A0A077Z3C9_TRITR Loading...

EGF domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z3C9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 198 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	57.8	Low	79.2	Confident	237 Å²	237	102.5 Å²	102.5	100%	1.167	52%	0.516	S	S	*	.				0	105.1	0	-78	-179.6	164.8	0	0	108
2	L	67.5	Low	80.3	Confident	66 Å²	66	101.6 Å²	101.6	35%	0.346	52%	0.52	S	S	.	.			trans	-159.8	104.6	-179.5	-106.1	147.7	0	0	0	103.6	N15 N18 M20	L2-N15 VanDerWaalsContact C-OD1 3.23Å; L2-N15 VanDerWaalsContact CB-OD1 3.3Å; L2-N15 WeakPolarHBondContact CB-OD1 3.26Å; L2-N15 HydrophobicContact CD2-CB 4.39Å; L2-N15 VanDerWaalsContact CD2-OD1 3.23Å; L2-N15 WeakPolarHBondContact CD2-OD1 3.39Å; L2-N15 PolarHBondContact O-ND2 2.79Å; L2-N15 PolarHBondContact O-OD1 2.66Å; L2-N18 HydrophobicContact CD1-CB 4.49Å; L2-N18 WeakPolarHBondContact CD2-O 3.44Å; L2-M20 HydrophobicContact CD2-CB 4.11Å
3	C	77.7	Confident	81.2	Confident	47 Å²	47	96.2 Å²	96.2	32%	0.318	50%	0.497	S	S	.	.			trans	68.8	99.1	-158	-59.2	0	0	0	0	115.4	C13 N15	C3-C13 WeakPolarHBondContact CA-SG 3.37Å; C3-C13 HydrophobicContact CB-CB 3.67Å; C3-C13 WeakPolarHBondContact CB-SG 3.09Å; C3-C13 WeakPolarHBondContact SG-CB 3.4Å; C3-C13 CovalentContact SG-SG 2.02Å; C3-C13 PolarHBondContact SG-SG 3.21Å; C3-N15 PolarHBondContact SG-OD1 3.19Å; C3-N15 VanDerWaalsContact SG-OD1 3.33Å
4	D	74.1	Confident	81.9	Confident	122 Å²	122	91.8 Å²	91.8	65%	0.652	48%	0.476	S	S	*	.			trans	-92.4	152.1	157	-160.1	-6.8	0	0	0	108.4	L6 T7	D4-L6 PolarHBondContact O-N 3.16Å; D4-T7 PolarHBondContact O-N 2.9Å; D4-T7 PolarHBondContact O-OG1 3.14Å
5	R	65.6	Low	82.3	Confident	242 Å²	242	91.4 Å²	91.4	91%	0.913	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-11.6	-167.3	-89.5	-176.1	-179.7	-176.1	0.8	115
6	L	72.9	Confident	82.6	Confident	157 Å²	157	90.4 Å²	90.4	82%	0.822	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	4.3	-173.9	-102.1	74.9	0	0	0	115.1	D4	D4-L6 PolarHBondContact O-N 3.16Å
7	T	83.9	Confident	83	Confident	45 Å²	45	91.6 Å²	91.6	28%	0.276	49%	0.492	S	S	.	.	S	Bend	trans	-76.4	-31.8	-170.5	-45.4	0	0	0	0	114.2	D4 M20 F32	D4-T7 PolarHBondContact O-N 2.9Å; D4-T7 PolarHBondContact O-OG1 3.14Å; T7-M20 HydrophobicContact CG2-CE 4.48Å; T7-M20 HydrophobicContact CG2-SD 3.39Å; T7-M20 WeakPolarHBondContact CG2-SD 3.44Å; T7-F32 HydrophobicContact CG2-CD1 3.62Å; T7-F32 HydrophobicContact CG2-CE1 3.56Å; T7-F32 WeakPolarHBondContact O-CB 3.37Å; T7-F32 VanDerWaalsContact O-CD1 3.28Å; T7-F32 WeakPolarHBondContact O-CD1 3.33Å
8	C	91.4	Very high	83	Confident	18 Å²	18	94.5 Å²	94.5	12%	0.122	51%	0.507	C	S	.	.			trans	-106.7	107.8	178.8	-50.2	0	0	0	0	109.7	C13 C22 F32	C8-C13 WeakPolarHBondContact SG-CA 3.42Å; C8-C13 WeakPolarHBondContact SG-CB 3.41Å; C8-C22 VanDerWaalsContact CA-SG 3.59Å; C8-C22 HydrophobicContact CB-CB 3.81Å; C8-C22 WeakPolarHBondContact CB-SG 3.41Å; C8-C22 WeakPolarHBondContact SG-CA 3.37Å; C8-C22 WeakPolarHBondContact SG-CB 3.48Å; C8-C22 CovalentContact SG-SG 2.03Å; C8-C22 PolarHBondContact SG-SG 3.3Å; C8-F32 CarbonylContact C-O 3.43Å; C8-F32 WeakPolarHBondContact CA-O 3.43Å
9	M	93	Very high	83.1	Confident	133 Å²	133	94.2 Å²	94.2	66%	0.655	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-53.2	-174.6	-64.9	-175.8	74.8	0	0	111.5	F32 E34	M9-F32 PolarHBondContact N-O 2.96Å; M9-E34 HydrophobicContact SD-CB 3.7Å
10	N	94.3	Very high	83.3	Confident	42 Å²	42	91.5 Å²	91.5	23%	0.225	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	49.7	178.7	-62.3	-69.5	0	0	0	111.6	K25 Y28 C33	N10-K25 WeakPolarHBondContact O-CB 3.49Å; N10-K25 WeakPolarHBondContact O-CG 3.45Å; N10-K25 PolarHBondContact O-N 3.11Å; N10-Y28 HydrophobicContact CB-CD1 3.51Å; N10-Y28 HydrophobicContact CB-CD2 3.62Å; N10-Y28 HydrophobicContact CB-CE1 3.8Å; N10-Y28 HydrophobicContact CB-CE2 3.91Å; N10-Y28 HydrophobicContact CB-CG 3.41Å; N10-Y28 VanDerWaalsContact CB-CG 3.41Å; N10-Y28 VanDerWaalsContact ND2-CD1 3.34Å; N10-Y28 WeakPolarHBondContact ND2-CD1 3.43Å; N10-Y28 WeakPolarHBondContact ND2-CE1 3.21Å; N10-C33 HydrophobicContact CB-CB 4.16Å; N10-C33 WeakPolarHBondContact CB-O 3.28Å; N10-C33 PolarHBondContact N-O 3.37Å; N10-C33 PolarHBondContact ND2-O 2.88Å; N10-C33 VanDerWaalsContact ND2-O 3.16Å; N10-C33 WeakPolarHBondContact O-CB 3.32Å
11	G	93.4	Very high	83.7	Confident	18 Å²	18	90.1 Å²	90.1	19%	0.186	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	178.3	-177.6	0	0	0	0	0	113.7	K23	G11-K23 CarbonylContact C-O 3.46Å; G11-K23 WeakPolarHBondContact CA-O 3.13Å
12	V	92.2	Very high	85.4	Confident	92 Å²	92	79.6 Å²	79.6	56%	0.558	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.5	124.6	172.5	-178.1	0	0	0	0	108.5	V14 K23	V12-V14 HydrophobicContact CG1-CG1 4.28Å; V12-K23 PolarHBondContact N-O 3.08Å; V12-K23 PolarHBondContact O-N 3.31Å
13	C	92.1	Very high	86.7	Confident	32 Å²	32	83 Å²	83	22%	0.216	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	127.3	174.1	-167.7	0	0	0	0	110.2	C3 C8 M20	C3-C13 WeakPolarHBondContact CA-SG 3.37Å; C3-C13 HydrophobicContact CB-CB 3.67Å; C3-C13 WeakPolarHBondContact CB-SG 3.09Å; C3-C13 WeakPolarHBondContact SG-CB 3.4Å; C3-C13 CovalentContact SG-SG 2.02Å; C3-C13 PolarHBondContact SG-SG 3.21Å; C8-C13 WeakPolarHBondContact SG-CA 3.42Å; C8-C13 WeakPolarHBondContact SG-CB 3.41Å; C13-M20 WeakPolarHBondContact SG-CG 3.27Å
14	V	90.4	Very high	87.5	Confident	34 Å²	34	82.8 Å²	82.8	21%	0.206	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.5	175	-61.5	0	0	0	0	110.8	V12 V16 V21 K23	V12-V14 HydrophobicContact CG1-CG1 4.28Å; V14-V16 HydrophobicContact CG2-CG2 4.05Å; V14-V21 HydrophobicContact CG2-CB 4.17Å; V14-V21 VanDerWaalsContact CG2-O 3.31Å; V14-V21 WeakPolarHBondContact CG2-O 3.47Å; V14-V21 PolarHBondContact N-O 3.48Å; V14-V21 PolarHBondContact O-N 3.23Å; V14-K23 HydrophobicContact CG1-CD 4.13Å; V14-K23 HydrophobicContact CG2-CD 3.99Å; V14-K23 HydrophobicContact CG2-CG 3.95Å
15	N	88.3	Confident	88.5	Confident	86 Å²	86	83.1 Å²	83.1	46%	0.46	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	118.3	175.8	-65.8	-36.1	0	0	0	109.2	L2 C3	L2-N15 VanDerWaalsContact C-OD1 3.23Å; L2-N15 VanDerWaalsContact CB-OD1 3.3Å; L2-N15 WeakPolarHBondContact CB-OD1 3.26Å; L2-N15 HydrophobicContact CD2-CB 4.39Å; L2-N15 VanDerWaalsContact CD2-OD1 3.23Å; L2-N15 WeakPolarHBondContact CD2-OD1 3.39Å; L2-N15 PolarHBondContact O-ND2 2.79Å; L2-N15 PolarHBondContact O-OD1 2.66Å; C3-N15 PolarHBondContact SG-OD1 3.19Å; C3-N15 VanDerWaalsContact SG-OD1 3.33Å
16	V	87	Confident	90	Very high	75 Å²	75	78.1 Å²	78.1	46%	0.455	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	113.7	179.4	-174.7	0	0	0	0	108	V14 N18 V19 V21	V14-V16 HydrophobicContact CG2-CG2 4.05Å; V16-N18 VanDerWaalsContact C-N 3.33Å; V16-N18 PolarHBondContact O-N 3.44Å; V16-V19 PolarHBondContact N-O 3.43Å; V16-V19 WeakPolarHBondContact O-CA 3.34Å; V16-V19 WeakPolarHBondContact O-CB 3.45Å; V16-V19 PolarHBondContact O-N 3.42Å; V16-V21 HydrophobicContact CB-CG2 4.32Å; V16-V21 HydrophobicContact CG2-CB 4.49Å; V16-V21 HydrophobicContact CG2-CG2 4.32Å
17	S	89.1	Confident	91.1	Very high	112 Å²	112	71.2 Å²	71.2	78%	0.783	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	44.1	178.8	-55.4	0	0	0	0	114.3	V19	S17-V19 PolarHBondContact O-N 3.34Å
18	N	82.7	Confident	91.8	Very high	143 Å²	143	71.4 Å²	71.4	77%	0.765	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	16.7	-174.6	-55.7	-37.6	0	0	0	115.2	L2 V16	L2-N18 HydrophobicContact CD1-CB 4.49Å; L2-N18 WeakPolarHBondContact CD2-O 3.44Å; V16-N18 VanDerWaalsContact C-N 3.33Å; V16-N18 PolarHBondContact O-N 3.44Å
19	V	86.2	Confident	92	Very high	88 Å²	88	76.1 Å²	76.1	53%	0.533	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	137.3	170.4	-177.2	0	0	0	0	109.4	V16 S17 V21	V16-V19 PolarHBondContact N-O 3.43Å; V16-V19 WeakPolarHBondContact O-CA 3.34Å; V16-V19 WeakPolarHBondContact O-CB 3.45Å; V16-V19 PolarHBondContact O-N 3.42Å; S17-V19 PolarHBondContact O-N 3.34Å; V19-V21 HydrophobicContact CG1-CG2 4.41Å
20	M	87.2	Confident	92.1	Very high	41 Å²	41	71.4 Å²	71.4	20%	0.202	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	126.7	171.7	-176.7	-124.6	72.6	0	0	109.3	L2 T7 C13 F32	L2-M20 HydrophobicContact CD2-CB 4.11Å; T7-M20 HydrophobicContact CG2-CE 4.48Å; T7-M20 HydrophobicContact CG2-SD 3.39Å; T7-M20 WeakPolarHBondContact CG2-SD 3.44Å; C13-M20 WeakPolarHBondContact SG-CG 3.27Å; M20-F32 HydrophobicContact CE-CD1 4.38Å; M20-F32 HydrophobicContact CE-CE1 4.12Å; M20-F32 HydrophobicContact SD-CE1 4.38Å
21	V	90.7	Very high	92	Very high	62 Å²	62	78.3 Å²	78.3	38%	0.376	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	128.4	175.9	-179	0	0	0	0	109	V14 V16 V19	V14-V21 HydrophobicContact CG2-CB 4.17Å; V14-V21 VanDerWaalsContact CG2-O 3.31Å; V14-V21 WeakPolarHBondContact CG2-O 3.47Å; V14-V21 PolarHBondContact N-O 3.48Å; V14-V21 PolarHBondContact O-N 3.23Å; V16-V21 HydrophobicContact CB-CG2 4.32Å; V16-V21 HydrophobicContact CG2-CB 4.49Å; V16-V21 HydrophobicContact CG2-CG2 4.32Å; V19-V21 HydrophobicContact CG1-CG2 4.41Å
22	C	93.2	Very high	92	Very high	17 Å²	17	80.9 Å²	80.9	12%	0.115	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	121.5	170.7	-68.7	0	0	0	0	109.6	C8 R31	C8-C22 VanDerWaalsContact CA-SG 3.59Å; C8-C22 HydrophobicContact CB-CB 3.81Å; C8-C22 WeakPolarHBondContact CB-SG 3.41Å; C8-C22 WeakPolarHBondContact SG-CA 3.37Å; C8-C22 WeakPolarHBondContact SG-CB 3.48Å; C8-C22 CovalentContact SG-SG 2.03Å; C8-C22 PolarHBondContact SG-SG 3.3Å; C22-R31 WeakPolarHBondContact CB-O 3.25Å; C22-R31 PolarHBondContact SG-O 3.42Å
23	K	94.4	Very high	92.1	Very high	136 Å²	136	76.5 Å²	76.5	59%	0.591	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	103.7	167	-72.2	-178.3	172.5	179.8	0	108.3	G11 V12 V14	G11-K23 CarbonylContact C-O 3.46Å; G11-K23 WeakPolarHBondContact CA-O 3.13Å; V12-K23 PolarHBondContact N-O 3.08Å; V12-K23 PolarHBondContact O-N 3.31Å; V14-K23 HydrophobicContact CG1-CD 4.13Å; V14-K23 HydrophobicContact CG2-CD 3.99Å; V14-K23 HydrophobicContact CG2-CG 3.95Å
24	C	95.3	Very high	92.3	Very high	43 Å²	43	78 Å²	78	29%	0.291	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	146.5	-176.9	-56.1	0	0	0	0	112	Y28 C33	C24-Y28 WeakPolarHBondContact CB-O 3.32Å; C24-C33 WeakPolarHBondContact CA-SG 3.49Å; C24-C33 HydrophobicContact CB-CB 3.72Å; C24-C33 WeakPolarHBondContact CB-SG 3.23Å; C24-C33 PolarHBondContact N-SG 2.88Å; C24-C33 WeakPolarHBondContact SG-CA 3.36Å; C24-C33 WeakPolarHBondContact SG-CB 3.3Å; C24-C33 CovalentContact SG-SG 2.04Å; C24-C33 PolarHBondContact SG-SG 3.08Å
25	K	96.3	Very high	92.5	Very high	130 Å²	130	81.2 Å²	81.2	57%	0.565	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-65.1	156	164.5	-66.5	176.3	-177.5	174.9	0	108.8	N10 G27 Y28	N10-K25 WeakPolarHBondContact O-CB 3.49Å; N10-K25 WeakPolarHBondContact O-CG 3.45Å; N10-K25 PolarHBondContact O-N 3.11Å; K25-G27 PolarHBondContact O-N 3.42Å; K25-Y28 HydrophobicContact CB-CD2 4.26Å; K25-Y28 PolarHBondContact O-N 2.8Å; K25-Y28 VanDerWaalsContact O-N 3.14Å
