A0A077Z976_TRITR Loading...

Cystatin domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z976, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 127 aa.

						>A0A077Z976_TRITR|A0A077Z976
MVALLKLSVIVLCFVSVSAVEKALLDKFAQAAVNGINKDKDSGDKLFIVYKYSSVEESDKAVIFDLIAVQTSCPKNAQYDEKKCKPTGKSPVLEHKVVASKKPGGVFSVASTGPMDPDSHETLSKLK
					

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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)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.8	Very low	49.8	Very low	244 Å²	244	141.4 Å²	141.4	100%	1.202	78%	0.783	S	S	*	*				0	106.2	0	-71.7	-179	-99.7	0	107.3
2	V	44.2	Very low	49.7	Very low	139 Å²	139	139.3 Å²	139.3	84%	0.842	77%	0.769	S	S	*	*			trans	-88.7	111.5	-178.9	178.7	0	0	0	107.2	L4	V2-L4 PolarHBondContact O-N 3.15Å; V2-L4 VanDerWaalsContact O-N 3.15Å
3	A	48.4	Very low	49.7	Very low	89 Å²	89	135.9 Å²	135.9	74%	0.736	76%	0.759	S	S	*	*			trans	-71.6	105.5	178.7	0	0	0	0	109.3	L5	A3-L5 PolarHBondContact O-N 3.15Å; A3-L5 VanDerWaalsContact O-N 3.15Å
4	L	49.6	Very low	49.3	Very low	160 Å²	160	137.9 Å²	137.9	84%	0.838	76%	0.756	S	S	*	*			trans	-72.3	96.9	168.6	-82.5	154	0	0	108.6	V2 K6	V2-L4 PolarHBondContact O-N 3.15Å; V2-L4 VanDerWaalsContact O-N 3.15Å; L4-K6 PolarHBondContact O-N 3.07Å
5	L	46.9	Very low	49.3	Very low	150 Å²	150	135.9 Å²	135.9	79%	0.785	75%	0.749	S	S	*	*			trans	-65.2	104.2	164.5	-104.3	104.4	0	0	108.4	A3 L7	A3-L5 PolarHBondContact O-N 3.15Å; A3-L5 VanDerWaalsContact O-N 3.15Å; L5-L7 PolarHBondContact O-N 3.07Å; L5-L7 VanDerWaalsContact O-N 3.07Å
6	K	52.5	Low	48.8	Very low	189 Å²	189	134.5 Å²	134.5	82%	0.822	75%	0.752	S	S	*	*			trans	-70.3	97.9	165	-73.1	-169.9	176.5	-177.5	108	L4 S8	L4-K6 PolarHBondContact O-N 3.07Å; K6-S8 PolarHBondContact O-N 3.01Å
7	L	45.6	Very low	48.8	Very low	143 Å²	143	133.5 Å²	133.5	75%	0.749	75%	0.749	S	S	*	*			trans	-66.9	84.7	163.7	-103.7	100.4	0	0	108.5	L5 V9	L5-L7 PolarHBondContact O-N 3.07Å; L5-L7 VanDerWaalsContact O-N 3.07Å; L7-V9 HydrophobicContact CD2-CG2 4.06Å; L7-V9 PolarHBondContact O-N 2.88Å
8	S	54.4	Low	49	Very low	95 Å²	95	129.9 Å²	129.9	66%	0.664	74%	0.735	S	S	*	*			trans	-75.9	78.6	165.8	-53.9	0	0	0	107.8	K6 I10	K6-S8 PolarHBondContact O-N 3.01Å; S8-I10 PolarHBondContact O-N 2.93Å
9	V	49.6	Very low	50	Low	105 Å²	105	127.2 Å²	127.2	64%	0.636	73%	0.73	S	S	*	*			trans	-72.7	88.8	166.5	-174.3	0	0	0	106.2	L7 V11	L7-V9 HydrophobicContact CD2-CG2 4.06Å; L7-V9 PolarHBondContact O-N 2.88Å; V9-V11 HydrophobicContact CG1-CG2 3.54Å; V9-V11 PolarHBondContact O-N 2.93Å
10	I	55.6	Low	51.6	Low	134 Å²	134	121.9 Å²	121.9	69%	0.687	70%	0.7	S	S	*	*			trans	-71.2	89.1	166.5	-56.7	176.7	0	0	105.4	S8 L12	S8-I10 PolarHBondContact O-N 2.93Å; I10-L12 HydrophobicContact CG2-CD1 3.72Å; I10-L12 HydrophobicContact CG2-CG 3.74Å; I10-L12 PolarHBondContact O-N 2.99Å
11	V	51.4	Low	53.3	Low	107 Å²	107	122.8 Å²	122.8	65%	0.648	70%	0.698	S	S	*	*			trans	-70.1	83	168.2	-177.8	0	0	0	107	V9 C13	V9-V11 HydrophobicContact CG1-CG2 3.54Å; V9-V11 PolarHBondContact O-N 2.93Å; V11-C13 HydrophobicContact CG1-CB 4.47Å; V11-C13 VanDerWaalsContact CG1-SG 3.51Å; V11-C13 PolarHBondContact O-N 2.88Å
12	L	48.5	Very low	55.3	Low	117 Å²	117	118.2 Å²	118.2	61%	0.613	67%	0.671	S	S	*	*			trans	-74.3	76.3	164.8	-84.9	149	0	0	107.8	I10 F14	I10-L12 HydrophobicContact CG2-CD1 3.72Å; I10-L12 HydrophobicContact CG2-CG 3.74Å; I10-L12 PolarHBondContact O-N 2.99Å; L12-F14 HydrophobicContact CB-CD2 4.06Å; L12-F14 HydrophobicContact CB-CE2 3.95Å; L12-F14 HydrophobicContact CD1-CE2 4.45Å; L12-F14 HydrophobicContact CD2-CD2 4.31Å; L12-F14 HydrophobicContact CD2-CE2 3.58Å; L12-F14 HydrophobicContact CD2-CZ 3.7Å; L12-F14 HydrophobicContact CG-CE2 4.18Å; L12-F14 PolarHBondContact O-N 2.91Å
13	C	49.3	Very low	57.6	Low	95 Å²	95	114.1 Å²	114.1	64%	0.642	65%	0.652	S	S	*	*			trans	-69.6	83.5	160.9	-80.6	0	0	0	107.8	V11 V15	V11-C13 HydrophobicContact CG1-CB 4.47Å; V11-C13 VanDerWaalsContact CG1-SG 3.51Å; V11-C13 PolarHBondContact O-N 2.88Å; C13-V15 HydrophobicContact CB-CG2 3.9Å; C13-V15 PolarHBondContact O-N 2.98Å
14	F	44.9	Very low	59.7	Low	163 Å²	163	112.4 Å²	112.4	72%	0.715	63%	0.63	S	S	*	*			trans	-69.3	75	156.9	-71.5	-77.6	0	0	107.5	L12 S16	L12-F14 HydrophobicContact CB-CD2 4.06Å; L12-F14 HydrophobicContact CB-CE2 3.95Å; L12-F14 HydrophobicContact CD1-CE2 4.45Å; L12-F14 HydrophobicContact CD2-CD2 4.31Å; L12-F14 HydrophobicContact CD2-CE2 3.58Å; L12-F14 HydrophobicContact CD2-CZ 3.7Å; L12-F14 HydrophobicContact CG-CE2 4.18Å; L12-F14 PolarHBondContact O-N 2.91Å; F14-S16 PolarHBondContact O-N 2.88Å
15	V	48.3	Very low	62	Low	108 Å²	108	105.4 Å²	105.4	66%	0.655	59%	0.594	S	S	*	*			trans	-77.5	82	163.3	-146.3	0	0	0	105.4	C13 V17	C13-V15 HydrophobicContact CB-CG2 3.9Å; C13-V15 PolarHBondContact O-N 2.98Å; V15-V17 HydrophobicContact CB-CG2 3.99Å; V15-V17 HydrophobicContact CG1-CG2 3.2Å; V15-V17 PolarHBondContact O-N 2.83Å
16	S	41.4	Very low	64.3	Low	114 Å²	114	101.5 Å²	101.5	80%	0.797	57%	0.574	S	S	*	*			trans	-68.3	71.4	160.4	26.8	0	0	0	107.6	F14 S18	F14-S16 PolarHBondContact O-N 2.88Å; S16-S18 PolarHBondContact O-N 3.09Å; S16-S18 VanDerWaalsContact O-N 3.09Å
17	V	48.7	Very low	66.5	Low	117 Å²	117	99.4 Å²	99.4	71%	0.709	57%	0.565	S	S	*	*			trans	-79.8	74.3	162	-164.7	0	0	0	106.6	V15	V15-V17 HydrophobicContact CB-CG2 3.99Å; V15-V17 HydrophobicContact CG1-CG2 3.2Å; V15-V17 PolarHBondContact O-N 2.83Å
18	S	53.9	Low	68.9	Low	69 Å²	69	93.1 Å²	93.1	48%	0.483	53%	0.531	S	S	.	.			trans	-108.5	77.2	153	95.7	0	0	0	106.8	S16 E57	S16-S18 PolarHBondContact O-N 3.09Å; S16-S18 VanDerWaalsContact O-N 3.09Å; S18-E57 VanDerWaalsContact C-OE2 3.24Å; S18-E57 VanDerWaalsContact CB-CD 3.48Å; S18-E57 VanDerWaalsContact CB-OE1 3.28Å; S18-E57 WeakPolarHBondContact CB-OE1 3.28Å; S18-E57 PolarHBondContact OG-OE1 3.32Å; S18-E57 PolarHBondContact OG-OE2 3.25Å
19	A	67.7	Low	71	Confident	79 Å²	79	88.6 Å²	88.6	65%	0.653	50%	0.5	S	S	*	.			trans	-97.6	98.4	148.6	0	0	0	0	103.7	E21	A19-E21 PolarHBondContact O-N 3.31Å; A19-E21 VanDerWaalsContact O-N 3.13Å
20	V	80.7	Confident	73.3	Confident	21 Å²	21	87.8 Å²	87.8	13%	0.127	49%	0.489	C	S	.	.			trans	-41.5	124.5	170.8	58.1	0	0	0	109	K22 L24 L25 F28 V55 E57 V62	V20-K22 PolarHBondContact O-N 2.97Å; V20-L24 HydrophobicContact CG2-CB 4.14Å; V20-L24 HydrophobicContact CG2-CD2 4.02Å; V20-L24 HydrophobicContact CG2-CG 4.2Å; V20-L25 HydrophobicContact CB-CG 4.48Å; V20-L25 HydrophobicContact CG1-CD1 3.74Å; V20-L25 HydrophobicContact CG1-CD2 3.82Å; V20-L25 HydrophobicContact CG1-CG 3.69Å; V20-L25 HydrophobicContact CG2-CD2 4.26Å; V20-L25 HydrophobicContact CG2-CG 3.99Å; V20-F28 HydrophobicContact CG2-CE2 4.47Å; V20-V55 HydrophobicContact CG1-CG1 4.01Å; V20-E57 WeakPolarHBondContact CB-OE2 3.25Å; V20-E57 PolarHBondContact N-OE2 2.75Å; V20-V62 HydrophobicContact CB-CG2 4.23Å; V20-V62 HydrophobicContact CG1-CG1 4.08Å; V20-V62 HydrophobicContact CG2-CG1 4.5Å; V20-V62 HydrophobicContact CG2-CG2 4.08Å
21	E	88.1	Confident	75.3	Confident	141 Å²	141	83.4 Å²	83.4	66%	0.659	47%	0.473	S	S	*	.			trans	-59.7	139	-176.5	-71.2	-175.9	173.5	0	109.8	A19 A23 L24 L25	A19-E21 PolarHBondContact O-N 3.31Å; A19-E21 VanDerWaalsContact O-N 3.13Å; E21-A23 PolarHBondContact O-N 3.38Å; E21-A23 VanDerWaalsContact O-N 3.14Å; E21-L24 HydrophobicContact CB-CB 4.35Å; E21-L24 WeakPolarHBondContact O-CA 3.47Å; E21-L24 WeakPolarHBondContact O-CB 3.13Å; E21-L24 PolarHBondContact O-N 3.13Å; E21-L25 PolarHBondContact O-N 2.75Å
22	K	91.2	Very high	77.5	Confident	147 Å²	147	78.5 Å²	78.5	64%	0.639	44%	0.443	S	S	*	.	H	α-helix	trans	-51.7	-40	175.7	-171.1	-171.6	174.7	-161.3	111.8	V20 L24 L25 D26 Y52	V20-K22 PolarHBondContact O-N 2.97Å; K22-L24 PolarHBondContact O-N 3.25Å; K22-L25 WeakPolarHBondContact O-CB 3.29Å; K22-L25 PolarHBondContact O-N 3.28Å; K22-D26 WeakPolarHBondContact O-CB 3.43Å; K22-D26 PolarHBondContact O-N 2.87Å; K22-Y52 WeakPolarHBondContact CG-OH 2.92Å
23	A	92.6	Very high	79.9	Confident	53 Å²	53	72.9 Å²	72.9	44%	0.438	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-29.9	177.5	0	0	0	0	113.3	E21 K27	E21-A23 PolarHBondContact O-N 3.38Å; E21-A23 VanDerWaalsContact O-N 3.14Å; A23-K27 WeakPolarHBondContact O-CG 3.42Å; A23-K27 PolarHBondContact O-N 2.83Å
