A0A077ZBY2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZBY2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 148 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	38.8	Very low	39.8	Very low	236 Å²	236	122.6 Å²	122.6	100%	1.163	71%	0.706	S	S	*	*				0	93.3	0	-68	-177.8	-175.4	0	0	108.3	S3	M1-S3 PolarHBondContact O-N 3.1Å; M1-S3 VanDerWaalsContact O-N 3.1Å
2	S	37.4	Very low	39.7	Very low	132 Å²	132	123.8 Å²	123.8	92%	0.923	71%	0.706	S	S	*	*			trans	-81	87.2	-173.9	-54.7	0	0	0	0	109.4	L4	S2-L4 PolarHBondContact O-N 3.45Å
3	S	42.3	Very low	39.4	Very low	92 Å²	92	129.7 Å²	129.7	64%	0.643	71%	0.71	S	S	*	*			trans	-82	117	-174.3	-164.5	0	0	0	0	111.2	M1 I5	M1-S3 PolarHBondContact O-N 3.1Å; M1-S3 VanDerWaalsContact O-N 3.1Å; S3-I5 PolarHBondContact O-N 3.25Å
4	L	47.6	Very low	39.1	Very low	159 Å²	159	133.6 Å²	133.6	83%	0.832	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-13.9	2.3	166.7	-73.6	147.8	0	0	0	122.3	S2 S6 G7	S2-L4 PolarHBondContact O-N 3.45Å; L4-S6 VanDerWaalsContact C-N 3.28Å; L4-S6 PolarHBondContact O-N 3.45Å; L4-G7 PolarHBondContact O-N 3.34Å
5	I	46.1	Very low	38.7	Very low	132 Å²	132	140.4 Å²	140.4	68%	0.677	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-20.9	-176.7	-51.5	178.2	0	0	0	111.9	S3 G7	S3-I5 PolarHBondContact O-N 3.25Å; I5-G7 PolarHBondContact O-N 3.29Å
6	S	42.5	Very low	38.3	Very low	86 Å²	86	142.3 Å²	142.3	60%	0.601	73%	0.729	S	S	*	*	H	α-helix	trans	-64.5	-24.6	177.6	-176.4	0	0	0	0	113.8	L4	L4-S6 VanDerWaalsContact C-N 3.28Å; L4-S6 PolarHBondContact O-N 3.45Å
7	G	35.2	Very low	37.9	Very low	41 Å²	41	145.6 Å²	145.6	42%	0.423	73%	0.73	S	S	.	*	H	α-helix	trans	-70	-40.7	-176.1	0	0	0	0	0	113.9	L4 I5 K10 L11	L4-G7 PolarHBondContact O-N 3.34Å; I5-G7 PolarHBondContact O-N 3.29Å; G7-K10 PolarHBondContact O-N 2.69Å; G7-L11 PolarHBondContact O-N 3.42Å
8	I	38.2	Very low	37.3	Very low	120 Å²	120	147.4 Å²	147.4	62%	0.615	74%	0.736	S	S	*	*	H	α-helix	trans	-75.3	-38.1	-172.4	-57.2	175.5	0	0	0	110.8	K10 L11 L12	I8-K10 PolarHBondContact O-N 3.08Å; I8-L11 PolarHBondContact O-N 3.19Å; I8-L12 PolarHBondContact O-N 2.94Å
9	A	39.3	Very low	36.8	Very low	60 Å²	60	145.5 Å²	145.5	50%	0.496	74%	0.735	S	S	.	*	H	α-helix	trans	-63.4	-30.1	175.3	0	0	0	0	0	112.8	R13	A9-R13 PolarHBondContact O-N 3.09Å
10	K	35	Very low	36.4	Very low	152 Å²	152	141.5 Å²	141.5	66%	0.661	73%	0.726	S	S	*	*	H	α-helix	trans	-73.5	-35.2	175.5	-93.9	-179	177.2	174.8	0	113	G7 I8	G7-K10 PolarHBondContact O-N 2.69Å; I8-K10 PolarHBondContact O-N 3.08Å
11	L	34.9	Very low	36.1	Very low	139 Å²	139	140 Å²	140	73%	0.728	73%	0.734	S	S	*	*	H	α-helix	trans	-66.7	-40.4	176.9	-95.6	152.6	0	0	0	111.6	G7 I8 K14	G7-L11 PolarHBondContact O-N 3.42Å; I8-L11 PolarHBondContact O-N 3.19Å; L11-K14 PolarHBondContact O-N 2.91Å
12	L	38.7	Very low	35.7	Very low	136 Å²	136	132.5 Å²	132.5	71%	0.712	72%	0.718	S	S	*	*	H	α-helix	trans	-70.6	-34	178.5	-68.9	172.9	0	0	0	113.1	I8 K14 R15	I8-L12 PolarHBondContact O-N 2.94Å; L12-K14 PolarHBondContact O-N 3.31Å; L12-R15 PolarHBondContact O-N 3.35Å
13	R	36.7	Very low	35.5	Very low	201 Å²	201	132.6 Å²	132.6	76%	0.758	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-16.1	175	-86.9	-172.5	-177.4	-176.9	2.2	114.5	A9 K16	A9-R13 PolarHBondContact O-N 3.09Å; R13-K16 WeakPolarHBondContact O-CG 3.19Å
14	K	35.1	Very low	35.1	Very low	185 Å²	185	137.8 Å²	137.8	80%	0.804	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-14.3	-178.6	-81.5	-164.5	176.2	-172.1	0	114.5	L11 L12 K16	L11-K14 PolarHBondContact O-N 2.91Å; L12-K14 PolarHBondContact O-N 3.31Å; K14-K16 PolarHBondContact O-N 3.21Å
15	R	32	Very low	34.4	Very low	235 Å²	235	137.2 Å²	137.2	89%	0.887	71%	0.711	S	S	*	*			trans	-78.8	50.1	158.7	-85.8	-173.7	-178.6	173.4	0.5	109.9	L12 W17	L12-R15 PolarHBondContact O-N 3.35Å; R15-W17 PolarHBondContact O-N 3.2Å; R15-W17 VanDerWaalsContact O-N 3.09Å
16	K	33.7	Very low	34	Very low	170 Å²	170	135 Å²	135	74%	0.739	71%	0.707	S	S	*	*			trans	-67.3	105.4	158	-90.2	177	178.7	-169.1	0	104.9	R13 K14 Q18	R13-K16 WeakPolarHBondContact O-CG 3.19Å; K14-K16 PolarHBondContact O-N 3.21Å; K16-Q18 PolarHBondContact O-N 3.46Å
17	W	30.2	Very low	33.8	Very low	199 Å²	199	136.6 Å²	136.6	75%	0.754	71%	0.709	S	S	*	*			trans	-39.1	107.5	156.4	-101.9	81.5	0	0	0	108	R15 P19	R15-W17 PolarHBondContact O-N 3.2Å; R15-W17 VanDerWaalsContact O-N 3.09Å; W17-P19 WeakPolarHBondContact O-CD 3.43Å
18	Q	28.4	Very low	33.9	Very low	179 Å²	179	141.4 Å²	141.4	84%	0.836	72%	0.718	S	S	*	*			trans	-76.2	109.2	159.7	-82.1	178.7	-49.5	0	0	104.3	K16 A20	K16-Q18 PolarHBondContact O-N 3.46Å; Q18-A20 PolarHBondContact O-N 3.32Å; Q18-A20 VanDerWaalsContact O-N 3.14Å
19	P	27.5	Very low	33.7	Very low	110 Å²	110	137.1 Å²	137.1	71%	0.714	70%	0.698	S	S	*	*			trans	-60.1	121.6	168.5	25.7	-30.8	0	0	0	106.6	W17 A21	W17-P19 WeakPolarHBondContact O-CD 3.43Å; P19-A21 PolarHBondContact O-N 3.24Å
20	A	29.5	Very low	33.7	Very low	66 Å²	66	141.6 Å²	141.6	55%	0.545	72%	0.719	S	S	.	*			trans	-55.4	124.4	173.6	0	0	0	0	0	107.7	Q18 G22	Q18-A20 PolarHBondContact O-N 3.32Å; Q18-A20 VanDerWaalsContact O-N 3.14Å; A20-G22 PolarHBondContact O-N 3.3Å; A20-G22 VanDerWaalsContact O-N 3.12Å
21	A	29.5	Very low	34	Very low	110 Å²	110	142.1 Å²	142.1	91%	0.909	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	115.7	179.2	0	0	0	0	0	108.5	P19	P19-A21 PolarHBondContact O-N 3.24Å
22	G	30.5	Very low	34.2	Very low	79 Å²	79	141.5 Å²	141.5	81%	0.814	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	118.7	-5.7	169.2	0	0	0	0	0	116.7	A20 E24	A20-G22 PolarHBondContact O-N 3.3Å; A20-G22 VanDerWaalsContact O-N 3.12Å; G22-E24 PolarHBondContact O-N 2.97Å
23	E	32.5	Very low	34.3	Very low	133 Å²	133	138 Å²	138	62%	0.621	70%	0.701	S	S	*	*			trans	-95.9	88.3	178.6	-73.2	177.7	179.3	0	0	111.1	E25	E23-E25 HydrophobicContact CB-CB 4.39Å; E23-E25 PolarHBondContact O-N 2.81Å
24	E	35	Very low	34.3	Very low	202 Å²	202	133.3 Å²	133.3	94%	0.944	69%	0.686	S	S	*	*			trans	-76.2	30.8	149.6	-153	179.9	-170	0	0	110.2	G22	G22-E24 PolarHBondContact O-N 2.97Å
25	E	32.4	Very low	34.4	Very low	146 Å²	146	127.4 Å²	127.4	68%	0.682	66%	0.661	S	S	*	*	S	Bend	trans	-80.7	124.1	169	-81.1	-163.3	152.3	0	0	108.5	E23 N27	E23-E25 HydrophobicContact CB-CB 4.39Å; E23-E25 PolarHBondContact O-N 2.81Å; E25-N27 PolarHBondContact O-N 2.97Å
26	S	37.2	Very low	34.6	Very low	87 Å²	87	118.3 Å²	118.3	61%	0.608	63%	0.63	S	S	*	*			trans	-44.2	113.2	171.8	-169.1	0	0	0	0	108.8	K28	S26-K28 PolarHBondContact O-N 3.17Å; S26-K28 WeakPolarHBondContact OG-CG 3Å
27	N	39	Very low	34.5	Very low	118 Å²	118	119.2 Å²	119.2	63%	0.631	63%	0.628	S	S	*	*			trans	-66.6	41.9	172.7	-84.9	-78.6	0	0	0	111.3	E25	E25-N27 PolarHBondContact O-N 2.97Å
28	K	36.2	Very low	34.6	Very low	143 Å²	143	111.3 Å²	111.3	62%	0.622	60%	0.603	S	S	*	*			trans	-71.4	128.2	167.4	-85.7	178.3	179.5	-178.9	0	106.9	S26 T30	S26-K28 PolarHBondContact O-N 3.17Å; S26-K28 WeakPolarHBondContact OG-CG 3Å; K28-T30 PolarHBondContact O-N 3.17Å
