A0A077YY17_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YY17, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 170 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	27.7	Very low	32.9	Very low	229 Å²	229	146.6 Å²	146.6	100%	1.128	88%	0.875	S	S	*	*				0	82.2	0	-164.5	173.3	-175	0	0	107.8
2	W	34.4	Very low	32.9	Very low	269 Å²	269	154.4 Å²	154.4	100%	1.019	88%	0.878	S	S	*	*			trans	-119.2	115.2	175.7	-94.6	34.2	0	0	0	108.5
3	S	32.2	Very low	32.6	Very low	113 Å²	113	148.2 Å²	148.2	79%	0.79	87%	0.869	S	S	*	*			trans	-104.9	135.2	-177.9	-53.2	0	0	0	0	108.7
4	G	31.6	Very low	32.2	Very low	82 Å²	82	142.9 Å²	142.9	85%	0.845	86%	0.861	S	S	*	*			trans	72	100	151.8	0	0	0	0	0	118.4
5	A	41.9	Very low	32	Very low	97 Å²	97	142.3 Å²	142.3	80%	0.802	86%	0.858	S	S	*	*			trans	-137.6	115.9	150.4	0	0	0	0	0	109.7
6	V	33.1	Very low	31.8	Very low	141 Å²	141	144.7 Å²	144.7	86%	0.855	86%	0.857	S	S	*	*			trans	-72	138.5	-173.6	173.9	0	0	0	0	110.9
7	W	30.8	Very low	31.9	Very low	246 Å²	246	150.4 Å²	150.4	93%	0.932	86%	0.86	S	S	*	*			trans	-81.5	122.7	176.9	-78	35.5	0	0	0	111.4
8	C	33.5	Very low	31.6	Very low	126 Å²	126	149.7 Å²	149.7	85%	0.851	86%	0.864	S	S	*	*			trans	-135.6	103.2	158.7	-89.7	0	0	0	0	110.1
9	G	33.1	Very low	31.5	Very low	84 Å²	84	145.6 Å²	145.6	87%	0.866	86%	0.858	S	S	*	*			trans	31.8	90	150.5	0	0	0	0	0	119.5
10	A	32.2	Very low	31.3	Very low	76 Å²	76	145.9 Å²	145.9	63%	0.628	86%	0.861	S	S	*	*			trans	-77.8	134.8	160.4	0	0	0	0	0	111.2
11	V	31.4	Very low	31.2	Very low	150 Å²	150	147 Å²	147	91%	0.909	86%	0.858	S	S	*	*			trans	-145.9	103.6	141.5	-172.2	0	0	0	0	108.2
12	W	32.4	Very low	31.2	Very low	240 Å²	240	146.8 Å²	146.8	91%	0.909	84%	0.844	S	S	*	*			trans	-83.2	142.8	177.2	-71.7	68.4	0	0	0	110.1
13	G	29.1	Very low	30.7	Very low	74 Å²	74	140.3 Å²	140.3	76%	0.763	84%	0.839	S	S	*	*			trans	-76.8	170.5	176.7	0	0	0	0	0	114.3
14	G	27.5	Very low	30.4	Very low	74 Å²	74	138.4 Å²	138.4	76%	0.763	84%	0.837	S	S	*	*			trans	82.4	146.8	155.9	0	0	0	0	0	117.6
15	V	29.6	Very low	30.1	Very low	134 Å²	134	140.7 Å²	140.7	81%	0.812	83%	0.834	S	S	*	*			trans	96.7	98.9	158.8	-166.8	0	0	0	0	117.3
16	E	28.8	Very low	29.3	Very low	180 Å²	180	142 Å²	142	84%	0.841	83%	0.832	S	S	*	*			trans	-17	125.9	144.8	-59.4	174.7	145.1	0	0	115.7
17	R	33.6	Very low	29	Very low	241 Å²	241	147 Å²	147	91%	0.909	84%	0.835	S	S	*	*			trans	-143.7	100.7	148.6	-73.7	-163.3	176	-179.4	-1.5	110
18	C	26.3	Very low	28.8	Very low	138 Å²	138	140.3 Å²	140.3	93%	0.932	83%	0.826	S	S	*	*			trans	-54.1	136.5	158.5	-62.9	0	0	0	0	109.9
19	G	28.5	Very low	28.4	Very low	72 Å²	72	138.1 Å²	138.1	74%	0.742	83%	0.825	S	S	*	*			trans	169.7	70.6	176.4	0	0	0	0	0	113.2
20	V	29.2	Very low	28.2	Very low	152 Å²	152	137.7 Å²	137.7	92%	0.921	81%	0.813	S	S	*	*			trans	-128.2	83.6	160.7	-177.7	0	0	0	0	107.5
21	E	27.8	Very low	27.9	Very low	170 Å²	170	141 Å²	141	79%	0.794	83%	0.825	S	S	*	*			trans	-103	150.6	157.5	-74.4	-160.3	153.5	0	0	109.3
22	R	29.3	Very low	27.9	Very low	224 Å²	224	145.2 Å²	145.2	85%	0.845	83%	0.825	S	S	*	*			trans	98.9	83.3	163.3	-55	-172.2	178	-170.1	-2.4	117.7
23	C	23.8	Very low	27.5	Very low	133 Å²	133	137 Å²	137	90%	0.899	82%	0.816	S	S	*	*				45.2	122.7	114.6	-58.9	0	0	0	0	120.6
24	G	24	Very low	27.4	Very low	73 Å²	73	137.2 Å²	137.2	75%	0.753	82%	0.817	S	S	*	*				94.9	102.7	126.7	0	0	0	0	0	117.7
25	V	26.8	Very low	27.5	Very low	130 Å²	130	138.7 Å²	138.7	79%	0.788	81%	0.811	S	S	*	*			trans	-141.9	114	151.8	-174.8	0	0	0	0	110.1
26	V	24.7	Very low	27.3	Very low	125 Å²	125	139.7 Å²	139.7	76%	0.758	81%	0.807	S	S	*	*			trans	-73.9	132.2	169.4	172.7	0	0	0	0	108.8	S28	V26-S28 PolarHBondContact O-N 3.01Å
27	W	27.3	Very low	27.5	Very low	245 Å²	245	140.9 Å²	140.9	93%	0.928	80%	0.804	S	S	*	*			trans	-93.3	96.7	173.1	-78.8	61.7	0	0	0	110.2
28	S	25.6	Very low	27.2	Very low	106 Å²	106	139.8 Å²	139.8	74%	0.741	80%	0.8	S	S	*	*			trans	-97.8	126.3	166.7	-68.1	0	0	0	0	109.7	V26	V26-S28 PolarHBondContact O-N 3.01Å
29	G	26.4	Very low	27.3	Very low	80 Å²	80	136.6 Å²	136.6	83%	0.825	79%	0.791	S	S	*	*			trans	70.5	102.3	151.8	0	0	0	0	0	118.4
30	A	28.6	Very low	27.3	Very low	74 Å²	74	137.3 Å²	137.3	61%	0.612	78%	0.78	S	S	*	*			trans	-147.2	100.4	148	0	0	0	0	0	109.7
31	V	25.4	Very low	27.2	Very low	147 Å²	147	133.2 Å²	133.2	89%	0.891	77%	0.769	S	S	*	*			trans	-76.2	117	169.6	176.2	0	0	0	0	107
32	W	30.6	Very low	27.4	Very low	237 Å²	237	135.2 Å²	135.2	90%	0.898	77%	0.769	S	S	*	*			trans	-112.1	99	170.2	-71.7	80.8	0	0	0	108.1
33	G	25.5	Very low	27.3	Very low	69 Å²	69	136.6 Å²	136.6	71%	0.711	77%	0.774	S	S	*	*			trans	-87.3	143.4	168.1	0	0	0	0	0	110.7
34	G	26.2	Very low	27.5	Very low	77 Å²	77	133.6 Å²	133.6	79%	0.794	77%	0.766	S	S	*	*			trans	71.8	81.2	155.9	0	0	0	0	0	117.4
35	V	28.9	Very low	27.8	Very low	105 Å²	105	134.5 Å²	134.5	64%	0.636	76%	0.757	S	S	*	*			trans	-142.6	118.2	148.2	-172.7	0	0	0	0	109.6	W37	V35-W37 HydrophobicContact CG1-CZ2 4.41Å; V35-W37 PolarHBondContact O-N 3.49Å
36	E	26.5	Very low	27.6	Very low	156 Å²	156	131.3 Å²	131.3	73%	0.729	75%	0.751	S	S	*	*			trans	-72.6	109.6	174.4	-168.2	-176.5	176.3	0	0	109.6	R38	E36-R38 HydrophobicContact CG-CG 4.4Å; E36-R38 PolarHBondContact O-N 3.04Å; E36-R38 WeakPolarHBondContact OE1-CD 3.45Å; E36-R38 IonicContact OE1-NE 3.24Å; E36-R38 PolarHBondContact OE1-NE 2.73Å
37	W	33.1	Very low	27.7	Very low	204 Å²	204	132.7 Å²	132.7	77%	0.773	74%	0.742	S	S	*	*			trans	-92.6	65	179.8	-66.5	94.5	0	0	0	111.6	V35 V40	V35-W37 HydrophobicContact CG1-CZ2 4.41Å; V35-W37 PolarHBondContact O-N 3.49Å; W37-V40 HydrophobicContact CE3-CG2 3.51Å; W37-V40 HydrophobicContact CZ3-CG2 3.82Å
38	R	26.4	Very low	27.7	Very low	218 Å²	218	132.4 Å²	132.4	82%	0.823	74%	0.741	S	S	*	*			trans	-86.9	95.8	160.3	-73.9	-178.8	-178.8	-108.9	-1.2	108.1	E36	E36-R38 HydrophobicContact CG-CG 4.4Å; E36-R38 PolarHBondContact O-N 3.04Å; E36-R38 WeakPolarHBondContact OE1-CD 3.45Å; E36-R38 IonicContact OE1-NE 3.24Å; E36-R38 PolarHBondContact OE1-NE 2.73Å
39	G	28.4	Very low	27.9	Very low	72 Å²	72	133.6 Å²	133.6	74%	0.742	74%	0.743	S	S	*	*			trans	141.6	11.2	163.3	0	0	0	0	0	120.3	G41	G39-G41 PolarHBondContact O-N 3.49Å
40	V	29.8	Very low	28.1	Very low	87 Å²	87	134.5 Å²	134.5	53%	0.527	74%	0.743	S	S	.	*			trans	-86.3	82.9	175.6	-168.6	0	0	0	0	110.2	W37 W42	W37-V40 HydrophobicContact CE3-CG2 3.51Å; W37-V40 HydrophobicContact CZ3-CG2 3.82Å; V40-W42 VanDerWaalsContact O-CD1 3.3Å; V40-W42 PolarHBondContact O-N 3.35Å
41	G	25.8	Very low	28	Very low	66 Å²	66	142.1 Å²	142.1	68%	0.68	76%	0.756	S	S	*	*			trans	-63.2	113.8	167.8	0	0	0	0	0	110.5	G39 R43	G39-G41 PolarHBondContact O-N 3.49Å; G41-R43 PolarHBondContact O-N 3.42Å
42	W	32	Very low	28	Very low	212 Å²	212	142 Å²	142	80%	0.803	76%	0.76	S	S	*	*			trans	-72.4	60.7	175	-64.2	82.2	0	0	0	111.4	V40 V45	V40-W42 VanDerWaalsContact O-CD1 3.3Å; V40-W42 PolarHBondContact O-N 3.35Å; W42-V45 HydrophobicContact CE3-CG2 3.65Å; W42-V45 HydrophobicContact CZ3-CG2 3.9Å
43	R	27.8	Very low	27.9	Very low	252 Å²	252	133.5 Å²	133.5	95%	0.951	75%	0.746	S	S	*	*			trans	-101.8	7.8	171.1	-80.7	-170.6	-173.7	-97.7	1.8	113.6	G41	G41-R43 PolarHBondContact O-N 3.42Å