24	L	94	Very high	82.1	Confident	53 Å²	53	71.8 Å²	71.8	28%	0.277	40%	0.402	S	S	.	.	H	α-helix	trans	-78	-40.9	175.5	-172.9	58	0	0	111.1	V20 E21 K22 K27 F28 F107	V20-L24 HydrophobicContact CG2-CB 4.14Å; V20-L24 HydrophobicContact CG2-CD2 4.02Å; V20-L24 HydrophobicContact CG2-CG 4.2Å; E21-L24 HydrophobicContact CB-CB 4.35Å; E21-L24 WeakPolarHBondContact O-CA 3.47Å; E21-L24 WeakPolarHBondContact O-CB 3.13Å; E21-L24 PolarHBondContact O-N 3.13Å; K22-L24 PolarHBondContact O-N 3.25Å; L24-K27 WeakPolarHBondContact O-CB 3.22Å; L24-K27 PolarHBondContact O-N 2.8Å; L24-F28 HydrophobicContact CD1-CE1 3.71Å; L24-F28 HydrophobicContact CD1-CE2 4.32Å; L24-F28 HydrophobicContact CD1-CZ 3.59Å; L24-F28 HydrophobicContact CD2-CE2 4.26Å; L24-F28 HydrophobicContact CD2-CZ 3.94Å; L24-F28 HydrophobicContact CG-CE1 4.08Å; L24-F28 HydrophobicContact CG-CE2 3.75Å; L24-F28 HydrophobicContact CG-CZ 3.48Å; L24-F28 VanDerWaalsContact CG-CZ 3.48Å; L24-F28 WeakPolarHBondContact O-CG 3.49Å; L24-F28 PolarHBondContact O-N 2.94Å; L24-F107 HydrophobicContact CD2-CE2 4.13Å; L24-F107 HydrophobicContact CD2-CZ 4.41Å
25	L	96.1	Very high	84.5	Confident	13 Å²	13	65.8 Å²	65.8	7%	0.068	39%	0.386	C	S	.	.	H	α-helix	trans	-58.3	-45.3	170.3	-75.5	172.3	0	0	112.1	V20 E21 K22 K27 F28 A29 Y52 V55 V62 F64	V20-L25 HydrophobicContact CB-CG 4.48Å; V20-L25 HydrophobicContact CG1-CD1 3.74Å; V20-L25 HydrophobicContact CG1-CD2 3.82Å; V20-L25 HydrophobicContact CG1-CG 3.69Å; V20-L25 HydrophobicContact CG2-CD2 4.26Å; V20-L25 HydrophobicContact CG2-CG 3.99Å; E21-L25 PolarHBondContact O-N 2.75Å; K22-L25 WeakPolarHBondContact O-CB 3.29Å; K22-L25 PolarHBondContact O-N 3.28Å; L25-K27 PolarHBondContact O-N 2.88Å; L25-F28 PolarHBondContact O-N 2.8Å; L25-A29 PolarHBondContact O-N 3.14Å; L25-Y52 HydrophobicContact CB-CE2 4.17Å; L25-Y52 HydrophobicContact CD1-CE2 4.15Å; L25-V55 HydrophobicContact CD1-CG1 4.17Å; L25-V55 HydrophobicContact CD1-CG2 4.06Å; L25-V55 HydrophobicContact CD2-CG1 3.96Å; L25-V55 HydrophobicContact CD2-CG2 4.38Å; L25-V62 HydrophobicContact CD2-CG1 3.67Å; L25-F64 HydrophobicContact CD2-CD1 3.98Å; L25-F64 HydrophobicContact CD2-CE1 4.16Å
26	D	96.9	Very high	86.8	Confident	69 Å²	69	60.7 Å²	60.7	37%	0.369	36%	0.355	S	S	.	.	H	α-helix	trans	-56.9	-40.3	176.9	-71.8	-21.8	0	0	111.1	K22 Q30 Y52	K22-D26 WeakPolarHBondContact O-CB 3.43Å; K22-D26 PolarHBondContact O-N 2.87Å; D26-Q30 VanDerWaalsContact O-CB 3.32Å; D26-Q30 WeakPolarHBondContact O-CB 3.44Å; D26-Q30 PolarHBondContact O-N 3.23Å; D26-Y52 VanDerWaalsContact OD1-CE1 3.25Å; D26-Y52 WeakPolarHBondContact OD1-CE1 3.37Å; D26-Y52 VanDerWaalsContact OD1-CZ 3.3Å; D26-Y52 PolarHBondContact OD1-OH 3.46Å
27	K	96.8	Very high	89.4	Confident	145 Å²	145	56.2 Å²	56.2	63%	0.63	32%	0.322	S	S	*	.	H	α-helix	trans	-65.9	-40.5	174.9	-72.7	172.1	-177.2	175.9	112.3	A23 L24 L25 A31	A23-K27 WeakPolarHBondContact O-CG 3.42Å; A23-K27 PolarHBondContact O-N 2.83Å; L24-K27 WeakPolarHBondContact O-CB 3.22Å; L24-K27 PolarHBondContact O-N 2.8Å; L25-K27 PolarHBondContact O-N 2.88Å; K27-A31 WeakPolarHBondContact O-CB 3.48Å; K27-A31 PolarHBondContact O-N 3.3Å
28	F	97.7	Very high	91.7	Very high	10 Å²	10	59.2 Å²	59.2	4%	0.044	33%	0.326	C	S	.	.	H	α-helix	trans	-67.1	-43.7	177.2	-60.1	-25	0	0	111.7	V20 L24 L25 Q30 A31 A32 V62 F64 A99 F107 V109	V20-F28 HydrophobicContact CG2-CE2 4.47Å; L24-F28 HydrophobicContact CD1-CE1 3.71Å; L24-F28 HydrophobicContact CD1-CE2 4.32Å; L24-F28 HydrophobicContact CD1-CZ 3.59Å; L24-F28 HydrophobicContact CD2-CE2 4.26Å; L24-F28 HydrophobicContact CD2-CZ 3.94Å; L24-F28 HydrophobicContact CG-CE1 4.08Å; L24-F28 HydrophobicContact CG-CE2 3.75Å; L24-F28 HydrophobicContact CG-CZ 3.48Å; L24-F28 VanDerWaalsContact CG-CZ 3.48Å; L24-F28 WeakPolarHBondContact O-CG 3.49Å; L24-F28 PolarHBondContact O-N 2.94Å; L25-F28 PolarHBondContact O-N 2.8Å; F28-Q30 VanDerWaalsContact C-N 3.34Å; F28-Q30 PolarHBondContact O-N 3.02Å; F28-A31 PolarHBondContact O-N 3Å; F28-A32 PolarHBondContact O-N 2.84Å; F28-V62 HydrophobicContact CE2-CB 4.32Å; F28-V62 HydrophobicContact CE2-CG2 4.33Å; F28-F64 HydrophobicContact CB-CE1 3.75Å; F28-F64 HydrophobicContact CB-CZ 3.76Å; F28-F64 HydrophobicContact CD2-CE1 4.35Å; F28-A99 HydrophobicContact CB-CB 4.32Å; F28-A99 HydrophobicContact CD1-CB 4Å; F28-A99 HydrophobicContact CD2-CB 3.39Å; F28-A99 HydrophobicContact CE1-CB 4.1Å; F28-A99 HydrophobicContact CE2-CB 3.5Å; F28-A99 HydrophobicContact CG-CB 3.65Å; F28-A99 HydrophobicContact CZ-CB 3.86Å; F28-F107 HydrophobicContact CE1-CB 3.59Å; F28-F107 HydrophobicContact CE1-CD1 4.25Å; F28-F107 HydrophobicContact CE1-CD2 4.17Å; F28-F107 AromaticContact CE1-CG 3.76Å; F28-F107 HydrophobicContact CE1-CG 3.76Å; F28-F107 HydrophobicContact CE2-CD1 4.23Å; F28-F107 HydrophobicContact CE2-CE1 4.43Å; F28-F107 HydrophobicContact CE2-CG 4.49Å; F28-F107 HydrophobicContact CZ-CB 3.8Å; F28-F107 AromaticContact CZ-CD1 3.55Å; F28-F107 HydrophobicContact CZ-CD1 3.55Å; F28-F107 AromaticContact CZ-CD2 3.76Å; F28-F107 HydrophobicContact CZ-CD2 3.76Å; F28-F107 AromaticContact CZ-CE1 3.98Å; F28-F107 HydrophobicContact CZ-CE1 3.98Å; F28-F107 HydrophobicContact CZ-CE2 4.17Å; F28-F107 AromaticContact CZ-CG 3.41Å; F28-F107 HydrophobicContact CZ-CG 3.41Å; F28-F107 VanDerWaalsContact CZ-CG 3.41Å; F28-F107 HydrophobicContact CZ-CZ 4.27Å; F28-V109 HydrophobicContact CB-CG1 4.5Å; F28-V109 HydrophobicContact CB-CG2 4.23Å; F28-V109 HydrophobicContact CD1-CG2 3.55Å; F28-V109 HydrophobicContact CE1-CG2 4.22Å; F28-V109 HydrophobicContact CG-CG2 4.12Å
29	A	98.3	Very high	93.6	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60	-45.7	175.6	0	0	0	0	111	L25 A31 A32 V33 V49 Y52 F64 L66	L25-A29 PolarHBondContact O-N 3.14Å; A29-A31 PolarHBondContact O-N 3.44Å; A29-A32 PolarHBondContact O-N 2.83Å; A29-V33 PolarHBondContact O-N 2.55Å; A29-V49 HydrophobicContact CB-CG1 4.05Å; A29-V49 HydrophobicContact CB-CG2 3.92Å; A29-Y52 HydrophobicContact CB-CD1 3.75Å; A29-Y52 HydrophobicContact CB-CE1 4.16Å; A29-F64 HydrophobicContact CB-CE2 4.08Å; A29-F64 HydrophobicContact CB-CZ 4.24Å; A29-L66 HydrophobicContact CB-CD1 4.04Å
30	Q	97.6	Very high	94.9	Very high	88 Å²	88	63.8 Å²	63.8	41%	0.411	33%	0.325	S	S	.	.	H	α-helix	trans	-63.3	-40.3	176.2	-170.9	62.8	48.1	0	112.1	D26 F28 V33 N34	D26-Q30 VanDerWaalsContact O-CB 3.32Å; D26-Q30 WeakPolarHBondContact O-CB 3.44Å; D26-Q30 PolarHBondContact O-N 3.23Å; F28-Q30 VanDerWaalsContact C-N 3.34Å; F28-Q30 PolarHBondContact O-N 3.02Å; Q30-V33 PolarHBondContact O-N 3.14Å; Q30-N34 PolarHBondContact NE2-OD1 2.85Å; Q30-N34 WeakPolarHBondContact O-CB 3.46Å; Q30-N34 PolarHBondContact O-N 2.8Å; Q30-N34 PolarHBondContact O-ND2 3.43Å; Q30-N34 PolarHBondContact O-OD1 3.16Å
31	A	97.5	Very high	95.5	Very high	42 Å²	42	68.1 Å²	68.1	35%	0.347	35%	0.347	S	S	.	.	H	α-helix	trans	-62.6	-41.8	176.8	0	0	0	0	111.9	K27 F28 A29 N34 G35 V109	K27-A31 WeakPolarHBondContact O-CB 3.48Å; K27-A31 PolarHBondContact O-N 3.3Å; F28-A31 PolarHBondContact O-N 3Å; A29-A31 PolarHBondContact O-N 3.44Å; A31-N34 PolarHBondContact O-N 3.43Å; A31-G35 PolarHBondContact O-N 2.85Å; A31-V109 HydrophobicContact CB-CB 4.18Å; A31-V109 HydrophobicContact CB-CG1 4.22Å; A31-V109 HydrophobicContact CB-CG2 4.23Å
32	A	98.2	Very high	95.9	Very high	4 Å²	4	61.4 Å²	61.4	3%	0.033	32%	0.316	C	S	.	.	H	α-helix	trans	-62.9	-48	175.5	0	0	0	0	111.8	F28 A29 N34 G35 I36 L66 V97 V109	F28-A32 PolarHBondContact O-N 2.84Å; A29-A32 PolarHBondContact O-N 2.83Å; A32-N34 VanDerWaalsContact C-N 3.3Å; A32-N34 PolarHBondContact O-N 2.88Å; A32-G35 WeakPolarHBondContact O-CA 3.35Å; A32-G35 PolarHBondContact O-N 3.33Å; A32-I36 PolarHBondContact O-N 3.04Å; A32-L66 HydrophobicContact CB-CD2 3.59Å; A32-V97 HydrophobicContact CB-CG1 4.19Å; A32-V97 HydrophobicContact CB-CG2 3.69Å; A32-V109 HydrophobicContact CB-CG1 4.42Å
33	V	97.3	Very high	96	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-36.3	175.6	171.7	0	0	0	112.2	A29 Q30 G35 I36 N37 F47 V49 L66 A68	A29-V33 PolarHBondContact O-N 2.55Å; Q30-V33 PolarHBondContact O-N 3.14Å; V33-G35 PolarHBondContact O-N 2.83Å; V33-I36 WeakPolarHBondContact O-CB 3.19Å; V33-I36 PolarHBondContact O-N 2.8Å; V33-N37 WeakPolarHBondContact CG1-ND2 3.38Å; V33-N37 WeakPolarHBondContact O-CB 3.47Å; V33-N37 PolarHBondContact O-N 3.37Å; V33-N37 PolarHBondContact O-ND2 2.74Å; V33-F47 HydrophobicContact CG1-CB 4.19Å; V33-F47 WeakPolarHBondContact CG1-O 3.49Å; V33-V49 HydrophobicContact CB-CG2 4.21Å; V33-V49 HydrophobicContact CG2-CB 4.44Å; V33-V49 HydrophobicContact CG2-CG2 3.57Å; V33-L66 HydrophobicContact CG2-CD1 4.4Å; V33-L66 HydrophobicContact CG2-CD2 3.92Å; V33-A68 HydrophobicContact CG2-CB 3.99Å