29	P	35.5	Very low	34.6	Very low	29 Å²	29	105.8 Å²	105.8	19%	0.188	58%	0.584	C	S	.	*			trans	-53.9	135.5	172.7	-19.9	28.1	0	0	0	109.9	R31 F33 I95 D97	P29-R31 PolarHBondContact O-N 3.22Å; P29-F33 HydrophobicContact CB-CB 4.3Å; P29-F33 HydrophobicContact CB-CD1 3.77Å; P29-F33 HydrophobicContact CB-CG 4.35Å; P29-F33 HydrophobicContact CG-CB 4.06Å; P29-F33 HydrophobicContact CG-CD1 3.59Å; P29-F33 HydrophobicContact CG-CE1 4.18Å; P29-F33 HydrophobicContact CG-CG 3.9Å; P29-I95 HydrophobicContact CG-CG2 3.93Å; P29-D97 HydrophobicContact CB-CB 4.48Å; P29-D97 HydrophobicContact CG-CB 4.43Å
30	T	38.5	Very low	34.6	Very low	154 Å²	154	106.3 Å²	106.3	95%	0.945	58%	0.581	S	S	*	*	S	Bend	trans	-70	-10.8	178.5	-10.6	0	0	0	0	112.4	K28	K28-T30 PolarHBondContact O-N 3.17Å
31	R	40.3	Very low	34.5	Very low	164 Å²	164	112.5 Å²	112.5	62%	0.619	59%	0.592	S	S	*	*	S	Bend	trans	-109.8	159.6	-178.2	-67.2	-177.7	178.8	179.4	0.6	111.2	P29 F33	P29-R31 PolarHBondContact O-N 3.22Å; R31-F33 WeakPolarHBondContact O-CD1 3.38Å; R31-F33 PolarHBondContact O-N 3.01Å
32	P	39.9	Very low	34.2	Very low	125 Å²	125	115.6 Å²	115.6	81%	0.812	59%	0.587	S	S	*	*			trans	-59.3	112.2	173.6	-17.4	29.9	0	0	0	109.8
33	F	40.9	Very low	34.1	Very low	64 Å²	64	123.5 Å²	123.5	28%	0.281	59%	0.594	S	S	.	*			trans	-105.6	152.2	177.2	60.4	-93.5	0	0	0	109.9	P29 R31 E35 I95	P29-F33 HydrophobicContact CB-CB 4.3Å; P29-F33 HydrophobicContact CB-CD1 3.77Å; P29-F33 HydrophobicContact CB-CG 4.35Å; P29-F33 HydrophobicContact CG-CB 4.06Å; P29-F33 HydrophobicContact CG-CD1 3.59Å; P29-F33 HydrophobicContact CG-CE1 4.18Å; P29-F33 HydrophobicContact CG-CG 3.9Å; R31-F33 WeakPolarHBondContact O-CD1 3.38Å; R31-F33 PolarHBondContact O-N 3.01Å; F33-E35 HydrophobicContact CE2-CB 4.32Å; F33-I95 HydrophobicContact CB-CG2 4.15Å; F33-I95 HydrophobicContact CD1-CG2 4.47Å; F33-I95 HydrophobicContact CD2-CB 4.32Å; F33-I95 HydrophobicContact CD2-CG1 4.38Å; F33-I95 HydrophobicContact CD2-CG2 3.3Å; F33-I95 HydrophobicContact CE2-CB 4.42Å; F33-I95 HydrophobicContact CE2-CD1 4.28Å; F33-I95 HydrophobicContact CE2-CG1 4Å; F33-I95 HydrophobicContact CE2-CG2 3.67Å; F33-I95 HydrophobicContact CG-CG2 3.74Å; F33-I95 HydrophobicContact CZ-CG2 4.41Å
34	K	36.6	Very low	33.7	Very low	102 Å²	102	120.7 Å²	120.7	44%	0.443	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.6	115.6	169.1	-82	-173.8	172	-178.1	0	108.4	L36 A96 S146	K34-L36 PolarHBondContact O-N 3.34Å; K34-A96 PolarHBondContact N-O 2.99Å; K34-A96 WeakPolarHBondContact O-CB 3.46Å; K34-A96 PolarHBondContact O-N 2.82Å; K34-A96 VanDerWaalsContact O-O 3.08Å; K34-S146 PolarHBondContact NZ-OG 3.12Å
35	E	36.8	Very low	33.1	Very low	60 Å²	60	113.6 Å²	113.6	28%	0.28	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.8	111	170.5	-168.1	175.2	-137.1	0	0	108.2	F33 R37 K93 I95	F33-E35 HydrophobicContact CE2-CB 4.32Å; E35-R37 PolarHBondContact O-N 3.14Å; E35-R37 VanDerWaalsContact O-N 3.12Å; E35-R37 IonicContact OE2-NE 3.92Å; E35-K93 HydrophobicContact CG-CB 4.33Å; E35-K93 HydrophobicContact CG-CG 4.35Å; E35-K93 WeakPolarHBondContact OE1-CD 3.36Å; E35-K93 WeakPolarHBondContact OE1-CE 3.32Å; E35-K93 WeakPolarHBondContact OE1-CG 3.13Å; E35-K93 IonicContact OE1-NZ 3.82Å; E35-I95 HydrophobicContact CG-CG1 4.32Å
36	L	36	Very low	32.8	Very low	44 Å²	44	115.8 Å²	115.8	23%	0.23	59%	0.593	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-73	105.2	168	-66.6	166.9	0	0	0	107.3	K34 C38 M74 V94 A96	K34-L36 PolarHBondContact O-N 3.34Å; L36-C38 PolarHBondContact O-N 3.27Å; L36-M74 HydrophobicContact CD1-CE 3.13Å; L36-M74 HydrophobicContact CD1-SD 3.69Å; L36-V94 WeakPolarHBondContact CA-O 3.43Å; L36-V94 HydrophobicContact CB-CB 4.15Å; L36-V94 VanDerWaalsContact CB-O 3.3Å; L36-V94 WeakPolarHBondContact CB-O 3.49Å; L36-V94 HydrophobicContact CD1-CG1 4.33Å; L36-V94 PolarHBondContact N-O 2.82Å; L36-V94 PolarHBondContact O-N 3.04Å; L36-A96 HydrophobicContact CD1-CB 3.98Å; L36-A96 HydrophobicContact CG-CB 4.18Å
37	R	31.8	Very low	32.3	Very low	189 Å²	189	117.8 Å²	117.8	71%	0.713	60%	0.595	S	S	*	*			trans	-76.7	115.5	166.6	-64.1	-173.7	177.1	-170.1	0.8	106.8	E35 S39	E35-R37 PolarHBondContact O-N 3.14Å; E35-R37 VanDerWaalsContact O-N 3.12Å; E35-R37 IonicContact OE2-NE 3.92Å; R37-S39 PolarHBondContact O-N 3.24Å; R37-S39 VanDerWaalsContact O-N 3.11Å
38	C	33	Very low	31.7	Very low	33 Å²	33	118.6 Å²	118.6	22%	0.223	60%	0.599	C	S	.	*			trans	-57.1	117.7	162.8	-66.8	0	0	0	0	106.2	L36 D40	L36-C38 PolarHBondContact O-N 3.27Å; C38-D40 PolarHBondContact O-N 3.08Å
39	S	28.1	Very low	31.4	Very low	63 Å²	63	116.9 Å²	116.9	44%	0.441	61%	0.605	S	S	.	*			trans	-59.4	137.2	165.4	47.6	0	0	0	0	107.5	R37 Y41	R37-S39 PolarHBondContact O-N 3.24Å; R37-S39 VanDerWaalsContact O-N 3.11Å; S39-Y41 PolarHBondContact O-N 3.09Å; S39-Y41 WeakPolarHBondContact OG-CD2 3.36Å; S39-Y41 WeakPolarHBondContact OG-CE2 2.95Å
40	D	27.9	Very low	31.1	Very low	122 Å²	122	123.1 Å²	123.1	65%	0.652	64%	0.637	S	S	*	*			trans	-62.6	71.3	173.1	-66.1	-50.7	0	0	0	109.8	C38 Q42 P91	C38-D40 PolarHBondContact O-N 3.08Å; D40-Q42 PolarHBondContact O-N 2.77Å; D40-P91 WeakPolarHBondContact OD1-CB 3.36Å; D40-P91 WeakPolarHBondContact OD1-CG 3.39Å
41	Y	26.3	Very low	30.3	Very low	195 Å²	195	120.5 Å²	120.5	77%	0.765	63%	0.625	S	S	*	*			trans	-71.9	90.5	162.7	-84	-75.2	0	0	0	106	S39 Y43	S39-Y41 PolarHBondContact O-N 3.09Å; S39-Y41 WeakPolarHBondContact OG-CD2 3.36Å; S39-Y41 WeakPolarHBondContact OG-CE2 2.95Å; Y41-Y43 PolarHBondContact O-N 2Å
42	Q	24.9	Very low	29.6	Very low	175 Å²	175	116.9 Å²	116.9	82%	0.818	63%	0.625	S	S	*	*			trans	-48.2	112.3	171.7	-71.2	-177.8	9.3	0	0	108.4	D40 G44	D40-Q42 PolarHBondContact O-N 2.77Å; Q42-G44 PolarHBondContact O-N 2.84Å
43	Y	26.7	Very low	28.9	Very low	245 Å²	245	115.5 Å²	115.5	96%	0.961	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	82	171.9	-146	-89.2	0	0	0	106.6	Y41	Y41-Y43 PolarHBondContact O-N 2Å
44	G	25.8	Very low	28.1	Very low	75 Å²	75	118.9 Å²	118.9	77%	0.773	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-174.6	-5.4	-173.4	0	0	0	0	0	117.3	Q42	Q42-G44 PolarHBondContact O-N 2.84Å
45	G	22.6	Very low	27.7	Very low	52 Å²	52	121 Å²	121	54%	0.536	65%	0.653	S	S	.	*			trans	-96	124.3	168.4	0	0	0	0	0	109.8	I47	G45-I47 WeakPolarHBondContact O-CG1 3.49Å; G45-I47 PolarHBondContact O-N 3.44Å
46	E	25.8	Very low	27	Very low	193 Å²	193	123.8 Å²	123.8	90%	0.902	67%	0.674	S	S	*	*			trans	-58.6	83.8	150.1	-74.6	177.6	145.8	0	0	107	N48	E46-N48 VanDerWaalsContact C-N 3.29Å; E46-N48 PolarHBondContact O-N 3Å
47	I	27	Very low	26.5	Very low	129 Å²	129	127 Å²	127	66%	0.662	70%	0.697	S	S	*	*			trans	-77.5	94.5	177.4	-52.6	175.3	0	0	0	105.3	G45 S49	G45-I47 WeakPolarHBondContact O-CG1 3.49Å; G45-I47 PolarHBondContact O-N 3.44Å; I47-S49 PolarHBondContact O-N 2.7Å; I47-S49 VanDerWaalsContact O-N 3.17Å
48	N	25.7	Very low	26.5	Very low	135 Å²	135	125.1 Å²	125.1	72%	0.722	70%	0.701	S	S	*	*			trans	-34.5	121.1	163.7	-74.6	-43	0	0	0	109.3	E46 D50	E46-N48 VanDerWaalsContact C-N 3.29Å; E46-N48 PolarHBondContact O-N 3Å; N48-D50 PolarHBondContact O-N 2.88Å
