-NZ 2.84Å; Y557-K595 HydrophobicContact CD2-CB 4.23Å; Y557-K595 HydrophobicContact CD2-CG 3.81Å; Y557-K595 HydrophobicContact CG-CB 4.27Å; Y557-K595 HydrophobicContact CG-CG 3.9Å; L593-K595 PolarHBondContact O-N 2.79Å
596	G	88.4	Confident	92.1	Very high	17 Å²	17	36.5 Å²	36.5	18%	0.175	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	24.2	177.9	0	0	0	0	0	115.3	A592 L593 H598 K692	A592-G596 CarbonylContact O-C 3.53Å; A592-G596 WeakPolarHBondContact O-CA 3.15Å; A592-G596 PolarHBondContact O-N 2.75Å; L593-G596 WeakPolarHBondContact O-CA 3.42Å; L593-G596 PolarHBondContact O-N 3.25Å; G596-H598 PolarHBondContact O-N 3.07Å; G596-K692 WeakPolarHBondContact O-CE 3.47Å; G596-K692 PolarHBondContact O-NZ 3.33Å
597	D	92.4	Very high	92	Very high	45 Å²	45	40.2 Å²	40.2	24%	0.241	20%	0.199	C	C	.	.			trans	-74	90.3	168.8	-170.3	-29.2	0	0	0	109.9	Y557 A592 E599 E600 F601	Y557-D597 HydrophobicContact CE1-CB 4.13Å; Y557-D597 WeakPolarHBondContact OH-CB 3.21Å; Y557-D597 PolarHBondContact OH-OD2 3.47Å; A592-D597 HydrophobicContact CB-CB 4.44Å; A592-D597 PolarHBondContact O-N 2.75Å; D597-E599 VanDerWaalsContact C-N 3.27Å; D597-E599 PolarHBondContact O-N 3.23Å; D597-E599 PolarHBondContact OD1-N 2.99Å; D597-E600 PolarHBondContact OD1-N 3.01Å; D597-F601 WeakPolarHBondContact O-CB 3.23Å; D597-F601 PolarHBondContact O-N 3.08Å; D597-F601 VanDerWaalsContact O-N 3.14Å
598	H	88.2	Confident	91.9	Very high	63 Å²	63	39.6 Å²	39.6	29%	0.292	19%	0.194	S	C	.	.	H	α-helix	trans	-72.6	-14.7	178.6	72.1	-58.9	0	0	0	114.2	G596 N602 F633	G596-H598 PolarHBondContact O-N 3.07Å; H598-N602 WeakPolarHBondContact O-CB 3.13Å; H598-N602 PolarHBondContact O-N 3.14Å; H598-N602 VanDerWaalsContact O-N 3.15Å; H598-F633 AromaticContact CD2-CE1 3.64Å
599	E	91.7	Very high	91.6	Very high	131 Å²	131	43.1 Å²	43.1	61%	0.612	21%	0.209	S	C	*	.	H	α-helix	trans	-83.9	-46.4	-179.7	-63.1	-172.2	-179.1	0	0	110.5	D597 N602 Q603	D597-E599 VanDerWaalsContact C-N 3.27Å; D597-E599 PolarHBondContact O-N 3.23Å; D597-E599 PolarHBondContact OD1-N 2.99Å; E599-N602 PolarHBondContact O-N 2.83Å; E599-Q603 WeakPolarHBondContact O-CG 2.72Å; E599-Q603 PolarHBondContact O-N 3.22Å; E599-Q603 PolarHBondContact O-NE2 3.31Å
600	E	92.3	Very high	91.4	Very high	15 Å²	15	44.7 Å²	44.7	7%	0.07	22%	0.222	C	C	.	.	H	α-helix	trans	-66.2	-38.2	170	-75	-60.7	144.9	0	0	112.1	K565 R568 H588 A592 D597 N602 Q603 C604	K565-E600 WeakPolarHBondContact CE-OE1 3.14Å; K565-E600 WeakPolarHBondContact CE-OE2 3.41Å; K565-E600 IonicContact NZ-OE1 2.74Å; K565-E600 PolarHBondContact NZ-OE1 3.36Å; K565-E600 IonicContact NZ-OE2 3.74Å; R568-E600 IonicContact CZ-OE2 3.69Å; R568-E600 IonicContact NH1-OE2 2.66Å; R568-E600 IonicContact NH2-OE2 2.79Å; R568-E600 PolarHBondContact NH2-OE2 3.42Å; H588-E600 IonicContact CE1-OE2 3.97Å; A592-E600 HydrophobicContact CB-CB 4.16Å; D597-E600 PolarHBondContact OD1-N 3.01Å; E600-N602 VanDerWaalsContact C-N 3.34Å; E600-N602 PolarHBondContact O-N 3.15Å; E600-Q603 PolarHBondContact O-N 3.23Å; E600-Q603 PolarHBondContact OE1-NE2 3.12Å; E600-C604 PolarHBondContact O-N 3.46Å; E600-C604 PolarHBondContact O-SG 3.27Å
601	F	93.8	Very high	91.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-57.5	-46.2	172.3	171.2	-100.4	0	0	0	111.7	A589 A592 L593 D597 Q603 C604 Q605 F623 Y626 Y630 L689	A589-F601 HydrophobicContact CB-CD2 3.96Å; A589-F601 HydrophobicContact CB-CE2 4.18Å; A592-F601 HydrophobicContact CB-CB 4.26Å; L593-F601 HydrophobicContact CD1-CD2 3.96Å; L593-F601 HydrophobicContact CD1-CE2 3.87Å; L593-F601 HydrophobicContact CD2-CB 4.19Å; L593-F601 HydrophobicContact CD2-CD1 4.14Å; L593-F601 HydrophobicContact CD2-CD2 3.66Å; L593-F601 HydrophobicContact CD2-CE2 4.13Å; L593-F601 HydrophobicContact CD2-CG 3.68Å; L593-F601 HydrophobicContact CG-CD2 3.61Å; L593-F601 HydrophobicContact CG-CE2 4.05Å; L593-F601 HydrophobicContact CG-CG 4.12Å; D597-F601 WeakPolarHBondContact O-CB 3.23Å; D597-F601 PolarHBondContact O-N 3.08Å; D597-F601 VanDerWaalsContact O-N 3.14Å; F601-Q603 PolarHBondContact O-N 3.47Å; F601-C604 WeakPolarHBondContact O-CB 3.46Å; F601-C604 PolarHBondContact O-N 2.86Å; F601-Q605 HydrophobicContact CE1-CB 4.21Å; F601-Q605 HydrophobicContact CE1-CG 4.39Å; F601-Q605 HydrophobicContact CE2-CB 4.43Å; F601-Q605 HydrophobicContact CZ-CB 4.03Å; F601-Q605 HydrophobicContact CZ-CG 4.16Å; F601-Q605 VanDerWaalsContact O-CB 3.31Å; F601-Q605 WeakPolarHBondContact O-CB 3.32Å; F601-Q605 PolarHBondContact O-N 2.88Å; F601-F623 HydrophobicContact CE2-CD1 4.49Å; F601-F623 HydrophobicContact CE2-CE1 4.5Å; F601-Y626 HydrophobicContact CE2-CD2 4.31Å; F601-Y630 HydrophobicContact CD1-CD2 4.17Å; F601-Y630 HydrophobicContact CE1-CD2 4.19Å; F601-Y630 HydrophobicContact CE1-CG 4.49Å; F601-L689 HydrophobicContact CD1-CD2 4.28Å; F601-L689 HydrophobicContact CE1-CD1 4.29Å; F601-L689 HydrophobicContact CE1-CD2 4.15Å; F601-L689 HydrophobicContact CZ-CD1 4.21Å
602	N	91.9	Very high	91	Very high	48 Å²	48	43.2 Å²	43.2	26%	0.257	22%	0.217	S	C	.	.	H	α-helix	trans	-66.4	-36.2	179.7	-172.8	59.4	0	0	0	112.6	H598 E599 E600 Q605 T606 Y630	H598-N602 WeakPolarHBondContact O-CB 3.13Å; H598-N602 PolarHBondContact O-N 3.14Å; H598-N602 VanDerWaalsContact O-N 3.15Å; E599-N602 PolarHBondContact O-N 2.83Å; E600-N602 VanDerWaalsContact C-N 3.34Å; E600-N602 PolarHBondContact O-N 3.15Å; N602-Q605 PolarHBondContact O-N 3.04Å; N602-T606 WeakPolarHBondContact O-CB 3.16Å; N602-T606 PolarHBondContact O-N 3.35Å; N602-T606 PolarHBondContact O-OG1 3.08Å; N602-Y630 HydrophobicContact CB-CE1 4.29Å; N602-Y630 HydrophobicContact CB-CE2 4.01Å; N602-Y630 WeakPolarHBondContact OD1-CE1 3.41Å
603	Q	91.3	Very high	90.6	Very high	95 Å²	95	51.4 Å²	51.4	44%	0.444	25%	0.253	S	S	.	.	H	α-helix	trans	-61	-43.9	170.3	-72.2	173.1	76	0	0	111.8	E599 E600 F601 Q607	E599-Q603 WeakPolarHBondContact O-CG 2.72Å; E599-Q603 PolarHBondContact O-N 3.22Å; E599-Q603 PolarHBondContact O-NE2 3.31Å; E600-Q603 PolarHBondContact O-N 3.23Å; E600-Q603 PolarHBondContact OE1-NE2 3.12Å; F601-Q603 PolarHBondContact O-N 3.47Å; Q603-Q607 PolarHBondContact O-N 3.44Å
604	C	93.7	Very high	90.1	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-51.5	175.7	-60.1	0	0	0	0	111.6	R568 Y585 A589 E600 F601 T606 Q607 L608	R568-C604 PolarHBondContact NH1-SG 3.41Å; Y585-C604 HydrophobicContact CD1-CB 4.43Å; A589-C604 HydrophobicContact CB-CB 3.71Å; E600-C604 PolarHBondContact O-N 3.46Å; E600-C604 PolarHBondContact O-SG 3.27Å; F601-C604 WeakPolarHBondContact O-CB 3.46Å; F601-C604 PolarHBondContact O-N 2.86Å; C604-T606 VanDerWaalsContact C-N 3.32Å; C604-T606 PolarHBondContact O-N 2.9Å; C604-Q607 PolarHBondContact O-N 3.27Å; C604-Q607 VanDerWaalsContact O-N 3.14Å; C604-L608 WeakPolarHBondContact O-CG 3.4Å; C604-L608 PolarHBondContact O-N 3.33Å
605	Q	91.1	Very high	89.6	Confident	6 Å²	6	52.9 Å²	52.9	3%	0.028	26%	0.263	C	S	.	.	H	α-helix	trans	-61.8	-37.4	-175.7	179.4	-111.3	103.1	0	0	112.2	F601 N602 L608 K609 R627	F601-Q605 HydrophobicContact CE1-CB 4.21Å; F601-Q605 HydrophobicContact CE1-CG 4.39Å; F601-Q605 HydrophobicContact CE2-CB 4.43Å; F601-Q605 HydrophobicContact CZ-CB 4.03Å; F601-Q605 HydrophobicContact CZ-CG 4.16Å; F601-Q605 VanDerWaalsContact O-CB 3.31Å; F601-Q605 WeakPolarHBondContact O-CB 3.32Å; F601-Q605 PolarHBondContact O-N 2.88Å; N602-Q605 PolarHBondContact O-N 3.04Å; Q605-L608 PolarHBondContact O-N 3.07Å; Q605-K609 PolarHBondContact O-N 2.85Å; Q605-R627 HydrophobicContact CG-CB 4.01Å; Q605-R627 HydrophobicContact CG-CG 4.24Å
606	T	90.8	Very high	89.1	Confident	76 Å²	76	53.3 Å²	53.3	47%	0.466	28%	0.276	S	S	.	.	H	α-helix	trans	-61.7	-43.3	174.7	-57.8	0	0	0	0	111.8	N602 C604	N602-T606 WeakPolarHBondContact O-CB 3.16Å; N602-T606 PolarHBondContact O-N 3.35Å; N602-T606 PolarHBondContact O-OG1 3.08Å; C604-T606 VanDerWaalsContact C-N 3.32Å; C604-T606 PolarHBondContact O-N 2.9Å
607	Q	91.2	Very high	88.7	Confident	86 Å²	86	54 Å²	54	40%	0.402	28%	0.278	S	S	.	.	H	α-helix	trans	-76.4	-34.7	178.7	-65.5	-70.3	20.3	0	0	112.5	Y585 Q603 C604 K609 A610 L611	Y585-Q607 HydrophobicContact CD1-CB 3.87Å; Y585-Q607 HydrophobicContact CE1-CB 3.37Å; Y585-Q607 HydrophobicContact CE1-CG 3.73Å; Q603-Q607 PolarHBondContact O-N 3.44Å; C604-Q607 PolarHBondContact O-N 3.27Å; C604-Q607 VanDerWaalsContact O-N 3.14Å; Q607-K609 VanDerWaalsContact C-N 3.32Å; Q607-K609 PolarHBondContact O-N 2.73Å; Q607-A610 WeakPolarHBondContact O-CB 3.29Å; Q607-A610 PolarHBondContact O-N 3.15Å; Q607-L611 WeakPolarHBondContact O-CG 3.48Å; Q607-L611 PolarHBondContact O-N 3.13Å
608	L	92.1	Very high	88.1	Confident	2 Å²	2	61 Å²	61	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-59.8	-41	171.2	-74.7	169.8	0	0	0	111.6	V582 E586 A589 C604 Q605 A610 L611 Y612 F623	V582-L608 HydrophobicContact CG1-CD2 4.21Å; E586-L608 HydrophobicContact CG-CD1 4.22Å; E586-L608 HydrophobicContact CG-CD2 3.86Å; A589-L608 HydrophobicContact CB-CD1 4.44Å; C604-L608 WeakPolarHBondContact O-CG 3.4Å; C604-L608 PolarHBondContact O-N 3.33Å; Q605-L608 PolarHBondContact O-N 3.07Å; L608-A610 PolarHBondContact O-N 3.46Å; L608-A610 VanDerWaalsContact O-N 3.17Å; L608-L611 PolarHBondContact O-N 3.06Å; L608-Y612 HydrophobicContact CB-CD2 4.25Å; L608-Y612 HydrophobicContact CB-CE2 3.84Å; L608-Y612 HydrophobicContact CD2-CE1 4.29Å; L608-Y612 HydrophobicContact CD2-CE2 4.39Å; L608-Y612 WeakPolarHBondContact O-CB 3.49Å; L608-Y612 WeakPolarHBondContact O-CD2 3.37Å; L608-Y612 VanDerWaalsContact O-CG 3.27Å; L608-Y612 PolarHBondContact O-N 3.39Å; L608-F623 HydrophobicContact CD1-CD1 3.76Å; L608-F623 HydrophobicContact CD1-CE1 4.08Å; L608-F623 HydrophobicContact CD1-CG 4.01Å
609	K	89.3	Confident	88	Confident	74 Å²	74	59.8 Å²	59.8	32%	0.322	31%	0.305	S	S	.	.	H	α-helix	trans	-58.6	-26.1	173.4	-176.2	176	-176.6	166.8	0	113.2	Q605 Q607 R627 E643	Q605-K609 PolarHBondContact O-N 2.85Å; Q607-K609 VanDerWaalsContact C-N 3.32Å; Q607-K609 PolarHBondContact O-N 2.73Å; K609-R627 VanDerWaalsContact CE-NH1 3.33Å; K609-E643 WeakPolarHBondContact CE-OE2 3.44Å; K609-E643 IonicContact NZ-OE2 3.77Å; K609-E643 PolarHBondContact NZ-OE2 2.79Å
610	A	88.9	Confident	87.8	Confident	33 Å²	33	55.2 Å²	55.2	27%	0.273	28%	0.284	S	S	.	.	H	α-helix	trans	-84.3	-48.2	172	0	0	0	0	0	111.8	Q607 L608 Y612 K613	Q607-A610 WeakPolarHBondContact O-CB 3.29Å; Q607-A610 PolarHBondContact O-N 3.15Å; L608-A610 PolarHBondContact O-N 3.46Å; L608-A610 VanDerWaalsContact O-N 3.17Å; A610-Y612 VanDerWaalsContact C-N 3.35Å; A610-Y612 PolarHBondContact O-N 2.93Å; A610-K613 WeakPolarHBondContact O-CB 3.49Å; A610-K613 PolarHBondContact O-N 3.45Å; A610-K613 VanDerWaalsContact O-N 3.17Å
611	L	88.8	Confident	87.6	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-38.1	-177.7	-70.9	163.4	0	0	0	113.1	R577 T581 V582 Y585 Q607 L608 K613 D614 N615	R577-L611 HydrophobicContact CB-CD2 4.27Å; R577-L611 HydrophobicContact CG-CD2 4.28Å; T581-L611 HydrophobicContact CG2-CD1 4.07Å; T581-L611 HydrophobicContact CG2-CD2 4.02Å; V582-L611 HydrophobicContact CG2-CB 4.03Å; Y585-L611 HydrophobicContact CD2-CD1 3.74Å; Y585-L611 HydrophobicContact CE2-CD1 4.13Å; Y585-L611 HydrophobicContact CG-CD1 4.1Å; Q607-L611 WeakPolarHBondContact O-CG 3.48Å; Q607-L611 PolarHBondContact O-N 3.13Å; L608-L611 PolarHBondContact O-N 3.06Å; L611-K613 PolarHBondContact O-N 3.41Å; L611-K613 VanDerWaalsContact O-N 3.16Å; L611-D614 PolarHBondContact O-N 3.07Å; L611-N615 PolarHBondContact O-N 2.91Å
612	Y	89.3	Confident	87.5	Confident	27 Å²	27	55.1 Å²	55.1	11%	0.106	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-7.8	177.7	-66.2	-37.9	0	0	0	114.9	V582 E586 L608 A610 I620 F623	V582-Y612 HydrophobicContact CG1-CD1 4.22Å; V582-Y612 HydrophobicContact CG1-CE1 3.52Å; E586-Y612 WeakPolarHBondContact CG-OH 3.44Å; E586-Y612 PolarHBondContact OE1-OH 3.5Å; L608-Y612 HydrophobicContact CB-CD2 4.25Å; L608-Y612 HydrophobicContact CB-CE2 3.84Å; L608-Y612 HydrophobicContact CD2-CE1 4.29Å; L608-Y612 HydrophobicContact CD2-CE2 4.39Å; L608-Y612 WeakPolarHBondContact O-CB 3.49Å; L608-Y612 WeakPolarHBondContact O-CD2 3.37Å; L608-Y612 VanDerWaalsContact O-CG 3.27Å; L608-Y612 PolarHBondContact O-N 3.39Å; A610-Y612 VanDerWaalsContact C-N 3.35Å; A610-Y612 PolarHBondContact O-N 2.93Å; Y612-I620 HydrophobicContact CD1-CG1 3.66Å; Y612-I620 HydrophobicContact CD2-CG1 4.07Å; Y612-I620 HydrophobicContact CD2-CG2 4.37Å; Y612-I620 HydrophobicContact CE1-CG1 3.97Å; Y612-I620 HydrophobicContact CE2-CG1 4.35Å; Y612-I620 HydrophobicContact CG-CG1 3.72Å; Y612-F623 HydrophobicContact CE2-CB 3.89Å; Y612-F623 WeakPolarHBondContact OH-CD2 3.45Å
613	K	84.9	Confident	87.5	Confident	173 Å²	173	53 Å²	53	75%	0.752	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-28.2	169	-64.3	-175	176.7	-173.9	0	112.3	A610 L611	A610-K613 WeakPolarHBondContact O-CB 3.49Å; A610-K613 PolarHBondContact O-N 3.45Å; A610-K613 VanDerWaalsContact O-N 3.17Å; L611-K613 PolarHBondContact O-N 3.41Å; L611-K613 VanDerWaalsContact O-N 3.16Å
614	D	81.1	Confident	87.5	Confident	87 Å²	87	48.4 Å²	48.4	47%	0.465	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-42.5	-172	-42.8	-28.1	0	0	0	110.2	R577 L611	R577-D614 IonicContact CZ-OD2 2.7Å; R577-D614 IonicContact NE-OD2 3.87Å; R577-D614 PolarHBondContact NE-OD2 2.82Å; R577-D614 IonicContact NH2-OD2 3.62Å; R577-D614 PolarHBondContact NH2-OD2 3.47Å; L611-D614 PolarHBondContact O-N 3.07Å
615	N	80.1	Confident	87.4	Confident	34 Å²	34	48.5 Å²	48.5	18%	0.182	25%	0.252	C	S	.	.	S	Bend	trans	-125.7	104.6	178.5	-57.8	-87.8	0	0	0	110	R577 V582 L611 S617	R577-N615 PolarHBondContact O-ND2 3.39Å; V582-N615 HydrophobicContact CG2-CB 4.39Å; L611-N615 PolarHBondContact O-N 2.91Å; N615-S617 PolarHBondContact O-N 3.31Å
616	P	79.4	Confident	87.5	Confident	104 Å²	104	48.3 Å²	48.3	68%	0.675	25%	0.251	S	S	*	.			trans	-77.7	120.4	179	29.4	-32.6	0	0	0	112.1	I620	P616-I620 HydrophobicContact CB-CD1 4Å
617	S	79.9	Confident	87.6	Confident	32 Å²	32	45.6 Å²	45.6	22%	0.224	23%	0.233	C	C	.	.			trans	-101.1	152.4	179.4	163.5	0	0	0	0	112.1	E586 N615 N619 I620	E586-S617 PolarHBondContact OE1-OG 3.21Å; E586-S617 VanDerWaalsContact OE1-OG 3.07Å; N615-S617 PolarHBondContact O-N 3.31Å; S617-N619 PolarHBondContact O-N 2.83Å; S617-N619 VanDerWaalsContact O-N 3.12Å; S617-N619 PolarHBondContact OG-N 2.71Å; S617-N619 VanDerWaalsContact OG-N 3.13Å; S617-I620 VanDerWaalsContact O-CD1 3.22Å; S617-I620 WeakPolarHBondContact O-CD1 3.49Å; S617-I620 WeakPolarHBondContact O-CG1 3.18Å; S617-I620 PolarHBondContact O-N 2.83Å
618	E	81.1	Confident	87.6	Confident	193 Å²	193	41.6 Å²	41.6	90%	0.902	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.6	171.3	-59.6	-177.2	159.2	0	0	113