26	D	96.4	Very high	92.9	Very high	137 Å²	137	80 Å²	80	73%	0.733	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	140.2	175.9	-60.4	-29.5	0	0	0	110.7	Y28 A56	D26-Y28 VanDerWaalsContact C-N 3.34Å; D26-A56 HydrophobicContact CB-CB 3.8Å
27	G	96.1	Very high	93.4	Very high	12 Å²	12	81.1 Å²	81.1	12%	0.124	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.8	2.9	-175.7	0	0	0	0	0	115	K25 E36 M37	K25-G27 PolarHBondContact O-N 3.42Å; G27-E36 CarbonylContact O-C 3.54Å; G27-E36 WeakPolarHBondContact O-CA 3.23Å; G27-M37 PolarHBondContact O-N 3Å
28	Y	97.5	Very high	93.7	Very high	49 Å²	49	79.4 Å²	79.4	19%	0.192	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	149.3	176.8	-65	-90.5	0	0	0	112.9	N10 C24 K25 D26 F35 E36 I55	N10-Y28 HydrophobicContact CB-CD1 3.51Å; N10-Y28 HydrophobicContact CB-CD2 3.62Å; N10-Y28 HydrophobicContact CB-CE1 3.8Å; N10-Y28 HydrophobicContact CB-CE2 3.91Å; N10-Y28 HydrophobicContact CB-CG 3.41Å; N10-Y28 VanDerWaalsContact CB-CG 3.41Å; N10-Y28 VanDerWaalsContact ND2-CD1 3.34Å; N10-Y28 WeakPolarHBondContact ND2-CD1 3.43Å; N10-Y28 WeakPolarHBondContact ND2-CE1 3.21Å; C24-Y28 WeakPolarHBondContact CB-O 3.32Å; K25-Y28 HydrophobicContact CB-CD2 4.26Å; K25-Y28 PolarHBondContact O-N 2.8Å; K25-Y28 VanDerWaalsContact O-N 3.14Å; D26-Y28 VanDerWaalsContact C-N 3.34Å; Y28-F35 CarbonylContact C-O 3.5Å; Y28-F35 VanDerWaalsContact CA-O 3.25Å; Y28-F35 WeakPolarHBondContact CA-O 3.41Å; Y28-F35 WeakPolarHBondContact CD1-O 3.36Å; Y28-E36 HydrophobicContact CD1-CB 4.01Å; Y28-E36 HydrophobicContact CD1-CG 4.42Å; Y28-E36 HydrophobicContact CE1-CB 3.78Å; Y28-E36 HydrophobicContact CE1-CG 4.02Å; Y28-I55 HydrophobicContact CE2-CG2 3.67Å; Y28-I55 WeakPolarHBondContact OH-CD1 3.3Å
29	Y	95.8	Very high	94.4	Very high	117 Å²	117	74 Å²	74	46%	0.459	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	175.7	177.4	75.5	-82	0	0	0	111.8	C33 E34 F35 E36 M37	Y29-C33 CarbonylContact O-C 3.52Å; Y29-C33 WeakPolarHBondContact O-CA 3.24Å; Y29-E34 PolarHBondContact O-N 3.31Å; Y29-F35 HydrophobicContact CD1-CB 3.77Å; Y29-F35 HydrophobicContact CD2-CB 4.16Å; Y29-F35 HydrophobicContact CD2-CD2 4.3Å; Y29-F35 HydrophobicContact CE1-CB 3.39Å; Y29-F35 HydrophobicContact CE1-CG 4.44Å; Y29-F35 HydrophobicContact CE2-CB 3.8Å; Y29-F35 AromaticContact CE2-CD2 3.91Å; Y29-F35 HydrophobicContact CE2-CD2 3.91Å; Y29-F35 HydrophobicContact CE2-CG 4.1Å; Y29-F35 HydrophobicContact CG-CB 4.15Å; Y29-F35 AromaticContact CZ-CG 3.98Å; Y29-F35 PolarHBondContact N-O 3.01Å; Y29-F35 PolarHBondContact O-N 3.36Å; Y29-F35 VanDerWaalsContact O-N 3.09Å; Y29-E36 WeakPolarHBondContact CE1-O 3.35Å; Y29-M37 HydrophobicContact CD1-CB 4.1Å
30	G	95.1	Very high	94.9	Very high	34 Å²	34	70.6 Å²	70.6	35%	0.351	34%	0.342	S	S	.	.	S	Bend	trans	106.9	172.5	-174.5	0	0	0	0	0	112.3	F32 E34	G30-F32 PolarHBondContact O-N 3.06Å; G30-E34 WeakPolarHBondContact CA-OE2 3.44Å
31	R	92.4	Very high	95.3	Very high	187 Å²	187	72.7 Å²	72.7	71%	0.706	36%	0.361	S	S	*	.	S	Bend	trans	-68.2	-29.5	-177.7	-177.7	176.6	-179.6	178.2	0.7	111.6	C22 E34	C22-R31 WeakPolarHBondContact CB-O 3.25Å; C22-R31 PolarHBondContact SG-O 3.42Å; R31-E34 PolarHBondContact N-OE2 3.17Å
32	F	93.2	Very high	95.5	Very high	71 Å²	71	74.2 Å²	74.2	31%	0.311	37%	0.374	S	S	.	.	S	Bend	trans	-119	11.3	-176.1	-57.5	-62.2	0	0	0	112.2	T7 C8 M9 M20 G30 E34	T7-F32 HydrophobicContact CG2-CD1 3.62Å; T7-F32 HydrophobicContact CG2-CE1 3.56Å; T7-F32 WeakPolarHBondContact O-CB 3.37Å; T7-F32 VanDerWaalsContact O-CD1 3.28Å; T7-F32 WeakPolarHBondContact O-CD1 3.33Å; C8-F32 CarbonylContact C-O 3.43Å; C8-F32 WeakPolarHBondContact CA-O 3.43Å; M9-F32 PolarHBondContact N-O 2.96Å; M20-F32 HydrophobicContact CE-CD1 4.38Å; M20-F32 HydrophobicContact CE-CE1 4.12Å; M20-F32 HydrophobicContact SD-CE1 4.38Å; G30-F32 PolarHBondContact O-N 3.06Å; F32-E34 VanDerWaalsContact CA-OE2 3.25Å; F32-E34 WeakPolarHBondContact CA-OE2 3.49Å; F32-E34 WeakPolarHBondContact CB-OE2 3.43Å; F32-E34 PolarHBondContact N-OE2 2.87Å; F32-E34 PolarHBondContact O-N 3.4Å
33	C	95.6	Very high	95.7	Very high	0 Å²	0	79.1 Å²	79.1	0%	0	40%	0.399	C	S	.	.	S	Bend	trans	57.6	38.9	-175.7	-44.1	0	0	0	0	112.2	N10 C24 Y29	N10-C33 HydrophobicContact CB-CB 4.16Å; N10-C33 WeakPolarHBondContact CB-O 3.28Å; N10-C33 PolarHBondContact N-O 3.37Å; N10-C33 PolarHBondContact ND2-O 2.88Å; N10-C33 VanDerWaalsContact ND2-O 3.16Å; N10-C33 WeakPolarHBondContact O-CB 3.32Å; C24-C33 WeakPolarHBondContact CA-SG 3.49Å; C24-C33 HydrophobicContact CB-CB 3.72Å; C24-C33 WeakPolarHBondContact CB-SG 3.23Å; C24-C33 PolarHBondContact N-SG 2.88Å; C24-C33 WeakPolarHBondContact SG-CA 3.36Å; C24-C33 WeakPolarHBondContact SG-CB 3.3Å; C24-C33 CovalentContact SG-SG 2.04Å; C24-C33 PolarHBondContact SG-SG 3.08Å; Y29-C33 CarbonylContact O-C 3.52Å; Y29-C33 WeakPolarHBondContact O-CA 3.24Å
34	E	94.5	Very high	95.8	Very high	64 Å²	64	73.4 Å²	73.4	30%	0.299	38%	0.376	S	S	.	.			trans	-86.1	-18.1	-174.6	67.4	-87.1	-145.3	0	0	113	M9 Y29 G30 R31 F32	M9-E34 HydrophobicContact SD-CB 3.7Å; Y29-E34 PolarHBondContact O-N 3.31Å; G30-E34 WeakPolarHBondContact CA-OE2 3.44Å; R31-E34 PolarHBondContact N-OE2 3.17Å; F32-E34 VanDerWaalsContact CA-OE2 3.25Å; F32-E34 WeakPolarHBondContact CA-OE2 3.49Å; F32-E34 WeakPolarHBondContact CB-OE2 3.43Å; F32-E34 PolarHBondContact N-OE2 2.87Å; F32-E34 PolarHBondContact O-N 3.4Å
35	F	96.2	Very high	95.9	Very high	102 Å²	102	72.2 Å²	72.2	45%	0.447	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	133.6	179.9	-55.7	-64.1	0	0	0	110.6	Y28 Y29	Y28-F35 CarbonylContact C-O 3.5Å; Y28-F35 VanDerWaalsContact CA-O 3.25Å; Y28-F35 WeakPolarHBondContact CA-O 3.41Å; Y28-F35 WeakPolarHBondContact CD1-O 3.36Å; Y29-F35 HydrophobicContact CD1-CB 3.77Å; Y29-F35 HydrophobicContact CD2-CB 4.16Å; Y29-F35 HydrophobicContact CD2-CD2 4.3Å; Y29-F35 HydrophobicContact CE1-CB 3.39Å; Y29-F35 HydrophobicContact CE1-CG 4.44Å; Y29-F35 HydrophobicContact CE2-CB 3.8Å; Y29-F35 AromaticContact CE2-CD2 3.91Å; Y29-F35 HydrophobicContact CE2-CD2 3.91Å; Y29-F35 HydrophobicContact CE2-CG 4.1Å; Y29-F35 HydrophobicContact CG-CB 4.15Å; Y29-F35 AromaticContact CZ-CG 3.98Å; Y29-F35 PolarHBondContact N-O 3.01Å; Y29-F35 PolarHBondContact O-N 3.36Å; Y29-F35 VanDerWaalsContact O-N 3.09Å
36	E	96.3	Very high	95.9	Very high	61 Å²	61	73.3 Å²	73.3	29%	0.285	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	136.6	167.5	-170.7	-97.2	-160.2	0	0	108.7	G27 Y28 Y29	G27-E36 CarbonylContact O-C 3.54Å; G27-E36 WeakPolarHBondContact O-CA 3.23Å; Y28-E36 HydrophobicContact CD1-CB 4.01Å; Y28-E36 HydrophobicContact CD1-CG 4.42Å; Y28-E36 HydrophobicContact CE1-CB 3.78Å; Y28-E36 HydrophobicContact CE1-CG 4.02Å; Y29-E36 WeakPolarHBondContact CE1-O 3.35Å
37	M	96.5	Very high	95.8	Very high	97 Å²	97	70 Å²	70	48%	0.478	35%	0.351	S	S	.	.			trans	-79.1	118.9	-178.7	177.6	173.1	-73.6	0	0	108.2	G27 Y29 E39	G27-M37 PolarHBondContact O-N 3Å; Y29-M37 HydrophobicContact CD1-CB 4.1Å; M37-E39 PolarHBondContact O-N 3.21Å; M37-E39 VanDerWaalsContact O-N 3.09Å
38	N	96.6	Very high	95.7	Very high	76 Å²	76	71.5 Å²	71.5	41%	0.406	37%	0.366	S	S	.	.			trans	-77.3	97.2	174.9	177.2	-25	0	0	0	110.7	C40 S41 D53	N38-C40 PolarHBondContact O-N 3.31Å; N38-C40 VanDerWaalsContact OD1-CA 3.3Å; N38-C40 WeakPolarHBondContact OD1-CA 3.46Å; N38-C40 WeakPolarHBondContact OD1-CB 3.34Å; N38-C40 PolarHBondContact OD1-N 3.21Å; N38-S41 WeakPolarHBondContact CB-OG 3.42Å; N38-S41 VanDerWaalsContact CG-OG 3.28Å; N38-S41 VanDerWaalsContact O-CB 3.27Å; N38-S41 WeakPolarHBondContact O-CB 3.49Å; N38-S41 PolarHBondContact O-N 3.47Å; N38-S41 VanDerWaalsContact O-N 3.12Å; N38-S41 PolarHBondContact O-OG 3.32Å; N38-S41 PolarHBondContact OD1-N 3.5Å; N38-S41 PolarHBondContact OD1-OG 2.74Å; N38-D53 VanDerWaalsContact CA-OD1 3.22Å; N38-D53 WeakPolarHBondContact CA-OD1 3.38Å; N38-D53 WeakPolarHBondContact CA-OD2 3.47Å; N38-D53 PolarHBondContact OD1-OD1 3.14Å
39	E	96.2	Very high	95.7	Very high	30 Å²	30	69.8 Å²	69.8	14%	0.14	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-63.8	-24.6	178.8	-69	83.5	-176.8	0	0	112.4	M37 S41 S42 D53 A56 S57 F58	M37-E39 PolarHBondContact O-N 3.21Å; M37-E39 VanDerWaalsContact O-N 3.09Å; E39-S41 PolarHBondContact O-N 3.29Å; E39-S42 PolarHBondContact O-OG 2.92Å; E39-D53 PolarHBondContact N-OD1 2.65Å; E39-A56 WeakPolarHBondContact OE1-CA 3.29Å; E39-A56 PolarHBondContact OE1-N 3.27Å; E39-S57 WeakPolarHBondContact CB-O 3.31Å; E39-S57 PolarHBondContact OE1-N 3.49Å; E39-S57 VanDerWaalsContact OE2-O 3.13Å; E39-F58 HydrophobicContact CB-CB 4.14Å; E39-F58 HydrophobicContact CB-CD1 4.39Å
40	C	97.3	Very high	95.7	Very high	16 Å²	16	67.6 Å²	67.6	11%	0.108	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-69.2	-16.7	175.1	-72.7	0	0	0	0	114.2	N38 S42 N43 C51 I52 D53	N38-C40 PolarHBondContact O-N 3.31Å; N38-C40 VanDerWaalsContact OD1-CA 3.3Å; N38-C40 WeakPolarHBondContact OD1-CA 3.46Å; N38-C40 WeakPolarHBondContact OD1-CB 3.34Å; N38-C40 PolarHBondContact OD1-N 3.21Å; C40-S42 PolarHBondContact O-N 2.84Å; C40-S42 VanDerWaalsContact O-N 3.1Å; C40-N43 PolarHBondContact O-N 3.25Å; C40-C51 WeakPolarHBondContact CA-SG 3.43Å; C40-C51 HydrophobicContact CB-CB 3.7Å; C40-C51 WeakPolarHBondContact CB-SG 3.32Å; C40-C51 WeakPolarHBondContact SG-CB 3.3Å; C40-C51 CovalentContact SG-SG 2.03Å; C40-C51 PolarHBondContact SG-SG 2.7Å; C40-I52 PolarHBondContact SG-N 2.87Å; C40-D53 PolarHBondContact N-OD1 3.23Å; C40-D53 PolarHBondContact SG-N 3.31Å
41	S	96.3	Very high	95.8	Very high	86 Å²	86	68 Å²	68	60%	0.601	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-58.4	-26.8	179.3	-55.6	0	0	0	0	113.2	N38 E39 N43	N38-S41 WeakPolarHBondContact CB-OG 3.42Å; N38-S41 VanDerWaalsContact CG-OG 3.28Å; N38-S41 VanDerWaalsContact O-CB 3.27Å; N38-S41 WeakPolarHBondContact O-CB 3.49Å; N38-S41 PolarHBondContact O-N 3.47Å; N38-S41 VanDerWaalsContact O-N 3.12Å; N38-S41 PolarHBondContact O-OG 3.32Å; N38-S41 PolarHBondContact OD1-N 3.5Å; N38-S41 PolarHBondContact OD1-OG 2.74Å; E39-S41 PolarHBondContact O-N 3.29Å; S41-N43 VanDerWaalsContact C-N 3.26Å; S41-N43 PolarHBondContact O-N 3.46Å
42	S	95.3	Very high	96.1	Very high	93 Å²	93	61.6 Å²	61.6	65%	0.65	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-79.2	-3.9	177	66.5	0	0	0	0	114.2	E39 C40	E39-S42 PolarHBondContact O-OG 2.92Å; C40-S42 PolarHBondContact O-N 2.84Å; C40-S42 VanDerWaalsContact O-N 3.1Å
43	N	95.9	Very high	96.2	Very high	120 Å²	120	60.5 Å²	60.5	64%	0.642	34%	0.339	S	S	*	.			trans	50.2	59.2	-172.2	-63.7	-62.5	0	0	0	113.1	C40 S41 C45	C40-N43 PolarHBondContact O-N 3.25Å; S41-N43 VanDerWaalsContact C-N 3.26Å; S41-N43 PolarHBondContact O-N 3.46Å; N43-C45 PolarHBondContact O-N 2.92Å
