A0A093HNK7_STRCA Loading...

Cyclin-dependent kinase inhibitor 1B

Important regulator of cell cycle progression. Inhibits the kinase activity of CDK2 bound to cyclin A, but has little inhibitory activity on CDK2 bound to SPDYA. Involved in G1 arrest. Potent inhibitor of cyclin E- and cyclin A-CDK2 complexes. Forms a complex with cyclin type D-CDK4 complexes and is involved in the assembly, stability, and modulation of CCND1-CDK4 complex activation. Acts either as an inhibitor or an activator of cyclin type D-CDK4 complexes depending on its phosphorylation state and/or stoichometry.

AlphaFold DB , UniProt , Accession A0A093HNK7, Species STRCA (Struthio camelus australis), Gene n/a, Length 198 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.6	Very low	57.2	Low	234 Å²	234	141.5 Å²	141.5	100%	1.153	81%	0.808	S	S	*	*				0	106.9	0	-62.3	174	82.4	0	0	107
2	S	54.9	Low	57.4	Low	107 Å²	107	140.1 Å²	140.1	75%	0.748	80%	0.804	S	S	*	*			trans	-85.1	114.6	-173.1	48.5	0	0	0	0	110.8	V4	S2-V4 PolarHBondContact O-N 3.28Å; S2-V4 VanDerWaalsContact O-N 3.14Å
3	N	54.4	Low	57.4	Low	161 Å²	161	142.8 Å²	142.8	86%	0.861	81%	0.813	S	S	*	*			trans	-78.9	92.9	175	-60	-36.5	0	0	0	109.3	R5	N3-R5 PolarHBondContact O-N 3.49Å
4	V	62.5	Low	57.7	Low	110 Å²	110	144.4 Å²	144.4	67%	0.667	81%	0.81	S	S	*	*			trans	-80.9	109.5	173.6	-179.9	0	0	0	0	108.2	S2 I6	S2-V4 PolarHBondContact O-N 3.28Å; S2-V4 VanDerWaalsContact O-N 3.14Å; V4-I6 HydrophobicContact CG1-CG1 3.95Å; V4-I6 PolarHBondContact O-N 2.95Å
5	R	68.1	Low	57.7	Low	240 Å²	240	150.7 Å²	150.7	91%	0.906	82%	0.816	S	S	*	*			trans	-82.4	104	167.1	-72.5	-153.9	-87.5	152.1	-9.7	108.5	N3 S7	N3-R5 PolarHBondContact O-N 3.49Å; R5-S7 PolarHBondContact O-N 3.48Å
6	I	59.8	Low	57.5	Low	137 Å²	137	150.9 Å²	150.9	70%	0.703	81%	0.813	S	S	*	*			trans	-82.5	105.2	170.4	-49	158.4	0	0	0	105.3	V4 N8	V4-I6 HydrophobicContact CG1-CG1 3.95Å; V4-I6 PolarHBondContact O-N 2.95Å; I6-N8 PolarHBondContact O-N 3.2Å
7	S	62.8	Low	57.7	Low	114 Å²	114	151.8 Å²	151.8	80%	0.797	81%	0.811	S	S	*	*			trans	-65.2	115.6	172.3	-85.3	0	0	0	0	109.3	R5 G9	R5-S7 PolarHBondContact O-N 3.48Å; S7-G9 PolarHBondContact O-N 2.69Å
8	N	57.6	Low	58	Low	162 Å²	162	148.1 Å²	148.1	87%	0.866	81%	0.805	S	S	*	*			trans	-74.5	78.8	166.4	-63.3	-9.6	0	0	0	108.6	I6	I6-N8 PolarHBondContact O-N 3.2Å
9	G	57.4	Low	57.9	Low	62 Å²	62	151.3 Å²	151.3	64%	0.639	80%	0.803	S	S	*	*			trans	-116.3	71.2	170.7	0	0	0	0	0	109.3	S7 P11	S7-G9 PolarHBondContact O-N 2.69Å; G9-P11 WeakPolarHBondContact O-CD 3.03Å
10	S	55.1	Low	57.9	Low	113 Å²	113	151.9 Å²	151.9	79%	0.79	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-59	119.9	163.5	-63.6	0	0	0	0	106.6	T12	S10-T12 PolarHBondContact O-N 2.87Å; S10-T12 VanDerWaalsContact O-N 3.12Å
11	P	55.3	Low	57.8	Low	117 Å²	117	149.2 Å²	149.2	76%	0.76	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-61.5	123.3	175	25.6	-29.1	0	0	0	106.2	G9 L13	G9-P11 WeakPolarHBondContact O-CD 3.03Å; P11-L13 PolarHBondContact O-N 2.73Å
12	T	59.1	Low	58.8	Low	124 Å²	124	146.2 Å²	146.2	76%	0.761	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-46.5	127.2	171.7	-48.1	0	0	0	0	107.2	S10 E14	S10-T12 PolarHBondContact O-N 2.87Å; S10-T12 VanDerWaalsContact O-N 3.12Å; T12-E14 PolarHBondContact O-N 3.44Å
13	L	57.5	Low	59.5	Low	175 Å²	175	150.5 Å²	150.5	92%	0.916	78%	0.78	S	S	*	*			trans	-65.8	66.9	167.4	-75.8	171.5	0	0	0	108.1	P11 R15	P11-L13 PolarHBondContact O-N 2.73Å; L13-R15 PolarHBondContact O-N 2.91Å
14	E	61.6	Low	60.9	Low	165 Å²	165	148.4 Å²	148.4	77%	0.771	78%	0.775	S	S	*	*			trans	-58.6	104.1	154.5	-76.5	-160.2	155.3	0	0	104.6	T12 M16	T12-E14 PolarHBondContact O-N 3.44Å; E14-M16 VanDerWaalsContact C-N 3.3Å; E14-M16 PolarHBondContact O-N 3.45Å
15	R	58.3	Low	62	Low	239 Å²	239	151.5 Å²	151.5	90%	0.902	78%	0.78	S	S	*	*			trans	-32.1	97.4	166.8	-171.2	-174.6	-155.8	86.7	-1.5	107.3	L13 E17	L13-R15 PolarHBondContact O-N 2.91Å; R15-E17 VanDerWaalsContact C-N 3.25Å; R15-E17 PolarHBondContact O-N 3.11Å
16	M	53.7	Low	63.1	Low	155 Å²	155	144.3 Å²	144.3	76%	0.764	76%	0.764	S	S	*	*			trans	-55.9	104.1	170.7	-86.3	-176.8	174.4	0	0	104.2	E14 A18	E14-M16 VanDerWaalsContact C-N 3.3Å; E14-M16 PolarHBondContact O-N 3.45Å; M16-A18 PolarHBondContact O-N 3.09Å; M16-A18 VanDerWaalsContact O-N 3.15Å
17	E	61.8	Low	64.6	Low	166 Å²	166	142.6 Å²	142.6	78%	0.776	76%	0.764	S	S	*	*			trans	-45.9	125.5	161.8	-179.2	172.1	-176	0	0	105.1	R15 R19	R15-E17 VanDerWaalsContact C-N 3.25Å; R15-E17 PolarHBondContact O-N 3.11Å; E17-R19 PolarHBondContact O-N 3.11Å
18	A	61.6	Low	66.1	Low	85 Å²	85	141 Å²	141	70%	0.702	76%	0.758	S	S	*	*			trans	-45.2	114.4	-175	0	0	0	0	0	107	M16 Q20	M16-A18 PolarHBondContact O-N 3.09Å; M16-A18 VanDerWaalsContact O-N 3.15Å; A18-Q20 VanDerWaalsContact C-N 3.33Å; A18-Q20 PolarHBondContact O-N 2.93Å
19	R	57	Low	67.8	Low	208 Å²	208	137.6 Å²	137.6	79%	0.785	75%	0.745	S	S	*	*			trans	-48.3	110	172.9	-69.5	-110.7	-177.1	157.7	0.2	104.1	E17 S21	E17-R19 PolarHBondContact O-N 3.11Å; R19-S21 PolarHBondContact O-N 2.91Å
20	Q	56.9	Low	69.6	Low	163 Å²	163	142.7 Å²	142.7	76%	0.762	75%	0.745	S	S	*	*			trans	-49.6	117	173.9	-67	-156.8	-9.6	0	0	104.3	A18 E22	A18-Q20 VanDerWaalsContact C-N 3.33Å; A18-Q20 PolarHBondContact O-N 2.93Å; Q20-E22 PolarHBondContact O-N 3.03Å
21	S	56.9	Low	71.5	Confident	96 Å²	96	142.3 Å²	142.3	67%	0.671	74%	0.735	S	S	*	*			trans	-70.2	76.9	178.7	44.4	0	0	0	0	105.7	R19 Y23	R19-S21 PolarHBondContact O-N 2.91Å; S21-Y23 PolarHBondContact O-N 2.72Å
22	E	61.5	Low	73.5	Confident	172 Å²	172	142.8 Å²	142.8	80%	0.804	73%	0.73	S	S	*	*			trans	-77.5	58.6	178.3	-162.9	157.3	-145.3	0	0	107.7	Q20 P24	Q20-E22 PolarHBondContact O-N 3.03Å; E22-P24 WeakPolarHBondContact O-CD 3.33Å
23	Y	70.7	Confident	75.3	Confident	196 Å²	196	146.4 Å²	146.4	77%	0.769	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-72	121.4	156.9	-67.6	-75.9	0	0	0	105.9	S21 K25	S21-Y23 PolarHBondContact O-N 2.72Å; Y23-K25 PolarHBondContact O-N 3.41Å
24	P	84	Confident	77.1	Confident	118 Å²	118	139.5 Å²	139.5	77%	0.766	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-56.9	131.1	176.4	20.6	-29.7	0	0	0	108.9	E22	E22-P24 WeakPolarHBondContact O-CD 3.33Å
25	K	85.7	Confident	78.8	Confident	175 Å²	175	137.9 Å²	137.9	76%	0.761	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-54.8	135.6	179.1	-70.6	174.2	-178.2	171.7	0	109	Y23 C29	Y23-K25 PolarHBondContact O-N 3.41Å; K25-C29 HydrophobicContact CB-CB 4.39Å
26	P	90.9	Very high	80.6	Confident	89 Å²	89	130.5 Å²	130.5	58%	0.578	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-52.7	145.3	173.4	-23.2	31.7	0	0	0	110.3	A28 C29	P26-A28 PolarHBondContact O-N 2.8Å; P26-C29 PolarHBondContact O-N 2.87Å
27	S	90.8	Very high	82.7	Confident	100 Å²	100	126.9 Å²	126.9	70%	0.699	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-15.4	-178.3	63.7	0	0	0	0	114.2	R30	S27-R30 VanDerWaalsContact O-CZ 3.25Å; S27-R30 PolarHBondContact O-NE 3.34Å; S27-R30 PolarHBondContact O-NH2 2.84Å
28	A	95.4	Very high	84.4	Confident	82 Å²	82	124.9 Å²	124.9	68%	0.678	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-25.2	175.1	0	0	0	0	0	113.6	P26 R30	P26-A28 PolarHBondContact O-N 2.8Å; A28-R30 PolarHBondContact O-N 3.17Å