44	G	27.3	Very low	28	Very low	70 Å²	70	137.2 Å²	137.2	72%	0.722	76%	0.755	S	S	*	*			trans	-119.5	-6.1	-173.1	0	0	0	0	0	117.5	G46	G44-G46 PolarHBondContact O-N 3.41Å
45	V	30.1	Very low	28.1	Very low	92 Å²	92	137.6 Å²	137.6	56%	0.558	75%	0.751	S	S	*	*			trans	-85.8	69	-179	-166.1	0	0	0	0	109.8	W42 W47	W42-V45 HydrophobicContact CE3-CG2 3.65Å; W42-V45 HydrophobicContact CZ3-CG2 3.9Å; V45-W47 PolarHBondContact O-N 3.32Å
46	G	24.3	Very low	28	Very low	64 Å²	64	144.3 Å²	144.3	66%	0.66	76%	0.764	S	S	*	*			trans	-69.7	106.9	169	0	0	0	0	0	109.5	G44 R48	G44-G46 PolarHBondContact O-N 3.41Å; G46-R48 VanDerWaalsContact C-N 3.26Å; G46-R48 PolarHBondContact O-N 2.9Å
47	W	26.6	Very low	28.2	Very low	154 Å²	154	143.3 Å²	143.3	58%	0.583	77%	0.773	S	S	*	*			trans	-61.7	84.7	167.6	-62.2	86.5	0	0	0	109.3	V45 V49 W132	V45-W47 PolarHBondContact O-N 3.32Å; W47-V49 PolarHBondContact O-N 3.07Å; W47-W132 HydrophobicContact CD2-CZ3 4.35Å; W47-W132 AromaticContact CE3-CZ3 3.89Å; W47-W132 HydrophobicContact CE3-CZ3 3.89Å; W47-W132 AromaticContact CH2-CH2 3.62Å; W47-W132 HydrophobicContact CH2-CH2 3.62Å; W47-W132 AromaticContact CH2-CZ3 3.58Å; W47-W132 HydrophobicContact CH2-CZ3 3.58Å; W47-W132 HydrophobicContact CZ2-CH2 4.04Å; W47-W132 HydrophobicContact CZ2-CZ3 4.05Å; W47-W132 HydrophobicContact CZ3-CH2 4.01Å; W47-W132 AromaticContact CZ3-CZ3 3.49Å; W47-W132 HydrophobicContact CZ3-CZ3 3.49Å; W47-W132 VanDerWaalsContact CZ3-CZ3 3.49Å
48	R	27.5	Very low	28	Very low	239 Å²	239	136.9 Å²	136.9	90%	0.902	77%	0.77	S	S	*	*			trans	-77.7	102.5	165.9	-75.4	-169.3	-153.6	-104.3	0.7	107.5	G46 A50	G46-R48 VanDerWaalsContact C-N 3.26Å; G46-R48 PolarHBondContact O-N 2.9Å; R48-A50 VanDerWaalsContact C-N 3.33Å; R48-A50 PolarHBondContact O-N 3.15Å
49	V	29	Very low	27.9	Very low	131 Å²	131	138.9 Å²	138.9	79%	0.794	78%	0.778	S	S	*	*			trans	-50	102.7	157	-176.9	0	0	0	0	106.4	W47 R51	W47-V49 PolarHBondContact O-N 3.07Å; V49-R51 PolarHBondContact O-N 2.73Å
50	A	29.8	Very low	27.8	Very low	98 Å²	98	138.9 Å²	138.9	81%	0.81	78%	0.778	S	S	*	*			trans	-71.4	84.1	173.3	0	0	0	0	0	107.3	R48 C52	R48-A50 VanDerWaalsContact C-N 3.33Å; R48-A50 PolarHBondContact O-N 3.15Å; A50-C52 PolarHBondContact O-N 2.93Å; A50-C52 VanDerWaalsContact O-N 3.11Å
51	R	26.4	Very low	27.8	Very low	234 Å²	234	140 Å²	140	88%	0.883	78%	0.784	S	S	*	*			trans	-60.4	110.9	164.8	-133.7	-177.4	-157.1	179	5.7	105.7	V49 G53	V49-R51 PolarHBondContact O-N 2.73Å; R51-G53 PolarHBondContact O-N 2.85Å
52	C	27.1	Very low	27.8	Very low	144 Å²	144	143.1 Å²	143.1	97%	0.973	79%	0.79	S	S	*	*			trans	-72.2	85	172.9	-133.7	0	0	0	0	107.7	A50	A50-C52 PolarHBondContact O-N 2.93Å; A50-C52 VanDerWaalsContact O-N 3.11Å
53	G	28.4	Very low	27.6	Very low	60 Å²	60	142.4 Å²	142.4	62%	0.619	79%	0.787	S	S	*	*			trans	-115.7	119.5	164.7	0	0	0	0	0	107.2	R51	R51-G53 PolarHBondContact O-N 2.85Å
54	V	27.3	Very low	27.5	Very low	147 Å²	147	142.2 Å²	142.2	89%	0.891	79%	0.786	S	S	*	*	S	Bend	trans	1.8	132.4	162.2	-167.6	0	0	0	0	117.1
55	A	27.6	Very low	27.7	Very low	85 Å²	85	142.7 Å²	142.7	70%	0.702	79%	0.792	S	S	*	*	S	Bend	trans	93.3	112	160.7	0	0	0	0	0	118.6
56	R	27.9	Very low	27.6	Very low	246 Å²	246	143.3 Å²	143.3	93%	0.928	80%	0.796	S	S	*	*			trans	43.5	101.2	143.2	-64.6	-179.7	-178.7	158.8	0.1	117.7
57	C	30.5	Very low	27.7	Very low	135 Å²	135	143.1 Å²	143.1	91%	0.912	79%	0.793	S	S	*	*			trans	-155.5	119.6	145	-83.4	0	0	0	0	105.3
58	G	27.4	Very low	27.8	Very low	69 Å²	69	147.9 Å²	147.9	71%	0.711	81%	0.811	S	S	*	*			cis	92.1	91.2	28.4	0	0	0	0	0	109.6
59	R	25.6	Very low	28.1	Very low	260 Å²	260	142 Å²	142	98%	0.981	80%	0.801	S	S	*	*			trans	53.1	111.7	163.7	-65.2	178.9	-128.7	-129.4	-0.4	118
60	G	25.3	Very low	28.1	Very low	72 Å²	72	138.4 Å²	138.4	74%	0.742	79%	0.791	S	S	*	*			trans	168.2	107.3	160.2	0	0	0	0	0	114.5
61	V	29.3	Very low	28	Very low	110 Å²	110	145.5 Å²	145.5	67%	0.667	80%	0.797	S	S	*	*			trans	63.5	110.6	160.9	-145.6	0	0	0	0	117.8	W63	V61-W63 HydrophobicContact CG1-CZ2 3.92Å; V61-W63 VanDerWaalsContact CG1-NE1 3.29Å
62	V	26.9	Very low	28	Very low	132 Å²	132	140.6 Å²	140.6	80%	0.8	80%	0.798	S	S	*	*			trans	-87	113.9	173.6	179.9	0	0	0	0	109.2
63	W	27	Very low	28	Very low	197 Å²	197	135.4 Å²	135.4	75%	0.746	77%	0.768	S	S	*	*			trans	-105.8	113.7	171.2	-62.1	91.1	0	0	0	109.2	V61	V61-W63 HydrophobicContact CG1-CZ2 3.92Å; V61-W63 VanDerWaalsContact CG1-NE1 3.29Å
64	R	25.3	Very low	28.2	Very low	247 Å²	247	137.2 Å²	137.2	93%	0.932	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	121.5	176.4	-67.6	-175.2	-153.9	-108.8	2	109
65	G	31.5	Very low	28.4	Very low	81 Å²	81	134 Å²	134	84%	0.835	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	137	-6	179.5	0	0	0	0	0	114.5
66	V	29.6	Very low	28.7	Very low	105 Å²	105	132.4 Å²	132.4	64%	0.636	73%	0.73	S	S	*	*			trans	-98.2	102.6	-174.1	-171	0	0	0	0	110.2
67	G	26.8	Very low	28.8	Very low	59 Å²	59	124.8 Å²	124.8	61%	0.608	72%	0.72	S	S	*	*			trans	-68.9	132.8	164.9	0	0	0	0	0	110.2	V69	G67-V69 PolarHBondContact O-N 3.43Å
68	R	28.6	Very low	28.9	Very low	254 Å²	254	126.8 Å²	126.8	96%	0.958	71%	0.708	S	S	*	*			trans	-60	117.5	172.8	-74	-179.6	-178.3	179.7	0.9	109.1
69	V	33.2	Very low	29.3	Very low	115 Å²	115	127.5 Å²	127.5	70%	0.697	71%	0.708	S	S	*	*			trans	-113.1	128.2	161.6	-173.9	0	0	0	0	107.9	G67	G67-V69 PolarHBondContact O-N 3.43Å
70	G	29.2	Very low	29.7	Very low	57 Å²	57	117.1 Å²	117.1	59%	0.588	68%	0.677	S	S	*	*			trans	-62.6	156.3	-167.7	0	0	0	0	0	113.9
71	R	26.9	Very low	30.3	Very low	246 Å²	246	120.5 Å²	120.5	93%	0.928	67%	0.674	S	S	*	*	S	Bend	trans	14.6	107.9	161.4	-67.5	175.3	-155.6	-157.2	4.8	115
72	C	25.8	Very low	30.5	Very low	132 Å²	132	117.9 Å²	117.9	89%	0.892	66%	0.656	S	S	*	*	S	Bend	trans	69.7	59.6	173.7	-53.1	0	0	0	0	114.4
73	G	28.7	Very low	30.7	Very low	34 Å²	34	121.7 Å²	121.7	35%	0.351	66%	0.656	S	S	.	*			trans	-148.2	113.6	175.6	0	0	0	0	0	111.6	S75	G73-S75 PolarHBondContact O-N 2Å; G73-S75 VanDerWaalsContact O-N 3.08Å; G73-S75 PolarHBondContact O-OG 3.3Å
74	V	31.3	Very low	30.8	Very low	99 Å²	99	114 Å²	114	60%	0.6	63%	0.63	S	S	*	*			trans	-63.3	107.9	175.9	176.8	0	0	0	0	108.6	I76 L129	V74-I76 HydrophobicContact CG1-CD1 3.53Å; V74-I76 HydrophobicContact CG1-CG1 3.8Å; V74-I76 PolarHBondContact O-N 3.25Å; V74-L129 HydrophobicContact CB-CD1 4.41Å; V74-L129 HydrophobicContact CG1-CD1 4.43Å
75	S	31.7	Very low	31.2	Very low	79 Å²	79	108.2 Å²	108.2	55%	0.552	63%	0.628	S	S	*	*			trans	-84.3	95.3	-176.3	-22.5	0	0	0	0	109.9	G73	G73-S75 PolarHBondContact O-N 2Å; G73-S75 VanDerWaalsContact O-N 3.08Å; G73-S75 PolarHBondContact O-OG 3.3Å
76	I	34.9	Very low	31.2	Very low	52 Å²	52	108.8 Å²	108.8	27%	0.267	62%	0.615	S	S	.	*			trans	-135.4	85.6	178.2	-63	178	0	0	0	108.8	V74 W78 I94 L109	V74-I76 HydrophobicContact CG1-CD1 3.53Å; V74-I76 HydrophobicContact CG1-CG1 3.8Å; V74-I76 PolarHBondContact O-N 3.25Å; I76-W78 HydrophobicContact CG2-CG 4.48Å; I76-I94 HydrophobicContact CG2-CG2 4.47Å; I76-L109 HydrophobicContact CG2-CD1 4.22Å
77	A	30.5	Very low	31.6	Very low	86 Å²	86	109.8 Å²	109.8	71%	0.711	63%	0.627	S	S	*	*			trans	-107.5	108.3	159.8	0	0	0	0	0	107.3