44	P	96.7	Very high	96.3	Very high	17 Å²	17	65.1 Å²	65.1	11%	0.11	36%	0.359	C	S	.	.			trans	-67.7	-26.1	-175.2	28	-34.1	0	0	0	112.7	R46 F58 T70	P44-R46 PolarHBondContact O-N 3.41Å; P44-F58 HydrophobicContact CB-CD1 4.34Å; P44-F58 HydrophobicContact CB-CD2 4.01Å; P44-F58 HydrophobicContact CB-CE1 4.02Å; P44-F58 HydrophobicContact CB-CE2 3.68Å; P44-F58 HydrophobicContact CB-CG 4.34Å; P44-F58 HydrophobicContact CB-CZ 3.68Å; P44-F58 HydrophobicContact CG-CB 4.4Å; P44-F58 HydrophobicContact CG-CD1 4.07Å; P44-F58 HydrophobicContact CG-CD2 3.6Å; P44-F58 HydrophobicContact CG-CE1 4.26Å; P44-F58 HydrophobicContact CG-CE2 3.83Å; P44-F58 HydrophobicContact CG-CG 3.74Å; P44-F58 HydrophobicContact CG-CZ 4.16Å; P44-T70 HydrophobicContact CB-CG2 4.43Å; P44-T70 VanDerWaalsContact O-CB 3.24Å; P44-T70 WeakPolarHBondContact O-CB 3.46Å; P44-T70 WeakPolarHBondContact O-CG2 3.46Å
45	C	97.7	Very high	96.3	Very high	18 Å²	18	66.8 Å²	66.8	12%	0.122	37%	0.369	C	S	.	.			trans	-78.3	120.5	-176.9	-50	0	0	0	0	112.5	N43 C51 C60	N43-C45 PolarHBondContact O-N 2.92Å; C45-C51 HydrophobicContact CB-CB 4.48Å; C45-C51 VanDerWaalsContact SG-CA 3.52Å; C45-C51 WeakPolarHBondContact SG-CB 3.47Å; C45-C60 WeakPolarHBondContact CA-SG 3.43Å; C45-C60 HydrophobicContact CB-CB 3.75Å; C45-C60 WeakPolarHBondContact CB-SG 3.42Å; C45-C60 WeakPolarHBondContact SG-CA 3.5Å; C45-C60 WeakPolarHBondContact SG-CB 3.23Å; C45-C60 CovalentContact SG-SG 2.02Å; C45-C60 PolarHBondContact SG-SG 2.79Å
46	R	96.4	Very high	96.2	Very high	153 Å²	153	64.4 Å²	64.4	58%	0.577	37%	0.369	S	S	*	.			trans	-88.3	171.2	178.6	-55.4	-57.7	-174.5	177	-0.9	111.5	P44 G48 G49 T70 C71 Q72	P44-R46 PolarHBondContact O-N 3.41Å; R46-G48 PolarHBondContact O-N 2.93Å; R46-G49 PolarHBondContact O-N 3.46Å; R46-T70 WeakPolarHBondContact CB-O 3.33Å; R46-T70 PolarHBondContact N-O 2.94Å; R46-C71 WeakPolarHBondContact O-CB 3.14Å; R46-Q72 HydrophobicContact CG-CB 4.31Å
47	N	94.9	Very high	96.2	Very high	66 Å²	66	64.1 Å²	64.1	35%	0.353	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	30.3	171.6	-61.6	-50.2	0	0	0	114.7	G49 Y66 C71	N47-G49 VanDerWaalsContact C-N 3.3Å; N47-G49 PolarHBondContact O-N 3.17Å; N47-Y66 HydrophobicContact CB-CD1 3.43Å; N47-Y66 VanDerWaalsContact CB-CD1 3.43Å; N47-Y66 HydrophobicContact CB-CD2 4.07Å; N47-Y66 HydrophobicContact CB-CE1 3.3Å; N47-Y66 HydrophobicContact CB-CE2 3.98Å; N47-Y66 HydrophobicContact CB-CG 3.79Å; N47-Y66 VanDerWaalsContact CG-CD1 3.43Å; N47-Y66 VanDerWaalsContact ND2-CD1 3.27Å; N47-Y66 WeakPolarHBondContact ND2-CD1 3.24Å; N47-Y66 VanDerWaalsContact ND2-CE1 3.31Å; N47-Y66 WeakPolarHBondContact ND2-CE1 3.28Å; N47-Y66 WeakPolarHBondContact OD1-CE1 3.46Å; N47-C71 PolarHBondContact ND2-O 3.32Å
48	G	94.2	Very high	96.2	Very high	44 Å²	44	62.7 Å²	62.7	45%	0.454	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	70	23.1	-179	0	0	0	0	0	114.3	R46 K63	R46-G48 PolarHBondContact O-N 2.93Å; G48-K63 WeakPolarHBondContact O-CD 3.35Å; G48-K63 WeakPolarHBondContact O-CE 3.3Å
49	G	95.6	Very high	96.3	Very high	14 Å²	14	63.3 Å²	63.3	14%	0.144	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-63.9	146.8	167.6	0	0	0	0	0	111.7	R46 N47 Q61	R46-G49 PolarHBondContact O-N 3.46Å; N47-G49 VanDerWaalsContact C-N 3.3Å; N47-G49 PolarHBondContact O-N 3.17Å; G49-Q61 CarbonylContact C-O 3.59Å; G49-Q61 WeakPolarHBondContact CA-O 3.39Å
50	S	97	Very high	96.3	Very high	71 Å²	71	62.5 Å²	62.5	50%	0.497	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	130.3	176.2	-59.1	0	0	0	0	109.9	Q61	S50-Q61 PolarHBondContact N-O 3.45Å; S50-Q61 PolarHBondContact O-N 3.5Å
51	C	97.8	Very high	96.3	Very high	41 Å²	41	67 Å²	67	28%	0.277	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	133.2	178	-165.2	0	0	0	0	110.8	C40 C45	C40-C51 WeakPolarHBondContact CA-SG 3.43Å; C40-C51 HydrophobicContact CB-CB 3.7Å; C40-C51 WeakPolarHBondContact CB-SG 3.32Å; C40-C51 WeakPolarHBondContact SG-CB 3.3Å; C40-C51 CovalentContact SG-SG 2.03Å; C40-C51 PolarHBondContact SG-SG 2.7Å; C45-C51 HydrophobicContact CB-CB 4.48Å; C45-C51 VanDerWaalsContact SG-CA 3.52Å; C45-C51 WeakPolarHBondContact SG-CB 3.47Å
52	I	97.5	Very high	96.3	Very high	53 Å²	53	65.1 Å²	65.1	27%	0.272	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	120.5	171.8	-60	176.7	0	0	0	108.2	C40 L59 Q61	C40-I52 PolarHBondContact SG-N 2.87Å; I52-L59 HydrophobicContact CB-CB 4.31Å; I52-L59 PolarHBondContact N-O 2.85Å; I52-L59 PolarHBondContact O-N 3.05Å; I52-Q61 VanDerWaalsContact CD1-CD 3.45Å; I52-Q61 HydrophobicContact CD1-CG 3.81Å; I52-Q61 HydrophobicContact CG1-CG 4.5Å
53	D	96.7	Very high	96.2	Very high	48 Å²	48	66.2 Å²	66.2	26%	0.257	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	141	178.6	-153.4	39.8	0	0	0	111.4	N38 E39 C40	N38-D53 VanDerWaalsContact CA-OD1 3.22Å; N38-D53 WeakPolarHBondContact CA-OD1 3.38Å; N38-D53 WeakPolarHBondContact CA-OD2 3.47Å; N38-D53 PolarHBondContact OD1-OD1 3.14Å; E39-D53 PolarHBondContact N-OD1 2.65Å; C40-D53 PolarHBondContact N-OD1 3.23Å; C40-D53 PolarHBondContact SG-N 3.31Å
54	K	96.2	Very high	95.9	Very high	98 Å²	98	66.6 Å²	66.6	43%	0.426	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	146.1	-178.5	-65.4	-65.2	175.1	-162.1	0	108.7	A56 S57	K54-A56 PolarHBondContact O-N 3.47Å; K54-S57 CarbonylContact C-O 3.49Å; K54-S57 WeakPolarHBondContact CB-O 3.42Å; K54-S57 WeakPolarHBondContact CB-OG 3.34Å; K54-S57 PolarHBondContact N-O 2.87Å; K54-S57 CarbonylContact O-C 3.27Å; K54-S57 PolarHBondContact O-N 3.44Å
55	I	95	Very high	95.6	Very high	98 Å²	98	67.6 Å²	67.6	50%	0.503	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	117.9	175.9	-57.8	167.9	0	0	0	110.9	Y28 S57	Y28-I55 HydrophobicContact CE2-CG2 3.67Å; Y28-I55 WeakPolarHBondContact OH-CD1 3.3Å; I55-S57 PolarHBondContact O-N 2.82Å; I55-S57 VanDerWaalsContact O-N 3.16Å; I55-S57 PolarHBondContact O-OG 3.21Å
56	A	94.4	Very high	95.4	Very high	53 Å²	53	69.7 Å²	69.7	44%	0.438	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	18.3	179.5	0	0	0	0	0	114.8	D26 E39 K54	D26-A56 HydrophobicContact CB-CB 3.8Å; E39-A56 WeakPolarHBondContact OE1-CA 3.29Å; E39-A56 PolarHBondContact OE1-N 3.27Å; K54-A56 PolarHBondContact O-N 3.47Å
57	S	96.6	Very high	95.2	Very high	54 Å²	54	65.2 Å²	65.2	38%	0.378	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	178.1	-174.1	57.7	0	0	0	0	112.5	E39 K54 I55	E39-S57 WeakPolarHBondContact CB-O 3.31Å; E39-S57 PolarHBondContact OE1-N 3.49Å; E39-S57 VanDerWaalsContact OE2-O 3.13Å; K54-S57 CarbonylContact C-O 3.49Å; K54-S57 WeakPolarHBondContact CB-O 3.42Å; K54-S57 WeakPolarHBondContact CB-OG 3.34Å; K54-S57 PolarHBondContact N-O 2.87Å; K54-S57 CarbonylContact O-C 3.27Å; K54-S57 PolarHBondContact O-N 3.44Å; I55-S57 PolarHBondContact O-N 2.82Å; I55-S57 VanDerWaalsContact O-N 3.16Å; I55-S57 PolarHBondContact O-OG 3.21Å
58	F	96.7	Very high	95.1	Very high	68 Å²	68	63.2 Å²	63.2	30%	0.298	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	157.3	171.6	62.8	-89.6	0	0	0	109.5	E39 P44 I69 T70	E39-F58 HydrophobicContact CB-CB 4.14Å; E39-F58 HydrophobicContact CB-CD1 4.39Å; P44-F58 HydrophobicContact CB-CD1 4.34Å; P44-F58 HydrophobicContact CB-CD2 4.01Å; P44-F58 HydrophobicContact CB-CE1 4.02Å; P44-F58 HydrophobicContact CB-CE2 3.68Å; P44-F58 HydrophobicContact CB-CG 4.34Å; P44-F58 HydrophobicContact CB-CZ 3.68Å; P44-F58 HydrophobicContact CG-CB 4.4Å; P44-F58 HydrophobicContact CG-CD1 4.07Å; P44-F58 HydrophobicContact CG-CD2 3.6Å; P44-F58 HydrophobicContact CG-CE1 4.26Å; P44-F58 HydrophobicContact CG-CE2 3.83Å; P44-F58 HydrophobicContact CG-CG 3.74Å; P44-F58 HydrophobicContact CG-CZ 4.16Å; F58-I69 HydrophobicContact CE2-CG2 4.28Å; F58-I69 HydrophobicContact CZ-CG2 4.3Å; F58-T70 HydrophobicContact CE2-CG2 3.86Å; F58-T70 HydrophobicContact CZ-CG2 3.83Å
59	L	97.2	Very high	95.2	Very high	89 Å²	89	67.6 Å²	67.6	47%	0.466	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	120.1	172.6	176.8	67.2	0	0	0	109.8	I52	I52-L59 HydrophobicContact CB-CB 4.31Å; I52-L59 PolarHBondContact N-O 2.85Å; I52-L59 PolarHBondContact O-N 3.05Å
60	C	97.7	Very high	95.2	Very high	13 Å²	13	68.6 Å²	68.6	9%	0.088	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	119.5	171.8	-65.4	0	0	0	0	111.5	C45 C62 I69 C71	C45-C60 WeakPolarHBondContact CA-SG 3.43Å; C45-C60 HydrophobicContact CB-CB 3.75Å; C45-C60 WeakPolarHBondContact CB-SG 3.42Å; C45-C60 WeakPolarHBondContact SG-CA 3.5Å; C45-C60 WeakPolarHBondContact SG-CB 3.23Å; C45-C60 CovalentContact SG-SG 2.02Å; C45-C60 PolarHBondContact SG-SG 2.79Å; C60-C62 PolarHBondContact O-N 3.15Å; C60-I69 WeakPolarHBondContact CB-O 3.34Å; C60-I69 PolarHBondContact SG-O 3.21Å; C60-C71 VanDerWaalsContact CB-SG 3.54Å
61	Q	97	Very high	95.2	Very high	109 Å²	109	65.2 Å²	65.2	51%	0.509	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	102.9	168.1	-68	-171.6	-18	0	0	109.7	G49 S50 I52	G49-Q61 CarbonylContact C-O 3.59Å; G49-Q61 WeakPolarHBondContact CA-O 3.39Å; S50-Q61 PolarHBondContact N-O 3.45Å; S50-Q61 PolarHBondContact O-N 3.5Å; I52-Q61 VanDerWaalsContact CD1-CD 3.45Å; I52-Q61 HydrophobicContact CD1-CG 3.81Å; I52-Q61 HydrophobicContact CG1-CG 4.5Å
62	C	95.6	Very high	95.1	Very high	47 Å²	47	67.5 Å²	67.5	32%	0.318	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-75.6	141.4	-176.4	-53	0	0	0	0	112.5	C60 Y66 C71	C60-C62 PolarHBondContact O-N 3.15Å; C62-Y66 WeakPolarHBondContact CB-O 3.32Å; C62-C71 WeakPolarHBondContact CA-SG 3.18Å; C62-C71 HydrophobicContact CB-CB 3.75Å; C62-C71 WeakPolarHBondContact CB-SG 3.37Å; C62-C71 PolarHBondContact N-SG 3.34Å; C62-C71 WeakPolarHBondContact SG-CA 3.34Å; C62-C71 WeakPolarHBondContact SG-CB 3.48Å; C62-C71 CovalentContact SG-SG 2.04Å; C62-C71 PolarHBondContact SG-SG 3.09Å
63	K	93.6	Very high	94.8	Very high	116 Å²	116	70.1 Å²	70.1	50%	0.504	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-65.2	155.8	169	-77.5	180	173.8	170.5	0	110.6	G48 G65 Y66	G48-K63 WeakPolarHBondContact O-CD 3.35Å; G48-K63 WeakPolarHBondContact O-CE 3.3Å; K63-G65 PolarHBondContact O-N 2.86Å; K63-Y66 HydrophobicContact CB-CD2 4.23Å; K63-Y66 PolarHBondContact O-N 3.33Å
64	P	90	Very high	94.5	Very high	129 Å²	129	72.3 Å²	72.3	84%	0.838	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	133.8	174	-26.4	34.8	0	0	0	111.6
65	G	89.6	Confident	93.7	Very high	38 Å²	38	71.9 Å²	71.9	39%	0.392	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	5	-177.5	0	0	0	0	0	115	K63 M74 M75	K63-G65 PolarHBondContact O-N 2.86Å; G65-M74 CarbonylContact O-C 3.52Å; G65-M74 WeakPolarHBondContact O-CA 3.39Å; G65-M75 PolarHBondContact O-N 3.01Å
66	Y	93.1	Very high	92.2	Very high	62 Å²	62	75.3 Å²	75.3	24%	0.243	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	149.5	172	-64.1	-86.1	0	0	0	112.1	N47 C62 K63 Q73 M74	N47-Y66 HydrophobicContact CB-CD1 3.43Å; N47-Y66 VanDerWaalsContact CB-CD1 3.43Å; N47-Y66 HydrophobicContact CB-CD2 4.07Å; N47-Y66 HydrophobicContact CB-CE1 3.3Å; N47-Y66 HydrophobicContact CB-CE2 3.98Å; N47-Y66 HydrophobicContact CB-CG 3.79Å; N47-Y66 VanDerWaalsContact CG-CD1 3.43Å; N47-Y66 VanDerWaalsContact ND2-CD1 3.27Å; N47-Y66 WeakPolarHBondContact ND2-CD1 3.24Å; N47-Y66 VanDerWaalsContact ND2-CE1 3.31Å; N47-Y66 WeakPolarHBondContact ND2-CE1 3.28Å; N47-Y66 WeakPolarHBondContact OD1-CE1 3.46Å; C62-Y66 WeakPolarHBondContact CB-O 3.32Å; K63-Y66 HydrophobicContact CB-CD2 4.23Å; K63-Y66 PolarHBondContact O-N 3.33Å; Y66-Q73 CarbonylContact C-O 3.55Å; Y66-Q73 VanDerWaalsContact CA-O 3.23Å; Y66-Q73 WeakPolarHBondContact CA-O 3.47Å; Y66-M74 HydrophobicContact CD1-CB 4.45Å; Y66-M74 HydrophobicContact CD1-CG 3.69Å; Y66-M74 HydrophobicContact CE1-CB 4.38Å; Y66-M74 HydrophobicContact CE1-CE 3.69Å; Y66-M74 HydrophobicContact CE1-CG 3.23Å; Y66-M74 HydrophobicContact CE1-SD 4.28Å; Y66-M74 WeakPolarHBondContact OH-CE 3.26Å
