X5D7J4_HUMAN Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession X5D7J4, Species HUMAN (Homo sapiens, Human), Gene MARK1, Length 595 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.2	Very low	38.3	Very low	249 Å²	249	144.9 Å²	144.9	100%	1.227	82%	0.823	S	S	*	*				0	156.5	0	-76.2	169.6	163.6	0	0	108.4
2	S	35.3	Very low	37.7	Very low	121 Å²	121	144.5 Å²	144.5	85%	0.846	81%	0.809	S	S	*	*			trans	-111.9	179.6	-166.9	-51.6	0	0	0	0	112.7
3	A	36.2	Very low	37.7	Very low	94 Å²	94	147.6 Å²	147.6	78%	0.777	80%	0.8	S	S	*	*			trans	86	143.2	165.9	0	0	0	0	0	116.4
4	R	37.2	Very low	37.3	Very low	241 Å²	241	146.1 Å²	146.1	91%	0.909	79%	0.791	S	S	*	*			cis	-157.9	156.1	-12	-132.4	174	-176.4	174.2	-0.6	112.5
5	T	40.3	Very low	37.2	Very low	118 Å²	118	143.6 Å²	143.6	72%	0.724	78%	0.783	S	S	*	*			trans	-65.8	165.4	163.6	-4.8	0	0	0	0	111.8
6	P	52.8	Low	36.9	Very low	123 Å²	123	144.8 Å²	144.8	80%	0.799	78%	0.782	S	S	*	*				-149.2	168.5	72.8	41	-21.6	0	0	0	118.6
7	L	33.8	Very low	36.5	Very low	153 Å²	153	145.2 Å²	145.2	80%	0.801	78%	0.784	S	S	*	*			trans	-88.4	171.9	159.6	-75.7	159.3	0	0	0	110.6
8	P	47.3	Very low	36.3	Very low	121 Å²	121	146.7 Å²	146.7	79%	0.786	78%	0.784	S	S	*	*			trans	-118.3	156.3	141	36.2	-29.6	0	0	0	113.5
9	T	34.6	Very low	36	Very low	126 Å²	126	146.6 Å²	146.6	77%	0.773	79%	0.79	S	S	*	*			trans	-109.9	166.4	169.7	42.2	0	0	0	0	109
10	V	34.2	Very low	35.8	Very low	120 Å²	120	144.5 Å²	144.5	73%	0.727	79%	0.787	S	S	*	*				175.8	169.6	81.8	163.7	0	0	0	0	108.9
11	N	31.8	Very low	35.8	Very low	128 Å²	128	144.7 Å²	144.7	68%	0.684	79%	0.792	S	S	*	*			trans	-40.7	-176.2	164.8	-35.2	-0.5	0	0	0	116.7
12	E	30.7	Very low	35.8	Very low	140 Å²	140	138.6 Å²	138.6	65%	0.654	77%	0.765	S	S	*	*			cis	-150.9	-147.8	5.2	-151.8	148.7	151.5	0	0	113.3
13	R	37.2	Very low	35.3	Very low	185 Å²	185	136.6 Å²	136.6	70%	0.698	76%	0.763	S	S	*	*			trans	-87.1	-176.8	179.5	-48.4	179	-156.8	78	9.8	110.4
14	D	32.8	Very low	35	Very low	126 Å²	126	141 Å²	141	67%	0.674	76%	0.761	S	S	*	*			cis	-167.4	175.8	34.6	-116.6	-42.1	0	0	0	113.7
15	T	35	Very low	34.7	Very low	109 Å²	109	136 Å²	136	67%	0.669	76%	0.757	S	S	*	*			trans	69.6	126.4	152.6	45.3	0	0	0	0	125.1
16	E	32.6	Very low	34.1	Very low	162 Å²	162	138 Å²	138	76%	0.757	76%	0.759	S	S	*	*			trans	69	122	130.7	-65.6	174.4	179	0	0	124.1
17	N	30.7	Very low	33.7	Very low	153 Å²	153	137.2 Å²	137.2	82%	0.818	75%	0.753	S	S	*	*				-167.4	158.7	99	-106.4	-76.6	0	0	0	114.3
18	H	33.4	Very low	33.3	Very low	171 Å²	171	137.7 Å²	137.7	79%	0.792	75%	0.751	S	S	*	*			trans	-120.4	151.5	175.4	-80.8	-105.6	0	0	0	111
19	T	30.6	Very low	32.5	Very low	146 Å²	146	139.1 Å²	139.1	90%	0.896	75%	0.75	S	S	*	*			trans	-143.9	143.3	147.1	40.4	0	0	0	0	111.3
20	S	32.3	Very low	32.1	Very low	104 Å²	104	141.3 Å²	141.3	73%	0.727	75%	0.752	S	S	*	*			trans	-128.3	168.3	174.1	-61.1	0	0	0	0	109.1
21	V	35.4	Very low	32.9	Very low	149 Å²	149	140.5 Å²	140.5	90%	0.903	75%	0.749	S	S	*	*			trans	-130.2	134.2	164.5	160.1	0	0	0	0	108.8
22	D	37.2	Very low	32.7	Very low	120 Å²	120	141.3 Å²	141.3	64%	0.642	76%	0.759	S	S	*	*			trans	-93	166.4	-169.9	-90	-9.3	0	0	0	114.5	Y24	D22-Y24 HydrophobicContact CB-CD2 4.33Å; D22-Y24 HydrophobicContact CB-CE2 3.7Å; D22-Y24 VanDerWaalsContact OD2-CE2 3.27Å; D22-Y24 WeakPolarHBondContact OD2-CE2 3.43Å; D22-Y24 PolarHBondContact OD2-OH 3.46Å
23	G	26.1	Very low	32.8	Very low	79 Å²	79	143.7 Å²	143.7	81%	0.814	77%	0.767	S	S	*	*			trans	-162.7	100.3	165.9	0	0	0	0	0	112.6
24	Y	29	Very low	32.3	Very low	187 Å²	187	140.2 Å²	140.2	73%	0.733	77%	0.771	S	S	*	*			trans	-77.1	167.4	176.3	-57	-101.3	0	0	0	110.2	D22	D22-Y24 HydrophobicContact CB-CD2 4.33Å; D22-Y24 HydrophobicContact CB-CE2 3.7Å; D22-Y24 VanDerWaalsContact OD2-CE2 3.27Å; D22-Y24 WeakPolarHBondContact OD2-CE2 3.43Å; D22-Y24 PolarHBondContact OD2-OH 3.46Å
25	T	31	Very low	32.1	Very low	135 Å²	135	139.8 Å²	139.8	83%	0.828	78%	0.778	S	S	*	*			cis	-159.2	164.5	27.4	-40	0	0	0	0	111.5
26	E	28.3	Very low	32	Very low	162 Å²	162	140.4 Å²	140.4	76%	0.757	79%	0.787	S	S	*	*			trans	-80.6	-175.2	167.3	-125.8	-140.3	106.4	0	0	111.7	H28	E26-H28 PolarHBondContact OE1-N 3.42Å
27	P	45.1	Very low	32.2	Very low	105 Å²	105	143.5 Å²	143.5	68%	0.682	79%	0.791	S	S	*	*			cis	-144.5	177.6	14.5	43.8	-23.4	0	0	0	120.8
28	H	24.9	Very low	32.6	Very low	163 Å²	163	145.5 Å²	145.5	76%	0.755	80%	0.796	S	S	*	*			trans	88.3	155.6	139.8	-137.7	-91.9	0	0	0	124.2	E26	E26-H28 PolarHBondContact OE1-N 3.42Å
29	I	29.4	Very low	32.5	Very low	151 Å²	151	143.8 Å²	143.8	77%	0.774	79%	0.792	S	S	*	*			trans	96.1	122.5	163.9	-53.9	-179.9	0	0	0	119.6
30	Q	27.2	Very low	32.8	Very low	173 Å²	173	143.7 Å²	143.7	81%	0.808	79%	0.785	S	S	*	*			trans	-122.3	-173.9	161.7	-72.1	-169.7	15.4	0	0	108.4
31	P	51.2	Low	33.4	Very low	102 Å²	102	143 Å²	143	66%	0.662	78%	0.778	S	S	*	*				-127.9	176.7	-51.6	35.6	-20.8	0	0	0	112.1
32	T	27.9	Very low	33.3	Very low	145 Å²	145	146.7 Å²	146.7	89%	0.89	78%	0.776	S	S	*	*			trans	-137.2	163.2	160	51.1	0	0	0	0	113.1
33	K	31.3	Very low	33	Very low	191 Å²	191	147 Å²	147	83%	0.83	79%	0.786	S	S	*	*			trans	-136.1	178.8	-174.6	-69.5	179.5	178.6	172.5	0	110.4
34	S	27.4	Very low	33.6	Very low	111 Å²	111	154.6 Å²	154.6	78%	0.776	79%	0.79	S	S	*	*			trans	81.2	156.4	160.6	89.2	0	0	0	0	115.7
35	S	28.4	Very low	34	Very low	118 Å²	118	153.3 Å²	153.3	83%	0.825	80%	0.795	S	S	*	*			cis	-170.3	139.2	-23.6	-102.9	0	0	0	0	109.9
36	S	32.2	Very low	34.1	Very low	121 Å²	121	151.8 Å²	151.8	85%	0.846	79%	0.79	S	S	*	*			trans	-162.4	150.7	148	-167.7	0	0	0	0	111.5
37	R	37.4	Very low	35	Very low	228 Å²	228	152.1 Å²	152.1	86%	0.86	80%	0.796	S	S	*	*			trans	-130.8	131.4	172.9	-72	176.9	173.2	173.3	-3.3	109
38	Q	40.2	Very low	34.7	Very low	194 Å²	194	153.2 Å²	153.2	91%	0.907	80%	0.8	S	S	*	*			trans	-136.9	164.4	149.9	-70.8	-162.1	-7.4	0	0	109.4
39	N	31.2	Very low	35.8	Very low	135 Å²	135	150.9 Å²	150.9	72%	0.722	80%	0.803	S	S	*	*			trans	-130.7	138.6	-147	-104.4	-31.7	0	0	0	113.8
40	I	36	Very low	36.2	Very low	145 Å²	145	147.9 Å²	147.9	74%	0.744	80%	0.801	S	S	*	*			trans	71.3	144.2	136.8	-67.6	171.3	0	0	0	117.1
41	P	45.6	Very low	37.1	Very low	89 Å²	89	146.3 Å²	146.3	58%	0.578	80%	0.803	S	S	*	*			cis	-135.4	-170.2	-14.9	37.4	-17.9	0	0	0	115.6
42	R	33.1	Very low	36.8	Very low	227 Å²	227	146.9 Å²	146.9	86%	0.857	80%	0.8	S	S	*	*			trans	72.1	116.3	162	-61.3	166.9	-174.2	150.3	0.6	115.4
43	C	30.4	Very low	38.1	Very low	126 Å²	126	148.7 Å²	148.7	85%	0.851	80%	0.799	S	S	*	*			cis	-156.5	134.3	38.1	-83.9	0	0	0	0	111	N45	C43-N45 PolarHBondContact O-N 3.28Å
44	R	39.3	Very low	39.7	Very low	239 Å²	239	141.7 Å²	141.7	90%	0.902	77%	0.769	S	S	*	*			trans	-89.2	102.4	179.3	-172.9	-177.1	-164	163.6	6	111.1
45	N	37.1	Very low	42.2	Very low	159 Å²	159	139.7 Å²	139.7	85%	0.85	75%	0.753	S	S	*	*			trans	-161.1	47.1	160.9	-104.8	-12.3	0	0	0	112.5	C43	C43-N45 PolarHBondContact O-N 3.28Å
46	S	33	Very low	44.9	Very low	103 Å²	103	139.5 Å²	139.5	72%	0.72	74%	0.739	S	S	*	*			trans	-79.9	114.8	166.1	42	0	0	0	0	110.1	T48	S46-T48 PolarHBondContact O-N 3.45Å; S46-T48 VanDerWaalsContact O-N 3.16Å
47	I	46.2	Very low	47.4	Very low	169 Å²	169	137.9 Å²	137.9	87%	0.867	72%	0.72	S	S	*	*			trans	-75.7	99.5	170	-60.6	171.7	0	0	0	107.1	S49	I47-S49 PolarHBondContact O-N 3.15Å
48	T	40.2	Very low	49.8	Very low	128 Å²	128	130.1 Å²	130.1	79%	0.785	71%	0.711	S	S	*	*			trans	-73	112.7	-178.2	49.8	0	0	0	0	111.3	S46	S46-T48 PolarHBondContact O-N 3.45Å; S46-T48 VanDerWaalsContact O-N 3.16Å
49	S	46.5	Very low	52.3	Low	115 Å²	115	125.1 Å²	125.1	80%	0.804	69%	0.691	S	S	*	*			trans	-72.8	130.5	172.7	51.4	0	0	0	0	112.6	I47	I47-S49 PolarHBondContact O-N 3.15Å
50	A	38.5	Very low	55.3	Low	88 Å²	88	123 Å²	123	73%	0.727	67%	0.673	S	S	*	*			trans	-161.9	135.2	152	0	0	0	0	0	111.7
51	T	45.1	Very low	58.1	Low	140 Å²	140	120.8 Å²	120.8	86%	0.859	66%	0.656	S	S	*	*			trans	32.6	99.4	149	58.9	0	0	0	0	119.6
52	D	45.6	Very low	60.4	Low	113 Å²	113	116.9 Å²	116.9	60%	0.604	63%	0.63	S	S	*	*				-162.6	119.6	115	-169.2	3.9	0	0	0	109.2	Q54	D52-Q54 HydrophobicContact CB-CG 3.88Å; D52-Q54 PolarHBondContact O-N 3.03Å; D52-Q54 WeakPolarHBondContact OD2-CG 3.35Å; D52-Q54 PolarHBondContact OD2-NE2 3.03Å
53	E	55.7	Low	63.2	Low	184 Å²	184	108.2 Å²	108.2	86%	0.86	60%	0.599	S	S	*	*			trans	-76.7	61.6	178.4	-98.8	-65.7	122.2	0	0	110.4	P55	E53-P55 WeakPolarHBondContact O-CD 3.47Å
54	Q	64.1	Low	66.2	Low	44 Å²	44	109.3 Å²	109.3	21%	0.206	59%	0.589	C	S	.	*	P	Polyproline II helix	trans	-69.3	118	-177	-71.5	171.5	-0.9	0	0	109.4	D52 H56 R61	D52-Q54 HydrophobicContact CB-CG 3.88Å; D52-Q54 PolarHBondContact O-N 3.03Å; D52-Q54 WeakPolarHBondContact OD2-CG 3.35Å; D52-Q54 PolarHBondContact OD2-NE2 3.03Å; Q54-H56 PolarHBondContact O-CE1 2.84Å; Q54-H56 VanDerWaalsContact O-CE1 3.27Å; Q54-H56 PolarHBondContact O-N 2.96Å; Q54-H56 PolarHBondContact O-ND1 3.38Å; Q54-R61 HydrophobicContact CB-CG 3.69Å; Q54-R61 VanDerWaalsContact OE1-CD 3.25Å
55	P	80.4	Confident	68.8	Low	69 Å²	69	100.5 Å²	100.5	45%	0.448	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-64.2	127.8	-170.6	21.1	-31.2	0	0	0	111.2	E53 L62	E53-P55 WeakPolarHBondContact O-CD 3.47Å; P55-L62 HydrophobicContact CB-CD1 4.38Å; P55-L62 HydrophobicContact CG-CB 4.31Å; P55-L62 HydrophobicContact CG-CD1 4.23Å; P55-L62 WeakPolarHBondContact O-CB 3.38Å; P55-L62 WeakPolarHBondContact O-CG 3.49Å; P55-L62 PolarHBondContact O-N 3.08Å
56	H	85.8	Confident	71.5	Confident	113 Å²	113	97 Å²	97	52%	0.523	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	143.7	-179.7	-69.6	73.9	0	0	0	111.2	Q54 Y60 R61	Q54-H56 PolarHBondContact O-CE1 2.84Å; Q54-H56 VanDerWaalsContact O-CE1 3.27Å; Q54-H56 PolarHBondContact O-N 2.96Å; Q54-H56 PolarHBondContact O-ND1 3.38Å; H56-Y60 WeakPolarHBondContact CA-O 3.36Å; H56-R61 WeakPolarHBondContact NE2-CB 3.44Å; H56-R61 WeakPolarHBondContact NE2-CD 3.41Å
57	I	84.6	Confident	74.3	Confident	87 Å²	87	93.4 Å²	93.4	45%	0.446	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	98.4	169	-62	-174.4	0	0	0	107.6	N59 Y60 L62	I57-N59 PolarHBondContact O-N 3.47Å; I57-Y60 PolarHBondContact N-O 3.42Å; I57-Y60 PolarHBondContact O-N 3.25Å; I57-Y60 VanDerWaalsContact O-N 3.15Å; I57-L62 HydrophobicContact CD1-CD1 3.63Å; I57-L62 HydrophobicContact CD1-CD2 4.35Å; I57-L62 HydrophobicContact CD1-CG 4.32Å; I57-L62 HydrophobicContact CG1-CD1 3.82Å; I57-L62 HydrophobicContact CG1-CG 4.23Å
58	G	88	Confident	76.4	Confident	66 Å²	66	93.9 Å²	93.9	68%	0.68	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	-131.3	-170.8	0	0	0	0	0	111.2	Y60	G58-Y60 PolarHBondContact O-N 2.94Å
59	N	91	Very high	78.3	Confident	89 Å²	89	89.9 Å²	89.9	48%	0.476	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	15.2	-179.3	-61.1	-7.6	0	0	0	114.6	I57 H79 V80	I57-N59 PolarHBondContact O-N 3.47Å; N59-H79 WeakPolarHBondContact CB-NE2 3.29Å; N59-H79 CarbonylContact O-C 3.54Å; N59-H79 WeakPolarHBondContact O-CA 3.47Å; N59-H79 PolarHBondContact O-CD2 3.42Å; N59-V80 WeakPolarHBondContact O-CG2 3.15Å; N59-V80 PolarHBondContact O-N 2.97Å
60	Y	94.6	Very high	79.8	Confident	90 Å²	90	91.5 Å²	91.5	35%	0.353	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	118.2	-177.3	-60.6	-89.3	0	0	0	111.7	H56 I57 G58 R78 H79 V86	H56-Y60 WeakPolarHBondContact CA-O 3.36Å; I57-Y60 PolarHBondContact N-O 3.42Å; I57-Y60 PolarHBondContact O-N 3.25Å; I57-Y60 VanDerWaalsContact O-N 3.15Å; G58-Y60 PolarHBondContact O-N 2.94Å; Y60-R78 WeakPolarHBondContact CA-O 3.35Å; Y60-H79 HydrophobicContact CD1-CB 3.84Å; Y60-H79 AromaticContact CD1-CD2 3.92Å; Y60-H79 HydrophobicContact CE1-CB 3.66Å; Y60-H79 AromaticContact CE1-CD2 3.5Å; Y60-H79 VanDerWaalsContact CE1-CD2 3.5Å; Y60-H79 WeakPolarHBondContact CE1-CD2 3.08Å; Y60-H79 AromaticContact CE1-CG 3.87Å; Y60-H79 AromaticContact CE2-CD2 3.97Å; Y60-H79 AromaticContact CZ-CD2 3.52Å; Y60-V86 HydrophobicContact CD1-CG2 3.62Å; Y60-V86 HydrophobicContact CE1-CG1 4.46Å; Y60-V86 HydrophobicContact CE1-CG2 3.63Å
61	R	94.6	Very high	81.7	Confident	99 Å²	99	92.7 Å²	92.7	37%	0.374	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	114.1	168.6	-177.6	164	55.6	174.4	-7.4	108.9	Q54 H56 A77 R78 V80	Q54-R61 HydrophobicContact CB-CG 3.69Å; Q54-R61 VanDerWaalsContact OE1-CD 3.25Å; H56-R61 WeakPolarHBondContact NE2-CB 3.44Å; H56-R61 WeakPolarHBondContact NE2-CD 3.41Å; R61-A77 CarbonylContact O-C 3.54Å; R61-A77 VanDerWaalsContact O-CA 3.26Å; R61-A77 WeakPolarHBondContact O-CA 3.38Å; R61-A77 WeakPolarHBondContact O-CB 3.46Å; R61-R78 PolarHBondContact N-O 2.98Å; R61-R78 PolarHBondContact O-N 3.3Å; R61-V80 HydrophobicContact CB-CG2 4.4Å
62	L	94.1	Very high	83.7	Confident	7 Å²	7	86.9 Å²	86.9	4%	0.037	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	138.9	179.2	-59.2	173.5	0	0	0	110.6	P55 I57 K75 A77 V88 I90	P55-L62 HydrophobicContact CB-CD1 4.38Å; P55-L62 HydrophobicContact CG-CB 4.31Å; P55-L62 HydrophobicContact CG-CD1 4.23Å; P55-L62 WeakPolarHBondContact O-CB 3.38Å; P55-L62 WeakPolarHBondContact O-CG 3.49Å; P55-L62 PolarHBondContact O-N 3.08Å; I57-L62 HydrophobicContact CD1-CD1 3.63Å; I57-L62 HydrophobicContact CD1-CD2 4.35Å; I57-L62 HydrophobicContact CD1-CG 4.32Å; I57-L62 HydrophobicContact CG1-CD1 3.82Å; I57-L62 HydrophobicContact CG1-CG 4.23Å; L62-K75 HydrophobicContact CB-CD 3.8Å; L62-K75 HydrophobicContact CD1-CD 3.99Å; L62-K75 HydrophobicContact CD2-CB 4.36Å; L62-K75 HydrophobicContact CD2-CD 4.3Å; L62-K75 HydrophobicContact CG-CD 4.27Å; L62-A77 HydrophobicContact CD2-CB 3.93Å; L62-V88 HydrophobicContact CD2-CB 4.17Å; L62-V88 HydrophobicContact CD2-CG1 4.21Å; L62-V88 HydrophobicContact CD2-CG2 4.28Å; L62-I90 HydrophobicContact CD1-CD1 4.03Å
63	Q	92.8	Very high	85.9	Confident	45 Å²	45	86.1 Å²	86.1	21%	0.21	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	-146.8	178.2	-59.6	174.2	-59.6	0	0	109.4	K75 L76	Q63-K75 WeakPolarHBondContact O-CD 3.36Å; Q63-L76 WeakPolarHBondContact CA-O 3.25Å; Q63-L76 HydrophobicContact CB-CB 4.38Å; Q63-L76 WeakPolarHBondContact CB-O 3.46Å; Q63-L76 PolarHBondContact N-O 2.96Å
64	K	92.8	Very high	87.7	Confident	149 Å²	149	79.1 Å²	79.1	65%	0.648	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.3	150.7	180	65.5	-179.1	178.6	-178.6	0	113.1	I66 K75 L76	K64-I66 HydrophobicContact CG-CG2 4.28Å; K64-K75 WeakPolarHBondContact O-CA 3.36Å; K64-L76 HydrophobicContact CG-CB 4.46Å; K64-L76 PolarHBondContact O-N 3.26Å
65	T	94.1	Very high	89.2	Confident	54 Å²	54	78.6 Å²	78.6	33%	0.331	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	129.3	169.6	-54.3	0	0	0	0	108.5	G67 K68 K73 V74	T65-G67 VanDerWaalsContact CG2-O 3.32Å; T65-G67 WeakPolarHBondContact CG2-O 3.36Å; T65-K68 HydrophobicContact CG2-CG 4.11Å; T65-K73 HydrophobicContact CG2-CG 3.77Å; T65-K73 VanDerWaalsContact OG1-CE 3.28Å; T65-K73 WeakPolarHBondContact OG1-CE 3.25Å; T65-V74 WeakPolarHBondContact CG2-O 3.45Å
66	I	93.9	Very high	89.9	Confident	85 Å²	85	76.8 Å²	76.8	44%	0.436	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-8.1	179.1	59.9	177.3	0	0	0	112.8	K64 V74 L76 A87	K64-I66 HydrophobicContact CG-CG2 4.28Å; I66-V74 HydrophobicContact CD1-CG1 4.03Å; I66-V74 HydrophobicContact CG1-CB 4.24Å; I66-V74 HydrophobicContact CG1-CG1 3.79Å; I66-V74 PolarHBondContact N-O 3.49Å; I66-L76 HydrophobicContact CD1-CB 4.37Å; I66-L76 HydrophobicContact CG2-CB 3.8Å; I66-A87 HydrophobicContact CD1-CB 3.89Å
67	G	92.6	Very high	90.4	Very high	27 Å²	27	71.4 Å²	71.4	28%	0.278	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	151.1	169.8	0	0	0	0	0	112.2	T65 V74	T65-G67 VanDerWaalsContact CG2-O 3.32Å; T65-G67 WeakPolarHBondContact CG2-O 3.36Å; G67-V74 PolarHBondContact N-O 2.91Å; G67-V74 PolarHBondContact O-N 2.88Å
68	K	90.3	Very high	90.9	Very high	179 Å²	179	70.7 Å²	70.7	78%	0.778	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.1	138.8	165.5	-62.6	179.1	-174.6	174.7	0	107.4	T65	T65-K68 HydrophobicContact CG2-CG 4.11Å
69	G	80.4	Confident	91.3	Very high	45 Å²	45	69 Å²	69	46%	0.464	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	165.8	164.3	0	0	0	0	0	108.9	F71 A72	G69-F71 PolarHBondContact O-N 3.1Å; G69-A72 PolarHBondContact N-O 3.41Å; G69-A72 PolarHBondContact O-N 3.23Å
70	N	77.3	Confident	91.3	Very high	149 Å²	149	68.9 Å²	68.9	80%	0.797	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	-37	-166.3	-56.7	8.6	0	0	0	114.5
71	F	77.9	Confident	91.1	Very high	112 Å²	112	70.8 Å²	70.8	49%	0.491	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	3.7	-176	-48.2	-62.9	0	0	0	114.3	G69 L96 L101	G69-F71 PolarHBondContact O-N 3.1Å; F71-L96 HydrophobicContact CB-CD2 4.23Å; F71-L96 HydrophobicContact CD1-CD2 3.66Å; F71-L96 HydrophobicContact CE1-CD2 4.42Å; F71-L96 HydrophobicContact CG-CD2 4.21Å; F71-L101 HydrophobicContact CE1-CD1 3.78Å; F71-L101 HydrophobicContact CZ-CD1 3.9Å
72	A	86.4	Confident	91.1	Very high	18 Å²	18	69.5 Å²	69.5	15%	0.149	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	140.8	-173.5	0	0	0	0	0	115.4	G69 K89 I90 I91	G69-A72 PolarHBondContact N-O 3.41Å; G69-A72 PolarHBondContact O-N 3.23Å; A72-K89 HydrophobicContact CB-CD 4.2Å; A72-K89 HydrophobicContact CB-CG 3.78Å; A72-I90 CarbonylContact C-O 3.58Å; A72-I90 VanDerWaalsContact CA-O 3.23Å; A72-I90 WeakPolarHBondContact CA-O 3.15Å; A72-I91 HydrophobicContact CB-CG1 4.01Å
73	K	92.4	Very high	90.9	Very high	97 Å²	97	71 Å²	71	42%	0.422	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	114.5	170.8	-169.3	171.1	-176.3	174.9	0	109.1	T65 I90	T65-K73 HydrophobicContact CG2-CG 3.77Å; T65-K73 VanDerWaalsContact OG1-CE 3.28Å; T65-K73 WeakPolarHBondContact OG1-CE 3.25Å; K73-I90 PolarHBondContact N-O 2.85Å; K73-I90 WeakPolarHBondContact O-CB 3.43Å; K73-I90 PolarHBondContact O-N 3.41Å
74	V	93.6	Very high	91	Very high	37 Å²	37	77 Å²	77	22%	0.224	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	121.4	178.2	-169	0	0	0	0	108.9	T65 I66 G67 A87 V88 K89	T65-V74 WeakPolarHBondContact CG2-O 3.45Å; I66-V74 HydrophobicContact CD1-CG1 4.03Å; I66-V74 HydrophobicContact CG1-CB 4.24Å; I66-V74 HydrophobicContact CG1-CG1 3.79Å; I66-V74 PolarHBondContact N-O 3.49Å; G67-V74 PolarHBondContact N-O 2.91Å; G67-V74 PolarHBondContact O-N 2.88Å; V74-A87 HydrophobicContact CG1-CB 4.08Å; V74-V88 CarbonylContact C-O 3.58Å; V74-V88 WeakPolarHBondContact CA-O 3.19Å; V74-K89 HydrophobicContact CG2-CB 4.43Å; V74-K89 HydrophobicContact CG2-CG 4.26Å
75	K	96.1	Very high	91.1	Very high	33 Å²	33	74.9 Å²	74.9	14%	0.143	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	147.8	173.4	-75	-166.4	171.8	-163.4	0	111.2	L62 Q63 K64 V88 I90	L62-K75 HydrophobicContact CB-CD 3.8Å; L62-K75 HydrophobicContact CD1-CD 3.99Å; L62-K75 HydrophobicContact CD2-CB 4.36Å; L62-K75 HydrophobicContact CD2-CD 4.3Å; L62-K75 HydrophobicContact CG-CD 4.27Å; Q63-K75 WeakPolarHBondContact O-CD 3.36Å; K64-K75 WeakPolarHBondContact O-CA 3.36Å; K75-V88 PolarHBondContact N-O 2.99Å; K75-V88 PolarHBondContact O-N 3.23Å; K75-I90 HydrophobicContact CD-CD1 4.05Å; K75-I90 HydrophobicContact CG-CD1 4.18Å
76	L	95.1	Very high	91.1	Very high	32 Å²	32	74.8 Å²	74.8	17%	0.168	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	142.7	157	-169.2	67.3	0	0	0	107.7	Q63 K64 I66 E85 V86	Q63-L76 WeakPolarHBondContact CA-O 3.25Å; Q63-L76 HydrophobicContact CB-CB 4.38Å; Q63-L76 WeakPolarHBondContact CB-O 3.46Å; Q63-L76 PolarHBondContact N-O 2.96Å; K64-L76 HydrophobicContact CG-CB 4.46Å; K64-L76 PolarHBondContact O-N 3.26Å; I66-L76 HydrophobicContact CD1-CB 4.37Å; I66-L76 HydrophobicContact CG2-CB 3.8Å; L76-E85 HydrophobicContact CD1-CB 4.1Å; L76-V86 CarbonylContact C-O 3.53Å
77	A	96.6	Very high	91.2	Very high	0 Å²	0	74 Å²	74	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	148.2	173.8	0	0	0	0	0	110.8	R61 L62 E85 V86 V88	R61-A77 CarbonylContact O-C 3.54Å; R61-A77 VanDerWaalsContact O-CA 3.26Å; R61-A77 WeakPolarHBondContact O-CA 3.38Å; R61-A77 WeakPolarHBondContact O-CB 3.46Å; L62-A77 HydrophobicContact CD2-CB 3.93Å; A77-E85 CarbonylContact O-C 3.57Å; A77-E85 WeakPolarHBondContact O-CA 3.38Å; A77-V86 HydrophobicContact CB-CG2 4.18Å; A77-V86 PolarHBondContact N-O 2.91Å; A77-V86 PolarHBondContact O-N 3.43Å; A77-V88 HydrophobicContact CB-CG2 3.59Å
78	R	95.4	Very high	91.3	Very high	71 Å²	71	74.4 Å²	74.4	27%	0.268	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	122.5	173.8	-164.3	178	-56.7	-65.3	-4.7	109.7	Y60 R61 V80 G83 R84 E85	Y60-R78 WeakPolarHBondContact CA-O 3.35Å; R61-R78 PolarHBondContact N-O 2.98Å; R61-R78 PolarHBondContact O-N 3.3Å; R78-V80 PolarHBondContact O-N 2.82Å; R78-G83 WeakPolarHBondContact CD-O 3.44Å; R78-G83 WeakPolarHBondContact CG-O 3.34Å; R78-G83 PolarHBondContact NH1-O 3.3Å; R78-R84 WeakPolarHBondContact CA-O 3.16Å; R78-E85 IonicContact CZ-OE1 3.16Å; R78-E85 IonicContact NH1-OE1 2.77Å; R78-E85 PolarHBondContact NH1-OE1 2.94Å; R78-E85 IonicContact NH2-OE1 2.7Å; R78-E85 PolarHBondContact NH2-OE1 3.28Å
79	H	94.5	Very high	91.4	Very high	30 Å²	30	72.7 Å²	72.7	14%	0.139	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	117.7	171.1	-175.5	-114.8	0	0	0	109.5	N59 Y60 L81 T82 G83 R84	N59-H79 WeakPolarHBondContact CB-NE2 3.29Å; N59-H79 CarbonylContact O-C 3.54Å; N59-H79 WeakPolarHBondContact O-CA 3.47Å; N59-H79 PolarHBondContact O-CD2 3.42Å; Y60-H79 HydrophobicContact CD1-CB 3.84Å; Y60-H79 AromaticContact CD1-CD2 3.92Å; Y60-H79 HydrophobicContact CE1-CB 3.66Å; Y60-H79 AromaticContact CE1-CD2 3.5Å; Y60-H79 VanDerWaalsContact CE1-CD2 3.5Å; Y60-H79 WeakPolarHBondContact CE1-CD2 3.08Å; Y60-H79 AromaticContact CE1-CG 3.87Å; Y60-H79 AromaticContact CE2-CD2 3.97Å; Y60-H79 AromaticContact CZ-CD2 3.52Å; H79-L81 PolarHBondContact O-N 3.08Å; H79-T82 PolarHBondContact ND1-OG1 3.38Å; H79-T82 PolarHBondContact O-N 3.09Å; H79-G83 WeakPolarHBondContact O-CA 3.33Å; H79-G83 PolarHBondContact O-N 2.72Å; H79-R84 PolarHBondContact N-O 3.23Å
80	V	92.1	Very high	91.9	Very high	87 Å²	87	73.2 Å²	73.2	53%	0.527	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-44.7	-168.3	178.3	0	0	0	0	111.4	N59 R61 R78 T82	N59-V80 WeakPolarHBondContact O-CG2 3.15Å; N59-V80 PolarHBondContact O-N 2.97Å; R61-V80 HydrophobicContact CB-CG2 4.4Å; R78-V80 PolarHBondContact O-N 2.82Å; V80-T82 VanDerWaalsContact C-N 3.35Å; V80-T82 PolarHBondContact O-N 3.37Å
81	L	90.6	Very high	92.3	Very high	131 Å²	131	70 Å²	70	69%	0.686	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-16.2	-175.2	-58.6	174.7	0	0	0	114.8	H79	H79-L81 PolarHBondContact O-N 3.08Å
82	T	93.3	Very high	92.5	Very high	72 Å²	72	68 Å²	68	44%	0.442	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.5	1.2	-174.6	65.2	0	0	0	0	114.6	H79 V80 R84	H79-T82 PolarHBondContact ND1-OG1 3.38Å; H79-T82 PolarHBondContact O-N 3.09Å; V80-T82 VanDerWaalsContact C-N 3.35Å; V80-T82 PolarHBondContact O-N 3.37Å; T82-R84 PolarHBondContact O-N 2.64Å
83	G	91.4	Very high	92	Very high	37 Å²	37	75.5 Å²	75.5	38%	0.381	39%	0.386	S	S	.	.			trans	66.3	-8.4	-179.1	0	0	0	0	0	115.8	R78 H79	R78-G83 WeakPolarHBondContact CD-O 3.44Å; R78-G83 WeakPolarHBondContact CG-O 3.34Å; R78-G83 PolarHBondContact NH1-O 3.3Å; H79-G83 WeakPolarHBondContact O-CA 3.33Å; H79-G83 PolarHBondContact O-N 2.72Å
84	R	93.6	Very high	90.9	Very high	173 Å²	173	76.3 Å²	76.3	65%	0.653	40%	0.399	S	S	*	.			trans	-69	141.6	-174	-64.7	-177.4	-172.9	158.8	4.8	111.8	R78 H79 T82	R78-R84 WeakPolarHBondContact CA-O 3.16Å; H79-R84 PolarHBondContact N-O 3.23Å; T82-R84 PolarHBondContact O-N 2.64Å
