A0A087X089_HUMAN Loading...

C-C motif chemokine

AlphaFold DB , UniProt , Accession A0A087X089, Species HUMAN (Homo sapiens, Human), Gene CCL14, Length 115 aa.

						>A0A087X089_HUMAN|A0A087X089|CCL14
MRKAYSPLQVLRGCLLLPSLLHALSLQEQPMVWPLTRGPSSASDALSSGGPYHPSECCFTYTTYKIPRQRIMDYYETNSQCSKPGIVFITKRGHSVCTNPSDKWVQDYIKDMKEN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.3	Very low	41.6	Very low	249 Å²	249	161.8 Å²	161.8	100%	1.227	83%	0.831	S	S	*	*				0	99.4	0	-65.5	-170.3	-176.7	0	0	108.5
2	R	36.7	Very low	42.1	Very low	179 Å²	179	169.3 Å²	169.3	68%	0.675	84%	0.841	S	S	*	*			trans	-101.4	118.4	179.7	-70.8	172.8	163.9	-145.5	-20.3	108.2	A4 N115	R2-A4 PolarHBondContact O-N 3.19Å; R2-N115 PolarHBondContact NE-O 3.05Å; R2-N115 VanDerWaalsContact NE-O 3.12Å; R2-N115 PolarHBondContact NH1-O 2.99Å; R2-N115 PolarHBondContact NH1-OXT 2.79Å; R2-N115 PolarHBondContact NH2-O 2.79Å; R2-N115 PolarHBondContact NH2-OXT 3.11Å
3	K	38.5	Very low	42.4	Very low	192 Å²	192	162.8 Å²	162.8	84%	0.835	84%	0.843	S	S	*	*			trans	-78.1	99.9	167.2	-106.2	169.7	178.4	173.6	0	107.2	Y5	K3-Y5 PolarHBondContact O-N 2.88Å
4	A	42.8	Very low	43.3	Very low	90 Å²	90	159.6 Å²	159.6	74%	0.744	84%	0.841	S	S	*	*			trans	-69.4	108.7	160.1	0	0	0	0	0	107.1	R2	R2-A4 PolarHBondContact O-N 3.19Å
5	Y	36.9	Very low	43.8	Very low	206 Å²	206	159.5 Å²	159.5	81%	0.808	84%	0.84	S	S	*	*			trans	-93.9	97.3	168.6	-117.8	-94.1	0	0	0	107.9	K3	K3-Y5 PolarHBondContact O-N 2.88Å
6	S	37.4	Very low	43.9	Very low	87 Å²	87	160.1 Å²	160.1	61%	0.608	84%	0.842	S	S	*	*			trans	-66.9	139.6	174	-63.9	0	0	0	0	111.2	L8	S6-L8 PolarHBondContact O-N 3.15Å; S6-L8 VanDerWaalsContact O-N 3.08Å
7	P	41.9	Very low	44.3	Very low	127 Å²	127	160.5 Å²	160.5	83%	0.825	84%	0.844	S	S	*	*	S	Bend	trans	-78.5	18	-176.7	31	-34.6	0	0	0	115	Q9	P7-Q9 PolarHBondContact O-N 3.24Å
8	L	43.3	Very low	44.4	Very low	160 Å²	160	157.3 Å²	157.3	84%	0.838	83%	0.834	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	20.8	-168.1	-135.6	83.5	0	0	0	116	S6	S6-L8 PolarHBondContact O-N 3.15Å; S6-L8 VanDerWaalsContact O-N 3.08Å
9	Q	49	Very low	44.7	Very low	174 Å²	174	154.4 Å²	154.4	81%	0.813	83%	0.828	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.9	13.7	-172.2	-72	-147.1	67.1	0	0	117.7	P7 L11	P7-Q9 PolarHBondContact O-N 3.24Å; Q9-L11 VanDerWaalsContact C-N 3.33Å; Q9-L11 PolarHBondContact O-N 3.16Å
10	V	46.6	Very low	44.7	Very low	145 Å²	145	154.9 Å²	154.9	88%	0.879	83%	0.83	S	S	*	*			trans	-95.2	23.9	178.2	-162	0	0	0	0	113.1
11	L	47.3	Very low	44.9	Very low	171 Å²	171	155 Å²	155	90%	0.895	83%	0.829	S	S	*	*			trans	-117.8	58.8	176.9	-144.9	88	0	0	0	112.1	Q9	Q9-L11 VanDerWaalsContact C-N 3.33Å; Q9-L11 PolarHBondContact O-N 3.16Å
12	R	47.9	Very low	45.2	Very low	252 Å²	252	151.8 Å²	151.8	95%	0.951	81%	0.811	S	S	*	*			trans	-163.7	93.7	165.7	-113.2	-178.2	179.6	-160.7	-0.8	110.9
13	G	45.1	Very low	45.5	Very low	84 Å²	84	147.7 Å²	147.7	87%	0.866	82%	0.816	S	S	*	*			trans	175.8	35.5	174.8	0	0	0	0	0	114.8
14	C	54.9	Low	45.9	Very low	119 Å²	119	146.5 Å²	146.5	80%	0.804	82%	0.818	S	S	*	*			trans	-85.2	148.8	161	-153.7	0	0	0	0	107.5
15	L	50.9	Low	46.1	Very low	158 Å²	158	147.8 Å²	147.8	83%	0.827	82%	0.821	S	S	*	*			trans	89.8	94.1	178	-49.5	170.4	0	0	0	114.8
16	L	45.6	Very low	46.5	Very low	168 Å²	168	143.9 Å²	143.9	88%	0.88	81%	0.813	S	S	*	*				-171.5	82	119.3	-88.8	178.8	0	0	0	108.9
17	L	51.5	Low	46.9	Very low	168 Å²	168	148.1 Å²	148.1	88%	0.88	82%	0.824	S	S	*	*			trans	-97.7	129.7	147.7	-93.6	154	0	0	0	105.5
18	P	46.1	Very low	47	Very low	102 Å²	102	148.9 Å²	148.9	66%	0.662	82%	0.816	S	S	*	*				-145.2	140	113.9	28.7	-8.9	0	0	0	114.6
19	S	49	Very low	46.9	Very low	103 Å²	103	149.6 Å²	149.6	72%	0.72	82%	0.815	S	S	*	*			trans	72.2	97.6	136.9	-50.9	0	0	0	0	119.8
20	L	44.5	Very low	46.8	Very low	164 Å²	164	146 Å²	146	86%	0.859	81%	0.807	S	S	*	*				-169.4	88.5	122.1	-99.9	145.3	0	0	0	110
21	L	50.4	Low	46.8	Very low	157 Å²	157	147.8 Å²	147.8	82%	0.822	81%	0.808	S	S	*	*			trans	-53.5	156	144.5	-110.3	72.9	0	0	0	109
22	H	42	Very low	47	Very low	181 Å²	181	145.6 Å²	145.6	84%	0.838	80%	0.801	S	S	*	*			trans	119.5	97.5	171.4	-61.1	118	0	0	0	108.3
23	A	44.7	Very low	46.6	Very low	94 Å²	94	142.6 Å²	142.6	78%	0.777	79%	0.79	S	S	*	*			cis	-160.8	132.1	41.5	0	0	0	0	0	110.5
24	L	45.3	Very low	47	Very low	167 Å²	167	143 Å²	143	87%	0.874	78%	0.777	S	S	*	*			trans	-69.1	122.8	149.5	-86.5	98.1	0	0	0	107.3	L26	L24-L26 HydrophobicContact CD2-CD1 4.45Å
25	S	47.9	Very low	47	Very low	116 Å²	116	144.6 Å²	144.6	81%	0.811	78%	0.777	S	S	*	*			trans	-134.9	106.1	151	-162.5	0	0	0	0	107.3	Q27	S25-Q27 PolarHBondContact O-N 2.95Å
26	L	46	Very low	47.4	Very low	124 Å²	124	142.6 Å²	142.6	65%	0.649	77%	0.772	S	S	*	*			trans	-54.6	129.5	171.3	-82.5	81.8	0	0	0	109.4	L24 E28	L24-L26 HydrophobicContact CD2-CD1 4.45Å; L26-E28 HydrophobicContact CD2-CG 4.14Å
27	Q	45.2	Very low	47.9	Very low	177 Å²	177	146.4 Å²	146.4	83%	0.827	77%	0.774	S	S	*	*			trans	-124.6	96.3	139.4	-171.7	64.6	46.8	0	0	106.9	S25	S25-Q27 PolarHBondContact O-N 2.95Å
28	E	43.8	Very low	48.2	Very low	142 Å²	142	141.1 Å²	141.1	66%	0.664	76%	0.76	S	S	*	*			trans	-43	140	158.8	-64.2	-94.4	88.8	0	0	110.6	L26	L26-E28 HydrophobicContact CD2-CG 4.14Å
29	Q	42	Very low	48.4	Very low	175 Å²	175	142.9 Å²	142.9	82%	0.818	77%	0.772	S	S	*	*			trans	163.5	156.4	134.3	-72.5	-115.5	-38.1	0	0	109.5
30	P	45.5	Very low	48.6	Very low	99 Å²	99	143.5 Å²	143.5	64%	0.643	78%	0.776	S	S	*	*				-119.6	164.3	-77.2	23.5	-2	0	0	0	112	V32	P30-V32 PolarHBondContact O-N 3.16Å
31	M	47.8	Very low	49	Very low	183 Å²	183	140.9 Å²	140.9	90%	0.901	77%	0.772	S	S	*	*			trans	-62.7	96.9	164.7	-86.2	-129.9	-100.8	0	0	111.1