34	N	96	Very high	96.1	Very high	72 Å²	72	58.3 Å²	58.3	39%	0.385	31%	0.308	S	S	.	.	H	α-helix	trans	-63.4	-33.2	172.9	-69.8	-12.8	0	0	111.9	Q30 A31 A32 K38	Q30-N34 PolarHBondContact NE2-OD1 2.85Å; Q30-N34 WeakPolarHBondContact O-CB 3.46Å; Q30-N34 PolarHBondContact O-N 2.8Å; Q30-N34 PolarHBondContact O-ND2 3.43Å; Q30-N34 PolarHBondContact O-OD1 3.16Å; A31-N34 PolarHBondContact O-N 3.43Å; A32-N34 VanDerWaalsContact C-N 3.3Å; A32-N34 PolarHBondContact O-N 2.88Å; N34-K38 VanDerWaalsContact O-CG 3.31Å; N34-K38 WeakPolarHBondContact O-CG 3.42Å; N34-K38 PolarHBondContact O-N 2.85Å
35	G	96.1	Very high	96.2	Very high	37 Å²	37	58.6 Å²	58.6	38%	0.381	31%	0.307	S	S	.	.	H	α-helix	trans	-62.6	-51.8	170.5	0	0	0	0	111.6	A31 A32 V33 N37 K38 D39	A31-G35 PolarHBondContact O-N 2.85Å; A32-G35 WeakPolarHBondContact O-CA 3.35Å; A32-G35 PolarHBondContact O-N 3.33Å; V33-G35 PolarHBondContact O-N 2.83Å; G35-N37 VanDerWaalsContact C-N 3.29Å; G35-N37 PolarHBondContact O-N 2.97Å; G35-K38 PolarHBondContact O-N 3.29Å; G35-D39 PolarHBondContact O-N 3.06Å; G35-D39 VanDerWaalsContact O-N 3.16Å
36	I	96.7	Very high	96.2	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-52.9	-48.3	175.4	-64.1	171.6	0	0	110.6	A32 V33 K38 D39 S42 F47 A68 L93 M115	A32-I36 PolarHBondContact O-N 3.04Å; V33-I36 WeakPolarHBondContact O-CB 3.19Å; V33-I36 PolarHBondContact O-N 2.8Å; I36-K38 PolarHBondContact O-N 3.03Å; I36-D39 WeakPolarHBondContact O-CB 3.41Å; I36-D39 PolarHBondContact O-N 2.78Å; I36-D39 VanDerWaalsContact O-N 3.09Å; I36-S42 PolarHBondContact O-OG 3.31Å; I36-F47 HydrophobicContact CG2-CB 4.28Å; I36-F47 HydrophobicContact CG2-CD2 4.11Å; I36-F47 HydrophobicContact CG2-CG 4.12Å; I36-A68 HydrophobicContact CD1-CB 3.85Å; I36-L93 HydrophobicContact CG2-CD1 3.76Å; I36-M115 HydrophobicContact CG1-CE 4.41Å; I36-M115 HydrophobicContact CG1-SD 4.3Å; I36-M115 HydrophobicContact CG2-SD 4.4Å
37	N	96.3	Very high	96.2	Very high	21 Å²	21	55.6 Å²	55.6	11%	0.112	29%	0.291	C	S	.	.	H	α-helix	trans	-66.6	-20.3	-178	-76.9	-39.5	0	0	114.7	V33 G35 L46 F47	V33-N37 WeakPolarHBondContact CG1-ND2 3.38Å; V33-N37 WeakPolarHBondContact O-CB 3.47Å; V33-N37 PolarHBondContact O-N 3.37Å; V33-N37 PolarHBondContact O-ND2 2.74Å; G35-N37 VanDerWaalsContact C-N 3.29Å; G35-N37 PolarHBondContact O-N 2.97Å; N37-L46 HydrophobicContact CB-CD1 4.49Å; N37-L46 WeakPolarHBondContact ND2-CD1 3.05Å; N37-F47 PolarHBondContact ND2-O 3.28Å; N37-F47 PolarHBondContact OD1-N 2.9Å
38	K	95.1	Very high	96.2	Very high	179 Å²	179	50 Å²	50	78%	0.778	27%	0.267	S	S	*	.	H	α-helix	trans	-88.8	-19	174.6	-73.8	174.6	-179.8	-178.7	112.7	N34 G35 I36	N34-K38 VanDerWaalsContact O-CG 3.31Å; N34-K38 WeakPolarHBondContact O-CG 3.42Å; N34-K38 PolarHBondContact O-N 2.85Å; G35-K38 PolarHBondContact O-N 3.29Å; I36-K38 PolarHBondContact O-N 3.03Å
39	D	95.1	Very high	96.2	Very high	55 Å²	55	51.4 Å²	51.4	29%	0.294	28%	0.277	S	S	.	.			trans	-69.7	144.1	175.6	-157.9	-67.6	0	0	110.2	G35 I36 D41 S42 K75 M115	G35-D39 PolarHBondContact O-N 3.06Å; G35-D39 VanDerWaalsContact O-N 3.16Å; I36-D39 WeakPolarHBondContact O-CB 3.41Å; I36-D39 PolarHBondContact O-N 2.78Å; I36-D39 VanDerWaalsContact O-N 3.09Å; D39-D41 WeakPolarHBondContact OD1-CB 3.25Å; D39-D41 PolarHBondContact OD1-N 2.88Å; D39-S42 PolarHBondContact O-OG 3.48Å; D39-K75 PolarHBondContact O-NZ 2.84Å; D39-M115 HydrophobicContact CB-CE 4.15Å; D39-M115 HydrophobicContact CB-SD 4.03Å
40	K	93.7	Very high	96.1	Very high	189 Å²	189	55.8 Å²	55.8	82%	0.822	29%	0.294	S	S	*	.	S	Bend	trans	-80.1	-30.6	179.9	-68.8	-178.6	-178.4	176.1	111.6	S42 G43	K40-S42 VanDerWaalsContact C-N 3.26Å; K40-S42 PolarHBondContact O-N 3.22Å; K40-G43 PolarHBondContact O-N 2.84Å
41	D	95	Very high	96	Very high	113 Å²	113	55.7 Å²	55.7	60%	0.604	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-17.7	-171.6	-61.5	-20.9	0	0	111.7	D39 G43 M115	D39-D41 WeakPolarHBondContact OD1-CB 3.25Å; D39-D41 PolarHBondContact OD1-N 2.88Å; D41-G43 PolarHBondContact O-N 2.77Å; D41-M115 HydrophobicContact CB-CB 3.9Å
42	S	94.8	Very high	96	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	20	173.2	65.3	0	0	0	115.1	I36 D39 K40 F47 K75 M115	I36-S42 PolarHBondContact O-OG 3.31Å; D39-S42 PolarHBondContact O-OG 3.48Å; K40-S42 VanDerWaalsContact C-N 3.26Å; K40-S42 PolarHBondContact O-N 3.22Å; S42-F47 WeakPolarHBondContact O-CE2 3.31Å; S42-K75 VanDerWaalsContact C-NZ 3.34Å; S42-K75 PolarHBondContact O-NZ 3.45Å; S42-K75 WeakPolarHBondContact OG-CE 3.37Å; S42-K75 PolarHBondContact OG-NZ 2.96Å; S42-M115 WeakPolarHBondContact CA-O 3.42Å; S42-M115 WeakPolarHBondContact CB-O 3.46Å
43	G	94	Very high	95.9	Very high	38 Å²	38	58.5 Å²	58.5	39%	0.392	30%	0.302	S	S	.	.			trans	76.3	-156.5	172.4	0	0	0	0	114.8	K40 D41 K75	K40-G43 PolarHBondContact O-N 2.84Å; D41-G43 PolarHBondContact O-N 2.77Å; G43-K75 VanDerWaalsContact O-CD 3.29Å; G43-K75 WeakPolarHBondContact O-CD 3.37Å; G43-K75 WeakPolarHBondContact O-CE 3.38Å; G43-K75 PolarHBondContact O-NZ 2.82Å
44	D	94.7	Very high	95.8	Very high	97 Å²	97	61.8 Å²	61.8	52%	0.519	33%	0.325	S	S	.	.	S	Bend	trans	-103.7	-5.1	-175	76.5	-34	0	0	113.5	P74 K75	D44-P74 CarbonylContact O-C 3.59Å; D44-P74 WeakPolarHBondContact O-CA 3.32Å; D44-K75 PolarHBondContact O-N 2.75Å
45	K	95.8	Very high	95.8	Very high	59 Å²	59	61.3 Å²	61.3	26%	0.257	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	151.5	-175.6	-58.9	-47	178.7	-147.1	112.9	Q70 C73 K75	K45-Q70 HydrophobicContact CB-CG 3.48Å; K45-Q70 VanDerWaalsContact CB-CG 3.48Å; K45-Q70 HydrophobicContact CG-CG 4.12Å; K45-C73 CarbonylContact C-O 3.51Å; K45-C73 WeakPolarHBondContact CA-O 3.36Å; K45-K75 WeakPolarHBondContact O-CE 3.46Å; K45-K75 VanDerWaalsContact O-CG 3.27Å; K45-K75 WeakPolarHBondContact O-CG 3.45Å
46	L	96.7	Very high	95.8	Very high	18 Å²	18	65.7 Å²	65.7	9%	0.094	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	131.1	175.8	179	76.7	0	0	109.9	N37 I48 T71 C73 Y79	N37-L46 HydrophobicContact CB-CD1 4.49Å; N37-L46 WeakPolarHBondContact ND2-CD1 3.05Å; L46-I48 HydrophobicContact CD2-CG2 4.43Å; L46-T71 WeakPolarHBondContact CB-OG1 3.34Å; L46-T71 WeakPolarHBondContact O-CB 3.31Å; L46-T71 WeakPolarHBondContact O-CG2 3.4Å; L46-T71 PolarHBondContact O-N 2.98Å; L46-T71 PolarHBondContact O-OG1 2.89Å; L46-C73 PolarHBondContact N-O 2.88Å; L46-Y79 HydrophobicContact CD2-CD2 4.22Å
47	F	97.3	Very high	95.5	Very high	1 Å²	1	69.3 Å²	69.3	0%	0.004	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	146.4	167.3	-75.9	-97.9	0	0	111	V33 I36 N37 S42 A68 V69 Q70 L93 P117	V33-F47 HydrophobicContact CG1-CB 4.19Å; V33-F47 WeakPolarHBondContact CG1-O 3.49Å; I36-F47 HydrophobicContact CG2-CB 4.28Å; I36-F47 HydrophobicContact CG2-CD2 4.11Å; I36-F47 HydrophobicContact CG2-CG 4.12Å; N37-F47 PolarHBondContact ND2-O 3.28Å; N37-F47 PolarHBondContact OD1-N 2.9Å; S42-F47 WeakPolarHBondContact O-CE2 3.31Å; F47-A68 HydrophobicContact CB-CB 4.29Å; F47-A68 HydrophobicContact CD1-CB 3.99Å; F47-V69 WeakPolarHBondContact CA-O 3.39Å; F47-Q70 HydrophobicContact CD1-CB 4.21Å; F47-Q70 HydrophobicContact CE1-CB 3.65Å; F47-Q70 HydrophobicContact CE1-CG 4.29Å; F47-Q70 HydrophobicContact CE2-CB 4.28Å; F47-Q70 HydrophobicContact CE2-CG 4.01Å; F47-Q70 HydrophobicContact CZ-CB 3.7Å; F47-Q70 HydrophobicContact CZ-CG 3.85Å; F47-L93 HydrophobicContact CD1-CD1 4.17Å; F47-L93 HydrophobicContact CD1-CG 4.3Å; F47-L93 HydrophobicContact CE1-CB 4.42Å; F47-L93 HydrophobicContact CE1-CD1 3.73Å; F47-L93 HydrophobicContact CE1-CG 3.63Å; F47-L93 HydrophobicContact CE2-CD1 4.25Å; F47-L93 HydrophobicContact CZ-CD1 3.77Å; F47-L93 HydrophobicContact CZ-CG 3.98Å; F47-P117 HydrophobicContact CZ-CB 4.14Å; F47-P117 HydrophobicContact CZ-CG 4.37Å
48	I	96.7	Very high	95.3	Very high	26 Å²	26	71.3 Å²	71.3	13%	0.133	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	160.8	172.3	63.4	172.8	0	0	110.4	L46 Y50 A68 V69 T71 Y79 P86	L46-I48 HydrophobicContact CD2-CG2 4.43Å; I48-Y50 PolarHBondContact O-N 2.94Å; I48-A68 CarbonylContact O-C 3.58Å; I48-A68 VanDerWaalsContact O-CA 3.31Å; I48-A68 WeakPolarHBondContact O-CA 3.16Å; I48-V69 HydrophobicContact CD1-CG1 4.17Å; I48-V69 HydrophobicContact CG1-CG1 3.59Å; I48-V69 PolarHBondContact N-O 3.42Å; I48-V69 PolarHBondContact O-N 3.1Å; I48-T71 HydrophobicContact CB-CG2 4.46Å; I48-T71 HydrophobicContact CD1-CG2 4.11Å; I48-T71 HydrophobicContact CG1-CG2 4Å; I48-T71 HydrophobicContact CG2-CG2 3.8Å; I48-Y79 HydrophobicContact CD1-CE1 4.43Å; I48-Y79 HydrophobicContact CD1-CE2 3.77Å; I48-Y79 WeakPolarHBondContact CD1-OH 3.28Å; I48-Y79 HydrophobicContact CG2-CD2 3.7Å; I48-Y79 HydrophobicContact CG2-CE2 3.87Å; I48-Y79 HydrophobicContact CG2-CG 4.07Å; I48-P86 HydrophobicContact CD1-CG 3.84Å; I48-P86 HydrophobicContact CG1-CG 4.39Å
