A0A096NY95_PAPAN Loading...

Serine peptidase inhibitor Kazal type 14 (putative)

AlphaFold DB , UniProt , Accession A0A096NY95, Species PAPAN (Papio anubis, Olive baboon), Gene SPINK14, Length 97 aa.

						>A0A096NY95_PAPAN|A0A096NY95|SPINK14
MARSFPVFSLLSFVLIHLVLSSVSGPRHWWPPHGIIKVKCPYEKVNLSWYNGTVNPCPGLYQPICGTNFITYDNPCILCVESLKSHGRIRFYHDGKC
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.2	Very low	47.7	Very low	241 Å²	241	142.9 Å²	142.9	100%	1.187	76%	0.758	S	S	*	*				0	86.8	0	-67.8	128.4	-175.2	0	0	108	R3	M1-R3 PolarHBondContact O-N 3.26Å
2	A	38.6	Very low	48.7	Very low	106 Å²	106	134.5 Å²	134.5	88%	0.876	72%	0.72	S	S	*	*			trans	-83.4	98.7	-177.1	0	0	0	0	0	108.3	S4	A2-S4 PolarHBondContact O-N 3.45Å; A2-S4 VanDerWaalsContact O-N 3.14Å
3	R	44	Very low	49.4	Very low	217 Å²	217	134.6 Å²	134.6	82%	0.819	71%	0.71	S	S	*	*			trans	-78.5	98.3	166.5	-70.2	-142.5	148	170.9	-4.4	107	M1 F5	M1-R3 PolarHBondContact O-N 3.26Å; R3-F5 VanDerWaalsContact C-N 3.34Å; R3-F5 WeakPolarHBondContact O-CD2 3.44Å; R3-F5 PolarHBondContact O-N 2.03Å
4	S	43.3	Very low	50.2	Low	110 Å²	110	131 Å²	131	77%	0.769	70%	0.696	S	S	*	*			trans	-49.6	101.7	162.1	-175.4	0	0	0	0	107.3	A2 P6	A2-S4 PolarHBondContact O-N 3.45Å; A2-S4 VanDerWaalsContact O-N 3.14Å; S4-P6 VanDerWaalsContact O-CD 3.29Å; S4-P6 WeakPolarHBondContact O-CD 3.35Å
5	F	45	Very low	51	Low	178 Å²	178	129.4 Å²	129.4	78%	0.781	69%	0.687	S	S	*	*			trans	-74.6	109.6	167.6	-69.8	-80.8	0	0	0	104.9	R3 V7	R3-F5 VanDerWaalsContact C-N 3.34Å; R3-F5 WeakPolarHBondContact O-CD2 3.44Å; R3-F5 PolarHBondContact O-N 2.03Å; F5-V7 PolarHBondContact O-N 3.08Å
6	P	47	Very low	51.7	Low	88 Å²	88	128.3 Å²	128.3	57%	0.571	68%	0.679	S	S	*	*			trans	-59.7	134.4	-176	26	-32.3	0	0	0	107.6	S4 F8	S4-P6 VanDerWaalsContact O-CD 3.29Å; S4-P6 WeakPolarHBondContact O-CD 3.35Å; P6-F8 HydrophobicContact CB-CB 4.3Å; P6-F8 HydrophobicContact CB-CD2 4.04Å; P6-F8 PolarHBondContact O-N 2.92Å
7	V	52.1	Low	52.1	Low	139 Å²	139	128.1 Å²	128.1	84%	0.842	67%	0.674	S	S	*	*			trans	-68.9	58	167.6	-174.8	0	0	0	0	108	F5	F5-V7 PolarHBondContact O-N 3.08Å
8	F	48.3	Very low	52.4	Low	181 Å²	181	127.7 Å²	127.7	79%	0.794	67%	0.672	S	S	*	*			trans	-133.4	98.9	172.2	-84.1	-92.4	0	0	0	101.9	P6	P6-F8 HydrophobicContact CB-CB 4.3Å; P6-F8 HydrophobicContact CB-CD2 4.04Å; P6-F8 PolarHBondContact O-N 2.92Å
9	S	55.8	Low	52.7	Low	39 Å²	39	126.1 Å²	126.1	27%	0.273	67%	0.667	S	S	.	*			cis	-173.2	86.7	38.1	-179.5	0	0	0	0	107.1	L11 S12 F13	S9-L11 PolarHBondContact O-N 3.49Å; S9-S12 WeakPolarHBondContact CB-OG 3.15Å; S9-S12 PolarHBondContact O-N 2.95Å; S9-S12 PolarHBondContact O-OG 3.36Å; S9-S12 WeakPolarHBondContact OG-CB 3.02Å; S9-S12 PolarHBondContact OG-N 2.96Å; S9-S12 PolarHBondContact OG-OG 2.8Å; S9-F13 WeakPolarHBondContact O-CD2 3.36Å; S9-F13 PolarHBondContact O-N 2.96Å
10	L	54.9	Low	52.8	Low	139 Å²	139	126.1 Å²	126.1	73%	0.728	67%	0.666	S	S	*	*	H	α-helix	trans	-54	-30.3	163	-82.5	160.5	0	0	0	109.6	S12 F13 V14	L10-S12 PolarHBondContact O-N 2.6Å; L10-F13 PolarHBondContact O-N 3.18Å; L10-V14 WeakPolarHBondContact O-CB 3.44Å; L10-V14 WeakPolarHBondContact O-CG2 3.15Å; L10-V14 PolarHBondContact O-N 3.17Å
11	L	56.8	Low	52.7	Low	134 Å²	134	124.9 Å²	124.9	70%	0.702	67%	0.669	S	S	*	*	H	α-helix	trans	-57.7	-40	168.8	-113.4	92.4	0	0	0	113.6	S9 L15	S9-L11 PolarHBondContact O-N 3.49Å; L11-L15 WeakPolarHBondContact O-CB 3.42Å; L11-L15 WeakPolarHBondContact O-CD1 3.12Å; L11-L15 VanDerWaalsContact O-CG 3.23Å; L11-L15 WeakPolarHBondContact O-CG 3.43Å; L11-L15 PolarHBondContact O-N 3.28Å
12	S	58.9	Low	53.4	Low	42 Å²	42	117.6 Å²	117.6	29%	0.294	64%	0.641	S	S	.	*	H	α-helix	trans	-75.9	-35.7	-179	64.6	0	0	0	0	112.3	S9 L10 L15 I16	S9-S12 WeakPolarHBondContact CB-OG 3.15Å; S9-S12 PolarHBondContact O-N 2.95Å; S9-S12 PolarHBondContact O-OG 3.36Å; S9-S12 WeakPolarHBondContact OG-CB 3.02Å; S9-S12 PolarHBondContact OG-N 2.96Å; S9-S12 PolarHBondContact OG-OG 2.8Å; L10-S12 PolarHBondContact O-N 2.6Å; S12-L15 PolarHBondContact O-N 3.31Å; S12-I16 WeakPolarHBondContact O-CD1 3.24Å; S12-I16 VanDerWaalsContact O-CG1 3.23Å; S12-I16 WeakPolarHBondContact O-CG1 3.38Å; S12-I16 PolarHBondContact O-N 2.91Å
13	F	58.6	Low	54.1	Low	136 Å²	136	118.2 Å²	118.2	60%	0.596	63%	0.634	S	S	*	*	H	α-helix	trans	-65.9	-41.1	172.3	-75.8	-80.3	0	0	0	111	S9 L10 L15 I16 H17	S9-F13 WeakPolarHBondContact O-CD2 3.36Å; S9-F13 PolarHBondContact O-N 2.96Å; L10-F13 PolarHBondContact O-N 3.18Å; F13-L15 VanDerWaalsContact C-N 3.33Å; F13-L15 PolarHBondContact O-N 2.82Å; F13-I16 PolarHBondContact O-N 2.94Å; F13-H17 PolarHBondContact O-CD2 3.21Å; F13-H17 VanDerWaalsContact O-CD2 3.25Å; F13-H17 PolarHBondContact O-N 3.4Å
14	V	60.7	Low	54.9	Low	84 Å²	84	112.9 Å²	112.9	51%	0.509	63%	0.63	S	S	.	*	H	α-helix	trans	-60.7	-41.4	172.3	170.9	0	0	0	0	111.3	L10 H17 L18	L10-V14 WeakPolarHBondContact O-CB 3.44Å; L10-V14 WeakPolarHBondContact O-CG2 3.15Å; L10-V14 PolarHBondContact O-N 3.17Å; V14-H17 PolarHBondContact O-N 3.08Å; V14-L18 HydrophobicContact CG1-CD1 3.67Å; V14-L18 WeakPolarHBondContact O-CB 3.21Å; V14-L18 VanDerWaalsContact O-CD1 3.27Å; V14-L18 WeakPolarHBondContact O-CD1 3.26Å; V14-L18 PolarHBondContact O-N 3.06Å
