A0A077Z5A3_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z5A3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 296 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	41.6	Very low	34.3	Very low	247 Å²	247	143.3 Å²	143.3	100%	1.217	81%	0.811	S	S	*	*				0	101.3	0	-72.7	-174	165.8	0	0	107.7
2	S	29.8	Very low	34.3	Very low	123 Å²	123	137.5 Å²	137.5	86%	0.86	78%	0.781	S	S	*	*			trans	-81.2	127.9	-172.2	-55.6	0	0	0	0	110.7
3	R	33.5	Very low	34.1	Very low	250 Å²	250	135.3 Å²	135.3	94%	0.943	76%	0.764	S	S	*	*			trans	-96.5	106.8	168.1	-111.9	179.1	169.6	170.6	-3.1	107.7	S5	R3-S5 PolarHBondContact O-N 3.49Å
4	E	35.2	Very low	33.9	Very low	192 Å²	192	130 Å²	130	90%	0.897	75%	0.745	S	S	*	*			trans	-63	120.4	169.7	-75.1	174.1	131.3	0	0	110	G6	E4-G6 PolarHBondContact O-N 2.98Å
5	S	35.1	Very low	33.7	Very low	112 Å²	112	134.5 Å²	134.5	78%	0.783	75%	0.745	S	S	*	*			trans	-72.7	105.8	162.4	46.5	0	0	0	0	108.9	R3 Q7	R3-S5 PolarHBondContact O-N 3.49Å; S5-Q7 PolarHBondContact O-N 3.29Å; S5-Q7 VanDerWaalsContact O-N 3.07Å
6	G	30.8	Very low	33.6	Very low	69 Å²	69	137.1 Å²	137.1	71%	0.711	74%	0.74	S	S	*	*			trans	-65.7	102.6	171.2	0	0	0	0	0	111.1	E4 V8	E4-G6 PolarHBondContact O-N 2.98Å; G6-V8 PolarHBondContact O-N 3.5Å; G6-V8 VanDerWaalsContact O-N 3.13Å
7	Q	30.9	Very low	33.5	Very low	191 Å²	191	135.3 Å²	135.3	89%	0.893	73%	0.729	S	S	*	*			trans	-57.3	108.1	161.5	-83.2	175.6	-38.7	0	0	108.9	S5 A9	S5-Q7 PolarHBondContact O-N 3.29Å; S5-Q7 VanDerWaalsContact O-N 3.07Å; Q7-A9 PolarHBondContact O-N 3.43Å
8	V	35.8	Very low	33.2	Very low	132 Å²	132	133.1 Å²	133.1	80%	0.8	72%	0.717	S	S	*	*			trans	-74	112.4	165.7	177.7	0	0	0	0	106.9	G6 D10	G6-V8 PolarHBondContact O-N 3.5Å; G6-V8 VanDerWaalsContact O-N 3.13Å; V8-D10 PolarHBondContact O-N 2.71Å
9	A	33.6	Very low	33.2	Very low	65 Å²	65	135.2 Å²	135.2	54%	0.537	71%	0.714	S	S	.	*			trans	-57.8	120.8	-175.1	0	0	0	0	0	112.7	Q7 G11 T12	Q7-A9 PolarHBondContact O-N 3.43Å; A9-G11 PolarHBondContact O-N 3.48Å; A9-T12 PolarHBondContact O-N 3.2Å; A9-T12 PolarHBondContact O-OG1 2.93Å
10	D	38.2	Very low	33	Very low	148 Å²	148	136.8 Å²	136.8	79%	0.791	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.7	-15.3	173	-91	-38.1	0	0	0	114.6	V8 T12	V8-D10 PolarHBondContact O-N 2.71Å; D10-T12 PolarHBondContact O-N 3.22Å
11	G	32.9	Very low	32.9	Very low	47 Å²	47	140.5 Å²	140.5	49%	0.485	72%	0.719	S	S	.	*	H	α-helix	trans	-73.3	-19.1	178.7	0	0	0	0	0	115.5	A9 R15	A9-G11 PolarHBondContact O-N 3.48Å; G11-R15 PolarHBondContact O-N 2.9Å
12	T	34	Very low	32.4	Very low	74 Å²	74	133.2 Å²	133.2	45%	0.454	69%	0.688	S	S	.	*	H	α-helix	trans	-80.9	-28.2	-172.5	-24.1	0	0	0	0	112.7	A9 D10 R16	A9-T12 PolarHBondContact O-N 3.2Å; A9-T12 PolarHBondContact O-OG1 2.93Å; D10-T12 PolarHBondContact O-N 3.22Å; T12-R16 WeakPolarHBondContact O-CG 3.3Å
13	I	32.4	Very low	32.2	Very low	109 Å²	109	130.8 Å²	130.8	56%	0.559	68%	0.683	S	S	*	*	H	α-helix	trans	-80.7	-41	178.5	-60.8	173.9	0	0	0	110.1	R15 R16 I17	I13-R15 VanDerWaalsContact C-N 3.34Å; I13-R15 PolarHBondContact O-N 3.42Å; I13-R16 PolarHBondContact O-N 3.22Å; I13-R16 VanDerWaalsContact O-N 3.1Å; I13-I17 HydrophobicContact CG2-CD1 4.29Å; I13-I17 PolarHBondContact O-N 2.97Å
14	A	30.8	Very low	31.9	Very low	61 Å²	61	122.4 Å²	122.4	50%	0.504	66%	0.663	S	S	.	*	H	α-helix	trans	-60.3	-41.2	176.6	0	0	0	0	0	112.4	R16 I17	A14-R16 VanDerWaalsContact C-N 3.29Å; A14-R16 PolarHBondContact O-N 3.44Å; A14-I17 PolarHBondContact O-N 3.28Å
15	R	31.4	Very low	31.7	Very low	198 Å²	198	119.8 Å²	119.8	75%	0.747	66%	0.659	S	S	*	*	H	α-helix	trans	-67.9	-23.5	175.7	-84.3	-175.5	173	175.7	-0.7	114.2	G11 I13 W19	G11-R15 PolarHBondContact O-N 2.9Å; I13-R15 VanDerWaalsContact C-N 3.34Å; I13-R15 PolarHBondContact O-N 3.42Å; R15-W19 PolarHBondContact O-NE1 3.24Å
16	R	31.1	Very low	31.5	Very low	176 Å²	176	118.9 Å²	118.9	66%	0.664	65%	0.649	S	S	*	*	H	α-helix	trans	-81.4	-20.3	179.5	-78	177.5	175.5	-156.5	-0.6	113.1	T12 I13 A14	T12-R16 WeakPolarHBondContact O-CG 3.3Å; I13-R16 PolarHBondContact O-N 3.22Å; I13-R16 VanDerWaalsContact O-N 3.1Å; A14-R16 VanDerWaalsContact C-N 3.29Å; A14-R16 PolarHBondContact O-N 3.44Å
17	I	32.1	Very low	31.3	Very low	106 Å²	106	120.1 Å²	120.1	54%	0.544	64%	0.644	S	S	.	*	H	α-helix	trans	-84.1	-30.3	179.6	-62.3	171	0	0	0	111.5	I13 A14 W19 F20	I13-I17 HydrophobicContact CG2-CD1 4.29Å; I13-I17 PolarHBondContact O-N 2.97Å; A14-I17 PolarHBondContact O-N 3.28Å; I17-W19 PolarHBondContact O-N 3.1Å; I17-F20 PolarHBondContact O-N 3.04Å
18	D	29.3	Very low	31.1	Very low	95 Å²	95	117.2 Å²	117.2	51%	0.508	65%	0.646	S	S	.	*	H	α-helix	trans	-68.4	-18.6	176.9	-82.4	-26.3	0	0	0	114.1	F20 R21 T22	D18-F20 VanDerWaalsContact C-N 3.32Å; D18-F20 PolarHBondContact O-N 2.85Å; D18-R21 PolarHBondContact O-N 2.96Å; D18-T22 PolarHBondContact O-OG1 3.35Å
19	W	32.1	Very low	30.8	Very low	174 Å²	174	118.5 Å²	118.5	66%	0.659	65%	0.646	S	S	*	*	H	α-helix	trans	-68.5	-31.3	177.9	-74.8	33.1	0	0	0	112.3	R15 I17 V26	R15-W19 PolarHBondContact O-NE1 3.24Å; I17-W19 PolarHBondContact O-N 3.1Å; W19-V26 HydrophobicContact CZ3-CG2 4.49Å
20	F	30.3	Very low	30.5	Very low	167 Å²	167	118.5 Å²	118.5	73%	0.732	65%	0.652	S	S	*	*	H	α-helix	trans	-77	-22	176.7	-86.9	-86	0	0	0	113.4	I17 D18	I17-F20 PolarHBondContact O-N 3.04Å; D18-F20 VanDerWaalsContact C-N 3.32Å; D18-F20 PolarHBondContact O-N 2.85Å
21	R	29.4	Very low	30	Very low	214 Å²	214	120.5 Å²	120.5	81%	0.808	66%	0.657	S	S	*	*	H	α-helix	trans	-83.9	-20.3	-179.1	-89.7	-176.1	175.6	177.6	0.2	114.5	D18	D18-R21 PolarHBondContact O-N 2.96Å
22	T	31.3	Very low	29.9	Very low	94 Å²	94	122.7 Å²	122.7	58%	0.577	66%	0.662	S	S	*	*	S	Bend	trans	-101.7	-4.1	-169.3	51.4	0	0	0	0	114.5	D18 S24	D18-T22 PolarHBondContact O-OG1 3.35Å; T22-S24 PolarHBondContact O-N 3.37Å; T22-S24 PolarHBondContact OG1-OG 2.87Å; T22-S24 VanDerWaalsContact OG1-OG 3.1Å
23	G	26.9	Very low	29.7	Very low	72 Å²	72	124.9 Å²	124.9	74%	0.742	68%	0.678	S	S	*	*			trans	55.8	21.5	177.6	0	0	0	0	0	113.7	V25	G23-V25 PolarHBondContact O-N 2.95Å
24	S	26.9	Very low	29.4	Very low	75 Å²	75	127.1 Å²	127.1	52%	0.524	70%	0.696	S	S	.	*	P	Polyproline II helix	trans	-81.9	118.2	-173.9	47.6	0	0	0	0	109.5	T22 V26	T22-S24 PolarHBondContact O-N 3.37Å; T22-S24 PolarHBondContact OG1-OG 2.87Å; T22-S24 VanDerWaalsContact OG1-OG 3.1Å; S24-V26 PolarHBondContact O-N 3.03Å
25	V	30	Very low	29.3	Very low	136 Å²	136	127.8 Å²	127.8	82%	0.824	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-57.3	118.7	173.3	179.7	0	0	0	0	107.9	G23 P27	G23-V25 PolarHBondContact O-N 2.95Å; V25-P27 VanDerWaalsContact O-CD 3.3Å; V25-P27 WeakPolarHBondContact O-CD 3.44Å
26	V	30.8	Very low	29.3	Very low	94 Å²	94	123.1 Å²	123.1	57%	0.57	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-58.6	119.2	173.4	174.5	0	0	0	0	108.1	W19 S24 S28	W19-V26 HydrophobicContact CZ3-CG2 4.49Å; S24-V26 PolarHBondContact O-N 3.03Å; V26-S28 PolarHBondContact O-N 2.95Å
27	P	27.5	Very low	29.3	Very low	94 Å²	94	119 Å²	119	61%	0.61	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-64.6	131.8	166.3	27	-30.3	0	0	0	107.7	V25 I29	V25-P27 VanDerWaalsContact O-CD 3.3Å; V25-P27 WeakPolarHBondContact O-CD 3.44Å; P27-I29 PolarHBondContact O-N 3.3Å
28	S	27.1	Very low	29.1	Very low	131 Å²	131	121.6 Å²	121.6	92%	0.916	73%	0.731	S	S	*	*			trans	-53.9	96.3	-177.9	-47.1	0	0	0	0	111.4	V26	V26-S28 PolarHBondContact O-N 2.95Å
29	I	27.9	Very low	29.4	Very low	159 Å²	159	124.8 Å²	124.8	82%	0.815	75%	0.748	S	S	*	*			trans	-104.1	106.3	170.8	-63.7	168.4	0	0	0	106.7	P27	P27-I29 PolarHBondContact O-N 3.3Å
30	G	29	Very low	29.3	Very low	64 Å²	64	124.1 Å²	124.1	66%	0.66	76%	0.758	S	S	*	*			trans	122.4	75.7	170.5	0	0	0	0	0	113.5
31	Q	27.8	Very low	29.6	Very low	191 Å²	191	123 Å²	123	89%	0.893	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-56.1	127.4	159.1	-83.1	172.5	-43.9	0	0	108.7
32	P	29	Very low	29.5	Very low	92 Å²	92	117.3 Å²	117.3	60%	0.597	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-64	147.5	167.9	27.5	-31.7	0	0	0	109.3	V34	P32-V34 PolarHBondContact O-N 3.2Å
33	P	30.1	Very low	29.5	Very low	121 Å²	121	121.7 Å²	121.7	79%	0.786	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-57.5	128.7	-178.1	22.9	-32.2	0	0	0	110.9	G35	P33-G35 PolarHBondContact O-N 3.29Å
34	V	27.7	Very low	29.6	Very low	156 Å²	156	122.1 Å²	122.1	95%	0.945	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	115.5	173.1	179.1	0	0	0	0	108.4	P32	P32-V34 PolarHBondContact O-N 3.2Å
35	G	28.1	Very low	29.6	Very low	74 Å²	74	123.3 Å²	123.3	76%	0.763	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	150.5	-5.3	176.5	0	0	0	0	0	117.2	P33 A37	P33-G35 PolarHBondContact O-N 3.29Å; G35-A37 PolarHBondContact O-N 3.27Å
36	A	30.2	Very low	29.5	Very low	100 Å²	100	125.1 Å²	125.1	83%	0.826	77%	0.77	S	S	*	*			trans	-84	102.6	171.4	0	0	0	0	0	109.3
37	A	31.5	Very low	29.4	Very low	89 Å²	89	128 Å²	128	74%	0.736	78%	0.777	S	S	*	*			trans	-51.5	143.9	178.9	0	0	0	0	0	112.6	G35 D39	G35-A37 PolarHBondContact O-N 3.27Å; A37-D39 PolarHBondContact O-N 3.32Å
38	D	28.3	Very low	29.4	Very low	161 Å²	161	127.4 Å²	127.4	86%	0.861	77%	0.768	S	S	*	*			trans	-48.3	114.5	171.9	-68.7	-57.9	0	0	0	111.3
39	D	35.5	Very low	29.3	Very low	162 Å²	162	123 Å²	123	87%	0.866	74%	0.744	S	S	*	*			trans	-118.2	115.3	151	-90.8	-44.8	0	0	0	107.1	A37 D41	A37-D39 PolarHBondContact O-N 3.32Å; D39-D41 PolarHBondContact O-N 3.47Å
40	D	30.7	Very low	29.3	Very low	160 Å²	160	118.5 Å²	118.5	86%	0.856	73%	0.731	S	S	*	*	S	Bend	trans	-48.9	91.8	175.8	-85.4	-61.5	0	0	0	112.1
41	D	35.5	Very low	29.3	Very low	145 Å²	145	119.4 Å²	119.4	78%	0.775	72%	0.72	S	S	*	*			trans	-164.2	91.3	153.4	-98.2	-31.9	0	0	0	108.6	D39 R43	D39-D41 PolarHBondContact O-N 3.47Å; D41-R43 PolarHBondContact O-N 3.4Å
42	G	28.1	Very low	29.3	Very low	93 Å²	93	112.8 Å²	112.8	96%	0.959	70%	0.698	S	S	*	*			trans	-65.1	43.6	-178.4	0	0	0	0	0	116
43	R	30.5	Very low	29.3	Very low	186 Å²	186	117 Å²	117	70%	0.702	71%	0.707	S	S	*	*			trans	-107.9	97.8	-179.8	-81.9	-179.1	171.1	-176.6	-1.2	112.1	D41 S45	D41-R43 PolarHBondContact O-N 3.4Å; R43-S45 PolarHBondContact O-N 3.41Å
44	S	29	Very low	29.5	Very low	82 Å²	82	113.5 Å²	113.5	57%	0.573	69%	0.685	S	S	*	*			trans	52	34.6	137.5	61.5	0	0	0	0	118.7	F46	S44-F46 PolarHBondContact O-N 3.39Å
45	S	27.9	Very low	29.9	Very low	99 Å²	99	107.6 Å²	107.6	69%	0.692	65%	0.648	S	S	*	*	H	α-helix	trans	-65.7	-16	173.1	49.2	0	0	0	0	113.5	R43	R43-S45 PolarHBondContact O-N 3.41Å
46	F	26.2	Very low	30.2	Very low	175 Å²	175	105.7 Å²	105.7	77%	0.768	63%	0.628	S	S	*	*	H	α-helix	trans	-82.6	-10.4	-176.6	-97.4	-91.1	0	0	0	116.3	S44	S44-F46 PolarHBondContact O-N 3.39Å
47	Q	29.2	Very low	30.6	Very low	153 Å²	153	108.3 Å²	108.3	72%	0.715	62%	0.621	S	S	*	*	H	α-helix	trans	-102.1	-21.1	-177.1	-74.3	-175.5	-5.6	0	0	114.8
48	L	28	Very low	31	Very low	82 Å²	82	109.6 Å²	109.6	43%	0.429	61%	0.612	S	S	.	*	H	α-helix	trans	-80	-27.1	178.3	-90.2	135.3	0	0	0	113.1	A50 L51 A52 K110	L48-A50 VanDerWaalsContact C-N 3.3Å; L48-A50 PolarHBondContact O-N 2.98Å; L48-L51 PolarHBondContact O-N 2.89Å; L48-A52 PolarHBondContact O-N 3.43Å; L48-K110 HydrophobicContact CD2-CG 4.05Å
