A0A077ZKY6_TRITR Loading...

PDZ domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZKY6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 119 aa.

						>A0A077ZKY6_TRITR|A0A077ZKY6
MSAPSGGTRSLVALKIDLAKPTRSFGLGIRMHNGKVMVSSMKPNSISSDHFKVGDFIVTINKQPVTTKVVCRNLITSNRGIIEVIVEREADTKLTHESYVQVSFLSHYYCSRRVSTGTP
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42	Very low	59.1	Low	248 Å²	248	111.5 Å²	111.5	100%	1.222	70%	0.704	S	S	*	*				0	103.6	0	-67.6	178.6	180	0	0	106.9	A3	M1-A3 PolarHBondContact O-N 3.26Å
2	S	44.2	Very low	61.2	Low	124 Å²	124	106.1 Å²	106.1	87%	0.867	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-66.5	119.8	-178.1	-48.4	0	0	0	0	108.6
3	A	56.9	Low	63.1	Low	86 Å²	86	104.2 Å²	104.2	71%	0.711	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-53.1	136.7	169.9	0	0	0	0	0	108.1	M1 S5	M1-A3 PolarHBondContact O-N 3.26Å; A3-S5 PolarHBondContact O-N 3.44Å
4	P	55.7	Low	64.7	Low	121 Å²	121	98.1 Å²	98.1	79%	0.786	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-59.3	118.1	170.2	25.5	-30.3	0	0	0	106	G6	P4-G6 PolarHBondContact O-N 2.87Å
5	S	49.5	Very low	66.1	Low	127 Å²	127	99.2 Å²	99.2	89%	0.888	62%	0.62	S	S	*	*			trans	-64	62.6	162.7	36	0	0	0	0	108.4	A3 G7	A3-S5 PolarHBondContact O-N 3.44Å; S5-G7 PolarHBondContact O-N 3.48Å; S5-G7 VanDerWaalsContact O-N 3.17Å
6	G	49.5	Very low	67.2	Low	55 Å²	55	93.1 Å²	93.1	57%	0.567	58%	0.582	S	S	*	*			trans	-69.5	107.7	168.8	0	0	0	0	0	105.8	P4 T8	P4-G6 PolarHBondContact O-N 2.87Å; G6-T8 PolarHBondContact O-N 3.19Å; G6-T8 VanDerWaalsContact O-N 3.09Å
7	G	54.7	Low	68.1	Low	56 Å²	56	91.4 Å²	91.4	58%	0.577	57%	0.568	S	S	*	*			trans	-45.3	122.4	172.6	0	0	0	0	0	109.1	S5 R9	S5-G7 PolarHBondContact O-N 3.48Å; S5-G7 VanDerWaalsContact O-N 3.17Å; G7-R9 PolarHBondContact O-N 3.23Å
8	T	64.3	Low	68.5	Low	114 Å²	114	88.3 Å²	88.3	70%	0.699	55%	0.547	S	S	*	.			trans	-63.8	99.4	-175	-50.1	0	0	0	0	108.5	G6 A90	G6-T8 PolarHBondContact O-N 3.19Å; G6-T8 VanDerWaalsContact O-N 3.09Å; T8-A90 WeakPolarHBondContact O-CB 3.44Å; T8-A90 PolarHBondContact O-N 3.16Å
9	R	70.3	Confident	68.6	Low	135 Å²	135	87.2 Å²	87.2	51%	0.509	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	123.7	169.8	-64.4	-173.8	176.9	-175.3	-1.7	107.8	G7 E87 R88	G7-R9 PolarHBondContact O-N 3.23Å; R9-E87 HydrophobicContact CB-CG 3.87Å; R9-E87 WeakPolarHBondContact CD-OE1 3.37Å; R9-E87 IonicContact CZ-OE1 3.7Å; R9-E87 IonicContact NE-OE1 3.85Å; R9-E87 IonicContact NH1-OE1 2.78Å; R9-E87 PolarHBondContact NH1-OE1 3.21Å; R9-R88 CarbonylContact C-O 3.55Å; R9-R88 WeakPolarHBondContact CA-O 3.46Å
10	S	79.5	Confident	68.6	Low	47 Å²	47	90.6 Å²	90.6	33%	0.329	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.3	139.5	178	-74.5	0	0	0	0	110.2	R88 A90	S10-R88 PolarHBondContact N-O 2.79Å; S10-R88 PolarHBondContact O-N 2.75Å; S10-A90 WeakPolarHBondContact OG-CB 3.34Å
11	L	83.5	Confident	68.3	Low	113 Å²	113	91.6 Å²	91.6	59%	0.592	56%	0.562	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.7	124.6	168.8	-63.7	176.8	0	0	0	108.6	V58 I85 V86 E87	L11-V58 HydrophobicContact CD2-CG2 4Å; L11-I85 HydrophobicContact CB-CG2 4.04Å; L11-I85 HydrophobicContact CD2-CG2 4.11Å; L11-I85 HydrophobicContact CG-CG2 4.45Å; L11-V86 CarbonylContact C-O 3.55Å; L11-V86 WeakPolarHBondContact CA-O 3.47Å; L11-E87 HydrophobicContact CD2-CB 3.88Å; L11-E87 HydrophobicContact CD2-CG 4.34Å
12	V	84.4	Confident	69.2	Low	47 Å²	47	85.8 Å²	85.8	29%	0.285	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.6	177.1	-178.9	0	0	0	0	108.5	L14 I85 V86 R88	V12-L14 HydrophobicContact CG1-CD2 3.87Å; V12-L14 HydrophobicContact CG1-CG 4.36Å; V12-I85 WeakPolarHBondContact O-CA 3.41Å; V12-V86 HydrophobicContact CB-CG2 3.95Å; V12-V86 PolarHBondContact N-O 2.95Å; V12-V86 PolarHBondContact O-N 3.35Å; V12-R88 HydrophobicContact CG2-CG 3.94Å
13	A	85.6	Confident	70.3	Confident	81 Å²	81	86.9 Å²	86.9	67%	0.669	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	119.1	172.5	0	0	0	0	0	109.4	I85	A13-I85 HydrophobicContact CB-CG1 4.46Å
14	L	85.2	Confident	71.1	Confident	19 Å²	19	86.9 Å²	86.9	10%	0.099	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.6	177.9	-58.8	173.6	0	0	0	108.6	V12 I16 H50 F51 E83 V84 V86	V12-L14 HydrophobicContact CG1-CD2 3.87Å; V12-L14 HydrophobicContact CG1-CG 4.36Å; L14-I16 HydrophobicContact CB-CG1 4.46Å; L14-H50 HydrophobicContact CD1-CB 4.27Å; L14-H50 HydrophobicContact CD2-CB 4.41Å; L14-F51 HydrophobicContact CD1-CD1 3.86Å; L14-F51 HydrophobicContact CD1-CD2 4.49Å; L14-F51 HydrophobicContact CD1-CE1 3.74Å; L14-F51 HydrophobicContact CD1-CE2 4.41Å; L14-F51 HydrophobicContact CD1-CG 4.25Å; L14-F51 HydrophobicContact CD1-CZ 4.04Å; L14-E83 CarbonylContact O-C 3.54Å; L14-E83 WeakPolarHBondContact O-CA 3.42Å; L14-V84 HydrophobicContact CB-CB 4.42Å; L14-V84 PolarHBondContact N-O 2.78Å; L14-V84 PolarHBondContact O-N 3.15Å; L14-V86 HydrophobicContact CD1-CG1 4.09Å; L14-V86 HydrophobicContact CD1-CG2 3.93Å; L14-V86 HydrophobicContact CG-CG2 4.35Å
15	K	86.1	Confident	72	Confident	115 Å²	115	82.8 Å²	82.8	50%	0.5	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	114.6	175.7	-171.2	176.6	-176.3	178.1	0	108.7	I81	K15-I81 HydrophobicContact CD-CG2 4.09Å; K15-I81 VanDerWaalsContact CE-CG2 3.46Å; K15-I81 HydrophobicContact CG-CG2 3.45Å; K15-I81 VanDerWaalsContact CG-CG2 3.45Å
16	I	83.6	Confident	73.5	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.005	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.2	-172	-55.9	173.9	0	0	0	109.1	L14 L18 F25 I46 H50 F51 I81 I82 V84	L14-I16 HydrophobicContact CB-CG1 4.46Å; I16-L18 HydrophobicContact CG2-CD2 4.41Å; I16-F25 HydrophobicContact CD1-CE2 3.94Å; I16-F25 HydrophobicContact CD1-CZ 4.34Å; I16-F25 HydrophobicContact CG2-CE2 4.32Å; I16-I46 HydrophobicContact CG2-CG2 3.33Å; I16-H50 HydrophobicContact CD1-CB 4.35Å; I16-F51 HydrophobicContact CD1-CD2 4.41Å; I16-F51 HydrophobicContact CD1-CE2 3.35Å; I16-F51 HydrophobicContact CD1-CZ 3.75Å; I16-I81 CarbonylContact O-C 3.44Å; I16-I81 WeakPolarHBondContact O-CA 3.42Å; I16-I82 HydrophobicContact CB-CD1 4.34Å; I16-I82 HydrophobicContact CB-CG1 3.78Å; I16-I82 HydrophobicContact CG2-CG1 4.45Å; I16-I82 PolarHBondContact N-O 3.35Å; I16-I82 PolarHBondContact O-N 2.71Å; I16-V84 HydrophobicContact CD1-CG2 4.29Å