619	N	85.4	Confident	87.6	Confident	37 Å²	37	41.5 Å²	41.5	20%	0.198	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	6.4	-176.6	-71.7	-37.6	0	0	0	115	E586 R590 S617 G621 E622 F623 R684	E586-N619 WeakPolarHBondContact OE1-CB 3.34Å; E586-N619 WeakPolarHBondContact OE2-CB 3.42Å; E586-N619 PolarHBondContact OE2-ND2 2.87Å; R590-N619 VanDerWaalsContact NH2-CG 3.32Å; R590-N619 PolarHBondContact NH2-ND2 3.23Å; S617-N619 PolarHBondContact O-N 2.83Å; S617-N619 VanDerWaalsContact O-N 3.12Å; S617-N619 PolarHBondContact OG-N 2.71Å; S617-N619 VanDerWaalsContact OG-N 3.13Å; N619-G621 PolarHBondContact O-N 3.47Å; N619-G621 VanDerWaalsContact O-N 3.15Å; N619-E622 WeakPolarHBondContact O-CB 3.46Å; N619-E622 PolarHBondContact O-N 3.48Å; N619-F623 HydrophobicContact CB-CD2 4.22Å; N619-F623 HydrophobicContact CB-CE2 4.29Å; N619-F623 PolarHBondContact O-N 3.18Å; N619-F623 VanDerWaalsContact O-N 3.16Å; N619-R684 PolarHBondContact OD1-NH1 2.85Å
620	I	87.9	Confident	87.8	Confident	35 Å²	35	39.4 Å²	39.4	18%	0.179	20%	0.204	C	C	.	.	H	α-helix	trans	-53.9	-37.2	176.9	-62.6	157.6	0	0	0	111.3	Y612 P616 S617 T624 L651	Y612-I620 HydrophobicContact CD1-CG1 3.66Å; Y612-I620 HydrophobicContact CD2-CG1 4.07Å; Y612-I620 HydrophobicContact CD2-CG2 4.37Å; Y612-I620 HydrophobicContact CE1-CG1 3.97Å; Y612-I620 HydrophobicContact CE2-CG1 4.35Å; Y612-I620 HydrophobicContact CG-CG1 3.72Å; P616-I620 HydrophobicContact CB-CD1 4Å; S617-I620 VanDerWaalsContact O-CD1 3.22Å; S617-I620 WeakPolarHBondContact O-CD1 3.49Å; S617-I620 WeakPolarHBondContact O-CG1 3.18Å; S617-I620 PolarHBondContact O-N 2.83Å; I620-T624 WeakPolarHBondContact O-CB 3.49Å; I620-T624 PolarHBondContact O-N 2.79Å; I620-T624 PolarHBondContact O-OG1 3.15Å; I620-L651 HydrophobicContact CB-CD1 4.05Å; I620-L651 HydrophobicContact CG2-CD1 3.7Å; I620-L651 HydrophobicContact CG2-CD2 3.9Å; I620-L651 HydrophobicContact CG2-CG 4.49Å
621	G	87.9	Confident	87.9	Confident	4 Å²	4	38.8 Å²	38.8	4%	0.041	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-42.6	177.4	0	0	0	0	0	113	N619 A625 D654 V657	N619-G621 PolarHBondContact O-N 3.47Å; N619-G621 VanDerWaalsContact O-N 3.15Å; G621-A625 VanDerWaalsContact O-CB 3.25Å; G621-A625 WeakPolarHBondContact O-CB 3.44Å; G621-A625 PolarHBondContact O-N 2.89Å; G621-D654 WeakPolarHBondContact CA-OD2 3.33Å; G621-V657 WeakPolarHBondContact O-CG2 3.29Å
622	E	91.5	Very high	88	Confident	9 Å²	9	38.6 Å²	38.6	4%	0.042	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-51.4	176.2	178.2	179.1	164.7	0	0	111.3	R590 N619 T624 A625 Y626 R684	R590-E622 IonicContact CZ-OE1 3.42Å; R590-E622 IonicContact CZ-OE2 2.74Å; R590-E622 IonicContact NE-OE1 3.66Å; R590-E622 PolarHBondContact NE-OE1 3.49Å; R590-E622 IonicContact NE-OE2 3.57Å; R590-E622 VanDerWaalsContact NH2-CD 3.29Å; R590-E622 IonicContact NH2-OE1 2.92Å; R590-E622 PolarHBondContact NH2-OE1 3.27Å; R590-E622 IonicContact NH2-OE2 3.68Å; R590-E622 PolarHBondContact NH2-OE2 3.24Å; N619-E622 WeakPolarHBondContact O-CB 3.46Å; N619-E622 PolarHBondContact O-N 3.48Å; E622-T624 VanDerWaalsContact C-N 3.32Å; E622-T624 PolarHBondContact O-N 3.11Å; E622-A625 WeakPolarHBondContact O-CB 3.34Å; E622-A625 PolarHBondContact O-N 3.03Å; E622-Y626 HydrophobicContact CG-CD2 4.06Å; E622-Y626 HydrophobicContact CG-CE1 4.05Å; E622-Y626 HydrophobicContact CG-CE2 3.34Å; E622-Y626 VanDerWaalsContact CG-OH 3.27Å; E622-Y626 WeakPolarHBondContact CG-OH 3.4Å; E622-Y626 VanDerWaalsContact O-CG 3.28Å; E622-Y626 PolarHBondContact O-N 2.66Å; E622-Y626 WeakPolarHBondContact OE1-CE2 3.5Å; E622-Y626 VanDerWaalsContact OE1-CZ 3.28Å; E622-Y626 PolarHBondContact OE1-OH 3.06Å; E622-R684 VanDerWaalsContact OE2-CD 3.29Å; E622-R684 WeakPolarHBondContact OE2-CD 3.41Å; E622-R684 IonicContact OE2-CZ 2.65Å; E622-R684 IonicContact OE2-NE 2.7Å; E622-R684 IonicContact OE2-NH1 3.96Å; E622-R684 PolarHBondContact OE2-NH1 3.43Å
623	F	92	Very high	88.1	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-74.9	-23	-176.9	-73.6	-77.6	0	0	0	113.4	E586 A589 R590 F601 L608 Y612 N619 Y626 R627	E586-F623 HydrophobicContact CB-CE2 3.67Å; E586-F623 HydrophobicContact CB-CZ 3.73Å; E586-F623 HydrophobicContact CG-CD2 3.9Å; E586-F623 HydrophobicContact CG-CE2 3.39Å; E586-F623 HydrophobicContact CG-CZ 3.89Å; A589-F623 HydrophobicContact CB-CD1 4.37Å; A589-F623 HydrophobicContact CB-CE1 3.51Å; A589-F623 HydrophobicContact CB-CZ 4.2Å; R590-F623 HydrophobicContact CG-CZ 4.09Å; F601-F623 HydrophobicContact CE2-CD1 4.49Å; F601-F623 HydrophobicContact CE2-CE1 4.5Å; L608-F623 HydrophobicContact CD1-CD1 3.76Å; L608-F623 HydrophobicContact CD1-CE1 4.08Å; L608-F623 HydrophobicContact CD1-CG 4.01Å; Y612-F623 HydrophobicContact CE2-CB 3.89Å; Y612-F623 WeakPolarHBondContact OH-CD2 3.45Å; N619-F623 HydrophobicContact CB-CD2 4.22Å; N619-F623 HydrophobicContact CB-CE2 4.29Å; N619-F623 PolarHBondContact O-N 3.18Å; N619-F623 VanDerWaalsContact O-N 3.16Å; F623-Y626 AromaticContact CD1-CD2 3.96Å; F623-Y626 HydrophobicContact CD1-CD2 3.96Å; F623-Y626 HydrophobicContact CE1-CD2 4.01Å; F623-Y626 HydrophobicContact CE1-CE2 4.24Å; F623-R627 WeakPolarHBondContact O-CB 3.31Å; F623-R627 PolarHBondContact O-N 3.45Å
624	T	90.9	Very high	88.4	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-75.6	-38.4	170.3	-58.8	0	0	0	0	112	I620 E622 R627 L628 L647 L651	I620-T624 WeakPolarHBondContact O-CB 3.49Å; I620-T624 PolarHBondContact O-N 2.79Å; I620-T624 PolarHBondContact O-OG1 3.15Å; E622-T624 VanDerWaalsContact C-N 3.32Å; E622-T624 PolarHBondContact O-N 3.11Å; T624-R627 PolarHBondContact O-N 3.39Å; T624-R627 PolarHBondContact OG1-NH2 3.39Å; T624-L628 WeakPolarHBondContact O-CG 3.42Å; T624-L628 PolarHBondContact O-N 3Å; T624-L647 HydrophobicContact CG2-CD1 3.53Å; T624-L651 HydrophobicContact CG2-CD2 3.79Å
625	A	92.8	Very high	88.6	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-56	-55.6	168.1	0	0	0	0	0	110.8	G621 E622 R627 L628 L629 C656 V657 S660	G621-A625 VanDerWaalsContact O-CB 3.25Å; G621-A625 WeakPolarHBondContact O-CB 3.44Å; G621-A625 PolarHBondContact O-N 2.89Å; E622-A625 WeakPolarHBondContact O-CB 3.34Å; E622-A625 PolarHBondContact O-N 3.03Å; A625-R627 VanDerWaalsContact C-N 3.27Å; A625-R627 PolarHBondContact O-N 2.91Å; A625-L628 WeakPolarHBondContact O-CB 3.37Å; A625-L628 PolarHBondContact O-N 3.09Å; A625-L628 VanDerWaalsContact O-N 3.07Å; A625-L629 WeakPolarHBondContact O-CG 3.45Å; A625-L629 PolarHBondContact O-N 2.76Å; A625-C656 HydrophobicContact CB-CB 3.81Å; A625-C656 VanDerWaalsContact CB-O 3.23Å; A625-C656 WeakPolarHBondContact CB-O 3.4Å; A625-V657 HydrophobicContact CB-CG2 4.3Å; A625-S660 VanDerWaalsContact CB-OG 3.29Å; A625-S660 WeakPolarHBondContact CB-OG 3.48Å
626	Y	93.3	Very high	89	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-57.8	-35.9	178.6	-64.1	-13.4	0	0	0	113.5	L593 F601 E622 F623 L629 Y630 R684 M685 A686 L689	L593-Y626 HydrophobicContact CD1-CD2 3.84Å; L593-Y626 HydrophobicContact CD1-CE2 3.88Å; L593-Y626 HydrophobicContact CD1-CG 4.44Å; F601-Y626 HydrophobicContact CE2-CD2 4.31Å; E622-Y626 HydrophobicContact CG-CD2 4.06Å; E622-Y626 HydrophobicContact CG-CE1 4.05Å; E622-Y626 HydrophobicContact CG-CE2 3.34Å; E622-Y626 VanDerWaalsContact CG-OH 3.27Å; E622-Y626 WeakPolarHBondContact CG-OH 3.4Å; E622-Y626 VanDerWaalsContact O-CG 3.28Å; E622-Y626 PolarHBondContact O-N 2.66Å; E622-Y626 WeakPolarHBondContact OE1-CE2 3.5Å; E622-Y626 VanDerWaalsContact OE1-CZ 3.28Å; E622-Y626 PolarHBondContact OE1-OH 3.06Å; F623-Y626 AromaticContact CD1-CD2 3.96Å; F623-Y626 HydrophobicContact CD1-CD2 3.96Å; F623-Y626 HydrophobicContact CE1-CD2 4.01Å; F623-Y626 HydrophobicContact CE1-CE2 4.24Å; Y626-L629 HydrophobicContact CD1-CD1 4.29Å; Y626-L629 WeakPolarHBondContact O-CB 3.46Å; Y626-L629 PolarHBondContact O-N 3.02Å; Y626-Y630 WeakPolarHBondContact O-CB 3.27Å; Y626-Y630 PolarHBondContact O-N 2.95Å; Y626-R684 WeakPolarHBondContact OH-CB 3.34Å; Y626-M685 HydrophobicContact CE1-CB 4.38Å; Y626-M685 HydrophobicContact CE2-CB 4.49Å; Y626-M685 WeakPolarHBondContact OH-CB 3.48Å; Y626-M685 PolarHBondContact OH-N 2.87Å; Y626-A686 HydrophobicContact CE1-CB 4.32Å; Y626-L689 VanDerWaalsContact CB-CD1 3.48Å; Y626-L689 HydrophobicContact CD1-CD1 3.97Å; Y626-L689 HydrophobicContact CG-CD1 3.77Å
627	R	91.8	Very high	89.2	Confident	19 Å²	19	35.5 Å²	35.5	7%	0.072	18%	0.182	C	C	.	.	H	α-helix	trans	-66.7	-41.2	175.2	179.3	162.3	51.5	123.4	2.7	112.6	Q605 K609 F623 T624 A625 Y630 Y631 E643	Q605-R627 HydrophobicContact CG-CB 4.01Å; Q605-R627 HydrophobicContact CG-CG 4.24Å; K609-R627 VanDerWaalsContact CE-NH1 3.33Å; F623-R627 WeakPolarHBondContact O-CB 3.31Å; F623-R627 PolarHBondContact O-N 3.45Å; T624-R627 PolarHBondContact O-N 3.39Å; T624-R627 PolarHBondContact OG1-NH2 3.39Å; A625-R627 VanDerWaalsContact C-N 3.27Å; A625-R627 PolarHBondContact O-N 2.91Å; R627-Y630 PolarHBondContact O-N 3.02Å; R627-Y631 HydrophobicContact CG-CD2 4.37Å; R627-Y631 HydrophobicContact CG-CE2 3.64Å; R627-Y631 VanDerWaalsContact O-CD2 3.28Å; R627-Y631 WeakPolarHBondContact O-CD2 3.16Å; R627-Y631 PolarHBondContact O-N 3.17Å; R627-E643 IonicContact CZ-OE1 2.75Å; R627-E643 VanDerWaalsContact CZ-OE1 3.27Å; R627-E643 IonicContact CZ-OE2 3.59Å; R627-E643 IonicContact NH1-OE1 2.76Å; R627-E643 PolarHBondContact NH1-OE1 3.17Å; R627-E643 IonicContact NH1-OE2 2.57Å; R627-E643 PolarHBondContact NH1-OE2 3.16Å; R627-E643 IonicContact NH2-OE1 3.12Å; R627-E643 PolarHBondContact NH2-OE1 3.47Å
628	L	91.9	Very high	89.5	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-63.8	-38.8	171.6	-68.9	171	0	0	0	112.2	T624 A625 Y631 M632 E643 L644 V657 L661	T624-L628 WeakPolarHBondContact O-CG 3.42Å; T624-L628 PolarHBondContact O-N 3Å; A625-L628 WeakPolarHBondContact O-CB 3.37Å; A625-L628 PolarHBondContact O-N 3.09Å; A625-L628 VanDerWaalsContact O-N 3.07Å; L628-Y631 PolarHBondContact O-N 2.91Å; L628-M632 PolarHBondContact O-N 3.17Å; L628-E643 HydrophobicContact CD2-CB 4.26Å; L628-E643 HydrophobicContact CD2-CG 4.15Å; L628-L644 HydrophobicContact CD2-CD2 4.15Å; L628-L644 HydrophobicContact CD2-CG 4.37Å; L628-V657 HydrophobicContact CD1-CG1 4.34Å; L628-L661 HydrophobicContact CD1-CD2 4.16Å
629	L	92.6	Very high	89.8	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.1	-42.7	172.6	-59.2	177.3	0	0	0	111.5	A625 Y626 Y631 M632 F633 L663 A686 L689 I690	A625-L629 WeakPolarHBondContact O-CG 3.45Å; A625-L629 PolarHBondContact O-N 2.76Å; Y626-L629 HydrophobicContact CD1-CD1 4.29Å; Y626-L629 WeakPolarHBondContact O-CB 3.46Å; Y626-L629 PolarHBondContact O-N 3.02Å; L629-Y631 VanDerWaalsContact C-N 3.35Å; L629-Y631 PolarHBondContact O-N 3.19Å; L629-M632 HydrophobicContact CD2-CE 3.61Å; L629-M632 WeakPolarHBondContact O-CB 3.27Å; L629-M632 PolarHBondContact O-N 2.87Å; L629-M632 VanDerWaalsContact O-N 3.08Å; L629-F633 PolarHBondContact O-N 3.43Å; L629-L663 HydrophobicContact CD2-CD2 3.61Å; L629-A686 HydrophobicContact CD1-CB 3.63Å; L629-L689 HydrophobicContact CB-CB 4.02Å; L629-L689 HydrophobicContact CB-CD1 4.28Å; L629-L689 HydrophobicContact CD1-CB 4.04Å; L629-L689 HydrophobicContact CD1-CD1 4.25Å; L629-I690 HydrophobicContact CD1-CG1 4.33Å; L629-I690 HydrophobicContact CD2-CD1 4.42Å; L629-I690 HydrophobicContact CD2-CG1 4.05Å
630	Y	92.3	Very high	89.9	Confident	30 Å²	30	28.5 Å²	28.5	12%	0.118	16%	0.158	C	C	.	.	H	α-helix	trans	-63.6	-36.6	178.1	-173.5	-92.5	0	0	0	112.7	F601 N602 Y626 R627 M632 F633 T634	F601-Y630 HydrophobicContact CD1-CD2 4.17Å; F601-Y630 HydrophobicContact CE1-CD2 4.19Å; F601-Y630 HydrophobicContact CE1-CG 4.49Å; N602-Y630 HydrophobicContact CB-CE1 4.29Å; N602-Y630 HydrophobicContact CB-CE2 4.01Å; N602-Y630 WeakPolarHBondContact OD1-CE1 3.41Å; Y626-Y630 WeakPolarHBondContact O-CB 3.27Å; Y626-Y630 PolarHBondContact O-N 2.95Å; R627-Y630 PolarHBondContact O-N 3.02Å; Y630-M632 VanDerWaalsContact C-N 3.33Å; Y630-M632 PolarHBondContact O-N 3.27Å; Y630-F633 HydrophobicContact CD2-CD1 4.28Å; Y630-F633 HydrophobicContact CE2-CD1 4.19Å; Y630-F633 WeakPolarHBondContact O-CB 3.22Å; Y630-F633 PolarHBondContact O-N 2.88Å; Y630-T634 HydrophobicContact CD1-CG2 4.11Å; Y630-T634 HydrophobicContact CE1-CG2 3.59Å; Y630-T634 HydrophobicContact CE2-CG2 4.41Å; Y630-T634 PolarHBondContact O-N 3.45Å; Y630-T634 PolarHBondContact O-OG1 2.99Å
631	Y	91.7	Very high	89.9	Confident	20 Å²	20	31.5 Å²	31.5	8%	0.078	17%	0.173	C	C	.	.	H	α-helix	trans	-68.1	-28.8	172.2	-60.9	-41.6	0	0	0	113.1	R627 L628 L629 T634 K635 N636 D639 E643	R627-Y631 HydrophobicContact CG-CD2 4.37Å; R627-Y631 HydrophobicContact CG-CE2 3.64Å; R627-Y631 VanDerWaalsContact O-CD2 3.28Å; R627-Y631 WeakPolarHBondContact O-CD2 3.16Å; R627-Y631 PolarHBondContact O-N 3.17Å; L628-Y631 PolarHBondContact O-N 2.91Å; L629-Y631 VanDerWaalsContact C-N 3.35Å; L629-Y631 PolarHBondContact O-N 3.19Å; Y631-T634 WeakPolarHBondContact CA-OG1 3.4Å; Y631-T634 PolarHBondContact O-OG1 3.45Å; Y631-K635 CarbonylContact O-C 3.26Å; Y631-K635 WeakPolarHBondContact O-CA 3.35Å; Y631-K635 PolarHBondContact O-N 3.16Å; Y631-N636 HydrophobicContact CD1-CB 4.43Å; Y631-N636 PolarHBondContact O-N 3.1Å; Y631-N636 VanDerWaalsContact O-N 3.12Å; Y631-D639 HydrophobicContact CD1-CB 3.99Å; Y631-D639 HydrophobicContact CE1-CB 3.64Å; Y631-D639 HydrophobicContact CE2-CB 4.22Å; Y631-D639 HydrophobicContact CG-CB 4.44Å; Y631-E643 HydrophobicContact CE2-CB 4.07Å; Y631-E643 HydrophobicContact CE2-CG 4.25Å
632	M	91.1	Very high	90	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-74.2	-36.8	169.9	-71.3	-171.4	-75.3	0	0	113.1	L628 L629 Y630 K635 Q640 L663 R664 W667 F693 R696	L628-M632 PolarHBondContact O-N 3.17Å; L629-M632 HydrophobicContact CD2-CE 3.61Å; L629-M632 WeakPolarHBondContact O-CB 3.27Å; L629-M632 PolarHBondContact O-N 2.87Å; L629-M632 VanDerWaalsContact O-N 3.08Å; Y630-M632 VanDerWaalsContact C-N 3.33Å; Y630-M632 PolarHBondContact O-N 3.27Å; M632-K635 PolarHBondContact O-N 2.86Å; M632-Q640 VanDerWaalsContact CG-NE2 3.32Å; M632-L663 HydrophobicContact CE-CD2 4.05Å; M632-L663 HydrophobicContact CE-CG 4.4Å; M632-R664 HydrophobicContact CE-CB 4.04Å; M632-R664 WeakPolarHBondContact SD-CA 3.33Å; M632-R664 HydrophobicContact SD-CB 3.69Å; M632-R664 HydrophobicContact SD-CG 4.03Å; M632-W667 HydrophobicContact CG-CD2 4.27Å; M632-W667 HydrophobicContact CG-CE3 3.92Å; M632-W667 HydrophobicContact CG-CZ3 4.19Å; M632-W667 HydrophobicContact SD-CB 4.12Å; M632-W667 HydrophobicContact SD-CD2 4.18Å; M632-W667 HydrophobicContact SD-CE3 4.06Å; M632-W667 HydrophobicContact SD-CG 4.23Å; M632-F693 HydrophobicContact CB-CE1 4.3Å; M632-F693 HydrophobicContact CB-CE2 3.97Å; M632-F693 HydrophobicContact CB-CZ 3.68Å; M632-F693 HydrophobicContact CE-CZ 4.48Å; M632-R696 PolarHBondContact O-NH2 3.1Å