49	S	29.7	Very low	26.2	Very low	106 Å²	106	131.4 Å²	131.4	74%	0.741	72%	0.724	S	S	*	*	S	Bend	trans	-72	35.9	-168.6	-50.2	0	0	0	0	113.5	I47	I47-S49 PolarHBondContact O-N 2.7Å; I47-S49 VanDerWaalsContact O-N 3.17Å
50	D	27.9	Very low	26.4	Very low	160 Å²	160	135.8 Å²	135.8	86%	0.856	74%	0.743	S	S	*	*			trans	-106.6	11.1	-171.9	-79.9	-23.3	0	0	0	114.5	N48	N48-D50 PolarHBondContact O-N 2.88Å
51	S	23.1	Very low	26.5	Very low	99 Å²	99	136 Å²	136	69%	0.692	74%	0.744	S	S	*	*			trans	-120.4	62.2	160.5	58.1	0	0	0	0	110.3	P53	S51-P53 VanDerWaalsContact O-CD 3.28Å; S51-P53 WeakPolarHBondContact O-CD 2.91Å
52	S	26.2	Very low	26.8	Very low	89 Å²	89	130 Å²	130	62%	0.622	74%	0.742	S	S	*	*			trans	-59.9	117.2	158.5	-68.3	0	0	0	0	107.1	V54	S52-V54 PolarHBondContact O-N 2.69Å; S52-V54 VanDerWaalsContact O-N 3.08Å
53	P	25.1	Very low	27.2	Very low	95 Å²	95	128 Å²	128	62%	0.617	73%	0.733	S	S	*	*			trans	-55.7	124.1	174	22	-30.4	0	0	0	107	S51 H55	S51-P53 VanDerWaalsContact O-CD 3.28Å; S51-P53 WeakPolarHBondContact O-CD 2.91Å; P53-H55 VanDerWaalsContact C-N 3.3Å; P53-H55 PolarHBondContact O-N 2.96Å
54	V	23.6	Very low	27.8	Very low	135 Å²	135	124.2 Å²	124.2	82%	0.818	73%	0.728	S	S	*	*			trans	-51.1	97.4	-178	176.1	0	0	0	0	108.1	S52 T56	S52-V54 PolarHBondContact O-N 2.69Å; S52-V54 VanDerWaalsContact O-N 3.08Å; V54-T56 VanDerWaalsContact C-N 3.33Å; V54-T56 PolarHBondContact O-N 3.24Å
55	H	26.7	Very low	28.3	Very low	147 Å²	147	129.4 Å²	129.4	68%	0.681	72%	0.724	S	S	*	*			trans	-64.4	100.8	167.4	-76.2	-60.9	0	0	0	105.2	P53 P57	P53-H55 VanDerWaalsContact C-N 3.3Å; P53-H55 PolarHBondContact O-N 2.96Å; H55-P57 WeakPolarHBondContact O-CD 2.96Å
56	T	22.8	Very low	29	Very low	119 Å²	119	134.2 Å²	134.2	73%	0.73	74%	0.737	S	S	*	*			trans	-73.2	107.9	146	20.4	0	0	0	0	104.4	V54 L58	V54-T56 VanDerWaalsContact C-N 3.33Å; V54-T56 PolarHBondContact O-N 3.24Å; T56-L58 VanDerWaalsContact C-N 3.34Å; T56-L58 PolarHBondContact O-N 2.93Å
57	P	26.5	Very low	29.8	Very low	111 Å²	111	131 Å²	131	72%	0.721	72%	0.722	S	S	*	*			trans	-61	110.4	163.5	10.7	0.4	0	0	0	104.4	H55 K59	H55-P57 WeakPolarHBondContact O-CD 2.96Å; P57-K59 VanDerWaalsContact C-N 3.32Å; P57-K59 PolarHBondContact O-N 3.45Å
58	L	31.4	Very low	30.6	Very low	149 Å²	149	132.1 Å²	132.1	78%	0.78	72%	0.723	S	S	*	*			trans	-55.3	107.7	167.9	-151.9	85.3	0	0	0	104.4	T56 D60	T56-L58 VanDerWaalsContact C-N 3.34Å; T56-L58 PolarHBondContact O-N 2.93Å; L58-D60 PolarHBondContact O-N 2.82Å
59	K	25.8	Very low	31.9	Very low	166 Å²	166	127.5 Å²	127.5	72%	0.722	70%	0.697	S	S	*	*			trans	-55	113	176	-80.4	-177.5	173.5	-177.8	0	106.1	P57 D61	P57-K59 VanDerWaalsContact C-N 3.32Å; P57-K59 PolarHBondContact O-N 3.45Å; K59-D61 PolarHBondContact O-N 3.24Å
60	D	33.6	Very low	33	Very low	155 Å²	155	126 Å²	126	83%	0.829	68%	0.68	S	S	*	*			trans	-72.5	69.9	171.8	-165.2	7.9	0	0	0	106.9	L58 G62	L58-D60 PolarHBondContact O-N 2.82Å; D60-G62 PolarHBondContact O-N 2.89Å
61	D	29.8	Very low	34.3	Very low	125 Å²	125	118.9 Å²	118.9	67%	0.668	64%	0.641	S	S	*	*			trans	-76.7	59	180	-82	-10.4	0	0	0	109	K59 Q63	K59-D61 PolarHBondContact O-N 3.24Å; D61-Q63 PolarHBondContact O-N 2.72Å
62	G	31.9	Very low	35.9	Very low	71 Å²	71	117 Å²	117	73%	0.732	62%	0.621	S	S	*	*	S	Bend	trans	50.3	3.2	156.6	0	0	0	0	0	119	D60 L64	D60-G62 PolarHBondContact O-N 2.89Å; G62-L64 PolarHBondContact O-N 3.29Å
63	Q	33.2	Very low	37.2	Very low	133 Å²	133	114.7 Å²	114.7	62%	0.621	60%	0.6	S	S	*	*			trans	-101.4	94.9	179.2	-80.3	-170.3	16.3	0	0	105.2	D61 R65	D61-Q63 PolarHBondContact O-N 2.72Å; Q63-R65 HydrophobicContact CB-CG 4.3Å; Q63-R65 PolarHBondContact O-N 2.77Å
64	L	38.7	Very low	38.7	Very low	164 Å²	164	110.3 Å²	110.3	86%	0.859	57%	0.571	S	S	*	*			trans	-54.7	58.9	150.1	-78.5	139.8	0	0	0	109.6	G62 N66	G62-L64 PolarHBondContact O-N 3.29Å; L64-N66 PolarHBondContact O-N 2.93Å
65	R	36.1	Very low	40	Very low	185 Å²	185	106.6 Å²	106.6	70%	0.698	55%	0.545	S	S	*	.			trans	-64.2	118.8	154.2	-77.8	-177.5	-175.7	-145.2	-3	103	Q63 E67	Q63-R65 HydrophobicContact CB-CG 4.3Å; Q63-R65 PolarHBondContact O-N 2.77Å; R65-E67 PolarHBondContact O-N 3.45Å
66	N	37.3	Very low	41.3	Very low	152 Å²	152	99.7 Å²	99.7	81%	0.813	51%	0.513	S	S	*	.			trans	-56.3	77.1	173.8	-67.1	-52.1	0	0	0	108.9	L64 K68	L64-N66 PolarHBondContact O-N 2.93Å; N66-K68 VanDerWaalsContact C-N 3.35Å; N66-K68 PolarHBondContact O-N 3.04Å
67	E	42.6	Very low	42.5	Very low	126 Å²	126	96.2 Å²	96.2	59%	0.589	49%	0.49	S	S	*	.			trans	-65.5	103	174	-77	-172.6	166.4	0	0	105	R65 M69	R65-E67 PolarHBondContact O-N 3.45Å; E67-M69 PolarHBondContact O-N 3.01Å
68	K	45.4	Very low	43.6	Very low	153 Å²	153	91.3 Å²	91.3	67%	0.665	46%	0.458	S	S	*	.			trans	-61.8	91.9	170.6	-71.1	-175.9	179.6	-177.9	0	107	N66	N66-K68 VanDerWaalsContact C-N 3.35Å; N66-K68 PolarHBondContact O-N 3.04Å
69	M	52.4	Low	44.3	Very low	37 Å²	37	92.1 Å²	92.1	18%	0.182	46%	0.457	C	S	.	.			trans	-76.3	125.7	170.8	-71.6	-166.5	-177.2	0	0	108.5	E67 Y71	E67-M69 PolarHBondContact O-N 3.01Å; M69-Y71 HydrophobicContact CB-CD2 4.43Å; M69-Y71 HydrophobicContact CB-CE1 4.17Å; M69-Y71 HydrophobicContact CB-CE2 3.62Å; M69-Y71 VanDerWaalsContact CB-CZ 3.48Å; M69-Y71 WeakPolarHBondContact CB-OH 3.24Å; M69-Y71 PolarHBondContact SD-OH 2.9Å
70	I	53.1	Low	45.2	Very low	76 Å²	76	86.4 Å²	86.4	39%	0.39	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	112.7	177.8	-73.8	171.5	0	0	0	106.4	V101 A141	I70-V101 HydrophobicContact CB-CG1 3.89Å; I70-V101 HydrophobicContact CG1-CG1 3.98Å; I70-V101 HydrophobicContact CG2-CB 4.05Å; I70-V101 HydrophobicContact CG2-CG1 3.23Å; I70-V101 HydrophobicContact CG2-CG2 3.61Å; I70-A141 HydrophobicContact CB-CB 4.37Å; I70-A141 HydrophobicContact CG2-CB 3.54Å; I70-A141 VanDerWaalsContact O-CB 3.27Å; I70-A141 WeakPolarHBondContact O-CB 3.17Å; I70-A141 PolarHBondContact O-N 3.41Å
71	Y	55.4	Low	45.5	Very low	10 Å²	10	82.3 Å²	82.3	4%	0.039	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	143.7	176.2	-59.5	-72.2	0	0	0	110.7	M69 V101 T102 I112 V139 N140	M69-Y71 HydrophobicContact CB-CD2 4.43Å; M69-Y71 HydrophobicContact CB-CE1 4.17Å; M69-Y71 HydrophobicContact CB-CE2 3.62Å; M69-Y71 VanDerWaalsContact CB-CZ 3.48Å; M69-Y71 WeakPolarHBondContact CB-OH 3.24Å; M69-Y71 PolarHBondContact SD-OH 2.9Å; Y71-V101 VanDerWaalsContact O-CA 3.23Å; Y71-V101 WeakPolarHBondContact O-CA 2.93Å; Y71-T102 PolarHBondContact N-O 2.96Å; Y71-T102 PolarHBondContact O-N 3.02Å; Y71-T102 VanDerWaalsContact O-N 3.12Å; Y71-I112 HydrophobicContact CD1-CG2 3.39Å; Y71-I112 HydrophobicContact CD2-CD1 4.21Å; Y71-I112 HydrophobicContact CE1-CD1 4.4Å; Y71-I112 HydrophobicContact CE1-CG2 3.23Å; Y71-I112 HydrophobicContact CE2-CD1 3.85Å; Y71-I112 HydrophobicContact CG-CG2 4.14Å; Y71-V139 CarbonylContact C-O 3.58Å; Y71-V139 VanDerWaalsContact CA-O 3.32Å; Y71-V139 WeakPolarHBondContact CA-O 3.1Å; Y71-N140 HydrophobicContact CE1-CB 4.45Å