29	C	93.3	Very high	86.1	Confident	89 Å²	89	127.5 Å²	127.5	60%	0.601	66%	0.663	S	S	*	*			trans	-81.2	65.3	-177.6	-62.8	0	0	0	0	111.4	K25 P26	K25-C29 HydrophobicContact CB-CB 4.39Å; P26-C29 PolarHBondContact O-N 2.87Å
30	R	95.1	Very high	88	Confident	169 Å²	169	122.1 Å²	122.1	64%	0.638	65%	0.647	S	S	*	*			trans	-123.2	150.1	-178.8	74.1	-178.1	88	171.8	10.7	111.3	S27 A28 L32	S27-R30 VanDerWaalsContact O-CZ 3.25Å; S27-R30 PolarHBondContact O-NE 3.34Å; S27-R30 PolarHBondContact O-NH2 2.84Å; A28-R30 PolarHBondContact O-N 3.17Å; R30-L32 HydrophobicContact CG-CD2 3.84Å
31	N	94.9	Very high	89.9	Confident	106 Å²	106	117.9 Å²	117.9	57%	0.567	63%	0.629	S	S	*	*			trans	-81.6	127.2	168.2	-172.2	-43.3	0	0	0	109.1	F33 G34	N31-F33 PolarHBondContact OD1-N 2.86Å; N31-G34 VanDerWaalsContact ND2-C 3.28Å; N31-G34 PolarHBondContact ND2-O 2.76Å; N31-G34 WeakPolarHBondContact OD1-CA 2.89Å; N31-G34 PolarHBondContact OD1-N 3.3Å; N31-G34 PolarHBondContact OD1-O 3.42Å; N31-G34 VanDerWaalsContact OD1-O 3.12Å
32	L	96.8	Very high	91.8	Very high	126 Å²	126	117.2 Å²	117.2	66%	0.66	62%	0.618	S	S	*	*	S	Bend	trans	-88.2	-29.2	-176.7	-61.3	179.1	0	0	0	113.9	R30	R30-L32 HydrophobicContact CG-CD2 3.84Å
33	F	96.9	Very high	93.6	Very high	201 Å²	201	116.1 Å²	116.1	88%	0.882	61%	0.607	S	S	*	*	S	Bend	trans	-133.6	6.5	-166.7	-58.3	-66.9	0	0	0	114.7	N31	N31-F33 PolarHBondContact OD1-N 2.86Å
34	G	96.1	Very high	94.9	Very high	29 Å²	29	110 Å²	110	30%	0.299	59%	0.587	S	S	.	*			trans	96	178.8	-179.4	0	0	0	0	0	114.8	N31	N31-G34 VanDerWaalsContact ND2-C 3.28Å; N31-G34 PolarHBondContact ND2-O 2.76Å; N31-G34 WeakPolarHBondContact OD1-CA 2.89Å; N31-G34 PolarHBondContact OD1-N 3.3Å; N31-G34 PolarHBondContact OD1-O 3.42Å; N31-G34 VanDerWaalsContact OD1-O 3.12Å
35	P	95.9	Very high	95.5	Very high	131 Å²	131	108.7 Å²	108.7	85%	0.851	57%	0.573	S	S	*	*			trans	-64.7	150.2	179.3	28.5	-34.5	0	0	0	111.5
36	V	97	Very high	96	Very high	84 Å²	84	107.5 Å²	107.5	51%	0.509	57%	0.568	S	S	.	*			trans	-113.5	139.2	-177.2	179.2	0	0	0	0	109.6	H38 L41	V36-H38 PolarHBondContact O-N 3.34Å; V36-L41 HydrophobicContact CG1-CB 4.22Å; V36-L41 HydrophobicContact CG1-CD2 3.88Å
37	N	96.8	Very high	96.3	Very high	80 Å²	80	108.8 Å²	108.8	43%	0.428	57%	0.565	S	S	.	*			trans	-77.1	106.4	168.6	-178	-30.6	0	0	0	109.2	E39 E40 L41	N37-E39 PolarHBondContact OD1-N 3.28Å; N37-E39 VanDerWaalsContact OD1-N 3.13Å; N37-E39 PolarHBondContact OD1-OE2 2.81Å; N37-E40 HydrophobicContact CB-CB 4.08Å; N37-E40 PolarHBondContact OD1-N 2.96Å; N37-L41 WeakPolarHBondContact O-CB 3.5Å; N37-L41 PolarHBondContact O-N 3.49Å
38	H	97.3	Very high	96.6	Very high	124 Å²	124	109.5 Å²	109.5	57%	0.574	56%	0.557	S	S	*	*	H	α-helix	trans	-73.1	-30	-174.9	-72.8	-73.3	0	0	0	113	V36 N42	V36-H38 PolarHBondContact O-N 3.34Å; H38-N42 VanDerWaalsContact O-CB 3.3Å; H38-N42 WeakPolarHBondContact O-CB 3.4Å; H38-N42 VanDerWaalsContact O-CG 3.31Å; H38-N42 PolarHBondContact O-N 3.42Å; H38-N42 VanDerWaalsContact O-N 3.11Å; H38-N42 PolarHBondContact O-ND2 2.9Å
39	E	97.5	Very high	96.6	Very high	139 Å²	139	108.6 Å²	108.6	65%	0.65	54%	0.544	S	S	*	.	H	α-helix	trans	-68.5	-42.8	177	-60.7	88.4	-179.4	0	0	111.3	N37 R43	N37-E39 PolarHBondContact OD1-N 3.28Å; N37-E39 VanDerWaalsContact OD1-N 3.13Å; N37-E39 PolarHBondContact OD1-OE2 2.81Å; E39-R43 PolarHBondContact O-N 3.08Å
40	E	97.3	Very high	96.7	Very high	96 Å²	96	110.1 Å²	110.1	45%	0.449	54%	0.541	S	S	.	.	H	α-helix	trans	-66.7	-50.3	177.5	-174	176	-176.9	0	0	111.8	N37 N42 R43 D44	N37-E40 HydrophobicContact CB-CB 4.08Å; N37-E40 PolarHBondContact OD1-N 2.96Å; E40-N42 VanDerWaalsContact C-N 3.28Å; E40-N42 PolarHBondContact O-N 2.81Å; E40-R43 WeakPolarHBondContact O-CB 3.35Å; E40-R43 PolarHBondContact O-N 2.99Å; E40-D44 PolarHBondContact O-N 3.2Å
41	L	97.1	Very high	96.7	Very high	74 Å²	74	106.3 Å²	106.3	39%	0.387	53%	0.53	S	S	.	.	H	α-helix	trans	-56.1	-44.3	178.1	177.3	63.6	0	0	0	111.8	V36 N37 R43 D44 L45	V36-L41 HydrophobicContact CG1-CB 4.22Å; V36-L41 HydrophobicContact CG1-CD2 3.88Å; N37-L41 WeakPolarHBondContact O-CB 3.5Å; N37-L41 PolarHBondContact O-N 3.49Å; L41-R43 VanDerWaalsContact C-N 3.3Å; L41-R43 PolarHBondContact O-N 2.77Å; L41-D44 PolarHBondContact O-N 3.47Å; L41-L45 HydrophobicContact CD1-CD1 4.08Å; L41-L45 HydrophobicContact CD1-CG 4.02Å; L41-L45 HydrophobicContact CG-CD1 3.94Å; L41-L45 HydrophobicContact CG-CG 4.3Å; L41-L45 WeakPolarHBondContact O-CB 3.27Å; L41-L45 VanDerWaalsContact O-CG 3.25Å; L41-L45 WeakPolarHBondContact O-CG 3.39Å; L41-L45 PolarHBondContact O-N 2.92Å
42	N	97.2	Very high	96.8	Very high	81 Å²	81	107.2 Å²	107.2	43%	0.433	53%	0.533	S	S	.	.	H	α-helix	trans	-64.3	-35.9	178.6	-82.7	-51.5	0	0	0	112.5	H38 E40 K46	H38-N42 VanDerWaalsContact O-CB 3.3Å; H38-N42 WeakPolarHBondContact O-CB 3.4Å; H38-N42 VanDerWaalsContact O-CG 3.31Å; H38-N42 PolarHBondContact O-N 3.42Å; H38-N42 VanDerWaalsContact O-N 3.11Å; H38-N42 PolarHBondContact O-ND2 2.9Å; E40-N42 VanDerWaalsContact C-N 3.28Å; E40-N42 PolarHBondContact O-N 2.81Å; N42-K46 WeakPolarHBondContact O-CB 3.18Å; N42-K46 WeakPolarHBondContact O-CG 3.47Å; N42-K46 PolarHBondContact O-N 3.13Å; N42-K46 VanDerWaalsContact O-N 3.09Å
43	R	98.3	Very high	96.6	Very high	150 Å²	150	105.6 Å²	105.6	57%	0.566	52%	0.522	S	S	*	.	H	α-helix	trans	-65.4	-46.3	176.2	-169	-171.7	-53.4	105.8	4.5	110.7	E39 E40 L41 K46 K47	E39-R43 PolarHBondContact O-N 3.08Å; E40-R43 WeakPolarHBondContact O-CB 3.35Å; E40-R43 PolarHBondContact O-N 2.99Å; L41-R43 VanDerWaalsContact C-N 3.3Å; L41-R43 PolarHBondContact O-N 2.77Å; R43-K46 PolarHBondContact O-N 2.93Å; R43-K47 WeakPolarHBondContact O-CB 3.39Å; R43-K47 PolarHBondContact O-N 3.36Å
44	D	97.8	Very high	96.5	Very high	66 Å²	66	99.3 Å²	99.3	35%	0.353	50%	0.495	S	S	.	.	H	α-helix	trans	-67.5	-42.7	-178.1	-68.7	-11.3	0	0	0	111.7	E40 L41 K46 K47 H48	E40-D44 PolarHBondContact O-N 3.2Å; L41-D44 PolarHBondContact O-N 3.47Å; D44-K46 PolarHBondContact O-N 3.44Å; D44-K47 WeakPolarHBondContact O-CB 3.27Å; D44-K47 PolarHBondContact O-N 3.03Å; D44-H48 PolarHBondContact O-CD2 3.46Å; D44-H48 VanDerWaalsContact O-CD2 3.23Å; D44-H48 PolarHBondContact O-N 3.42Å
45	L	97.2	Very high	96.5	Very high	91 Å²	91	100.2 Å²	100.2	48%	0.476	50%	0.5	S	S	.	.	H	α-helix	trans	-59.3	-47.5	174.1	-71.6	176.1	0	0	0	111.5	L41 K47 H48 C49	L41-L45 HydrophobicContact CD1-CD1 4.08Å; L41-L45 HydrophobicContact CD1-CG 4.02Å; L41-L45 HydrophobicContact CG-CD1 3.94Å; L41-L45 HydrophobicContact CG-CG 4.3Å; L41-L45 WeakPolarHBondContact O-CB 3.27Å; L41-L45 VanDerWaalsContact O-CG 3.25Å; L41-L45 WeakPolarHBondContact O-CG 3.39Å; L41-L45 PolarHBondContact O-N 2.92Å; L45-K47 VanDerWaalsContact C-N 3.34Å; L45-K47 PolarHBondContact O-N 3.43Å; L45-H48 PolarHBondContact O-N 3.24Å; L45-C49 PolarHBondContact O-N 2.93Å; L45-C49 PolarHBondContact O-SG 2.99Å
46	K	96.6	Very high	96.4	Very high	151 Å²	151	96.3 Å²	96.3	66%	0.657	48%	0.475	S	S	*	.	H	α-helix	trans	-62.2	-41.9	177.5	-75.3	174.3	-177.4	-178.5	0	112	N42 R43 D44 C49 K50	N42-K46 WeakPolarHBondContact O-CB 3.18Å; N42-K46 WeakPolarHBondContact O-CG 3.47Å; N42-K46 PolarHBondContact O-N 3.13Å; N42-K46 VanDerWaalsContact O-N 3.09Å; R43-K46 PolarHBondContact O-N 2.93Å; D44-K46 PolarHBondContact O-N 3.44Å; K46-C49 PolarHBondContact O-N 3.37Å; K46-K50 WeakPolarHBondContact O-CB 3.4Å; K46-K50 PolarHBondContact O-N 2.74Å