32	V	50.5	Low	49.2	Very low	124 Å²	124	138.6 Å²	138.6	75%	0.752	78%	0.775	S	S	*	*			trans	-149.4	81.4	150	-78.1	0	0	0	0	109.1	P30 P34	P30-V32 PolarHBondContact O-N 3.16Å; V32-P34 WeakPolarHBondContact O-CD 3.08Å
33	W	39.8	Very low	49.8	Very low	190 Å²	190	134.5 Å²	134.5	72%	0.72	77%	0.767	S	S	*	*			trans	-78.8	120.1	159	69.8	-84.8	0	0	0	107	L35	W33-L35 HydrophobicContact CH2-CD2 3.5Å; W33-L35 HydrophobicContact CH2-CG 4.36Å; W33-L35 HydrophobicContact CZ2-CD2 4.21Å; W33-L35 HydrophobicContact CZ3-CD2 3.89Å; W33-L35 HydrophobicContact CZ3-CG 4.44Å; W33-L35 PolarHBondContact O-N 3.34Å
34	P	52.7	Low	50.4	Low	92 Å²	92	137.8 Å²	137.8	60%	0.597	77%	0.772	S	S	*	*			trans	-64.8	135.7	175.1	26.3	-31.8	0	0	0	108.7	V32 T36	V32-P34 WeakPolarHBondContact O-CD 3.08Å; P34-T36 PolarHBondContact O-N 3.4Å
35	L	54.9	Low	50.9	Low	153 Å²	153	134.3 Å²	134.3	80%	0.801	77%	0.767	S	S	*	*			trans	-62.3	76.4	167.8	-76.7	162.6	0	0	0	110.1	W33	W33-L35 HydrophobicContact CH2-CD2 3.5Å; W33-L35 HydrophobicContact CH2-CG 4.36Å; W33-L35 HydrophobicContact CZ2-CD2 4.21Å; W33-L35 HydrophobicContact CZ3-CD2 3.89Å; W33-L35 HydrophobicContact CZ3-CG 4.44Å; W33-L35 PolarHBondContact O-N 3.34Å
36	T	60.1	Low	51.1	Low	116 Å²	116	135.9 Å²	135.9	71%	0.712	77%	0.765	S	S	*	*			trans	-104.8	89.8	165.5	50.3	0	0	0	0	109.6	P34	P34-T36 PolarHBondContact O-N 3.4Å
37	R	57.1	Low	51.5	Low	248 Å²	248	135.1 Å²	135.1	94%	0.936	77%	0.771	S	S	*	*			trans	-20.5	119.2	147.8	-171.9	177.4	-64.8	-147.8	-1.7	114.2
38	G	56.7	Low	52.2	Low	57 Å²	57	130.5 Å²	130.5	59%	0.588	76%	0.757	S	S	*	*			trans	143.3	101.6	152.2	0	0	0	0	0	115.7	S40	G38-S40 PolarHBondContact O-N 2.83Å
39	P	50	Low	52.9	Low	138 Å²	138	127 Å²	127	90%	0.896	76%	0.759	S	S	*	*			trans	-75.2	107.5	164.3	29.2	-28.4	0	0	0	109.4	S41	P39-S41 PolarHBondContact O-N 3.07Å
40	S	53.7	Low	53.9	Low	117 Å²	117	120.5 Å²	120.5	82%	0.818	74%	0.74	S	S	*	*			trans	-90.8	98.3	167.7	-65	0	0	0	0	108.9	G38	G38-S40 PolarHBondContact O-N 2.83Å
41	S	53.1	Low	54.9	Low	109 Å²	109	121.9 Å²	121.9	76%	0.762	75%	0.749	S	S	*	*			trans	43.9	76.1	154.7	-56.4	0	0	0	0	118.2	P39 S43	P39-S41 PolarHBondContact O-N 3.07Å; S41-S43 VanDerWaalsContact C-N 3.28Å; S41-S43 PolarHBondContact O-N 3.13Å
42	A	53.8	Low	56	Low	108 Å²	108	123.6 Å²	123.6	89%	0.893	75%	0.747	S	S	*	*			trans	-84.6	76.3	146.7	0	0	0	0	0	108.3	D44	A42-D44 VanDerWaalsContact C-N 3.32Å; A42-D44 PolarHBondContact O-N 2.87Å
43	S	56.4	Low	56.9	Low	96 Å²	96	120.4 Å²	120.4	67%	0.671	72%	0.724	S	S	*	*			trans	-94.5	62.6	170.9	58	0	0	0	0	109.8	S41	S41-S43 VanDerWaalsContact C-N 3.28Å; S41-S43 PolarHBondContact O-N 3.13Å
44	D	57.3	Low	58.5	Low	163 Å²	163	115.6 Å²	115.6	87%	0.872	72%	0.717	S	S	*	*			trans	-160.1	92.2	163.4	-85.5	-48.7	0	0	0	110.5	A42	A42-D44 VanDerWaalsContact C-N 3.32Å; A42-D44 PolarHBondContact O-N 2.87Å
45	A	55.2	Low	59.8	Low	93 Å²	93	114 Å²	114	77%	0.769	71%	0.707	S	S	*	*			trans	178	74.7	142.9	0	0	0	0	0	107.5	S47	A45-S47 PolarHBondContact O-N 3.22Å
46	L	51.6	Low	61.2	Low	149 Å²	149	112.3 Å²	112.3	78%	0.78	70%	0.696	S	S	*	*			trans	-71.6	73.4	162.9	-161	79.5	0	0	0	107.5	S48	L46-S48 PolarHBondContact O-N 2.82Å; L46-S48 VanDerWaalsContact O-N 3.09Å
47	S	54.2	Low	62.8	Low	109 Å²	109	108.9 Å²	108.9	76%	0.762	68%	0.676	S	S	*	*			trans	-69	104.9	165.2	-171.6	0	0	0	0	106.4	A45 G49	A45-S47 PolarHBondContact O-N 3.22Å; S47-G49 VanDerWaalsContact C-N 3.31Å; S47-G49 PolarHBondContact O-N 2.82Å
48	S	60.1	Low	64.6	Low	79 Å²	79	97.2 Å²	97.2	55%	0.552	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	82.1	-175.4	-178.4	0	0	0	0	111.3	L46 H53	L46-S48 PolarHBondContact O-N 2.82Å; L46-S48 VanDerWaalsContact O-N 3.09Å; S48-H53 VanDerWaalsContact CA-CD2 3.43Å; S48-H53 WeakPolarHBondContact CA-CD2 3.39Å; S48-H53 WeakPolarHBondContact CB-NE2 3.45Å; S48-H53 PolarHBondContact OG-CD2 2.89Å; S48-H53 PolarHBondContact OG-CE1 2.97Å; S48-H53 PolarHBondContact OG-ND1 2.61Å; S48-H53 PolarHBondContact OG-NE2 2.67Å
49	G	59.6	Low	66.3	Low	68 Å²	68	102 Å²	102	70%	0.701	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-171.2	7.3	178.8	0	0	0	0	0	116	S47	S47-G49 VanDerWaalsContact C-N 3.31Å; S47-G49 PolarHBondContact O-N 2.82Å
50	G	61.8	Low	68.4	Low	40 Å²	40	100.8 Å²	100.8	41%	0.412	63%	0.627	S	S	.	*	S	Bend	trans	-80.7	158.7	170.7	0	0	0	0	0	111.6	Y52 H53	G50-Y52 PolarHBondContact O-N 2.73Å; G50-H53 WeakPolarHBondContact O-CB 3.15Å; G50-H53 PolarHBondContact O-N 3.12Å
51	P	66.7	Low	70.5	Confident	127 Å²	127	98.1 Å²	98.1	83%	0.825	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-10	178.2	25.2	-34.1	0	0	0	114.2
52	Y	70.6	Confident	72.5	Confident	219 Å²	219	93.8 Å²	93.8	86%	0.859	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	11.7	176.8	-56.6	-74.8	0	0	0	113.2	G50	G50-Y52 PolarHBondContact O-N 2.73Å
53	H	69.7	Low	74.5	Confident	58 Å²	58	95.5 Å²	95.5	27%	0.269	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-70.3	125.1	177.3	-178.2	-90	0	0	0	110.2	S48 G50 S55	S48-H53 VanDerWaalsContact CA-CD2 3.43Å; S48-H53 WeakPolarHBondContact CA-CD2 3.39Å; S48-H53 WeakPolarHBondContact CB-NE2 3.45Å; S48-H53 PolarHBondContact OG-CD2 2.89Å; S48-H53 PolarHBondContact OG-CE1 2.97Å; S48-H53 PolarHBondContact OG-ND1 2.61Å; S48-H53 PolarHBondContact OG-NE2 2.67Å; G50-H53 WeakPolarHBondContact O-CB 3.15Å; G50-H53 PolarHBondContact O-N 3.12Å; H53-S55 PolarHBondContact O-N 3Å
54	P	73.9	Confident	76.4	Confident	89 Å²	89	98 Å²	98	58%	0.578	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-63	123.9	177	25.3	-32.8	0	0	0	110
55	S	78.7	Confident	78.2	Confident	57 Å²	57	95.6 Å²	95.6	40%	0.399	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-68.5	137.3	173.3	-64.5	0	0	0	0	110.1	H53 C57 N78	H53-S55 PolarHBondContact O-N 3Å; S55-C57 PolarHBondContact O-N 3.44Å; S55-N78 PolarHBondContact OG-ND2 3.25Å