15	L	61.4	Low	55.4	Low	107 Å²	107	110.3 Å²	110.3	56%	0.56	62%	0.621	S	S	*	*	H	α-helix	trans	-62.8	-40.9	175.1	-79.2	161.1	0	0	0	112.4	L11 S12 F13 L18 V19	L11-L15 WeakPolarHBondContact O-CB 3.42Å; L11-L15 WeakPolarHBondContact O-CD1 3.12Å; L11-L15 VanDerWaalsContact O-CG 3.23Å; L11-L15 WeakPolarHBondContact O-CG 3.43Å; L11-L15 PolarHBondContact O-N 3.28Å; S12-L15 PolarHBondContact O-N 3.31Å; F13-L15 VanDerWaalsContact C-N 3.33Å; F13-L15 PolarHBondContact O-N 2.82Å; L15-L18 PolarHBondContact O-N 3.33Å; L15-V19 WeakPolarHBondContact O-CG2 3.45Å; L15-V19 PolarHBondContact O-N 2.99Å; L15-V19 VanDerWaalsContact O-N 3.13Å
16	I	62.2	Low	55.7	Low	111 Å²	111	107.3 Å²	107.3	57%	0.569	62%	0.619	S	S	*	*	H	α-helix	trans	-69.8	-39.9	179.2	-64.9	161.1	0	0	0	111.3	S12 F13 V19 L20	S12-I16 WeakPolarHBondContact O-CD1 3.24Å; S12-I16 VanDerWaalsContact O-CG1 3.23Å; S12-I16 WeakPolarHBondContact O-CG1 3.38Å; S12-I16 PolarHBondContact O-N 2.91Å; F13-I16 PolarHBondContact O-N 2.94Å; I16-V19 PolarHBondContact O-N 2.78Å; I16-L20 PolarHBondContact O-N 2.95Å; I16-L20 VanDerWaalsContact O-N 3.11Å
17	H	59	Low	55.7	Low	126 Å²	126	113.4 Å²	113.4	58%	0.583	63%	0.631	S	S	*	*	H	α-helix	trans	-67.6	-37	174.5	-80.9	-79.6	0	0	0	112.7	F13 V14 V19 L20 S21	F13-H17 PolarHBondContact O-CD2 3.21Å; F13-H17 VanDerWaalsContact O-CD2 3.25Å; F13-H17 PolarHBondContact O-N 3.4Å; V14-H17 PolarHBondContact O-N 3.08Å; H17-V19 VanDerWaalsContact C-N 3.29Å; H17-V19 PolarHBondContact O-N 3.34Å; H17-L20 PolarHBondContact O-N 3.03Å; H17-S21 PolarHBondContact O-N 3.48Å; H17-S21 VanDerWaalsContact O-N 3.17Å; H17-S21 PolarHBondContact O-OG 2.81Å
18	L	57.4	Low	55.4	Low	121 Å²	121	115 Å²	115	63%	0.634	63%	0.628	S	S	*	*	H	α-helix	trans	-61.2	-37.3	172.5	-106.4	97.5	0	0	0	112.3	V14 L15	V14-L18 HydrophobicContact CG1-CD1 3.67Å; V14-L18 WeakPolarHBondContact O-CB 3.21Å; V14-L18 VanDerWaalsContact O-CD1 3.27Å; V14-L18 WeakPolarHBondContact O-CD1 3.26Å; V14-L18 PolarHBondContact O-N 3.06Å; L15-L18 PolarHBondContact O-N 3.33Å
19	V	58.6	Low	55.1	Low	96 Å²	96	116.3 Å²	116.3	58%	0.582	63%	0.628	S	S	*	*	H	α-helix	trans	-75.5	-30.2	-179.6	177.2	0	0	0	0	111.7	L15 I16 H17 S22	L15-V19 WeakPolarHBondContact O-CG2 3.45Å; L15-V19 PolarHBondContact O-N 2.99Å; L15-V19 VanDerWaalsContact O-N 3.13Å; I16-V19 PolarHBondContact O-N 2.78Å; H17-V19 VanDerWaalsContact C-N 3.29Å; H17-V19 PolarHBondContact O-N 3.34Å; V19-S22 PolarHBondContact O-OG 2.83Å
20	L	54.4	Low	53.9	Low	126 Å²	126	121.4 Å²	121.4	66%	0.66	64%	0.642	S	S	*	*	H	α-helix	trans	-81.4	-32.8	-179.5	-153.2	72	0	0	0	113.5	I16 H17 S22 V23	I16-L20 PolarHBondContact O-N 2.95Å; I16-L20 VanDerWaalsContact O-N 3.11Å; H17-L20 PolarHBondContact O-N 3.03Å; L20-S22 PolarHBondContact O-N 3.42Å; L20-S22 VanDerWaalsContact O-N 3.17Å; L20-V23 PolarHBondContact O-N 2.85Å
21	S	51.1	Low	53.6	Low	102 Å²	102	119.6 Å²	119.6	71%	0.713	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-9.3	176.3	-63.2	0	0	0	0	114.1	H17	H17-S21 PolarHBondContact O-N 3.48Å; H17-S21 VanDerWaalsContact O-N 3.17Å; H17-S21 PolarHBondContact O-OG 2.81Å
22	S	52.5	Low	53	Low	87 Å²	87	119 Å²	119	61%	0.608	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-6.8	177.6	55.3	0	0	0	0	114.7	V19 L20	V19-S22 PolarHBondContact O-OG 2.83Å; L20-S22 PolarHBondContact O-N 3.42Å; L20-S22 VanDerWaalsContact O-N 3.17Å
23	V	53.9	Low	52.4	Low	119 Å²	119	126.8 Å²	126.8	72%	0.721	67%	0.674	S	S	*	*	S	Bend	trans	-93.4	-4.8	-179.8	-179.7	0	0	0	0	113	L20	L20-V23 PolarHBondContact O-N 2.85Å
24	S	60.3	Low	51.5	Low	106 Å²	106	123.6 Å²	123.6	74%	0.741	68%	0.679	S	S	*	*			trans	-107.7	47.8	173.4	-50.1	0	0	0	0	111.4
25	G	54.7	Low	50.8	Low	56 Å²	56	127.6 Å²	127.6	58%	0.577	70%	0.696	S	S	*	*			trans	-63	137.9	168	0	0	0	0	0	109.9	R27	G25-R27 PolarHBondContact O-N 3.44Å; G25-R27 VanDerWaalsContact O-N 3.15Å
26	P	51.2	Low	50	Low	114 Å²	114	126.6 Å²	126.6	74%	0.74	69%	0.69	S	S	*	*			trans	-57.4	125.2	170.6	22.5	-29.7	0	0	0	107.9	H28	P26-H28 VanDerWaalsContact C-N 3.35Å; P26-H28 PolarHBondContact O-N 3.14Å
27	R	47.5	Very low	49.1	Very low	217 Å²	217	130.1 Å²	130.1	82%	0.819	70%	0.701	S	S	*	*			trans	-30	92.1	170.3	-95.6	-171.6	-88	-112.5	3.8	111.3	G25 W29	G25-R27 PolarHBondContact O-N 3.44Å; G25-R27 VanDerWaalsContact O-N 3.15Å; R27-W29 VanDerWaalsContact C-CD1 3.49Å; R27-W29 VanDerWaalsContact CB-NE1 3.27Å; R27-W29 VanDerWaalsContact O-CD1 3.27Å; R27-W29 PolarHBondContact O-N 3.41Å
28	H	44.6	Very low	48.7	Very low	171 Å²	171	127.1 Å²	127.1	79%	0.792	69%	0.692	S	S	*	*			trans	-87.7	92.3	-176.9	-134.2	90.1	0	0	0	107.6	P26	P26-H28 VanDerWaalsContact C-N 3.35Å; P26-H28 PolarHBondContact O-N 3.14Å