47	K	97.6	Very high	96.3	Very high	116 Å²	116	95 Å²	95	50%	0.504	46%	0.464	S	S	.	.	H	α-helix	trans	-58.3	-50	176.6	178.2	-176.5	168.8	-172.7	0	110.5	R43 D44 L45 K50 E51	R43-K47 WeakPolarHBondContact O-CB 3.39Å; R43-K47 PolarHBondContact O-N 3.36Å; D44-K47 WeakPolarHBondContact O-CB 3.27Å; D44-K47 PolarHBondContact O-N 3.03Å; L45-K47 VanDerWaalsContact C-N 3.34Å; L45-K47 PolarHBondContact O-N 3.43Å; K47-K50 PolarHBondContact O-N 2.95Å; K47-E51 WeakPolarHBondContact CE-OE1 3.32Å; K47-E51 IonicContact NZ-OE1 4Å; K47-E51 WeakPolarHBondContact O-CG 3.35Å; K47-E51 PolarHBondContact O-N 3.12Å
48	H	97.1	Very high	96.1	Very high	115 Å²	115	100 Å²	100	53%	0.532	48%	0.476	S	S	.	.	H	α-helix	trans	-65.7	-39.3	179.9	-73.2	-46.3	0	0	0	113.5	D44 L45 K50 E51 M52	D44-H48 PolarHBondContact O-CD2 3.46Å; D44-H48 VanDerWaalsContact O-CD2 3.23Å; D44-H48 PolarHBondContact O-N 3.42Å; L45-H48 PolarHBondContact O-N 3.24Å; H48-K50 VanDerWaalsContact C-N 3.35Å; H48-E51 IonicContact CE1-OE2 3.85Å; H48-E51 IonicContact ND1-OE2 3.08Å; H48-E51 PolarHBondContact ND1-OE2 3.32Å; H48-E51 VanDerWaalsContact ND1-OE2 3.08Å; H48-E51 PolarHBondContact O-N 2.87Å; H48-M52 PolarHBondContact O-N 2.91Å; H48-M52 VanDerWaalsContact O-N 3.12Å
49	C	94.3	Very high	96.1	Very high	62 Å²	62	99.8 Å²	99.8	42%	0.419	47%	0.474	S	S	.	.	H	α-helix	trans	-59.3	-47.6	172.7	-68.5	0	0	0	0	111.1	L45 K46 E51 M52 E53	L45-C49 PolarHBondContact O-N 2.93Å; L45-C49 PolarHBondContact O-SG 2.99Å; K46-C49 PolarHBondContact O-N 3.37Å; C49-E51 PolarHBondContact O-N 3.14Å; C49-M52 PolarHBondContact O-N 2.78Å; C49-E53 WeakPolarHBondContact O-CG 3.44Å; C49-E53 PolarHBondContact O-N 3.13Å
50	K	95.4	Very high	96	Very high	121 Å²	121	97.7 Å²	97.7	53%	0.526	46%	0.46	S	S	.	.	H	α-helix	trans	-62.1	-42.8	179.3	-173.6	172.5	-169.6	-84.1	0	112.5	K46 K47 H48 M52 E53 E54	K46-K50 WeakPolarHBondContact O-CB 3.4Å; K46-K50 PolarHBondContact O-N 2.74Å; K47-K50 PolarHBondContact O-N 2.95Å; H48-K50 VanDerWaalsContact C-N 3.35Å; K50-M52 VanDerWaalsContact C-N 3.31Å; K50-M52 PolarHBondContact O-N 3.02Å; K50-E53 PolarHBondContact O-N 2.84Å; K50-E54 WeakPolarHBondContact CE-OE1 3.35Å; K50-E54 HydrophobicContact CG-CG 4.41Å; K50-E54 WeakPolarHBondContact CG-OE1 3.17Å; K50-E54 IonicContact NZ-OE1 2.66Å; K50-E54 PolarHBondContact NZ-OE1 3.3Å; K50-E54 WeakPolarHBondContact O-CB 3.5Å; K50-E54 VanDerWaalsContact O-CG 3.31Å; K50-E54 WeakPolarHBondContact O-CG 3.41Å; K50-E54 PolarHBondContact O-N 3.01Å
51	E	96.3	Very high	95.9	Very high	89 Å²	89	93.6 Å²	93.6	42%	0.416	44%	0.441	S	S	.	.	H	α-helix	trans	-59.2	-42.8	176.2	-75.3	169.9	172.6	0	0	111.8	K47 H48 C49 A55	K47-E51 WeakPolarHBondContact CE-OE1 3.32Å; K47-E51 IonicContact NZ-OE1 4Å; K47-E51 WeakPolarHBondContact O-CG 3.35Å; K47-E51 PolarHBondContact O-N 3.12Å; H48-E51 IonicContact CE1-OE2 3.85Å; H48-E51 IonicContact ND1-OE2 3.08Å; H48-E51 PolarHBondContact ND1-OE2 3.32Å; H48-E51 VanDerWaalsContact ND1-OE2 3.08Å; H48-E51 PolarHBondContact O-N 2.87Å; C49-E51 PolarHBondContact O-N 3.14Å; E51-A55 VanDerWaalsContact O-CB 3.32Å; E51-A55 WeakPolarHBondContact O-CB 3.37Å; E51-A55 PolarHBondContact O-N 3.39Å
52	M	95.5	Very high	95.9	Very high	126 Å²	126	91.1 Å²	91.1	62%	0.621	43%	0.427	S	S	*	.	H	α-helix	trans	-67.1	-43.9	177.2	-175.7	172	61.6	0	0	111.8	H48 C49 K50 A55 C56	H48-M52 PolarHBondContact O-N 2.91Å; H48-M52 VanDerWaalsContact O-N 3.12Å; C49-M52 PolarHBondContact O-N 2.78Å; K50-M52 VanDerWaalsContact C-N 3.31Å; K50-M52 PolarHBondContact O-N 3.02Å; M52-A55 PolarHBondContact O-N 3.21Å; M52-C56 WeakPolarHBondContact O-CB 3.28Å; M52-C56 PolarHBondContact O-N 3.08Å; M52-C56 PolarHBondContact O-SG 3.44Å; M52-C56 VanDerWaalsContact O-SG 3.34Å
53	E	93.4	Very high	95.7	Very high	91 Å²	91	88.5 Å²	88.5	43%	0.425	41%	0.414	S	S	.	.	H	α-helix	trans	-60	-47.8	175.8	-74.3	165.8	-161.7	0	0	111.5	C49 K50 A55 C56 Q57	C49-E53 WeakPolarHBondContact O-CG 3.44Å; C49-E53 PolarHBondContact O-N 3.13Å; K50-E53 PolarHBondContact O-N 2.84Å; E53-A55 PolarHBondContact O-N 2.8Å; E53-C56 PolarHBondContact O-N 3.23Å; E53-Q57 VanDerWaalsContact O-CB 3.27Å; E53-Q57 WeakPolarHBondContact O-CB 3.37Å; E53-Q57 PolarHBondContact O-N 3.45Å
54	E	95.2	Very high	95.4	Very high	69 Å²	69	86.4 Å²	86.4	32%	0.322	41%	0.409	S	S	.	.	H	α-helix	trans	-63.4	-39.4	177.6	-74.5	178.1	-168.5	0	0	112.3	K50 Q57 R58	K50-E54 WeakPolarHBondContact CE-OE1 3.35Å; K50-E54 HydrophobicContact CG-CG 4.41Å; K50-E54 WeakPolarHBondContact CG-OE1 3.17Å; K50-E54 IonicContact NZ-OE1 2.66Å; K50-E54 PolarHBondContact NZ-OE1 3.3Å; K50-E54 WeakPolarHBondContact O-CB 3.5Å; K50-E54 VanDerWaalsContact O-CG 3.31Å; K50-E54 WeakPolarHBondContact O-CG 3.41Å; K50-E54 PolarHBondContact O-N 3.01Å; E54-Q57 PolarHBondContact O-N 3.33Å; E54-R58 VanDerWaalsContact O-CB 3.28Å; E54-R58 WeakPolarHBondContact O-CB 3.27Å; E54-R58 PolarHBondContact O-N 2.91Å
55	A	95.3	Very high	95	Very high	49 Å²	49	90.4 Å²	90.4	41%	0.405	43%	0.425	S	S	.	.	H	α-helix	trans	-65	-42.7	176.5	0	0	0	0	0	111.2	E51 M52 E53 K59	E51-A55 VanDerWaalsContact O-CB 3.32Å; E51-A55 WeakPolarHBondContact O-CB 3.37Å; E51-A55 PolarHBondContact O-N 3.39Å; M52-A55 PolarHBondContact O-N 3.21Å; E53-A55 PolarHBondContact O-N 2.8Å; A55-K59 VanDerWaalsContact O-CB 3.27Å; A55-K59 WeakPolarHBondContact O-CB 3.27Å; A55-K59 PolarHBondContact O-N 3.19Å
56	C	94	Very high	94.7	Very high	48 Å²	48	90.9 Å²	90.9	32%	0.324	43%	0.428	S	S	.	.	H	α-helix	trans	-64.8	-46.9	174.2	-74.6	0	0	0	0	111.8	M52 E53 R58 K59 W60 F64	M52-C56 WeakPolarHBondContact O-CB 3.28Å; M52-C56 PolarHBondContact O-N 3.08Å; M52-C56 PolarHBondContact O-SG 3.44Å; M52-C56 VanDerWaalsContact O-SG 3.34Å; E53-C56 PolarHBondContact O-N 3.23Å; C56-R58 VanDerWaalsContact C-N 3.34Å; C56-R58 PolarHBondContact O-N 2.95Å; C56-K59 PolarHBondContact O-N 3.27Å; C56-W60 WeakPolarHBondContact O-CB 3.36Å; C56-W60 VanDerWaalsContact O-CD1 3.23Å; C56-W60 PolarHBondContact O-N 3.47Å; C56-F64 HydrophobicContact CB-CD2 4.25Å; C56-F64 HydrophobicContact CB-CE2 3.81Å
57	Q	94.3	Very high	94.5	Very high	58 Å²	58	90.8 Å²	90.8	27%	0.271	43%	0.43	S	S	.	.	H	α-helix	trans	-59.1	-45.1	178.4	-178.7	-179.8	35	0	0	111.1	E53 E54 N61 F62 L70	E53-Q57 VanDerWaalsContact O-CB 3.27Å; E53-Q57 WeakPolarHBondContact O-CB 3.37Å; E53-Q57 PolarHBondContact O-N 3.45Å; E54-Q57 PolarHBondContact O-N 3.33Å; Q57-N61 WeakPolarHBondContact O-CA 3.42Å; Q57-N61 PolarHBondContact O-N 2.66Å; Q57-F62 WeakPolarHBondContact CA-O 3.4Å; Q57-F62 WeakPolarHBondContact CG-O 3.34Å; Q57-F62 PolarHBondContact O-N 2.94Å; Q57-L70 HydrophobicContact CG-CD1 3.68Å
58	R	94.4	Very high	94.2	Very high	183 Å²	183	91.9 Å²	91.9	69%	0.691	44%	0.435	S	S	*	.	H	α-helix	trans	-66.7	-38.7	177.2	-165.9	-175	-53	114.9	7.3	112.3	E54 C56	E54-R58 VanDerWaalsContact O-CB 3.28Å; E54-R58 WeakPolarHBondContact O-CB 3.27Å; E54-R58 PolarHBondContact O-N 2.91Å; C56-R58 VanDerWaalsContact C-N 3.34Å; C56-R58 PolarHBondContact O-N 2.95Å