49	G	25.7	Very low	31.7	Very low	40 Å²	40	109.9 Å²	109.9	41%	0.412	61%	0.608	S	S	.	*	H	α-helix	trans	-63.3	-34.7	174.8	0	0	0	0	0	113.1	F53	G49-F53 WeakPolarHBondContact O-CB 3.42Å; G49-F53 WeakPolarHBondContact O-CD2 3.35Å; G49-F53 PolarHBondContact O-N 3.41Å
50	A	26.3	Very low	31.9	Very low	64 Å²	64	104.3 Å²	104.3	53%	0.529	59%	0.589	S	S	.	*	H	α-helix	trans	-72.7	-29.6	-179.1	0	0	0	0	0	113.4	L48 C54	L48-A50 VanDerWaalsContact C-N 3.3Å; L48-A50 PolarHBondContact O-N 2.98Å; A50-C54 PolarHBondContact O-SG 3.37Å
51	L	29.7	Very low	32.3	Very low	82 Å²	82	100.7 Å²	100.7	43%	0.429	57%	0.565	S	S	.	*	H	α-helix	trans	-81.1	-33.2	177.4	-93.2	155.8	0	0	0	112.6	L48 F53 C54 I113	L48-L51 PolarHBondContact O-N 2.89Å; L51-F53 VanDerWaalsContact C-N 3.28Å; L51-C54 PolarHBondContact O-N 2.93Å; L51-I113 HydrophobicContact CD1-CD1 4.4Å; L51-I113 HydrophobicContact CD1-CG2 4.46Å; L51-I113 HydrophobicContact CD2-CD1 3.98Å
52	A	28.2	Very low	32.7	Very low	52 Å²	52	94.1 Å²	94.1	43%	0.43	53%	0.53	S	S	.	.	H	α-helix	trans	-68.5	-28.6	172	0	0	0	0	0	112.3	L48 C54	L48-A52 PolarHBondContact O-N 3.43Å; A52-C54 VanDerWaalsContact C-N 3.26Å; A52-C54 PolarHBondContact O-N 2.93Å
53	F	29.6	Very low	33.2	Very low	181 Å²	181	90.4 Å²	90.4	79%	0.794	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-12.6	178.8	-109.3	-93	0	0	0	114.8	G49 L51	G49-F53 WeakPolarHBondContact O-CB 3.42Å; G49-F53 WeakPolarHBondContact O-CD2 3.35Å; G49-F53 PolarHBondContact O-N 3.41Å; L51-F53 VanDerWaalsContact C-N 3.28Å
54	C	33.2	Very low	33.9	Very low	48 Å²	48	84.8 Å²	84.8	32%	0.324	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-5.1	-177.1	-70.1	0	0	0	0	114.2	A50 L51 A52 G56 P65	A50-C54 PolarHBondContact O-SG 3.37Å; L51-C54 PolarHBondContact O-N 2.93Å; A52-C54 VanDerWaalsContact C-N 3.26Å; A52-C54 PolarHBondContact O-N 2.93Å; C54-G56 PolarHBondContact O-N 3.35Å; C54-P65 HydrophobicContact CB-CG 4.27Å; C54-P65 WeakPolarHBondContact O-CD 3.46Å; C54-P65 VanDerWaalsContact O-CG 3.31Å; C54-P65 WeakPolarHBondContact O-CG 3.44Å
55	L	36.1	Very low	34.4	Very low	31 Å²	31	84.8 Å²	84.8	16%	0.162	47%	0.47	C	S	.	.			trans	-89.5	103.7	-178.8	-69.3	158.5	0	0	0	109.8	L62 L63 L64 T105 L109	L55-L62 HydrophobicContact CB-CD2 3.99Å; L55-L62 HydrophobicContact CD1-CD2 3.6Å; L55-L62 HydrophobicContact CD2-CD2 3.82Å; L55-L62 HydrophobicContact CG-CD2 3.99Å; L55-L63 WeakPolarHBondContact CA-O 3.35Å; L55-L64 HydrophobicContact CD2-CD2 4.01Å; L55-L64 HydrophobicContact CD2-CG 4.13Å; L55-T105 HydrophobicContact CD1-CG2 3.24Å; L55-L109 HydrophobicContact CD1-CD1 3.85Å; L55-L109 HydrophobicContact CD1-CD2 4.5Å
56	G	34.5	Very low	35.1	Very low	34 Å²	34	83.1 Å²	83.1	35%	0.351	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	136.1	169.2	0	0	0	0	0	109.7	C54 L63	C54-G56 PolarHBondContact O-N 3.35Å; G56-L63 PolarHBondContact N-O 3.36Å; G56-L63 VanDerWaalsContact O-CB 3.3Å; G56-L63 WeakPolarHBondContact O-CB 3.49Å; G56-L63 PolarHBondContact O-N 3.43Å
57	K	39.3	Very low	35.6	Very low	155 Å²	155	83.3 Å²	83.3	67%	0.674	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	107.4	171.5	-173.5	178.2	178.8	178.3	0	108	I101	K57-I101 HydrophobicContact CD-CD1 4.12Å; K57-I101 HydrophobicContact CG-CD1 4.39Å
58	E	39.8	Very low	36	Very low	117 Å²	117	81.4 Å²	81.4	55%	0.547	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.8	165.7	-106.5	-174.8	143.1	0	0	107.8	G60 K61 L63	E58-G60 PolarHBondContact O-N 3.23Å; E58-K61 PolarHBondContact N-O 2.71Å; E58-K61 WeakPolarHBondContact O-CB 3.19Å; E58-K61 PolarHBondContact O-N 2.95Å; E58-L63 HydrophobicContact CB-CD1 3.9Å; E58-L63 HydrophobicContact CG-CD1 4.41Å
59	E	41.7	Very low	36.9	Very low	167 Å²	167	79.5 Å²	79.5	78%	0.78	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	35	172.2	-53.3	-174	148.6	0	0	115.8	K61	E59-K61 PolarHBondContact O-N 3.23Å; E59-K61 IonicContact OE2-NZ 3.09Å; E59-K61 PolarHBondContact OE2-NZ 2.94Å
60	G	40.3	Very low	37.6	Very low	45 Å²	45	80.8 Å²	80.8	46%	0.464	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	11.6	-178.6	0	0	0	0	0	114.7	E58	E58-G60 PolarHBondContact O-N 3.23Å
61	K	39	Very low	38.4	Very low	83 Å²	83	81.4 Å²	81.4	36%	0.361	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.3	173.7	-62.4	153	-175.3	163.1	0	109.2	E58 E59 V72	E58-K61 PolarHBondContact N-O 2.71Å; E58-K61 WeakPolarHBondContact O-CB 3.19Å; E58-K61 PolarHBondContact O-N 2.95Å; E59-K61 PolarHBondContact O-N 3.23Å; E59-K61 IonicContact OE2-NZ 3.09Å; E59-K61 PolarHBondContact OE2-NZ 2.94Å; K61-V72 HydrophobicContact CB-CG1 3.55Å; K61-V72 HydrophobicContact CD-CG1 3.63Å; K61-V72 HydrophobicContact CG-CG1 3.71Å
62	L	43.3	Very low	39	Very low	7 Å²	7	80.1 Å²	80.1	4%	0.037	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	125.4	166.4	-83.4	129.8	0	0	0	108.3	L55 L73 I101 M104	L55-L62 HydrophobicContact CB-CD2 3.99Å; L55-L62 HydrophobicContact CD1-CD2 3.6Å; L55-L62 HydrophobicContact CD2-CD2 3.82Å; L55-L62 HydrophobicContact CG-CD2 3.99Å; L62-L73 HydrophobicContact CB-CB 4.5Å; L62-L73 HydrophobicContact CB-CD1 3.62Å; L62-L73 HydrophobicContact CB-CD2 4.38Å; L62-L73 HydrophobicContact CB-CG 4.38Å; L62-L73 VanDerWaalsContact O-CD1 3.26Å; L62-L73 WeakPolarHBondContact O-CD1 3.31Å; L62-L73 PolarHBondContact O-N 3.2Å; L62-I101 HydrophobicContact CD1-CG1 4.12Å; L62-I101 HydrophobicContact CD1-CG2 4Å; L62-I101 HydrophobicContact CD2-CG2 3.79Å; L62-I101 HydrophobicContact CG-CG1 4.49Å; L62-I101 HydrophobicContact CG-CG2 3.83Å; L62-M104 HydrophobicContact CD1-SD 3.87Å
63	L	39.2	Very low	40	Very low	16 Å²	16	78.6 Å²	78.6	8%	0.084	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.2	175	-60.5	-178.5	0	0	0	109.8	L55 G56 E58 P65 L71 V72	L55-L63 WeakPolarHBondContact CA-O 3.35Å; G56-L63 PolarHBondContact N-O 3.36Å; G56-L63 VanDerWaalsContact O-CB 3.3Å; G56-L63 WeakPolarHBondContact O-CB 3.49Å; G56-L63 PolarHBondContact O-N 3.43Å; E58-L63 HydrophobicContact CB-CD1 3.9Å; E58-L63 HydrophobicContact CG-CD1 4.41Å; L63-P65 WeakPolarHBondContact O-CD 3.2Å; L63-L71 WeakPolarHBondContact CA-O 3.25Å; L63-V72 HydrophobicContact CD2-CB 4.24Å; L63-V72 HydrophobicContact CD2-CG1 4.23Å; L63-V72 HydrophobicContact CD2-CG2 3.81Å
64	L	45.6	Very low	40.5	Very low	67 Å²	67	73.6 Å²	73.6	35%	0.351	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	117.2	166.5	-77.8	152.5	0	0	0	108.5	L55 T66 L71 L73	L55-L64 HydrophobicContact CD2-CD2 4.01Å; L55-L64 HydrophobicContact CD2-CG 4.13Å; L64-T66 PolarHBondContact O-N 3.39Å; L64-L71 HydrophobicContact CB-CB 4.03Å; L64-L71 PolarHBondContact N-O 2.96Å; L64-L71 PolarHBondContact O-N 2.86Å; L64-L73 HydrophobicContact CD1-CD1 3.5Å; L64-L73 HydrophobicContact CD1-CG 4.15Å; L64-L73 HydrophobicContact CG-CD1 3.8Å
65	P	40.4	Very low	41	Very low	83 Å²	83	79.4 Å²	79.4	54%	0.539	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	126.2	174.2	26.8	-32.1	0	0	0	109.2	C54 L63	C54-P65 HydrophobicContact CB-CG 4.27Å; C54-P65 WeakPolarHBondContact O-CD 3.46Å; C54-P65 VanDerWaalsContact O-CG 3.31Å; C54-P65 WeakPolarHBondContact O-CG 3.44Å; L63-P65 WeakPolarHBondContact O-CD 3.2Å
66	T	41.4	Very low	41.4	Very low	64 Å²	64	81.2 Å²	81.2	39%	0.393	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	161.3	172.5	67.6	0	0	0	0	109.8	L64 K68 G69 L71	L64-T66 PolarHBondContact O-N 3.39Å; T66-K68 PolarHBondContact O-N 3.1Å; T66-G69 WeakPolarHBondContact CA-O 3.49Å; T66-G69 PolarHBondContact N-O 3.39Å; T66-G69 PolarHBondContact O-N 3.37Å; T66-G69 VanDerWaalsContact O-N 3.08Å; T66-G69 VanDerWaalsContact O-O 3.06Å; T66-G69 PolarHBondContact OG1-O 2.95Å; T66-L71 HydrophobicContact CG2-CB 4.13Å; T66-L71 HydrophobicContact CG2-CD1 3.59Å; T66-L71 HydrophobicContact CG2-CG 4.49Å
67	E	35.9	Very low	41.5	Very low	178 Å²	178	90.1 Å²	90.1	83%	0.832	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-10.1	177.2	-65.4	-168	149	0	0	114.5
68	K	38.5	Very low	41.5	Very low	113 Å²	113	85 Å²	85	49%	0.491	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	6.7	-178.3	-60.5	179.2	-161.7	140.6	0	114	T66 K141	T66-K68 PolarHBondContact O-N 3.1Å; K68-K141 VanDerWaalsContact NZ-CB 3.3Å
69	G	46.7	Very low	41.5	Very low	42 Å²	42	86 Å²	86	43%	0.433	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	133.3	-163.9	-177.9	0	0	0	0	0	112.9	T66	T66-G69 WeakPolarHBondContact CA-O 3.49Å; T66-G69 PolarHBondContact N-O 3.39Å; T66-G69 PolarHBondContact O-N 3.37Å; T66-G69 VanDerWaalsContact O-N 3.08Å; T66-G69 VanDerWaalsContact O-O 3.06Å; T66-G69 PolarHBondContact OG1-O 2.95Å
70	S	41.6	Very low	41.4	Very low	67 Å²	67	80.1 Å²	80.1	47%	0.469	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	125.4	177.5	45.6	0	0	0	0	111.1
71	L	41.8	Very low	41.3	Very low	78 Å²	78	82.7 Å²	82.7	41%	0.408	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	112.8	172.7	-127.4	139.5	0	0	0	108.2	L63 L64 T66	L63-L71 WeakPolarHBondContact CA-O 3.25Å; L64-L71 HydrophobicContact CB-CB 4.03Å; L64-L71 PolarHBondContact N-O 2.96Å; L64-L71 PolarHBondContact O-N 2.86Å; T66-L71 HydrophobicContact CG2-CB 4.13Å; T66-L71 HydrophobicContact CG2-CD1 3.59Å; T66-L71 HydrophobicContact CG2-CG 4.49Å
72	V	43	Very low	41.3	Very low	54 Å²	54	81.7 Å²	81.7	33%	0.327	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	126.6	173.5	-157.1	0	0	0	0	107.1	K61 L63 P74	K61-V72 HydrophobicContact CB-CG1 3.55Å; K61-V72 HydrophobicContact CD-CG1 3.63Å; K61-V72 HydrophobicContact CG-CG1 3.71Å; L63-V72 HydrophobicContact CD2-CB 4.24Å; L63-V72 HydrophobicContact CD2-CG1 4.23Å; L63-V72 HydrophobicContact CD2-CG2 3.81Å; V72-P74 VanDerWaalsContact C-N 3.35Å; V72-P74 HydrophobicContact CB-CG 4.31Å; V72-P74 HydrophobicContact CG1-CG 3.66Å; V72-P74 WeakPolarHBondContact O-CD 3.34Å
73	L	48.2	Very low	41.2	Very low	20 Å²	20	83.3 Å²	83.3	11%	0.105	46%	0.464	C	S	.	.	G	3₁₀ helix	trans	-60	-14.5	179.5	-92.9	83.2	0	0	0	118.6	L62 L64 E75 L76	L62-L73 HydrophobicContact CB-CB 4.5Å; L62-L73 HydrophobicContact CB-CD1 3.62Å; L62-L73 HydrophobicContact CB-CD2 4.38Å; L62-L73 HydrophobicContact CB-CG 4.38Å; L62-L73 VanDerWaalsContact O-CD1 3.26Å; L62-L73 WeakPolarHBondContact O-CD1 3.31Å; L62-L73 PolarHBondContact O-N 3.2Å; L64-L73 HydrophobicContact CD1-CD1 3.5Å; L64-L73 HydrophobicContact CD1-CG 4.15Å; L64-L73 HydrophobicContact CG-CD1 3.8Å; L73-E75 PolarHBondContact O-N 3.45Å; L73-L76 HydrophobicContact CB-CD1 4.4Å; L73-L76 HydrophobicContact CD2-CD1 4.03Å; L73-L76 HydrophobicContact CG-CD1 4.14Å; L73-L76 PolarHBondContact O-N 2.9Å
74	P	41.8	Very low	41.2	Very low	77 Å²	77	84.4 Å²	84.4	50%	0.5	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-69.8	1.2	-177.9	8.5	-4.4	0	0	0	115.8	V72	V72-P74 VanDerWaalsContact C-N 3.35Å; V72-P74 HydrophobicContact CB-CG 4.31Å; V72-P74 HydrophobicContact CG1-CG 3.66Å; V72-P74 WeakPolarHBondContact O-CD 3.34Å
75	E	42.7	Very low	41.1	Very low	170 Å²	170	86.4 Å²	86.4	79%	0.794	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-112.3	27.8	175.9	-65.7	-169.4	167.2	0	0	114	L73 R77	L73-E75 PolarHBondContact O-N 3.45Å; E75-R77 PolarHBondContact O-N 3.29Å