49	V	97.1	Very high	94.9	Very high	40 Å²	40	70 Å²	70	24%	0.242	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	120.4	170.7	-179.7	0	0	0	108.5	A29 V33 Y52 L66	A29-V49 HydrophobicContact CB-CG1 4.05Å; A29-V49 HydrophobicContact CB-CG2 3.92Å; V33-V49 HydrophobicContact CB-CG2 4.21Å; V33-V49 HydrophobicContact CG2-CB 4.44Å; V33-V49 HydrophobicContact CG2-CG2 3.57Å; V49-Y52 HydrophobicContact CG1-CD1 4.3Å; V49-L66 HydrophobicContact CG1-CD1 3.97Å; V49-L66 HydrophobicContact CG2-CD1 4.4Å
50	Y	96.4	Very high	94.8	Very high	92 Å²	92	75.6 Å²	75.6	36%	0.361	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-56.2	170.5	178.9	-121.7	0	0	111.1	I48 I67 V69 L123	I48-Y50 PolarHBondContact O-N 2.94Å; Y50-I67 WeakPolarHBondContact CB-O 3.39Å; Y50-I67 HydrophobicContact CD1-CB 4.44Å; Y50-I67 HydrophobicContact CD1-CG2 4.09Å; Y50-I67 PolarHBondContact N-O 3.33Å; Y50-V69 HydrophobicContact CD2-CG1 4.44Å; Y50-V69 HydrophobicContact CG-CG1 4.41Å; Y50-L123 HydrophobicContact CD1-CD1 3.56Å; Y50-L123 HydrophobicContact CD2-CD1 3.8Å; Y50-L123 HydrophobicContact CE1-CD1 3.44Å; Y50-L123 VanDerWaalsContact CE1-CD1 3.44Å; Y50-L123 HydrophobicContact CE2-CD1 3.71Å; Y50-L123 HydrophobicContact CE2-CD2 4.4Å; Y50-L123 HydrophobicContact CG-CD1 3.74Å
51	K	96.3	Very high	94.9	Very high	87 Å²	87	67.1 Å²	67.1	38%	0.378	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	165	174.6	66.1	-179.7	178.3	178.2	110.6	I67	K51-I67 HydrophobicContact CD-CD1 4.43Å; K51-I67 HydrophobicContact CG-CB 4.16Å; K51-I67 HydrophobicContact CG-CD1 4.18Å; K51-I67 HydrophobicContact CG-CG1 4.23Å; K51-I67 PolarHBondContact N-O 3.47Å; K51-I67 PolarHBondContact O-N 3.01Å
52	Y	96.9	Very high	94.9	Very high	51 Å²	51	61.8 Å²	61.8	20%	0.2	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	155.8	165.9	50.4	-102.3	0	0	110.2	K22 L25 D26 A29 V49 V55 F64 D65	K22-Y52 WeakPolarHBondContact CG-OH 2.92Å; L25-Y52 HydrophobicContact CB-CE2 4.17Å; L25-Y52 HydrophobicContact CD1-CE2 4.15Å; D26-Y52 VanDerWaalsContact OD1-CE1 3.25Å; D26-Y52 WeakPolarHBondContact OD1-CE1 3.37Å; D26-Y52 VanDerWaalsContact OD1-CZ 3.3Å; D26-Y52 PolarHBondContact OD1-OH 3.46Å; A29-Y52 HydrophobicContact CB-CD1 3.75Å; A29-Y52 HydrophobicContact CB-CE1 4.16Å; V49-Y52 HydrophobicContact CG1-CD1 4.3Å; Y52-V55 HydrophobicContact CD2-CG2 4.48Å; Y52-F64 HydrophobicContact CG-CD2 4.32Å; Y52-F64 HydrophobicContact CG-CE2 4.44Å; Y52-D65 CarbonylContact C-O 3.55Å; Y52-D65 WeakPolarHBondContact CA-O 3.43Å; Y52-D65 WeakPolarHBondContact CB-O 3.33Å
53	S	96.4	Very high	95	Very high	54 Å²	54	64.1 Å²	64.1	38%	0.378	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	-178	-176.2	58.9	0	0	0	111.5	V55 F64 D65	S53-V55 VanDerWaalsContact C-N 3.28Å; S53-V55 PolarHBondContact O-N 3.32Å; S53-F64 WeakPolarHBondContact O-CB 3.21Å; S53-D65 PolarHBondContact N-O 3.31Å; S53-D65 PolarHBondContact O-N 2.96Å
54	S	95.4	Very high	95.2	Very high	69 Å²	69	62.3 Å²	62.3	48%	0.483	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.9	43	173.9	-40.2	0	0	0	112.7	E56 D65	S54-E56 PolarHBondContact O-N 3.23Å; S54-D65 WeakPolarHBondContact CB-OD2 3.16Å; S54-D65 PolarHBondContact OG-OD2 2.9Å
55	V	96.1	Very high	95.4	Very high	61 Å²	61	60 Å²	60	37%	0.37	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	119.1	-176.6	-176	0	0	0	109.5	V20 L25 Y52 S53 V62 I63 F64	V20-V55 HydrophobicContact CG1-CG1 4.01Å; L25-V55 HydrophobicContact CD1-CG1 4.17Å; L25-V55 HydrophobicContact CD1-CG2 4.06Å; L25-V55 HydrophobicContact CD2-CG1 3.96Å; L25-V55 HydrophobicContact CD2-CG2 4.38Å; Y52-V55 HydrophobicContact CD2-CG2 4.48Å; S53-V55 VanDerWaalsContact C-N 3.28Å; S53-V55 PolarHBondContact O-N 3.32Å; V55-V62 HydrophobicContact CG1-CG1 4.04Å; V55-I63 CarbonylContact C-O 3.44Å; V55-I63 WeakPolarHBondContact CA-O 3.41Å; V55-F64 HydrophobicContact CB-CB 4.44Å; V55-F64 HydrophobicContact CG2-CB 3.94Å
56	E	94.7	Very high	95.5	Very high	129 Å²	129	57.2 Å²	57.2	60%	0.603	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.7	173.9	-66.7	179.1	-177.4	0	108.8	S54 V62 I63	S54-E56 PolarHBondContact O-N 3.23Å; E56-V62 CarbonylContact O-C 3.51Å; E56-V62 WeakPolarHBondContact O-CA 3.33Å; E56-I63 HydrophobicContact CB-CB 4.49Å; E56-I63 PolarHBondContact N-O 3.37Å; E56-I63 PolarHBondContact O-N 2.9Å
57	E	91.9	Very high	95.5	Very high	76 Å²	76	57 Å²	57	36%	0.355	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	137.3	177.4	-177.6	168.3	-168.6	0	110.2	S18 V20 V62	S18-E57 VanDerWaalsContact C-OE2 3.24Å; S18-E57 VanDerWaalsContact CB-CD 3.48Å; S18-E57 VanDerWaalsContact CB-OE1 3.28Å; S18-E57 WeakPolarHBondContact CB-OE1 3.28Å; S18-E57 PolarHBondContact OG-OE1 3.32Å; S18-E57 PolarHBondContact OG-OE2 3.25Å; V20-E57 WeakPolarHBondContact CB-OE2 3.25Å; V20-E57 PolarHBondContact N-OE2 2.75Å; E57-V62 HydrophobicContact CG-CG2 4.13Å
58	S	90.6	Very high	95.6	Very high	63 Å²	63	57 Å²	57	44%	0.441	30%	0.295	S	S	.	.			trans	-135.6	168.5	171.6	68.4	0	0	0	109.4	K60 A61	S58-K60 PolarHBondContact O-N 3.23Å; S58-K60 PolarHBondContact OG-N 3.09Å; S58-A61 PolarHBondContact N-O 2.74Å; S58-A61 PolarHBondContact O-N 2.97Å; S58-A61 PolarHBondContact OG-N 2.84Å; S58-A61 VanDerWaalsContact OG-N 3.14Å; S58-A61 PolarHBondContact OG-O 2.92Å
59	D	88.2	Confident	95.6	Very high	153 Å²	153	55.8 Å²	55.8	82%	0.818	29%	0.289	S	S	*	.	S	Bend	trans	-55.9	-23.3	176.3	-64.9	-27.8	0	0	114
60	K	92.1	Very high	95.6	Very high	171 Å²	171	55.7 Å²	55.7	74%	0.743	29%	0.286	S	S	*	.	S	Bend	trans	-104.4	-25.7	-173.5	-63	-178.1	-177.3	175	113.6	S58 K101	S58-K60 PolarHBondContact O-N 3.23Å; S58-K60 PolarHBondContact OG-N 3.09Å; K60-K101 WeakPolarHBondContact O-CB 3.28Å; K60-K101 PolarHBondContact O-N 3.04Å
61	A	95.2	Very high	95.6	Very high	11 Å²	11	51.4 Å²	51.4	9%	0.091	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	155.5	-172.9	0	0	0	0	112.7	S58 I63 V98 A99	S58-A61 PolarHBondContact N-O 2.74Å; S58-A61 PolarHBondContact O-N 2.97Å; S58-A61 PolarHBondContact OG-N 2.84Å; S58-A61 VanDerWaalsContact OG-N 3.14Å; S58-A61 PolarHBondContact OG-O 2.92Å; A61-I63 HydrophobicContact CB-CG1 4.42Å; A61-V98 HydrophobicContact CB-CG1 4.24Å; A61-A99 CarbonylContact C-O 3.53Å; A61-A99 VanDerWaalsContact CA-O 3.22Å; A61-A99 WeakPolarHBondContact CA-O 3.26Å
62	V	95.9	Very high	95.5	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.012	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.9	162.2	-177.4	0	0	0	107.7	V20 L25 F28 V55 E56 E57 F64 A99	V20-V62 HydrophobicContact CB-CG2 4.23Å; V20-V62 HydrophobicContact CG1-CG1 4.08Å; V20-V62 HydrophobicContact CG2-CG1 4.5Å; V20-V62 HydrophobicContact CG2-CG2 4.08Å; L25-V62 HydrophobicContact CD2-CG1 3.67Å; F28-V62 HydrophobicContact CE2-CB 4.32Å; F28-V62 HydrophobicContact CE2-CG2 4.33Å; V55-V62 HydrophobicContact CG1-CG1 4.04Å; E56-V62 CarbonylContact O-C 3.51Å; E56-V62 WeakPolarHBondContact O-CA 3.33Å; E57-V62 HydrophobicContact CG-CG2 4.13Å; V62-F64 HydrophobicContact CG1-CD1 4.3Å; V62-A99 HydrophobicContact CB-CB 4.34Å; V62-A99 PolarHBondContact N-O 3.34Å; V62-A99 PolarHBondContact O-N 2.9Å
63	I	97.2	Very high	95.4	Very high	49 Å²	49	49.1 Å²	49.1	25%	0.251	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.5	-179.3	-55	175.8	0	0	107.9	V55 E56 A61 K96 V97 V98	V55-I63 CarbonylContact C-O 3.44Å; V55-I63 WeakPolarHBondContact CA-O 3.41Å; E56-I63 HydrophobicContact CB-CB 4.49Å; E56-I63 PolarHBondContact N-O 3.37Å; E56-I63 PolarHBondContact O-N 2.9Å; A61-I63 HydrophobicContact CB-CG1 4.42Å; I63-K96 HydrophobicContact CG2-CD 4.22Å; I63-K96 HydrophobicContact CG2-CG 4.08Å; I63-V97 VanDerWaalsContact CA-O 3.29Å; I63-V97 WeakPolarHBondContact CA-O 3.26Å; I63-V98 HydrophobicContact CG1-CG1 4.29Å; I63-V98 HydrophobicContact CG1-CG2 4.29Å; I63-V98 HydrophobicContact CG2-CG2 4.38Å
