A0A087Y9W5_POEFO Loading...

Ninjurin 1

AlphaFold DB , UniProt , Accession A0A087Y9W5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 119 aa.

						>A0A087Y9W5_POEFO|A0A087Y9W5
PDAQPSGPPLLNMNHYANKKSAAESMLDLALLMANASQLKAVMEQGAKSSFYTPVVTLIAISLCLQVTIGILLIFTVRWNLDDEQKHWRLNLMENLATGLVFIIVVVNIFITALGVHQP
					

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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	P	49.9	Very low	52.6	Low	161 Å²	161	129.2 Å²	129.2	100%	1.045	80%	0.8	S	S	*	*				0	116	0	28.1	-7	0	0	0	110
2	D	45	Very low	52.9	Low	153 Å²	153	126 Å²	126	82%	0.818	77%	0.773	S	S	*	*			cis	-152.6	137.1	12.5	-69.1	-54.3	0	0	0	107.7	Q4	D2-Q4 PolarHBondContact O-N 3.38Å
3	A	63.9	Low	52.8	Low	110 Å²	110	128 Å²	128	91%	0.909	77%	0.772	S	S	*	*			trans	-66.7	123.6	167.4	0	0	0	0	0	108.4
4	Q	53	Low	52.9	Low	188 Å²	188	127.5 Å²	127.5	88%	0.879	76%	0.763	S	S	*	*			trans	-111.2	132.1	167.8	-162.3	166.1	-89	0	0	108.9	D2	D2-Q4 PolarHBondContact O-N 3.38Å
5	P	47.3	Very low	52.9	Low	112 Å²	112	126.7 Å²	126.7	73%	0.727	75%	0.748	S	S	*	*			trans	-78.2	138	-151.3	30.1	-32.9	0	0	0	110.9	G7	P5-G7 VanDerWaalsContact C-N 3.27Å; P5-G7 PolarHBondContact O-N 2.88Å
6	S	50.8	Low	52.8	Low	121 Å²	121	130.7 Å²	130.7	85%	0.846	75%	0.747	S	S	*	*			trans	-49.9	96.6	153.8	23.8	0	0	0	0	108
7	G	56.1	Low	52.8	Low	53 Å²	53	126.5 Å²	126.5	55%	0.546	73%	0.733	S	S	.	*	P	Polyproline II helix	trans	-49.1	142.7	166	0	0	0	0	0	108.2	P5	P5-G7 VanDerWaalsContact C-N 3.27Å; P5-G7 PolarHBondContact O-N 2.88Å
8	P	54.6	Low	52.9	Low	109 Å²	109	126.1 Å²	126.1	71%	0.708	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-49.8	132.1	-176.7	22.5	-31.7	0	0	0	107.1	L10	P8-L10 PolarHBondContact O-N 3.46Å
9	P	55.3	Low	52.9	Low	118 Å²	118	127.5 Å²	127.5	77%	0.766	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-51.6	117	175	10.4	-12.3	0	0	0	103.9	L11	P9-L11 WeakPolarHBondContact O-CA 3.29Å; P9-L11 PolarHBondContact O-N 2.82Å
10	L	49.9	Very low	53.1	Low	163 Å²	163	128 Å²	128	85%	0.853	72%	0.717	S	S	*	*			trans	-51.9	98.2	175.1	-69.1	173.1	0	0	0	103.2	P8 N12	P8-L10 PolarHBondContact O-N 3.46Å; L10-N12 VanDerWaalsContact O-CA 3.23Å; L10-N12 WeakPolarHBondContact O-CA 3.12Å; L10-N12 PolarHBondContact O-N 3.34Å
11	L	52.8	Low	53.2	Low	133 Å²	133	124 Å²	124	70%	0.696	70%	0.698	S	S	*	*			trans	-59.1	107.1	-171.4	-177.6	171.2	0	0	0	100.8	P9 M13	P9-L11 WeakPolarHBondContact O-CA 3.29Å; P9-L11 PolarHBondContact O-N 2.82Å; L11-M13 WeakPolarHBondContact O-CA 3.26Å; L11-M13 PolarHBondContact O-N 2.77Å
12	N	56.2	Low	53.6	Low	91 Å²	91	118.9 Å²	118.9	49%	0.487	67%	0.669	S	S	.	*			trans	-59.3	91.1	-156.4	-158.7	-30	0	0	0	105.3	L10 N14 H15	L10-N12 VanDerWaalsContact O-CA 3.23Å; L10-N12 WeakPolarHBondContact O-CA 3.12Å; L10-N12 PolarHBondContact O-N 3.34Å; N12-N14 PolarHBondContact O-N 3.1Å; N12-N14 VanDerWaalsContact O-N 3.11Å; N12-H15 WeakPolarHBondContact O-CB 3.36Å; N12-H15 PolarHBondContact O-N 3.45Å
13	M	51.9	Low	54.6	Low	152 Å²	152	114.6 Å²	114.6	75%	0.749	66%	0.655	S	S	*	*	H	α-helix	trans	-64.8	-24	-165.7	-161.5	93.2	75.1	0	0	108.6	L11 H15 Y16 A17	L11-M13 WeakPolarHBondContact O-CA 3.26Å; L11-M13 PolarHBondContact O-N 2.77Å; M13-H15 VanDerWaalsContact C-N 3.32Å; M13-H15 PolarHBondContact O-N 3.36Å; M13-Y16 PolarHBondContact O-N 3.01Å; M13-A17 PolarHBondContact O-N 3.48Å; M13-A17 VanDerWaalsContact O-N 3.11Å
14	N	53.8	Low	54.4	Low	121 Å²	121	113 Å²	113	65%	0.647	63%	0.629	S	S	*	*	H	α-helix	trans	-55.7	-35.6	166.1	-86.2	18.5	0	0	0	113.9	N12 Y16 N18	N12-N14 PolarHBondContact O-N 3.1Å; N12-N14 VanDerWaalsContact O-N 3.11Å; N14-Y16 VanDerWaalsContact C-N 3.32Å; N14-Y16 PolarHBondContact O-N 3.27Å; N14-N18 WeakPolarHBondContact O-CA 3.47Å; N14-N18 WeakPolarHBondContact O-CB 3.3Å; N14-N18 PolarHBondContact O-N 2.87Å
15	H	53.6	Low	54.8	Low	116 Å²	116	106.3 Å²	106.3	54%	0.537	60%	0.603	S	S	.	*	H	α-helix	trans	-69.8	-28.1	178.8	-90.5	107.4	0	0	0	113.3	N12 M13 K19	N12-H15 WeakPolarHBondContact O-CB 3.36Å; N12-H15 PolarHBondContact O-N 3.45Å; M13-H15 VanDerWaalsContact C-N 3.32Å; M13-H15 PolarHBondContact O-N 3.36Å; H15-K19 VanDerWaalsContact O-CB 3.27Å; H15-K19 WeakPolarHBondContact O-CB 3.5Å; H15-K19 WeakPolarHBondContact O-CG 3.34Å; H15-K19 PolarHBondContact O-N 3.47Å
16	Y	51.3	Low	55.9	Low	190 Å²	190	107.8 Å²	107.8	75%	0.745	60%	0.602	S	S	*	*	H	α-helix	trans	-83.7	-43.6	177.4	-130.4	-90.5	0	0	0	111.4	M13 N14 K19 K20	M13-Y16 PolarHBondContact O-N 3.01Å; N14-Y16 VanDerWaalsContact C-N 3.32Å; N14-Y16 PolarHBondContact O-N 3.27Å; Y16-K19 PolarHBondContact O-N 3.36Å; Y16-K20 WeakPolarHBondContact O-CB 3.45Å; Y16-K20 PolarHBondContact O-N 3.37Å
17	A	52.5	Low	56.9	Low	60 Å²	60	107 Å²	107	50%	0.496	59%	0.588	S	S	.	*	H	α-helix	trans	-62.6	-42.4	175	0	0	0	0	0	111.7	M13 K20 S21	M13-A17 PolarHBondContact O-N 3.48Å; M13-A17 VanDerWaalsContact O-N 3.11Å; A17-K20 PolarHBondContact O-N 3.25Å; A17-S21 WeakPolarHBondContact O-CB 3.33Å; A17-S21 PolarHBondContact O-N 3.18Å
18	N	54.1	Low	57.5	Low	119 Å²	119	106.7 Å²	106.7	64%	0.636	57%	0.574	S	S	*	*	H	α-helix	trans	-74.1	-33.1	-178.5	-154.5	42.6	0	0	0	112.2	N14 A22	N14-N18 WeakPolarHBondContact O-CA 3.47Å; N14-N18 WeakPolarHBondContact O-CB 3.3Å; N14-N18 PolarHBondContact O-N 2.87Å; N18-A22 WeakPolarHBondContact O-CB 3.43Å; N18-A22 PolarHBondContact O-N 3.08Å
19	K	53.9	Low	58.2	Low	153 Å²	153	106.8 Å²	106.8	67%	0.665	57%	0.568	S	S	*	*	H	α-helix	trans	-70.1	-36.5	171.8	-79.2	-174.6	172.6	-165.9	0	112.6	H15 Y16 A23	H15-K19 VanDerWaalsContact O-CB 3.27Å; H15-K19 WeakPolarHBondContact O-CB 3.5Å; H15-K19 WeakPolarHBondContact O-CG 3.34Å; H15-K19 PolarHBondContact O-N 3.47Å; Y16-K19 PolarHBondContact O-N 3.36Å; K19-A23 WeakPolarHBondContact O-CB 3.45Å; K19-A23 PolarHBondContact O-N 2.84Å
20	K	56.8	Low	59.1	Low	136 Å²	136	104 Å²	104	59%	0.591	55%	0.554	S	S	*	*	H	α-helix	trans	-65.7	-50.1	175.5	-169.6	-179	177.1	-159.4	0	110.8	Y16 A17 A22 A23 E24	Y16-K20 WeakPolarHBondContact O-CB 3.45Å; Y16-K20 PolarHBondContact O-N 3.37Å; A17-K20 PolarHBondContact O-N 3.25Å; K20-A22 VanDerWaalsContact C-N 3.32Å; K20-A22 PolarHBondContact O-N 2.96Å; K20-A23 PolarHBondContact O-N 2.85Å; K20-E24 WeakPolarHBondContact O-CB 3.32Å; K20-E24 PolarHBondContact O-N 3.09Å
21	S	55.3	Low	59.7	Low	45 Å²	45	99.6 Å²	99.6	32%	0.315	53%	0.531	S	S	.	.	H	α-helix	trans	-63.1	-36	177	-174	0	0	0	0	112.7	A17 E24 S25	A17-S21 WeakPolarHBondContact O-CB 3.33Å; A17-S21 PolarHBondContact O-N 3.18Å; S21-E24 PolarHBondContact O-N 3.49Å; S21-S25 WeakPolarHBondContact O-CB 3.31Å; S21-S25 PolarHBondContact O-N 3.41Å; S21-S25 PolarHBondContact O-OG 3.47Å
22	A	58.4	Low	60.3	Low	53 Å²	53	95.9 Å²	95.9	44%	0.438	51%	0.512	S	S	.	.	H	α-helix	trans	-65.5	-42.2	173.4	0	0	0	0	0	112.7	N18 K20 S25 M26	N18-A22 WeakPolarHBondContact O-CB 3.43Å; N18-A22 PolarHBondContact O-N 3.08Å; K20-A22 VanDerWaalsContact C-N 3.32Å; K20-A22 PolarHBondContact O-N 2.96Å; A22-S25 WeakPolarHBondContact CA-OG 3.29Å; A22-S25 PolarHBondContact O-OG 3.1Å; A22-M26 VanDerWaalsContact O-CB 3.23Å; A22-M26 WeakPolarHBondContact O-CB 3.18Å; A22-M26 PolarHBondContact O-N 3.39Å