85	E	95.6	Very high	89.3	Confident	103 Å²	103	81.3 Å²	81.3	48%	0.481	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	141.4	175	-62.5	-177.9	-172	0	0	110.9	L76 A77 R78	L76-E85 HydrophobicContact CD1-CB 4.1Å; A77-E85 CarbonylContact O-C 3.57Å; A77-E85 WeakPolarHBondContact O-CA 3.38Å; R78-E85 IonicContact CZ-OE1 3.16Å; R78-E85 IonicContact NH1-OE1 2.77Å; R78-E85 PolarHBondContact NH1-OE1 2.94Å; R78-E85 IonicContact NH2-OE1 2.7Å; R78-E85 PolarHBondContact NH2-OE1 3.28Å
86	V	94.8	Very high	87.7	Confident	52 Å²	52	82.5 Å²	82.5	32%	0.315	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	157.8	-179.8	-63	0	0	0	0	110.7	Y60 L76 A77 V88	Y60-V86 HydrophobicContact CD1-CG2 3.62Å; Y60-V86 HydrophobicContact CE1-CG1 4.46Å; Y60-V86 HydrophobicContact CE1-CG2 3.63Å; L76-V86 CarbonylContact C-O 3.53Å; A77-V86 HydrophobicContact CB-CG2 4.18Å; A77-V86 PolarHBondContact N-O 2.91Å; A77-V86 PolarHBondContact O-N 3.43Å; V86-V88 HydrophobicContact CG2-CG2 4.08Å
87	A	95.6	Very high	86.2	Confident	70 Å²	70	84.5 Å²	84.5	58%	0.579	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	117.9	169.1	0	0	0	0	0	110.2	I66 V74	I66-A87 HydrophobicContact CD1-CB 3.89Å; V74-A87 HydrophobicContact CG1-CB 4.08Å
88	V	93.5	Very high	84.6	Confident	34 Å²	34	89 Å²	89	21%	0.206	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	114.8	176	179.4	0	0	0	0	109	L62 V74 K75 A77 V86 I90	L62-V88 HydrophobicContact CD2-CB 4.17Å; L62-V88 HydrophobicContact CD2-CG1 4.21Å; L62-V88 HydrophobicContact CD2-CG2 4.28Å; V74-V88 CarbonylContact C-O 3.58Å; V74-V88 WeakPolarHBondContact CA-O 3.19Å; K75-V88 PolarHBondContact N-O 2.99Å; K75-V88 PolarHBondContact O-N 3.23Å; A77-V88 HydrophobicContact CB-CG2 3.59Å; V86-V88 HydrophobicContact CG2-CG2 4.08Å; V88-I90 HydrophobicContact CG1-CG1 4.08Å; V88-I90 PolarHBondContact O-N 3.43Å
89	K	93.6	Very high	83.1	Confident	144 Å²	144	89.2 Å²	89.2	63%	0.626	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	104.8	174.3	-174.8	178.2	-179.5	-178.7	0	109.7	A72 V74 I91	A72-K89 HydrophobicContact CB-CD 4.2Å; A72-K89 HydrophobicContact CB-CG 3.78Å; V74-K89 HydrophobicContact CG2-CB 4.43Å; V74-K89 HydrophobicContact CG2-CG 4.26Å; K89-I91 HydrophobicContact CG-CG1 4.42Å
90	I	90.2	Very high	81.6	Confident	56 Å²	56	91 Å²	91	29%	0.287	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	130.8	176.9	-51.6	173.1	0	0	0	108.1	L62 A72 K73 K75 V88	L62-I90 HydrophobicContact CD1-CD1 4.03Å; A72-I90 CarbonylContact C-O 3.58Å; A72-I90 VanDerWaalsContact CA-O 3.23Å; A72-I90 WeakPolarHBondContact CA-O 3.15Å; K73-I90 PolarHBondContact N-O 2.85Å; K73-I90 WeakPolarHBondContact O-CB 3.43Å; K73-I90 PolarHBondContact O-N 3.41Å; K75-I90 HydrophobicContact CD-CD1 4.05Å; K75-I90 HydrophobicContact CG-CD1 4.18Å; V88-I90 HydrophobicContact CG1-CG1 4.08Å; V88-I90 PolarHBondContact O-N 3.43Å
91	I	86.9	Confident	80.5	Confident	82 Å²	82	89.5 Å²	89.5	42%	0.421	48%	0.481	S	S	.	.			trans	-122.7	124	177.9	-64.7	174.5	0	0	0	107.3	A72 K89 K93 L96	A72-I91 HydrophobicContact CB-CG1 4.01Å; K89-I91 HydrophobicContact CG-CG1 4.42Å; I91-K93 PolarHBondContact O-N 3.05Å; I91-L96 HydrophobicContact CG2-CD1 3.46Å; I91-L96 VanDerWaalsContact CG2-CD1 3.46Å; I91-L96 HydrophobicContact CG2-CG 4.43Å
92	D	81.1	Confident	79.3	Confident	68 Å²	68	87.6 Å²	87.6	36%	0.364	47%	0.469	S	S	.	.			trans	-82.2	113.9	171	-173.3	-14.9	0	0	0	109	T94 Q95	D92-T94 VanDerWaalsContact C-N 3.31Å; D92-T94 VanDerWaalsContact CG-OG1 3.31Å; D92-T94 WeakPolarHBondContact OD1-CB 3.19Å; D92-T94 PolarHBondContact OD1-N 3.48Å; D92-T94 PolarHBondContact OD1-OG1 3.37Å; D92-T94 PolarHBondContact OD2-OG1 2.86Å; D92-Q95 HydrophobicContact CB-CB 4.36Å; D92-Q95 HydrophobicContact CB-CG 4.35Å; D92-Q95 PolarHBondContact OD2-NE2 3.14Å
93	K	75.6	Confident	78.1	Confident	177 Å²	177	90.8 Å²	90.8	77%	0.77	48%	0.477	S	S	*	.	S	Bend	trans	-74.9	-19.2	179.8	-67.4	-174	178.2	-177.2	0	113.1	I91 L96	I91-K93 PolarHBondContact O-N 3.05Å; K93-L96 PolarHBondContact O-N 3.12Å
94	T	69.4	Low	77.1	Confident	113 Å²	113	94.7 Å²	94.7	69%	0.693	49%	0.485	S	S	*	.	S	Bend	trans	-74.4	-36.7	178.6	69.4	0	0	0	0	111.2	D92 L96 N97	D92-T94 VanDerWaalsContact C-N 3.31Å; D92-T94 VanDerWaalsContact CG-OG1 3.31Å; D92-T94 WeakPolarHBondContact OD1-CB 3.19Å; D92-T94 PolarHBondContact OD1-N 3.48Å; D92-T94 PolarHBondContact OD1-OG1 3.37Å; D92-T94 PolarHBondContact OD2-OG1 2.86Å; T94-L96 PolarHBondContact O-N 3.33Å; T94-N97 PolarHBondContact O-N 3.5Å
95	Q	61.3	Low	76	Confident	143 Å²	143	90 Å²	90	67%	0.668	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-10	172.6	-65.2	178.6	55.2	0	0	113.1	D92 N97	D92-Q95 HydrophobicContact CB-CB 4.36Å; D92-Q95 HydrophobicContact CB-CG 4.35Å; D92-Q95 PolarHBondContact OD2-NE2 3.14Å; Q95-N97 VanDerWaalsContact C-N 3.31Å; Q95-N97 PolarHBondContact O-N 3.11Å
96	L	61.7	Low	74.7	Confident	58 Å²	58	86.6 Å²	86.6	30%	0.304	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	38.5	171.2	-66.5	179	0	0	0	112.5	F71 I91 K93 T94	F71-L96 HydrophobicContact CB-CD2 4.23Å; F71-L96 HydrophobicContact CD1-CD2 3.66Å; F71-L96 HydrophobicContact CE1-CD2 4.42Å; F71-L96 HydrophobicContact CG-CD2 4.21Å; I91-L96 HydrophobicContact CG2-CD1 3.46Å; I91-L96 VanDerWaalsContact CG2-CD1 3.46Å; I91-L96 HydrophobicContact CG2-CG 4.43Å; K93-L96 PolarHBondContact O-N 3.12Å; T94-L96 PolarHBondContact O-N 3.33Å
97	N	63.1	Low	73.4	Confident	74 Å²	74	89.4 Å²	89.4	40%	0.396	47%	0.465	S	S	.	.			trans	-56.6	121.5	167.2	179.7	-36.1	0	0	0	108.8	T94 Q95 T99 S100 L101	T94-N97 PolarHBondContact O-N 3.5Å; Q95-N97 VanDerWaalsContact C-N 3.31Å; Q95-N97 PolarHBondContact O-N 3.11Å; N97-T99 VanDerWaalsContact C-N 3.27Å; N97-T99 PolarHBondContact O-N 3.29Å; N97-T99 WeakPolarHBondContact OD1-CB 3.28Å; N97-T99 PolarHBondContact OD1-N 3.34Å; N97-S100 PolarHBondContact O-N 2.95Å; N97-S100 VanDerWaalsContact O-N 3.13Å; N97-L101 WeakPolarHBondContact O-CB 3.32Å; N97-L101 PolarHBondContact O-N 3.02Å
98	P	63.3	Low	72.2	Confident	95 Å²	95	89.4 Å²	89.4	62%	0.617	46%	0.455	S	S	*	.	H	α-helix	trans	-61.4	-34.5	-173.4	24.3	-34.1	0	0	0	112.5	L101 Q102	P98-L101 PolarHBondContact O-N 3.44Å; P98-Q102 VanDerWaalsContact O-CB 3.29Å; P98-Q102 WeakPolarHBondContact O-CB 3.48Å; P98-Q102 PolarHBondContact O-N 2.87Å
99	T	64.1	Low	70.6	Confident	75 Å²	75	97.9 Å²	97.9	46%	0.46	48%	0.483	S	S	.	.	H	α-helix	trans	-68.4	-38.4	178	-46.9	0	0	0	0	111.7	N97 K103	N97-T99 VanDerWaalsContact C-N 3.27Å; N97-T99 PolarHBondContact O-N 3.29Å; N97-T99 WeakPolarHBondContact OD1-CB 3.28Å; N97-T99 PolarHBondContact OD1-N 3.34Å; T99-K103 VanDerWaalsContact O-CG 3.31Å; T99-K103 WeakPolarHBondContact O-CG 3.35Å; T99-K103 PolarHBondContact O-N 2.71Å; T99-K103 VanDerWaalsContact O-N 3.12Å
100	S	63.8	Low	69.4	Low	67 Å²	67	98 Å²	98	47%	0.469	48%	0.48	S	S	.	.	H	α-helix	trans	-71.3	-40	174.3	-57.2	0	0	0	0	111.5	N97 K103 Q104	N97-S100 PolarHBondContact O-N 2.95Å; N97-S100 VanDerWaalsContact O-N 3.13Å; S100-K103 PolarHBondContact O-N 3.42Å; S100-Q104 VanDerWaalsContact O-CB 3.3Å; S100-Q104 WeakPolarHBondContact O-CB 3.27Å; S100-Q104 PolarHBondContact O-N 2.66Å
101	L	67.4	Low	68.1	Low	56 Å²	56	98.1 Å²	98.1	29%	0.293	48%	0.479	S	S	.	.	H	α-helix	trans	-63.5	-44.3	176	180	60.2	0	0	0	111.3	F71 N97 P98 Q104 I105	F71-L101 HydrophobicContact CE1-CD1 3.78Å; F71-L101 HydrophobicContact CZ-CD1 3.9Å; N97-L101 WeakPolarHBondContact O-CB 3.32Å; N97-L101 PolarHBondContact O-N 3.02Å; P98-L101 PolarHBondContact O-N 3.44Å; L101-Q104 PolarHBondContact O-N 2.98Å; L101-I105 HydrophobicContact CD1-CD1 3.91Å; L101-I105 HydrophobicContact CD1-CG1 4.2Å; L101-I105 HydrophobicContact CG-CD1 3.82Å; L101-I105 HydrophobicContact CG-CG1 4.48Å; L101-I105 VanDerWaalsContact O-CB 3.28Å; L101-I105 WeakPolarHBondContact O-CB 3.42Å; L101-I105 VanDerWaalsContact O-CG1 3.25Å; L101-I105 WeakPolarHBondContact O-CG1 3.24Å; L101-I105 PolarHBondContact O-N 2.84Å
102	Q	66.1	Low	67.1	Low	91 Å²	91	95.3 Å²	95.3	43%	0.425	47%	0.465	S	S	.	.	H	α-helix	trans	-58.9	-50.9	174.6	-178.3	179.8	12.9	0	0	111.1	P98 Q104 I105 M106	P98-Q102 VanDerWaalsContact O-CB 3.29Å; P98-Q102 WeakPolarHBondContact O-CB 3.48Å; P98-Q102 PolarHBondContact O-N 2.87Å; Q102-Q104 VanDerWaalsContact C-N 3.27Å; Q102-Q104 PolarHBondContact O-N 2.75Å; Q102-I105 WeakPolarHBondContact O-CB 3.17Å; Q102-I105 PolarHBondContact O-N 2.68Å; Q102-M106 HydrophobicContact CG-CG 4.46Å; Q102-M106 HydrophobicContact CG-SD 3.6Å; Q102-M106 WeakPolarHBondContact O-CB 3.24Å; Q102-M106 VanDerWaalsContact O-CG 3.27Å; Q102-M106 WeakPolarHBondContact O-CG 3.46Å; Q102-M106 PolarHBondContact O-N 2.85Å
103	K	67.8	Low	66.4	Low	139 Å²	139	97 Å²	97	60%	0.604	48%	0.478	S	S	*	.	H	α-helix	trans	-60	-35.3	176.6	-72.9	175.3	179.4	-175.1	0	112.9	T99 S100 K107	T99-K103 VanDerWaalsContact O-CG 3.31Å; T99-K103 WeakPolarHBondContact O-CG 3.35Å; T99-K103 PolarHBondContact O-N 2.71Å; T99-K103 VanDerWaalsContact O-N 3.12Å; S100-K103 PolarHBondContact O-N 3.42Å; K103-K107 PolarHBondContact O-N 2.87Å
104	Q	69.8	Low	65.7	Low	119 Å²	119	91.8 Å²	91.8	56%	0.556	47%	0.474	S	S	*	.	H	α-helix	trans	-74.8	-34	177.6	-173.3	59	70.5	0	0	113	S100 L101 Q102 D108	S100-Q104 VanDerWaalsContact O-CB 3.3Å; S100-Q104 WeakPolarHBondContact O-CB 3.27Å; S100-Q104 PolarHBondContact O-N 2.66Å; L101-Q104 PolarHBondContact O-N 2.98Å; Q102-Q104 VanDerWaalsContact C-N 3.27Å; Q102-Q104 PolarHBondContact O-N 2.75Å; Q104-D108 PolarHBondContact O-N 3.42Å
105	I	71.4	Confident	65.2	Low	73 Å²	73	91.2 Å²	91.2	37%	0.374	46%	0.464	S	S	.	.	H	α-helix	trans	-66.4	-49.1	173.8	-81.3	173.7	0	0	0	109.9	L101 Q102 K107 D108 M111	L101-I105 HydrophobicContact CD1-CD1 3.91Å; L101-I105 HydrophobicContact CD1-CG1 4.2Å; L101-I105 HydrophobicContact CG-CD1 3.82Å; L101-I105 HydrophobicContact CG-CG1 4.48Å; L101-I105 VanDerWaalsContact O-CB 3.28Å; L101-I105 WeakPolarHBondContact O-CB 3.42Å; L101-I105 VanDerWaalsContact O-CG1 3.25Å; L101-I105 WeakPolarHBondContact O-CG1 3.24Å; L101-I105 PolarHBondContact O-N 2.84Å; Q102-I105 WeakPolarHBondContact O-CB 3.17Å; Q102-I105 PolarHBondContact O-N 2.68Å; I105-K107 PolarHBondContact O-N 2.88Å; I105-D108 VanDerWaalsContact O-CB 3.27Å; I105-D108 WeakPolarHBondContact O-CB 3.44Å; I105-D108 PolarHBondContact O-N 3.47Å; I105-M111 HydrophobicContact CB-CE 4.24Å; I105-M111 HydrophobicContact CG2-CE 3.59Å; I105-M111 HydrophobicContact CG2-SD 3.46Å; I105-M111 WeakPolarHBondContact CG2-SD 3.27Å; I105-M111 WeakPolarHBondContact O-CE 3.35Å
106	M	68.9	Low	65.2	Low	32 Å²	32	92.7 Å²	92.7	16%	0.158	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-8.6	-178.2	-62.4	174.9	68	0	0	114.2	Q102 N112 L120 K121 P122	Q102-M106 HydrophobicContact CG-CG 4.46Å; Q102-M106 HydrophobicContact CG-SD 3.6Å; Q102-M106 WeakPolarHBondContact O-CB 3.24Å; Q102-M106 VanDerWaalsContact O-CG 3.27Å; Q102-M106 WeakPolarHBondContact O-CG 3.46Å; Q102-M106 PolarHBondContact O-N 2.85Å; M106-N112 PolarHBondContact O-ND2 3.31Å; M106-N112 PolarHBondContact O-OD1 2.91Å; M106-L120 HydrophobicContact CE-CB 4.15Å; M106-L120 WeakPolarHBondContact CE-O 3.43Å; M106-K121 VanDerWaalsContact CE-O 3.26Å; M106-K121 WeakPolarHBondContact CE-O 3.42Å; M106-P122 HydrophobicContact CE-CB 4.48Å; M106-P122 HydrophobicContact CE-CG 4.16Å; M106-P122 VanDerWaalsContact CE-N 3.27Å; M106-P122 HydrophobicContact SD-CG 4.35Å
107	K	66.3	Low	65	Low	112 Å²	112	99.6 Å²	99.6	49%	0.487	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	8.2	169.3	-72.8	179.1	176	-79.1	0	113.1	K103 I105 E119	K103-K107 PolarHBondContact O-N 2.87Å; I105-K107 PolarHBondContact O-N 2.88Å; K107-E119 IonicContact NZ-OE1 2.63Å; K107-E119 PolarHBondContact NZ-OE1 3.01Å; K107-E119 IonicContact NZ-OE2 2.66Å; K107-E119 PolarHBondContact NZ-OE2 3.39Å
108	D	70.5	Confident	65	Low	69 Å²	69	101.5 Å²	101.5	37%	0.369	51%	0.508	S	S	.	.			trans	-85	130.6	-179.7	-159.8	-10.4	0	0	0	111.4	Q104 I105 W110 M111 N112	Q104-D108 PolarHBondContact O-N 3.42Å; I105-D108 VanDerWaalsContact O-CB 3.27Å; I105-D108 WeakPolarHBondContact O-CB 3.44Å; I105-D108 PolarHBondContact O-N 3.47Å; D108-W110 VanDerWaalsContact CG-NE1 3.31Å; D108-W110 PolarHBondContact O-N 2.81Å; D108-W110 PolarHBondContact OD2-NE1 3.06Å; D108-M111 HydrophobicContact CB-CE 4.04Å; D108-M111 PolarHBondContact O-N 2.83Å; D108-N112 PolarHBondContact O-N 2.57Å
109	R	61	Low	64.9	Low	213 Å²	213	102.5 Å²	102.5	80%	0.804	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	5.4	-169.2	-71.4	-177.5	-71.8	-169.1	-4.7	115.1	V113	R109-V113 WeakPolarHBondContact O-CG2 3.49Å
110	W	68.6	Low	64.7	Low	147 Å²	147	102 Å²	102	56%	0.557	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-13.9	169.4	70.4	-80.8	0	0	0	113.5	D108	D108-W110 VanDerWaalsContact CG-NE1 3.31Å; D108-W110 PolarHBondContact O-N 2.81Å; D108-W110 PolarHBondContact OD2-NE1 3.06Å
111	M	61.1	Low	64.7	Low	57 Å²	57	105.8 Å²	105.8	28%	0.281	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-36	168.7	-95.7	162.6	-81.2	0	0	111.7	I105 D108 V113 L120	I105-M111 HydrophobicContact CB-CE 4.24Å; I105-M111 HydrophobicContact CG2-CE 3.59Å; I105-M111 HydrophobicContact CG2-SD 3.46Å; I105-M111 WeakPolarHBondContact CG2-SD 3.27Å; I105-M111 WeakPolarHBondContact O-CE 3.35Å; D108-M111 HydrophobicContact CB-CE 4.04Å; D108-M111 PolarHBondContact O-N 2.83Å; M111-V113 VanDerWaalsContact C-N 3.27Å; M111-V113 PolarHBondContact O-N 3.24Å; M111-L120 HydrophobicContact CB-CD1 4.27Å
112	N	67.9	Low	64.7	Low	23 Å²	23	106.8 Å²	106.8	12%	0.123	52%	0.517	C	S	.	.	S	Bend	trans	-90	18.1	-174.2	-55.6	5.1	0	0	0	113	M106 D108 G114 H115 L120	M106-N112 PolarHBondContact O-ND2 3.31Å; M106-N112 PolarHBondContact O-OD1 2.91Å; D108-N112 PolarHBondContact O-N 2.57Å; N112-G114 PolarHBondContact O-N 2.94Å; N112-H115 CarbonylContact O-C 3.6Å; N112-H115 PolarHBondContact O-N 3.36Å; N112-L120 VanDerWaalsContact OD1-CD1 3.27Å; N112-L120 WeakPolarHBondContact OD1-CD1 3.38Å
113	V	66.1	Low	64.7	Low	103 Å²	103	111.5 Å²	111.5	62%	0.624	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	113.4	178.3	-178.2	0	0	0	0	108.8	R109 M111	R109-V113 WeakPolarHBondContact O-CG2 3.49Å; M111-V113 VanDerWaalsContact C-N 3.27Å; M111-V113 PolarHBondContact O-N 3.24Å
114	G	60.2	Low	64.8	Low	68 Å²	68	110.6 Å²	110.6	70%	0.701	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	-3.8	-171.3	0	0	0	0	0	114.7	N112	N112-G114 PolarHBondContact O-N 2.94Å
115	H	58.1	Low	64.2	Low	102 Å²	102	112.1 Å²	112.1	47%	0.472	55%	0.545	S	S	.	.			trans	-118.1	56.7	170	-73	-87.7	0	0	0	109.3	N112 L120	N112-H115 CarbonylContact O-C 3.6Å; N112-H115 PolarHBondContact O-N 3.36Å; H115-L120 HydrophobicContact CB-CD2 4.45Å
116	E	61.1	Low	64.2	Low	174 Å²	174	113 Å²	113	81%	0.813	56%	0.555	S	S	*	*	S	Bend	trans	-83.7	-22.6	-174.8	-61	-172.1	-172	0	0	112.7
117	E	58.9	Low	64.2	Low	203 Å²	203	119 Å²	119	95%	0.949	59%	0.588	S	S	*	*	S	Bend	trans	-98.4	-16.6	178.5	-62.3	-172.6	-177.2	0	0	114.1
118	E	63.2	Low	64.1	Low	114 Å²	114	117.7 Å²	117.7	53%	0.533	59%	0.591	S	S	.	*	S	Bend	trans	-126.8	107.5	175.1	-178.5	161.7	-143.7	0	0	111.2	L120 K121	E118-L120 PolarHBondContact O-N 3.06Å; E118-K121 IonicContact OE1-NZ 3.69Å; E118-K121 PolarHBondContact OE1-NZ 3.36Å
119	E	61.7	Low	64.1	Low	115 Å²	115	118.9 Å²	118.9	54%	0.537	60%	0.598	S	S	.	*			trans	-58.5	128	172.1	-69.9	-155	133	0	0	110.7	K107 K121	K107-E119 IonicContact NZ-OE1 2.63Å; K107-E119 PolarHBondContact NZ-OE1 3.01Å; K107-E119 IonicContact NZ-OE2 2.66Å; K107-E119 PolarHBondContact NZ-OE2 3.39Å; E119-K121 PolarHBondContact O-N 3.16Å
120	L	59.2	Low	64.9	Low	66 Å²	66	111 Å²	111	35%	0.346	57%	0.569	S	S	.	*			trans	-56.1	109.9	176	-65.8	-177.3	0	0	0	110.7	M106 M111 N112 H115 E118	M106-L120 HydrophobicContact CE-CB 4.15Å; M106-L120 WeakPolarHBondContact CE-O 3.43Å; M111-L120 HydrophobicContact CB-CD1 4.27Å; N112-L120 VanDerWaalsContact OD1-CD1 3.27Å; N112-L120 WeakPolarHBondContact OD1-CD1 3.38Å; H115-L120 HydrophobicContact CB-CD2 4.45Å; E118-L120 PolarHBondContact O-N 3.06Å
121	K	62.7	Low	65.4	Low	145 Å²	145	110 Å²	110	63%	0.63	58%	0.575	S	S	*	*			trans	-85.1	151.2	171	-65.4	154	-163.9	153	0	109.4	M106 E118 E119 Y123	M106-K121 VanDerWaalsContact CE-O 3.26Å; M106-K121 WeakPolarHBondContact CE-O 3.42Å; E118-K121 IonicContact OE1-NZ 3.69Å; E118-K121 PolarHBondContact OE1-NZ 3.36Å; E119-K121 PolarHBondContact O-N 3.16Å; K121-Y123 PolarHBondContact O-N 3.41Å
122	P	68.6	Low	66.6	Low	78 Å²	78	109.3 Å²	109.3	51%	0.506	57%	0.572	S	S	.	*			trans	-55	135.9	170.2	-24.1	35	0	0	0	110	M106 T124	M106-P122 HydrophobicContact CE-CB 4.48Å; M106-P122 HydrophobicContact CE-CG 4.16Å; M106-P122 VanDerWaalsContact CE-N 3.27Å; M106-P122 HydrophobicContact SD-CG 4.35Å; P122-T124 PolarHBondContact O-N 2.87Å; P122-T124 VanDerWaalsContact O-N 3.15Å
123	Y	66.3	Low	67.6	Low	190 Å²	190	112.6 Å²	112.6	75%	0.745	59%	0.593	S	S	*	*			trans	-64.8	115.8	174.7	177.8	-96.2	0	0	0	109.4	K121 E125 P126	K121-Y123 PolarHBondContact O-N 3.41Å; Y123-E125 HydrophobicContact CE1-CB 4.05Å; Y123-P126 WeakPolarHBondContact OH-CD 3.47Å
124	T	68.3	Low	68.6	Low	120 Å²	120	115.5 Å²	115.5	74%	0.736	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-92.9	126.2	164.6	-53.5	0	0	0	0	107.1	P122	P122-T124 PolarHBondContact O-N 2.87Å; P122-T124 VanDerWaalsContact O-N 3.15Å
125	E	59.1	Low	70	Confident	151 Å²	151	115 Å²	115	71%	0.706	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-64.7	128.8	171.9	-171.2	164.9	-164.2	0	0	108.8	Y123	Y123-E125 HydrophobicContact CE1-CB 4.05Å
126	P	71.3	Confident	71.6	Confident	90 Å²	90	110.6 Å²	110.6	58%	0.584	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-61.2	139.6	177.7	-23.2	33.6	0	0	0	111.5	Y123 P128	Y123-P126 WeakPolarHBondContact OH-CD 3.47Å; P126-P128 WeakPolarHBondContact O-CD 3.29Å
127	D	67.4	Low	73	Confident	159 Å²	159	106.6 Å²	106.6	85%	0.85	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-55.9	125.5	177.1	-65	-64	0	0	0	110.7	D129	D127-D129 PolarHBondContact O-N 2.88Å
128	P	65.9	Low	74.6	Confident	84 Å²	84	100.7 Å²	100.7	55%	0.545	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-66	130.5	-178.1	-22	33	0	0	0	112.2	P126 F130	P126-P128 WeakPolarHBondContact O-CD 3.29Å; P128-F130 HydrophobicContact CB-CE1 4.28Å; P128-F130 HydrophobicContact CB-CE2 4Å; P128-F130 HydrophobicContact CB-CZ 3.8Å; P128-F130 HydrophobicContact CG-CZ 4.28Å; P128-F130 WeakPolarHBondContact O-CD2 3.3Å; P128-F130 WeakPolarHBondContact O-CE2 3.27Å; P128-F130 PolarHBondContact O-N 3.2Å
129	D	69.4	Low	76.1	Confident	95 Å²	95	95.2 Å²	95.2	51%	0.508	49%	0.487	S	S	.	.			trans	-76	114.4	174.4	-171.9	9.7	0	0	0	111.4	D127 N131 Y165	D127-D129 PolarHBondContact O-N 2.88Å; D129-N131 WeakPolarHBondContact OD1-CB 3.26Å; D129-N131 PolarHBondContact OD1-N 3.01Å; D129-N131 PolarHBondContact OD1-ND2 3.4Å; D129-Y165 PolarHBondContact O-OH 3.43Å
130	F	79.1	Confident	77.6	Confident	46 Å²	46	92.4 Å²	92.4	20%	0.202	48%	0.478	C	S	.	.			trans	-94.3	4.6	178.4	-64.5	-64.5	0	0	0	113.5	P128 L153 M162 Y165	P128-F130 HydrophobicContact CB-CE1 4.28Å; P128-F130 HydrophobicContact CB-CE2 4Å; P128-F130 HydrophobicContact CB-CZ 3.8Å; P128-F130 HydrophobicContact CG-CZ 4.28Å; P128-F130 WeakPolarHBondContact O-CD2 3.3Å; P128-F130 WeakPolarHBondContact O-CE2 3.27Å; P128-F130 PolarHBondContact O-N 3.2Å; F130-L153 HydrophobicContact CB-CB 4.33Å; F130-L153 HydrophobicContact CB-CD1 4.45Å; F130-L153 HydrophobicContact CD1-CD2 3.84Å; F130-L153 HydrophobicContact CE1-CD2 4.33Å; F130-M162 HydrophobicContact CE1-CE 4.01Å; F130-M162 HydrophobicContact CZ-CE 3.91Å; F130-Y165 VanDerWaalsContact CA-OH 3.27Å; F130-Y165 WeakPolarHBondContact CA-OH 3.4Å; F130-Y165 HydrophobicContact CD1-CD1 4.04Å; F130-Y165 AromaticContact CD1-CE1 3.68Å; F130-Y165 HydrophobicContact CD1-CE1 3.68Å; F130-Y165 HydrophobicContact CE1-CD1 4.47Å; F130-Y165 HydrophobicContact CE1-CE1 4.38Å; F130-Y165 PolarHBondContact O-OH 2.89Å
131	N	78.6	Confident	79.2	Confident	127 Å²	127	94.8 Å²	94.8	68%	0.679	50%	0.495	S	S	*	.			trans	-99.1	17.9	-177.8	-53.3	-84.5	0	0	0	114.1	D129 T133	D129-N131 WeakPolarHBondContact OD1-CB 3.26Å; D129-N131 PolarHBondContact OD1-N 3.01Å; D129-N131 PolarHBondContact OD1-ND2 3.4Å; N131-T133 VanDerWaalsContact C-N 3.33Å; N131-T133 PolarHBondContact O-N 3.06Å
132	D	86.4	Confident	80.6	Confident	43 Å²	43	93.4 Å²	93.4	23%	0.23	49%	0.492	C	S	.	.			trans	-74.2	86.9	-179.7	-167.4	-24.8	0	0	0	111	K134 R135 I136 Y165	D132-K134 PolarHBondContact O-N 3.06Å; D132-K134 WeakPolarHBondContact OD1-CB 3.42Å; D132-K134 PolarHBondContact OD1-N 2.77Å; D132-R135 HydrophobicContact CB-CB 4.24Å; D132-R135 HydrophobicContact CB-CG 4.06Å; D132-R135 PolarHBondContact O-N 3.44Å; D132-R135 PolarHBondContact OD1-N 2.77Å; D132-R135 IonicContact OD2-CZ 2.7Å; D132-R135 IonicContact OD2-NE 3.78Å; D132-R135 PolarHBondContact OD2-NE 3.42Å; D132-R135 IonicContact OD2-NH2 2.82Å; D132-R135 PolarHBondContact OD2-NH2 3.29Å; D132-I136 PolarHBondContact O-N 3.37Å; D132-I136 VanDerWaalsContact O-N 3.11Å; D132-Y165 HydrophobicContact CB-CE2 4.31Å; D132-Y165 VanDerWaalsContact CB-OH 3.24Å; D132-Y165 WeakPolarHBondContact CB-OH 3.5Å; D132-Y165 PolarHBondContact N-OH 2.8Å
133	T	87.3	Confident	81.7	Confident	91 Å²	91	92.8 Å²	92.8	56%	0.558	50%	0.5	S	S	*	.	H	α-helix	trans	-48.2	-29.5	176.5	-55.3	0	0	0	0	113.1	N131 D137	N131-T133 VanDerWaalsContact C-N 3.33Å; N131-T133 PolarHBondContact O-N 3.06Å; T133-D137 WeakPolarHBondContact O-CB 3.39Å; T133-D137 PolarHBondContact O-N 3.23Å
134	K	88.4	Confident	83	Confident	164 Å²	164	85.8 Å²	85.8	71%	0.713	47%	0.474	S	S	*	.	H	α-helix	trans	-76.4	-37.4	179.4	-58.4	174.3	-178.9	172.5	0	111.8	D132 D137 I138	D132-K134 PolarHBondContact O-N 3.06Å; D132-K134 WeakPolarHBondContact OD1-CB 3.42Å; D132-K134 PolarHBondContact OD1-N 2.77Å; K134-D137 PolarHBondContact O-N 3.04Å; K134-I138 WeakPolarHBondContact O-CD1 3.43Å; K134-I138 VanDerWaalsContact O-CG1 3.25Å; K134-I138 WeakPolarHBondContact O-CG1 3.18Å; K134-I138 PolarHBondContact O-N 2.91Å
135	R	90.3	Very high	84.2	Confident	58 Å²	58	82.6 Å²	82.6	22%	0.219	46%	0.46	C	S	.	.	H	α-helix	trans	-64.9	-42.8	171.3	-67.9	177.5	-138.3	164.1	13.5	110.9	D132 D137 I138 M139 Y165 L168	D132-R135 HydrophobicContact CB-CB 4.24Å; D132-R135 HydrophobicContact CB-CG 4.06Å; D132-R135 PolarHBondContact O-N 3.44Å; D132-R135 PolarHBondContact OD1-N 2.77Å; D132-R135 IonicContact OD2-CZ 2.7Å; D132-R135 IonicContact OD2-NE 3.78Å; D132-R135 PolarHBondContact OD2-NE 3.42Å; D132-R135 IonicContact OD2-NH2 2.82Å; D132-R135 PolarHBondContact OD2-NH2 3.29Å; R135-D137 VanDerWaalsContact C-N 3.3Å; R135-D137 PolarHBondContact O-N 2.79Å; R135-I138 PolarHBondContact O-N 3.35Å; R135-M139 VanDerWaalsContact O-CG 3.29Å; R135-M139 WeakPolarHBondContact O-CG 3.45Å; R135-M139 PolarHBondContact O-N 2.81Å; R135-Y165 HydrophobicContact CB-CD2 3.74Å; R135-Y165 HydrophobicContact CB-CE2 3.59Å; R135-Y165 HydrophobicContact CG-CE2 4.36Å; R135-L168 HydrophobicContact CG-CB 4.21Å
136	I	90.8	Very high	85.8	Confident	9 Å²	9	80.1 Å²	80.1	5%	0.046	44%	0.444	C	S	.	.	H	α-helix	trans	-59.4	-43.1	175.6	-58.2	173.8	0	0	0	110.2	D132 M139 V140 R146 I149 Y165	D132-I136 PolarHBondContact O-N 3.37Å; D132-I136 VanDerWaalsContact O-N 3.11Å; I136-M139 PolarHBondContact O-N 2.75Å; I136-V140 WeakPolarHBondContact O-CG2 3.41Å; I136-V140 PolarHBondContact O-N 3.31Å; I136-R146 HydrophobicContact CG2-CG 3.96Å; I136-I149 HydrophobicContact CG1-CG2 4.04Å; I136-I149 HydrophobicContact CG2-CD1 4.02Å; I136-I149 HydrophobicContact CG2-CG2 4.18Å; I136-Y165 HydrophobicContact CG1-CD2 4.49Å; I136-Y165 HydrophobicContact CG1-CE2 4.16Å