64	F	98	Very high	95.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	159.6	176.1	59.5	-88.1	0	0	111.3	L25 F28 A29 Y52 S53 V55 V62 L66 V97	L25-F64 HydrophobicContact CD2-CD1 3.98Å; L25-F64 HydrophobicContact CD2-CE1 4.16Å; F28-F64 HydrophobicContact CB-CE1 3.75Å; F28-F64 HydrophobicContact CB-CZ 3.76Å; F28-F64 HydrophobicContact CD2-CE1 4.35Å; A29-F64 HydrophobicContact CB-CE2 4.08Å; A29-F64 HydrophobicContact CB-CZ 4.24Å; Y52-F64 HydrophobicContact CG-CD2 4.32Å; Y52-F64 HydrophobicContact CG-CE2 4.44Å; S53-F64 WeakPolarHBondContact O-CB 3.21Å; V55-F64 HydrophobicContact CB-CB 4.44Å; V55-F64 HydrophobicContact CG2-CB 3.94Å; V62-F64 HydrophobicContact CG1-CD1 4.3Å; F64-L66 HydrophobicContact CD2-CB 4.44Å; F64-L66 HydrophobicContact CE2-CB 4.21Å; F64-V97 HydrophobicContact CD1-CB 4.15Å; F64-V97 HydrophobicContact CD1-CG1 4.33Å; F64-V97 HydrophobicContact CD2-CB 4Å; F64-V97 HydrophobicContact CD2-CG2 4.24Å; F64-V97 HydrophobicContact CE1-CB 3.79Å; F64-V97 HydrophobicContact CE1-CG1 3.55Å; F64-V97 HydrophobicContact CE2-CB 3.65Å; F64-V97 HydrophobicContact CE2-CG1 4.03Å; F64-V97 HydrophobicContact CE2-CG2 3.7Å; F64-V97 HydrophobicContact CG-CB 4.26Å; F64-V97 HydrophobicContact CZ-CB 3.54Å; F64-V97 HydrophobicContact CZ-CG1 3.38Å; F64-V97 HydrophobicContact CZ-CG2 3.94Å; F64-V97 PolarHBondContact N-O 3Å; F64-V97 PolarHBondContact O-N 2.86Å
65	D	98.1	Very high	95.1	Very high	47 Å²	47	48.1 Å²	48.1	25%	0.251	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	134.7	171.4	-58.3	-33.4	0	0	109	Y52 S53 S54 K96	Y52-D65 CarbonylContact C-O 3.55Å; Y52-D65 WeakPolarHBondContact CA-O 3.43Å; Y52-D65 WeakPolarHBondContact CB-O 3.33Å; S53-D65 PolarHBondContact N-O 3.31Å; S53-D65 PolarHBondContact O-N 2.96Å; S54-D65 WeakPolarHBondContact CB-OD2 3.16Å; S54-D65 PolarHBondContact OG-OD2 2.9Å; D65-K96 IonicContact OD1-NZ 2.74Å; D65-K96 PolarHBondContact OD1-NZ 3.33Å
66	L	98.5	Very high	94.6	Very high	1 Å²	1	53 Å²	53	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	133.3	-179.6	170	68.1	0	0	109.1	A29 A32 V33 V49 F64 E94 H95 V97	A29-L66 HydrophobicContact CB-CD1 4.04Å; A32-L66 HydrophobicContact CB-CD2 3.59Å; V33-L66 HydrophobicContact CG2-CD1 4.4Å; V33-L66 HydrophobicContact CG2-CD2 3.92Å; V49-L66 HydrophobicContact CG1-CD1 3.97Å; V49-L66 HydrophobicContact CG2-CD1 4.4Å; F64-L66 HydrophobicContact CD2-CB 4.44Å; F64-L66 HydrophobicContact CE2-CB 4.21Å; L66-E94 WeakPolarHBondContact O-CA 3.36Å; L66-H95 HydrophobicContact CB-CB 4.43Å; L66-H95 PolarHBondContact N-O 3.36Å; L66-H95 PolarHBondContact O-N 3.02Å; L66-V97 HydrophobicContact CB-CG2 3.58Å; L66-V97 HydrophobicContact CD2-CG2 3.75Å; L66-V97 HydrophobicContact CG-CG2 4.32Å
67	I	97.6	Very high	94.3	Very high	15 Å²	15	48.5 Å²	48.5	8%	0.077	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	115.8	165.5	-54.2	-166.3	0	0	108.3	Y50 K51 V92 E94 L126	Y50-I67 WeakPolarHBondContact CB-O 3.39Å; Y50-I67 HydrophobicContact CD1-CB 4.44Å; Y50-I67 HydrophobicContact CD1-CG2 4.09Å; Y50-I67 PolarHBondContact N-O 3.33Å; K51-I67 HydrophobicContact CD-CD1 4.43Å; K51-I67 HydrophobicContact CG-CB 4.16Å; K51-I67 HydrophobicContact CG-CD1 4.18Å; K51-I67 HydrophobicContact CG-CG1 4.23Å; K51-I67 PolarHBondContact N-O 3.47Å; K51-I67 PolarHBondContact O-N 3.01Å; I67-V92 HydrophobicContact CG2-CB 4.07Å; I67-V92 HydrophobicContact CG2-CG1 4.29Å; I67-E94 HydrophobicContact CG1-CG 4.4Å; I67-L126 HydrophobicContact CD1-CD1 3.66Å; I67-L126 HydrophobicContact CD1-CD2 4.01Å; I67-L126 HydrophobicContact CD1-CG 4.43Å; I67-L126 HydrophobicContact CG2-CD1 3.6Å
68	A	97.8	Very high	94	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	136.3	169.2	0	0	0	0	109.2	V33 I36 F47 I48 V92 L93	V33-A68 HydrophobicContact CG2-CB 3.99Å; I36-A68 HydrophobicContact CD1-CB 3.85Å; F47-A68 HydrophobicContact CB-CB 4.29Å; F47-A68 HydrophobicContact CD1-CB 3.99Å; I48-A68 CarbonylContact O-C 3.58Å; I48-A68 VanDerWaalsContact O-CA 3.31Å; I48-A68 WeakPolarHBondContact O-CA 3.16Å; A68-V92 CarbonylContact O-C 3.6Å; A68-V92 VanDerWaalsContact O-CA 3.26Å; A68-V92 WeakPolarHBondContact O-CA 3.46Å; A68-L93 HydrophobicContact CB-CB 4.46Å; A68-L93 PolarHBondContact N-O 3Å; A68-L93 PolarHBondContact O-N 3.2Å
69	V	97.2	Very high	93.8	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136.3	178.6	64.7	0	0	0	110.7	F47 I48 Y50 P86 V92 L123	F47-V69 WeakPolarHBondContact CA-O 3.39Å; I48-V69 HydrophobicContact CD1-CG1 4.17Å; I48-V69 HydrophobicContact CG1-CG1 3.59Å; I48-V69 PolarHBondContact N-O 3.42Å; I48-V69 PolarHBondContact O-N 3.1Å; Y50-V69 HydrophobicContact CD2-CG1 4.44Å; Y50-V69 HydrophobicContact CG-CG1 4.41Å; V69-P86 HydrophobicContact CG1-CB 4.07Å; V69-P86 HydrophobicContact CG1-CG 3.62Å; V69-P86 HydrophobicContact CG2-CB 3.69Å; V69-P86 HydrophobicContact CG2-CG 4.16Å; V69-V92 HydrophobicContact CB-CG1 4.24Å; V69-V92 HydrophobicContact CG2-CG1 4.04Å; V69-L123 HydrophobicContact CB-CD1 4.4Å; V69-L123 HydrophobicContact CG2-CB 4.3Å; V69-L123 HydrophobicContact CG2-CD1 4.03Å; V69-L123 HydrophobicContact CG2-CD2 4.25Å; V69-L123 HydrophobicContact CG2-CG 4.44Å
70	Q	97.1	Very high	93.8	Very high	37 Å²	37	50.1 Å²	50.1	17%	0.173	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	132.7	177.1	-163.4	-177.3	-85	0	111	K45 F47 S90 P91	K45-Q70 HydrophobicContact CB-CG 3.48Å; K45-Q70 VanDerWaalsContact CB-CG 3.48Å; K45-Q70 HydrophobicContact CG-CG 4.12Å; F47-Q70 HydrophobicContact CD1-CB 4.21Å; F47-Q70 HydrophobicContact CE1-CB 3.65Å; F47-Q70 HydrophobicContact CE1-CG 4.29Å; F47-Q70 HydrophobicContact CE2-CB 4.28Å; F47-Q70 HydrophobicContact CE2-CG 4.01Å; F47-Q70 HydrophobicContact CZ-CB 3.7Å; F47-Q70 HydrophobicContact CZ-CG 3.85Å; Q70-S90 WeakPolarHBondContact O-CB 3.14Å; Q70-S90 PolarHBondContact O-OG 2.99Å; Q70-P91 HydrophobicContact CB-CB 4.27Å; Q70-P91 HydrophobicContact CB-CG 4.5Å; Q70-P91 WeakPolarHBondContact CB-O 3.44Å; Q70-P91 PolarHBondContact N-O 2.94Å
71	T	96.4	Very high	93.6	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	173.2	172.9	70.7	0	0	0	111.6	L46 I48 C73 Y79 C84 P86	L46-T71 WeakPolarHBondContact CB-OG1 3.34Å; L46-T71 WeakPolarHBondContact O-CB 3.31Å; L46-T71 WeakPolarHBondContact O-CG2 3.4Å; L46-T71 PolarHBondContact O-N 2.98Å; L46-T71 PolarHBondContact O-OG1 2.89Å; I48-T71 HydrophobicContact CB-CG2 4.46Å; I48-T71 HydrophobicContact CD1-CG2 4.11Å; I48-T71 HydrophobicContact CG1-CG2 4Å; I48-T71 HydrophobicContact CG2-CG2 3.8Å; T71-C73 VanDerWaalsContact C-N 3.26Å; T71-C73 PolarHBondContact OG1-N 2.95Å; T71-Y79 HydrophobicContact CG2-CD2 4.23Å; T71-Y79 HydrophobicContact CG2-CE2 3.96Å; T71-C84 WeakPolarHBondContact CB-O 3.48Å; T71-C84 HydrophobicContact CG2-CB 4.44Å; T71-C84 WeakPolarHBondContact CG2-O 3.4Å; T71-P86 HydrophobicContact CG2-CG 4.31Å
72	S	94.2	Very high	93.2	Very high	73 Å²	73	57.1 Å²	57.1	51%	0.51	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	-12.9	168.9	51.4	0	0	0	113.4	K83 C84	S72-K83 PolarHBondContact OG-O 3.21Å; S72-K83 VanDerWaalsContact OG-O 3.1Å; S72-C84 WeakPolarHBondContact OG-CA 3.36Å
73	C	95.5	Very high	92.9	Very high	16 Å²	16	64.5 Å²	64.5	11%	0.108	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	145.9	-172.7	-74.7	0	0	0	112	K45 L46 T71 A77 C84	K45-C73 CarbonylContact C-O 3.51Å; K45-C73 WeakPolarHBondContact CA-O 3.36Å; L46-C73 PolarHBondContact N-O 2.88Å; T71-C73 VanDerWaalsContact C-N 3.26Å; T71-C73 PolarHBondContact OG1-N 2.95Å; C73-A77 HydrophobicContact CB-CB 4.21Å; C73-C84 HydrophobicContact CB-CB 3.76Å; C73-C84 WeakPolarHBondContact CB-SG 3.24Å; C73-C84 WeakPolarHBondContact SG-CA 3.4Å; C73-C84 WeakPolarHBondContact SG-CB 3.44Å; C73-C84 CovalentContact SG-SG 2.02Å; C73-C84 PolarHBondContact SG-SG 3.39Å
74	P	94.8	Very high	92.6	Very high	70 Å²	70	62.3 Å²	62.3	46%	0.455	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	155.7	176.1	29.5	-33.5	0	0	110.9	D44 A77	D44-P74 CarbonylContact O-C 3.59Å; D44-P74 WeakPolarHBondContact O-CA 3.32Å; P74-A77 HydrophobicContact CG-CB 4.16Å; P74-A77 VanDerWaalsContact O-CB 3.27Å; P74-A77 WeakPolarHBondContact O-CB 3.4Å; P74-A77 PolarHBondContact O-N 3.18Å; P74-A77 VanDerWaalsContact O-N 3.16Å
75	K	91	Very high	92.3	Very high	33 Å²	33	69.2 Å²	69.2	14%	0.143	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	144.2	168.6	-74.3	-179.4	173.6	173.8	109.9	D39 S42 G43 D44 K45 A77	D39-K75 PolarHBondContact O-NZ 2.84Å; S42-K75 VanDerWaalsContact C-NZ 3.34Å; S42-K75 PolarHBondContact O-NZ 3.45Å; S42-K75 WeakPolarHBondContact OG-CE 3.37Å; S42-K75 PolarHBondContact OG-NZ 2.96Å; G43-K75 VanDerWaalsContact O-CD 3.29Å; G43-K75 WeakPolarHBondContact O-CD 3.37Å; G43-K75 WeakPolarHBondContact O-CE 3.38Å; G43-K75 PolarHBondContact O-NZ 2.82Å; D44-K75 PolarHBondContact O-N 2.75Å; K45-K75 WeakPolarHBondContact O-CE 3.46Å; K45-K75 VanDerWaalsContact O-CG 3.27Å; K45-K75 WeakPolarHBondContact O-CG 3.45Å; K75-A77 PolarHBondContact O-N 3.03Å
76	N	85.6	Confident	92.1	Very high	162 Å²	162	68 Å²	68	87%	0.866	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	-4.1	-175.1	-45	-52.6	0	0	116.4