78	W	32.6	Very low	32.4	Very low	176 Å²	176	108.2 Å²	108.2	67%	0.667	61%	0.61	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-123.1	124.4	175.2	-65	74.1	0	0	0	108.4	I76 I94	I76-W78 HydrophobicContact CG2-CG 4.48Å; W78-I94 HydrophobicContact CB-CD1 4.35Å; W78-I94 PolarHBondContact O-N 2.98Å; W78-I94 VanDerWaalsContact O-N 3.13Å
79	A	33.9	Very low	33.3	Very low	85 Å²	85	99.5 Å²	99.5	70%	0.702	59%	0.588	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.9	104.2	163.2	0	0	0	0	0	106.8
80	A	35.6	Very low	34.1	Very low	42 Å²	42	94.5 Å²	94.5	35%	0.347	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.9	108.9	171.1	0	0	0	0	0	107.7	L82 I92	A80-L82 HydrophobicContact CB-CD1 4.19Å; A80-L82 HydrophobicContact CB-CG 4.39Å; A80-I92 PolarHBondContact N-O 3.48Å; A80-I92 PolarHBondContact O-N 3.04Å
81	H	37.1	Very low	35.1	Very low	143 Å²	143	93 Å²	93	66%	0.662	54%	0.538	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	108.5	161.5	-89.1	-75.4	0	0	0	107.5
82	L	33.6	Very low	36.6	Very low	55 Å²	55	81.9 Å²	81.9	29%	0.288	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	123.3	175.2	-72.3	152	0	0	0	106.8	A80 F90 I92 L168	A80-L82 HydrophobicContact CB-CD1 4.19Å; A80-L82 HydrophobicContact CB-CG 4.39Å; L82-F90 HydrophobicContact CB-CD1 4.11Å; L82-F90 HydrophobicContact CB-CD2 3.84Å; L82-F90 HydrophobicContact CB-CE1 3.44Å; L82-F90 VanDerWaalsContact CB-CE1 3.44Å; L82-F90 HydrophobicContact CB-CE2 3.18Å; L82-F90 HydrophobicContact CB-CG 4.29Å; L82-F90 HydrophobicContact CB-CZ 2.98Å; L82-F90 HydrophobicContact CD1-CD2 4.24Å; L82-F90 HydrophobicContact CD1-CE2 3.21Å; L82-F90 HydrophobicContact CD1-CZ 3.57Å; L82-F90 HydrophobicContact CD2-CZ 4.48Å; L82-F90 HydrophobicContact CG-CE2 3.79Å; L82-F90 HydrophobicContact CG-CZ 3.8Å; L82-F90 PolarHBondContact N-O 2.91Å; L82-F90 WeakPolarHBondContact O-CD1 3.15Å; L82-F90 WeakPolarHBondContact O-CE1 3.49Å; L82-F90 PolarHBondContact O-N 3.08Å; L82-F90 VanDerWaalsContact O-O 3.06Å; L82-I92 HydrophobicContact CD1-CD1 4.41Å; L82-L168 HydrophobicContact CD1-CD2 3.52Å; L82-L168 HydrophobicContact CD2-CD2 3.82Å; L82-L168 HydrophobicContact CG-CD2 4.29Å
83	R	30.6	Very low	38.1	Very low	212 Å²	212	77 Å²	77	80%	0.8	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	118.7	172	-72	-178.8	-131.7	-116.5	-0.2	106.8
84	T	30.3	Very low	39.5	Very low	35 Å²	35	77.2 Å²	77.2	22%	0.215	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	150.4	164.5	39.6	0	0	0	0	110.6	T86 G88 F90 Q170	T84-T86 PolarHBondContact O-N 3.04Å; T84-T86 VanDerWaalsContact O-N 3.12Å; T84-G88 PolarHBondContact OG1-O 2.87Å; T84-F90 HydrophobicContact CG2-CD1 4.24Å; T84-F90 HydrophobicContact CG2-CE1 3.57Å; T84-Q170 WeakPolarHBondContact CG2-O 3.46Å; T84-Q170 WeakPolarHBondContact CG2-OXT 3.23Å
85	S	33.6	Very low	40.6	Very low	126 Å²	126	76.2 Å²	76.2	88%	0.881	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-5.2	-177.5	56.8	0	0	0	0	113.4
86	T	31.9	Very low	41.7	Very low	93 Å²	93	74.2 Å²	74.2	57%	0.571	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.5	111.3	178.7	51.6	0	0	0	0	109.8	T84 G88	T84-T86 PolarHBondContact O-N 3.04Å; T84-T86 VanDerWaalsContact O-N 3.12Å; T86-G88 PolarHBondContact O-N 2.82Å
87	S	36	Very low	42.5	Very low	126 Å²	126	72 Å²	72	88%	0.881	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	36	156.9	57	0	0	0	0	120.5
88	G	44.4	Very low	43.3	Very low	25 Å²	25	71.6 Å²	71.6	26%	0.258	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	157.1	146.1	142.8	0	0	0	0	0	116.7	T84 T86 F90 P116	T84-G88 PolarHBondContact OG1-O 2.87Å; T86-G88 PolarHBondContact O-N 2.82Å; G88-F90 PolarHBondContact O-N 3.23Å; G88-P116 VanDerWaalsContact CA-CB 3.47Å
89	S	48.5	Very low	44.2	Very low	71 Å²	71	68.2 Å²	68.2	50%	0.497	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	120.3	176.6	54.6	0	0	0	0	110.9
90	F	49.2	Very low	44.7	Very low	10 Å²	10	68.6 Å²	68.6	4%	0.044	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	151.6	161.6	63.1	-83.4	0	0	0	109.6	L82 T84 G88 I92 N114 V167	L82-F90 HydrophobicContact CB-CD1 4.11Å; L82-F90 HydrophobicContact CB-CD2 3.84Å; L82-F90 HydrophobicContact CB-CE1 3.44Å; L82-F90 VanDerWaalsContact CB-CE1 3.44Å; L82-F90 HydrophobicContact CB-CE2 3.18Å; L82-F90 HydrophobicContact CB-CG 4.29Å; L82-F90 HydrophobicContact CB-CZ 2.98Å; L82-F90 HydrophobicContact CD1-CD2 4.24Å; L82-F90 HydrophobicContact CD1-CE2 3.21Å; L82-F90 HydrophobicContact CD1-CZ 3.57Å; L82-F90 HydrophobicContact CD2-CZ 4.48Å; L82-F90 HydrophobicContact CG-CE2 3.79Å; L82-F90 HydrophobicContact CG-CZ 3.8Å; L82-F90 PolarHBondContact N-O 2.91Å; L82-F90 WeakPolarHBondContact O-CD1 3.15Å; L82-F90 WeakPolarHBondContact O-CE1 3.49Å; L82-F90 PolarHBondContact O-N 3.08Å; L82-F90 VanDerWaalsContact O-O 3.06Å; T84-F90 HydrophobicContact CG2-CD1 4.24Å; T84-F90 HydrophobicContact CG2-CE1 3.57Å; G88-F90 PolarHBondContact O-N 3.23Å; F90-I92 HydrophobicContact CD2-CD1 4.42Å; F90-I92 HydrophobicContact CD2-CG1 4.25Å; F90-I92 HydrophobicContact CE2-CD1 4.27Å; F90-N114 VanDerWaalsContact CA-O 3.29Å; F90-N114 WeakPolarHBondContact CA-O 3.49Å; F90-N114 WeakPolarHBondContact CB-O 3.34Å; F90-V167 HydrophobicContact CD2-CG1 3.44Å; F90-V167 VanDerWaalsContact CD2-CG1 3.44Å; F90-V167 HydrophobicContact CE2-CG1 3.16Å; F90-V167 HydrophobicContact CG-CG1 4.2Å; F90-V167 HydrophobicContact CZ-CG1 3.77Å; F90-V167 WeakPolarHBondContact CZ-O 3.04Å
91	S	50.7	Low	45	Very low	27 Å²	27	68 Å²	68	19%	0.189	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	130.6	172.9	50.5	0	0	0	0	109.5	N114	S91-N114 PolarHBondContact N-O 3.2Å; S91-N114 PolarHBondContact O-N 2.87Å; S91-N114 WeakPolarHBondContact OG-CB 3.35Å; S91-N114 PolarHBondContact OG-ND2 3.45Å
92	I	57.9	Low	45.2	Very low	11 Å²	11	69.9 Å²	69.9	6%	0.056	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116	172.2	-56.1	176.9	0	0	0	106.5	A80 L82 F90 I94 I111 K112 L164 V167	A80-I92 PolarHBondContact N-O 3.48Å; A80-I92 PolarHBondContact O-N 3.04Å; L82-I92 HydrophobicContact CD1-CD1 4.41Å; F90-I92 HydrophobicContact CD2-CD1 4.42Å; F90-I92 HydrophobicContact CD2-CG1 4.25Å; F90-I92 HydrophobicContact CE2-CD1 4.27Å; I92-I94 HydrophobicContact CG2-CG1 4.21Å; I92-I111 HydrophobicContact CG2-CG2 3.9Å; I92-K112 WeakPolarHBondContact CA-O 3.46Å; I92-L164 HydrophobicContact CD1-CD2 3.74Å; I92-V167 HydrophobicContact CD1-CG1 4.24Å
93	A	56.3	Low	45.8	Very low	30 Å²	30	71 Å²	71	25%	0.248	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	121.3	173.2	0	0	0	0	0	108.9	I111 K112	A93-I111 WeakPolarHBondContact O-CA 2.9Å; A93-K112 HydrophobicContact CB-CB 4.43Å; A93-K112 PolarHBondContact N-O 2.96Å; A93-K112 PolarHBondContact O-N 2.86Å
94	I	58.7	Low	46.4	Very low	38 Å²	38	65.2 Å²	65.2	20%	0.195	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	120.5	173	-54.5	-177.7	0	0	0	107.6	I76 W78 I92 L109 L110 I111	I76-I94 HydrophobicContact CG2-CG2 4.47Å; W78-I94 HydrophobicContact CB-CD1 4.35Å; W78-I94 PolarHBondContact O-N 2.98Å; W78-I94 VanDerWaalsContact O-N 3.13Å; I92-I94 HydrophobicContact CG2-CG1 4.21Å; I94-L109 HydrophobicContact CG2-CB 4.21Å; I94-L109 HydrophobicContact CG2-CD1 4.07Å; I94-L109 HydrophobicContact CG2-CD2 4.04Å; I94-L109 HydrophobicContact CG2-CG 4.34Å; I94-L110 WeakPolarHBondContact CA-O 3.44Å; I94-I111 HydrophobicContact CG1-CG1 4.29Å; I94-I111 HydrophobicContact CG1-CG2 4.44Å