23	A	65.7	Low	61	Low	63 Å²	63	98 Å²	98	52%	0.521	52%	0.52	S	S	.	.	H	α-helix	trans	-68.2	-39.3	176.6	0	0	0	0	0	112.1	K19 K20 M26 L27	K19-A23 WeakPolarHBondContact O-CB 3.45Å; K19-A23 PolarHBondContact O-N 2.84Å; K20-A23 PolarHBondContact O-N 2.85Å; A23-M26 PolarHBondContact O-N 3.49Å; A23-L27 PolarHBondContact O-N 3.25Å
24	E	58.4	Low	61.8	Low	77 Å²	77	93 Å²	93	36%	0.36	50%	0.504	S	S	.	.	H	α-helix	trans	-64.9	-47.5	177.8	-154.9	164	142	0	0	110.9	K20 S21 M26 L27 D28	K20-E24 WeakPolarHBondContact O-CB 3.32Å; K20-E24 PolarHBondContact O-N 3.09Å; S21-E24 PolarHBondContact O-N 3.49Å; E24-M26 PolarHBondContact O-N 3Å; E24-L27 PolarHBondContact O-N 3.45Å; E24-D28 PolarHBondContact O-N 3.22Å
25	S	61.7	Low	62.4	Low	48 Å²	48	87.8 Å²	87.8	34%	0.336	48%	0.476	S	S	.	.	H	α-helix	trans	-65.9	-34.1	174.8	60.1	0	0	0	0	113.6	S21 A22 D28 L29	S21-S25 WeakPolarHBondContact O-CB 3.31Å; S21-S25 PolarHBondContact O-N 3.41Å; S21-S25 PolarHBondContact O-OG 3.47Å; A22-S25 WeakPolarHBondContact CA-OG 3.29Å; A22-S25 PolarHBondContact O-OG 3.1Å; S25-D28 PolarHBondContact O-N 2.9Å; S25-L29 WeakPolarHBondContact O-CB 3.46Å; S25-L29 WeakPolarHBondContact O-CD1 3.42Å; S25-L29 PolarHBondContact O-N 3.34Å
26	M	71.4	Confident	62.6	Low	143 Å²	143	84 Å²	84	70%	0.704	46%	0.464	S	S	*	.	H	α-helix	trans	-66.7	-38	176.3	-175	177.9	-178.6	0	0	111.9	A22 A23 E24 A30	A22-M26 VanDerWaalsContact O-CB 3.23Å; A22-M26 WeakPolarHBondContact O-CB 3.18Å; A22-M26 PolarHBondContact O-N 3.39Å; A23-M26 PolarHBondContact O-N 3.49Å; E24-M26 PolarHBondContact O-N 3Å; M26-A30 WeakPolarHBondContact O-CB 3.25Å; M26-A30 PolarHBondContact O-N 3.01Å
27	L	70.4	Confident	63.3	Low	105 Å²	105	78.6 Å²	78.6	55%	0.55	45%	0.454	S	S	.	.	H	α-helix	trans	-65.8	-43.1	176.4	-176.5	132.5	0	0	0	111.4	A23 E24 A30 L31	A23-L27 PolarHBondContact O-N 3.25Å; E24-L27 PolarHBondContact O-N 3.45Å; L27-A30 PolarHBondContact O-N 3.33Å; L27-L31 HydrophobicContact CD2-CD1 3.85Å; L27-L31 HydrophobicContact CG-CD1 4.41Å; L27-L31 WeakPolarHBondContact O-CG 3.31Å; L27-L31 PolarHBondContact O-N 2.9Å
28	D	70.4	Confident	63.5	Low	46 Å²	46	80 Å²	80	25%	0.246	45%	0.451	C	S	.	.	H	α-helix	trans	-64.4	-42.2	176.5	-87	-2.6	0	0	0	112.5	E24 S25 L31 L32	E24-D28 PolarHBondContact O-N 3.22Å; S25-D28 PolarHBondContact O-N 2.9Å; D28-L31 PolarHBondContact O-N 3.41Å; D28-L32 WeakPolarHBondContact O-CB 3.34Å; D28-L32 PolarHBondContact O-N 2.92Å
29	L	68.8	Low	63.8	Low	111 Å²	111	76 Å²	76	58%	0.581	43%	0.429	S	S	*	.	H	α-helix	trans	-65.2	-40.1	175.7	-101.9	133.2	0	0	0	112.5	S25 L31 L32 M33	S25-L29 WeakPolarHBondContact O-CB 3.46Å; S25-L29 WeakPolarHBondContact O-CD1 3.42Å; S25-L29 PolarHBondContact O-N 3.34Å; L29-L31 VanDerWaalsContact C-N 3.34Å; L29-L32 PolarHBondContact O-N 2.94Å; L29-M33 WeakPolarHBondContact O-CB 3.48Å; L29-M33 PolarHBondContact O-N 3.44Å
30	A	73.3	Confident	64.2	Low	58 Å²	58	74.5 Å²	74.5	48%	0.479	42%	0.422	S	S	.	.	H	α-helix	trans	-63.5	-41.6	177.2	0	0	0	0	0	111.4	M26 L27 M33 A34	M26-A30 WeakPolarHBondContact O-CB 3.25Å; M26-A30 PolarHBondContact O-N 3.01Å; L27-A30 PolarHBondContact O-N 3.33Å; A30-M33 PolarHBondContact O-N 3.03Å; A30-A34 WeakPolarHBondContact O-CB 3.3Å; A30-A34 PolarHBondContact O-N 3.41Å
31	L	63.7	Low	64.5	Low	71 Å²	71	70.7 Å²	70.7	37%	0.372	42%	0.416	S	S	.	.	H	α-helix	trans	-67.1	-40.6	175	-75.7	168	0	0	0	112.2	L27 D28 L29 M33 A34 N35	L27-L31 HydrophobicContact CD2-CD1 3.85Å; L27-L31 HydrophobicContact CG-CD1 4.41Å; L27-L31 WeakPolarHBondContact O-CG 3.31Å; L27-L31 PolarHBondContact O-N 2.9Å; D28-L31 PolarHBondContact O-N 3.41Å; L29-L31 VanDerWaalsContact C-N 3.34Å; L31-M33 VanDerWaalsContact C-N 3.35Å; L31-A34 PolarHBondContact O-N 3.4Å; L31-N35 WeakPolarHBondContact O-CB 3.2Å; L31-N35 PolarHBondContact O-N 2.91Å; L31-N35 PolarHBondContact O-ND2 3.42Å
32	L	65.1	Low	64.5	Low	55 Å²	55	70.1 Å²	70.1	29%	0.288	41%	0.411	S	S	.	.	H	α-helix	trans	-60.4	-44.7	173.3	-179.5	148.9	0	0	0	111.4	D28 L29 N35 A36 Q66	D28-L32 WeakPolarHBondContact O-CB 3.34Å; D28-L32 PolarHBondContact O-N 2.92Å; L29-L32 PolarHBondContact O-N 2.94Å; L32-N35 PolarHBondContact O-N 3.41Å; L32-A36 WeakPolarHBondContact O-CB 3.38Å; L32-A36 PolarHBondContact O-N 3.32Å; L32-Q66 HydrophobicContact CD1-CB 3.93Å
33	M	71.4	Confident	64.3	Low	136 Å²	136	73.2 Å²	73.2	67%	0.67	42%	0.418	S	S	*	.	H	α-helix	trans	-66.2	-40.4	178.8	-172.3	178.5	-75.6	0	0	111.8	L29 A30 L31 A36 S37	L29-M33 WeakPolarHBondContact O-CB 3.48Å; L29-M33 PolarHBondContact O-N 3.44Å; A30-M33 PolarHBondContact O-N 3.03Å; L31-M33 VanDerWaalsContact C-N 3.35Å; M33-A36 PolarHBondContact O-N 2.93Å; M33-S37 WeakPolarHBondContact O-CB 3.4Å; M33-S37 PolarHBondContact O-N 3.36Å
34	A	67.4	Low	64	Low	48 Å²	48	77 Å²	77	40%	0.397	43%	0.425	S	S	.	.	H	α-helix	trans	-63.7	-41.9	175	0	0	0	0	0	112	A30 L31 S37 Q38	A30-A34 WeakPolarHBondContact O-CB 3.3Å; A30-A34 PolarHBondContact O-N 3.41Å; L31-A34 PolarHBondContact O-N 3.4Å; A34-S37 PolarHBondContact O-N 2.99Å; A34-Q38 PolarHBondContact O-N 3.4Å
35	N	65.9	Low	63.7	Low	11 Å²	11	80.9 Å²	80.9	6%	0.059	44%	0.442	C	S	.	.	H	α-helix	trans	-66.4	-40.5	175.7	-70.6	-18.4	0	0	0	111.8	L31 L32 Q38 L39 Q66	L31-N35 WeakPolarHBondContact O-CB 3.2Å; L31-N35 PolarHBondContact O-N 2.91Å; L31-N35 PolarHBondContact O-ND2 3.42Å; L32-N35 PolarHBondContact O-N 3.41Å; N35-Q38 PolarHBondContact O-N 3.33Å; N35-L39 PolarHBondContact O-N 3.33Å; N35-Q66 PolarHBondContact ND2-NE2 3.03Å; N35-Q66 VanDerWaalsContact ND2-NE2 3.13Å; N35-Q66 PolarHBondContact ND2-OE1 3Å
36	A	59	Low	63.3	Low	37 Å²	37	80.7 Å²	80.7	31%	0.306	45%	0.448	S	S	.	.	H	α-helix	trans	-65.6	-37.2	175.5	0	0	0	0	0	112.3	L32 M33 L39 K40 L63	L32-A36 WeakPolarHBondContact O-CB 3.38Å; L32-A36 PolarHBondContact O-N 3.32Å; M33-A36 PolarHBondContact O-N 2.93Å; A36-L39 WeakPolarHBondContact O-CB 3.19Å; A36-L39 PolarHBondContact O-N 2.89Å; A36-K40 WeakPolarHBondContact O-CB 3.43Å; A36-K40 PolarHBondContact O-N 2.95Å; A36-L63 HydrophobicContact CB-CD1 4.27Å
37	S	65	Low	62.2	Low	76 Å²	76	78.4 Å²	78.4	53%	0.531	45%	0.452	S	S	.	.	H	α-helix	trans	-68.4	-39.8	175	-170.3	0	0	0	0	111.8	M33 A34 K40 A41	M33-S37 WeakPolarHBondContact O-CB 3.4Å; M33-S37 PolarHBondContact O-N 3.36Å; A34-S37 PolarHBondContact O-N 2.99Å; S37-K40 PolarHBondContact O-N 2.81Å; S37-A41 WeakPolarHBondContact O-CB 3.16Å; S37-A41 PolarHBondContact O-N 3.35Å
38	Q	57	Low	61.4	Low	90 Å²	90	82.5 Å²	82.5	42%	0.421	47%	0.465	S	S	.	.	H	α-helix	trans	-63.6	-42	172.8	-78	-176.3	92.5	0	0	111.4	A34 N35 K40 A41 V42	A34-Q38 PolarHBondContact O-N 3.4Å; N35-Q38 PolarHBondContact O-N 3.33Å; Q38-K40 VanDerWaalsContact C-N 3.31Å; Q38-K40 PolarHBondContact O-N 2.79Å; Q38-A41 PolarHBondContact O-N 3.49Å; Q38-V42 WeakPolarHBondContact O-CB 3.48Å; Q38-V42 VanDerWaalsContact O-CG2 3.3Å; Q38-V42 WeakPolarHBondContact O-CG2 3.29Å; Q38-V42 PolarHBondContact O-N 3.07Å