67	T	92.2	Very high	90.4	Very high	58 Å²	58	81.1 Å²	81.1	36%	0.356	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	177.3	-179.1	-167.8	0	0	0	0	111.3	C71 Q72 Q73 M75	T67-C71 CarbonylContact O-C 3.52Å; T67-C71 VanDerWaalsContact O-C 3.27Å; T67-C71 VanDerWaalsContact O-CA 3.27Å; T67-C71 WeakPolarHBondContact O-CA 3Å; T67-Q72 PolarHBondContact O-N 3.37Å; T67-Q73 HydrophobicContact CG2-CB 3.74Å; T67-Q73 PolarHBondContact N-O 2.95Å; T67-Q73 WeakPolarHBondContact O-CB 3.43Å; T67-Q73 PolarHBondContact O-N 2.98Å; T67-M75 HydrophobicContact CG2-CB 4.19Å; T67-M75 HydrophobicContact CG2-SD 4.41Å
68	G	93.7	Very high	88.5	Confident	24 Å²	24	83.5 Å²	83.5	25%	0.247	44%	0.443	C	S	.	.	S	Bend	trans	93.3	163.1	-173.4	0	0	0	0	0	113	T70 C71	G68-T70 PolarHBondContact O-N 3.48Å; G68-C71 PolarHBondContact O-N 3.33Å
69	I	95.6	Very high	86.4	Confident	137 Å²	137	82.7 Å²	82.7	70%	0.703	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-35.6	-176.2	-64.8	165	0	0	0	112	F58 C60	F58-I69 HydrophobicContact CE2-CG2 4.28Å; F58-I69 HydrophobicContact CZ-CG2 4.3Å; C60-I69 WeakPolarHBondContact CB-O 3.34Å; C60-I69 PolarHBondContact SG-O 3.21Å
70	T	96.6	Very high	84.3	Confident	34 Å²	34	83.7 Å²	83.7	21%	0.209	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	18.6	179	53.1	0	0	0	0	112.2	P44 R46 F58 G68 Q72	P44-T70 HydrophobicContact CB-CG2 4.43Å; P44-T70 VanDerWaalsContact O-CB 3.24Å; P44-T70 WeakPolarHBondContact O-CB 3.46Å; P44-T70 WeakPolarHBondContact O-CG2 3.46Å; R46-T70 WeakPolarHBondContact CB-O 3.33Å; R46-T70 PolarHBondContact N-O 2.94Å; F58-T70 HydrophobicContact CE2-CG2 3.86Å; F58-T70 HydrophobicContact CZ-CG2 3.83Å; G68-T70 PolarHBondContact O-N 3.48Å; T70-Q72 VanDerWaalsContact N-OE1 3.07Å; T70-Q72 PolarHBondContact O-N 3.42Å; T70-Q72 VanDerWaalsContact O-N 3.15Å; T70-Q72 VanDerWaalsContact OG1-CD 3.3Å; T70-Q72 PolarHBondContact OG1-OE1 2.91Å
71	C	96.3	Very high	82.2	Confident	0 Å²	0	92.6 Å²	92.6	0%	0	51%	0.506	C	S	.	.	S	Bend	trans	56.8	25.2	-176.4	-48.8	0	0	0	0	114	R46 N47 C60 C62 T67 G68 Q73	R46-C71 WeakPolarHBondContact O-CB 3.14Å; N47-C71 PolarHBondContact ND2-O 3.32Å; C60-C71 VanDerWaalsContact CB-SG 3.54Å; C62-C71 WeakPolarHBondContact CA-SG 3.18Å; C62-C71 HydrophobicContact CB-CB 3.75Å; C62-C71 WeakPolarHBondContact CB-SG 3.37Å; C62-C71 PolarHBondContact N-SG 3.34Å; C62-C71 WeakPolarHBondContact SG-CA 3.34Å; C62-C71 WeakPolarHBondContact SG-CB 3.48Å; C62-C71 CovalentContact SG-SG 2.04Å; C62-C71 PolarHBondContact SG-SG 3.09Å; T67-C71 CarbonylContact O-C 3.52Å; T67-C71 VanDerWaalsContact O-C 3.27Å; T67-C71 VanDerWaalsContact O-CA 3.27Å; T67-C71 WeakPolarHBondContact O-CA 3Å; G68-C71 PolarHBondContact O-N 3.33Å; C71-Q73 VanDerWaalsContact C-N 3.35Å
72	Q	94.9	Very high	79.8	Confident	89 Å²	89	91.5 Å²	91.5	42%	0.416	50%	0.503	S	S	.	.			trans	-78.1	-19	-173.3	74.5	-75.3	13.1	0	0	113.5	R46 T67 T70	R46-Q72 HydrophobicContact CG-CB 4.31Å; T67-Q72 PolarHBondContact O-N 3.37Å; T70-Q72 VanDerWaalsContact N-OE1 3.07Å; T70-Q72 PolarHBondContact O-N 3.42Å; T70-Q72 VanDerWaalsContact O-N 3.15Å; T70-Q72 VanDerWaalsContact OG1-CD 3.3Å; T70-Q72 PolarHBondContact OG1-OE1 2.91Å
73	Q	93	Very high	77.5	Confident	108 Å²	108	99.5 Å²	99.5	51%	0.505	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.8	-178	-62.5	174.6	-17.3	0	0	109.8	Y66 T67 C71	Y66-Q73 CarbonylContact C-O 3.55Å; Y66-Q73 VanDerWaalsContact CA-O 3.23Å; Y66-Q73 WeakPolarHBondContact CA-O 3.47Å; T67-Q73 HydrophobicContact CG2-CB 3.74Å; T67-Q73 PolarHBondContact N-O 2.95Å; T67-Q73 WeakPolarHBondContact O-CB 3.43Å; T67-Q73 PolarHBondContact O-N 2.98Å; C71-Q73 VanDerWaalsContact C-N 3.35Å
74	M	88.9	Confident	75.2	Confident	94 Å²	94	102.6 Å²	102.6	46%	0.463	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	123	168.7	-73.3	164.2	168.6	0	0	109.1	G65 Y66 Y76	G65-M74 CarbonylContact O-C 3.52Å; G65-M74 WeakPolarHBondContact O-CA 3.39Å; Y66-M74 HydrophobicContact CD1-CB 4.45Å; Y66-M74 HydrophobicContact CD1-CG 3.69Å; Y66-M74 HydrophobicContact CE1-CB 4.38Å; Y66-M74 HydrophobicContact CE1-CE 3.69Å; Y66-M74 HydrophobicContact CE1-CG 3.23Å; Y66-M74 HydrophobicContact CE1-SD 4.28Å; Y66-M74 WeakPolarHBondContact OH-CE 3.26Å; M74-Y76 VanDerWaalsContact C-N 3.28Å; M74-Y76 HydrophobicContact CB-CD2 3.52Å; M74-Y76 HydrophobicContact CB-CE2 3.34Å; M74-Y76 HydrophobicContact CB-CG 4.49Å; M74-Y76 HydrophobicContact CG-CD2 4.39Å; M74-Y76 HydrophobicContact CG-CE2 3.71Å; M74-Y76 PolarHBondContact O-N 3.36Å; M74-Y76 HydrophobicContact SD-CD2 4.37Å; M74-Y76 HydrophobicContact SD-CE2 3.33Å; M74-Y76 WeakPolarHBondContact SD-CE2 3.3Å
75	M	80.3	Confident	73.1	Confident	89 Å²	89	101.1 Å²	101.1	44%	0.438	53%	0.534	S	S	.	.			trans	-87.8	70.1	172.6	-157.4	166.9	102.7	0	0	109	G65 T67 L77	G65-M75 PolarHBondContact O-N 3.01Å; T67-M75 HydrophobicContact CG2-CB 4.19Å; T67-M75 HydrophobicContact CG2-SD 4.41Å; M75-L77 PolarHBondContact O-N 3.23Å
76	Y	62.9	Low	71.4	Confident	170 Å²	170	104.4 Å²	104.4	67%	0.667	56%	0.557	S	S	*	*			trans	-82	103.6	162.7	-61.9	-69.7	0	0	0	107.3	M74	M74-Y76 VanDerWaalsContact C-N 3.28Å; M74-Y76 HydrophobicContact CB-CD2 3.52Å; M74-Y76 HydrophobicContact CB-CE2 3.34Å; M74-Y76 HydrophobicContact CB-CG 4.49Å; M74-Y76 HydrophobicContact CG-CD2 4.39Å; M74-Y76 HydrophobicContact CG-CE2 3.71Å; M74-Y76 PolarHBondContact O-N 3.36Å; M74-Y76 HydrophobicContact SD-CD2 4.37Å; M74-Y76 HydrophobicContact SD-CE2 3.33Å; M74-Y76 WeakPolarHBondContact SD-CE2 3.3Å
77	L	57.4	Low	69.7	Low	176 Å²	176	109.5 Å²	109.5	92%	0.921	58%	0.583	S	S	*	*	S	Bend	trans	62.3	61.7	159.7	-64.9	152.5	0	0	0	116.7	M75	M75-L77 PolarHBondContact O-N 3.23Å
78	S	56.3	Low	67.6	Low	103 Å²	103	108.9 Å²	108.9	72%	0.72	59%	0.588	S	S	*	*	S	Bend	trans	-147.3	114.2	150.2	-169.3	0	0	0	0	108.7
79	G	53.2	Low	65.7	Low	52 Å²	52	113.8 Å²	113.8	54%	0.536	61%	0.608	S	S	.	*	S	Bend	trans	95.1	81.2	-178.1	0	0	0	0	0	113.1	K81	G79-K81 VanDerWaalsContact C-N 3.28Å; G79-K81 PolarHBondContact O-N 3.23Å
80	S	52.5	Low	63.7	Low	110 Å²	110	108.9 Å²	108.9	77%	0.769	59%	0.592	S	S	*	*			trans	-18.6	85.9	138.3	38.7	0	0	0	0	114	L82	S80-L82 PolarHBondContact O-N 3.42Å; S80-L82 VanDerWaalsContact O-N 3.16Å
81	K	53.4	Low	61.9	Low	200 Å²	200	115.7 Å²	115.7	87%	0.87	62%	0.621	S	S	*	*			trans	-80.7	75.2	140.5	-146.7	171.8	-166.3	172.9	0	104.9	G79 R83	G79-K81 VanDerWaalsContact C-N 3.28Å; G79-K81 PolarHBondContact O-N 3.23Å; K81-R83 PolarHBondContact O-N 3.21Å
82	L	46	Very low	60.5	Low	85 Å²	85	120.5 Å²	120.5	45%	0.445	65%	0.65	S	S	.	*			trans	-54.3	101	154.8	-119.7	101.1	0	0	0	103.6	S80 M84	S80-L82 PolarHBondContact O-N 3.42Å; S80-L82 VanDerWaalsContact O-N 3.16Å; L82-M84 PolarHBondContact O-N 2.91Å
83	R	47.8	Very low	59.3	Low	216 Å²	216	118.1 Å²	118.1	82%	0.815	65%	0.65	S	S	*	*			trans	-49.4	115.1	138.8	-93.8	-176.8	179	167.3	0	102.7	K81 T85	K81-R83 PolarHBondContact O-N 3.21Å; R83-T85 PolarHBondContact O-N 3.33Å
84	M	45.3	Very low	58.7	Low	180 Å²	180	117.2 Å²	117.2	89%	0.887	65%	0.651	S	S	*	*			trans	-65.2	62.2	167.8	-63.8	168.4	76.2	0	0	107.8	L82	L82-M84 PolarHBondContact O-N 2.91Å
85	T	46.6	Very low	58.4	Low	99 Å²	99	115.1 Å²	115.1	61%	0.607	65%	0.649	S	S	*	*			trans	-82	115.8	141.4	52.8	0	0	0	0	103.2	R83 H87	R83-T85 PolarHBondContact O-N 3.33Å; T85-H87 PolarHBondContact O-N 3.25Å
86	A	54.4	Low	58.7	Low	107 Å²	107	115.2 Å²	115.2	88%	0.884	65%	0.654	S	S	*	*	S	Bend	trans	-52.5	57	-172.4	0	0	0	0	0	116.4
87	H	55.9	Low	59.9	Low	169 Å²	169	109.4 Å²	109.4	78%	0.782	64%	0.642	S	S	*	*			trans	-152.3	20.3	-164.9	-131.2	-78.2	0	0	0	114.9	T85	T85-H87 PolarHBondContact O-N 3.25Å
88	G	48.2	Very low	61.5	Low	44 Å²	44	106.1 Å²	106.1	45%	0.454	62%	0.623	S	S	.	*	S	Bend	trans	-107.3	-5.9	-174.4	0	0	0	0	0	117.2
89	D	55.2	Low	63.4	Low	127 Å²	127	107 Å²	107	68%	0.679	62%	0.618	S	S	*	*	S	Bend	trans	-109.7	22.4	170.8	-67.6	-47.8	0	0	0	111.8	H91 G93	D89-H91 PolarHBondContact O-N 3.23Å; D89-G93 WeakPolarHBondContact O-CA 3.43Å; D89-G93 PolarHBondContact O-N 3.23Å
90	G	53.1	Low	65.3	Low	35 Å²	35	106.9 Å²	106.9	36%	0.361	61%	0.613	S	S	.	*	H	α-helix	trans	-60.6	-40.7	-174.3	0	0	0	0	0	113.1	V94	G90-V94 WeakPolarHBondContact O-CB 3.29Å; G90-V94 WeakPolarHBondContact O-CG2 3.42Å; G90-V94 PolarHBondContact O-N 3.16Å
91	H	58.8	Low	67.4	Low	176 Å²	176	107.2 Å²	107.2	82%	0.815	61%	0.605	S	S	*	*	H	α-helix	trans	-77.2	-41.4	-175.9	-78.5	-69.8	0	0	0	113.6	D89 A95	D89-H91 PolarHBondContact O-N 3.23Å; H91-A95 VanDerWaalsContact O-CB 3.29Å; H91-A95 WeakPolarHBondContact O-CB 3.24Å; H91-A95 PolarHBondContact O-N 2.82Å
92	V	67	Low	69.5	Low	101 Å²	101	102.7 Å²	102.7	61%	0.612	59%	0.59	S	S	*	*	H	α-helix	trans	-71.8	-41	176.7	-175.7	0	0	0	0	109.9	A95 V96	V92-A95 PolarHBondContact O-N 3.12Å; V92-V96 HydrophobicContact CG1-CG2 4.27Å; V92-V96 WeakPolarHBondContact O-CB 3.47Å; V92-V96 VanDerWaalsContact O-CG2 3.24Å; V92-V96 WeakPolarHBondContact O-CG2 3.21Å; V92-V96 PolarHBondContact O-N 2.95Å
93	G	70.3	Confident	71.9	Confident	40 Å²	40	105 Å²	105	41%	0.412	60%	0.597	S	S	.	*	H	α-helix	trans	-61.5	-44.5	175.3	0	0	0	0	0	112.9	D89 A97	D89-G93 WeakPolarHBondContact O-CA 3.43Å; D89-G93 PolarHBondContact O-N 3.23Å; G93-A97 VanDerWaalsContact O-CB 3.24Å; G93-A97 WeakPolarHBondContact O-CB 3.41Å; G93-A97 PolarHBondContact O-N 3.28Å
94	V	78.5	Confident	74.2	Confident	89 Å²	89	100.1 Å²	100.1	54%	0.539	59%	0.585	S	S	.	*	H	α-helix	trans	-66.6	-42.6	176	171.6	0	0	0	0	110.9	G90 A97 M98	G90-V94 WeakPolarHBondContact O-CB 3.29Å; G90-V94 WeakPolarHBondContact O-CG2 3.42Å; G90-V94 PolarHBondContact O-N 3.16Å; V94-A97 PolarHBondContact O-N 3.46Å; V94-M98 HydrophobicContact CG1-CG 4.13Å; V94-M98 WeakPolarHBondContact O-CB 3.5Å; V94-M98 WeakPolarHBondContact O-CG 3.02Å; V94-M98 PolarHBondContact O-N 2.89Å
95	A	83.2	Confident	76.7	Confident	50 Å²	50	94.1 Å²	94.1	41%	0.413	56%	0.564	S	S	.	*	H	α-helix	trans	-62.3	-45.1	177.4	0	0	0	0	0	112.1	H91 V92 M98 L99	H91-A95 VanDerWaalsContact O-CB 3.29Å; H91-A95 WeakPolarHBondContact O-CB 3.24Å; H91-A95 PolarHBondContact O-N 2.82Å; V92-A95 PolarHBondContact O-N 3.12Å; A95-M98 PolarHBondContact O-N 3.33Å; A95-L99 WeakPolarHBondContact O-CB 3.45Å; A95-L99 VanDerWaalsContact O-CG 3.3Å; A95-L99 WeakPolarHBondContact O-CG 3.09Å; A95-L99 PolarHBondContact O-N 3.09Å