95	K	55.6	Low	47.3	Very low	79 Å²	79	66.7 Å²	66.7	34%	0.343	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	145.1	-178.3	-73.2	175.6	160.2	-109.7	0	110.8	E99 F100 L110	K95-E99 WeakPolarHBondContact CD-OE2 2.91Å; K95-E99 IonicContact NZ-OE2 2.75Å; K95-E99 PolarHBondContact NZ-OE2 3.32Å; K95-F100 HydrophobicContact CB-CD2 4.5Å; K95-F100 HydrophobicContact CB-CE2 3.83Å; K95-F100 HydrophobicContact CD-CE2 3.3Å; K95-F100 HydrophobicContact CD-CZ 3.49Å; K95-F100 VanDerWaalsContact CD-CZ 3.49Å; K95-F100 HydrophobicContact CG-CE2 4.22Å; K95-L110 PolarHBondContact N-O 3.25Å; K95-L110 PolarHBondContact O-N 2.93Å
96	P	52.9	Low	47.9	Very low	37 Å²	37	65.9 Å²	65.9	24%	0.24	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	142.9	170.8	30.7	-34.6	0	0	0	109.9	N98 E99	P96-N98 VanDerWaalsContact CB-OD1 3.24Å; P96-N98 WeakPolarHBondContact CB-OD1 3.36Å; P96-N98 VanDerWaalsContact CG-OD1 3.23Å; P96-N98 WeakPolarHBondContact CG-OD1 3.29Å; P96-N98 PolarHBondContact O-N 3.12Å; P96-E99 HydrophobicContact CG-CG 4.05Å; P96-E99 WeakPolarHBondContact O-CB 3.17Å; P96-E99 PolarHBondContact O-N 3.33Å; P96-E99 VanDerWaalsContact O-N 3.1Å
97	V	53.2	Low	48.8	Very low	5 Å²	5	63.3 Å²	63.3	3%	0.03	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-66.7	-23	-175.4	163.1	0	0	0	0	112.8	E99 F100 T101 A108 L110 Y126	V97-E99 PolarHBondContact O-N 3.43Å; V97-F100 PolarHBondContact O-N 2.85Å; V97-T101 HydrophobicContact CG1-CG2 4.27Å; V97-T101 WeakPolarHBondContact CG1-OG1 3.37Å; V97-T101 PolarHBondContact O-N 3.3Å; V97-T101 PolarHBondContact O-OG1 3.39Å; V97-A108 HydrophobicContact CB-CB 3.84Å; V97-A108 WeakPolarHBondContact CB-O 3.44Å; V97-A108 HydrophobicContact CG1-CB 4.31Å; V97-A108 VanDerWaalsContact CG2-C 3.44Å; V97-A108 HydrophobicContact CG2-CB 3.54Å; V97-A108 VanDerWaalsContact CG2-O 3.3Å; V97-A108 WeakPolarHBondContact CG2-O 3.17Å; V97-A108 PolarHBondContact N-O 2.88Å; V97-L110 HydrophobicContact CG2-CB 4.27Å; V97-Y126 HydrophobicContact CG1-CE2 4.24Å; V97-Y126 HydrophobicContact CG2-CD2 4.02Å; V97-Y126 HydrophobicContact CG2-CE2 3.76Å
98	N	47.8	Very low	49.6	Very low	78 Å²	78	57.4 Å²	57.4	42%	0.417	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-61.2	-18.4	172	65.7	11.2	0	0	0	113.6	P96 F100	P96-N98 VanDerWaalsContact CB-OD1 3.24Å; P96-N98 WeakPolarHBondContact CB-OD1 3.36Å; P96-N98 VanDerWaalsContact CG-OD1 3.23Å; P96-N98 WeakPolarHBondContact CG-OD1 3.29Å; P96-N98 PolarHBondContact O-N 3.12Å; N98-F100 VanDerWaalsContact C-N 3.34Å
99	E	50.2	Low	50.3	Low	105 Å²	105	57.2 Å²	57.2	49%	0.491	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-76.6	-18.4	173.5	-80.7	-177.2	-161.6	0	0	113.3	K95 P96 V97	K95-E99 WeakPolarHBondContact CD-OE2 2.91Å; K95-E99 IonicContact NZ-OE2 2.75Å; K95-E99 PolarHBondContact NZ-OE2 3.32Å; P96-E99 HydrophobicContact CG-CG 4.05Å; P96-E99 WeakPolarHBondContact O-CB 3.17Å; P96-E99 PolarHBondContact O-N 3.33Å; P96-E99 VanDerWaalsContact O-N 3.1Å; V97-E99 PolarHBondContact O-N 3.43Å
100	F	44.6	Very low	50.7	Low	92 Å²	92	54.2 Å²	54.2	40%	0.404	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.8	-10.5	-173.7	-68.2	-72.7	0	0	0	114.6	K95 V97 N98 L110	K95-F100 HydrophobicContact CB-CD2 4.5Å; K95-F100 HydrophobicContact CB-CE2 3.83Å; K95-F100 HydrophobicContact CD-CE2 3.3Å; K95-F100 HydrophobicContact CD-CZ 3.49Å; K95-F100 VanDerWaalsContact CD-CZ 3.49Å; K95-F100 HydrophobicContact CG-CE2 4.22Å; V97-F100 PolarHBondContact O-N 2.85Å; N98-F100 VanDerWaalsContact C-N 3.34Å; F100-L110 HydrophobicContact CD2-CD1 4.19Å; F100-L110 HydrophobicContact CE2-CD2 4.38Å
101	T	41.9	Very low	51.5	Low	30 Å²	30	54 Å²	54	18%	0.184	30%	0.303	C	S	.	.	S	Bend	trans	-137.4	146.3	-179.7	63.9	0	0	0	0	109.5	V97 I103	V97-T101 HydrophobicContact CG1-CG2 4.27Å; V97-T101 WeakPolarHBondContact CG1-OG1 3.37Å; V97-T101 PolarHBondContact O-N 3.3Å; V97-T101 PolarHBondContact O-OG1 3.39Å; T101-I103 PolarHBondContact O-N 3.16Å
102	N	41.5	Very low	52	Low	182 Å²	182	56 Å²	56	97%	0.973	31%	0.309	S	S	*	.	S	Bend	trans	-70.2	15.4	168.1	-81.1	-12.8	0	0	0	112.5
103	I	46	Very low	52.4	Low	79 Å²	79	55.5 Å²	55.5	41%	0.405	31%	0.307	S	S	.	.			trans	-92.1	118.5	179.6	-52.6	173.2	0	0	0	106.2	T101 D105	T101-I103 PolarHBondContact O-N 3.16Å; I103-D105 HydrophobicContact CG2-CB 3.95Å; I103-D105 WeakPolarHBondContact CG2-OD2 3.37Å; I103-D105 PolarHBondContact O-N 3.37Å
104	A	43.9	Very low	52.7	Low	90 Å²	90	56.2 Å²	56.2	74%	0.744	31%	0.306	S	S	*	.			trans	-74.4	48.8	175.1	0	0	0	0	0	111.4	D106	A104-D106 PolarHBondContact O-N 2.77Å
105	D	47.9	Very low	52.8	Low	67 Å²	67	56.9 Å²	56.9	36%	0.358	31%	0.307	S	S	.	.			trans	-91.6	84.2	175.7	-77.9	-13.9	0	0	0	108.7	I103 A107 A108	I103-D105 HydrophobicContact CG2-CB 3.95Å; I103-D105 WeakPolarHBondContact CG2-OD2 3.37Å; I103-D105 PolarHBondContact O-N 3.37Å; D105-A107 PolarHBondContact O-N 3.41Å; D105-A107 VanDerWaalsContact O-N 3.12Å; D105-A108 HydrophobicContact CB-CB 4.33Å; D105-A108 PolarHBondContact O-N 3.2Å
106	D	47.8	Very low	52.7	Low	108 Å²	108	56 Å²	56	58%	0.578	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-11.7	169.7	-67.4	-30.3	0	0	0	112.3	A104	A104-D106 PolarHBondContact O-N 2.77Å
107	A	50.7	Low	52.9	Low	39 Å²	39	56.8 Å²	56.8	32%	0.322	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	7	177.7	0	0	0	0	0	113	D105 N128 L129 A130	D105-A107 PolarHBondContact O-N 3.41Å; D105-A107 VanDerWaalsContact O-N 3.12Å; A107-N128 CarbonylContact O-C 3.49Å; A107-N128 WeakPolarHBondContact O-CA 3.46Å; A107-N128 PolarHBondContact O-OD1 2.87Å; A107-L129 WeakPolarHBondContact O-CA 3.13Å; A107-L129 WeakPolarHBondContact O-CB 3.47Å; A107-L129 PolarHBondContact O-N 2.95Å; A107-A130 HydrophobicContact CB-CB 4.34Å
108	A	51.9	Low	53.1	Low	2 Å²	2	69 Å²	69	2%	0.017	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	139.2	-178.7	0	0	0	0	0	114.1	V97 D105 Y126 A127	V97-A108 HydrophobicContact CB-CB 3.84Å; V97-A108 WeakPolarHBondContact CB-O 3.44Å; V97-A108 HydrophobicContact CG1-CB 4.31Å; V97-A108 VanDerWaalsContact CG2-C 3.44Å; V97-A108 HydrophobicContact CG2-CB 3.54Å; V97-A108 VanDerWaalsContact CG2-O 3.3Å; V97-A108 WeakPolarHBondContact CG2-O 3.17Å; V97-A108 PolarHBondContact N-O 2.88Å; D105-A108 HydrophobicContact CB-CB 4.33Å; D105-A108 PolarHBondContact O-N 3.2Å; A108-Y126 HydrophobicContact CB-CD2 4.47Å; A108-Y126 HydrophobicContact CB-CE1 4.36Å; A108-Y126 HydrophobicContact CB-CE2 3.51Å; A108-Y126 VanDerWaalsContact CB-CZ 3.44Å; A108-Y126 WeakPolarHBondContact CB-OH 3.17Å; A108-A127 WeakPolarHBondContact CA-O 3.16Å
109	L	58.3	Low	53.5	Low	21 Å²	21	73.1 Å²	73.1	11%	0.11	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.8	177.4	-67	174.9	0	0	0	110.1	I76 I94 A127 L129	I76-L109 HydrophobicContact CG2-CD1 4.22Å; I94-L109 HydrophobicContact CG2-CB 4.21Å; I94-L109 HydrophobicContact CG2-CD1 4.07Å; I94-L109 HydrophobicContact CG2-CD2 4.04Å; I94-L109 HydrophobicContact CG2-CG 4.34Å; L109-A127 PolarHBondContact N-O 2.78Å; L109-A127 PolarHBondContact O-N 2.96Å; L109-L129 HydrophobicContact CD1-CD1 4.15Å; L109-L129 HydrophobicContact CD1-CD2 3.92Å; L109-L129 HydrophobicContact CD1-CG 4.12Å; L109-L129 HydrophobicContact CG-CD1 3.96Å; L109-L129 HydrophobicContact CG-CG 4.18Å