39	L	60.8	Low	60.3	Low	33 Å²	33	84.7 Å²	84.7	17%	0.173	48%	0.484	C	S	.	.	H	α-helix	trans	-56.1	-48.4	172.8	-176.4	55.1	0	0	0	111	N35 A36 A41 V42 M43 I59	N35-L39 PolarHBondContact O-N 3.33Å; A36-L39 WeakPolarHBondContact O-CB 3.19Å; A36-L39 PolarHBondContact O-N 2.89Å; L39-A41 PolarHBondContact O-N 3.31Å; L39-V42 PolarHBondContact O-N 3.43Å; L39-M43 WeakPolarHBondContact O-CB 3.19Å; L39-M43 PolarHBondContact O-N 2.93Å; L39-I59 HydrophobicContact CB-CG2 3.63Å; L39-I59 HydrophobicContact CD1-CB 3.92Å; L39-I59 HydrophobicContact CD1-CD1 4.09Å; L39-I59 HydrophobicContact CD1-CG2 3.76Å; L39-I59 HydrophobicContact CD2-CG2 4.06Å; L39-I59 HydrophobicContact CG-CG2 3.99Å
40	K	62.3	Low	59.6	Low	123 Å²	123	84.8 Å²	84.8	54%	0.535	49%	0.494	S	S	.	.	H	α-helix	trans	-62.1	-44.3	-178.5	-168.7	-170.5	177.7	-146.9	0	111.2	A36 S37 Q38 M43 E44	A36-K40 WeakPolarHBondContact O-CB 3.43Å; A36-K40 PolarHBondContact O-N 2.95Å; S37-K40 PolarHBondContact O-N 2.81Å; Q38-K40 VanDerWaalsContact C-N 3.31Å; Q38-K40 PolarHBondContact O-N 2.79Å; K40-M43 PolarHBondContact O-N 3.34Å; K40-E44 WeakPolarHBondContact CE-OE2 3.45Å; K40-E44 IonicContact NZ-OE2 3.43Å; K40-E44 PolarHBondContact NZ-OE2 3.2Å; K40-E44 WeakPolarHBondContact O-CB 3.16Å; K40-E44 PolarHBondContact O-N 2.92Å
41	A	63.2	Low	58.6	Low	56 Å²	56	87.4 Å²	87.4	46%	0.463	50%	0.495	S	S	.	.	H	α-helix	trans	-63.5	-41.8	177.3	0	0	0	0	0	112.4	S37 Q38 L39 M43 Q45	S37-A41 WeakPolarHBondContact O-CB 3.16Å; S37-A41 PolarHBondContact O-N 3.35Å; Q38-A41 PolarHBondContact O-N 3.49Å; L39-A41 PolarHBondContact O-N 3.31Å; A41-M43 VanDerWaalsContact C-N 3.32Å; A41-Q45 PolarHBondContact O-N 2.86Å
42	V	54.3	Low	58.2	Low	32 Å²	32	87.5 Å²	87.5	19%	0.194	49%	0.491	C	S	.	.	H	α-helix	trans	-64.9	-38.8	173.8	170.6	0	0	0	0	110.8	Q38 L39 Q45 Y52 V55 V56	Q38-V42 WeakPolarHBondContact O-CB 3.48Å; Q38-V42 VanDerWaalsContact O-CG2 3.3Å; Q38-V42 WeakPolarHBondContact O-CG2 3.29Å; Q38-V42 PolarHBondContact O-N 3.07Å; L39-V42 PolarHBondContact O-N 3.43Å; V42-Q45 PolarHBondContact O-N 2.83Å; V42-Y52 WeakPolarHBondContact O-CE2 3.19Å; V42-Y52 PolarHBondContact O-OH 3.22Å; V42-Y52 VanDerWaalsContact O-OH 3.07Å; V42-V55 HydrophobicContact CG1-CG1 3.96Å; V42-V55 HydrophobicContact CG2-CG1 4.33Å; V42-V56 HydrophobicContact CG1-CG2 4.22Å
43	M	55.7	Low	57.6	Low	119 Å²	119	89.8 Å²	89.8	59%	0.586	51%	0.507	S	S	*	.	H	α-helix	trans	-73.4	-32.7	-179.1	-161.2	172.6	68.4	0	0	112.9	L39 K40 A41 Q45 Y52	L39-M43 WeakPolarHBondContact O-CB 3.19Å; L39-M43 PolarHBondContact O-N 2.93Å; K40-M43 PolarHBondContact O-N 3.34Å; A41-M43 VanDerWaalsContact C-N 3.32Å; M43-Q45 VanDerWaalsContact C-N 3.3Å; M43-Y52 VanDerWaalsContact C-OH 3.27Å; M43-Y52 WeakPolarHBondContact CA-OH 3.25Å; M43-Y52 PolarHBondContact O-OH 3.43Å
44	E	58	Low	56.7	Low	143 Å²	143	86.1 Å²	86.1	67%	0.668	49%	0.493	S	S	*	.	H	α-helix	trans	-70.9	-25.3	171.8	-91.3	178.7	83.9	0	0	112.1	K40 G46	K40-E44 WeakPolarHBondContact CE-OE2 3.45Å; K40-E44 IonicContact NZ-OE2 3.43Å; K40-E44 PolarHBondContact NZ-OE2 3.2Å; K40-E44 WeakPolarHBondContact O-CB 3.16Å; K40-E44 PolarHBondContact O-N 2.92Å; E44-G46 PolarHBondContact O-N 2.93Å; E44-G46 VanDerWaalsContact O-N 3.1Å
45	Q	53.4	Low	56.2	Low	157 Å²	157	84.8 Å²	84.8	73%	0.734	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	14	175.2	-95.8	176.8	2.5	0	0	114.7	A41 V42 M43 A47	A41-Q45 PolarHBondContact O-N 2.86Å; V42-Q45 PolarHBondContact O-N 2.83Å; M43-Q45 VanDerWaalsContact C-N 3.3Å; Q45-A47 PolarHBondContact O-N 3.42Å
46	G	52.1	Low	56.1	Low	44 Å²	44	86.2 Å²	86.2	45%	0.454	49%	0.489	S	S	.	.			trans	-24.2	126.1	-178.3	0	0	0	0	0	117.7	E44 Y52	E44-G46 PolarHBondContact O-N 2.93Å; E44-G46 VanDerWaalsContact O-N 3.1Å; G46-Y52 VanDerWaalsContact CA-OH 3.29Å; G46-Y52 WeakPolarHBondContact CA-OH 3.45Å; G46-Y52 PolarHBondContact N-OH 3.27Å
47	A	49.8	Very low	56.2	Low	95 Å²	95	87.9 Å²	87.9	79%	0.785	50%	0.496	S	S	*	.	S	Bend	trans	62.4	52.9	154.5	0	0	0	0	0	118	Q45	Q45-A47 PolarHBondContact O-N 3.42Å
48	K	52.1	Low	56.2	Low	192 Å²	192	86.8 Å²	86.8	84%	0.835	48%	0.484	S	S	*	.	S	Bend	trans	-138.7	98.4	154.4	-119.8	174.8	170.9	178.5	0	109.5
49	S	47.1	Very low	56.6	Low	91 Å²	91	83 Å²	83	64%	0.636	47%	0.467	S	S	*	.	S	Bend	trans	102.7	146	166.7	-48.4	0	0	0	0	118.2	F51	S49-F51 PolarHBondContact O-N 3.48Å
50	S	54.2	Low	57	Low	113 Å²	113	83.6 Å²	83.6	79%	0.79	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	3.2	-163.8	-162	0	0	0	0	118.5
51	F	53.7	Low	57.3	Low	114 Å²	114	81.9 Å²	81.9	50%	0.5	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	0.9	-174.4	-78.5	-85.8	0	0	0	114.5	S49 P54 V55	S49-F51 PolarHBondContact O-N 3.48Å; F51-P54 WeakPolarHBondContact O-CD 3.14Å; F51-V55 VanDerWaalsContact O-CG2 3.3Å; F51-V55 WeakPolarHBondContact O-CG2 3.3Å
52	Y	54.7	Low	57.5	Low	72 Å²	72	79.2 Å²	79.2	28%	0.282	45%	0.45	S	S	.	.	H	α-helix	trans	-65.8	-40.5	-177.4	-148.1	-96	0	0	0	113.3	V42 M43 G46 V56	V42-Y52 WeakPolarHBondContact O-CE2 3.19Å; V42-Y52 PolarHBondContact O-OH 3.22Å; V42-Y52 VanDerWaalsContact O-OH 3.07Å; M43-Y52 VanDerWaalsContact C-OH 3.27Å; M43-Y52 WeakPolarHBondContact CA-OH 3.25Å; M43-Y52 PolarHBondContact O-OH 3.43Å; G46-Y52 VanDerWaalsContact CA-OH 3.29Å; G46-Y52 WeakPolarHBondContact CA-OH 3.45Å; G46-Y52 PolarHBondContact N-OH 3.27Å; Y52-V56 HydrophobicContact CD1-CG2 3.76Å; Y52-V56 HydrophobicContact CE1-CG2 3.82Å; Y52-V56 HydrophobicContact CG-CG2 4.48Å; Y52-V56 VanDerWaalsContact O-CB 3.31Å; Y52-V56 WeakPolarHBondContact O-CB 3.35Å; Y52-V56 WeakPolarHBondContact O-CG2 3.38Å; Y52-V56 PolarHBondContact O-N 3.44Å
53	T	52.1	Low	58.1	Low	103 Å²	103	80.2 Å²	80.2	63%	0.632	45%	0.454	S	S	*	.	H	α-helix	trans	-65.6	-53.1	-175.2	-48.4	0	0	0	0	113.1	V55 T57	T53-V55 PolarHBondContact O-N 3.4Å; T53-T57 WeakPolarHBondContact O-CB 3.49Å; T53-T57 PolarHBondContact O-N 3.43Å; T53-T57 PolarHBondContact O-OG1 3.49Å
54	P	52.9	Low	58.8	Low	59 Å²	59	78.4 Å²	78.4	38%	0.383	45%	0.452	S	S	.	.	H	α-helix	trans	-63.9	-39.8	179.6	21.3	-30.6	0	0	0	112.6	F51 T57 L58	F51-P54 WeakPolarHBondContact O-CD 3.14Å; P54-T57 PolarHBondContact O-N 3.02Å; P54-L58 VanDerWaalsContact O-CB 3.3Å; P54-L58 WeakPolarHBondContact O-CB 3.28Å; P54-L58 WeakPolarHBondContact O-CD1 3.17Å; P54-L58 WeakPolarHBondContact O-CG 3.36Å; P54-L58 PolarHBondContact O-N 2.86Å
55	V	57.5	Low	59.1	Low	20 Å²	20	74.5 Å²	74.5	12%	0.121	44%	0.436	C	S	.	.	H	α-helix	trans	-65.5	-47	-179.7	177.3	0	0	0	0	111.8	V42 F51 T53 T57 L58 I59 I111	V42-V55 HydrophobicContact CG1-CG1 3.96Å; V42-V55 HydrophobicContact CG2-CG1 4.33Å; F51-V55 VanDerWaalsContact O-CG2 3.3Å; F51-V55 WeakPolarHBondContact O-CG2 3.3Å; T53-V55 PolarHBondContact O-N 3.4Å; V55-T57 VanDerWaalsContact C-N 3.34Å; V55-T57 PolarHBondContact O-N 2.84Å; V55-L58 PolarHBondContact O-N 2.89Å; V55-I59 HydrophobicContact CG1-CD1 3.8Å; V55-I59 VanDerWaalsContact O-CG1 3.25Å; V55-I59 WeakPolarHBondContact O-CG1 3.27Å; V55-I59 PolarHBondContact O-N 3.46Å; V55-I111 HydrophobicContact CG2-CG2 3.54Å