29	W	42.5	Very low	48.4	Very low	209 Å²	209	129.6 Å²	129.6	79%	0.792	70%	0.697	S	S	*	*			trans	-112	59.9	176.1	-51.2	78.9	0	0	0	110.4	R27	R27-W29 VanDerWaalsContact C-CD1 3.49Å; R27-W29 VanDerWaalsContact CB-NE1 3.27Å; R27-W29 VanDerWaalsContact O-CD1 3.27Å; R27-W29 PolarHBondContact O-N 3.41Å
30	W	31.8	Very low	48.7	Very low	146 Å²	146	126.7 Å²	126.7	55%	0.553	68%	0.681	S	S	*	*	S	Bend	trans	-162.3	133.2	164.6	-142.7	-142.5	0	0	0	112.5
31	P	47	Very low	48.7	Very low	102 Å²	102	125.7 Å²	125.7	66%	0.662	68%	0.682	S	S	*	*			trans	-89	152.8	-162.4	34.5	-33.5	0	0	0	114.2
32	P	45	Very low	48.9	Very low	121 Å²	121	126.1 Å²	126.1	79%	0.786	67%	0.669	S	S	*	*	S	Bend	trans	-85.8	136	167.8	34.3	-29.3	0	0	0	111.2
33	H	45.2	Very low	48.6	Very low	206 Å²	206	130.2 Å²	130.2	95%	0.954	68%	0.678	S	S	*	*	S	Bend	trans	48	101.2	165.6	-91.6	-104.3	0	0	0	119.1
34	G	40.6	Very low	48.3	Very low	68 Å²	68	134.3 Å²	134.3	70%	0.701	69%	0.687	S	S	*	*			trans	171.7	153.2	166.8	0	0	0	0	0	115	I36	G34-I36 PolarHBondContact O-N 3.12Å
35	I	45.8	Very low	47.9	Very low	169 Å²	169	132.6 Å²	132.6	87%	0.867	67%	0.671	S	S	*	*	S	Bend	trans	-47.5	130.2	-177.4	-59.6	169.5	0	0	0	110.7	K37	I35-K37 PolarHBondContact O-N 2.99Å
36	I	44.7	Very low	47.8	Very low	85 Å²	85	135.1 Å²	135.1	44%	0.436	67%	0.672	S	S	.	*			trans	-55.8	94	-164.1	-51	176.7	0	0	0	111.4	G34 V38 R90	G34-I36 PolarHBondContact O-N 3.12Å; I36-V38 HydrophobicContact CG2-CG2 3.82Å; I36-V38 PolarHBondContact O-N 2.79Å; I36-R90 VanDerWaalsContact CD1-NH1 3.35Å; I36-R90 VanDerWaalsContact CG1-NH1 3.3Å
37	K	42.8	Very low	48	Very low	186 Å²	186	134.8 Å²	134.8	81%	0.809	66%	0.663	S	S	*	*			trans	-83.6	99.7	162.8	-68.4	-174.7	-179.9	178.4	0	107	I35 K39	I35-K37 PolarHBondContact O-N 2.99Å; K37-K39 PolarHBondContact O-N 3.33Å
38	V	50.9	Low	48.7	Very low	63 Å²	63	129.6 Å²	129.6	38%	0.382	66%	0.66	S	S	.	*			trans	-70.1	86.6	169.6	-174.2	0	0	0	0	107.4	I36	I36-V38 HydrophobicContact CG2-CG2 3.82Å; I36-V38 PolarHBondContact O-N 2.79Å
39	K	51.3	Low	49.1	Very low	172 Å²	172	128.3 Å²	128.3	75%	0.748	65%	0.648	S	S	*	*			trans	-97.5	96.1	171.9	-164.8	169.2	-176.8	-178.1	0	106.4	K37	K37-K39 PolarHBondContact O-N 3.33Å
40	C	64.4	Low	49.6	Very low	35 Å²	35	123.8 Å²	123.8	24%	0.236	63%	0.632	C	S	.	*			trans	-60.7	129.1	173.5	-64.9	0	0	0	0	108.7	Y42 C79	C40-Y42 PolarHBondContact O-N 3.37Å; C40-C79 HydrophobicContact CB-CB 3.9Å; C40-C79 WeakPolarHBondContact CB-SG 2.98Å; C40-C79 WeakPolarHBondContact SG-CB 3.02Å; C40-C79 CovalentContact SG-SG 2.03Å; C40-C79 PolarHBondContact SG-SG 3.47Å
41	P	55.5	Low	50.9	Low	106 Å²	106	124 Å²	124	69%	0.688	64%	0.644	S	S	*	*	S	Bend	trans	-69.7	-21.3	-178.4	23.2	-28.2	0	0	0	112.1	E43	P41-E43 PolarHBondContact O-N 3.45Å
42	Y	54.7	Low	51.3	Low	110 Å²	110	121.5 Å²	121.5	43%	0.431	64%	0.636	S	S	.	*	S	Bend	trans	-90.7	101.5	174.9	-64.4	-90.6	0	0	0	107.3	C40 Q62 P75	C40-Y42 PolarHBondContact O-N 3.37Å; Y42-Q62 PolarHBondContact OH-OE1 3.03Å; Y42-P75 HydrophobicContact CD2-CB 3.95Å; Y42-P75 HydrophobicContact CE2-CB 3.46Å; Y42-P75 VanDerWaalsContact CE2-CB 3.46Å; Y42-P75 HydrophobicContact CE2-CG 3.87Å
43	E	45.9	Very low	51.7	Low	174 Å²	174	121.8 Å²	121.8	81%	0.813	64%	0.636	S	S	*	*			trans	-4.7	139.8	172	-163.7	149.6	-172	0	0	117.3	P41 V45	P41-E43 PolarHBondContact O-N 3.45Å; E43-V45 WeakPolarHBondContact O-CG2 3.49Å; E43-V45 PolarHBondContact O-N 3.01Å
44	K	48.5	Very low	52.5	Low	205 Å²	205	115.5 Å²	115.5	89%	0.891	61%	0.612	S	S	*	*			trans	-38.3	97	177.2	-69.4	179.1	-179.1	176.6	0	110.6	N46	K44-N46 PolarHBondContact O-N 3.39Å
45	V	52.3	Low	53.7	Low	70 Å²	70	117.4 Å²	117.4	42%	0.424	61%	0.606	S	S	.	*			trans	-66.6	114.9	177.1	-176.7	0	0	0	0	105.1	E43 L47	E43-V45 WeakPolarHBondContact O-CG2 3.49Å; E43-V45 PolarHBondContact O-N 3.01Å; V45-L47 HydrophobicContact CB-CD1 3.98Å; V45-L47 HydrophobicContact CG1-CD1 3.96Å; V45-L47 HydrophobicContact CG1-CG 4.43Å; V45-L47 WeakPolarHBondContact O-CD1 3.29Å; V45-L47 PolarHBondContact O-N 3.3Å; V45-L47 VanDerWaalsContact O-N 3.08Å
46	N	51.8	Low	54.9	Low	109 Å²	109	111.4 Å²	111.4	58%	0.583	58%	0.578	S	S	*	*			trans	-77.4	96.1	173.5	-165.4	-48.9	0	0	0	106.8	K44 S48 W49	K44-N46 PolarHBondContact O-N 3.39Å; N46-S48 PolarHBondContact O-N 3.42Å; N46-S48 VanDerWaalsContact O-N 3.12Å; N46-S48 WeakPolarHBondContact OD1-CB 3.44Å; N46-S48 PolarHBondContact OD1-N 3.28Å; N46-S48 PolarHBondContact OD1-OG 2.85Å; N46-W49 VanDerWaalsContact O-CD1 3.24Å
47	L	55.5	Low	56.4	Low	107 Å²	107	107.8 Å²	107.8	56%	0.56	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-71.6	7.8	-179.8	-83	90.1	0	0	0	113.5	V45 W49 Y50	V45-L47 HydrophobicContact CB-CD1 3.98Å; V45-L47 HydrophobicContact CG1-CD1 3.96Å; V45-L47 HydrophobicContact CG1-CG 4.43Å; V45-L47 WeakPolarHBondContact O-CD1 3.29Å; V45-L47 PolarHBondContact O-N 3.3Å; V45-L47 VanDerWaalsContact O-N 3.08Å; L47-W49 PolarHBondContact O-N 3.27Å; L47-W49 VanDerWaalsContact O-N 3.09Å; L47-Y50 WeakPolarHBondContact O-CB 3.41Å; L47-Y50 PolarHBondContact O-N 3.44Å