77	A	87.9	Confident	91.8	Very high	36 Å²	36	72 Å²	72	30%	0.298	36%	0.362	S	S	.	.	S	Bend	trans	-67.1	143.7	166.5	0	0	0	0	110.2	C73 P74 K75 Y79	C73-A77 HydrophobicContact CB-CB 4.21Å; P74-A77 HydrophobicContact CG-CB 4.16Å; P74-A77 VanDerWaalsContact O-CB 3.27Å; P74-A77 WeakPolarHBondContact O-CB 3.4Å; P74-A77 PolarHBondContact O-N 3.18Å; P74-A77 VanDerWaalsContact O-N 3.16Å; K75-A77 PolarHBondContact O-N 3.03Å; A77-Y79 PolarHBondContact O-N 3.25Å
78	Q	85.1	Confident	91.6	Very high	183 Å²	183	72.7 Å²	72.7	86%	0.855	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-67.1	126.8	165.8	-169.8	171.8	16.7	0	108.5	D80	Q78-D80 PolarHBondContact O-N 3.01Å
79	Y	86.6	Confident	91.5	Very high	87 Å²	87	81.2 Å²	81.2	34%	0.341	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-63.3	120.3	178.4	179.2	-112.2	0	0	110.3	L46 I48 T71 A77 E81 C84	L46-Y79 HydrophobicContact CD2-CD2 4.22Å; I48-Y79 HydrophobicContact CD1-CE1 4.43Å; I48-Y79 HydrophobicContact CD1-CE2 3.77Å; I48-Y79 WeakPolarHBondContact CD1-OH 3.28Å; I48-Y79 HydrophobicContact CG2-CD2 3.7Å; I48-Y79 HydrophobicContact CG2-CE2 3.87Å; I48-Y79 HydrophobicContact CG2-CG 4.07Å; T71-Y79 HydrophobicContact CG2-CD2 4.23Å; T71-Y79 HydrophobicContact CG2-CE2 3.96Å; A77-Y79 PolarHBondContact O-N 3.25Å; Y79-E81 HydrophobicContact CE1-CB 3.9Å; Y79-C84 HydrophobicContact CD2-CB 3.6Å; Y79-C84 HydrophobicContact CE2-CB 3.62Å
80	D	89	Confident	91.4	Very high	56 Å²	56	81.7 Å²	81.7	30%	0.299	41%	0.414	S	S	.	.			trans	-118.2	108.2	169.5	177.2	-15.9	0	0	106.9	Q78 K82 K83 C84	Q78-D80 PolarHBondContact O-N 3.01Å; D80-K82 PolarHBondContact O-N 2.87Å; D80-K82 WeakPolarHBondContact OD1-CB 3.1Å; D80-K82 PolarHBondContact OD1-N 3.36Å; D80-K83 HydrophobicContact CB-CB 4.21Å; D80-K83 HydrophobicContact CB-CD 4.33Å; D80-K83 HydrophobicContact CB-CG 4.38Å; D80-K83 PolarHBondContact O-N 3.37Å; D80-K83 VanDerWaalsContact OD2-CD 3.26Å; D80-K83 WeakPolarHBondContact OD2-CD 3.5Å; D80-K83 WeakPolarHBondContact OD2-CE 3.47Å; D80-K83 IonicContact OD2-NZ 3.53Å; D80-C84 VanDerWaalsContact O-CB 3.3Å; D80-C84 WeakPolarHBondContact O-CB 3.36Å; D80-C84 PolarHBondContact O-N 2.89Å
81	E	86.2	Confident	91.4	Very high	130 Å²	130	80.9 Å²	80.9	61%	0.607	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-29.7	-176.6	-176.7	176.8	-175.4	0	112.9	Y79 K85	Y79-E81 HydrophobicContact CE1-CB 3.9Å; E81-K85 WeakPolarHBondContact O-CB 3.42Å
82	K	88	Confident	91.4	Very high	198 Å²	198	81 Å²	81	86%	0.861	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-28.6	179.6	-62.8	-177.5	-179.7	-179.9	112.6	D80	D80-K82 PolarHBondContact O-N 2.87Å; D80-K82 WeakPolarHBondContact OD1-CB 3.1Å; D80-K82 PolarHBondContact OD1-N 3.36Å
83	K	88.8	Confident	91.6	Very high	158 Å²	158	77.7 Å²	77.7	69%	0.687	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-31.7	-176.2	-62.6	179.3	-172.8	165.1	113.1	S72 D80	S72-K83 PolarHBondContact OG-O 3.21Å; S72-K83 VanDerWaalsContact OG-O 3.1Å; D80-K83 HydrophobicContact CB-CB 4.21Å; D80-K83 HydrophobicContact CB-CD 4.33Å; D80-K83 HydrophobicContact CB-CG 4.38Å; D80-K83 PolarHBondContact O-N 3.37Å; D80-K83 VanDerWaalsContact OD2-CD 3.26Å; D80-K83 WeakPolarHBondContact OD2-CD 3.5Å; D80-K83 WeakPolarHBondContact OD2-CE 3.47Å; D80-K83 IonicContact OD2-NZ 3.53Å
84	C	91.8	Very high	91.6	Very high	3 Å²	3	82 Å²	82	2%	0.02	41%	0.408	C	S	.	.	S	Bend	trans	-105.2	17.7	-171.5	-53.3	0	0	0	112.5	T71 S72 C73 Y79 D80 P86	T71-C84 WeakPolarHBondContact CB-O 3.48Å; T71-C84 HydrophobicContact CG2-CB 4.44Å; T71-C84 WeakPolarHBondContact CG2-O 3.4Å; S72-C84 WeakPolarHBondContact OG-CA 3.36Å; C73-C84 HydrophobicContact CB-CB 3.76Å; C73-C84 WeakPolarHBondContact CB-SG 3.24Å; C73-C84 WeakPolarHBondContact SG-CA 3.4Å; C73-C84 WeakPolarHBondContact SG-CB 3.44Å; C73-C84 CovalentContact SG-SG 2.02Å; C73-C84 PolarHBondContact SG-SG 3.39Å; Y79-C84 HydrophobicContact CD2-CB 3.6Å; Y79-C84 HydrophobicContact CE2-CB 3.62Å; D80-C84 VanDerWaalsContact O-CB 3.3Å; D80-C84 WeakPolarHBondContact O-CB 3.36Å; D80-C84 PolarHBondContact O-N 2.89Å; C84-P86 WeakPolarHBondContact O-CD 3.44Å
85	K	91.3	Very high	91.8	Very high	144 Å²	144	78.9 Å²	78.9	63%	0.626	39%	0.387	S	S	*	.			trans	-62.3	126.9	-171.7	-165.3	173.8	178.7	172.7	111.8	E81	E81-K85 WeakPolarHBondContact O-CB 3.42Å
86	P	93.5	Very high	92.2	Very high	23 Å²	23	82.3 Å²	82.3	15%	0.149	40%	0.402	C	S	.	.			trans	-62.8	149.5	170.3	-20.6	31.9	0	0	112.3	I48 V69 T71 C84 S90 L123	I48-P86 HydrophobicContact CD1-CG 3.84Å; I48-P86 HydrophobicContact CG1-CG 4.39Å; V69-P86 HydrophobicContact CG1-CB 4.07Å; V69-P86 HydrophobicContact CG1-CG 3.62Å; V69-P86 HydrophobicContact CG2-CB 3.69Å; V69-P86 HydrophobicContact CG2-CG 4.16Å; T71-P86 HydrophobicContact CG2-CG 4.31Å; C84-P86 WeakPolarHBondContact O-CD 3.44Å; P86-S90 WeakPolarHBondContact CA-OG 3.31Å; P86-L123 HydrophobicContact CB-CD2 4.27Å
87	T	93.1	Very high	92.8	Very high	83 Å²	83	74.6 Å²	74.6	51%	0.509	36%	0.361	S	S	.	.			trans	-111.5	171.5	173.5	72.5	0	0	0	110.2	K89 S90	T87-K89 PolarHBondContact O-N 3.03Å; T87-K89 VanDerWaalsContact O-N 3.1Å; T87-K89 PolarHBondContact OG1-N 3.01Å; T87-S90 PolarHBondContact N-OG 3.04Å; T87-S90 VanDerWaalsContact O-CB 3.26Å; T87-S90 WeakPolarHBondContact O-CB 3.46Å; T87-S90 PolarHBondContact O-N 3.42Å; T87-S90 PolarHBondContact O-OG 2.98Å
88	G	93.4	Very high	93.3	Very high	30 Å²	30	75.1 Å²	75.1	31%	0.309	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.1	173.8	0	0	0	0	113.8	T122 S124	G88-T122 WeakPolarHBondContact O-CB 3.26Å; G88-T122 PolarHBondContact O-OG1 2.02Å; G88-S124 WeakPolarHBondContact O-CB 3.32Å; G88-S124 PolarHBondContact O-N 3.05Å; G88-S124 PolarHBondContact O-OG 3.45Å; G88-S124 VanDerWaalsContact O-OG 3.09Å
89	K	94.1	Very high	93.9	Very high	179 Å²	179	66.4 Å²	66.4	78%	0.778	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-2.8	177.7	-60.2	-175.9	179.5	-176.8	113.5	T87 P91 T122	T87-K89 PolarHBondContact O-N 3.03Å; T87-K89 VanDerWaalsContact O-N 3.1Å; T87-K89 PolarHBondContact OG1-N 3.01Å; K89-P91 WeakPolarHBondContact O-CD 3.47Å; K89-T122 WeakPolarHBondContact O-CG2 3.45Å
90	S	95.8	Very high	94.3	Very high	12 Å²	12	64.2 Å²	64.2	8%	0.084	32%	0.317	C	S	.	.			trans	-63.5	128.3	178.2	-77.8	0	0	0	110.1	Q70 P86 T87 T122 L123	Q70-S90 WeakPolarHBondContact O-CB 3.14Å; Q70-S90 PolarHBondContact O-OG 2.99Å; P86-S90 WeakPolarHBondContact CA-OG 3.31Å; T87-S90 PolarHBondContact N-OG 3.04Å; T87-S90 VanDerWaalsContact O-CB 3.26Å; T87-S90 WeakPolarHBondContact O-CB 3.46Å; T87-S90 PolarHBondContact O-N 3.42Å; T87-S90 PolarHBondContact O-OG 2.98Å; S90-T122 CarbonylContact O-C 3.54Å; S90-T122 VanDerWaalsContact O-CA 3.25Å; S90-T122 WeakPolarHBondContact O-CA 3.21Å; S90-L123 PolarHBondContact O-N 3.38Å
91	P	96.9	Very high	94.6	Very high	19 Å²	19	67.1 Å²	67.1	12%	0.123	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-56.1	150.1	171	-26.1	34.3	0	0	112.3	Q70 K89 P117 E121	Q70-P91 HydrophobicContact CB-CB 4.27Å; Q70-P91 HydrophobicContact CB-CG 4.5Å; Q70-P91 WeakPolarHBondContact CB-O 3.44Å; Q70-P91 PolarHBondContact N-O 2.94Å; K89-P91 WeakPolarHBondContact O-CD 3.47Å; P91-P117 HydrophobicContact CB-CB 3.73Å; P91-P117 HydrophobicContact CG-CB 4.44Å; P91-E121 CarbonylContact C-O 3.58Å; P91-E121 VanDerWaalsContact CA-O 3.28Å; P91-E121 WeakPolarHBondContact CA-O 3.3Å
92	V	97.3	Very high	94.9	Very high	7 Å²	7	66 Å²	66	4%	0.042	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	147.4	176.6	-60.9	0	0	0	110.6	I67 A68 V69 E121 L123 L126	I67-V92 HydrophobicContact CG2-CB 4.07Å; I67-V92 HydrophobicContact CG2-CG1 4.29Å; A68-V92 CarbonylContact O-C 3.6Å; A68-V92 VanDerWaalsContact O-CA 3.26Å; A68-V92 WeakPolarHBondContact O-CA 3.46Å; V69-V92 HydrophobicContact CB-CG1 4.24Å; V69-V92 HydrophobicContact CG2-CG1 4.04Å; V92-E121 HydrophobicContact CG2-CB 4.37Å; V92-E121 PolarHBondContact N-O 3.1Å; V92-L123 HydrophobicContact CG1-CB 4.21Å; V92-L123 HydrophobicContact CG1-CD1 4.18Å; V92-L126 HydrophobicContact CB-CD1 4.23Å; V92-L126 HydrophobicContact CG1-CD1 3.9Å; V92-L126 HydrophobicContact CG2-CD1 3.98Å
93	L	97.4	Very high	95	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.01	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	125.6	170.3	-60.9	177.9	0	0	108.4	I36 F47 A68 P114 P117	I36-L93 HydrophobicContact CG2-CD1 3.76Å; F47-L93 HydrophobicContact CD1-CD1 4.17Å; F47-L93 HydrophobicContact CD1-CG 4.3Å; F47-L93 HydrophobicContact CE1-CB 4.42Å; F47-L93 HydrophobicContact CE1-CD1 3.73Å; F47-L93 HydrophobicContact CE1-CG 3.63Å; F47-L93 HydrophobicContact CE2-CD1 4.25Å; F47-L93 HydrophobicContact CZ-CD1 3.77Å; F47-L93 HydrophobicContact CZ-CG 3.98Å; A68-L93 HydrophobicContact CB-CB 4.46Å; A68-L93 PolarHBondContact N-O 3Å; A68-L93 PolarHBondContact O-N 3.2Å; L93-P114 HydrophobicContact CD2-CG 4.42Å; L93-P114 WeakPolarHBondContact CD2-O 3.35Å; L93-P117 HydrophobicContact CD2-CB 4.23Å