72	K	55.7	Low	46.2	Very low	60 Å²	60	80.2 Å²	80.2	26%	0.261	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	131.4	167.3	-74.1	177.8	178.8	173.7	0	108.2	Y138 V139 A141	K72-Y138 CarbonylContact O-C 3.53Å; K72-Y138 WeakPolarHBondContact O-CA 3.32Å; K72-V139 PolarHBondContact N-O 3.21Å; K72-V139 PolarHBondContact O-N 2.92Å; K72-A141 HydrophobicContact CD-CB 4.07Å; K72-A141 HydrophobicContact CG-CB 3.93Å
73	E	54.5	Low	47	Very low	39 Å²	39	86.7 Å²	86.7	18%	0.182	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	138.8	166.8	-170.4	168.8	98	0	0	108.7	H75 D97 S99 T136 L137 Y138	E73-H75 IonicContact OE1-CD2 3.93Å; E73-H75 IonicContact OE1-CE1 3.98Å; E73-H75 IonicContact OE1-NE2 3.04Å; E73-H75 PolarHBondContact OE1-NE2 2.9Å; E73-D97 CarbonylContact C-O 3.53Å; E73-S99 VanDerWaalsContact OE1-CB 3.28Å; E73-S99 WeakPolarHBondContact OE1-CB 3.31Å; E73-T136 HydrophobicContact CG-CG2 3.39Å; E73-L137 CarbonylContact C-O 3.56Å; E73-Y138 HydrophobicContact CB-CD1 4.09Å; E73-Y138 HydrophobicContact CB-CE1 3.76Å; E73-Y138 HydrophobicContact CG-CD1 4.41Å; E73-Y138 HydrophobicContact CG-CE1 3.79Å; E73-Y138 VanDerWaalsContact OE2-CE1 3.3Å; E73-Y138 WeakPolarHBondContact OE2-CE1 3.18Å; E73-Y138 PolarHBondContact OE2-OH 2.62Å
74	M	55.4	Low	47.2	Very low	4 Å²	4	82.5 Å²	82.5	2%	0.02	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	111	-179.9	171.9	171.4	171.7	0	0	107.9	L36 V76 V94 A96 F121 L137 V139	L36-M74 HydrophobicContact CD1-CE 3.13Å; L36-M74 HydrophobicContact CD1-SD 3.69Å; M74-V76 HydrophobicContact CE-CG2 4.17Å; M74-V94 HydrophobicContact CE-CG1 3.43Å; M74-V94 VanDerWaalsContact CE-CG1 3.43Å; M74-A96 HydrophobicContact CB-CB 4.44Å; M74-A96 HydrophobicContact CE-CB 4.05Å; M74-A96 HydrophobicContact CG-CB 3.63Å; M74-A96 HydrophobicContact SD-CB 4.01Å; M74-F121 HydrophobicContact CE-CE1 3.75Å; M74-F121 HydrophobicContact CE-CZ 3.5Å; M74-F121 HydrophobicContact SD-CE1 3.85Å; M74-F121 HydrophobicContact SD-CZ 4.23Å; M74-L137 PolarHBondContact N-O 2.88Å; M74-L137 PolarHBondContact O-N 3.19Å; M74-V139 HydrophobicContact CB-CG2 3.44Å; M74-V139 VanDerWaalsContact CB-CG2 3.44Å; M74-V139 HydrophobicContact CG-CG2 4.2Å; M74-V139 HydrophobicContact SD-CG2 3.77Å
75	H	52.3	Low	47.3	Very low	56 Å²	56	77 Å²	77	26%	0.259	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	137.8	169.7	-69	-93.7	0	0	0	109.7	E73 D97 T136	E73-H75 IonicContact OE1-CD2 3.93Å; E73-H75 IonicContact OE1-CE1 3.98Å; E73-H75 IonicContact OE1-NE2 3.04Å; E73-H75 PolarHBondContact OE1-NE2 2.9Å; H75-D97 HydrophobicContact CB-CB 4.32Å; H75-T136 PolarHBondContact CE1-OG1 3.44Å; H75-T136 PolarHBondContact ND1-OG1 3.12Å
76	V	53.6	Low	47.7	Very low	3 Å²	3	69.1 Å²	69.1	2%	0.018	36%	0.357	C	S	.	.			trans	-104.6	106.8	177.1	-178.6	0	0	0	0	109.7	M74 V94 F121 V131 G134 D135 L137	M74-V76 HydrophobicContact CE-CG2 4.17Å; V76-V94 HydrophobicContact CG1-CG1 4.4Å; V76-F121 HydrophobicContact CG2-CE2 4.1Å; V76-F121 HydrophobicContact CG2-CZ 3.89Å; V76-V131 HydrophobicContact CB-CG1 3.76Å; V76-V131 HydrophobicContact CG1-CG1 3.8Å; V76-V131 HydrophobicContact CG2-CG1 3.87Å; V76-G134 PolarHBondContact O-N 2.96Å; V76-G134 VanDerWaalsContact O-N 3.09Å; V76-D135 PolarHBondContact N-O 3.08Å; V76-L137 HydrophobicContact CG2-CD1 3.58Å; V76-L137 HydrophobicContact CG2-CG 4.03Å
77	L	48.2	Very low	48.2	Very low	46 Å²	46	66.2 Å²	66.2	24%	0.241	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-94.8	116.4	169.4	-61.5	-176.5	0	0	0	109.5	I95	L77-I95 HydrophobicContact CB-CB 4.27Å; L77-I95 HydrophobicContact CD1-CB 3.95Å; L77-I95 HydrophobicContact CD1-CD1 4.07Å; L77-I95 HydrophobicContact CD1-CG2 4.01Å; L77-I95 HydrophobicContact CG-CB 4.38Å
78	C	48.4	Very low	48.4	Very low	8 Å²	8	63.4 Å²	63.4	5%	0.054	33%	0.331	C	S	.	.			trans	-99.8	139.5	178.1	-48.3	0	0	0	0	110.2	V81 C86 K133	C78-V81 HydrophobicContact CB-CG2 4.33Å; C78-C86 HydrophobicContact CB-CB 3.99Å; C78-C86 WeakPolarHBondContact CB-SG 3.49Å; C78-C86 WeakPolarHBondContact SG-CB 3.47Å; C78-C86 CovalentContact SG-SG 2Å; C78-C86 PolarHBondContact SG-SG 3.35Å; C78-K133 HydrophobicContact CB-CB 4.02Å; C78-K133 HydrophobicContact CB-CG 4.49Å
79	H	46.3	Very low	48.2	Very low	165 Å²	165	56.9 Å²	56.9	76%	0.764	31%	0.305	S	S	*	.	S	Bend	trans	-66	-43.7	170.9	-173.1	67.1	0	0	0	111.4
80	S	44.5	Very low	47.3	Very low	47 Å²	47	60.3 Å²	60.3	33%	0.329	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	149.3	175.3	62.7	0	0	0	0	111.6	Q87	S80-Q87 PolarHBondContact O-N 3.12Å; S80-Q87 VanDerWaalsContact O-N 3.17Å; S80-Q87 PolarHBondContact OG-OE1 3Å
81	V	41.3	Very low	46.2	Very low	69 Å²	69	61.1 Å²	61.1	42%	0.418	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	114.2	170.3	-179.8	0	0	0	0	107.1	C78 S85 K133	C78-V81 HydrophobicContact CB-CG2 4.33Å; V81-S85 CarbonylContact C-O 3.59Å; V81-S85 WeakPolarHBondContact CA-O 3.38Å; V81-K133 HydrophobicContact CG2-CB 3.56Å
82	N	44.8	Very low	45	Very low	81 Å²	81	62 Å²	62	43%	0.433	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	131.2	177.9	-170	1.7	0	0	0	109.2	G84 S85 Q87	N82-G84 PolarHBondContact O-N 2.78Å; N82-G84 VanDerWaalsContact O-N 3.08Å; N82-S85 PolarHBondContact N-O 2.78Å; N82-S85 PolarHBondContact O-N 3.17Å; N82-S85 PolarHBondContact O-OG 3.04Å; N82-Q87 HydrophobicContact CB-CG 4.18Å
83	K	48	Very low	44.1	Very low	206 Å²	206	65 Å²	65	90%	0.896	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	32.2	-176.8	-63.8	-178.8	179.2	179.9	0	114.8	S85	K83-S85 VanDerWaalsContact C-N 3.26Å; K83-S85 PolarHBondContact O-N 2.89Å
84	G	36.7	Very low	43.6	Very low	46 Å²	46	63.3 Å²	63.3	47%	0.474	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	13.6	-179.9	0	0	0	0	0	114.4	N82 I132	N82-G84 PolarHBondContact O-N 2.78Å; N82-G84 VanDerWaalsContact O-N 3.08Å; G84-I132 WeakPolarHBondContact O-CG2 3.12Å
85	S	41.6	Very low	42.8	Very low	47 Å²	47	64.5 Å²	64.5	33%	0.329	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	135.6	165.2	58.1	0	0	0	0	110.1	V81 N82 K83 Q87	V81-S85 CarbonylContact C-O 3.59Å; V81-S85 WeakPolarHBondContact CA-O 3.38Å; N82-S85 PolarHBondContact N-O 2.78Å; N82-S85 PolarHBondContact O-N 3.17Å; N82-S85 PolarHBondContact O-OG 3.04Å; K83-S85 VanDerWaalsContact C-N 3.26Å; K83-S85 PolarHBondContact O-N 2.89Å; S85-Q87 PolarHBondContact O-N 2.96Å; S85-Q87 VanDerWaalsContact O-N 3.17Å
86	C	44.6	Very low	42.5	Very low	21 Å²	21	61.9 Å²	61.9	14%	0.142	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	116	162	-176	0	0	0	0	107.2	C78 P88 V131	C78-C86 HydrophobicContact CB-CB 3.99Å; C78-C86 WeakPolarHBondContact CB-SG 3.49Å; C78-C86 WeakPolarHBondContact SG-CB 3.47Å; C78-C86 CovalentContact SG-SG 2Å; C78-C86 PolarHBondContact SG-SG 3.35Å; C86-P88 WeakPolarHBondContact O-CD 2.99Å; C86-V131 WeakPolarHBondContact CA-O 3.05Å; C86-V131 WeakPolarHBondContact CB-O 3.06Å; C86-V131 PolarHBondContact N-O 3.15Å