17	D	82.5	Confident	75.1	Confident	65 Å²	65	76.9 Å²	76.9	35%	0.348	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	109.2	178.5	-165.8	-82.4	0	0	0	110.7	A19 K20 I81	D17-A19 WeakPolarHBondContact OD1-CB 3.45Å; D17-A19 PolarHBondContact OD1-N 3.44Å; D17-A19 VanDerWaalsContact OD1-N 3.13Å; D17-K20 PolarHBondContact OD1-N 2.84Å; D17-I81 HydrophobicContact CB-CG1 4.37Å; D17-I81 WeakPolarHBondContact OD2-CG1 3.34Å
18	L	76	Confident	76.7	Confident	36 Å²	36	75.1 Å²	75.1	19%	0.188	42%	0.423	C	S	.	.			trans	-89.2	-3.5	174.6	-56.8	170.8	0	0	0	112.6	I16 K20 F25 I46 I75 N78 G80 I82	I16-L18 HydrophobicContact CG2-CD2 4.41Å; L18-K20 PolarHBondContact O-N 2.94Å; L18-F25 HydrophobicContact CD2-CD2 4.21Å; L18-I46 HydrophobicContact CD2-CD1 4.41Å; L18-I75 HydrophobicContact CD1-CG2 4.21Å; L18-N78 WeakPolarHBondContact CD1-O 3.34Å; L18-G80 WeakPolarHBondContact CA-O 3.16Å; L18-G80 WeakPolarHBondContact CB-O 3.29Å; L18-G80 PolarHBondContact N-O 3.44Å; L18-I82 HydrophobicContact CD1-CD1 4.08Å; L18-I82 HydrophobicContact CD1-CG1 4.24Å; L18-I82 HydrophobicContact CD1-CG2 3.59Å; L18-I82 HydrophobicContact CG-CD1 4.46Å; L18-I82 HydrophobicContact CG-CG1 4.39Å; L18-I82 HydrophobicContact CG-CG2 4.37Å
19	A	70.5	Confident	77.9	Confident	67 Å²	67	71.8 Å²	71.8	55%	0.554	40%	0.4	S	S	*	.	S	Bend	trans	-71.8	-16.1	-178	0	0	0	0	0	112.6	D17 P21	D17-A19 WeakPolarHBondContact OD1-CB 3.45Å; D17-A19 PolarHBondContact OD1-N 3.44Å; D17-A19 VanDerWaalsContact OD1-N 3.13Å; A19-P21 WeakPolarHBondContact O-CD 3.29Å
20	K	67.7	Low	78.8	Confident	155 Å²	155	71.2 Å²	71.2	67%	0.674	40%	0.398	S	S	*	.	S	Bend	trans	-102.7	78.3	172.4	-61.7	178.6	-174.7	175.7	0	110.2	D17 L18 T22	D17-K20 PolarHBondContact OD1-N 2.84Å; L18-K20 PolarHBondContact O-N 2.94Å; K20-T22 PolarHBondContact O-N 3.31Å
21	P	62.4	Low	79.3	Confident	112 Å²	112	72.8 Å²	72.8	73%	0.727	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	27.7	-172.4	31.9	-39.3	0	0	0	114.7	A19 R23	A19-P21 WeakPolarHBondContact O-CD 3.29Å; P21-R23 PolarHBondContact O-N 3.25Å
22	T	62.1	Low	79.4	Confident	125 Å²	125	71 Å²	71	77%	0.767	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-18.5	-178.9	61.2	0	0	0	0	112.7	K20	K20-T22 PolarHBondContact O-N 3.31Å
23	R	67.2	Low	79.5	Confident	148 Å²	148	75.7 Å²	75.7	56%	0.558	41%	0.414	S	S	*	.	S	Bend	trans	-129.5	139.8	-178.1	-63.7	-177.6	-177.4	-161.1	0.9	110.9	P21 I46	P21-R23 PolarHBondContact O-N 3.25Å; R23-I46 HydrophobicContact CB-CG1 4.02Å
24	S	72.2	Confident	79.5	Confident	86 Å²	86	74.5 Å²	74.5	60%	0.601	41%	0.409	S	S	*	.			trans	-62.5	145.2	168.3	-61.3	0	0	0	0	109.6	G26 S45 I46	S24-G26 VanDerWaalsContact C-N 3.28Å; S24-G26 PolarHBondContact O-N 2.77Å; S24-S45 WeakPolarHBondContact O-CA 3.36Å; S24-S45 WeakPolarHBondContact O-CB 3.01Å; S24-I46 PolarHBondContact O-N 3.44Å
25	F	76	Confident	79.6	Confident	34 Å²	34	77.6 Å²	77.6	15%	0.149	42%	0.422	C	S	.	.			trans	-59.4	-44.1	173.3	-167.6	-114.3	0	0	0	110.3	I16 L18 L27 S45 I46 S47 F51 I75 I82	I16-F25 HydrophobicContact CD1-CE2 3.94Å; I16-F25 HydrophobicContact CD1-CZ 4.34Å; I16-F25 HydrophobicContact CG2-CE2 4.32Å; L18-F25 HydrophobicContact CD2-CD2 4.21Å; F25-L27 VanDerWaalsContact C-N 3.27Å; F25-L27 HydrophobicContact CD1-CB 3.42Å; F25-L27 VanDerWaalsContact CD1-CB 3.42Å; F25-L27 HydrophobicContact CD1-CD2 4.36Å; F25-L27 HydrophobicContact CD1-CG 4.49Å; F25-L27 HydrophobicContact CE1-CB 3.39Å; F25-L27 HydrophobicContact CE1-CD2 3.47Å; F25-L27 VanDerWaalsContact CE1-CD2 3.47Å; F25-L27 HydrophobicContact CE1-CG 4Å; F25-L27 HydrophobicContact CZ-CB 4.47Å; F25-L27 HydrophobicContact CZ-CD2 4.15Å; F25-L27 PolarHBondContact O-N 3.21Å; F25-S45 WeakPolarHBondContact O-CB 3.18Å; F25-S45 PolarHBondContact O-OG 2.8Å; F25-I46 HydrophobicContact CD2-CB 4.29Å; F25-I46 HydrophobicContact CD2-CG2 4.41Å; F25-S47 WeakPolarHBondContact CD1-OG 3.28Å; F25-S47 WeakPolarHBondContact CE1-OG 3.47Å; F25-S47 WeakPolarHBondContact O-CB 3.2Å; F25-S47 PolarHBondContact O-N 3.44Å; F25-S47 VanDerWaalsContact O-N 3.12Å; F25-S47 PolarHBondContact O-OG 3.28Å; F25-F51 HydrophobicContact CE1-CE2 4.5Å; F25-F51 HydrophobicContact CE2-CE2 4.11Å; F25-F51 AromaticContact CZ-CE2 3.6Å; F25-F51 HydrophobicContact CZ-CE2 3.6Å; F25-F51 HydrophobicContact CZ-CZ 4.03Å; F25-I75 HydrophobicContact CD1-CD1 4.27Å; F25-I75 HydrophobicContact CE1-CD1 3.68Å; F25-I75 HydrophobicContact CZ-CD1 4.15Å; F25-I82 HydrophobicContact CE2-CD1 4.41Å
26	G	80.5	Confident	79.8	Confident	24 Å²	24	72.1 Å²	72.1	25%	0.247	40%	0.398	C	S	.	.			trans	63	30	169.7	0	0	0	0	0	114	S24 M41 K42	S24-G26 VanDerWaalsContact C-N 3.28Å; S24-G26 PolarHBondContact O-N 2.77Å; G26-M41 CarbonylContact O-C 3.59Å; G26-M41 WeakPolarHBondContact O-CA 3.33Å; G26-K42 PolarHBondContact O-N 2.95Å
27	L	82.5	Confident	80.1	Confident	34 Å²	34	72.7 Å²	72.7	18%	0.178	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.7	177	-162.8	70.6	0	0	0	111	F25 I29 V38 S47 F51 I57	F25-L27 VanDerWaalsContact C-N 3.27Å; F25-L27 HydrophobicContact CD1-CB 3.42Å; F25-L27 VanDerWaalsContact CD1-CB 3.42Å; F25-L27 HydrophobicContact CD1-CD2 4.36Å; F25-L27 HydrophobicContact CD1-CG 4.49Å; F25-L27 HydrophobicContact CE1-CB 3.39Å; F25-L27 HydrophobicContact CE1-CD2 3.47Å; F25-L27 VanDerWaalsContact CE1-CD2 3.47Å; F25-L27 HydrophobicContact CE1-CG 4Å; F25-L27 HydrophobicContact CZ-CB 4.47Å; F25-L27 HydrophobicContact CZ-CD2 4.15Å; F25-L27 PolarHBondContact O-N 3.21Å; L27-I29 HydrophobicContact CD2-CG2 3.41Å; L27-I29 VanDerWaalsContact CD2-CG2 3.41Å; L27-I29 HydrophobicContact CG-CG2 3.75Å; L27-V38 HydrophobicContact CD1-CB 4.47Å; L27-V38 HydrophobicContact CD1-CG1 3.67Å; L27-V38 HydrophobicContact CD1-CG2 3.98Å; L27-V38 HydrophobicContact CD2-CG2 4.43Å; L27-S47 WeakPolarHBondContact CB-OG 3.48Å; L27-F51 HydrophobicContact CD1-CB 4.08Å; L27-F51 HydrophobicContact CD1-CD2 4.07Å; L27-F51 HydrophobicContact CD1-CG 3.98Å; L27-I57 HydrophobicContact CD2-CD1 3.96Å
28	G	87.9	Confident	80.4	Confident	20 Å²	20	69.6 Å²	69.6	21%	0.206	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	112.9	164.9	0	0	0	0	0	109.9	S39 S40	G28-S39 PolarHBondContact O-N 3.25Å; G28-S40 VanDerWaalsContact CA-O 3.27Å; G28-S40 WeakPolarHBondContact CA-O 3.42Å; G28-S40 PolarHBondContact N-O 2.83Å; G28-S40 PolarHBondContact O-N 3.32Å; G28-S40 VanDerWaalsContact O-N 3.16Å