59	K	96.1	Very high	94.1	Very high	121 Å²	121	89.8 Å²	89.8	53%	0.526	43%	0.431	S	S	.	.	H	α-helix	trans	-67.6	-42.5	178.8	-177.6	172.6	179.8	176.6	0	111.6	A55 C56 R73	A55-K59 VanDerWaalsContact O-CB 3.27Å; A55-K59 WeakPolarHBondContact O-CB 3.27Å; A55-K59 PolarHBondContact O-N 3.19Å; C56-K59 PolarHBondContact O-N 3.27Å; K59-R73 PolarHBondContact O-NH1 2.91Å
60	W	96.4	Very high	94	Very high	94 Å²	94	90.3 Å²	90.3	36%	0.356	43%	0.43	S	S	.	.	H	α-helix	trans	-102	-4.7	-170.9	-66.5	113.2	0	0	0	114.1	C56 F62 F64 Y74 W76	C56-W60 WeakPolarHBondContact O-CB 3.36Å; C56-W60 VanDerWaalsContact O-CD1 3.23Å; C56-W60 PolarHBondContact O-N 3.47Å; W60-F62 HydrophobicContact CB-CB 4.36Å; W60-F62 PolarHBondContact O-N 2.97Å; W60-F64 HydrophobicContact CB-CE2 4.43Å; W60-F64 HydrophobicContact CB-CZ 4.25Å; W60-F64 HydrophobicContact CG-CZ 4.38Å; W60-Y74 HydrophobicContact CD2-CE2 4.36Å; W60-Y74 HydrophobicContact CE3-CD2 4.03Å; W60-Y74 AromaticContact CE3-CE2 3.43Å; W60-Y74 HydrophobicContact CE3-CE2 3.43Å; W60-Y74 VanDerWaalsContact CE3-CE2 3.43Å; W60-Y74 AromaticContact CE3-CZ 3.78Å; W60-Y74 HydrophobicContact CZ3-CE1 4.42Å; W60-Y74 AromaticContact CZ3-CE2 3.83Å; W60-Y74 HydrophobicContact CZ3-CE2 3.83Å; W60-Y74 AromaticContact CZ3-CZ 3.66Å; W60-Y74 WeakPolarHBondContact CZ3-OH 3.37Å; W60-W76 HydrophobicContact CB-CZ2 4.11Å; W60-W76 HydrophobicContact CE3-CZ2 4.4Å; W60-W76 WeakPolarHBondContact O-CZ2 3.2Å; W60-W76 PolarHBondContact O-NE1 3.4Å
61	N	95.4	Very high	93.8	Very high	11 Å²	11	94.1 Å²	94.1	6%	0.059	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	43	45.4	-169.1	63.2	-92.9	0	0	0	111.9	Q57 L70 R73 Y74 W76	Q57-N61 WeakPolarHBondContact O-CA 3.42Å; Q57-N61 PolarHBondContact O-N 2.66Å; N61-L70 HydrophobicContact CB-CB 4.38Å; N61-L70 PolarHBondContact ND2-O 3.09Å; N61-L70 CarbonylContact O-C 3.54Å; N61-L70 WeakPolarHBondContact O-CA 3.32Å; N61-L70 WeakPolarHBondContact O-CB 3.37Å; N61-L70 PolarHBondContact O-N 3.38Å; N61-R73 WeakPolarHBondContact OD1-CG 3.31Å; N61-R73 PolarHBondContact OD1-N 3.43Å; N61-Y74 PolarHBondContact ND2-O 2.74Å; N61-Y74 WeakPolarHBondContact OD1-CB 3.48Å; N61-Y74 VanDerWaalsContact OD1-CD2 3.27Å; N61-Y74 WeakPolarHBondContact OD1-CD2 3.35Å; N61-Y74 PolarHBondContact OD1-N 3.13Å; N61-W76 PolarHBondContact ND2-NE1 2.96Å; N61-W76 PolarHBondContact O-NE1 2.9Å
62	F	95.3	Very high	93.6	Very high	21 Å²	21	92.7 Å²	92.7	9%	0.092	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	127.4	179	-169.3	-87.2	0	0	0	108.9	Q57 W60 F64 P69 W76	Q57-F62 WeakPolarHBondContact CA-O 3.4Å; Q57-F62 WeakPolarHBondContact CG-O 3.34Å; Q57-F62 PolarHBondContact O-N 2.94Å; W60-F62 HydrophobicContact CB-CB 4.36Å; W60-F62 PolarHBondContact O-N 2.97Å; F62-F64 HydrophobicContact CB-CE2 4.48Å; F62-F64 HydrophobicContact CB-CZ 4.37Å; F62-F64 AromaticContact CD1-CD1 3.78Å; F62-F64 HydrophobicContact CD1-CD1 3.78Å; F62-F64 HydrophobicContact CD1-CD2 4.44Å; F62-F64 AromaticContact CD1-CE1 3.89Å; F62-F64 HydrophobicContact CD1-CE1 3.89Å; F62-F64 HydrophobicContact CD1-CG 4.08Å; F62-F64 HydrophobicContact CD1-CZ 4.26Å; F62-F64 HydrophobicContact CE1-CD1 4.18Å; F62-F64 WeakPolarHBondContact O-CD2 2.95Å; F62-F64 PolarHBondContact O-N 3.43Å; F62-P69 HydrophobicContact CD2-CB 3.97Å; F62-P69 HydrophobicContact CE2-CB 4.18Å; F62-W76 HydrophobicContact CB-CZ2 3.96Å; F62-W76 AromaticContact CD2-CD2 3.72Å; F62-W76 HydrophobicContact CD2-CD2 3.72Å; F62-W76 AromaticContact CD2-CE2 3.86Å; F62-W76 HydrophobicContact CD2-CE3 4.16Å; F62-W76 AromaticContact CD2-CG 3.92Å; F62-W76 HydrophobicContact CD2-CG 3.92Å; F62-W76 HydrophobicContact CD2-CZ2 4.44Å; F62-W76 HydrophobicContact CE2-CD2 4.44Å; F62-W76 HydrophobicContact CG-CZ2 4.46Å
63	D	93.7	Very high	93.6	Very high	27 Å²	27	94.4 Å²	94.4	14%	0.144	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	101.3	173.4	-175.3	-12.8	0	0	0	109.5	Q65 N66 H67 K68 L70	D63-Q65 VanDerWaalsContact C-N 3.27Å; D63-Q65 PolarHBondContact O-N 3.19Å; D63-Q65 WeakPolarHBondContact OD1-CB 3.49Å; D63-Q65 PolarHBondContact OD1-N 3Å; D63-N66 PolarHBondContact OD1-N 3.06Å; D63-N66 PolarHBondContact OD2-ND2 3.43Å; D63-H67 VanDerWaalsContact O-CA 3.27Å; D63-H67 WeakPolarHBondContact O-CA 3.47Å; D63-H67 PolarHBondContact O-N 3.46Å; D63-K68 WeakPolarHBondContact CA-O 3.25Å; D63-K68 WeakPolarHBondContact CB-O 3.41Å; D63-K68 PolarHBondContact N-O 3.47Å; D63-K68 PolarHBondContact O-N 3.28Å; D63-L70 HydrophobicContact CB-CD1 4.32Å; D63-L70 HydrophobicContact CB-CG 4.27Å
64	F	91.8	Very high	93.7	Very high	106 Å²	106	93.9 Å²	93.9	47%	0.465	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-24.3	178.8	-63.9	-80	0	0	0	113.2	C56 W60 F62	C56-F64 HydrophobicContact CB-CD2 4.25Å; C56-F64 HydrophobicContact CB-CE2 3.81Å; W60-F64 HydrophobicContact CB-CE2 4.43Å; W60-F64 HydrophobicContact CB-CZ 4.25Å; W60-F64 HydrophobicContact CG-CZ 4.38Å; F62-F64 HydrophobicContact CB-CE2 4.48Å; F62-F64 HydrophobicContact CB-CZ 4.37Å; F62-F64 AromaticContact CD1-CD1 3.78Å; F62-F64 HydrophobicContact CD1-CD1 3.78Å; F62-F64 HydrophobicContact CD1-CD2 4.44Å; F62-F64 AromaticContact CD1-CE1 3.89Å; F62-F64 HydrophobicContact CD1-CE1 3.89Å; F62-F64 HydrophobicContact CD1-CG 4.08Å; F62-F64 HydrophobicContact CD1-CZ 4.26Å; F62-F64 HydrophobicContact CE1-CD1 4.18Å; F62-F64 WeakPolarHBondContact O-CD2 2.95Å; F62-F64 PolarHBondContact O-N 3.43Å
65	Q	89.4	Confident	93.7	Very high	150 Å²	150	98.4 Å²	98.4	70%	0.701	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-44.1	-178.4	-176.3	64	13.3	0	0	111.1	D63	D63-Q65 VanDerWaalsContact C-N 3.27Å; D63-Q65 PolarHBondContact O-N 3.19Å; D63-Q65 WeakPolarHBondContact OD1-CB 3.49Å; D63-Q65 PolarHBondContact OD1-N 3Å
66	N	91.3	Very high	93.7	Very high	101 Å²	101	101 Å²	101	54%	0.54	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-4	178.8	-65.2	-53.4	0	0	0	113.1	D63 K68	D63-N66 PolarHBondContact OD1-N 3.06Å; D63-N66 PolarHBondContact OD2-ND2 3.43Å; N66-K68 VanDerWaalsContact C-N 3.29Å; N66-K68 HydrophobicContact CB-CB 4.49Å; N66-K68 HydrophobicContact CB-CD 4.34Å; N66-K68 HydrophobicContact CB-CG 4.37Å; N66-K68 PolarHBondContact O-N 2.9Å
67	H	91.4	Very high	93.6	Very high	149 Å²	149	105.5 Å²	105.5	69%	0.69	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	47.9	-172.6	-167	-82.3	0	0	0	111.8	D63	D63-H67 VanDerWaalsContact O-CA 3.27Å; D63-H67 WeakPolarHBondContact O-CA 3.47Å; D63-H67 PolarHBondContact O-N 3.46Å
68	K	92.4	Very high	93.5	Very high	138 Å²	138	108.1 Å²	108.1	60%	0.6	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128	136.1	-177.7	-73.9	179.9	-176	-176	0	110.8	D63 N66	D63-K68 WeakPolarHBondContact CA-O 3.25Å; D63-K68 WeakPolarHBondContact CB-O 3.41Å; D63-K68 PolarHBondContact N-O 3.47Å; D63-K68 PolarHBondContact O-N 3.28Å; N66-K68 VanDerWaalsContact C-N 3.29Å; N66-K68 HydrophobicContact CB-CB 4.49Å; N66-K68 HydrophobicContact CB-CD 4.34Å; N66-K68 HydrophobicContact CB-CG 4.37Å; N66-K68 PolarHBondContact O-N 2.9Å
69	P	94.8	Very high	93.3	Very high	71 Å²	71	103 Å²	103	46%	0.461	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	146.2	171.3	32.2	-35	0	0	0	110.8	F62 W76	F62-P69 HydrophobicContact CD2-CB 3.97Å; F62-P69 HydrophobicContact CE2-CB 4.18Å; P69-W76 HydrophobicContact CB-CB 3.34Å; P69-W76 HydrophobicContact CB-CG 3.66Å; P69-W76 HydrophobicContact CG-CB 4.12Å