94	E	97	Very high	94.9	Very high	106 Å²	106	59.1 Å²	59.1	50%	0.495	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	116.8	176.7	-62.9	-171.1	-176.1	0	109.7	L66 I67 P114	L66-E94 WeakPolarHBondContact O-CA 3.36Å; I67-E94 HydrophobicContact CG1-CG 4.4Å; E94-P114 WeakPolarHBondContact O-CD 3.31Å
95	H	98.3	Very high	94.6	Very high	5 Å²	5	61 Å²	61	2%	0.023	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	143.1	-176.8	-79.2	-130.6	0	0	110.4	L66 S111 T112 P114	L66-H95 HydrophobicContact CB-CB 4.43Å; L66-H95 PolarHBondContact N-O 3.36Å; L66-H95 PolarHBondContact O-N 3.02Å; H95-S111 PolarHBondContact ND1-OG 2.78Å; H95-T112 CarbonylContact C-O 3.54Å; H95-T112 VanDerWaalsContact CA-O 3.31Å; H95-T112 WeakPolarHBondContact CA-O 3.46Å; H95-P114 PolarHBondContact NE2-O 3.13Å
96	K	98.5	Very high	94.5	Very high	105 Å²	105	58.8 Å²	58.8	46%	0.457	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	122.1	161.1	-171.6	168.2	-66.8	-65	108.9	I63 D65 S111 T112	I63-K96 HydrophobicContact CG2-CD 4.22Å; I63-K96 HydrophobicContact CG2-CG 4.08Å; D65-K96 IonicContact OD1-NZ 2.74Å; D65-K96 PolarHBondContact OD1-NZ 3.33Å; K96-S111 CarbonylContact O-C 3.59Å; K96-S111 VanDerWaalsContact O-CA 3.28Å; K96-S111 WeakPolarHBondContact O-CA 3.33Å; K96-T112 PolarHBondContact N-O 3.48Å; K96-T112 PolarHBondContact O-N 2.83Å
97	V	98.5	Very high	94.6	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	136.8	179	-177.5	0	0	0	109.6	A32 I63 F64 L66 V109 A110	A32-V97 HydrophobicContact CB-CG1 4.19Å; A32-V97 HydrophobicContact CB-CG2 3.69Å; I63-V97 VanDerWaalsContact CA-O 3.29Å; I63-V97 WeakPolarHBondContact CA-O 3.26Å; F64-V97 HydrophobicContact CD1-CB 4.15Å; F64-V97 HydrophobicContact CD1-CG1 4.33Å; F64-V97 HydrophobicContact CD2-CB 4Å; F64-V97 HydrophobicContact CD2-CG2 4.24Å; F64-V97 HydrophobicContact CE1-CB 3.79Å; F64-V97 HydrophobicContact CE1-CG1 3.55Å; F64-V97 HydrophobicContact CE2-CB 3.65Å; F64-V97 HydrophobicContact CE2-CG1 4.03Å; F64-V97 HydrophobicContact CE2-CG2 3.7Å; F64-V97 HydrophobicContact CG-CB 4.26Å; F64-V97 HydrophobicContact CZ-CB 3.54Å; F64-V97 HydrophobicContact CZ-CG1 3.38Å; F64-V97 HydrophobicContact CZ-CG2 3.94Å; F64-V97 PolarHBondContact N-O 3Å; F64-V97 PolarHBondContact O-N 2.86Å; L66-V97 HydrophobicContact CB-CG2 3.58Å; L66-V97 HydrophobicContact CD2-CG2 3.75Å; L66-V97 HydrophobicContact CG-CG2 4.32Å; V97-V109 HydrophobicContact CG1-CG1 3.69Å; V97-A110 WeakPolarHBondContact CA-O 3.39Å
98	V	98	Very high	94.7	Very high	48 Å²	48	59.3 Å²	59.3	29%	0.291	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	110.4	174	-176.9	0	0	0	108.4	A61 I63 A110	A61-V98 HydrophobicContact CB-CG1 4.24Å; I63-V98 HydrophobicContact CG1-CG1 4.29Å; I63-V98 HydrophobicContact CG1-CG2 4.29Å; I63-V98 HydrophobicContact CG2-CG2 4.38Å; V98-A110 PolarHBondContact N-O 2.87Å; V98-A110 PolarHBondContact O-N 2.69Å
99	A	97.6	Very high	94.9	Very high	0 Å²	0	60 Å²	60	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	95.4	170.6	0	0	0	0	109.3	F28 A61 V62 F107 S108 V109	F28-A99 HydrophobicContact CB-CB 4.32Å; F28-A99 HydrophobicContact CD1-CB 4Å; F28-A99 HydrophobicContact CD2-CB 3.39Å; F28-A99 HydrophobicContact CE1-CB 4.1Å; F28-A99 HydrophobicContact CE2-CB 3.5Å; F28-A99 HydrophobicContact CG-CB 3.65Å; F28-A99 HydrophobicContact CZ-CB 3.86Å; A61-A99 CarbonylContact C-O 3.53Å; A61-A99 VanDerWaalsContact CA-O 3.22Å; A61-A99 WeakPolarHBondContact CA-O 3.26Å; V62-A99 HydrophobicContact CB-CB 4.34Å; V62-A99 PolarHBondContact N-O 3.34Å; V62-A99 PolarHBondContact O-N 2.9Å; A99-F107 HydrophobicContact CB-CD1 4.25Å; A99-S108 CarbonylContact C-O 3.56Å; A99-S108 WeakPolarHBondContact CA-O 3.15Å; A99-V109 HydrophobicContact CB-CG2 4.13Å
100	S	96.7	Very high	95.1	Very high	41 Å²	41	54.3 Å²	54.3	29%	0.287	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	126.2	-179.7	-62.9	0	0	0	111.4	F107 S108	S100-F107 WeakPolarHBondContact O-CA 3.43Å; S100-S108 PolarHBondContact N-O 3.27Å; S100-S108 PolarHBondContact O-N 2.77Å
101	K	94.4	Very high	95.1	Very high	117 Å²	117	55.1 Å²	55.1	51%	0.509	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	126.9	174	-165.1	172.8	-176.1	177.1	109.6	K60 F107	K60-K101 WeakPolarHBondContact O-CB 3.28Å; K60-K101 PolarHBondContact O-N 3.04Å; K101-F107 HydrophobicContact CB-CD1 4.23Å; K101-F107 HydrophobicContact CB-CE1 3.86Å; K101-F107 HydrophobicContact CB-CZ 4.39Å; K101-F107 HydrophobicContact CD-CZ 4.32Å; K101-F107 HydrophobicContact CG-CE1 4.13Å; K101-F107 HydrophobicContact CG-CZ 4.15Å
102	K	93.1	Very high	95.1	Very high	105 Å²	105	59.6 Å²	59.6	46%	0.457	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-103.5	160.8	177.2	-61.2	-63	-176.3	-179	110.4	G104 G105 V106	K102-G104 PolarHBondContact O-N 2.72Å; K102-G105 PolarHBondContact O-N 3.22Å; K102-G105 VanDerWaalsContact O-N 3.16Å; K102-V106 WeakPolarHBondContact CB-O 3.27Å; K102-V106 PolarHBondContact N-O 2.65Å
103	P	89.4	Confident	95.1	Very high	129 Å²	129	60.9 Å²	60.9	84%	0.838	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	138.2	169.3	-25.6	35	0	0	110.9
104	G	87.4	Confident	94.9	Very high	83 Å²	83	64.5 Å²	64.5	86%	0.856	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.5	6	-175.2	0	0	0	0	115.3	K102 V106	K102-G104 PolarHBondContact O-N 2.72Å; G104-V106 VanDerWaalsContact C-N 3.27Å; G104-V106 PolarHBondContact O-N 2.81Å
105	G	84.5	Confident	94.8	Very high	44 Å²	44	61.6 Å²	61.6	45%	0.454	39%	0.388	S	S	.	.	S	Bend	trans	79.2	6.9	173.4	0	0	0	0	114.8	K102	K102-G105 PolarHBondContact O-N 3.22Å; K102-G105 VanDerWaalsContact O-N 3.16Å
106	V	90.6	Very high	94.6	Very high	97 Å²	97	67.3 Å²	67.3	59%	0.588	42%	0.419	S	S	*	.			trans	-78.9	148.8	173.3	-176.7	0	0	0	109.7	K102 G104	K102-V106 WeakPolarHBondContact CB-O 3.27Å; K102-V106 PolarHBondContact N-O 2.65Å; G104-V106 VanDerWaalsContact C-N 3.27Å; G104-V106 PolarHBondContact O-N 2.81Å
107	F	94.9	Very high	94.2	Very high	59 Å²	59	63.6 Å²	63.6	26%	0.259	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	142.9	174.6	-70.5	-96.1	0	0	111.5	L24 F28 A99 S100 K101	L24-F107 HydrophobicContact CD2-CE2 4.13Å; L24-F107 HydrophobicContact CD2-CZ 4.41Å; F28-F107 HydrophobicContact CE1-CB 3.59Å; F28-F107 HydrophobicContact CE1-CD1 4.25Å; F28-F107 HydrophobicContact CE1-CD2 4.17Å; F28-F107 AromaticContact CE1-CG 3.76Å; F28-F107 HydrophobicContact CE1-CG 3.76Å; F28-F107 HydrophobicContact CE2-CD1 4.23Å; F28-F107 HydrophobicContact CE2-CE1 4.43Å; F28-F107 HydrophobicContact CE2-CG 4.49Å; F28-F107 HydrophobicContact CZ-CB 3.8Å; F28-F107 AromaticContact CZ-CD1 3.55Å; F28-F107 HydrophobicContact CZ-CD1 3.55Å; F28-F107 AromaticContact CZ-CD2 3.76Å; F28-F107 HydrophobicContact CZ-CD2 3.76Å; F28-F107 AromaticContact CZ-CE1 3.98Å; F28-F107 HydrophobicContact CZ-CE1 3.98Å; F28-F107 HydrophobicContact CZ-CE2 4.17Å; F28-F107 AromaticContact CZ-CG 3.41Å; F28-F107 HydrophobicContact CZ-CG 3.41Å; F28-F107 VanDerWaalsContact CZ-CG 3.41Å; F28-F107 HydrophobicContact CZ-CZ 4.27Å; A99-F107 HydrophobicContact CB-CD1 4.25Å; S100-F107 WeakPolarHBondContact O-CA 3.43Å; K101-F107 HydrophobicContact CB-CD1 4.23Å; K101-F107 HydrophobicContact CB-CE1 3.86Å; K101-F107 HydrophobicContact CB-CZ 4.39Å; K101-F107 HydrophobicContact CD-CZ 4.32Å; K101-F107 HydrophobicContact CG-CE1 4.13Å; K101-F107 HydrophobicContact CG-CZ 4.15Å
108	S	96	Very high	93.8	Very high	58 Å²	58	67.2 Å²	67.2	41%	0.406	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.1	167.2	176.3	0	0	0	108.2	A99 S100	A99-S108 CarbonylContact C-O 3.56Å; A99-S108 WeakPolarHBondContact CA-O 3.15Å; S100-S108 PolarHBondContact N-O 3.27Å; S100-S108 PolarHBondContact O-N 2.77Å
109	V	97.6	Very high	93.3	Very high	43 Å²	43	69 Å²	69	26%	0.261	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128	-176.1	-175.4	0	0	0	109.3	F28 A31 A32 V97 A99	F28-V109 HydrophobicContact CB-CG1 4.5Å; F28-V109 HydrophobicContact CB-CG2 4.23Å; F28-V109 HydrophobicContact CD1-CG2 3.55Å; F28-V109 HydrophobicContact CE1-CG2 4.22Å; F28-V109 HydrophobicContact CG-CG2 4.12Å; A31-V109 HydrophobicContact CB-CB 4.18Å; A31-V109 HydrophobicContact CB-CG1 4.22Å; A31-V109 HydrophobicContact CB-CG2 4.23Å; A32-V109 HydrophobicContact CB-CG1 4.42Å; V97-V109 HydrophobicContact CG1-CG1 3.69Å; A99-V109 HydrophobicContact CB-CG2 4.13Å