29	I	89.2	Confident	81.1	Confident	43 Å²	43	69.8 Å²	69.8	22%	0.221	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	142.2	176	59.8	176.4	0	0	0	110.9	L27 V36 M37 I57 K68 C71	L27-I29 HydrophobicContact CD2-CG2 3.41Å; L27-I29 VanDerWaalsContact CD2-CG2 3.41Å; L27-I29 HydrophobicContact CG-CG2 3.75Å; I29-V36 HydrophobicContact CB-CG1 3.7Å; I29-V36 HydrophobicContact CD1-CG1 3.91Å; I29-V36 HydrophobicContact CG1-CG1 4.31Å; I29-V36 HydrophobicContact CG2-CG1 3.92Å; I29-M37 CarbonylContact C-O 3.57Å; I29-M37 WeakPolarHBondContact CA-O 3.4Å; I29-I57 HydrophobicContact CG2-CD1 4.05Å; I29-K68 HydrophobicContact CD1-CB 3.88Å; I29-K68 HydrophobicContact CG1-CB 4.24Å; I29-C71 HydrophobicContact CD1-CB 3.69Å
30	R	90.3	Very high	81.9	Confident	123 Å²	123	69.6 Å²	69.6	46%	0.464	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	154.6	171.5	71.1	179.5	177.8	-150.7	5.3	110.8	M37 S39	R30-M37 HydrophobicContact CG-CB 4.41Å; R30-M37 HydrophobicContact CG-CE 4.17Å; R30-M37 PolarHBondContact N-O 2.93Å; R30-M37 PolarHBondContact O-N 3.41Å; R30-S39 WeakPolarHBondContact CD-OG 3.44Å; R30-S39 PolarHBondContact NH1-OG 3.1Å; R30-S39 VanDerWaalsContact NH1-OG 3.14Å
31	M	89	Confident	82.9	Confident	81 Å²	81	65.2 Å²	65.2	40%	0.399	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	127.7	171.8	-72.2	-63.6	-57.2	0	0	108.9	V36 T66	M31-V36 HydrophobicContact SD-CG2 3.84Å; M31-T66 VanDerWaalsContact CE-O 3.28Å; M31-T66 WeakPolarHBondContact CE-O 3.31Å
32	H	87.4	Confident	84	Confident	74 Å²	74	66.1 Å²	66.1	34%	0.343	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	118.6	176.6	-171.2	-92.5	0	0	0	109.7	G34 K35 M37 F56	H32-G34 VanDerWaalsContact C-N 3.27Å; H32-G34 PolarHBondContact O-N 3.02Å; H32-K35 PolarHBondContact N-O 3.11Å; H32-K35 PolarHBondContact O-N 3.16Å; H32-M37 HydrophobicContact CB-CB 4.1Å; H32-M37 HydrophobicContact CB-CE 4.07Å; H32-M37 HydrophobicContact CB-SD 4.42Å; H32-F56 HydrophobicContact CB-CE1 4.34Å; H32-F56 AromaticContact ND1-CE1 3.96Å
33	N	85.9	Confident	84.8	Confident	147 Å²	147	64.9 Å²	64.9	79%	0.786	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	40.5	-177.6	-62.1	-22.7	0	0	0	114.2	K35	N33-K35 PolarHBondContact O-N 3.07Å
34	G	84.9	Confident	85.6	Confident	56 Å²	56	64.2 Å²	64.2	58%	0.577	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	0.8	-178.2	0	0	0	0	0	115.2	H32	H32-G34 VanDerWaalsContact C-N 3.27Å; H32-G34 PolarHBondContact O-N 3.02Å
35	K	86.9	Confident	86.1	Confident	83 Å²	83	60.4 Å²	60.4	36%	0.361	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	155	173.3	-62.7	-173.2	178.5	-171.8	0	110.7	H32 N33 F56 E87	H32-K35 PolarHBondContact N-O 3.11Å; H32-K35 PolarHBondContact O-N 3.16Å; N33-K35 PolarHBondContact O-N 3.07Å; K35-F56 HydrophobicContact CB-CD1 3.83Å; K35-F56 HydrophobicContact CB-CE1 4.47Å; K35-F56 HydrophobicContact CD-CD1 4.17Å; K35-F56 HydrophobicContact CD-CG 4.49Å; K35-E87 IonicContact NZ-OE1 3.16Å; K35-E87 PolarHBondContact NZ-OE1 3.04Å; K35-E87 VanDerWaalsContact NZ-OE1 3.16Å; K35-E87 IonicContact NZ-OE2 2.92Å; K35-E87 PolarHBondContact NZ-OE2 3.06Å
36	V	90.1	Very high	86.3	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	115.8	172.1	178.7	0	0	0	0	108.5	I29 M31 F56 I57 V65	I29-V36 HydrophobicContact CB-CG1 3.7Å; I29-V36 HydrophobicContact CD1-CG1 3.91Å; I29-V36 HydrophobicContact CG1-CG1 4.31Å; I29-V36 HydrophobicContact CG2-CG1 3.92Å; M31-V36 HydrophobicContact SD-CG2 3.84Å; V36-F56 CarbonylContact O-C 3.46Å; V36-F56 WeakPolarHBondContact O-CA 3.16Å; V36-I57 HydrophobicContact CB-CB 4.32Å; V36-I57 HydrophobicContact CG1-CB 4.42Å; V36-I57 HydrophobicContact CG1-CD1 4.06Å; V36-I57 PolarHBondContact O-N 2.75Å; V36-V65 HydrophobicContact CB-CG1 4.25Å; V36-V65 HydrophobicContact CG2-CG1 3.62Å
37	M	90.1	Very high	86.4	Confident	13 Å²	13	58.9 Å²	58.9	6%	0.064	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	140.6	178.6	-169.6	174.6	68.1	0	0	110.7	I29 R30 H32 S39 D55 F56	I29-M37 CarbonylContact C-O 3.57Å; I29-M37 WeakPolarHBondContact CA-O 3.4Å; R30-M37 HydrophobicContact CG-CB 4.41Å; R30-M37 HydrophobicContact CG-CE 4.17Å; R30-M37 PolarHBondContact N-O 2.93Å; R30-M37 PolarHBondContact O-N 3.41Å; H32-M37 HydrophobicContact CB-CB 4.1Å; H32-M37 HydrophobicContact CB-CE 4.07Å; H32-M37 HydrophobicContact CB-SD 4.42Å; M37-S39 PolarHBondContact O-N 2.85Å; M37-D55 CarbonylContact C-O 3.58Å; M37-D55 WeakPolarHBondContact CA-O 3.35Å; M37-F56 HydrophobicContact CB-CD1 3.79Å; M37-F56 HydrophobicContact CB-CE1 3.74Å; M37-F56 HydrophobicContact CG-CD1 3.97Å; M37-F56 HydrophobicContact CG-CE1 3.77Å; M37-F56 HydrophobicContact CG-CG 4.45Å; M37-F56 HydrophobicContact CG-CZ 4.06Å; M37-F56 HydrophobicContact SD-CD1 4.31Å; M37-F56 HydrophobicContact SD-CE1 3.52Å; M37-F56 VanDerWaalsContact SD-CE1 3.52Å; M37-F56 HydrophobicContact SD-CE2 4.05Å; M37-F56 HydrophobicContact SD-CZ 3.36Å; M37-F56 WeakPolarHBondContact SD-CZ 3.25Å
38	V	90	Very high	86.4	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	114.2	173.5	-178.6	0	0	0	0	109.1	L27 F51 G54 D55 I57	L27-V38 HydrophobicContact CD1-CB 4.47Å; L27-V38 HydrophobicContact CD1-CG1 3.67Å; L27-V38 HydrophobicContact CD1-CG2 3.98Å; L27-V38 HydrophobicContact CD2-CG2 4.43Å; V38-F51 HydrophobicContact CG2-CB 4.46Å; V38-F51 HydrophobicContact CG2-CD1 4.07Å; V38-G54 PolarHBondContact O-N 2.84Å; V38-D55 HydrophobicContact CG2-CB 4.16Å; V38-D55 PolarHBondContact N-O 2.84Å; V38-I57 HydrophobicContact CG2-CD1 4.4Å; V38-I57 HydrophobicContact CG2-CG1 4.49Å
39	S	89.6	Confident	86.1	Confident	40 Å²	40	65 Å²	65	28%	0.28	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-36.4	179.1	-166.1	0	0	0	0	112.5	G28 R30 M37	G28-S39 PolarHBondContact O-N 3.25Å; R30-S39 WeakPolarHBondContact CD-OG 3.44Å; R30-S39 PolarHBondContact NH1-OG 3.1Å; R30-S39 VanDerWaalsContact NH1-OG 3.14Å; M37-S39 PolarHBondContact O-N 2.85Å
40	S	88.8	Confident	85.8	Confident	64 Å²	64	65.8 Å²	65.8	45%	0.448	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	161.6	-176.5	56.9	0	0	0	0	109.9	G28	G28-S40 VanDerWaalsContact CA-O 3.27Å; G28-S40 WeakPolarHBondContact CA-O 3.42Å; G28-S40 PolarHBondContact N-O 2.83Å; G28-S40 PolarHBondContact O-N 3.32Å; G28-S40 VanDerWaalsContact O-N 3.16Å
41	M	88.2	Confident	85.6	Confident	63 Å²	63	60.1 Å²	60.1	31%	0.31	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	142.2	176.3	56.6	-160.9	-126	0	0	108.8	G26 S48 V53	G26-M41 CarbonylContact O-C 3.59Å; G26-M41 WeakPolarHBondContact O-CA 3.33Å; M41-S48 WeakPolarHBondContact CE-O 3.35Å; M41-S48 WeakPolarHBondContact CE-OG 3.27Å; M41-V53 HydrophobicContact CG-CG2 4.38Å; M41-V53 HydrophobicContact SD-CG2 4.26Å