76	L	44.9	Very low	41.3	Very low	68 Å²	68	84.2 Å²	84.2	36%	0.356	47%	0.469	S	S	.	.			trans	-65.6	101	170	-73.6	162.2	0	0	0	109.8	L73 V87	L73-L76 HydrophobicContact CB-CD1 4.4Å; L73-L76 HydrophobicContact CD2-CD1 4.03Å; L73-L76 HydrophobicContact CG-CD1 4.14Å; L73-L76 PolarHBondContact O-N 2.9Å; L76-V87 HydrophobicContact CB-CG1 3.96Å; L76-V87 HydrophobicContact CB-CG2 3.82Å; L76-V87 HydrophobicContact CD1-CG2 4.36Å
77	R	37.3	Very low	41.6	Very low	221 Å²	221	82 Å²	82	83%	0.834	46%	0.456	S	S	*	.			trans	-88.6	117.3	162.7	-68.3	-173.8	178.8	-169.5	-0.6	107.5	E75	E75-R77 PolarHBondContact O-N 3.29Å
78	C	38.5	Very low	42.2	Very low	48 Å²	48	76.6 Å²	76.6	32%	0.324	44%	0.438	S	S	.	.			trans	-72.3	137.4	173.4	55.4	0	0	0	0	110.6	D83 C84	C78-D83 HydrophobicContact CB-CB 3.89Å; C78-C84 HydrophobicContact CB-CB 3.7Å; C78-C84 WeakPolarHBondContact CB-SG 3.32Å; C78-C84 WeakPolarHBondContact SG-CA 3.31Å; C78-C84 WeakPolarHBondContact SG-CB 3.12Å; C78-C84 CovalentContact SG-SG 2.02Å; C78-C84 PolarHBondContact SG-SG 3.2Å
79	T	38.8	Very low	42.9	Very low	137 Å²	137	74.9 Å²	74.9	84%	0.84	43%	0.433	S	S	*	.	S	Bend	trans	-103.9	-13.2	176.4	44.2	0	0	0	0	112.8
80	S	40.5	Very low	42.9	Very low	44 Å²	44	74 Å²	74	31%	0.308	42%	0.417	S	S	.	.	S	Bend	trans	-132.4	156.8	177.6	79.6	0	0	0	0	111	S82 D83 C84	S80-S82 VanDerWaalsContact C-N 3.31Å; S80-S82 PolarHBondContact O-N 3.41Å; S80-S82 PolarHBondContact OG-OG 2.73Å; S80-D83 PolarHBondContact O-N 3.08Å; S80-D83 PolarHBondContact OG-N 3.35Å; S80-D83 PolarHBondContact OG-OD1 2.91Å; S80-D83 PolarHBondContact OG-OD2 3.14Å; S80-C84 PolarHBondContact O-N 3.29Å; S80-C84 PolarHBondContact O-SG 3.05Å
81	S	37.8	Very low	43.6	Very low	99 Å²	99	74.6 Å²	74.6	69%	0.692	41%	0.413	S	S	*	.	H	α-helix	trans	-60.6	-37.8	-177.2	53.6	0	0	0	0	113	C84 D85	S81-C84 WeakPolarHBondContact O-CB 3.44Å; S81-C84 PolarHBondContact O-N 3.36Å; S81-D85 PolarHBondContact O-N 3.09Å; S81-D85 VanDerWaalsContact O-N 3.14Å
82	S	39.2	Very low	44.3	Very low	62 Å²	62	79.5 Å²	79.5	43%	0.434	43%	0.426	S	S	.	.	H	α-helix	trans	-66.9	-36.6	176.2	48.2	0	0	0	0	112.7	S80 C84 D85 C86	S80-S82 VanDerWaalsContact C-N 3.31Å; S80-S82 PolarHBondContact O-N 3.41Å; S80-S82 PolarHBondContact OG-OG 2.73Å; S82-C84 VanDerWaalsContact C-N 3.32Å; S82-D85 PolarHBondContact O-N 3.5Å; S82-C86 PolarHBondContact O-N 3.43Å; S82-C86 PolarHBondContact O-SG 2.89Å
83	D	41.7	Very low	44.8	Very low	42 Å²	42	79.2 Å²	79.2	23%	0.225	42%	0.421	C	S	.	.	H	α-helix	trans	-71	-34.1	176.2	-57.8	-27.7	0	0	0	110.5	C78 S80 D85 C86 V87	C78-D83 HydrophobicContact CB-CB 3.89Å; S80-D83 PolarHBondContact O-N 3.08Å; S80-D83 PolarHBondContact OG-N 3.35Å; S80-D83 PolarHBondContact OG-OD1 2.91Å; S80-D83 PolarHBondContact OG-OD2 3.14Å; D83-D85 VanDerWaalsContact C-N 3.35Å; D83-C86 PolarHBondContact O-N 2.94Å; D83-V87 WeakPolarHBondContact O-CB 3.43Å; D83-V87 WeakPolarHBondContact O-CG2 3.39Å; D83-V87 PolarHBondContact O-N 2.89Å
84	C	39	Very low	45.3	Very low	39 Å²	39	82.9 Å²	82.9	26%	0.264	44%	0.437	S	S	.	.	H	α-helix	trans	-64.9	-39.3	176.3	-66.2	0	0	0	0	111.8	C78 S80 S81 S82 V87 S88	C78-C84 HydrophobicContact CB-CB 3.7Å; C78-C84 WeakPolarHBondContact CB-SG 3.32Å; C78-C84 WeakPolarHBondContact SG-CA 3.31Å; C78-C84 WeakPolarHBondContact SG-CB 3.12Å; C78-C84 CovalentContact SG-SG 2.02Å; C78-C84 PolarHBondContact SG-SG 3.2Å; S80-C84 PolarHBondContact O-N 3.29Å; S80-C84 PolarHBondContact O-SG 3.05Å; S81-C84 WeakPolarHBondContact O-CB 3.44Å; S81-C84 PolarHBondContact O-N 3.36Å; S82-C84 VanDerWaalsContact C-N 3.32Å; C84-V87 PolarHBondContact O-N 3.26Å; C84-S88 WeakPolarHBondContact O-CB 3.45Å; C84-S88 PolarHBondContact O-N 3.43Å; C84-S88 PolarHBondContact O-OG 2.85Å
85	D	42.8	Very low	46.2	Very low	108 Å²	108	89.2 Å²	89.2	58%	0.578	45%	0.451	S	S	*	.	H	α-helix	trans	-65.6	-42.5	178	-70.4	-26	0	0	0	111.6	S81 S82 D83 S88 L89	S81-D85 PolarHBondContact O-N 3.09Å; S81-D85 VanDerWaalsContact O-N 3.14Å; S82-D85 PolarHBondContact O-N 3.5Å; D83-D85 VanDerWaalsContact C-N 3.35Å; D85-S88 PolarHBondContact O-N 3.48Å; D85-L89 WeakPolarHBondContact O-CB 3.45Å; D85-L89 PolarHBondContact O-N 3.35Å
86	C	45.8	Very low	46.8	Very low	37 Å²	37	85.8 Å²	85.8	25%	0.25	44%	0.438	C	S	.	.	H	α-helix	trans	-65.4	-44.1	177.1	-67	0	0	0	0	112.2	S82 D83 L89 Y90	S82-C86 PolarHBondContact O-N 3.43Å; S82-C86 PolarHBondContact O-SG 2.89Å; D83-C86 PolarHBondContact O-N 2.94Å; C86-L89 PolarHBondContact O-N 3.37Å; C86-Y90 PolarHBondContact O-N 3.43Å
87	V	47.4	Very low	47.2	Very low	17 Å²	17	85.8 Å²	85.8	10%	0.103	46%	0.455	C	S	.	.	H	α-helix	trans	-67.7	-36.9	177	173.7	0	0	0	0	111.3	L76 D83 C84 Y90 Q91	L76-V87 HydrophobicContact CB-CG1 3.96Å; L76-V87 HydrophobicContact CB-CG2 3.82Å; L76-V87 HydrophobicContact CD1-CG2 4.36Å; D83-V87 WeakPolarHBondContact O-CB 3.43Å; D83-V87 WeakPolarHBondContact O-CG2 3.39Å; D83-V87 PolarHBondContact O-N 2.89Å; C84-V87 PolarHBondContact O-N 3.26Å; V87-Y90 WeakPolarHBondContact O-CB 3.39Å; V87-Y90 PolarHBondContact O-N 3.48Å; V87-Q91 WeakPolarHBondContact O-CG 3.34Å; V87-Q91 PolarHBondContact O-N 3.37Å
88	S	48.8	Very low	48	Very low	66 Å²	66	82.7 Å²	82.7	46%	0.462	45%	0.447	S	S	.	.	H	α-helix	trans	-67	-40.3	176.1	-59.7	0	0	0	0	111.6	C84 D85 Q91 R92	C84-S88 WeakPolarHBondContact O-CB 3.45Å; C84-S88 PolarHBondContact O-N 3.43Å; C84-S88 PolarHBondContact O-OG 2.85Å; D85-S88 PolarHBondContact O-N 3.48Å; S88-Q91 PolarHBondContact O-N 3.13Å; S88-R92 VanDerWaalsContact O-CB 3.23Å; S88-R92 WeakPolarHBondContact O-CB 3.36Å; S88-R92 PolarHBondContact O-N 3.07Å
89	L	51.7	Low	48.6	Very low	76 Å²	76	82.1 Å²	82.1	40%	0.398	44%	0.441	S	S	.	.	H	α-helix	trans	-60.6	-45.8	172	-92.1	158.1	0	0	0	111.5	D85 C86 R92 Q93 F108	D85-L89 WeakPolarHBondContact O-CB 3.45Å; D85-L89 PolarHBondContact O-N 3.35Å; C86-L89 PolarHBondContact O-N 3.37Å; L89-R92 PolarHBondContact O-N 3.39Å; L89-Q93 WeakPolarHBondContact O-CB 3.34Å; L89-Q93 WeakPolarHBondContact O-CG 3.43Å; L89-Q93 PolarHBondContact O-N 2.73Å; L89-F108 HydrophobicContact CB-CE1 4.13Å
90	Y	48.5	Very low	49.1	Very low	23 Å²	23	78.3 Å²	78.3	9%	0.09	42%	0.419	C	S	.	.	H	α-helix	trans	-55.4	-53	174.2	166.8	-98	0	0	0	111.7	C86 V87 R92 Q93 Q94 M104	C86-Y90 PolarHBondContact O-N 3.43Å; V87-Y90 WeakPolarHBondContact O-CB 3.39Å; V87-Y90 PolarHBondContact O-N 3.48Å; Y90-R92 VanDerWaalsContact C-N 3.28Å; Y90-R92 PolarHBondContact O-N 2.91Å; Y90-Q93 PolarHBondContact O-N 2.69Å; Y90-Q94 VanDerWaalsContact O-CB 3.31Å; Y90-Q94 WeakPolarHBondContact O-CB 3.33Å; Y90-Q94 PolarHBondContact O-N 3.32Å; Y90-M104 HydrophobicContact CD2-CE 3.96Å; Y90-M104 HydrophobicContact CD2-SD 3.45Å; Y90-M104 WeakPolarHBondContact CD2-SD 3.46Å; Y90-M104 HydrophobicContact CE2-CE 3.88Å; Y90-M104 HydrophobicContact CE2-SD 3.4Å; Y90-M104 WeakPolarHBondContact CE2-SD 3.47Å
91	Q	54.6	Low	49.4	Very low	80 Å²	80	78.1 Å²	78.1	37%	0.374	42%	0.415	S	S	.	.	H	α-helix	trans	-63	-36.5	179.9	-70.6	-177.8	5.9	0	0	111.9	V87 S88 R95	V87-Q91 WeakPolarHBondContact O-CG 3.34Å; V87-Q91 PolarHBondContact O-N 3.37Å; S88-Q91 PolarHBondContact O-N 3.13Å; Q91-R95 WeakPolarHBondContact O-CB 3.37Å; Q91-R95 WeakPolarHBondContact O-CG 3.22Å; Q91-R95 PolarHBondContact O-N 3Å; Q91-R95 VanDerWaalsContact O-N 3.11Å
92	R	56.8	Low	49.7	Very low	182 Å²	182	79.1 Å²	79.1	69%	0.687	41%	0.412	S	S	*	.	H	α-helix	trans	-69.5	-42.9	178.7	-163.8	176.9	-161.4	179.8	5.1	111.7	S88 L89 Y90 R95 L96	S88-R92 VanDerWaalsContact O-CB 3.23Å; S88-R92 WeakPolarHBondContact O-CB 3.36Å; S88-R92 PolarHBondContact O-N 3.07Å; L89-R92 PolarHBondContact O-N 3.39Å; Y90-R92 VanDerWaalsContact C-N 3.28Å; Y90-R92 PolarHBondContact O-N 2.91Å; R92-R95 PolarHBondContact O-N 3.34Å; R92-L96 HydrophobicContact CG-CD1 4.3Å; R92-L96 WeakPolarHBondContact O-CG 3.34Å; R92-L96 PolarHBondContact O-N 3.44Å; R92-L96 VanDerWaalsContact O-N 3.09Å
93	Q	54.8	Low	50.2	Low	47 Å²	47	81.4 Å²	81.4	22%	0.22	42%	0.416	C	S	.	.	H	α-helix	trans	-75.6	-33.4	-178.3	-74.2	173	-28.6	0	0	112.6	L89 Y90 L96 G97 K98 I99 F108	L89-Q93 WeakPolarHBondContact O-CB 3.34Å; L89-Q93 WeakPolarHBondContact O-CG 3.43Å; L89-Q93 PolarHBondContact O-N 2.73Å; Y90-Q93 PolarHBondContact O-N 2.69Å; Q93-L96 PolarHBondContact O-N 3.17Å; Q93-G97 PolarHBondContact O-N 2.94Å; Q93-K98 PolarHBondContact O-N 3.01Å; Q93-I99 HydrophobicContact CB-CB 4.39Å; Q93-I99 HydrophobicContact CB-CD1 3.61Å; Q93-I99 HydrophobicContact CB-CG1 3.87Å; Q93-I99 HydrophobicContact CG-CD1 3.76Å; Q93-I99 HydrophobicContact CG-CG1 4.27Å; Q93-F108 VanDerWaalsContact OE1-CE2 3.29Å
94	Q	58.2	Low	50.4	Low	97 Å²	97	80 Å²	80	45%	0.453	41%	0.408	S	S	.	.	H	α-helix	trans	-62.4	-44.8	169.7	-165.9	-172.4	24	0	0	111.1	Y90 L96 G97	Y90-Q94 VanDerWaalsContact O-CB 3.31Å; Y90-Q94 WeakPolarHBondContact O-CB 3.33Å; Y90-Q94 PolarHBondContact O-N 3.32Å; Q94-L96 VanDerWaalsContact C-N 3.26Å; Q94-L96 PolarHBondContact O-N 2.8Å; Q94-G97 PolarHBondContact O-N 2.91Å; Q94-G97 VanDerWaalsContact O-N 3.17Å
95	R	59.8	Low	50.8	Low	210 Å²	210	79.3 Å²	79.3	79%	0.792	40%	0.403	S	S	*	.	H	α-helix	trans	-63.6	-30.2	175.5	-76.6	176.6	-173.8	-176	4.9	113.4	Q91 R92 G97	Q91-R95 WeakPolarHBondContact O-CB 3.37Å; Q91-R95 WeakPolarHBondContact O-CG 3.22Å; Q91-R95 PolarHBondContact O-N 3Å; Q91-R95 VanDerWaalsContact O-N 3.11Å; R92-R95 PolarHBondContact O-N 3.34Å; R95-G97 VanDerWaalsContact C-N 3.29Å
96	L	56.6	Low	50.9	Low	98 Å²	98	83.4 Å²	83.4	51%	0.513	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-7.7	178.7	-70.7	169.4	0	0	0	113	R92 Q93 Q94 K98	R92-L96 HydrophobicContact CG-CD1 4.3Å; R92-L96 WeakPolarHBondContact O-CG 3.34Å; R92-L96 PolarHBondContact O-N 3.44Å; R92-L96 VanDerWaalsContact O-N 3.09Å; Q93-L96 PolarHBondContact O-N 3.17Å; Q94-L96 VanDerWaalsContact C-N 3.26Å; Q94-L96 PolarHBondContact O-N 2.8Å; L96-K98 HydrophobicContact CB-CB 4.14Å; L96-K98 HydrophobicContact CB-CD 4.07Å; L96-K98 HydrophobicContact CB-CG 3.95Å; L96-K98 HydrophobicContact CD1-CD 4.47Å; L96-K98 WeakPolarHBondContact O-CG 3.29Å; L96-K98 PolarHBondContact O-N 3.19Å; L96-K98 VanDerWaalsContact O-N 3.11Å
97	G	53	Low	51.1	Low	69 Å²	69	88.6 Å²	88.6	71%	0.711	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	18.1	-175.2	0	0	0	0	0	113.3	Q93 Q94 R95	Q93-G97 PolarHBondContact O-N 2.94Å; Q94-G97 PolarHBondContact O-N 2.91Å; Q94-G97 VanDerWaalsContact O-N 3.17Å; R95-G97 VanDerWaalsContact C-N 3.29Å
98	K	53.2	Low	51	Low	155 Å²	155	90 Å²	90	67%	0.674	44%	0.436	S	S	*	.			trans	-94.6	-3.6	-168.6	-80.8	-174	-177	-171.9	0	114.2	Q93 L96	Q93-K98 PolarHBondContact O-N 3.01Å; L96-K98 HydrophobicContact CB-CB 4.14Å; L96-K98 HydrophobicContact CB-CD 4.07Å; L96-K98 HydrophobicContact CB-CG 3.95Å; L96-K98 HydrophobicContact CD1-CD 4.47Å; L96-K98 WeakPolarHBondContact O-CG 3.29Å; L96-K98 PolarHBondContact O-N 3.19Å; L96-K98 VanDerWaalsContact O-N 3.11Å
99	I	52.1	Low	50.9	Low	36 Å²	36	88 Å²	88	19%	0.185	42%	0.42	C	S	.	.			trans	-127.7	120.2	-177.2	-68.3	-163.3	0	0	0	110.4	Q93 E103 M104 F108	Q93-I99 HydrophobicContact CB-CB 4.39Å; Q93-I99 HydrophobicContact CB-CD1 3.61Å; Q93-I99 HydrophobicContact CB-CG1 3.87Å; Q93-I99 HydrophobicContact CG-CD1 3.76Å; Q93-I99 HydrophobicContact CG-CG1 4.27Å; I99-E103 HydrophobicContact CG2-CB 4.3Å; I99-M104 HydrophobicContact CB-CE 4.22Å; I99-M104 HydrophobicContact CG2-CB 3.71Å; I99-M104 HydrophobicContact CG2-CE 3.51Å; I99-M104 HydrophobicContact CG2-CG 4.1Å; I99-F108 HydrophobicContact CD1-CE2 3.94Å