48	S	61.1	Low	58.1	Low	108 Å²	108	102.8 Å²	102.8	76%	0.755	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-62.4	-17.2	-178.7	60.4	0	0	0	0	114.6	N46	N46-S48 PolarHBondContact O-N 3.42Å; N46-S48 VanDerWaalsContact O-N 3.12Å; N46-S48 WeakPolarHBondContact OD1-CB 3.44Å; N46-S48 PolarHBondContact OD1-N 3.28Å; N46-S48 PolarHBondContact OD1-OG 2.85Å
49	W	53.3	Low	59.5	Low	144 Å²	144	104 Å²	104	55%	0.545	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-98.1	-2.8	176.4	74.9	-86.6	0	0	0	113.7	N46 L47 N51 V54	N46-W49 VanDerWaalsContact O-CD1 3.24Å; L47-W49 PolarHBondContact O-N 3.27Å; L47-W49 VanDerWaalsContact O-N 3.09Å; W49-N51 VanDerWaalsContact C-N 3.27Å; W49-N51 PolarHBondContact O-N 2.91Å; W49-V54 HydrophobicContact CH2-CB 3.56Å; W49-V54 HydrophobicContact CH2-CG1 3.69Å; W49-V54 HydrophobicContact CH2-CG2 4.24Å; W49-V54 HydrophobicContact CZ3-CB 3.65Å; W49-V54 HydrophobicContact CZ3-CG1 4.15Å; W49-V54 HydrophobicContact CZ3-CG2 3.85Å
50	Y	53.2	Low	60.9	Low	114 Å²	114	99.8 Å²	99.8	45%	0.447	56%	0.557	S	S	.	*			trans	-75.2	78.2	-176.1	-163.7	-95.5	0	0	0	110.7	L47 G52 V54 P56	L47-Y50 WeakPolarHBondContact O-CB 3.41Å; L47-Y50 PolarHBondContact O-N 3.44Å; Y50-G52 PolarHBondContact O-N 2.99Å; Y50-V54 VanDerWaalsContact CE2-O 3.24Å; Y50-V54 WeakPolarHBondContact CE2-O 3.41Å; Y50-P56 HydrophobicContact CE2-CG 4.47Å
51	N	58.8	Low	62.1	Low	150 Å²	150	104.4 Å²	104.4	80%	0.802	57%	0.571	S	S	*	*			trans	-80.7	28.6	168.4	-161.2	22.9	0	0	0	111.8	W49	W49-N51 VanDerWaalsContact C-N 3.27Å; W49-N51 PolarHBondContact O-N 2.91Å
52	G	55.4	Low	63.5	Low	49 Å²	49	103.2 Å²	103.2	51%	0.505	56%	0.556	S	S	.	*	S	Bend	trans	84.8	8	167.2	0	0	0	0	0	118.5	Y50	Y50-G52 PolarHBondContact O-N 2.99Å
53	T	54.9	Low	65.4	Low	128 Å²	128	99.5 Å²	99.5	79%	0.785	55%	0.545	S	S	*	.			trans	-126.2	-1.6	-168	49.6	0	0	0	0	117.6
54	V	61	Low	67.5	Low	74 Å²	74	91.5 Å²	91.5	45%	0.448	51%	0.508	S	S	.	.	S	Bend	trans	-131.1	129.4	-178	-173.8	0	0	0	0	110.9	W49 Y50	W49-V54 HydrophobicContact CH2-CB 3.56Å; W49-V54 HydrophobicContact CH2-CG1 3.69Å; W49-V54 HydrophobicContact CH2-CG2 4.24Å; W49-V54 HydrophobicContact CZ3-CB 3.65Å; W49-V54 HydrophobicContact CZ3-CG1 4.15Å; W49-V54 HydrophobicContact CZ3-CG2 3.85Å; Y50-V54 VanDerWaalsContact CE2-O 3.24Å; Y50-V54 WeakPolarHBondContact CE2-O 3.41Å
55	N	65.8	Low	69.6	Low	108 Å²	108	81.7 Å²	81.7	58%	0.578	47%	0.465	S	S	*	.			trans	-54	119.7	174.4	-178.1	2.4	0	0	0	109.5	C57	N55-C57 PolarHBondContact O-N 2.77Å; N55-C57 VanDerWaalsContact O-N 3.16Å; N55-C57 PolarHBondContact OD1-N 2.85Å; N55-C57 VanDerWaalsContact OD1-N 3.11Å
56	P	70.6	Confident	71.5	Confident	42 Å²	42	78.4 Å²	78.4	27%	0.273	45%	0.445	S	S	.	.	S	Bend	trans	-71.3	-9.2	-176.9	30.8	-36	0	0	0	112.4	Y50 V80	Y50-P56 HydrophobicContact CE2-CG 4.47Å; P56-V80 HydrophobicContact CG-CG2 4.11Å
57	C	77.6	Confident	73.4	Confident	9 Å²	9	75.9 Å²	75.9	6%	0.061	43%	0.434	C	S	.	.	S	Bend	trans	-101	134.7	-177.5	-63.7	0	0	0	0	112.1	N55 C76 I77	N55-C57 PolarHBondContact O-N 2.77Å; N55-C57 VanDerWaalsContact O-N 3.16Å; N55-C57 PolarHBondContact OD1-N 2.85Å; N55-C57 VanDerWaalsContact OD1-N 3.11Å; C57-C76 WeakPolarHBondContact CA-SG 3.07Å; C57-C76 HydrophobicContact CB-CB 3.57Å; C57-C76 WeakPolarHBondContact CB-SG 3.34Å; C57-C76 WeakPolarHBondContact SG-CB 3.38Å; C57-C76 PolarHBondContact SG-O 2.72Å; C57-C76 CovalentContact SG-SG 2.04Å; C57-C76 PolarHBondContact SG-SG 2.95Å; C57-I77 HydrophobicContact CB-CG1 4.24Å; C57-I77 PolarHBondContact SG-N 3.08Å
58	P	77.2	Confident	75.3	Confident	82 Å²	82	73.4 Å²	73.4	53%	0.532	42%	0.421	S	S	.	.			trans	-60.4	148.3	171.5	27.3	-33.5	0	0	0	109.9	L60 N74	P58-L60 PolarHBondContact O-N 3.23Å; P58-N74 PolarHBondContact O-ND2 3.35Å
59	G	80.4	Confident	77	Confident	87 Å²	87	75.3 Å²	75.3	90%	0.897	42%	0.416	S	S	*	.	S	Bend	trans	-72.4	38.6	174.2	0	0	0	0	0	113.6
60	L	80.1	Confident	79.1	Confident	85 Å²	85	72.6 Å²	72.6	45%	0.445	41%	0.412	S	S	.	.			trans	-82	132.8	174.5	-177.5	63.9	0	0	0	108.3	P58 Q62 N74	P58-L60 PolarHBondContact O-N 3.23Å; L60-Q62 HydrophobicContact CD2-CG 4.06Å; L60-Q62 HydrophobicContact CG-CG 3.96Å; L60-N74 WeakPolarHBondContact O-CB 3.39Å; L60-N74 PolarHBondContact O-ND2 3.46Å
61	Y	90	Very high	81.1	Confident	132 Å²	132	69.3 Å²	69.3	52%	0.518	40%	0.403	S	S	.	.			trans	-99.4	107.9	175.3	-175.4	-103.3	0	0	0	110	P63 D73 K96	Y61-P63 HydrophobicContact CE1-CG 3.92Å; Y61-D73 HydrophobicContact CD2-CB 4.11Å; Y61-D73 HydrophobicContact CE2-CB 4.33Å; Y61-K96 VanDerWaalsContact OH-CE 3.29Å; Y61-K96 WeakPolarHBondContact OH-CE 3.44Å
62	Q	86.5	Confident	82.7	Confident	80 Å²	80	63.1 Å²	63.1	37%	0.374	37%	0.369	S	S	.	.			trans	-142.7	77.3	179.8	-78.6	-179.3	-28.2	0	0	108	Y42 L60 I64 D73 N74	Y42-Q62 PolarHBondContact OH-OE1 3.03Å; L60-Q62 HydrophobicContact CD2-CG 4.06Å; L60-Q62 HydrophobicContact CG-CG 3.96Å; Q62-I64 PolarHBondContact O-N 3.25Å; Q62-D73 CarbonylContact C-O 3.53Å; Q62-D73 PolarHBondContact N-O 3.4Å; Q62-N74 WeakPolarHBondContact O-CA 3.35Å