42	K	84.8	Confident	85.4	Confident	131 Å²	131	62.4 Å²	62.4	57%	0.57	34%	0.342	S	S	*	.			trans	-81.7	133.8	180	-169.9	174.2	-179.5	168.7	0	108.8	G26 S45	G26-K42 PolarHBondContact O-N 2.95Å; K42-S45 WeakPolarHBondContact O-CB 3.44Å; K42-S45 PolarHBondContact O-N 2.86Å; K42-S45 PolarHBondContact O-OG 3.25Å
43	P	80.2	Confident	85.5	Confident	99 Å²	99	63.2 Å²	63.2	64%	0.643	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	145.9	171.2	25.2	-33.8	0	0	0	110	S45	P43-S45 PolarHBondContact O-N 2.71Å
44	N	82.1	Confident	85.5	Confident	134 Å²	134	57.8 Å²	57.8	72%	0.717	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	17.4	-174.8	-59.1	-35.7	0	0	0	115.7
45	S	82.8	Confident	85.7	Confident	6 Å²	6	55.4 Å²	55.4	4%	0.042	31%	0.305	C	S	.	.	S	Bend	trans	-97.6	160	175.5	92.9	0	0	0	0	111.7	S24 F25 K42 P43 S47 S48	S24-S45 WeakPolarHBondContact O-CA 3.36Å; S24-S45 WeakPolarHBondContact O-CB 3.01Å; F25-S45 WeakPolarHBondContact O-CB 3.18Å; F25-S45 PolarHBondContact O-OG 2.8Å; K42-S45 WeakPolarHBondContact O-CB 3.44Å; K42-S45 PolarHBondContact O-N 2.86Å; K42-S45 PolarHBondContact O-OG 3.25Å; P43-S45 PolarHBondContact O-N 2.71Å; S45-S47 PolarHBondContact O-N 2.79Å; S45-S47 PolarHBondContact OG-N 2.97Å; S45-S48 WeakPolarHBondContact O-CB 3.4Å; S45-S48 PolarHBondContact O-N 2.87Å; S45-S48 VanDerWaalsContact O-N 3.11Å; S45-S48 PolarHBondContact OG-N 3.2Å
46	I	81.7	Confident	85.8	Confident	25 Å²	25	53 Å²	53	13%	0.128	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-37.1	176	-61.4	170.8	0	0	0	110.2	I16 L18 R23 S24 F25 S48 D49 H50	I16-I46 HydrophobicContact CG2-CG2 3.33Å; L18-I46 HydrophobicContact CD2-CD1 4.41Å; R23-I46 HydrophobicContact CB-CG1 4.02Å; S24-I46 PolarHBondContact O-N 3.44Å; F25-I46 HydrophobicContact CD2-CB 4.29Å; F25-I46 HydrophobicContact CD2-CG2 4.41Å; I46-S48 PolarHBondContact O-N 3.46Å; I46-D49 PolarHBondContact O-N 3.32Å; I46-H50 PolarHBondContact O-CD2 2.87Å
47	S	82.8	Confident	85.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-67	-24.5	179.7	-61.1	0	0	0	0	114.8	F25 L27 S45 D49 F51	F25-S47 WeakPolarHBondContact CD1-OG 3.28Å; F25-S47 WeakPolarHBondContact CE1-OG 3.47Å; F25-S47 WeakPolarHBondContact O-CB 3.2Å; F25-S47 PolarHBondContact O-N 3.44Å; F25-S47 VanDerWaalsContact O-N 3.12Å; F25-S47 PolarHBondContact O-OG 3.28Å; L27-S47 WeakPolarHBondContact CB-OG 3.48Å; S45-S47 PolarHBondContact O-N 2.79Å; S45-S47 PolarHBondContact OG-N 2.97Å; S47-D49 PolarHBondContact O-N 2.78Å; S47-F51 WeakPolarHBondContact O-CB 3.44Å; S47-F51 PolarHBondContact O-N 3.43Å
48	S	82.2	Confident	85.7	Confident	47 Å²	47	55.1 Å²	55.1	33%	0.329	31%	0.307	S	S	.	.	H	α-helix	trans	-68.4	-21.9	177.9	-173.5	0	0	0	0	113.1	M41 S45 I46	M41-S48 WeakPolarHBondContact CE-O 3.35Å; M41-S48 WeakPolarHBondContact CE-OG 3.27Å; S45-S48 WeakPolarHBondContact O-CB 3.4Å; S45-S48 PolarHBondContact O-N 2.87Å; S45-S48 VanDerWaalsContact O-N 3.11Å; S45-S48 PolarHBondContact OG-N 3.2Å; I46-S48 PolarHBondContact O-N 3.46Å
49	D	81.1	Confident	85.7	Confident	135 Å²	135	56.5 Å²	56.5	72%	0.722	32%	0.316	S	S	*	.	H	α-helix	trans	-87.9	-39.5	-178.9	-160.2	-102.6	0	0	0	111.4	I46 S47	I46-D49 PolarHBondContact O-N 3.32Å; S47-D49 PolarHBondContact O-N 2.78Å
50	H	83.3	Confident	85.7	Confident	61 Å²	61	54.7 Å²	54.7	28%	0.282	30%	0.303	S	S	.	.	H	α-helix	trans	-100.8	-35.7	-171.8	-61.9	-70	0	0	0	115	L14 I16 I46	L14-H50 HydrophobicContact CD1-CB 4.27Å; L14-H50 HydrophobicContact CD2-CB 4.41Å; I16-H50 HydrophobicContact CD1-CB 4.35Å; I46-H50 PolarHBondContact O-CD2 2.87Å
51	F	85.7	Confident	85.6	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.018	29%	0.291	C	S	.	.			trans	-101.6	155.7	-175.6	-63.5	-93	0	0	0	111.3	L14 I16 F25 L27 V38 S47 I57 V84 V86	L14-F51 HydrophobicContact CD1-CD1 3.86Å; L14-F51 HydrophobicContact CD1-CD2 4.49Å; L14-F51 HydrophobicContact CD1-CE1 3.74Å; L14-F51 HydrophobicContact CD1-CE2 4.41Å; L14-F51 HydrophobicContact CD1-CG 4.25Å; L14-F51 HydrophobicContact CD1-CZ 4.04Å; I16-F51 HydrophobicContact CD1-CD2 4.41Å; I16-F51 HydrophobicContact CD1-CE2 3.35Å; I16-F51 HydrophobicContact CD1-CZ 3.75Å; F25-F51 HydrophobicContact CE1-CE2 4.5Å; F25-F51 HydrophobicContact CE2-CE2 4.11Å; F25-F51 AromaticContact CZ-CE2 3.6Å; F25-F51 HydrophobicContact CZ-CE2 3.6Å; F25-F51 HydrophobicContact CZ-CZ 4.03Å; L27-F51 HydrophobicContact CD1-CB 4.08Å; L27-F51 HydrophobicContact CD1-CD2 4.07Å; L27-F51 HydrophobicContact CD1-CG 3.98Å; V38-F51 HydrophobicContact CG2-CB 4.46Å; V38-F51 HydrophobicContact CG2-CD1 4.07Å; S47-F51 WeakPolarHBondContact O-CB 3.44Å; S47-F51 PolarHBondContact O-N 3.43Å; F51-I57 HydrophobicContact CE1-CD1 4.36Å; F51-I57 HydrophobicContact CE1-CG1 4.3Å; F51-V84 HydrophobicContact CE1-CG1 3.92Å; F51-V84 HydrophobicContact CZ-CB 4.22Å; F51-V84 HydrophobicContact CZ-CG1 3.94Å; F51-V84 HydrophobicContact CZ-CG2 4.3Å; F51-V86 HydrophobicContact CD1-CG1 3.96Å; F51-V86 HydrophobicContact CE1-CG1 3.64Å
52	K	85.7	Confident	85.5	Confident	128 Å²	128	58.2 Å²	58.2	56%	0.557	31%	0.311	S	S	*	.			trans	-119	152.7	164.6	-59.3	179.9	-168.6	178.5	0	110.2	G54 D55	K52-G54 PolarHBondContact O-N 2.77Å; K52-D55 PolarHBondContact N-OD2 3.41Å; K52-D55 WeakPolarHBondContact O-CB 3.41Å; K52-D55 PolarHBondContact O-N 3.23Å; K52-D55 VanDerWaalsContact O-N 3.15Å
53	V	87.8	Confident	85.7	Confident	91 Å²	91	57.1 Å²	57.1	55%	0.552	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	129.3	171.8	180	0	0	0	0	108.7	M41	M41-V53 HydrophobicContact CG-CG2 4.38Å; M41-V53 HydrophobicContact SD-CG2 4.26Å
54	G	87.1	Confident	86.1	Confident	33 Å²	33	55.9 Å²	55.9	34%	0.34	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.3	-9	-175.1	0	0	0	0	0	115.3	V38 K52	V38-G54 PolarHBondContact O-N 2.84Å; K52-G54 PolarHBondContact O-N 2.77Å