100	S	48.6	Very low	50.4	Low	57 Å²	57	89.8 Å²	89.8	40%	0.399	42%	0.424	S	S	.	.			trans	-69.3	144.1	163.5	67.5	0	0	0	0	109.5	D102 E103 M104	S100-D102 PolarHBondContact O-N 2.65Å; S100-E103 PolarHBondContact O-N 3.05Å; S100-E103 VanDerWaalsContact O-N 3.08Å; S100-E103 PolarHBondContact OG-N 2.95Å; S100-E103 PolarHBondContact OG-OE2 2.82Å; S100-M104 PolarHBondContact O-N 3.29Å; S100-M104 VanDerWaalsContact O-N 3.15Å
101	I	46.6	Very low	49.9	Very low	41 Å²	41	91.1 Å²	91.1	21%	0.21	44%	0.436	C	S	.	.	H	α-helix	trans	-53.2	-28.9	176.2	-70.1	168.4	0	0	0	111.4	K57 L62 M104 T105	K57-I101 HydrophobicContact CD-CD1 4.12Å; K57-I101 HydrophobicContact CG-CD1 4.39Å; L62-I101 HydrophobicContact CD1-CG1 4.12Å; L62-I101 HydrophobicContact CD1-CG2 4Å; L62-I101 HydrophobicContact CD2-CG2 3.79Å; L62-I101 HydrophobicContact CG-CG1 4.49Å; L62-I101 HydrophobicContact CG-CG2 3.83Å; I101-M104 WeakPolarHBondContact O-CB 3.34Å; I101-M104 PolarHBondContact O-N 2.92Å; I101-T105 PolarHBondContact O-N 2.88Å; I101-T105 VanDerWaalsContact O-N 3.12Å; I101-T105 PolarHBondContact O-OG1 3.2Å
102	D	45.3	Very low	49.2	Very low	120 Å²	120	90.8 Å²	90.8	64%	0.642	44%	0.436	S	S	*	.	H	α-helix	trans	-75.2	-35.9	-179.7	-62.1	-28.9	0	0	0	113.3	S100 M104 T105	S100-D102 PolarHBondContact O-N 2.65Å; D102-M104 VanDerWaalsContact C-N 3.33Å; D102-T105 WeakPolarHBondContact CA-OG1 3.4Å; D102-T105 PolarHBondContact O-OG1 3.04Å; D102-T105 VanDerWaalsContact O-OG1 3.04Å
103	E	48.3	Very low	48.4	Very low	109 Å²	109	84.4 Å²	84.4	51%	0.509	42%	0.415	S	S	.	.	H	α-helix	trans	-68.2	-37.1	169.9	-94.2	163.7	140.5	0	0	111.3	I99 S100 T105 R106 E107	I99-E103 HydrophobicContact CG2-CB 4.3Å; S100-E103 PolarHBondContact O-N 3.05Å; S100-E103 VanDerWaalsContact O-N 3.08Å; S100-E103 PolarHBondContact OG-N 2.95Å; S100-E103 PolarHBondContact OG-OE2 2.82Å; E103-T105 PolarHBondContact O-N 3.22Å; E103-R106 PolarHBondContact O-N 3.04Å; E103-E107 WeakPolarHBondContact O-CB 3.3Å; E103-E107 PolarHBondContact O-N 3.29Å
104	M	46.4	Very low	47.4	Very low	13 Å²	13	88.2 Å²	88.2	6%	0.064	43%	0.434	C	S	.	.	H	α-helix	trans	-66.5	-37.4	-178.1	-153.4	-175.7	-71.9	0	0	112.6	L62 Y90 I99 S100 I101 D102 R106 F108 L109	L62-M104 HydrophobicContact CD1-SD 3.87Å; Y90-M104 HydrophobicContact CD2-CE 3.96Å; Y90-M104 HydrophobicContact CD2-SD 3.45Å; Y90-M104 WeakPolarHBondContact CD2-SD 3.46Å; Y90-M104 HydrophobicContact CE2-CE 3.88Å; Y90-M104 HydrophobicContact CE2-SD 3.4Å; Y90-M104 WeakPolarHBondContact CE2-SD 3.47Å; I99-M104 HydrophobicContact CB-CE 4.22Å; I99-M104 HydrophobicContact CG2-CB 3.71Å; I99-M104 HydrophobicContact CG2-CE 3.51Å; I99-M104 HydrophobicContact CG2-CG 4.1Å; S100-M104 PolarHBondContact O-N 3.29Å; S100-M104 VanDerWaalsContact O-N 3.15Å; I101-M104 WeakPolarHBondContact O-CB 3.34Å; I101-M104 PolarHBondContact O-N 2.92Å; D102-M104 VanDerWaalsContact C-N 3.33Å; M104-R106 VanDerWaalsContact C-N 3.32Å; M104-R106 PolarHBondContact O-N 3.49Å; M104-F108 HydrophobicContact CG-CB 4.22Å; M104-F108 HydrophobicContact CG-CD2 4.4Å; M104-F108 WeakPolarHBondContact O-CB 3.49Å; M104-F108 PolarHBondContact O-N 2.81Å; M104-L109 PolarHBondContact O-N 2.89Å
105	T	47.1	Very low	46.1	Very low	24 Å²	24	87.5 Å²	87.5	15%	0.147	43%	0.433	C	S	.	.	H	α-helix	trans	-66.3	-33.2	176.7	17.9	0	0	0	0	112.6	L55 I101 D102 E103 L109	L55-T105 HydrophobicContact CD1-CG2 3.24Å; I101-T105 PolarHBondContact O-N 2.88Å; I101-T105 VanDerWaalsContact O-N 3.12Å; I101-T105 PolarHBondContact O-OG1 3.2Å; D102-T105 WeakPolarHBondContact CA-OG1 3.4Å; D102-T105 PolarHBondContact O-OG1 3.04Å; D102-T105 VanDerWaalsContact O-OG1 3.04Å; E103-T105 PolarHBondContact O-N 3.22Å; T105-L109 HydrophobicContact CG2-CD1 3.6Å; T105-L109 WeakPolarHBondContact O-CB 3.49Å
106	R	46.1	Very low	44.7	Very low	195 Å²	195	80.1 Å²	80.1	74%	0.736	42%	0.417	S	S	*	.	H	α-helix	trans	-81.1	-41.9	-180	-73.2	-176.3	-175.3	-168.7	1.8	113.3	E103 M104	E103-R106 PolarHBondContact O-N 3.04Å; M104-R106 VanDerWaalsContact C-N 3.32Å; M104-R106 PolarHBondContact O-N 3.49Å
107	E	48.6	Very low	43.6	Very low	145 Å²	145	83.4 Å²	83.4	68%	0.678	42%	0.423	S	S	*	.	H	α-helix	trans	-94.7	-40.7	-170.5	-68.8	-83.3	135.3	0	0	112.8	E103	E103-E107 WeakPolarHBondContact O-CB 3.3Å; E103-E107 PolarHBondContact O-N 3.29Å
108	F	46.8	Very low	42.6	Very low	47 Å²	47	82.6 Å²	82.6	21%	0.206	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-26.3	-169.4	-76.5	-87.3	0	0	0	114.7	L89 Q93 I99 M104 P111 I112	L89-F108 HydrophobicContact CB-CE1 4.13Å; Q93-F108 VanDerWaalsContact OE1-CE2 3.29Å; I99-F108 HydrophobicContact CD1-CE2 3.94Å; M104-F108 HydrophobicContact CG-CB 4.22Å; M104-F108 HydrophobicContact CG-CD2 4.4Å; M104-F108 WeakPolarHBondContact O-CB 3.49Å; M104-F108 PolarHBondContact O-N 2.81Å; F108-P111 WeakPolarHBondContact O-CD 3.47Å; F108-I112 VanDerWaalsContact O-CD1 3.31Å; F108-I112 WeakPolarHBondContact O-CD1 3.47Å; F108-I112 VanDerWaalsContact O-CG1 3.3Å; F108-I112 WeakPolarHBondContact O-CG1 3.31Å
109	L	45.2	Very low	41.6	Very low	24 Å²	24	79 Å²	79	13%	0.126	39%	0.394	C	S	.	.	H	α-helix	trans	-78.1	-23.3	177.4	-98.8	131.8	0	0	0	113.2	L55 M104 T105 I112 I113	L55-L109 HydrophobicContact CD1-CD1 3.85Å; L55-L109 HydrophobicContact CD1-CD2 4.5Å; M104-L109 PolarHBondContact O-N 2.89Å; T105-L109 HydrophobicContact CG2-CD1 3.6Å; T105-L109 WeakPolarHBondContact O-CB 3.49Å; L109-I112 PolarHBondContact O-N 3.32Å; L109-I113 HydrophobicContact CB-CD1 4.1Å; L109-I113 HydrophobicContact CD2-CD1 3.68Å; L109-I113 HydrophobicContact CD2-CG1 4.02Å; L109-I113 WeakPolarHBondContact O-CB 3.39Å; L109-I113 WeakPolarHBondContact O-CD1 3.49Å; L109-I113 WeakPolarHBondContact O-CG1 3.32Å; L109-I113 PolarHBondContact O-N 2.81Å
110	K	42.7	Very low	40.7	Very low	114 Å²	114	84.2 Å²	84.2	50%	0.496	42%	0.418	S	S	.	.	H	α-helix	trans	-56.1	-52.4	174.1	-95.1	-178.3	179	175.9	0	112.3	L48 M114	L48-K110 HydrophobicContact CD2-CG 4.05Å; K110-M114 VanDerWaalsContact O-CG 3.32Å; K110-M114 WeakPolarHBondContact O-CG 3.34Å; K110-M114 PolarHBondContact O-N 2.82Å
111	P	37.5	Very low	39.9	Very low	51 Å²	51	86.4 Å²	86.4	33%	0.331	42%	0.422	S	S	.	.	H	α-helix	trans	-65.2	-41.2	175.6	-17.6	24.8	0	0	0	113.8	F108 I113 M114 L115	F108-P111 WeakPolarHBondContact O-CD 3.47Å; P111-I113 PolarHBondContact O-N 3.32Å; P111-M114 PolarHBondContact O-N 2.76Å; P111-L115 WeakPolarHBondContact O-CG 3.48Å; P111-L115 PolarHBondContact O-N 2.9Å
112	I	39.9	Very low	39	Very low	73 Å²	73	91.1 Å²	91.1	37%	0.374	44%	0.443	S	S	.	.	H	α-helix	trans	-68.1	-35.9	-174.5	-63.5	171.1	0	0	0	111.3	F108 L109 A116	F108-I112 VanDerWaalsContact O-CD1 3.31Å; F108-I112 WeakPolarHBondContact O-CD1 3.47Å; F108-I112 VanDerWaalsContact O-CG1 3.3Å; F108-I112 WeakPolarHBondContact O-CG1 3.31Å; L109-I112 PolarHBondContact O-N 3.32Å; I112-A116 PolarHBondContact O-N 3.08Å
113	I	39.6	Very low	38.1	Very low	48 Å²	48	89.6 Å²	89.6	25%	0.246	44%	0.438	C	S	.	.	H	α-helix	trans	-74.9	-30.8	174.6	-65	162.9	0	0	0	111.4	L51 L109 P111 R117	L51-I113 HydrophobicContact CD1-CD1 4.4Å; L51-I113 HydrophobicContact CD1-CG2 4.46Å; L51-I113 HydrophobicContact CD2-CD1 3.98Å; L109-I113 HydrophobicContact CB-CD1 4.1Å; L109-I113 HydrophobicContact CD2-CD1 3.68Å; L109-I113 HydrophobicContact CD2-CG1 4.02Å; L109-I113 WeakPolarHBondContact O-CB 3.39Å; L109-I113 WeakPolarHBondContact O-CD1 3.49Å; L109-I113 WeakPolarHBondContact O-CG1 3.32Å; L109-I113 PolarHBondContact O-N 2.81Å; P111-I113 PolarHBondContact O-N 3.32Å; I113-R117 PolarHBondContact O-N 2.87Å
114	M	33.3	Very low	37	Very low	127 Å²	127	91.3 Å²	91.3	63%	0.626	46%	0.456	S	S	*	.	H	α-helix	trans	-71.7	-37.4	174.7	-75	-162.5	-50.5	0	0	112.6	K110 P111 A116 R117 S118	K110-M114 VanDerWaalsContact O-CG 3.32Å; K110-M114 WeakPolarHBondContact O-CG 3.34Å; K110-M114 PolarHBondContact O-N 2.82Å; P111-M114 PolarHBondContact O-N 2.76Å; M114-A116 VanDerWaalsContact C-N 3.34Å; M114-R117 PolarHBondContact O-N 3.46Å; M114-S118 PolarHBondContact O-N 3.37Å
115	L	30.9	Very low	35.9	Very low	81 Å²	81	95.9 Å²	95.9	42%	0.424	49%	0.489	S	S	.	.	H	α-helix	trans	-64.5	-37.7	174.4	-77.8	156.6	0	0	0	111.9	P111 R117	P111-L115 WeakPolarHBondContact O-CG 3.48Å; P111-L115 PolarHBondContact O-N 2.9Å; L115-R117 VanDerWaalsContact C-N 3.28Å; L115-R117 PolarHBondContact O-N 3.06Å
116	A	31.6	Very low	34.8	Very low	56 Å²	56	99.7 Å²	99.7	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-69.7	-20.6	176	0	0	0	0	0	114.3	I112 M114	I112-A116 PolarHBondContact O-N 3.08Å; M114-A116 VanDerWaalsContact C-N 3.34Å
117	R	33.5	Very low	33.8	Very low	166 Å²	166	99.4 Å²	99.4	63%	0.626	52%	0.523	S	S	*	.	H	α-helix	trans	-97.4	-22.5	178.4	-86.7	-177.7	162.5	176.8	-3.9	114	I113 M114 L115 D119	I113-R117 PolarHBondContact O-N 2.87Å; M114-R117 PolarHBondContact O-N 3.46Å; L115-R117 VanDerWaalsContact C-N 3.28Å; L115-R117 PolarHBondContact O-N 3.06Å; R117-D119 VanDerWaalsContact C-N 3.35Å
118	S	31.4	Very low	32.7	Very low	52 Å²	52	96.1 Å²	96.1	36%	0.364	52%	0.515	S	S	.	.	H	α-helix	trans	-75	-24.3	178.8	-162.9	0	0	0	0	113.1	M114	M114-S118 PolarHBondContact O-N 3.37Å
119	D	31.5	Very low	31.8	Very low	79 Å²	79	97.6 Å²	97.6	42%	0.422	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-10.8	178.7	-86.2	8.4	0	0	0	113.7	R117 S129	R117-D119 VanDerWaalsContact C-N 3.35Å; D119-S129 PolarHBondContact OD2-OG 3.27Å
120	E	34	Very low	30.9	Very low	147 Å²	147	101.2 Å²	101.2	69%	0.687	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-7.6	174.5	-94.9	-173.8	149.3	0	0	113.8
121	Q	32.2	Very low	30.2	Very low	103 Å²	103	102.5 Å²	102.5	48%	0.481	56%	0.561	S	S	.	*	S	Bend	trans	-117.4	3	180	-78	-165.9	-17	0	0	115.6	M216	Q121-M216 HydrophobicContact CG-CE 4.29Å
122	Q	26.4	Very low	29.8	Very low	140 Å²	140	104 Å²	104	65%	0.654	57%	0.569	S	S	*	*			trans	-108.9	78.3	171.8	-77.1	-173.5	-2	0	0	111.6
123	T	26.1	Very low	29.3	Very low	88 Å²	88	103.6 Å²	103.6	54%	0.54	57%	0.57	S	S	.	*			trans	-138.8	64.5	158.7	44.8	0	0	0	0	111.7	P128	T123-P128 HydrophobicContact CG2-CB 3.55Å; T123-P128 HydrophobicContact CG2-CG 3.81Å
124	V	26.1	Very low	28.8	Very low	145 Å²	145	108.3 Å²	108.3	88%	0.879	59%	0.591	S	S	*	*	S	Bend	trans	-120.9	103.1	147.5	-176	0	0	0	0	105.4
125	S	23.8	Very low	28.7	Very low	108 Å²	108	105.2 Å²	105.2	76%	0.755	58%	0.577	S	S	*	*	S	Bend	trans	74.6	133.3	-178.1	-168.9	0	0	0	0	115.4
126	S	23.7	Very low	28.8	Very low	105 Å²	105	107.2 Å²	107.2	73%	0.734	60%	0.598	S	S	*	*	S	Bend	trans	65	91.7	179.3	49.3	0	0	0	0	118.5
127	Q	25.4	Very low	29.4	Very low	188 Å²	188	110.7 Å²	110.7	88%	0.879	61%	0.609	S	S	*	*			trans	39.4	103.4	152.9	-66.7	-171.9	-7.3	0	0	119	S129	Q127-S129 PolarHBondContact O-N 2.87Å
128	P	25.9	Very low	30.1	Very low	77 Å²	77	104.7 Å²	104.7	50%	0.5	60%	0.598	S	S	.	*			trans	-66.2	124.2	169.4	24.2	-28.8	0	0	0	111	T123 L130	T123-P128 HydrophobicContact CG2-CB 3.55Å; T123-P128 HydrophobicContact CG2-CG 3.81Å; P128-L130 PolarHBondContact O-N 3.46Å