96	V	86.7	Confident	79.1	Confident	90 Å²	90	94 Å²	94	55%	0.545	56%	0.563	S	S	.	*	H	α-helix	trans	-64.5	-41.4	176.6	173.9	0	0	0	0	111	V92 L99 A100	V92-V96 HydrophobicContact CG1-CG2 4.27Å; V92-V96 WeakPolarHBondContact O-CB 3.47Å; V92-V96 VanDerWaalsContact O-CG2 3.24Å; V92-V96 WeakPolarHBondContact O-CG2 3.21Å; V92-V96 PolarHBondContact O-N 2.95Å; V96-L99 PolarHBondContact O-N 3.23Å; V96-A100 WeakPolarHBondContact O-CB 3.21Å; V96-A100 PolarHBondContact O-N 2.92Å
97	A	88.7	Confident	81.1	Confident	49 Å²	49	92.5 Å²	92.5	41%	0.405	54%	0.539	S	S	.	.	H	α-helix	trans	-63.8	-43	175.7	0	0	0	0	0	112.1	G93 V94 A100 L101	G93-A97 VanDerWaalsContact O-CB 3.24Å; G93-A97 WeakPolarHBondContact O-CB 3.41Å; G93-A97 PolarHBondContact O-N 3.28Å; V94-A97 PolarHBondContact O-N 3.46Å; A97-A100 PolarHBondContact O-N 3.27Å; A97-L101 WeakPolarHBondContact O-CB 3.01Å; A97-L101 VanDerWaalsContact O-CG 3.28Å; A97-L101 WeakPolarHBondContact O-CG 3.49Å; A97-L101 PolarHBondContact O-N 3Å
98	M	91.7	Very high	83	Confident	107 Å²	107	88.4 Å²	88.4	53%	0.527	53%	0.526	S	S	.	.	H	α-helix	trans	-64.3	-43.3	176.7	-70.6	-63.9	-74.6	0	0	111.5	V94 A95 L101 L102	V94-M98 HydrophobicContact CG1-CG 4.13Å; V94-M98 WeakPolarHBondContact O-CB 3.5Å; V94-M98 WeakPolarHBondContact O-CG 3.02Å; V94-M98 PolarHBondContact O-N 2.89Å; A95-M98 PolarHBondContact O-N 3.33Å; M98-L101 PolarHBondContact O-N 3.34Å; M98-L102 WeakPolarHBondContact O-CB 3.31Å; M98-L102 VanDerWaalsContact O-CG 3.26Å; M98-L102 WeakPolarHBondContact O-CG 3.33Å; M98-L102 PolarHBondContact O-N 3.11Å
99	L	94.6	Very high	85.2	Confident	120 Å²	120	88.9 Å²	88.9	63%	0.628	53%	0.526	S	S	*	.	H	α-helix	trans	-63.9	-40.2	175.2	-70.8	174	0	0	0	111.9	A95 V96 L102 F103	A95-L99 WeakPolarHBondContact O-CB 3.45Å; A95-L99 VanDerWaalsContact O-CG 3.3Å; A95-L99 WeakPolarHBondContact O-CG 3.09Å; A95-L99 PolarHBondContact O-N 3.09Å; V96-L99 PolarHBondContact O-N 3.23Å; L99-L102 PolarHBondContact O-N 2.88Å; L99-F103 WeakPolarHBondContact O-CB 3.27Å; L99-F103 PolarHBondContact O-N 3.02Å
100	A	94.6	Very high	87.1	Confident	51 Å²	51	85.6 Å²	85.6	42%	0.421	52%	0.517	S	S	.	.	H	α-helix	trans	-64.6	-43	175.8	0	0	0	0	0	112	V96 A97 F103 M104	V96-A100 WeakPolarHBondContact O-CB 3.21Å; V96-A100 PolarHBondContact O-N 2.92Å; A97-A100 PolarHBondContact O-N 3.27Å; A100-F103 PolarHBondContact O-N 3.43Å; A100-M104 VanDerWaalsContact O-CG 3.3Å; A100-M104 WeakPolarHBondContact O-CG 3.27Å; A100-M104 PolarHBondContact O-N 3.27Å
101	L	95.7	Very high	89	Confident	116 Å²	116	88 Å²	88	61%	0.607	53%	0.525	S	S	*	.	H	α-helix	trans	-64.8	-42.5	176.4	-72	173.5	0	0	0	111.9	A97 M98 M104 A105	A97-L101 WeakPolarHBondContact O-CB 3.01Å; A97-L101 VanDerWaalsContact O-CG 3.28Å; A97-L101 WeakPolarHBondContact O-CG 3.49Å; A97-L101 PolarHBondContact O-N 3Å; M98-L101 PolarHBondContact O-N 3.34Å; L101-M104 PolarHBondContact O-N 2.87Å; L101-A105 WeakPolarHBondContact O-CB 3.34Å; L101-A105 PolarHBondContact O-N 2.97Å
102	L	97	Very high	90.7	Very high	105 Å²	105	85.4 Å²	85.4	55%	0.55	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-43.5	174.7	-72.2	173.5	0	0	0	111.4	M98 L99 A105 V106	M98-L102 WeakPolarHBondContact O-CB 3.31Å; M98-L102 VanDerWaalsContact O-CG 3.26Å; M98-L102 WeakPolarHBondContact O-CG 3.33Å; M98-L102 PolarHBondContact O-N 3.11Å; L99-L102 PolarHBondContact O-N 2.88Å; L102-A105 PolarHBondContact O-N 3.25Å; L102-V106 VanDerWaalsContact O-CG2 3.32Å; L102-V106 WeakPolarHBondContact O-CG2 3.39Å; L102-V106 PolarHBondContact O-N 3.5Å
103	F	96.7	Very high	91.9	Very high	133 Å²	133	89.8 Å²	89.8	58%	0.583	51%	0.514	S	S	*	.	H	α-helix	trans	-62.3	-45	177.2	-174	-108.8	0	0	0	111.8	L99 A100 A105 V106 L107	L99-F103 WeakPolarHBondContact O-CB 3.27Å; L99-F103 PolarHBondContact O-N 3.02Å; A100-F103 PolarHBondContact O-N 3.43Å; F103-A105 PolarHBondContact O-N 3.36Å; F103-V106 PolarHBondContact O-N 2.9Å; F103-L107 HydrophobicContact CD1-CD1 3.82Å; F103-L107 HydrophobicContact CD1-CG 4.36Å; F103-L107 HydrophobicContact CE1-CD1 3.39Å; F103-L107 HydrophobicContact CE1-CG 4.09Å; F103-L107 HydrophobicContact CZ-CD1 3.85Å; F103-L107 HydrophobicContact CZ-CD2 4.27Å; F103-L107 HydrophobicContact CZ-CG 4.17Å; F103-L107 WeakPolarHBondContact O-CG 3.23Å; F103-L107 PolarHBondContact O-N 3.18Å
104	M	96.7	Very high	92.9	Very high	115 Å²	115	92.2 Å²	92.2	57%	0.567	52%	0.523	S	S	*	.	H	α-helix	trans	-64.1	-38.4	175.6	-69.4	-61.9	-73.6	0	0	112.5	A100 L101 L107 T108	A100-M104 VanDerWaalsContact O-CG 3.3Å; A100-M104 WeakPolarHBondContact O-CG 3.27Å; A100-M104 PolarHBondContact O-N 3.27Å; L101-M104 PolarHBondContact O-N 2.87Å; M104-L107 PolarHBondContact O-N 3.41Å; M104-L107 HydrophobicContact SD-CD1 4.46Å; M104-T108 WeakPolarHBondContact O-CB 3Å; M104-T108 VanDerWaalsContact O-CG2 3.3Å; M104-T108 WeakPolarHBondContact O-CG2 3.4Å; M104-T108 PolarHBondContact O-N 2.73Å; M104-T108 PolarHBondContact O-OG1 2.94Å
105	A	96.5	Very high	93.4	Very high	54 Å²	54	91.2 Å²	91.2	45%	0.446	52%	0.52	S	S	.	.	H	α-helix	trans	-63.6	-41.4	174.3	0	0	0	0	0	112	L101 L102 F103 T108 A109	L101-A105 WeakPolarHBondContact O-CB 3.34Å; L101-A105 PolarHBondContact O-N 2.97Å; L102-A105 PolarHBondContact O-N 3.25Å; F103-A105 PolarHBondContact O-N 3.36Å; A105-T108 WeakPolarHBondContact CA-OG1 3.03Å; A105-T108 PolarHBondContact O-OG1 3.46Å; A105-A109 WeakPolarHBondContact O-CB 3.45Å; A105-A109 PolarHBondContact O-N 2.94Å
106	V	96.9	Very high	93.8	Very high	96 Å²	96	93.1 Å²	93.1	58%	0.582	52%	0.517	S	S	*	.	H	α-helix	trans	-66.3	-43.1	176.2	172.3	0	0	0	0	111.3	L102 F103 A109 A110	L102-V106 VanDerWaalsContact O-CG2 3.32Å; L102-V106 WeakPolarHBondContact O-CG2 3.39Å; L102-V106 PolarHBondContact O-N 3.5Å; F103-V106 PolarHBondContact O-N 2.9Å; V106-A109 PolarHBondContact O-N 2.9Å; V106-A110 VanDerWaalsContact O-CB 3.29Å; V106-A110 WeakPolarHBondContact O-CB 2.98Å; V106-A110 PolarHBondContact O-N 2.91Å
107	L	96.5	Very high	93.9	Very high	76 Å²	76	94.8 Å²	94.8	40%	0.398	52%	0.517	S	S	.	.	H	α-helix	trans	-64.1	-41.8	177.1	-71.4	-178.7	0	0	0	112.5	F103 M104 A110 T111	F103-L107 HydrophobicContact CD1-CD1 3.82Å; F103-L107 HydrophobicContact CD1-CG 4.36Å; F103-L107 HydrophobicContact CE1-CD1 3.39Å; F103-L107 HydrophobicContact CE1-CG 4.09Å; F103-L107 HydrophobicContact CZ-CD1 3.85Å; F103-L107 HydrophobicContact CZ-CD2 4.27Å; F103-L107 HydrophobicContact CZ-CG 4.17Å; F103-L107 WeakPolarHBondContact O-CG 3.23Å; F103-L107 PolarHBondContact O-N 3.18Å; M104-L107 PolarHBondContact O-N 3.41Å; M104-L107 HydrophobicContact SD-CD1 4.46Å; L107-A110 PolarHBondContact O-N 3.3Å; L107-T111 WeakPolarHBondContact O-CB 3.03Å; L107-T111 VanDerWaalsContact O-CG2 3.31Å; L107-T111 WeakPolarHBondContact O-CG2 3.47Å; L107-T111 PolarHBondContact O-N 3.47Å; L107-T111 PolarHBondContact O-OG1 2.94Å
108	T	95.8	Very high	93.8	Very high	82 Å²	82	101.4 Å²	101.4	50%	0.503	53%	0.531	S	S	.	.	H	α-helix	trans	-66.9	-40.1	176.6	51	0	0	0	0	111.7	M104 A105 T111 Y112	M104-T108 WeakPolarHBondContact O-CB 3Å; M104-T108 VanDerWaalsContact O-CG2 3.3Å; M104-T108 WeakPolarHBondContact O-CG2 3.4Å; M104-T108 PolarHBondContact O-N 2.73Å; M104-T108 PolarHBondContact O-OG1 2.94Å; A105-T108 WeakPolarHBondContact CA-OG1 3.03Å; A105-T108 PolarHBondContact O-OG1 3.46Å; T108-T111 WeakPolarHBondContact CA-OG1 3.33Å; T108-T111 PolarHBondContact O-OG1 3.42Å; T108-Y112 VanDerWaalsContact O-CB 3.23Å; T108-Y112 WeakPolarHBondContact O-CB 3.32Å; T108-Y112 PolarHBondContact O-N 2.9Å
109	A	95.4	Very high	93.5	Very high	55 Å²	55	105.7 Å²	105.7	46%	0.455	54%	0.542	S	S	.	.	H	α-helix	trans	-64.2	-42.8	173.6	0	0	0	0	0	112.3	A105 V106 Y112 W113	A105-A109 WeakPolarHBondContact O-CB 3.45Å; A105-A109 PolarHBondContact O-N 2.94Å; V106-A109 PolarHBondContact O-N 2.9Å; A109-Y112 PolarHBondContact O-N 3.06Å; A109-W113 WeakPolarHBondContact O-CB 3.45Å; A109-W113 PolarHBondContact O-N 3.22Å
110	A	95.1	Very high	92.8	Very high	58 Å²	58	101.7 Å²	101.7	48%	0.479	52%	0.522	S	S	.	.	H	α-helix	trans	-64.9	-45.1	178.7	0	0	0	0	0	112.1	V106 L107 W113 C114	V106-A110 VanDerWaalsContact O-CB 3.29Å; V106-A110 WeakPolarHBondContact O-CB 2.98Å; V106-A110 PolarHBondContact O-N 2.91Å; L107-A110 PolarHBondContact O-N 3.3Å; A110-W113 PolarHBondContact O-N 2.89Å; A110-C114 WeakPolarHBondContact O-CB 3.37Å; A110-C114 PolarHBondContact O-N 2.91Å
111	T	93.6	Very high	92.4	Very high	86 Å²	86	105.8 Å²	105.8	53%	0.528	53%	0.531	S	S	.	.	H	α-helix	trans	-63.9	-44.8	175.9	51.1	0	0	0	0	111.3	L107 T108 W113 C114 S115	L107-T111 WeakPolarHBondContact O-CB 3.03Å; L107-T111 VanDerWaalsContact O-CG2 3.31Å; L107-T111 WeakPolarHBondContact O-CG2 3.47Å; L107-T111 PolarHBondContact O-N 3.47Å; L107-T111 PolarHBondContact O-OG1 2.94Å; T108-T111 WeakPolarHBondContact CA-OG1 3.33Å; T108-T111 PolarHBondContact O-OG1 3.42Å; T111-W113 PolarHBondContact O-N 3.49Å; T111-C114 PolarHBondContact O-N 3.4Å; T111-S115 WeakPolarHBondContact O-CB 3.49Å; T111-S115 PolarHBondContact O-N 3.49Å; T111-S115 PolarHBondContact O-OG 3.42Å; T111-S115 VanDerWaalsContact O-OG 3.12Å
112	Y	93	Very high	91.7	Very high	120 Å²	120	104.5 Å²	104.5	47%	0.471	52%	0.523	S	S	.	.	H	α-helix	trans	-57.8	-47.9	174.7	176.7	-96.4	0	0	0	112.2	T108 A109 C114 S115 R116	T108-Y112 VanDerWaalsContact O-CB 3.23Å; T108-Y112 WeakPolarHBondContact O-CB 3.32Å; T108-Y112 PolarHBondContact O-N 2.9Å; A109-Y112 PolarHBondContact O-N 3.06Å; Y112-C114 PolarHBondContact O-N 2.96Å; Y112-S115 PolarHBondContact O-N 3.39Å; Y112-R116 WeakPolarHBondContact O-CB 3.43Å; Y112-R116 PolarHBondContact O-N 2.88Å
113	W	92.1	Very high	90.8	Very high	194 Å²	194	103.4 Å²	103.4	74%	0.735	52%	0.518	S	S	*	.	H	α-helix	trans	-62.9	-44.1	178.7	-159.8	-39.6	0	0	0	111	A109 A110 T111 S115 R116 K117	A109-W113 WeakPolarHBondContact O-CB 3.45Å; A109-W113 PolarHBondContact O-N 3.22Å; A110-W113 PolarHBondContact O-N 2.89Å; T111-W113 PolarHBondContact O-N 3.49Å; W113-S115 PolarHBondContact O-N 2.94Å; W113-R116 PolarHBondContact O-N 2.89Å; W113-K117 WeakPolarHBondContact O-CB 3.48Å; W113-K117 PolarHBondContact O-N 3.3Å
114	C	92.4	Very high	90.1	Very high	90 Å²	90	105.9 Å²	105.9	61%	0.608	52%	0.523	S	S	*	.	H	α-helix	trans	-60.9	-47	178.2	-164.5	0	0	0	0	111.6	A110 T111 Y112 R116 K117 R118	A110-C114 WeakPolarHBondContact O-CB 3.37Å; A110-C114 PolarHBondContact O-N 2.91Å; T111-C114 PolarHBondContact O-N 3.4Å; Y112-C114 PolarHBondContact O-N 2.96Å; C114-R116 PolarHBondContact O-N 3.47Å; C114-K117 PolarHBondContact O-N 3.41Å; C114-R118 PolarHBondContact O-N 3.43Å
115	S	89.6	Confident	89.4	Confident	68 Å²	68	103.4 Å²	103.4	48%	0.476	52%	0.517	S	S	.	.	H	α-helix	trans	-61	-42.5	175.3	-62.8	0	0	0	0	112.2	T111 Y112 W113 R118 R119	T111-S115 WeakPolarHBondContact O-CB 3.49Å; T111-S115 PolarHBondContact O-N 3.49Å; T111-S115 PolarHBondContact O-OG 3.42Å; T111-S115 VanDerWaalsContact O-OG 3.12Å; Y112-S115 PolarHBondContact O-N 3.39Å; W113-S115 PolarHBondContact O-N 2.94Å; S115-R118 PolarHBondContact O-N 2.93Å; S115-R119 WeakPolarHBondContact O-CG 3.43Å; S115-R119 PolarHBondContact O-N 3.27Å