63	P	93.4	Very high	84.6	Confident	32 Å²	32	65.1 Å²	65.1	21%	0.208	37%	0.368	C	S	.	.			trans	-62.8	136.6	-169.9	25.6	-34.5	0	0	0	111.3	Y61 T71 Y72 G95 K96	Y61-P63 HydrophobicContact CE1-CG 3.92Å; P63-T71 HydrophobicContact CB-CG2 4.18Å; P63-Y72 VanDerWaalsContact CA-O 3.31Å; P63-Y72 WeakPolarHBondContact CA-O 3.47Å; P63-G95 CarbonylContact O-C 3.17Å; P63-G95 WeakPolarHBondContact O-CA 3.44Å; P63-G95 PolarHBondContact O-N 3.24Å; P63-K96 HydrophobicContact CB-CG 4.13Å
64	I	91.1	Very high	86.1	Confident	6 Å²	6	59.4 Å²	59.4	3%	0.031	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	155.4	176.8	60.4	168.6	0	0	0	111	Q62 T71 Y72 P75 L78 F91 G95	Q62-I64 PolarHBondContact O-N 3.25Å; I64-T71 WeakPolarHBondContact O-CA 3.31Å; I64-Y72 PolarHBondContact N-O 2.97Å; I64-Y72 PolarHBondContact O-N 3.48Å; I64-P75 VanDerWaalsContact CD1-CA 3.49Å; I64-P75 HydrophobicContact CD1-CB 3.96Å; I64-P75 HydrophobicContact CD1-CG 4.06Å; I64-P75 HydrophobicContact CG2-CG 4.28Å; I64-L78 HydrophobicContact CD1-CB 3.77Å; I64-L78 HydrophobicContact CD1-CD2 3.32Å; I64-L78 HydrophobicContact CD1-CG 4.15Å; I64-L78 HydrophobicContact CG1-CD2 4.31Å; I64-F91 HydrophobicContact CB-CD2 4.42Å; I64-F91 HydrophobicContact CB-CE2 4.2Å; I64-F91 HydrophobicContact CD1-CD2 4.1Å; I64-F91 HydrophobicContact CG2-CE2 4.17Å; I64-G95 CarbonylContact C-O 3.42Å; I64-G95 WeakPolarHBondContact CA-O 3.17Å; I64-G95 PolarHBondContact N-O 2.96Å
65	C	91.4	Very high	87.2	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.1	177.8	-171.4	0	0	0	0	111.1	Y92 H93 G95 C97	C65-Y92 HydrophobicContact CB-CD1 4.45Å; C65-Y92 WeakPolarHBondContact O-CA 3.24Å; C65-Y92 WeakPolarHBondContact O-CB 3.38Å; C65-Y92 PolarHBondContact O-N 2.86Å; C65-H93 VanDerWaalsContact CB-CE1 3.44Å; C65-H93 WeakPolarHBondContact CB-CE1 3.18Å; C65-H93 PolarHBondContact N-O 2.81Å; C65-H93 PolarHBondContact O-N 3.11Å; C65-G95 PolarHBondContact N-O 3.27Å; C65-C97 WeakPolarHBondContact CA-SG 3.29Å; C65-C97 HydrophobicContact CB-CB 4.1Å; C65-C97 WeakPolarHBondContact CB-SG 3.22Å; C65-C97 WeakPolarHBondContact SG-CB 3.23Å; C65-C97 CovalentContact SG-SG 2.03Å; C65-C97 PolarHBondContact SG-SG 2.93Å
66	G	92.3	Very high	88.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	163	171.3	0	0	0	0	0	113	N68 F69 I70 R90	G66-N68 PolarHBondContact O-N 2.04Å; G66-N68 VanDerWaalsContact O-N 3.08Å; G66-F69 PolarHBondContact O-N 3.02Å; G66-I70 PolarHBondContact N-O 3.25Å; G66-R90 CarbonylContact C-O 3.5Å; G66-R90 WeakPolarHBondContact CA-O 3.41Å
67	T	92.6	Very high	89.1	Confident	57 Å²	57	52.8 Å²	52.8	35%	0.35	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-10.7	175.3	51.8	0	0	0	0	113.9	F69 R90	T67-F69 VanDerWaalsContact C-N 3.33Å; T67-R90 HydrophobicContact CG2-CB 3.8Å; T67-R90 PolarHBondContact N-O 3.16Å; T67-R90 PolarHBondContact OG1-N 3.2Å
68	N	94.8	Very high	89.6	Confident	54 Å²	54	52.9 Å²	52.9	29%	0.289	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	8.4	171.5	61.7	-16.3	0	0	0	113.1	G66 I70 Y72	G66-N68 PolarHBondContact O-N 2.04Å; G66-N68 VanDerWaalsContact O-N 3.08Å; N68-I70 WeakPolarHBondContact ND2-CD1 3.14Å; N68-I70 PolarHBondContact O-N 2.03Å; N68-I70 PolarHBondContact OD1-N 3.09Å; N68-Y72 PolarHBondContact ND2-OH 3.17Å
69	F	96.3	Very high	90	Very high	149 Å²	149	50 Å²	50	65%	0.654	28%	0.275	S	S	*	.	S	Bend	trans	60.1	26.3	-177.1	-54.1	-79.1	0	0	0	114.2	G66 T67 Y92	G66-F69 PolarHBondContact O-N 3.02Å; T67-F69 VanDerWaalsContact C-N 3.33Å; F69-Y92 HydrophobicContact CE1-CE1 4.21Å
70	I	97.2	Very high	90.2	Very high	87 Å²	87	47.8 Å²	47.8	45%	0.446	24%	0.244	S	C	.	.			trans	-101.1	133.8	172.1	-60	-173.3	0	0	0	108.8	G66 N68 Y72 C97	G66-I70 PolarHBondContact N-O 3.25Å; N68-I70 WeakPolarHBondContact ND2-CD1 3.14Å; N68-I70 PolarHBondContact O-N 2.03Å; N68-I70 PolarHBondContact OD1-N 3.09Å; I70-Y72 HydrophobicContact CB-CE2 3.94Å; I70-Y72 HydrophobicContact CG2-CD2 4.49Å; I70-Y72 HydrophobicContact CG2-CE2 4.05Å; I70-Y72 VanDerWaalsContact O-CD2 3.24Å; I70-Y72 WeakPolarHBondContact O-CD2 3.37Å; I70-Y72 WeakPolarHBondContact O-CE2 3.22Å; I70-C97 PolarHBondContact O-SG 3.27Å
71	T	96	Very high	90.7	Very high	45 Å²	45	46.7 Å²	46.7	28%	0.276	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	129.6	170.7	-64.8	0	0	0	0	109.6	P63 I64 K96 C97	P63-T71 HydrophobicContact CB-CG2 4.18Å; I64-T71 WeakPolarHBondContact O-CA 3.31Å; T71-K96 HydrophobicContact CG2-CB 4.04Å; T71-K96 HydrophobicContact CG2-CG 3.88Å; T71-K96 WeakPolarHBondContact OG1-CA 3.14Å; T71-C97 PolarHBondContact OG1-N 3.14Å