87	Q	47.6	Very low	42	Very low	91 Å²	91	63 Å²	63	43%	0.425	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	114.2	165	-77.3	-172.6	-51.5	0	0	105.6	S80 N82 S85 C89	S80-Q87 PolarHBondContact O-N 3.12Å; S80-Q87 VanDerWaalsContact O-N 3.17Å; S80-Q87 PolarHBondContact OG-OE1 3Å; N82-Q87 HydrophobicContact CB-CG 4.18Å; S85-Q87 PolarHBondContact O-N 2.96Å; S85-Q87 VanDerWaalsContact O-N 3.17Å; Q87-C89 PolarHBondContact O-N 2.73Å
88	P	46.2	Very low	41.9	Very low	67 Å²	67	63.5 Å²	63.5	44%	0.435	37%	0.367	S	S	.	.			trans	-56.1	120.3	170.3	24.2	-30.5	0	0	0	105.2	C86 S90	C86-P88 WeakPolarHBondContact O-CD 2.99Å; P88-S90 PolarHBondContact O-N 2.72Å
89	C	41.5	Very low	41.6	Very low	16 Å²	16	64 Å²	64	11%	0.108	37%	0.371	C	S	.	.			trans	-43.5	139.8	-166.2	-57.9	0	0	0	0	110.8	Q87 G92 K93	Q87-C89 PolarHBondContact O-N 2.73Å; C89-G92 WeakPolarHBondContact CB-O 3.44Å; C89-K93 PolarHBondContact SG-O 3.13Å
90	S	34.3	Very low	41.5	Very low	108 Å²	108	61.2 Å²	61.2	76%	0.755	37%	0.367	S	S	*	.	S	Bend	trans	-35.2	128.7	148.4	-56.2	0	0	0	0	107.5	P88 G92	P88-S90 PolarHBondContact O-N 2.72Å; S90-G92 PolarHBondContact O-N 3.19Å
91	P	30.5	Very low	41.6	Very low	93 Å²	93	62.3 Å²	62.3	60%	0.604	37%	0.372	S	S	*	.	S	Bend	trans	-37.6	106	-158.6	8.9	-26.2	0	0	0	112	D40	D40-P91 WeakPolarHBondContact OD1-CB 3.36Å; D40-P91 WeakPolarHBondContact OD1-CG 3.39Å
92	G	29.5	Very low	41.8	Very low	29 Å²	29	62.2 Å²	62.2	30%	0.299	37%	0.372	S	S	.	.	S	Bend	trans	145.7	103.2	-172.2	0	0	0	0	0	113.7	C89 S90	C89-G92 WeakPolarHBondContact CB-O 3.44Å; S90-G92 PolarHBondContact O-N 3.19Å
93	K	37.5	Very low	41.8	Very low	123 Å²	123	63.6 Å²	63.6	54%	0.535	38%	0.376	S	S	.	.			trans	84.6	82.6	150.6	-43.8	-175.2	167.3	-171.8	0	116.3	E35 C89	E35-K93 HydrophobicContact CG-CB 4.33Å; E35-K93 HydrophobicContact CG-CG 4.35Å; E35-K93 WeakPolarHBondContact OE1-CD 3.36Å; E35-K93 WeakPolarHBondContact OE1-CE 3.32Å; E35-K93 WeakPolarHBondContact OE1-CG 3.13Å; E35-K93 IonicContact OE1-NZ 3.82Å; C89-K93 PolarHBondContact SG-O 3.13Å
94	V	42.7	Very low	41.6	Very low	4 Å²	4	55.4 Å²	55.4	2%	0.024	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	112.4	149.4	177.6	0	0	0	0	106.2	L36 M74 V76 A96	L36-V94 WeakPolarHBondContact CA-O 3.43Å; L36-V94 HydrophobicContact CB-CB 4.15Å; L36-V94 VanDerWaalsContact CB-O 3.3Å; L36-V94 WeakPolarHBondContact CB-O 3.49Å; L36-V94 HydrophobicContact CD1-CG1 4.33Å; L36-V94 PolarHBondContact N-O 2.82Å; L36-V94 PolarHBondContact O-N 3.04Å; M74-V94 HydrophobicContact CE-CG1 3.43Å; M74-V94 VanDerWaalsContact CE-CG1 3.43Å; V76-V94 HydrophobicContact CG1-CG1 4.4Å; V94-A96 PolarHBondContact O-N 3.43Å
95	I	39.8	Very low	41.7	Very low	28 Å²	28	61.3 Å²	61.3	14%	0.144	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	111	-179.9	-67.7	165.2	0	0	0	108.3	P29 F33 E35 L77	P29-I95 HydrophobicContact CG-CG2 3.93Å; F33-I95 HydrophobicContact CB-CG2 4.15Å; F33-I95 HydrophobicContact CD1-CG2 4.47Å; F33-I95 HydrophobicContact CD2-CB 4.32Å; F33-I95 HydrophobicContact CD2-CG1 4.38Å; F33-I95 HydrophobicContact CD2-CG2 3.3Å; F33-I95 HydrophobicContact CE2-CB 4.42Å; F33-I95 HydrophobicContact CE2-CD1 4.28Å; F33-I95 HydrophobicContact CE2-CG1 4Å; F33-I95 HydrophobicContact CE2-CG2 3.67Å; F33-I95 HydrophobicContact CG-CG2 3.74Å; F33-I95 HydrophobicContact CZ-CG2 4.41Å; E35-I95 HydrophobicContact CG-CG1 4.32Å; L77-I95 HydrophobicContact CB-CB 4.27Å; L77-I95 HydrophobicContact CD1-CB 3.95Å; L77-I95 HydrophobicContact CD1-CD1 4.07Å; L77-I95 HydrophobicContact CD1-CG2 4.01Å; L77-I95 HydrophobicContact CG-CB 4.38Å
96	A	45.8	Very low	41.5	Very low	1 Å²	1	61.8 Å²	61.8	1%	0.008	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	108.8	172.9	0	0	0	0	0	109.4	K34 L36 M74 V94 S98	K34-A96 PolarHBondContact N-O 2.99Å; K34-A96 WeakPolarHBondContact O-CB 3.46Å; K34-A96 PolarHBondContact O-N 2.82Å; K34-A96 VanDerWaalsContact O-O 3.08Å; L36-A96 HydrophobicContact CD1-CB 3.98Å; L36-A96 HydrophobicContact CG-CB 4.18Å; M74-A96 HydrophobicContact CB-CB 4.44Å; M74-A96 HydrophobicContact CE-CB 4.05Å; M74-A96 HydrophobicContact CG-CB 3.63Å; M74-A96 HydrophobicContact SD-CB 4.01Å; V94-A96 PolarHBondContact O-N 3.43Å; A96-S98 PolarHBondContact O-N 2.76Å
97	D	43.4	Very low	41.2	Very low	26 Å²	26	69.8 Å²	69.8	14%	0.139	40%	0.404	C	S	.	.			trans	-74.2	113.3	162.5	-172.4	3.9	0	0	0	108	P29 E73 H75 S99	P29-D97 HydrophobicContact CB-CB 4.48Å; P29-D97 HydrophobicContact CG-CB 4.43Å; E73-D97 CarbonylContact C-O 3.53Å; H75-D97 HydrophobicContact CB-CB 4.32Å; D97-S99 PolarHBondContact O-N 3.26Å
98	S	44.6	Very low	40.9	Very low	57 Å²	57	70.4 Å²	70.4	40%	0.399	41%	0.41	S	S	.	.			trans	-85.6	84.6	177.3	63.5	0	0	0	0	109.2	A96	A96-S98 PolarHBondContact O-N 2.76Å
99	S	43	Very low	40.6	Very low	19 Å²	19	71.8 Å²	71.8	13%	0.133	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-75.5	156.3	168	-83.3	0	0	0	0	110.8	E73 D97	E73-S99 VanDerWaalsContact OE1-CB 3.28Å; E73-S99 WeakPolarHBondContact OE1-CB 3.31Å; D97-S99 PolarHBondContact O-N 3.26Å
100	P	43	Very low	40.7	Very low	106 Å²	106	79 Å²	79	69%	0.688	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-61.2	150.8	-164.9	20.8	-31.7	0	0	0	113.8	T102	P100-T102 PolarHBondContact O-N 3.13Å
101	V	47.8	Very low	41.3	Very low	70 Å²	70	80 Å²	80	42%	0.424	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-48.9	117.8	-177.3	168.8	0	0	0	0	111.4	I70 Y71	I70-V101 HydrophobicContact CB-CG1 3.89Å; I70-V101 HydrophobicContact CG1-CG1 3.98Å; I70-V101 HydrophobicContact CG2-CB 4.05Å; I70-V101 HydrophobicContact CG2-CG1 3.23Å; I70-V101 HydrophobicContact CG2-CG2 3.61Å; Y71-V101 VanDerWaalsContact O-CA 3.23Å; Y71-V101 WeakPolarHBondContact O-CA 2.93Å
102	T	45.9	Very low	42.4	Very low	67 Å²	67	75.9 Å²	75.9	41%	0.411	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	122.8	170.5	10.1	0	0	0	0	109.1	Y71 P100	Y71-T102 PolarHBondContact N-O 2.96Å; Y71-T102 PolarHBondContact O-N 3.02Å; Y71-T102 VanDerWaalsContact O-N 3.12Å; P100-T102 PolarHBondContact O-N 3.13Å
103	Q	43.8	Very low	43.7	Very low	110 Å²	110	74.5 Å²	74.5	51%	0.514	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	103.6	169.2	-71.7	-178.1	14.1	0	0	107.8	Q105	Q103-Q105 PolarHBondContact O-N 3.31Å
104	S	43.2	Very low	44.6	Very low	34 Å²	34	69.5 Å²	69.5	24%	0.238	38%	0.381	C	S	.	.			trans	-80.6	119.8	172.2	78.4	0	0	0	0	109.4
105	Q	38.9	Very low	45.3	Very low	171 Å²	171	74 Å²	74	80%	0.799	40%	0.397	S	S	*	.			trans	-98.5	109.3	162.9	-71.6	-171.9	8.7	0	0	108.3	Q103	Q103-Q105 PolarHBondContact O-N 3.31Å
106	G	38.8	Very low	46.2	Very low	56 Å²	56	76.7 Å²	76.7	58%	0.577	41%	0.406	S	S	*	.	S	Bend	trans	81.6	117.2	169.9	0	0	0	0	0	114.8	D108	G106-D108 PolarHBondContact O-N 3.11Å
107	K	38.2	Very low	46.8	Very low	190 Å²	190	80 Å²	80	83%	0.826	42%	0.421	S	S	*	.	S	Bend	trans	71.7	1	155	-59.3	-170.8	178.5	-179	0	120.1	N109	K107-N109 PolarHBondContact O-N 3.42Å; K107-N109 VanDerWaalsContact O-N 3.13Å
108	D	39.7	Very low	47.6	Very low	104 Å²	104	87.5 Å²	87.5	56%	0.556	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-77.9	9.2	171.8	-67.4	-26.4	0	0	0	114.3	G106 Q110 L111 I112	G106-D108 PolarHBondContact O-N 3.11Å; D108-Q110 PolarHBondContact O-N 3.27Å; D108-L111 PolarHBondContact O-N 3.45Å; D108-I112 HydrophobicContact CB-CD1 4.17Å; D108-I112 VanDerWaalsContact O-CD1 3.27Å; D108-I112 WeakPolarHBondContact O-CD1 3.28Å; D108-I112 VanDerWaalsContact O-CG1 3.29Å; D108-I112 WeakPolarHBondContact O-CG1 3.47Å