116	R	89.6	Confident	88.6	Confident	91 Å²	91	106 Å²	106	34%	0.343	52%	0.523	S	S	.	.	H	α-helix	trans	-64.1	-43.8	177.7	-172.5	171.6	177.8	-176.8	-7.1	111.7	Y112 W113 C114 R118 R119 T120	Y112-R116 WeakPolarHBondContact O-CB 3.43Å; Y112-R116 PolarHBondContact O-N 2.88Å; W113-R116 PolarHBondContact O-N 2.89Å; C114-R116 PolarHBondContact O-N 3.47Å; R116-R118 VanDerWaalsContact C-N 3.31Å; R116-R118 PolarHBondContact O-N 2.94Å; R116-R119 PolarHBondContact O-N 2.93Å; R116-T120 WeakPolarHBondContact O-CG2 3.27Å; R116-T120 PolarHBondContact O-N 2.89Å; R116-T120 PolarHBondContact O-OG1 2.92Å
117	K	89.1	Confident	87.7	Confident	124 Å²	124	105.3 Å²	105.3	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-63.6	-35.9	176.6	-167.2	173.7	-173.3	175.6	0	111.9	W113 C114 T120 K121	W113-K117 WeakPolarHBondContact O-CB 3.48Å; W113-K117 PolarHBondContact O-N 3.3Å; C114-K117 PolarHBondContact O-N 3.41Å; K117-T120 PolarHBondContact O-OG1 3.33Å; K117-T120 VanDerWaalsContact O-OG1 3.09Å; K117-K121 WeakPolarHBondContact O-CB 3.17Å; K117-K121 WeakPolarHBondContact O-CG 3.2Å; K117-K121 PolarHBondContact O-N 3.46Å; K117-K121 VanDerWaalsContact O-N 3.11Å
118	R	87.2	Confident	86.9	Confident	188 Å²	188	104.7 Å²	104.7	71%	0.709	52%	0.515	S	S	*	.	H	α-helix	trans	-67.6	-45.9	174.2	-165	179.8	-130.4	-178.8	3.7	111.4	C114 S115 R116 K121 I122	C114-R118 PolarHBondContact O-N 3.43Å; S115-R118 PolarHBondContact O-N 2.93Å; R116-R118 VanDerWaalsContact C-N 3.31Å; R116-R118 PolarHBondContact O-N 2.94Å; R118-K121 PolarHBondContact O-N 2.94Å; R118-I122 HydrophobicContact CG-CD1 4.11Å; R118-I122 WeakPolarHBondContact O-CG1 3.3Å; R118-I122 PolarHBondContact O-N 2.89Å
119	R	85.8	Confident	86.2	Confident	197 Å²	197	105 Å²	105	74%	0.743	51%	0.511	S	S	*	.	H	α-helix	trans	-61	-45	176.9	-74.6	-177.7	-177.1	-175	1.9	112.1	S115 R116 K121 I122 L123	S115-R119 WeakPolarHBondContact O-CG 3.43Å; S115-R119 PolarHBondContact O-N 3.27Å; R116-R119 PolarHBondContact O-N 2.93Å; R119-K121 PolarHBondContact O-N 3.38Å; R119-I122 PolarHBondContact O-N 2.91Å; R119-L123 WeakPolarHBondContact O-CB 3.37Å; R119-L123 PolarHBondContact O-N 3.42Å
120	T	79.1	Confident	85.5	Confident	36 Å²	36	106.9 Å²	106.9	22%	0.221	51%	0.51	C	S	.	.	H	α-helix	trans	-66.4	-37.1	178.4	55.6	0	0	0	0	112.2	R116 K117 R124 F158	R116-T120 WeakPolarHBondContact O-CG2 3.27Å; R116-T120 PolarHBondContact O-N 2.89Å; R116-T120 PolarHBondContact O-OG1 2.92Å; K117-T120 PolarHBondContact O-OG1 3.33Å; K117-T120 VanDerWaalsContact O-OG1 3.09Å; T120-R124 VanDerWaalsContact O-CB 3.32Å; T120-R124 WeakPolarHBondContact O-CB 3.24Å; T120-R124 VanDerWaalsContact O-CG 3.24Å; T120-R124 WeakPolarHBondContact O-CG 3.45Å; T120-R124 PolarHBondContact O-N 2.83Å; T120-F158 HydrophobicContact CG2-CE1 4.18Å
121	K	86.2	Confident	84.5	Confident	138 Å²	138	106.7 Å²	106.7	60%	0.6	50%	0.5	S	S	*	.	H	α-helix	trans	-61.9	-47.3	172.4	-79.2	-175.9	177.3	-169.3	0	112.2	K117 R118 R119 R124 S125	K117-K121 WeakPolarHBondContact O-CB 3.17Å; K117-K121 WeakPolarHBondContact O-CG 3.2Å; K117-K121 PolarHBondContact O-N 3.46Å; K117-K121 VanDerWaalsContact O-N 3.11Å; R118-K121 PolarHBondContact O-N 2.94Å; R119-K121 PolarHBondContact O-N 3.38Å; K121-R124 PolarHBondContact O-N 2.97Å; K121-S125 PolarHBondContact O-N 2.65Å; K121-S125 PolarHBondContact O-OG 3.36Å
122	I	82.6	Confident	83.8	Confident	88 Å²	88	107 Å²	107	45%	0.451	49%	0.494	S	S	.	.	H	α-helix	trans	-63.5	-46	178.7	-66.8	167.3	0	0	0	110.5	R118 R119 R124 S125 L126	R118-I122 HydrophobicContact CG-CD1 4.11Å; R118-I122 WeakPolarHBondContact O-CG1 3.3Å; R118-I122 PolarHBondContact O-N 2.89Å; R119-I122 PolarHBondContact O-N 2.91Å; I122-R124 PolarHBondContact O-N 2.89Å; I122-S125 WeakPolarHBondContact CA-OG 3.22Å; I122-S125 PolarHBondContact O-N 3.33Å; I122-S125 VanDerWaalsContact O-N 3.17Å; I122-S125 PolarHBondContact O-OG 2.91Å; I122-L126 HydrophobicContact CG2-CD1 3.91Å; I122-L126 HydrophobicContact CG2-CG 4.35Å; I122-L126 WeakPolarHBondContact O-CG 3.16Å; I122-L126 PolarHBondContact O-N 2.92Å
123	L	77.5	Confident	83.3	Confident	83 Å²	83	109.4 Å²	109.4	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-61.5	-43.8	178.5	-172	67.3	0	0	0	111.4	R119 S125 L126 L127 F158	R119-L123 WeakPolarHBondContact O-CB 3.37Å; R119-L123 PolarHBondContact O-N 3.42Å; L123-S125 PolarHBondContact O-N 3.36Å; L123-L126 PolarHBondContact O-N 2.89Å; L123-L127 VanDerWaalsContact O-CB 3.32Å; L123-L127 WeakPolarHBondContact O-CB 3.34Å; L123-L127 PolarHBondContact O-N 3Å; L123-F158 HydrophobicContact CD2-CD2 4.23Å; L123-F158 HydrophobicContact CD2-CE1 4.39Å; L123-F158 HydrophobicContact CD2-CE2 3.41Å; L123-F158 VanDerWaalsContact CD2-CE2 3.41Å; L123-F158 HydrophobicContact CD2-CZ 3.5Å
124	R	81.1	Confident	82.6	Confident	184 Å²	184	106.5 Å²	106.5	69%	0.694	49%	0.491	S	S	*	.	H	α-helix	trans	-60.7	-42.6	173.9	-76.2	177	-177.1	-178.3	-0.5	111.7	T120 K121 I122 T128	T120-R124 VanDerWaalsContact O-CB 3.32Å; T120-R124 WeakPolarHBondContact O-CB 3.24Å; T120-R124 VanDerWaalsContact O-CG 3.24Å; T120-R124 WeakPolarHBondContact O-CG 3.45Å; T120-R124 PolarHBondContact O-N 2.83Å; K121-R124 PolarHBondContact O-N 2.97Å; I122-R124 PolarHBondContact O-N 2.89Å; R124-T128 VanDerWaalsContact O-CB 3.25Å; R124-T128 WeakPolarHBondContact O-CB 3.38Å; R124-T128 PolarHBondContact O-N 3.35Å; R124-T128 PolarHBondContact O-OG1 2.9Å
125	S	81.9	Confident	81.7	Confident	64 Å²	64	105.5 Å²	105.5	45%	0.448	48%	0.479	S	S	.	.	H	α-helix	trans	-65.5	-40.2	176.5	59.6	0	0	0	0	113.1	K121 I122 L123 T128 E129	K121-S125 PolarHBondContact O-N 2.65Å; K121-S125 PolarHBondContact O-OG 3.36Å; I122-S125 WeakPolarHBondContact CA-OG 3.22Å; I122-S125 PolarHBondContact O-N 3.33Å; I122-S125 VanDerWaalsContact O-N 3.17Å; I122-S125 PolarHBondContact O-OG 2.91Å; L123-S125 PolarHBondContact O-N 3.36Å; S125-T128 PolarHBondContact O-N 2.8Å; S125-E129 WeakPolarHBondContact O-CB 3.43Å; S125-E129 WeakPolarHBondContact O-CG 3.4Å; S125-E129 PolarHBondContact O-N 3.16Å
126	L	81.2	Confident	81.3	Confident	108 Å²	108	110.2 Å²	110.2	57%	0.565	49%	0.487	S	S	*	.	H	α-helix	trans	-67.2	-45.3	177.2	-74.2	171.7	0	0	0	111.3	I122 L123 T128 E129 E130	I122-L126 HydrophobicContact CG2-CD1 3.91Å; I122-L126 HydrophobicContact CG2-CG 4.35Å; I122-L126 WeakPolarHBondContact O-CG 3.16Å; I122-L126 PolarHBondContact O-N 2.92Å; L123-L126 PolarHBondContact O-N 2.89Å; L126-T128 VanDerWaalsContact C-N 3.33Å; L126-T128 PolarHBondContact O-N 3.36Å; L126-E129 PolarHBondContact O-N 2.69Å; L126-E130 WeakPolarHBondContact O-CB 3.25Å; L126-E130 PolarHBondContact O-N 3.07Å
127	L	77.5	Confident	80.8	Confident	82 Å²	82	111.9 Å²	111.9	43%	0.429	50%	0.503	S	S	.	.	H	α-helix	trans	-61.1	-45.2	175.9	-170.2	68.2	0	0	0	110.1	L123 E129 E130 M131	L123-L127 VanDerWaalsContact O-CB 3.32Å; L123-L127 WeakPolarHBondContact O-CB 3.34Å; L123-L127 PolarHBondContact O-N 3Å; L127-E129 PolarHBondContact O-N 2.77Å; L127-E130 PolarHBondContact O-N 3.34Å; L127-M131 HydrophobicContact CG-CG 4.37Å; L127-M131 HydrophobicContact CG-SD 4.08Å; L127-M131 WeakPolarHBondContact O-CB 3.48Å; L127-M131 WeakPolarHBondContact O-CG 3.41Å; L127-M131 PolarHBondContact O-N 3.41Å
128	T	79.3	Confident	80	Confident	62 Å²	62	107.4 Å²	107.4	38%	0.38	49%	0.487	S	S	.	.	H	α-helix	trans	-61.4	-42.1	177.9	-56.1	0	0	0	0	111.9	R124 S125 L126 K132	R124-T128 VanDerWaalsContact O-CB 3.25Å; R124-T128 WeakPolarHBondContact O-CB 3.38Å; R124-T128 PolarHBondContact O-N 3.35Å; R124-T128 PolarHBondContact O-OG1 2.9Å; S125-T128 PolarHBondContact O-N 2.8Å; L126-T128 VanDerWaalsContact C-N 3.33Å; L126-T128 PolarHBondContact O-N 3.36Å; T128-K132 HydrophobicContact CG2-CD 4.44Å; T128-K132 WeakPolarHBondContact O-CB 3.43Å; T128-K132 VanDerWaalsContact O-CG 3.27Å; T128-K132 WeakPolarHBondContact O-CG 3.07Å; T128-K132 PolarHBondContact O-N 2.71Å
129	E	81.8	Confident	79.3	Confident	90 Å²	90	108 Å²	108	42%	0.421	49%	0.494	S	S	.	.	H	α-helix	trans	-70.7	-36.1	176.9	-75.5	-52.5	131.9	0	0	112.8	S125 L126 L127 K132 R133	S125-E129 WeakPolarHBondContact O-CB 3.43Å; S125-E129 WeakPolarHBondContact O-CG 3.4Å; S125-E129 PolarHBondContact O-N 3.16Å; L126-E129 PolarHBondContact O-N 2.69Å; L127-E129 PolarHBondContact O-N 2.77Å; E129-K132 PolarHBondContact O-N 2.97Å; E129-K132 WeakPolarHBondContact OE1-CD 3.25Å; E129-K132 IonicContact OE1-NZ 3.53Å; E129-K132 PolarHBondContact OE1-NZ 3.46Å; E129-R133 VanDerWaalsContact O-CB 3.28Å; E129-R133 WeakPolarHBondContact O-CB 3.5Å; E129-R133 PolarHBondContact O-N 2.99Å
130	E	80.9	Confident	78.8	Confident	93 Å²	93	103.9 Å²	103.9	44%	0.435	49%	0.487	S	S	.	.	H	α-helix	trans	-66	-43.3	173.1	-165.8	176.6	166.1	0	0	111.2	L126 L127 R133 R134	L126-E130 WeakPolarHBondContact O-CB 3.25Å; L126-E130 PolarHBondContact O-N 3.07Å; L127-E130 PolarHBondContact O-N 3.34Å; E130-R133 WeakPolarHBondContact O-CB 3.03Å; E130-R133 PolarHBondContact O-N 2.81Å; E130-R134 WeakPolarHBondContact O-CG 3.4Å; E130-R134 PolarHBondContact O-N 3.43Å; E130-R134 IonicContact OE1-CZ 3.42Å; E130-R134 IonicContact OE1-NE 2.82Å; E130-R134 PolarHBondContact OE1-NE 3.18Å; E130-R134 IonicContact OE1-NH2 2.8Å; E130-R134 PolarHBondContact OE1-NH2 3.02Å
131	M	72.6	Confident	78.5	Confident	55 Å²	55	107.5 Å²	107.5	27%	0.271	51%	0.514	S	S	.	.	H	α-helix	trans	-58	-49.7	173.4	-69.4	173.7	85	0	0	111	L127 R133 R134 L135 L151	L127-M131 HydrophobicContact CG-CG 4.37Å; L127-M131 HydrophobicContact CG-SD 4.08Å; L127-M131 WeakPolarHBondContact O-CB 3.48Å; L127-M131 WeakPolarHBondContact O-CG 3.41Å; L127-M131 PolarHBondContact O-N 3.41Å; M131-R133 VanDerWaalsContact C-N 3.29Å; M131-R133 PolarHBondContact O-N 2.04Å; M131-R134 PolarHBondContact O-N 2.8Å; M131-L135 WeakPolarHBondContact O-CG 3.49Å; M131-L135 PolarHBondContact O-N 3.19Å; M131-L151 HydrophobicContact CB-CD1 4.26Å; M131-L151 HydrophobicContact CE-CB 3.98Å; M131-L151 HydrophobicContact CE-CD1 3.81Å; M131-L151 HydrophobicContact CE-CG 4.37Å; M131-L151 HydrophobicContact CG-CD1 3.79Å; M131-L151 HydrophobicContact CG-CD2 4.06Å; M131-L151 HydrophobicContact CG-CG 4.49Å
132	K	79.7	Confident	78	Confident	92 Å²	92	105.6 Å²	105.6	40%	0.4	51%	0.514	S	S	.	.	H	α-helix	trans	-59.9	-38.1	175.2	-74.8	173.9	-174	170.1	0	112.2	T128 E129 R136	T128-K132 HydrophobicContact CG2-CD 4.44Å; T128-K132 WeakPolarHBondContact O-CB 3.43Å; T128-K132 VanDerWaalsContact O-CG 3.27Å; T128-K132 WeakPolarHBondContact O-CG 3.07Å; T128-K132 PolarHBondContact O-N 2.71Å; E129-K132 PolarHBondContact O-N 2.97Å; E129-K132 WeakPolarHBondContact OE1-CD 3.25Å; E129-K132 IonicContact OE1-NZ 3.53Å; E129-K132 PolarHBondContact OE1-NZ 3.46Å; K132-R136 WeakPolarHBondContact O-CG 3.47Å; K132-R136 PolarHBondContact O-N 3.03Å
133	R	82.4	Confident	77.6	Confident	171 Å²	171	103.4 Å²	103.4	65%	0.645	51%	0.507	S	S	*	.	H	α-helix	trans	-67.7	-43.1	178.4	-170.4	178.9	-174.5	-179.2	1.5	111.8	E129 E130 M131 L135 R136 N137	E129-R133 VanDerWaalsContact O-CB 3.28Å; E129-R133 WeakPolarHBondContact O-CB 3.5Å; E129-R133 PolarHBondContact O-N 2.99Å; E130-R133 WeakPolarHBondContact O-CB 3.03Å; E130-R133 PolarHBondContact O-N 2.81Å; M131-R133 VanDerWaalsContact C-N 3.29Å; M131-R133 PolarHBondContact O-N 2.04Å; R133-L135 VanDerWaalsContact C-N 3.35Å; R133-R136 PolarHBondContact O-N 3.49Å; R133-N137 PolarHBondContact O-N 3.07Å