137	D	91.3	Very high	86.9	Confident	91 Å²	91	81.8 Å²	81.8	49%	0.487	45%	0.448	S	S	.	.	H	α-helix	trans	-66.4	-39.8	178.2	-156.3	60.7	0	0	0	113.2	T133 K134 R135 M139 V140 T141	T133-D137 WeakPolarHBondContact O-CB 3.39Å; T133-D137 PolarHBondContact O-N 3.23Å; K134-D137 PolarHBondContact O-N 3.04Å; R135-D137 VanDerWaalsContact C-N 3.3Å; R135-D137 PolarHBondContact O-N 2.79Å; D137-M139 VanDerWaalsContact C-N 3.33Å; D137-M139 PolarHBondContact O-N 3.16Å; D137-V140 PolarHBondContact O-N 3.31Å; D137-T141 WeakPolarHBondContact O-CB 3.34Å; D137-T141 PolarHBondContact O-N 3.32Å; D137-T141 PolarHBondContact O-OG1 3.01Å
138	I	92.3	Very high	88.1	Confident	78 Å²	78	78.7 Å²	78.7	40%	0.4	43%	0.428	S	S	.	.	H	α-helix	trans	-62	-41.3	171.8	-69	163	0	0	0	110.8	K134 R135 T141 M142 L168	K134-I138 WeakPolarHBondContact O-CD1 3.43Å; K134-I138 VanDerWaalsContact O-CG1 3.25Å; K134-I138 WeakPolarHBondContact O-CG1 3.18Å; K134-I138 PolarHBondContact O-N 2.91Å; R135-I138 PolarHBondContact O-N 3.35Å; I138-T141 CarbonylContact O-C 3.59Å; I138-T141 WeakPolarHBondContact O-CB 3.27Å; I138-T141 PolarHBondContact O-N 3.29Å; I138-M142 HydrophobicContact CG2-CE 3.82Å; I138-M142 HydrophobicContact CG2-SD 4.32Å; I138-M142 WeakPolarHBondContact O-CG 3.34Å; I138-M142 PolarHBondContact O-N 3.17Å; I138-L168 HydrophobicContact CB-CD1 4.39Å; I138-L168 HydrophobicContact CG2-CD1 3.85Å; I138-L168 HydrophobicContact CG2-CD2 3.9Å
139	M	93.6	Very high	89.4	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-69.4	-38.9	177.8	-71.3	171.9	71.7	0	0	112.8	R135 I136 D137 T141 M142 G143 F144 I149 V161 T164 Y165 L168	R135-M139 VanDerWaalsContact O-CG 3.29Å; R135-M139 WeakPolarHBondContact O-CG 3.45Å; R135-M139 PolarHBondContact O-N 2.81Å; I136-M139 PolarHBondContact O-N 2.75Å; D137-M139 VanDerWaalsContact C-N 3.33Å; D137-M139 PolarHBondContact O-N 3.16Å; M139-T141 VanDerWaalsContact C-N 3.25Å; M139-T141 PolarHBondContact O-N 3.37Å; M139-M142 CarbonylContact O-C 3.58Å; M139-M142 WeakPolarHBondContact O-CA 3.45Å; M139-M142 WeakPolarHBondContact O-CB 3.3Å; M139-M142 PolarHBondContact O-N 3.46Å; M139-G143 PolarHBondContact O-N 3.1Å; M139-G143 VanDerWaalsContact O-N 3.15Å; M139-F144 HydrophobicContact CB-CB 4.36Å; M139-F144 HydrophobicContact CB-CD2 4.02Å; M139-F144 HydrophobicContact CE-CD2 4.35Å; M139-F144 HydrophobicContact CE-CG 4.5Å; M139-F144 HydrophobicContact CG-CD2 4.44Å; M139-F144 WeakPolarHBondContact O-CD2 3.15Å; M139-F144 PolarHBondContact O-N 2.84Å; M139-F144 VanDerWaalsContact O-N 3.08Å; M139-I149 HydrophobicContact CB-CD1 3.55Å; M139-I149 HydrophobicContact CB-CG1 4.36Å; M139-I149 HydrophobicContact CE-CD1 4.36Å; M139-I149 HydrophobicContact CE-CG1 3.94Å; M139-I149 HydrophobicContact CE-CG2 4.15Å; M139-I149 HydrophobicContact SD-CG2 4.27Å; M139-V161 HydrophobicContact CE-CB 4.47Å; M139-V161 HydrophobicContact CE-CG1 3.56Å; M139-V161 WeakPolarHBondContact CE-O 3.28Å; M139-T164 HydrophobicContact CE-CG2 4.33Å; M139-T164 HydrophobicContact CG-CG2 4.17Å; M139-Y165 VanDerWaalsContact SD-CA 3.57Å; M139-Y165 HydrophobicContact SD-CD2 3.94Å; M139-Y165 HydrophobicContact SD-CG 4.28Å; M139-L168 HydrophobicContact CG-CD1 3.42Å; M139-L168 VanDerWaalsContact CG-CD1 3.42Å; M139-L168 HydrophobicContact SD-CD1 4.17Å
140	V	93.7	Very high	90.4	Very high	56 Å²	56	72.9 Å²	72.9	34%	0.339	39%	0.392	S	S	.	.	H	α-helix	trans	-60.6	-39.2	170.5	170.6	0	0	0	0	110.4	I136 D137 M142 G143 F144 R146 I149	I136-V140 WeakPolarHBondContact O-CG2 3.41Å; I136-V140 PolarHBondContact O-N 3.31Å; D137-V140 PolarHBondContact O-N 3.31Å; V140-M142 VanDerWaalsContact C-N 3.26Å; V140-M142 PolarHBondContact O-N 3.08Å; V140-G143 PolarHBondContact O-N 2.82Å; V140-F144 WeakPolarHBondContact CA-O 2.95Å; V140-R146 HydrophobicContact CG2-CB 3.9Å; V140-R146 HydrophobicContact CG2-CG 4.15Å; V140-I149 HydrophobicContact CG2-CD1 3.87Å
141	T	93.1	Very high	91	Very high	116 Å²	116	74 Å²	74	71%	0.712	40%	0.4	S	S	*	.	H	α-helix	trans	-65.5	-27.2	173.1	-55	0	0	0	0	112.9	D137 I138 M139 G143	D137-T141 WeakPolarHBondContact O-CB 3.34Å; D137-T141 PolarHBondContact O-N 3.32Å; D137-T141 PolarHBondContact O-OG1 3.01Å; I138-T141 CarbonylContact O-C 3.59Å; I138-T141 WeakPolarHBondContact O-CB 3.27Å; I138-T141 PolarHBondContact O-N 3.29Å; M139-T141 VanDerWaalsContact C-N 3.25Å; M139-T141 PolarHBondContact O-N 3.37Å; T141-G143 VanDerWaalsContact C-N 3.3Å
142	M	91.4	Very high	91.7	Very high	115 Å²	115	68 Å²	68	57%	0.567	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-7.3	171.9	-69	173.4	174.3	0	0	113.7	I138 M139 V140 F144 T164 L168	I138-M142 HydrophobicContact CG2-CE 3.82Å; I138-M142 HydrophobicContact CG2-SD 4.32Å; I138-M142 WeakPolarHBondContact O-CG 3.34Å; I138-M142 PolarHBondContact O-N 3.17Å; M139-M142 CarbonylContact O-C 3.58Å; M139-M142 WeakPolarHBondContact O-CA 3.45Å; M139-M142 WeakPolarHBondContact O-CB 3.3Å; M139-M142 PolarHBondContact O-N 3.46Å; V140-M142 VanDerWaalsContact C-N 3.26Å; V140-M142 PolarHBondContact O-N 3.08Å; M142-F144 HydrophobicContact CB-CD2 4.08Å; M142-F144 HydrophobicContact CB-CE2 4.19Å; M142-T164 HydrophobicContact SD-CG2 4.36Å; M142-L168 HydrophobicContact CE-CD2 4.13Å; M142-L168 HydrophobicContact SD-CD1 4.43Å
143	G	91.4	Very high	91.9	Very high	66 Å²	66	66.3 Å²	66.3	68%	0.68	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.7	3.1	176.6	0	0	0	0	0	115.9	M139 V140 T141	M139-G143 PolarHBondContact O-N 3.1Å; M139-G143 VanDerWaalsContact O-N 3.15Å; V140-G143 PolarHBondContact O-N 2.82Å; T141-G143 VanDerWaalsContact C-N 3.3Å
144	F	93.8	Very high	92	Very high	43 Å²	43	68.3 Å²	68.3	19%	0.189	37%	0.366	C	S	.	.			trans	-73.8	139.3	174.6	-65.5	-77.3	0	0	0	111.2	M139 V140 M142 I149 E160 V161 T164	M139-F144 HydrophobicContact CB-CB 4.36Å; M139-F144 HydrophobicContact CB-CD2 4.02Å; M139-F144 HydrophobicContact CE-CD2 4.35Å; M139-F144 HydrophobicContact CE-CG 4.5Å; M139-F144 HydrophobicContact CG-CD2 4.44Å; M139-F144 WeakPolarHBondContact O-CD2 3.15Å; M139-F144 PolarHBondContact O-N 2.84Å; M139-F144 VanDerWaalsContact O-N 3.08Å; V140-F144 WeakPolarHBondContact CA-O 2.95Å; M142-F144 HydrophobicContact CB-CD2 4.08Å; M142-F144 HydrophobicContact CB-CE2 4.19Å; F144-I149 HydrophobicContact CB-CD1 3.91Å; F144-I149 HydrophobicContact CB-CG1 3.91Å; F144-E160 HydrophobicContact CE1-CG 4.5Å; F144-E160 HydrophobicContact CZ-CG 4.47Å; F144-V161 HydrophobicContact CD1-CG1 4.32Å; F144-V161 HydrophobicContact CD1-CG2 3.85Å; F144-V161 HydrophobicContact CE1-CG2 4.02Å; F144-T164 HydrophobicContact CE2-CG2 3.96Å; F144-T164 HydrophobicContact CZ-CG2 4.44Å
145	A	94.4	Very high	92	Very high	53 Å²	53	65.2 Å²	65.2	44%	0.438	36%	0.357	S	S	.	.			trans	-72.4	136	179.5	0	0	0	0	0	110.8	D147 E148 I149	A145-D147 VanDerWaalsContact C-N 3.27Å; A145-D147 PolarHBondContact O-N 2.99Å; A145-E148 HydrophobicContact CB-CB 3.9Å; A145-E148 PolarHBondContact N-OE2 3.38Å; A145-E148 WeakPolarHBondContact O-CB 3.28Å; A145-E148 PolarHBondContact O-N 3.21Å; A145-E148 VanDerWaalsContact O-N 3.1Å; A145-I149 WeakPolarHBondContact O-CG1 3.34Å; A145-I149 PolarHBondContact O-N 3.02Å
146	R	92.6	Very high	91.8	Very high	98 Å²	98	66.9 Å²	66.9	37%	0.37	37%	0.367	S	S	.	.	H	α-helix	trans	-60.3	-37.6	-174.4	-163.3	176.5	-174	95.3	7	112.9	I136 V140 I149 N150	I136-R146 HydrophobicContact CG2-CG 3.96Å; V140-R146 HydrophobicContact CG2-CB 3.9Å; V140-R146 HydrophobicContact CG2-CG 4.15Å; R146-I149 PolarHBondContact O-N 3.46Å; R146-N150 VanDerWaalsContact O-CG 3.25Å; R146-N150 PolarHBondContact O-N 3.21Å; R146-N150 PolarHBondContact O-ND2 3.08Å; R146-N150 VanDerWaalsContact O-ND2 3.14Å
147	D	93.5	Very high	91.7	Very high	126 Å²	126	71.1 Å²	71.1	67%	0.674	39%	0.385	S	S	*	.	H	α-helix	trans	-72	-34.9	178.7	-55.1	-47.8	0	0	0	112.1	A145 N150 D151	A145-D147 VanDerWaalsContact C-N 3.27Å; A145-D147 PolarHBondContact O-N 2.99Å; D147-N150 PolarHBondContact O-N 2.97Å; D147-D151 WeakPolarHBondContact O-CB 3.35Å; D147-D151 PolarHBondContact O-N 2.94Å
148	E	93.7	Very high	91.6	Very high	94 Å²	94	74.7 Å²	74.7	44%	0.439	39%	0.393	S	S	.	.	H	α-helix	trans	-65.1	-40.3	172.7	-176.7	-175.3	-151.9	0	0	111.3	A145 D151 A152 V161	A145-E148 HydrophobicContact CB-CB 3.9Å; A145-E148 PolarHBondContact N-OE2 3.38Å; A145-E148 WeakPolarHBondContact O-CB 3.28Å; A145-E148 PolarHBondContact O-N 3.21Å; A145-E148 VanDerWaalsContact O-N 3.1Å; E148-D151 PolarHBondContact O-N 2.81Å; E148-A152 WeakPolarHBondContact O-CB 3.25Å; E148-A152 PolarHBondContact O-N 2.72Å; E148-V161 HydrophobicContact CG-CG2 4.15Å
149	I	91.6	Very high	91.6	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-61.1	-51.2	172.2	-58	163	0	0	0	110.2	I136 M139 V140 F144 A145 R146 D151 A152 L153 V161	I136-I149 HydrophobicContact CG1-CG2 4.04Å; I136-I149 HydrophobicContact CG2-CD1 4.02Å; I136-I149 HydrophobicContact CG2-CG2 4.18Å; M139-I149 HydrophobicContact CB-CD1 3.55Å; M139-I149 HydrophobicContact CB-CG1 4.36Å; M139-I149 HydrophobicContact CE-CD1 4.36Å; M139-I149 HydrophobicContact CE-CG1 3.94Å; M139-I149 HydrophobicContact CE-CG2 4.15Å; M139-I149 HydrophobicContact SD-CG2 4.27Å; V140-I149 HydrophobicContact CG2-CD1 3.87Å; F144-I149 HydrophobicContact CB-CD1 3.91Å; F144-I149 HydrophobicContact CB-CG1 3.91Å; A145-I149 WeakPolarHBondContact O-CG1 3.34Å; A145-I149 PolarHBondContact O-N 3.02Å; R146-I149 PolarHBondContact O-N 3.46Å; I149-D151 VanDerWaalsContact C-N 3.34Å; I149-D151 PolarHBondContact O-N 3.4Å; I149-A152 PolarHBondContact O-N 3.14Å; I149-L153 HydrophobicContact CG2-CD1 3.9Å; I149-L153 HydrophobicContact CG2-CG 4.29Å; I149-L153 WeakPolarHBondContact O-CB 3.2Å; I149-L153 VanDerWaalsContact O-CG 3.24Å; I149-L153 WeakPolarHBondContact O-CG 3.35Å; I149-L153 PolarHBondContact O-N 2.9Å; I149-V161 HydrophobicContact CB-CG1 4.17Å; I149-V161 HydrophobicContact CG1-CG1 3.75Å
150	N	90.9	Very high	91.6	Very high	56 Å²	56	80.6 Å²	80.6	30%	0.299	42%	0.421	S	S	.	.	H	α-helix	trans	-58.2	-46.7	179.4	-66.6	-33.5	0	0	0	111.4	R146 D147 L153 I154	R146-N150 VanDerWaalsContact O-CG 3.25Å; R146-N150 PolarHBondContact O-N 3.21Å; R146-N150 PolarHBondContact O-ND2 3.08Å; R146-N150 VanDerWaalsContact O-ND2 3.14Å; D147-N150 PolarHBondContact O-N 2.97Å; N150-L153 PolarHBondContact O-N 2.87Å; N150-I154 HydrophobicContact CB-CD1 4.41Å; N150-I154 VanDerWaalsContact O-CB 3.27Å; N150-I154 WeakPolarHBondContact O-CB 3.29Å; N150-I154 WeakPolarHBondContact O-CD1 3.17Å; N150-I154 WeakPolarHBondContact O-CG1 3.27Å; N150-I154 PolarHBondContact O-N 3.31Å
151	D	92.3	Very high	91.5	Very high	69 Å²	69	78.2 Å²	78.2	37%	0.369	41%	0.406	S	S	.	.	H	α-helix	trans	-66.4	-37.8	-179.7	172.9	48.2	0	0	0	113	D147 E148 I149 N155 K157	D147-D151 WeakPolarHBondContact O-CB 3.35Å; D147-D151 PolarHBondContact O-N 2.94Å; E148-D151 PolarHBondContact O-N 2.81Å; I149-D151 VanDerWaalsContact C-N 3.34Å; I149-D151 PolarHBondContact O-N 3.4Å; D151-N155 WeakPolarHBondContact O-CB 3.17Å; D151-N155 PolarHBondContact O-N 2.95Å; D151-N155 PolarHBondContact O-ND2 2.78Å; D151-N155 PolarHBondContact OD1-ND2 3.17Å; D151-K157 WeakPolarHBondContact OD1-CE 3.33Å; D151-K157 IonicContact OD1-NZ 3.19Å; D151-K157 PolarHBondContact OD1-NZ 2.85Å; D151-K157 IonicContact OD2-NZ 2.64Å; D151-K157 PolarHBondContact OD2-NZ 2.99Å
152	A	92.8	Very high	91.4	Very high	1 Å²	1	72.8 Å²	72.8	1%	0.008	37%	0.373	C	S	.	.	H	α-helix	trans	-68	-38.4	174.4	0	0	0	0	0	112.8	E148 I149 Q156 K157 V161	E148-A152 WeakPolarHBondContact O-CB 3.25Å; E148-A152 PolarHBondContact O-N 2.72Å; I149-A152 PolarHBondContact O-N 3.14Å; A152-Q156 WeakPolarHBondContact O-CA 3.44Å; A152-Q156 PolarHBondContact O-N 3.11Å; A152-Q156 VanDerWaalsContact O-N 3.16Å; A152-K157 PolarHBondContact O-N 2.95Å; A152-V161 HydrophobicContact CB-CB 3.96Å; A152-V161 HydrophobicContact CB-CG1 4.09Å
153	L	89.9	Confident	91.4	Very high	8 Å²	8	69.4 Å²	69.4	4%	0.042	36%	0.363	C	S	.	.	H	α-helix	trans	-76.4	-46.7	179.1	-64.8	-176.4	0	0	0	112.4	F130 I149 N150 N155 Q156 M162 Y165	F130-L153 HydrophobicContact CB-CB 4.33Å; F130-L153 HydrophobicContact CB-CD1 4.45Å; F130-L153 HydrophobicContact CD1-CD2 3.84Å; F130-L153 HydrophobicContact CE1-CD2 4.33Å; I149-L153 HydrophobicContact CG2-CD1 3.9Å; I149-L153 HydrophobicContact CG2-CG 4.29Å; I149-L153 WeakPolarHBondContact O-CB 3.2Å; I149-L153 VanDerWaalsContact O-CG 3.24Å; I149-L153 WeakPolarHBondContact O-CG 3.35Å; I149-L153 PolarHBondContact O-N 2.9Å; N150-L153 PolarHBondContact O-N 2.87Å; L153-N155 PolarHBondContact O-N 2.66Å; L153-Q156 PolarHBondContact O-N 3.26Å; L153-M162 HydrophobicContact CD2-CB 4.43Å; L153-M162 HydrophobicContact CD2-CG 4.08Å; L153-Y165 HydrophobicContact CD1-CD1 4.19Å; L153-Y165 HydrophobicContact CD1-CD2 3.63Å; L153-Y165 HydrophobicContact CD1-CE1 4.31Å; L153-Y165 HydrophobicContact CD1-CE2 3.73Å; L153-Y165 HydrophobicContact CD1-CG 3.87Å; L153-Y165 HydrophobicContact CD2-CD1 3.74Å; L153-Y165 HydrophobicContact CD2-CD2 4.37Å; L153-Y165 HydrophobicContact CD2-CE1 4.4Å; L153-Y165 HydrophobicContact CD2-CG 3.74Å; L153-Y165 HydrophobicContact CG-CG 4.42Å
154	I	89.3	Confident	91.3	Very high	134 Å²	134	67.7 Å²	67.7	69%	0.687	34%	0.339	S	S	*	.	H	α-helix	trans	-61.9	-43.8	180	-71.1	166.1	0	0	0	111	N150	N150-I154 HydrophobicContact CB-CD1 4.41Å; N150-I154 VanDerWaalsContact O-CB 3.27Å; N150-I154 WeakPolarHBondContact O-CB 3.29Å; N150-I154 WeakPolarHBondContact O-CD1 3.17Å; N150-I154 WeakPolarHBondContact O-CG1 3.27Å; N150-I154 PolarHBondContact O-N 3.31Å
155	N	89.3	Confident	91.2	Very high	99 Å²	99	65.7 Å²	65.7	53%	0.529	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	1.7	-179	-61.8	-78.2	0	0	0	113.8	D151 L153 K157	D151-N155 WeakPolarHBondContact O-CB 3.17Å; D151-N155 PolarHBondContact O-N 2.95Å; D151-N155 PolarHBondContact O-ND2 2.78Å; D151-N155 PolarHBondContact OD1-ND2 3.17Å; L153-N155 PolarHBondContact O-N 2.66Å; N155-K157 HydrophobicContact CB-CG 4Å; N155-K157 PolarHBondContact O-N 3.48Å
156	Q	87.3	Confident	90.9	Very high	93 Å²	93	66.1 Å²	66.1	44%	0.435	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	45	62.3	-174.7	-59.4	-174.6	14.2	0	0	112.7	A152 L153 Y158 M162	A152-Q156 WeakPolarHBondContact O-CA 3.44Å; A152-Q156 PolarHBondContact O-N 3.11Å; A152-Q156 VanDerWaalsContact O-N 3.16Å; L153-Q156 PolarHBondContact O-N 3.26Å; Q156-Y158 VanDerWaalsContact C-N 3.28Å; Q156-Y158 HydrophobicContact CB-CE2 3.83Å; Q156-Y158 WeakPolarHBondContact O-CD2 3.45Å; Q156-Y158 WeakPolarHBondContact O-CE2 3.36Å; Q156-Y158 PolarHBondContact O-N 3.15Å; Q156-Y158 PolarHBondContact OE1-OH 3.24Å; Q156-M162 HydrophobicContact CB-CE 3.85Å; Q156-M162 HydrophobicContact CB-SD 4.22Å; Q156-M162 HydrophobicContact CG-CE 3.98Å
157	K	88.3	Confident	90.8	Very high	97 Å²	97	67 Å²	67	42%	0.422	34%	0.336	S	S	.	.			trans	-74.9	-12.5	-170.7	-68.2	-169.6	-179.2	-176.6	0	115.1	D151 A152 N155 D159	D151-K157 WeakPolarHBondContact OD1-CE 3.33Å; D151-K157 IonicContact OD1-NZ 3.19Å; D151-K157 PolarHBondContact OD1-NZ 2.85Å; D151-K157 IonicContact OD2-NZ 2.64Å; D151-K157 PolarHBondContact OD2-NZ 2.99Å; A152-K157 PolarHBondContact O-N 2.95Å; N155-K157 HydrophobicContact CB-CG 4Å; N155-K157 PolarHBondContact O-N 3.48Å; K157-D159 HydrophobicContact CB-CB 4.42Å; K157-D159 WeakPolarHBondContact CB-OD2 3.16Å; K157-D159 PolarHBondContact O-N 2.69Å; K157-D159 VanDerWaalsContact O-N 3.17Å
158	Y	88.8	Confident	90.5	Very high	167 Å²	167	63.9 Å²	63.9	66%	0.655	32%	0.319	S	S	*	.			trans	51.8	31.8	-177.2	-61.2	-82	0	0	0	113.7	Q156 M162	Q156-Y158 VanDerWaalsContact C-N 3.28Å; Q156-Y158 HydrophobicContact CB-CE2 3.83Å; Q156-Y158 WeakPolarHBondContact O-CD2 3.45Å; Q156-Y158 WeakPolarHBondContact O-CE2 3.36Å; Q156-Y158 PolarHBondContact O-N 3.15Å; Q156-Y158 PolarHBondContact OE1-OH 3.24Å; Y158-M162 HydrophobicContact CD1-CE 4.31Å; Y158-M162 HydrophobicContact CD1-SD 3.95Å; Y158-M162 HydrophobicContact CD2-SD 4.39Å; Y158-M162 HydrophobicContact CE1-CE 3.95Å; Y158-M162 HydrophobicContact CE1-SD 4.19Å; Y158-M162 HydrophobicContact CG-SD 4.04Å; Y158-M162 PolarHBondContact N-SD 3.37Å
159	D	92.2	Very high	89.6	Confident	53 Å²	53	60.9 Å²	60.9	28%	0.283	31%	0.314	S	S	.	.	S	Bend	trans	-90.1	-175.2	178.6	54.1	24.7	0	0	0	112.1	K157 V161 M162 A163	K157-D159 HydrophobicContact CB-CB 4.42Å; K157-D159 WeakPolarHBondContact CB-OD2 3.16Å; K157-D159 PolarHBondContact O-N 2.69Å; K157-D159 VanDerWaalsContact O-N 3.17Å; D159-V161 PolarHBondContact O-N 2.95Å; D159-V161 WeakPolarHBondContact OD1-CB 3.49Å; D159-V161 PolarHBondContact OD1-N 2.74Å; D159-M162 PolarHBondContact O-N 2.7Å; D159-M162 WeakPolarHBondContact OD1-CB 3.39Å; D159-M162 PolarHBondContact OD1-N 3.28Å; D159-A163 WeakPolarHBondContact O-CB 3.28Å; D159-A163 PolarHBondContact O-N 3.47Å
160	E	92.8	Very high	88.6	Confident	149 Å²	149	69.3 Å²	69.3	70%	0.696	35%	0.345	S	S	*	.	H	α-helix	trans	-60	-30.6	177.3	-177.1	163.6	-150.5	0	0	112.6	F144 T164	F144-E160 HydrophobicContact CE1-CG 4.5Å; F144-E160 HydrophobicContact CZ-CG 4.47Å; E160-T164 VanDerWaalsContact O-CB 3.25Å; E160-T164 WeakPolarHBondContact O-CB 3.37Å; E160-T164 PolarHBondContact O-N 3Å; E160-T164 PolarHBondContact O-OG1 2.85Å
161	V	92.6	Very high	86.8	Confident	6 Å²	6	73.6 Å²	73.6	4%	0.036	36%	0.362	C	S	.	.	H	α-helix	trans	-72.1	-53.8	-179.9	-168.6	0	0	0	0	109.9	M139 F144 E148 I149 A152 D159 A163 T164 Y165	M139-V161 HydrophobicContact CE-CB 4.47Å; M139-V161 HydrophobicContact CE-CG1 3.56Å; M139-V161 WeakPolarHBondContact CE-O 3.28Å; F144-V161 HydrophobicContact CD1-CG1 4.32Å; F144-V161 HydrophobicContact CD1-CG2 3.85Å; F144-V161 HydrophobicContact CE1-CG2 4.02Å; E148-V161 HydrophobicContact CG-CG2 4.15Å; I149-V161 HydrophobicContact CB-CG1 4.17Å; I149-V161 HydrophobicContact CG1-CG1 3.75Å; A152-V161 HydrophobicContact CB-CB 3.96Å; A152-V161 HydrophobicContact CB-CG1 4.09Å; D159-V161 PolarHBondContact O-N 2.95Å; D159-V161 WeakPolarHBondContact OD1-CB 3.49Å; D159-V161 PolarHBondContact OD1-N 2.74Å; V161-A163 VanDerWaalsContact C-N 3.33Å; V161-A163 PolarHBondContact O-N 2.74Å; V161-T164 PolarHBondContact O-N 2.82Å; V161-Y165 PolarHBondContact O-N 3.02Å
162	M	90.6	Very high	84.8	Confident	2 Å²	2	75 Å²	75	1%	0.01	38%	0.375	C	S	.	.	H	α-helix	trans	-61.8	-39.9	175.4	-172.3	-178.1	-171.8	0	0	111.8	F130 L153 Q156 Y158 D159 Y165 I166	F130-M162 HydrophobicContact CE1-CE 4.01Å; F130-M162 HydrophobicContact CZ-CE 3.91Å; L153-M162 HydrophobicContact CD2-CB 4.43Å; L153-M162 HydrophobicContact CD2-CG 4.08Å; Q156-M162 HydrophobicContact CB-CE 3.85Å; Q156-M162 HydrophobicContact CB-SD 4.22Å; Q156-M162 HydrophobicContact CG-CE 3.98Å; Y158-M162 HydrophobicContact CD1-CE 4.31Å; Y158-M162 HydrophobicContact CD1-SD 3.95Å; Y158-M162 HydrophobicContact CD2-SD 4.39Å; Y158-M162 HydrophobicContact CE1-CE 3.95Å; Y158-M162 HydrophobicContact CE1-SD 4.19Å; Y158-M162 HydrophobicContact CG-SD 4.04Å; Y158-M162 PolarHBondContact N-SD 3.37Å; D159-M162 PolarHBondContact O-N 2.7Å; D159-M162 WeakPolarHBondContact OD1-CB 3.39Å; D159-M162 PolarHBondContact OD1-N 3.28Å; M162-Y165 PolarHBondContact O-N 3.28Å; M162-I166 HydrophobicContact CE-CD1 4.23Å; M162-I166 HydrophobicContact CG-CD1 4Å; M162-I166 VanDerWaalsContact O-CG1 3.32Å; M162-I166 WeakPolarHBondContact O-CG1 3.37Å; M162-I166 PolarHBondContact O-N 2.78Å
163	A	91	Very high	82.4	Confident	44 Å²	44	81.3 Å²	81.3	36%	0.364	42%	0.415	S	S	.	.	H	α-helix	trans	-61.9	-43.7	175.6	0	0	0	0	0	111.8	D159 V161 I166 L167	D159-A163 WeakPolarHBondContact O-CB 3.28Å; D159-A163 PolarHBondContact O-N 3.47Å; V161-A163 VanDerWaalsContact C-N 3.33Å; V161-A163 PolarHBondContact O-N 2.74Å; A163-I166 PolarHBondContact O-N 3.24Å; A163-L167 WeakPolarHBondContact O-CB 3.42Å; A163-L167 VanDerWaalsContact O-CG 3.28Å; A163-L167 WeakPolarHBondContact O-CG 3.37Å; A163-L167 PolarHBondContact O-N 2.74Å
164	T	90.3	Very high	80.2	Confident	29 Å²	29	87 Å²	87	18%	0.178	44%	0.442	C	S	.	.	H	α-helix	trans	-64.9	-42.4	177.6	-61.5	0	0	0	0	111.7	M139 M142 F144 E160 V161 I166 L167 L168	M139-T164 HydrophobicContact CE-CG2 4.33Å; M139-T164 HydrophobicContact CG-CG2 4.17Å; M142-T164 HydrophobicContact SD-CG2 4.36Å; F144-T164 HydrophobicContact CE2-CG2 3.96Å; F144-T164 HydrophobicContact CZ-CG2 4.44Å; E160-T164 VanDerWaalsContact O-CB 3.25Å; E160-T164 WeakPolarHBondContact O-CB 3.37Å; E160-T164 PolarHBondContact O-N 3Å; E160-T164 PolarHBondContact O-OG1 2.85Å; V161-T164 PolarHBondContact O-N 2.82Å; T164-I166 PolarHBondContact O-N 3.28Å; T164-L167 PolarHBondContact O-N 2.75Å; T164-L168 HydrophobicContact CG2-CD1 4.04Å; T164-L168 HydrophobicContact CG2-CG 4.42Å; T164-L168 WeakPolarHBondContact O-CB 3.4Å; T164-L168 WeakPolarHBondContact O-CG 3.18Å; T164-L168 PolarHBondContact O-N 3.42Å
165	Y	90.8	Very high	77.6	Confident	2 Å²	2	89.8 Å²	89.8	1%	0.008	45%	0.449	C	S	.	.	H	α-helix	trans	-58.4	-44.7	174.2	-179.8	-90.9	0	0	0	112.4	D129 F130 D132 R135 I136 M139 L153 V161 M162 L168 G169	D129-Y165 PolarHBondContact O-OH 3.43Å; F130-Y165 VanDerWaalsContact CA-OH 3.27Å; F130-Y165 WeakPolarHBondContact CA-OH 3.4Å; F130-Y165 HydrophobicContact CD1-CD1 4.04Å; F130-Y165 AromaticContact CD1-CE1 3.68Å; F130-Y165 HydrophobicContact CD1-CE1 3.68Å; F130-Y165 HydrophobicContact CE1-CD1 4.47Å; F130-Y165 HydrophobicContact CE1-CE1 4.38Å; F130-Y165 PolarHBondContact O-OH 2.89Å; D132-Y165 HydrophobicContact CB-CE2 4.31Å; D132-Y165 VanDerWaalsContact CB-OH 3.24Å; D132-Y165 WeakPolarHBondContact CB-OH 3.5Å; D132-Y165 PolarHBondContact N-OH 2.8Å; R135-Y165 HydrophobicContact CB-CD2 3.74Å; R135-Y165 HydrophobicContact CB-CE2 3.59Å; R135-Y165 HydrophobicContact CG-CE2 4.36Å; I136-Y165 HydrophobicContact CG1-CD2 4.49Å; I136-Y165 HydrophobicContact CG1-CE2 4.16Å; M139-Y165 VanDerWaalsContact SD-CA 3.57Å; M139-Y165 HydrophobicContact SD-CD2 3.94Å; M139-Y165 HydrophobicContact SD-CG 4.28Å; L153-Y165 HydrophobicContact CD1-CD1 4.19Å; L153-Y165 HydrophobicContact CD1-CD2 3.63Å; L153-Y165 HydrophobicContact CD1-CE1 4.31Å; L153-Y165 HydrophobicContact CD1-CE2 3.73Å; L153-Y165 HydrophobicContact CD1-CG 3.87Å; L153-Y165 HydrophobicContact CD2-CD1 3.74Å; L153-Y165 HydrophobicContact CD2-CD2 4.37Å; L153-Y165 HydrophobicContact CD2-CE1 4.4Å; L153-Y165 HydrophobicContact CD2-CG 3.74Å; L153-Y165 HydrophobicContact CG-CG 4.42Å; V161-Y165 PolarHBondContact O-N 3.02Å; M162-Y165 PolarHBondContact O-N 3.28Å; Y165-L168 PolarHBondContact O-N 2.64Å; Y165-G169 PolarHBondContact O-N 2.89Å
166	I	89.4	Confident	75.3	Confident	62 Å²	62	94.5 Å²	94.5	32%	0.318	47%	0.468	S	S	.	.	H	α-helix	trans	-67.6	-38.4	179	-68.5	166.9	0	0	0	111.2	M162 A163 T164 G169 R170	M162-I166 HydrophobicContact CE-CD1 4.23Å; M162-I166 HydrophobicContact CG-CD1 4Å; M162-I166 VanDerWaalsContact O-CG1 3.32Å; M162-I166 WeakPolarHBondContact O-CG1 3.37Å; M162-I166 PolarHBondContact O-N 2.78Å; A163-I166 PolarHBondContact O-N 3.24Å; T164-I166 PolarHBondContact O-N 3.28Å; I166-G169 PolarHBondContact O-N 3.32Å; I166-R170 PolarHBondContact O-N 2.96Å