55	D	88.3	Confident	86.4	Confident	7 Å²	7	50 Å²	50	4%	0.037	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-66.5	139.7	174.1	-72.3	-19.6	0	0	0	111.2	M37 V38 K52 V86 R88	M37-D55 CarbonylContact C-O 3.58Å; M37-D55 WeakPolarHBondContact CA-O 3.35Å; V38-D55 HydrophobicContact CG2-CB 4.16Å; V38-D55 PolarHBondContact N-O 2.84Å; K52-D55 PolarHBondContact N-OD2 3.41Å; K52-D55 WeakPolarHBondContact O-CB 3.41Å; K52-D55 PolarHBondContact O-N 3.23Å; K52-D55 VanDerWaalsContact O-N 3.15Å; D55-V86 HydrophobicContact CB-CB 4.32Å; D55-R88 WeakPolarHBondContact OD1-CB 3.47Å; D55-R88 IonicContact OD1-CZ 3.5Å; D55-R88 VanDerWaalsContact OD1-CZ 3.31Å; D55-R88 IonicContact OD1-NE 3.92Å; D55-R88 PolarHBondContact OD1-NE 3.04Å; D55-R88 IonicContact OD1-NH2 2.79Å; D55-R88 PolarHBondContact OD1-NH2 3.4Å; D55-R88 IonicContact OD2-CZ 3.31Å; D55-R88 IonicContact OD2-NE 3.04Å; D55-R88 IonicContact OD2-NH2 2.75Å; D55-R88 PolarHBondContact OD2-NH2 2.86Å
56	F	89.3	Confident	86.6	Confident	32 Å²	32	53.8 Å²	53.8	14%	0.14	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	118.4	174.8	-67.3	-85.2	0	0	0	110.9	H32 K35 V36 M37 V58 V86 E87	H32-F56 HydrophobicContact CB-CE1 4.34Å; H32-F56 AromaticContact ND1-CE1 3.96Å; K35-F56 HydrophobicContact CB-CD1 3.83Å; K35-F56 HydrophobicContact CB-CE1 4.47Å; K35-F56 HydrophobicContact CD-CD1 4.17Å; K35-F56 HydrophobicContact CD-CG 4.49Å; V36-F56 CarbonylContact O-C 3.46Å; V36-F56 WeakPolarHBondContact O-CA 3.16Å; M37-F56 HydrophobicContact CB-CD1 3.79Å; M37-F56 HydrophobicContact CB-CE1 3.74Å; M37-F56 HydrophobicContact CG-CD1 3.97Å; M37-F56 HydrophobicContact CG-CE1 3.77Å; M37-F56 HydrophobicContact CG-CG 4.45Å; M37-F56 HydrophobicContact CG-CZ 4.06Å; M37-F56 HydrophobicContact SD-CD1 4.31Å; M37-F56 HydrophobicContact SD-CE1 3.52Å; M37-F56 VanDerWaalsContact SD-CE1 3.52Å; M37-F56 HydrophobicContact SD-CE2 4.05Å; M37-F56 HydrophobicContact SD-CZ 3.36Å; M37-F56 WeakPolarHBondContact SD-CZ 3.25Å; F56-V58 PolarHBondContact O-N 2.81Å; F56-V86 CarbonylContact O-C 3.52Å; F56-V86 WeakPolarHBondContact O-CA 3.43Å; F56-E87 HydrophobicContact CB-CB 4.21Å; F56-E87 PolarHBondContact N-O 3.49Å; F56-E87 VanDerWaalsContact N-O 3.1Å; F56-E87 PolarHBondContact O-N 3.13Å
57	I	89.4	Confident	86.9	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	122.4	176.2	-57.5	170.1	0	0	0	108.8	L27 I29 V36 V38 F51 I60 V65 V84 V86	L27-I57 HydrophobicContact CD2-CD1 3.96Å; I29-I57 HydrophobicContact CG2-CD1 4.05Å; V36-I57 HydrophobicContact CB-CB 4.32Å; V36-I57 HydrophobicContact CG1-CB 4.42Å; V36-I57 HydrophobicContact CG1-CD1 4.06Å; V36-I57 PolarHBondContact O-N 2.75Å; V38-I57 HydrophobicContact CG2-CD1 4.4Å; V38-I57 HydrophobicContact CG2-CG1 4.49Å; F51-I57 HydrophobicContact CE1-CD1 4.36Å; F51-I57 HydrophobicContact CE1-CG1 4.3Å; I57-I60 HydrophobicContact CG2-CD1 4.16Å; I57-I60 HydrophobicContact CG2-CG1 3.97Å; I57-V65 HydrophobicContact CG2-CB 4.32Å; I57-V65 HydrophobicContact CG2-CG2 4.1Å; I57-V84 HydrophobicContact CG2-CG1 3.92Å; I57-V86 HydrophobicContact CG1-CG1 4.07Å
58	V	89.1	Confident	87.1	Confident	53 Å²	53	61.2 Å²	61.2	32%	0.321	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-53.8	-179.5	-169.7	0	0	0	0	110	L11 F56 V65 I85 E87	L11-V58 HydrophobicContact CD2-CG2 4Å; F56-V58 PolarHBondContact O-N 2.81Å; V58-V65 PolarHBondContact O-N 2.78Å; V58-I85 PolarHBondContact N-O 2.87Å; V58-E87 HydrophobicContact CG2-CB 3.88Å
59	T	89.9	Confident	87.4	Confident	29 Å²	29	62.9 Å²	62.9	18%	0.178	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	152.7	-178.8	68.9	0	0	0	0	111.9	Q63 I85	T59-Q63 CarbonylContact C-O 3.47Å; T59-Q63 WeakPolarHBondContact CA-O 3.44Å; T59-Q63 VanDerWaalsContact CB-O 3.31Å; T59-Q63 WeakPolarHBondContact CB-O 3.36Å; T59-I85 PolarHBondContact N-O 2.78Å; T59-I85 PolarHBondContact O-N 3.3Å; T59-I85 WeakPolarHBondContact OG1-CB 3.44Å; T59-I85 WeakPolarHBondContact OG1-CD1 3.45Å
60	I	89.3	Confident	87.7	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	126.1	173.5	-63.4	171.4	0	0	0	107.6	I57 K62 Q63 V65 C71 L74 I75 E83 V84	I57-I60 HydrophobicContact CG2-CD1 4.16Å; I57-I60 HydrophobicContact CG2-CG1 3.97Å; I60-K62 PolarHBondContact O-N 3.08Å; I60-Q63 PolarHBondContact N-O 3.24Å; I60-Q63 WeakPolarHBondContact O-CA 3.36Å; I60-Q63 VanDerWaalsContact O-CB 3.25Å; I60-Q63 WeakPolarHBondContact O-CB 3.09Å; I60-Q63 PolarHBondContact O-N 3.16Å; I60-V65 HydrophobicContact CB-CG2 4.07Å; I60-V65 HydrophobicContact CD1-CG2 3.64Å; I60-V65 HydrophobicContact CG1-CG2 3.62Å; I60-C71 HydrophobicContact CD1-CB 4.47Å; I60-C71 WeakPolarHBondContact CD1-SG 3.22Å; I60-L74 HydrophobicContact CB-CB 4.36Å; I60-L74 HydrophobicContact CB-CD1 4.17Å; I60-L74 HydrophobicContact CG2-CB 4.1Å; I60-I75 HydrophobicContact CD1-CD1 4.34Å; I60-I75 HydrophobicContact CD1-CG1 4.16Å; I60-E83 CarbonylContact C-O 3.56Å; I60-E83 WeakPolarHBondContact CA-O 3.39Å; I60-V84 HydrophobicContact CG1-CB 4.46Å; I60-V84 HydrophobicContact CG1-CG1 3.94Å; I60-V84 HydrophobicContact CG1-CG2 4.09Å; I60-V84 HydrophobicContact CG2-CG2 4.3Å
61	N	87.6	Confident	87.9	Confident	38 Å²	38	55.9 Å²	55.9	20%	0.203	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	44.6	-175.7	-76.5	-27.1	0	0	0	112.6	Q63 N78 I82 E83	N61-Q63 PolarHBondContact O-N 2.76Å; N61-Q63 VanDerWaalsContact O-N 3.1Å; N61-N78 PolarHBondContact ND2-ND2 2.86Å; N61-I82 WeakPolarHBondContact OD1-CA 3.44Å; N61-E83 PolarHBondContact N-O 3.14Å; N61-E83 PolarHBondContact OD1-N 2.8Å
62	K	84.5	Confident	87.9	Confident	164 Å²	164	64.4 Å²	64.4	71%	0.713	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	10	-176.5	-51.8	168.9	-178.2	173.4	0	114.1	I60	I60-K62 PolarHBondContact O-N 3.08Å
63	Q	89.4	Confident	88	Confident	108 Å²	108	62.5 Å²	62.5	51%	0.505	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	130.5	173.7	-63.1	-66.6	-56.8	0	0	110.6	T59 I60 N61 L74	T59-Q63 CarbonylContact C-O 3.47Å; T59-Q63 WeakPolarHBondContact CA-O 3.44Å; T59-Q63 VanDerWaalsContact CB-O 3.31Å; T59-Q63 WeakPolarHBondContact CB-O 3.36Å; I60-Q63 PolarHBondContact N-O 3.24Å; I60-Q63 WeakPolarHBondContact O-CA 3.36Å; I60-Q63 VanDerWaalsContact O-CB 3.25Å; I60-Q63 WeakPolarHBondContact O-CB 3.09Å; I60-Q63 PolarHBondContact O-N 3.16Å; N61-Q63 PolarHBondContact O-N 2.76Å; N61-Q63 VanDerWaalsContact O-N 3.1Å; Q63-L74 HydrophobicContact CB-CD1 3.92Å; Q63-L74 HydrophobicContact CB-CD2 3.81Å; Q63-L74 HydrophobicContact CG-CD2 3.92Å
64	P	88.5	Confident	88	Confident	73 Å²	73	59.5 Å²	59.5	47%	0.474	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	135.5	178.8	28.6	-33.6	0	0	0	111.4