56	E	84.3	Confident	80.2	Confident	119 Å²	119	91.5 Å²	91.5	56%	0.556	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-71.2	120.5	175.1	-68.9	-164.9	130.4	0	0	110.5	Y75	E56-Y75 PolarHBondContact OE2-OH 3.16Å
57	C	93.7	Very high	82.3	Confident	44 Å²	44	87 Å²	87	30%	0.297	49%	0.491	S	S	.	.			trans	-120.5	146.4	179.6	-66.6	0	0	0	0	111.2	S55 F59 C81	S55-C57 PolarHBondContact O-N 3.44Å; C57-F59 HydrophobicContact CB-CE2 4.41Å; C57-F59 HydrophobicContact CB-CZ 4.3Å; C57-C81 WeakPolarHBondContact CA-SG 3.32Å; C57-C81 HydrophobicContact CB-CB 3.75Å; C57-C81 WeakPolarHBondContact CB-SG 3.42Å; C57-C81 WeakPolarHBondContact SG-CB 3.43Å; C57-C81 CovalentContact SG-SG 2.03Å; C57-C81 PolarHBondContact SG-SG 2.99Å
58	C	95.3	Very high	84.2	Confident	3 Å²	3	85.3 Å²	85.3	2%	0.02	47%	0.468	C	S	.	.			trans	-93.1	117.4	174.4	-69.5	0	0	0	0	111.3	Y61 T77 C97	C58-Y61 HydrophobicContact CB-CD1 4.37Å; C58-Y61 HydrophobicContact CB-CE1 3.95Å; C58-T77 HydrophobicContact CB-CG2 4.41Å; C58-C97 WeakPolarHBondContact CA-SG 3.41Å; C58-C97 HydrophobicContact CB-CB 3.68Å; C58-C97 WeakPolarHBondContact CB-SG 3Å; C58-C97 WeakPolarHBondContact SG-CB 3.5Å; C58-C97 CovalentContact SG-SG 2.04Å; C58-C97 PolarHBondContact SG-SG 2.91Å
59	F	92.9	Very high	85.9	Confident	158 Å²	158	89.3 Å²	89.3	69%	0.693	48%	0.478	S	S	*	.	S	Bend	trans	-92.1	-34.2	174.4	-61.7	-75.9	0	0	0	112.3	C57 K83	C57-F59 HydrophobicContact CB-CE2 4.41Å; C57-F59 HydrophobicContact CB-CZ 4.3Å; F59-K83 PolarHBondContact O-NZ 2.93Å
60	T	94.6	Very high	87.6	Confident	112 Å²	112	93.8 Å²	93.8	69%	0.687	47%	0.473	S	S	*	.	S	Bend	trans	-128.5	150	-179.6	56.1	0	0	0	0	109.9	C97	T60-C97 WeakPolarHBondContact O-CB 3.12Å
61	Y	97	Very high	89.2	Confident	60 Å²	60	92.1 Å²	92.1	24%	0.235	46%	0.455	C	S	.	.			trans	-113.2	148.5	177.1	-54.4	-59.1	0	0	0	110	C58 K83 P84 T98 N99	C58-Y61 HydrophobicContact CB-CD1 4.37Å; C58-Y61 HydrophobicContact CB-CE1 3.95Å; Y61-K83 WeakPolarHBondContact OH-CB 3.46Å; Y61-P84 PolarHBondContact OH-O 2.94Å; Y61-T98 WeakPolarHBondContact CD1-O 3.37Å; Y61-T98 WeakPolarHBondContact CE1-O 3.44Å; Y61-N99 HydrophobicContact CD1-CB 4.28Å; Y61-N99 HydrophobicContact CD2-CB 3.82Å; Y61-N99 HydrophobicContact CE2-CB 4.12Å; Y61-N99 HydrophobicContact CG-CB 3.9Å
62	T	96.3	Very high	90.6	Very high	18 Å²	18	91.7 Å²	91.7	11%	0.11	44%	0.443	C	S	.	.			trans	-61.8	138	167	-173.4	0	0	0	0	110.3	Y64 V96 C97 T98 W104	T62-Y64 WeakPolarHBondContact CG2-O 3.25Å; T62-Y64 WeakPolarHBondContact OG1-CD1 3.43Å; T62-Y64 WeakPolarHBondContact OG1-CE1 3.16Å; T62-Y64 PolarHBondContact OG1-N 3.5Å; T62-Y64 PolarHBondContact OG1-O 2.99Å; T62-V96 HydrophobicContact CG2-CG1 4.1Å; T62-C97 PolarHBondContact N-O 3.18Å; T62-T98 HydrophobicContact CG2-CG2 3.7Å; T62-W104 HydrophobicContact CG2-CH2 4.36Å; T62-W104 HydrophobicContact CG2-CZ2 4.13Å
63	T	95.1	Very high	91.8	Very high	145 Å²	145	85.2 Å²	85.2	89%	0.89	42%	0.424	S	S	*	.	S	Bend	trans	-89.4	-16.2	173.8	53.3	0	0	0	0	112.3
64	Y	95.4	Very high	93.1	Very high	147 Å²	147	84.9 Å²	84.9	58%	0.576	42%	0.421	S	S	*	.	S	Bend	trans	-103.6	143.3	-179.1	61.3	-91.5	0	0	0	111.5	T62 I66	T62-Y64 WeakPolarHBondContact CG2-O 3.25Å; T62-Y64 WeakPolarHBondContact OG1-CD1 3.43Å; T62-Y64 WeakPolarHBondContact OG1-CE1 3.16Å; T62-Y64 PolarHBondContact OG1-N 3.5Å; T62-Y64 PolarHBondContact OG1-O 2.99Å; Y64-I66 HydrophobicContact CE2-CG1 4.37Å; Y64-I66 PolarHBondContact O-N 3.34Å
65	K	96.3	Very high	94.1	Very high	113 Å²	113	83.8 Å²	83.8	49%	0.491	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-70.4	122.4	173.5	-178.2	168.5	-179.2	171.3	0	110	W104 Y108	K65-W104 HydrophobicContact CB-CD2 4.3Å; K65-W104 HydrophobicContact CD-CB 3.85Å; K65-W104 HydrophobicContact CD-CD2 4.28Å; K65-W104 HydrophobicContact CD-CE3 4.47Å; K65-W104 HydrophobicContact CD-CG 4.04Å; K65-W104 HydrophobicContact CG-CB 4.4Å; K65-W104 HydrophobicContact CG-CD2 3.84Å; K65-W104 HydrophobicContact CG-CE3 3.83Å; K65-W104 HydrophobicContact CG-CG 4.1Å; K65-W104 HydrophobicContact CG-CZ3 4.37Å; K65-Y108 WeakPolarHBondContact CE-OH 3.4Å
66	I	96.2	Very high	94.8	Very high	7 Å²	7	87.8 Å²	87.8	4%	0.036	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-72.9	133.1	176.7	-54.3	169.9	0	0	0	108.2	Y64 R68 I71 F88 V96 T98 W104 Y108	Y64-I66 HydrophobicContact CE2-CG1 4.37Å; Y64-I66 PolarHBondContact O-N 3.34Å; I66-R68 PolarHBondContact O-N 3.22Å; I66-I71 HydrophobicContact CB-CD1 4.17Å; I66-I71 HydrophobicContact CB-CG1 4.41Å; I66-I71 HydrophobicContact CG2-CD1 4.12Å; I66-I71 HydrophobicContact CG2-CG1 3.81Å; I66-F88 HydrophobicContact CD1-CB 4.18Å; I66-F88 HydrophobicContact CD1-CD2 4Å; I66-V96 HydrophobicContact CD1-CB 3.72Å; I66-V96 HydrophobicContact CD1-CG1 3.63Å; I66-V96 HydrophobicContact CD1-CG2 4.19Å; I66-V96 HydrophobicContact CG1-CG1 4.46Å; I66-T98 HydrophobicContact CD1-CG2 4.23Å; I66-W104 HydrophobicContact CB-CH2 4.46Å; I66-W104 HydrophobicContact CB-CZ3 4.45Å; I66-W104 HydrophobicContact CD1-CH2 4.31Å; I66-W104 HydrophobicContact CG1-CH2 4.12Å; I66-Y108 VanDerWaalsContact O-CE2 3.25Å; I66-Y108 WeakPolarHBondContact O-CE2 3.21Å; I66-Y108 PolarHBondContact O-OH 2.98Å
67	P	96.2	Very high	95.3	Very high	56 Å²	56	82.6 Å²	82.6	36%	0.364	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-60.5	124.9	175.1	-24.6	34	0	0	0	111.6	Q69 R70	P67-Q69 PolarHBondContact O-N 3.22Å; P67-R70 HydrophobicContact CB-CG 4.29Å; P67-R70 WeakPolarHBondContact O-CB 3.38Å; P67-R70 PolarHBondContact O-N 3.12Å
68	R	94.8	Very high	95.1	Very high	73 Å²	73	83 Å²	83	28%	0.275	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-48.3	-40.1	-176.1	-174.9	60.8	-175	85.8	5.9	114.1	I66 R70 I71 Y108	I66-R68 PolarHBondContact O-N 3.22Å; R68-R70 PolarHBondContact O-N 3.38Å; R68-I71 PolarHBondContact O-N 2.94Å; R68-I71 VanDerWaalsContact O-N 3.11Å; R68-Y108 HydrophobicContact CB-CE1 3.98Å; R68-Y108 HydrophobicContact CB-CE2 4.09Å; R68-Y108 WeakPolarHBondContact CB-OH 3.37Å; R68-Y108 HydrophobicContact CG-CE1 4.26Å; R68-Y108 PolarHBondContact N-OH 3.31Å; R68-Y108 VanDerWaalsContact N-OH 3.16Å