167	L	89.3	Confident	73.1	Confident	117 Å²	117	93.1 Å²	93.1	61%	0.613	48%	0.479	S	S	*	.	H	α-helix	trans	-67.4	-42.5	176.7	-73.3	168.9	0	0	0	112	A163 T164 G169 R170	A163-L167 WeakPolarHBondContact O-CB 3.42Å; A163-L167 VanDerWaalsContact O-CG 3.28Å; A163-L167 WeakPolarHBondContact O-CG 3.37Å; A163-L167 PolarHBondContact O-N 2.74Å; T164-L167 PolarHBondContact O-N 2.75Å; L167-G169 PolarHBondContact O-N 3.09Å; L167-R170 PolarHBondContact O-N 2.7Å; L167-R170 VanDerWaalsContact O-N 3.12Å
168	L	86.8	Confident	70.5	Confident	59 Å²	59	92 Å²	92	31%	0.309	49%	0.494	S	S	.	.	H	α-helix	trans	-63.1	-27.4	172.7	-72.6	171.2	0	0	0	112.9	R135 I138 M139 M142 T164 Y165 R170	R135-L168 HydrophobicContact CG-CB 4.21Å; I138-L168 HydrophobicContact CB-CD1 4.39Å; I138-L168 HydrophobicContact CG2-CD1 3.85Å; I138-L168 HydrophobicContact CG2-CD2 3.9Å; M139-L168 HydrophobicContact CG-CD1 3.42Å; M139-L168 VanDerWaalsContact CG-CD1 3.42Å; M139-L168 HydrophobicContact SD-CD1 4.17Å; M142-L168 HydrophobicContact CE-CD2 4.13Å; M142-L168 HydrophobicContact SD-CD1 4.43Å; T164-L168 HydrophobicContact CG2-CD1 4.04Å; T164-L168 HydrophobicContact CG2-CG 4.42Å; T164-L168 WeakPolarHBondContact O-CB 3.4Å; T164-L168 WeakPolarHBondContact O-CG 3.18Å; T164-L168 PolarHBondContact O-N 3.42Å; Y165-L168 PolarHBondContact O-N 2.64Å; L168-R170 VanDerWaalsContact C-N 3.3Å
169	G	75.6	Confident	68	Low	32 Å²	32	93.1 Å²	93.1	33%	0.33	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-14.4	174.6	0	0	0	0	0	114.7	Y165 I166 L167 K171	Y165-G169 PolarHBondContact O-N 2.89Å; I166-G169 PolarHBondContact O-N 3.32Å; L167-G169 PolarHBondContact O-N 3.09Å; G169-K171 PolarHBondContact O-N 3.43Å
170	R	70.6	Confident	65.6	Low	176 Å²	176	96.1 Å²	96.1	66%	0.664	53%	0.531	S	S	*	.			trans	-85.2	108	176.2	-67.9	178.4	-175	-87.5	-5.6	109.5	I166 L167 L168	I166-R170 PolarHBondContact O-N 2.96Å; L167-R170 PolarHBondContact O-N 2.7Å; L167-R170 VanDerWaalsContact O-N 3.12Å; L168-R170 VanDerWaalsContact C-N 3.3Å
171	K	53.5	Low	62.9	Low	147 Å²	147	96.8 Å²	96.8	64%	0.639	54%	0.539	S	S	*	.			trans	-47.1	140.9	154.9	-84.5	-171.3	162.2	-146.5	0	108.8	G169 E174	G169-K171 PolarHBondContact O-N 3.43Å; K171-E174 WeakPolarHBondContact CD-OE1 3.26Å; K171-E174 WeakPolarHBondContact CE-OE1 3.47Å; K171-E174 IonicContact NZ-OE1 2.7Å; K171-E174 PolarHBondContact NZ-OE1 3.48Å; K171-E174 IonicContact NZ-OE2 2.71Å; K171-E174 PolarHBondContact NZ-OE2 2.83Å
172	P	49.2	Very low	60.1	Low	99 Å²	99	101.8 Å²	101.8	64%	0.643	57%	0.573	S	S	*	*			trans	-56.4	151.7	162.9	28.7	-34.6	0	0	0	108.7	E174	P172-E174 VanDerWaalsContact C-N 3.33Å; P172-E174 PolarHBondContact O-N 2.8Å
173	P	43.4	Very low	57.7	Low	133 Å²	133	108 Å²	108	86%	0.864	62%	0.617	S	S	*	*			trans	-64.8	95.9	177	26.8	-33.5	0	0	0	109.4	F175	P173-F175 PolarHBondContact O-N 2.89Å
174	E	42.3	Very low	54.9	Low	127 Å²	127	108.9 Å²	108.9	59%	0.593	63%	0.631	S	S	*	*			trans	-60.7	106.8	174	-76.7	166.2	-171.1	0	0	107.8	K171 P172 E176	K171-E174 WeakPolarHBondContact CD-OE1 3.26Å; K171-E174 WeakPolarHBondContact CE-OE1 3.47Å; K171-E174 IonicContact NZ-OE1 2.7Å; K171-E174 PolarHBondContact NZ-OE1 3.48Å; K171-E174 IonicContact NZ-OE2 2.71Å; K171-E174 PolarHBondContact NZ-OE2 2.83Å; P172-E174 VanDerWaalsContact C-N 3.33Å; P172-E174 PolarHBondContact O-N 2.8Å; E174-E176 PolarHBondContact O-N 3.39Å
175	F	35.4	Very low	52.2	Low	192 Å²	192	114.7 Å²	114.7	84%	0.842	66%	0.661	S	S	*	*			trans	-61.6	119.7	173.9	174.6	-95	0	0	0	108.3	P173 G177	P173-F175 PolarHBondContact O-N 2.89Å; F175-G177 VanDerWaalsContact C-N 3.34Å; F175-G177 PolarHBondContact O-N 2.93Å
176	E	41.9	Very low	49.7	Very low	198 Å²	198	123.3 Å²	123.3	93%	0.925	71%	0.706	S	S	*	*	S	Bend	trans	-69.3	84.5	-168.6	-168.7	173.5	-152.6	0	0	111.5	E174	E174-E176 PolarHBondContact O-N 3.39Å
177	G	39.4	Very low	47.1	Very low	64 Å²	64	125.8 Å²	125.8	66%	0.66	73%	0.728	S	S	*	*			trans	172.3	67.5	-174	0	0	0	0	0	114.5	F175	F175-G177 VanDerWaalsContact C-N 3.34Å; F175-G177 PolarHBondContact O-N 2.93Å
178	G	35.1	Very low	44.6	Very low	73 Å²	73	129.5 Å²	129.5	75%	0.753	74%	0.742	S	S	*	*			trans	174.8	129.7	170.3	0	0	0	0	0	111.9
179	E	36.9	Very low	41.9	Very low	192 Å²	192	138.4 Å²	138.4	90%	0.897	77%	0.771	S	S	*	*			trans	-75.3	148.7	-177.5	58.7	-121.2	94.1	0	0	114.4
180	S	40.8	Very low	39.8	Very low	116 Å²	116	141.7 Å²	141.7	81%	0.811	79%	0.79	S	S	*	*			trans	-69.7	129.2	-170.7	-53.1	0	0	0	0	114.4
181	L	35.8	Very low	38.2	Very low	163 Å²	163	144.8 Å²	144.8	85%	0.853	80%	0.801	S	S	*	*			trans	-139	118.7	151.9	-78.2	-177.3	0	0	0	112.8
182	S	33.4	Very low	37.4	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	81%	0.81	S	S	*	*			trans	34.8	121.2	149.6	58.6	0	0	0	0	121.3
183	S	40.3	Very low	36.6	Very low	132 Å²	132	144.5 Å²	144.5	92%	0.923	82%	0.817	S	S	*	*			trans	-54.9	143.3	159.4	-41.5	0	0	0	0	113.2
184	G	33.4	Very low	36.2	Very low	64 Å²	64	143.6 Å²	143.6	66%	0.66	81%	0.814	S	S	*	*			trans	-176.6	113.2	170.6	0	0	0	0	0	116.4
185	N	32.2	Very low	35.8	Very low	151 Å²	151	144.1 Å²	144.1	81%	0.807	82%	0.821	S	S	*	*			trans	61.6	106.7	152	-55.1	-30	0	0	0	120.2	C187	N185-C187 PolarHBondContact O-N 3.45Å
186	L	39.7	Very low	36.1	Very low	183 Å²	183	143 Å²	143	96%	0.958	82%	0.823	S	S	*	*			trans	-67	117.9	150.8	-73.3	161.5	0	0	0	109.6
187	C	33.3	Very low	35.7	Very low	114 Å²	114	140.2 Å²	140.2	77%	0.77	81%	0.814	S	S	*	*			trans	-115.8	120.6	167.8	-74.4	0	0	0	0	110	N185 R189	N185-C187 PolarHBondContact O-N 3.45Å; C187-R189 PolarHBondContact O-N 2.95Å
188	Q	36.9	Very low	35.2	Very low	195 Å²	195	143.3 Å²	143.3	91%	0.911	82%	0.815	S	S	*	*			trans	-64.6	130.9	171	-64.8	178.7	-6.8	0	0	109.5
189	R	31.6	Very low	35.2	Very low	245 Å²	245	144 Å²	144	93%	0.925	81%	0.809	S	S	*	*			trans	-108.9	107.1	165.4	-167.6	173.4	-175.3	-173.9	1	110.1	C187	C187-R189 PolarHBondContact O-N 2.95Å
190	S	31.3	Very low	35	Very low	102 Å²	102	140.6 Å²	140.6	71%	0.713	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-56.8	142.4	178.4	-40.8	0	0	0	0	112.1
191	R	37.3	Very low	34.6	Very low	241 Å²	241	143.2 Å²	143.2	91%	0.909	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-72.6	128.3	163	-67.1	178.5	179.3	165.3	-0.7	108.6
192	P	36.1	Very low	34.4	Very low	127 Å²	127	144.6 Å²	144.6	83%	0.825	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-73.2	143	162.9	31.3	-32.1	0	0	0	109.8
193	S	32	Very low	34.5	Very low	112 Å²	112	144.5 Å²	144.5	78%	0.783	81%	0.807	S	S	*	*			trans	-126.4	136.2	168	-165.1	0	0	0	0	108.2
194	S	34.7	Very low	34.6	Very low	115 Å²	115	144.2 Å²	144.2	80%	0.804	80%	0.802	S	S	*	*			trans	-164.1	115.2	174	55.4	0	0	0	0	109.9
195	D	35.2	Very low	34.6	Very low	137 Å²	137	145.5 Å²	145.5	73%	0.733	81%	0.806	S	S	*	*			trans	-89.2	171.6	178.6	-60.6	-87.9	0	0	0	112.8
196	L	40.2	Very low	34.9	Very low	169 Å²	169	147.5 Å²	147.5	89%	0.885	81%	0.811	S	S	*	*			trans	71.3	136.8	165.7	-57.4	158.4	0	0	0	115.2
197	N	33.8	Very low	34.7	Very low	140 Å²	140	146.7 Å²	146.7	75%	0.749	81%	0.806	S	S	*	*			cis	-159.9	158.5	14	-163.2	8	0	0	0	113.7
198	N	29.3	Very low	34.8	Very low	128 Å²	128	150 Å²	150	68%	0.684	81%	0.808	S	S	*	*			trans	72.8	114.7	147.3	-142.1	25.5	0	0	0	123.8
199	S	34.2	Very low	34.5	Very low	89 Å²	89	146.7 Å²	146.7	62%	0.622	80%	0.8	S	S	*	*			trans	56.9	142.2	136.4	72.5	0	0	0	0	121.2
200	T	33.2	Very low	34.6	Very low	120 Å²	120	143.3 Å²	143.3	74%	0.736	80%	0.795	S	S	*	*			cis	-156.3	167.7	21.4	-35.6	0	0	0	0	111.9
201	L	33.7	Very low	35	Very low	171 Å²	171	149.6 Å²	149.6	90%	0.895	80%	0.803	S	S	*	*			trans	82.4	159	168.7	-56.7	177.1	0	0	0	117.1
202	Q	31	Very low	34.8	Very low	192 Å²	192	143.3 Å²	143.3	90%	0.897	80%	0.796	S	S	*	*			trans	-142.1	149.7	-139.8	-169.7	172	1.3	0	0	113.3
203	S	34.6	Very low	34.6	Very low	107 Å²	107	144.8 Å²	144.8	75%	0.748	80%	0.795	S	S	*	*			trans	-73.5	164.1	-172.5	-40.1	0	0	0	0	114.9
204	P	43.6	Very low	34.8	Very low	126 Å²	126	144.8 Å²	144.8	82%	0.818	80%	0.795	S	S	*	*				-138.4	162.6	102.9	37.2	-26.8	0	0	0	113.6
205	A	32.6	Very low	34.9	Very low	92 Å²	92	143.8 Å²	143.8	76%	0.76	79%	0.794	S	S	*	*			cis	-166.5	164.5	-20.1	0	0	0	0	0	109.7
206	H	38.7	Very low	34.8	Very low	193 Å²	193	144.6 Å²	144.6	89%	0.894	80%	0.798	S	S	*	*			trans	-106.8	140.8	171.2	-96	-99.5	0	0	0	111.4
207	L	34.7	Very low	34.5	Very low	165 Å²	165	144.6 Å²	144.6	86%	0.864	79%	0.794	S	S	*	*			trans	-145.8	137.6	166.4	-99	176.3	0	0	0	114.4
208	K	37.1	Very low	34.5	Very low	185 Å²	185	147.3 Å²	147.3	80%	0.804	80%	0.799	S	S	*	*			trans	84.1	105	160.1	-68.5	-175.1	175.3	175.3	0	122
209	V	30.5	Very low	35	Very low	124 Å²	124	149.2 Å²	149.2	75%	0.752	80%	0.804	S	S	*	*				78	77.7	126.9	-171	0	0	0	0	118.6
210	Q	33.3	Very low	35.2	Very low	175 Å²	175	156.3 Å²	156.3	82%	0.818	82%	0.817	S	S	*	*				-28.4	134.2	127.2	173	-163.1	36.4	0	0	114.9
211	R	39.3	Very low	35.4	Very low	233 Å²	233	162 Å²	162	88%	0.879	83%	0.825	S	S	*	*			trans	-163	127.6	137.6	-112.5	171.8	-160.5	-159.1	3.7	113.2
212	S	33.7	Very low	35.5	Very low	109 Å²	109	163.7 Å²	163.7	76%	0.762	83%	0.825	S	S	*	*			trans	-95.4	143.9	171.7	42.2	0	0	0	0	110.7
213	I	32.5	Very low	35.7	Very low	159 Å²	159	158.8 Å²	158.8	82%	0.815	81%	0.812	S	S	*	*			trans	-137.7	100.8	171.4	-53.8	-179.7	0	0	0	110.6
214	S	35.8	Very low	35.7	Very low	111 Å²	111	159.5 Å²	159.5	78%	0.776	81%	0.808	S	S	*	*			trans	31.1	118.5	138.5	-161.1	0	0	0	0	120.5
215	A	36.2	Very low	35.2	Very low	94 Å²	94	161.6 Å²	161.6	78%	0.777	81%	0.806	S	S	*	*			trans	-81.5	141.5	159.5	0	0	0	0	0	111.2	Q217	A215-Q217 PolarHBondContact O-N 2.96Å; A215-Q217 VanDerWaalsContact O-N 3.08Å
216	N	32	Very low	35.2	Very low	155 Å²	155	162.1 Å²	162.1	83%	0.829	81%	0.811	S	S	*	*			trans	-82.3	87.8	-171.8	-161.7	-62.1	0	0	0	112.5	K218	N216-K218 PolarHBondContact O-N 2.71Å
217	Q	34.9	Very low	35	Very low	169 Å²	169	156.4 Å²	156.4	79%	0.79	80%	0.804	S	S	*	*			trans	-84.8	102	178.4	-166.2	173.5	12.6	0	0	111.7	A215 Q219	A215-Q217 PolarHBondContact O-N 2.96Å; A215-Q217 VanDerWaalsContact O-N 3.08Å; Q217-Q219 PolarHBondContact O-N 3.45Å; Q217-Q219 VanDerWaalsContact O-N 3.09Å
218	K	34	Very low	35.1	Very low	197 Å²	197	155 Å²	155	86%	0.857	81%	0.805	S	S	*	*			trans	-85.7	76.3	-173.6	-164	171	-173.2	171.6	0	112.7	N216	N216-K218 PolarHBondContact O-N 2.71Å
219	Q	38.6	Very low	34.7	Very low	168 Å²	168	151.9 Å²	151.9	79%	0.785	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-77	165.8	178.9	-159.6	158.1	-6.3	0	0	112.8	Q217	Q217-Q219 PolarHBondContact O-N 3.45Å; Q217-Q219 VanDerWaalsContact O-N 3.09Å
220	R	39.1	Very low	34.9	Very low	238 Å²	238	153.7 Å²	153.7	90%	0.898	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-80.9	153	-166.6	-67.2	-173.3	-179.8	-166.3	2.8	114.1
221	R	38.4	Very low	35.2	Very low	239 Å²	239	150.9 Å²	150.9	90%	0.902	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-65.8	122.2	174.5	-178.6	-167.8	-163.1	-172.4	5.9	112.1
222	F	35.4	Very low	35.6	Very low	206 Å²	206	145.6 Å²	145.6	90%	0.904	80%	0.802	S	S	*	*			trans	-134.9	156.9	146.1	-93.1	-78.3	0	0	0	108.6
223	S	35.3	Very low	35.5	Very low	89 Å²	89	144.9 Å²	144.9	62%	0.622	80%	0.803	S	S	*	*			trans	-112.4	168.5	175.8	55.1	0	0	0	0	108.1
224	D	33	Very low	35.5	Very low	123 Å²	123	143.6 Å²	143.6	66%	0.658	80%	0.802	S	S	*	*			cis	-154.7	160.1	34.8	-97.6	-64.4	0	0	0	114.7
225	H	34.5	Very low	35.3	Very low	169 Å²	169	143 Å²	143	78%	0.782	80%	0.798	S	S	*	*			trans	54	112.5	145.1	-72.9	66.4	0	0	0	123.8
226	A	32.7	Very low	35	Very low	104 Å²	104	148.4 Å²	148.4	86%	0.86	80%	0.8	S	S	*	*				77.1	138	124.6	0	0	0	0	0	123.3
227	G	33.2	Very low	35	Very low	72 Å²	72	146.7 Å²	146.7	74%	0.742	80%	0.795	S	S	*	*			trans	107.1	104.7	151.4	0	0	0	0	0	117.6
228	P	37.7	Very low	34.7	Very low	137 Å²	137	148.6 Å²	148.6	89%	0.89	80%	0.801	S	S	*	*			trans	-87.4	149.6	166.9	35.1	-32.4	0	0	0	112.1
229	S	28.5	Very low	34.6	Very low	118 Å²	118	150.3 Å²	150.3	83%	0.825	80%	0.802	S	S	*	*			trans	-132.4	151.3	175.4	60.4	0	0	0	0	112.4
230	I	34.6	Very low	34.8	Very low	162 Å²	162	146.9 Å²	146.9	83%	0.831	80%	0.795	S	S	*	*			trans	-132.3	142.9	174.6	-68.6	-179.8	0	0	0	107.3
231	P	39.3	Very low	34.4	Very low	116 Å²	116	144.3 Å²	144.3	75%	0.753	79%	0.792	S	S	*	*			trans	-103.4	-166.2	-163.6	42.6	-36.2	0	0	0	112.8
232	P	48.1	Very low	34	Very low	122 Å²	122	136.7 Å²	136.7	79%	0.792	78%	0.781	S	S	*	*				-128.9	164.4	-69.6	39	-25.1	0	0	0	112.9
233	A	31.1	Very low	33.6	Very low	94 Å²	94	133.7 Å²	133.7	78%	0.777	77%	0.774	S	S	*	*			trans	-147.2	113.9	170.6	0	0	0	0	0	115.5
234	V	32.6	Very low	33.5	Very low	132 Å²	132	134.8 Å²	134.8	80%	0.8	78%	0.782	S	S	*	*			trans	55.2	99.6	130.9	-170.5	0	0	0	0	120.3
235	S	32.3	Very low	33.3	Very low	99 Å²	99	135.4 Å²	135.4	69%	0.692	79%	0.79	S	S	*	*			trans	87.9	133.4	131.9	79.9	0	0	0	0	124.1
236	Y	29.6	Very low	33.1	Very low	208 Å²	208	135.6 Å²	135.6	82%	0.816	79%	0.791	S	S	*	*			trans	80.8	104.9	135.9	-90.8	-121.1	0	0	0	124
237	T	31.1	Very low	33.1	Very low	119 Å²	119	136.8 Å²	136.8	73%	0.73	79%	0.793	S	S	*	*				82.1	133	129.9	54.3	0	0	0	0	124.4
238	K	30.2	Very low	33	Very low	209 Å²	209	141.6 Å²	141.6	91%	0.909	80%	0.796	S	S	*	*			trans	73.7	110.6	148.2	-95.3	-176.3	174.6	-179.2	0	122.4
239	R	30.5	Very low	32.6	Very low	233 Å²	233	143.2 Å²	143.2	88%	0.879	79%	0.792	S	S	*	*			trans	-45.1	170.3	138.4	-103.6	-174.9	-175.5	-177.3	2.5	113.9
240	P	44.4	Very low	32.6	Very low	96 Å²	96	144.9 Å²	144.9	62%	0.623	78%	0.784	S	S	*	*			cis	-136.2	-175.7	-4.2	39.4	-20.4	0	0	0	115.3
241	Q	30.5	Very low	32.4	Very low	183 Å²	183	144 Å²	144	86%	0.855	78%	0.776	S	S	*	*			trans	30.5	151.5	138.4	-68.1	175.7	-48.8	0	0	121.8
242	A	29.5	Very low	31.9	Very low	79 Å²	79	145.6 Å²	145.6	65%	0.653	77%	0.774	S	S	*	*			cis	-155.4	162.4	18	0	0	0	0	0	114.3
243	N	26.7	Very low	30.8	Very low	144 Å²	144	150.5 Å²	150.5	77%	0.77	78%	0.777	S	S	*	*			trans	39.5	154.5	136.5	-59.8	10.3	0	0	0	124.5
244	S	32.8	Very low	30.8	Very low	111 Å²	111	150.5 Å²	150.5	78%	0.776	76%	0.764	S	S	*	*			trans	76.8	146.6	150.9	-75.5	0	0	0	0	118.6
245	V	30.2	Very low	30.8	Very low	137 Å²	137	151.5 Å²	151.5	83%	0.83	76%	0.757	S	S	*	*			cis	-137.7	160.5	-2	-101.1	0	0	0	0	110.9
246	E	30.4	Very low	30.7	Very low	173 Å²	173	153.5 Å²	153.5	81%	0.808	76%	0.76	S	S	*	*			trans	-73.3	160.6	166.1	-65.5	154.8	92	0	0	112.4
247	S	31.2	Very low	30.8	Very low	128 Å²	128	148.7 Å²	148.7	90%	0.895	75%	0.752	S	S	*	*			trans	-157.1	125.9	139.6	-81.3	0	0	0	0	109.9
248	E	31.1	Very low	30.8	Very low	173 Å²	173	147 Å²	147	81%	0.808	75%	0.751	S	S	*	*			trans	-82.1	163	170.2	-52.8	171	99.8	0	0	110.9
249	Q	30.4	Very low	31	Very low	171 Å²	171	147.9 Å²	147.9	80%	0.799	75%	0.748	S	S	*	*			trans	158.8	126	133.5	-88.8	-171.5	22.2	0	0	110.5
250	K	27.5	Very low	31.1	Very low	154 Å²	154	145 Å²	145	67%	0.67	74%	0.742	S	S	*	*				84.4	128.4	71.8	-171.8	174.8	-176	-169.7	0	110.2
251	E	30.9	Very low	30.7	Very low	142 Å²	142	147.8 Å²	147.8	66%	0.664	75%	0.751	S	S	*	*			cis	-164.5	179.6	2.2	-140.9	156.7	-140.7	0	0	111.5
252	E	28.3	Very low	30.6	Very low	151 Å²	151	142.7 Å²	142.7	71%	0.706	75%	0.747	S	S	*	*			trans	82.1	150.7	132.5	-171	164	-126.1	0	0	124.1
253	W	26.2	Very low	30.8	Very low	224 Å²	224	144 Å²	144	85%	0.848	75%	0.752	S	S	*	*			trans	75.9	164.9	169.7	-126.6	-98.5	0	0	0	121.8
254	D	30.4	Very low	31.1	Very low	95 Å²	95	143 Å²	143	51%	0.508	75%	0.751	S	S	.	*			trans	-150.7	155.8	-130.6	-168.9	12.5	0	0	0	113.2
255	K	33.3	Very low	31.2	Very low	153 Å²	153	143.4 Å²	143.4	67%	0.665	75%	0.749	S	S	*	*			trans	62.7	121.8	160.9	-82.9	150.8	-161.8	146	0	123.9
256	D	30.3	Very low	31.4	Very low	141 Å²	141	144 Å²	144	75%	0.754	75%	0.752	S	S	*	*				112	126.9	113.4	-83.8	-26.8	0	0	0	124.4
257	V	30.7	Very low	31.3	Very low	106 Å²	106	138.9 Å²	138.9	64%	0.642	75%	0.747	S	S	*	*			trans	69.3	83.2	139.1	-174.2	0	0	0	0	121.9
258	A	30.6	Very low	31.6	Very low	85 Å²	85	138.8 Å²	138.8	70%	0.702	75%	0.746	S	S	*	*				52.8	151.6	114.4	0	0	0	0	0	125.4
259	R	34.9	Very low	31.6	Very low	226 Å²	226	139.4 Å²	139.4	85%	0.853	75%	0.746	S	S	*	*			trans	92.4	145.8	163.2	-57.8	176.1	-172.8	123.6	-1.2	116.2
260	K	33.7	Very low	31.7	Very low	172 Å²	172	135.4 Å²	135.4	75%	0.748	74%	0.737	S	S	*	*			cis	-175.6	160.8	-13.5	-175.5	-154.9	172	-164.4	0	110.6
261	L	35.5	Very low	31.9	Very low	156 Å²	156	135.9 Å²	135.9	82%	0.817	74%	0.742	S	S	*	*			trans	79	152	169.1	-56.8	172.5	0	0	0	116.4
262	G	27.5	Very low	31.8	Very low	75 Å²	75	136.8 Å²	136.8	77%	0.773	75%	0.748	S	S	*	*			cis	175.2	178.6	-5.7	0	0	0	0	0	108.2
263	S	34.2	Very low	31.9	Very low	107 Å²	107	136.2 Å²	136.2	75%	0.748	76%	0.755	S	S	*	*			cis	175.3	-177.5	-12.3	-170.8	0	0	0	0	106.9
264	T	33.4	Very low	32.2	Very low	124 Å²	124	129.9 Å²	129.9	76%	0.761	75%	0.75	S	S	*	*			trans	77.6	144.9	170.4	64.8	0	0	0	0	119.1
265	T	35.5	Very low	32.6	Very low	118 Å²	118	131.1 Å²	131.1	72%	0.724	77%	0.766	S	S	*	*			cis	-163.1	146.8	2.7	14.1	0	0	0	0	114.5
266	V	33.8	Very low	32.8	Very low	149 Å²	149	129.8 Å²	129.8	90%	0.903	77%	0.773	S	S	*	*			trans	61.9	146.2	146.4	178.8	0	0	0	0	119.6
267	G	28.9	Very low	32.9	Very low	67 Å²	67	130.8 Å²	130.8	69%	0.691	78%	0.777	S	S	*	*			cis	-170.7	-169.1	5.3	0	0	0	0	0	115.6
268	S	35.6	Very low	33	Very low	126 Å²	126	132.1 Å²	132.1	88%	0.881	79%	0.786	S	S	*	*			trans	-69.8	176.2	-165.9	-44.3	0	0	0	0	117.5
269	K	31.7	Very low	33	Very low	185 Å²	185	131.3 Å²	131.3	80%	0.804	79%	0.786	S	S	*	*			cis	-167.8	158.4	28.9	-166.6	-174.2	177.8	-174.2	0	113.7
270	S	33	Very low	33.4	Very low	87 Å²	87	126.9 Å²	126.9	61%	0.608	79%	0.786	S	S	*	*			trans	60.7	117.9	159.9	40.9	0	0	0	0	119.2
271	E	30.8	Very low	33.3	Very low	165 Å²	165	127 Å²	127	77%	0.771	79%	0.789	S	S	*	*				91.4	131.1	60.2	-82.1	-176.8	76.5	0	0	113.8
272	M	30.1	Very low	33.2	Very low	161 Å²	161	130.4 Å²	130.4	79%	0.793	79%	0.791	S	S	*	*			cis	-149.6	144.2	-8.8	-87.4	-153.3	178.8	0	0	111.7
273	T	29.1	Very low	33.5	Very low	139 Å²	139	137.5 Å²	137.5	85%	0.853	80%	0.801	S	S	*	*			trans	-144.3	143.8	152.8	50.8	0	0	0	0	110.8
274	A	33.9	Very low	33.3	Very low	90 Å²	90	142.2 Å²	142.2	74%	0.744	81%	0.808	S	S	*	*	S	Bend	trans	46.1	108.7	162.6	0	0	0	0	0	120.9
275	S	38.8	Very low	33.2	Very low	122 Å²	122	141.7 Å²	141.7	85%	0.853	81%	0.809	S	S	*	*			trans	60.5	127.7	141.9	-57.5	0	0	0	0	122
276	P	37	Very low	33	Very low	124 Å²	124	141.2 Å²	141.2	81%	0.805	81%	0.811	S	S	*	*			trans	-107.8	134.1	157.6	36	-27.7	0	0	0	114.4
277	L	31.6	Very low	32.8	Very low	162 Å²	162	139.5 Å²	139.5	85%	0.848	80%	0.801	S	S	*	*				3	149.5	123.4	-106.7	64.2	0	0	0	117.7
278	V	32.8	Very low	33.2	Very low	135 Å²	135	142.9 Å²	142.9	82%	0.818	80%	0.801	S	S	*	*			cis	-154	153.6	33.1	-177.5	0	0	0	0	111.2
279	G	32.2	Very low	33.4	Very low	68 Å²	68	143 Å²	143	70%	0.701	80%	0.799	S	S	*	*			trans	158.7	119.2	144	0	0	0	0	0	117
280	P	42.5	Very low	33.3	Very low	132 Å²	132	139.2 Å²	139.2	86%	0.857	80%	0.796	S	S	*	*			trans	-88.3	157.2	-173.7	34.6	-35.8	0	0	0	115.5
281	E	31.3	Very low	33.3	Very low	175 Å²	175	141.3 Å²	141.3	82%	0.818	80%	0.801	S	S	*	*			trans	-76.1	144.2	179	-58.5	-168.4	124.7	0	0	114.8
282	R	33.5	Very low	33.3	Very low	227 Å²	227	139.8 Å²	139.8	86%	0.857	80%	0.798	S	S	*	*				163	111.3	110.1	-87.1	172.7	112.8	104.7	-3	110.2
283	K	33.4	Very low	33.3	Very low	224 Å²	224	138 Å²	138	97%	0.974	80%	0.796	S	S	*	*			trans	-76.1	146.2	173.6	-73.6	-176.9	177.1	177.2	0	111.3
284	K	31.6	Very low	33.2	Very low	207 Å²	207	141.6 Å²	141.6	90%	0.9	80%	0.795	S	S	*	*			trans	-121.2	138.6	-173	-173.9	178.4	-179.2	-179.4	0	110.5
285	S	30.8	Very low	32.9	Very low	113 Å²	113	142.8 Å²	142.8	79%	0.79	80%	0.798	S	S	*	*			trans	-93.9	139.6	177.5	52.9	0	0	0	0	112.5
286	S	30.1	Very low	32.5	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	80%	0.8	S	S	*	*			trans	-168.5	116	155.2	-162.9	0	0	0	0	115.4
287	T	30.1	Very low	32.1	Very low	113 Å²	113	138.8 Å²	138.8	69%	0.693	80%	0.798	S	S	*	*				57.9	105.8	125	-39.7	0	0	0	0	123.6
288	I	36.5	Very low	32.2	Very low	137 Å²	137	136.2 Å²	136.2	70%	0.703	79%	0.794	S	S	*	*				38.2	136.3	118.7	-51.2	167.7	0	0	0	120.5
289	P	41.8	Very low	32.2	Very low	128 Å²	128	138.3 Å²	138.3	83%	0.831	80%	0.797	S	S	*	*				-121.1	157.5	122.8	37	-33.7	0	0	0	114.4
290	S	29.6	Very low	32.1	Very low	106 Å²	106	137.9 Å²	137.9	74%	0.741	79%	0.787	S	S	*	*			trans	-83.7	178	178.7	-51.9	0	0	0	0	111.9
291	N	31.6	Very low	31.9	Very low	132 Å²	132	142 Å²	142	71%	0.706	79%	0.786	S	S	*	*			cis	-168.9	154.5	36.7	-165.6	24	0	0	0	114.5
292	N	30.8	Very low	32.3	Very low	133 Å²	133	142.2 Å²	142.2	71%	0.711	78%	0.779	S	S	*	*			trans	34.4	136.3	157.6	-74.8	-12.1	0	0	0	123.6
293	V	29.6	Very low	32	Very low	124 Å²	124	138.6 Å²	138.6	75%	0.752	78%	0.776	S	S	*	*				-178.5	115	107.7	148.2	0	0	0	0	113.5
294	Y	27.9	Very low	31.9	Very low	213 Å²	213	132.9 Å²	132.9	84%	0.835	76%	0.76	S	S	*	*			trans	64.9	146.7	146.7	-77.5	-109.6	0	0	0	126.3
295	S	27.6	Very low	31.9	Very low	115 Å²	115	132.6 Å²	132.6	80%	0.804	76%	0.755	S	S	*	*			trans	83.4	110	148.8	-66.4	0	0	0	0	122.5
296	G	31.2	Very low	31.7	Very low	88 Å²	88	133 Å²	133	91%	0.907	75%	0.753	S	S	*	*			trans	95	131.7	156.8	0	0	0	0	0	116.2
297	G	28.3	Very low	31.7	Very low	74 Å²	74	133.2 Å²	133.2	76%	0.763	75%	0.753	S	S	*	*			cis	135.8	110.1	-12.6	0	0	0	0	0	113.8
298	S	33	Very low	31.4	Very low	109 Å²	109	137.2 Å²	137.2	76%	0.762	76%	0.764	S	S	*	*			trans	66.7	157.6	175.2	-99.2	0	0	0	0	116.5
299	M	32.3	Very low	31.1	Very low	178 Å²	178	142.2 Å²	142.2	88%	0.877	77%	0.774	S	S	*	*			cis	-147.6	-167.1	-19.3	-139.1	-171.6	-142.8	0	0	111.5
300	A	31.1	Very low	30.6	Very low	60 Å²	60	142 Å²	142	50%	0.496	77%	0.77	S	S	.	*			trans	-130.1	151.4	-166.8	0	0	0	0	0	114.4	R302	A300-R302 PolarHBondContact O-NH1 3.03Å
301	R	37.8	Very low	30.7	Very low	218 Å²	218	142.3 Å²	142.3	82%	0.823	77%	0.768	S	S	*	*			trans	67.8	157.2	159.1	-59.2	174.2	164.9	-164.7	-3.3	119
302	R	38.8	Very low	30.5	Very low	180 Å²	180	143.3 Å²	143.3	68%	0.679	77%	0.773	S	S	*	*			trans	97.1	143.5	154.6	-54.8	169	-153.7	76.3	-11.3	113.9	A300	A300-R302 PolarHBondContact O-NH1 3.03Å
303	N	27.4	Very low	30.6	Very low	150 Å²	150	147.7 Å²	147.7	80%	0.802	78%	0.78	S	S	*	*				-123.4	123.6	117.9	-96.2	-20.9	0	0	0	108.1
304	T	31.4	Very low	30.5	Very low	104 Å²	104	152.9 Å²	152.9	64%	0.638	79%	0.787	S	S	*	*			trans	-113.2	122.4	159.7	-69.9	0	0	0	0	104.1	V306	T304-V306 HydrophobicContact CG2-CG2 4.08Å; T304-V306 PolarHBondContact O-N 2.91Å
305	Y	31.6	Very low	30.6	Very low	201 Å²	201	148.7 Å²	148.7	79%	0.788	78%	0.784	S	S	*	*			trans	-87	107.4	167.1	-97	-84.7	0	0	0	109.1
306	V	27.9	Very low	30.7	Very low	122 Å²	122	147.3 Å²	147.3	74%	0.739	78%	0.779	S	S	*	*			trans	-132.1	126.3	153.9	174.6	0	0	0	0	104.7	T304	T304-V306 HydrophobicContact CG2-CG2 4.08Å; T304-V306 PolarHBondContact O-N 2.91Å
307	C	29.1	Very low	30.7	Very low	113 Å²	113	150.5 Å²	150.5	76%	0.764	78%	0.775	S	S	*	*			trans	-83.2	133	177.2	-60.4	0	0	0	0	109.4
308	E	25	Very low	30.8	Very low	196 Å²	196	155 Å²	155	92%	0.916	78%	0.776	S	S	*	*			trans	-92.6	147.2	157	-71	-168.6	134.2	0	0	109.6
309	R	29.9	Very low	30.5	Very low	243 Å²	243	157.8 Å²	157.8	92%	0.917	78%	0.782	S	S	*	*			trans	-118.8	129.6	162.7	-178.2	-177.7	-68.3	-170.8	-0.6	106.9
310	T	30.5	Very low	30.4	Very low	122 Å²	122	152.8 Å²	152.8	75%	0.748	78%	0.776	S	S	*	*			trans	-70.3	147.7	177.2	53.1	0	0	0	0	111.5
311	T	31.9	Very low	30.5	Very low	114 Å²	114	158.3 Å²	158.3	70%	0.699	79%	0.789	S	S	*	*				157	114.5	112.8	-72.8	0	0	0	0	111.9