633	F	91.5	Very high	89.8	Confident	48 Å²	48	34.3 Å²	34.3	21%	0.211	19%	0.189	C	C	.	.	H	α-helix	trans	-58.9	-55.7	171.3	166.7	-112.2	0	0	0	110.7	H598 L629 Y630 K635 K692 F693 R696	H598-F633 AromaticContact CD2-CE1 3.64Å; L629-F633 PolarHBondContact O-N 3.43Å; Y630-F633 HydrophobicContact CD2-CD1 4.28Å; Y630-F633 HydrophobicContact CE2-CD1 4.19Å; Y630-F633 WeakPolarHBondContact O-CB 3.22Å; Y630-F633 PolarHBondContact O-N 2.88Å; F633-K635 VanDerWaalsContact C-N 3.27Å; F633-K635 PolarHBondContact O-N 2.94Å; F633-K692 HydrophobicContact CD2-CB 3.45Å; F633-K692 VanDerWaalsContact CD2-CB 3.45Å; F633-K692 WeakPolarHBondContact CD2-O 3.32Å; F633-K692 HydrophobicContact CE2-CB 3.59Å; F633-K692 WeakPolarHBondContact CE2-O 3.25Å; F633-K692 HydrophobicContact CG-CB 4.16Å; F633-K692 HydrophobicContact CZ-CB 4.38Å; F633-F693 HydrophobicContact CB-CD1 3.7Å; F633-F693 HydrophobicContact CB-CE1 4.12Å; F633-F693 HydrophobicContact CB-CG 4.5Å; F633-F693 HydrophobicContact CD2-CB 4.21Å; F633-F693 HydrophobicContact CD2-CD1 4.32Å; F633-R696 PolarHBondContact O-NH1 3.05Å
634	T	89.8	Confident	89.6	Confident	61 Å²	61	35.7 Å²	35.7	37%	0.374	20%	0.197	S	C	.	.	H	α-helix	trans	-73	-11.7	-179.4	53.3	0	0	0	0	114.8	Y630 Y631 N636	Y630-T634 HydrophobicContact CD1-CG2 4.11Å; Y630-T634 HydrophobicContact CE1-CG2 3.59Å; Y630-T634 HydrophobicContact CE2-CG2 4.41Å; Y630-T634 PolarHBondContact O-N 3.45Å; Y630-T634 PolarHBondContact O-OG1 2.99Å; Y631-T634 WeakPolarHBondContact CA-OG1 3.4Å; Y631-T634 PolarHBondContact O-OG1 3.45Å; T634-N636 PolarHBondContact O-N 3.43Å
635	K	86.7	Confident	89.5	Confident	111 Å²	111	40.9 Å²	40.9	48%	0.483	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	23.4	-171.2	-56.8	-171	175.6	-172.5	0	114.7	Y631 M632 F633 S637 W667	Y631-K635 CarbonylContact O-C 3.26Å; Y631-K635 WeakPolarHBondContact O-CA 3.35Å; Y631-K635 PolarHBondContact O-N 3.16Å; M632-K635 PolarHBondContact O-N 2.86Å; F633-K635 VanDerWaalsContact C-N 3.27Å; F633-K635 PolarHBondContact O-N 2.94Å; K635-S637 PolarHBondContact O-N 3.35Å; K635-W667 HydrophobicContact CG-CZ2 4.37Å
636	N	87.1	Confident	89.1	Confident	61 Å²	61	49.1 Å²	49.1	33%	0.326	26%	0.26	S	S	.	.			trans	-75.3	92.2	177.6	-173.3	-19.8	0	0	0	110.6	Y631 T634 G638 D639 Q640	Y631-N636 HydrophobicContact CD1-CB 4.43Å; Y631-N636 PolarHBondContact O-N 3.1Å; Y631-N636 VanDerWaalsContact O-N 3.12Å; T634-N636 PolarHBondContact O-N 3.43Å; N636-G638 PolarHBondContact OD1-N 2.84Å; N636-D639 PolarHBondContact ND2-OD2 3.28Å; N636-D639 PolarHBondContact OD1-N 3.05Å; N636-Q640 VanDerWaalsContact O-CB 3.26Å; N636-Q640 WeakPolarHBondContact O-CB 3.41Å; N636-Q640 PolarHBondContact O-N 3.18Å; N636-Q640 VanDerWaalsContact O-N 3.15Å
637	S	83.7	Confident	88.8	Confident	78 Å²	78	49.4 Å²	49.4	55%	0.545	26%	0.262	S	S	.	.	H	α-helix	trans	-69.4	-32.9	-179.6	53.4	0	0	0	0	113.2	K635 I641	K635-S637 PolarHBondContact O-N 3.35Å; S637-I641 WeakPolarHBondContact O-CB 3.18Å; S637-I641 WeakPolarHBondContact O-CD1 3.37Å; S637-I641 WeakPolarHBondContact O-CG1 3.43Å; S637-I641 PolarHBondContact O-N 3.42Å
638	G	86.9	Confident	88.6	Confident	38 Å²	38	52 Å²	52	39%	0.392	28%	0.28	S	S	.	.	H	α-helix	trans	-64.8	-53.7	180	0	0	0	0	0	112	N636 Q640 I641 T642	N636-G638 PolarHBondContact OD1-N 2.84Å; G638-Q640 VanDerWaalsContact C-N 3.34Å; G638-Q640 PolarHBondContact O-N 3.11Å; G638-I641 PolarHBondContact O-N 3.14Å; G638-T642 WeakPolarHBondContact O-CB 3.17Å; G638-T642 PolarHBondContact O-N 3.49Å; G638-T642 PolarHBondContact O-OG1 3.37Å
639	D	87	Confident	88.2	Confident	71 Å²	71	56.9 Å²	56.9	38%	0.38	31%	0.311	S	S	.	.	H	α-helix	trans	-67.6	-35	176.9	-74.1	-38.4	0	0	0	111.8	Y631 N636 T642 E643	Y631-D639 HydrophobicContact CD1-CB 3.99Å; Y631-D639 HydrophobicContact CE1-CB 3.64Å; Y631-D639 HydrophobicContact CE2-CB 4.22Å; Y631-D639 HydrophobicContact CG-CB 4.44Å; N636-D639 PolarHBondContact ND2-OD2 3.28Å; N636-D639 PolarHBondContact OD1-N 3.05Å; D639-T642 PolarHBondContact O-N 2.86Å; D639-E643 WeakPolarHBondContact O-CB 3.41Å; D639-E643 PolarHBondContact O-N 3.15Å
640	Q	88.1	Confident	87.8	Confident	7 Å²	7	60.3 Å²	60.3	3%	0.033	34%	0.339	C	S	.	.	H	α-helix	trans	-60.8	-46.2	174	-171.8	-172.4	92.4	0	0	112.3	M632 N636 G638 L644	M632-Q640 VanDerWaalsContact CG-NE2 3.32Å; N636-Q640 VanDerWaalsContact O-CB 3.26Å; N636-Q640 WeakPolarHBondContact O-CB 3.41Å; N636-Q640 PolarHBondContact O-N 3.18Å; N636-Q640 VanDerWaalsContact O-N 3.15Å; G638-Q640 VanDerWaalsContact C-N 3.34Å; G638-Q640 PolarHBondContact O-N 3.11Å; Q640-L644 HydrophobicContact CG-CD1 4.23Å; Q640-L644 WeakPolarHBondContact O-CD1 3.36Å; Q640-L644 WeakPolarHBondContact O-CG 3.44Å; Q640-L644 PolarHBondContact O-N 3.46Å
641	I	88.4	Confident	87.4	Confident	98 Å²	98	60.1 Å²	60.1	50%	0.503	34%	0.341	S	S	.	.	H	α-helix	trans	-64.8	-45.5	177.9	-70.8	164.1	0	0	0	110	S637 G638 E643 L644 V645	S637-I641 WeakPolarHBondContact O-CB 3.18Å; S637-I641 WeakPolarHBondContact O-CD1 3.37Å; S637-I641 WeakPolarHBondContact O-CG1 3.43Å; S637-I641 PolarHBondContact O-N 3.42Å; G638-I641 PolarHBondContact O-N 3.14Å; I641-E643 VanDerWaalsContact C-N 3.32Å; I641-E643 PolarHBondContact O-N 3.38Å; I641-L644 PolarHBondContact O-N 2.98Å; I641-V645 PolarHBondContact O-N 3.37Å
642	T	89.4	Confident	87.2	Confident	60 Å²	60	63.8 Å²	63.8	37%	0.368	35%	0.354	S	S	.	.	H	α-helix	trans	-57.7	-44.7	178.5	-57.5	0	0	0	0	111.4	G638 D639 L644 V645 Y646	G638-T642 WeakPolarHBondContact O-CB 3.17Å; G638-T642 PolarHBondContact O-N 3.49Å; G638-T642 PolarHBondContact O-OG1 3.37Å; D639-T642 PolarHBondContact O-N 2.86Å; T642-L644 PolarHBondContact O-N 3.44Å; T642-V645 PolarHBondContact O-N 3.05Å; T642-Y646 HydrophobicContact CG2-CD2 3.88Å; T642-Y646 HydrophobicContact CG2-CE2 3.62Å; T642-Y646 WeakPolarHBondContact O-CD2 3.16Å; T642-Y646 PolarHBondContact O-N 3.31Å
643	E	87.2	Confident	87	Confident	11 Å²	11	68.2 Å²	68.2	5%	0.051	39%	0.385	C	S	.	.	H	α-helix	trans	-65.1	-37.3	178.6	-161.2	62.4	-129	0	0	112.8	K609 R627 L628 Y631 D639 I641 V645 Y646 L647	K609-E643 WeakPolarHBondContact CE-OE2 3.44Å; K609-E643 IonicContact NZ-OE2 3.77Å; K609-E643 PolarHBondContact NZ-OE2 2.79Å; R627-E643 IonicContact CZ-OE1 2.75Å; R627-E643 VanDerWaalsContact CZ-OE1 3.27Å; R627-E643 IonicContact CZ-OE2 3.59Å; R627-E643 IonicContact NH1-OE1 2.76Å; R627-E643 PolarHBondContact NH1-OE1 3.17Å; R627-E643 IonicContact NH1-OE2 2.57Å; R627-E643 PolarHBondContact NH1-OE2 3.16Å; R627-E643 IonicContact NH2-OE1 3.12Å; R627-E643 PolarHBondContact NH2-OE1 3.47Å; L628-E643 HydrophobicContact CD2-CB 4.26Å; L628-E643 HydrophobicContact CD2-CG 4.15Å; Y631-E643 HydrophobicContact CE2-CB 4.07Å; Y631-E643 HydrophobicContact CE2-CG 4.25Å; D639-E643 WeakPolarHBondContact O-CB 3.41Å; D639-E643 PolarHBondContact O-N 3.15Å; I641-E643 VanDerWaalsContact C-N 3.32Å; I641-E643 PolarHBondContact O-N 3.38Å; E643-V645 VanDerWaalsContact C-N 3.25Å; E643-V645 PolarHBondContact O-N 2.94Å; E643-Y646 PolarHBondContact O-N 3.34Å; E643-L647 WeakPolarHBondContact O-CB 3.38Å; E643-L647 PolarHBondContact O-N 3.44Å
644	L	87.4	Confident	86.9	Confident	32 Å²	32	68.8 Å²	68.8	17%	0.168	39%	0.391	C	S	.	.	H	α-helix	trans	-67.6	-25	178.3	-69	166.5	0	0	0	113.4	L628 Q640 I641 T642 L647 R652 L661	L628-L644 HydrophobicContact CD2-CD2 4.15Å; L628-L644 HydrophobicContact CD2-CG 4.37Å; Q640-L644 HydrophobicContact CG-CD1 4.23Å; Q640-L644 WeakPolarHBondContact O-CD1 3.36Å; Q640-L644 WeakPolarHBondContact O-CG 3.44Å; Q640-L644 PolarHBondContact O-N 3.46Å; I641-L644 PolarHBondContact O-N 2.98Å; T642-L644 PolarHBondContact O-N 3.44Å; L644-L647 HydrophobicContact CD2-CD2 4.44Å; L644-R652 PolarHBondContact O-NH2 3.18Å; L644-L661 HydrophobicContact CD2-CD2 3.23Å
645	V	88.6	Confident	86.9	Confident	108 Å²	108	73.7 Å²	73.7	66%	0.655	41%	0.409	S	S	*	.	H	α-helix	trans	-75.2	-45.6	172.6	173.8	0	0	0	0	111	I641 T642 E643 L647	I641-V645 PolarHBondContact O-N 3.37Å; T642-V645 PolarHBondContact O-N 3.05Å; E643-V645 VanDerWaalsContact C-N 3.25Å; E643-V645 PolarHBondContact O-N 2.94Å; V645-L647 VanDerWaalsContact C-N 3.25Å; V645-L647 PolarHBondContact O-N 3.06Å
646	Y	85.1	Confident	87.1	Confident	175 Å²	175	68.9 Å²	68.9	69%	0.686	39%	0.39	S	S	*	.	H	α-helix	trans	-74.9	-11	178.2	-70	-64.7	0	0	0	114.4	T642 E643 T648	T642-Y646 HydrophobicContact CG2-CD2 3.88Å; T642-Y646 HydrophobicContact CG2-CE2 3.62Å; T642-Y646 WeakPolarHBondContact O-CD2 3.16Å; T642-Y646 PolarHBondContact O-N 3.31Å; E643-Y646 PolarHBondContact O-N 3.34Å; Y646-T648 PolarHBondContact O-N 2.97Å
647	L	87.1	Confident	87.3	Confident	8 Å²	8	66 Å²	66	4%	0.042	37%	0.374	C	S	.	.			trans	-63.7	122.3	178	-157.3	72.2	0	0	0	111	T624 E643 L644 V645 L651 R652 V657 L661	T624-L647 HydrophobicContact CG2-CD1 3.53Å; E643-L647 WeakPolarHBondContact O-CB 3.38Å; E643-L647 PolarHBondContact O-N 3.44Å; L644-L647 HydrophobicContact CD2-CD2 4.44Å; V645-L647 VanDerWaalsContact C-N 3.25Å; V645-L647 PolarHBondContact O-N 3.06Å; L647-L651 HydrophobicContact CD1-CD2 3.88Å; L647-R652 HydrophobicContact CD2-CG 3.63Å; L647-R652 HydrophobicContact CG-CG 4.05Å; L647-R652 PolarHBondContact O-NH1 3.44Å; L647-R652 PolarHBondContact O-NH2 3.47Å; L647-V657 HydrophobicContact CD1-CG1 4.27Å; L647-V657 HydrophobicContact CD2-CG1 4.01Å; L647-L661 HydrophobicContact CD2-CD1 4.02Å; L647-L661 HydrophobicContact CD2-CD2 4.05Å; L647-L661 HydrophobicContact CD2-CG 4.47Å
648	T	86.1	Confident	87.7	Confident	74 Å²	74	64.4 Å²	64.4	45%	0.454	37%	0.365	S	S	.	.			trans	-78	156.7	178.7	64.8	0	0	0	0	111.5	Y646 A650 L651 R652	Y646-T648 PolarHBondContact O-N 2.97Å; T648-A650 PolarHBondContact O-N 3.07Å; T648-L651 PolarHBondContact O-N 2.83Å; T648-L651 WeakPolarHBondContact OG1-CB 3.31Å; T648-L651 PolarHBondContact OG1-N 3.27Å; T648-R652 PolarHBondContact O-N 3.2Å; T648-R652 PolarHBondContact O-NH1 2.95Å
649	P	84.2	Confident	88	Confident	103 Å²	103	63.6 Å²	63.6	67%	0.669	35%	0.352	S	S	*	.	H	α-helix	trans	-60.1	-41.3	177	-25.6	36	0	0	0	113.5	L651 R652 S653	P649-L651 VanDerWaalsContact C-N 3.32Å; P649-L651 PolarHBondContact O-N 2.91Å; P649-R652 WeakPolarHBondContact O-CB 3.4Å; P649-R652 PolarHBondContact O-N 3.48Å; P649-S653 PolarHBondContact O-N 3.46Å
650	A	84.6	Confident	88.3	Confident	72 Å²	72	60.3 Å²	60.3	60%	0.595	33%	0.334	S	S	*	.	H	α-helix	trans	-59.7	-41.4	177.7	0	0	0	0	0	112.2	T648 R652 S653	T648-A650 PolarHBondContact O-N 3.07Å; A650-R652 PolarHBondContact O-N 3.23Å; A650-S653 PolarHBondContact O-N 3.12Å; A650-S653 VanDerWaalsContact O-N 3.17Å; A650-S653 PolarHBondContact O-OG 3.13Å
651	L	84.3	Confident	88.5	Confident	27 Å²	27	61.8 Å²	61.8	14%	0.141	34%	0.342	C	S	.	.	H	α-helix	trans	-73.4	-11.3	176.9	-148.8	78	0	0	0	113.2	I620 T624 L647 T648 P649 D654 V657	I620-L651 HydrophobicContact CB-CD1 4.05Å; I620-L651 HydrophobicContact CG2-CD1 3.7Å; I620-L651 HydrophobicContact CG2-CD2 3.9Å; I620-L651 HydrophobicContact CG2-CG 4.49Å; T624-L651 HydrophobicContact CG2-CD2 3.79Å; L647-L651 HydrophobicContact CD1-CD2 3.88Å; T648-L651 PolarHBondContact O-N 2.83Å; T648-L651 WeakPolarHBondContact OG1-CB 3.31Å; T648-L651 PolarHBondContact OG1-N 3.27Å; P649-L651 VanDerWaalsContact C-N 3.32Å; P649-L651 PolarHBondContact O-N 2.91Å; L651-D654 VanDerWaalsContact CD1-OD2 3.27Å; L651-D654 WeakPolarHBondContact CD1-OD2 3.44Å; L651-V657 HydrophobicContact CG-CG2 4.41Å; L651-V657 WeakPolarHBondContact O-CB 3.35Å; L651-V657 WeakPolarHBondContact O-CG1 3.38Å; L651-V657 WeakPolarHBondContact O-CG2 3.22Å
652	R	86.6	Confident	88.8	Confident	96 Å²	96	58.9 Å²	58.9	36%	0.362	33%	0.332	S	S	.	.	H	α-helix	trans	-81.7	-20.6	170.4	-68.6	-175.3	-175.5	84.8	2	112.7	L644 L647 T648 P649 A650 L661	L644-R652 PolarHBondContact O-NH2 3.18Å; L647-R652 HydrophobicContact CD2-CG 3.63Å; L647-R652 HydrophobicContact CG-CG 4.05Å; L647-R652 PolarHBondContact O-NH1 3.44Å; L647-R652 PolarHBondContact O-NH2 3.47Å; T648-R652 PolarHBondContact O-N 3.2Å; T648-R652 PolarHBondContact O-NH1 2.95Å; P649-R652 WeakPolarHBondContact O-CB 3.4Å; P649-R652 PolarHBondContact O-N 3.48Å; A650-R652 PolarHBondContact O-N 3.23Å; R652-L661 HydrophobicContact CB-CD1 4.41Å; R652-L661 HydrophobicContact CG-CD1 4.07Å
653	S	87.6	Confident	89	Confident	93 Å²	93	56 Å²	56	65%	0.65	32%	0.315	S	S	*	.	H	α-helix	trans	-78.2	-19.9	176.1	12.6	0	0	0	0	113.7	P649 A650 E655	P649-S653 PolarHBondContact O-N 3.46Å; A650-S653 PolarHBondContact O-N 3.12Å; A650-S653 VanDerWaalsContact O-N 3.17Å; A650-S653 PolarHBondContact O-OG 3.13Å; S653-E655 PolarHBondContact O-N 3.26Å
654	D	88.8	Confident	89.2	Confident	61 Å²	61	58.7 Å²	58.7	33%	0.326	32%	0.324	S	S	.	.	S	Bend	trans	-59.8	128.2	175.6	-71	-36.8	0	0	0	111.4	G621 L651 C656 V657 A658	G621-D654 WeakPolarHBondContact CA-OD2 3.33Å; L651-D654 VanDerWaalsContact CD1-OD2 3.27Å; L651-D654 WeakPolarHBondContact CD1-OD2 3.44Å; D654-C656 PolarHBondContact O-N 3.12Å; D654-C656 VanDerWaalsContact O-N 3.13Å; D654-V657 HydrophobicContact CB-CB 4.19Å; D654-V657 HydrophobicContact CB-CG2 3.99Å; D654-V657 PolarHBondContact O-N 3.07Å; D654-A658 WeakPolarHBondContact O-CB 3.32Å; D654-A658 PolarHBondContact O-N 3.01Å
655	E	89.9	Confident	89.5	Confident	164 Å²	164	59.3 Å²	59.3	77%	0.766	33%	0.334	S	S	*	.	H	α-helix	trans	-52.6	-40.8	-178.7	-59.5	-174.2	142.6	0	0	112.8	S653 V657 H659	S653-E655 PolarHBondContact O-N 3.26Å; E655-V657 PolarHBondContact O-N 2.86Å; E655-H659 WeakPolarHBondContact O-CB 3.09Å; E655-H659 PolarHBondContact O-N 2.7Å
656	C	90.7	Very high	89.7	Confident	10 Å²	10	54.4 Å²	54.4	7%	0.068	31%	0.305	C	S	.	.	H	α-helix	trans	-65	-38.4	179.3	-65.7	0	0	0	0	112.3	A625 D654 S660 P683	A625-C656 HydrophobicContact CB-CB 3.81Å; A625-C656 VanDerWaalsContact CB-O 3.23Å; A625-C656 WeakPolarHBondContact CB-O 3.4Å; D654-C656 PolarHBondContact O-N 3.12Å; D654-C656 VanDerWaalsContact O-N 3.13Å; C656-S660 WeakPolarHBondContact O-CB 3.39Å; C656-S660 PolarHBondContact O-N 2.96Å; C656-S660 VanDerWaalsContact O-N 3.1Å; C656-S660 PolarHBondContact O-OG 2.7Å; C656-P683 HydrophobicContact CB-CG 4.45Å