56	V	62.4	Low	59.5	Low	41 Å²	41	67.9 Å²	67.9	25%	0.248	41%	0.405	C	S	.	.	H	α-helix	trans	-65.5	-39.5	178.1	171.5	0	0	0	0	111	V42 Y52 I59 A60	V42-V56 HydrophobicContact CG1-CG2 4.22Å; Y52-V56 HydrophobicContact CD1-CG2 3.76Å; Y52-V56 HydrophobicContact CE1-CG2 3.82Å; Y52-V56 HydrophobicContact CG-CG2 4.48Å; Y52-V56 VanDerWaalsContact O-CB 3.31Å; Y52-V56 WeakPolarHBondContact O-CB 3.35Å; Y52-V56 WeakPolarHBondContact O-CG2 3.38Å; Y52-V56 PolarHBondContact O-N 3.44Å; V56-I59 PolarHBondContact O-N 3.36Å; V56-A60 VanDerWaalsContact O-CB 3.28Å; V56-A60 WeakPolarHBondContact O-CB 3.39Å; V56-A60 PolarHBondContact O-N 3.13Å
57	T	60.9	Low	60.4	Low	72 Å²	72	69.4 Å²	69.4	44%	0.442	41%	0.405	S	S	.	.	H	α-helix	trans	-65.5	-42.8	175.7	-59.5	0	0	0	0	112	T53 P54 V55 I59 A60 I61	T53-T57 WeakPolarHBondContact O-CB 3.49Å; T53-T57 PolarHBondContact O-N 3.43Å; T53-T57 PolarHBondContact O-OG1 3.49Å; P54-T57 PolarHBondContact O-N 3.02Å; V55-T57 VanDerWaalsContact C-N 3.34Å; V55-T57 PolarHBondContact O-N 2.84Å; T57-I59 PolarHBondContact O-N 3.05Å; T57-A60 PolarHBondContact O-N 3.34Å; T57-I61 HydrophobicContact CG2-CD1 3.82Å; T57-I61 HydrophobicContact CG2-CG1 4.47Å; T57-I61 WeakPolarHBondContact O-CB 3.23Å; T57-I61 WeakPolarHBondContact O-CD1 3.5Å; T57-I61 WeakPolarHBondContact O-CG1 3.42Å; T57-I61 PolarHBondContact O-N 2.88Å
58	L	65.4	Low	61.5	Low	53 Å²	53	68.5 Å²	68.5	28%	0.277	39%	0.39	S	S	.	.	H	α-helix	trans	-62.9	-39.7	177.7	-76.7	156.4	0	0	0	112.2	P54 V55 S62 N108	P54-L58 VanDerWaalsContact O-CB 3.3Å; P54-L58 WeakPolarHBondContact O-CB 3.28Å; P54-L58 WeakPolarHBondContact O-CD1 3.17Å; P54-L58 WeakPolarHBondContact O-CG 3.36Å; P54-L58 PolarHBondContact O-N 2.86Å; V55-L58 PolarHBondContact O-N 2.89Å; L58-S62 WeakPolarHBondContact O-CB 3.43Å; L58-S62 PolarHBondContact O-N 3.18Å; L58-N108 WeakPolarHBondContact CB-OD1 3.28Å
59	I	66.3	Low	62.2	Low	12 Å²	12	60.8 Å²	60.8	6%	0.062	36%	0.357	C	S	.	.	H	α-helix	trans	-74.7	-38.1	177.5	-59	163.7	0	0	0	111.7	L39 V55 V56 T57 I61 S62 L63	L39-I59 HydrophobicContact CB-CG2 3.63Å; L39-I59 HydrophobicContact CD1-CB 3.92Å; L39-I59 HydrophobicContact CD1-CD1 4.09Å; L39-I59 HydrophobicContact CD1-CG2 3.76Å; L39-I59 HydrophobicContact CD2-CG2 4.06Å; L39-I59 HydrophobicContact CG-CG2 3.99Å; V55-I59 HydrophobicContact CG1-CD1 3.8Å; V55-I59 VanDerWaalsContact O-CG1 3.25Å; V55-I59 WeakPolarHBondContact O-CG1 3.27Å; V55-I59 PolarHBondContact O-N 3.46Å; V56-I59 PolarHBondContact O-N 3.36Å; T57-I59 PolarHBondContact O-N 3.05Å; I59-I61 VanDerWaalsContact C-N 3.34Å; I59-I61 PolarHBondContact O-N 3.3Å; I59-S62 WeakPolarHBondContact O-CB 3.39Å; I59-S62 PolarHBondContact O-N 3.43Å; I59-L63 PolarHBondContact O-N 3.46Å
60	A	69.3	Low	63.2	Low	45 Å²	45	57.8 Å²	57.8	37%	0.372	34%	0.341	S	S	.	.	H	α-helix	trans	-61.6	-42.2	174.4	0	0	0	0	0	111.8	V56 T57 S62 L63 C64	V56-A60 VanDerWaalsContact O-CB 3.28Å; V56-A60 WeakPolarHBondContact O-CB 3.39Å; V56-A60 PolarHBondContact O-N 3.13Å; T57-A60 PolarHBondContact O-N 3.34Å; A60-S62 VanDerWaalsContact C-N 3.35Å; A60-L63 PolarHBondContact O-N 3.48Å; A60-C64 WeakPolarHBondContact O-CB 3.42Å; A60-C64 PolarHBondContact O-N 3.38Å; A60-C64 PolarHBondContact O-SG 2.86Å
61	I	67.7	Low	64.1	Low	86 Å²	86	57.3 Å²	57.3	44%	0.441	33%	0.328	S	S	.	.	H	α-helix	trans	-62.3	-43.5	173.6	-68.7	167.8	0	0	0	110.1	T57 I59 L63 C64 L65	T57-I61 HydrophobicContact CG2-CD1 3.82Å; T57-I61 HydrophobicContact CG2-CG1 4.47Å; T57-I61 WeakPolarHBondContact O-CB 3.23Å; T57-I61 WeakPolarHBondContact O-CD1 3.5Å; T57-I61 WeakPolarHBondContact O-CG1 3.42Å; T57-I61 PolarHBondContact O-N 2.88Å; I59-I61 VanDerWaalsContact C-N 3.34Å; I59-I61 PolarHBondContact O-N 3.3Å; I61-L63 PolarHBondContact O-N 3.03Å; I61-C64 PolarHBondContact O-N 2.92Å; I61-L65 HydrophobicContact CG2-CD1 3.86Å; I61-L65 WeakPolarHBondContact O-CB 3.41Å; I61-L65 VanDerWaalsContact O-CD1 3.23Å; I61-L65 WeakPolarHBondContact O-CD1 3.11Å; I61-L65 PolarHBondContact O-N 3.47Å
62	S	66.9	Low	64.7	Low	1 Å²	1	56.1 Å²	56.1	1%	0.007	33%	0.327	C	S	.	.	H	α-helix	trans	-59.8	-42.9	175.3	-170.8	0	0	0	0	112.6	L58 I59 A60 L65 Q66	L58-S62 WeakPolarHBondContact O-CB 3.43Å; L58-S62 PolarHBondContact O-N 3.18Å; I59-S62 WeakPolarHBondContact O-CB 3.39Å; I59-S62 PolarHBondContact O-N 3.43Å; A60-S62 VanDerWaalsContact C-N 3.35Å; S62-L65 PolarHBondContact O-N 3.19Å; S62-Q66 WeakPolarHBondContact O-CB 3.35Å; S62-Q66 VanDerWaalsContact O-CG 3.27Å; S62-Q66 WeakPolarHBondContact O-CG 3.5Å; S62-Q66 PolarHBondContact O-N 3.36Å
63	L	67.4	Low	65.2	Low	53 Å²	53	53.9 Å²	53.9	28%	0.277	32%	0.32	S	S	.	.	H	α-helix	trans	-66.6	-43	179.3	-136	86.2	0	0	0	111.2	A36 I59 A60 I61 Q66 V67	A36-L63 HydrophobicContact CB-CD1 4.27Å; I59-L63 PolarHBondContact O-N 3.46Å; A60-L63 PolarHBondContact O-N 3.48Å; I61-L63 PolarHBondContact O-N 3.03Å; L63-Q66 PolarHBondContact O-N 2.95Å; L63-V67 VanDerWaalsContact O-CG2 3.29Å; L63-V67 WeakPolarHBondContact O-CG2 3.34Å; L63-V67 PolarHBondContact O-N 3.07Å
64	C	71.6	Confident	65.9	Low	81 Å²	81	55 Å²	55	55%	0.547	32%	0.32	S	S	.	.	H	α-helix	trans	-62.6	-42.5	175.4	-77.7	0	0	0	0	112.1	A60 I61 T68	A60-C64 WeakPolarHBondContact O-CB 3.42Å; A60-C64 PolarHBondContact O-N 3.38Å; A60-C64 PolarHBondContact O-SG 2.86Å; I61-C64 PolarHBondContact O-N 2.92Å; C64-T68 WeakPolarHBondContact O-CB 3.42Å; C64-T68 PolarHBondContact O-N 3.01Å; C64-T68 PolarHBondContact O-OG1 2.95Å
65	L	64.3	Low	66.5	Low	61 Å²	61	57.9 Å²	57.9	32%	0.319	33%	0.327	S	S	.	.	H	α-helix	trans	-66.6	-42.9	176.6	-94	70.9	0	0	0	111.1	I61 S62 V67 T68 I69 I104	I61-L65 HydrophobicContact CG2-CD1 3.86Å; I61-L65 WeakPolarHBondContact O-CB 3.41Å; I61-L65 VanDerWaalsContact O-CD1 3.23Å; I61-L65 WeakPolarHBondContact O-CD1 3.11Å; I61-L65 PolarHBondContact O-N 3.47Å; S62-L65 PolarHBondContact O-N 3.19Å; L65-V67 PolarHBondContact O-N 3.41Å; L65-T68 WeakPolarHBondContact O-CB 3.18Å; L65-T68 PolarHBondContact O-N 3.49Å; L65-I69 WeakPolarHBondContact O-CB 3.34Å; L65-I69 WeakPolarHBondContact O-CD1 3.23Å; L65-I69 WeakPolarHBondContact O-CG1 3.49Å; L65-I69 PolarHBondContact O-N 3.02Å; L65-I104 HydrophobicContact CD2-CD1 4.13Å
66	Q	62.2	Low	66.7	Low	18 Å²	18	58 Å²	58	8%	0.084	33%	0.328	C	S	.	.	H	α-helix	trans	-63.8	-39.4	177	-73.2	176.3	-54.8	0	0	112.7	L32 N35 S62 L63 I69 G70 V101	L32-Q66 HydrophobicContact CD1-CB 3.93Å; N35-Q66 PolarHBondContact ND2-NE2 3.03Å; N35-Q66 VanDerWaalsContact ND2-NE2 3.13Å; N35-Q66 PolarHBondContact ND2-OE1 3Å; S62-Q66 WeakPolarHBondContact O-CB 3.35Å; S62-Q66 VanDerWaalsContact O-CG 3.27Å; S62-Q66 WeakPolarHBondContact O-CG 3.5Å; S62-Q66 PolarHBondContact O-N 3.36Å; L63-Q66 PolarHBondContact O-N 2.95Å; Q66-I69 PolarHBondContact O-N 3.48Å; Q66-G70 PolarHBondContact O-N 2.92Å; Q66-V101 HydrophobicContact CG-CG2 4.37Å
67	V	70.4	Confident	66.4	Low	76 Å²	76	59.4 Å²	59.4	46%	0.461	34%	0.336	S	S	.	.	H	α-helix	trans	-64.9	-41.9	173.5	170.6	0	0	0	0	111	L63 L65 I69 G70 I71	L63-V67 VanDerWaalsContact O-CG2 3.29Å; L63-V67 WeakPolarHBondContact O-CG2 3.34Å; L63-V67 PolarHBondContact O-N 3.07Å; L65-V67 PolarHBondContact O-N 3.41Å; V67-I69 VanDerWaalsContact C-N 3.33Å; V67-I69 PolarHBondContact O-N 2.99Å; V67-G70 PolarHBondContact O-N 2.91Å; V67-I71 HydrophobicContact CG1-CD1 3.89Å; V67-I71 VanDerWaalsContact O-CG1 3.28Å; V67-I71 WeakPolarHBondContact O-CG1 3.27Å; V67-I71 PolarHBondContact O-N 2.88Å