129	S	26.2	Very low	30.8	Very low	77 Å²	77	103.5 Å²	103.5	54%	0.538	59%	0.588	S	S	.	*			trans	-63.2	79.8	160.1	24.3	0	0	0	0	109.1	D119 Q127 L131	D119-S129 PolarHBondContact OD2-OG 3.27Å; Q127-S129 PolarHBondContact O-N 2.87Å; S129-L131 PolarHBondContact O-N 3.02Å
130	L	26.5	Very low	31.7	Very low	101 Å²	101	100.9 Å²	100.9	53%	0.529	58%	0.576	S	S	.	*			trans	-54.3	125.9	166.6	-91.4	157.5	0	0	0	108.3	P128 V132 D142	P128-L130 PolarHBondContact O-N 3.46Å; L130-V132 HydrophobicContact CB-CG2 3.95Å; L130-V132 WeakPolarHBondContact O-CG2 3.43Å; L130-V132 PolarHBondContact O-N 3.28Å; L130-D142 HydrophobicContact CD2-CB 4.28Å
131	L	28.2	Very low	32.4	Very low	140 Å²	140	96.5 Å²	96.5	73%	0.733	55%	0.554	S	S	*	*			trans	-69	88.3	167.8	-140.8	152	0	0	0	107.4	S129 V133	S129-L131 PolarHBondContact O-N 3.02Å; L131-V133 PolarHBondContact O-N 3.03Å
132	V	28.6	Very low	33.3	Very low	82 Å²	82	92.7 Å²	92.7	50%	0.497	54%	0.537	S	S	.	.			trans	-80.4	98.2	-175.1	173.9	0	0	0	0	108.6	L130 Q134 T140	L130-V132 HydrophobicContact CB-CG2 3.95Å; L130-V132 WeakPolarHBondContact O-CG2 3.43Å; L130-V132 PolarHBondContact O-N 3.28Å; V132-Q134 PolarHBondContact O-N 3.18Å; V132-T140 HydrophobicContact CG1-CG2 3.12Å
133	V	30.6	Very low	34.2	Very low	66 Å²	66	91.8 Å²	91.8	40%	0.4	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	99.2	164.8	-177	0	0	0	0	107.5	L131 L135 T140	L131-V133 PolarHBondContact O-N 3.03Å; V133-L135 PolarHBondContact O-N 3.23Å; V133-L135 VanDerWaalsContact O-N 3.13Å; V133-T140 WeakPolarHBondContact O-CA 3.38Å
134	Q	29.6	Very low	35.4	Very low	146 Å²	146	90.9 Å²	90.9	68%	0.682	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	98.4	175.8	-156.6	175.5	2	0	0	108.5	V132	V132-Q134 PolarHBondContact O-N 3.18Å
135	L	31.6	Very low	36.8	Very low	62 Å²	62	86 Å²	86	33%	0.325	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	142.8	168.2	-59.3	163.1	0	0	0	107.2	V133 N137 G138 V139 K141	V133-L135 PolarHBondContact O-N 3.23Å; V133-L135 VanDerWaalsContact O-N 3.13Å; L135-N137 PolarHBondContact O-N 2.93Å; L135-G138 PolarHBondContact O-N 3.36Å; L135-V139 VanDerWaalsContact CB-O 3.23Å; L135-V139 WeakPolarHBondContact CB-O 3.48Å; L135-V139 PolarHBondContact N-O 3.45Å; L135-V139 VanDerWaalsContact N-O 3.14Å; L135-K141 HydrophobicContact CD1-CG 4.17Å
136	S	32.9	Very low	38.3	Very low	123 Å²	123	87 Å²	87	86%	0.86	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	-12	-178.8	44.9	0	0	0	0	115.3
137	N	44.1	Very low	40.2	Very low	130 Å²	130	84.5 Å²	84.5	70%	0.695	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	9.9	-176.2	-51.7	-2.8	0	0	0	113.3	L135 V139	L135-N137 PolarHBondContact O-N 2.93Å; N137-V139 VanDerWaalsContact C-N 3.27Å; N137-V139 PolarHBondContact O-N 3.24Å
138	G	47.4	Very low	41.9	Very low	39 Å²	39	78.8 Å²	78.8	40%	0.402	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	18.4	-178.3	0	0	0	0	0	114.3	L135	L135-G138 PolarHBondContact O-N 3.36Å
139	V	46.1	Very low	43.5	Very low	27 Å²	27	82.2 Å²	82.2	16%	0.164	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	132.4	177.2	-180	0	0	0	0	108.2	L135 N137 Q147 W148	L135-V139 VanDerWaalsContact CB-O 3.23Å; L135-V139 WeakPolarHBondContact CB-O 3.48Å; L135-V139 PolarHBondContact N-O 3.45Å; L135-V139 VanDerWaalsContact N-O 3.14Å; N137-V139 VanDerWaalsContact C-N 3.27Å; N137-V139 PolarHBondContact O-N 3.24Å; V139-Q147 HydrophobicContact CG1-CB 4.07Å; V139-Q147 HydrophobicContact CG1-CG 4.1Å; V139-W148 CarbonylContact C-O 3.55Å; V139-W148 WeakPolarHBondContact CA-O 3.38Å
140	T	50.8	Low	44.9	Very low	25 Å²	25	87.2 Å²	87.2	15%	0.153	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	143.8	-179.5	58	0	0	0	0	108.5	V132 V133 Q147 W148	V132-T140 HydrophobicContact CG1-CG2 3.12Å; V133-T140 WeakPolarHBondContact O-CA 3.38Å; T140-Q147 CarbonylContact O-C 3.53Å; T140-Q147 WeakPolarHBondContact O-CA 3.26Å; T140-W148 PolarHBondContact N-O 2.75Å; T140-W148 PolarHBondContact O-N 3.06Å; T140-W148 WeakPolarHBondContact OG1-CB 3.42Å; T140-W148 PolarHBondContact OG1-O 2.74Å
141	K	48.3	Very low	46.2	Very low	55 Å²	55	84.7 Å²	84.7	24%	0.239	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134.5	176.3	-68.3	-157.2	-154.1	168.8	0	109.7	K68 L135 R146 Q147	K68-K141 VanDerWaalsContact NZ-CB 3.3Å; L135-K141 HydrophobicContact CD1-CG 4.17Å; K141-R146 VanDerWaalsContact CA-O 3.27Å; K141-R146 WeakPolarHBondContact CA-O 3.31Å; K141-Q147 HydrophobicContact CD-CG 3.79Å; K141-Q147 HydrophobicContact CG-CG 3.69Å
142	D	51.2	Low	47.4	Very low	23 Å²	23	83.2 Å²	83.2	12%	0.123	46%	0.457	C	S	.	.			trans	-81.2	172.7	170.8	64.9	25.7	0	0	0	111.7	L130 S144 G145 R146 W148	L130-D142 HydrophobicContact CD2-CB 4.28Å; D142-S144 PolarHBondContact O-N 2.83Å; D142-S144 VanDerWaalsContact OD1-C 3.25Å; D142-S144 VanDerWaalsContact OD1-CA 3.29Å; D142-S144 WeakPolarHBondContact OD1-CA 3.27Å; D142-S144 WeakPolarHBondContact OD1-CB 3.44Å; D142-S144 PolarHBondContact OD1-N 3Å; D142-S144 PolarHBondContact OD1-OG 3.24Å; D142-S144 PolarHBondContact OD2-OG 2.98Å; D142-G145 PolarHBondContact O-N 3.06Å; D142-G145 PolarHBondContact OD1-N 2.94Å; D142-R146 PolarHBondContact N-O 3.37Å; D142-R146 PolarHBondContact OD1-N 3.3Å; D142-R146 WeakPolarHBondContact OD2-CB 3.3Å; D142-W148 PolarHBondContact OD2-NE1 3.39Å
143	T	45.4	Very low	48.4	Very low	121 Å²	121	90.3 Å²	90.3	74%	0.742	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.7	175.4	50	0	0	0	0	113.1	G145	T143-G145 VanDerWaalsContact C-N 3.35Å
144	S	51.4	Low	49.6	Very low	69 Å²	69	93.7 Å²	93.7	48%	0.483	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	6.3	173.9	76.2	0	0	0	0	113.5	D142 R146	D142-S144 PolarHBondContact O-N 2.83Å; D142-S144 VanDerWaalsContact OD1-C 3.25Å; D142-S144 VanDerWaalsContact OD1-CA 3.29Å; D142-S144 WeakPolarHBondContact OD1-CA 3.27Å; D142-S144 WeakPolarHBondContact OD1-CB 3.44Å; D142-S144 PolarHBondContact OD1-N 3Å; D142-S144 PolarHBondContact OD1-OG 3.24Å; D142-S144 PolarHBondContact OD2-OG 2.98Å; S144-R146 PolarHBondContact O-N 3.37Å; S144-R146 WeakPolarHBondContact OG-CD 3.45Å; S144-R146 WeakPolarHBondContact OG-CG 3.41Å; S144-R146 PolarHBondContact OG-NE 3.19Å
145	G	55.7	Low	50.5	Low	42 Å²	42	88.5 Å²	88.5	43%	0.433	47%	0.472	S	S	.	.			trans	75.2	3	-179.5	0	0	0	0	0	114.7	D142 T143	D142-G145 PolarHBondContact O-N 3.06Å; D142-G145 PolarHBondContact OD1-N 2.94Å; T143-G145 VanDerWaalsContact C-N 3.35Å
146	R	55.5	Low	51.4	Low	130 Å²	130	92.2 Å²	92.2	49%	0.491	49%	0.485	S	S	.	.			trans	-72.7	139.2	175.4	-53.8	168.7	-152.4	-149.9	4.9	108.8	K141 D142 S144 Q159	K141-R146 VanDerWaalsContact CA-O 3.27Å; K141-R146 WeakPolarHBondContact CA-O 3.31Å; D142-R146 PolarHBondContact N-O 3.37Å; D142-R146 PolarHBondContact OD1-N 3.3Å; D142-R146 WeakPolarHBondContact OD2-CB 3.3Å; S144-R146 PolarHBondContact O-N 3.37Å; S144-R146 WeakPolarHBondContact OG-CD 3.45Å; S144-R146 WeakPolarHBondContact OG-CG 3.41Å; S144-R146 PolarHBondContact OG-NE 3.19Å; R146-Q159 HydrophobicContact CB-CG 4.46Å
147	Q	63.6	Low	52.2	Low	52 Å²	52	90.3 Å²	90.3	24%	0.243	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	139.1	175.6	-77	174.2	25.6	0	0	109.2	V139 T140 K141 Q159 V160	V139-Q147 HydrophobicContact CG1-CB 4.07Å; V139-Q147 HydrophobicContact CG1-CG 4.1Å; T140-Q147 CarbonylContact O-C 3.53Å; T140-Q147 WeakPolarHBondContact O-CA 3.26Å; K141-Q147 HydrophobicContact CD-CG 3.79Å; K141-Q147 HydrophobicContact CG-CG 3.69Å; Q147-Q159 CarbonylContact O-C 3.6Å; Q147-Q159 WeakPolarHBondContact O-CA 3.34Å; Q147-V160 HydrophobicContact CB-CB 3.71Å; Q147-V160 HydrophobicContact CB-CG1 4.49Å; Q147-V160 HydrophobicContact CB-CG2 4.04Å; Q147-V160 PolarHBondContact O-N 3.05Å
148	W	60.6	Low	52.9	Low	67 Å²	67	91.4 Å²	91.4	25%	0.254	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	137.6	177.6	-61.4	93	0	0	0	107.6	V139 T140 D142 V157 R158 Q159	V139-W148 CarbonylContact C-O 3.55Å; V139-W148 WeakPolarHBondContact CA-O 3.38Å; T140-W148 PolarHBondContact N-O 2.75Å; T140-W148 PolarHBondContact O-N 3.06Å; T140-W148 WeakPolarHBondContact OG1-CB 3.42Å; T140-W148 PolarHBondContact OG1-O 2.74Å; D142-W148 PolarHBondContact OD2-NE1 3.39Å; W148-V157 HydrophobicContact CB-CG1 3.88Å; W148-V157 HydrophobicContact CD2-CG1 4.4Å; W148-V157 HydrophobicContact CE3-CG1 3.88Å; W148-V157 HydrophobicContact CG-CG1 4.46Å; W148-R158 CarbonylContact C-O 3.56Å; W148-R158 WeakPolarHBondContact CA-O 3.37Å; W148-Q159 HydrophobicContact CD2-CB 4.44Å; W148-Q159 HydrophobicContact CE3-CB 3.9Å; W148-Q159 HydrophobicContact CH2-CB 4.18Å; W148-Q159 HydrophobicContact CZ3-CB 3.77Å
149	R	59.8	Low	53.9	Low	150 Å²	150	93.6 Å²	93.6	57%	0.566	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.5	133.2	177.9	-169.6	177.6	-173.2	-173.3	1.9	108.5	R158 V160	R149-R158 PolarHBondContact N-O 3.2Å; R149-R158 PolarHBondContact O-N 3.04Å; R149-V160 HydrophobicContact CB-CG2 3.66Å
150	R	54.2	Low	54.8	Low	181 Å²	181	94.9 Å²	94.9	68%	0.683	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	122.5	173.8	-159.9	175.5	-165.4	-175.1	3.5	109	A152 G155 V157	R150-A152 PolarHBondContact O-N 3.47Å; R150-G155 PolarHBondContact NE-O 3.02Å; R150-V157 HydrophobicContact CG-CG2 4.28Å
151	D	55.6	Low	55.4	Low	48 Å²	48	98.5 Å²	98.5	26%	0.257	49%	0.493	S	S	.	.			trans	-69.6	116.6	173.6	-87	-28.9	0	0	0	109.5	R153 H154 G155 K156 R158	D151-R153 PolarHBondContact O-N 3.12Å; D151-R153 VanDerWaalsContact O-N 3.15Å; D151-H154 PolarHBondContact O-N 3.45Å; D151-G155 WeakPolarHBondContact O-CA 3.31Å; D151-G155 PolarHBondContact O-N 3.15Å; D151-K156 PolarHBondContact N-O 3.08Å; D151-R158 VanDerWaalsContact OD2-CD 3.31Å; D151-R158 WeakPolarHBondContact OD2-CD 3.45Å; D151-R158 IonicContact OD2-CZ 2.91Å; D151-R158 IonicContact OD2-NE 3.56Å; D151-R158 PolarHBondContact OD2-NE 3.31Å; D151-R158 VanDerWaalsContact OD2-NE 3.09Å
152	A	53.4	Low	55.7	Low	110 Å²	110	104.5 Å²	104.5	91%	0.909	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.6	-179.4	0	0	0	0	0	113.5	R150	R150-A152 PolarHBondContact O-N 3.47Å
153	R	48	Very low	55.3	Low	231 Å²	231	112.5 Å²	112.5	87%	0.872	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-24	-177.8	-65	-171.9	-173.6	-161.7	1.3	114.3	D151	D151-R153 PolarHBondContact O-N 3.12Å; D151-R153 VanDerWaalsContact O-N 3.15Å
154	H	55.8	Low	54.9	Low	136 Å²	136	110.6 Å²	110.6	63%	0.63	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.5	-1.5	-169.4	-62.6	-31.6	0	0	0	113.8	D151 K156	D151-H154 PolarHBondContact O-N 3.45Å; H154-K156 HydrophobicContact CB-CG 4.35Å; H154-K156 PolarHBondContact O-N 3.23Å
155	G	48.4	Very low	54.1	Low	38 Å²	38	116 Å²	116	39%	0.392	56%	0.564	S	S	.	*			trans	65.6	-5.2	-177.1	0	0	0	0	0	114.8	R150 D151	R150-G155 PolarHBondContact NE-O 3.02Å; D151-G155 WeakPolarHBondContact O-CA 3.31Å; D151-G155 PolarHBondContact O-N 3.15Å
156	K	50.6	Low	53	Low	139 Å²	139	120.4 Å²	120.4	60%	0.604	58%	0.577	S	S	*	*			trans	-69.2	132.3	-179.1	-72.9	-173.7	177.7	-178.5	0	110.6	D151 H154	D151-K156 PolarHBondContact N-O 3.08Å; H154-K156 HydrophobicContact CB-CG 4.35Å; H154-K156 PolarHBondContact O-N 3.23Å