312	D	28.6	Very low	30.1	Very low	152 Å²	152	153.8 Å²	153.8	81%	0.813	78%	0.781	S	S	*	*			trans	54.2	167.1	152.4	-79	-67.7	0	0	0	124.6
313	R	32.2	Very low	29.9	Very low	226 Å²	226	150 Å²	150	85%	0.853	78%	0.783	S	S	*	*			trans	-90.8	151.6	-175.7	-51.2	164	177.2	159.9	-2.7	110.8
314	Y	27.9	Very low	29.9	Very low	232 Å²	232	148 Å²	148	91%	0.91	78%	0.78	S	S	*	*				-160.4	175.8	120.6	-126.6	-95.5	0	0	0	111.2
315	V	30	Very low	29.9	Very low	126 Å²	126	150.3 Å²	150.3	76%	0.764	79%	0.788	S	S	*	*			trans	-111.2	137.3	-170.3	170.9	0	0	0	0	111.4
316	A	29.7	Very low	29.9	Very low	85 Å²	85	147 Å²	147	70%	0.702	79%	0.788	S	S	*	*			trans	39.5	131	159.5	0	0	0	0	0	120.3
317	L	31	Very low	30	Very low	155 Å²	155	149.7 Å²	149.7	81%	0.812	79%	0.793	S	S	*	*				-166.5	172.4	113.1	-103.6	168.8	0	0	0	113.3
318	Q	29.4	Very low	30.1	Very low	168 Å²	168	153.1 Å²	153.1	79%	0.785	80%	0.8	S	S	*	*			trans	-55.8	153.5	-168.6	-69.6	157.8	-17.6	0	0	118.7
319	N	27.4	Very low	30.5	Very low	168 Å²	168	149.2 Å²	149.2	90%	0.898	79%	0.794	S	S	*	*			trans	67.7	143.1	135	-161.1	36.4	0	0	0	119.7
320	G	30.8	Very low	30.4	Very low	73 Å²	73	144.2 Å²	144.2	75%	0.753	79%	0.79	S	S	*	*			trans	152.1	117.9	-178.7	0	0	0	0	0	110.4
321	K	31.7	Very low	30.5	Very low	177 Å²	177	143.1 Å²	143.1	77%	0.77	79%	0.788	S	S	*	*			trans	-128.2	133.4	-170.3	-168.4	-163.6	162.5	-172.1	0	109.3
322	D	30.8	Very low	30.5	Very low	122 Å²	122	143.2 Å²	143.2	65%	0.652	79%	0.793	S	S	*	*			trans	53.2	178.6	161.7	81.1	-105	0	0	0	116.3
323	S	33.5	Very low	30.8	Very low	102 Å²	102	143.4 Å²	143.4	71%	0.713	79%	0.792	S	S	*	*			cis	-146.8	174.6	-20.3	36.7	0	0	0	0	107.9
324	S	27.1	Very low	30.9	Very low	107 Å²	107	137.7 Å²	137.7	75%	0.748	79%	0.787	S	S	*	*			trans	-149.6	116.9	161.6	67	0	0	0	0	112.8
325	L	31.7	Very low	31.2	Very low	152 Å²	152	131.8 Å²	131.8	80%	0.796	78%	0.78	S	S	*	*				158.5	134.3	127.4	-86.1	171.4	0	0	0	111.1
326	T	31.9	Very low	31.4	Very low	131 Å²	131	130.7 Å²	130.7	80%	0.804	78%	0.784	S	S	*	*			trans	62.7	144.5	157.2	48.9	0	0	0	0	117.6
327	E	29.4	Very low	31.4	Very low	179 Å²	179	130.3 Å²	130.3	84%	0.836	79%	0.789	S	S	*	*			cis	-142.5	-176.6	16.6	-94.4	-144.6	121.8	0	0	113.3
328	M	31.1	Very low	31.6	Very low	186 Å²	186	128.4 Å²	128.4	92%	0.916	79%	0.788	S	S	*	*			trans	84.1	154.6	153	86.3	173.4	175.5	0	0	121.2
329	S	33	Very low	31.8	Very low	113 Å²	113	125 Å²	125	79%	0.79	78%	0.783	S	S	*	*			trans	-121.1	153.6	-151.1	-44.4	0	0	0	0	113.8
330	V	29.6	Very low	32.2	Very low	138 Å²	138	123.3 Å²	123.3	84%	0.836	78%	0.778	S	S	*	*			trans	-161.4	128.7	136.3	-101.5	0	0	0	0	113.5
331	S	31.6	Very low	32.2	Very low	100 Å²	100	123.9 Å²	123.9	70%	0.699	78%	0.776	S	S	*	*			trans	51.1	118.2	134.9	-51	0	0	0	0	123.8
332	S	32.1	Very low	32.2	Very low	115 Å²	115	121 Å²	121	80%	0.804	78%	0.778	S	S	*	*			trans	74.3	145.8	140.6	-49.1	0	0	0	0	117.8
333	I	35.2	Very low	32.2	Very low	156 Å²	156	119.5 Å²	119.5	80%	0.8	78%	0.783	S	S	*	*			cis	-143.5	164.8	15.6	43.2	174.4	0	0	0	112.9
334	S	33.2	Very low	32.4	Very low	107 Å²	107	121.3 Å²	121.3	75%	0.748	79%	0.789	S	S	*	*			trans	2.8	151	144.8	-55.7	0	0	0	0	121.3
335	S	35.8	Very low	33.6	Very low	108 Å²	108	121.7 Å²	121.7	76%	0.755	79%	0.789	S	S	*	*			cis	-174.9	151.1	2.9	41.6	0	0	0	0	115.1
336	A	33.9	Very low	33.5	Very low	102 Å²	102	120 Å²	120	84%	0.843	79%	0.79	S	S	*	*			trans	51.4	123.3	140	0	0	0	0	0	125.2
337	G	29.6	Very low	33.6	Very low	78 Å²	78	118.6 Å²	118.6	80%	0.804	79%	0.792	S	S	*	*			trans	78.4	169.3	137.3	0	0	0	0	0	120.2
338	S	35.3	Very low	33.9	Very low	114 Å²	114	120.8 Å²	120.8	80%	0.797	79%	0.792	S	S	*	*			cis	-169.7	147.1	-25.2	-147	0	0	0	0	113.4
339	S	33.6	Very low	34.4	Very low	96 Å²	96	117.6 Å²	117.6	67%	0.671	79%	0.786	S	S	*	*			trans	66.5	151.3	149.9	69	0	0	0	0	124.6
340	V	34.7	Very low	34.6	Very low	133 Å²	133	120.6 Å²	120.6	81%	0.806	78%	0.78	S	S	*	*			trans	57	138	161	-64.5	0	0	0	0	119.9
341	A	32.2	Very low	34.7	Very low	86 Å²	86	122.7 Å²	122.7	71%	0.711	78%	0.78	S	S	*	*			cis	81.9	138	38.7	0	0	0	0	0	113.3
342	S	30.9	Very low	34.9	Very low	116 Å²	116	124 Å²	124	81%	0.811	78%	0.775	S	S	*	*			cis	-157.9	167.3	21.8	-63.3	0	0	0	0	114.8
343	A	31.2	Very low	35	Very low	91 Å²	91	127.4 Å²	127.4	75%	0.752	78%	0.776	S	S	*	*			trans	56.2	124.6	143.3	0	0	0	0	0	125.7
344	V	37.6	Very low	35	Very low	139 Å²	139	124.9 Å²	124.9	84%	0.842	77%	0.771	S	S	*	*			trans	-20.6	170	141.5	-93	0	0	0	0	120.3
345	P	51.4	Low	34.9	Very low	115 Å²	115	127.8 Å²	127.8	75%	0.747	78%	0.775	S	S	*	*			cis	-141.7	-177.8	10.2	38.9	-18.3	0	0	0	119.2
346	S	30.4	Very low	34.7	Very low	117 Å²	117	127.6 Å²	127.6	82%	0.818	77%	0.774	S	S	*	*			trans	86.9	117.2	140.7	-159.9	0	0	0	0	122.6
347	A	33.3	Very low	34.9	Very low	102 Å²	102	128.9 Å²	128.9	84%	0.843	77%	0.772	S	S	*	*				179.3	155.9	126.5	0	0	0	0	0	112.1
348	R	35.7	Very low	35	Very low	224 Å²	224	131.1 Å²	131.1	85%	0.845	78%	0.775	S	S	*	*			trans	-154	134.2	176	-164.2	-170.6	-168.2	-170	7.7	111.6
349	P	42.4	Very low	34.8	Very low	120 Å²	120	128.9 Å²	128.9	78%	0.779	77%	0.77	S	S	*	*				-139.1	131.8	118.9	35.2	-22.7	0	0	0	110.9
350	R	37	Very low	34.7	Very low	176 Å²	176	133.6 Å²	133.6	66%	0.664	78%	0.781	S	S	*	*				53.2	107.2	69.3	-167	178.6	-170.1	172.3	3.8	114.5
351	H	32.2	Very low	35.7	Very low	181 Å²	181	132.2 Å²	132.2	84%	0.838	78%	0.775	S	S	*	*			trans	-141.9	158.5	137.8	-128.5	-81.2	0	0	0	112
352	Q	35.8	Very low	35.8	Very low	128 Å²	128	135.3 Å²	135.3	60%	0.598	78%	0.778	S	S	*	*			trans	-158	138.7	-166.2	177.1	-174.7	6.4	0	0	109.5
353	K	33.3	Very low	35.8	Very low	187 Å²	187	139.2 Å²	139.2	81%	0.813	78%	0.78	S	S	*	*			trans	-151.3	131.2	162.5	-88.3	172.1	-178.7	175.9	0	106.3
354	S	34.8	Very low	36	Very low	102 Å²	102	141.2 Å²	141.2	71%	0.713	78%	0.783	S	S	*	*			cis	81.9	143	47.3	-62.4	0	0	0	0	112.9
355	M	32.3	Very low	35.8	Very low	168 Å²	168	140.8 Å²	140.8	83%	0.828	78%	0.781	S	S	*	*			cis	171	147.3	-24.6	-114.4	-70	178.2	0	0	107.5
356	S	32	Very low	34.8	Very low	104 Å²	104	142.8 Å²	142.8	73%	0.727	78%	0.784	S	S	*	*			trans	165.1	117.4	157.2	-78.5	0	0	0	0	109.6
357	T	36.6	Very low	36.1	Very low	130 Å²	130	142.3 Å²	142.3	80%	0.798	78%	0.778	S	S	*	*				67.3	135	68.4	64.2	0	0	0	0	113.9
358	S	33.5	Very low	35.9	Very low	125 Å²	125	144 Å²	144	87%	0.874	78%	0.778	S	S	*	*			cis	-142.1	-174.1	27.4	57.4	0	0	0	0	112.1
359	G	29.8	Very low	35.8	Very low	67 Å²	67	140.8 Å²	140.8	69%	0.691	78%	0.776	S	S	*	*			cis	-178.7	162	-2.2	0	0	0	0	0	111.3
360	H	31.9	Very low	35.3	Very low	194 Å²	194	142.7 Å²	142.7	90%	0.898	77%	0.772	S	S	*	*			trans	-103.1	-160.8	-178.9	-52.3	-68	0	0	0	111.5
361	P	56.1	Low	35	Very low	105 Å²	105	140.8 Å²	140.8	68%	0.682	78%	0.775	S	S	*	*			cis	-144.2	169.5	-8.8	32.9	-9	0	0	0	119.2
362	I	34.7	Very low	35	Very low	151 Å²	151	134.9 Å²	134.9	77%	0.774	76%	0.764	S	S	*	*			trans	52.9	127.3	137.8	-64.5	164.6	0	0	0	121.9
363	K	30.8	Very low	35	Very low	198 Å²	198	134.5 Å²	134.5	86%	0.861	78%	0.775	S	S	*	*				-178.7	-178.1	104.3	-133.8	148.7	-170.6	178.8	0	114.8
364	V	35.5	Very low	35.1	Very low	132 Å²	132	134.3 Å²	134.3	80%	0.8	78%	0.777	S	S	*	*			trans	-142.9	155	-169.5	-177.9	0	0	0	0	111.3
365	T	32	Very low	35	Very low	131 Å²	131	133.8 Å²	133.8	80%	0.804	78%	0.779	S	S	*	*			trans	122.7	149	155.3	-45.4	0	0	0	0	116.7
366	L	30.2	Very low	34.8	Very low	157 Å²	157	136.8 Å²	136.8	82%	0.822	78%	0.782	S	S	*	*			trans	-83.9	-174.3	-176	-91.4	72.8	0	0	0	113.9
367	P	57.5	Low	34.8	Very low	107 Å²	107	142.2 Å²	142.2	70%	0.695	79%	0.787	S	S	*	*			cis	-140.9	170.5	-43	39.4	-23	0	0	0	115.7
368	T	29.4	Very low	35.5	Very low	136 Å²	136	141.9 Å²	141.9	83%	0.834	79%	0.787	S	S	*	*			trans	-158.4	170.3	163.5	43	0	0	0	0	112.3
369	I	33.9	Very low	35.3	Very low	157 Å²	157	138.8 Å²	138.8	81%	0.805	78%	0.775	S	S	*	*				-158.5	-173.2	-54.8	-140.1	167.9	0	0	0	111.5
370	K	31.6	Very low	35.5	Very low	161 Å²	161	141.6 Å²	141.6	70%	0.7	78%	0.779	S	S	*	*			trans	-46	165.4	171.6	-75	174.7	149	-87.1	0	116.5
371	D	31.5	Very low	35.6	Very low	135 Å²	135	138.5 Å²	138.5	72%	0.722	77%	0.774	S	S	*	*			cis	-166	-177.7	-7.3	-95	-18.9	0	0	0	106.4
372	G	31.2	Very low	34.4	Very low	58 Å²	58	141.4 Å²	141.4	60%	0.598	78%	0.778	S	S	*	*			cis	159.6	165.4	-3.1	0	0	0	0	0	112
373	S	37.2	Very low	34.3	Very low	120 Å²	120	144.8 Å²	144.8	84%	0.839	78%	0.781	S	S	*	*			trans	68	158.9	176.1	79.2	0	0	0	0	117.3
374	E	34.3	Very low	34.5	Very low	183 Å²	183	141.9 Å²	141.9	86%	0.855	78%	0.78	S	S	*	*			cis	-159.5	169.9	-1.3	-141.1	177.5	-166.4	0	0	113.4
375	A	32.1	Very low	35.1	Very low	90 Å²	90	141.4 Å²	141.4	74%	0.744	78%	0.779	S	S	*	*			trans	63.6	156.9	159.1	0	0	0	0	0	119.8
376	Y	30	Very low	35.1	Very low	231 Å²	231	140.2 Å²	140.2	91%	0.906	78%	0.783	S	S	*	*			cis	-149.9	-177.5	-0.5	-152.9	-118.7	0	0	0	111.7
377	R	31.9	Very low	35	Very low	218 Å²	218	137.4 Å²	137.4	82%	0.823	78%	0.782	S	S	*	*			trans	-147.5	-174.3	-178.1	-130.5	-172.9	177.7	-168.4	2.2	109.2
378	P	49.6	Very low	33.7	Very low	124 Å²	124	138.1 Å²	138.1	81%	0.805	79%	0.79	S	S	*	*			cis	-135.9	-166.6	-17.6	43	-24.3	0	0	0	114.9
379	G	29.3	Very low	34.7	Very low	60 Å²	60	138 Å²	138	62%	0.619	79%	0.792	S	S	*	*			trans	148.8	107.6	157.4	0	0	0	0	0	115.3
380	T	34	Very low	34.7	Very low	126 Å²	126	136.1 Å²	136.1	77%	0.773	79%	0.792	S	S	*	*				81.1	96	78.9	50	0	0	0	0	115.7
381	T	34.3	Very low	34.7	Very low	129 Å²	129	131.6 Å²	131.6	79%	0.791	79%	0.785	S	S	*	*				77.6	149.2	95.1	52.5	0	0	0	0	116.6
382	Q	31.9	Very low	34.8	Very low	165 Å²	165	133.7 Å²	133.7	77%	0.771	79%	0.79	S	S	*	*			cis	-175.5	159.3	-19.2	-174.6	-175.3	54.6	0	0	109.8
383	R	31.2	Very low	34.9	Very low	223 Å²	223	135.9 Å²	135.9	84%	0.842	80%	0.796	S	S	*	*			trans	93.6	163	153.2	-127.1	174.1	-159.8	157.3	5.3	120.3
384	V	35.3	Very low	34.8	Very low	136 Å²	136	137.3 Å²	137.3	82%	0.824	79%	0.793	S	S	*	*			trans	-162.3	152	-167.7	-123.1	0	0	0	0	111.7
385	P	49.5	Very low	34.5	Very low	122 Å²	122	133.9 Å²	133.9	79%	0.792	79%	0.789	S	S	*	*			trans	-149.5	143.7	144	38.2	-21.1	0	0	0	118.6
386	A	31.2	Very low	34.4	Very low	106 Å²	106	136.2 Å²	136.2	88%	0.876	79%	0.794	S	S	*	*			trans	54.7	141.2	133	0	0	0	0	0	126.2
387	A	29.2	Very low	34.6	Very low	99 Å²	99	130.2 Å²	130.2	82%	0.818	79%	0.792	S	S	*	*			trans	-164.8	151.8	140.2	0	0	0	0	0	112.2
388	S	29.5	Very low	34.8	Very low	122 Å²	122	126.5 Å²	126.5	85%	0.853	79%	0.794	S	S	*	*			trans	-169.5	148.3	169.7	-70.7	0	0	0	0	110.2
389	P	49.7	Very low	34.6	Very low	134 Å²	134	126.3 Å²	126.3	87%	0.87	79%	0.793	S	S	*	*				-151.3	-156.4	110	39.2	-19.1	0	0	0	115.6
390	S	33.4	Very low	34.6	Very low	117 Å²	117	130.5 Å²	130.5	82%	0.818	80%	0.801	S	S	*	*			trans	-97.5	-170.2	-162.5	55.7	0	0	0	0	115.1
391	A	32.2	Very low	34.7	Very low	66 Å²	66	135.4 Å²	135.4	55%	0.545	81%	0.806	S	S	.	*			cis	-162.7	-179.7	17.7	0	0	0	0	0	114.4
392	H	34.9	Very low	34.9	Very low	178 Å²	178	135.2 Å²	135.2	82%	0.824	80%	0.804	S	S	*	*			trans	77.2	130.5	173	-45	102.7	0	0	0	115.7
393	S	31.4	Very low	35.2	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	81%	0.807	S	S	*	*			cis	107.1	133.3	28.7	-74.7	0	0	0	0	111.1
394	I	35.4	Very low	35.7	Very low	150 Å²	150	136.3 Å²	136.3	77%	0.769	81%	0.807	S	S	*	*			cis	-161	172.2	-0.3	31.8	167.1	0	0	0	110.2
395	S	27.8	Very low	36.1	Very low	111 Å²	111	136.1 Å²	136.1	78%	0.776	81%	0.808	S	S	*	*			trans	71.2	143.3	162.1	-69.3	0	0	0	0	118.8
396	T	30.1	Very low	35.8	Very low	139 Å²	139	142.3 Å²	142.3	85%	0.853	82%	0.816	S	S	*	*			cis	-140.2	145.5	-6.3	38.7	0	0	0	0	111.1
397	A	35.7	Very low	36	Very low	105 Å²	105	141.1 Å²	141.1	87%	0.868	81%	0.814	S	S	*	*			trans	-160.8	161.1	166.3	0	0	0	0	0	111.7
398	T	35.8	Very low	36.1	Very low	140 Å²	140	141.6 Å²	141.6	86%	0.859	81%	0.811	S	S	*	*			trans	-98.9	160.7	-168	38.2	0	0	0	0	115.6
399	P	45.5	Very low	36.4	Very low	121 Å²	121	141 Å²	141	79%	0.786	81%	0.807	S	S	*	*			trans	-88.5	178.9	-176.5	41	-40.2	0	0	0	112.3
400	D	28.9	Very low	35.7	Very low	148 Å²	148	140 Å²	140	79%	0.791	80%	0.803	S	S	*	*			cis	-148.8	166.1	9.5	-167	4.1	0	0	0	111.1
401	R	35.7	Very low	36	Very low	229 Å²	229	145 Å²	145	86%	0.864	80%	0.804	S	S	*	*			trans	-159.3	94.7	171.4	-175.4	-170	141.2	166.9	-5.8	115.2
402	T	38.8	Very low	36.4	Very low	124 Å²	124	147.4 Å²	147.4	76%	0.761	82%	0.817	S	S	*	*			trans	-166.5	163.7	146	40.1	0	0	0	0	110.5
403	R	38	Very low	36.7	Very low	218 Å²	218	144.7 Å²	144.7	82%	0.823	81%	0.813	S	S	*	*			cis	-165.7	107.9	-33.2	-177.8	-177.6	-148.3	162.6	5	109.4
404	F	41.9	Very low	36.6	Very low	194 Å²	194	149 Å²	149	85%	0.851	82%	0.819	S	S	*	*			trans	23.5	135.8	166.7	-53.2	-71.1	0	0	0	121.9
405	P	43	Very low	36.6	Very low	131 Å²	131	150 Å²	150	85%	0.851	82%	0.82	S	S	*	*				-130.6	-175.1	117	39.2	-32.5	0	0	0	114.5
406	R	43.5	Very low	36.8	Very low	253 Å²	253	148.6 Å²	148.6	96%	0.955	82%	0.823	S	S	*	*			trans	-94.2	142	-174.6	-62	173.6	172.2	114.3	-6.6	112.6
407	G	36.3	Very low	37	Very low	80 Å²	80	150.7 Å²	150.7	83%	0.825	82%	0.823	S	S	*	*			trans	106.5	102.2	135	0	0	0	0	0	118.8
408	S	31.3	Very low	36.9	Very low	109 Å²	109	154 Å²	154	76%	0.762	82%	0.821	S	S	*	*			trans	-147.7	150.4	136.2	70	0	0	0	0	109.4
409	S	35.7	Very low	36.8	Very low	110 Å²	110	154.4 Å²	154.4	77%	0.769	82%	0.817	S	S	*	*			trans	-131.2	84	168.1	-167.5	0	0	0	0	107.7	R411	S409-R411 PolarHBondContact O-N 3.05Å
410	S	34.3	Very low	36.6	Very low	113 Å²	113	154.5 Å²	154.5	79%	0.79	80%	0.802	S	S	*	*			trans	-70.6	72.6	178.1	-55.9	0	0	0	0	110.2	S412	S410-S412 VanDerWaalsContact C-N 3.33Å; S410-S412 PolarHBondContact O-N 2.91Å
411	R	39.2	Very low	36.7	Very low	222 Å²	222	153.9 Å²	153.9	84%	0.838	79%	0.794	S	S	*	*			trans	-81.5	80.1	-176.1	-167.6	174.8	-172.4	-126.5	0.7	109.6	S409 T413	S409-R411 PolarHBondContact O-N 3.05Å; R411-T413 PolarHBondContact O-N 2.67Å
412	S	40.9	Very low	36.6	Very low	116 Å²	116	147.1 Å²	147.1	81%	0.811	77%	0.769	S	S	*	*			trans	-50.2	127.9	-178.8	-175.8	0	0	0	0	112.1	S410	S410-S412 VanDerWaalsContact C-N 3.33Å; S410-S412 PolarHBondContact O-N 2.91Å
413	T	42.2	Very low	36.5	Very low	122 Å²	122	150.9 Å²	150.9	75%	0.748	77%	0.769	S	S	*	*			trans	-104.6	104.3	175.8	47.3	0	0	0	0	109.3	R411	R411-T413 PolarHBondContact O-N 2.67Å
414	F	29.4	Very low	36.2	Very low	193 Å²	193	144.6 Å²	144.6	85%	0.846	76%	0.758	S	S	*	*			trans	-139.1	136.2	159	-150.4	-94.8	0	0	0	110.5
415	H	35.6	Very low	35.7	Very low	171 Å²	171	141.7 Å²	141.7	79%	0.792	76%	0.756	S	S	*	*			trans	-96.9	107	-179.6	-81.5	-105.5	0	0	0	109.1	E417	H415-E417 PolarHBondContact O-N 2.99Å
416	G	31.7	Very low	35.1	Very low	82 Å²	82	139.8 Å²	139.8	85%	0.845	75%	0.752	S	S	*	*			trans	-73.6	89.6	169.3	0	0	0	0	0	110.3	Q418	G416-Q418 PolarHBondContact O-N 2.83Å
417	E	32.8	Very low	34.5	Very low	183 Å²	183	138.9 Å²	138.9	86%	0.855	75%	0.75	S	S	*	*			trans	-72.9	119.6	168.4	-180	169	-149.2	0	0	109.4	H415	H415-E417 PolarHBondContact O-N 2.99Å
418	Q	34.9	Very low	34.3	Very low	175 Å²	175	142.6 Å²	142.6	82%	0.818	75%	0.751	S	S	*	*			trans	-147.1	111.8	153.8	-131.5	177	15.7	0	0	113.8	G416	G416-Q418 PolarHBondContact O-N 2.83Å
419	L	33.8	Very low	34.6	Very low	149 Å²	149	140.7 Å²	140.7	78%	0.78	75%	0.748	S	S	*	*			trans	-35.3	130.7	148.7	-141.4	165	0	0	0	110.9
420	R	41.3	Very low	35	Very low	123 Å²	123	141.5 Å²	141.5	46%	0.464	75%	0.751	S	S	.	*			trans	-81	137	168.6	-73.3	178.7	176.3	116.3	-11.5	109.7	F502	R420-F502 HydrophobicContact CB-CD1 4.44Å; R420-F502 HydrophobicContact CB-CD2 4.39Å; R420-F502 HydrophobicContact CB-CE1 3.76Å; R420-F502 HydrophobicContact CB-CE2 3.71Å; R420-F502 HydrophobicContact CB-CZ 3.36Å; R420-F502 VanDerWaalsContact CD-CD1 3.42Å; R420-F502 VanDerWaalsContact CD-CE1 3.43Å; R420-F502 HydrophobicContact CG-CE1 4.32Å; R420-F502 HydrophobicContact CG-CZ 4.33Å; R420-F502 WeakPolarHBondContact O-CE2 3.15Å; R420-F502 VanDerWaalsContact O-CZ 3.3Å; R420-F502 WeakPolarHBondContact O-CZ 3.3Å
421	E	31.1	Very low	35.7	Very low	134 Å²	134	141.8 Å²	141.8	63%	0.626	75%	0.75	S	S	*	*			trans	-109.2	151.6	147.2	-165	48.1	-82.5	0	0	111	R501	E421-R501 IonicContact OE1-CZ 2.66Å; E421-R501 IonicContact OE1-NE 2.69Å; E421-R501 PolarHBondContact OE1-NE 3.13Å; E421-R501 IonicContact OE1-NH2 2.79Å; E421-R501 PolarHBondContact OE1-NH2 3.11Å; E421-R501 IonicContact OE2-CZ 3.19Å; E421-R501 IonicContact OE2-NE 2.85Å; E421-R501 IonicContact OE2-NH2 2.67Å; E421-R501 PolarHBondContact OE2-NH2 2.73Å
422	R	34	Very low	35.4	Very low	88 Å²	88	136 Å²	136	33%	0.332	75%	0.75	S	S	.	*			trans	-92.1	137.3	-175.1	-75	178.9	160.4	-101.7	2.5	111.4	R501 F502	R422-R501 PolarHBondContact NE-O 3.07Å; R422-R501 PolarHBondContact NH2-O 3.34Å; R422-F502 HydrophobicContact CG-CE1 3.62Å; R422-F502 HydrophobicContact CG-CZ 4.01Å
423	R	35.1	Very low	35.1	Very low	203 Å²	203	135.8 Å²	135.8	77%	0.766	75%	0.748	S	S	*	*			trans	-79.2	140.2	138.5	-95.6	-177.3	173.3	153.3	1.7	110.4
424	S	31.7	Very low	35.5	Very low	85 Å²	85	135.7 Å²	135.7	59%	0.594	75%	0.75	S	S	*	*			trans	-123.4	100.8	141.5	-65.6	0	0	0	0	104
425	V	32.2	Very low	35.6	Very low	133 Å²	133	131.6 Å²	131.6	81%	0.806	75%	0.745	S	S	*	*				54.3	85.7	89.1	-175.9	0	0	0	0	110.1
426	A	29.9	Very low	35.6	Very low	92 Å²	92	130.6 Å²	130.6	76%	0.76	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-74.8	163.2	158.6	0	0	0	0	0	109.9
427	Y	30.8	Very low	35.4	Very low	234 Å²	234	134.1 Å²	134.1	92%	0.918	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-77.9	159.8	-179.6	-156.2	-104.6	0	0	0	111.6
428	N	32.6	Very low	35.4	Very low	158 Å²	158	132.2 Å²	132.2	85%	0.845	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-79.3	139.9	178.9	-76.4	-35.7	0	0	0	112.1
429	G	37.3	Very low	35.2	Very low	68 Å²	68	127.4 Å²	127.4	70%	0.701	73%	0.733	S	S	*	*			trans	-170.9	114.1	168.4	0	0	0	0	0	111.8
430	P	43.5	Very low	35.1	Very low	128 Å²	128	124.4 Å²	124.4	83%	0.831	73%	0.73	S	S	*	*			trans	-80.3	165.6	172.6	33.1	-33.2	0	0	0	112.2
431	P	50.2	Low	34.6	Very low	119 Å²	119	128.3 Å²	128.3	77%	0.773	75%	0.75	S	S	*	*			trans	-103.4	169.5	-151.9	39.5	-37.4	0	0	0	116
432	A	32.8	Very low	34.6	Very low	101 Å²	101	126.5 Å²	126.5	84%	0.835	76%	0.759	S	S	*	*			trans	-126.4	147.1	152.7	0	0	0	0	0	108.8
433	S	34.2	Very low	34.7	Very low	110 Å²	110	131 Å²	131	77%	0.769	78%	0.783	S	S	*	*			trans	-113	-162.5	-170.5	-45.2	0	0	0	0	111.6
434	P	50.9	Low	34.5	Very low	121 Å²	121	125.8 Å²	125.8	79%	0.786	78%	0.783	S	S	*	*				-115.1	176.1	-127.7	37.8	-19.6	0	0	0	114.9
435	S	31.5	Very low	34.5	Very low	106 Å²	106	133.4 Å²	133.4	74%	0.741	80%	0.799	S	S	*	*			trans	-156	131.1	164.6	-85	0	0	0	0	113
436	H	34.7	Very low	34.5	Very low	150 Å²	150	139.3 Å²	139.3	69%	0.694	81%	0.806	S	S	*	*			trans	37.3	122.2	151.3	-58.1	-69.9	0	0	0	120.7
437	E	28	Very low	34.5	Very low	157 Å²	157	138 Å²	138	73%	0.734	80%	0.802	S	S	*	*				65.3	122.4	67.3	-63.4	-177.6	129.5	0	0	113.1
438	T	32.2	Very low	35	Very low	143 Å²	143	133.6 Å²	133.6	88%	0.877	80%	0.8	S	S	*	*				-171.5	176.2	69.7	37.3	0	0	0	0	110.6
439	G	31.8	Very low	35.2	Very low	74 Å²	74	131.5 Å²	131.5	76%	0.763	80%	0.798	S	S	*	*			trans	124.6	57.8	150.5	0	0	0	0	0	121.5
440	A	31.8	Very low	35.3	Very low	86 Å²	86	135 Å²	135	71%	0.711	81%	0.806	S	S	*	*			trans	35.2	121.7	139.6	0	0	0	0	0	123.8
441	F	30.8	Very low	34.8	Very low	204 Å²	204	132.3 Å²	132.3	90%	0.895	80%	0.801	S	S	*	*			trans	46.7	121	133.4	-68.7	-82.7	0	0	0	123.6
442	A	31.3	Very low	34.6	Very low	97 Å²	97	134.3 Å²	134.3	80%	0.802	80%	0.803	S	S	*	*				-159.7	161.1	127.4	0	0	0	0	0	111.7
443	H	35.2	Very low	35.2	Very low	183 Å²	183	136.8 Å²	136.8	85%	0.847	80%	0.801	S	S	*	*			trans	-109.5	145.4	170.3	-71.7	-12.8	0	0	0	110.8
444	A	31.8	Very low	35.1	Very low	92 Å²	92	136.4 Å²	136.4	76%	0.76	80%	0.799	S	S	*	*				157.1	139.9	120.2	0	0	0	0	0	115.9
445	R	31.1	Very low	34.6	Very low	245 Å²	245	139.4 Å²	139.4	93%	0.925	80%	0.799	S	S	*	*			trans	45.4	121.5	139.9	-62.1	180	177.9	-168.9	-0.9	122
446	R	32.8	Very low	35.1	Very low	257 Å²	257	141.2 Å²	141.2	97%	0.97	80%	0.799	S	S	*	*			trans	6.5	130.5	144.5	-56.1	179.2	-178.3	-175.3	-0.2	119
447	G	30.1	Very low	35.1	Very low	65 Å²	65	141 Å²	141	67%	0.67	81%	0.808	S	S	*	*			trans	143.5	89.8	141.9	0	0	0	0	0	119.6
448	T	40.7	Very low	35.5	Very low	142 Å²	142	138.3 Å²	138.3	87%	0.871	81%	0.807	S	S	*	*			trans	25.8	113.5	143.5	53.8	0	0	0	0	122
449	S	36.4	Very low	35.9	Very low	114 Å²	114	139 Å²	139	80%	0.797	80%	0.798	S	S	*	*			trans	171.5	157.6	144.5	28.9	0	0	0	0	109.5
450	T	39.9	Very low	35.8	Very low	142 Å²	142	142.9 Å²	142.9	87%	0.871	79%	0.794	S	S	*	*			cis	175	140.8	-26	32.8	0	0	0	0	106.5
451	G	32.4	Very low	35.9	Very low	71 Å²	71	145.8 Å²	145.8	73%	0.732	80%	0.802	S	S	*	*			trans	146.2	154.2	170.6	0	0	0	0	0	114.6
452	I	47.1	Very low	36.2	Very low	160 Å²	160	146.3 Å²	146.3	82%	0.821	80%	0.799	S	S	*	*			cis	-146.8	120.2	-8.8	-45	174.5	0	0	0	110.7
453	I	43.8	Very low	36.4	Very low	153 Å²	153	152.1 Å²	152.1	79%	0.785	80%	0.8	S	S	*	*			trans	27.4	128.1	142	-44.3	176.9	0	0	0	122.2
454	S	33.8	Very low	36.2	Very low	103 Å²	103	149.5 Å²	149.5	72%	0.72	79%	0.792	S	S	*	*			trans	59.2	113.1	147.8	-64.4	0	0	0	0	125.7
455	K	39.5	Very low	36.7	Very low	184 Å²	184	151.5 Å²	151.5	80%	0.8	80%	0.797	S	S	*	*				39.4	123.7	105.7	-73.9	-176.6	177.7	178.9	0	121.9
456	I	41.4	Very low	36.9	Very low	144 Å²	144	144.7 Å²	144.7	74%	0.738	79%	0.787	S	S	*	*			trans	77.9	118	138.3	-58.8	164	0	0	0	119.2
457	T	35.5	Very low	36.9	Very low	145 Å²	145	141.8 Å²	141.8	89%	0.89	78%	0.784	S	S	*	*				-126.6	153.4	128.9	54.3	0	0	0	0	110.2
458	S	35.1	Very low	37	Very low	100 Å²	100	142 Å²	142	70%	0.699	79%	0.786	S	S	*	*			trans	-122.1	162.7	173.1	-169.5	0	0	0	0	106.2
459	K	40.6	Very low	36.6	Very low	158 Å²	158	144.2 Å²	144.2	69%	0.687	79%	0.787	S	S	*	*				-168.4	178.5	58.5	-63.3	167.5	-171.4	172.6	0	106.6
460	F	30.5	Very low	36.5	Very low	156 Å²	156	143.6 Å²	143.6	68%	0.684	79%	0.789	S	S	*	*			cis	-136.4	173.7	13.4	-73.6	-88.9	0	0	0	107.7
461	V	33.7	Very low	36.1	Very low	146 Å²	146	142.6 Å²	142.6	89%	0.885	79%	0.788	S	S	*	*			cis	-134.4	-176.2	40	173.1	0	0	0	0	111.1
462	R	38.1	Very low	36.1	Very low	216 Å²	216	142.5 Å²	142.5	82%	0.815	79%	0.786	S	S	*	*			trans	-98.6	174.8	-155.6	-58.7	178.8	-172.9	153	3.2	115
463	R	34.5	Very low	35.8	Very low	219 Å²	219	146.6 Å²	146.6	83%	0.826	79%	0.791	S	S	*	*			trans	-69.5	-175	168	-50.8	-175.7	-172.1	111	-2.6	111
464	D	32.2	Very low	35.4	Very low	127 Å²	127	146.1 Å²	146.1	68%	0.679	80%	0.796	S	S	*	*			cis	-143.1	177.6	20.1	-67.4	-81.1	0	0	0	112.1
465	P	42.4	Very low	35.4	Very low	134 Å²	134	148.8 Å²	148.8	87%	0.87	80%	0.802	S	S	*	*				-130	155.5	125.7	38	-32.1	0	0	0	113.4
466	S	33.9	Very low	35.2	Very low	103 Å²	103	146.8 Å²	146.8	72%	0.72	81%	0.805	S	S	*	*			trans	-144.1	153.6	178.3	58.4	0	0	0	0	112
467	E	33.8	Very low	34.8	Very low	195 Å²	195	144.9 Å²	144.9	91%	0.911	81%	0.805	S	S	*	*			trans	72.9	162.6	165.5	-46.2	-161.1	144.9	0	0	118.6
468	G	32.2	Very low	34.8	Very low	69 Å²	69	148.9 Å²	148.9	71%	0.711	80%	0.804	S	S	*	*			trans	87	83.2	-175.8	0	0	0	0	0	113.8
469	E	32	Very low	34.7	Very low	190 Å²	190	149.3 Å²	149.3	89%	0.888	81%	0.807	S	S	*	*				73.5	137.4	66.8	-68	-148.3	108	0	0	116.9
470	A	33.2	Very low	34.5	Very low	101 Å²	101	148.1 Å²	148.1	84%	0.835	81%	0.813	S	S	*	*			trans	63.4	162	158.9	0	0	0	0	0	119.4