657	V	91.7	Very high	90.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-80	-45.4	-180	-176.8	0	0	0	0	110.1	G621 A625 L628 L647 L651 D654 E655 H659 S660 L661	G621-V657 WeakPolarHBondContact O-CG2 3.29Å; A625-V657 HydrophobicContact CB-CG2 4.3Å; L628-V657 HydrophobicContact CD1-CG1 4.34Å; L647-V657 HydrophobicContact CD1-CG1 4.27Å; L647-V657 HydrophobicContact CD2-CG1 4.01Å; L651-V657 HydrophobicContact CG-CG2 4.41Å; L651-V657 WeakPolarHBondContact O-CB 3.35Å; L651-V657 WeakPolarHBondContact O-CG1 3.38Å; L651-V657 WeakPolarHBondContact O-CG2 3.22Å; D654-V657 HydrophobicContact CB-CB 4.19Å; D654-V657 HydrophobicContact CB-CG2 3.99Å; D654-V657 PolarHBondContact O-N 3.07Å; E655-V657 PolarHBondContact O-N 2.86Å; V657-H659 VanDerWaalsContact C-N 3.27Å; V657-H659 PolarHBondContact O-N 2.74Å; V657-S660 CarbonylContact O-C 3.42Å; V657-S660 PolarHBondContact O-N 3.47Å; V657-L661 HydrophobicContact CG1-CD1 4Å; V657-L661 HydrophobicContact CG1-CG 4.17Å; V657-L661 WeakPolarHBondContact O-CB 3.38Å; V657-L661 VanDerWaalsContact O-CG 3.25Å; V657-L661 WeakPolarHBondContact O-CG 3.17Å; V657-L661 PolarHBondContact O-N 3.05Å
658	A	92.4	Very high	90.3	Very high	44 Å²	44	51.6 Å²	51.6	36%	0.364	31%	0.306	S	S	.	.	H	α-helix	trans	-54.3	-44.2	173.1	0	0	0	0	0	111.5	D654 L661 A662	D654-A658 WeakPolarHBondContact O-CB 3.32Å; D654-A658 PolarHBondContact O-N 3.01Å; A658-L661 PolarHBondContact O-N 3.11Å; A658-A662 WeakPolarHBondContact O-CB 3.27Å; A658-A662 PolarHBondContact O-N 3.07Å
659	H	93.1	Very high	90.5	Very high	22 Å²	22	54.9 Å²	54.9	10%	0.102	32%	0.321	C	S	.	.	H	α-helix	trans	-59.2	-50.3	171.9	-176.6	102.9	0	0	0	112	E655 V657 L661 A662 L663 L678 E681 P683	E655-H659 WeakPolarHBondContact O-CB 3.09Å; E655-H659 PolarHBondContact O-N 2.7Å; V657-H659 VanDerWaalsContact C-N 3.27Å; V657-H659 PolarHBondContact O-N 2.74Å; H659-L661 VanDerWaalsContact C-N 3.31Å; H659-L661 PolarHBondContact O-N 2.93Å; H659-A662 PolarHBondContact O-N 3.45Å; H659-L663 WeakPolarHBondContact O-CB 3.48Å; H659-L663 PolarHBondContact O-N 3.42Å; H659-L678 PolarHBondContact CE1-O 2.67Å; H659-L678 PolarHBondContact NE2-O 3Å; H659-E681 VanDerWaalsContact CE1-C 3.49Å; H659-E681 PolarHBondContact CE1-O 3.09Å; H659-E681 PolarHBondContact ND1-O 2.92Å; H659-P683 HydrophobicContact CB-CG 4.07Å; H659-P683 VanDerWaalsContact CG-CD 3.5Å
660	S	93.3	Very high	90.7	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.007	30%	0.303	C	S	.	.	H	α-helix	trans	-64.7	-34.4	-178.2	-61	0	0	0	0	112.7	A625 C656 V657 R664	A625-S660 VanDerWaalsContact CB-OG 3.29Å; A625-S660 WeakPolarHBondContact CB-OG 3.48Å; C656-S660 WeakPolarHBondContact O-CB 3.39Å; C656-S660 PolarHBondContact O-N 2.96Å; C656-S660 VanDerWaalsContact O-N 3.1Å; C656-S660 PolarHBondContact O-OG 2.7Å; V657-S660 CarbonylContact O-C 3.42Å; V657-S660 PolarHBondContact O-N 3.47Å; S660-R664 WeakPolarHBondContact O-CB 3.42Å; S660-R664 PolarHBondContact O-N 3.47Å
661	L	92.9	Very high	91.1	Very high	38 Å²	38	51.6 Å²	51.6	20%	0.199	29%	0.294	C	S	.	.	H	α-helix	trans	-66.9	-43.9	172.1	-69.4	173.2	0	0	0	111.6	L628 L644 L647 R652 V657 A658 H659 R664 A665	L628-L661 HydrophobicContact CD1-CD2 4.16Å; L644-L661 HydrophobicContact CD2-CD2 3.23Å; L647-L661 HydrophobicContact CD2-CD1 4.02Å; L647-L661 HydrophobicContact CD2-CD2 4.05Å; L647-L661 HydrophobicContact CD2-CG 4.47Å; R652-L661 HydrophobicContact CB-CD1 4.41Å; R652-L661 HydrophobicContact CG-CD1 4.07Å; V657-L661 HydrophobicContact CG1-CD1 4Å; V657-L661 HydrophobicContact CG1-CG 4.17Å; V657-L661 WeakPolarHBondContact O-CB 3.38Å; V657-L661 VanDerWaalsContact O-CG 3.25Å; V657-L661 WeakPolarHBondContact O-CG 3.17Å; V657-L661 PolarHBondContact O-N 3.05Å; A658-L661 PolarHBondContact O-N 3.11Å; H659-L661 VanDerWaalsContact C-N 3.31Å; H659-L661 PolarHBondContact O-N 2.93Å; L661-R664 PolarHBondContact O-N 3.36Å; L661-A665 WeakPolarHBondContact O-CB 3.36Å; L661-A665 PolarHBondContact O-N 3.03Å
662	A	93.1	Very high	91.4	Very high	37 Å²	37	53.1 Å²	53.1	31%	0.306	30%	0.299	S	S	.	.	H	α-helix	trans	-64.2	-40	175.6	0	0	0	0	0	111.9	A658 H659 A665 A666 L678	A658-A662 WeakPolarHBondContact O-CB 3.27Å; A658-A662 PolarHBondContact O-N 3.07Å; H659-A662 PolarHBondContact O-N 3.45Å; A662-A665 PolarHBondContact O-N 2.96Å; A662-A666 WeakPolarHBondContact O-CB 3.35Å; A662-A666 PolarHBondContact O-N 2.89Å; A662-L678 HydrophobicContact CB-CD1 3.89Å; A662-L678 HydrophobicContact CB-CD2 4.45Å
663	L	93.9	Very high	91.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-43.1	175.3	-169.4	75.7	0	0	0	110.8	L629 M632 H659 A665 A666 W667 F675 L678 I690	L629-L663 HydrophobicContact CD2-CD2 3.61Å; M632-L663 HydrophobicContact CE-CD2 4.05Å; M632-L663 HydrophobicContact CE-CG 4.4Å; H659-L663 WeakPolarHBondContact O-CB 3.48Å; H659-L663 PolarHBondContact O-N 3.42Å; L663-A665 PolarHBondContact O-N 2.84Å; L663-A666 PolarHBondContact O-N 3.14Å; L663-W667 VanDerWaalsContact O-CB 3.31Å; L663-W667 WeakPolarHBondContact O-CB 3.32Å; L663-W667 PolarHBondContact O-N 3.48Å; L663-F675 HydrophobicContact CD1-CD2 3.46Å; L663-F675 VanDerWaalsContact CD1-CD2 3.46Å; L663-F675 HydrophobicContact CD1-CE2 3.7Å; L663-F675 HydrophobicContact CD1-CG 4.11Å; L663-F675 HydrophobicContact CD2-CE2 4.24Å; L663-F675 HydrophobicContact CG-CD2 3.91Å; L663-F675 HydrophobicContact CG-CE2 3.87Å; L663-L678 HydrophobicContact CB-CD1 4.29Å; L663-L678 HydrophobicContact CD1-CB 3.61Å; L663-L678 HydrophobicContact CD1-CD1 4.3Å; L663-I690 HydrophobicContact CD2-CD1 3.59Å; L663-I690 HydrophobicContact CD2-CG1 3.76Å
664	R	92.6	Very high	91.7	Very high	67 Å²	67	54.1 Å²	54.1	25%	0.253	29%	0.293	S	S	.	.	H	α-helix	trans	-62.8	-38.6	175.2	-176.7	-90	176.8	171.8	2.9	112.7	M632 S660 L661 A668	M632-R664 HydrophobicContact CE-CB 4.04Å; M632-R664 WeakPolarHBondContact SD-CA 3.33Å; M632-R664 HydrophobicContact SD-CB 3.69Å; M632-R664 HydrophobicContact SD-CG 4.03Å; S660-R664 WeakPolarHBondContact O-CB 3.42Å; S660-R664 PolarHBondContact O-N 3.47Å; L661-R664 PolarHBondContact O-N 3.36Å; R664-A668 VanDerWaalsContact O-CB 3.26Å; R664-A668 WeakPolarHBondContact O-CB 3.41Å; R664-A668 PolarHBondContact O-N 3.38Å
665	A	92.9	Very high	91.9	Very high	45 Å²	45	51.3 Å²	51.3	37%	0.372	28%	0.277	S	S	.	.	H	α-helix	trans	-67	-45.8	173.8	0	0	0	0	0	111.4	L661 A662 L663 W667 A668 L669	L661-A665 WeakPolarHBondContact O-CB 3.36Å; L661-A665 PolarHBondContact O-N 3.03Å; A662-A665 PolarHBondContact O-N 2.96Å; L663-A665 PolarHBondContact O-N 2.84Å; A665-W667 VanDerWaalsContact C-N 3.35Å; A665-W667 PolarHBondContact O-N 3.28Å; A665-A668 PolarHBondContact O-N 2.79Å; A665-L669 WeakPolarHBondContact O-CB 3.34Å; A665-L669 VanDerWaalsContact O-CG 3.26Å; A665-L669 WeakPolarHBondContact O-CG 3.42Å; A665-L669 PolarHBondContact O-N 2.74Å
666	A	93.4	Very high	91.9	Very high	5 Å²	5	43.6 Å²	43.6	4%	0.041	24%	0.242	C	C	.	.	H	α-helix	trans	-61.1	-42.2	176.3	0	0	0	0	0	112.2	A662 L663 G670 N671 R674 F675 L678	A662-A666 WeakPolarHBondContact O-CB 3.35Å; A662-A666 PolarHBondContact O-N 2.89Å; L663-A666 PolarHBondContact O-N 3.14Å; A666-G670 PolarHBondContact O-N 2.83Å; A666-N671 HydrophobicContact CB-CB 4.5Å; A666-N671 PolarHBondContact O-N 2.97Å; A666-R674 HydrophobicContact CB-CB 4.12Å; A666-R674 HydrophobicContact CB-CG 4.17Å; A666-F675 HydrophobicContact CB-CB 4.25Å; A666-L678 HydrophobicContact CB-CD1 4.45Å
667	W	92.5	Very high	92	Very high	59 Å²	59	48 Å²	48	22%	0.223	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-50.8	176	179.8	72.1	0	0	0	112.2	M632 K635 L663 A665 L669 G670 F675 E697	M632-W667 HydrophobicContact CG-CD2 4.27Å; M632-W667 HydrophobicContact CG-CE3 3.92Å; M632-W667 HydrophobicContact CG-CZ3 4.19Å; M632-W667 HydrophobicContact SD-CB 4.12Å; M632-W667 HydrophobicContact SD-CD2 4.18Å; M632-W667 HydrophobicContact SD-CE3 4.06Å; M632-W667 HydrophobicContact SD-CG 4.23Å; K635-W667 HydrophobicContact CG-CZ2 4.37Å; L663-W667 VanDerWaalsContact O-CB 3.31Å; L663-W667 WeakPolarHBondContact O-CB 3.32Å; L663-W667 PolarHBondContact O-N 3.48Å; A665-W667 VanDerWaalsContact C-N 3.35Å; A665-W667 PolarHBondContact O-N 3.28Å; W667-L669 VanDerWaalsContact C-N 3.26Å; W667-L669 PolarHBondContact O-N 3.18Å; W667-G670 PolarHBondContact O-N 3.07Å; W667-F675 HydrophobicContact CB-CD2 4.13Å; W667-F675 HydrophobicContact CB-CE2 4.33Å; W667-E697 PolarHBondContact NE1-OE1 3.03Å; W667-E697 PolarHBondContact NE1-OE2 3.24Å
668	A	90.8	Very high	91.9	Very high	65 Å²	65	48.3 Å²	48.3	54%	0.537	26%	0.261	S	S	.	.	H	α-helix	trans	-63.9	-28.7	-179.9	0	0	0	0	0	113.6	R664 A665	R664-A668 VanDerWaalsContact O-CB 3.26Å; R664-A668 WeakPolarHBondContact O-CB 3.41Å; R664-A668 PolarHBondContact O-N 3.38Å; A665-A668 PolarHBondContact O-N 2.79Å
669	L	91	Very high	91.8	Very high	144 Å²	144	48.5 Å²	48.5	75%	0.754	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-4.2	174.9	-67.1	171.6	0	0	0	113.8	A665 W667 N671	A665-L669 WeakPolarHBondContact O-CB 3.34Å; A665-L669 VanDerWaalsContact O-CG 3.26Å; A665-L669 WeakPolarHBondContact O-CG 3.42Å; A665-L669 PolarHBondContact O-N 2.74Å; W667-L669 VanDerWaalsContact C-N 3.26Å; W667-L669 PolarHBondContact O-N 3.18Å; L669-N671 PolarHBondContact O-N 2.78Å
670	G	89.5	Confident	91.6	Very high	29 Å²	29	57 Å²	57	30%	0.299	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	64	22.3	-172.6	0	0	0	0	0	114.1	A666 W667 Y672	A666-G670 PolarHBondContact O-N 2.83Å; W667-G670 PolarHBondContact O-N 3.07Å; G670-Y672 VanDerWaalsContact C-N 3.29Å; G670-Y672 WeakPolarHBondContact O-CD2 3.47Å; G670-Y672 VanDerWaalsContact O-CE2 3.26Å; G670-Y672 WeakPolarHBondContact O-CE2 3.12Å; G670-Y672 PolarHBondContact O-N 3.14Å
671	N	92.6	Very high	91.3	Very high	77 Å²	77	61.1 Å²	61.1	41%	0.412	30%	0.303	S	S	.	.			trans	-80.7	76.9	179.1	-171.6	-25	0	0	0	110.3	A666 L669 H673 R674 F675	A666-N671 HydrophobicContact CB-CB 4.5Å; A666-N671 PolarHBondContact O-N 2.97Å; L669-N671 PolarHBondContact O-N 2.78Å; N671-H673 VanDerWaalsContact C-N 3.31Å; N671-H673 PolarHBondContact O-N 2.89Å; N671-R674 HydrophobicContact CB-CB 4.47Å; N671-R674 PolarHBondContact O-N 2.88Å; N671-R674 WeakPolarHBondContact OD1-CB 3.48Å; N671-R674 PolarHBondContact OD1-N 2.86Å; N671-F675 WeakPolarHBondContact O-CB 3.32Å; N671-F675 PolarHBondContact O-N 2.57Å
672	Y	89.9	Confident	91	Very high	59 Å²	59	60.5 Å²	60.5	23%	0.231	30%	0.304	C	S	.	.	H	α-helix	trans	-56.6	-40.4	-176.5	-53.2	-62.8	0	0	0	112.9	G670 R674 F675 F676 L700 A701 A704	G670-Y672 VanDerWaalsContact C-N 3.29Å; G670-Y672 WeakPolarHBondContact O-CD2 3.47Å; G670-Y672 VanDerWaalsContact O-CE2 3.26Å; G670-Y672 WeakPolarHBondContact O-CE2 3.12Å; G670-Y672 PolarHBondContact O-N 3.14Å; Y672-R674 PolarHBondContact O-N 2.79Å; Y672-F675 WeakPolarHBondContact O-CB 2.86Å; Y672-F675 PolarHBondContact O-N 3.15Å; Y672-F676 WeakPolarHBondContact O-CD2 3.46Å; Y672-F676 PolarHBondContact O-N 2.84Å; Y672-L700 HydrophobicContact CE1-CB 4.37Å; Y672-A701 HydrophobicContact CD1-CB 3.48Å; Y672-A701 VanDerWaalsContact CD1-CB 3.48Å; Y672-A701 HydrophobicContact CD2-CB 3.79Å; Y672-A701 HydrophobicContact CE1-CB 3.94Å; Y672-A701 HydrophobicContact CE2-CB 4.23Å; Y672-A701 HydrophobicContact CG-CB 3.39Å; Y672-A704 HydrophobicContact CE2-CB 3.86Å
673	H	88.8	Confident	90.6	Very high	111 Å²	111	60.2 Å²	60.2	51%	0.514	30%	0.298	S	S	.	.	H	α-helix	trans	-63.7	-41.8	179.2	-175.8	-94.5	0	0	0	112.2	N671 K677	N671-H673 VanDerWaalsContact C-N 3.31Å; N671-H673 PolarHBondContact O-N 2.89Å; H673-K677 WeakPolarHBondContact O-CB 3.41Å; H673-K677 PolarHBondContact O-N 3.1Å
674	R	91.3	Very high	90.2	Very high	98 Å²	98	67 Å²	67	37%	0.37	32%	0.324	S	S	.	.	H	α-helix	trans	-71.9	-35	174.2	-172	53.2	172.2	144.2	-7	112	A666 N671 Y672 K677 L678 E681	A666-R674 HydrophobicContact CB-CB 4.12Å; A666-R674 HydrophobicContact CB-CG 4.17Å; N671-R674 HydrophobicContact CB-CB 4.47Å; N671-R674 PolarHBondContact O-N 2.88Å; N671-R674 WeakPolarHBondContact OD1-CB 3.48Å; N671-R674 PolarHBondContact OD1-N 2.86Å; Y672-R674 PolarHBondContact O-N 2.79Å; R674-K677 PolarHBondContact O-N 3.14Å; R674-L678 HydrophobicContact CG-CD1 4.01Å; R674-L678 HydrophobicContact CG-CG 4.42Å; R674-L678 WeakPolarHBondContact O-CB 3.02Å; R674-L678 WeakPolarHBondContact O-CG 3.3Å; R674-L678 PolarHBondContact O-N 2.86Å; R674-E681 IonicContact CZ-OE2 3.67Å; R674-E681 IonicContact NH1-OE2 2.66Å; R674-E681 PolarHBondContact NH1-OE2 3.28Å
675	F	92.9	Very high	89.7	Confident	2 Å²	2	65 Å²	65	1%	0.009	32%	0.318	C	S	.	.	H	α-helix	trans	-60.5	-52.1	174.6	179.3	-91.4	0	0	0	111.9	L663 A666 W667 N671 Y672 K677 L678 Y679 I690 F693 E697	L663-F675 HydrophobicContact CD1-CD2 3.46Å; L663-F675 VanDerWaalsContact CD1-CD2 3.46Å; L663-F675 HydrophobicContact CD1-CE2 3.7Å; L663-F675 HydrophobicContact CD1-CG 4.11Å; L663-F675 HydrophobicContact CD2-CE2 4.24Å; L663-F675 HydrophobicContact CG-CD2 3.91Å; L663-F675 HydrophobicContact CG-CE2 3.87Å; A666-F675 HydrophobicContact CB-CB 4.25Å; W667-F675 HydrophobicContact CB-CD2 4.13Å; W667-F675 HydrophobicContact CB-CE2 4.33Å; N671-F675 WeakPolarHBondContact O-CB 3.32Å; N671-F675 PolarHBondContact O-N 2.57Å; Y672-F675 WeakPolarHBondContact O-CB 2.86Å; Y672-F675 PolarHBondContact O-N 3.15Å; F675-K677 VanDerWaalsContact C-N 3.35Å; F675-K677 PolarHBondContact O-N 3.4Å; F675-L678 PolarHBondContact O-N 3.13Å; F675-Y679 WeakPolarHBondContact O-CB 3.47Å; F675-Y679 PolarHBondContact O-N 3.19Å; F675-I690 HydrophobicContact CZ-CG2 3.99Å; F675-F693 AromaticContact CE2-CE2 3.93Å; F675-F693 HydrophobicContact CE2-CE2 3.93Å; F675-F693 HydrophobicContact CZ-CD2 4.31Å; F675-F693 AromaticContact CZ-CE2 3.82Å; F675-F693 HydrophobicContact CZ-CE2 3.82Å; F675-E697 HydrophobicContact CD1-CB 4.5Å; F675-E697 HydrophobicContact CE1-CB 3.92Å; F675-E697 HydrophobicContact CE1-CG 4.11Å; F675-E697 HydrophobicContact CZ-CB 4.26Å; F675-E697 HydrophobicContact CZ-CG 3.9Å
676	F	91.5	Very high	89.5	Confident	3 Å²	3	63 Å²	63	1%	0.013	30%	0.301	C	S	.	.	H	α-helix	trans	-71.4	-26.9	179.4	-68.1	-61.9	0	0	0	113.4	Y672 R680 V694 E697 R698 A701 T721 L722	Y672-F676 WeakPolarHBondContact O-CD2 3.46Å; Y672-F676 PolarHBondContact O-N 2.84Å; F676-R680 PolarHBondContact O-N 3.32Å; F676-V694 HydrophobicContact CD1-CG2 4.33Å; F676-V694 HydrophobicContact CE1-CG2 3.75Å; F676-E697 HydrophobicContact CZ-CB 4.42Å; F676-R698 HydrophobicContact CE1-CG 3.54Å; F676-R698 HydrophobicContact CE2-CG 4.4Å; F676-R698 HydrophobicContact CZ-CB 4.22Å; F676-R698 HydrophobicContact CZ-CG 3.4Å; F676-R698 VanDerWaalsContact CZ-CG 3.4Å; F676-A701 HydrophobicContact CE2-CB 4.09Å; F676-T721 WeakPolarHBondContact CD2-O 3.22Å; F676-L722 WeakPolarHBondContact CD1-O 3.45Å; F676-L722 HydrophobicContact CD2-CD2 4.29Å; F676-L722 HydrophobicContact CE2-CD2 3.72Å; F676-L722 HydrophobicContact CZ-CD2 4.38Å