68	T	72.2	Confident	66.3	Low	76 Å²	76	65.3 Å²	65.3	47%	0.466	35%	0.351	S	S	.	.	H	α-helix	trans	-61.9	-43.1	176.5	-56.2	0	0	0	0	111.1	C64 L65 I71 L72	C64-T68 WeakPolarHBondContact O-CB 3.42Å; C64-T68 PolarHBondContact O-N 3.01Å; C64-T68 PolarHBondContact O-OG1 2.95Å; L65-T68 WeakPolarHBondContact O-CB 3.18Å; L65-T68 PolarHBondContact O-N 3.49Å; T68-I71 PolarHBondContact O-N 2.88Å; T68-L72 HydrophobicContact CG2-CD1 4.16Å; T68-L72 WeakPolarHBondContact O-CB 3.49Å; T68-L72 WeakPolarHBondContact O-CD1 3.45Å; T68-L72 PolarHBondContact O-N 2.96Å
69	I	67.2	Low	65.7	Low	29 Å²	29	69.8 Å²	69.8	15%	0.149	36%	0.364	C	S	.	.	H	α-helix	trans	-64.2	-46.2	175.8	-67.8	159	0	0	0	110.6	L65 Q66 V67 I71 L72 L73 A97 V101	L65-I69 WeakPolarHBondContact O-CB 3.34Å; L65-I69 WeakPolarHBondContact O-CD1 3.23Å; L65-I69 WeakPolarHBondContact O-CG1 3.49Å; L65-I69 PolarHBondContact O-N 3.02Å; Q66-I69 PolarHBondContact O-N 3.48Å; V67-I69 VanDerWaalsContact C-N 3.33Å; V67-I69 PolarHBondContact O-N 2.99Å; I69-I71 VanDerWaalsContact C-N 3.3Å; I69-I71 PolarHBondContact O-N 3.38Å; I69-L72 CarbonylContact O-C 3.55Å; I69-L72 WeakPolarHBondContact O-CA 3.18Å; I69-L72 WeakPolarHBondContact O-CB 3.21Å; I69-L72 PolarHBondContact O-N 3.34Å; I69-L72 VanDerWaalsContact O-N 3.1Å; I69-L73 HydrophobicContact CG2-CD1 4.13Å; I69-L73 WeakPolarHBondContact O-CB 3.41Å; I69-L73 PolarHBondContact O-N 3.49Å; I69-A97 HydrophobicContact CD1-CB 3.4Å; I69-A97 VanDerWaalsContact CD1-CB 3.4Å; I69-A97 HydrophobicContact CG1-CB 3.59Å; I69-A97 HydrophobicContact CG2-CB 4.15Å; I69-V101 HydrophobicContact CD1-CG2 3.97Å
70	G	67.1	Low	65.1	Low	29 Å²	29	72.3 Å²	72.3	30%	0.299	38%	0.377	S	S	.	.	H	α-helix	trans	-59.4	-38.7	177	0	0	0	0	0	113	Q66 V67 L73 I74	Q66-G70 PolarHBondContact O-N 2.92Å; V67-G70 PolarHBondContact O-N 2.91Å; G70-L73 WeakPolarHBondContact O-CB 3.4Å; G70-L73 PolarHBondContact O-N 3.01Å; G70-I74 WeakPolarHBondContact O-CD1 3.27Å; G70-I74 VanDerWaalsContact O-CG1 3.28Å; G70-I74 WeakPolarHBondContact O-CG1 3.46Å; G70-I74 PolarHBondContact O-N 2.79Å
71	I	73.8	Confident	64.2	Low	102 Å²	102	77.2 Å²	77.2	52%	0.523	40%	0.397	S	S	.	.	H	α-helix	trans	-67.7	-44.9	173.6	-66.4	165.5	0	0	0	110.5	V67 T68 I69 L73 I74 F75	V67-I71 HydrophobicContact CG1-CD1 3.89Å; V67-I71 VanDerWaalsContact O-CG1 3.28Å; V67-I71 WeakPolarHBondContact O-CG1 3.27Å; V67-I71 PolarHBondContact O-N 2.88Å; T68-I71 PolarHBondContact O-N 2.88Å; I69-I71 VanDerWaalsContact C-N 3.3Å; I69-I71 PolarHBondContact O-N 3.38Å; I71-L73 VanDerWaalsContact C-N 3.26Å; I71-L73 PolarHBondContact O-N 2.85Å; I71-I74 PolarHBondContact O-N 3.11Å; I71-F75 VanDerWaalsContact O-CB 3.26Å; I71-F75 WeakPolarHBondContact O-CB 3.42Å; I71-F75 PolarHBondContact O-N 3.47Å
72	L	66.8	Low	63.5	Low	90 Å²	90	79.7 Å²	79.7	47%	0.471	41%	0.411	S	S	.	.	H	α-helix	trans	-60.4	-36.1	175.8	-103.2	71.6	0	0	0	112.3	T68 I69 T76	T68-L72 HydrophobicContact CG2-CD1 4.16Å; T68-L72 WeakPolarHBondContact O-CB 3.49Å; T68-L72 WeakPolarHBondContact O-CD1 3.45Å; T68-L72 PolarHBondContact O-N 2.96Å; I69-L72 CarbonylContact O-C 3.55Å; I69-L72 WeakPolarHBondContact O-CA 3.18Å; I69-L72 WeakPolarHBondContact O-CB 3.21Å; I69-L72 PolarHBondContact O-N 3.34Å; I69-L72 VanDerWaalsContact O-N 3.1Å; L72-T76 WeakPolarHBondContact O-CB 3.49Å; L72-T76 PolarHBondContact O-N 3.26Å; L72-T76 PolarHBondContact O-OG1 2.97Å
73	L	64.2	Low	62.7	Low	25 Å²	25	84.7 Å²	84.7	13%	0.131	44%	0.437	C	S	.	.	H	α-helix	trans	-66.4	-48.8	176.3	-113.9	157.5	0	0	0	111.6	I69 G70 I71 F75 T76 V77 E94	I69-L73 HydrophobicContact CG2-CD1 4.13Å; I69-L73 WeakPolarHBondContact O-CB 3.41Å; I69-L73 PolarHBondContact O-N 3.49Å; G70-L73 WeakPolarHBondContact O-CB 3.4Å; G70-L73 PolarHBondContact O-N 3.01Å; I71-L73 VanDerWaalsContact C-N 3.26Å; I71-L73 PolarHBondContact O-N 2.85Å; L73-F75 VanDerWaalsContact C-N 3.32Å; L73-F75 PolarHBondContact O-N 2.87Å; L73-T76 WeakPolarHBondContact O-CB 3.32Å; L73-T76 PolarHBondContact O-N 3.04Å; L73-V77 WeakPolarHBondContact O-CG2 3.44Å; L73-V77 PolarHBondContact O-N 3.31Å; L73-E94 WeakPolarHBondContact CD2-OE1 3.34Å; L73-E94 HydrophobicContact CG-CG 4.26Å; L73-E94 WeakPolarHBondContact CG-OE1 3.1Å
74	I	67.4	Low	62	Low	125 Å²	125	90.3 Å²	90.3	64%	0.641	46%	0.462	S	S	*	.	H	α-helix	trans	-61.6	-43.2	175.9	-69.8	163	0	0	0	110.6	G70 I71 V77 R78	G70-I74 WeakPolarHBondContact O-CD1 3.27Å; G70-I74 VanDerWaalsContact O-CG1 3.28Å; G70-I74 WeakPolarHBondContact O-CG1 3.46Å; G70-I74 PolarHBondContact O-N 2.79Å; I71-I74 PolarHBondContact O-N 3.11Å; I74-V77 PolarHBondContact O-N 3.4Å; I74-R78 WeakPolarHBondContact O-CB 3.46Å; I74-R78 PolarHBondContact O-N 3.2Å
75	F	65.3	Low	61	Low	121 Å²	121	94.9 Å²	94.9	53%	0.531	48%	0.476	S	S	.	.	H	α-helix	trans	-66.4	-39.8	178	-156.3	-102.2	0	0	0	111.4	I71 L73 R78 W79	I71-F75 VanDerWaalsContact O-CB 3.26Å; I71-F75 WeakPolarHBondContact O-CB 3.42Å; I71-F75 PolarHBondContact O-N 3.47Å; L73-F75 VanDerWaalsContact C-N 3.32Å; L73-F75 PolarHBondContact O-N 2.87Å; F75-R78 WeakPolarHBondContact O-CB 3.48Å; F75-R78 PolarHBondContact O-N 3.39Å; F75-W79 HydrophobicContact CD1-CD2 4.29Å; F75-W79 AromaticContact CD1-CE3 3.33Å; F75-W79 HydrophobicContact CD1-CE3 3.33Å; F75-W79 HydrophobicContact CD1-CH2 4.35Å; F75-W79 AromaticContact CD1-CZ3 3.45Å; F75-W79 HydrophobicContact CD1-CZ3 3.45Å; F75-W79 VanDerWaalsContact CD1-CZ3 3.45Å; F75-W79 HydrophobicContact CD2-CE3 4.24Å; F75-W79 AromaticContact CD2-CZ3 3.85Å; F75-W79 HydrophobicContact CD2-CZ3 3.85Å; F75-W79 HydrophobicContact CE1-CD2 4.13Å; F75-W79 AromaticContact CE1-CE3 3.24Å; F75-W79 HydrophobicContact CE1-CE3 3.24Å; F75-W79 AromaticContact CE1-CH2 3.41Å; F75-W79 HydrophobicContact CE1-CH2 3.41Å; F75-W79 VanDerWaalsContact CE1-CH2 3.41Å; F75-W79 HydrophobicContact CE1-CZ2 4.24Å; F75-W79 AromaticContact CE1-CZ3 2.9Å; F75-W79 HydrophobicContact CE1-CZ3 2.9Å; F75-W79 HydrophobicContact CE2-CE3 4.17Å; F75-W79 HydrophobicContact CE2-CH2 4.07Å; F75-W79 AromaticContact CE2-CZ3 3.35Å; F75-W79 HydrophobicContact CE2-CZ3 3.35Å; F75-W79 AromaticContact CG-CE3 3.89Å; F75-W79 HydrophobicContact CG-CE3 3.89Å; F75-W79 AromaticContact CG-CZ3 3.93Å; F75-W79 HydrophobicContact CG-CZ3 3.93Å; F75-W79 AromaticContact CZ-CE3 3.72Å; F75-W79 HydrophobicContact CZ-CE3 3.72Å; F75-W79 AromaticContact CZ-CH2 3.26Å; F75-W79 HydrophobicContact CZ-CH2 3.26Å; F75-W79 HydrophobicContact CZ-CZ2 4.42Å; F75-W79 AromaticContact CZ-CZ3 2.87Å; F75-W79 HydrophobicContact CZ-CZ3 2.87Å; F75-W79 WeakPolarHBondContact O-CB 3.29Å; F75-W79 PolarHBondContact O-N 2.98Å