471	S	33.1	Very low	34.6	Very low	121 Å²	121	146.6 Å²	146.6	85%	0.846	82%	0.821	S	S	*	*			cis	-169.7	162.3	-34.8	-173.2	0	0	0	0	108.9
472	G	31.4	Very low	34.4	Very low	68 Å²	68	143.4 Å²	143.4	70%	0.701	82%	0.819	S	S	*	*			trans	82.3	126.1	176.7	0	0	0	0	0	113.4
473	R	40.3	Very low	34.3	Very low	246 Å²	246	140.9 Å²	140.9	93%	0.928	82%	0.816	S	S	*	*			cis	57.4	107	38.1	-78	-174.6	158.5	-177.9	-5.1	115.5
474	T	36.5	Very low	34.7	Very low	144 Å²	144	135.7 Å²	135.7	88%	0.883	81%	0.81	S	S	*	*				-164.3	125.7	119.4	26.2	0	0	0	0	110.7
475	D	33.9	Very low	34.8	Very low	158 Å²	158	136.8 Å²	136.8	85%	0.845	81%	0.809	S	S	*	*			trans	-77	150.4	158.9	-65.8	-83.9	0	0	0	110.5
476	T	34.4	Very low	34.6	Very low	142 Å²	142	137.7 Å²	137.7	87%	0.871	80%	0.802	S	S	*	*			trans	-156.1	148.5	150.8	-72.9	0	0	0	0	110.5
477	S	33.4	Very low	35.1	Very low	104 Å²	104	142.9 Å²	142.9	73%	0.727	81%	0.806	S	S	*	*			trans	-78.4	138.7	-158.7	52.6	0	0	0	0	118.4
478	R	35.6	Very low	35.6	Very low	230 Å²	230	141.5 Å²	141.5	87%	0.868	81%	0.805	S	S	*	*				22.4	125.1	124.5	173.2	-167.7	-79.7	-176	-5	117.8
479	S	33.3	Very low	36.1	Very low	109 Å²	109	146.4 Å²	146.4	76%	0.762	81%	0.806	S	S	*	*				-170.4	124.1	121.7	-81.6	0	0	0	0	116
480	T	35.6	Very low	36.7	Very low	132 Å²	132	146.1 Å²	146.1	81%	0.81	81%	0.805	S	S	*	*			trans	14.9	123.8	147.3	57.8	0	0	0	0	122.9
481	S	33.8	Very low	37.2	Very low	124 Å²	124	149.6 Å²	149.6	87%	0.867	80%	0.804	S	S	*	*			trans	-174.8	145.2	130.2	58.4	0	0	0	0	113.3
482	G	29.2	Very low	37.8	Very low	80 Å²	80	146.9 Å²	146.9	83%	0.825	80%	0.795	S	S	*	*			trans	84.1	121.1	149.1	0	0	0	0	0	120.2
483	E	34.9	Very low	38.5	Very low	162 Å²	162	151.5 Å²	151.5	76%	0.757	80%	0.796	S	S	*	*			trans	-77.4	171.1	155.8	-103.4	-109.6	109.4	0	0	110.8	K485	E483-K485 PolarHBondContact OE1-N 3.45Å
484	P	43.2	Very low	39	Very low	110 Å²	110	146.1 Å²	146.1	71%	0.714	79%	0.786	S	S	*	*			cis	-127.4	169.7	7.2	39.5	-23.9	0	0	0	116.8
485	K	33.8	Very low	40.5	Very low	150 Å²	150	142.6 Å²	142.6	65%	0.652	77%	0.767	S	S	*	*			trans	-42.8	133.4	175	-74.6	169	173.4	162.8	0	116.2	E483 R487	E483-K485 PolarHBondContact OE1-N 3.45Å; K485-R487 HydrophobicContact CB-CG 4.5Å; K485-R487 PolarHBondContact O-N 2.69Å
486	E	38.5	Very low	43	Very low	154 Å²	154	143.1 Å²	143.1	72%	0.72	76%	0.762	S	S	*	*			trans	-58.3	120.2	150.4	-76.1	-167.2	117.7	0	0	109.6	K489	E486-K489 IonicContact OE1-NZ 2.82Å; E486-K489 PolarHBondContact OE1-NZ 3.16Å
487	R	44.9	Very low	45.5	Very low	211 Å²	211	137 Å²	137	80%	0.796	72%	0.724	S	S	*	*			trans	-144.4	53.7	167.4	-85.8	-160	-69.4	-175.9	-2	112.1	K485	K485-R487 HydrophobicContact CB-CG 4.5Å; K485-R487 PolarHBondContact O-N 2.69Å
488	D	43.4	Very low	48.2	Very low	166 Å²	166	137.1 Å²	137.1	89%	0.888	71%	0.708	S	S	*	*			trans	-155.5	73.9	164.7	-101.8	-38.2	0	0	0	110.6
489	K	44.5	Very low	50.8	Low	172 Å²	172	130 Å²	130	75%	0.748	69%	0.694	S	S	*	*			trans	-156	19.7	178.9	-117.8	172.1	-157	163.6	0	116.7	E486	E486-K489 IonicContact OE1-NZ 2.82Å; E486-K489 PolarHBondContact OE1-NZ 3.16Å
490	E	44.3	Very low	53.2	Low	185 Å²	185	126.6 Å²	126.6	86%	0.864	67%	0.667	S	S	*	*			trans	-119.7	15.6	175.4	-140	-169.3	160.7	0	0	115.2	G492	E490-G492 PolarHBondContact O-N 3.04Å
491	E	43.2	Very low	54.9	Low	173 Å²	173	126.2 Å²	126.2	81%	0.808	65%	0.651	S	S	*	*			trans	-92.2	24.7	167.6	-142.8	-174.6	-144.6	0	0	113.1	K493 R537	E491-K493 VanDerWaalsContact C-N 3.29Å; E491-K493 PolarHBondContact O-N 3.44Å; E491-R537 PolarHBondContact O-NH2 3.21Å
492	G	45.3	Very low	56.2	Low	64 Å²	64	122.8 Å²	122.8	66%	0.66	62%	0.621	S	S	*	*			trans	-82.6	19.5	-178.8	0	0	0	0	0	115.6	E490 D494	E490-G492 PolarHBondContact O-N 3.04Å; G492-D494 PolarHBondContact O-N 3.17Å
493	K	46	Very low	57.8	Low	166 Å²	166	121.4 Å²	121.4	72%	0.722	60%	0.596	S	S	*	*			trans	-72.7	120.6	174	-76.7	178.9	-179.7	168.7	0	109.8	E491 S495	E491-K493 VanDerWaalsContact C-N 3.29Å; E491-K493 PolarHBondContact O-N 3.44Å; K493-S495 PolarHBondContact O-N 3.23Å; K493-S495 PolarHBondContact O-OG 3.3Å
494	D	51.4	Low	58.5	Low	133 Å²	133	124.5 Å²	124.5	71%	0.711	60%	0.601	S	S	*	*			trans	-66.5	72.6	176	-74.3	-49.5	0	0	0	111.9	G492 K496	G492-D494 PolarHBondContact O-N 3.17Å; D494-K496 PolarHBondContact O-N 3Å
495	S	68.6	Low	59	Low	70 Å²	70	123.5 Å²	123.5	49%	0.49	60%	0.597	S	S	.	*			trans	-72.3	64.2	178.9	-60.7	0	0	0	0	111.3	K493 F538	K493-S495 PolarHBondContact O-N 3.23Å; K493-S495 PolarHBondContact O-OG 3.3Å; S495-F538 VanDerWaalsContact O-CD2 3.25Å; S495-F538 WeakPolarHBondContact O-CD2 3.3Å; S495-F538 WeakPolarHBondContact O-CE2 3.26Å
496	K	85	Confident	60.6	Low	169 Å²	169	117.6 Å²	117.6	74%	0.735	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-46.8	137.9	-178.8	-71	157.9	-173.7	168.5	0	110.6	D494	D494-K496 PolarHBondContact O-N 3Å
497	P	88.4	Confident	61.9	Low	12 Å²	12	118.4 Å²	118.4	8%	0.078	57%	0.572	C	S	.	*	P	Polyproline II helix	trans	-58.4	144.4	-173.4	23.3	-34.3	0	0	0	112.1	S499 P514 F538 V559 K561	P497-S499 PolarHBondContact O-N 2.96Å; P497-P514 HydrophobicContact CG-CB 3.89Å; P497-P514 HydrophobicContact CG-CG 3.61Å; P497-F538 HydrophobicContact CB-CB 4.21Å; P497-F538 HydrophobicContact CB-CD2 3.84Å; P497-F538 HydrophobicContact CB-CE2 4.43Å; P497-F538 HydrophobicContact CB-CG 3.94Å; P497-F538 HydrophobicContact CG-CD2 4.39Å; P497-V559 HydrophobicContact CB-CG1 4.39Å; P497-V559 WeakPolarHBondContact CB-O 3.46Å; P497-K561 HydrophobicContact CG-CD 3.85Å; P497-K561 HydrophobicContact CG-CG 4.07Å; P497-K561 WeakPolarHBondContact O-CG 3.35Å
498	R	90.3	Very high	63.7	Low	107 Å²	107	109.1 Å²	109.1	40%	0.404	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	134.5	-170.5	-162.9	175.4	-68	138.3	-8.4	111.3	E536 E558 C560 K561	R498-E536 IonicContact CZ-OE1 3.87Å; R498-E536 IonicContact CZ-OE2 2.73Å; R498-E536 IonicContact NH1-OE1 3.7Å; R498-E536 IonicContact NH2-OE1 3.64Å; R498-E536 PolarHBondContact NH2-OE1 3.31Å; R498-E536 IonicContact NH2-OE2 3.46Å; R498-E536 PolarHBondContact NH2-OE2 2.79Å; R498-E558 WeakPolarHBondContact CB-OE1 3.21Å; R498-E558 VanDerWaalsContact CD-OE1 3.3Å; R498-E558 WeakPolarHBondContact CD-OE1 3.3Å; R498-E558 IonicContact CZ-OE1 2.83Å; R498-E558 IonicContact NE-OE1 3.48Å; R498-E558 VanDerWaalsContact NH1-CD 3.32Å; R498-E558 IonicContact NH1-OE1 3.72Å; R498-E558 PolarHBondContact NH1-OE1 3.34Å; R498-E558 IonicContact NH1-OE2 3.14Å; R498-C560 CarbonylContact O-C 3.52Å; R498-C560 VanDerWaalsContact O-CA 3.23Å; R498-C560 WeakPolarHBondContact O-CA 3.5Å; R498-C560 WeakPolarHBondContact O-CB 3.36Å; R498-K561 PolarHBondContact O-N 3.47Å
499	S	89.3	Confident	65.9	Low	80 Å²	80	103.9 Å²	103.9	56%	0.559	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	114.2	-179	-73.8	0	0	0	0	111.8	P497	P497-S499 PolarHBondContact O-N 2.96Å
500	L	84.4	Confident	68.2	Low	39 Å²	39	95.9 Å²	95.9	20%	0.204	48%	0.479	C	S	.	.			trans	-99	120.4	-179	-67.6	177.6	0	0	0	112.2	F502 M506 C560 K561 L562 P563	L500-F502 PolarHBondContact O-N 2.94Å; L500-F502 VanDerWaalsContact O-N 3.13Å; L500-M506 HydrophobicContact CD1-CE 3.77Å; L500-C560 HydrophobicContact CD1-CB 3.8Å; L500-C560 HydrophobicContact CG-CB 4.08Å; L500-K561 PolarHBondContact N-O 3.48Å; L500-L562 HydrophobicContact CB-CD2 4.43Å; L500-P563 WeakPolarHBondContact O-CD 3.27Å
501	R	70.8	Confident	70.5	Confident	124 Å²	124	92.1 Å²	92.1	47%	0.468	47%	0.473	S	S	.	.	S	Bend	trans	-65.8	-10.5	179.2	-168.8	173.9	179	92.3	-10	113.8	E421 R422	E421-R501 IonicContact OE1-CZ 2.66Å; E421-R501 IonicContact OE1-NE 2.69Å; E421-R501 PolarHBondContact OE1-NE 3.13Å; E421-R501 IonicContact OE1-NH2 2.79Å; E421-R501 PolarHBondContact OE1-NH2 3.11Å; E421-R501 IonicContact OE2-CZ 3.19Å; E421-R501 IonicContact OE2-NE 2.85Å; E421-R501 IonicContact OE2-NH2 2.67Å; E421-R501 PolarHBondContact OE2-NH2 2.73Å; R422-R501 PolarHBondContact NE-O 3.07Å; R422-R501 PolarHBondContact NH2-O 3.34Å
502	F	61.7	Low	72.8	Confident	52 Å²	52	87.2 Å²	87.2	23%	0.228	45%	0.451	C	S	.	.			trans	-138.4	126.3	-170.7	-56.6	-68.6	0	0	0	113.1	R420 R422 L500	R420-F502 HydrophobicContact CB-CD1 4.44Å; R420-F502 HydrophobicContact CB-CD2 4.39Å; R420-F502 HydrophobicContact CB-CE1 3.76Å; R420-F502 HydrophobicContact CB-CE2 3.71Å; R420-F502 HydrophobicContact CB-CZ 3.36Å; R420-F502 VanDerWaalsContact CD-CD1 3.42Å; R420-F502 VanDerWaalsContact CD-CE1 3.43Å; R420-F502 HydrophobicContact CG-CE1 4.32Å; R420-F502 HydrophobicContact CG-CZ 4.33Å; R420-F502 WeakPolarHBondContact O-CE2 3.15Å; R420-F502 VanDerWaalsContact O-CZ 3.3Å; R420-F502 WeakPolarHBondContact O-CZ 3.3Å; R422-F502 HydrophobicContact CG-CE1 3.62Å; R422-F502 HydrophobicContact CG-CZ 4.01Å; L500-F502 PolarHBondContact O-N 2.94Å; L500-F502 VanDerWaalsContact O-N 3.13Å
503	T	62	Low	75.1	Confident	50 Å²	50	88 Å²	88	31%	0.307	44%	0.441	S	S	.	.			trans	-101.2	-7.4	-172.5	47.5	0	0	0	0	114.9	S505 M506 L562 L565	T503-S505 PolarHBondContact O-N 3.27Å; T503-M506 PolarHBondContact O-N 3.06Å; T503-L562 HydrophobicContact CG2-CB 4.28Å; T503-L562 HydrophobicContact CG2-CD1 4.27Å; T503-L562 HydrophobicContact CG2-CD2 4.1Å; T503-L562 HydrophobicContact CG2-CG 4.45Å; T503-L565 HydrophobicContact CG2-CD1 3.93Å; T503-L565 HydrophobicContact CG2-CG 4.32Å
504	W	50.3	Low	77.5	Confident	228 Å²	228	80.8 Å²	80.8	86%	0.864	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-17.7	-163.8	-172.3	-88.9	0	0	0	116.4
505	S	53.5	Low	79.6	Confident	89 Å²	89	78 Å²	78	62%	0.622	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	-2.3	178.7	56.7	0	0	0	0	114.8	T503 K507	T503-S505 PolarHBondContact O-N 3.27Å; S505-K507 PolarHBondContact O-N 3.37Å
506	M	67.8	Low	80.9	Confident	25 Å²	25	77.5 Å²	77.5	12%	0.123	39%	0.387	C	S	.	.			trans	-82	118.2	177.2	-108	59.3	86.5	0	0	110	L500 T503 T509 L562 R571	L500-M506 HydrophobicContact CD1-CE 3.77Å; T503-M506 PolarHBondContact O-N 3.06Å; M506-T509 HydrophobicContact CB-CG2 4.21Å; M506-L562 HydrophobicContact CB-CD1 4.39Å; M506-L562 HydrophobicContact CE-CD2 3.78Å; M506-L562 HydrophobicContact CG-CD1 4.33Å; M506-R571 HydrophobicContact CE-CB 4.25Å; M506-R571 VanDerWaalsContact SD-CA 3.58Å; M506-R571 HydrophobicContact SD-CB 3.62Å; M506-R571 HydrophobicContact SD-CG 4.25Å
507	K	64.8	Low	81.4	Confident	171 Å²	171	69.5 Å²	69.5	74%	0.743	35%	0.353	S	S	*	.			trans	-97	-26.3	169.8	-66.7	-177.1	178.4	-179.6	0	112.8	S505	S505-K507 PolarHBondContact O-N 3.37Å
508	T	81.8	Confident	81.9	Confident	16 Å²	16	69 Å²	69	10%	0.098	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	112.6	-174.5	-42.3	0	0	0	0	107.9	G569 V570 L593 L595	T508-G569 VanDerWaalsContact O-CA 3.3Å; T508-G569 WeakPolarHBondContact O-CA 3.47Å; T508-V570 HydrophobicContact CG2-CG2 4.46Å; T508-V570 PolarHBondContact O-N 2.91Å; T508-L593 HydrophobicContact CG2-CB 4.31Å; T508-L593 HydrophobicContact CG2-CD1 4.2Å; T508-L595 HydrophobicContact CG2-CD1 3.91Å
509	T	90.7	Very high	82.2	Confident	57 Å²	57	71.7 Å²	71.7	35%	0.35	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	140.5	-176.7	55.1	0	0	0	0	109.8	M506 L562 N568	M506-T509 HydrophobicContact CB-CG2 4.21Å; T509-L562 HydrophobicContact CG2-CD1 3.6Å; T509-N568 CarbonylContact C-O 3.6Å; T509-N568 VanDerWaalsContact CA-O 3.26Å; T509-N568 WeakPolarHBondContact CA-O 3.34Å
510	S	92.4	Very high	82.6	Confident	3 Å²	3	69.2 Å²	69.2	2%	0.021	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	153.2	-163.7	172.8	0	0	0	0	112.4	M512 L567 N568 L595	S510-M512 WeakPolarHBondContact OG-CB 3.42Å; S510-M512 PolarHBondContact OG-N 3.33Å; S510-L567 WeakPolarHBondContact O-CB 3.49Å; S510-N568 PolarHBondContact N-O 3.02Å; S510-N568 PolarHBondContact O-N 3.21Å; S510-L595 WeakPolarHBondContact CB-OXT 3.5Å; S510-L595 PolarHBondContact OG-OXT 3.46Å
511	S	91.9	Very high	83.3	Confident	107 Å²	107	67.4 Å²	67.4	75%	0.748	33%	0.33	S	S	*	.	S	Bend	trans	-96.5	-6.6	168.4	50.8	0	0	0	0	113.7
512	M	92.1	Very high	84.6	Confident	69 Å²	69	64.9 Å²	64.9	34%	0.34	32%	0.32	S	S	.	.	S	Bend	trans	-62.6	155.4	176.4	-70.6	-178.3	55.7	0	0	112.1	S510 D516 M517 N568 L595	S510-M512 WeakPolarHBondContact OG-CB 3.42Å; S510-M512 PolarHBondContact OG-N 3.33Å; M512-D516 HydrophobicContact CE-CB 3.84Å; M512-M517 HydrophobicContact CB-CG 4.11Å; M512-N568 PolarHBondContact O-ND2 3.33Å; M512-L595 HydrophobicContact SD-CD2 4.33Å
513	D	94.6	Very high	86.3	Confident	82 Å²	82	67.6 Å²	67.6	44%	0.439	33%	0.332	S	S	.	.			trans	-60.9	137.9	175.6	-174.9	-91.5	0	0	0	111.6	N515 D516 M517	D513-N515 PolarHBondContact O-N 3.07Å; D513-N515 VanDerWaalsContact O-N 3.11Å; D513-N515 VanDerWaalsContact OD1-CB 3.27Å; D513-N515 WeakPolarHBondContact OD1-CB 2.98Å; D513-N515 PolarHBondContact OD1-N 3.31Å; D513-N515 PolarHBondContact OD1-ND2 3.05Å; D513-D516 PolarHBondContact O-N 3.12Å; D513-M517 WeakPolarHBondContact O-CG 3.46Å; D513-M517 PolarHBondContact O-N 3.04Å
514	P	94.8	Very high	88	Confident	13 Å²	13	65.7 Å²	65.7	8%	0.084	32%	0.32	C	S	.	.	H	α-helix	trans	-52.9	-32.1	179.5	-30.1	38.2	0	0	0	115.3	P497 M518 F538 V559	P497-P514 HydrophobicContact CG-CB 3.89Å; P497-P514 HydrophobicContact CG-CG 3.61Å; P514-M518 VanDerWaalsContact O-CG 3.28Å; P514-M518 WeakPolarHBondContact O-CG 3.5Å; P514-M518 PolarHBondContact O-N 2.96Å; P514-F538 HydrophobicContact CB-CD1 3.9Å; P514-F538 HydrophobicContact CB-CE1 3.39Å; P514-F538 HydrophobicContact CB-CZ 3.78Å; P514-V559 HydrophobicContact CB-CG1 3.91Å
515	N	95.8	Very high	90.3	Very high	76 Å²	76	54.9 Å²	54.9	41%	0.406	28%	0.279	S	S	.	.	H	α-helix	trans	-72.7	-36.6	179.7	-57.7	-82.4	0	0	0	111.2	D513 M518 R519	D513-N515 PolarHBondContact O-N 3.07Å; D513-N515 VanDerWaalsContact O-N 3.11Å; D513-N515 VanDerWaalsContact OD1-CB 3.27Å; D513-N515 WeakPolarHBondContact OD1-CB 2.98Å; D513-N515 PolarHBondContact OD1-N 3.31Å; D513-N515 PolarHBondContact OD1-ND2 3.05Å; N515-M518 PolarHBondContact O-N 3.08Å; N515-R519 PolarHBondContact O-N 3.01Å
516	D	96.9	Very high	92.5	Very high	59 Å²	59	54.8 Å²	54.8	32%	0.316	27%	0.272	S	S	.	.	H	α-helix	trans	-75.8	-32.1	173.9	-72.5	-39.8	0	0	0	112.3	M512 D513 M518 R519 E520	M512-D516 HydrophobicContact CE-CB 3.84Å; D513-D516 PolarHBondContact O-N 3.12Å; D516-M518 VanDerWaalsContact C-N 3.3Å; D516-M518 PolarHBondContact O-N 2.89Å; D516-R519 WeakPolarHBondContact O-CB 3.16Å; D516-R519 PolarHBondContact O-N 3.13Å; D516-R519 VanDerWaalsContact O-N 3.15Å; D516-R519 IonicContact OD1-CZ 2.87Å; D516-R519 IonicContact OD1-NE 2.71Å; D516-R519 PolarHBondContact OD1-NE 2.97Å; D516-R519 IonicContact OD1-NH2 2.75Å; D516-R519 PolarHBondContact OD1-NH2 2.72Å; D516-E520 PolarHBondContact O-N 2.72Å
517	M	96.2	Very high	93.9	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-57.6	-45.1	166.4	-63.5	179.4	71.8	0	0	111.2	M512 D513 R519 E520 I521 V559 N568 V570 L595	M512-M517 HydrophobicContact CB-CG 4.11Å; D513-M517 WeakPolarHBondContact O-CG 3.46Å; D513-M517 PolarHBondContact O-N 3.04Å; M517-R519 VanDerWaalsContact C-N 3.31Å; M517-R519 PolarHBondContact O-N 2.5Å; M517-E520 PolarHBondContact O-N 2.99Å; M517-I521 WeakPolarHBondContact O-CB 2.93Å; M517-I521 WeakPolarHBondContact O-CD1 3.26Å; M517-I521 WeakPolarHBondContact O-CG1 3.16Å; M517-I521 PolarHBondContact O-N 2.88Å; M517-V559 HydrophobicContact CB-CG1 4.42Å; M517-V559 HydrophobicContact CB-CG2 4.13Å; M517-V559 HydrophobicContact CE-CG1 4.17Å; M517-V559 HydrophobicContact CE-CG2 4.5Å; M517-V559 HydrophobicContact SD-CG1 3.83Å; M517-N568 HydrophobicContact CE-CB 3.91Å; M517-N568 HydrophobicContact SD-CB 3.29Å; M517-N568 WeakPolarHBondContact SD-CB 3.27Å; M517-V570 HydrophobicContact CE-CG2 3.71Å; M517-L595 HydrophobicContact CB-CD2 4.12Å; M517-L595 HydrophobicContact CE-CD1 4.05Å; M517-L595 HydrophobicContact CG-CD2 4.08Å
518	M	97.2	Very high	95.5	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-65.2	-32.8	175.5	-69.9	-66.7	-66.6	0	0	112.7	P514 N515 D516 I521 R522 F538 L540 V559	P514-M518 VanDerWaalsContact O-CG 3.28Å; P514-M518 WeakPolarHBondContact O-CG 3.5Å; P514-M518 PolarHBondContact O-N 2.96Å; N515-M518 PolarHBondContact O-N 3.08Å; D516-M518 VanDerWaalsContact C-N 3.3Å; D516-M518 PolarHBondContact O-N 2.89Å; M518-I521 HydrophobicContact SD-CD1 4.33Å; M518-R522 WeakPolarHBondContact O-CG 3.4Å; M518-R522 PolarHBondContact O-N 2.86Å; M518-R522 VanDerWaalsContact O-N 3.11Å; M518-F538 HydrophobicContact CG-CD1 3.66Å; M518-F538 HydrophobicContact CG-CE1 4.15Å; M518-F538 HydrophobicContact SD-CD1 4.41Å; M518-L540 HydrophobicContact CE-CD1 4.33Å; M518-L540 HydrophobicContact CE-CD2 3.65Å; M518-L540 HydrophobicContact CE-CG 3.71Å; M518-V559 HydrophobicContact CG-CG2 4.03Å; M518-V559 HydrophobicContact SD-CB 4.21Å; M518-V559 HydrophobicContact SD-CG2 3.56Å; M518-V559 VanDerWaalsContact SD-CG2 3.56Å
519	R	97.6	Very high	96.2	Very high	163 Å²	163	55.3 Å²	55.3	62%	0.615	29%	0.293	S	S	*	.	H	α-helix	trans	-64.3	-47.9	174.3	-161.6	-162.5	-54.3	-113.2	7.3	111.3	N515 D516 M517 K523	N515-R519 PolarHBondContact O-N 3.01Å; D516-R519 WeakPolarHBondContact O-CB 3.16Å; D516-R519 PolarHBondContact O-N 3.13Å; D516-R519 VanDerWaalsContact O-N 3.15Å; D516-R519 IonicContact OD1-CZ 2.87Å; D516-R519 IonicContact OD1-NE 2.71Å; D516-R519 PolarHBondContact OD1-NE 2.97Å; D516-R519 IonicContact OD1-NH2 2.75Å; D516-R519 PolarHBondContact OD1-NH2 2.72Å; M517-R519 VanDerWaalsContact C-N 3.31Å; M517-R519 PolarHBondContact O-N 2.5Å; R519-K523 WeakPolarHBondContact O-CB 3.43Å; R519-K523 PolarHBondContact O-N 3.25Å; R519-K523 VanDerWaalsContact O-N 3.14Å
520	E	97.9	Very high	96.5	Very high	28 Å²	28	52.8 Å²	52.8	13%	0.131	28%	0.278	C	S	.	.	H	α-helix	trans	-69	-37.2	177.6	-171.8	64.9	-166.9	0	0	112	D516 M517 K523 V524 L593 L595	D516-E520 PolarHBondContact O-N 2.72Å; M517-E520 PolarHBondContact O-N 2.99Å; E520-K523 PolarHBondContact O-N 3.46Å; E520-K523 IonicContact OE1-NZ 2.68Å; E520-K523 PolarHBondContact OE1-NZ 2.78Å; E520-K523 IonicContact OE2-NZ 2.57Å; E520-K523 PolarHBondContact OE2-NZ 3.25Å; E520-V524 HydrophobicContact CG-CG2 4.38Å; E520-V524 WeakPolarHBondContact O-CB 3.37Å; E520-V524 WeakPolarHBondContact O-CG2 3.3Å; E520-V524 PolarHBondContact O-N 3.41Å; E520-L593 HydrophobicContact CG-CD2 4.46Å; E520-L595 HydrophobicContact CB-CD2 3.81Å; E520-L595 HydrophobicContact CG-CD2 4.03Å
521	I	97.9	Very high	96.8	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-58	-50.3	174.5	-73.7	162.5	0	0	0	111.3	M517 M518 V524 L525 L540 M557 V559 V570 L593	M517-I521 WeakPolarHBondContact O-CB 2.93Å; M517-I521 WeakPolarHBondContact O-CD1 3.26Å; M517-I521 WeakPolarHBondContact O-CG1 3.16Å; M517-I521 PolarHBondContact O-N 2.88Å; M518-I521 HydrophobicContact SD-CD1 4.33Å; I521-V524 PolarHBondContact O-N 3.31Å; I521-L525 HydrophobicContact CG2-CD1 3.74Å; I521-L525 HydrophobicContact CG2-CG 4.45Å; I521-L525 VanDerWaalsContact O-CG 3.28Å; I521-L525 WeakPolarHBondContact O-CG 3.49Å; I521-L525 PolarHBondContact O-N 2.65Å; I521-L540 HydrophobicContact CG2-CD1 3.64Å; I521-M557 HydrophobicContact CB-CE 4.49Å; I521-M557 HydrophobicContact CD1-CE 4.47Å; I521-M557 HydrophobicContact CG1-CE 4.13Å; I521-M557 HydrophobicContact CG2-CE 3.61Å; I521-M557 HydrophobicContact CG2-SD 4.3Å; I521-V559 HydrophobicContact CD1-CG2 3.5Å; I521-V570 HydrophobicContact CD1-CG1 3.96Å; I521-V570 HydrophobicContact CD1-CG2 3.92Å; I521-L593 HydrophobicContact CB-CD2 4.27Å; I521-L593 HydrophobicContact CG1-CD1 4.38Å; I521-L593 HydrophobicContact CG1-CD2 3.64Å
522	R	98.4	Very high	97.1	Very high	70 Å²	70	56.9 Å²	56.9	26%	0.264	29%	0.286	S	S	.	.	H	α-helix	trans	-59.5	-51	177.5	-73.1	-175.8	-64	-105.6	-6.7	111	M518 V524 L525 D526 Y532 L540	M518-R522 WeakPolarHBondContact O-CG 3.4Å; M518-R522 PolarHBondContact O-N 2.86Å; M518-R522 VanDerWaalsContact O-N 3.11Å; R522-V524 VanDerWaalsContact C-N 3.29Å; R522-V524 PolarHBondContact O-N 3.28Å; R522-L525 CarbonylContact O-C 3.5Å; R522-L525 WeakPolarHBondContact O-CA 3.32Å; R522-L525 WeakPolarHBondContact O-CB 3.11Å; R522-L525 PolarHBondContact O-N 2.97Å; R522-D526 VanDerWaalsContact C-OD2 3.25Å; R522-D526 PolarHBondContact O-N 3.01Å; R522-Y532 HydrophobicContact CB-CE1 4.41Å; R522-Y532 HydrophobicContact CB-CE2 4.09Å; R522-Y532 HydrophobicContact CG-CD2 4.12Å; R522-Y532 HydrophobicContact CG-CE2 3.54Å; R522-L540 HydrophobicContact CG-CD1 3.95Å
523	K	98.3	Very high	97.4	Very high	110 Å²	110	58.4 Å²	58.4	48%	0.478	29%	0.292	S	S	.	.	H	α-helix	trans	-53.8	-38.4	176	164	167.6	161.3	-83.3	0	114.2	R519 E520 D526 A527	R519-K523 WeakPolarHBondContact O-CB 3.43Å; R519-K523 PolarHBondContact O-N 3.25Å; R519-K523 VanDerWaalsContact O-N 3.14Å; E520-K523 PolarHBondContact O-N 3.46Å; E520-K523 IonicContact OE1-NZ 2.68Å; E520-K523 PolarHBondContact OE1-NZ 2.78Å; E520-K523 IonicContact OE2-NZ 2.57Å; E520-K523 PolarHBondContact OE2-NZ 3.25Å; K523-D526 WeakPolarHBondContact CA-OD2 3.2Å; K523-D526 PolarHBondContact N-OD2 2.92Å; K523-A527 WeakPolarHBondContact O-CB 3.32Å; K523-A527 PolarHBondContact O-N 2.96Å; K523-A527 VanDerWaalsContact O-N 3.17Å
524	V	98.3	Very high	97.6	Very high	10 Å²	10	58.4 Å²	58.4	6%	0.061	29%	0.289	C	S	.	.	H	α-helix	trans	-77	-33.2	176.5	172.7	0	0	0	0	111.8	E520 I521 R522 N528 I589 E592 L593	E520-V524 HydrophobicContact CG-CG2 4.38Å; E520-V524 WeakPolarHBondContact O-CB 3.37Å; E520-V524 WeakPolarHBondContact O-CG2 3.3Å; E520-V524 PolarHBondContact O-N 3.41Å; I521-V524 PolarHBondContact O-N 3.31Å; R522-V524 VanDerWaalsContact C-N 3.29Å; R522-V524 PolarHBondContact O-N 3.28Å; V524-N528 WeakPolarHBondContact O-CB 3.15Å; V524-N528 PolarHBondContact O-N 2.9Å; V524-N528 PolarHBondContact O-ND2 3.13Å; V524-I589 HydrophobicContact CG1-CD1 3.96Å; V524-I589 HydrophobicContact CG1-CG2 4.14Å; V524-E592 HydrophobicContact CG1-CB 3.87Å; V524-L593 HydrophobicContact CB-CD2 4.11Å; V524-L593 HydrophobicContact CG1-CD2 4.43Å; V524-L593 HydrophobicContact CG2-CD2 4.14Å
525	L	98.1	Very high	97.6	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-66.4	-44.7	171.8	-69.9	164.5	0	0	0	111.6	I521 R522 A527 N528 N529 C530 Y532 L540 C542 W555 M557 I589	I521-L525 HydrophobicContact CG2-CD1 3.74Å; I521-L525 HydrophobicContact CG2-CG 4.45Å; I521-L525 VanDerWaalsContact O-CG 3.28Å; I521-L525 WeakPolarHBondContact O-CG 3.49Å; I521-L525 PolarHBondContact O-N 2.65Å; R522-L525 CarbonylContact O-C 3.5Å; R522-L525 WeakPolarHBondContact O-CA 3.32Å; R522-L525 WeakPolarHBondContact O-CB 3.11Å; R522-L525 PolarHBondContact O-N 2.97Å; L525-A527 PolarHBondContact O-N 2.86Å; L525-N528 CarbonylContact O-C 3.57Å; L525-N528 WeakPolarHBondContact O-CA 3.29Å; L525-N528 PolarHBondContact O-N 3.06Å; L525-N529 PolarHBondContact O-N 3.43Å; L525-C530 HydrophobicContact CB-CB 3.99Å; L525-C530 HydrophobicContact CD2-CB 3.55Å; L525-C530 HydrophobicContact CG-CB 4.38Å; L525-C530 PolarHBondContact O-N 3.07Å; L525-Y532 HydrophobicContact CB-CD1 3.62Å; L525-Y532 HydrophobicContact CB-CE1 3.83Å; L525-Y532 HydrophobicContact CD1-CD1 3.8Å; L525-Y532 HydrophobicContact CD1-CE1 4.5Å; L525-Y532 HydrophobicContact CD1-CG 4.09Å; L525-Y532 HydrophobicContact CG-CD1 4.33Å; L525-L540 HydrophobicContact CD1-CD1 3.66Å; L525-C542 HydrophobicContact CD2-CB 4.36Å; L525-W555 HydrophobicContact CD2-CZ2 3.97Å; L525-M557 HydrophobicContact CD1-SD 4.21Å; L525-M557 HydrophobicContact CD2-SD 4Å; L525-M557 HydrophobicContact CG-SD 4.44Å; L525-I589 HydrophobicContact CD2-CD1 4.02Å; L525-I589 HydrophobicContact CD2-CG1 4.37Å