70	L	92.7	Very high	93	Very high	74 Å²	74	104.8 Å²	104.8	39%	0.387	52%	0.52	S	S	.	.			trans	-107.4	154.1	170.6	-61.4	170.7	0	0	0	109	Q57 N61 D63	Q57-L70 HydrophobicContact CG-CD1 3.68Å; N61-L70 HydrophobicContact CB-CB 4.38Å; N61-L70 PolarHBondContact ND2-O 3.09Å; N61-L70 CarbonylContact O-C 3.54Å; N61-L70 WeakPolarHBondContact O-CA 3.32Å; N61-L70 WeakPolarHBondContact O-CB 3.37Å; N61-L70 PolarHBondContact O-N 3.38Å; D63-L70 HydrophobicContact CB-CD1 4.32Å; D63-L70 HydrophobicContact CB-CG 4.27Å
71	E	91.9	Very high	92.2	Very high	200 Å²	200	106.9 Å²	106.9	94%	0.935	53%	0.532	S	S	*	.	S	Bend	trans	-64.5	136.5	172.4	-65.4	178.1	-173.9	0	0	110.1
72	G	91.8	Very high	91.8	Very high	60 Å²	60	110 Å²	110	62%	0.619	57%	0.566	S	S	*	*	S	Bend	trans	168.2	-150.2	-179.2	0	0	0	0	0	113.2	Y74	G72-Y74 VanDerWaalsContact C-N 3.33Å; G72-Y74 PolarHBondContact O-N 2.88Å
73	R	94.8	Very high	91.5	Very high	162 Å²	162	112.9 Å²	112.9	61%	0.611	59%	0.589	S	S	*	*	S	Bend	trans	-68.6	-26.3	-174.9	57.5	-178	-75.8	-133.9	2.6	114.4	K59 N61	K59-R73 PolarHBondContact O-NH1 2.91Å; N61-R73 WeakPolarHBondContact OD1-CG 3.31Å; N61-R73 PolarHBondContact OD1-N 3.43Å
74	Y	94.5	Very high	91.3	Very high	79 Å²	79	113.2 Å²	113.2	31%	0.31	59%	0.593	S	S	.	*	S	Bend	trans	-108	131.4	178.1	-64.5	-70.2	0	0	0	110.4	W60 N61 G72	W60-Y74 HydrophobicContact CD2-CE2 4.36Å; W60-Y74 HydrophobicContact CE3-CD2 4.03Å; W60-Y74 AromaticContact CE3-CE2 3.43Å; W60-Y74 HydrophobicContact CE3-CE2 3.43Å; W60-Y74 VanDerWaalsContact CE3-CE2 3.43Å; W60-Y74 AromaticContact CE3-CZ 3.78Å; W60-Y74 HydrophobicContact CZ3-CE1 4.42Å; W60-Y74 AromaticContact CZ3-CE2 3.83Å; W60-Y74 HydrophobicContact CZ3-CE2 3.83Å; W60-Y74 AromaticContact CZ3-CZ 3.66Å; W60-Y74 WeakPolarHBondContact CZ3-OH 3.37Å; N61-Y74 PolarHBondContact ND2-O 2.74Å; N61-Y74 WeakPolarHBondContact OD1-CB 3.48Å; N61-Y74 VanDerWaalsContact OD1-CD2 3.27Å; N61-Y74 WeakPolarHBondContact OD1-CD2 3.35Å; N61-Y74 PolarHBondContact OD1-N 3.13Å; G72-Y74 VanDerWaalsContact C-N 3.33Å; G72-Y74 PolarHBondContact O-N 2.88Å
75	E	95.4	Very high	91.4	Very high	165 Å²	165	112.2 Å²	112.2	77%	0.771	60%	0.598	S	S	*	*			trans	-89.5	110.7	167.9	-168.3	-172.1	151.9	0	0	108.6	Q77	E75-Q77 PolarHBondContact OE1-NE2 3.27Å
76	W	95.6	Very high	91.5	Very high	104 Å²	104	109.4 Å²	109.4	39%	0.394	59%	0.587	S	S	.	*			trans	-91.4	131.3	-179.4	-69.6	97.1	0	0	0	110.7	W60 N61 F62 P69	W60-W76 HydrophobicContact CB-CZ2 4.11Å; W60-W76 HydrophobicContact CE3-CZ2 4.4Å; W60-W76 WeakPolarHBondContact O-CZ2 3.2Å; W60-W76 PolarHBondContact O-NE1 3.4Å; N61-W76 PolarHBondContact ND2-NE1 2.96Å; N61-W76 PolarHBondContact O-NE1 2.9Å; F62-W76 HydrophobicContact CB-CZ2 3.96Å; F62-W76 AromaticContact CD2-CD2 3.72Å; F62-W76 HydrophobicContact CD2-CD2 3.72Å; F62-W76 AromaticContact CD2-CE2 3.86Å; F62-W76 HydrophobicContact CD2-CE3 4.16Å; F62-W76 AromaticContact CD2-CG 3.92Å; F62-W76 HydrophobicContact CD2-CG 3.92Å; F62-W76 HydrophobicContact CD2-CZ2 4.44Å; F62-W76 HydrophobicContact CE2-CD2 4.44Å; F62-W76 HydrophobicContact CG-CZ2 4.46Å; P69-W76 HydrophobicContact CB-CB 3.34Å; P69-W76 HydrophobicContact CB-CG 3.66Å; P69-W76 HydrophobicContact CG-CB 4.12Å
77	Q	93.1	Very high	91.6	Very high	141 Å²	141	112.3 Å²	112.3	66%	0.659	60%	0.596	S	S	*	*			trans	-122.5	137	177.2	-63.7	-179.1	7	0	0	110.2	E75	E75-Q77 PolarHBondContact OE1-NE2 3.27Å
78	A	90.6	Very high	91.6	Very high	113 Å²	113	113 Å²	113	93%	0.934	59%	0.593	S	S	*	*			trans	-79.3	122.9	171.4	0	0	0	0	0	108.8
79	V	90.9	Very high	91.5	Very high	75 Å²	75	109.7 Å²	109.7	46%	0.455	58%	0.579	S	S	.	*			trans	-113.9	135.1	-174.9	177.1	0	0	0	0	108.6	S83	V79-S83 WeakPolarHBondContact CG1-OG 3.35Å
80	E	89.1	Confident	91.4	Very high	159 Å²	159	113.7 Å²	113.7	74%	0.743	59%	0.585	S	S	*	*			trans	-68.4	142.8	178	-172.7	177	-167.6	0	0	110.6	G82 S83	E80-G82 PolarHBondContact O-N 3.33Å; E80-S83 PolarHBondContact O-N 3.41Å; E80-S83 PolarHBondContact O-OG 3.11Å
81	K	81.4	Confident	91.3	Very high	139 Å²	139	114.1 Å²	114.1	60%	0.604	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	-26.2	-175.9	-65.5	176.5	-175.9	-77.9	0	114	F89	K81-F89 HydrophobicContact CB-CD2 4.19Å; K81-F89 HydrophobicContact CB-CE2 4.34Å; K81-F89 HydrophobicContact CG-CD1 4.24Å; K81-F89 HydrophobicContact CG-CD2 4.18Å; K81-F89 HydrophobicContact CG-CE2 4.43Å; K81-F89 HydrophobicContact CG-CG 4.06Å
82	G	85.8	Confident	91.3	Very high	75 Å²	75	110.1 Å²	110.1	77%	0.773	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-13	178.3	0	0	0	0	0	115.2	E80	E80-G82 PolarHBondContact O-N 3.33Å
83	S	89.4	Confident	91.2	Very high	83 Å²	83	117.7 Å²	117.7	58%	0.58	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-8.1	-174.3	64.3	0	0	0	0	114.1	V79 E80	V79-S83 WeakPolarHBondContact CG1-OG 3.35Å; E80-S83 PolarHBondContact O-N 3.41Å; E80-S83 PolarHBondContact O-OG 3.11Å
84	S	90.4	Very high	90.7	Very high	33 Å²	33	116.4 Å²	116.4	23%	0.231	60%	0.598	C	S	.	*	S	Bend	trans	-132.9	161	174.6	56.7	0	0	0	0	111.4	D86 F89	S84-D86 PolarHBondContact O-N 3.04Å; S84-F89 WeakPolarHBondContact OG-CE2 3.36Å; S84-F89 WeakPolarHBondContact OG-CZ 3.3Å
85	P	93.4	Very high	89.8	Confident	86 Å²	86	120.3 Å²	120.3	56%	0.558	62%	0.623	S	S	*	*			trans	-55.3	139.2	-177.4	-27.6	35.4	0	0	0	113.1	F87 Y88	P85-F87 PolarHBondContact O-N 3.01Å; P85-Y88 HydrophobicContact CB-CD2 4.28Å; P85-Y88 HydrophobicContact CB-CE2 4.32Å; P85-Y88 HydrophobicContact CG-CD2 4.49Å; P85-Y88 HydrophobicContact CG-CE2 4.19Å; P85-Y88 WeakPolarHBondContact O-CD2 3.36Å; P85-Y88 PolarHBondContact O-N 3.19Å; P85-Y88 VanDerWaalsContact O-N 3.11Å
86	D	90.8	Very high	88.5	Confident	90 Å²	90	121.4 Å²	121.4	48%	0.481	63%	0.626	S	S	.	*	G	3₁₀ helix	trans	-49.7	-29.6	179.3	176.4	63.5	0	0	0	113.5	S84 Y88 F89 R90	S84-D86 PolarHBondContact O-N 3.04Å; D86-Y88 PolarHBondContact O-N 3.36Å; D86-Y88 VanDerWaalsContact O-N 3.11Å; D86-F89 PolarHBondContact O-N 3.36Å; D86-F89 VanDerWaalsContact O-N 3.09Å; D86-R90 WeakPolarHBondContact O-CB 3.36Å; D86-R90 PolarHBondContact O-N 2.97Å; D86-R90 IonicContact OD2-CZ 3.25Å; D86-R90 VanDerWaalsContact OD2-CZ 3.25Å; D86-R90 IonicContact OD2-NE 2.91Å; D86-R90 PolarHBondContact OD2-NE 3.35Å; D86-R90 IonicContact OD2-NH2 2.73Å; D86-R90 PolarHBondContact OD2-NH2 3.14Å
87	F	92.7	Very high	86.6	Confident	162 Å²	162	120.5 Å²	120.5	71%	0.711	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-49.6	-37.6	177.6	177.5	-99.7	0	0	0	114.2	P85 F89	P85-F87 PolarHBondContact O-N 3.01Å; F87-F89 VanDerWaalsContact C-N 3.33Å; F87-F89 PolarHBondContact O-N 3.06Å
88	Y	91.7	Very high	84.3	Confident	163 Å²	163	119.6 Å²	119.6	64%	0.639	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-75.4	-19	-176.1	-65.7	-72.4	0	0	0	114.2	P85 D86	P85-Y88 HydrophobicContact CB-CD2 4.28Å; P85-Y88 HydrophobicContact CB-CE2 4.32Å; P85-Y88 HydrophobicContact CG-CD2 4.49Å; P85-Y88 HydrophobicContact CG-CE2 4.19Å; P85-Y88 WeakPolarHBondContact O-CD2 3.36Å; P85-Y88 PolarHBondContact O-N 3.19Å; P85-Y88 VanDerWaalsContact O-N 3.11Å; D86-Y88 PolarHBondContact O-N 3.36Å; D86-Y88 VanDerWaalsContact O-N 3.11Å