76	T	62.3	Low	60.4	Low	23 Å²	23	98.6 Å²	98.6	14%	0.141	49%	0.489	C	S	.	.	H	α-helix	trans	-58.2	-53.4	172.6	-77.8	0	0	0	0	111.1	L72 L73 R78 W79 N80 L90	L72-T76 WeakPolarHBondContact O-CB 3.49Å; L72-T76 PolarHBondContact O-N 3.26Å; L72-T76 PolarHBondContact O-OG1 2.97Å; L73-T76 WeakPolarHBondContact O-CB 3.32Å; L73-T76 PolarHBondContact O-N 3.04Å; T76-R78 PolarHBondContact O-N 2.89Å; T76-W79 PolarHBondContact O-N 3.41Å; T76-W79 VanDerWaalsContact O-N 3.14Å; T76-N80 VanDerWaalsContact O-CB 3.28Å; T76-N80 WeakPolarHBondContact O-CB 3.17Å; T76-N80 PolarHBondContact O-N 2.85Å; T76-L90 HydrophobicContact CG2-CB 4.08Å; T76-L90 HydrophobicContact CG2-CD2 3.54Å; T76-L90 HydrophobicContact CG2-CG 4.16Å; T76-L90 WeakPolarHBondContact OG1-CD2 3.45Å
77	V	56	Low	59.9	Low	70 Å²	70	101.5 Å²	101.5	42%	0.424	50%	0.503	S	S	.	.	H	α-helix	trans	-58.6	-39.2	177.7	169.9	0	0	0	0	111	L73 I74	L73-V77 WeakPolarHBondContact O-CG2 3.44Å; L73-V77 PolarHBondContact O-N 3.31Å; I74-V77 PolarHBondContact O-N 3.4Å
78	R	59.6	Low	59.1	Low	196 Å²	196	107.3 Å²	107.3	74%	0.74	52%	0.516	S	S	*	.	H	α-helix	trans	-66.8	-39.5	177.1	-162.4	70.2	146.1	124.7	-0.5	112.8	I74 F75 T76	I74-R78 WeakPolarHBondContact O-CB 3.46Å; I74-R78 PolarHBondContact O-N 3.2Å; F75-R78 WeakPolarHBondContact O-CB 3.48Å; F75-R78 PolarHBondContact O-N 3.39Å; T76-R78 PolarHBondContact O-N 2.89Å
79	W	53	Low	58.3	Low	146 Å²	146	111.6 Å²	111.6	55%	0.553	52%	0.524	S	S	*	.	H	α-helix	trans	-79.2	-26	177.6	-116.4	-78.7	0	0	0	113.5	F75 T76 L81 D82 D83	F75-W79 HydrophobicContact CD1-CD2 4.29Å; F75-W79 AromaticContact CD1-CE3 3.33Å; F75-W79 HydrophobicContact CD1-CE3 3.33Å; F75-W79 HydrophobicContact CD1-CH2 4.35Å; F75-W79 AromaticContact CD1-CZ3 3.45Å; F75-W79 HydrophobicContact CD1-CZ3 3.45Å; F75-W79 VanDerWaalsContact CD1-CZ3 3.45Å; F75-W79 HydrophobicContact CD2-CE3 4.24Å; F75-W79 AromaticContact CD2-CZ3 3.85Å; F75-W79 HydrophobicContact CD2-CZ3 3.85Å; F75-W79 HydrophobicContact CE1-CD2 4.13Å; F75-W79 AromaticContact CE1-CE3 3.24Å; F75-W79 HydrophobicContact CE1-CE3 3.24Å; F75-W79 AromaticContact CE1-CH2 3.41Å; F75-W79 HydrophobicContact CE1-CH2 3.41Å; F75-W79 VanDerWaalsContact CE1-CH2 3.41Å; F75-W79 HydrophobicContact CE1-CZ2 4.24Å; F75-W79 AromaticContact CE1-CZ3 2.9Å; F75-W79 HydrophobicContact CE1-CZ3 2.9Å; F75-W79 HydrophobicContact CE2-CE3 4.17Å; F75-W79 HydrophobicContact CE2-CH2 4.07Å; F75-W79 AromaticContact CE2-CZ3 3.35Å; F75-W79 HydrophobicContact CE2-CZ3 3.35Å; F75-W79 AromaticContact CG-CE3 3.89Å; F75-W79 HydrophobicContact CG-CE3 3.89Å; F75-W79 AromaticContact CG-CZ3 3.93Å; F75-W79 HydrophobicContact CG-CZ3 3.93Å; F75-W79 AromaticContact CZ-CE3 3.72Å; F75-W79 HydrophobicContact CZ-CE3 3.72Å; F75-W79 AromaticContact CZ-CH2 3.26Å; F75-W79 HydrophobicContact CZ-CH2 3.26Å; F75-W79 HydrophobicContact CZ-CZ2 4.42Å; F75-W79 AromaticContact CZ-CZ3 2.87Å; F75-W79 HydrophobicContact CZ-CZ3 2.87Å; F75-W79 WeakPolarHBondContact O-CB 3.29Å; F75-W79 PolarHBondContact O-N 2.98Å; T76-W79 PolarHBondContact O-N 3.41Å; T76-W79 VanDerWaalsContact O-N 3.14Å; W79-L81 PolarHBondContact O-N 3.4Å; W79-D82 PolarHBondContact O-N 3.48Å; W79-D83 PolarHBondContact O-N 2.94Å
80	N	52.4	Low	57.8	Low	65 Å²	65	112.4 Å²	112.4	35%	0.348	53%	0.528	S	S	.	.	H	α-helix	trans	-64.3	-24.2	-179.8	-148.4	-89.9	0	0	0	112.2	T76 D82 H87	T76-N80 VanDerWaalsContact O-CB 3.28Å; T76-N80 WeakPolarHBondContact O-CB 3.17Å; T76-N80 PolarHBondContact O-N 2.85Å; N80-D82 VanDerWaalsContact C-N 3.3Å; N80-H87 PolarHBondContact ND2-CE1 3.42Å; N80-H87 PolarHBondContact ND2-ND1 2.85Å; N80-H87 PolarHBondContact OD1-CE1 2.92Å
81	L	50.2	Low	57.5	Low	149 Å²	149	115.3 Å²	115.3	78%	0.78	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-19.4	173.5	-88.8	134.9	0	0	0	113.8	W79	W79-L81 PolarHBondContact O-N 3.4Å
82	D	53.5	Low	56.9	Low	138 Å²	138	114.3 Å²	114.3	74%	0.738	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-21.5	-170.6	-122.3	-83.7	0	0	0	113.3	W79 N80	W79-D82 PolarHBondContact O-N 3.48Å; N80-D82 VanDerWaalsContact C-N 3.3Å
83	D	49.4	Very low	56.7	Low	105 Å²	105	115 Å²	115	56%	0.561	54%	0.535	S	S	*	.			trans	-158.7	104	-177.5	-138.5	-33.8	0	0	0	113.5	W79 Q85	W79-D83 PolarHBondContact O-N 2.94Å; D83-Q85 PolarHBondContact O-N 2.89Å
84	E	53.3	Low	56.9	Low	171 Å²	171	115.4 Å²	115.4	80%	0.799	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	12.9	-175.5	-157.5	176.3	87.4	0	0	114.1	H87	E84-H87 VanDerWaalsContact C-CD2 3.47Å; E84-H87 WeakPolarHBondContact CA-NE2 2.91Å; E84-H87 PolarHBondContact O-CD2 3.23Å; E84-H87 PolarHBondContact O-NE2 3.39Å
85	Q	49.7	Very low	56.8	Low	177 Å²	177	114.6 Å²	114.6	83%	0.827	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-6.2	-172.5	-78.8	-146	-28.4	0	0	116.4	D83	D83-Q85 PolarHBondContact O-N 2.89Å
86	K	52.6	Low	56.9	Low	139 Å²	139	113.2 Å²	113.2	60%	0.604	53%	0.53	S	S	*	.			trans	-113.7	21	-177.9	-75.3	179.2	-179.3	163.2	0	115.5	W88 R89	K86-W88 PolarHBondContact O-N 3.36Å; K86-W88 VanDerWaalsContact O-N 3.09Å; K86-R89 PolarHBondContact O-N 3.44Å
87	H	52.4	Low	57.1	Low	79 Å²	79	112.8 Å²	112.8	37%	0.366	53%	0.529	S	S	.	.	H	α-helix	trans	-54.3	-31	-179.1	-67.1	-86.4	0	0	0	114.9	N80 E84 N91	N80-H87 PolarHBondContact ND2-CE1 3.42Å; N80-H87 PolarHBondContact ND2-ND1 2.85Å; N80-H87 PolarHBondContact OD1-CE1 2.92Å; E84-H87 VanDerWaalsContact C-CD2 3.47Å; E84-H87 WeakPolarHBondContact CA-NE2 2.91Å; E84-H87 PolarHBondContact O-CD2 3.23Å; E84-H87 PolarHBondContact O-NE2 3.39Å; H87-N91 VanDerWaalsContact O-CB 3.32Å; H87-N91 WeakPolarHBondContact O-CB 3.33Å; H87-N91 PolarHBondContact O-N 3.49Å
88	W	52.7	Low	57.6	Low	198 Å²	198	112.5 Å²	112.5	75%	0.75	53%	0.527	S	S	*	.	H	α-helix	trans	-71.1	-36.9	-175.6	-172.6	71.2	0	0	0	113.7	K86 L92	K86-W88 PolarHBondContact O-N 3.36Å; K86-W88 VanDerWaalsContact O-N 3.09Å; W88-L92 HydrophobicContact CH2-CD2 4.22Å; W88-L92 HydrophobicContact CZ2-CD2 4.44Å; W88-L92 HydrophobicContact CZ3-CD2 4.45Å; W88-L92 WeakPolarHBondContact O-CB 3.21Å; W88-L92 PolarHBondContact O-N 2.96Å
89	R	54.5	Low	58.1	Low	167 Å²	167	104.7 Å²	104.7	63%	0.63	51%	0.508	S	S	*	.	H	α-helix	trans	-75.9	-33.4	-177	-73.6	-174.3	63.5	-165.7	-3.1	112.7	K86 M93	K86-R89 PolarHBondContact O-N 3.44Å; R89-M93 VanDerWaalsContact O-CG 3.23Å; R89-M93 WeakPolarHBondContact O-CG 3.48Å; R89-M93 PolarHBondContact O-N 2.94Å; R89-M93 VanDerWaalsContact O-N 3.08Å
90	L	57.3	Low	58.6	Low	45 Å²	45	101.7 Å²	101.7	24%	0.236	50%	0.502	C	S	.	.	H	α-helix	trans	-73.8	-47.6	-179.5	-80.9	61.7	0	0	0	109.5	T76 L92 M93 E94	T76-L90 HydrophobicContact CG2-CB 4.08Å; T76-L90 HydrophobicContact CG2-CD2 3.54Å; T76-L90 HydrophobicContact CG2-CG 4.16Å; T76-L90 WeakPolarHBondContact OG1-CD2 3.45Å; L90-L92 PolarHBondContact O-N 2.76Å; L90-M93 PolarHBondContact O-N 2.86Å; L90-M93 VanDerWaalsContact O-N 3.1Å; L90-E94 PolarHBondContact O-N 3.31Å
91	N	60.8	Low	59.3	Low	91 Å²	91	99.4 Å²	99.4	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-64.5	-28.8	176.1	-156.2	101.7	0	0	0	112.5	H87 N95	H87-N91 VanDerWaalsContact O-CB 3.32Å; H87-N91 WeakPolarHBondContact O-CB 3.33Å; H87-N91 PolarHBondContact O-N 3.49Å; N91-N95 WeakPolarHBondContact O-CB 3.37Å; N91-N95 PolarHBondContact O-N 3.25Å