72	Y	93.3	Very high	90.5	Very high	20 Å²	20	40.7 Å²	40.7	8%	0.078	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.5	174.1	-66.5	-91.3	0	0	0	109.5	P63 I64 N68 I70 N74 I77 L78 E81 I89	P63-Y72 VanDerWaalsContact CA-O 3.31Å; P63-Y72 WeakPolarHBondContact CA-O 3.47Å; I64-Y72 PolarHBondContact N-O 2.97Å; I64-Y72 PolarHBondContact O-N 3.48Å; N68-Y72 PolarHBondContact ND2-OH 3.17Å; I70-Y72 HydrophobicContact CB-CE2 3.94Å; I70-Y72 HydrophobicContact CG2-CD2 4.49Å; I70-Y72 HydrophobicContact CG2-CE2 4.05Å; I70-Y72 VanDerWaalsContact O-CD2 3.24Å; I70-Y72 WeakPolarHBondContact O-CD2 3.37Å; I70-Y72 WeakPolarHBondContact O-CE2 3.22Å; Y72-N74 PolarHBondContact O-N 2.99Å; Y72-N74 VanDerWaalsContact O-N 3.14Å; Y72-I77 HydrophobicContact CD1-CB 4.41Å; Y72-I77 HydrophobicContact CD1-CG2 3.79Å; Y72-I77 HydrophobicContact CE1-CG2 4.49Å; Y72-L78 HydrophobicContact CD1-CB 4.28Å; Y72-L78 HydrophobicContact CD2-CB 4.14Å; Y72-L78 HydrophobicContact CD2-CD1 3.46Å; Y72-L78 VanDerWaalsContact CD2-CD1 3.46Å; Y72-L78 HydrophobicContact CD2-CG 4.34Å; Y72-L78 HydrophobicContact CE1-CD1 4.46Å; Y72-L78 HydrophobicContact CE2-CD1 3.38Å; Y72-L78 HydrophobicContact CG-CB 3.89Å; Y72-L78 HydrophobicContact CG-CD1 4.05Å; Y72-E81 HydrophobicContact CE1-CB 3.87Å; Y72-E81 HydrophobicContact CE1-CG 4Å; Y72-I89 HydrophobicContact CE2-CG2 4.31Å
73	D	93.6	Very high	90.3	Very high	90 Å²	90	41.9 Å²	41.9	48%	0.481	22%	0.222	S	C	.	.	S	Bend	trans	-61.7	-25.2	-175.4	-65.8	-31.4	0	0	0	113.4	Y61 Q62 I77	Y61-D73 HydrophobicContact CD2-CB 4.11Å; Y61-D73 HydrophobicContact CE2-CB 4.33Å; Q62-D73 CarbonylContact C-O 3.53Å; Q62-D73 PolarHBondContact N-O 3.4Å; D73-I77 HydrophobicContact CB-CD1 3.92Å
74	N	87.2	Confident	89.9	Confident	8 Å²	8	46.8 Å²	46.8	4%	0.043	24%	0.241	C	C	.	.	S	Bend	trans	-154.9	164.7	170.3	63.5	59.4	0	0	0	113.2	P58 L60 Q62 Y72 C76 I77 L78	P58-N74 PolarHBondContact O-ND2 3.35Å; L60-N74 WeakPolarHBondContact O-CB 3.39Å; L60-N74 PolarHBondContact O-ND2 3.46Å; Q62-N74 WeakPolarHBondContact O-CA 3.35Å; Y72-N74 PolarHBondContact O-N 2.99Å; Y72-N74 VanDerWaalsContact O-N 3.14Å; N74-C76 PolarHBondContact O-N 2.84Å; N74-C76 WeakPolarHBondContact OD1-CA 3.29Å; N74-C76 VanDerWaalsContact OD1-CB 3.29Å; N74-C76 WeakPolarHBondContact OD1-CB 3.44Å; N74-C76 PolarHBondContact OD1-N 3.38Å; N74-I77 PolarHBondContact O-N 2.81Å; N74-I77 WeakPolarHBondContact OD1-CG1 3.1Å; N74-I77 PolarHBondContact OD1-N 3.2Å; N74-L78 PolarHBondContact O-N 3.15Å
75	P	83.9	Confident	89.7	Confident	23 Å²	23	47.4 Å²	47.4	15%	0.149	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-26.3	178.2	-23.6	33.4	0	0	0	115.6	Y42 I64 C79	Y42-P75 HydrophobicContact CD2-CB 3.95Å; Y42-P75 HydrophobicContact CE2-CB 3.46Å; Y42-P75 VanDerWaalsContact CE2-CB 3.46Å; Y42-P75 HydrophobicContact CE2-CG 3.87Å; I64-P75 VanDerWaalsContact CD1-CA 3.49Å; I64-P75 HydrophobicContact CD1-CB 3.96Å; I64-P75 HydrophobicContact CD1-CG 4.06Å; I64-P75 HydrophobicContact CG2-CG 4.28Å; P75-C79 WeakPolarHBondContact O-CB 2.98Å; P75-C79 PolarHBondContact O-N 3.32Å
76	C	86.3	Confident	89.2	Confident	14 Å²	14	55.5 Å²	55.5	10%	0.095	28%	0.283	C	S	.	.	H	α-helix	trans	-67.6	-43.3	176.9	177.6	0	0	0	0	111.1	C57 N74 L78 C79 V80	C57-C76 WeakPolarHBondContact CA-SG 3.07Å; C57-C76 HydrophobicContact CB-CB 3.57Å; C57-C76 WeakPolarHBondContact CB-SG 3.34Å; C57-C76 WeakPolarHBondContact SG-CB 3.38Å; C57-C76 PolarHBondContact SG-O 2.72Å; C57-C76 CovalentContact SG-SG 2.04Å; C57-C76 PolarHBondContact SG-SG 2.95Å; N74-C76 PolarHBondContact O-N 2.84Å; N74-C76 WeakPolarHBondContact OD1-CA 3.29Å; N74-C76 VanDerWaalsContact OD1-CB 3.29Å; N74-C76 WeakPolarHBondContact OD1-CB 3.44Å; N74-C76 PolarHBondContact OD1-N 3.38Å; C76-L78 VanDerWaalsContact C-N 3.35Å; C76-L78 PolarHBondContact O-N 2.75Å; C76-C79 WeakPolarHBondContact O-CB 3.28Å; C76-C79 PolarHBondContact O-N 2.88Å; C76-C79 VanDerWaalsContact O-N 3.12Å; C76-V80 WeakPolarHBondContact O-CG2 3.46Å; C76-V80 PolarHBondContact O-N 3.02Å
77	I	89.8	Confident	88.7	Confident	49 Å²	49	56 Å²	56	25%	0.251	29%	0.288	S	S	.	.	H	α-helix	trans	-62.2	-44.3	178.2	-60.7	164.4	0	0	0	110.1	C57 Y72 D73 N74 C79 V80 E81	C57-I77 HydrophobicContact CB-CG1 4.24Å; C57-I77 PolarHBondContact SG-N 3.08Å; Y72-I77 HydrophobicContact CD1-CB 4.41Å; Y72-I77 HydrophobicContact CD1-CG2 3.79Å; Y72-I77 HydrophobicContact CE1-CG2 4.49Å; D73-I77 HydrophobicContact CB-CD1 3.92Å; N74-I77 PolarHBondContact O-N 2.81Å; N74-I77 WeakPolarHBondContact OD1-CG1 3.1Å; N74-I77 PolarHBondContact OD1-N 3.2Å; I77-C79 VanDerWaalsContact C-N 3.31Å; I77-C79 PolarHBondContact O-N 3.17Å; I77-V80 PolarHBondContact O-N 3.12Å; I77-E81 PolarHBondContact O-N 2.57Å
78	L	88.9	Confident	88.4	Confident	11 Å²	11	63.1 Å²	63.1	6%	0.058	31%	0.308	C	S	.	.	H	α-helix	trans	-59.1	-42.2	173.9	177.7	72.4	0	0	0	111.7	I64 Y72 N74 C76 E81 S82 I89 F91	I64-L78 HydrophobicContact CD1-CB 3.77Å; I64-L78 HydrophobicContact CD1-CD2 3.32Å; I64-L78 HydrophobicContact CD1-CG 4.15Å; I64-L78 HydrophobicContact CG1-CD2 4.31Å; Y72-L78 HydrophobicContact CD1-CB 4.28Å; Y72-L78 HydrophobicContact CD2-CB 4.14Å; Y72-L78 HydrophobicContact CD2-CD1 3.46Å; Y72-L78 VanDerWaalsContact CD2-CD1 3.46Å; Y72-L78 HydrophobicContact CD2-CG 4.34Å; Y72-L78 HydrophobicContact CE1-CD1 4.46Å; Y72-L78 HydrophobicContact CE2-CD1 3.38Å; Y72-L78 HydrophobicContact CG-CB 3.89Å; Y72-L78 HydrophobicContact CG-CD1 4.05Å; N74-L78 PolarHBondContact O-N 3.15Å; C76-L78 VanDerWaalsContact C-N 3.35Å; C76-L78 PolarHBondContact O-N 2.75Å; L78-E81 PolarHBondContact O-N 3.25Å; L78-S82 VanDerWaalsContact O-CB 3.24Å; L78-S82 WeakPolarHBondContact O-CB 3.49Å; L78-S82 PolarHBondContact O-N 3.17Å; L78-I89 HydrophobicContact CD1-CG2 3.67Å; L78-F91 HydrophobicContact CD2-CB 3.92Å; L78-F91 HydrophobicContact CD2-CD2 4.34Å