110	L	58.6	Low	53.8	Low	8 Å²	8	71.6 Å²	71.6	4%	0.042	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	123.2	171.2	-163.7	144.5	0	0	0	108.8	I94 K95 V97 F100 K112 Y125	I94-L110 WeakPolarHBondContact CA-O 3.44Å; K95-L110 PolarHBondContact N-O 3.25Å; K95-L110 PolarHBondContact O-N 2.93Å; V97-L110 HydrophobicContact CG2-CB 4.27Å; F100-L110 HydrophobicContact CD2-CD1 4.19Å; F100-L110 HydrophobicContact CE2-CD2 4.38Å; L110-K112 HydrophobicContact CD2-CB 4.48Å; L110-Y125 WeakPolarHBondContact CA-O 3.43Å
111	I	64.2	Low	54.4	Low	5 Å²	5	71.5 Å²	71.5	3%	0.026	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	110.3	-179	-53.4	176.8	0	0	0	107.7	I92 A93 I94 V113 C124 Y125 A127 M155 L160	I92-I111 HydrophobicContact CG2-CG2 3.9Å; A93-I111 WeakPolarHBondContact O-CA 2.9Å; I94-I111 HydrophobicContact CG1-CG1 4.29Å; I94-I111 HydrophobicContact CG1-CG2 4.44Å; I111-V113 HydrophobicContact CG2-CG2 4.26Å; I111-C124 CarbonylContact O-C 3.39Å; I111-C124 WeakPolarHBondContact O-CA 3.21Å; I111-Y125 PolarHBondContact N-O 3.38Å; I111-Y125 PolarHBondContact O-N 2.88Å; I111-A127 HydrophobicContact CD1-CB 4.34Å; I111-M155 HydrophobicContact CD1-SD 4.23Å; I111-L160 HydrophobicContact CD1-CD1 3.47Å; I111-L160 VanDerWaalsContact CD1-CD1 3.47Å; I111-L160 HydrophobicContact CD1-CD2 4.15Å; I111-L160 HydrophobicContact CD1-CG 4.42Å
112	K	63.1	Low	55.4	Low	69 Å²	69	71.5 Å²	71.5	30%	0.3	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	119.1	173.7	-172.6	175.8	-171.1	-173	0	109.4	I92 A93 L110 N114	I92-K112 WeakPolarHBondContact CA-O 3.46Å; A93-K112 HydrophobicContact CB-CB 4.43Å; A93-K112 PolarHBondContact N-O 2.96Å; A93-K112 PolarHBondContact O-N 2.86Å; L110-K112 HydrophobicContact CD2-CB 4.48Å; K112-N114 WeakPolarHBondContact CE-OD1 3.34Å
113	V	64.4	Low	56.3	Low	2 Å²	2	67.5 Å²	67.5	1%	0.012	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	111.5	173.6	-175.6	0	0	0	0	107.9	I111 Y115 S122 K123 Y125 V167	I111-V113 HydrophobicContact CG2-CG2 4.26Å; V113-Y115 HydrophobicContact CB-CE2 4.28Å; V113-Y115 HydrophobicContact CG1-CD2 4.4Å; V113-Y115 HydrophobicContact CG1-CE1 4Å; V113-Y115 HydrophobicContact CG1-CE2 3.86Å; V113-S122 WeakPolarHBondContact O-CA 3.09Å; V113-K123 PolarHBondContact N-O 2.83Å; V113-K123 PolarHBondContact O-N 3.38Å; V113-K123 VanDerWaalsContact O-N 3.08Å; V113-Y125 HydrophobicContact CB-CE2 4.44Å; V113-Y125 HydrophobicContact CG2-CD2 4.14Å; V113-Y125 HydrophobicContact CG2-CE2 3.85Å; V113-V167 HydrophobicContact CG1-CG2 4.45Å
114	N	63.2	Low	56.8	Low	45 Å²	45	64.3 Å²	64.3	24%	0.241	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	117.9	173.2	-59.8	-51.2	0	0	0	108.9	F90 S91 K112	F90-N114 VanDerWaalsContact CA-O 3.29Å; F90-N114 WeakPolarHBondContact CA-O 3.49Å; F90-N114 WeakPolarHBondContact CB-O 3.34Å; S91-N114 PolarHBondContact N-O 3.2Å; S91-N114 PolarHBondContact O-N 2.87Å; S91-N114 WeakPolarHBondContact OG-CB 3.35Å; S91-N114 PolarHBondContact OG-ND2 3.45Å; K112-N114 WeakPolarHBondContact CE-OD1 3.34Å
115	Y	60.7	Low	57.6	Low	52 Å²	52	60.7 Å²	60.7	20%	0.204	31%	0.312	C	S	.	.			trans	-85.5	147	175.4	-62.6	-84.2	0	0	0	110.3	V113 S117 I120 K123 V167	V113-Y115 HydrophobicContact CB-CE2 4.28Å; V113-Y115 HydrophobicContact CG1-CD2 4.4Å; V113-Y115 HydrophobicContact CG1-CE1 4Å; V113-Y115 HydrophobicContact CG1-CE2 3.86Å; Y115-S117 VanDerWaalsContact C-N 3.27Å; Y115-S117 PolarHBondContact O-N 3.25Å; Y115-I120 HydrophobicContact CD1-CG2 4.29Å; Y115-I120 HydrophobicContact CD2-CB 4.28Å; Y115-I120 HydrophobicContact CD2-CG2 3.41Å; Y115-I120 VanDerWaalsContact CD2-CG2 3.41Å; Y115-I120 HydrophobicContact CE2-CG2 3.9Å; Y115-I120 HydrophobicContact CG-CB 4.14Å; Y115-I120 HydrophobicContact CG-CG2 3.64Å; Y115-K123 HydrophobicContact CE2-CB 4.31Å; Y115-K123 HydrophobicContact CE2-CD 4.27Å; Y115-K123 HydrophobicContact CE2-CG 4.11Å; Y115-V167 HydrophobicContact CE1-CG2 4.41Å
116	P	53.2	Low	58	Low	59 Å²	59	59.5 Å²	59.5	38%	0.383	30%	0.303	S	S	.	.	S	Bend	trans	-68.5	-26.2	179.6	24.7	-32.4	0	0	0	113.3	G88	G88-P116 VanDerWaalsContact CA-CB 3.47Å
117	S	58.6	Low	58.5	Low	55 Å²	55	54.7 Å²	54.7	39%	0.385	28%	0.278	S	S	.	.	S	Bend	trans	-82.7	125.7	-177.1	-48	0	0	0	0	111.3	Y115 L119 I120	Y115-S117 VanDerWaalsContact C-N 3.27Å; Y115-S117 PolarHBondContact O-N 3.25Å; S117-L119 PolarHBondContact O-N 3.35Å; S117-I120 PolarHBondContact O-N 3.21Å
118	R	57.7	Low	58.6	Low	262 Å²	262	54.3 Å²	54.3	99%	0.989	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-15.5	170.7	-70.6	-174.1	-177.1	179	1.5	113.8
119	L	55.2	Low	58.5	Low	164 Å²	164	56 Å²	56	86%	0.859	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-22.3	177.7	-68.3	165.5	0	0	0	113.2	S117	S117-L119 PolarHBondContact O-N 3.35Å
120	I	57.2	Low	57.7	Low	72 Å²	72	56.3 Å²	56.3	37%	0.369	29%	0.285	S	S	.	.	S	Bend	trans	-106.5	112.8	-178.9	-58.1	163.8	0	0	0	108	Y115 S117 S122	Y115-I120 HydrophobicContact CD1-CG2 4.29Å; Y115-I120 HydrophobicContact CD2-CB 4.28Å; Y115-I120 HydrophobicContact CD2-CG2 3.41Å; Y115-I120 VanDerWaalsContact CD2-CG2 3.41Å; Y115-I120 HydrophobicContact CE2-CG2 3.9Å; Y115-I120 HydrophobicContact CG-CB 4.14Å; Y115-I120 HydrophobicContact CG-CG2 3.64Å; S117-I120 PolarHBondContact O-N 3.21Å; I120-S122 PolarHBondContact O-N 3.03Å
121	P	57.3	Low	57	Low	91 Å²	91	60.7 Å²	60.7	59%	0.591	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-62.3	140.8	176	25.3	-32.3	0	0	0	110	K123	P121-K123 PolarHBondContact O-N 3.1Å
122	S	62.2	Low	55.8	Low	29 Å²	29	64.3 Å²	64.3	20%	0.203	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-54.2	132.3	172.2	59.5	0	0	0	0	109.6	V113 I120	V113-S122 WeakPolarHBondContact O-CA 3.09Å; I120-S122 PolarHBondContact O-N 3.03Å
123	K	60.4	Low	54	Low	99 Å²	99	65 Å²	65	43%	0.43	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.9	177.9	-68.7	-176.7	-178.8	177.2	0	109.6	V113 Y115 P121 Y125	V113-K123 PolarHBondContact N-O 2.83Å; V113-K123 PolarHBondContact O-N 3.38Å; V113-K123 VanDerWaalsContact O-N 3.08Å; Y115-K123 HydrophobicContact CE2-CB 4.31Å; Y115-K123 HydrophobicContact CE2-CD 4.27Å; Y115-K123 HydrophobicContact CE2-CG 4.11Å; P121-K123 PolarHBondContact O-N 3.1Å; K123-Y125 HydrophobicContact CB-CE1 4.48Å; K123-Y125 HydrophobicContact CB-CE2 3.74Å; K123-Y125 WeakPolarHBondContact CD-OH 3.21Å
124	C	57.2	Low	52.2	Low	11 Å²	11	71.2 Å²	71.2	7%	0.074	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	128	174.3	-63.2	0	0	0	0	108.6	I111 H145	I111-C124 CarbonylContact O-C 3.39Å; I111-C124 WeakPolarHBondContact O-CA 3.21Å; C124-H145 VanDerWaalsContact CB-CE1 3.43Å; C124-H145 WeakPolarHBondContact CB-CE1 3.3Å; C124-H145 PolarHBondContact SG-CE1 3.4Å