109	N	39.8	Very low	48.2	Very low	95 Å²	95	86.1 Å²	86.1	51%	0.508	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-51.4	-15.2	177.6	-58.7	-0.5	0	0	0	114.7	K107	K107-N109 PolarHBondContact O-N 3.42Å; K107-N109 VanDerWaalsContact O-N 3.13Å
110	Q	43.5	Very low	49.1	Very low	169 Å²	169	92 Å²	92	79%	0.79	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-81.2	-12.7	-171	-67.5	-170.6	2.1	0	0	114.9	D108	D108-Q110 PolarHBondContact O-N 3.27Å
111	L	47.8	Very low	50.2	Low	127 Å²	127	87.5 Å²	87.5	67%	0.665	44%	0.436	S	S	*	.	S	Bend	trans	-134.8	14	-179.1	-67.2	171.1	0	0	0	114.1	D108	D108-L111 PolarHBondContact O-N 3.45Å
112	I	54.5	Low	50.8	Low	8 Å²	8	85 Å²	85	4%	0.041	42%	0.421	C	S	.	.			trans	-97.5	105.4	-175.3	-58.8	173.7	0	0	0	109.2	Y71 D108 V114 Y138	Y71-I112 HydrophobicContact CD1-CG2 3.39Å; Y71-I112 HydrophobicContact CD2-CD1 4.21Å; Y71-I112 HydrophobicContact CE1-CD1 4.4Å; Y71-I112 HydrophobicContact CE1-CG2 3.23Å; Y71-I112 HydrophobicContact CE2-CD1 3.85Å; Y71-I112 HydrophobicContact CG-CG2 4.14Å; D108-I112 HydrophobicContact CB-CD1 4.17Å; D108-I112 VanDerWaalsContact O-CD1 3.27Å; D108-I112 WeakPolarHBondContact O-CD1 3.28Å; D108-I112 VanDerWaalsContact O-CG1 3.29Å; D108-I112 WeakPolarHBondContact O-CG1 3.47Å; I112-V114 HydrophobicContact CG2-CG1 4.22Å; I112-V114 PolarHBondContact O-N 3.5Å; I112-V114 VanDerWaalsContact O-N 3.13Å; I112-Y138 CarbonylContact C-O 3.5Å; I112-Y138 WeakPolarHBondContact CA-O 3.43Å; I112-Y138 WeakPolarHBondContact CG2-O 3.38Å
113	A	56.4	Low	51.6	Low	0 Å²	0	82.4 Å²	82.4	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	99.8	169.4	0	0	0	0	0	109.2	R115 F121 I122 L129 L137 Y138 V139	A113-R115 VanDerWaalsContact C-N 3.28Å; A113-R115 PolarHBondContact O-N 2.69Å; A113-F121 HydrophobicContact CB-CB 3.92Å; A113-F121 HydrophobicContact CB-CD1 3.96Å; A113-F121 HydrophobicContact CB-CG 4.35Å; A113-I122 CarbonylContact C-O 3.55Å; A113-L129 HydrophobicContact CB-CD1 3.62Å; A113-L137 HydrophobicContact CB-CB 4.46Å; A113-L137 HydrophobicContact CB-CD1 4.43Å; A113-Y138 CarbonylContact C-O 3.51Å; A113-Y138 PolarHBondContact N-O 2.84Å; A113-V139 WeakPolarHBondContact O-CA 3.3Å; A113-V139 WeakPolarHBondContact O-CG1 3.23Å
114	V	55.3	Low	52.2	Low	18 Å²	18	84.7 Å²	84.7	11%	0.109	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	-18.8	-174.8	-62.3	0	0	0	0	113.9	I112 I122 R124 N140 N143	I112-V114 HydrophobicContact CG2-CG1 4.22Å; I112-V114 PolarHBondContact O-N 3.5Å; I112-V114 VanDerWaalsContact O-N 3.13Å; V114-I122 PolarHBondContact N-O 3.02Å; V114-R124 HydrophobicContact CG1-CB 3.92Å; V114-R124 HydrophobicContact CG2-CB 4.32Å; V114-N140 WeakPolarHBondContact O-CB 3.4Å; V114-N143 PolarHBondContact O-ND2 3.5Å
115	R	57.4	Low	53	Low	98 Å²	98	87.9 Å²	87.9	37%	0.37	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	157.7	178.5	66.7	-175	-173.7	-172.7	5.3	112.6	A113 E117 I122	A113-R115 VanDerWaalsContact C-N 3.28Å; A113-R115 PolarHBondContact O-N 2.69Å; R115-E117 IonicContact CZ-OE2 3.65Å; R115-E117 IonicContact NE-OE2 3.68Å; R115-E117 IonicContact NH2-OE2 3.5Å; R115-E117 PolarHBondContact NH2-OE2 3.24Å; R115-I122 HydrophobicContact CG-CB 3.98Å; R115-I122 PolarHBondContact N-O 3.14Å; R115-I122 PolarHBondContact O-N 2.8Å
116	Y	59.4	Low	54.2	Low	84 Å²	84	81.9 Å²	81.9	33%	0.329	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	121	170.7	-176	-105.4	0	0	0	109.1	G119 R120 F121	Y116-G119 WeakPolarHBondContact OH-CA 3.27Å; Y116-R120 WeakPolarHBondContact CA-O 3.49Å; Y116-F121 AromaticContact CD2-CD1 3.72Å; Y116-F121 HydrophobicContact CD2-CD1 3.72Å; Y116-F121 AromaticContact CD2-CD2 3.98Å; Y116-F121 HydrophobicContact CD2-CD2 3.98Å; Y116-F121 AromaticContact CD2-CE1 3.57Å; Y116-F121 HydrophobicContact CD2-CE1 3.57Å; Y116-F121 AromaticContact CD2-CE2 3.85Å; Y116-F121 HydrophobicContact CD2-CE2 3.85Å; Y116-F121 AromaticContact CD2-CG 3.93Å; Y116-F121 HydrophobicContact CD2-CG 3.93Å; Y116-F121 AromaticContact CD2-CZ 3.64Å; Y116-F121 HydrophobicContact CD2-CZ 3.64Å; Y116-F121 HydrophobicContact CE2-CD2 4.07Å; Y116-F121 HydrophobicContact CE2-CE1 4.21Å; Y116-F121 AromaticContact CE2-CE2 3.72Å; Y116-F121 HydrophobicContact CE2-CE2 3.72Å; Y116-F121 HydrophobicContact CE2-CG 4.48Å; Y116-F121 AromaticContact CE2-CZ 3.78Å; Y116-F121 HydrophobicContact CE2-CZ 3.78Å; Y116-F121 HydrophobicContact CG-CE1 4.31Å
117	E	58	Low	55.4	Low	70 Å²	70	85.5 Å²	85.5	33%	0.327	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	133.9	-176	-173.9	-174.9	170.2	0	0	109.7	R115 G119 R120 I122	R115-E117 IonicContact CZ-OE2 3.65Å; R115-E117 IonicContact NE-OE2 3.68Å; R115-E117 IonicContact NH2-OE2 3.5Å; R115-E117 PolarHBondContact NH2-OE2 3.24Å; E117-G119 PolarHBondContact O-N 3.23Å; E117-G119 VanDerWaalsContact O-N 3.12Å; E117-R120 PolarHBondContact N-O 3.36Å; E117-R120 WeakPolarHBondContact O-CB 3.29Å; E117-R120 PolarHBondContact O-N 3.34Å; E117-I122 HydrophobicContact CB-CD1 3.83Å
118	K	60	Low	56.7	Low	185 Å²	185	81 Å²	81	80%	0.804	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	40.6	176.2	-64.5	171.2	-174.9	179	0	113.6	R120	K118-R120 VanDerWaalsContact C-N 3.31Å; K118-R120 PolarHBondContact O-N 3.01Å
119	G	57	Low	57.6	Low	28 Å²	28	78 Å²	78	29%	0.289	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	10.1	179.8	0	0	0	0	0	115.1	Y116 E117	Y116-G119 WeakPolarHBondContact OH-CA 3.27Å; E117-G119 PolarHBondContact O-N 3.23Å; E117-G119 VanDerWaalsContact O-N 3.12Å
120	R	61.9	Low	58.4	Low	141 Å²	141	78 Å²	78	53%	0.532	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	140.5	-173.2	-61.4	179.7	-178.2	-176.7	1	111.1	Y116 E117 K118 I128	Y116-R120 WeakPolarHBondContact CA-O 3.49Å; E117-R120 PolarHBondContact N-O 3.36Å; E117-R120 WeakPolarHBondContact O-CB 3.29Å; E117-R120 PolarHBondContact O-N 3.34Å; K118-R120 VanDerWaalsContact C-N 3.31Å; K118-R120 PolarHBondContact O-N 3.01Å; R120-I128 HydrophobicContact CB-CG2 4.19Å; R120-I128 HydrophobicContact CG-CG2 4.41Å