526	D	98.3	Very high	97.5	Very high	87 Å²	87	63.5 Å²	63.5	47%	0.465	31%	0.308	S	S	.	.	H	α-helix	trans	-54.7	-52	174.5	-58.9	-44	0	0	0	110.5	R522 K523 N528 N529 Y532	R522-D526 VanDerWaalsContact C-OD2 3.25Å; R522-D526 PolarHBondContact O-N 3.01Å; K523-D526 WeakPolarHBondContact CA-OD2 3.2Å; K523-D526 PolarHBondContact N-OD2 2.92Å; D526-N528 PolarHBondContact O-N 3.49Å; D526-N528 VanDerWaalsContact O-N 3.08Å; D526-N529 PolarHBondContact O-N 3.5Å; D526-N529 VanDerWaalsContact O-N 3.1Å; D526-Y532 WeakPolarHBondContact OD1-CE1 3.28Å; D526-Y532 PolarHBondContact OD1-OH 2.91Å; D526-Y532 PolarHBondContact OD2-OH 2.86Å
527	A	98.2	Very high	97.3	Very high	76 Å²	76	66 Å²	66	63%	0.628	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-8.7	178.4	0	0	0	0	0	114.3	K523 L525	K523-A527 WeakPolarHBondContact O-CB 3.32Å; K523-A527 PolarHBondContact O-N 2.96Å; K523-A527 VanDerWaalsContact O-N 3.17Å; L525-A527 PolarHBondContact O-N 2.86Å
528	N	97.4	Very high	97.4	Very high	6 Å²	6	66.8 Å²	66.8	3%	0.032	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	7	177.4	-86.3	-90.5	0	0	0	113.5	V524 L525 D526 C530 K588 I589 E592	V524-N528 WeakPolarHBondContact O-CB 3.15Å; V524-N528 PolarHBondContact O-N 2.9Å; V524-N528 PolarHBondContact O-ND2 3.13Å; L525-N528 CarbonylContact O-C 3.57Å; L525-N528 WeakPolarHBondContact O-CA 3.29Å; L525-N528 PolarHBondContact O-N 3.06Å; D526-N528 PolarHBondContact O-N 3.49Å; D526-N528 VanDerWaalsContact O-N 3.08Å; N528-C530 PolarHBondContact O-N 2.97Å; N528-K588 WeakPolarHBondContact OD1-CD 3.39Å; N528-K588 WeakPolarHBondContact OD1-CE 3.28Å; N528-K588 PolarHBondContact OD1-NZ 2.79Å; N528-I589 HydrophobicContact CB-CD1 3.61Å; N528-E592 PolarHBondContact ND2-OE2 3.37Å
529	N	97.4	Very high	97.4	Very high	142 Å²	142	67.4 Å²	67.4	76%	0.759	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	41.8	-173.5	-56.8	107.4	0	0	0	112.3	L525 D526	L525-N529 PolarHBondContact O-N 3.43Å; D526-N529 PolarHBondContact O-N 3.5Å; D526-N529 VanDerWaalsContact O-N 3.1Å
530	C	98	Very high	97.4	Very high	4 Å²	4	59.6 Å²	59.6	3%	0.027	29%	0.29	C	S	.	.			trans	-99.1	118.5	171.3	-59.3	0	0	0	0	109	L525 N528 Y532 V543 H544 W555	L525-C530 HydrophobicContact CB-CB 3.99Å; L525-C530 HydrophobicContact CD2-CB 3.55Å; L525-C530 HydrophobicContact CG-CB 4.38Å; L525-C530 PolarHBondContact O-N 3.07Å; N528-C530 PolarHBondContact O-N 2.97Å; C530-Y532 WeakPolarHBondContact O-CD1 3.21Å; C530-V543 CarbonylContact C-O 3.6Å; C530-V543 VanDerWaalsContact CA-O 3.29Å; C530-V543 WeakPolarHBondContact CA-O 3.41Å; C530-H544 HydrophobicContact CB-CB 4.38Å; C530-W555 HydrophobicContact CB-CH2 4.28Å
531	D	98.3	Very high	97.4	Very high	120 Å²	120	60.4 Å²	60.4	64%	0.642	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	148.1	169.1	-57.4	-54.2	0	0	0	109.6	C542 V543	D531-C542 CarbonylContact O-C 3.53Å; D531-C542 WeakPolarHBondContact O-CA 3.44Å; D531-V543 HydrophobicContact CB-CB 4.37Å; D531-V543 PolarHBondContact N-O 2.91Å; D531-V543 PolarHBondContact O-N 2.86Å
532	Y	98.4	Very high	97.5	Very high	76 Å²	76	60.3 Å²	60.3	30%	0.298	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	151.6	175.1	55.1	-93.1	0	0	0	113.6	R522 L525 D526 C530 L540 F541	R522-Y532 HydrophobicContact CB-CE1 4.41Å; R522-Y532 HydrophobicContact CB-CE2 4.09Å; R522-Y532 HydrophobicContact CG-CD2 4.12Å; R522-Y532 HydrophobicContact CG-CE2 3.54Å; L525-Y532 HydrophobicContact CB-CD1 3.62Å; L525-Y532 HydrophobicContact CB-CE1 3.83Å; L525-Y532 HydrophobicContact CD1-CD1 3.8Å; L525-Y532 HydrophobicContact CD1-CE1 4.5Å; L525-Y532 HydrophobicContact CD1-CG 4.09Å; L525-Y532 HydrophobicContact CG-CD1 4.33Å; D526-Y532 WeakPolarHBondContact OD1-CE1 3.28Å; D526-Y532 PolarHBondContact OD1-OH 2.91Å; D526-Y532 PolarHBondContact OD2-OH 2.86Å; C530-Y532 WeakPolarHBondContact O-CD1 3.21Å; Y532-L540 HydrophobicContact CD2-CD1 4.29Å; Y532-L540 HydrophobicContact CD2-CD2 4.45Å; Y532-L540 HydrophobicContact CG-CD1 4.36Å; Y532-F541 CarbonylContact C-O 3.51Å; Y532-F541 VanDerWaalsContact CA-O 3.27Å; Y532-F541 WeakPolarHBondContact CA-O 3.3Å
533	E	98.1	Very high	97.4	Very high	100 Å²	100	58.4 Å²	58.4	47%	0.467	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	131.4	176.6	-159.9	-163.5	143.8	0	0	109.7	K535 L540 F541	E533-K535 PolarHBondContact O-N 2.9Å; E533-K535 WeakPolarHBondContact OE1-CE 3.49Å; E533-K535 IonicContact OE1-NZ 3.82Å; E533-K535 PolarHBondContact OE1-NZ 3.4Å; E533-K535 WeakPolarHBondContact OE2-CE 3.15Å; E533-K535 IonicContact OE2-NZ 2.64Å; E533-K535 PolarHBondContact OE2-NZ 3.15Å; E533-L540 CarbonylContact O-C 3.52Å; E533-L540 WeakPolarHBondContact O-CA 3.23Å; E533-F541 PolarHBondContact N-O 2.83Å; E533-F541 PolarHBondContact O-N 3.48Å
534	Q	97.4	Very high	97.4	Very high	82 Å²	82	56 Å²	56	38%	0.383	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	102.5	-179.3	-174.2	81.7	63.3	0	0	109.6	E536 R537 L540	Q534-E536 PolarHBondContact NE2-O 3.3Å; Q534-R537 PolarHBondContact NE2-O 3Å; Q534-L540 HydrophobicContact CB-CD2 4.16Å; Q534-L540 HydrophobicContact CG-CD2 4.4Å
535	K	95.3	Very high	97.3	Very high	106 Å²	106	57.4 Å²	57.4	46%	0.461	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	-36.6	-174	-67.2	-63.1	-172.3	-174.6	0	114.1	E533 L539 F541	E533-K535 PolarHBondContact O-N 2.9Å; E533-K535 WeakPolarHBondContact OE1-CE 3.49Å; E533-K535 IonicContact OE1-NZ 3.82Å; E533-K535 PolarHBondContact OE1-NZ 3.4Å; E533-K535 WeakPolarHBondContact OE2-CE 3.15Å; E533-K535 IonicContact OE2-NZ 2.64Å; E533-K535 PolarHBondContact OE2-NZ 3.15Å; K535-L539 HydrophobicContact CB-CD2 4.1Å; K535-L539 HydrophobicContact CB-CG 4.32Å; K535-L539 PolarHBondContact N-O 2.67Å; K535-F541 HydrophobicContact CG-CB 3.8Å
536	E	94.7	Very high	97	Very high	90 Å²	90	60.5 Å²	60.5	42%	0.421	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	166	168.2	-53.6	172.9	-136.9	0	0	107.6	R498 Q534 F538 L539	R498-E536 IonicContact CZ-OE1 3.87Å; R498-E536 IonicContact CZ-OE2 2.73Å; R498-E536 IonicContact NH1-OE1 3.7Å; R498-E536 IonicContact NH2-OE1 3.64Å; R498-E536 PolarHBondContact NH2-OE1 3.31Å; R498-E536 IonicContact NH2-OE2 3.46Å; R498-E536 PolarHBondContact NH2-OE2 2.79Å; Q534-E536 PolarHBondContact NE2-O 3.3Å; E536-F538 PolarHBondContact O-N 2.82Å; E536-L539 HydrophobicContact CB-CB 3.73Å; E536-L539 HydrophobicContact CG-CB 3.98Å; E536-L539 HydrophobicContact CG-CD2 4.05Å; E536-L539 PolarHBondContact N-O 2.97Å; E536-L539 PolarHBondContact O-N 3.13Å; E536-L539 VanDerWaalsContact O-O 3.1Å; E536-L539 VanDerWaalsContact OE1-CD2 3.29Å; E536-L539 WeakPolarHBondContact OE1-CD2 3.46Å
537	R	93	Very high	96.5	Very high	111 Å²	111	60 Å²	60	42%	0.419	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-34.2	178.1	-173.4	177.5	-70.5	-111.1	1.5	113.7	E491 Q534	E491-R537 PolarHBondContact O-NH2 3.21Å; Q534-R537 PolarHBondContact NE2-O 3Å
538	F	96.8	Very high	96.2	Very high	17 Å²	17	67 Å²	67	8%	0.075	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	20.8	179.9	-63.5	-62.2	0	0	0	114.3	S495 P497 P514 M518 E536 E558 V559	S495-F538 VanDerWaalsContact O-CD2 3.25Å; S495-F538 WeakPolarHBondContact O-CD2 3.3Å; S495-F538 WeakPolarHBondContact O-CE2 3.26Å; P497-F538 HydrophobicContact CB-CB 4.21Å; P497-F538 HydrophobicContact CB-CD2 3.84Å; P497-F538 HydrophobicContact CB-CE2 4.43Å; P497-F538 HydrophobicContact CB-CG 3.94Å; P497-F538 HydrophobicContact CG-CD2 4.39Å; P514-F538 HydrophobicContact CB-CD1 3.9Å; P514-F538 HydrophobicContact CB-CE1 3.39Å; P514-F538 HydrophobicContact CB-CZ 3.78Å; M518-F538 HydrophobicContact CG-CD1 3.66Å; M518-F538 HydrophobicContact CG-CE1 4.15Å; M518-F538 HydrophobicContact SD-CD1 4.41Å; E536-F538 PolarHBondContact O-N 2.82Å; F538-E558 CarbonylContact O-C 3.56Å; F538-E558 WeakPolarHBondContact O-CA 3.27Å; F538-V559 HydrophobicContact CB-CB 4.23Å; F538-V559 HydrophobicContact CD1-CB 4.28Å; F538-V559 HydrophobicContact CD1-CG1 4.49Å; F538-V559 PolarHBondContact O-N 3.33Å
539	L	96.9	Very high	95.7	Very high	16 Å²	16	73.5 Å²	73.5	8%	0.084	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	123.6	177.3	-177	69.4	0	0	0	111.3	K535 E536 E556 M557 E558	K535-L539 HydrophobicContact CB-CD2 4.1Å; K535-L539 HydrophobicContact CB-CG 4.32Å; K535-L539 PolarHBondContact N-O 2.67Å; E536-L539 HydrophobicContact CB-CB 3.73Å; E536-L539 HydrophobicContact CG-CB 3.98Å; E536-L539 HydrophobicContact CG-CD2 4.05Å; E536-L539 PolarHBondContact N-O 2.97Å; E536-L539 PolarHBondContact O-N 3.13Å; E536-L539 VanDerWaalsContact O-O 3.1Å; E536-L539 VanDerWaalsContact OE1-CD2 3.29Å; E536-L539 WeakPolarHBondContact OE1-CD2 3.46Å; L539-E556 HydrophobicContact CD1-CB 4.01Å; L539-E556 HydrophobicContact CD1-CG 4.18Å; L539-M557 WeakPolarHBondContact CA-O 3.05Å; L539-E558 HydrophobicContact CD1-CB 3.76Å; L539-E558 HydrophobicContact CD1-CG 4.28Å
540	L	98.3	Very high	95	Very high	0 Å²	0	72.5 Å²	72.5	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	144.1	166.8	-56.5	-176.3	0	0	0	110.7	M518 I521 R522 L525 Y532 E533 Q534 E556 M557	M518-L540 HydrophobicContact CE-CD1 4.33Å; M518-L540 HydrophobicContact CE-CD2 3.65Å; M518-L540 HydrophobicContact CE-CG 3.71Å; I521-L540 HydrophobicContact CG2-CD1 3.64Å; R522-L540 HydrophobicContact CG-CD1 3.95Å; L525-L540 HydrophobicContact CD1-CD1 3.66Å; Y532-L540 HydrophobicContact CD2-CD1 4.29Å; Y532-L540 HydrophobicContact CD2-CD2 4.45Å; Y532-L540 HydrophobicContact CG-CD1 4.36Å; E533-L540 CarbonylContact O-C 3.52Å; E533-L540 WeakPolarHBondContact O-CA 3.23Å; Q534-L540 HydrophobicContact CB-CD2 4.16Å; Q534-L540 HydrophobicContact CG-CD2 4.4Å; L540-E556 CarbonylContact O-C 3.47Å; L540-E556 VanDerWaalsContact O-CA 3.3Å; L540-E556 WeakPolarHBondContact O-CA 3.5Å; L540-M557 HydrophobicContact CB-CB 4.49Å; L540-M557 PolarHBondContact N-O 2.98Å; L540-M557 PolarHBondContact O-N 3.27Å
541	F	98.6	Very high	94.8	Very high	44 Å²	44	74.3 Å²	74.3	19%	0.193	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	117.5	160.6	179.5	-90.2	0	0	0	108.2	Y532 E533 K535 V543 Q554 I575	Y532-F541 CarbonylContact C-O 3.51Å; Y532-F541 VanDerWaalsContact CA-O 3.27Å; Y532-F541 WeakPolarHBondContact CA-O 3.3Å; E533-F541 PolarHBondContact N-O 2.83Å; E533-F541 PolarHBondContact O-N 3.48Å; K535-F541 HydrophobicContact CG-CB 3.8Å; F541-V543 HydrophobicContact CD1-CG2 4.22Å; F541-V543 HydrophobicContact CE1-CG2 3.8Å; F541-Q554 HydrophobicContact CE1-CB 4.32Å; F541-Q554 HydrophobicContact CE1-CG 4.44Å; F541-Q554 HydrophobicContact CE2-CB 4.27Å; F541-Q554 HydrophobicContact CZ-CB 3.73Å; F541-Q554 HydrophobicContact CZ-CG 4.12Å; F541-I575 HydrophobicContact CE2-CB 4.38Å; F541-I575 HydrophobicContact CE2-CG1 4.11Å; F541-I575 HydrophobicContact CE2-CG2 4.35Å
542	C	98.5	Very high	94.7	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	149	-171.8	-52	0	0	0	0	111.7	L525 D531 Q554 W555	L525-C542 HydrophobicContact CD2-CB 4.36Å; D531-C542 CarbonylContact O-C 3.53Å; D531-C542 WeakPolarHBondContact O-CA 3.44Å; C542-Q554 CarbonylContact O-C 3.59Å; C542-Q554 VanDerWaalsContact O-CA 3.26Å; C542-Q554 WeakPolarHBondContact O-CA 3.25Å; C542-W555 HydrophobicContact CB-CD2 3.9Å; C542-W555 HydrophobicContact CB-CE3 4.29Å; C542-W555 HydrophobicContact CB-CG 4.42Å; C542-W555 HydrophobicContact CB-CH2 4.05Å; C542-W555 HydrophobicContact CB-CZ2 3.63Å; C542-W555 HydrophobicContact CB-CZ3 4.36Å; C542-W555 PolarHBondContact N-O 3.38Å; C542-W555 PolarHBondContact O-N 3.2Å
543	V	98.3	Very high	94.7	Very high	30 Å²	30	67.7 Å²	67.7	18%	0.182	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	140.6	-179.8	-168.8	0	0	0	0	109.7	C530 D531 F541 L552 V553 Q554	C530-V543 CarbonylContact C-O 3.6Å; C530-V543 VanDerWaalsContact CA-O 3.29Å; C530-V543 WeakPolarHBondContact CA-O 3.41Å; D531-V543 HydrophobicContact CB-CB 4.37Å; D531-V543 PolarHBondContact N-O 2.91Å; D531-V543 PolarHBondContact O-N 2.86Å; F541-V543 HydrophobicContact CD1-CG2 4.22Å; F541-V543 HydrophobicContact CE1-CG2 3.8Å; V543-L552 HydrophobicContact CG1-CD1 3.56Å; V543-V553 WeakPolarHBondContact CA-O 3.46Å; V543-Q554 HydrophobicContact CG1-CG 4.09Å; V543-Q554 HydrophobicContact CG2-CG 4.1Å
544	H	97.8	Very high	94.7	Very high	58 Å²	58	65.9 Å²	65.9	27%	0.269	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	145.5	174.2	166.1	-76.5	0	0	0	110.9	C530 L552 V553 W555 I585	C530-H544 HydrophobicContact CB-CB 4.38Å; H544-L552 CarbonylContact O-C 3.49Å; H544-L552 WeakPolarHBondContact O-CA 3.29Å; H544-V553 PolarHBondContact N-O 3.31Å; H544-V553 VanDerWaalsContact N-O 3.08Å; H544-V553 PolarHBondContact O-N 3.19Å; H544-W555 HydrophobicContact CB-CH2 3.64Å; H544-W555 HydrophobicContact CB-CZ3 3.74Å; H544-I585 HydrophobicContact CB-CG1 4.28Å
545	G	95	Very high	94.7	Very high	40 Å²	40	62 Å²	62	41%	0.412	31%	0.311	S	S	.	.	S	Bend	trans	98.9	178.9	175.5	0	0	0	0	0	114
546	D	91.8	Very high	94.9	Very high	66 Å²	66	58.6 Å²	58.6	35%	0.353	30%	0.297	S	S	.	.			trans	-113.5	132.1	-176.3	-178.4	1.3	0	0	0	110.6	R548 Q549 S551 L552	D546-R548 PolarHBondContact O-N 3.12Å; D546-R548 WeakPolarHBondContact OD1-CB 3.27Å; D546-R548 WeakPolarHBondContact OD1-CG 3.12Å; D546-R548 PolarHBondContact OD1-N 3.44Å; D546-R548 WeakPolarHBondContact OD2-CB 3.26Å; D546-Q549 HydrophobicContact CB-CB 4.39Å; D546-Q549 HydrophobicContact CB-CG 4.16Å; D546-Q549 PolarHBondContact O-N 2.9Å; D546-Q549 VanDerWaalsContact O-N 3.16Å; D546-S551 PolarHBondContact N-OG 3.26Å; D546-S551 PolarHBondContact O-N 3.44Å; D546-S551 PolarHBondContact O-OG 2.96Å; D546-L552 PolarHBondContact O-N 2.84Å
547	A	89.3	Confident	95	Very high	75 Å²	75	54.3 Å²	54.3	62%	0.62	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-59.8	-29.8	174.2	0	0	0	0	0	112.4	Q549 L552	A547-Q549 PolarHBondContact O-N 2.97Å; A547-L552 HydrophobicContact CB-CD2 4.01Å
548	R	90.1	Very high	95.1	Very high	224 Å²	224	49.3 Å²	49.3	85%	0.845	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-72	-15.6	178.9	-59.3	174	166.5	-164.8	-4.4	113.6	D546	D546-R548 PolarHBondContact O-N 3.12Å; D546-R548 WeakPolarHBondContact OD1-CB 3.27Å; D546-R548 WeakPolarHBondContact OD1-CG 3.12Å; D546-R548 PolarHBondContact OD1-N 3.44Å; D546-R548 WeakPolarHBondContact OD2-CB 3.26Å
549	Q	86.9	Confident	95	Very high	143 Å²	143	48.5 Å²	48.5	67%	0.668	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-115.4	9.8	-174	-58.8	-66.2	-13.5	0	0	113	D546 A547 S551	D546-Q549 HydrophobicContact CB-CB 4.39Å; D546-Q549 HydrophobicContact CB-CG 4.16Å; D546-Q549 PolarHBondContact O-N 2.9Å; D546-Q549 VanDerWaalsContact O-N 3.16Å; A547-Q549 PolarHBondContact O-N 2.97Å; Q549-S551 PolarHBondContact O-N 3.44Å
550	D	84.3	Confident	94.9	Very high	121 Å²	121	47.8 Å²	47.8	65%	0.647	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	25.5	-170.6	-162.7	34.2	0	0	0	113.6	T578	D550-T578 WeakPolarHBondContact OD2-CG2 3.49Å
551	S	92.5	Very high	94.7	Very high	42 Å²	42	51.1 Å²	51.1	29%	0.294	27%	0.265	S	S	.	.			trans	-105.1	-9.6	-176.5	69.2	0	0	0	0	113.2	D546 Q549 V553	D546-S551 PolarHBondContact N-OG 3.26Å; D546-S551 PolarHBondContact O-N 3.44Å; D546-S551 PolarHBondContact O-OG 2.96Å; Q549-S551 PolarHBondContact O-N 3.44Å; S551-V553 PolarHBondContact O-N 3.32Å
552	L	96.9	Very high	94.3	Very high	56 Å²	56	49.1 Å²	49.1	29%	0.293	26%	0.256	S	S	.	.			trans	-61.7	126.7	173.8	-178.1	63.7	0	0	0	111.3	V543 H544 D546 A547 G577	V543-L552 HydrophobicContact CG1-CD1 3.56Å; H544-L552 CarbonylContact O-C 3.49Å; H544-L552 WeakPolarHBondContact O-CA 3.29Å; D546-L552 PolarHBondContact O-N 2.84Å; A547-L552 HydrophobicContact CB-CD2 4.01Å; L552-G577 WeakPolarHBondContact O-CA 3.41Å
553	V	98	Very high	93.7	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.006	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	141.1	176	-175.5	0	0	0	0	108.9	V543 H544 S551 W555 R574 A581 F582	V543-V553 WeakPolarHBondContact CA-O 3.46Å; H544-V553 PolarHBondContact N-O 3.31Å; H544-V553 VanDerWaalsContact N-O 3.08Å; H544-V553 PolarHBondContact O-N 3.19Å; S551-V553 PolarHBondContact O-N 3.32Å; V553-W555 HydrophobicContact CB-CE3 4.23Å; V553-W555 HydrophobicContact CB-CZ3 4.33Å; V553-W555 HydrophobicContact CG1-CE3 3.83Å; V553-W555 HydrophobicContact CG1-CZ3 4.39Å; V553-R574 HydrophobicContact CG1-CG 4.48Å; V553-A581 HydrophobicContact CG2-CB 3.41Å; V553-A581 VanDerWaalsContact CG2-CB 3.41Å; V553-F582 HydrophobicContact CG1-CB 3.72Å; V553-F582 HydrophobicContact CG1-CD2 3.94Å; V553-F582 HydrophobicContact CG1-CG 4.31Å
554	Q	98.3	Very high	93.1	Very high	62 Å²	62	58.8 Å²	58.8	29%	0.29	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	136.5	167.9	-54.7	167.9	-53.9	0	0	109.5	F541 C542 V543 I575 S576	F541-Q554 HydrophobicContact CE1-CB 4.32Å; F541-Q554 HydrophobicContact CE1-CG 4.44Å; F541-Q554 HydrophobicContact CE2-CB 4.27Å; F541-Q554 HydrophobicContact CZ-CB 3.73Å; F541-Q554 HydrophobicContact CZ-CG 4.12Å; C542-Q554 CarbonylContact O-C 3.59Å; C542-Q554 VanDerWaalsContact O-CA 3.26Å; C542-Q554 WeakPolarHBondContact O-CA 3.25Å; V543-Q554 HydrophobicContact CG1-CG 4.09Å; V543-Q554 HydrophobicContact CG2-CG 4.1Å; Q554-I575 HydrophobicContact CB-CB 4.47Å; Q554-I575 PolarHBondContact O-N 2.88Å; Q554-S576 VanDerWaalsContact CB-OG 3.27Å; Q554-S576 WeakPolarHBondContact CB-OG 3.49Å; Q554-S576 VanDerWaalsContact CG-OG 3.3Å; Q554-S576 WeakPolarHBondContact CG-OG 3.28Å; Q554-S576 PolarHBondContact N-OG 3.49Å; Q554-S576 PolarHBondContact O-N 2.82Å; Q554-S576 VanDerWaalsContact O-N 3.09Å; Q554-S576 PolarHBondContact OE1-OG 2.87Å
555	W	98.3	Very high	92.4	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	152.8	-179.8	70.9	97.2	0	0	0	112.5	L525 C530 C542 H544 V553 M557 F572 K573 F582 I585	L525-W555 HydrophobicContact CD2-CZ2 3.97Å; C530-W555 HydrophobicContact CB-CH2 4.28Å; C542-W555 HydrophobicContact CB-CD2 3.9Å; C542-W555 HydrophobicContact CB-CE3 4.29Å; C542-W555 HydrophobicContact CB-CG 4.42Å; C542-W555 HydrophobicContact CB-CH2 4.05Å; C542-W555 HydrophobicContact CB-CZ2 3.63Å; C542-W555 HydrophobicContact CB-CZ3 4.36Å; C542-W555 PolarHBondContact N-O 3.38Å; C542-W555 PolarHBondContact O-N 3.2Å; H544-W555 HydrophobicContact CB-CH2 3.64Å; H544-W555 HydrophobicContact CB-CZ3 3.74Å; V553-W555 HydrophobicContact CB-CE3 4.23Å; V553-W555 HydrophobicContact CB-CZ3 4.33Å; V553-W555 HydrophobicContact CG1-CE3 3.83Å; V553-W555 HydrophobicContact CG1-CZ3 4.39Å; W555-M557 VanDerWaalsContact NE1-CG 3.35Å; W555-M557 PolarHBondContact NE1-SD 2.66Å; W555-M557 VanDerWaalsContact NE1-SD 3.43Å; W555-F572 AromaticContact NE1-CD1 3.97Å; W555-K573 CarbonylContact C-O 3.46Å; W555-K573 VanDerWaalsContact CA-O 3.28Å; W555-K573 WeakPolarHBondContact CA-O 3.47Å; W555-K573 WeakPolarHBondContact CB-O 3.38Å; W555-F582 HydrophobicContact CB-CD2 3.96Å; W555-F582 HydrophobicContact CB-CE2 3.61Å; W555-F582 HydrophobicContact CG-CD2 4.28Å; W555-F582 AromaticContact CG-CE2 3.9Å; W555-F582 HydrophobicContact CG-CE2 3.9Å; W555-I585 HydrophobicContact CE3-CG2 4.4Å; W555-I585 HydrophobicContact CH2-CG1 3.79Å; W555-I585 HydrophobicContact CH2-CG2 4.03Å; W555-I585 HydrophobicContact CZ2-CG1 4.2Å; W555-I585 HydrophobicContact CZ2-CG2 4.46Å; W555-I585 HydrophobicContact CZ3-CG1 4.49Å; W555-I585 HydrophobicContact CZ3-CG2 4Å
556	E	97.7	Very high	92	Very high	34 Å²	34	63.7 Å²	63.7	16%	0.159	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	141.5	168.8	-74.5	163.8	-156.8	0	0	110.9	L539 L540 F572 K573 I575	L539-E556 HydrophobicContact CD1-CB 4.01Å; L539-E556 HydrophobicContact CD1-CG 4.18Å; L540-E556 CarbonylContact O-C 3.47Å; L540-E556 VanDerWaalsContact O-CA 3.3Å; L540-E556 WeakPolarHBondContact O-CA 3.5Å; E556-F572 WeakPolarHBondContact O-CA 3.49Å; E556-K573 HydrophobicContact CB-CB 4.24Å; E556-K573 PolarHBondContact N-O 2.9Å; E556-K573 PolarHBondContact O-N 3.19Å; E556-K573 IonicContact OE1-NZ 2.67Å; E556-K573 PolarHBondContact OE1-NZ 3Å; E556-K573 VanDerWaalsContact OE2-CD 3.26Å; E556-K573 WeakPolarHBondContact OE2-CD 3.49Å; E556-K573 WeakPolarHBondContact OE2-CE 3.44Å; E556-K573 IonicContact OE2-NZ 3.06Å; E556-K573 PolarHBondContact OE2-NZ 3.15Å; E556-I575 HydrophobicContact CG-CD1 4.08Å; E556-I575 HydrophobicContact CG-CG1 4.25Å; E556-I575 WeakPolarHBondContact OE1-CD1 3.27Å
557	M	97	Very high	92	Very high	1 Å²	1	63.1 Å²	63.1	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	118.9	164.5	-69.9	-174.4	60.7	0	0	110	I521 L525 L539 L540 W555 V570 R571 F572 I589 L593	I521-M557 HydrophobicContact CB-CE 4.49Å; I521-M557 HydrophobicContact CD1-CE 4.47Å; I521-M557 HydrophobicContact CG1-CE 4.13Å; I521-M557 HydrophobicContact CG2-CE 3.61Å; I521-M557 HydrophobicContact CG2-SD 4.3Å; L525-M557 HydrophobicContact CD1-SD 4.21Å; L525-M557 HydrophobicContact CD2-SD 4Å; L525-M557 HydrophobicContact CG-SD 4.44Å; L539-M557 WeakPolarHBondContact CA-O 3.05Å; L540-M557 HydrophobicContact CB-CB 4.49Å; L540-M557 PolarHBondContact N-O 2.98Å; L540-M557 PolarHBondContact O-N 3.27Å; W555-M557 VanDerWaalsContact NE1-CG 3.35Å; W555-M557 PolarHBondContact NE1-SD 2.66Å; W555-M557 VanDerWaalsContact NE1-SD 3.43Å; M557-V570 HydrophobicContact CE-CG1 3.76Å; M557-R571 WeakPolarHBondContact CA-O 3.31Å; M557-F572 HydrophobicContact CE-CD1 4.3Å; M557-F572 HydrophobicContact CE-CE1 3.5Å; M557-F572 HydrophobicContact CE-CE2 4.49Å; M557-F572 HydrophobicContact CE-CZ 3.62Å; M557-F572 HydrophobicContact CG-CD1 3.88Å; M557-F572 HydrophobicContact CG-CE1 4.01Å; M557-F572 HydrophobicContact SD-CD1 4.08Å; M557-F572 HydrophobicContact SD-CE1 3.63Å; M557-F572 HydrophobicContact SD-CZ 4.37Å; M557-I589 HydrophobicContact CE-CG2 3.85Å; M557-I589 HydrophobicContact SD-CG2 4.16Å; M557-L593 HydrophobicContact CE-CD1 4.36Å
558	E	95.6	Very high	92.2	Very high	6 Å²	6	59.9 Å²	59.9	3%	0.028	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.7	-175.2	-177.8	-172.6	-177.3	0	0	110.9	R498 F538 L539 V570 R571	R498-E558 WeakPolarHBondContact CB-OE1 3.21Å; R498-E558 VanDerWaalsContact CD-OE1 3.3Å; R498-E558 WeakPolarHBondContact CD-OE1 3.3Å; R498-E558 IonicContact CZ-OE1 2.83Å; R498-E558 IonicContact NE-OE1 3.48Å; R498-E558 VanDerWaalsContact NH1-CD 3.32Å; R498-E558 IonicContact NH1-OE1 3.72Å; R498-E558 PolarHBondContact NH1-OE1 3.34Å; R498-E558 IonicContact NH1-OE2 3.14Å; F538-E558 CarbonylContact O-C 3.56Å; F538-E558 WeakPolarHBondContact O-CA 3.27Å; L539-E558 HydrophobicContact CD1-CB 3.76Å; L539-E558 HydrophobicContact CD1-CG 4.28Å; E558-V570 WeakPolarHBondContact O-CA 3.22Å; E558-R571 HydrophobicContact CB-CB 4.25Å; E558-R571 PolarHBondContact N-O 2.63Å; E558-R571 PolarHBondContact O-N 2.87Å; E558-R571 VanDerWaalsContact OE2-CD 3.27Å; E558-R571 WeakPolarHBondContact OE2-CD 3.41Å; E558-R571 IonicContact OE2-CZ 3.82Å; E558-R571 IonicContact OE2-NE 3.63Å; E558-R571 IonicContact OE2-NH1 2.75Å; E558-R571 PolarHBondContact OE2-NH1 3.38Å
559	V	95.6	Very high	92.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	126.1	167.8	175.7	0	0	0	0	108.9	P497 P514 M517 M518 I521 F538 G569	P497-V559 HydrophobicContact CB-CG1 4.39Å; P497-V559 WeakPolarHBondContact CB-O 3.46Å; P514-V559 HydrophobicContact CB-CG1 3.91Å; M517-V559 HydrophobicContact CB-CG1 4.42Å; M517-V559 HydrophobicContact CB-CG2 4.13Å; M517-V559 HydrophobicContact CE-CG1 4.17Å; M517-V559 HydrophobicContact CE-CG2 4.5Å; M517-V559 HydrophobicContact SD-CG1 3.83Å; M518-V559 HydrophobicContact CG-CG2 4.03Å; M518-V559 HydrophobicContact SD-CB 4.21Å; M518-V559 HydrophobicContact SD-CG2 3.56Å; M518-V559 VanDerWaalsContact SD-CG2 3.56Å; I521-V559 HydrophobicContact CD1-CG2 3.5Å; F538-V559 HydrophobicContact CB-CB 4.23Å; F538-V559 HydrophobicContact CD1-CB 4.28Å; F538-V559 HydrophobicContact CD1-CG1 4.49Å; F538-V559 PolarHBondContact O-N 3.33Å; V559-G569 WeakPolarHBondContact CA-O 3.23Å