65	V	88.3	Confident	87.8	Confident	10 Å²	10	59.3 Å²	59.3	6%	0.061	30%	0.301	C	S	.	.			trans	-102.3	103.3	179.7	-175.5	0	0	0	0	109.7	V36 I57 V58 I60 C71 L74	V36-V65 HydrophobicContact CB-CG1 4.25Å; V36-V65 HydrophobicContact CG2-CG1 3.62Å; I57-V65 HydrophobicContact CG2-CB 4.32Å; I57-V65 HydrophobicContact CG2-CG2 4.1Å; V58-V65 PolarHBondContact O-N 2.78Å; I60-V65 HydrophobicContact CB-CG2 4.07Å; I60-V65 HydrophobicContact CD1-CG2 3.64Å; I60-V65 HydrophobicContact CG1-CG2 3.62Å; V65-C71 HydrophobicContact CG1-CB 3.49Å; V65-C71 VanDerWaalsContact CG1-CB 3.49Å; V65-L74 HydrophobicContact CG2-CD1 3.9Å
66	T	86.7	Confident	87.5	Confident	85 Å²	85	63.5 Å²	63.5	52%	0.521	33%	0.327	S	S	.	.			trans	-94.1	-28.5	179.2	54.5	0	0	0	0	113.2	M31	M31-T66 VanDerWaalsContact CE-O 3.28Å; M31-T66 WeakPolarHBondContact CE-O 3.31Å
67	T	88.9	Confident	87.3	Confident	55 Å²	55	66.5 Å²	66.5	34%	0.337	35%	0.352	S	S	.	.	S	Bend	trans	-136.6	157	-176.4	67.2	0	0	0	0	111.8	V69 V70 C71	T67-V69 PolarHBondContact O-N 2.92Å; T67-V70 PolarHBondContact O-N 3.34Å; T67-V70 VanDerWaalsContact OG1-CG2 3.29Å; T67-V70 WeakPolarHBondContact OG1-CG2 3.43Å; T67-V70 PolarHBondContact OG1-N 3.11Å; T67-C71 PolarHBondContact O-N 2.95Å
68	K	87.2	Confident	86.8	Confident	126 Å²	126	68.9 Å²	68.9	55%	0.548	37%	0.365	S	S	.	.	H	α-helix	trans	-54.6	-32.6	172.3	65.9	-179	179.5	-176.9	0	113.1	I29 R72	I29-K68 HydrophobicContact CD1-CB 3.88Å; I29-K68 HydrophobicContact CG1-CB 4.24Å; K68-R72 WeakPolarHBondContact O-CB 3.18Å; K68-R72 PolarHBondContact O-N 2.86Å; K68-R72 VanDerWaalsContact O-N 3.07Å
69	V	87.8	Confident	85.9	Confident	82 Å²	82	78 Å²	78	50%	0.497	39%	0.394	S	S	.	.	H	α-helix	trans	-71.9	-46.1	-179.5	-176	0	0	0	0	110.3	T67 C71 R72 N73	T67-V69 PolarHBondContact O-N 2.92Å; V69-C71 VanDerWaalsContact C-N 3.32Å; V69-C71 PolarHBondContact O-N 3.16Å; V69-R72 PolarHBondContact O-N 2.72Å; V69-N73 WeakPolarHBondContact O-CB 3.36Å; V69-N73 VanDerWaalsContact O-CG 3.25Å; V69-N73 PolarHBondContact O-N 2.97Å; V69-N73 PolarHBondContact O-OD1 3.44Å
70	V	88.7	Confident	85.5	Confident	49 Å²	49	77.5 Å²	77.5	30%	0.297	39%	0.394	S	S	.	.	H	α-helix	trans	-60.3	-44.3	175.7	172.3	0	0	0	0	110.6	T67 R72 N73 L74	T67-V70 PolarHBondContact O-N 3.34Å; T67-V70 VanDerWaalsContact OG1-CG2 3.29Å; T67-V70 WeakPolarHBondContact OG1-CG2 3.43Å; T67-V70 PolarHBondContact OG1-N 3.11Å; V70-R72 PolarHBondContact O-N 3.28Å; V70-N73 PolarHBondContact O-N 3.12Å; V70-L74 HydrophobicContact CG1-CD1 3.68Å; V70-L74 HydrophobicContact CG1-CG 4.23Å; V70-L74 WeakPolarHBondContact O-CB 3.41Å; V70-L74 VanDerWaalsContact O-CG 3.29Å; V70-L74 WeakPolarHBondContact O-CG 3.11Å; V70-L74 PolarHBondContact O-N 3.1Å
71	C	86.4	Confident	85.3	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-55.2	-51.4	175.5	-169.3	0	0	0	0	111.7	I29 I60 V65 T67 V69 N73 L74 I75	I29-C71 HydrophobicContact CD1-CB 3.69Å; I60-C71 HydrophobicContact CD1-CB 4.47Å; I60-C71 WeakPolarHBondContact CD1-SG 3.22Å; V65-C71 HydrophobicContact CG1-CB 3.49Å; V65-C71 VanDerWaalsContact CG1-CB 3.49Å; T67-C71 PolarHBondContact O-N 2.95Å; V69-C71 VanDerWaalsContact C-N 3.32Å; V69-C71 PolarHBondContact O-N 3.16Å; C71-N73 VanDerWaalsContact C-N 3.34Å; C71-N73 PolarHBondContact O-N 3.26Å; C71-L74 PolarHBondContact O-N 3.37Å; C71-I75 WeakPolarHBondContact O-CG1 3.19Å; C71-I75 PolarHBondContact O-N 3.24Å
72	R	85.7	Confident	85.2	Confident	183 Å²	183	79.6 Å²	79.6	69%	0.691	40%	0.404	S	S	*	.	H	α-helix	trans	-60.5	-44.3	179	-173.7	-178.2	-176	125.5	-0.6	111.5	K68 V69 V70 I75 T76	K68-R72 WeakPolarHBondContact O-CB 3.18Å; K68-R72 PolarHBondContact O-N 2.86Å; K68-R72 VanDerWaalsContact O-N 3.07Å; V69-R72 PolarHBondContact O-N 2.72Å; V70-R72 PolarHBondContact O-N 3.28Å; R72-I75 PolarHBondContact O-N 3.33Å; R72-T76 WeakPolarHBondContact O-CB 3.45Å; R72-T76 PolarHBondContact O-N 2.84Å; R72-T76 PolarHBondContact O-OG1 2.75Å
73	N	88.3	Confident	85.4	Confident	88 Å²	88	76.2 Å²	76.2	47%	0.471	39%	0.391	S	S	.	.	H	α-helix	trans	-64.2	-44.3	179	-70.8	-6	0	0	0	110.9	V69 V70 C71 I75 T76 S77	V69-N73 WeakPolarHBondContact O-CB 3.36Å; V69-N73 VanDerWaalsContact O-CG 3.25Å; V69-N73 PolarHBondContact O-N 2.97Å; V69-N73 PolarHBondContact O-OD1 3.44Å; V70-N73 PolarHBondContact O-N 3.12Å; C71-N73 VanDerWaalsContact C-N 3.34Å; C71-N73 PolarHBondContact O-N 3.26Å; N73-I75 PolarHBondContact O-N 2.76Å; N73-T76 PolarHBondContact O-N 2.9Å; N73-S77 WeakPolarHBondContact O-CB 3.2Å; N73-S77 PolarHBondContact O-N 2.79Å; N73-S77 PolarHBondContact O-OG 2.88Å
74	L	86.8	Confident	85.3	Confident	29 Å²	29	71.1 Å²	71.1	15%	0.152	37%	0.367	C	S	.	.	H	α-helix	trans	-61.9	-41.3	178.2	-72.6	167.1	0	0	0	112.4	I60 Q63 V65 V70 C71 N78	I60-L74 HydrophobicContact CB-CB 4.36Å; I60-L74 HydrophobicContact CB-CD1 4.17Å; I60-L74 HydrophobicContact CG2-CB 4.1Å; Q63-L74 HydrophobicContact CB-CD1 3.92Å; Q63-L74 HydrophobicContact CB-CD2 3.81Å; Q63-L74 HydrophobicContact CG-CD2 3.92Å; V65-L74 HydrophobicContact CG2-CD1 3.9Å; V70-L74 HydrophobicContact CG1-CD1 3.68Å; V70-L74 HydrophobicContact CG1-CG 4.23Å; V70-L74 WeakPolarHBondContact O-CB 3.41Å; V70-L74 VanDerWaalsContact O-CG 3.29Å; V70-L74 WeakPolarHBondContact O-CG 3.11Å; V70-L74 PolarHBondContact O-N 3.1Å; C71-L74 PolarHBondContact O-N 3.37Å; L74-N78 WeakPolarHBondContact O-CB 3.34Å; L74-N78 PolarHBondContact O-N 3.39Å; L74-N78 PolarHBondContact O-ND2 3.24Å
75	I	83.1	Confident	85.3	Confident	29 Å²	29	70.3 Å²	70.3	15%	0.149	36%	0.358	C	S	.	.	H	α-helix	trans	-68.1	-40	176.6	-63.4	162.7	0	0	0	110.8	L18 F25 I60 C71 R72 N73 I82	L18-I75 HydrophobicContact CD1-CG2 4.21Å; F25-I75 HydrophobicContact CD1-CD1 4.27Å; F25-I75 HydrophobicContact CE1-CD1 3.68Å; F25-I75 HydrophobicContact CZ-CD1 4.15Å; I60-I75 HydrophobicContact CD1-CD1 4.34Å; I60-I75 HydrophobicContact CD1-CG1 4.16Å; C71-I75 WeakPolarHBondContact O-CG1 3.19Å; C71-I75 PolarHBondContact O-N 3.24Å; R72-I75 PolarHBondContact O-N 3.33Å; N73-I75 PolarHBondContact O-N 2.76Å; I75-I82 HydrophobicContact CG1-CD1 4.29Å
76	T	82.7	Confident	85.4	Confident	95 Å²	95	69.8 Å²	69.8	58%	0.583	36%	0.355	S	S	*	.	H	α-helix	trans	-75.4	-35.8	-177.2	-50.9	0	0	0	0	112.5	R72 N73	R72-T76 WeakPolarHBondContact O-CB 3.45Å; R72-T76 PolarHBondContact O-N 2.84Å; R72-T76 PolarHBondContact O-OG1 2.75Å; N73-T76 PolarHBondContact O-N 2.9Å
77	S	84.8	Confident	85.4	Confident	95 Å²	95	67.1 Å²	67.1	66%	0.664	34%	0.337	S	S	*	.	H	α-helix	trans	-72.5	-30.8	-179.9	-65.9	0	0	0	0	112.4	N73	N73-S77 WeakPolarHBondContact O-CB 3.2Å; N73-S77 PolarHBondContact O-N 2.79Å; N73-S77 PolarHBondContact O-OG 2.88Å