121	F	66	Low	59	Low	12 Å²	12	70.3 Å²	70.3	5%	0.053	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	128.3	171	-67.1	-83	0	0	0	109.5	M74 V76 A113 Y116 I128 L129 V131 L137	M74-F121 HydrophobicContact CE-CE1 3.75Å; M74-F121 HydrophobicContact CE-CZ 3.5Å; M74-F121 HydrophobicContact SD-CE1 3.85Å; M74-F121 HydrophobicContact SD-CZ 4.23Å; V76-F121 HydrophobicContact CG2-CE2 4.1Å; V76-F121 HydrophobicContact CG2-CZ 3.89Å; A113-F121 HydrophobicContact CB-CB 3.92Å; A113-F121 HydrophobicContact CB-CD1 3.96Å; A113-F121 HydrophobicContact CB-CG 4.35Å; Y116-F121 AromaticContact CD2-CD1 3.72Å; Y116-F121 HydrophobicContact CD2-CD1 3.72Å; Y116-F121 AromaticContact CD2-CD2 3.98Å; Y116-F121 HydrophobicContact CD2-CD2 3.98Å; Y116-F121 AromaticContact CD2-CE1 3.57Å; Y116-F121 HydrophobicContact CD2-CE1 3.57Å; Y116-F121 AromaticContact CD2-CE2 3.85Å; Y116-F121 HydrophobicContact CD2-CE2 3.85Å; Y116-F121 AromaticContact CD2-CG 3.93Å; Y116-F121 HydrophobicContact CD2-CG 3.93Å; Y116-F121 AromaticContact CD2-CZ 3.64Å; Y116-F121 HydrophobicContact CD2-CZ 3.64Å; Y116-F121 HydrophobicContact CE2-CD2 4.07Å; Y116-F121 HydrophobicContact CE2-CE1 4.21Å; Y116-F121 AromaticContact CE2-CE2 3.72Å; Y116-F121 HydrophobicContact CE2-CE2 3.72Å; Y116-F121 HydrophobicContact CE2-CG 4.48Å; Y116-F121 AromaticContact CE2-CZ 3.78Å; Y116-F121 HydrophobicContact CE2-CZ 3.78Å; Y116-F121 HydrophobicContact CG-CE1 4.31Å; F121-I128 WeakPolarHBondContact O-CA 3Å; F121-L129 HydrophobicContact CB-CB 4.11Å; F121-L129 HydrophobicContact CB-CD1 4.3Å; F121-L129 PolarHBondContact O-N 2.87Å; F121-V131 HydrophobicContact CB-CG2 4.3Å; F121-V131 HydrophobicContact CD2-CB 4.42Å; F121-V131 HydrophobicContact CD2-CG2 3.57Å; F121-V131 HydrophobicContact CE2-CG2 4.24Å; F121-V131 HydrophobicContact CG-CG2 4.19Å; F121-L137 HydrophobicContact CB-CD1 4.23Å; F121-L137 HydrophobicContact CD1-CD1 3.44Å; F121-L137 VanDerWaalsContact CD1-CD1 3.44Å; F121-L137 HydrophobicContact CD2-CD1 3.7Å; F121-L137 HydrophobicContact CE1-CD1 3.58Å; F121-L137 HydrophobicContact CE2-CD1 3.82Å; F121-L137 HydrophobicContact CG-CD1 3.5Å; F121-L137 VanDerWaalsContact CG-CD1 3.5Å; F121-L137 HydrophobicContact CZ-CD1 3.77Å
122	I	61.1	Low	59	Low	19 Å²	19	67.8 Å²	67.8	10%	0.097	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	127.8	-176.2	-52	179.4	0	0	0	108.8	A113 V114 R115 E117 K127	A113-I122 CarbonylContact C-O 3.55Å; V114-I122 PolarHBondContact N-O 3.02Å; R115-I122 HydrophobicContact CG-CB 3.98Å; R115-I122 PolarHBondContact N-O 3.14Å; R115-I122 PolarHBondContact O-N 2.8Å; E117-I122 HydrophobicContact CB-CD1 3.83Å; I122-K127 WeakPolarHBondContact CA-O 3.3Å
123	T	63.8	Low	58.9	Low	11 Å²	11	73.5 Å²	73.5	7%	0.067	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	169.8	174.7	46	0	0	0	0	111.7	D125 G126 K127 L129	T123-D125 WeakPolarHBondContact CB-OD1 3.14Å; T123-D125 PolarHBondContact O-N 3.12Å; T123-D125 PolarHBondContact OG1-OD1 3.2Å; T123-G126 PolarHBondContact O-N 3.16Å; T123-K127 PolarHBondContact N-O 2.87Å; T123-K127 WeakPolarHBondContact OG1-CA 3.41Å; T123-K127 VanDerWaalsContact OG1-CB 3.31Å; T123-K127 WeakPolarHBondContact OG1-CB 3.45Å; T123-K127 PolarHBondContact OG1-N 3.04Å; T123-K127 PolarHBondContact OG1-O 2.86Å; T123-L129 HydrophobicContact CG2-CD1 3.74Å; T123-L129 HydrophobicContact CG2-CD2 3.59Å; T123-L129 HydrophobicContact CG2-CG 3.64Å
124	R	56.7	Low	58.5	Low	158 Å²	158	75 Å²	75	60%	0.596	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-32.2	-179.9	-169.1	176.6	176.7	170.9	0.1	113.3	V114 G126	V114-R124 HydrophobicContact CG1-CB 3.92Å; V114-R124 HydrophobicContact CG2-CB 4.32Å; R124-G126 PolarHBondContact O-N 3.07Å
125	D	60.1	Low	58.4	Low	101 Å²	101	76.6 Å²	76.6	54%	0.54	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	10.5	176.8	67.2	-16.4	0	0	0	113.1	T123 K127	T123-D125 WeakPolarHBondContact CB-OD1 3.14Å; T123-D125 PolarHBondContact O-N 3.12Å; T123-D125 PolarHBondContact OG1-OD1 3.2Å; D125-K127 VanDerWaalsContact C-N 3.31Å; D125-K127 PolarHBondContact O-N 2.92Å; D125-K127 VanDerWaalsContact OD2-CD 3.24Å; D125-K127 WeakPolarHBondContact OD2-CD 3.38Å; D125-K127 WeakPolarHBondContact OD2-CE 3.18Å; D125-K127 IonicContact OD2-NZ 2.7Å; D125-K127 PolarHBondContact OD2-NZ 2.95Å
126	G	63.4	Low	58.2	Low	46 Å²	46	74.6 Å²	74.6	47%	0.474	38%	0.38	S	S	.	.	S	Bend	trans	81.3	4.7	175.8	0	0	0	0	0	114.4	T123 R124	T123-G126 PolarHBondContact O-N 3.16Å; R124-G126 PolarHBondContact O-N 3.07Å
127	K	64	Low	58.2	Low	132 Å²	132	71.1 Å²	71.1	57%	0.574	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-76	137.6	177.6	-63.5	175.1	-178.7	143.1	0	111.1	I122 T123 D125	I122-K127 WeakPolarHBondContact CA-O 3.3Å; T123-K127 PolarHBondContact N-O 2.87Å; T123-K127 WeakPolarHBondContact OG1-CA 3.41Å; T123-K127 VanDerWaalsContact OG1-CB 3.31Å; T123-K127 WeakPolarHBondContact OG1-CB 3.45Å; T123-K127 PolarHBondContact OG1-N 3.04Å; T123-K127 PolarHBondContact OG1-O 2.86Å; D125-K127 VanDerWaalsContact C-N 3.31Å; D125-K127 PolarHBondContact O-N 2.92Å; D125-K127 VanDerWaalsContact OD2-CD 3.24Å; D125-K127 WeakPolarHBondContact OD2-CD 3.38Å; D125-K127 WeakPolarHBondContact OD2-CE 3.18Å; D125-K127 IonicContact OD2-NZ 2.7Å; D125-K127 PolarHBondContact OD2-NZ 2.95Å
128	I	64.9	Low	58.3	Low	95 Å²	95	71.2 Å²	71.2	49%	0.487	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	126.1	172.6	-64.2	162.3	0	0	0	108.5	R120 F121	R120-I128 HydrophobicContact CB-CG2 4.19Å; R120-I128 HydrophobicContact CG-CG2 4.41Å; F121-I128 WeakPolarHBondContact O-CA 3Å
129	L	58.5	Low	58.3	Low	40 Å²	40	62.7 Å²	62.7	21%	0.209	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	129.4	171.5	-65.7	170.7	0	0	0	109.6	A113 F121 T123 V131 L137	A113-L129 HydrophobicContact CB-CD1 3.62Å; F121-L129 HydrophobicContact CB-CB 4.11Å; F121-L129 HydrophobicContact CB-CD1 4.3Å; F121-L129 PolarHBondContact O-N 2.87Å; T123-L129 HydrophobicContact CG2-CD1 3.74Å; T123-L129 HydrophobicContact CG2-CD2 3.59Å; T123-L129 HydrophobicContact CG2-CG 3.64Å; L129-V131 HydrophobicContact CB-CG2 4.09Å; L129-L137 HydrophobicContact CD1-CD2 4.33Å
130	S	56.3	Low	58.3	Low	95 Å²	95	62.8 Å²	62.8	66%	0.664	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-82.6	119.8	162	-136.1	0	0	0	0	107.2
131	V	57	Low	58.1	Low	9 Å²	9	57 Å²	57	6%	0.055	31%	0.305	C	S	.	.			trans	-113.3	139.8	-175.7	-173.3	0	0	0	0	107.8	V76 C86 F121 L129 D135 L137	V76-V131 HydrophobicContact CB-CG1 3.76Å; V76-V131 HydrophobicContact CG1-CG1 3.8Å; V76-V131 HydrophobicContact CG2-CG1 3.87Å; C86-V131 WeakPolarHBondContact CA-O 3.05Å; C86-V131 WeakPolarHBondContact CB-O 3.06Å; C86-V131 PolarHBondContact N-O 3.15Å; F121-V131 HydrophobicContact CB-CG2 4.3Å; F121-V131 HydrophobicContact CD2-CB 4.42Å; F121-V131 HydrophobicContact CD2-CG2 3.57Å; F121-V131 HydrophobicContact CE2-CG2 4.24Å; F121-V131 HydrophobicContact CG-CG2 4.19Å; L129-V131 HydrophobicContact CB-CG2 4.09Å; V131-D135 WeakPolarHBondContact CA-OD2 3.49Å; V131-D135 HydrophobicContact CG1-CB 3.67Å; V131-L137 HydrophobicContact CG1-CD1 4.08Å; V131-L137 HydrophobicContact CG1-CG 4.46Å; V131-L137 HydrophobicContact CG2-CD1 3.83Å; V131-L137 HydrophobicContact CG2-CD2 4.29Å
132	I	48.1	Very low	57.6	Low	74 Å²	74	59.7 Å²	59.7	38%	0.379	33%	0.329	S	S	.	.			trans	-114.2	162.4	173.2	58.8	171.5	0	0	0	110.8	G84 G134 D135	G84-I132 WeakPolarHBondContact O-CG2 3.12Å; I132-G134 PolarHBondContact O-N 2.73Å; I132-D135 VanDerWaalsContact CG1-CG 3.44Å; I132-D135 WeakPolarHBondContact CG1-OD1 3.28Å; I132-D135 WeakPolarHBondContact CG1-OD2 3.14Å; I132-D135 PolarHBondContact N-OD2 3.47Å; I132-D135 VanDerWaalsContact O-CB 3.32Å; I132-D135 WeakPolarHBondContact O-CB 3.21Å; I132-D135 PolarHBondContact O-N 2.94Å; I132-D135 VanDerWaalsContact O-N 3.08Å