125	Y	60.2	Low	50.5	Low	15 Å²	15	76.4 Å²	76.4	6%	0.059	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	143.4	179.5	-55.8	-77.8	0	0	0	109.8	L110 I111 V113 K123 L153 M155 I163	L110-Y125 WeakPolarHBondContact CA-O 3.43Å; I111-Y125 PolarHBondContact N-O 3.38Å; I111-Y125 PolarHBondContact O-N 2.88Å; V113-Y125 HydrophobicContact CB-CE2 4.44Å; V113-Y125 HydrophobicContact CG2-CD2 4.14Å; V113-Y125 HydrophobicContact CG2-CE2 3.85Å; K123-Y125 HydrophobicContact CB-CE1 4.48Å; K123-Y125 HydrophobicContact CB-CE2 3.74Å; K123-Y125 WeakPolarHBondContact CD-OH 3.21Å; Y125-L153 HydrophobicContact CD1-CB 4.44Å; Y125-M155 HydrophobicContact CD1-CE 3.22Å; Y125-M155 HydrophobicContact CD1-SD 4.47Å; Y125-M155 HydrophobicContact CD2-CE 3.63Å; Y125-M155 HydrophobicContact CD2-SD 4.46Å; Y125-M155 HydrophobicContact CE1-CE 3.59Å; Y125-M155 HydrophobicContact CE2-CE 3.98Å; Y125-M155 HydrophobicContact CG-CE 3.2Å; Y125-M155 HydrophobicContact CG-SD 4.03Å; Y125-I163 HydrophobicContact CE1-CD1 4Å; Y125-I163 HydrophobicContact CE2-CD1 4.33Å; Y125-I163 HydrophobicContact CE2-CG2 4.48Å
126	Y	56.7	Low	48.9	Very low	41 Å²	41	80 Å²	80	16%	0.161	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	122.9	173.9	178.2	-90.9	0	0	0	108.1	V97 A108 N128 L153 M155	V97-Y126 HydrophobicContact CG1-CE2 4.24Å; V97-Y126 HydrophobicContact CG2-CD2 4.02Å; V97-Y126 HydrophobicContact CG2-CE2 3.76Å; A108-Y126 HydrophobicContact CB-CD2 4.47Å; A108-Y126 HydrophobicContact CB-CE1 4.36Å; A108-Y126 HydrophobicContact CB-CE2 3.51Å; A108-Y126 VanDerWaalsContact CB-CZ 3.44Å; A108-Y126 WeakPolarHBondContact CB-OH 3.17Å; Y126-N128 HydrophobicContact CE1-CB 4Å; Y126-L153 PolarHBondContact N-O 3.02Å; Y126-M155 PolarHBondContact O-N 2.9Å
127	A	56.5	Low	47.6	Very low	8 Å²	8	85 Å²	85	7%	0.066	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	114.2	175.2	0	0	0	0	0	108.5	A108 L109 I111 L129	A108-A127 WeakPolarHBondContact CA-O 3.16Å; L109-A127 PolarHBondContact N-O 2.78Å; L109-A127 PolarHBondContact O-N 2.96Å; I111-A127 HydrophobicContact CD1-CB 4.34Å; A127-L129 PolarHBondContact O-N 3.24Å
128	N	53.2	Low	46.4	Very low	30 Å²	30	88.3 Å²	88.3	16%	0.16	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	114.1	168.4	-161.8	-24	0	0	0	107.7	A107 Y126 A130 E131	A107-N128 CarbonylContact O-C 3.49Å; A107-N128 WeakPolarHBondContact O-CA 3.46Å; A107-N128 PolarHBondContact O-OD1 2.87Å; Y126-N128 HydrophobicContact CE1-CB 4Å; N128-A130 PolarHBondContact O-N 2.99Å; N128-A130 WeakPolarHBondContact OD1-CA 3.39Å; N128-A130 WeakPolarHBondContact OD1-CB 3.48Å; N128-A130 PolarHBondContact OD1-N 3.03Å; N128-E131 HydrophobicContact CB-CG 4.26Å; N128-E131 WeakPolarHBondContact O-CB 3.45Å; N128-E131 PolarHBondContact O-N 3.26Å
129	L	50.4	Low	45.2	Very low	37 Å²	37	86.2 Å²	86.2	19%	0.194	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-54	-22.6	165.7	-66.3	158.9	0	0	0	111.6	V74 A107 L109 A127 E131 W132	V74-L129 HydrophobicContact CB-CD1 4.41Å; V74-L129 HydrophobicContact CG1-CD1 4.43Å; A107-L129 WeakPolarHBondContact O-CA 3.13Å; A107-L129 WeakPolarHBondContact O-CB 3.47Å; A107-L129 PolarHBondContact O-N 2.95Å; L109-L129 HydrophobicContact CD1-CD1 4.15Å; L109-L129 HydrophobicContact CD1-CD2 3.92Å; L109-L129 HydrophobicContact CD1-CG 4.12Å; L109-L129 HydrophobicContact CG-CD1 3.96Å; L109-L129 HydrophobicContact CG-CG 4.18Å; A127-L129 PolarHBondContact O-N 3.24Å; L129-E131 VanDerWaalsContact C-N 3.34Å; L129-W132 WeakPolarHBondContact O-CB 3.33Å; L129-W132 PolarHBondContact O-N 3.03Å; L129-W132 VanDerWaalsContact O-N 3.13Å
130	A	41.3	Very low	44.2	Very low	29 Å²	29	84 Å²	84	24%	0.24	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-69.2	-26	170.3	0	0	0	0	0	113.1	A107 N128 W132 C133	A107-A130 HydrophobicContact CB-CB 4.34Å; N128-A130 PolarHBondContact O-N 2.99Å; N128-A130 WeakPolarHBondContact OD1-CA 3.39Å; N128-A130 WeakPolarHBondContact OD1-CB 3.48Å; N128-A130 PolarHBondContact OD1-N 3.03Å; A130-W132 PolarHBondContact O-N 2.85Å; A130-C133 CarbonylContact O-C 3.6Å; A130-C133 WeakPolarHBondContact O-CA 3.19Å; A130-C133 WeakPolarHBondContact O-CB 3.31Å; A130-C133 PolarHBondContact O-N 2.97Å
131	E	43.2	Very low	43.1	Very low	100 Å²	100	82.1 Å²	82.1	47%	0.467	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-70.3	-10.1	169.6	-74.4	-175.6	172.4	0	0	112.5	N128 L129 C133	N128-E131 HydrophobicContact CB-CG 4.26Å; N128-E131 WeakPolarHBondContact O-CB 3.45Å; N128-E131 PolarHBondContact O-N 3.26Å; L129-E131 VanDerWaalsContact C-N 3.34Å; E131-C133 VanDerWaalsContact C-N 3.29Å
132	W	39	Very low	42.1	Very low	81 Å²	81	84.7 Å²	84.7	31%	0.307	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-88.9	-1.7	168.7	-68.5	45.5	0	0	0	112.1	W47 L129 A130 K157 L160	W47-W132 HydrophobicContact CD2-CZ3 4.35Å; W47-W132 AromaticContact CE3-CZ3 3.89Å; W47-W132 HydrophobicContact CE3-CZ3 3.89Å; W47-W132 AromaticContact CH2-CH2 3.62Å; W47-W132 HydrophobicContact CH2-CH2 3.62Å; W47-W132 AromaticContact CH2-CZ3 3.58Å; W47-W132 HydrophobicContact CH2-CZ3 3.58Å; W47-W132 HydrophobicContact CZ2-CH2 4.04Å; W47-W132 HydrophobicContact CZ2-CZ3 4.05Å; W47-W132 HydrophobicContact CZ3-CH2 4.01Å; W47-W132 AromaticContact CZ3-CZ3 3.49Å; W47-W132 HydrophobicContact CZ3-CZ3 3.49Å; W47-W132 VanDerWaalsContact CZ3-CZ3 3.49Å; L129-W132 WeakPolarHBondContact O-CB 3.33Å; L129-W132 PolarHBondContact O-N 3.03Å; L129-W132 VanDerWaalsContact O-N 3.13Å; A130-W132 PolarHBondContact O-N 2.85Å; W132-K157 HydrophobicContact CD2-CB 4.34Å; W132-K157 HydrophobicContact CD2-CD 3.85Å; W132-K157 HydrophobicContact CD2-CG 4.3Å; W132-K157 HydrophobicContact CE3-CD 3.83Å; W132-K157 HydrophobicContact CH2-CD 3.73Å; W132-K157 HydrophobicContact CH2-CG 3.78Å; W132-K157 HydrophobicContact CZ2-CB 3.81Å; W132-K157 HydrophobicContact CZ2-CD 3.76Å; W132-K157 HydrophobicContact CZ2-CG 3.44Å; W132-K157 VanDerWaalsContact CZ2-CG 3.44Å; W132-K157 HydrophobicContact CZ3-CD 3.76Å; W132-K157 VanDerWaalsContact CZ3-CE 3.46Å; W132-K157 HydrophobicContact CZ3-CG 4.33Å; W132-L160 HydrophobicContact CZ2-CD2 4.27Å
133	C	26.8	Very low	40.8	Very low	82 Å²	82	84.2 Å²	84.2	55%	0.554	44%	0.444	S	S	*	.	S	Bend	trans	-105.4	144.3	164.1	-75.6	0	0	0	0	109.4	A130 E131 E135	A130-C133 CarbonylContact O-C 3.6Å; A130-C133 WeakPolarHBondContact O-CA 3.19Å; A130-C133 WeakPolarHBondContact O-CB 3.31Å; A130-C133 PolarHBondContact O-N 2.97Å; E131-C133 VanDerWaalsContact C-N 3.29Å; C133-E135 PolarHBondContact O-N 3.18Å
134	P	26.5	Very low	39.7	Very low	134 Å²	134	86.2 Å²	86.2	87%	0.87	46%	0.46	S	S	*	.	S	Bend	trans	-74.7	7.8	-169.3	28.4	-33.4	0	0	0	115.8
135	E	26.1	Very low	38.7	Very low	154 Å²	154	87.4 Å²	87.4	72%	0.72	46%	0.464	S	S	*	.	S	Bend	trans	-140.5	125.8	-174.6	-67.5	-178.3	175.5	0	0	110.3	C133	C133-E135 PolarHBondContact O-N 3.18Å
136	N	27.3	Very low	37.4	Very low	127 Å²	127	90.3 Å²	90.3	68%	0.679	50%	0.499	S	S	*	.			trans	105.3	80.4	173	-54.2	-39.1	0	0	0	116.8
137	I	27.1	Very low	36.3	Very low	163 Å²	163	100 Å²	100	84%	0.836	54%	0.535	S	S	*	.			trans	-55.5	124.2	143.4	-60.2	159.6	0	0	0	107.2
138	L	31.9	Very low	35.3	Very low	125 Å²	125	102.5 Å²	102.5	65%	0.654	55%	0.549	S	S	*	.			trans	-172.2	122.1	151.5	-97.6	166.3	0	0	0	112.6
139	R	34.4	Very low	34.4	Very low	219 Å²	219	105.4 Å²	105.4	83%	0.826	59%	0.586	S	S	*	*			trans	67.3	113.1	146.8	-69	174.3	-173.6	-176.2	2.7	119.9	G141	R139-G141 PolarHBondContact O-N 3.02Å
140	S	32.6	Very low	33.9	Very low	118 Å²	118	106.2 Å²	106.2	83%	0.825	59%	0.593	S	S	*	*			trans	-38.1	102.1	160.9	55.3	0	0	0	0	113.3	L142	S140-L142 PolarHBondContact O-N 3.1Å