78	N	78.7	Confident	85.1	Confident	54 Å²	54	67 Å²	67	29%	0.289	33%	0.33	S	S	.	.			trans	-91.8	107.3	-179.5	-67.8	-51.5	0	0	0	110.4	L18 N61 L74 I82	L18-N78 WeakPolarHBondContact CD1-O 3.34Å; N61-N78 PolarHBondContact ND2-ND2 2.86Å; L74-N78 WeakPolarHBondContact O-CB 3.34Å; L74-N78 PolarHBondContact O-N 3.39Å; L74-N78 PolarHBondContact O-ND2 3.24Å; N78-I82 HydrophobicContact CB-CG2 3.72Å
79	R	70	Confident	84.3	Confident	245 Å²	245	68.3 Å²	68.3	93%	0.925	34%	0.338	S	S	*	.			trans	-97.2	92.8	173.8	-64.6	-175.4	-177.4	172	0.5	109.4
80	G	82	Confident	83.1	Confident	17 Å²	17	66.4 Å²	66.4	18%	0.175	33%	0.331	C	S	.	.	S	Bend	trans	154	-142.3	-179.8	0	0	0	0	0	112	L18	L18-G80 WeakPolarHBondContact CA-O 3.16Å; L18-G80 WeakPolarHBondContact CB-O 3.29Å; L18-G80 PolarHBondContact N-O 3.44Å
81	I	84.3	Confident	81.5	Confident	84 Å²	84	70.5 Å²	70.5	43%	0.431	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	127.9	176.6	-61.2	166.2	0	0	0	109.2	K15 I16 D17	K15-I81 HydrophobicContact CD-CG2 4.09Å; K15-I81 VanDerWaalsContact CE-CG2 3.46Å; K15-I81 HydrophobicContact CG-CG2 3.45Å; K15-I81 VanDerWaalsContact CG-CG2 3.45Å; I16-I81 CarbonylContact O-C 3.44Å; I16-I81 WeakPolarHBondContact O-CA 3.42Å; D17-I81 HydrophobicContact CB-CG1 4.37Å; D17-I81 WeakPolarHBondContact OD2-CG1 3.34Å
82	I	86.1	Confident	79.7	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	139.2	171.3	66	167.8	0	0	0	110.5	I16 L18 F25 N61 I75 N78 V84	I16-I82 HydrophobicContact CB-CD1 4.34Å; I16-I82 HydrophobicContact CB-CG1 3.78Å; I16-I82 HydrophobicContact CG2-CG1 4.45Å; I16-I82 PolarHBondContact N-O 3.35Å; I16-I82 PolarHBondContact O-N 2.71Å; L18-I82 HydrophobicContact CD1-CD1 4.08Å; L18-I82 HydrophobicContact CD1-CG1 4.24Å; L18-I82 HydrophobicContact CD1-CG2 3.59Å; L18-I82 HydrophobicContact CG-CD1 4.46Å; L18-I82 HydrophobicContact CG-CG1 4.39Å; L18-I82 HydrophobicContact CG-CG2 4.37Å; F25-I82 HydrophobicContact CE2-CD1 4.41Å; N61-I82 WeakPolarHBondContact OD1-CA 3.44Å; I75-I82 HydrophobicContact CG1-CD1 4.29Å; N78-I82 HydrophobicContact CB-CG2 3.72Å; I82-V84 HydrophobicContact CD1-CG2 3.81Å; I82-V84 HydrophobicContact CG1-CG2 4.14Å
83	E	88.3	Confident	77.9	Confident	93 Å²	93	75.2 Å²	75.2	44%	0.435	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	112.9	173.9	-62.8	-176.3	100.4	0	0	109.2	L14 I60 N61	L14-E83 CarbonylContact O-C 3.54Å; L14-E83 WeakPolarHBondContact O-CA 3.42Å; I60-E83 CarbonylContact C-O 3.56Å; I60-E83 WeakPolarHBondContact CA-O 3.39Å; N61-E83 PolarHBondContact N-O 3.14Å; N61-E83 PolarHBondContact OD1-N 2.8Å
84	V	87.9	Confident	76.1	Confident	1 Å²	1	78.9 Å²	78.9	1%	0.006	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	125	-178.2	-173.9	0	0	0	0	109.5	L14 I16 F51 I57 I60 I82 V86	L14-V84 HydrophobicContact CB-CB 4.42Å; L14-V84 PolarHBondContact N-O 2.78Å; L14-V84 PolarHBondContact O-N 3.15Å; I16-V84 HydrophobicContact CD1-CG2 4.29Å; F51-V84 HydrophobicContact CE1-CG1 3.92Å; F51-V84 HydrophobicContact CZ-CB 4.22Å; F51-V84 HydrophobicContact CZ-CG1 3.94Å; F51-V84 HydrophobicContact CZ-CG2 4.3Å; I57-V84 HydrophobicContact CG2-CG1 3.92Å; I60-V84 HydrophobicContact CG1-CB 4.46Å; I60-V84 HydrophobicContact CG1-CG1 3.94Å; I60-V84 HydrophobicContact CG1-CG2 4.09Å; I60-V84 HydrophobicContact CG2-CG2 4.3Å; I82-V84 HydrophobicContact CD1-CG2 3.81Å; I82-V84 HydrophobicContact CG1-CG2 4.14Å; V84-V86 HydrophobicContact CG1-CG1 4.01Å
85	I	88.9	Confident	73.9	Confident	56 Å²	56	81.9 Å²	81.9	29%	0.287	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	120.8	174.6	-61.8	173.2	0	0	0	108.4	L11 V12 A13 V58 T59	L11-I85 HydrophobicContact CB-CG2 4.04Å; L11-I85 HydrophobicContact CD2-CG2 4.11Å; L11-I85 HydrophobicContact CG-CG2 4.45Å; V12-I85 WeakPolarHBondContact O-CA 3.41Å; A13-I85 HydrophobicContact CB-CG1 4.46Å; V58-I85 PolarHBondContact N-O 2.87Å; T59-I85 PolarHBondContact N-O 2.78Å; T59-I85 PolarHBondContact O-N 3.3Å; T59-I85 WeakPolarHBondContact OG1-CB 3.44Å; T59-I85 WeakPolarHBondContact OG1-CD1 3.45Å
86	V	89.4	Confident	72.3	Confident	0 Å²	0	89.4 Å²	89.4	0%	0	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	142.8	176.7	-58.9	0	0	0	0	111.6	L11 V12 L14 F51 D55 F56 I57 V84	L11-V86 CarbonylContact C-O 3.55Å; L11-V86 WeakPolarHBondContact CA-O 3.47Å; V12-V86 HydrophobicContact CB-CG2 3.95Å; V12-V86 PolarHBondContact N-O 2.95Å; V12-V86 PolarHBondContact O-N 3.35Å; L14-V86 HydrophobicContact CD1-CG1 4.09Å; L14-V86 HydrophobicContact CD1-CG2 3.93Å; L14-V86 HydrophobicContact CG-CG2 4.35Å; F51-V86 HydrophobicContact CD1-CG1 3.96Å; F51-V86 HydrophobicContact CE1-CG1 3.64Å; D55-V86 HydrophobicContact CB-CB 4.32Å; F56-V86 CarbonylContact O-C 3.52Å; F56-V86 WeakPolarHBondContact O-CA 3.43Å; I57-V86 HydrophobicContact CG1-CG1 4.07Å; V84-V86 HydrophobicContact CG1-CG1 4.01Å
87	E	86.7	Confident	70.8	Confident	29 Å²	29	93.4 Å²	93.4	14%	0.136	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	121.1	172.5	-177.5	-171.9	114.2	0	0	108.3	R9 L11 K35 F56 V58	R9-E87 HydrophobicContact CB-CG 3.87Å; R9-E87 WeakPolarHBondContact CD-OE1 3.37Å; R9-E87 IonicContact CZ-OE1 3.7Å; R9-E87 IonicContact NE-OE1 3.85Å; R9-E87 IonicContact NH1-OE1 2.78Å; R9-E87 PolarHBondContact NH1-OE1 3.21Å; L11-E87 HydrophobicContact CD2-CB 3.88Å; L11-E87 HydrophobicContact CD2-CG 4.34Å; K35-E87 IonicContact NZ-OE1 3.16Å; K35-E87 PolarHBondContact NZ-OE1 3.04Å; K35-E87 VanDerWaalsContact NZ-OE1 3.16Å; K35-E87 IonicContact NZ-OE2 2.92Å; K35-E87 PolarHBondContact NZ-OE2 3.06Å; F56-E87 HydrophobicContact CB-CB 4.21Å; F56-E87 PolarHBondContact N-O 3.49Å; F56-E87 VanDerWaalsContact N-O 3.1Å; F56-E87 PolarHBondContact O-N 3.13Å; V58-E87 HydrophobicContact CG2-CB 3.88Å
88	R	82.6	Confident	68.9	Low	52 Å²	52	93.7 Å²	93.7	20%	0.196	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	157	177.4	76.1	-167.7	-32.7	176.9	18.6	111.3	R9 S10 V12 D55 A90	R9-R88 CarbonylContact C-O 3.55Å; R9-R88 WeakPolarHBondContact CA-O 3.46Å; S10-R88 PolarHBondContact N-O 2.79Å; S10-R88 PolarHBondContact O-N 2.75Å; V12-R88 HydrophobicContact CG2-CG 3.94Å; D55-R88 WeakPolarHBondContact OD1-CB 3.47Å; D55-R88 IonicContact OD1-CZ 3.5Å; D55-R88 VanDerWaalsContact OD1-CZ 3.31Å; D55-R88 IonicContact OD1-NE 3.92Å; D55-R88 PolarHBondContact OD1-NE 3.04Å; D55-R88 IonicContact OD1-NH2 2.79Å; D55-R88 PolarHBondContact OD1-NH2 3.4Å; D55-R88 IonicContact OD2-CZ 3.31Å; D55-R88 IonicContact OD2-NE 3.04Å; D55-R88 IonicContact OD2-NH2 2.75Å; D55-R88 PolarHBondContact OD2-NH2 2.86Å; R88-A90 PolarHBondContact O-N 2.82Å