69	Q	94.7	Very high	94.9	Very high	163 Å²	163	88.5 Å²	88.5	76%	0.762	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-63.2	-20.4	-179.2	-65.6	176.8	-22.1	0	0	113.9	P67 K91	P67-Q69 PolarHBondContact O-N 3.22Å; Q69-K91 WeakPolarHBondContact O-CD 3.03Å; Q69-K91 WeakPolarHBondContact O-CE 3.47Å; Q69-K91 PolarHBondContact O-NZ 2.9Å
70	R	95.8	Very high	94.8	Very high	161 Å²	161	88.7 Å²	88.7	61%	0.608	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-88.7	-14.9	178.2	-63.4	-174.9	-173.5	169.6	2.8	112.7	P67 R68 T90 K91	P67-R70 HydrophobicContact CB-CG 4.29Å; P67-R70 WeakPolarHBondContact O-CB 3.38Å; P67-R70 PolarHBondContact O-N 3.12Å; R68-R70 PolarHBondContact O-N 3.38Å; R70-T90 CarbonylContact O-C 3.57Å; R70-T90 WeakPolarHBondContact O-CA 3.49Å; R70-T90 WeakPolarHBondContact O-CB 3.15Å; R70-K91 PolarHBondContact O-N 2.99Å
71	I	96.1	Very high	94.6	Very high	6 Å²	6	84.1 Å²	84.1	3%	0.031	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129	-179.4	-60.5	171.9	0	0	0	108.7	I66 R68 F88 Y108 M112	I66-I71 HydrophobicContact CB-CD1 4.17Å; I66-I71 HydrophobicContact CB-CG1 4.41Å; I66-I71 HydrophobicContact CG2-CD1 4.12Å; I66-I71 HydrophobicContact CG2-CG1 3.81Å; R68-I71 PolarHBondContact O-N 2.94Å; R68-I71 VanDerWaalsContact O-N 3.11Å; I71-F88 HydrophobicContact CD1-CB 4.38Å; I71-F88 HydrophobicContact CD1-CD1 3.98Å; I71-F88 HydrophobicContact CD1-CD2 4.19Å; I71-F88 HydrophobicContact CD1-CE1 4.37Å; I71-F88 HydrophobicContact CD1-CG 3.92Å; I71-F88 HydrophobicContact CG1-CB 4.33Å; I71-F88 HydrophobicContact CG1-CG 4.38Å; I71-F88 HydrophobicContact CG2-CB 4.23Å; I71-F88 HydrophobicContact CG2-CD1 3.66Å; I71-F88 HydrophobicContact CG2-CE1 4.46Å; I71-F88 HydrophobicContact CG2-CG 4.2Å; I71-Y108 HydrophobicContact CD1-CD2 3.3Å; I71-Y108 HydrophobicContact CD1-CE2 3.45Å; I71-Y108 VanDerWaalsContact CD1-CE2 3.45Å; I71-M112 HydrophobicContact CG2-CE 4.3Å; I71-M112 HydrophobicContact CG2-SD 3.86Å
72	M	95.4	Very high	94.4	Very high	117 Å²	117	87.4 Å²	87.4	58%	0.576	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	-44.3	177.2	-176.4	176.6	72	0	0	110.8	I89 K91	M72-I89 HydrophobicContact CE-CG2 3.89Å; M72-I89 PolarHBondContact N-O 3.21Å; M72-K91 HydrophobicContact CB-CG 4.11Å
73	D	95.5	Very high	94.2	Very high	83 Å²	83	91.3 Å²	91.3	44%	0.444	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	174.4	-174.9	-158.2	3.3	0	0	0	111.2	I89	D73-I89 HydrophobicContact CB-CB 4.26Å; D73-I89 HydrophobicContact CB-CD1 4.41Å; D73-I89 PolarHBondContact N-O 2.96Å; D73-I89 PolarHBondContact O-N 3.23Å
74	Y	96	Very high	94.2	Very high	52 Å²	52	88.2 Å²	88.2	20%	0.204	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	155.3	171.8	78.2	-78.3	0	0	0	112.3	I86 V87 F88 I109 M112 K113	Y74-I86 HydrophobicContact CD2-CG2 4.06Å; Y74-V87 CarbonylContact C-O 3.42Å; Y74-V87 WeakPolarHBondContact CA-O 3.43Å; Y74-F88 HydrophobicContact CG-CE1 4.38Å; Y74-I109 HydrophobicContact CD2-CG1 4.04Å; Y74-I109 HydrophobicContact CE1-CG2 4.47Å; Y74-I109 HydrophobicContact CE2-CD1 4.49Å; Y74-I109 HydrophobicContact CE2-CG1 3.95Å; Y74-I109 HydrophobicContact CE2-CG2 3.97Å; Y74-I109 HydrophobicContact CG-CG1 4.49Å; Y74-M112 HydrophobicContact CD1-CB 4.26Å; Y74-M112 HydrophobicContact CD1-CE 3.15Å; Y74-M112 HydrophobicContact CD1-SD 3.85Å; Y74-M112 HydrophobicContact CE1-CB 3.96Å; Y74-M112 HydrophobicContact CE1-CE 3.84Å; Y74-M112 HydrophobicContact CG-CE 3.74Å; Y74-K113 WeakPolarHBondContact OH-CE 3.46Å; Y74-K113 WeakPolarHBondContact OH-CG 3.48Å
75	Y	95	Very high	94.2	Very high	66 Å²	66	81.2 Å²	81.2	26%	0.259	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	157.2	168.3	60.2	-82.4	0	0	0	110.8	E56 V87 I89	E56-Y75 PolarHBondContact OE2-OH 3.16Å; Y75-V87 HydrophobicContact CD1-CB 4.08Å; Y75-V87 HydrophobicContact CD1-CG1 4.42Å; Y75-V87 HydrophobicContact CD2-CB 4.21Å; Y75-V87 HydrophobicContact CD2-CG2 4.4Å; Y75-V87 HydrophobicContact CE1-CB 3.61Å; Y75-V87 HydrophobicContact CE1-CG1 3.57Å; Y75-V87 HydrophobicContact CE1-CG2 4.47Å; Y75-V87 HydrophobicContact CE2-CB 3.81Å; Y75-V87 HydrophobicContact CE2-CG1 4.33Å; Y75-V87 HydrophobicContact CE2-CG2 3.81Å; Y75-V87 HydrophobicContact CG-CB 4.35Å; Y75-V87 VanDerWaalsContact CZ-CB 3.49Å; Y75-V87 PolarHBondContact N-O 3.04Å; Y75-V87 PolarHBondContact O-N 2.97Å; Y75-V87 WeakPolarHBondContact OH-CG1 3.47Å; Y75-I89 HydrophobicContact CD1-CD1 3.95Å; Y75-I89 HydrophobicContact CD1-CG1 4.09Å; Y75-I89 HydrophobicContact CE1-CD1 3.88Å; Y75-I89 HydrophobicContact CE1-CG1 3.85Å
76	E	94.7	Very high	94.3	Very high	140 Å²	140	76.2 Å²	76.2	65%	0.654	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	138.5	173	-169.1	171.7	174.8	0	0	109.4	I86	E76-I86 HydrophobicContact CB-CD1 4.01Å; E76-I86 HydrophobicContact CG-CD1 3.99Å
77	T	93.9	Very high	94.3	Very high	10 Å²	10	76.1 Å²	76.1	6%	0.061	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-66.7	159	174.4	56.9	0	0	0	0	110.9	C58 S79 G85 V87	C58-T77 HydrophobicContact CB-CG2 4.41Å; T77-S79 PolarHBondContact O-N 3.34Å; T77-G85 PolarHBondContact N-O 2.86Å; T77-G85 WeakPolarHBondContact OG1-CA 3.34Å; T77-G85 PolarHBondContact OG1-N 3.44Å; T77-G85 PolarHBondContact OG1-O 2.76Å; T77-V87 HydrophobicContact CG2-CG2 3.85Å
78	N	90.6	Very high	94.4	Very high	52 Å²	52	73.5 Å²	73.5	28%	0.278	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-56.8	138.5	176.9	-169.3	-27.8	0	0	0	111.3	S55 Q80 C81	S55-N78 PolarHBondContact OG-ND2 3.25Å; N78-Q80 PolarHBondContact O-N 3.17Å; N78-Q80 VanDerWaalsContact O-N 3.14Å; N78-Q80 WeakPolarHBondContact OD1-CG 3.3Å; N78-Q80 PolarHBondContact OD1-N 3.32Å; N78-C81 WeakPolarHBondContact O-CB 3.44Å; N78-C81 PolarHBondContact O-N 2.91Å; N78-C81 PolarHBondContact O-SG 2.83Å