89	F	90.6	Very high	82.1	Confident	70 Å²	70	119.7 Å²	119.7	31%	0.307	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119.1	-5.6	-178.5	-47.8	-74.5	0	0	0	113.6	K81 S84 D86 F87 P91	K81-F89 HydrophobicContact CB-CD2 4.19Å; K81-F89 HydrophobicContact CB-CE2 4.34Å; K81-F89 HydrophobicContact CG-CD1 4.24Å; K81-F89 HydrophobicContact CG-CD2 4.18Å; K81-F89 HydrophobicContact CG-CE2 4.43Å; K81-F89 HydrophobicContact CG-CG 4.06Å; S84-F89 WeakPolarHBondContact OG-CE2 3.36Å; S84-F89 WeakPolarHBondContact OG-CZ 3.3Å; D86-F89 PolarHBondContact O-N 3.36Å; D86-F89 VanDerWaalsContact O-N 3.09Å; F87-F89 VanDerWaalsContact C-N 3.33Å; F87-F89 PolarHBondContact O-N 3.06Å; F89-P91 WeakPolarHBondContact O-CD 3.34Å
90	R	92.6	Very high	80	Confident	155 Å²	155	125.6 Å²	125.6	59%	0.585	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-60.4	122.3	-179.4	176.6	177.9	-68.7	-146.8	-1.8	110.1	D86	D86-R90 WeakPolarHBondContact O-CB 3.36Å; D86-R90 PolarHBondContact O-N 2.97Å; D86-R90 IonicContact OD2-CZ 3.25Å; D86-R90 VanDerWaalsContact OD2-CZ 3.25Å; D86-R90 IonicContact OD2-NE 2.91Å; D86-R90 PolarHBondContact OD2-NE 3.35Å; D86-R90 IonicContact OD2-NH2 2.73Å; D86-R90 PolarHBondContact OD2-NH2 3.14Å
91	P	90.6	Very high	77.5	Confident	83 Å²	83	122.5 Å²	122.5	54%	0.539	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-68.4	156.8	175.9	28.3	-34.1	0	0	0	111.3	F89 R93	F89-P91 WeakPolarHBondContact O-CD 3.34Å; P91-R93 PolarHBondContact O-N 3.19Å
92	P	91.9	Very high	75.8	Confident	116 Å²	116	121 Å²	121	75%	0.753	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-53.8	137.3	173.6	-25.1	34.3	0	0	0	111.4	L94	P92-L94 PolarHBondContact O-N 3.31Å; P92-L94 VanDerWaalsContact O-N 3.13Å
93	R	89.6	Confident	74	Confident	218 Å²	218	120.9 Å²	120.9	82%	0.823	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-64.9	119.1	176.6	-65.7	-166	-64.4	-160.5	-1.4	108.8	P91 L95	P91-R93 PolarHBondContact O-N 3.19Å; R93-L95 PolarHBondContact O-N 2.92Å; R93-L95 VanDerWaalsContact O-N 3.08Å
94	L	84.1	Confident	72.1	Confident	135 Å²	135	125.3 Å²	125.3	71%	0.707	68%	0.675	S	S	*	*			trans	-60.1	115.7	166.6	-65.8	177.4	0	0	0	107.6	P92 K96 I117	P92-L94 PolarHBondContact O-N 3.31Å; P92-L94 VanDerWaalsContact O-N 3.13Å; L94-K96 VanDerWaalsContact C-N 3.34Å; L94-K96 PolarHBondContact O-N 2.95Å; L94-I117 HydrophobicContact CD2-CG2 4.19Å
95	L	75.4	Confident	70.2	Confident	161 Å²	161	131.8 Å²	131.8	84%	0.843	70%	0.702	S	S	*	*			trans	-65.2	102.6	169	-68.9	175.7	0	0	0	106.5	R93 A97	R93-L95 PolarHBondContact O-N 2.92Å; R93-L95 VanDerWaalsContact O-N 3.08Å; L95-A97 PolarHBondContact O-N 2.92Å
96	K	68.7	Low	68.3	Low	188 Å²	188	133 Å²	133	82%	0.817	71%	0.713	S	S	*	*			trans	-58	112.2	167.9	-166.3	168	-173.8	171.3	0	105.6	L94 V98	L94-K96 VanDerWaalsContact C-N 3.34Å; L94-K96 PolarHBondContact O-N 2.95Å; K96-V98 VanDerWaalsContact C-N 3.3Å; K96-V98 PolarHBondContact O-N 2.88Å
97	A	56.7	Low	66.9	Low	85 Å²	85	133.4 Å²	133.4	70%	0.702	71%	0.714	S	S	*	*			trans	-55.9	99.4	173.8	0	0	0	0	0	107.6	L95 C99	L95-A97 PolarHBondContact O-N 2.92Å; A97-C99 PolarHBondContact O-N 2.9Å
98	V	44.4	Very low	65.4	Low	123 Å²	123	128.2 Å²	128.2	75%	0.745	69%	0.694	S	S	*	*			trans	-78.5	70.7	167.9	-178.3	0	0	0	0	105.8	K96 K100	K96-V98 VanDerWaalsContact C-N 3.3Å; K96-V98 PolarHBondContact O-N 2.88Å; V98-K100 HydrophobicContact CG1-CB 4.43Å; V98-K100 PolarHBondContact O-N 2.77Å; V98-K100 VanDerWaalsContact O-N 3.14Å
99	C	44.4	Very low	64	Low	114 Å²	114	128.2 Å²	128.2	77%	0.77	71%	0.71	S	S	*	*			trans	-82.8	70.6	160	-66.5	0	0	0	0	107.3	A97 S101	A97-C99 PolarHBondContact O-N 2.9Å; C99-S101 VanDerWaalsContact C-N 3.28Å
100	K	45.7	Very low	62.7	Low	200 Å²	200	131.6 Å²	131.6	87%	0.87	73%	0.732	S	S	*	*			trans	-96.9	67.4	153.6	-72.8	-170.8	178.4	-177.4	0	107.7	V98	V98-K100 HydrophobicContact CG1-CB 4.43Å; V98-K100 PolarHBondContact O-N 2.77Å; V98-K100 VanDerWaalsContact O-N 3.14Å
101	S	36.4	Very low	60.7	Low	93 Å²	93	126.8 Å²	126.8	65%	0.65	73%	0.73	S	S	*	*			trans	-137.4	103.6	153.6	-178	0	0	0	0	105.8	C99 G103	C99-S101 VanDerWaalsContact C-N 3.28Å; S101-G103 PolarHBondContact O-N 2.7Å
102	A	46.8	Very low	59	Low	109 Å²	109	126.5 Å²	126.5	90%	0.901	72%	0.724	S	S	*	*	S	Bend	trans	-53.9	121.7	163.2	0	0	0	0	0	107.6
103	G	48.7	Very low	57.3	Low	71 Å²	71	124.9 Å²	124.9	73%	0.732	72%	0.715	S	S	*	*	S	Bend	trans	85.8	80	173	0	0	0	0	0	115.1	S101	S101-G103 PolarHBondContact O-N 2.7Å
104	H	48	Very low	55	Low	177 Å²	177	121.1 Å²	121.1	82%	0.819	71%	0.706	S	S	*	*				175.1	89.4	123.4	-156.1	-102.2	0	0	0	107.3	S106	H104-S106 PolarHBondContact O-N 3.12Å; H104-S106 VanDerWaalsContact O-N 3.13Å
105	Q	51.1	Low	53.3	Low	168 Å²	168	119.9 Å²	119.9	79%	0.785	71%	0.705	S	S	*	*			trans	-70	108.7	171	-67.2	-173.2	94.8	0	0	107.2	L107	Q105-L107 PolarHBondContact O-N 3.33Å
106	S	53.4	Low	51.8	Low	112 Å²	112	117.3 Å²	117.3	78%	0.783	70%	0.696	S	S	*	*			trans	-73.1	95.2	170.1	-178	0	0	0	0	107.9	H104	H104-S106 PolarHBondContact O-N 3.12Å; H104-S106 VanDerWaalsContact O-N 3.13Å
107	L	61	Low	50.8	Low	99 Å²	99	112.7 Å²	112.7	52%	0.518	68%	0.679	S	S	.	*			trans	-79	142.1	170.3	-62.5	166.8	0	0	0	108.6	Q105	Q105-L107 PolarHBondContact O-N 3.33Å
108	D	62.4	Low	50	Low	53 Å²	53	117.5 Å²	117.5	28%	0.283	68%	0.684	S	S	.	*			trans	-69.1	166.9	163.8	65.8	54.4	0	0	0	110.5	N110 G111 N112	D108-N110 PolarHBondContact O-N 3.13Å; D108-N110 WeakPolarHBondContact OD1-CA 3.38Å; D108-N110 WeakPolarHBondContact OD1-CB 3.49Å; D108-N110 PolarHBondContact OD1-N 2.79Å; D108-G111 PolarHBondContact O-N 2.93Å; D108-G111 PolarHBondContact OD1-N 3.01Å; D108-N112 PolarHBondContact N-O 3.25Å; D108-N112 PolarHBondContact OD1-N 2.92Å; D108-N112 VanDerWaalsContact OD1-N 3.14Å; D108-N112 VanDerWaalsContact OD2-C 3.29Å; D108-N112 WeakPolarHBondContact OD2-CB 3.4Å
109	V	62.4	Low	50.1	Low	162 Å²	162	116.2 Å²	116.2	98%	0.982	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-8.2	-174	-161.7	0	0	0	0	112.6
110	N	63.1	Low	49.7	Very low	141 Å²	141	112.8 Å²	112.8	75%	0.754	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	9.5	175.8	-174.5	33.6	0	0	0	112.6	D108 N112	D108-N110 PolarHBondContact O-N 3.13Å; D108-N110 WeakPolarHBondContact OD1-CA 3.38Å; D108-N110 WeakPolarHBondContact OD1-CB 3.49Å; D108-N110 PolarHBondContact OD1-N 2.79Å; N110-N112 PolarHBondContact O-N 2.96Å
111	G	50.7	Low	49.7	Very low	54 Å²	54	109.1 Å²	109.1	56%	0.557	66%	0.66	S	S	*	*	S	Bend	trans	66.6	16.7	179.4	0	0	0	0	0	114	D108	D108-G111 PolarHBondContact O-N 2.93Å; D108-G111 PolarHBondContact OD1-N 3.01Å
112	N	54.8	Low	49.8	Very low	78 Å²	78	111.6 Å²	111.6	42%	0.417	66%	0.661	S	S	.	*			trans	-91.3	147.2	172.6	-165.5	10.9	0	0	0	109.7	D108 N110 Q114	D108-N112 PolarHBondContact N-O 3.25Å; D108-N112 PolarHBondContact OD1-N 2.92Å; D108-N112 VanDerWaalsContact OD1-N 3.14Å; D108-N112 VanDerWaalsContact OD2-C 3.29Å; D108-N112 WeakPolarHBondContact OD2-CB 3.4Å; N110-N112 PolarHBondContact O-N 2.96Å; N112-Q114 PolarHBondContact O-N 2.79Å
113	C	55.4	Low	49.5	Very low	81 Å²	81	108.9 Å²	108.9	55%	0.547	64%	0.644	S	S	.	*			trans	-94.7	74.9	171.5	-49.2	0	0	0	0	106.1	T115	C113-T115 PolarHBondContact O-N 2.69Å