79	C	85.3	Confident	88.2	Confident	21 Å²	21	61.7 Å²	61.7	14%	0.142	30%	0.301	C	S	.	.	H	α-helix	trans	-60.7	-46.8	177.6	168.4	0	0	0	0	111.7	C40 P75 C76 I77 E81 S82 L83	C40-C79 HydrophobicContact CB-CB 3.9Å; C40-C79 WeakPolarHBondContact CB-SG 2.98Å; C40-C79 WeakPolarHBondContact SG-CB 3.02Å; C40-C79 CovalentContact SG-SG 2.03Å; C40-C79 PolarHBondContact SG-SG 3.47Å; P75-C79 WeakPolarHBondContact O-CB 2.98Å; P75-C79 PolarHBondContact O-N 3.32Å; C76-C79 WeakPolarHBondContact O-CB 3.28Å; C76-C79 PolarHBondContact O-N 2.88Å; C76-C79 VanDerWaalsContact O-N 3.12Å; I77-C79 VanDerWaalsContact C-N 3.31Å; I77-C79 PolarHBondContact O-N 3.17Å; C79-E81 VanDerWaalsContact C-N 3.31Å; C79-E81 PolarHBondContact O-N 2.99Å; C79-S82 WeakPolarHBondContact O-CB 3.49Å; C79-S82 PolarHBondContact O-N 3.25Å; C79-L83 WeakPolarHBondContact O-CG 3.27Å; C79-L83 PolarHBondContact O-N 3.25Å
80	V	85	Confident	87.8	Confident	40 Å²	40	59.1 Å²	59.1	24%	0.242	29%	0.286	C	S	.	.	H	α-helix	trans	-59.4	-44.2	176.9	171.4	0	0	0	0	110.7	P56 C76 I77 L83 K84	P56-V80 HydrophobicContact CG-CG2 4.11Å; C76-V80 WeakPolarHBondContact O-CG2 3.46Å; C76-V80 PolarHBondContact O-N 3.02Å; I77-V80 PolarHBondContact O-N 3.12Å; V80-L83 PolarHBondContact O-N 3.46Å; V80-K84 WeakPolarHBondContact O-CG 3.24Å; V80-K84 PolarHBondContact O-N 3.47Å
81	E	89.4	Confident	87.2	Confident	63 Å²	63	58.1 Å²	58.1	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-71.1	-33	-179.7	-153.5	59.4	-156.6	0	0	112.5	Y72 I77 L78 C79 K84 S85 I89	Y72-E81 HydrophobicContact CE1-CB 3.87Å; Y72-E81 HydrophobicContact CE1-CG 4Å; I77-E81 PolarHBondContact O-N 2.57Å; L78-E81 PolarHBondContact O-N 3.25Å; C79-E81 VanDerWaalsContact C-N 3.31Å; C79-E81 PolarHBondContact O-N 2.99Å; E81-K84 WeakPolarHBondContact OE2-CD 3.39Å; E81-K84 IonicContact OE2-NZ 2.91Å; E81-K84 PolarHBondContact OE2-NZ 2.9Å; E81-S85 VanDerWaalsContact O-CB 3.26Å; E81-S85 WeakPolarHBondContact O-CB 3.32Å; E81-S85 PolarHBondContact O-N 2.92Å; E81-S85 PolarHBondContact O-OG 3.46Å; E81-I89 HydrophobicContact CG-CD1 3.81Å
82	S	86.2	Confident	86.8	Confident	5 Å²	5	62.2 Å²	62.2	4%	0.035	29%	0.29	C	S	.	.	H	α-helix	trans	-61.3	-45.5	169.8	-169.6	0	0	0	0	111.3	L78 C79 S85 H86 G87 I89	L78-S82 VanDerWaalsContact O-CB 3.24Å; L78-S82 WeakPolarHBondContact O-CB 3.49Å; L78-S82 PolarHBondContact O-N 3.17Å; C79-S82 WeakPolarHBondContact O-CB 3.49Å; C79-S82 PolarHBondContact O-N 3.25Å; S82-S85 WeakPolarHBondContact CA-OG 3.17Å; S82-S85 CarbonylContact O-C 3.03Å; S82-S85 PolarHBondContact O-N 3.33Å; S82-S85 PolarHBondContact O-OG 3.42Å; S82-S85 VanDerWaalsContact O-OG 3.06Å; S82-H86 PolarHBondContact O-N 3.32Å; S82-G87 WeakPolarHBondContact O-CA 3.11Å; S82-G87 PolarHBondContact O-N 2.99Å; S82-I89 WeakPolarHBondContact CB-O 3.4Å; S82-I89 PolarHBondContact OG-O 2.91Å
83	L	82.1	Confident	86.4	Confident	105 Å²	105	64.8 Å²	64.8	55%	0.55	30%	0.303	S	S	.	.	H	α-helix	trans	-63.4	-47	177	-70.9	171	0	0	0	111.9	C79 V80 S85 H86	C79-L83 WeakPolarHBondContact O-CG 3.27Å; C79-L83 PolarHBondContact O-N 3.25Å; V80-L83 PolarHBondContact O-N 3.46Å; L83-S85 PolarHBondContact O-N 3.35Å; L83-H86 PolarHBondContact O-N 3.13Å; L83-H86 VanDerWaalsContact O-N 3.08Å
84	K	84.6	Confident	86	Confident	136 Å²	136	66.5 Å²	66.5	59%	0.591	31%	0.312	S	S	*	.	H	α-helix	trans	-59.7	-36.6	175.9	-70.4	176.6	-167.6	160.7	0	112.5	V80 E81 H86	V80-K84 WeakPolarHBondContact O-CG 3.24Å; V80-K84 PolarHBondContact O-N 3.47Å; E81-K84 WeakPolarHBondContact OE2-CD 3.39Å; E81-K84 IonicContact OE2-NZ 2.91Å; E81-K84 PolarHBondContact OE2-NZ 2.9Å; K84-H86 PolarHBondContact O-N 3.46Å
85	S	86.6	Confident	86	Confident	18 Å²	18	67.4 Å²	67.4	13%	0.126	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	10.4	179.3	66.9	0	0	0	0	113.6	E81 S82 L83 G87 R88 I89	E81-S85 VanDerWaalsContact O-CB 3.26Å; E81-S85 WeakPolarHBondContact O-CB 3.32Å; E81-S85 PolarHBondContact O-N 2.92Å; E81-S85 PolarHBondContact O-OG 3.46Å; S82-S85 WeakPolarHBondContact CA-OG 3.17Å; S82-S85 CarbonylContact O-C 3.03Å; S82-S85 PolarHBondContact O-N 3.33Å; S82-S85 PolarHBondContact O-OG 3.42Å; S82-S85 VanDerWaalsContact O-OG 3.06Å; L83-S85 PolarHBondContact O-N 3.35Å; S85-G87 PolarHBondContact O-N 3.11Å; S85-R88 WeakPolarHBondContact O-CB 3.41Å; S85-R88 WeakPolarHBondContact O-CD 3.23Å; S85-R88 WeakPolarHBondContact O-CG 3.44Å; S85-R88 PolarHBondContact O-N 3.21Å; S85-I89 PolarHBondContact OG-N 2.87Å