141	G	35.4	Very low	34.3	Very low	31 Å²	31	113.7 Å²	113.7	32%	0.32	62%	0.62	S	S	.	*			trans	-76.8	112.3	163.9	0	0	0	0	0	109.4	R139 C143	R139-G141 PolarHBondContact O-N 3.02Å; G141-C143 PolarHBondContact O-N 3.27Å
142	L	34.6	Very low	34.5	Very low	145 Å²	145	110 Å²	110	76%	0.759	61%	0.605	S	S	*	*			trans	-60.3	98.2	166.4	-73.2	160.4	0	0	0	108.1	S140 N144	S140-L142 PolarHBondContact O-N 3.1Å; L142-N144 PolarHBondContact O-N 3.19Å; L142-N144 VanDerWaalsContact O-N 3.15Å
143	C	35.4	Very low	35.3	Very low	19 Å²	19	111.2 Å²	111.2	13%	0.128	62%	0.617	C	S	.	*			trans	-70.4	108.7	169.2	59.7	0	0	0	0	108.1	G141 H145 C152	G141-C143 PolarHBondContact O-N 3.27Å; C143-H145 PolarHBondContact O-N 2.88Å; C143-C152 HydrophobicContact CB-CB 4.06Å; C143-C152 WeakPolarHBondContact CB-SG 3.12Å; C143-C152 WeakPolarHBondContact SG-CB 3.36Å; C143-C152 PolarHBondContact SG-N 2.75Å; C143-C152 CovalentContact SG-SG 2Å; C143-C152 PolarHBondContact SG-SG 2.86Å
144	N	37.6	Very low	36.6	Very low	141 Å²	141	112.2 Å²	112.2	75%	0.754	62%	0.623	S	S	*	*			trans	-75	75.1	170.3	-75.9	-26.7	0	0	0	108.8	L142 G146	L142-N144 PolarHBondContact O-N 3.19Å; L142-N144 VanDerWaalsContact O-N 3.15Å; N144-G146 PolarHBondContact O-N 2.8Å
145	H	36.3	Very low	38	Very low	36 Å²	36	106.1 Å²	106.1	17%	0.167	58%	0.582	C	S	.	*			trans	-67.1	88.8	160.2	-88.7	114.2	0	0	0	107.6	C124 C143 R147 V148	C124-H145 VanDerWaalsContact CB-CE1 3.43Å; C124-H145 WeakPolarHBondContact CB-CE1 3.3Å; C124-H145 PolarHBondContact SG-CE1 3.4Å; C143-H145 PolarHBondContact O-N 2.88Å; H145-R147 PolarHBondContact O-N 2.95Å; H145-V148 WeakPolarHBondContact CB-O 3.07Å; H145-V148 PolarHBondContact O-N 2.83Å; H145-V148 VanDerWaalsContact O-N 3.07Å
146	G	32.6	Very low	39.4	Very low	77 Å²	77	103 Å²	103	79%	0.794	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	18.3	-177.6	0	0	0	0	0	116.2	N144	N144-G146 PolarHBondContact O-N 2.8Å
147	R	33	Very low	40.5	Very low	245 Å²	245	100.9 Å²	100.9	93%	0.925	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.4	-6.9	170.9	-72.7	-168.6	-172.7	-176.1	1.6	115	H145	H145-R147 PolarHBondContact O-N 2.95Å
148	V	37.4	Very low	41.9	Very low	59 Å²	59	95.6 Å²	95.6	36%	0.358	54%	0.536	S	S	.	.			trans	-144.3	106	-179.4	-167	0	0	0	0	105.9	H145 T150	H145-V148 WeakPolarHBondContact CB-O 3.07Å; H145-V148 PolarHBondContact O-N 2.83Å; H145-V148 VanDerWaalsContact O-N 3.07Å; V148-T150 HydrophobicContact CG1-CG2 3.82Å; V148-T150 PolarHBondContact O-N 3.13Å; V148-T150 PolarHBondContact O-OG1 3.26Å
149	G	33.6	Very low	43.2	Very low	91 Å²	91	91.1 Å²	91.1	94%	0.938	52%	0.517	S	S	*	.			trans	-67.6	39.2	-176.4	0	0	0	0	0	114.7
150	T	40.1	Very low	44.4	Very low	55 Å²	55	81.9 Å²	81.9	34%	0.337	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-92	122.8	-179.5	46.5	0	0	0	0	110.1	V148 C152	V148-T150 HydrophobicContact CG1-CG2 3.82Å; V148-T150 PolarHBondContact O-N 3.13Å; V148-T150 PolarHBondContact O-OG1 3.26Å; T150-C152 PolarHBondContact O-N 2.84Å
151	K	48.4	Very low	45.4	Very low	186 Å²	186	80.6 Å²	80.6	81%	0.809	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-60.5	126.1	168.5	-68.1	-179.6	178.4	179	0	108.6	L153	K151-L153 PolarHBondContact O-N 3.18Å
152	C	48.9	Very low	46.6	Very low	21 Å²	21	87.4 Å²	87.4	14%	0.142	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-67	130.1	170.7	-66	0	0	0	0	109.2	C143 T150	C143-C152 HydrophobicContact CB-CB 4.06Å; C143-C152 WeakPolarHBondContact CB-SG 3.12Å; C143-C152 WeakPolarHBondContact SG-CB 3.36Å; C143-C152 PolarHBondContact SG-N 2.75Å; C143-C152 CovalentContact SG-SG 2Å; C143-C152 PolarHBondContact SG-SG 2.86Å; T150-C152 PolarHBondContact O-N 2.84Å
153	L	54.7	Low	47.8	Very low	107 Å²	107	81.9 Å²	81.9	56%	0.56	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	138.1	174	-66.5	170.4	0	0	0	109.2	Y125 Y126 K151 M155	Y125-L153 HydrophobicContact CD1-CB 4.44Å; Y126-L153 PolarHBondContact N-O 3.02Å; K151-L153 PolarHBondContact O-N 3.18Å; L153-M155 PolarHBondContact O-N 2.61Å
154	P	53.7	Low	48.9	Very low	104 Å²	104	83.6 Å²	83.6	68%	0.675	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	134.6	170.7	27.7	-32.9	0	0	0	109.1
155	M	56.8	Low	49.8	Very low	5 Å²	5	79.1 Å²	79.1	3%	0.025	44%	0.442	C	S	.	.			trans	-123.4	110	-178.7	177.8	169.3	-79.5	0	0	110.6	I111 Y125 Y126 L153 A159 L160 I163	I111-M155 HydrophobicContact CD1-SD 4.23Å; Y125-M155 HydrophobicContact CD1-CE 3.22Å; Y125-M155 HydrophobicContact CD1-SD 4.47Å; Y125-M155 HydrophobicContact CD2-CE 3.63Å; Y125-M155 HydrophobicContact CD2-SD 4.46Å; Y125-M155 HydrophobicContact CE1-CE 3.59Å; Y125-M155 HydrophobicContact CE2-CE 3.98Å; Y125-M155 HydrophobicContact CG-CE 3.2Å; Y125-M155 HydrophobicContact CG-SD 4.03Å; Y126-M155 PolarHBondContact O-N 2.9Å; L153-M155 PolarHBondContact O-N 2.61Å; M155-A159 HydrophobicContact CG-CB 4.15Å; M155-L160 HydrophobicContact CG-CB 4.02Å; M155-L160 HydrophobicContact SD-CB 3.74Å; M155-L160 HydrophobicContact SD-CD1 3.68Å; M155-L160 HydrophobicContact SD-CG 4.3Å; M155-I163 HydrophobicContact CE-CD1 3.21Å; M155-I163 HydrophobicContact CE-CG1 4.45Å
156	N	54.7	Low	50.7	Low	90 Å²	90	83 Å²	83	48%	0.481	46%	0.46	S	S	.	.			trans	-76.2	163.9	170.1	68.7	21.9	0	0	0	111.2	A158 A159 L160	N156-A158 VanDerWaalsContact C-N 3.25Å; N156-A158 PolarHBondContact O-N 3.44Å; N156-A158 PolarHBondContact OD1-N 3.13Å; N156-A159 PolarHBondContact O-N 2.92Å; N156-A159 VanDerWaalsContact O-N 3.1Å; N156-A159 WeakPolarHBondContact OD1-CB 3.19Å; N156-A159 PolarHBondContact OD1-N 3.05Å; N156-L160 PolarHBondContact O-N 3.25Å
157	K	51.9	Low	51.7	Low	82 Å²	82	79.9 Å²	79.9	36%	0.357	43%	0.426	S	S	.	.	H	α-helix	trans	-51.7	-42.8	178.8	-179.1	168.6	-174.9	172.3	0	112.9	W132 L160 H161	W132-K157 HydrophobicContact CD2-CB 4.34Å; W132-K157 HydrophobicContact CD2-CD 3.85Å; W132-K157 HydrophobicContact CD2-CG 4.3Å; W132-K157 HydrophobicContact CE3-CD 3.83Å; W132-K157 HydrophobicContact CH2-CD 3.73Å; W132-K157 HydrophobicContact CH2-CG 3.78Å; W132-K157 HydrophobicContact CZ2-CB 3.81Å; W132-K157 HydrophobicContact CZ2-CD 3.76Å; W132-K157 HydrophobicContact CZ2-CG 3.44Å; W132-K157 VanDerWaalsContact CZ2-CG 3.44Å; W132-K157 HydrophobicContact CZ3-CD 3.76Å; W132-K157 VanDerWaalsContact CZ3-CE 3.46Å; W132-K157 HydrophobicContact CZ3-CG 4.33Å; K157-L160 PolarHBondContact O-N 3.22Å; K157-H161 PolarHBondContact O-CD2 3.46Å; K157-H161 VanDerWaalsContact O-CD2 3.26Å; K157-H161 PolarHBondContact O-N 3.06Å
158	A	55	Low	52.3	Low	52 Å²	52	72.8 Å²	72.8	43%	0.43	41%	0.405	S	S	.	.	H	α-helix	trans	-65	-40.4	-179.3	0	0	0	0	0	112.2	N156 H161 R162	N156-A158 VanDerWaalsContact C-N 3.25Å; N156-A158 PolarHBondContact O-N 3.44Å; N156-A158 PolarHBondContact OD1-N 3.13Å; A158-H161 PolarHBondContact O-N 3.22Å; A158-R162 WeakPolarHBondContact O-CG 3.4Å; A158-R162 PolarHBondContact O-N 3.24Å
159	A	59.5	Low	52.6	Low	30 Å²	30	77.1 Å²	77.1	25%	0.248	43%	0.426	C	S	.	.	H	α-helix	trans	-67.4	-39.5	176.9	0	0	0	0	0	111.6	M155 N156 R162 I163	M155-A159 HydrophobicContact CG-CB 4.15Å; N156-A159 PolarHBondContact O-N 2.92Å; N156-A159 VanDerWaalsContact O-N 3.1Å; N156-A159 WeakPolarHBondContact OD1-CB 3.19Å; N156-A159 PolarHBondContact OD1-N 3.05Å; A159-R162 PolarHBondContact O-N 3.32Å; A159-I163 WeakPolarHBondContact O-CB 3.18Å; A159-I163 PolarHBondContact O-N 3.12Å