114	Q	42	Very low	49.2	Very low	139 Å²	139	113 Å²	113	65%	0.65	65%	0.647	S	S	*	*			trans	-75.7	72.3	-178.1	-127.2	177.8	3.1	0	0	111.6	N112 V116	N112-Q114 PolarHBondContact O-N 2.79Å; Q114-V116 HydrophobicContact CB-CG2 4.17Å; Q114-V116 HydrophobicContact CG-CG2 3.63Å; Q114-V116 PolarHBondContact O-N 2.78Å
115	T	47.5	Very low	48.9	Very low	110 Å²	110	110.5 Å²	110.5	68%	0.675	65%	0.65	S	S	*	*			trans	-73.7	81.6	155.8	-48.6	0	0	0	0	106	C113 I117	C113-T115 PolarHBondContact O-N 2.69Å; T115-I117 HydrophobicContact CG2-CD1 3.76Å; T115-I117 HydrophobicContact CG2-CG1 3.98Å; T115-I117 PolarHBondContact O-N 2.88Å
116	V	43.9	Very low	48.5	Very low	107 Å²	107	111 Å²	111	65%	0.648	65%	0.652	S	S	*	*			trans	-72.5	86.1	168.8	-162.4	0	0	0	0	106	Q114 F118	Q114-V116 HydrophobicContact CB-CG2 4.17Å; Q114-V116 HydrophobicContact CG-CG2 3.63Å; Q114-V116 PolarHBondContact O-N 2.78Å; V116-F118 PolarHBondContact O-N 3.15Å
117	I	48.6	Very low	47.6	Very low	91 Å²	91	113 Å²	113	47%	0.467	65%	0.654	S	S	.	*			trans	-65.2	105.5	161.6	-53	-77.7	0	0	0	104.4	L94 T115 V119	L94-I117 HydrophobicContact CD2-CG2 4.19Å; T115-I117 HydrophobicContact CG2-CD1 3.76Å; T115-I117 HydrophobicContact CG2-CG1 3.98Å; T115-I117 PolarHBondContact O-N 2.88Å; I117-V119 HydrophobicContact CB-CG2 4.29Å; I117-V119 HydrophobicContact CG2-CG2 3.47Å; I117-V119 VanDerWaalsContact CG2-CG2 3.47Å; I117-V119 PolarHBondContact O-N 2.86Å
118	F	38.9	Very low	46.5	Very low	185 Å²	185	113.1 Å²	113.1	81%	0.811	66%	0.659	S	S	*	*			trans	-69.6	83.2	161.4	-168.6	-94.9	0	0	0	106.8	V116 G120	V116-F118 PolarHBondContact O-N 3.15Å; F118-G120 PolarHBondContact O-N 2.9Å
119	V	46.4	Very low	45	Very low	97 Å²	97	117.7 Å²	117.7	59%	0.588	68%	0.678	S	S	*	*			trans	-69.5	105.5	159.6	175.8	0	0	0	0	104	I117 S121	I117-V119 HydrophobicContact CB-CG2 4.29Å; I117-V119 HydrophobicContact CG2-CG2 3.47Å; I117-V119 VanDerWaalsContact CG2-CG2 3.47Å; I117-V119 PolarHBondContact O-N 2.86Å; V119-S121 PolarHBondContact O-N 2.75Å; V119-S121 VanDerWaalsContact O-N 3.13Å
120	G	37.5	Very low	43.5	Very low	42 Å²	42	116.3 Å²	116.3	43%	0.433	68%	0.675	S	S	.	*			trans	-50.7	124.1	166.1	0	0	0	0	0	107.5	F118 Q122	F118-G120 PolarHBondContact O-N 2.9Å; G120-Q122 PolarHBondContact O-N 3.18Å
121	S	44	Very low	42	Very low	122 Å²	122	115 Å²	115	85%	0.853	67%	0.672	S	S	*	*			trans	-46.7	98.6	-177.5	-60.9	0	0	0	0	110.8	V119 G123	V119-S121 PolarHBondContact O-N 2.75Å; V119-S121 VanDerWaalsContact O-N 3.13Å; S121-G123 PolarHBondContact O-N 2.76Å
122	Q	39.1	Very low	41.3	Very low	146 Å²	146	119.8 Å²	119.8	68%	0.682	68%	0.684	S	S	*	*			trans	-77.5	82.5	162.2	-162	88.1	61.8	0	0	105.3	G120	G120-Q122 PolarHBondContact O-N 3.18Å
123	G	41.2	Very low	40.3	Very low	52 Å²	52	124.7 Å²	124.7	54%	0.536	71%	0.705	S	S	.	*			trans	-59.9	139.3	163.6	0	0	0	0	0	108.8	S121	S121-G123 PolarHBondContact O-N 2.76Å
124	I	42.5	Very low	39.4	Very low	156 Å²	156	130.7 Å²	130.7	80%	0.8	72%	0.722	S	S	*	*			trans	72.2	91.2	172	72.8	155.9	0	0	0	117.1
125	S	41.3	Very low	39	Very low	125 Å²	125	130.6 Å²	130.6	87%	0.874	73%	0.73	S	S	*	*			trans	-132.4	86.4	146.2	-177.9	0	0	0	0	107
126	E	43	Very low	38.3	Very low	178 Å²	178	132.4 Å²	132.4	83%	0.832	74%	0.736	S	S	*	*			trans	-93.4	132.5	168.4	-61.3	-176.7	165.9	0	0	108.5
127	D	33.5	Very low	37.8	Very low	156 Å²	156	133.7 Å²	133.7	83%	0.834	74%	0.744	S	S	*	*			trans	87.8	146.8	152.3	-139.9	0.1	0	0	0	119.7
128	T	37.6	Very low	37.1	Very low	101 Å²	101	133.5 Å²	133.5	62%	0.62	75%	0.75	S	S	*	*			trans	114.2	81.6	169	-43.8	0	0	0	0	115.1
129	H	31.6	Very low	37	Very low	148 Å²	148	132.3 Å²	132.3	69%	0.685	75%	0.748	S	S	*	*			trans	10.3	127.1	146.9	73	-81.5	0	0	0	119.2
130	C	30.8	Very low	36.4	Very low	134 Å²	134	135.4 Å²	135.4	91%	0.905	76%	0.761	S	S	*	*			trans	-108.4	107.3	158.1	-65	0	0	0	0	108
131	V	31.7	Very low	36.4	Very low	114 Å²	114	141.6 Å²	141.6	69%	0.691	78%	0.779	S	S	*	*			trans	-82.2	126.6	166.8	168.3	0	0	0	0	108	Q133	V131-Q133 PolarHBondContact O-N 2.7Å
132	D	35.3	Very low	35.9	Very low	154 Å²	154	142.4 Å²	142.4	82%	0.824	78%	0.778	S	S	*	*			trans	-46.4	122.3	166.5	-80.9	-71.8	0	0	0	112.4
133	Q	34.9	Very low	35.7	Very low	180 Å²	180	141.5 Å²	141.5	84%	0.841	78%	0.778	S	S	*	*			trans	-142.8	108.2	146.1	-67.3	-166.7	56.4	0	0	110.2	V131	V131-Q133 PolarHBondContact O-N 2.7Å
134	K	36.3	Very low	35.3	Very low	208 Å²	208	149 Å²	149	90%	0.904	80%	0.797	S	S	*	*			trans	-66.7	126.7	158	-93	-174.3	167.3	-171	0	109
135	T	33.7	Very low	35.2	Very low	136 Å²	136	145.7 Å²	145.7	83%	0.834	79%	0.792	S	S	*	*			trans	-150.7	127.9	142.3	-30.7	0	0	0	0	110.5
136	D	31.7	Very low	35.2	Very low	148 Å²	148	148.2 Å²	148.2	79%	0.791	79%	0.79	S	S	*	*			trans	-72.2	176.3	171	-165.1	-83.9	0	0	0	111.1
137	V	34.5	Very low	34.7	Very low	134 Å²	134	148.1 Å²	148.1	81%	0.812	79%	0.79	S	S	*	*			trans	94.1	129.3	-178.1	-179.2	0	0	0	0	114
138	S	34.3	Very low	34.7	Very low	87 Å²	87	147 Å²	147	61%	0.608	79%	0.793	S	S	*	*			cis	-173.2	135.6	-10.3	163.8	0	0	0	0	105.3
139	E	35.7	Very low	34.8	Very low	161 Å²	161	148.4 Å²	148.4	75%	0.752	80%	0.802	S	S	*	*			trans	-5.6	132.7	155.2	46.8	-165.7	138.5	0	0	117.9
140	N	33.3	Very low	35	Very low	162 Å²	162	145.1 Å²	145.1	87%	0.866	81%	0.808	S	S	*	*				-168	121.9	124.5	-80.8	-36.5	0	0	0	111.8
141	Q	37.5	Very low	35.6	Very low	172 Å²	172	147.5 Å²	147.5	80%	0.804	81%	0.805	S	S	*	*			trans	-72.1	138.4	169.4	174.5	178.2	52.9	0	0	110.1
142	T	35	Very low	36.3	Very low	138 Å²	138	151.9 Å²	151.9	85%	0.847	81%	0.81	S	S	*	*			trans	-159.7	134.1	146.7	15.5	0	0	0	0	110.8
143	D	34.9	Very low	37.1	Very low	128 Å²	128	152.9 Å²	152.9	68%	0.684	81%	0.807	S	S	*	*			trans	-63.1	144	-177.6	-57.2	-87.6	0	0	0	114
144	F	32.9	Very low	38.3	Very low	210 Å²	210	155.9 Å²	155.9	92%	0.921	81%	0.81	S	S	*	*			trans	-132.3	96.8	146	-99.3	-85.2	0	0	0	109
145	A	40.2	Very low	38.8	Very low	86 Å²	86	151.9 Å²	151.9	71%	0.711	81%	0.806	S	S	*	*			trans	-81.2	111.9	167.9	0	0	0	0	0	108.8
146	E	40.3	Very low	39.2	Very low	178 Å²	178	150.4 Å²	150.4	83%	0.832	81%	0.807	S	S	*	*			trans	-106.7	105.5	159.6	-80.2	-169.3	154	0	0	109.4
147	Q	33	Very low	39.8	Very low	175 Å²	175	149.8 Å²	149.8	82%	0.818	81%	0.809	S	S	*	*			trans	-76.6	112.3	167.1	-72.5	175.5	13.9	0	0	109	T149	Q147-T149 PolarHBondContact O-N 3.12Å
148	C	32.9	Very low	40.4	Very low	132 Å²	132	151.1 Å²	151.1	89%	0.892	81%	0.811	S	S	*	*			trans	-88.3	104.5	160.8	-80.5	0	0	0	0	109.5
149	T	40.4	Very low	40.7	Very low	132 Å²	132	153.9 Å²	153.9	81%	0.81	82%	0.819	S	S	*	*			trans	-74.2	142.2	162.1	51.9	0	0	0	0	109.2	Q147	Q147-T149 PolarHBondContact O-N 3.12Å
150	G	36.6	Very low	41	Very low	79 Å²	79	150.9 Å²	150.9	81%	0.814	82%	0.816	S	S	*	*			trans	159	120.2	169	0	0	0	0	0	115.7
151	Q	43	Very low	41.7	Very low	183 Å²	183	148.2 Å²	148.2	86%	0.855	81%	0.81	S	S	*	*			trans	-81	145.8	-170.6	-65.8	-137.9	-18.9	0	0	115.3
152	R	45.4	Very low	42.1	Very low	207 Å²	207	145.5 Å²	145.5	78%	0.781	81%	0.807	S	S	*	*			trans	36.5	136.1	134.4	-104.7	-179.4	177.2	177.9	0.5	122.1
153	K	52.6	Low	42.6	Very low	175 Å²	175	147.9 Å²	147.9	76%	0.761	81%	0.809	S	S	*	*			trans	88.4	111.2	143.3	-58.6	-93.6	-178.4	173.9	0	117.1