79	S	90.3	Very high	94.5	Very high	120 Å²	120	71.8 Å²	71.8	84%	0.839	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-16.1	176.8	57.5	0	0	0	0	113.7	T77 C81	T77-S79 PolarHBondContact O-N 3.34Å; S79-C81 PolarHBondContact O-N 3.23Å
80	Q	90.5	Very high	94.5	Very high	162 Å²	162	64.8 Å²	64.8	76%	0.757	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-14.6	171.9	-64.3	178.6	49	0	0	113.3	N78	N78-Q80 PolarHBondContact O-N 3.17Å; N78-Q80 VanDerWaalsContact O-N 3.14Å; N78-Q80 WeakPolarHBondContact OD1-CG 3.3Å; N78-Q80 PolarHBondContact OD1-N 3.32Å
81	C	91.6	Very high	94.5	Very high	15 Å²	15	64 Å²	64	10%	0.101	34%	0.336	C	S	.	.	S	Bend	trans	-66.3	139.3	175.8	-60.3	0	0	0	0	110.3	C57 N78 S79 K83	C57-C81 WeakPolarHBondContact CA-SG 3.32Å; C57-C81 HydrophobicContact CB-CB 3.75Å; C57-C81 WeakPolarHBondContact CB-SG 3.42Å; C57-C81 WeakPolarHBondContact SG-CB 3.43Å; C57-C81 CovalentContact SG-SG 2.03Å; C57-C81 PolarHBondContact SG-SG 2.99Å; N78-C81 WeakPolarHBondContact O-CB 3.44Å; N78-C81 PolarHBondContact O-N 2.91Å; N78-C81 PolarHBondContact O-SG 2.83Å; S79-C81 PolarHBondContact O-N 3.23Å; C81-K83 WeakPolarHBondContact CB-O 3.49Å; C81-K83 PolarHBondContact O-N 2.04Å
82	S	91.4	Very high	94.5	Very high	129 Å²	129	73.7 Å²	73.7	90%	0.902	37%	0.372	S	S	*	.	S	Bend	trans	-62	-19.1	178.5	-48.4	0	0	0	0	113.6
83	K	93.1	Very high	94.4	Very high	100 Å²	100	70.7 Å²	70.7	44%	0.435	37%	0.372	S	S	.	.	S	Bend	trans	-129.2	132.7	177.6	-66.8	-174.4	-179.4	-179.5	0	109.3	F59 Y61 C81	F59-K83 PolarHBondContact O-NZ 2.93Å; Y61-K83 WeakPolarHBondContact OH-CB 3.46Å; C81-K83 WeakPolarHBondContact CB-O 3.49Å; C81-K83 PolarHBondContact O-N 2.04Å
84	P	94.7	Very high	94.4	Very high	80 Å²	80	72 Å²	72	52%	0.519	38%	0.375	S	S	.	.			trans	-70.9	140.2	173.6	32.4	-35.6	0	0	0	109.5	Y61 P100	Y61-P84 PolarHBondContact OH-O 2.94Å; P84-P100 HydrophobicContact CB-CG 3.96Å; P84-P100 HydrophobicContact CG-CG 3.98Å; P84-P100 WeakPolarHBondContact O-CD 2.85Å
85	G	95.7	Very high	94.3	Very high	1 Å²	1	72.7 Å²	72.7	1%	0.01	39%	0.388	C	S	.	.			trans	-143.8	141.8	-176	0	0	0	0	0	112	T77	T77-G85 PolarHBondContact N-O 2.86Å; T77-G85 WeakPolarHBondContact OG1-CA 3.34Å; T77-G85 PolarHBondContact OG1-N 3.44Å; T77-G85 PolarHBondContact OG1-O 2.76Å
86	I	97.1	Very high	94.4	Very high	8 Å²	8	70.8 Å²	70.8	4%	0.041	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123.1	165.8	-60.3	-67.6	0	0	0	107.3	Y74 E76 F88 T98 P100 V105 I109	Y74-I86 HydrophobicContact CD2-CG2 4.06Å; E76-I86 HydrophobicContact CB-CD1 4.01Å; E76-I86 HydrophobicContact CG-CD1 3.99Å; I86-F88 HydrophobicContact CG2-CE1 4.2Å; I86-F88 HydrophobicContact CG2-CE2 4.42Å; I86-F88 HydrophobicContact CG2-CZ 4.1Å; I86-T98 PolarHBondContact N-O 2.93Å; I86-T98 VanDerWaalsContact N-O 3.14Å; I86-T98 PolarHBondContact O-N 2.97Å; I86-T98 PolarHBondContact O-OG1 3.1Å; I86-P100 HydrophobicContact CG1-CB 4Å; I86-V105 HydrophobicContact CB-CG1 3.96Å; I86-V105 HydrophobicContact CG1-CG1 4.12Å; I86-V105 HydrophobicContact CG2-CG1 4.1Å; I86-I109 HydrophobicContact CD1-CD1 3.93Å; I86-I109 HydrophobicContact CG1-CD1 3.89Å; I86-I109 HydrophobicContact CG2-CD1 4.08Å; I86-I109 HydrophobicContact CG2-CG1 4.45Å
87	V	97.1	Very high	94.5	Very high	5 Å²	5	65.8 Å²	65.8	3%	0.03	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	118.3	176.7	-174.7	0	0	0	0	108.6	Y74 Y75 T77 V96	Y74-V87 CarbonylContact C-O 3.42Å; Y74-V87 WeakPolarHBondContact CA-O 3.43Å; Y75-V87 HydrophobicContact CD1-CB 4.08Å; Y75-V87 HydrophobicContact CD1-CG1 4.42Å; Y75-V87 HydrophobicContact CD2-CB 4.21Å; Y75-V87 HydrophobicContact CD2-CG2 4.4Å; Y75-V87 HydrophobicContact CE1-CB 3.61Å; Y75-V87 HydrophobicContact CE1-CG1 3.57Å; Y75-V87 HydrophobicContact CE1-CG2 4.47Å; Y75-V87 HydrophobicContact CE2-CB 3.81Å; Y75-V87 HydrophobicContact CE2-CG1 4.33Å; Y75-V87 HydrophobicContact CE2-CG2 3.81Å; Y75-V87 HydrophobicContact CG-CB 4.35Å; Y75-V87 VanDerWaalsContact CZ-CB 3.49Å; Y75-V87 PolarHBondContact N-O 3.04Å; Y75-V87 PolarHBondContact O-N 2.97Å; Y75-V87 WeakPolarHBondContact OH-CG1 3.47Å; T77-V87 HydrophobicContact CG2-CG2 3.85Å; V87-V96 WeakPolarHBondContact CA-O 3.39Å
88	F	97.5	Very high	94.7	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131	169.6	-69.6	-62.3	0	0	0	110.3	I66 I71 Y74 I86 S95 V96 T98 W104 V105 Y108 M112	I66-F88 HydrophobicContact CD1-CB 4.18Å; I66-F88 HydrophobicContact CD1-CD2 4Å; I71-F88 HydrophobicContact CD1-CB 4.38Å; I71-F88 HydrophobicContact CD1-CD1 3.98Å; I71-F88 HydrophobicContact CD1-CD2 4.19Å; I71-F88 HydrophobicContact CD1-CE1 4.37Å; I71-F88 HydrophobicContact CD1-CG 3.92Å; I71-F88 HydrophobicContact CG1-CB 4.33Å; I71-F88 HydrophobicContact CG1-CG 4.38Å; I71-F88 HydrophobicContact CG2-CB 4.23Å; I71-F88 HydrophobicContact CG2-CD1 3.66Å; I71-F88 HydrophobicContact CG2-CE1 4.46Å; I71-F88 HydrophobicContact CG2-CG 4.2Å; Y74-F88 HydrophobicContact CG-CE1 4.38Å; I86-F88 HydrophobicContact CG2-CE1 4.2Å; I86-F88 HydrophobicContact CG2-CE2 4.42Å; I86-F88 HydrophobicContact CG2-CZ 4.1Å; F88-S95 WeakPolarHBondContact O-CA 3.42Å; F88-V96 PolarHBondContact N-O 3.14Å; F88-V96 PolarHBondContact O-N 3.12Å; F88-T98 HydrophobicContact CD2-CG2 3.41Å; F88-T98 VanDerWaalsContact CD2-CG2 3.41Å; F88-T98 HydrophobicContact CE2-CG2 3.71Å; F88-T98 WeakPolarHBondContact CE2-OG1 3.18Å; F88-W104 HydrophobicContact CD2-CH2 4.29Å; F88-W104 HydrophobicContact CD2-CZ3 4.24Å; F88-W104 AromaticContact CE2-CH2 3.93Å; F88-W104 HydrophobicContact CE2-CH2 3.93Å; F88-W104 AromaticContact CE2-CZ3 3.66Å; F88-W104 HydrophobicContact CE2-CZ3 3.66Å; F88-W104 HydrophobicContact CZ-CZ3 4.46Å; F88-V105 HydrophobicContact CE2-CB 4.43Å; F88-V105 HydrophobicContact CE2-CG1 3.99Å; F88-V105 HydrophobicContact CE2-CG2 4.18Å; F88-V105 HydrophobicContact CZ-CB 4.45Å; F88-V105 HydrophobicContact CZ-CG1 3.86Å; F88-Y108 HydrophobicContact CZ-CD2 4.33Å; F88-M112 HydrophobicContact CD1-CE 3.96Å; F88-M112 HydrophobicContact CE1-CE 3.46Å; F88-M112 VanDerWaalsContact CE1-CE 3.46Å