677	K	91.1	Very high	89.3	Confident	103 Å²	103	64.5 Å²	64.5	45%	0.448	31%	0.311	S	S	.	.	H	α-helix	trans	-63.7	-50.6	166.7	-179.9	171.4	173.8	173.8	0	110.9	H673 R674 F675 Y679 R680 E681	H673-K677 WeakPolarHBondContact O-CB 3.41Å; H673-K677 PolarHBondContact O-N 3.1Å; R674-K677 PolarHBondContact O-N 3.14Å; F675-K677 VanDerWaalsContact C-N 3.35Å; F675-K677 PolarHBondContact O-N 3.4Å; K677-Y679 PolarHBondContact O-N 2.66Å; K677-R680 PolarHBondContact O-N 3.29Å; K677-R680 VanDerWaalsContact O-N 3.12Å; K677-E681 WeakPolarHBondContact CE-OE1 3.49Å; K677-E681 WeakPolarHBondContact CE-OE2 3.48Å; K677-E681 IonicContact NZ-OE1 3.66Å; K677-E681 PolarHBondContact NZ-OE1 3.11Å; K677-E681 WeakPolarHBondContact O-CG 3.4Å; K677-E681 PolarHBondContact O-N 3.45Å
678	L	91.4	Very high	89.1	Confident	6 Å²	6	66.6 Å²	66.6	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-62.9	-40.4	179	-74.2	168.3	0	0	0	112.4	H659 A662 L663 A666 R674 F675 R680 E681 A682	H659-L678 PolarHBondContact CE1-O 2.67Å; H659-L678 PolarHBondContact NE2-O 3Å; A662-L678 HydrophobicContact CB-CD1 3.89Å; A662-L678 HydrophobicContact CB-CD2 4.45Å; L663-L678 HydrophobicContact CB-CD1 4.29Å; L663-L678 HydrophobicContact CD1-CB 3.61Å; L663-L678 HydrophobicContact CD1-CD1 4.3Å; A666-L678 HydrophobicContact CB-CD1 4.45Å; R674-L678 HydrophobicContact CG-CD1 4.01Å; R674-L678 HydrophobicContact CG-CG 4.42Å; R674-L678 WeakPolarHBondContact O-CB 3.02Å; R674-L678 WeakPolarHBondContact O-CG 3.3Å; R674-L678 PolarHBondContact O-N 2.86Å; F675-L678 PolarHBondContact O-N 3.13Å; L678-R680 PolarHBondContact O-N 3.14Å; L678-R680 VanDerWaalsContact O-N 3.15Å; L678-E681 CarbonylContact O-C 3.6Å; L678-E681 VanDerWaalsContact O-C 3.26Å; L678-E681 WeakPolarHBondContact O-CA 3.4Å; L678-E681 PolarHBondContact O-N 3.07Å; L678-A682 PolarHBondContact O-N 3.27Å; L678-A682 VanDerWaalsContact O-N 3.14Å
679	Y	90.3	Very high	89.1	Confident	48 Å²	48	63.7 Å²	63.7	19%	0.188	30%	0.295	C	S	.	.	H	α-helix	trans	-54.8	-32.5	173.1	163.4	-102.2	0	0	0	113.5	F675 K677 A682 I690 D691 V694	F675-Y679 WeakPolarHBondContact O-CB 3.47Å; F675-Y679 PolarHBondContact O-N 3.19Å; K677-Y679 PolarHBondContact O-N 2.66Å; Y679-A682 WeakPolarHBondContact O-CB 3.41Å; Y679-I690 HydrophobicContact CD2-CB 4Å; Y679-I690 HydrophobicContact CD2-CD1 4.5Å; Y679-I690 HydrophobicContact CD2-CG2 3.54Å; Y679-I690 HydrophobicContact CE2-CG2 4.27Å; Y679-I690 HydrophobicContact CG-CG2 4.36Å; Y679-D691 WeakPolarHBondContact CE2-OD1 3.23Å; Y679-D691 PolarHBondContact OH-OD1 3.01Å; Y679-D691 VanDerWaalsContact OH-OD1 3.11Å; Y679-V694 HydrophobicContact CD1-CG2 4.5Å; Y679-V694 HydrophobicContact CD2-CG2 4.24Å; Y679-V694 HydrophobicContact CE1-CG2 4.43Å; Y679-V694 HydrophobicContact CE2-CG2 4.12Å; Y679-V694 HydrophobicContact CG-CG2 4.41Å
680	R	87.5	Confident	89.1	Confident	199 Å²	199	56.8 Å²	56.8	75%	0.751	26%	0.259	S	S	*	.	H	α-helix	trans	-81	-16.8	172.8	-68.7	-178	62.2	175	0.1	114.2	F676 K677 L678	F676-R680 PolarHBondContact O-N 3.32Å; K677-R680 PolarHBondContact O-N 3.29Å; K677-R680 VanDerWaalsContact O-N 3.12Å; L678-R680 PolarHBondContact O-N 3.14Å; L678-R680 VanDerWaalsContact O-N 3.15Å
681	E	87.9	Confident	89.2	Confident	89 Å²	89	58.8 Å²	58.8	42%	0.416	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	20.6	178.9	-62	173.9	153.7	0	0	110.9	H659 R674 K677 L678	H659-E681 VanDerWaalsContact CE1-C 3.49Å; H659-E681 PolarHBondContact CE1-O 3.09Å; H659-E681 PolarHBondContact ND1-O 2.92Å; R674-E681 IonicContact CZ-OE2 3.67Å; R674-E681 IonicContact NH1-OE2 2.66Å; R674-E681 PolarHBondContact NH1-OE2 3.28Å; K677-E681 WeakPolarHBondContact CE-OE1 3.49Å; K677-E681 WeakPolarHBondContact CE-OE2 3.48Å; K677-E681 IonicContact NZ-OE1 3.66Å; K677-E681 PolarHBondContact NZ-OE1 3.11Å; K677-E681 WeakPolarHBondContact O-CG 3.4Å; K677-E681 PolarHBondContact O-N 3.45Å; L678-E681 CarbonylContact O-C 3.6Å; L678-E681 VanDerWaalsContact O-C 3.26Å; L678-E681 WeakPolarHBondContact O-CA 3.4Å; L678-E681 PolarHBondContact O-N 3.07Å
682	A	86.9	Confident	89	Confident	25 Å²	25	59.3 Å²	59.3	21%	0.207	26%	0.261	C	S	.	.			trans	-75.1	122.4	-169.4	0	0	0	0	0	112.6	L678 Y679 A686 I690	L678-A682 PolarHBondContact O-N 3.27Å; L678-A682 VanDerWaalsContact O-N 3.14Å; Y679-A682 WeakPolarHBondContact O-CB 3.41Å; A682-A686 HydrophobicContact CB-CB 4.24Å; A682-I690 HydrophobicContact CB-CD1 4.17Å
683	P	84.6	Confident	89.1	Confident	30 Å²	30	56.6 Å²	56.6	20%	0.195	25%	0.251	C	S	.	.			trans	-82.5	154.2	-176.6	32.3	-35.4	0	0	0	113.2	C656 H659 M685 A686	C656-P683 HydrophobicContact CB-CG 4.45Å; H659-P683 HydrophobicContact CB-CG 4.07Å; H659-P683 VanDerWaalsContact CG-CD 3.5Å; P683-M685 PolarHBondContact O-N 3.41Å; P683-A686 WeakPolarHBondContact O-CB 3.19Å; P683-A686 PolarHBondContact O-N 2.99Å; P683-A686 VanDerWaalsContact O-N 3.1Å
684	R	84.6	Confident	89.2	Confident	144 Å²	144	51.6 Å²	51.6	54%	0.543	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	-122.5	179.5	-56	-173	-172.5	-163.6	2.1	111	N619 E622 Y626	N619-R684 PolarHBondContact OD1-NH1 2.85Å; E622-R684 VanDerWaalsContact OE2-CD 3.29Å; E622-R684 WeakPolarHBondContact OE2-CD 3.41Å; E622-R684 IonicContact OE2-CZ 2.65Å; E622-R684 IonicContact OE2-NE 2.7Å; E622-R684 IonicContact OE2-NH1 3.96Å; E622-R684 PolarHBondContact OE2-NH1 3.43Å; Y626-R684 WeakPolarHBondContact OH-CB 3.34Å
685	M	83.3	Confident	89.2	Confident	24 Å²	24	51.7 Å²	51.7	12%	0.118	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	18.1	-177	-51.6	170.3	72.9	0	0	112.5	R590 L593 E594 Y626 P683 S687 Y688	R590-M685 HydrophobicContact CB-CE 3.98Å; R590-M685 HydrophobicContact CB-SD 3.76Å; R590-M685 HydrophobicContact CG-CE 4.47Å; R590-M685 HydrophobicContact CG-SD 3.63Å; R590-M685 WeakPolarHBondContact O-CE 3.4Å; L593-M685 HydrophobicContact CB-CE 4.08Å; L593-M685 HydrophobicContact CD1-CB 4.45Å; E594-M685 HydrophobicContact CG-CE 3.5Å; Y626-M685 HydrophobicContact CE1-CB 4.38Å; Y626-M685 HydrophobicContact CE2-CB 4.49Å; Y626-M685 WeakPolarHBondContact OH-CB 3.48Å; Y626-M685 PolarHBondContact OH-N 2.87Å; P683-M685 PolarHBondContact O-N 3.41Å; M685-S687 PolarHBondContact O-N 3.48Å; M685-Y688 HydrophobicContact CB-CD2 3.91Å; M685-Y688 HydrophobicContact CB-CE2 4.37Å; M685-Y688 PolarHBondContact O-N 3.5Å
686	A	87.4	Confident	89.1	Confident	3 Å²	3	54.6 Å²	54.6	3%	0.025	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-33.4	-178.6	0	0	0	0	0	113.1	Y626 L629 A682 P683 Y688 L689 I690	Y626-A686 HydrophobicContact CE1-CB 4.32Å; L629-A686 HydrophobicContact CD1-CB 3.63Å; A682-A686 HydrophobicContact CB-CB 4.24Å; P683-A686 WeakPolarHBondContact O-CB 3.19Å; P683-A686 PolarHBondContact O-N 2.99Å; P683-A686 VanDerWaalsContact O-N 3.1Å; A686-Y688 PolarHBondContact O-N 3.33Å; A686-L689 PolarHBondContact O-N 3.3Å; A686-I690 HydrophobicContact CB-CD1 4.49Å; A686-I690 WeakPolarHBondContact O-CG1 3.37Å; A686-I690 PolarHBondContact O-N 3.3Å; A686-I690 VanDerWaalsContact O-N 3.1Å
687	S	89.1	Confident	89.1	Confident	36 Å²	36	54.9 Å²	54.9	25%	0.252	25%	0.245	S	C	.	.	H	α-helix	trans	-50.3	-52.9	175.8	45.6	0	0	0	0	112.6	M685 L689 I690 D691	M685-S687 PolarHBondContact O-N 3.48Å; S687-L689 PolarHBondContact O-N 3.03Å; S687-I690 PolarHBondContact O-N 3.43Å; S687-D691 PolarHBondContact O-N 2.98Å
688	Y	89.4	Confident	89.2	Confident	104 Å²	104	51.4 Å²	51.4	41%	0.408	23%	0.229	S	C	.	.	H	α-helix	trans	-56.1	-27.3	-178.8	-64.1	-87	0	0	0	114.1	M685 A686	M685-Y688 HydrophobicContact CB-CD2 3.91Å; M685-Y688 HydrophobicContact CB-CE2 4.37Å; M685-Y688 PolarHBondContact O-N 3.5Å; A686-Y688 PolarHBondContact O-N 3.33Å
689	L	90.4	Very high	89.1	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.016	24%	0.239	C	C	.	.	H	α-helix	trans	-85.9	-37.1	174.5	-79.3	166.2	0	0	0	112.6	L593 F601 Y626 L629 A686 S687 D691 K692 F693	L593-L689 HydrophobicContact CD1-CD1 4.27Å; L593-L689 HydrophobicContact CD2-CD1 4.03Å; L593-L689 HydrophobicContact CD2-CD2 3.7Å; L593-L689 HydrophobicContact CD2-CG 3.65Å; F601-L689 HydrophobicContact CD1-CD2 4.28Å; F601-L689 HydrophobicContact CE1-CD1 4.29Å; F601-L689 HydrophobicContact CE1-CD2 4.15Å; F601-L689 HydrophobicContact CZ-CD1 4.21Å; Y626-L689 VanDerWaalsContact CB-CD1 3.48Å; Y626-L689 HydrophobicContact CD1-CD1 3.97Å; Y626-L689 HydrophobicContact CG-CD1 3.77Å; L629-L689 HydrophobicContact CB-CB 4.02Å; L629-L689 HydrophobicContact CB-CD1 4.28Å; L629-L689 HydrophobicContact CD1-CB 4.04Å; L629-L689 HydrophobicContact CD1-CD1 4.25Å; A686-L689 PolarHBondContact O-N 3.3Å; S687-L689 PolarHBondContact O-N 3.03Å; L689-D691 VanDerWaalsContact C-N 3.33Å; L689-K692 PolarHBondContact O-N 3.12Å; L689-F693 WeakPolarHBondContact O-CD1 3.24Å; L689-F693 WeakPolarHBondContact O-CE1 3.45Å
690	I	91.4	Very high	89.1	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-67.1	-38.2	176.3	-57.8	161.4	0	0	0	110	L629 L663 F675 Y679 A682 A686 S687 K692 F693 V694	L629-I690 HydrophobicContact CD1-CG1 4.33Å; L629-I690 HydrophobicContact CD2-CD1 4.42Å; L629-I690 HydrophobicContact CD2-CG1 4.05Å; L663-I690 HydrophobicContact CD2-CD1 3.59Å; L663-I690 HydrophobicContact CD2-CG1 3.76Å; F675-I690 HydrophobicContact CZ-CG2 3.99Å; Y679-I690 HydrophobicContact CD2-CB 4Å; Y679-I690 HydrophobicContact CD2-CD1 4.5Å; Y679-I690 HydrophobicContact CD2-CG2 3.54Å; Y679-I690 HydrophobicContact CE2-CG2 4.27Å; Y679-I690 HydrophobicContact CG-CG2 4.36Å; A682-I690 HydrophobicContact CB-CD1 4.17Å; A686-I690 HydrophobicContact CB-CD1 4.49Å; A686-I690 WeakPolarHBondContact O-CG1 3.37Å; A686-I690 PolarHBondContact O-N 3.3Å; A686-I690 VanDerWaalsContact O-N 3.1Å; S687-I690 PolarHBondContact O-N 3.43Å; I690-K692 PolarHBondContact O-N 3.21Å; I690-K692 VanDerWaalsContact O-N 3.13Å; I690-F693 HydrophobicContact CG2-CZ 4.39Å; I690-F693 CarbonylContact O-C 3.56Å; I690-F693 PolarHBondContact O-N 3.5Å; I690-V694 HydrophobicContact CG2-CB 4.45Å; I690-V694 WeakPolarHBondContact O-CB 3.33Å; I690-V694 PolarHBondContact O-N 3.01Å
691	D	90.8	Very high	89.3	Confident	70 Å²	70	45.2 Å²	45.2	37%	0.374	21%	0.211	S	C	.	.	H	α-helix	trans	-53.3	-34	176.4	-75.1	-33.4	0	0	0	113.2	Y679 S687 L689 F693	Y679-D691 WeakPolarHBondContact CE2-OD1 3.23Å; Y679-D691 PolarHBondContact OH-OD1 3.01Å; Y679-D691 VanDerWaalsContact OH-OD1 3.11Å; S687-D691 PolarHBondContact O-N 2.98Å; L689-D691 VanDerWaalsContact C-N 3.33Å; D691-F693 PolarHBondContact O-N 3.5Å; D691-F693 VanDerWaalsContact O-N 3.15Å
692	K	88.5	Confident	89.4	Confident	88 Å²	88	41 Å²	41	38%	0.383	19%	0.191	S	C	.	.	H	α-helix	trans	-64.4	-17.5	177.5	-56.3	-57.2	-167.2	174.2	0	113.7	G596 F633 L689 I690	G596-K692 WeakPolarHBondContact O-CE 3.47Å; G596-K692 PolarHBondContact O-NZ 3.33Å; F633-K692 HydrophobicContact CD2-CB 3.45Å; F633-K692 VanDerWaalsContact CD2-CB 3.45Å; F633-K692 WeakPolarHBondContact CD2-O 3.32Å; F633-K692 HydrophobicContact CE2-CB 3.59Å; F633-K692 WeakPolarHBondContact CE2-O 3.25Å; F633-K692 HydrophobicContact CG-CB 4.16Å; F633-K692 HydrophobicContact CZ-CB 4.38Å; L689-K692 PolarHBondContact O-N 3.12Å; I690-K692 PolarHBondContact O-N 3.21Å; I690-K692 VanDerWaalsContact O-N 3.13Å
693	F	91.9	Very high	89.5	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.009	20%	0.196	C	C	.	.	H	α-helix	trans	-130.3	-3.2	174	63.3	-78.2	0	0	0	115.3	M632 F633 F675 L689 I690 D691 E695 R696 E697	M632-F693 HydrophobicContact CB-CE1 4.3Å; M632-F693 HydrophobicContact CB-CE2 3.97Å; M632-F693 HydrophobicContact CB-CZ 3.68Å; M632-F693 HydrophobicContact CE-CZ 4.48Å; F633-F693 HydrophobicContact CB-CD1 3.7Å; F633-F693 HydrophobicContact CB-CE1 4.12Å; F633-F693 HydrophobicContact CB-CG 4.5Å; F633-F693 HydrophobicContact CD2-CB 4.21Å; F633-F693 HydrophobicContact CD2-CD1 4.32Å; F675-F693 AromaticContact CE2-CE2 3.93Å; F675-F693 HydrophobicContact CE2-CE2 3.93Å; F675-F693 HydrophobicContact CZ-CD2 4.31Å; F675-F693 AromaticContact CZ-CE2 3.82Å; F675-F693 HydrophobicContact CZ-CE2 3.82Å; L689-F693 WeakPolarHBondContact O-CD1 3.24Å; L689-F693 WeakPolarHBondContact O-CE1 3.45Å; I690-F693 HydrophobicContact CG2-CZ 4.39Å; I690-F693 CarbonylContact O-C 3.56Å; I690-F693 PolarHBondContact O-N 3.5Å; D691-F693 PolarHBondContact O-N 3.5Å; D691-F693 VanDerWaalsContact O-N 3.15Å; F693-E695 PolarHBondContact O-N 3.24Å; F693-R696 VanDerWaalsContact O-CB 3.29Å; F693-R696 WeakPolarHBondContact O-CB 3.49Å; F693-R696 PolarHBondContact O-N 2.86Å; F693-E697 HydrophobicContact CD2-CG 3.82Å; F693-E697 HydrophobicContact CE2-CG 4.44Å; F693-E697 PolarHBondContact O-N 2.74Å; F693-E697 VanDerWaalsContact O-N 3.1Å
694	V	91.9	Very high	89.8	Confident	6 Å²	6	43.9 Å²	43.9	4%	0.036	20%	0.201	C	C	.	.	H	α-helix	trans	-56.8	-38.2	-178.2	76.6	0	0	0	0	112.2	F676 Y679 I690 R696 E697 R698	F676-V694 HydrophobicContact CD1-CG2 4.33Å; F676-V694 HydrophobicContact CE1-CG2 3.75Å; Y679-V694 HydrophobicContact CD1-CG2 4.5Å; Y679-V694 HydrophobicContact CD2-CG2 4.24Å; Y679-V694 HydrophobicContact CE1-CG2 4.43Å; Y679-V694 HydrophobicContact CE2-CG2 4.12Å; Y679-V694 HydrophobicContact CG-CG2 4.41Å; I690-V694 HydrophobicContact CG2-CB 4.45Å; I690-V694 WeakPolarHBondContact O-CB 3.33Å; I690-V694 PolarHBondContact O-N 3.01Å; V694-R696 PolarHBondContact O-N 3.05Å; V694-E697 PolarHBondContact O-N 3.12Å; V694-R698 VanDerWaalsContact O-CG 3.3Å; V694-R698 WeakPolarHBondContact O-CG 3.35Å; V694-R698 PolarHBondContact O-N 3.48Å
695	E	90.4	Very high	90	Very high	101 Å²	101	37.6 Å²	37.6	47%	0.472	18%	0.178	S	C	.	.	H	α-helix	trans	-65.1	-39.4	177.4	-161.3	-157.6	138	0	0	112.3	F693 R698 K699 F733	F693-E695 PolarHBondContact O-N 3.24Å; E695-R698 PolarHBondContact O-N 3.04Å; E695-K699 WeakPolarHBondContact O-CG 3.41Å; E695-K699 PolarHBondContact O-N 3.18Å; E695-K699 WeakPolarHBondContact OE1-CE 3.28Å; E695-K699 IonicContact OE1-NZ 3.03Å; E695-K699 PolarHBondContact OE1-NZ 3.38Å; E695-F733 HydrophobicContact CG-CE2 3.91Å
696	R	91	Very high	90.3	Very high	63 Å²	63	36.5 Å²	36.5	24%	0.238	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-46.4	175.7	-178.5	-173.4	76.5	-161.8	3.5	110.8	M632 F633 F693 V694 K699 L700	M632-R696 PolarHBondContact O-NH2 3.1Å; F633-R696 PolarHBondContact O-NH1 3.05Å; F693-R696 VanDerWaalsContact O-CB 3.29Å; F693-R696 WeakPolarHBondContact O-CB 3.49Å; F693-R696 PolarHBondContact O-N 2.86Å; V694-R696 PolarHBondContact O-N 3.05Å; R696-K699 PolarHBondContact O-N 3.39Å; R696-L700 WeakPolarHBondContact O-CG 3.36Å; R696-L700 PolarHBondContact O-N 2.9Å; R696-L700 VanDerWaalsContact O-N 3.13Å