134	R	77.7	Confident	77.3	Confident	133 Å²	133	100.7 Å²	100.7	50%	0.502	50%	0.496	S	S	.	.	H	α-helix	trans	-64.6	-39.9	176.2	-69	-174.6	-174.8	-153.1	4.3	111.6	E130 M131 N137 S138 V147	E130-R134 WeakPolarHBondContact O-CG 3.4Å; E130-R134 PolarHBondContact O-N 3.43Å; E130-R134 IonicContact OE1-CZ 3.42Å; E130-R134 IonicContact OE1-NE 2.82Å; E130-R134 PolarHBondContact OE1-NE 3.18Å; E130-R134 IonicContact OE1-NH2 2.8Å; E130-R134 PolarHBondContact OE1-NH2 3.02Å; M131-R134 PolarHBondContact O-N 2.8Å; R134-N137 PolarHBondContact O-N 3.33Å; R134-S138 PolarHBondContact O-N 2.03Å; R134-V147 HydrophobicContact CB-CG1 3.81Å
135	L	73.8	Confident	77	Confident	69 Å²	69	96.8 Å²	96.8	36%	0.361	49%	0.489	S	S	.	.	H	α-helix	trans	-64	-44.1	174.7	-75.4	164.3	0	0	0	112.5	M131 R133 N137 S138 A144	M131-L135 WeakPolarHBondContact O-CG 3.49Å; M131-L135 PolarHBondContact O-N 3.19Å; R133-L135 VanDerWaalsContact C-N 3.35Å; L135-N137 VanDerWaalsContact C-N 3.29Å; L135-N137 PolarHBondContact O-N 3.47Å; L135-S138 WeakPolarHBondContact O-CB 3.44Å; L135-S138 PolarHBondContact O-N 2.02Å; L135-A144 HydrophobicContact CD2-CB 4.01Å
136	R	79.8	Confident	76.8	Confident	166 Å²	166	101.2 Å²	101.2	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-62.2	-31.3	177.5	-79.3	-171.8	-66.4	-102	0.3	114.1	K132 R133 S138	K132-R136 WeakPolarHBondContact O-CG 3.47Å; K132-R136 PolarHBondContact O-N 3.03Å; R133-R136 PolarHBondContact O-N 3.49Å; R136-S138 VanDerWaalsContact C-N 3.33Å
137	N	79.6	Confident	76.3	Confident	127 Å²	127	97.9 Å²	97.9	68%	0.679	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-5.7	-180	-78.2	0.8	0	0	0	113.6	R133 R134 L135 K139	R133-N137 PolarHBondContact O-N 3.07Å; R134-N137 PolarHBondContact O-N 3.33Å; L135-N137 VanDerWaalsContact C-N 3.29Å; L135-N137 PolarHBondContact O-N 3.47Å; N137-K139 PolarHBondContact O-N 2.84Å
138	S	73.1	Confident	75.8	Confident	29 Å²	29	101 Å²	101	20%	0.203	49%	0.491	C	S	.	.			trans	-75.9	117.6	178	175.1	0	0	0	0	110.6	R134 L135 R136 D140 S143 A144	R134-S138 PolarHBondContact O-N 2.03Å; L135-S138 WeakPolarHBondContact O-CB 3.44Å; L135-S138 PolarHBondContact O-N 2.02Å; R136-S138 VanDerWaalsContact C-N 3.33Å; S138-D140 PolarHBondContact OG-O 2.75Å; S138-S143 VanDerWaalsContact OG-C 3.24Å; S138-S143 VanDerWaalsContact OG-CB 3.26Å; S138-S143 WeakPolarHBondContact OG-CB 3.47Å; S138-S143 PolarHBondContact OG-OG 2.73Å; S138-A144 WeakPolarHBondContact OG-CA 3.35Å; S138-A144 PolarHBondContact OG-N 3.29Å
139	K	72.5	Confident	75.4	Confident	201 Å²	201	102.8 Å²	102.8	87%	0.874	50%	0.497	S	S	*	.	S	Bend	trans	-75	-22.7	-177.5	-75.4	179.5	176	178.2	0	114.4	N137	N137-K139 PolarHBondContact O-N 2.84Å
140	D	75.5	Confident	74.8	Confident	110 Å²	110	101.1 Å²	101.1	59%	0.588	50%	0.499	S	S	*	.	S	Bend	trans	-131.5	155.9	179.4	-66.9	-47.3	0	0	0	112.8	S138 T142 S143 A144	S138-D140 PolarHBondContact OG-O 2.75Å; D140-T142 PolarHBondContact O-N 3.15Å; D140-S143 PolarHBondContact N-OG 3.25Å; D140-S143 PolarHBondContact O-N 3.31Å; D140-S143 VanDerWaalsContact O-N 3.16Å; D140-S143 PolarHBondContact O-OG 2.89Å; D140-A144 PolarHBondContact O-N 3.49Å; D140-A144 VanDerWaalsContact O-N 3.14Å
141	S	71.3	Confident	73.9	Confident	112 Å²	112	98.1 Å²	98.1	78%	0.783	49%	0.486	S	S	*	.	H	α-helix	trans	-60	-33.9	178.7	-57	0	0	0	0	112.9	A144 L145	S141-A144 PolarHBondContact O-N 3.48Å; S141-L145 PolarHBondContact O-N 3.2Å
142	T	76.6	Confident	73.4	Confident	99 Å²	99	98.5 Å²	98.5	61%	0.607	49%	0.494	S	S	*	.	H	α-helix	trans	-68.7	-37.4	176.5	17.7	0	0	0	0	112.4	D140 A144 K146	D140-T142 PolarHBondContact O-N 3.15Å; T142-A144 VanDerWaalsContact C-N 3.34Å; T142-K146 WeakPolarHBondContact O-CG 3.02Å; T142-K146 PolarHBondContact O-N 2.98Å; T142-K146 VanDerWaalsContact O-N 3.11Å
143	S	73.2	Confident	72.4	Confident	42 Å²	42	101.3 Å²	101.3	29%	0.294	51%	0.509	S	S	.	.	H	α-helix	trans	-70.8	-32.1	174.3	42.4	0	0	0	0	111.9	S138 D140 K146 V147	S138-S143 VanDerWaalsContact OG-C 3.24Å; S138-S143 VanDerWaalsContact OG-CB 3.26Å; S138-S143 WeakPolarHBondContact OG-CB 3.47Å; S138-S143 PolarHBondContact OG-OG 2.73Å; D140-S143 PolarHBondContact N-OG 3.25Å; D140-S143 PolarHBondContact O-N 3.31Å; D140-S143 VanDerWaalsContact O-N 3.16Å; D140-S143 PolarHBondContact O-OG 2.89Å; S143-K146 PolarHBondContact O-N 2.88Å; S143-V147 WeakPolarHBondContact O-CG2 3.16Å; S143-V147 PolarHBondContact O-N 3.36Å; S143-V147 VanDerWaalsContact O-N 3.08Å
144	A	72.1	Confident	71.2	Confident	26 Å²	26	99.1 Å²	99.1	22%	0.215	51%	0.51	C	S	.	.	H	α-helix	trans	-67.9	-40.9	175.9	0	0	0	0	0	111	L135 S138 D140 S141 T142 V147 Y148	L135-A144 HydrophobicContact CD2-CB 4.01Å; S138-A144 WeakPolarHBondContact OG-CA 3.35Å; S138-A144 PolarHBondContact OG-N 3.29Å; D140-A144 PolarHBondContact O-N 3.49Å; D140-A144 VanDerWaalsContact O-N 3.14Å; S141-A144 PolarHBondContact O-N 3.48Å; T142-A144 VanDerWaalsContact C-N 3.34Å; A144-V147 PolarHBondContact O-N 3.29Å; A144-Y148 PolarHBondContact O-N 2.88Å
145	L	73.4	Confident	70.2	Confident	102 Å²	102	100.7 Å²	100.7	53%	0.534	52%	0.523	S	S	.	.	H	α-helix	trans	-64.6	-40.4	175.7	-170.4	66.4	0	0	0	112.2	S141 V147 Y148 L149	S141-L145 PolarHBondContact O-N 3.2Å; L145-V147 VanDerWaalsContact C-N 3.34Å; L145-V147 PolarHBondContact O-N 3.02Å; L145-Y148 PolarHBondContact O-N 3.16Å; L145-L149 HydrophobicContact CG-CD1 4.27Å; L145-L149 WeakPolarHBondContact O-CG 3.13Å; L145-L149 PolarHBondContact O-N 3.12Å
146	K	77.7	Confident	69	Low	157 Å²	157	103.7 Å²	103.7	68%	0.683	54%	0.538	S	S	*	.	H	α-helix	trans	-60.9	-41.9	173.8	-75.6	179.3	179.6	-178.2	0	112.3	T142 S143 A150	T142-K146 WeakPolarHBondContact O-CG 3.02Å; T142-K146 PolarHBondContact O-N 2.98Å; T142-K146 VanDerWaalsContact O-N 3.11Å; S143-K146 PolarHBondContact O-N 2.88Å; K146-A150 WeakPolarHBondContact O-CB 3.5Å; K146-A150 PolarHBondContact O-N 3.4Å; K146-A150 VanDerWaalsContact O-N 3.08Å
147	V	72	Confident	67.5	Low	37 Å²	37	102.4 Å²	102.4	22%	0.224	54%	0.539	C	S	.	.	H	α-helix	trans	-62.6	-44.9	174.6	170.8	0	0	0	0	110.4	R134 S143 A144 L145 A150 L151	R134-V147 HydrophobicContact CB-CG1 3.81Å; S143-V147 WeakPolarHBondContact O-CG2 3.16Å; S143-V147 PolarHBondContact O-N 3.36Å; S143-V147 VanDerWaalsContact O-N 3.08Å; A144-V147 PolarHBondContact O-N 3.29Å; L145-V147 VanDerWaalsContact C-N 3.34Å; L145-V147 PolarHBondContact O-N 3.02Å; V147-A150 PolarHBondContact O-N 2.9Å; V147-L151 HydrophobicContact CG1-CD1 3.69Å; V147-L151 WeakPolarHBondContact O-CD1 3.01Å; V147-L151 WeakPolarHBondContact O-CG 3.47Å; V147-L151 PolarHBondContact O-N 3.28Å
148	Y	67.3	Low	65.9	Low	148 Å²	148	103.8 Å²	103.8	58%	0.58	54%	0.539	S	S	*	.	H	α-helix	trans	-61.8	-44.8	178.7	-167.4	-89.7	0	0	0	112.9	A144 L145 L151 S152	A144-Y148 PolarHBondContact O-N 2.88Å; L145-Y148 PolarHBondContact O-N 3.16Å; Y148-L151 PolarHBondContact O-N 3.46Å; Y148-S152 PolarHBondContact O-N 2.98Å
149	L	71.2	Confident	64.5	Low	99 Å²	99	111.3 Å²	111.3	52%	0.518	56%	0.563	S	S	.	*	H	α-helix	trans	-64	-46.3	178.4	-72.5	169.4	0	0	0	112.1	L145 L151 S152	L145-L149 HydrophobicContact CG-CD1 4.27Å; L145-L149 WeakPolarHBondContact O-CG 3.13Å; L145-L149 PolarHBondContact O-N 3.12Å; L149-L151 PolarHBondContact O-N 2.87Å; L149-S152 PolarHBondContact O-N 3.34Å; L149-S152 VanDerWaalsContact O-N 3.14Å; L149-S152 PolarHBondContact O-OG 3.1Å
150	A	68.2	Low	63.2	Low	55 Å²	55	103.3 Å²	103.3	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-61	-28.6	178.1	0	0	0	0	0	113	K146 V147	K146-A150 WeakPolarHBondContact O-CB 3.5Å; K146-A150 PolarHBondContact O-N 3.4Å; K146-A150 VanDerWaalsContact O-N 3.08Å; V147-A150 PolarHBondContact O-N 2.9Å
151	L	63	Low	62.1	Low	30 Å²	30	102.9 Å²	102.9	16%	0.157	54%	0.535	C	S	.	.	H	α-helix	trans	-80.3	-24.1	179.6	-69.2	163.4	0	0	0	113.3	M131 V147 Y148 L149 E153	M131-L151 HydrophobicContact CB-CD1 4.26Å; M131-L151 HydrophobicContact CE-CB 3.98Å; M131-L151 HydrophobicContact CE-CD1 3.81Å; M131-L151 HydrophobicContact CE-CG 4.37Å; M131-L151 HydrophobicContact CG-CD1 3.79Å; M131-L151 HydrophobicContact CG-CD2 4.06Å; M131-L151 HydrophobicContact CG-CG 4.49Å; V147-L151 HydrophobicContact CG1-CD1 3.69Å; V147-L151 WeakPolarHBondContact O-CD1 3.01Å; V147-L151 WeakPolarHBondContact O-CG 3.47Å; V147-L151 PolarHBondContact O-N 3.28Å; Y148-L151 PolarHBondContact O-N 3.46Å; L149-L151 PolarHBondContact O-N 2.87Å; L151-E153 VanDerWaalsContact C-N 3.26Å; L151-E153 PolarHBondContact O-N 3.44Å
152	S	60.8	Low	61	Low	64 Å²	64	105.7 Å²	105.7	45%	0.448	53%	0.534	S	S	.	.	H	α-helix	trans	-71.9	-21.2	177.9	70.7	0	0	0	0	113.3	Y148 L149	Y148-S152 PolarHBondContact O-N 2.98Å; L149-S152 PolarHBondContact O-N 3.34Å; L149-S152 VanDerWaalsContact O-N 3.14Å; L149-S152 PolarHBondContact O-OG 3.1Å
153	E	59.8	Low	59.8	Low	151 Å²	151	107.7 Å²	107.7	71%	0.706	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-25.2	180	-63.9	-177	140.6	0	0	112.6	L151	L151-E153 VanDerWaalsContact C-N 3.26Å; L151-E153 PolarHBondContact O-N 3.44Å
154	D	57.1	Low	58.6	Low	125 Å²	125	110.5 Å²	110.5	67%	0.668	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-86.1	-16.5	-175.3	-84.4	-26.9	0	0	0	114.6	I156 Q157	D154-I156 PolarHBondContact O-N 2.88Å; D154-I156 VanDerWaalsContact O-N 3.15Å; D154-Q157 PolarHBondContact O-N 3.09Å
155	E	55.4	Low	57.6	Low	165 Å²	165	115 Å²	115	77%	0.771	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-69.4	-11.4	-177.6	-116.5	-173.5	149.7	0	0	114
156	I	49.3	Very low	56.7	Low	132 Å²	132	112.8 Å²	112.8	68%	0.677	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-82.6	-17.9	-175.8	-62.2	175.2	0	0	0	112.5	D154	D154-I156 PolarHBondContact O-N 2.88Å; D154-I156 VanDerWaalsContact O-N 3.15Å
157	Q	48.7	Very low	56.1	Low	140 Å²	140	109 Å²	109	65%	0.654	56%	0.56	S	S	*	*	S	Bend	trans	-91	-5.5	-169.3	-150.5	105.7	-34.2	0	0	114.9	D154 R159	D154-Q157 PolarHBondContact O-N 3.09Å; Q157-R159 PolarHBondContact O-N 2.78Å
158	F	45.6	Very low	55.9	Low	156 Å²	156	111.2 Å²	111.2	68%	0.684	58%	0.577	S	S	*	*			trans	-92.5	51	-176.8	-147.2	-93.3	0	0	0	113.2	T120 L123	T120-F158 HydrophobicContact CG2-CE1 4.18Å; L123-F158 HydrophobicContact CD2-CD2 4.23Å; L123-F158 HydrophobicContact CD2-CE1 4.39Å; L123-F158 HydrophobicContact CD2-CE2 3.41Å; L123-F158 VanDerWaalsContact CD2-CE2 3.41Å; L123-F158 HydrophobicContact CD2-CZ 3.5Å
159	R	43.7	Very low	56.1	Low	187 Å²	187	108.8 Å²	108.8	71%	0.706	57%	0.574	S	S	*	*			trans	-88.6	149.8	169	-112.8	179.9	-179.2	-161.8	2.1	110.4	Q157	Q157-R159 PolarHBondContact O-N 2.78Å
160	S	45.3	Very low	56.1	Low	32 Å²	32	108.5 Å²	108.5	22%	0.224	57%	0.57	C	S	.	*			trans	-49.5	151.4	-168	44.7	0	0	0	0	115.8	F162 F163	S160-F162 PolarHBondContact O-N 3.03Å; S160-F163 PolarHBondContact O-N 3.16Å; S160-F163 VanDerWaalsContact O-N 3.16Å
161	P	51.6	Low	56	Low	101 Å²	101	112.3 Å²	112.3	66%	0.656	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	9.2	177.9	29.8	-35.9	0	0	0	114.6