157	V	50.7	Low	51.9	Low	84 Å²	84	120.5 Å²	120.5	51%	0.509	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.9	124.7	174.1	-175.9	0	0	0	0	108.1	W148 R150	W148-V157 HydrophobicContact CB-CG1 3.88Å; W148-V157 HydrophobicContact CD2-CG1 4.4Å; W148-V157 HydrophobicContact CE3-CG1 3.88Å; W148-V157 HydrophobicContact CG-CG1 4.46Å; R150-V157 HydrophobicContact CG-CG2 4.28Å
158	R	59	Low	50.4	Low	152 Å²	152	126 Å²	126	57%	0.574	61%	0.612	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-117.9	138.3	178.1	-68.9	-175.1	174.4	-166.3	-1.8	110.3	W148 R149 D151 V160	W148-R158 CarbonylContact C-O 3.56Å; W148-R158 WeakPolarHBondContact CA-O 3.37Å; R149-R158 PolarHBondContact N-O 3.2Å; R149-R158 PolarHBondContact O-N 3.04Å; D151-R158 VanDerWaalsContact OD2-CD 3.31Å; D151-R158 WeakPolarHBondContact OD2-CD 3.45Å; D151-R158 IonicContact OD2-CZ 2.91Å; D151-R158 IonicContact OD2-NE 3.56Å; D151-R158 PolarHBondContact OD2-NE 3.31Å; D151-R158 VanDerWaalsContact OD2-NE 3.09Å; R158-V160 PolarHBondContact O-N 2.91Å
159	Q	68.3	Low	49.2	Very low	85 Å²	85	126.2 Å²	126.2	40%	0.397	63%	0.628	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68	125	170.3	-169.2	-177.5	-12.6	0	0	109	R146 Q147 W148 T161	R146-Q159 HydrophobicContact CB-CG 4.46Å; Q147-Q159 CarbonylContact O-C 3.6Å; Q147-Q159 WeakPolarHBondContact O-CA 3.34Å; W148-Q159 HydrophobicContact CD2-CB 4.44Å; W148-Q159 HydrophobicContact CE3-CB 3.9Å; W148-Q159 HydrophobicContact CH2-CB 4.18Å; W148-Q159 HydrophobicContact CZ3-CB 3.77Å; Q159-T161 VanDerWaalsContact C-N 3.32Å; Q159-T161 PolarHBondContact O-N 2.87Å
160	V	65.2	Low	48	Very low	55 Å²	55	126.9 Å²	126.9	33%	0.333	64%	0.643	S	S	.	*			trans	-76.4	87.6	172.4	-174.7	0	0	0	0	107.4	Q147 R149 R158 K162	Q147-V160 HydrophobicContact CB-CB 3.71Å; Q147-V160 HydrophobicContact CB-CG1 4.49Å; Q147-V160 HydrophobicContact CB-CG2 4.04Å; Q147-V160 PolarHBondContact O-N 3.05Å; R149-V160 HydrophobicContact CB-CG2 3.66Å; R158-V160 PolarHBondContact O-N 2.91Å; V160-K162 PolarHBondContact O-N 2.93Å
161	T	62.2	Low	47	Very low	101 Å²	101	123.7 Å²	123.7	62%	0.62	64%	0.643	S	S	*	*			trans	-69.1	110.7	166.6	54	0	0	0	0	107.6	Q159 K163	Q159-T161 VanDerWaalsContact C-N 3.32Å; Q159-T161 PolarHBondContact O-N 2.87Å; T161-K163 PolarHBondContact O-N 3.24Å
162	K	54.9	Low	46.1	Very low	180 Å²	180	127 Å²	127	78%	0.783	67%	0.668	S	S	*	*			trans	-58.8	105.8	160.5	-80.1	-173.9	176.6	-176.7	0	106.1	V160 A164	V160-K162 PolarHBondContact O-N 2.93Å; K162-A164 VanDerWaalsContact C-N 3.27Å; K162-A164 PolarHBondContact O-N 2.74Å
163	K	43.5	Very low	45.2	Very low	191 Å²	191	130 Å²	130	83%	0.83	67%	0.668	S	S	*	*			trans	-59.7	102.1	160.3	-82.8	-173.3	175.6	-177	0	105.3	T161 K165	T161-K163 PolarHBondContact O-N 3.24Å; K163-K165 VanDerWaalsContact C-N 3.25Å; K163-K165 PolarHBondContact O-N 3.28Å
164	A	35.7	Very low	44.5	Very low	81 Å²	81	123.6 Å²	123.6	67%	0.669	66%	0.658	S	S	*	*			trans	-58.7	100.7	160.4	0	0	0	0	0	105.5	K162 L166	K162-A164 VanDerWaalsContact C-N 3.27Å; K162-A164 PolarHBondContact O-N 2.74Å; A164-L166 PolarHBondContact O-N 3.11Å
165	K	35.1	Very low	43.7	Very low	184 Å²	184	123 Å²	123	80%	0.8	66%	0.664	S	S	*	*			trans	-65.2	82.2	155	-80.5	-175.3	175.3	-177.4	0	105.4	K163 N167	K163-K165 VanDerWaalsContact C-N 3.25Å; K163-K165 PolarHBondContact O-N 3.28Å; K165-N167 PolarHBondContact O-N 3.39Å
166	L	32.8	Very low	42.9	Very low	134 Å²	134	132.2 Å²	132.2	70%	0.702	69%	0.687	S	S	*	*			trans	-65.8	85.4	154.2	-102.9	139.9	0	0	0	105	A164 H168	A164-L166 PolarHBondContact O-N 3.11Å; L166-H168 PolarHBondContact O-N 3.33Å
167	N	32.1	Very low	42.1	Very low	131 Å²	131	132.3 Å²	132.3	70%	0.701	70%	0.695	S	S	*	*			trans	-65.9	95.8	161.8	-78.4	-11.7	0	0	0	105.8	K165 A169	K165-N167 PolarHBondContact O-N 3.39Å; N167-A169 PolarHBondContact O-N 2.75Å
168	H	33.4	Very low	41.6	Very low	168 Å²	168	133.4 Å²	133.4	78%	0.778	71%	0.706	S	S	*	*			trans	-63.3	79.6	157.6	-80.5	-77	0	0	0	107.9	L166	L166-H168 PolarHBondContact O-N 3.33Å
169	A	33.6	Very low	40.5	Very low	71 Å²	71	136 Å²	136	59%	0.587	72%	0.721	S	S	*	*			trans	-148.5	71.5	174.5	0	0	0	0	0	107.4	N167	N167-A169 PolarHBondContact O-N 2.75Å
170	N	35.2	Very low	39	Very low	164 Å²	164	136.9 Å²	136.9	88%	0.877	74%	0.743	S	S	*	*			trans	178.7	51.2	159.2	-90.6	-12.5	0	0	0	110.6	P172	N170-P172 WeakPolarHBondContact O-CD 3.37Å
171	V	34.2	Very low	37.5	Very low	114 Å²	114	137.5 Å²	137.5	69%	0.691	76%	0.76	S	S	*	*			trans	-95.9	108.5	161	179.2	0	0	0	0	106.2	L173	V171-L173 PolarHBondContact O-N 3.23Å
172	P	36.2	Very low	36.2	Very low	119 Å²	119	140.5 Å²	140.5	77%	0.773	77%	0.772	S	S	*	*			trans	-72.3	101.7	172.2	27.8	-28.8	0	0	0	108.5	N170 S174	N170-P172 WeakPolarHBondContact O-CD 3.37Å; P172-S174 PolarHBondContact O-N 2.82Å
173	L	33.6	Very low	35.1	Very low	173 Å²	173	139.2 Å²	139.2	91%	0.906	77%	0.773	S	S	*	*			trans	-66	104.7	157	-87.4	128.6	0	0	0	107.5	V171	V171-L173 PolarHBondContact O-N 3.23Å
174	S	34.3	Very low	34.7	Very low	95 Å²	95	136.2 Å²	136.2	66%	0.664	77%	0.771	S	S	*	*			trans	-124.3	108.2	166.1	-166.8	0	0	0	0	110.4	P172	P172-S174 PolarHBondContact O-N 2.82Å
175	T	38.9	Very low	34.7	Very low	124 Å²	124	141 Å²	141	76%	0.761	78%	0.779	S	S	*	*			trans	62.3	85.8	138.5	58.3	0	0	0	0	119.1	N177	T175-N177 PolarHBondContact O-N 2.82Å
176	R	31.1	Very low	34.9	Very low	231 Å²	231	139.4 Å²	139.4	87%	0.872	78%	0.779	S	S	*	*				-22.1	117.6	128.6	-160.4	-177.1	-159	-178.9	3.9	113
177	N	35.2	Very low	35.3	Very low	142 Å²	142	138.3 Å²	138.3	76%	0.759	78%	0.78	S	S	*	*				176.1	147.1	128.4	-91.5	-16.9	0	0	0	114.1	T175	T175-N177 PolarHBondContact O-N 2.82Å
178	S	38.5	Very low	35.8	Very low	106 Å²	106	144 Å²	144	74%	0.741	79%	0.791	S	S	*	*			trans	67.2	106.6	152.2	54.1	0	0	0	0	120.7
179	K	36.5	Very low	36.1	Very low	208 Å²	208	145 Å²	145	90%	0.904	80%	0.796	S	S	*	*				42.7	140.8	119.5	-78.7	-179.9	173.5	179.3	0	120
180	A	37.8	Very low	36.5	Very low	103 Å²	103	153.1 Å²	153.1	85%	0.851	81%	0.812	S	S	*	*			trans	75.9	114.2	172.1	0	0	0	0	0	112.2
181	G	32.3	Very low	37.2	Very low	67 Å²	67	156.6 Å²	156.6	69%	0.691	81%	0.813	S	S	*	*				87.7	81.1	54.7	0	0	0	0	0	106.6
182	D	35.4	Very low	38.2	Very low	164 Å²	164	156.6 Å²	156.6	88%	0.877	82%	0.815	S	S	*	*			trans	-175.2	135.2	142.1	-96.2	-24.9	0	0	0	111.7
183	L	31.3	Very low	39.5	Very low	154 Å²	154	156.4 Å²	156.4	81%	0.806	81%	0.814	S	S	*	*			trans	-64.7	130.1	176.3	-78.6	101.1	0	0	0	110.7
184	V	35.5	Very low	40.8	Very low	128 Å²	128	153.8 Å²	153.8	78%	0.776	81%	0.807	S	S	*	*			trans	-123.1	100.9	155.9	-178.5	0	0	0	0	108	L186	V184-L186 PolarHBondContact O-N 2.83Å
185	Q	35.9	Very low	41.6	Very low	180 Å²	180	155.3 Å²	155.3	84%	0.841	82%	0.815	S	S	*	*			trans	-66.6	112.1	167.3	-89.9	177.3	-5.8	0	0	109.1
186	L	39.6	Very low	41.9	Very low	152 Å²	152	154 Å²	154	80%	0.796	82%	0.817	S	S	*	*			trans	-77.6	139	167	-80.6	154.1	0	0	0	110.2	V184 R188	V184-L186 PolarHBondContact O-N 2.83Å; L186-R188 PolarHBondContact O-N 3.01Å
187	P	40.6	Very low	42.6	Very low	111 Å²	111	155.4 Å²	155.4	72%	0.721	82%	0.822	S	S	*	*			trans	-67.2	133.6	-177.2	26.2	-32	0	0	0	111.4	Q189	P187-Q189 PolarHBondContact O-N 3.37Å
188	R	41.8	Very low	42.9	Very low	250 Å²	250	151.4 Å²	151.4	94%	0.943	81%	0.814	S	S	*	*			trans	-56.5	102.8	174.9	-77.6	177.7	170	168.4	-2.8	110.6	L186	L186-R188 PolarHBondContact O-N 3.01Å
189	Q	40.4	Very low	43.2	Very low	188 Å²	188	156.5 Å²	156.5	88%	0.879	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-69.3	128.4	165.6	-78.8	-166.5	-10.4	0	0	110.3	P187	P187-Q189 PolarHBondContact O-N 3.37Å
190	R	42.8	Very low	43.8	Very low	243 Å²	243	152.5 Å²	152.5	92%	0.917	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-61.3	130.2	175.6	-70.5	179.8	173.1	-157.3	-1.7	110
191	R	48.7	Very low	44.6	Very low	237 Å²	237	152.8 Å²	152.8	89%	0.894	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-65.6	137	173.6	-69.3	-179.1	-179.6	-175.6	-0.3	110.3
192	P	55.8	Low	45.4	Very low	114 Å²	114	160.1 Å²	160.1	74%	0.74	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-67.5	151.7	168.7	28	-32.2	0	0	0	110.9
193	P	62.7	Low	46.3	Very low	115 Å²	115	155.7 Å²	155.7	75%	0.747	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-65.2	152.4	177.3	27.8	-33.7	0	0	0	111.5
194	P	61.9	Low	47.2	Very low	118 Å²	118	153.7 Å²	153.7	77%	0.766	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-63.9	142	177.3	27.2	-33.3	0	0	0	110.6	A196	P194-A196 PolarHBondContact O-N 2.82Å
195	P	50.7	Low	48	Very low	127 Å²	127	155.4 Å²	155.4	83%	0.825	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-60.9	136.2	174.7	25.2	-32.1	0	0	0	110	R197	P195-R197 PolarHBondContact O-N 3.13Å
196	A	46.1	Very low	48.8	Very low	97 Å²	97	149.5 Å²	149.5	80%	0.802	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-50.1	139	174.6	0	0	0	0	0	110.2	P194 G198	P194-A196 PolarHBondContact O-N 2.82Å; A196-G198 VanDerWaalsContact C-N 3.25Å; A196-G198 PolarHBondContact O-N 2.83Å
197	R	45	Very low	49.5	Very low	260 Å²	260	148.1 Å²	148.1	98%	0.981	74%	0.735	S	S	*	*			trans	-56.7	85.9	176.1	-78.5	176.3	171.9	170.7	-3.3	110	P195	P195-R197 PolarHBondContact O-N 3.13Å
198	G	41	Very low	50.1	Low	57 Å²	57	147.5 Å²	147.5	59%	0.588	73%	0.725	S	S	*	*			trans	-72.4	139.1	168.8	0	0	0	0	0	109.1	A196 N200	A196-G198 VanDerWaalsContact C-N 3.25Å; A196-G198 PolarHBondContact O-N 2.83Å; G198-N200 PolarHBondContact O-N 3.14Å
199	Y	44.4	Very low	50.8	Low	213 Å²	213	140.2 Å²	140.2	84%	0.835	70%	0.704	S	S	*	*			trans	-38.9	123.7	170.1	-95.7	-103.5	0	0	0	110.1	D201	Y199-D201 PolarHBondContact O-N 3Å
200	N	49.3	Very low	51.4	Low	124 Å²	124	133.4 Å²	133.4	66%	0.663	68%	0.679	S	S	*	*			trans	-55.4	112.6	176.9	-79.9	-26.2	0	0	0	108.5	G198 R202 S203	G198-N200 PolarHBondContact O-N 3.14Å; N200-R202 PolarHBondContact O-N 3.39Å; N200-S203 PolarHBondContact O-N 3.43Å; N200-S203 PolarHBondContact O-OG 2.9Å
201	D	54.5	Low	51.6	Low	109 Å²	109	124.1 Å²	124.1	58%	0.583	66%	0.655	S	S	*	*	H	α-helix	trans	-49.5	-25.2	179.7	-120.1	-15.8	0	0	0	112.7	Y199 R205	Y199-D201 PolarHBondContact O-N 3Å; D201-R205 VanDerWaalsContact O-CB 3.25Å; D201-R205 WeakPolarHBondContact O-CB 3.4Å; D201-R205 WeakPolarHBondContact O-CG 3.45Å; D201-R205 PolarHBondContact O-N 3.43Å
202	R	51	Low	51.7	Low	222 Å²	222	114.2 Å²	114.2	84%	0.838	63%	0.626	S	S	*	*	H	α-helix	trans	-67.8	-41.2	175.6	-69.2	-175.1	-179.5	-179.4	0.2	113.2	N200 A206	N200-R202 PolarHBondContact O-N 3.39Å; R202-A206 WeakPolarHBondContact O-CB 3.45Å; R202-A206 PolarHBondContact O-N 2.73Å
203	S	52.9	Low	51.4	Low	70 Å²	70	114 Å²	114	49%	0.49	62%	0.615	S	S	.	*	H	α-helix	trans	-71.5	-40.1	-178.8	-20.8	0	0	0	0	111	N200 A206 L207	N200-S203 PolarHBondContact O-N 3.43Å; N200-S203 PolarHBondContact O-OG 2.9Å; S203-A206 PolarHBondContact O-N 3.05Å; S203-L207 PolarHBondContact O-N 3.29Å
204	F	50.1	Low	50.8	Low	112 Å²	112	113.7 Å²	113.7	49%	0.491	61%	0.606	S	S	.	*	H	α-helix	trans	-69.5	-40.1	177.7	-167.6	-106.6	0	0	0	111.6	L207 L208	F204-L207 PolarHBondContact O-N 2.6Å; F204-L208 HydrophobicContact CD1-CD1 3.63Å; F204-L208 HydrophobicContact CD1-CG 4.37Å; F204-L208 HydrophobicContact CE1-CD1 3.43Å; F204-L208 VanDerWaalsContact CE1-CD1 3.43Å; F204-L208 HydrophobicContact CE1-CG 4.15Å; F204-L208 HydrophobicContact CZ-CD1 4.2Å; F204-L208 HydrophobicContact CZ-CG 4.49Å; F204-L208 WeakPolarHBondContact O-CB 3.23Å; F204-L208 WeakPolarHBondContact O-CG 3.45Å; F204-L208 PolarHBondContact O-N 3.5Å