160	L	60.7	Low	52.9	Low	26 Å²	26	80.6 Å²	80.6	14%	0.136	42%	0.418	C	S	.	.	H	α-helix	trans	-60.5	-48.9	173	179.1	62.4	0	0	0	111.2	I111 W132 M155 N156 K157 R162 I163 L164	I111-L160 HydrophobicContact CD1-CD1 3.47Å; I111-L160 VanDerWaalsContact CD1-CD1 3.47Å; I111-L160 HydrophobicContact CD1-CD2 4.15Å; I111-L160 HydrophobicContact CD1-CG 4.42Å; W132-L160 HydrophobicContact CZ2-CD2 4.27Å; M155-L160 HydrophobicContact CG-CB 4.02Å; M155-L160 HydrophobicContact SD-CB 3.74Å; M155-L160 HydrophobicContact SD-CD1 3.68Å; M155-L160 HydrophobicContact SD-CG 4.3Å; N156-L160 PolarHBondContact O-N 3.25Å; K157-L160 PolarHBondContact O-N 3.22Å; L160-R162 VanDerWaalsContact C-N 3.3Å; L160-R162 PolarHBondContact O-N 2.81Å; L160-I163 PolarHBondContact O-N 3.08Å; L160-L164 HydrophobicContact CD1-CD1 3.95Å; L160-L164 HydrophobicContact CD1-CG 4.02Å; L160-L164 HydrophobicContact CD2-CD1 4.45Å; L160-L164 HydrophobicContact CG-CD1 3.84Å; L160-L164 HydrophobicContact CG-CG 4.32Å; L160-L164 WeakPolarHBondContact O-CB 3.43Å; L160-L164 VanDerWaalsContact O-CG 3.31Å; L160-L164 WeakPolarHBondContact O-CG 3.39Å; L160-L164 PolarHBondContact O-N 2.83Å
161	H	54.1	Low	53.6	Low	91 Å²	91	81.9 Å²	81.9	42%	0.421	42%	0.422	S	S	.	.	H	α-helix	trans	-60.4	-39.5	177.8	-88.6	-97.1	0	0	0	112.1	K157 A158 A165	K157-H161 PolarHBondContact O-CD2 3.46Å; K157-H161 VanDerWaalsContact O-CD2 3.26Å; K157-H161 PolarHBondContact O-N 3.06Å; A158-H161 PolarHBondContact O-N 3.22Å; H161-A165 WeakPolarHBondContact O-CB 3.05Å; H161-A165 PolarHBondContact O-N 3.47Å
162	R	59.8	Low	53.9	Low	174 Å²	174	76.4 Å²	76.4	66%	0.657	40%	0.401	S	S	*	.	H	α-helix	trans	-65.7	-46.1	175.3	-75.3	177.3	-173.7	168.2	1.8	112.2	A158 A159 L160 A165 E166	A158-R162 WeakPolarHBondContact O-CG 3.4Å; A158-R162 PolarHBondContact O-N 3.24Å; A159-R162 PolarHBondContact O-N 3.32Å; L160-R162 VanDerWaalsContact C-N 3.3Å; L160-R162 PolarHBondContact O-N 2.81Å; R162-A165 CarbonylContact O-C 3.6Å; R162-A165 WeakPolarHBondContact O-CB 3.45Å; R162-A165 PolarHBondContact O-N 3.27Å; R162-E166 WeakPolarHBondContact O-CB 3.43Å; R162-E166 WeakPolarHBondContact O-CG 3.46Å; R162-E166 PolarHBondContact O-N 3.31Å
163	I	59.1	Low	54.1	Low	28 Å²	28	79.5 Å²	79.5	14%	0.144	42%	0.416	C	S	.	.	H	α-helix	trans	-67.4	-40.4	179.4	-76.9	159.1	0	0	0	111.1	Y125 M155 A159 L160 A165 E166 V167	Y125-I163 HydrophobicContact CE1-CD1 4Å; Y125-I163 HydrophobicContact CE2-CD1 4.33Å; Y125-I163 HydrophobicContact CE2-CG2 4.48Å; M155-I163 HydrophobicContact CE-CD1 3.21Å; M155-I163 HydrophobicContact CE-CG1 4.45Å; A159-I163 WeakPolarHBondContact O-CB 3.18Å; A159-I163 PolarHBondContact O-N 3.12Å; L160-I163 PolarHBondContact O-N 3.08Å; I163-A165 VanDerWaalsContact C-N 3.33Å; I163-E166 PolarHBondContact O-N 3.18Å; I163-V167 HydrophobicContact CG2-CG2 4.14Å; I163-V167 WeakPolarHBondContact O-CB 3.3Å; I163-V167 WeakPolarHBondContact O-CG2 3.18Å; I163-V167 PolarHBondContact O-N 2.91Å
164	L	58.2	Low	54.1	Low	56 Å²	56	77.9 Å²	77.9	29%	0.293	41%	0.407	S	S	.	.	H	α-helix	trans	-62.3	-42.5	172.1	-72.1	173.5	0	0	0	110.9	I92 L160 L168	I92-L164 HydrophobicContact CD1-CD2 3.74Å; L160-L164 HydrophobicContact CD1-CD1 3.95Å; L160-L164 HydrophobicContact CD1-CG 4.02Å; L160-L164 HydrophobicContact CD2-CD1 4.45Å; L160-L164 HydrophobicContact CG-CD1 3.84Å; L160-L164 HydrophobicContact CG-CG 4.32Å; L160-L164 WeakPolarHBondContact O-CB 3.43Å; L160-L164 VanDerWaalsContact O-CG 3.31Å; L160-L164 WeakPolarHBondContact O-CG 3.39Å; L160-L164 PolarHBondContact O-N 2.83Å; L164-L168 HydrophobicContact CB-CD1 4.47Å; L164-L168 WeakPolarHBondContact O-CB 3.35Å; L164-L168 VanDerWaalsContact O-CD1 3.3Å; L164-L168 WeakPolarHBondContact O-CD1 3.39Å; L164-L168 WeakPolarHBondContact O-CG 3.35Å; L164-L168 PolarHBondContact O-N 2.85Å
165	A	57.2	Low	54.1	Low	46 Å²	46	76.3 Å²	76.3	38%	0.38	39%	0.391	S	S	.	.	H	α-helix	trans	-62.8	-47.2	176	0	0	0	0	0	111.8	H161 R162 I163 L168 L169	H161-A165 WeakPolarHBondContact O-CB 3.05Å; H161-A165 PolarHBondContact O-N 3.47Å; R162-A165 CarbonylContact O-C 3.6Å; R162-A165 WeakPolarHBondContact O-CB 3.45Å; R162-A165 PolarHBondContact O-N 3.27Å; I163-A165 VanDerWaalsContact C-N 3.33Å; A165-L168 PolarHBondContact O-N 2.82Å; A165-L169 WeakPolarHBondContact O-CB 3.45Å; A165-L169 WeakPolarHBondContact O-CD1 3.34Å; A165-L169 WeakPolarHBondContact O-CG 3.37Å; A165-L169 PolarHBondContact O-N 2.93Å
166	E	55.7	Low	53.9	Low	119 Å²	119	81 Å²	81	56%	0.556	42%	0.415	S	S	*	.	H	α-helix	trans	-61.7	-44.5	177.5	-75.6	172.1	-172.3	0	0	112	R162 I163 L168 L169 Q170	R162-E166 WeakPolarHBondContact O-CB 3.43Å; R162-E166 WeakPolarHBondContact O-CG 3.46Å; R162-E166 PolarHBondContact O-N 3.31Å; I163-E166 PolarHBondContact O-N 3.18Å; E166-L168 VanDerWaalsContact C-N 3.35Å; E166-L169 PolarHBondContact O-N 3.22Å; E166-Q170 WeakPolarHBondContact O-CG 3.24Å; E166-Q170 PolarHBondContact O-N 3.11Å; E166-Q170 VanDerWaalsContact O-N 3.16Å
167	V	52.4	Low	53.9	Low	11 Å²	11	80.4 Å²	80.4	7%	0.067	41%	0.41	C	S	.	.	H	α-helix	trans	-72.9	-27.6	-179	170.4	0	0	0	0	112.2	F90 I92 V113 Y115 I163	F90-V167 HydrophobicContact CD2-CG1 3.44Å; F90-V167 VanDerWaalsContact CD2-CG1 3.44Å; F90-V167 HydrophobicContact CE2-CG1 3.16Å; F90-V167 HydrophobicContact CG-CG1 4.2Å; F90-V167 HydrophobicContact CZ-CG1 3.77Å; F90-V167 WeakPolarHBondContact CZ-O 3.04Å; I92-V167 HydrophobicContact CD1-CG1 4.24Å; V113-V167 HydrophobicContact CG1-CG2 4.45Å; Y115-V167 HydrophobicContact CE1-CG2 4.41Å; I163-V167 HydrophobicContact CG2-CG2 4.14Å; I163-V167 WeakPolarHBondContact O-CB 3.3Å; I163-V167 WeakPolarHBondContact O-CG2 3.18Å; I163-V167 PolarHBondContact O-N 2.91Å
168	L	45.8	Very low	54	Low	95 Å²	95	80.2 Å²	80.2	50%	0.497	41%	0.414	S	S	.	.	H	α-helix	trans	-85.7	-17.1	175.3	-71	167.6	0	0	0	113.2	L82 L164 A165 E166	L82-L168 HydrophobicContact CD1-CD2 3.52Å; L82-L168 HydrophobicContact CD2-CD2 3.82Å; L82-L168 HydrophobicContact CG-CD2 4.29Å; L164-L168 HydrophobicContact CB-CD1 4.47Å; L164-L168 WeakPolarHBondContact O-CB 3.35Å; L164-L168 VanDerWaalsContact O-CD1 3.3Å; L164-L168 WeakPolarHBondContact O-CD1 3.39Å; L164-L168 WeakPolarHBondContact O-CG 3.35Å; L164-L168 PolarHBondContact O-N 2.85Å; A165-L168 PolarHBondContact O-N 2.82Å; E166-L168 VanDerWaalsContact C-N 3.35Å
169	L	44.3	Very low	54	Low	151 Å²	151	82.6 Å²	82.6	79%	0.791	41%	0.413	S	S	*	.	H	α-helix	trans	-93.2	-22	178.5	-75.2	168.7	0	0	0	113.4	A165 E166	A165-L169 WeakPolarHBondContact O-CB 3.45Å; A165-L169 WeakPolarHBondContact O-CD1 3.34Å; A165-L169 WeakPolarHBondContact O-CG 3.37Å; A165-L169 PolarHBondContact O-N 2.93Å; E166-L169 PolarHBondContact O-N 3.22Å
170	Q	40.8	Very low	53.5	Low	164 Å²	164	87.4 Å²	87.4	77%	0.766	43%	0.428	S	S	*	.			trans	-81.5	0	165.9	-68.4	-170.8	-7.7	0	0	110.3	T84 E166	T84-Q170 WeakPolarHBondContact CG2-O 3.46Å; T84-Q170 WeakPolarHBondContact CG2-OXT 3.23Å; E166-Q170 WeakPolarHBondContact O-CG 3.24Å; E166-Q170 PolarHBondContact O-N 3.11Å; E166-Q170 VanDerWaalsContact O-N 3.16Å

Retrieved 170 of 170 residues in 35.8 ms (Link to these results)

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