92	L	61.9	Low	60.2	Low	80 Å²	80	99.1 Å²	99.1	42%	0.419	48%	0.484	S	S	.	.	H	α-helix	trans	-71.5	-43	172.9	-176	68.3	0	0	0	111.5	W88 L90 N95 L96	W88-L92 HydrophobicContact CH2-CD2 4.22Å; W88-L92 HydrophobicContact CZ2-CD2 4.44Å; W88-L92 HydrophobicContact CZ3-CD2 4.45Å; W88-L92 WeakPolarHBondContact O-CB 3.21Å; W88-L92 PolarHBondContact O-N 2.96Å; L90-L92 PolarHBondContact O-N 2.76Å; L92-N95 PolarHBondContact O-N 3.06Å; L92-L96 WeakPolarHBondContact O-CB 3.32Å; L92-L96 PolarHBondContact O-N 3.26Å
93	M	61.8	Low	60.8	Low	106 Å²	106	97.9 Å²	97.9	52%	0.522	48%	0.476	S	S	.	.	H	α-helix	trans	-66.2	-39.5	178.1	-71.3	-96	93.5	0	0	111.4	R89 L90 L96 A97	R89-M93 VanDerWaalsContact O-CG 3.23Å; R89-M93 WeakPolarHBondContact O-CG 3.48Å; R89-M93 PolarHBondContact O-N 2.94Å; R89-M93 VanDerWaalsContact O-N 3.08Å; L90-M93 PolarHBondContact O-N 2.86Å; L90-M93 VanDerWaalsContact O-N 3.1Å; M93-L96 HydrophobicContact CE-CD2 4.05Å; M93-A97 WeakPolarHBondContact O-CB 3.23Å; M93-A97 PolarHBondContact O-N 3.08Å
94	E	68.2	Low	61.7	Low	32 Å²	32	94.3 Å²	94.3	15%	0.15	46%	0.456	C	S	.	.	H	α-helix	trans	-63.8	-51.4	172.4	-81.9	172.6	122.8	0	0	111.9	L73 L90 L96 A97 T98	L73-E94 WeakPolarHBondContact CD2-OE1 3.34Å; L73-E94 HydrophobicContact CG-CG 4.26Å; L73-E94 WeakPolarHBondContact CG-OE1 3.1Å; L90-E94 PolarHBondContact O-N 3.31Å; E94-L96 VanDerWaalsContact C-N 3.27Å; E94-L96 PolarHBondContact O-N 3.1Å; E94-A97 CarbonylContact O-C 3.53Å; E94-A97 WeakPolarHBondContact O-CA 3.14Å; E94-A97 VanDerWaalsContact O-CB 3.27Å; E94-A97 WeakPolarHBondContact O-CB 2.82Å; E94-A97 PolarHBondContact O-N 3.27Å; E94-T98 PolarHBondContact O-N 2.86Å; E94-T98 PolarHBondContact O-OG1 2.61Å
95	N	65.3	Low	62.2	Low	109 Å²	109	87.8 Å²	87.8	58%	0.583	43%	0.428	S	S	*	.	H	α-helix	trans	-66.3	-31.8	-179	-162.9	52.8	0	0	0	112.1	N91 L92 G99	N91-N95 WeakPolarHBondContact O-CB 3.37Å; N91-N95 PolarHBondContact O-N 3.25Å; L92-N95 PolarHBondContact O-N 3.06Å; N95-G99 PolarHBondContact O-N 2.6Å
96	L	69	Low	62.9	Low	92 Å²	92	82.1 Å²	82.1	48%	0.482	41%	0.406	S	S	.	.	H	α-helix	trans	-67.3	-41.2	171.4	-162.8	92.5	0	0	0	110.9	L92 M93 E94 G99 L100	L92-L96 WeakPolarHBondContact O-CB 3.32Å; L92-L96 PolarHBondContact O-N 3.26Å; M93-L96 HydrophobicContact CE-CD2 4.05Å; E94-L96 VanDerWaalsContact C-N 3.27Å; E94-L96 PolarHBondContact O-N 3.1Å; L96-G99 PolarHBondContact O-N 3.11Å; L96-L100 HydrophobicContact CD2-CD1 4.26Å; L96-L100 HydrophobicContact CG-CD1 4.08Å; L96-L100 WeakPolarHBondContact O-CB 3.33Å; L96-L100 WeakPolarHBondContact O-CD1 3.45Å; L96-L100 PolarHBondContact O-N 3.02Å
97	A	65.2	Low	63.5	Low	14 Å²	14	78.7 Å²	78.7	12%	0.116	40%	0.396	C	S	.	.	H	α-helix	trans	-62.5	-47.9	174.7	0	0	0	0	0	111.8	I69 M93 E94 G99 L100 V101	I69-A97 HydrophobicContact CD1-CB 3.4Å; I69-A97 VanDerWaalsContact CD1-CB 3.4Å; I69-A97 HydrophobicContact CG1-CB 3.59Å; I69-A97 HydrophobicContact CG2-CB 4.15Å; M93-A97 WeakPolarHBondContact O-CB 3.23Å; M93-A97 PolarHBondContact O-N 3.08Å; E94-A97 CarbonylContact O-C 3.53Å; E94-A97 WeakPolarHBondContact O-CA 3.14Å; E94-A97 VanDerWaalsContact O-CB 3.27Å; E94-A97 WeakPolarHBondContact O-CB 2.82Å; E94-A97 PolarHBondContact O-N 3.27Å; A97-G99 VanDerWaalsContact C-N 3.3Å; A97-G99 PolarHBondContact O-N 3.4Å; A97-L100 PolarHBondContact O-N 3.26Å; A97-V101 WeakPolarHBondContact O-CB 3.48Å; A97-V101 VanDerWaalsContact O-CG2 3.25Å; A97-V101 WeakPolarHBondContact O-CG2 3.5Å; A97-V101 PolarHBondContact O-N 2.87Å
98	T	66.4	Low	64	Low	63 Å²	63	75.9 Å²	75.9	39%	0.387	38%	0.383	S	S	.	.	H	α-helix	trans	-59.7	-41.7	173.5	-51.1	0	0	0	0	111	E94 V101 F102	E94-T98 PolarHBondContact O-N 2.86Å; E94-T98 PolarHBondContact O-OG1 2.61Å; T98-V101 PolarHBondContact O-N 2.93Å; T98-F102 WeakPolarHBondContact O-CB 3.42Å; T98-F102 PolarHBondContact O-N 2.82Å
99	G	70	Confident	64.7	Low	32 Å²	32	71 Å²	71	33%	0.33	37%	0.371	S	S	.	.	H	α-helix	trans	-62.5	-42.9	174.5	0	0	0	0	0	113.3	N95 L96 A97 F102 I103	N95-G99 PolarHBondContact O-N 2.6Å; L96-G99 PolarHBondContact O-N 3.11Å; A97-G99 VanDerWaalsContact C-N 3.3Å; A97-G99 PolarHBondContact O-N 3.4Å; G99-F102 PolarHBondContact O-N 3.34Å; G99-I103 WeakPolarHBondContact O-CG1 3.28Å; G99-I103 PolarHBondContact O-N 3.37Å; G99-I103 VanDerWaalsContact O-N 3.09Å
100	L	63.3	Low	65.2	Low	83 Å²	83	69.6 Å²	69.6	44%	0.435	37%	0.37	S	S	.	.	H	α-helix	trans	-64.7	-45.2	174.6	-103.1	106.7	0	0	0	111.5	L96 A97 F102 I103 I104	L96-L100 HydrophobicContact CD2-CD1 4.26Å; L96-L100 HydrophobicContact CG-CD1 4.08Å; L96-L100 WeakPolarHBondContact O-CB 3.33Å; L96-L100 WeakPolarHBondContact O-CD1 3.45Å; L96-L100 PolarHBondContact O-N 3.02Å; A97-L100 PolarHBondContact O-N 3.26Å; L100-F102 VanDerWaalsContact C-N 3.31Å; L100-F102 PolarHBondContact O-N 3.44Å; L100-I103 PolarHBondContact O-N 3.45Å; L100-I104 WeakPolarHBondContact O-CD1 3.44Å; L100-I104 WeakPolarHBondContact O-CG1 3.35Å; L100-I104 PolarHBondContact O-N 2.95Å
101	V	67.2	Low	65.3	Low	18 Å²	18	70 Å²	70	11%	0.109	37%	0.372	C	S	.	.	H	α-helix	trans	-60.7	-41.7	176.9	170.4	0	0	0	0	110.6	Q66 I69 A97 T98 I103 I104 V105	Q66-V101 HydrophobicContact CG-CG2 4.37Å; I69-V101 HydrophobicContact CD1-CG2 3.97Å; A97-V101 WeakPolarHBondContact O-CB 3.48Å; A97-V101 VanDerWaalsContact O-CG2 3.25Å; A97-V101 WeakPolarHBondContact O-CG2 3.5Å; A97-V101 PolarHBondContact O-N 2.87Å; T98-V101 PolarHBondContact O-N 2.93Å; V101-I103 PolarHBondContact O-N 2.79Å; V101-I104 PolarHBondContact O-N 3.32Å; V101-V105 HydrophobicContact CG1-CG2 4.42Å; V101-V105 VanDerWaalsContact O-CG2 3.31Å; V101-V105 WeakPolarHBondContact O-CG2 3.23Å; V101-V105 PolarHBondContact O-N 3.48Å
102	F	68.9	Low	65.1	Low	143 Å²	143	69.3 Å²	69.3	63%	0.627	37%	0.371	S	S	*	.	H	α-helix	trans	-60.1	-45.9	175.8	-178.4	-100	0	0	0	112	T98 G99 L100 I104 V105 V106	T98-F102 WeakPolarHBondContact O-CB 3.42Å; T98-F102 PolarHBondContact O-N 2.82Å; G99-F102 PolarHBondContact O-N 3.34Å; L100-F102 VanDerWaalsContact C-N 3.31Å; L100-F102 PolarHBondContact O-N 3.44Å; F102-I104 VanDerWaalsContact C-N 3.35Å; F102-I104 PolarHBondContact O-N 3.1Å; F102-V105 PolarHBondContact O-N 2.94Å; F102-V106 HydrophobicContact CD1-CG2 4.44Å; F102-V106 HydrophobicContact CE1-CG2 4.11Å; F102-V106 HydrophobicContact CZ-CG2 4.18Å; F102-V106 WeakPolarHBondContact O-CG2 3.45Å; F102-V106 PolarHBondContact O-N 2.75Å
103	I	67.9	Low	65.1	Low	111 Å²	111	67.9 Å²	67.9	57%	0.569	37%	0.371	S	S	*	.	H	α-helix	trans	-63.2	-42.2	176.9	-67.2	172.8	0	0	0	110.8	G99 L100 V101 V105 V106 V107	G99-I103 WeakPolarHBondContact O-CG1 3.28Å; G99-I103 PolarHBondContact O-N 3.37Å; G99-I103 VanDerWaalsContact O-N 3.09Å; L100-I103 PolarHBondContact O-N 3.45Å; V101-I103 PolarHBondContact O-N 2.79Å; I103-V105 PolarHBondContact O-N 3.34Å; I103-V106 PolarHBondContact O-N 3.41Å; I103-V107 WeakPolarHBondContact O-CG2 3.38Å; I103-V107 PolarHBondContact O-N 2.98Å
104	I	67.6	Low	64.9	Low	31 Å²	31	68.6 Å²	68.6	16%	0.159	38%	0.376	C	S	.	.	H	α-helix	trans	-62.3	-42.1	177.7	-67.7	161.3	0	0	0	111.1	L65 L100 V101 F102 V107 N108	L65-I104 HydrophobicContact CD2-CD1 4.13Å; L100-I104 WeakPolarHBondContact O-CD1 3.44Å; L100-I104 WeakPolarHBondContact O-CG1 3.35Å; L100-I104 PolarHBondContact O-N 2.95Å; V101-I104 PolarHBondContact O-N 3.32Å; F102-I104 VanDerWaalsContact C-N 3.35Å; F102-I104 PolarHBondContact O-N 3.1Å; I104-V107 PolarHBondContact O-N 2.84Å; I104-N108 WeakPolarHBondContact O-CB 3.43Å; I104-N108 PolarHBondContact O-N 3.04Å