110	A	97	Very high	92.9	Very high	60 Å²	60	75.1 Å²	75.1	50%	0.496	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.4	169.9	0	0	0	0	109.4	V97 V98	V97-A110 WeakPolarHBondContact CA-O 3.39Å; V98-A110 PolarHBondContact N-O 2.87Å; V98-A110 PolarHBondContact O-N 2.69Å
111	S	96.9	Very high	92.8	Very high	30 Å²	30	76.9 Å²	76.9	21%	0.21	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	142.9	174.5	70.6	0	0	0	110.5	H95 K96	H95-S111 PolarHBondContact ND1-OG 2.78Å; K96-S111 CarbonylContact O-C 3.59Å; K96-S111 VanDerWaalsContact O-CA 3.28Å; K96-S111 WeakPolarHBondContact O-CA 3.33Å
112	T	97.1	Very high	92.8	Very high	113 Å²	113	72 Å²	72	69%	0.693	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	129.5	176.7	-54.9	0	0	0	109.3	H95 K96	H95-T112 CarbonylContact C-O 3.54Å; H95-T112 VanDerWaalsContact CA-O 3.31Å; H95-T112 WeakPolarHBondContact CA-O 3.46Å; K96-T112 PolarHBondContact N-O 3.48Å; K96-T112 PolarHBondContact O-N 2.83Å
113	G	95.7	Very high	92.8	Very high	33 Å²	33	67.6 Å²	67.6	34%	0.34	43%	0.433	S	S	.	.	S	Bend	trans	176.8	174.3	-177.2	0	0	0	0	110.3
114	P	94.6	Very high	93	Very high	79 Å²	79	64.4 Å²	64.4	51%	0.513	41%	0.414	S	S	.	.			trans	-62.6	139.4	172.1	28.2	-32.5	0	0	110	L93 E94 H95	L93-P114 HydrophobicContact CD2-CG 4.42Å; L93-P114 WeakPolarHBondContact CD2-O 3.35Å; E94-P114 WeakPolarHBondContact O-CD 3.31Å; H95-P114 PolarHBondContact NE2-O 3.13Å
115	M	94.8	Very high	93.3	Very high	44 Å²	44	65.8 Å²	65.8	22%	0.217	40%	0.396	C	S	.	.			trans	-97	-33.6	173.3	-74.4	-64.7	-173	0	112.1	I36 D39 D41 S42 P117	I36-M115 HydrophobicContact CG1-CE 4.41Å; I36-M115 HydrophobicContact CG1-SD 4.3Å; I36-M115 HydrophobicContact CG2-SD 4.4Å; D39-M115 HydrophobicContact CB-CE 4.15Å; D39-M115 HydrophobicContact CB-SD 4.03Å; D41-M115 HydrophobicContact CB-CB 3.9Å; S42-M115 WeakPolarHBondContact CA-O 3.42Å; S42-M115 WeakPolarHBondContact CB-O 3.46Å; M115-P117 VanDerWaalsContact O-CD 3.31Å; M115-P117 WeakPolarHBondContact O-CD 3.07Å
116	D	93.6	Very high	93.4	Very high	126 Å²	126	65.5 Å²	65.5	67%	0.674	38%	0.384	S	S	*	.	S	Bend	trans	-78	116.5	178.6	-172.9	14.9	0	0	110.6	D118	D116-D118 PolarHBondContact O-N 3.23Å
117	P	89.7	Confident	92.6	Very high	26 Å²	26	70.6 Å²	70.6	17%	0.169	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-71.1	118.6	-178.4	25.2	-30.8	0	0	112.7	F47 P91 L93 M115 S119	F47-P117 HydrophobicContact CZ-CB 4.14Å; F47-P117 HydrophobicContact CZ-CG 4.37Å; P91-P117 HydrophobicContact CB-CB 3.73Å; P91-P117 HydrophobicContact CG-CB 4.44Å; L93-P117 HydrophobicContact CD2-CB 4.23Å; M115-P117 VanDerWaalsContact O-CD 3.31Å; M115-P117 WeakPolarHBondContact O-CD 3.07Å; P117-S119 PolarHBondContact O-N 3.07Å
118	D	89.8	Confident	92.5	Very high	77 Å²	77	71.2 Å²	71.2	41%	0.412	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-76.3	122.7	171.5	-171.6	-19.2	0	0	110.7	D116 H120 E121	D116-D118 PolarHBondContact O-N 3.23Å; D118-H120 PolarHBondContact O-N 3.26Å; D118-H120 VanDerWaalsContact O-N 3.13Å; D118-H120 WeakPolarHBondContact OD1-CB 3.02Å; D118-H120 IonicContact OD1-CD2 3.36Å; D118-H120 PolarHBondContact OD1-CD2 3.16Å; D118-H120 IonicContact OD1-CG 3.71Å; D118-H120 PolarHBondContact OD1-N 3.32Å; D118-E121 HydrophobicContact CB-CB 4.17Å; D118-E121 HydrophobicContact CB-CG 4.12Å; D118-E121 PolarHBondContact O-N 2.78Å
119	S	87.2	Confident	92.3	Very high	85 Å²	85	71.8 Å²	71.8	59%	0.594	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-19	176.3	69.1	0	0	0	114.4	P117 T122	P117-S119 PolarHBondContact O-N 3.07Å; S119-T122 VanDerWaalsContact O-CG2 3.24Å; S119-T122 WeakPolarHBondContact O-CG2 3.34Å
120	H	90.1	Very high	92	Very high	129 Å²	129	73.4 Å²	73.4	60%	0.597	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-29.5	173.8	-64.8	-72.3	0	0	112	D118 T122 K125	D118-H120 PolarHBondContact O-N 3.26Å; D118-H120 VanDerWaalsContact O-N 3.13Å; D118-H120 WeakPolarHBondContact OD1-CB 3.02Å; D118-H120 IonicContact OD1-CD2 3.36Å; D118-H120 PolarHBondContact OD1-CD2 3.16Å; D118-H120 IonicContact OD1-CG 3.71Å; D118-H120 PolarHBondContact OD1-N 3.32Å; H120-T122 PolarHBondContact O-N 3.09Å; H120-K125 WeakPolarHBondContact O-CD 3.29Å; H120-K125 WeakPolarHBondContact O-CE 3.27Å; H120-K125 PolarHBondContact O-NZ 2.66Å
121	E	93.7	Very high	91.7	Very high	78 Å²	78	74.2 Å²	74.2	36%	0.364	41%	0.408	S	S	.	.	S	Bend	trans	-86	92.4	178.4	-65.2	-50.5	131.3	0	110.1	P91 V92 D118 K125	P91-E121 CarbonylContact C-O 3.58Å; P91-E121 VanDerWaalsContact CA-O 3.28Å; P91-E121 WeakPolarHBondContact CA-O 3.3Å; V92-E121 HydrophobicContact CG2-CB 4.37Å; V92-E121 PolarHBondContact N-O 3.1Å; D118-E121 HydrophobicContact CB-CB 4.17Å; D118-E121 HydrophobicContact CB-CG 4.12Å; D118-E121 PolarHBondContact O-N 2.78Å; E121-K125 IonicContact OE1-NZ 2.74Å; E121-K125 PolarHBondContact OE1-NZ 2.69Å; E121-K125 IonicContact OE2-NZ 3.7Å
122	T	95.3	Very high	91.4	Very high	15 Å²	15	77 Å²	77	9%	0.092	42%	0.421	C	S	.	.	B	Isolated β-bridge	trans	-121.3	160.6	-171.7	66.3	0	0	0	112.7	G88 K89 S90 S119 H120 S124 K125	G88-T122 WeakPolarHBondContact O-CB 3.26Å; G88-T122 PolarHBondContact O-OG1 2.02Å; K89-T122 WeakPolarHBondContact O-CG2 3.45Å; S90-T122 CarbonylContact O-C 3.54Å; S90-T122 VanDerWaalsContact O-CA 3.25Å; S90-T122 WeakPolarHBondContact O-CA 3.21Å; S119-T122 VanDerWaalsContact O-CG2 3.24Å; S119-T122 WeakPolarHBondContact O-CG2 3.34Å; H120-T122 PolarHBondContact O-N 3.09Å; T122-S124 PolarHBondContact O-N 3.44Å; T122-S124 PolarHBondContact OG1-OG 3.37Å; T122-K125 WeakPolarHBondContact O-CB 3.01Å; T122-K125 PolarHBondContact O-N 2.84Å
123	L	93.6	Very high	91	Very high	11 Å²	11	74.6 Å²	74.6	6%	0.058	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-52.5	-31.5	178.5	-167.7	65.5	0	0	113.7	Y50 V69 P86 S90 V92 K125 L126	Y50-L123 HydrophobicContact CD1-CD1 3.56Å; Y50-L123 HydrophobicContact CD2-CD1 3.8Å; Y50-L123 HydrophobicContact CE1-CD1 3.44Å; Y50-L123 VanDerWaalsContact CE1-CD1 3.44Å; Y50-L123 HydrophobicContact CE2-CD1 3.71Å; Y50-L123 HydrophobicContact CE2-CD2 4.4Å; Y50-L123 HydrophobicContact CG-CD1 3.74Å; V69-L123 HydrophobicContact CB-CD1 4.4Å; V69-L123 HydrophobicContact CG2-CB 4.3Å; V69-L123 HydrophobicContact CG2-CD1 4.03Å; V69-L123 HydrophobicContact CG2-CD2 4.25Å; V69-L123 HydrophobicContact CG2-CG 4.44Å; P86-L123 HydrophobicContact CB-CD2 4.27Å; S90-L123 PolarHBondContact O-N 3.38Å; V92-L123 HydrophobicContact CG1-CB 4.21Å; V92-L123 HydrophobicContact CG1-CD1 4.18Å; L123-K125 VanDerWaalsContact C-N 3.32Å; L123-K125 PolarHBondContact O-N 2.8Å; L123-L126 HydrophobicContact CD1-CD1 4.4Å; L123-L126 PolarHBondContact O-N 3.32Å
124	S	93.9	Very high	90.7	Very high	62 Å²	62	77.6 Å²	77.6	43%	0.434	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-68.2	-26	178.7	62.2	0	0	0	114.3	G88 T122 L126	G88-S124 WeakPolarHBondContact O-CB 3.32Å; G88-S124 PolarHBondContact O-N 3.05Å; G88-S124 PolarHBondContact O-OG 3.45Å; G88-S124 VanDerWaalsContact O-OG 3.09Å; T122-S124 PolarHBondContact O-N 3.44Å; T122-S124 PolarHBondContact OG1-OG 3.37Å; S124-L126 PolarHBondContact O-N 3.16Å
125	K	92.6	Very high	90.4	Very high	112 Å²	112	77.5 Å²	77.5	49%	0.487	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-73.9	-17	175.4	-73.4	-177.6	165.3	175.2	113.3	H120 E121 T122 L123	H120-K125 WeakPolarHBondContact O-CD 3.29Å; H120-K125 WeakPolarHBondContact O-CE 3.27Å; H120-K125 PolarHBondContact O-NZ 2.66Å; E121-K125 IonicContact OE1-NZ 2.74Å; E121-K125 PolarHBondContact OE1-NZ 2.69Å; E121-K125 IonicContact OE2-NZ 3.7Å; T122-K125 WeakPolarHBondContact O-CB 3.01Å; T122-K125 PolarHBondContact O-N 2.84Å; L123-K125 VanDerWaalsContact C-N 3.32Å; L123-K125 PolarHBondContact O-N 2.8Å
126	L	86.4	Confident	90	Very high	39 Å²	39	80.3 Å²	80.3	20%	0.204	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-92.7	-2.4	-176.8	-59.5	176.5	0	0	113.9	I67 V92 L123 S124	I67-L126 HydrophobicContact CD1-CD1 3.66Å; I67-L126 HydrophobicContact CD1-CD2 4.01Å; I67-L126 HydrophobicContact CD1-CG 4.43Å; I67-L126 HydrophobicContact CG2-CD1 3.6Å; V92-L126 HydrophobicContact CB-CD1 4.23Å; V92-L126 HydrophobicContact CG1-CD1 3.9Å; V92-L126 HydrophobicContact CG2-CD1 3.98Å; L123-L126 HydrophobicContact CD1-CD1 4.4Å; L123-L126 PolarHBondContact O-N 3.32Å; S124-L126 PolarHBondContact O-N 3.16Å
127	K	74.2	Confident	89.7	Confident	203 Å²	203	76.1 Å²	76.1	88%	0.883	39%	0.39	S	S	*	.			trans	-102	0	-179.4	-69.6	-174.1	178.7	-175.9	110.6

Retrieved 127 of 127 residues in 84.8 ms (Link to these results)

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