154	R	60.7	Low	42.9	Very low	243 Å²	243	149.6 Å²	149.6	92%	0.917	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-78.7	132	159.4	-62.9	-176.2	-177.8	106	1.8	108.8
155	P	46.3	Very low	44.1	Very low	124 Å²	124	149.3 Å²	149.3	81%	0.805	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-67.3	134.6	164.2	-13.6	28.1	0	0	0	109.8
156	A	41.3	Very low	44.4	Very low	104 Å²	104	155.9 Å²	155.9	86%	0.86	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-81.7	123.9	169.3	0	0	0	0	0	108.5
157	T	45.3	Very low	44.5	Very low	135 Å²	135	152 Å²	152	83%	0.828	82%	0.822	S	S	*	*			trans	-101.7	105.2	161.7	46.1	0	0	0	0	107.4
158	D	46.4	Very low	44.7	Very low	162 Å²	162	150.1 Å²	150.1	87%	0.866	82%	0.817	S	S	*	*			trans	-53.6	132.7	145.5	-100.6	-52.4	0	0	0	107.8
159	D	40.3	Very low	44.8	Very low	145 Å²	145	149.9 Å²	149.9	78%	0.775	81%	0.812	S	S	*	*				175.3	146.6	122.1	-172.2	42.5	0	0	0	111.6
160	S	43.6	Very low	45	Very low	98 Å²	98	150.1 Å²	150.1	69%	0.685	81%	0.813	S	S	*	*			trans	84.7	94.9	159.8	-72.8	0	0	0	0	119.6
161	S	46.1	Very low	45.8	Very low	106 Å²	106	154.4 Å²	154.4	74%	0.741	81%	0.812	S	S	*	*			trans	-62.7	141.9	162.5	178.3	0	0	0	0	113.3
162	P	46	Very low	45.9	Very low	116 Å²	116	153.9 Å²	153.9	75%	0.753	81%	0.809	S	S	*	*			trans	-91.6	108	168.7	32	-27.1	0	0	0	111.1
163	Q	46.2	Very low	45.6	Very low	187 Å²	187	151.3 Å²	151.3	87%	0.874	81%	0.806	S	S	*	*			trans	-86.6	104.6	163.2	-78.9	-173.6	-42.7	0	0	110	K165	Q163-K165 PolarHBondContact O-N 2.98Å
164	N	40.9	Very low	44.7	Very low	165 Å²	165	149 Å²	149	88%	0.882	81%	0.806	S	S	*	*			trans	-70.2	110.8	163.7	-74.5	-37.2	0	0	0	109.1
165	K	58.9	Low	44	Very low	203 Å²	203	143.5 Å²	143.5	88%	0.883	81%	0.805	S	S	*	*			trans	-100.7	117.7	171.1	-164.7	174	-177.3	-178.8	0	109.7	Q163	Q163-K165 PolarHBondContact O-N 2.98Å
166	R	46.5	Very low	43.6	Very low	225 Å²	225	146.2 Å²	146.2	85%	0.849	81%	0.807	S	S	*	*			trans	-74.5	140.6	170.7	-174.5	-174.5	-156.3	-177.1	6.7	110.3
167	A	42.6	Very low	43.3	Very low	97 Å²	97	149.1 Å²	149.1	80%	0.802	81%	0.808	S	S	*	*			trans	-172.7	140	136.4	0	0	0	0	0	111.6
168	N	35.7	Very low	43.6	Very low	134 Å²	134	147.4 Å²	147.4	72%	0.717	80%	0.802	S	S	*	*			trans	-81.9	-178.4	177.5	-71.1	-20.2	0	0	0	112.3
169	T	35.3	Very low	43.7	Very low	128 Å²	128	145 Å²	145	79%	0.785	80%	0.795	S	S	*	*			trans	100.1	116.1	150.3	70.3	0	0	0	0	118.2
170	T	44.5	Very low	43.3	Very low	137 Å²	137	143.9 Å²	143.9	84%	0.84	80%	0.799	S	S	*	*				-159.1	135.6	125.9	25.4	0	0	0	0	109.9
171	E	54.2	Low	43.1	Very low	168 Å²	168	144 Å²	144	79%	0.785	81%	0.805	S	S	*	*			trans	-69.8	161.4	174.5	56.2	-124.7	108.2	0	0	113.8
172	E	44.6	Very low	42.7	Very low	172 Å²	172	144 Å²	144	80%	0.804	81%	0.805	S	S	*	*				-177.5	121.6	129.3	-81	-124.7	139.8	0	0	111.5
173	E	40.2	Very low	42.5	Very low	154 Å²	154	143.6 Å²	143.6	72%	0.72	81%	0.805	S	S	*	*			trans	51.6	103.2	135.8	-50.2	-68.8	111.4	0	0	119.7
174	V	32.2	Very low	42.5	Very low	126 Å²	126	140.2 Å²	140.2	76%	0.764	80%	0.797	S	S	*	*				65.5	106.5	94.1	145.8	0	0	0	0	114.6
175	S	46.3	Very low	42.6	Very low	127 Å²	127	140.2 Å²	140.2	89%	0.888	79%	0.792	S	S	*	*			trans	-143.5	121.9	154.9	-152.1	0	0	0	0	107.8
176	E	39.3	Very low	42.2	Very low	182 Å²	182	139.1 Å²	139.1	85%	0.85	79%	0.79	S	S	*	*			trans	-80.7	128.6	-172.1	-57.1	174.6	137.8	0	0	111.3
177	D	34.2	Very low	42.7	Very low	164 Å²	164	133.3 Å²	133.3	88%	0.877	78%	0.78	S	S	*	*			trans	-160.1	145.3	135.4	-161.7	26.5	0	0	0	110
178	S	50.9	Low	43.3	Very low	99 Å²	99	135 Å²	135	69%	0.692	78%	0.782	S	S	*	*			trans	-94	-164.6	-156.5	-57	0	0	0	0	114.2
179	P	49.3	Very low	44.5	Very low	113 Å²	113	138.3 Å²	138.3	73%	0.734	79%	0.79	S	S	*	*				-125.2	-172	-101.7	37.4	-17.5	0	0	0	114.8
180	S	31.4	Very low	45.3	Very low	121 Å²	121	141.9 Å²	141.9	85%	0.846	80%	0.795	S	S	*	*			trans	88.5	136.5	162.2	75.6	0	0	0	0	116.8
181	A	39.2	Very low	45.6	Very low	100 Å²	100	140.8 Å²	140.8	83%	0.826	79%	0.793	S	S	*	*			cis	-148.9	161.9	10	0	0	0	0	0	111
182	S	38.4	Very low	46	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	79%	0.793	S	S	*	*			trans	-59.4	142.5	-164.4	51	0	0	0	0	119.1
183	S	41.5	Very low	46.5	Very low	107 Å²	107	136 Å²	136	75%	0.748	79%	0.794	S	S	*	*			trans	-59.4	138.6	154.8	-179.2	0	0	0	0	111.9
184	V	46.5	Very low	47.4	Very low	117 Å²	117	140 Å²	140	71%	0.709	80%	0.802	S	S	*	*			trans	-122.3	90.9	168.2	-177.5	0	0	0	0	108.1	Q186	V184-Q186 HydrophobicContact CG1-CG 4.3Å; V184-Q186 PolarHBondContact O-N 3.39Å
185	E	42.3	Very low	48.6	Very low	164 Å²	164	144 Å²	144	77%	0.766	80%	0.804	S	S	*	*			trans	-79.1	106.9	168.8	-169.3	172.5	115.8	0	0	108.7	T187	E185-T187 PolarHBondContact O-N 3.39Å
186	Q	52	Low	48.7	Very low	180 Å²	180	146.7 Å²	146.7	84%	0.841	80%	0.802	S	S	*	*			trans	-84.7	104.6	174.6	-78.5	-168.6	1.5	0	0	110.4	V184	V184-Q186 HydrophobicContact CG1-CG 4.3Å; V184-Q186 PolarHBondContact O-N 3.39Å
187	T	55.2	Low	49.5	Very low	104 Å²	104	145.3 Å²	145.3	64%	0.638	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-97.7	125	161.2	32.4	0	0	0	0	109.9	E185 K189	E185-T187 PolarHBondContact O-N 3.39Å; T187-K189 PolarHBondContact O-N 3.21Å
188	P	56.3	Low	50.4	Low	132 Å²	132	147.5 Å²	147.5	86%	0.857	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-74.5	123.6	177.5	26.3	-30.2	0	0	0	111.1
189	K	60	Low	50.4	Low	204 Å²	204	150 Å²	150	89%	0.887	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-82.4	128.1	174.6	-66.6	-172.2	178.1	179.9	0	110.7	T187	T187-K189 PolarHBondContact O-N 3.21Å
190	K	52.2	Low	50.4	Low	203 Å²	203	151.9 Å²	151.9	88%	0.883	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-73.8	126.1	173.4	-167.2	175.2	179.8	179.1	0	109.7
191	S	51.5	Low	51.5	Low	114 Å²	114	153.6 Å²	153.6	80%	0.797	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-72.7	134.9	174.4	55.3	0	0	0	0	110.9
192	S	62.1	Low	52.2	Low	111 Å²	111	156.8 Å²	156.8	78%	0.776	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-78.9	147.2	175.8	-54.6	0	0	0	0	111.1
193	P	56.6	Low	53.1	Low	127 Å²	127	159.9 Å²	159.9	83%	0.825	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-74.3	132.8	-178	29.4	-31.4	0	0	0	111.1	R195	P193-R195 PolarHBondContact O-N 3.43Å
194	R	58.7	Low	53.9	Low	238 Å²	238	163.5 Å²	163.5	90%	0.898	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-68.8	117.6	178.4	-155	177.2	-168.9	-142.7	3.3	109.1	H196	R194-H196 PolarHBondContact O-N 3.14Å
195	R	57.1	Low	54.4	Low	211 Å²	211	166.8 Å²	166.8	80%	0.796	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-68	116.2	175.2	-179.6	173.5	160.8	-169.9	-6.5	109.4	P193	P193-R195 PolarHBondContact O-N 3.43Å
196	H	48.2	Very low	55.3	Low	184 Å²	184	167 Å²	167	85%	0.852	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-68.7	134.2	167.3	-68.5	-83.9	0	0	0	109.2	R194	R194-H196 PolarHBondContact O-N 3.14Å
197	Q	55.2	Low	55.6	Low	152 Å²	152	165.9 Å²	165.9	71%	0.71	85%	0.851	S	S	*	*			trans	-125.8	136.9	159.5	-118.4	174.5	3.3	0	0	108.5
198	T	54.2	Low	55.6	Low	211 Å²	211	171.5 Å²	171.5	100%	1.294	87%	0.871	S	S	*	*			trans	-30.2	0	178.4	40.3	0	0	0	0	117.3

Retrieved 198 of 198 residues in 24 ms (Link to these results)

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