560	C	94	Very high	92.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	149.1	-169.4	58.2	0	0	0	0	112	R498 L500 N568 G569	R498-C560 CarbonylContact O-C 3.52Å; R498-C560 VanDerWaalsContact O-CA 3.23Å; R498-C560 WeakPolarHBondContact O-CA 3.5Å; R498-C560 WeakPolarHBondContact O-CB 3.36Å; L500-C560 HydrophobicContact CD1-CB 3.8Å; L500-C560 HydrophobicContact CG-CB 4.08Å; C560-N568 CarbonylContact O-C 3.4Å; C560-N568 VanDerWaalsContact O-CA 3.32Å; C560-N568 WeakPolarHBondContact O-CA 3.32Å; C560-G569 PolarHBondContact N-O 2.93Å; C560-G569 PolarHBondContact O-N 2.86Å; C560-G569 PolarHBondContact SG-O 3.32Å
561	K	93.5	Very high	93.2	Very high	71 Å²	71	40.1 Å²	40.1	31%	0.309	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	144.2	167.7	-60.6	-57.8	-58.8	-179	0	109.6	P497 R498 L500 P563 N568	P497-K561 HydrophobicContact CG-CD 3.85Å; P497-K561 HydrophobicContact CG-CG 4.07Å; P497-K561 WeakPolarHBondContact O-CG 3.35Å; R498-K561 PolarHBondContact O-N 3.47Å; L500-K561 PolarHBondContact N-O 3.48Å; K561-P563 WeakPolarHBondContact O-CD 3.34Å; K561-N568 WeakPolarHBondContact CD-OD1 3.49Å; K561-N568 VanDerWaalsContact CE-OD1 3.28Å; K561-N568 WeakPolarHBondContact CE-OD1 3.49Å; K561-N568 PolarHBondContact NZ-OD1 2.84Å
562	L	90.8	Very high	93.3	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	84.1	172.8	-58	-179.2	0	0	0	110.1	L500 T503 M506 T509 R564 L565 S566 L567	L500-L562 HydrophobicContact CB-CD2 4.43Å; T503-L562 HydrophobicContact CG2-CB 4.28Å; T503-L562 HydrophobicContact CG2-CD1 4.27Å; T503-L562 HydrophobicContact CG2-CD2 4.1Å; T503-L562 HydrophobicContact CG2-CG 4.45Å; M506-L562 HydrophobicContact CB-CD1 4.39Å; M506-L562 HydrophobicContact CE-CD2 3.78Å; M506-L562 HydrophobicContact CG-CD1 4.33Å; T509-L562 HydrophobicContact CG2-CD1 3.6Å; L562-R564 PolarHBondContact O-N 2.89Å; L562-L565 HydrophobicContact CB-CB 4.39Å; L562-L565 HydrophobicContact CD1-CD1 4.18Å; L562-L565 PolarHBondContact O-N 2.92Å; L562-S566 PolarHBondContact O-N 3.48Å; L562-S566 VanDerWaalsContact O-N 3.07Å; L562-L567 PolarHBondContact N-O 2.68Å
563	P	85.3	Confident	93.2	Very high	79 Å²	79	41.6 Å²	41.6	51%	0.513	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-6.1	-170	-23.8	34.9	0	0	0	116.1	L500 K561	L500-P563 WeakPolarHBondContact O-CD 3.27Å; K561-P563 WeakPolarHBondContact O-CD 3.34Å
564	R	85.6	Confident	93.2	Very high	155 Å²	155	46.7 Å²	46.7	59%	0.585	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-5.3	175.5	-61.9	-62.2	-177.5	170.3	-4.4	113.8	L562	L562-R564 PolarHBondContact O-N 2.89Å
565	L	83.6	Confident	93.1	Very high	93 Å²	93	47.2 Å²	47.2	49%	0.487	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.7	-6.9	175.9	-60	176.8	0	0	0	112.1	T503 L562 L567	T503-L565 HydrophobicContact CG2-CD1 3.93Å; T503-L565 HydrophobicContact CG2-CG 4.32Å; L562-L565 HydrophobicContact CB-CB 4.39Å; L562-L565 HydrophobicContact CD1-CD1 4.18Å; L562-L565 PolarHBondContact O-N 2.92Å; L565-L567 HydrophobicContact CB-CB 4.43Å; L565-L567 PolarHBondContact O-N 3.49Å
566	S	87.3	Confident	93.1	Very high	107 Å²	107	49 Å²	49	75%	0.748	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	-0	-170.8	-58.1	0	0	0	0	116	L562	L562-S566 PolarHBondContact O-N 3.48Å; L562-S566 VanDerWaalsContact O-N 3.07Å
567	L	91.8	Very high	93	Very high	55 Å²	55	48.6 Å²	48.6	29%	0.288	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	169.4	178.1	-63.4	-178.9	0	0	0	113.2	S510 L562 L565	S510-L567 WeakPolarHBondContact O-CB 3.49Å; L562-L567 PolarHBondContact N-O 2.68Å; L565-L567 HydrophobicContact CB-CB 4.43Å; L565-L567 PolarHBondContact O-N 3.49Å
568	N	92.9	Very high	93	Very high	6 Å²	6	50.3 Å²	50.3	3%	0.032	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	163.9	160.6	-58.7	-33.9	0	0	0	109.9	T509 S510 M512 M517 C560 K561	T509-N568 CarbonylContact C-O 3.6Å; T509-N568 VanDerWaalsContact CA-O 3.26Å; T509-N568 WeakPolarHBondContact CA-O 3.34Å; S510-N568 PolarHBondContact N-O 3.02Å; S510-N568 PolarHBondContact O-N 3.21Å; M512-N568 PolarHBondContact O-ND2 3.33Å; M517-N568 HydrophobicContact CE-CB 3.91Å; M517-N568 HydrophobicContact SD-CB 3.29Å; M517-N568 WeakPolarHBondContact SD-CB 3.27Å; C560-N568 CarbonylContact O-C 3.4Å; C560-N568 VanDerWaalsContact O-CA 3.32Å; C560-N568 WeakPolarHBondContact O-CA 3.32Å; K561-N568 WeakPolarHBondContact CD-OD1 3.49Å; K561-N568 VanDerWaalsContact CE-OD1 3.28Å; K561-N568 WeakPolarHBondContact CE-OD1 3.49Å; K561-N568 PolarHBondContact NZ-OD1 2.84Å
569	G	93.7	Very high	93	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	159.2	172.8	0	0	0	0	0	113.2	T508 V559 C560	T508-G569 VanDerWaalsContact O-CA 3.3Å; T508-G569 WeakPolarHBondContact O-CA 3.47Å; V559-G569 WeakPolarHBondContact CA-O 3.23Å; C560-G569 PolarHBondContact N-O 2.93Å; C560-G569 PolarHBondContact O-N 2.86Å; C560-G569 PolarHBondContact SG-O 3.32Å
570	V	95.1	Very high	93	Very high	1 Å²	1	59 Å²	59	1%	0.006	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	115.3	177.6	-170.5	0	0	0	0	109.5	T508 M517 I521 M557 E558 F572 L593 L595	T508-V570 HydrophobicContact CG2-CG2 4.46Å; T508-V570 PolarHBondContact O-N 2.91Å; M517-V570 HydrophobicContact CE-CG2 3.71Å; I521-V570 HydrophobicContact CD1-CG1 3.96Å; I521-V570 HydrophobicContact CD1-CG2 3.92Å; M557-V570 HydrophobicContact CE-CG1 3.76Å; E558-V570 WeakPolarHBondContact O-CA 3.22Å; V570-F572 HydrophobicContact CB-CE2 4.29Å; V570-F572 HydrophobicContact CG1-CD2 4.39Å; V570-F572 HydrophobicContact CG1-CE2 3.85Å; V570-F572 HydrophobicContact CG1-CZ 4.19Å; V570-L593 HydrophobicContact CG1-CD1 4.45Å; V570-L593 HydrophobicContact CG2-CD1 4.4Å; V570-L595 HydrophobicContact CG2-CD1 3.63Å
571	R	93.6	Very high	93	Very high	73 Å²	73	59.8 Å²	59.8	28%	0.275	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.5	177.1	176.5	-170.2	176.1	-146.3	1.8	109.6	M506 M557 E558	M506-R571 HydrophobicContact CE-CB 4.25Å; M506-R571 VanDerWaalsContact SD-CA 3.58Å; M506-R571 HydrophobicContact SD-CB 3.62Å; M506-R571 HydrophobicContact SD-CG 4.25Å; M557-R571 WeakPolarHBondContact CA-O 3.31Å; E558-R571 HydrophobicContact CB-CB 4.25Å; E558-R571 PolarHBondContact N-O 2.63Å; E558-R571 PolarHBondContact O-N 2.87Å; E558-R571 VanDerWaalsContact OE2-CD 3.27Å; E558-R571 WeakPolarHBondContact OE2-CD 3.41Å; E558-R571 IonicContact OE2-CZ 3.82Å; E558-R571 IonicContact OE2-NE 3.63Å; E558-R571 IonicContact OE2-NH1 2.75Å; E558-R571 PolarHBondContact OE2-NH1 3.38Å
572	F	95.3	Very high	93.2	Very high	47 Å²	47	58.3 Å²	58.3	21%	0.206	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.9	172.6	-62.7	-105.9	0	0	0	109.6	W555 E556 M557 V570 F582 A586 I589 A590 L593	W555-F572 AromaticContact NE1-CD1 3.97Å; E556-F572 WeakPolarHBondContact O-CA 3.49Å; M557-F572 HydrophobicContact CE-CD1 4.3Å; M557-F572 HydrophobicContact CE-CE1 3.5Å; M557-F572 HydrophobicContact CE-CE2 4.49Å; M557-F572 HydrophobicContact CE-CZ 3.62Å; M557-F572 HydrophobicContact CG-CD1 3.88Å; M557-F572 HydrophobicContact CG-CE1 4.01Å; M557-F572 HydrophobicContact SD-CD1 4.08Å; M557-F572 HydrophobicContact SD-CE1 3.63Å; M557-F572 HydrophobicContact SD-CZ 4.37Å; V570-F572 HydrophobicContact CB-CE2 4.29Å; V570-F572 HydrophobicContact CG1-CD2 4.39Å; V570-F572 HydrophobicContact CG1-CE2 3.85Å; V570-F572 HydrophobicContact CG1-CZ 4.19Å; F572-F582 HydrophobicContact CB-CZ 4.14Å; F572-A586 HydrophobicContact CD1-CB 3.84Å; F572-A586 HydrophobicContact CE1-CB 4.31Å; F572-A586 HydrophobicContact CG-CB 4.41Å; F572-I589 HydrophobicContact CE1-CB 4.2Å; F572-I589 HydrophobicContact CE1-CG2 3.94Å; F572-I589 HydrophobicContact CZ-CG2 4.08Å; F572-A590 HydrophobicContact CE2-CB 4Å; F572-A590 HydrophobicContact CZ-CB 3.88Å; F572-L593 HydrophobicContact CZ-CD1 4.23Å
573	K	95	Very high	93.4	Very high	81 Å²	81	64.4 Å²	64.4	35%	0.352	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	110.3	175.6	165.4	179.9	148.1	-135.7	0	110.2	W555 E556 I575	W555-K573 CarbonylContact C-O 3.46Å; W555-K573 VanDerWaalsContact CA-O 3.28Å; W555-K573 WeakPolarHBondContact CA-O 3.47Å; W555-K573 WeakPolarHBondContact CB-O 3.38Å; E556-K573 HydrophobicContact CB-CB 4.24Å; E556-K573 PolarHBondContact N-O 2.9Å; E556-K573 PolarHBondContact O-N 3.19Å; E556-K573 IonicContact OE1-NZ 2.67Å; E556-K573 PolarHBondContact OE1-NZ 3Å; E556-K573 VanDerWaalsContact OE2-CD 3.26Å; E556-K573 WeakPolarHBondContact OE2-CD 3.49Å; E556-K573 WeakPolarHBondContact OE2-CE 3.44Å; E556-K573 IonicContact OE2-NZ 3.06Å; E556-K573 PolarHBondContact OE2-NZ 3.15Å; K573-I575 HydrophobicContact CD-CD1 4.42Å; K573-I575 HydrophobicContact CG-CD1 4.17Å; K573-I575 PolarHBondContact O-N 3.18Å
574	R	96.7	Very high	93.9	Very high	108 Å²	108	65.2 Å²	65.2	41%	0.408	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	133.1	174.4	-170.9	-169.3	63.4	145.5	-0.9	110.8	V553 S576 G577 S579 F582	V553-R574 HydrophobicContact CG1-CG 4.48Å; R574-S576 WeakPolarHBondContact CD-O 3.47Å; R574-S576 WeakPolarHBondContact CG-O 3.35Å; R574-G577 PolarHBondContact NH1-O 2.9Å; R574-S579 PolarHBondContact NH1-OG 2.75Å; R574-F582 HydrophobicContact CB-CB 4.44Å; R574-F582 HydrophobicContact CB-CD1 3.78Å; R574-F582 HydrophobicContact CB-CD2 3.69Å; R574-F582 HydrophobicContact CB-CE1 3.9Å; R574-F582 HydrophobicContact CB-CE2 3.82Å; R574-F582 HydrophobicContact CB-CG 3.68Å; R574-F582 HydrophobicContact CB-CZ 3.92Å; R574-F582 HydrophobicContact CG-CB 3.94Å; R574-F582 HydrophobicContact CG-CD1 4.21Å; R574-F582 HydrophobicContact CG-CD2 3.87Å; R574-F582 HydrophobicContact CG-CE2 4.48Å; R574-F582 HydrophobicContact CG-CG 3.71Å
575	I	97.8	Very high	94.5	Very high	74 Å²	74	58.4 Å²	58.4	38%	0.379	31%	0.31	S	S	.	.			trans	-101.7	-49.5	172.1	-53.9	-55.8	0	0	0	110.4	F541 Q554 E556 K573	F541-I575 HydrophobicContact CE2-CB 4.38Å; F541-I575 HydrophobicContact CE2-CG1 4.11Å; F541-I575 HydrophobicContact CE2-CG2 4.35Å; Q554-I575 HydrophobicContact CB-CB 4.47Å; Q554-I575 PolarHBondContact O-N 2.88Å; E556-I575 HydrophobicContact CG-CD1 4.08Å; E556-I575 HydrophobicContact CG-CG1 4.25Å; E556-I575 WeakPolarHBondContact OE1-CD1 3.27Å; K573-I575 HydrophobicContact CD-CD1 4.42Å; K573-I575 HydrophobicContact CG-CD1 4.17Å; K573-I575 PolarHBondContact O-N 3.18Å
576	S	97.4	Very high	95.1	Very high	36 Å²	36	54.5 Å²	54.5	25%	0.252	29%	0.291	S	S	.	.	S	Bend	trans	-139.5	-175.5	-179.3	75.1	0	0	0	0	112.3	Q554 R574	Q554-S576 VanDerWaalsContact CB-OG 3.27Å; Q554-S576 WeakPolarHBondContact CB-OG 3.49Å; Q554-S576 VanDerWaalsContact CG-OG 3.3Å; Q554-S576 WeakPolarHBondContact CG-OG 3.28Å; Q554-S576 PolarHBondContact N-OG 3.49Å; Q554-S576 PolarHBondContact O-N 2.82Å; Q554-S576 VanDerWaalsContact O-N 3.09Å; Q554-S576 PolarHBondContact OE1-OG 2.87Å; R574-S576 WeakPolarHBondContact CD-O 3.47Å; R574-S576 WeakPolarHBondContact CG-O 3.35Å
577	G	96.1	Very high	95.4	Very high	27 Å²	27	51 Å²	51	28%	0.278	27%	0.266	S	S	.	.	S	Bend	trans	77	169.5	-179.2	0	0	0	0	0	114.8	L552 R574	L552-G577 WeakPolarHBondContact O-CA 3.41Å; R574-G577 PolarHBondContact NH1-O 2.9Å
578	T	96.1	Very high	95.6	Very high	37 Å²	37	52.8 Å²	52.8	23%	0.227	27%	0.272	C	S	.	.			trans	-70	146.9	-175.7	70.9	0	0	0	0	112.3	D550 I580 A581 F582	D550-T578 WeakPolarHBondContact OD2-CG2 3.49Å; T578-I580 PolarHBondContact O-N 2.81Å; T578-I580 WeakPolarHBondContact OG1-CG2 3.26Å; T578-A581 PolarHBondContact O-N 3.38Å; T578-A581 VanDerWaalsContact OG1-CB 3.26Å; T578-A581 WeakPolarHBondContact OG1-CB 3.19Å; T578-A581 PolarHBondContact OG1-N 3.36Å; T578-F582 PolarHBondContact O-N 2.9Å
579	S	95.6	Very high	95.8	Very high	83 Å²	83	52.5 Å²	52.5	58%	0.58	27%	0.271	S	S	*	.	H	α-helix	trans	-62.5	-24.2	-179.9	-53	0	0	0	0	113.3	R574 K583	R574-S579 PolarHBondContact NH1-OG 2.75Å; S579-K583 VanDerWaalsContact O-CB 3.3Å; S579-K583 WeakPolarHBondContact O-CB 3.47Å; S579-K583 PolarHBondContact O-N 2.81Å
580	I	95.5	Very high	95.9	Very high	104 Å²	104	53.3 Å²	53.3	53%	0.533	28%	0.277	S	S	.	.	H	α-helix	trans	-79.9	-46.4	176.8	-174.2	60	0	0	0	111.4	T578 F582 K583 N584	T578-I580 PolarHBondContact O-N 2.81Å; T578-I580 WeakPolarHBondContact OG1-CG2 3.26Å; I580-F582 PolarHBondContact O-N 2.89Å; I580-K583 PolarHBondContact O-N 2.92Å; I580-N584 PolarHBondContact O-N 3.3Å; I580-N584 PolarHBondContact O-OD1 3.27Å
581	A	95.4	Very high	95.8	Very high	18 Å²	18	59.9 Å²	59.9	15%	0.149	31%	0.312	C	S	.	.	H	α-helix	trans	-60.6	-45.6	175.7	0	0	0	0	0	111	V553 T578 K583 N584 I585	V553-A581 HydrophobicContact CG2-CB 3.41Å; V553-A581 VanDerWaalsContact CG2-CB 3.41Å; T578-A581 PolarHBondContact O-N 3.38Å; T578-A581 VanDerWaalsContact OG1-CB 3.26Å; T578-A581 WeakPolarHBondContact OG1-CB 3.19Å; T578-A581 PolarHBondContact OG1-N 3.36Å; A581-K583 PolarHBondContact O-N 2.99Å; A581-N584 PolarHBondContact O-N 2.86Å; A581-N584 VanDerWaalsContact O-N 3.16Å; A581-I585 PolarHBondContact O-N 2.97Å
582	F	97.1	Very high	95.9	Very high	39 Å²	39	60.1 Å²	60.1	17%	0.171	32%	0.317	C	S	.	.	H	α-helix	trans	-58	-47.7	174.6	171.1	-107.5	0	0	0	112.3	V553 W555 F572 R574 T578 I580 N584 A586	V553-F582 HydrophobicContact CG1-CB 3.72Å; V553-F582 HydrophobicContact CG1-CD2 3.94Å; V553-F582 HydrophobicContact CG1-CG 4.31Å; W555-F582 HydrophobicContact CB-CD2 3.96Å; W555-F582 HydrophobicContact CB-CE2 3.61Å; W555-F582 HydrophobicContact CG-CD2 4.28Å; W555-F582 AromaticContact CG-CE2 3.9Å; W555-F582 HydrophobicContact CG-CE2 3.9Å; F572-F582 HydrophobicContact CB-CZ 4.14Å; R574-F582 HydrophobicContact CB-CB 4.44Å; R574-F582 HydrophobicContact CB-CD1 3.78Å; R574-F582 HydrophobicContact CB-CD2 3.69Å; R574-F582 HydrophobicContact CB-CE1 3.9Å; R574-F582 HydrophobicContact CB-CE2 3.82Å; R574-F582 HydrophobicContact CB-CG 3.68Å; R574-F582 HydrophobicContact CB-CZ 3.92Å; R574-F582 HydrophobicContact CG-CB 3.94Å; R574-F582 HydrophobicContact CG-CD1 4.21Å; R574-F582 HydrophobicContact CG-CD2 3.87Å; R574-F582 HydrophobicContact CG-CE2 4.48Å; R574-F582 HydrophobicContact CG-CG 3.71Å; T578-F582 PolarHBondContact O-N 2.9Å; I580-F582 PolarHBondContact O-N 2.89Å; F582-N584 PolarHBondContact O-N 3.31Å; F582-A586 HydrophobicContact CD2-CB 4.23Å; F582-A586 HydrophobicContact CE2-CB 3.82Å; F582-A586 HydrophobicContact CZ-CB 4Å; F582-A586 WeakPolarHBondContact O-CB 3.1Å; F582-A586 PolarHBondContact O-N 2.96Å
583	K	95.1	Very high	95.9	Very high	129 Å²	129	58.7 Å²	58.7	56%	0.561	31%	0.311	S	S	*	.	H	α-helix	trans	-58.9	-40	178.2	-177.3	-170.3	172.4	-164.3	0	111.1	S579 I580 A581 S587	S579-K583 VanDerWaalsContact O-CB 3.3Å; S579-K583 WeakPolarHBondContact O-CB 3.47Å; S579-K583 PolarHBondContact O-N 2.81Å; I580-K583 PolarHBondContact O-N 2.92Å; A581-K583 PolarHBondContact O-N 2.99Å; K583-S587 WeakPolarHBondContact O-CB 3.49Å; K583-S587 PolarHBondContact O-N 2.91Å; K583-S587 PolarHBondContact O-OG 3.27Å
584	N	95.6	Very high	95.9	Very high	97 Å²	97	62.5 Å²	62.5	52%	0.519	33%	0.328	S	S	.	.	H	α-helix	trans	-66.3	-56.4	-178.6	-66.9	-7.6	0	0	0	111	I580 A581 F582 S587 K588	I580-N584 PolarHBondContact O-N 3.3Å; I580-N584 PolarHBondContact O-OD1 3.27Å; A581-N584 PolarHBondContact O-N 2.86Å; A581-N584 VanDerWaalsContact O-N 3.16Å; F582-N584 PolarHBondContact O-N 3.31Å; N584-S587 PolarHBondContact O-N 2.92Å; N584-K588 PolarHBondContact O-N 2.86Å
585	I	96.9	Very high	95.5	Very high	11 Å²	11	59.8 Å²	59.8	6%	0.056	32%	0.321	C	S	.	.	H	α-helix	trans	-65.9	-45.9	-178.1	-169.3	57.9	0	0	0	111.9	H544 W555 A581 S587 K588 I589	H544-I585 HydrophobicContact CB-CG1 4.28Å; W555-I585 HydrophobicContact CE3-CG2 4.4Å; W555-I585 HydrophobicContact CH2-CG1 3.79Å; W555-I585 HydrophobicContact CH2-CG2 4.03Å; W555-I585 HydrophobicContact CZ2-CG1 4.2Å; W555-I585 HydrophobicContact CZ2-CG2 4.46Å; W555-I585 HydrophobicContact CZ3-CG1 4.49Å; W555-I585 HydrophobicContact CZ3-CG2 4Å; A581-I585 PolarHBondContact O-N 2.97Å; I585-S587 VanDerWaalsContact C-N 3.28Å; I585-S587 PolarHBondContact O-N 2.87Å; I585-K588 WeakPolarHBondContact O-CB 3.48Å; I585-K588 PolarHBondContact O-N 2.89Å; I585-I589 HydrophobicContact CD1-CD1 4.49Å; I585-I589 HydrophobicContact CD1-CG1 4.28Å; I585-I589 HydrophobicContact CG1-CG1 4.32Å; I585-I589 WeakPolarHBondContact O-CG1 3.48Å; I585-I589 PolarHBondContact O-N 2.85Å
586	A	96.2	Very high	95.4	Very high	11 Å²	11	59.1 Å²	59.1	9%	0.091	32%	0.318	C	S	.	.	H	α-helix	trans	-64.6	-30.7	179.7	0	0	0	0	0	112.7	F572 F582 A590	F572-A586 HydrophobicContact CD1-CB 3.84Å; F572-A586 HydrophobicContact CE1-CB 4.31Å; F572-A586 HydrophobicContact CG-CB 4.41Å; F582-A586 HydrophobicContact CD2-CB 4.23Å; F582-A586 HydrophobicContact CE2-CB 3.82Å; F582-A586 HydrophobicContact CZ-CB 4Å; F582-A586 WeakPolarHBondContact O-CB 3.1Å; F582-A586 PolarHBondContact O-N 2.96Å; A586-A590 WeakPolarHBondContact O-CB 3.5Å; A586-A590 PolarHBondContact O-N 3.16Å
587	S	94.8	Very high	95.3	Very high	33 Å²	33	60.3 Å²	60.3	23%	0.231	32%	0.321	C	S	.	.	H	α-helix	trans	-76.3	-30.3	173.3	-55.7	0	0	0	0	112.7	K583 N584 I585 N591	K583-S587 WeakPolarHBondContact O-CB 3.49Å; K583-S587 PolarHBondContact O-N 2.91Å; K583-S587 PolarHBondContact O-OG 3.27Å; N584-S587 PolarHBondContact O-N 2.92Å; I585-S587 VanDerWaalsContact C-N 3.28Å; I585-S587 PolarHBondContact O-N 2.87Å; S587-N591 WeakPolarHBondContact O-CB 3.16Å; S587-N591 PolarHBondContact O-N 3.05Å; S587-N591 PolarHBondContact O-ND2 3.25Å; S587-N591 PolarHBondContact O-OD1 2.81Å
588	K	95.8	Very high	95.3	Very high	94 Å²	94	62.1 Å²	62.1	41%	0.409	32%	0.323	S	S	.	.	H	α-helix	trans	-66.2	-56.1	173.5	-172.8	-178.2	174.2	-152.5	0	110.2	N528 N584 I585 A590 N591 E592	N528-K588 WeakPolarHBondContact OD1-CD 3.39Å; N528-K588 WeakPolarHBondContact OD1-CE 3.28Å; N528-K588 PolarHBondContact OD1-NZ 2.79Å; N584-K588 PolarHBondContact O-N 2.86Å; I585-K588 WeakPolarHBondContact O-CB 3.48Å; I585-K588 PolarHBondContact O-N 2.89Å; K588-A590 VanDerWaalsContact C-N 3.34Å; K588-A590 PolarHBondContact O-N 2.81Å; K588-N591 PolarHBondContact O-N 2.7Å; K588-E592 WeakPolarHBondContact CE-OE1 3.47Å; K588-E592 VanDerWaalsContact CG-OE1 3.27Å; K588-E592 WeakPolarHBondContact CG-OE1 3.4Å; K588-E592 PolarHBondContact O-N 2.77Å; K588-E592 VanDerWaalsContact O-N 3.13Å
589	I	97	Very high	95.2	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-53.3	-50	176	-59.6	-65	0	0	0	110.8	V524 L525 N528 M557 F572 I585 N591 E592 L593	V524-I589 HydrophobicContact CG1-CD1 3.96Å; V524-I589 HydrophobicContact CG1-CG2 4.14Å; L525-I589 HydrophobicContact CD2-CD1 4.02Å; L525-I589 HydrophobicContact CD2-CG1 4.37Å; N528-I589 HydrophobicContact CB-CD1 3.61Å; M557-I589 HydrophobicContact CE-CG2 3.85Å; M557-I589 HydrophobicContact SD-CG2 4.16Å; F572-I589 HydrophobicContact CE1-CB 4.2Å; F572-I589 HydrophobicContact CE1-CG2 3.94Å; F572-I589 HydrophobicContact CZ-CG2 4.08Å; I585-I589 HydrophobicContact CD1-CD1 4.49Å; I585-I589 HydrophobicContact CD1-CG1 4.28Å; I585-I589 HydrophobicContact CG1-CG1 4.32Å; I585-I589 WeakPolarHBondContact O-CG1 3.48Å; I585-I589 PolarHBondContact O-N 2.85Å; I589-N591 PolarHBondContact O-N 2.73Å; I589-N591 VanDerWaalsContact O-N 3.12Å; I589-E592 PolarHBondContact O-N 3.43Å; I589-E592 VanDerWaalsContact O-N 3.08Å; I589-L593 HydrophobicContact CG2-CD1 4.24Å; I589-L593 HydrophobicContact CG2-CG 4.27Å; I589-L593 WeakPolarHBondContact O-CG 3.27Å; I589-L593 PolarHBondContact O-N 3.23Å
590	A	95.2	Very high	95.2	Very high	16 Å²	16	62.4 Å²	62.4	13%	0.132	31%	0.313	C	S	.	.	H	α-helix	trans	-63.4	-18.7	-178.4	0	0	0	0	0	115.3	F572 A586 K588	F572-A590 HydrophobicContact CE2-CB 4Å; F572-A590 HydrophobicContact CZ-CB 3.88Å; A586-A590 WeakPolarHBondContact O-CB 3.5Å; A586-A590 PolarHBondContact O-N 3.16Å; K588-A590 VanDerWaalsContact C-N 3.34Å; K588-A590 PolarHBondContact O-N 2.81Å
591	N	94.6	Very high	95.2	Very high	140 Å²	140	59.6 Å²	59.6	75%	0.749	30%	0.299	S	S	*	.	H	α-helix	trans	-93.2	-23.1	175.1	-69	-10.9	0	0	0	113	S587 K588 I589	S587-N591 WeakPolarHBondContact O-CB 3.16Å; S587-N591 PolarHBondContact O-N 3.05Å; S587-N591 PolarHBondContact O-ND2 3.25Å; S587-N591 PolarHBondContact O-OD1 2.81Å; K588-N591 PolarHBondContact O-N 2.7Å; I589-N591 PolarHBondContact O-N 2.73Å; I589-N591 VanDerWaalsContact O-N 3.12Å
592	E	95.8	Very high	95.2	Very high	78 Å²	78	62.6 Å²	62.6	36%	0.364	31%	0.309	S	S	.	.	H	α-helix	trans	-93.5	-19.2	-177.5	-72.4	173.8	-166.4	0	0	113	V524 N528 K588 I589 K594	V524-E592 HydrophobicContact CG1-CB 3.87Å; N528-E592 PolarHBondContact ND2-OE2 3.37Å; K588-E592 WeakPolarHBondContact CE-OE1 3.47Å; K588-E592 VanDerWaalsContact CG-OE1 3.27Å; K588-E592 WeakPolarHBondContact CG-OE1 3.4Å; K588-E592 PolarHBondContact O-N 2.77Å; K588-E592 VanDerWaalsContact O-N 3.13Å; I589-E592 PolarHBondContact O-N 3.43Å; I589-E592 VanDerWaalsContact O-N 3.08Å; E592-K594 PolarHBondContact O-N 2.73Å
593	L	95.3	Very high	95	Very high	16 Å²	16	64.4 Å²	64.4	8%	0.084	32%	0.32	C	S	.	.			trans	-58.9	118.3	170.9	-76.4	174	0	0	0	112.1	T508 E520 I521 V524 M557 V570 F572 I589 L595	T508-L593 HydrophobicContact CG2-CB 4.31Å; T508-L593 HydrophobicContact CG2-CD1 4.2Å; E520-L593 HydrophobicContact CG-CD2 4.46Å; I521-L593 HydrophobicContact CB-CD2 4.27Å; I521-L593 HydrophobicContact CG1-CD1 4.38Å; I521-L593 HydrophobicContact CG1-CD2 3.64Å; V524-L593 HydrophobicContact CB-CD2 4.11Å; V524-L593 HydrophobicContact CG1-CD2 4.43Å; V524-L593 HydrophobicContact CG2-CD2 4.14Å; M557-L593 HydrophobicContact CE-CD1 4.36Å; V570-L593 HydrophobicContact CG1-CD1 4.45Å; V570-L593 HydrophobicContact CG2-CD1 4.4Å; F572-L593 HydrophobicContact CZ-CD1 4.23Å; I589-L593 HydrophobicContact CG2-CD1 4.24Å; I589-L593 HydrophobicContact CG2-CG 4.27Å; I589-L593 WeakPolarHBondContact O-CG 3.27Å; I589-L593 PolarHBondContact O-N 3.23Å; L593-L595 HydrophobicContact CB-CD1 3.98Å; L593-L595 HydrophobicContact CB-CG 4.09Å; L593-L595 HydrophobicContact CD1-CD1 4.06Å; L593-L595 HydrophobicContact CD2-CD1 4.19Å; L593-L595 HydrophobicContact CG-CD1 4.31Å
594	K	93.6	Very high	95	Very high	162 Å²	162	59 Å²	59	70%	0.704	30%	0.3	S	S	*	.			trans	-99	88.4	175.1	-65.1	175.5	-175.3	178.2	0	109.6	E592	E592-K594 PolarHBondContact O-N 2.73Å
595	L	89.1	Confident	94.9	Very high	50 Å²	50	55.5 Å²	55.5	26%	0.262	28%	0.28	S	S	.	.			trans	-129.5	0	-172.2	-57.3	177.6	0	0	0	111.2	T508 S510 M512 M517 E520 V570 L593	T508-L595 HydrophobicContact CG2-CD1 3.91Å; S510-L595 WeakPolarHBondContact CB-OXT 3.5Å; S510-L595 PolarHBondContact OG-OXT 3.46Å; M512-L595 HydrophobicContact SD-CD2 4.33Å; M517-L595 HydrophobicContact CB-CD2 4.12Å; M517-L595 HydrophobicContact CE-CD1 4.05Å; M517-L595 HydrophobicContact CG-CD2 4.08Å; E520-L595 HydrophobicContact CB-CD2 3.81Å; E520-L595 HydrophobicContact CG-CD2 4.03Å; V570-L595 HydrophobicContact CG2-CD1 3.63Å; L593-L595 HydrophobicContact CB-CD1 3.98Å; L593-L595 HydrophobicContact CB-CG 4.09Å; L593-L595 HydrophobicContact CD1-CD1 4.06Å; L593-L595 HydrophobicContact CD2-CD1 4.19Å; L593-L595 HydrophobicContact CG-CD1 4.31Å

Retrieved 595 of 595 residues in 108.5 ms (Link to these results)

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