133	K	51.2	Low	57.1	Low	128 Å²	128	63.2 Å²	63.2	56%	0.557	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	128	175.7	-178	179.8	177.3	179.3	0	110	C78 V81	C78-K133 HydrophobicContact CB-CB 4.02Å; C78-K133 HydrophobicContact CB-CG 4.49Å; V81-K133 HydrophobicContact CG2-CB 3.56Å
134	G	48	Very low	56.2	Low	32 Å²	32	63.8 Å²	63.8	33%	0.33	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	-0	179.7	0	0	0	0	0	114	V76 I132	V76-G134 PolarHBondContact O-N 2.96Å; V76-G134 VanDerWaalsContact O-N 3.09Å; I132-G134 PolarHBondContact O-N 2.73Å
135	D	53.3	Low	55.6	Low	50 Å²	50	64 Å²	64	27%	0.267	36%	0.358	S	S	.	.			trans	-65.7	143	169.3	-77.2	-10.2	0	0	0	110.8	V76 V131 I132	V76-D135 PolarHBondContact N-O 3.08Å; V131-D135 WeakPolarHBondContact CA-OD2 3.49Å; V131-D135 HydrophobicContact CG1-CB 3.67Å; I132-D135 VanDerWaalsContact CG1-CG 3.44Å; I132-D135 WeakPolarHBondContact CG1-OD1 3.28Å; I132-D135 WeakPolarHBondContact CG1-OD2 3.14Å; I132-D135 PolarHBondContact N-OD2 3.47Å; I132-D135 VanDerWaalsContact O-CB 3.32Å; I132-D135 WeakPolarHBondContact O-CB 3.21Å; I132-D135 PolarHBondContact O-N 2.94Å; I132-D135 VanDerWaalsContact O-N 3.08Å
136	T	54.9	Low	54.5	Low	57 Å²	57	61.2 Å²	61.2	35%	0.35	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.5	169.6	-59.9	0	0	0	0	108	E73 H75 Y138	E73-T136 HydrophobicContact CG-CG2 3.39Å; H75-T136 PolarHBondContact CE1-OG1 3.44Å; H75-T136 PolarHBondContact ND1-OG1 3.12Å; T136-Y138 HydrophobicContact CG2-CE2 4.24Å
137	L	59.2	Low	53	Low	11 Å²	11	65.5 Å²	65.5	6%	0.058	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	150.4	176	-59.2	178.9	0	0	0	109.8	E73 M74 V76 A113 F121 L129 V131	E73-L137 CarbonylContact C-O 3.56Å; M74-L137 PolarHBondContact N-O 2.88Å; M74-L137 PolarHBondContact O-N 3.19Å; V76-L137 HydrophobicContact CG2-CD1 3.58Å; V76-L137 HydrophobicContact CG2-CG 4.03Å; A113-L137 HydrophobicContact CB-CB 4.46Å; A113-L137 HydrophobicContact CB-CD1 4.43Å; F121-L137 HydrophobicContact CB-CD1 4.23Å; F121-L137 HydrophobicContact CD1-CD1 3.44Å; F121-L137 VanDerWaalsContact CD1-CD1 3.44Å; F121-L137 HydrophobicContact CD2-CD1 3.7Å; F121-L137 HydrophobicContact CE1-CD1 3.58Å; F121-L137 HydrophobicContact CE2-CD1 3.82Å; F121-L137 HydrophobicContact CG-CD1 3.5Å; F121-L137 VanDerWaalsContact CG-CD1 3.5Å; F121-L137 HydrophobicContact CZ-CD1 3.77Å; L129-L137 HydrophobicContact CD1-CD2 4.33Å; V131-L137 HydrophobicContact CG1-CD1 4.08Å; V131-L137 HydrophobicContact CG1-CG 4.46Å; V131-L137 HydrophobicContact CG2-CD1 3.83Å; V131-L137 HydrophobicContact CG2-CD2 4.29Å
138	Y	59.1	Low	51.4	Low	72 Å²	72	68.6 Å²	68.6	28%	0.282	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	117.5	171.4	-65.4	-83.1	0	0	0	108.4	K72 E73 I112 A113 T136	K72-Y138 CarbonylContact O-C 3.53Å; K72-Y138 WeakPolarHBondContact O-CA 3.32Å; E73-Y138 HydrophobicContact CB-CD1 4.09Å; E73-Y138 HydrophobicContact CB-CE1 3.76Å; E73-Y138 HydrophobicContact CG-CD1 4.41Å; E73-Y138 HydrophobicContact CG-CE1 3.79Å; E73-Y138 VanDerWaalsContact OE2-CE1 3.3Å; E73-Y138 WeakPolarHBondContact OE2-CE1 3.18Å; E73-Y138 PolarHBondContact OE2-OH 2.62Å; I112-Y138 CarbonylContact C-O 3.5Å; I112-Y138 WeakPolarHBondContact CA-O 3.43Å; I112-Y138 WeakPolarHBondContact CG2-O 3.38Å; A113-Y138 CarbonylContact C-O 3.51Å; A113-Y138 PolarHBondContact N-O 2.84Å; T136-Y138 HydrophobicContact CG2-CE2 4.24Å
139	V	60.2	Low	50.7	Low	6 Å²	6	67.3 Å²	67.3	4%	0.036	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	141.9	-177.4	-121.7	0	0	0	0	111.4	Y71 K72 M74 A113 A141	Y71-V139 CarbonylContact C-O 3.58Å; Y71-V139 VanDerWaalsContact CA-O 3.32Å; Y71-V139 WeakPolarHBondContact CA-O 3.1Å; K72-V139 PolarHBondContact N-O 3.21Å; K72-V139 PolarHBondContact O-N 2.92Å; M74-V139 HydrophobicContact CB-CG2 3.44Å; M74-V139 VanDerWaalsContact CB-CG2 3.44Å; M74-V139 HydrophobicContact CG-CG2 4.2Å; M74-V139 HydrophobicContact SD-CG2 3.77Å; A113-V139 WeakPolarHBondContact O-CA 3.3Å; A113-V139 WeakPolarHBondContact O-CG1 3.23Å; V139-A141 PolarHBondContact O-N 2.78Å; V139-A141 VanDerWaalsContact O-N 3.14Å
140	N	57.3	Low	50.3	Low	30 Å²	30	68.7 Å²	68.7	16%	0.16	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	121	174.4	-175.6	-22.1	0	0	0	109.1	Y71 V114 A142 N143 H144	Y71-N140 HydrophobicContact CE1-CB 4.45Å; V114-N140 WeakPolarHBondContact O-CB 3.4Å; N140-A142 PolarHBondContact O-N 2.98Å; N140-A142 VanDerWaalsContact O-N 3.16Å; N140-A142 WeakPolarHBondContact OD1-CB 3.27Å; N140-A142 PolarHBondContact OD1-N 3.2Å; N140-N143 HydrophobicContact CB-CB 4.39Å; N140-N143 PolarHBondContact O-N 2.99Å; N140-N143 VanDerWaalsContact O-N 3.07Å; N140-H144 PolarHBondContact O-N 3.01Å
141	A	56.7	Low	50	Low	20 Å²	20	67.3 Å²	67.3	17%	0.165	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-29.9	-177.1	0	0	0	0	0	113.1	I70 K72 V139	I70-A141 HydrophobicContact CB-CB 4.37Å; I70-A141 HydrophobicContact CG2-CB 3.54Å; I70-A141 VanDerWaalsContact O-CB 3.27Å; I70-A141 WeakPolarHBondContact O-CB 3.17Å; I70-A141 PolarHBondContact O-N 3.41Å; K72-A141 HydrophobicContact CD-CB 4.07Å; K72-A141 HydrophobicContact CG-CB 3.93Å; V139-A141 PolarHBondContact O-N 2.78Å; V139-A141 VanDerWaalsContact O-N 3.14Å
142	A	56.1	Low	49.6	Very low	68 Å²	68	70.7 Å²	70.7	56%	0.562	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-36.6	178.3	0	0	0	0	0	112.5	N140	N140-A142 PolarHBondContact O-N 2.98Å; N140-A142 VanDerWaalsContact O-N 3.16Å; N140-A142 WeakPolarHBondContact OD1-CB 3.27Å; N140-A142 PolarHBondContact OD1-N 3.2Å
143	N	49.7	Very low	49.6	Very low	92 Å²	92	70.5 Å²	70.5	49%	0.492	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-18	177.5	-67.6	-21.1	0	0	0	112.4	V114 N140 Q145	V114-N143 PolarHBondContact O-ND2 3.5Å; N140-N143 HydrophobicContact CB-CB 4.39Å; N140-N143 PolarHBondContact O-N 2.99Å; N140-N143 VanDerWaalsContact O-N 3.07Å; N143-Q145 PolarHBondContact O-N 2.66Å
144	H	45.9	Very low	49.5	Very low	24 Å²	24	66.7 Å²	66.7	11%	0.111	39%	0.387	C	S	.	.			trans	-75.6	50	168.8	-164.2	-71.6	0	0	0	110.1	N140 S146	N140-H144 PolarHBondContact O-N 3.01Å; H144-S146 PolarHBondContact O-N 2.74Å
145	Q	43.6	Very low	49.7	Very low	163 Å²	163	69.1 Å²	69.1	76%	0.762	39%	0.391	S	S	*	.			trans	-59.3	112.2	164	-71.9	-168.6	-11.4	0	0	105.9	N143 N147	N143-Q145 PolarHBondContact O-N 2.66Å; Q145-N147 PolarHBondContact O-N 2.82Å
146	S	37.5	Very low	49.4	Very low	41 Å²	41	70.6 Å²	70.6	29%	0.287	40%	0.4	S	S	.	.			trans	-64.4	119.4	174.7	-51.7	0	0	0	0	104.7	K34 H144 T148	K34-S146 PolarHBondContact NZ-OG 3.12Å; H144-S146 PolarHBondContact O-N 2.74Å; S146-T148 PolarHBondContact O-N 2.57Å
147	N	31.7	Very low	48.9	Very low	137 Å²	137	71.8 Å²	71.8	73%	0.733	41%	0.405	S	S	*	.			trans	-60.8	87.6	162.3	-73.8	-12	0	0	0	106.3	Q145	Q145-N147 PolarHBondContact O-N 2.82Å
148	T	30.2	Very low	48	Very low	197 Å²	197	77.3 Å²	77.3	100%	1.209	44%	0.436	S	S	*	.			trans	-64.1	0	147.2	38.6	0	0	0	0	107.7	S146	S146-T148 PolarHBondContact O-N 2.57Å

Retrieved 148 of 148 residues in 94.8 ms (Link to these results)

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