89	E	71.6	Confident	67.1	Low	154 Å²	154	100.3 Å²	100.3	72%	0.72	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	128.3	172.6	-65.4	-177.8	107.1	0	0	109.1	D91	E89-D91 PolarHBondContact O-N 3.05Å
90	A	62.3	Low	65.6	Low	42 Å²	42	93.4 Å²	93.4	35%	0.347	48%	0.481	S	S	.	.			trans	-71.9	89	-175.7	0	0	0	0	0	110.4	T8 S10 R88 T92	T8-A90 WeakPolarHBondContact O-CB 3.44Å; T8-A90 PolarHBondContact O-N 3.16Å; S10-A90 WeakPolarHBondContact OG-CB 3.34Å; R88-A90 PolarHBondContact O-N 2.82Å; A90-T92 PolarHBondContact O-N 2.7Å
91	D	55.6	Low	63.5	Low	135 Å²	135	99.8 Å²	99.8	72%	0.722	51%	0.506	S	S	*	.			trans	-78.2	96.9	157.2	-159.4	-101	0	0	0	106.7	E89 K93	E89-D91 PolarHBondContact O-N 3.05Å; D91-K93 PolarHBondContact O-N 3.17Å
92	T	48.4	Very low	61.1	Low	118 Å²	118	101.4 Å²	101.4	72%	0.724	52%	0.519	S	S	*	.			trans	-61.8	83.3	-179	-53.9	0	0	0	0	110.4	A90	A90-T92 PolarHBondContact O-N 2.7Å
93	K	46.5	Very low	58.9	Low	164 Å²	164	104.8 Å²	104.8	71%	0.713	54%	0.543	S	S	*	.			trans	-131.2	80.6	155.4	-67.9	-170.2	-175.8	-176.7	0	107.5	D91 T95	D91-K93 PolarHBondContact O-N 3.17Å; K93-T95 PolarHBondContact O-N 3.44Å
94	L	50.5	Low	56.3	Low	164 Å²	164	109.4 Å²	109.4	86%	0.859	56%	0.562	S	S	*	*			trans	-63	77.8	163.2	-72	159.3	0	0	0	107.8	H96	L94-H96 PolarHBondContact O-N 2.99Å
95	T	42	Very low	54	Low	92 Å²	92	115.8 Å²	115.8	56%	0.564	60%	0.595	S	S	*	*			trans	-65.9	123.4	166.6	45.4	0	0	0	0	107.1	K93 E97 S98	K93-T95 PolarHBondContact O-N 3.44Å; T95-E97 PolarHBondContact O-N 2.91Å; T95-S98 PolarHBondContact O-N 2.85Å
96	H	49.7	Very low	51.9	Low	187 Å²	187	118.6 Å²	118.6	87%	0.866	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	10.6	-167.2	-173.8	-111	0	0	0	117.3	L94	L94-H96 PolarHBondContact O-N 2.99Å
97	E	50.2	Low	49.7	Very low	180 Å²	180	126.9 Å²	126.9	84%	0.841	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	-7.1	-177.1	-54.3	-167.6	97.6	0	0	113.3	T95	T95-E97 PolarHBondContact O-N 2.91Å
98	S	45.2	Very low	47.5	Very low	101 Å²	101	134.9 Å²	134.9	71%	0.706	69%	0.688	S	S	*	*			trans	-94.7	10	179.8	-54.6	0	0	0	0	114.6	T95 V100	T95-S98 PolarHBondContact O-N 2.85Å; S98-V100 PolarHBondContact O-N 3.09Å; S98-V100 VanDerWaalsContact O-N 3.16Å
99	Y	40.7	Very low	45.5	Very low	192 Å²	192	143.2 Å²	143.2	75%	0.753	72%	0.721	S	S	*	*			trans	-84.8	81.3	176.7	-166.9	-93.9	0	0	0	110.5
100	V	39.2	Very low	44.1	Very low	101 Å²	101	141.7 Å²	141.7	61%	0.612	73%	0.726	S	S	*	*			trans	-108.3	103.2	165	-173.3	0	0	0	0	107.7	S98	S98-V100 PolarHBondContact O-N 3.09Å; S98-V100 VanDerWaalsContact O-N 3.16Å
101	Q	37.6	Very low	43.3	Very low	151 Å²	151	144.9 Å²	144.9	71%	0.706	75%	0.746	S	S	*	*			trans	40	83.1	167.3	-83.8	-169.1	-91.3	0	0	115.8	S103	Q101-S103 PolarHBondContact NE2-OG 2.75Å; Q101-S103 PolarHBondContact O-N 3.3Å
102	V	34.7	Very low	42.6	Very low	118 Å²	118	150.4 Å²	150.4	72%	0.715	76%	0.757	S	S	*	*			trans	-74	72.1	150.9	-166.9	0	0	0	0	107.3	F104	V102-F104 PolarHBondContact O-N 3.2Å
103	S	38.2	Very low	42.5	Very low	70 Å²	70	155.6 Å²	155.6	49%	0.49	76%	0.763	S	S	.	*			trans	-89.7	96.5	171.6	-55	0	0	0	0	108.1	Q101 L105	Q101-S103 PolarHBondContact NE2-OG 2.75Å; Q101-S103 PolarHBondContact O-N 3.3Å; S103-L105 PolarHBondContact O-N 3.3Å
104	F	33.7	Very low	42.7	Very low	191 Å²	191	154.2 Å²	154.2	84%	0.838	77%	0.768	S	S	*	*			trans	20	97.4	149.5	-83.9	-100.8	0	0	0	116.2	V102	V102-F104 PolarHBondContact O-N 3.2Å
105	L	39.8	Very low	42.8	Very low	135 Å²	135	151 Å²	151	71%	0.707	76%	0.76	S	S	*	*			trans	-138.2	54.4	152.6	-142.1	82.2	0	0	0	111	S103 H107	S103-L105 PolarHBondContact O-N 3.3Å; L105-H107 PolarHBondContact O-N 2.7Å; L105-H107 VanDerWaalsContact O-N 3.08Å
106	S	45.9	Very low	43.2	Very low	114 Å²	114	153.1 Å²	153.1	80%	0.797	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	24.8	168.6	-172.2	0	0	0	0	113.1
107	H	41.8	Very low	43.4	Very low	175 Å²	175	147.2 Å²	147.2	81%	0.81	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.9	6.4	-171.2	-102.4	-114.9	0	0	0	116	L105	L105-H107 PolarHBondContact O-N 2.7Å; L105-H107 VanDerWaalsContact O-N 3.08Å
108	Y	41.7	Very low	44.2	Very low	196 Å²	196	145.3 Å²	145.3	77%	0.769	76%	0.763	S	S	*	*	S	Bend	trans	-128	7.2	-171.6	-110.4	-89.5	0	0	0	118.6
109	Y	40.6	Very low	45.2	Very low	227 Å²	227	149.9 Å²	149.9	89%	0.89	79%	0.791	S	S	*	*	S	Bend	trans	-136.8	132.4	169.9	-107.1	-98.9	0	0	0	110.5
110	C	41.9	Very low	45.4	Very low	122 Å²	122	147.8 Å²	147.8	82%	0.824	79%	0.793	S	S	*	*	S	Bend	trans	97.1	82.9	173	-151.7	0	0	0	0	116.5
111	S	44.6	Very low	45.7	Very low	110 Å²	110	150.3 Å²	150.3	77%	0.769	80%	0.802	S	S	*	*				162.3	66.8	128.5	-72	0	0	0	0	112.8
112	R	41.8	Very low	46.2	Very low	251 Å²	251	150.2 Å²	150.2	95%	0.947	81%	0.808	S	S	*	*			trans	-110.1	79.1	144.3	-98.3	-173.8	-167.3	-178.7	4.9	107.5	V114	R112-V114 PolarHBondContact O-N 2.81Å; R112-V114 VanDerWaalsContact O-N 3.11Å
113	R	47	Very low	46.9	Very low	227 Å²	227	152.1 Å²	152.1	86%	0.857	81%	0.813	S	S	*	*			trans	-59.4	107.7	159.4	-125.3	-178.4	-164.3	157.2	3.3	105.8	S115	R113-S115 VanDerWaalsContact C-N 3.34Å; R113-S115 PolarHBondContact O-N 3.31Å; R113-S115 VanDerWaalsContact O-N 3.16Å
114	V	50	Low	47.4	Very low	134 Å²	134	157.3 Å²	157.3	81%	0.812	83%	0.833	S	S	*	*			trans	-63.7	103.3	152.5	172.7	0	0	0	0	105.1	R112	R112-V114 PolarHBondContact O-N 2.81Å; R112-V114 VanDerWaalsContact O-N 3.11Å
115	S	52	Low	48.3	Very low	98 Å²	98	155 Å²	155	69%	0.685	83%	0.833	S	S	*	*			trans	-117.5	100.5	162.9	41.2	0	0	0	0	107	R113	R113-S115 VanDerWaalsContact C-N 3.34Å; R113-S115 PolarHBondContact O-N 3.31Å; R113-S115 VanDerWaalsContact O-N 3.16Å
116	T	50.3	Low	48.9	Very low	135 Å²	135	156.4 Å²	156.4	83%	0.828	84%	0.842	S	S	*	*			trans	-44.2	137.3	161.6	47	0	0	0	0	112.5
117	G	54	Low	49.2	Very low	64 Å²	64	159.7 Å²	159.7	66%	0.66	85%	0.845	S	S	*	*			trans	177.1	69.7	167.9	0	0	0	0	0	110.8
118	T	66.8	Low	49.8	Very low	139 Å²	139	158.4 Å²	158.4	85%	0.853	85%	0.848	S	S	*	*				73.4	149.6	111.1	-8.2	0	0	0	0	115.3
119	P	66.9	Low	50.5	Low	198 Å²	198	155 Å²	155	100%	1.286	86%	0.856	S	S	*	*				-70.3	0	-102.5	36.7	-29.8	0	0	0	115.7

Retrieved 119 of 119 residues in 28.8 ms (Link to these results)

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