105	V	62.9	Low	64.4	Low	34 Å²	34	69.2 Å²	69.2	21%	0.206	39%	0.391	C	S	.	.	H	α-helix	trans	-64.1	-44.7	176.8	168.8	0	0	0	0	111.3	V101 F102 I103 V107 N108 I109	V101-V105 HydrophobicContact CG1-CG2 4.42Å; V101-V105 VanDerWaalsContact O-CG2 3.31Å; V101-V105 WeakPolarHBondContact O-CG2 3.23Å; V101-V105 PolarHBondContact O-N 3.48Å; F102-V105 PolarHBondContact O-N 2.94Å; I103-V105 PolarHBondContact O-N 3.34Å; V105-V107 VanDerWaalsContact C-N 3.33Å; V105-V107 PolarHBondContact O-N 2.72Å; V105-N108 PolarHBondContact O-N 3.26Å; V105-I109 HydrophobicContact CG1-CD1 3.81Å; V105-I109 HydrophobicContact CG1-CG1 4.39Å; V105-I109 WeakPolarHBondContact O-CG1 3.1Å; V105-I109 PolarHBondContact O-N 3.47Å
106	V	65.3	Low	63.7	Low	58 Å²	58	69.4 Å²	69.4	35%	0.352	40%	0.396	S	S	.	.	H	α-helix	trans	-60.9	-43.6	177.3	170.9	0	0	0	0	111.1	F102 I103 I109 F110	F102-V106 HydrophobicContact CD1-CG2 4.44Å; F102-V106 HydrophobicContact CE1-CG2 4.11Å; F102-V106 HydrophobicContact CZ-CG2 4.18Å; F102-V106 WeakPolarHBondContact O-CG2 3.45Å; F102-V106 PolarHBondContact O-N 2.75Å; I103-V106 PolarHBondContact O-N 3.41Å; V106-I109 PolarHBondContact O-N 3.41Å; V106-F110 HydrophobicContact CG1-CD2 4.21Å; V106-F110 HydrophobicContact CG1-CE2 4.46Å; V106-F110 PolarHBondContact O-N 2.78Å
107	V	64.3	Low	62.4	Low	66 Å²	66	72.6 Å²	72.6	40%	0.4	41%	0.408	S	S	.	.	H	α-helix	trans	-62.9	-43.9	175.6	172.6	0	0	0	0	110.9	I103 I104 V105 I109 F110 I111	I103-V107 WeakPolarHBondContact O-CG2 3.38Å; I103-V107 PolarHBondContact O-N 2.98Å; I104-V107 PolarHBondContact O-N 2.84Å; V105-V107 VanDerWaalsContact C-N 3.33Å; V105-V107 PolarHBondContact O-N 2.72Å; V107-I109 PolarHBondContact O-N 2.78Å; V107-F110 PolarHBondContact O-N 3.31Å; V107-I111 HydrophobicContact CG1-CG1 4.44Å; V107-I111 VanDerWaalsContact O-CG1 3.29Å; V107-I111 WeakPolarHBondContact O-CG1 3.28Å; V107-I111 PolarHBondContact O-N 3.3Å
108	N	64.3	Low	61.2	Low	20 Å²	20	78.7 Å²	78.7	11%	0.107	43%	0.434	C	S	.	.	H	α-helix	trans	-61.5	-42.8	176.5	-80.8	-14.4	0	0	0	112.2	L58 I104 V105 F110 I111 T112	L58-N108 WeakPolarHBondContact CB-OD1 3.28Å; I104-N108 WeakPolarHBondContact O-CB 3.43Å; I104-N108 PolarHBondContact O-N 3.04Å; V105-N108 PolarHBondContact O-N 3.26Å; N108-F110 VanDerWaalsContact C-N 3.34Å; N108-F110 PolarHBondContact O-N 3.01Å; N108-I111 PolarHBondContact O-N 3.32Å; N108-T112 WeakPolarHBondContact O-CB 3.33Å; N108-T112 PolarHBondContact O-N 3.09Å; N108-T112 PolarHBondContact O-OG1 3.13Å; N108-T112 VanDerWaalsContact O-OG1 3.08Å
109	I	66.3	Low	60.1	Low	97 Å²	97	85.1 Å²	85.1	50%	0.497	48%	0.477	S	S	.	.	H	α-helix	trans	-62.5	-42	176.4	-69.6	168.3	0	0	0	110.9	V105 V106 V107 T112 A113	V105-I109 HydrophobicContact CG1-CD1 3.81Å; V105-I109 HydrophobicContact CG1-CG1 4.39Å; V105-I109 WeakPolarHBondContact O-CG1 3.1Å; V105-I109 PolarHBondContact O-N 3.47Å; V106-I109 PolarHBondContact O-N 3.41Å; V107-I109 PolarHBondContact O-N 2.78Å; I109-T112 PolarHBondContact O-N 3.27Å; I109-A113 VanDerWaalsContact O-CB 3.26Å; I109-A113 WeakPolarHBondContact O-CB 3.47Å; I109-A113 PolarHBondContact O-N 3.14Å
110	F	65.6	Low	59.6	Low	137 Å²	137	87.8 Å²	87.8	60%	0.601	48%	0.484	S	S	*	.	H	α-helix	trans	-61.3	-45.1	174.8	-101.7	-90.3	0	0	0	111.6	V106 V107 N108 A113 L114	V106-F110 HydrophobicContact CG1-CD2 4.21Å; V106-F110 HydrophobicContact CG1-CE2 4.46Å; V106-F110 PolarHBondContact O-N 2.78Å; V107-F110 PolarHBondContact O-N 3.31Å; N108-F110 VanDerWaalsContact C-N 3.34Å; N108-F110 PolarHBondContact O-N 3.01Å; F110-A113 PolarHBondContact O-N 2.79Å; F110-L114 VanDerWaalsContact O-CB 3.29Å; F110-L114 WeakPolarHBondContact O-CB 3.48Å; F110-L114 WeakPolarHBondContact O-CD1 3.4Å; F110-L114 WeakPolarHBondContact O-CG 3.26Å; F110-L114 PolarHBondContact O-N 2.89Å
111	I	59.8	Low	59.4	Low	54 Å²	54	88.1 Å²	88.1	28%	0.277	49%	0.487	S	S	.	.	H	α-helix	trans	-64.9	-40.4	177.3	-62.6	-74.3	0	0	0	111.1	V55 V107 N108 L114 G115	V55-I111 HydrophobicContact CG2-CG2 3.54Å; V107-I111 HydrophobicContact CG1-CG1 4.44Å; V107-I111 VanDerWaalsContact O-CG1 3.29Å; V107-I111 WeakPolarHBondContact O-CG1 3.28Å; V107-I111 PolarHBondContact O-N 3.3Å; N108-I111 PolarHBondContact O-N 3.32Å; I111-L114 PolarHBondContact O-N 2.91Å; I111-G115 PolarHBondContact O-N 3Å
112	T	56.9	Low	59	Low	75 Å²	75	91.9 Å²	91.9	46%	0.46	51%	0.508	S	S	.	.	H	α-helix	trans	-63.6	-43.7	174.2	-63.4	0	0	0	0	111.8	N108 I109 L114 G115 V116	N108-T112 WeakPolarHBondContact O-CB 3.33Å; N108-T112 PolarHBondContact O-N 3.09Å; N108-T112 PolarHBondContact O-OG1 3.13Å; N108-T112 VanDerWaalsContact O-OG1 3.08Å; I109-T112 PolarHBondContact O-N 3.27Å; T112-L114 VanDerWaalsContact C-N 3.31Å; T112-L114 PolarHBondContact O-N 3.44Å; T112-G115 PolarHBondContact O-N 3.5Å; T112-V116 PolarHBondContact O-N 3.46Å; T112-V116 VanDerWaalsContact O-N 3.1Å
113	A	60.2	Low	58.4	Low	51 Å²	51	88.9 Å²	88.9	42%	0.421	50%	0.501	S	S	.	.	H	α-helix	trans	-66.8	-32.4	177.2	0	0	0	0	0	112.7	I109 F110	I109-A113 VanDerWaalsContact O-CB 3.26Å; I109-A113 WeakPolarHBondContact O-CB 3.47Å; I109-A113 PolarHBondContact O-N 3.14Å; F110-A113 PolarHBondContact O-N 2.79Å
114	L	58.9	Low	57.8	Low	120 Å²	120	87.6 Å²	87.6	63%	0.628	50%	0.497	S	S	*	.	H	α-helix	trans	-79.5	-33.5	175.2	-69.2	169.6	0	0	0	112.2	F110 I111 T112 V116 H117	F110-L114 VanDerWaalsContact O-CB 3.29Å; F110-L114 WeakPolarHBondContact O-CB 3.48Å; F110-L114 WeakPolarHBondContact O-CD1 3.4Å; F110-L114 WeakPolarHBondContact O-CG 3.26Å; F110-L114 PolarHBondContact O-N 2.89Å; I111-L114 PolarHBondContact O-N 2.91Å; T112-L114 VanDerWaalsContact C-N 3.31Å; T112-L114 PolarHBondContact O-N 3.44Å; L114-V116 VanDerWaalsContact C-N 3.33Å; L114-H117 PolarHBondContact O-N 3.03Å
115	G	57	Low	57.1	Low	45 Å²	45	91.3 Å²	91.3	46%	0.464	52%	0.519	S	S	.	.	H	α-helix	trans	-74	-20.4	176.9	0	0	0	0	0	114	I111 T112 H117	I111-G115 PolarHBondContact O-N 3Å; T112-G115 PolarHBondContact O-N 3.5Å; G115-H117 VanDerWaalsContact C-N 3.3Å
116	V	51.6	Low	56.7	Low	113 Å²	113	95.4 Å²	95.4	69%	0.685	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-3.1	175.9	97.1	0	0	0	0	113.4	T112 L114	T112-V116 PolarHBondContact O-N 3.46Å; T112-V116 VanDerWaalsContact O-N 3.1Å; L114-V116 VanDerWaalsContact C-N 3.33Å
117	H	41.2	Very low	56.1	Low	159 Å²	159	98.3 Å²	98.3	74%	0.736	56%	0.556	S	S	*	*			trans	-107.1	53.4	176.6	-88.2	101.5	0	0	0	112.6	L114 G115	L114-H117 PolarHBondContact O-N 3.03Å; G115-H117 VanDerWaalsContact C-N 3.3Å
118	Q	39.8	Very low	55.4	Low	142 Å²	142	101 Å²	101	66%	0.664	57%	0.569	S	S	*	*			trans	-123.1	116	155.5	-116.3	-178.9	-104	0	0	108.7
119	P	43.1	Very low	54.6	Low	199 Å²	199	108.4 Å²	108.4	100%	1.292	61%	0.611	S	S	*	*			trans	-63.2	0	178.3	28.3	-34.8	0	0	0	112.6

Retrieved 119 of 119 residues in 84.1 ms (Link to these results)

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