697	E	91.9	Very high	90.2	Very high	9 Å²	9	42.9 Å²	42.9	4%	0.042	20%	0.2	C	C	.	.	H	α-helix	trans	-69.9	-33.7	178.6	-52.5	-48.9	146.2	0	0	111.8	W667 F675 F676 F693 V694 K699 L700 A701	W667-E697 PolarHBondContact NE1-OE1 3.03Å; W667-E697 PolarHBondContact NE1-OE2 3.24Å; F675-E697 HydrophobicContact CD1-CB 4.5Å; F675-E697 HydrophobicContact CE1-CB 3.92Å; F675-E697 HydrophobicContact CE1-CG 4.11Å; F675-E697 HydrophobicContact CZ-CB 4.26Å; F675-E697 HydrophobicContact CZ-CG 3.9Å; F676-E697 HydrophobicContact CZ-CB 4.42Å; F693-E697 HydrophobicContact CD2-CG 3.82Å; F693-E697 HydrophobicContact CE2-CG 4.44Å; F693-E697 PolarHBondContact O-N 2.74Å; F693-E697 VanDerWaalsContact O-N 3.1Å; V694-E697 PolarHBondContact O-N 3.12Å; E697-K699 VanDerWaalsContact C-N 3.35Å; E697-K699 PolarHBondContact O-N 2.87Å; E697-L700 PolarHBondContact O-N 3.3Å; E697-A701 VanDerWaalsContact O-CB 3.24Å; E697-A701 WeakPolarHBondContact O-CB 3.39Å; E697-A701 PolarHBondContact O-N 3.1Å
698	R	92	Very high	90.2	Very high	29 Å²	29	46.2 Å²	46.2	11%	0.109	22%	0.219	C	C	.	.	H	α-helix	trans	-60.8	-40.7	171.8	-75.8	177.4	174	139.6	1.6	112.1	F676 V694 E695 L702 L722 G723 F733	F676-R698 HydrophobicContact CE1-CG 3.54Å; F676-R698 HydrophobicContact CE2-CG 4.4Å; F676-R698 HydrophobicContact CZ-CB 4.22Å; F676-R698 HydrophobicContact CZ-CG 3.4Å; F676-R698 VanDerWaalsContact CZ-CG 3.4Å; V694-R698 VanDerWaalsContact O-CG 3.3Å; V694-R698 WeakPolarHBondContact O-CG 3.35Å; V694-R698 PolarHBondContact O-N 3.48Å; E695-R698 PolarHBondContact O-N 3.04Å; R698-L702 WeakPolarHBondContact O-CB 3.39Å; R698-L702 PolarHBondContact O-N 3.19Å; R698-L722 HydrophobicContact CB-CD1 4.48Å; R698-L722 HydrophobicContact CG-CB 4.3Å; R698-L722 PolarHBondContact NE-O 3.28Å; R698-L722 VanDerWaalsContact NE-O 3.07Å; R698-G723 PolarHBondContact NH2-O 3.03Å; R698-F733 HydrophobicContact CB-CE1 4.07Å; R698-F733 HydrophobicContact CB-CE2 4.23Å; R698-F733 HydrophobicContact CB-CZ 3.54Å
699	K	90.3	Very high	89.9	Confident	56 Å²	56	45.5 Å²	45.5	24%	0.243	22%	0.218	C	C	.	.	H	α-helix	trans	-65.9	-43.2	175.5	-67.7	178	-162.7	-174.3	0	112	E695 R696 E697 L702 R703 F733 L737	E695-K699 WeakPolarHBondContact O-CG 3.41Å; E695-K699 PolarHBondContact O-N 3.18Å; E695-K699 WeakPolarHBondContact OE1-CE 3.28Å; E695-K699 IonicContact OE1-NZ 3.03Å; E695-K699 PolarHBondContact OE1-NZ 3.38Å; R696-K699 PolarHBondContact O-N 3.39Å; E697-K699 VanDerWaalsContact C-N 3.35Å; E697-K699 PolarHBondContact O-N 2.87Å; K699-L702 PolarHBondContact O-N 3.48Å; K699-R703 WeakPolarHBondContact O-CB 3.01Å; K699-R703 WeakPolarHBondContact O-CG 3.41Å; K699-R703 PolarHBondContact O-N 3.18Å; K699-F733 HydrophobicContact CG-CE2 4.26Å; K699-F733 HydrophobicContact CG-CZ 3.89Å; K699-L737 HydrophobicContact CD-CD2 3.91Å; K699-L737 HydrophobicContact CG-CD1 4.14Å; K699-L737 HydrophobicContact CG-CD2 4.06Å
700	L	90.4	Very high	89.5	Confident	67 Å²	67	52 Å²	52	35%	0.351	24%	0.242	S	C	.	.	H	α-helix	trans	-64.3	-42.8	176.2	-68.1	174	0	0	0	112.2	Y672 R696 E697 R703 A704	Y672-L700 HydrophobicContact CE1-CB 4.37Å; R696-L700 WeakPolarHBondContact O-CG 3.36Å; R696-L700 PolarHBondContact O-N 2.9Å; R696-L700 VanDerWaalsContact O-N 3.13Å; E697-L700 PolarHBondContact O-N 3.3Å; L700-R703 PolarHBondContact O-N 3.35Å; L700-A704 PolarHBondContact O-N 3.09Å; L700-A704 VanDerWaalsContact O-N 3.1Å
701	A	91.7	Very high	89	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-50.6	174.7	0	0	0	0	0	112	Y672 F676 E697 R703 A704 I705 L722	Y672-A701 HydrophobicContact CD1-CB 3.48Å; Y672-A701 VanDerWaalsContact CD1-CB 3.48Å; Y672-A701 HydrophobicContact CD2-CB 3.79Å; Y672-A701 HydrophobicContact CE1-CB 3.94Å; Y672-A701 HydrophobicContact CE2-CB 4.23Å; Y672-A701 HydrophobicContact CG-CB 3.39Å; F676-A701 HydrophobicContact CE2-CB 4.09Å; E697-A701 VanDerWaalsContact O-CB 3.24Å; E697-A701 WeakPolarHBondContact O-CB 3.39Å; E697-A701 PolarHBondContact O-N 3.1Å; A701-R703 VanDerWaalsContact C-N 3.32Å; A701-R703 PolarHBondContact O-N 2.88Å; A701-A704 WeakPolarHBondContact O-CB 3.46Å; A701-A704 PolarHBondContact O-N 2.56Å; A701-I705 VanDerWaalsContact O-CG1 3.29Å; A701-I705 WeakPolarHBondContact O-CG1 3.21Å; A701-I705 PolarHBondContact O-N 3.35Å; A701-L722 HydrophobicContact CB-CD2 3.36Å
702	L	90.1	Very high	88.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.6	-41.5	178.2	-172.1	65	0	0	0	111.7	R698 K699 A704 I705 V706 V718 L722 F733 L734 L737 V739 L758	R698-L702 WeakPolarHBondContact O-CB 3.39Å; R698-L702 PolarHBondContact O-N 3.19Å; K699-L702 PolarHBondContact O-N 3.48Å; L702-A704 PolarHBondContact O-N 2.83Å; L702-I705 PolarHBondContact O-N 3.39Å; L702-V706 HydrophobicContact CD1-CG2 4.05Å; L702-V706 HydrophobicContact CG-CG2 4.28Å; L702-V706 WeakPolarHBondContact O-CB 3.49Å; L702-V706 WeakPolarHBondContact O-CG2 3.43Å; L702-V706 PolarHBondContact O-N 2.82Å; L702-V718 HydrophobicContact CD1-CG1 3.88Å; L702-V718 HydrophobicContact CD1-CG2 4.38Å; L702-L722 HydrophobicContact CB-CD1 4.3Å; L702-L722 HydrophobicContact CD1-CD1 4.48Å; L702-F733 HydrophobicContact CD2-CE1 4.27Å; L702-L734 HydrophobicContact CD1-CD2 3.99Å; L702-L734 HydrophobicContact CD2-CD2 3.59Å; L702-L734 HydrophobicContact CG-CD2 4.47Å; L702-L737 HydrophobicContact CD2-CD1 3.86Å; L702-V739 HydrophobicContact CD2-CG2 4.21Å; L702-L758 HydrophobicContact CD2-CD1 3.91Å; L702-L758 HydrophobicContact CD2-CD2 3.69Å; L702-L758 HydrophobicContact CD2-CG 4.47Å; L702-L758 HydrophobicContact CG-CD1 3.8Å; L702-L758 HydrophobicContact CG-CD2 4.36Å
703	R	89.2	Confident	88.5	Confident	80 Å²	80	52 Å²	52	30%	0.302	25%	0.252	S	S	.	.	H	α-helix	trans	-62.4	-24.1	174.1	-76.1	171.2	72.1	137.8	6.3	113.7	K699 L700 A701 K707 L758 S761	K699-R703 WeakPolarHBondContact O-CB 3.01Å; K699-R703 WeakPolarHBondContact O-CG 3.41Å; K699-R703 PolarHBondContact O-N 3.18Å; L700-R703 PolarHBondContact O-N 3.35Å; A701-R703 VanDerWaalsContact C-N 3.32Å; A701-R703 PolarHBondContact O-N 2.88Å; R703-K707 VanDerWaalsContact O-CD 3.32Å; R703-K707 WeakPolarHBondContact O-CD 3.35Å; R703-K707 VanDerWaalsContact O-CG 3.31Å; R703-K707 WeakPolarHBondContact O-CG 3.32Å; R703-L758 WeakPolarHBondContact CD-O 3.16Å; R703-L758 HydrophobicContact CG-CB 3.92Å; R703-L758 VanDerWaalsContact CG-O 3.24Å; R703-L758 WeakPolarHBondContact CG-O 3.19Å; R703-L758 PolarHBondContact NE-O 2.91Å; R703-L758 VanDerWaalsContact NE-O 3.1Å; R703-L758 PolarHBondContact NH1-O 3.27Å; R703-L758 VanDerWaalsContact NH1-O 3.12Å; R703-S761 PolarHBondContact NH1-OXT 2.75Å
704	A	89.8	Confident	88.4	Confident	36 Å²	36	54.8 Å²	54.8	30%	0.298	27%	0.27	S	S	.	.	H	α-helix	trans	-82.2	-51.3	172.2	0	0	0	0	0	111.2	Y672 L700 A701 L702 V706 K707 T708	Y672-A704 HydrophobicContact CE2-CB 3.86Å; L700-A704 PolarHBondContact O-N 3.09Å; L700-A704 VanDerWaalsContact O-N 3.1Å; A701-A704 WeakPolarHBondContact O-CB 3.46Å; A701-A704 PolarHBondContact O-N 2.56Å; L702-A704 PolarHBondContact O-N 2.83Å; A704-V706 PolarHBondContact O-N 3.07Å; A704-K707 WeakPolarHBondContact O-CB 3.36Å; A704-K707 PolarHBondContact O-N 3.33Å; A704-T708 PolarHBondContact O-N 3.39Å
705	I	89.4	Confident	88.2	Confident	12 Å²	12	54.5 Å²	54.5	6%	0.062	27%	0.268	C	S	.	.	H	α-helix	trans	-58.3	-46.4	-178.3	-61.9	163.9	0	0	0	110.8	A701 L702 K707 T708 F709 L713 Y717 T721 L722	A701-I705 VanDerWaalsContact O-CG1 3.29Å; A701-I705 WeakPolarHBondContact O-CG1 3.21Å; A701-I705 PolarHBondContact O-N 3.35Å; L702-I705 PolarHBondContact O-N 3.39Å; I705-K707 PolarHBondContact O-N 3.34Å; I705-T708 PolarHBondContact O-N 2.73Å; I705-T708 VanDerWaalsContact O-N 3.07Å; I705-T708 PolarHBondContact O-OG1 2.76Å; I705-F709 HydrophobicContact CB-CD2 4.35Å; I705-F709 HydrophobicContact CG2-CD2 3.52Å; I705-F709 HydrophobicContact CG2-CE2 4.01Å; I705-F709 HydrophobicContact CG2-CG 4.36Å; I705-F709 WeakPolarHBondContact O-CD2 3.43Å; I705-F709 PolarHBondContact O-N 2.9Å; I705-L713 HydrophobicContact CG2-CD1 3.72Å; I705-L713 HydrophobicContact CG2-CD2 3.57Å; I705-L713 HydrophobicContact CG2-CG 4.31Å; I705-Y717 HydrophobicContact CG2-CE1 4.22Å; I705-T721 HydrophobicContact CD1-CG2 3.84Å; I705-L722 HydrophobicContact CD1-CD2 4.23Å
706	V	88.8	Confident	88.1	Confident	2 Å²	2	55 Å²	55	1%	0.012	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-19.1	179.1	165.9	0	0	0	0	113.4	L702 A704 L713 C751 L758	L702-V706 HydrophobicContact CD1-CG2 4.05Å; L702-V706 HydrophobicContact CG-CG2 4.28Å; L702-V706 WeakPolarHBondContact O-CB 3.49Å; L702-V706 WeakPolarHBondContact O-CG2 3.43Å; L702-V706 PolarHBondContact O-N 2.82Å; A704-V706 PolarHBondContact O-N 3.07Å; V706-L713 HydrophobicContact CG2-CD2 3.9Å; V706-C751 HydrophobicContact CG1-CB 4.01Å; V706-C751 VanDerWaalsContact CG1-O 3.27Å; V706-C751 WeakPolarHBondContact CG1-O 3.21Å; V706-C751 WeakPolarHBondContact O-CB 3.26Å; V706-L758 HydrophobicContact CB-CD1 4.09Å; V706-L758 HydrophobicContact CG1-CD1 4.11Å; V706-L758 HydrophobicContact CG2-CD1 3.79Å
707	K	86.6	Confident	88	Confident	137 Å²	137	56.7 Å²	56.7	60%	0.596	28%	0.278	S	S	*	.	H	α-helix	trans	-82	-31.2	172.6	-72.5	175.8	-179.5	-177.4	0	112.8	R703 A704 I705	R703-K707 VanDerWaalsContact O-CD 3.32Å; R703-K707 WeakPolarHBondContact O-CD 3.35Å; R703-K707 VanDerWaalsContact O-CG 3.31Å; R703-K707 WeakPolarHBondContact O-CG 3.32Å; A704-K707 WeakPolarHBondContact O-CB 3.36Å; A704-K707 PolarHBondContact O-N 3.33Å; I705-K707 PolarHBondContact O-N 3.34Å
708	T	87.9	Confident	87.8	Confident	106 Å²	106	56.2 Å²	56.2	65%	0.65	28%	0.276	S	S	*	.	H	α-helix	trans	-93.5	-39.1	-175.1	56.4	0	0	0	0	113.3	A704 I705 R710	A704-T708 PolarHBondContact O-N 3.39Å; I705-T708 PolarHBondContact O-N 2.73Å; I705-T708 VanDerWaalsContact O-N 3.07Å; I705-T708 PolarHBondContact O-OG1 2.76Å; T708-R710 VanDerWaalsContact C-N 3.35Å; T708-R710 PolarHBondContact O-N 2.75Å
709	F	84.6	Confident	87.7	Confident	88 Å²	88	57.2 Å²	57.2	39%	0.386	28%	0.281	S	S	.	.	S	Bend	trans	-92.1	54.7	-175.1	-69.1	-88.9	0	0	0	112.6	I705 L713 Y717 C751	I705-F709 HydrophobicContact CB-CD2 4.35Å; I705-F709 HydrophobicContact CG2-CD2 3.52Å; I705-F709 HydrophobicContact CG2-CE2 4.01Å; I705-F709 HydrophobicContact CG2-CG 4.36Å; I705-F709 WeakPolarHBondContact O-CD2 3.43Å; I705-F709 PolarHBondContact O-N 2.9Å; F709-L713 HydrophobicContact CB-CB 4.49Å; F709-L713 HydrophobicContact CB-CD1 3.95Å; F709-L713 HydrophobicContact CG-CD1 4.16Å; F709-Y717 HydrophobicContact CE2-CE1 4.1Å; F709-Y717 HydrophobicContact CZ-CE1 4.07Å; F709-Y717 AromaticContact CZ-CZ 3.84Å; F709-Y717 WeakPolarHBondContact CZ-OH 3.32Å; F709-C751 PolarHBondContact O-SG 2.85Å
710	R	81.3	Confident	87.6	Confident	139 Å²	139	62 Å²	62	53%	0.525	30%	0.302	S	S	.	.			trans	-87	142.6	174.5	-72.5	175.8	171	-174.3	-4.5	110.5	T708 C751 T755	T708-R710 VanDerWaalsContact C-N 3.35Å; T708-R710 PolarHBondContact O-N 2.75Å; R710-C751 HydrophobicContact CG-CB 3.81Å; R710-T755 PolarHBondContact NH2-OG1 2.67Å
711	P	80.8	Confident	87.5	Confident	93 Å²	93	59.4 Å²	59.4	60%	0.604	29%	0.289	S	S	*	.	S	Bend	cis	-89.8	-33.5	9.1	33.3	-32.2	0	0	0	115	C751	P711-C751 VanDerWaalsContact O-CB 3.32Å; P711-C751 WeakPolarHBondContact O-CB 2.94Å; P711-C751 PolarHBondContact O-N 3Å
712	D	83.1	Confident	87.3	Confident	66 Å²	66	59.4 Å²	59.4	35%	0.353	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	145.8	-173.7	64.4	-62.6	0	0	0	113.5	K748 I749	D712-K748 HydrophobicContact CB-CD 4.35Å; D712-K748 WeakPolarHBondContact OD2-CD 3.48Å; D712-K748 WeakPolarHBondContact OD2-CE 3.2Å; D712-K748 IonicContact OD2-NZ 3.02Å; D712-K748 PolarHBondContact OD2-NZ 3.1Å; D712-I749 WeakPolarHBondContact CA-O 3.19Å
713	L	86.5	Confident	87.1	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	116.1	-174.7	170.7	67.9	0	0	0	110.7	I705 V706 F709 Y717 V718 I749 C751	I705-L713 HydrophobicContact CG2-CD1 3.72Å; I705-L713 HydrophobicContact CG2-CD2 3.57Å; I705-L713 HydrophobicContact CG2-CG 4.31Å; V706-L713 HydrophobicContact CG2-CD2 3.9Å; F709-L713 HydrophobicContact CB-CB 4.49Å; F709-L713 HydrophobicContact CB-CD1 3.95Å; F709-L713 HydrophobicContact CG-CD1 4.16Å; L713-Y717 HydrophobicContact CD1-CD1 3.79Å; L713-Y717 HydrophobicContact CD1-CE1 4.43Å; L713-V718 HydrophobicContact CD1-CG2 4.14Å; L713-V718 HydrophobicContact CD2-CG2 3.61Å; L713-V718 HydrophobicContact CG-CG2 3.74Å; L713-I749 HydrophobicContact CB-CB 4.24Å; L713-I749 HydrophobicContact CD2-CD1 4.16Å; L713-I749 HydrophobicContact CG-CD1 4.41Å; L713-I749 PolarHBondContact N-O 3Å; L713-I749 PolarHBondContact O-N 3.43Å; L713-C751 WeakPolarHBondContact CB-SG 3.36Å
714	P	89.1	Confident	87.1	Confident	59 Å²	59	56.8 Å²	56.8	38%	0.383	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	134.2	178	-24.4	34.8	0	0	0	113	E716 Y717 V718	P714-E716 PolarHBondContact O-N 2.71Å; P714-Y717 WeakPolarHBondContact O-CB 3.49Å; P714-Y717 PolarHBondContact O-N 2.74Å; P714-Y717 VanDerWaalsContact O-N 3.12Å; P714-V718 PolarHBondContact O-N 3.29Å
715	V	86.8	Confident	86.8	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-59	-36.6	176.8	169.8	0	0	0	0	111.6	Y717 V718 Q719 L727 M731 L734 F741 K747 I749	V715-Y717 VanDerWaalsContact C-N 3.3Å; V715-Y717 PolarHBondContact O-N 2.86Å; V715-V718 CarbonylContact O-C 3.52Å; V715-V718 WeakPolarHBondContact O-CB 3.46Å; V715-V718 PolarHBondContact O-N 2.88Å; V715-V718 VanDerWaalsContact O-N 3.08Å; V715-Q719 WeakPolarHBondContact O-CB 3.34Å; V715-Q719 PolarHBondContact O-N 3.01Å; V715-L727 HydrophobicContact CG1-CD1 4.08Å; V715-L727 HydrophobicContact CG1-CD2 4.39Å; V715-L727 HydrophobicContact CG1-CG 4Å; V715-M731 HydrophobicContact CB-SD 4.37Å; V715-M731 HydrophobicContact CG1-CG 4.18Å; V715-M731 HydrophobicContact CG1-SD 3.72Å; V715-M731 HydrophobicContact CG2-SD 3.8Å; V715-L734 HydrophobicContact CG1-CD1 4.23Å; V715-L734 HydrophobicContact CG2-CD1 4.15Å; V715-F741 HydrophobicContact CG2-CD1 4.37Å; V715-F741 HydrophobicContact CG2-CE1 3.84Å; V715-K747 WeakPolarHBondContact CG2-O 3.38Å; V715-K747 PolarHBondContact N-O 3.41Å; V715-I749 HydrophobicContact CG2-CD1 4.29Å; V715-I749 HydrophobicContact CG2-CG1 4.09Å
716	E	88.6	Confident	86.7	Confident	110 Å²	110	62.3 Å²	62.3	51%	0.514	32%	0.317	S	S	.	.	H	α-helix	trans	-59.9	-38.1	176.9	-65.3	172.2	-163.2	0	0	112.3	P714 V718 Q719 K720 L727	P714-E716 PolarHBondContact O-N 2.71Å; E716-V718 VanDerWaalsContact C-N 3.35Å; E716-Q719 PolarHBondContact O-N 2.88Å; E716-K720 WeakPolarHBondContact O-CB 3.49Å; E716-K720 PolarHBondContact O-N 2.89Å; E716-L727 HydrophobicContact CG-CD1 3.89Å