89	I	96.7	Very high	95	Very high	37 Å²	37	64.9 Å²	64.9	19%	0.19	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	118.8	170.4	-52.9	-178.5	0	0	0	107.7	M72 D73 Y75	M72-I89 HydrophobicContact CE-CG2 3.89Å; M72-I89 PolarHBondContact N-O 3.21Å; D73-I89 HydrophobicContact CB-CB 4.26Å; D73-I89 HydrophobicContact CB-CD1 4.41Å; D73-I89 PolarHBondContact N-O 2.96Å; D73-I89 PolarHBondContact O-N 3.23Å; Y75-I89 HydrophobicContact CD1-CD1 3.95Å; Y75-I89 HydrophobicContact CD1-CG1 4.09Å; Y75-I89 HydrophobicContact CE1-CD1 3.88Å; Y75-I89 HydrophobicContact CE1-CG1 3.85Å
90	T	96.4	Very high	95.3	Very high	16 Å²	16	60.6 Å²	60.6	10%	0.098	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	159.3	176.2	65.4	0	0	0	0	111.2	R70 R92 G93 H94 V96	R70-T90 CarbonylContact O-C 3.57Å; R70-T90 WeakPolarHBondContact O-CA 3.49Å; R70-T90 WeakPolarHBondContact O-CB 3.15Å; T90-R92 PolarHBondContact O-N 3.43Å; T90-G93 PolarHBondContact O-N 3.08Å; T90-H94 PolarHBondContact N-O 2.55Å; T90-H94 WeakPolarHBondContact OG1-CB 2.98Å; T90-H94 PolarHBondContact OG1-N 3.36Å; T90-H94 PolarHBondContact OG1-O 3.47Å; T90-H94 VanDerWaalsContact OG1-O 3.13Å; T90-V96 HydrophobicContact CG2-CG2 4.3Å
91	K	95.8	Very high	95.6	Very high	145 Å²	145	57.2 Å²	57.2	63%	0.63	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-16.7	173.5	-70	179.1	175.1	171.6	0	114.1	Q69 R70 M72 G93	Q69-K91 WeakPolarHBondContact O-CD 3.03Å; Q69-K91 WeakPolarHBondContact O-CE 3.47Å; Q69-K91 PolarHBondContact O-NZ 2.9Å; R70-K91 PolarHBondContact O-N 2.99Å; M72-K91 HydrophobicContact CB-CG 4.11Å; K91-G93 VanDerWaalsContact C-N 3.33Å
92	R	95.1	Very high	95.9	Very high	209 Å²	209	59 Å²	59	79%	0.789	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	3.8	174.9	-63.6	-174	67.1	170.6	0.7	112.9	T90 H94	T90-R92 PolarHBondContact O-N 3.43Å; R92-H94 VanDerWaalsContact C-N 3.34Å
93	G	93.6	Very high	96.1	Very high	55 Å²	55	60.4 Å²	60.4	57%	0.567	32%	0.32	S	S	*	.	S	Bend	trans	80.1	8.8	-178.6	0	0	0	0	0	114.6	T90 K91	T90-G93 PolarHBondContact O-N 3.08Å; K91-G93 VanDerWaalsContact C-N 3.33Å
94	H	94.8	Very high	96.3	Very high	109 Å²	109	57.3 Å²	57.3	51%	0.505	31%	0.305	S	S	.	.			trans	-83.9	131.5	177.1	-56	-179.8	0	0	0	110.6	T90 R92	T90-H94 PolarHBondContact N-O 2.55Å; T90-H94 WeakPolarHBondContact OG1-CB 2.98Å; T90-H94 PolarHBondContact OG1-N 3.36Å; T90-H94 PolarHBondContact OG1-O 3.47Å; T90-H94 VanDerWaalsContact OG1-O 3.13Å; R92-H94 VanDerWaalsContact C-N 3.34Å
95	S	95.6	Very high	96.4	Very high	68 Å²	68	53.5 Å²	53.5	48%	0.476	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.2	169.6	-63.7	0	0	0	0	110.4	F88	F88-S95 WeakPolarHBondContact O-CA 3.42Å
96	V	96.6	Very high	96.5	Very high	26 Å²	26	58.3 Å²	58.3	16%	0.158	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	119.1	180	-174.4	0	0	0	0	110.3	T62 I66 V87 F88 T90	T62-V96 HydrophobicContact CG2-CG1 4.1Å; I66-V96 HydrophobicContact CD1-CB 3.72Å; I66-V96 HydrophobicContact CD1-CG1 3.63Å; I66-V96 HydrophobicContact CD1-CG2 4.19Å; I66-V96 HydrophobicContact CG1-CG1 4.46Å; V87-V96 WeakPolarHBondContact CA-O 3.39Å; F88-V96 PolarHBondContact N-O 3.14Å; F88-V96 PolarHBondContact O-N 3.12Å; T90-V96 HydrophobicContact CG2-CG2 4.3Å
97	C	97.4	Very high	96.5	Very high	35 Å²	35	61.2 Å²	61.2	24%	0.236	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	131.9	175	-80.8	0	0	0	0	112.1	C58 T60 T62	C58-C97 WeakPolarHBondContact CA-SG 3.41Å; C58-C97 HydrophobicContact CB-CB 3.68Å; C58-C97 WeakPolarHBondContact CB-SG 3Å; C58-C97 WeakPolarHBondContact SG-CB 3.5Å; C58-C97 CovalentContact SG-SG 2.04Å; C58-C97 PolarHBondContact SG-SG 2.91Å; T60-C97 WeakPolarHBondContact O-CB 3.12Å; T62-C97 PolarHBondContact N-O 3.18Å
98	T	97.6	Very high	96.4	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	154.3	179.7	69.5	0	0	0	0	111.3	Y61 T62 I66 I86 F88 W104	Y61-T98 WeakPolarHBondContact CD1-O 3.37Å; Y61-T98 WeakPolarHBondContact CE1-O 3.44Å; T62-T98 HydrophobicContact CG2-CG2 3.7Å; I66-T98 HydrophobicContact CD1-CG2 4.23Å; I86-T98 PolarHBondContact N-O 2.93Å; I86-T98 VanDerWaalsContact N-O 3.14Å; I86-T98 PolarHBondContact O-N 2.97Å; I86-T98 PolarHBondContact O-OG1 3.1Å; F88-T98 HydrophobicContact CD2-CG2 3.41Å; F88-T98 VanDerWaalsContact CD2-CG2 3.41Å; F88-T98 HydrophobicContact CE2-CG2 3.71Å; F88-T98 WeakPolarHBondContact CE2-OG1 3.18Å; T98-W104 HydrophobicContact CG2-CH2 3.75Å; T98-W104 HydrophobicContact CG2-CZ2 4.17Å
99	N	97.5	Very high	96.4	Very high	42 Å²	42	63.3 Å²	63.3	23%	0.225	33%	0.328	C	S	.	.			trans	-82.2	121.3	-178.7	-175	-10.3	0	0	0	110	Y61 S101 D102 V105	Y61-N99 HydrophobicContact CD1-CB 4.28Å; Y61-N99 HydrophobicContact CD2-CB 3.82Å; Y61-N99 HydrophobicContact CE2-CB 4.12Å; Y61-N99 HydrophobicContact CG-CB 3.9Å; N99-S101 PolarHBondContact O-N 3.03Å; N99-S101 VanDerWaalsContact O-N 3.12Å; N99-S101 WeakPolarHBondContact OD1-CB 3.41Å; N99-S101 PolarHBondContact OD1-N 3.35Å; N99-S101 PolarHBondContact OD1-OG 3.41Å; N99-D102 WeakPolarHBondContact O-CB 3.38Å; N99-D102 PolarHBondContact O-N 2.57Å; N99-V105 WeakPolarHBondContact O-CG2 3.38Å
100	P	96.3	Very high	96.3	Very high	31 Å²	31	67 Å²	67	20%	0.201	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-19.7	178	23.9	-33.6	0	0	0	113.9	P84 I86 D102 Q106	P84-P100 HydrophobicContact CB-CG 3.96Å; P84-P100 HydrophobicContact CG-CG 3.98Å; P84-P100 WeakPolarHBondContact O-CD 2.85Å; I86-P100 HydrophobicContact CG1-CB 4Å; P100-D102 VanDerWaalsContact C-N 3.3Å; P100-Q106 WeakPolarHBondContact O-CG 3.41Å; P100-Q106 PolarHBondContact O-NE2 2.79Å