205	R	52.5	Low	50.2	Low	165 Å²	165	112 Å²	112	62%	0.623	59%	0.594	S	S	*	*	H	α-helix	trans	-61.7	-41.7	170.4	-77.1	178.3	-177.5	-151.7	0.7	112.4	D201 L208 I209	D201-R205 VanDerWaalsContact O-CB 3.25Å; D201-R205 WeakPolarHBondContact O-CB 3.4Å; D201-R205 WeakPolarHBondContact O-CG 3.45Å; D201-R205 PolarHBondContact O-N 3.43Å; R205-L208 PolarHBondContact O-N 3.39Å; R205-I209 WeakPolarHBondContact O-CD1 3.4Å; R205-I209 WeakPolarHBondContact O-CG1 3.45Å; R205-I209 PolarHBondContact O-N 3.17Å
206	A	53.2	Low	50	Low	56 Å²	56	109.2 Å²	109.2	46%	0.463	57%	0.571	S	S	.	*	H	α-helix	trans	-63.9	-41.3	176.9	0	0	0	0	0	112.2	R202 S203 I209 A210	R202-A206 WeakPolarHBondContact O-CB 3.45Å; R202-A206 PolarHBondContact O-N 2.73Å; S203-A206 PolarHBondContact O-N 3.05Å; A206-I209 PolarHBondContact O-N 3.18Å; A206-A210 WeakPolarHBondContact O-CB 3.37Å; A206-A210 PolarHBondContact O-N 3.42Å
207	L	53.4	Low	49.9	Very low	122 Å²	122	107.6 Å²	107.6	64%	0.639	56%	0.557	S	S	*	*	H	α-helix	trans	-64	-41.6	175.4	-164.3	87.6	0	0	0	111.8	S203 F204 A210 A211	S203-L207 PolarHBondContact O-N 3.29Å; F204-L207 PolarHBondContact O-N 2.6Å; L207-A210 PolarHBondContact O-N 3.49Å; L207-A211 WeakPolarHBondContact O-CB 3.19Å; L207-A211 PolarHBondContact O-N 3.09Å
208	L	53.8	Low	50.1	Low	98 Å²	98	99.8 Å²	99.8	51%	0.513	53%	0.534	S	S	.	.	H	α-helix	trans	-66.1	-37.4	176.5	-79.4	169	0	0	0	112.6	F204 R205 G212	F204-L208 HydrophobicContact CD1-CD1 3.63Å; F204-L208 HydrophobicContact CD1-CG 4.37Å; F204-L208 HydrophobicContact CE1-CD1 3.43Å; F204-L208 VanDerWaalsContact CE1-CD1 3.43Å; F204-L208 HydrophobicContact CE1-CG 4.15Å; F204-L208 HydrophobicContact CZ-CD1 4.2Å; F204-L208 HydrophobicContact CZ-CG 4.49Å; F204-L208 WeakPolarHBondContact O-CB 3.23Å; F204-L208 WeakPolarHBondContact O-CG 3.45Å; F204-L208 PolarHBondContact O-N 3.5Å; R205-L208 PolarHBondContact O-N 3.39Å; L208-G212 PolarHBondContact O-N 3.17Å
209	I	55.9	Low	50.6	Low	98 Å²	98	100.2 Å²	100.2	50%	0.503	53%	0.528	S	S	.	.	H	α-helix	trans	-65	-47.8	174.6	-68.7	163.2	0	0	0	109.8	R205 A206 A211 G212 E213	R205-I209 WeakPolarHBondContact O-CD1 3.4Å; R205-I209 WeakPolarHBondContact O-CG1 3.45Å; R205-I209 PolarHBondContact O-N 3.17Å; A206-I209 PolarHBondContact O-N 3.18Å; I209-A211 PolarHBondContact O-N 3.45Å; I209-G212 PolarHBondContact O-N 3.32Å; I209-G212 VanDerWaalsContact O-N 3.14Å; I209-E213 WeakPolarHBondContact O-CG 3.22Å; I209-E213 PolarHBondContact O-N 2.89Å
210	A	52.7	Low	50.9	Low	44 Å²	44	95.2 Å²	95.2	36%	0.364	52%	0.515	S	S	.	.	H	α-helix	trans	-62.3	-41.3	178.1	0	0	0	0	0	112.5	A206 L207 G212 E213 I214	A206-A210 WeakPolarHBondContact O-CB 3.37Å; A206-A210 PolarHBondContact O-N 3.42Å; L207-A210 PolarHBondContact O-N 3.49Å; A210-G212 VanDerWaalsContact C-N 3.33Å; A210-G212 PolarHBondContact O-N 2.84Å; A210-E213 PolarHBondContact O-N 2.89Å; A210-I214 WeakPolarHBondContact O-CG1 3.42Å; A210-I214 PolarHBondContact O-N 3.3Å; A210-I214 VanDerWaalsContact O-N 3.09Å
211	A	48.1	Very low	50.8	Low	49 Å²	49	91.6 Å²	91.6	41%	0.405	50%	0.5	S	S	.	.	H	α-helix	trans	-65.4	-37.1	174.8	0	0	0	0	0	112.1	L207 I209 T215	L207-A211 WeakPolarHBondContact O-CB 3.19Å; L207-A211 PolarHBondContact O-N 3.09Å; I209-A211 PolarHBondContact O-N 3.45Å; A211-T215 WeakPolarHBondContact O-CB 2.97Å; A211-T215 PolarHBondContact O-N 3.35Å; A211-T215 VanDerWaalsContact O-N 3.08Å; A211-T215 PolarHBondContact O-OG1 3.41Å
212	G	49.8	Very low	50.3	Low	29 Å²	29	90.9 Å²	90.9	30%	0.299	49%	0.494	S	S	.	.	H	α-helix	trans	-64.8	-43	174.4	0	0	0	0	0	112.9	L208 I209 A210 T215 M216	L208-G212 PolarHBondContact O-N 3.17Å; I209-G212 PolarHBondContact O-N 3.32Å; I209-G212 VanDerWaalsContact O-N 3.14Å; A210-G212 VanDerWaalsContact C-N 3.33Å; A210-G212 PolarHBondContact O-N 2.84Å; G212-T215 PolarHBondContact O-N 2.98Å; G212-M216 PolarHBondContact O-N 3.44Å
213	E	49.9	Very low	50.2	Low	108 Å²	108	82.5 Å²	82.5	51%	0.505	47%	0.473	S	S	.	.	H	α-helix	trans	-63.5	-44.9	177.3	-74.5	176	179.9	0	0	112	I209 A210 T215 M216 A217	I209-E213 WeakPolarHBondContact O-CG 3.22Å; I209-E213 PolarHBondContact O-N 2.89Å; A210-E213 PolarHBondContact O-N 2.89Å; E213-T215 VanDerWaalsContact C-N 3.32Å; E213-T215 PolarHBondContact O-N 3.4Å; E213-M216 PolarHBondContact O-N 3.46Å; E213-A217 WeakPolarHBondContact O-CB 3.38Å; E213-A217 PolarHBondContact O-N 2.97Å
214	I	50.2	Low	49.9	Very low	109 Å²	109	83 Å²	83	56%	0.559	48%	0.476	S	S	*	.	H	α-helix	trans	-62.6	-42.3	176.6	-65.8	166.3	0	0	0	110.5	A210 A217 I218	A210-I214 WeakPolarHBondContact O-CG1 3.42Å; A210-I214 PolarHBondContact O-N 3.3Å; A210-I214 VanDerWaalsContact O-N 3.09Å; I214-A217 PolarHBondContact O-N 2.84Å; I214-I218 HydrophobicContact CG2-CD1 3.96Å; I214-I218 VanDerWaalsContact O-CG1 3.31Å; I214-I218 WeakPolarHBondContact O-CG1 3.42Å; I214-I218 PolarHBondContact O-N 3.23Å
215	T	50.3	Low	49.6	Very low	84 Å²	84	84.9 Å²	84.9	52%	0.515	48%	0.484	S	S	.	.	H	α-helix	trans	-67	-39.3	179.7	-52.9	0	0	0	0	111.6	A211 G212 E213 I218 S219	A211-T215 WeakPolarHBondContact O-CB 2.97Å; A211-T215 PolarHBondContact O-N 3.35Å; A211-T215 VanDerWaalsContact O-N 3.08Å; A211-T215 PolarHBondContact O-OG1 3.41Å; G212-T215 PolarHBondContact O-N 2.98Å; E213-T215 VanDerWaalsContact C-N 3.32Å; E213-T215 PolarHBondContact O-N 3.4Å; T215-I218 PolarHBondContact O-N 2.9Å; T215-S219 WeakPolarHBondContact O-CB 3.47Å; T215-S219 PolarHBondContact O-N 3.32Å; T215-S219 PolarHBondContact O-OG 3.45Å
216	M	46.4	Very low	49	Very low	67 Å²	67	79.4 Å²	79.4	33%	0.33	48%	0.475	S	S	.	.	H	α-helix	trans	-67.5	-40.1	174.8	-80.9	-149.2	-113.5	0	0	112.3	Q121 G212 E213 I218 S219 L220	Q121-M216 HydrophobicContact CG-CE 4.29Å; G212-M216 PolarHBondContact O-N 3.44Å; E213-M216 PolarHBondContact O-N 3.46Å; M216-I218 VanDerWaalsContact C-N 3.33Å; M216-I218 PolarHBondContact O-N 3.28Å; M216-S219 PolarHBondContact O-N 3.09Å; M216-L220 WeakPolarHBondContact O-CB 3.41Å; M216-L220 PolarHBondContact O-N 2.96Å
217	A	42.9	Very low	48.3	Very low	63 Å²	63	81.4 Å²	81.4	52%	0.521	48%	0.484	S	S	.	.	H	α-helix	trans	-60.3	-43.2	175.6	0	0	0	0	0	111.9	E213 I214 S221	E213-A217 WeakPolarHBondContact O-CB 3.38Å; E213-A217 PolarHBondContact O-N 2.97Å; I214-A217 PolarHBondContact O-N 2.84Å; A217-S221 WeakPolarHBondContact O-CB 3.41Å; A217-S221 PolarHBondContact O-N 2.93Å
218	I	50.3	Low	47.6	Very low	96 Å²	96	78.8 Å²	78.8	49%	0.492	47%	0.474	S	S	.	.	H	α-helix	trans	-64.1	-43.8	174.8	-65.3	166.6	0	0	0	110.4	I214 T215 M216 S221 M222	I214-I218 HydrophobicContact CG2-CD1 3.96Å; I214-I218 VanDerWaalsContact O-CG1 3.31Å; I214-I218 WeakPolarHBondContact O-CG1 3.42Å; I214-I218 PolarHBondContact O-N 3.23Å; T215-I218 PolarHBondContact O-N 2.9Å; M216-I218 VanDerWaalsContact C-N 3.33Å; M216-I218 PolarHBondContact O-N 3.28Å; I218-S221 PolarHBondContact O-N 3.37Å; I218-S221 PolarHBondContact O-OG 3.11Å; I218-M222 WeakPolarHBondContact O-CG 3.4Å; I218-M222 PolarHBondContact O-N 3.25Å
219	S	51.1	Low	46.8	Very low	67 Å²	67	80.6 Å²	80.6	47%	0.469	48%	0.478	S	S	.	.	H	α-helix	trans	-66.5	-41.4	-178.8	-55.2	0	0	0	0	112.8	T215 M216 M222 A223	T215-S219 WeakPolarHBondContact O-CB 3.47Å; T215-S219 PolarHBondContact O-N 3.32Å; T215-S219 PolarHBondContact O-OG 3.45Å; M216-S219 PolarHBondContact O-N 3.09Å; S219-M222 PolarHBondContact O-N 3.17Å; S219-A223 WeakPolarHBondContact O-CB 3.21Å; S219-A223 PolarHBondContact O-N 3.39Å
220	L	50.5	Low	46.2	Very low	107 Å²	107	80.2 Å²	80.2	56%	0.56	48%	0.48	S	S	*	.	H	α-helix	trans	-66.8	-36.8	175	-85	152.3	0	0	0	111.6	M216 M222 A223 S224	M216-L220 WeakPolarHBondContact O-CB 3.41Å; M216-L220 PolarHBondContact O-N 2.96Å; L220-M222 VanDerWaalsContact C-N 3.34Å; L220-A223 PolarHBondContact O-N 3.03Å; L220-S224 WeakPolarHBondContact O-CB 3.31Å; L220-S224 PolarHBondContact O-N 3.33Å; L220-S224 PolarHBondContact O-OG 3.14Å
221	S	46.6	Very low	45.3	Very low	48 Å²	48	81 Å²	81	34%	0.336	49%	0.487	S	S	.	.	H	α-helix	trans	-63.1	-42.1	172.2	83.9	0	0	0	0	111.1	A217 I218 S224 F225	A217-S221 WeakPolarHBondContact O-CB 3.41Å; A217-S221 PolarHBondContact O-N 2.93Å; I218-S221 PolarHBondContact O-N 3.37Å; I218-S221 PolarHBondContact O-OG 3.11Å; S221-S224 WeakPolarHBondContact CA-OG 3.21Å; S221-S224 PolarHBondContact O-OG 3.28Å; S221-F225 VanDerWaalsContact O-CD2 3.31Å; S221-F225 WeakPolarHBondContact O-CD2 3.43Å; S221-F225 PolarHBondContact O-N 3.11Å
222	M	45.6	Very low	44.8	Very low	94 Å²	94	83.7 Å²	83.7	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-70.9	-36.6	178.7	-67.3	-72.9	102.3	0	0	112.5	I218 S219 L220 F225 A226	I218-M222 WeakPolarHBondContact O-CG 3.4Å; I218-M222 PolarHBondContact O-N 3.25Å; S219-M222 PolarHBondContact O-N 3.17Å; L220-M222 VanDerWaalsContact C-N 3.34Å; M222-F225 PolarHBondContact O-N 3.35Å; M222-A226 WeakPolarHBondContact O-CB 3.41Å; M222-A226 PolarHBondContact O-N 3.44Å
223	A	47	Very low	44.2	Very low	47 Å²	47	91 Å²	91	39%	0.388	51%	0.513	S	S	.	.	H	α-helix	trans	-69.2	-35.3	177.7	0	0	0	0	0	112.7	S219 L220 F225 A226 C227	S219-A223 WeakPolarHBondContact O-CB 3.21Å; S219-A223 PolarHBondContact O-N 3.39Å; L220-A223 PolarHBondContact O-N 3.03Å; A223-F225 VanDerWaalsContact C-N 3.32Å; A223-A226 PolarHBondContact O-N 3.37Å; A223-C227 PolarHBondContact O-N 3.28Å; A223-C227 VanDerWaalsContact O-N 3.11Å
224	S	46.9	Very low	43.7	Very low	81 Å²	81	95.1 Å²	95.1	57%	0.566	52%	0.524	S	S	*	.	H	α-helix	trans	-69.8	-28.5	175	44.2	0	0	0	0	112.7	L220 S221	L220-S224 WeakPolarHBondContact O-CB 3.31Å; L220-S224 PolarHBondContact O-N 3.33Å; L220-S224 PolarHBondContact O-OG 3.14Å; S221-S224 WeakPolarHBondContact CA-OG 3.21Å; S221-S224 PolarHBondContact O-OG 3.28Å
225	F	44.5	Very low	43.3	Very low	151 Å²	151	96 Å²	96	66%	0.662	54%	0.535	S	S	*	.	H	α-helix	trans	-76.5	-27.9	169	-86.6	-79.8	0	0	0	113.8	S221 M222 A223 F229	S221-F225 VanDerWaalsContact O-CD2 3.31Å; S221-F225 WeakPolarHBondContact O-CD2 3.43Å; S221-F225 PolarHBondContact O-N 3.11Å; M222-F225 PolarHBondContact O-N 3.35Å; A223-F225 VanDerWaalsContact C-N 3.32Å; F225-F229 WeakPolarHBondContact O-CD2 3.47Å
226	A	40.3	Very low	42.6	Very low	50 Å²	50	97 Å²	97	41%	0.413	54%	0.541	S	S	.	.	H	α-helix	trans	-84.2	-25.3	-177.8	0	0	0	0	0	114.4	M222 A223 F229 V230	M222-A226 WeakPolarHBondContact O-CB 3.41Å; M222-A226 PolarHBondContact O-N 3.44Å; A223-A226 PolarHBondContact O-N 3.37Å; A226-F229 PolarHBondContact O-N 3.26Å; A226-V230 PolarHBondContact O-N 2.98Å
227	C	38.7	Very low	42.1	Very low	97 Å²	97	99.8 Å²	99.8	66%	0.655	55%	0.553	S	S	*	*	H	α-helix	trans	-66.4	-33.6	-175.6	-108.8	0	0	0	0	116.7	A223 F229	A223-C227 PolarHBondContact O-N 3.28Å; A223-C227 VanDerWaalsContact O-N 3.11Å; C227-F229 VanDerWaalsContact C-N 3.32Å
228	P	37.4	Very low	41.7	Very low	67 Å²	67	101.7 Å²	101.7	44%	0.435	56%	0.56	S	S	.	*	H	α-helix	trans	-73.3	-24.5	174	26	-30.9	0	0	0	112.7	L232	P228-L232 WeakPolarHBondContact O-CB 3.15Å; P228-L232 WeakPolarHBondContact O-CD1 3.03Å; P228-L232 PolarHBondContact O-N 3.29Å