717	Y	88.5	Confident	86.6	Confident	99 Å²	99	65.4 Å²	65.4	39%	0.388	33%	0.333	S	S	.	.	H	α-helix	trans	-66.3	-38.9	174.6	-179.1	-89.1	0	0	0	111.4	I705 F709 L713 P714 V715 T721	I705-Y717 HydrophobicContact CG2-CE1 4.22Å; F709-Y717 HydrophobicContact CE2-CE1 4.1Å; F709-Y717 HydrophobicContact CZ-CE1 4.07Å; F709-Y717 AromaticContact CZ-CZ 3.84Å; F709-Y717 WeakPolarHBondContact CZ-OH 3.32Å; L713-Y717 HydrophobicContact CD1-CD1 3.79Å; L713-Y717 HydrophobicContact CD1-CE1 4.43Å; P714-Y717 WeakPolarHBondContact O-CB 3.49Å; P714-Y717 PolarHBondContact O-N 2.74Å; P714-Y717 VanDerWaalsContact O-N 3.12Å; V715-Y717 VanDerWaalsContact C-N 3.3Å; V715-Y717 PolarHBondContact O-N 2.86Å; Y717-T721 WeakPolarHBondContact CE1-OG1 3.21Å; Y717-T721 WeakPolarHBondContact O-CB 3.38Å; Y717-T721 PolarHBondContact O-N 2.9Å; Y717-T721 PolarHBondContact O-OG1 3.2Å
718	V	87.9	Confident	86.7	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-68.6	-44.8	176.7	-179.2	0	0	0	0	111.2	L702 L713 P714 V715 E716 K720 T721 L722 L734 I749	L702-V718 HydrophobicContact CD1-CG1 3.88Å; L702-V718 HydrophobicContact CD1-CG2 4.38Å; L713-V718 HydrophobicContact CD1-CG2 4.14Å; L713-V718 HydrophobicContact CD2-CG2 3.61Å; L713-V718 HydrophobicContact CG-CG2 3.74Å; P714-V718 PolarHBondContact O-N 3.29Å; V715-V718 CarbonylContact O-C 3.52Å; V715-V718 WeakPolarHBondContact O-CB 3.46Å; V715-V718 PolarHBondContact O-N 2.88Å; V715-V718 VanDerWaalsContact O-N 3.08Å; E716-V718 VanDerWaalsContact C-N 3.35Å; V718-K720 VanDerWaalsContact C-N 3.34Å; V718-K720 PolarHBondContact O-N 3.31Å; V718-T721 PolarHBondContact O-N 3.27Å; V718-L722 HydrophobicContact CG1-CD1 3.52Å; V718-L722 HydrophobicContact CG1-CG 3.95Å; V718-L722 WeakPolarHBondContact O-CB 3.29Å; V718-L722 WeakPolarHBondContact O-CG 3.2Å; V718-L722 PolarHBondContact O-N 2.96Å; V718-L734 HydrophobicContact CG1-CD2 4.39Å; V718-I749 HydrophobicContact CG2-CD1 3.87Å
719	Q	89.9	Confident	86.7	Confident	50 Å²	50	61.9 Å²	61.9	23%	0.234	32%	0.321	C	S	.	.	H	α-helix	trans	-55.9	-48.1	175.8	174.5	-82.7	-34.1	0	0	111.2	V715 E716 G723 F724 C730	V715-Q719 WeakPolarHBondContact O-CB 3.34Å; V715-Q719 PolarHBondContact O-N 3.01Å; E716-Q719 PolarHBondContact O-N 2.88Å; Q719-G723 PolarHBondContact O-N 2.88Å; Q719-F724 HydrophobicContact CG-CB 4.11Å; Q719-F724 PolarHBondContact NE2-O 3.4Å; Q719-F724 PolarHBondContact O-N 3.34Å; Q719-C730 HydrophobicContact CB-CB 4Å; Q719-C730 HydrophobicContact CG-CB 4.35Å
720	K	88.6	Confident	86.8	Confident	156 Å²	156	57.7 Å²	57.7	68%	0.678	30%	0.303	S	S	*	.	H	α-helix	trans	-65.5	-43.4	176.6	-174	173.7	-178.7	175.2	0	112.7	E716 V718	E716-K720 WeakPolarHBondContact O-CB 3.49Å; E716-K720 PolarHBondContact O-N 2.89Å; V718-K720 VanDerWaalsContact C-N 3.34Å; V718-K720 PolarHBondContact O-N 3.31Å
721	T	88.2	Confident	87	Confident	12 Å²	12	53.4 Å²	53.4	7%	0.074	29%	0.289	C	S	.	.	H	α-helix	trans	-76.2	-33	-174.5	-57	0	0	0	0	113.2	F676 I705 Y717 V718	F676-T721 WeakPolarHBondContact CD2-O 3.22Å; I705-T721 HydrophobicContact CD1-CG2 3.84Å; Y717-T721 WeakPolarHBondContact CE1-OG1 3.21Å; Y717-T721 WeakPolarHBondContact O-CB 3.38Å; Y717-T721 PolarHBondContact O-N 2.9Å; Y717-T721 PolarHBondContact O-OG1 3.2Å; V718-T721 PolarHBondContact O-N 3.27Å
722	L	88	Confident	87.4	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	6.5	179.8	-58.9	-170.7	0	0	0	114	F676 R698 A701 L702 I705 V718 F724 F733	F676-L722 WeakPolarHBondContact CD1-O 3.45Å; F676-L722 HydrophobicContact CD2-CD2 4.29Å; F676-L722 HydrophobicContact CE2-CD2 3.72Å; F676-L722 HydrophobicContact CZ-CD2 4.38Å; R698-L722 HydrophobicContact CB-CD1 4.48Å; R698-L722 HydrophobicContact CG-CB 4.3Å; R698-L722 PolarHBondContact NE-O 3.28Å; R698-L722 VanDerWaalsContact NE-O 3.07Å; A701-L722 HydrophobicContact CB-CD2 3.36Å; L702-L722 HydrophobicContact CB-CD1 4.3Å; L702-L722 HydrophobicContact CD1-CD1 4.48Å; I705-L722 HydrophobicContact CD1-CD2 4.23Å; V718-L722 HydrophobicContact CG1-CD1 3.52Å; V718-L722 HydrophobicContact CG1-CG 3.95Å; V718-L722 WeakPolarHBondContact O-CB 3.29Å; V718-L722 WeakPolarHBondContact O-CG 3.2Å; V718-L722 PolarHBondContact O-N 2.96Å; L722-F724 HydrophobicContact CB-CD2 3.76Å; L722-F724 HydrophobicContact CB-CE2 3.69Å; L722-F724 HydrophobicContact CD1-CE2 4.03Å; L722-F724 PolarHBondContact O-N 3.32Å; L722-F733 HydrophobicContact CD1-CE1 4.27Å
723	G	86.4	Confident	87.7	Confident	11 Å²	11	50.4 Å²	50.4	11%	0.113	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	43	175.9	0	0	0	0	0	113.7	R698 Q719	R698-G723 PolarHBondContact NH2-O 3.03Å; Q719-G723 PolarHBondContact O-N 2.88Å
724	F	87.6	Confident	87.8	Confident	14 Å²	14	50.3 Å²	50.3	6%	0.061	28%	0.276	C	S	.	.			trans	-82.8	139	173.6	-78.9	-76.8	0	0	0	111.1	Q719 L722 C730 F733	Q719-F724 HydrophobicContact CG-CB 4.11Å; Q719-F724 PolarHBondContact NE2-O 3.4Å; Q719-F724 PolarHBondContact O-N 3.34Å; L722-F724 HydrophobicContact CB-CD2 3.76Å; L722-F724 HydrophobicContact CB-CE2 3.69Å; L722-F724 HydrophobicContact CD1-CE2 4.03Å; L722-F724 PolarHBondContact O-N 3.32Å; F724-C730 HydrophobicContact CB-CB 4.07Å; F724-C730 HydrophobicContact CD2-CB 3.81Å; F724-C730 HydrophobicContact CE2-CB 4.37Å; F724-C730 HydrophobicContact CG-CB 3.89Å; F724-F733 HydrophobicContact CE1-CB 4Å; F724-F733 HydrophobicContact CE1-CG 4.26Å; F724-F733 AromaticContact CE2-CD1 3.89Å; F724-F733 HydrophobicContact CE2-CD1 3.89Å; F724-F733 HydrophobicContact CE2-CE1 4.36Å; F724-F733 HydrophobicContact CE2-CG 4.31Å; F724-F733 HydrophobicContact CZ-CB 3.62Å; F724-F733 AromaticContact CZ-CD1 3.52Å; F724-F733 HydrophobicContact CZ-CD1 3.52Å; F724-F733 HydrophobicContact CZ-CD2 4.11Å; F724-F733 HydrophobicContact CZ-CE1 4.13Å; F724-F733 AromaticContact CZ-CG 3.49Å; F724-F733 HydrophobicContact CZ-CG 3.49Å; F724-F733 VanDerWaalsContact CZ-CG 3.49Å
725	P	85	Confident	87.7	Confident	114 Å²	114	51.8 Å²	51.8	74%	0.74	28%	0.284	S	S	*	.	S	Bend	trans	-70.8	-36.8	-177.1	28	-34.3	0	0	0	112.9
726	C	86.9	Confident	87.7	Confident	50 Å²	50	55.2 Å²	55.2	34%	0.338	32%	0.319	S	S	.	.	S	Bend	trans	-133.4	164.8	175.2	66	0	0	0	0	111.3	D728 S729 C730	C726-D728 VanDerWaalsContact C-N 3.34Å; C726-S729 PolarHBondContact SG-N 2.86Å; C726-S729 VanDerWaalsContact SG-N 3.37Å; C726-S729 PolarHBondContact SG-OG 3.08Å; C726-C730 PolarHBondContact O-N 3.4Å
727	L	87.1	Confident	87.5	Confident	67 Å²	67	50.5 Å²	50.5	35%	0.351	30%	0.297	S	S	.	.	H	α-helix	trans	-68.2	-34.2	178.7	-171.2	137.4	0	0	0	111.8	V715 E716 S729 C730 M731	V715-L727 HydrophobicContact CG1-CD1 4.08Å; V715-L727 HydrophobicContact CG1-CD2 4.39Å; V715-L727 HydrophobicContact CG1-CG 4Å; E716-L727 HydrophobicContact CG-CD1 3.89Å; L727-S729 PolarHBondContact O-N 3.33Å; L727-C730 CarbonylContact O-C 3.59Å; L727-C730 WeakPolarHBondContact O-CA 3.45Å; L727-C730 VanDerWaalsContact O-CB 3.31Å; L727-C730 WeakPolarHBondContact O-CB 3.27Å; L727-C730 PolarHBondContact O-N 2.89Å; L727-C730 VanDerWaalsContact O-N 3.07Å; L727-M731 HydrophobicContact CD2-CG 3.71Å; L727-M731 HydrophobicContact CG-CG 4.48Å; L727-M731 WeakPolarHBondContact O-CG 3.42Å; L727-M731 PolarHBondContact O-N 2.94Å
728	D	87.1	Confident	87.3	Confident	117 Å²	117	47.8 Å²	47.8	63%	0.626	30%	0.299	S	S	*	.	H	α-helix	trans	-65.3	-39.7	-179.7	-42.9	-76.2	0	0	0	112	C726 C730 M731 A732	C726-D728 VanDerWaalsContact C-N 3.34Å; D728-C730 VanDerWaalsContact C-N 3.28Å; D728-C730 PolarHBondContact O-N 2.92Å; D728-M731 PolarHBondContact O-N 2.94Å; D728-A732 WeakPolarHBondContact O-CB 3.43Å; D728-A732 PolarHBondContact O-N 3.25Å
729	S	88.3	Confident	87.2	Confident	52 Å²	52	48.2 Å²	48.2	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-62.4	-36.3	172.2	-70.5	0	0	0	0	112	C726 L727 F733	C726-S729 PolarHBondContact SG-N 2.86Å; C726-S729 VanDerWaalsContact SG-N 3.37Å; C726-S729 PolarHBondContact SG-OG 3.08Å; L727-S729 PolarHBondContact O-N 3.33Å; S729-F733 WeakPolarHBondContact O-CB 3.46Å; S729-F733 PolarHBondContact O-N 2.87Å
730	C	87.3	Confident	86.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-69.5	-43.5	174.1	-167.9	0	0	0	0	111	Q719 F724 C726 L727 D728 F733 L734	Q719-C730 HydrophobicContact CB-CB 4Å; Q719-C730 HydrophobicContact CG-CB 4.35Å; F724-C730 HydrophobicContact CB-CB 4.07Å; F724-C730 HydrophobicContact CD2-CB 3.81Å; F724-C730 HydrophobicContact CE2-CB 4.37Å; F724-C730 HydrophobicContact CG-CB 3.89Å; C726-C730 PolarHBondContact O-N 3.4Å; L727-C730 CarbonylContact O-C 3.59Å; L727-C730 WeakPolarHBondContact O-CA 3.45Å; L727-C730 VanDerWaalsContact O-CB 3.31Å; L727-C730 WeakPolarHBondContact O-CB 3.27Å; L727-C730 PolarHBondContact O-N 2.89Å; L727-C730 VanDerWaalsContact O-N 3.07Å; D728-C730 VanDerWaalsContact C-N 3.28Å; D728-C730 PolarHBondContact O-N 2.92Å; C730-F733 PolarHBondContact O-N 3.31Å; C730-L734 WeakPolarHBondContact O-CB 3.03Å; C730-L734 WeakPolarHBondContact O-CG 3.13Å; C730-L734 PolarHBondContact O-N 2.92Å
731	M	85.6	Confident	86.7	Confident	49 Å²	49	43 Å²	43	24%	0.241	28%	0.283	C	S	.	.	H	α-helix	trans	-64.6	-40.9	178.3	-74.5	-62.2	-79.8	0	0	112.5	V715 L727 D728 L734 T735 F741	V715-M731 HydrophobicContact CB-SD 4.37Å; V715-M731 HydrophobicContact CG1-CG 4.18Å; V715-M731 HydrophobicContact CG1-SD 3.72Å; V715-M731 HydrophobicContact CG2-SD 3.8Å; L727-M731 HydrophobicContact CD2-CG 3.71Å; L727-M731 HydrophobicContact CG-CG 4.48Å; L727-M731 WeakPolarHBondContact O-CG 3.42Å; L727-M731 PolarHBondContact O-N 2.94Å; D728-M731 PolarHBondContact O-N 2.94Å; M731-L734 PolarHBondContact O-N 3.35Å; M731-L734 HydrophobicContact SD-CD1 4.32Å; M731-T735 VanDerWaalsContact O-CB 3.27Å; M731-T735 WeakPolarHBondContact O-CB 3.39Å; M731-T735 PolarHBondContact O-N 3.48Å; M731-T735 PolarHBondContact O-OG1 3.22Å; M731-F741 HydrophobicContact CE-CD1 4.39Å; M731-F741 HydrophobicContact CE-CE1 3.7Å; M731-F741 HydrophobicContact CE-CE2 4.32Å; M731-F741 HydrophobicContact CE-CZ 3.66Å; M731-F741 HydrophobicContact SD-CE1 3.67Å; M731-F741 HydrophobicContact SD-CZ 3.79Å
732	A	89.2	Confident	86.4	Confident	66 Å²	66	43.1 Å²	43.1	55%	0.545	29%	0.286	S	S	.	.	H	α-helix	trans	-60.5	-44.3	173.2	0	0	0	0	0	112	D728 T735 G736	D728-A732 WeakPolarHBondContact O-CB 3.43Å; D728-A732 PolarHBondContact O-N 3.25Å; A732-T735 PolarHBondContact O-N 3.45Å; A732-G736 PolarHBondContact O-N 3.29Å
733	F	89.2	Confident	85.5	Confident	30 Å²	30	49.7 Å²	49.7	13%	0.132	33%	0.329	C	S	.	.	H	α-helix	trans	-63.7	-44.1	175.5	175.5	-103.1	0	0	0	112.8	E695 R698 K699 L702 L722 F724 S729 C730 G736 L737	E695-F733 HydrophobicContact CG-CE2 3.91Å; R698-F733 HydrophobicContact CB-CE1 4.07Å; R698-F733 HydrophobicContact CB-CE2 4.23Å; R698-F733 HydrophobicContact CB-CZ 3.54Å; K699-F733 HydrophobicContact CG-CE2 4.26Å; K699-F733 HydrophobicContact CG-CZ 3.89Å; L702-F733 HydrophobicContact CD2-CE1 4.27Å; L722-F733 HydrophobicContact CD1-CE1 4.27Å; F724-F733 HydrophobicContact CE1-CB 4Å; F724-F733 HydrophobicContact CE1-CG 4.26Å; F724-F733 AromaticContact CE2-CD1 3.89Å; F724-F733 HydrophobicContact CE2-CD1 3.89Å; F724-F733 HydrophobicContact CE2-CE1 4.36Å; F724-F733 HydrophobicContact CE2-CG 4.31Å; F724-F733 HydrophobicContact CZ-CB 3.62Å; F724-F733 AromaticContact CZ-CD1 3.52Å; F724-F733 HydrophobicContact CZ-CD1 3.52Å; F724-F733 HydrophobicContact CZ-CD2 4.11Å; F724-F733 HydrophobicContact CZ-CE1 4.13Å; F724-F733 AromaticContact CZ-CG 3.49Å; F724-F733 HydrophobicContact CZ-CG 3.49Å; F724-F733 VanDerWaalsContact CZ-CG 3.49Å; S729-F733 WeakPolarHBondContact O-CB 3.46Å; S729-F733 PolarHBondContact O-N 2.87Å; C730-F733 PolarHBondContact O-N 3.31Å; F733-G736 PolarHBondContact O-N 3.46Å; F733-L737 HydrophobicContact CD1-CD1 4.02Å; F733-L737 HydrophobicContact CD2-CD1 4.46Å; F733-L737 HydrophobicContact CE1-CD1 3.55Å; F733-L737 HydrophobicContact CE2-CD1 4.03Å; F733-L737 HydrophobicContact CG-CD1 4.46Å; F733-L737 HydrophobicContact CZ-CD1 3.56Å; F733-L737 WeakPolarHBondContact O-CG 3.28Å; F733-L737 PolarHBondContact O-N 2.92Å
734	L	88.3	Confident	84.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-64.5	-43.4	177.4	-68.4	167.9	0	0	0	111.5	L702 V715 V718 C730 M731 L737 G738 V739 F741 I749	L702-L734 HydrophobicContact CD1-CD2 3.99Å; L702-L734 HydrophobicContact CD2-CD2 3.59Å; L702-L734 HydrophobicContact CG-CD2 4.47Å; V715-L734 HydrophobicContact CG1-CD1 4.23Å; V715-L734 HydrophobicContact CG2-CD1 4.15Å; V718-L734 HydrophobicContact CG1-CD2 4.39Å; C730-L734 WeakPolarHBondContact O-CB 3.03Å; C730-L734 WeakPolarHBondContact O-CG 3.13Å; C730-L734 PolarHBondContact O-N 2.92Å; M731-L734 PolarHBondContact O-N 3.35Å; M731-L734 HydrophobicContact SD-CD1 4.32Å; L734-L737 PolarHBondContact O-N 3.43Å; L734-L737 VanDerWaalsContact O-N 3.16Å; L734-G738 PolarHBondContact O-N 3.02Å; L734-V739 HydrophobicContact CB-CB 4.13Å; L734-V739 HydrophobicContact CB-CG1 4.45Å; L734-V739 HydrophobicContact CB-CG2 4.25Å; L734-V739 HydrophobicContact CD2-CB 4.39Å; L734-V739 HydrophobicContact CD2-CG1 4.23Å; L734-V739 HydrophobicContact CD2-CG2 3.93Å; L734-V739 VanDerWaalsContact O-CB 3.27Å; L734-V739 WeakPolarHBondContact O-CB 3.18Å; L734-V739 VanDerWaalsContact O-CG2 3.3Å; L734-V739 WeakPolarHBondContact O-CG2 3.19Å; L734-V739 PolarHBondContact O-N 2.66Å; L734-V739 VanDerWaalsContact O-N 3.1Å; L734-F741 HydrophobicContact CB-CZ 4.02Å; L734-F741 HydrophobicContact CD1-CE1 4.39Å; L734-F741 HydrophobicContact CD1-CZ 4.44Å; L734-I749 HydrophobicContact CD1-CD1 3.87Å; L734-I749 HydrophobicContact CD1-CG1 4.49Å; L734-I749 HydrophobicContact CD2-CD1 3.93Å
735	T	86.8	Confident	84.3	Confident	90 Å²	90	56.3 Å²	56.3	55%	0.552	37%	0.371	S	S	*	.	H	α-helix	trans	-65	-43	177.7	-55	0	0	0	0	111.1	M731 A732 L737 G738	M731-T735 VanDerWaalsContact O-CB 3.27Å; M731-T735 WeakPolarHBondContact O-CB 3.39Å; M731-T735 PolarHBondContact O-N 3.48Å; M731-T735 PolarHBondContact O-OG1 3.22Å; A732-T735 PolarHBondContact O-N 3.45Å; T735-L737 PolarHBondContact O-N 3.02Å; T735-G738 PolarHBondContact O-N 3.12Å
736	G	86.4	Confident	83.8	Confident	72 Å²	72	55.3 Å²	55.3	74%	0.742	37%	0.365	S	S	*	.	H	α-helix	trans	-63.9	-16.2	174.4	0	0	0	0	0	114.8	A732 F733	A732-G736 PolarHBondContact O-N 3.29Å; F733-G736 PolarHBondContact O-N 3.46Å
737	L	86.1	Confident	83.6	Confident	12 Å²	12	59 Å²	59	6%	0.063	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	3.9	172.8	-72.6	173.6	0	0	0	113.8	K699 L702 F733 L734 T735 V739 L758	K699-L737 HydrophobicContact CD-CD2 3.91Å; K699-L737 HydrophobicContact CG-CD1 4.14Å; K699-L737 HydrophobicContact CG-CD2 4.06Å; L702-L737 HydrophobicContact CD2-CD1 3.86Å; F733-L737 HydrophobicContact CD1-CD1 4.02Å; F733-L737 HydrophobicContact CD2-CD1 4.46Å; F733-L737 HydrophobicContact CE1-CD1 3.55Å; F733-L737 HydrophobicContact CE2-CD1 4.03Å; F733-L737 HydrophobicContact CG-CD1 4.46Å; F733-L737 HydrophobicContact CZ-CD1 3.56Å; F733-L737 WeakPolarHBondContact O-CG 3.28Å; F733-L737 PolarHBondContact O-N 2.92Å; L734-L737 PolarHBondContact O-N 3.43Å; L734-L737 VanDerWaalsContact O-N 3.16Å; T735-L737 PolarHBondContact O-N 3.02Å; L737-V739 HydrophobicContact CB-CG2 4Å; L737-V739 PolarHBondContact O-N 3.47Å; L737-L758 HydrophobicContact CB-CD2 3.95Å; L737-L758 HydrophobicContact CD1-CD2 3.96Å; L737-L758 HydrophobicContact CG-CD2 4.42Å