101	S	96.2	Very high	96.2	Very high	91 Å²	91	69.9 Å²	69.9	64%	0.636	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-13.4	176.4	-56.3	0	0	0	0	113.6	N99 K103	N99-S101 PolarHBondContact O-N 3.03Å; N99-S101 VanDerWaalsContact O-N 3.12Å; N99-S101 WeakPolarHBondContact OD1-CB 3.41Å; N99-S101 PolarHBondContact OD1-N 3.35Å; N99-S101 PolarHBondContact OD1-OG 3.41Å; S101-K103 PolarHBondContact O-N 2.87Å
102	D	96.9	Very high	95.9	Very high	53 Å²	53	64.4 Å²	64.4	28%	0.283	33%	0.334	S	S	.	.	S	Bend	trans	-73.1	126.8	179	-75.4	-13.1	0	0	0	110.8	N99 P100 W104 V105 Q106	N99-D102 WeakPolarHBondContact O-CB 3.38Å; N99-D102 PolarHBondContact O-N 2.57Å; P100-D102 VanDerWaalsContact C-N 3.3Å; D102-W104 VanDerWaalsContact C-N 3.25Å; D102-W104 PolarHBondContact O-N 2.74Å; D102-W104 PolarHBondContact OD2-NE1 3.23Å; D102-V105 HydrophobicContact CB-CB 4.21Å; D102-V105 HydrophobicContact CB-CG2 3.69Å; D102-V105 WeakPolarHBondContact O-CB 3.42Å; D102-V105 PolarHBondContact O-N 3.1Å; D102-Q106 PolarHBondContact O-N 3.31Å
103	K	96.9	Very high	95.7	Very high	158 Å²	158	61.5 Å²	61.5	69%	0.687	33%	0.327	S	S	*	.	H	α-helix	trans	-53	-43	-179.6	-175.6	178.4	178	178	0	112.8	S101 V105 Q106 D107	S101-K103 PolarHBondContact O-N 2.87Å; K103-V105 VanDerWaalsContact C-N 3.27Å; K103-V105 PolarHBondContact O-N 3.09Å; K103-Q106 PolarHBondContact O-N 2.03Å; K103-D107 PolarHBondContact O-N 3.15Å
104	W	96.9	Very high	95	Very high	34 Å²	34	65.3 Å²	65.3	13%	0.129	33%	0.33	C	S	.	.	H	α-helix	trans	-66.7	-29.1	-178.4	72.7	-91.2	0	0	0	113.3	T62 K65 I66 F88 T98 D102 Y108	T62-W104 HydrophobicContact CG2-CH2 4.36Å; T62-W104 HydrophobicContact CG2-CZ2 4.13Å; K65-W104 HydrophobicContact CB-CD2 4.3Å; K65-W104 HydrophobicContact CD-CB 3.85Å; K65-W104 HydrophobicContact CD-CD2 4.28Å; K65-W104 HydrophobicContact CD-CE3 4.47Å; K65-W104 HydrophobicContact CD-CG 4.04Å; K65-W104 HydrophobicContact CG-CB 4.4Å; K65-W104 HydrophobicContact CG-CD2 3.84Å; K65-W104 HydrophobicContact CG-CE3 3.83Å; K65-W104 HydrophobicContact CG-CG 4.1Å; K65-W104 HydrophobicContact CG-CZ3 4.37Å; I66-W104 HydrophobicContact CB-CH2 4.46Å; I66-W104 HydrophobicContact CB-CZ3 4.45Å; I66-W104 HydrophobicContact CD1-CH2 4.31Å; I66-W104 HydrophobicContact CG1-CH2 4.12Å; F88-W104 HydrophobicContact CD2-CH2 4.29Å; F88-W104 HydrophobicContact CD2-CZ3 4.24Å; F88-W104 AromaticContact CE2-CH2 3.93Å; F88-W104 HydrophobicContact CE2-CH2 3.93Å; F88-W104 AromaticContact CE2-CZ3 3.66Å; F88-W104 HydrophobicContact CE2-CZ3 3.66Å; F88-W104 HydrophobicContact CZ-CZ3 4.46Å; T98-W104 HydrophobicContact CG2-CH2 3.75Å; T98-W104 HydrophobicContact CG2-CZ2 4.17Å; D102-W104 VanDerWaalsContact C-N 3.25Å; D102-W104 PolarHBondContact O-N 2.74Å; D102-W104 PolarHBondContact OD2-NE1 3.23Å; W104-Y108 AromaticContact CE3-CD2 3.82Å; W104-Y108 HydrophobicContact CE3-CD2 3.82Å; W104-Y108 AromaticContact CE3-CE2 3.84Å; W104-Y108 HydrophobicContact CE3-CE2 3.84Å; W104-Y108 HydrophobicContact CE3-CG 4.38Å; W104-Y108 AromaticContact CZ3-CD2 3.86Å; W104-Y108 HydrophobicContact CZ3-CD2 3.86Å; W104-Y108 AromaticContact CZ3-CE2 3.91Å; W104-Y108 HydrophobicContact CZ3-CE2 3.91Å; W104-Y108 WeakPolarHBondContact O-CB 3.49Å; W104-Y108 WeakPolarHBondContact O-CD1 3.38Å; W104-Y108 VanDerWaalsContact O-CG 3.32Å; W104-Y108 PolarHBondContact O-N 3.14Å; W104-Y108 VanDerWaalsContact O-N 3.12Å
105	V	97.3	Very high	93.3	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-68.9	-46.3	175.6	175.9	0	0	0	0	108.9	I86 F88 N99 D102 K103 Y108 I109	I86-V105 HydrophobicContact CB-CG1 3.96Å; I86-V105 HydrophobicContact CG1-CG1 4.12Å; I86-V105 HydrophobicContact CG2-CG1 4.1Å; F88-V105 HydrophobicContact CE2-CB 4.43Å; F88-V105 HydrophobicContact CE2-CG1 3.99Å; F88-V105 HydrophobicContact CE2-CG2 4.18Å; F88-V105 HydrophobicContact CZ-CB 4.45Å; F88-V105 HydrophobicContact CZ-CG1 3.86Å; N99-V105 WeakPolarHBondContact O-CG2 3.38Å; D102-V105 HydrophobicContact CB-CB 4.21Å; D102-V105 HydrophobicContact CB-CG2 3.69Å; D102-V105 WeakPolarHBondContact O-CB 3.42Å; D102-V105 PolarHBondContact O-N 3.1Å; K103-V105 VanDerWaalsContact C-N 3.27Å; K103-V105 PolarHBondContact O-N 3.09Å; V105-Y108 PolarHBondContact O-N 3.44Å; V105-I109 HydrophobicContact CG1-CD1 3.99Å; V105-I109 WeakPolarHBondContact O-CG1 3.46Å; V105-I109 PolarHBondContact O-N 2.86Å
106	Q	97.4	Very high	93.1	Very high	103 Å²	103	66.2 Å²	66.2	48%	0.481	33%	0.332	S	S	.	.	H	α-helix	trans	-62.2	-44.1	177.2	-62.6	177	2.1	0	0	112.1	P100 D102 K103 Y108 I109 K110	P100-Q106 WeakPolarHBondContact O-CG 3.41Å; P100-Q106 PolarHBondContact O-NE2 2.79Å; D102-Q106 PolarHBondContact O-N 3.31Å; K103-Q106 PolarHBondContact O-N 2.03Å; Q106-Y108 VanDerWaalsContact C-N 3.28Å; Q106-Y108 PolarHBondContact O-N 3.06Å; Q106-I109 PolarHBondContact O-N 3.24Å; Q106-K110 WeakPolarHBondContact O-CB 3.43Å; Q106-K110 PolarHBondContact O-N 2.94Å
107	D	96.4	Very high	93	Very high	69 Å²	69	68.3 Å²	68.3	37%	0.369	34%	0.341	S	S	.	.	H	α-helix	trans	-57.4	-43.6	175.2	-65.9	-24.4	0	0	0	110.7	K103 K110 D111	K103-D107 PolarHBondContact O-N 3.15Å; D107-K110 PolarHBondContact O-N 2.98Å; D107-D111 PolarHBondContact O-N 2.96Å