162	F	50.1	Low	56.4	Low	172 Å²	172	118.9 Å²	118.9	75%	0.754	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	-8.4	177.8	-84.8	-84.2	0	0	0	113.1	S160	S160-F162 PolarHBondContact O-N 3.03Å
163	F	50.4	Low	57	Low	140 Å²	140	120.3 Å²	120.3	61%	0.614	60%	0.598	S	S	*	*	S	Bend	trans	-107.4	120.4	174.9	-81.7	-87.2	0	0	0	109.3	S160	S160-F163 PolarHBondContact O-N 3.16Å; S160-F163 VanDerWaalsContact O-N 3.16Å
164	S	48.6	Very low	57.2	Low	102 Å²	102	116.3 Å²	116.3	71%	0.713	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-53.1	143.7	166.5	-50.9	0	0	0	0	109.6	L166	S164-L166 PolarHBondContact O-N 3.06Å
165	P	51.2	Low	57.7	Low	121 Å²	121	112.7 Å²	112.7	79%	0.786	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-54.9	127.4	177.7	21.2	-30.8	0	0	0	109.9	T167	P165-T167 PolarHBondContact O-N 3.49Å
166	L	52.9	Low	58.5	Low	54 Å²	54	109 Å²	109	28%	0.283	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-63.7	128.7	175.4	-85.6	77.7	0	0	0	109.3	S164 Q170 R171 I174	S164-L166 PolarHBondContact O-N 3.06Å; L166-Q170 VanDerWaalsContact CA-OE1 3.25Å; L166-Q170 HydrophobicContact CB-CB 3.95Å; L166-Q170 HydrophobicContact CD2-CB 4Å; L166-Q170 HydrophobicContact CG-CB 4.04Å; L166-R171 HydrophobicContact CB-CG 4.5Å; L166-I174 HydrophobicContact CD2-CD1 3.23Å
167	T	67.1	Low	59.5	Low	77 Å²	77	108 Å²	108	47%	0.472	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-62.5	161.3	174.9	59.3	0	0	0	0	110.9	P165 D169 Q170 R171	P165-T167 PolarHBondContact O-N 3.49Å; T167-D169 PolarHBondContact O-N 3.41Å; T167-Q170 PolarHBondContact O-N 2.83Å; T167-Q170 VanDerWaalsContact O-N 3.09Å; T167-Q170 VanDerWaalsContact OG1-CG 3.3Å; T167-Q170 WeakPolarHBondContact OG1-CG 3.09Å; T167-Q170 PolarHBondContact OG1-N 3.14Å; T167-Q170 PolarHBondContact OG1-OE1 2.82Å; T167-R171 PolarHBondContact O-N 3.09Å
168	S	66.1	Low	60	Low	85 Å²	85	106.3 Å²	106.3	59%	0.594	54%	0.541	S	S	*	.	H	α-helix	trans	-55.1	-33.7	176	44.7	0	0	0	0	112.7	R171 R172	S168-R171 PolarHBondContact O-N 2.77Å; S168-R172 PolarHBondContact O-N 3.27Å
169	D	73.2	Confident	60.8	Low	96 Å²	96	104.8 Å²	104.8	51%	0.513	54%	0.539	S	S	.	.	H	α-helix	trans	-69.5	-45.2	175.8	-68.6	-28.1	0	0	0	111.3	T167 R171 R172 D173	T167-D169 PolarHBondContact O-N 3.41Å; D169-R171 PolarHBondContact O-N 3.37Å; D169-R172 WeakPolarHBondContact O-CB 3.28Å; D169-R172 PolarHBondContact O-N 3.38Å; D169-D173 PolarHBondContact O-N 3.24Å
170	Q	69.5	Low	61.5	Low	93 Å²	93	102.3 Å²	102.3	44%	0.435	54%	0.538	S	S	.	.	H	α-helix	trans	-61.7	-30.9	175.9	-72.8	176.8	-43.5	0	0	113.3	L166 T167 I174	L166-Q170 VanDerWaalsContact CA-OE1 3.25Å; L166-Q170 HydrophobicContact CB-CB 3.95Å; L166-Q170 HydrophobicContact CD2-CB 4Å; L166-Q170 HydrophobicContact CG-CB 4.04Å; T167-Q170 PolarHBondContact O-N 2.83Å; T167-Q170 VanDerWaalsContact O-N 3.09Å; T167-Q170 VanDerWaalsContact OG1-CG 3.3Å; T167-Q170 WeakPolarHBondContact OG1-CG 3.09Å; T167-Q170 PolarHBondContact OG1-N 3.14Å; T167-Q170 PolarHBondContact OG1-OE1 2.82Å; Q170-I174 WeakPolarHBondContact O-CG1 3.43Å; Q170-I174 PolarHBondContact O-N 2.03Å
171	R	66.4	Low	61.8	Low	136 Å²	136	107.5 Å²	107.5	51%	0.513	56%	0.559	S	S	.	*	H	α-helix	trans	-68	-39.3	172.9	-69.9	-173.5	-168.6	-137.8	0.1	112	L166 T167 S168 D169 A175	L166-R171 HydrophobicContact CB-CG 4.5Å; T167-R171 PolarHBondContact O-N 3.09Å; S168-R171 PolarHBondContact O-N 2.77Å; D169-R171 PolarHBondContact O-N 3.37Å; R171-A175 PolarHBondContact O-N 2.04Å
172	R	71.3	Confident	61.4	Low	168 Å²	168	106.2 Å²	106.2	63%	0.634	55%	0.552	S	S	*	*	H	α-helix	trans	-65.1	-43.7	175.2	-73	-177.7	-171.5	173.1	3.9	110.8	S168 D169 I174 A175 I176	S168-R172 PolarHBondContact O-N 3.27Å; D169-R172 WeakPolarHBondContact O-CB 3.28Å; D169-R172 PolarHBondContact O-N 3.38Å; R172-I174 PolarHBondContact O-N 3.5Å; R172-A175 PolarHBondContact O-N 2.82Å; R172-I176 WeakPolarHBondContact O-CB 3.36Å; R172-I176 WeakPolarHBondContact O-CD1 3Å; R172-I176 VanDerWaalsContact O-CG1 3.23Å; R172-I176 WeakPolarHBondContact O-CG1 2.95Å; R172-I176 PolarHBondContact O-N 3.46Å
173	D	73.3	Confident	61.1	Low	93 Å²	93	103.7 Å²	103.7	50%	0.497	55%	0.553	S	S	.	*	H	α-helix	trans	-62.2	-42.1	-178.3	-67.9	-22.9	0	0	0	112.5	D169 I176 Q177	D169-D173 PolarHBondContact O-N 3.24Å; D173-I176 PolarHBondContact O-N 3.3Å; D173-Q177 WeakPolarHBondContact O-CG 3.39Å; D173-Q177 PolarHBondContact O-N 2.86Å
174	I	65.4	Low	60.6	Low	68 Å²	68	102.7 Å²	102.7	35%	0.349	56%	0.564	S	S	.	*	H	α-helix	trans	-67.9	-39.1	176.9	-67.3	172.5	0	0	0	111.8	L166 Q170 R172 I176 Q177 N178	L166-I174 HydrophobicContact CD2-CD1 3.23Å; Q170-I174 WeakPolarHBondContact O-CG1 3.43Å; Q170-I174 PolarHBondContact O-N 2.03Å; R172-I174 PolarHBondContact O-N 3.5Å; I174-I176 VanDerWaalsContact C-N 3.31Å; I174-Q177 PolarHBondContact O-N 2.92Å; I174-N178 PolarHBondContact O-N 2.88Å; I174-N178 PolarHBondContact O-ND2 2.82Å
175	A	67.4	Low	60.1	Low	49 Å²	49	106.2 Å²	106.2	41%	0.405	57%	0.569	S	S	.	*	H	α-helix	trans	-63.6	-40	175.5	0	0	0	0	0	111.2	R171 R172 I179	R171-A175 PolarHBondContact O-N 2.04Å; R172-A175 PolarHBondContact O-N 2.82Å; A175-I179 WeakPolarHBondContact O-CD1 3.38Å; A175-I179 VanDerWaalsContact O-CG1 3.23Å; A175-I179 WeakPolarHBondContact O-CG1 3.39Å; A175-I179 PolarHBondContact O-N 3.39Å
176	I	71.1	Confident	59.5	Low	88 Å²	88	105.5 Å²	105.5	45%	0.451	57%	0.567	S	S	.	*	H	α-helix	trans	-67	-43.9	176.2	-68.2	165.1	0	0	0	110.9	R172 D173 I174 N178 I179 L180	R172-I176 WeakPolarHBondContact O-CB 3.36Å; R172-I176 WeakPolarHBondContact O-CD1 3Å; R172-I176 VanDerWaalsContact O-CG1 3.23Å; R172-I176 WeakPolarHBondContact O-CG1 2.95Å; R172-I176 PolarHBondContact O-N 3.46Å; D173-I176 PolarHBondContact O-N 3.3Å; I174-I176 VanDerWaalsContact C-N 3.31Å; I176-N178 PolarHBondContact O-N 2.88Å; I176-I179 PolarHBondContact O-N 2.87Å; I176-L180 HydrophobicContact CG2-CD1 3.54Å; I176-L180 HydrophobicContact CG2-CG 4.24Å; I176-L180 WeakPolarHBondContact O-CB 3.49Å; I176-L180 VanDerWaalsContact O-CG 3.3Å; I176-L180 WeakPolarHBondContact O-CG 3.41Å; I176-L180 PolarHBondContact O-N 3.44Å
177	Q	71.6	Confident	58.6	Low	110 Å²	110	109.4 Å²	109.4	51%	0.514	59%	0.593	S	S	.	*	H	α-helix	trans	-60.4	-46.2	176.9	-79.3	-170.3	-45.6	0	0	112.3	D173 I174 I179 L180 E181	D173-Q177 WeakPolarHBondContact O-CG 3.39Å; D173-Q177 PolarHBondContact O-N 2.86Å; I174-Q177 PolarHBondContact O-N 2.92Å; Q177-I179 PolarHBondContact O-N 2.02Å; Q177-L180 PolarHBondContact O-N 3.33Å; Q177-E181 WeakPolarHBondContact O-CB 3.31Å; Q177-E181 WeakPolarHBondContact O-CG 3.3Å; Q177-E181 PolarHBondContact O-N 2.89Å
178	N	59.3	Low	57.2	Low	105 Å²	105	111.3 Å²	111.3	56%	0.561	61%	0.61	S	S	*	*	H	α-helix	trans	-65.2	-26.5	179.1	-71.6	-24.7	0	0	0	113.4	I174 I176	I174-N178 PolarHBondContact O-N 2.88Å; I174-N178 PolarHBondContact O-ND2 2.82Å; I176-N178 PolarHBondContact O-N 2.88Å
179	I	60.5	Low	55.9	Low	124 Å²	124	115.2 Å²	115.2	64%	0.636	62%	0.619	S	S	*	*	H	α-helix	trans	-79.2	-39.3	175	-67.4	166.2	0	0	0	110.5	A175 I176 Q177 S182	A175-I179 WeakPolarHBondContact O-CD1 3.38Å; A175-I179 VanDerWaalsContact O-CG1 3.23Å; A175-I179 WeakPolarHBondContact O-CG1 3.39Å; A175-I179 PolarHBondContact O-N 3.39Å; I176-I179 PolarHBondContact O-N 2.87Å; Q177-I179 PolarHBondContact O-N 2.02Å; I179-S182 WeakPolarHBondContact O-CB 3.23Å; I179-S182 PolarHBondContact O-OG 3.26Å
180	L	60	Low	54.2	Low	134 Å²	134	115.8 Å²	115.8	70%	0.702	63%	0.625	S	S	*	*	H	α-helix	trans	-77.4	-23.9	-178.7	-69.4	172	0	0	0	113.9	I176 Q177 S182	I176-L180 HydrophobicContact CG2-CD1 3.54Å; I176-L180 HydrophobicContact CG2-CG 4.24Å; I176-L180 WeakPolarHBondContact O-CB 3.49Å; I176-L180 VanDerWaalsContact O-CG 3.3Å; I176-L180 WeakPolarHBondContact O-CG 3.41Å; I176-L180 PolarHBondContact O-N 3.44Å; Q177-L180 PolarHBondContact O-N 3.33Å; L180-S182 VanDerWaalsContact C-N 3.28Å
181	E	50.5	Low	53	Low	142 Å²	142	120 Å²	120	66%	0.664	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	4.2	176	-71.2	-179.5	147.7	0	0	113.3	Q177 P183	Q177-E181 WeakPolarHBondContact O-CB 3.31Å; Q177-E181 WeakPolarHBondContact O-CG 3.3Å; Q177-E181 PolarHBondContact O-N 2.89Å; E181-P183 VanDerWaalsContact O-CD 3.32Å; E181-P183 WeakPolarHBondContact O-CD 3.49Å
182	S	44	Very low	51.9	Low	73 Å²	73	121.2 Å²	121.2	51%	0.51	65%	0.654	S	S	.	*	S	Bend	trans	-63.7	120.8	168.2	-40.5	0	0	0	0	109.2	I179 L180 S184	I179-S182 WeakPolarHBondContact O-CB 3.23Å; I179-S182 PolarHBondContact O-OG 3.26Å; L180-S182 VanDerWaalsContact C-N 3.28Å; S182-S184 PolarHBondContact O-N 2.9Å
183	P	43.3	Very low	50.6	Low	119 Å²	119	117.8 Å²	117.8	77%	0.773	66%	0.656	S	S	*	*			trans	-63.4	114.6	171.2	-15.1	29.1	0	0	0	108.8	E181 E185	E181-P183 VanDerWaalsContact O-CD 3.32Å; E181-P183 WeakPolarHBondContact O-CD 3.49Å; P183-E185 PolarHBondContact O-N 3.28Å
184	S	38.9	Very low	49.3	Very low	119 Å²	119	119.6 Å²	119.6	83%	0.832	67%	0.67	S	S	*	*			trans	-66.7	106.3	163.3	54.1	0	0	0	0	108.5	S182	S182-S184 PolarHBondContact O-N 2.9Å
185	E	38.9	Very low	48.4	Very low	176 Å²	176	120.5 Å²	120.5	82%	0.822	69%	0.688	S	S	*	*			trans	-138	98.5	161.7	-133	161	169	0	0	111.9	P183	P183-E185 PolarHBondContact O-N 3.28Å
186	S	38	Very low	47.3	Very low	106 Å²	106	123.5 Å²	123.5	74%	0.741	70%	0.704	S	S	*	*			trans	62.6	91.6	148.9	63.5	0	0	0	0	119.3
187	T	34.2	Very low	46.2	Very low	136 Å²	136	129.4 Å²	129.4	83%	0.834	73%	0.726	S	S	*	*			trans	-61.5	125.7	134.3	44.2	0	0	0	0	110.5
188	S	39.1	Very low	45	Very low	117 Å²	117	131.5 Å²	131.5	82%	0.818	78%	0.777	S	S	*	*			trans	-128.6	100.6	143.2	53.4	0	0	0	0	108.5
189	E	38.6	Very low	44.3	Very low	168 Å²	168	132.9 Å²	132.9	79%	0.785	79%	0.788	S	S	*	*			trans	-53.4	150.5	151.3	-59.4	170.3	109.9	0	0	107.5
190	T	37.5	Very low	43.4	Very low	107 Å²	107	133.3 Å²	133.3	66%	0.656	80%	0.796	S	S	*	*				176.6	144.5	56.8	-13.8	0	0	0	0	106.9
191	K	43.1	Very low	42.5	Very low	182 Å²	182	133.3 Å²	133.3	79%	0.791	80%	0.801	S	S	*	*			trans	65.1	142.5	147.6	-69.8	174.6	-173.5	-173.6	0	117.4
192	E	43.3	Very low	42	Very low	161 Å²	161	132.8 Å²	132.8	75%	0.752	81%	0.81	S	S	*	*			cis	-177.2	142.9	4.8	171.1	160.9	158.8	0	0	107
193	S	44.1	Very low	41.9	Very low	96 Å²	96	136.5 Å²	136.5	67%	0.671	83%	0.828	S	S	*	*			trans	61.2	137.3	147.9	-160	0	0	0	0	122.6
194	T	46.5	Very low	41.8	Very low	131 Å²	131	137.7 Å²	137.7	80%	0.804	83%	0.832	S	S	*	*			trans	92	101.4	144.7	5.6	0	0	0	0	119.1
195	A	45.7	Very low	42	Very low	88 Å²	88	139 Å²	139	73%	0.727	83%	0.832	S	S	*	*			trans	-62.8	179.4	149.6	0	0	0	0	0	110.8
196	P	44.7	Very low	42.2	Very low	112 Å²	112	136.2 Å²	136.2	73%	0.727	83%	0.833	S	S	*	*			cis	-142.4	173.3	8.8	39.9	-19.1	0	0	0	117.4
197	K	48.2	Very low	42.6	Very low	211 Å²	211	138.7 Å²	138.7	92%	0.917	84%	0.84	S	S	*	*			trans	47.8	116	145.4	-71.7	-179.3	179.6	-177	0	120.9
198	G	46.1	Very low	43.4	Very low	155 Å²	155	138.9 Å²	138.9	100%	1.598	84%	0.841	S	S	*	*			trans	-126.3	0	133.4	0	0	0	0	0	108.2

Retrieved 198 of 198 residues in 159.1 ms (Link to these results)

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