86	H	82.8	Confident	86.6	Confident	171 Å²	171	72.6 Å²	72.6	79%	0.792	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	38.1	-177.1	-61.2	-92.7	0	0	0	113.2	S82 L83 K84 R88	S82-H86 PolarHBondContact O-N 3.32Å; L83-H86 PolarHBondContact O-N 3.13Å; L83-H86 VanDerWaalsContact O-N 3.08Å; K84-H86 PolarHBondContact O-N 3.46Å; H86-R88 VanDerWaalsContact C-N 3.34Å; H86-R88 PolarHBondContact O-N 3.24Å
87	G	81.5	Confident	86.8	Confident	10 Å²	10	76 Å²	76	10%	0.103	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	8.7	178.4	0	0	0	0	0	115.3	S82 S85 R90	S82-G87 WeakPolarHBondContact O-CA 3.11Å; S82-G87 PolarHBondContact O-N 2.99Å; S85-G87 PolarHBondContact O-N 3.11Å; G87-R90 WeakPolarHBondContact O-CG 3.4Å
88	R	86.5	Confident	86.7	Confident	207 Å²	207	77.4 Å²	77.4	78%	0.781	37%	0.373	S	S	*	.			trans	-65.8	-40.5	175.2	-69	171.4	-176.5	168.1	1.9	111.9	S85 H86	S85-R88 WeakPolarHBondContact O-CB 3.41Å; S85-R88 WeakPolarHBondContact O-CD 3.23Å; S85-R88 WeakPolarHBondContact O-CG 3.44Å; S85-R88 PolarHBondContact O-N 3.21Å; H86-R88 VanDerWaalsContact C-N 3.34Å; H86-R88 PolarHBondContact O-N 3.24Å
89	I	89.5	Confident	86.6	Confident	24 Å²	24	80.9 Å²	80.9	12%	0.123	39%	0.389	C	S	.	.	S	Bend	trans	-89.4	128	175.5	-57.5	166	0	0	0	107.9	Y72 L78 E81 S82 S85	Y72-I89 HydrophobicContact CE2-CG2 4.31Å; L78-I89 HydrophobicContact CD1-CG2 3.67Å; E81-I89 HydrophobicContact CG-CD1 3.81Å; S82-I89 WeakPolarHBondContact CB-O 3.4Å; S82-I89 PolarHBondContact OG-O 2.91Å; S85-I89 PolarHBondContact OG-N 2.87Å
90	R	87.3	Confident	86.6	Confident	95 Å²	95	84.2 Å²	84.2	36%	0.358	40%	0.403	S	S	.	.			trans	-133.9	168.8	-178.5	-58.2	173.1	68.9	-174.2	3.2	110.1	I36 G66 T67 G87	I36-R90 VanDerWaalsContact CD1-NH1 3.35Å; I36-R90 VanDerWaalsContact CG1-NH1 3.3Å; G66-R90 CarbonylContact C-O 3.5Å; G66-R90 WeakPolarHBondContact CA-O 3.41Å; T67-R90 HydrophobicContact CG2-CB 3.8Å; T67-R90 PolarHBondContact N-O 3.16Å; T67-R90 PolarHBondContact OG1-N 3.2Å; G87-R90 WeakPolarHBondContact O-CG 3.4Å
91	F	85.8	Confident	86.7	Confident	65 Å²	65	86.8 Å²	86.8	29%	0.285	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	135.7	169.3	175	-97.2	0	0	0	110.7	I64 L78 H93	I64-F91 HydrophobicContact CB-CD2 4.42Å; I64-F91 HydrophobicContact CB-CE2 4.2Å; I64-F91 HydrophobicContact CD1-CD2 4.1Å; I64-F91 HydrophobicContact CG2-CE2 4.17Å; L78-F91 HydrophobicContact CD2-CB 3.92Å; L78-F91 HydrophobicContact CD2-CD2 4.34Å; F91-H93 VanDerWaalsContact CE2-C 3.46Å; F91-H93 VanDerWaalsContact CZ-CA 3.5Å
92	Y	87.4	Confident	86.6	Confident	132 Å²	132	88.3 Å²	88.3	52%	0.518	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-63.8	173.9	-173.5	-127.3	0	0	0	111.4	C65 F69	C65-Y92 HydrophobicContact CB-CD1 4.45Å; C65-Y92 WeakPolarHBondContact O-CA 3.24Å; C65-Y92 WeakPolarHBondContact O-CB 3.38Å; C65-Y92 PolarHBondContact O-N 2.86Å; F69-Y92 HydrophobicContact CE1-CE1 4.21Å
93	H	84.9	Confident	86.6	Confident	73 Å²	73	93.9 Å²	93.9	34%	0.338	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	165.6	173.3	64.5	75	0	0	0	112.1	C65 F91 K96	C65-H93 VanDerWaalsContact CB-CE1 3.44Å; C65-H93 WeakPolarHBondContact CB-CE1 3.18Å; C65-H93 PolarHBondContact N-O 2.81Å; C65-H93 PolarHBondContact O-N 3.11Å; F91-H93 VanDerWaalsContact CE2-C 3.46Å; F91-H93 VanDerWaalsContact CZ-CA 3.5Å; H93-K96 PolarHBondContact CE1-O 2.72Å
94	D	84.1	Confident	86.9	Confident	126 Å²	126	93.1 Å²	93.1	67%	0.674	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	152.8	172.7	-60.4	-68.2	0	0	0	111.7
95	G	87.9	Confident	87.1	Confident	28 Å²	28	89.8 Å²	89.8	29%	0.289	43%	0.426	S	S	.	.	S	Bend	trans	83	-179.4	-176.6	0	0	0	0	0	113.2	P63 I64 C65	P63-G95 CarbonylContact O-C 3.17Å; P63-G95 WeakPolarHBondContact O-CA 3.44Å; P63-G95 PolarHBondContact O-N 3.24Å; I64-G95 CarbonylContact C-O 3.42Å; I64-G95 WeakPolarHBondContact CA-O 3.17Å; I64-G95 PolarHBondContact N-O 2.96Å; C65-G95 PolarHBondContact N-O 3.27Å
96	K	95.5	Very high	87.1	Confident	131 Å²	131	95.8 Å²	95.8	57%	0.57	45%	0.452	S	S	*	.			trans	-70.8	146.2	177.2	-53.9	-166.1	174.9	-176.6	0	110.4	Y61 P63 T71 H93	Y61-K96 VanDerWaalsContact OH-CE 3.29Å; Y61-K96 WeakPolarHBondContact OH-CE 3.44Å; P63-K96 HydrophobicContact CB-CG 4.13Å; T71-K96 HydrophobicContact CG2-CB 4.04Å; T71-K96 HydrophobicContact CG2-CG 3.88Å; T71-K96 WeakPolarHBondContact OG1-CA 3.14Å; H93-K96 PolarHBondContact CE1-O 2.72Å
97	C	92.3	Very high	87.5	Confident	87 Å²	87	88.9 Å²	88.9	59%	0.588	42%	0.421	S	S	*	.			trans	-64	0	151.5	-34.2	0	0	0	0	107.9	C65 I70 T71	C65-C97 WeakPolarHBondContact CA-SG 3.29Å; C65-C97 HydrophobicContact CB-CB 4.1Å; C65-C97 WeakPolarHBondContact CB-SG 3.22Å; C65-C97 WeakPolarHBondContact SG-CB 3.23Å; C65-C97 CovalentContact SG-SG 2.03Å; C65-C97 PolarHBondContact SG-SG 2.93Å; I70-C97 PolarHBondContact O-SG 3.27Å; T71-C97 PolarHBondContact OG1-N 3.14Å

Retrieved 97 of 97 residues in 49.8 ms (Link to these results)

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