108	Y	96.5	Very high	92.7	Very high	22 Å²	22	70.1 Å²	70.1	9%	0.086	35%	0.347	C	S	.	.	H	α-helix	trans	-68.4	-40.5	180	-78.7	11.6	0	0	0	113.1	K65 I66 R68 I71 F88 W104 V105 Q106 K110 D111 M112	K65-Y108 WeakPolarHBondContact CE-OH 3.4Å; I66-Y108 VanDerWaalsContact O-CE2 3.25Å; I66-Y108 WeakPolarHBondContact O-CE2 3.21Å; I66-Y108 PolarHBondContact O-OH 2.98Å; R68-Y108 HydrophobicContact CB-CE1 3.98Å; R68-Y108 HydrophobicContact CB-CE2 4.09Å; R68-Y108 WeakPolarHBondContact CB-OH 3.37Å; R68-Y108 HydrophobicContact CG-CE1 4.26Å; R68-Y108 PolarHBondContact N-OH 3.31Å; R68-Y108 VanDerWaalsContact N-OH 3.16Å; I71-Y108 HydrophobicContact CD1-CD2 3.3Å; I71-Y108 HydrophobicContact CD1-CE2 3.45Å; I71-Y108 VanDerWaalsContact CD1-CE2 3.45Å; F88-Y108 HydrophobicContact CZ-CD2 4.33Å; W104-Y108 AromaticContact CE3-CD2 3.82Å; W104-Y108 HydrophobicContact CE3-CD2 3.82Å; W104-Y108 AromaticContact CE3-CE2 3.84Å; W104-Y108 HydrophobicContact CE3-CE2 3.84Å; W104-Y108 HydrophobicContact CE3-CG 4.38Å; W104-Y108 AromaticContact CZ3-CD2 3.86Å; W104-Y108 HydrophobicContact CZ3-CD2 3.86Å; W104-Y108 AromaticContact CZ3-CE2 3.91Å; W104-Y108 HydrophobicContact CZ3-CE2 3.91Å; W104-Y108 WeakPolarHBondContact O-CB 3.49Å; W104-Y108 WeakPolarHBondContact O-CD1 3.38Å; W104-Y108 VanDerWaalsContact O-CG 3.32Å; W104-Y108 PolarHBondContact O-N 3.14Å; W104-Y108 VanDerWaalsContact O-N 3.12Å; V105-Y108 PolarHBondContact O-N 3.44Å; Q106-Y108 VanDerWaalsContact C-N 3.28Å; Q106-Y108 PolarHBondContact O-N 3.06Å; Y108-K110 VanDerWaalsContact C-N 3.29Å; Y108-D111 PolarHBondContact O-N 3.28Å; Y108-M112 WeakPolarHBondContact O-CB 3.03Å; Y108-M112 WeakPolarHBondContact O-CE 3.08Å; Y108-M112 VanDerWaalsContact O-CG 3.3Å; Y108-M112 WeakPolarHBondContact O-CG 3.4Å; Y108-M112 PolarHBondContact O-N 2.9Å
109	I	95.8	Very high	92.4	Very high	26 Å²	26	74.2 Å²	74.2	13%	0.133	37%	0.368	C	S	.	.	H	α-helix	trans	-60.1	-45.2	174.4	-69.3	165.4	0	0	0	109.7	Y74 I86 V105 Q106 M112 K113	Y74-I109 HydrophobicContact CD2-CG1 4.04Å; Y74-I109 HydrophobicContact CE1-CG2 4.47Å; Y74-I109 HydrophobicContact CE2-CD1 4.49Å; Y74-I109 HydrophobicContact CE2-CG1 3.95Å; Y74-I109 HydrophobicContact CE2-CG2 3.97Å; Y74-I109 HydrophobicContact CG-CG1 4.49Å; I86-I109 HydrophobicContact CD1-CD1 3.93Å; I86-I109 HydrophobicContact CG1-CD1 3.89Å; I86-I109 HydrophobicContact CG2-CD1 4.08Å; I86-I109 HydrophobicContact CG2-CG1 4.45Å; V105-I109 HydrophobicContact CG1-CD1 3.99Å; V105-I109 WeakPolarHBondContact O-CG1 3.46Å; V105-I109 PolarHBondContact O-N 2.86Å; Q106-I109 PolarHBondContact O-N 3.24Å; I109-M112 PolarHBondContact O-N 3.45Å; I109-K113 HydrophobicContact CG2-CD 4.11Å; I109-K113 HydrophobicContact CG2-CG 4.42Å; I109-K113 WeakPolarHBondContact O-CG 3.22Å; I109-K113 PolarHBondContact O-N 3.47Å
110	K	95.7	Very high	92.1	Very high	116 Å²	116	76.3 Å²	76.3	50%	0.504	38%	0.377	S	S	.	.	H	α-helix	trans	-59.8	-52.1	177.5	-174.5	-178.4	175.3	-174.2	0	111.4	Q106 D107 Y108 M112 K113 E114	Q106-K110 WeakPolarHBondContact O-CB 3.43Å; Q106-K110 PolarHBondContact O-N 2.94Å; D107-K110 PolarHBondContact O-N 2.98Å; Y108-K110 VanDerWaalsContact C-N 3.29Å; K110-M112 PolarHBondContact O-N 3.01Å; K110-M112 VanDerWaalsContact O-N 3.16Å; K110-K113 PolarHBondContact O-N 3.49Å; K110-K113 VanDerWaalsContact O-N 3.1Å; K110-E114 WeakPolarHBondContact CE-OE1 3.4Å; K110-E114 HydrophobicContact CG-CG 4.33Å; K110-E114 IonicContact NZ-OE1 3.92Å; K110-E114 WeakPolarHBondContact O-CB 3.37Å; K110-E114 WeakPolarHBondContact O-CG 3.43Å; K110-E114 PolarHBondContact O-N 2.75Å
111	D	93.1	Very high	91.8	Very high	76 Å²	76	79.3 Å²	79.3	41%	0.406	39%	0.388	S	S	.	.	H	α-helix	trans	-57.6	-30.9	177.3	-79.5	9.3	0	0	0	113.1	D107 Y108 N115	D107-D111 PolarHBondContact O-N 2.96Å; Y108-D111 PolarHBondContact O-N 3.28Å; D111-N115 PolarHBondContact O-N 2.97Å; D111-N115 PolarHBondContact O-ND2 3.45Å
112	M	91.2	Very high	91.5	Very high	30 Å²	30	78.4 Å²	78.4	15%	0.148	37%	0.37	C	S	.	.	H	α-helix	trans	-81.1	-33.7	177.7	-75.1	-172.5	-65	0	0	113.4	I71 Y74 F88 Y108 I109 K110	I71-M112 HydrophobicContact CG2-CE 4.3Å; I71-M112 HydrophobicContact CG2-SD 3.86Å; Y74-M112 HydrophobicContact CD1-CB 4.26Å; Y74-M112 HydrophobicContact CD1-CE 3.15Å; Y74-M112 HydrophobicContact CD1-SD 3.85Å; Y74-M112 HydrophobicContact CE1-CB 3.96Å; Y74-M112 HydrophobicContact CE1-CE 3.84Å; Y74-M112 HydrophobicContact CG-CE 3.74Å; F88-M112 HydrophobicContact CD1-CE 3.96Å; F88-M112 HydrophobicContact CE1-CE 3.46Å; F88-M112 VanDerWaalsContact CE1-CE 3.46Å; Y108-M112 WeakPolarHBondContact O-CB 3.03Å; Y108-M112 WeakPolarHBondContact O-CE 3.08Å; Y108-M112 VanDerWaalsContact O-CG 3.3Å; Y108-M112 WeakPolarHBondContact O-CG 3.4Å; Y108-M112 PolarHBondContact O-N 2.9Å; I109-M112 PolarHBondContact O-N 3.45Å; K110-M112 PolarHBondContact O-N 3.01Å; K110-M112 VanDerWaalsContact O-N 3.16Å
113	K	89.3	Confident	91.1	Very high	148 Å²	148	80.4 Å²	80.4	64%	0.643	38%	0.377	S	S	*	.	H	α-helix	trans	-73.6	-33.6	175.4	-75	-177.1	178.3	-176.3	0	112.8	Y74 I109 K110	Y74-K113 WeakPolarHBondContact OH-CE 3.46Å; Y74-K113 WeakPolarHBondContact OH-CG 3.48Å; I109-K113 HydrophobicContact CG2-CD 4.11Å; I109-K113 HydrophobicContact CG2-CG 4.42Å; I109-K113 WeakPolarHBondContact O-CG 3.22Å; I109-K113 PolarHBondContact O-N 3.47Å; K110-K113 PolarHBondContact O-N 3.49Å; K110-K113 VanDerWaalsContact O-N 3.1Å
114	E	80.5	Confident	90.6	Very high	135 Å²	135	73.9 Å²	73.9	63%	0.631	35%	0.351	S	S	*	.	H	α-helix	trans	-86.7	-19.6	-174.7	-70.9	-179.2	170.4	0	0	114.1	K110	K110-E114 WeakPolarHBondContact CE-OE1 3.4Å; K110-E114 HydrophobicContact CG-CG 4.33Å; K110-E114 IonicContact NZ-OE1 3.92Å; K110-E114 WeakPolarHBondContact O-CB 3.37Å; K110-E114 WeakPolarHBondContact O-CG 3.43Å; K110-E114 PolarHBondContact O-N 2.75Å
115	N	57.3	Low	90	Very high	128 Å²	128	77.5 Å²	77.5	68%	0.684	37%	0.372	S	S	*	.			trans	-67	0	168.5	-94.5	-72.3	0	0	0	109.1	R2 D111	R2-N115 PolarHBondContact NE-O 3.05Å; R2-N115 VanDerWaalsContact NE-O 3.12Å; R2-N115 PolarHBondContact NH1-O 2.99Å; R2-N115 PolarHBondContact NH1-OXT 2.79Å; R2-N115 PolarHBondContact NH2-O 2.79Å; R2-N115 PolarHBondContact NH2-OXT 3.11Å; D111-N115 PolarHBondContact O-N 2.97Å; D111-N115 PolarHBondContact O-ND2 3.45Å

Retrieved 115 of 115 residues in 212.7 ms (Link to these results)

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