229	F	38.8	Very low	40.9	Very low	137 Å²	137	102 Å²	102	60%	0.601	58%	0.577	S	S	*	*	H	α-helix	trans	-79.4	-33.8	-177.4	-75.9	-82.5	0	0	0	113.4	F225 A226 C227 L232 Y233	F225-F229 WeakPolarHBondContact O-CD2 3.47Å; A226-F229 PolarHBondContact O-N 3.26Å; C227-F229 VanDerWaalsContact C-N 3.32Å; F229-L232 PolarHBondContact O-N 2.75Å; F229-Y233 WeakPolarHBondContact O-CB 3.28Å; F229-Y233 PolarHBondContact O-N 3.49Å
230	V	41.6	Very low	40	Very low	90 Å²	90	105 Å²	105	55%	0.545	59%	0.588	S	S	.	*	H	α-helix	trans	-73.2	-34.2	176.6	-177.9	0	0	0	0	111.5	A226 Y233 W234	A226-V230 PolarHBondContact O-N 2.98Å; V230-Y233 PolarHBondContact O-N 2.02Å; V230-W234 PolarHBondContact O-N 3.15Å
231	A	35.2	Very low	39.4	Very low	61 Å²	61	107.7 Å²	107.7	50%	0.504	60%	0.602	S	S	.	*	H	α-helix	trans	-68.6	-35.3	173	0	0	0	0	0	112.4	V235	A231-V235 VanDerWaalsContact O-CG2 3.28Å; A231-V235 WeakPolarHBondContact O-CG2 3.49Å; A231-V235 PolarHBondContact O-N 2.9Å
232	L	36	Very low	38.9	Very low	105 Å²	105	111.3 Å²	111.3	55%	0.55	63%	0.627	S	S	.	*	H	α-helix	trans	-74.6	-34.6	174.4	-84.4	158.5	0	0	0	112.9	P228 F229 W234 V235 V236	P228-L232 WeakPolarHBondContact O-CB 3.15Å; P228-L232 WeakPolarHBondContact O-CD1 3.03Å; P228-L232 PolarHBondContact O-N 3.29Å; F229-L232 PolarHBondContact O-N 2.75Å; L232-W234 VanDerWaalsContact C-N 3.29Å; L232-W234 PolarHBondContact O-N 3.3Å; L232-V235 PolarHBondContact O-N 2.6Å; L232-V236 WeakPolarHBondContact O-CB 3.29Å; L232-V236 WeakPolarHBondContact O-CG2 3.23Å; L232-V236 PolarHBondContact O-N 2.83Å
233	Y	37.5	Very low	38.3	Very low	181 Å²	181	110.2 Å²	110.2	71%	0.71	63%	0.633	S	S	*	*	H	α-helix	trans	-68.5	-25.7	177.3	-117.9	-95.4	0	0	0	113.6	F229 V230	F229-Y233 WeakPolarHBondContact O-CB 3.28Å; F229-Y233 PolarHBondContact O-N 3.49Å; V230-Y233 PolarHBondContact O-N 2.02Å
234	W	40	Very low	37.7	Very low	195 Å²	195	119.3 Å²	119.3	74%	0.739	66%	0.657	S	S	*	*	H	α-helix	trans	-92.1	-21.6	177.2	-84	79.4	0	0	0	114	V230 L232	V230-W234 PolarHBondContact O-N 3.15Å; L232-W234 VanDerWaalsContact C-N 3.29Å; L232-W234 PolarHBondContact O-N 3.3Å
235	V	41.6	Very low	37.2	Very low	127 Å²	127	123.5 Å²	123.5	77%	0.77	67%	0.673	S	S	*	*	H	α-helix	trans	-87.7	-17.1	173.5	176.7	0	0	0	0	111.7	A231 L232	A231-V235 VanDerWaalsContact O-CG2 3.28Å; A231-V235 WeakPolarHBondContact O-CG2 3.49Å; A231-V235 PolarHBondContact O-N 2.9Å; L232-V235 PolarHBondContact O-N 2.6Å
236	V	36.5	Very low	36.9	Very low	106 Å²	106	126.3 Å²	126.3	64%	0.642	68%	0.679	S	S	*	*			trans	-116.5	52.9	175.1	-166.5	0	0	0	0	110.3	L232	L232-V236 WeakPolarHBondContact O-CB 3.29Å; L232-V236 WeakPolarHBondContact O-CG2 3.23Å; L232-V236 PolarHBondContact O-N 2.83Å
237	Q	35.5	Very low	36.6	Very low	125 Å²	125	133.1 Å²	133.1	58%	0.584	70%	0.696	S	S	*	*			trans	-94	119.6	156.9	-88	-165	-10	0	0	108.9	A239	Q237-A239 PolarHBondContact O-N 3.44Å
238	P	34.8	Very low	36.6	Very low	104 Å²	104	133.6 Å²	133.6	68%	0.675	70%	0.698	S	S	*	*			trans	-62	130.2	176.6	25.3	-31.2	0	0	0	109.1	D240	P238-D240 PolarHBondContact O-N 2.91Å
239	A	32.4	Very low	36.5	Very low	103 Å²	103	142.2 Å²	142.2	85%	0.851	72%	0.722	S	S	*	*	S	Bend	trans	-60.1	75.7	166.5	0	0	0	0	0	109.9	Q237	Q237-A239 PolarHBondContact O-N 3.44Å
240	D	33.6	Very low	36.1	Very low	130 Å²	130	139 Å²	139	70%	0.695	73%	0.728	S	S	*	*			trans	-164.7	43.1	179.6	-116.6	-17.4	0	0	0	115.2	P238	P238-D240 PolarHBondContact O-N 2.91Å
241	L	35.9	Very low	35.6	Very low	163 Å²	163	140 Å²	140	85%	0.853	74%	0.739	S	S	*	*	S	Bend	trans	-115.3	15.6	174.6	-88.7	155.4	0	0	0	115
242	S	36.5	Very low	35.4	Very low	123 Å²	123	143.7 Å²	143.7	86%	0.86	75%	0.749	S	S	*	*	S	Bend	trans	-108.7	12.7	176.8	55.6	0	0	0	0	115.4
243	A	34	Very low	35.3	Very low	72 Å²	72	146.4 Å²	146.4	60%	0.595	76%	0.762	S	S	*	*			trans	-106.1	2	-173.9	0	0	0	0	0	116.5
244	R	33.9	Very low	35	Very low	238 Å²	238	140.5 Å²	140.5	90%	0.898	76%	0.756	S	S	*	*			trans	-114.1	82.5	178	-79.7	-176.1	178.4	-174	0.1	111.6
245	N	37.2	Very low	34.7	Very low	169 Å²	169	138.5 Å²	138.5	90%	0.904	76%	0.76	S	S	*	*			trans	-174.2	72.7	142.5	-90.4	-19.6	0	0	0	108.1
246	R	37.5	Very low	34.4	Very low	209 Å²	209	137.8 Å²	137.8	79%	0.789	76%	0.761	S	S	*	*			trans	-98.8	102.6	170.1	-91.6	-172.1	-171.9	178.9	7.5	109
247	Y	33.5	Very low	34.3	Very low	194 Å²	194	143.1 Å²	143.1	76%	0.761	77%	0.769	S	S	*	*			trans	76.8	162.6	145.7	-55.2	-63.2	0	0	0	119.1
248	P	39	Very low	34.4	Very low	107 Å²	107	143 Å²	143	70%	0.695	78%	0.78	S	S	*	*			cis	-134	157.2	0.2	15.1	11.2	0	0	0	116.5
249	R	34.7	Very low	34.3	Very low	248 Å²	248	140.9 Å²	140.9	94%	0.936	77%	0.767	S	S	*	*			trans	46.9	111.5	133.9	-62.2	179	169.4	157.7	-3	119.1
250	G	31.2	Very low	34.2	Very low	70 Å²	70	142.7 Å²	142.7	72%	0.722	76%	0.762	S	S	*	*			trans	-172.5	107.1	141.5	0	0	0	0	0	111
251	S	31.8	Very low	34.2	Very low	111 Å²	111	148.2 Å²	148.2	78%	0.776	77%	0.774	S	S	*	*			trans	70.5	134.7	154.9	167.4	0	0	0	0	117
252	L	30.5	Very low	34.1	Very low	137 Å²	137	146.5 Å²	146.5	72%	0.717	78%	0.775	S	S	*	*			cis	-177.9	146.3	-6.3	-111.1	154.4	0	0	0	102.5
253	I	34.4	Very low	34.1	Very low	163 Å²	163	152.2 Å²	152.2	84%	0.836	78%	0.778	S	S	*	*			trans	76.3	115.9	154.8	-55	152	0	0	0	117.2
254	G	30.6	Very low	34.2	Very low	56 Å²	56	153.1 Å²	153.1	58%	0.577	79%	0.785	S	S	*	*			trans	123.4	103.8	139.5	0	0	0	0	0	116
255	N	33	Very low	34.4	Very low	153 Å²	153	150 Å²	150	82%	0.818	79%	0.785	S	S	*	*			trans	92.8	80.4	143.9	-49.3	-15.9	0	0	0	116.9
256	S	36.3	Very low	34.4	Very low	113 Å²	113	153.9 Å²	153.9	79%	0.79	79%	0.788	S	S	*	*				41.3	115.3	123.9	56.7	0	0	0	0	119.4
257	W	33.3	Very low	34.4	Very low	218 Å²	218	147.8 Å²	147.8	83%	0.826	78%	0.781	S	S	*	*			trans	-52.1	167.1	164.5	-119.5	39.5	0	0	0	114.3
258	P	38.1	Very low	34.5	Very low	123 Å²	123	149.8 Å²	149.8	80%	0.799	79%	0.788	S	S	*	*				-141	144.6	90.8	29.1	-9.5	0	0	0	116.3
259	S	32.3	Very low	34.5	Very low	58 Å²	58	152.9 Å²	152.9	41%	0.406	80%	0.798	S	S	.	*			trans	-44.7	169	154.7	39	0	0	0	0	114.7
260	D	31	Very low	34.6	Very low	142 Å²	142	147.2 Å²	147.2	76%	0.759	79%	0.793	S	S	*	*			trans	98.4	37	157.3	-57.4	-38.1	0	0	0	120.1
261	R	34.3	Very low	34.8	Very low	246 Å²	246	147.4 Å²	147.4	93%	0.928	80%	0.795	S	S	*	*	S	Bend	trans	-128.3	1.7	166.1	-73	-167.8	178.9	-171.2	0.8	118.8
262	S	34	Very low	35.2	Very low	126 Å²	126	149.1 Å²	149.1	88%	0.881	80%	0.8	S	S	*	*	S	Bend	trans	-112.6	7.7	179.7	53.5	0	0	0	0	116
263	R	36.1	Very low	35.4	Very low	243 Å²	243	152.7 Å²	152.7	92%	0.917	81%	0.81	S	S	*	*	S	Bend	trans	-96.9	1.9	174.9	-109.9	-178.4	-166.6	-178.3	4.2	115.7
264	A	36.2	Very low	35.6	Very low	91 Å²	91	148.9 Å²	148.9	75%	0.752	80%	0.803	S	S	*	*	S	Bend	trans	-106.1	6	-171.6	0	0	0	0	0	116.4
265	L	36.7	Very low	35.9	Very low	173 Å²	173	153.9 Å²	153.9	91%	0.906	81%	0.814	S	S	*	*	S	Bend	trans	-115.9	20.9	179.6	-84.2	161.2	0	0	0	114.1
266	R	37.2	Very low	36.1	Very low	251 Å²	251	151 Å²	151	95%	0.947	81%	0.812	S	S	*	*			trans	-98.3	20.3	178.5	-124.1	-176.5	-157.3	174.8	5.8	114.6
267	A	38.2	Very low	36	Very low	80 Å²	80	153.7 Å²	153.7	66%	0.661	81%	0.812	S	S	*	*	S	Bend	trans	-128.9	131.1	175.4	0	0	0	0	0	108.8
268	R	35.8	Very low	36.1	Very low	237 Å²	237	149.9 Å²	149.9	89%	0.894	81%	0.813	S	S	*	*			trans	90.8	79.7	176.4	-54	176	162.1	-176.5	-6.3	115.1
269	L	38.2	Very low	35.8	Very low	172 Å²	172	147.4 Å²	147.4	90%	0.901	81%	0.81	S	S	*	*				-159.7	102.4	128.1	-97.4	162.6	0	0	0	107.6
270	P	36.7	Very low	35.7	Very low	128 Å²	128	156.5 Å²	156.5	83%	0.831	84%	0.836	S	S	*	*			trans	-80.8	139.9	172.3	32.1	-28	0	0	0	109.4
271	G	36.1	Very low	36.1	Very low	74 Å²	74	155 Å²	155	76%	0.763	84%	0.836	S	S	*	*			trans	130.1	16.4	154	0	0	0	0	0	120.5
272	V	39.3	Very low	36.3	Very low	148 Å²	148	151.1 Å²	151.1	90%	0.897	83%	0.833	S	S	*	*			trans	-121.3	92.5	172.3	-168.3	0	0	0	0	111.4
273	K	36.3	Very low	36.4	Very low	212 Å²	212	148.5 Å²	148.5	92%	0.922	83%	0.827	S	S	*	*			trans	-95	111.8	166.1	-123.1	-177.5	-178.6	179.8	0	107
274	A	37.3	Very low	36.8	Very low	83 Å²	83	142.4 Å²	142.4	69%	0.686	82%	0.821	S	S	*	*			trans	-168.8	95.1	160.7	0	0	0	0	0	107.1
275	I	37.6	Very low	37	Very low	160 Å²	160	147.9 Å²	147.9	82%	0.821	83%	0.828	S	S	*	*				64.8	101.4	93.5	-58.6	167.2	0	0	0	113
276	A	36.8	Very low	37.1	Very low	93 Å²	93	145 Å²	145	77%	0.769	82%	0.82	S	S	*	*			trans	-176.9	96.3	142.9	0	0	0	0	0	105.5
277	Q	33.6	Very low	37.3	Very low	169 Å²	169	141.5 Å²	141.5	79%	0.79	81%	0.814	S	S	*	*				34.1	124.3	79	-77.4	-172.1	-19.7	0	0	110.9
278	T	35.2	Very low	37.5	Very low	138 Å²	138	149.4 Å²	149.4	85%	0.847	83%	0.827	S	S	*	*			cis	-180	153.8	25.2	10.8	0	0	0	0	106.1
279	G	32.2	Very low	38	Very low	71 Å²	71	149.6 Å²	149.6	73%	0.732	83%	0.828	S	S	*	*			trans	148.3	87	163.1	0	0	0	0	0	114.6
280	R	31	Very low	38.5	Very low	250 Å²	250	147.4 Å²	147.4	94%	0.943	82%	0.823	S	S	*	*				77.8	108.1	104.5	-108.2	-176.1	176.3	179.9	-0.5	115.8
281	S	39.5	Very low	39.1	Very low	109 Å²	109	146 Å²	146	76%	0.762	82%	0.822	S	S	*	*				172.9	124.7	101.3	54.9	0	0	0	0	113.2
282	N	38.8	Very low	39.6	Very low	165 Å²	165	151.1 Å²	151.1	88%	0.882	82%	0.824	S	S	*	*			trans	26.8	124.5	142	-57.4	-11.5	0	0	0	120.6
283	G	36.2	Very low	40.1	Very low	72 Å²	72	154.3 Å²	154.3	74%	0.742	83%	0.826	S	S	*	*			trans	162.1	69.3	157.4	0	0	0	0	0	116.9
284	S	42.8	Very low	40.7	Very low	114 Å²	114	152.7 Å²	152.7	80%	0.797	82%	0.822	S	S	*	*			trans	34	113.7	145.9	58	0	0	0	0	121.8
285	K	41.5	Very low	41.6	Very low	206 Å²	206	152.9 Å²	152.9	90%	0.896	82%	0.824	S	S	*	*			trans	81.8	147.1	132.1	-73.9	-171.9	-179.8	179.4	0	121.3
286	P	39	Very low	42.2	Very low	112 Å²	112	156.9 Å²	156.9	73%	0.727	85%	0.847	S	S	*	*			trans	-113.5	-175.3	-154.7	35.6	-17.2	0	0	0	112.9
287	Q	41.4	Very low	42.5	Very low	179 Å²	179	160.1 Å²	160.1	84%	0.836	85%	0.851	S	S	*	*			trans	89.5	108.5	149.3	-148.4	175.3	19.1	0	0	117
288	R	42.5	Very low	43	Very low	245 Å²	245	159.6 Å²	159.6	93%	0.925	85%	0.854	S	S	*	*			trans	-176.7	108.6	130.9	-100.4	171.1	-175.8	-139.8	1.5	110.9
289	R	46.3	Very low	43.4	Very low	242 Å²	242	160.8 Å²	160.8	91%	0.913	85%	0.854	S	S	*	*			trans	-88.3	149.6	141.9	-83.8	-173	176.7	-172.7	-0.2	106.3
290	P	47.3	Very low	44.1	Very low	125 Å²	125	166.1 Å²	166.1	81%	0.812	86%	0.861	S	S	*	*				-140.9	174.7	80.3	25.2	-0.5	0	0	0	110.7
291	A	49.6	Very low	44.9	Very low	98 Å²	98	160.9 Å²	160.9	81%	0.81	86%	0.856	S	S	*	*				-163.7	157.7	51.9	0	0	0	0	0	112.1
292	K	47.2	Very low	45.2	Very low	182 Å²	182	164.3 Å²	164.3	79%	0.791	86%	0.863	S	S	*	*			trans	-60.5	146.9	173.7	-67.5	169.2	168.1	-178.6	0	111.8
293	F	49.9	Very low	45.7	Very low	216 Å²	216	164.3 Å²	164.3	95%	0.947	86%	0.861	S	S	*	*			trans	-129.6	117.4	142.3	-118.4	-93.2	0	0	0	106.5
294	Q	49	Very low	46.4	Very low	177 Å²	177	171.4 Å²	171.4	83%	0.827	87%	0.87	S	S	*	*			trans	-134	119	173	-164	171.1	13.8	0	0	103.6
295	A	55.3	Low	46.7	Very low	88 Å²	88	176.2 Å²	176.2	73%	0.727	88%	0.876	S	S	*	*			trans	-143.8	143.8	163.9	0	0	0	0	0	105.4
296	D	52	Low	47.2	Very low	244 Å²	244	173.5 Å²	173.5	100%	1.305	88%	0.875	S	S	*	*			trans	-46.9	0	-165.3	-60	-61.3	0	0	0	117.1

Retrieved 296 of 296 residues in 99 ms (Link to these results)

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