738	G	83.2	Confident	83.5	Confident	41 Å²	41	59.1 Å²	59.1	42%	0.423	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	64	26.1	-177	0	0	0	0	0	113.7	L734 T735 S740 C757	L734-G738 PolarHBondContact O-N 3.02Å; T735-G738 PolarHBondContact O-N 3.12Å; G738-S740 PolarHBondContact O-N 3.32Å; G738-C757 VanDerWaalsContact O-CB 3.3Å; G738-C757 WeakPolarHBondContact O-CB 3.45Å; G738-C757 PolarHBondContact O-SG 2.83Å
739	V	85.7	Confident	83.4	Confident	10 Å²	10	53.6 Å²	53.6	6%	0.061	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-62	134.9	177.3	174.5	0	0	0	0	109.6	L702 L734 L737 I749 S754 L758	L702-V739 HydrophobicContact CD2-CG2 4.21Å; L734-V739 HydrophobicContact CB-CB 4.13Å; L734-V739 HydrophobicContact CB-CG1 4.45Å; L734-V739 HydrophobicContact CB-CG2 4.25Å; L734-V739 HydrophobicContact CD2-CB 4.39Å; L734-V739 HydrophobicContact CD2-CG1 4.23Å; L734-V739 HydrophobicContact CD2-CG2 3.93Å; L734-V739 VanDerWaalsContact O-CB 3.27Å; L734-V739 WeakPolarHBondContact O-CB 3.18Å; L734-V739 VanDerWaalsContact O-CG2 3.3Å; L734-V739 WeakPolarHBondContact O-CG2 3.19Å; L734-V739 PolarHBondContact O-N 2.66Å; L734-V739 VanDerWaalsContact O-N 3.1Å; L737-V739 HydrophobicContact CB-CG2 4Å; L737-V739 PolarHBondContact O-N 3.47Å; V739-I749 HydrophobicContact CG1-CB 4.28Å; V739-I749 HydrophobicContact CG1-CD1 4.32Å; V739-I749 HydrophobicContact CG1-CG1 3.91Å; V739-I749 HydrophobicContact CG1-CG2 3.49Å; V739-I749 VanDerWaalsContact CG1-CG2 3.49Å; V739-S754 WeakPolarHBondContact CG1-OG 3.44Å; V739-L758 HydrophobicContact CG2-CD1 4.33Å; V739-L758 HydrophobicContact CG2-CD2 3.89Å; V739-L758 HydrophobicContact CG2-CG 4.22Å
740	S	83.3	Confident	83.2	Confident	42 Å²	42	53.4 Å²	53.4	29%	0.294	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-93.5	130.1	179.3	-57.3	0	0	0	0	110.3	G738 D750 S754	G738-S740 PolarHBondContact O-N 3.32Å; S740-D750 PolarHBondContact O-N 3.09Å; S740-S754 PolarHBondContact N-OG 2.9Å; S740-S754 PolarHBondContact O-OG 2.92Å; S740-S754 VanDerWaalsContact O-OG 3.09Å
741	F	85.8	Confident	83.1	Confident	53 Å²	53	53.4 Å²	53.4	23%	0.232	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	157.1	176.5	-60.5	-86.5	0	0	0	111	V715 M731 L734 P746 K748 I749	V715-F741 HydrophobicContact CG2-CD1 4.37Å; V715-F741 HydrophobicContact CG2-CE1 3.84Å; M731-F741 HydrophobicContact CE-CD1 4.39Å; M731-F741 HydrophobicContact CE-CE1 3.7Å; M731-F741 HydrophobicContact CE-CE2 4.32Å; M731-F741 HydrophobicContact CE-CZ 3.66Å; M731-F741 HydrophobicContact SD-CE1 3.67Å; M731-F741 HydrophobicContact SD-CZ 3.79Å; L734-F741 HydrophobicContact CB-CZ 4.02Å; L734-F741 HydrophobicContact CD1-CE1 4.39Å; L734-F741 HydrophobicContact CD1-CZ 4.44Å; F741-P746 VanDerWaalsContact CD1-O 3.28Å; F741-P746 WeakPolarHBondContact CD1-O 3.33Å; F741-K748 CarbonylContact C-O 3.57Å; F741-K748 VanDerWaalsContact CA-O 3.25Å; F741-K748 WeakPolarHBondContact CA-O 3.37Å; F741-K748 WeakPolarHBondContact CB-O 3.27Å; F741-I749 HydrophobicContact CD1-CG1 4.19Å; F741-I749 HydrophobicContact CE1-CG1 4.02Å
742	A	81	Confident	83	Confident	15 Å²	15	58.9 Å²	58.9	12%	0.124	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	131.4	178.9	0	0	0	0	0	110.1	S744 D745 K748	A742-S744 PolarHBondContact O-N 3.28Å; A742-D745 CarbonylContact O-C 3.5Å; A742-D745 PolarHBondContact O-N 2.9Å; A742-K748 HydrophobicContact CB-CB 3.95Å; A742-K748 PolarHBondContact N-O 3.3Å
743	P	68.8	Low	82.7	Confident	139 Å²	139	57.6 Å²	57.6	90%	0.903	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-17.6	-180	-26.7	35.3	0	0	0	115
744	S	71.5	Confident	82.5	Confident	114 Å²	114	56.1 Å²	56.1	80%	0.797	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-16.2	178.5	49.5	0	0	0	0	114.8	A742	A742-S744 PolarHBondContact O-N 3.28Å
745	D	77.1	Confident	82.3	Confident	49 Å²	49	57.8 Å²	57.8	26%	0.262	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	111.1	-178.5	-179.4	4.5	0	0	0	111.1	A742 K747 K748	A742-D745 CarbonylContact O-C 3.5Å; A742-D745 PolarHBondContact O-N 2.9Å; D745-K747 PolarHBondContact O-N 2.87Å; D745-K747 VanDerWaalsContact O-N 3.15Å; D745-K747 VanDerWaalsContact OD1-CB 3.27Å; D745-K747 WeakPolarHBondContact OD1-CB 3.28Å; D745-K747 PolarHBondContact OD1-N 3.24Å; D745-K748 HydrophobicContact CB-CB 4.33Å; D745-K748 HydrophobicContact CB-CD 4.11Å; D745-K748 HydrophobicContact CB-CG 4.28Å; D745-K748 PolarHBondContact O-N 2.89Å; D745-K748 WeakPolarHBondContact OD2-CG 3.39Å
746	P	75.4	Confident	81.9	Confident	94 Å²	94	56.7 Å²	56.7	61%	0.61	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	-11.3	178	29.5	-35.6	0	0	0	113.6	F741 K748	F741-P746 VanDerWaalsContact CD1-O 3.28Å; F741-P746 WeakPolarHBondContact CD1-O 3.33Å; P746-K748 VanDerWaalsContact C-N 3.27Å
747	K	81.6	Confident	81.7	Confident	127 Å²	127	55.2 Å²	55.2	55%	0.552	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	-1.9	171.7	-56.4	-173.2	176.4	-171.7	0	113.3	V715 D745	V715-K747 WeakPolarHBondContact CG2-O 3.38Å; V715-K747 PolarHBondContact N-O 3.41Å; D745-K747 PolarHBondContact O-N 2.87Å; D745-K747 VanDerWaalsContact O-N 3.15Å; D745-K747 VanDerWaalsContact OD1-CB 3.27Å; D745-K747 WeakPolarHBondContact OD1-CB 3.28Å; D745-K747 PolarHBondContact OD1-N 3.24Å
748	K	85.7	Confident	81.4	Confident	70 Å²	70	54.9 Å²	54.9	30%	0.304	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	133.7	178.3	-72.9	178.3	172.7	-148.1	0	111.5	D712 F741 A742 D745 P746	D712-K748 HydrophobicContact CB-CD 4.35Å; D712-K748 WeakPolarHBondContact OD2-CD 3.48Å; D712-K748 WeakPolarHBondContact OD2-CE 3.2Å; D712-K748 IonicContact OD2-NZ 3.02Å; D712-K748 PolarHBondContact OD2-NZ 3.1Å; F741-K748 CarbonylContact C-O 3.57Å; F741-K748 VanDerWaalsContact CA-O 3.25Å; F741-K748 WeakPolarHBondContact CA-O 3.37Å; F741-K748 WeakPolarHBondContact CB-O 3.27Å; A742-K748 HydrophobicContact CB-CB 3.95Å; A742-K748 PolarHBondContact N-O 3.3Å; D745-K748 HydrophobicContact CB-CB 4.33Å; D745-K748 HydrophobicContact CB-CD 4.11Å; D745-K748 HydrophobicContact CB-CG 4.28Å; D745-K748 PolarHBondContact O-N 2.89Å; D745-K748 WeakPolarHBondContact OD2-CG 3.39Å; P746-K748 VanDerWaalsContact C-N 3.27Å
749	I	84.6	Confident	81.1	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	128.7	173	-63.9	161.2	0	0	0	108.5	D712 L713 V715 V718 L734 V739 F741 C751	D712-I749 WeakPolarHBondContact CA-O 3.19Å; L713-I749 HydrophobicContact CB-CB 4.24Å; L713-I749 HydrophobicContact CD2-CD1 4.16Å; L713-I749 HydrophobicContact CG-CD1 4.41Å; L713-I749 PolarHBondContact N-O 3Å; L713-I749 PolarHBondContact O-N 3.43Å; V715-I749 HydrophobicContact CG2-CD1 4.29Å; V715-I749 HydrophobicContact CG2-CG1 4.09Å; V718-I749 HydrophobicContact CG2-CD1 3.87Å; L734-I749 HydrophobicContact CD1-CD1 3.87Å; L734-I749 HydrophobicContact CD1-CG1 4.49Å; L734-I749 HydrophobicContact CD2-CD1 3.93Å; V739-I749 HydrophobicContact CG1-CB 4.28Å; V739-I749 HydrophobicContact CG1-CD1 4.32Å; V739-I749 HydrophobicContact CG1-CG1 3.91Å; V739-I749 HydrophobicContact CG1-CG2 3.49Å; V739-I749 VanDerWaalsContact CG1-CG2 3.49Å; F741-I749 HydrophobicContact CD1-CG1 4.19Å; F741-I749 HydrophobicContact CE1-CG1 4.02Å; I749-C751 PolarHBondContact O-N 2.88Å
750	D	85.9	Confident	80.1	Confident	49 Å²	49	59.9 Å²	59.9	26%	0.262	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	106.3	164.5	176.4	-18.4	0	0	0	107.9	S740 K752 A753 S754	S740-D750 PolarHBondContact O-N 3.09Å; D750-K752 VanDerWaalsContact C-N 3.29Å; D750-K752 PolarHBondContact O-N 3.19Å; D750-K752 WeakPolarHBondContact OD1-CA 3.28Å; D750-K752 VanDerWaalsContact OD1-CB 3.3Å; D750-K752 WeakPolarHBondContact OD1-CB 3.34Å; D750-K752 PolarHBondContact OD1-N 3.21Å; D750-A753 HydrophobicContact CB-CB 4.18Å; D750-A753 PolarHBondContact OD1-N 3.5Å; D750-A753 WeakPolarHBondContact OD2-CB 3.14Å; D750-S754 WeakPolarHBondContact O-CB 3.34Å; D750-S754 PolarHBondContact O-N 3.39Å; D750-S754 PolarHBondContact O-OG 3.36Å
751	C	84.7	Confident	78.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-70	-25.3	-179	-74.6	0	0	0	0	113.1	V706 F709 R710 P711 L713 I749 T755	V706-C751 HydrophobicContact CG1-CB 4.01Å; V706-C751 VanDerWaalsContact CG1-O 3.27Å; V706-C751 WeakPolarHBondContact CG1-O 3.21Å; V706-C751 WeakPolarHBondContact O-CB 3.26Å; F709-C751 PolarHBondContact O-SG 2.85Å; R710-C751 HydrophobicContact CG-CB 3.81Å; P711-C751 VanDerWaalsContact O-CB 3.32Å; P711-C751 WeakPolarHBondContact O-CB 2.94Å; P711-C751 PolarHBondContact O-N 3Å; L713-C751 WeakPolarHBondContact CB-SG 3.36Å; I749-C751 PolarHBondContact O-N 2.88Å; C751-T755 WeakPolarHBondContact O-CB 3.11Å; C751-T755 PolarHBondContact O-N 3.08Å; C751-T755 VanDerWaalsContact O-N 3.16Å; C751-T755 PolarHBondContact O-OG1 2.92Å
752	K	83.6	Confident	78.5	Confident	164 Å²	164	61.8 Å²	61.8	71%	0.713	39%	0.385	S	S	*	.	H	α-helix	trans	-74.3	-51.1	179.9	-175.9	-177.2	175.6	-173.9	0	110.4	D750	D750-K752 VanDerWaalsContact C-N 3.29Å; D750-K752 PolarHBondContact O-N 3.19Å; D750-K752 WeakPolarHBondContact OD1-CA 3.28Å; D750-K752 VanDerWaalsContact OD1-CB 3.3Å; D750-K752 WeakPolarHBondContact OD1-CB 3.34Å; D750-K752 PolarHBondContact OD1-N 3.21Å
753	A	82.4	Confident	78.4	Confident	38 Å²	38	64.2 Å²	64.2	31%	0.314	40%	0.399	S	S	.	.	H	α-helix	trans	-64	-48.5	175.2	0	0	0	0	0	111.2	D750 T755 A756	D750-A753 HydrophobicContact CB-CB 4.18Å; D750-A753 PolarHBondContact OD1-N 3.5Å; D750-A753 WeakPolarHBondContact OD2-CB 3.14Å; A753-T755 PolarHBondContact O-N 3.2Å; A753-T755 VanDerWaalsContact O-N 3.16Å; A753-A756 PolarHBondContact O-N 2.63Å; A753-A756 VanDerWaalsContact O-N 3.1Å
754	S	84.5	Confident	78.9	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-64.7	-21.9	-178.1	-57.1	0	0	0	0	114.2	V739 S740 D750 A756 C757 L758	V739-S754 WeakPolarHBondContact CG1-OG 3.44Å; S740-S754 PolarHBondContact N-OG 2.9Å; S740-S754 PolarHBondContact O-OG 2.92Å; S740-S754 VanDerWaalsContact O-OG 3.09Å; D750-S754 WeakPolarHBondContact O-CB 3.34Å; D750-S754 PolarHBondContact O-N 3.39Å; D750-S754 PolarHBondContact O-OG 3.36Å; S754-A756 PolarHBondContact O-N 3.22Å; S754-C757 PolarHBondContact O-N 3.48Å; S754-L758 VanDerWaalsContact O-CB 3.27Å; S754-L758 WeakPolarHBondContact O-CB 3.48Å; S754-L758 VanDerWaalsContact O-CG 3.25Å; S754-L758 WeakPolarHBondContact O-CG 3.35Å; S754-L758 PolarHBondContact O-N 2.71Å
755	T	83.8	Confident	79.4	Confident	34 Å²	34	56.9 Å²	56.9	21%	0.209	35%	0.346	C	S	.	.	H	α-helix	trans	-55.9	-35.5	173.4	-65.4	0	0	0	0	111.6	R710 C751 A753 A759	R710-T755 PolarHBondContact NH2-OG1 2.67Å; C751-T755 WeakPolarHBondContact O-CB 3.11Å; C751-T755 PolarHBondContact O-N 3.08Å; C751-T755 VanDerWaalsContact O-N 3.16Å; C751-T755 PolarHBondContact O-OG1 2.92Å; A753-T755 PolarHBondContact O-N 3.2Å; A753-T755 VanDerWaalsContact O-N 3.16Å; T755-A759 WeakPolarHBondContact O-CB 3.4Å; T755-A759 PolarHBondContact O-N 2.91Å
756	A	79.8	Confident	79.5	Confident	67 Å²	67	57.4 Å²	57.4	55%	0.554	35%	0.352	S	S	*	.	H	α-helix	trans	-73.7	-50.4	-178.6	0	0	0	0	0	112	A753 S754 L758 A759 A760	A753-A756 PolarHBondContact O-N 2.63Å; A753-A756 VanDerWaalsContact O-N 3.1Å; S754-A756 PolarHBondContact O-N 3.22Å; A756-L758 VanDerWaalsContact C-N 3.32Å; A756-L758 PolarHBondContact O-N 3.08Å; A756-A759 WeakPolarHBondContact O-CB 3.38Å; A756-A759 PolarHBondContact O-N 3.37Å; A756-A760 PolarHBondContact O-N 3.12Å
757	C	80.8	Confident	79.8	Confident	42 Å²	42	54.9 Å²	54.9	28%	0.284	33%	0.334	S	S	.	.	H	α-helix	trans	-59.8	-43.1	178.9	-54.1	0	0	0	0	111.7	G738 S754 A759 A760 S761	G738-C757 VanDerWaalsContact O-CB 3.3Å; G738-C757 WeakPolarHBondContact O-CB 3.45Å; G738-C757 PolarHBondContact O-SG 2.83Å; S754-C757 PolarHBondContact O-N 3.48Å; C757-A759 VanDerWaalsContact C-N 3.26Å; C757-A759 PolarHBondContact O-N 3.41Å; C757-A760 PolarHBondContact O-N 3.45Å; C757-S761 WeakPolarHBondContact O-CB 3.34Å; C757-S761 PolarHBondContact O-N 2.98Å; C757-S761 PolarHBondContact O-OG 3.26Å
758	L	81	Confident	79.6	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-75.3	-8.1	176.9	-62.8	173.4	0	0	0	113.8	L702 R703 V706 L737 V739 S754 A756	L702-L758 HydrophobicContact CD2-CD1 3.91Å; L702-L758 HydrophobicContact CD2-CD2 3.69Å; L702-L758 HydrophobicContact CD2-CG 4.47Å; L702-L758 HydrophobicContact CG-CD1 3.8Å; L702-L758 HydrophobicContact CG-CD2 4.36Å; R703-L758 WeakPolarHBondContact CD-O 3.16Å; R703-L758 HydrophobicContact CG-CB 3.92Å; R703-L758 VanDerWaalsContact CG-O 3.24Å; R703-L758 WeakPolarHBondContact CG-O 3.19Å; R703-L758 PolarHBondContact NE-O 2.91Å; R703-L758 VanDerWaalsContact NE-O 3.1Å; R703-L758 PolarHBondContact NH1-O 3.27Å; R703-L758 VanDerWaalsContact NH1-O 3.12Å; V706-L758 HydrophobicContact CB-CD1 4.09Å; V706-L758 HydrophobicContact CG1-CD1 4.11Å; V706-L758 HydrophobicContact CG2-CD1 3.79Å; L737-L758 HydrophobicContact CB-CD2 3.95Å; L737-L758 HydrophobicContact CD1-CD2 3.96Å; L737-L758 HydrophobicContact CG-CD2 4.42Å; V739-L758 HydrophobicContact CG2-CD1 4.33Å; V739-L758 HydrophobicContact CG2-CD2 3.89Å; V739-L758 HydrophobicContact CG2-CG 4.22Å; S754-L758 VanDerWaalsContact O-CB 3.27Å; S754-L758 WeakPolarHBondContact O-CB 3.48Å; S754-L758 VanDerWaalsContact O-CG 3.25Å; S754-L758 WeakPolarHBondContact O-CG 3.35Å; S754-L758 PolarHBondContact O-N 2.71Å; A756-L758 VanDerWaalsContact C-N 3.32Å; A756-L758 PolarHBondContact O-N 3.08Å
759	A	75.6	Confident	79.2	Confident	61 Å²	61	48.2 Å²	48.2	50%	0.504	32%	0.32	S	S	.	.	H	α-helix	trans	-85.8	-30.7	169.1	0	0	0	0	0	112	T755 A756 C757	T755-A759 WeakPolarHBondContact O-CB 3.4Å; T755-A759 PolarHBondContact O-N 2.91Å; A756-A759 WeakPolarHBondContact O-CB 3.38Å; A756-A759 PolarHBondContact O-N 3.37Å; C757-A759 VanDerWaalsContact C-N 3.26Å; C757-A759 PolarHBondContact O-N 3.41Å
760	A	64.8	Low	78.7	Confident	96 Å²	96	52.3 Å²	52.3	79%	0.793	35%	0.346	S	S	*	.	H	α-helix	trans	-85	-8.3	176.9	0	0	0	0	0	114.2	A756 C757	A756-A760 PolarHBondContact O-N 3.12Å; C757-A760 PolarHBondContact O-N 3.45Å
761	S	57.9	Low	78.1	Confident	72 Å²	72	52.5 Å²	52.5	50%	0.503	35%	0.354	S	S	.	.			trans	-114.1	0	-177.5	-51.2	0	0	0	0	113.6	R703 C757	R703-S761 PolarHBondContact NH1-OXT 2.75Å; C757-S761 WeakPolarHBondContact O-CB 3.34Å; C757-S761 PolarHBondContact O-N 2.98Å; C757-S761 PolarHBondContact O-OG 3.26Å

Retrieved 761 of 761 residues in 504.2 ms (Link to these results)

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