A0A077Z7W9_TRITR Loading...

CX domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z7W9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 190 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	41.4	Very low	38	Very low	237 Å²	237	136.4 Å²	136.4	100%	1.167	72%	0.719	S	S	*	*				0	105.9	0	-72.9	-175.1	177.4	0	0	104.7	E3	M1-E3 PolarHBondContact O-N 3.04Å
2	D	42.3	Very low	37.9	Very low	165 Å²	165	142.1 Å²	142.1	88%	0.882	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-70.5	123.7	-157.9	-61.1	-67.2	0	0	0	113.1
3	E	40.8	Very low	38.1	Very low	193 Å²	193	138.4 Å²	138.4	90%	0.902	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-71.4	123.2	176	-115.5	173.5	114.8	0	0	110.1	M1	M1-E3 PolarHBondContact O-N 3.04Å
4	V	41.5	Very low	38	Very low	134 Å²	134	138.6 Å²	138.6	81%	0.812	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-81.5	120.7	173.6	178.6	0	0	0	0	108.3
5	P	35.9	Very low	37.9	Very low	77 Å²	77	137 Å²	137	50%	0.5	70%	0.702	S	S	.	*	P	Polyproline II helix	trans	-71.7	149.2	-176.3	28.1	-32.5	0	0	0	111.4
6	P	35.2	Very low	37.8	Very low	86 Å²	86	139.4 Å²	139.4	56%	0.558	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-62.4	140.3	179.6	24.7	-31.8	0	0	0	111.4	D8 E9	P6-D8 PolarHBondContact O-N 3.29Å; P6-E9 PolarHBondContact O-N 3.06Å
7	M	35.5	Very low	37.9	Very low	135 Å²	135	142.5 Å²	142.5	67%	0.665	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.4	-18.6	-178.4	-80.7	-77.7	-70.5	0	0	114.9	E9	M7-E9 VanDerWaalsContact C-N 3.28Å; M7-E9 PolarHBondContact O-N 2.86Å
8	D	37	Very low	37.5	Very low	133 Å²	133	140.7 Å²	140.7	71%	0.711	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-23.2	178.7	-65.2	-48.3	0	0	0	113.4	P6	P6-D8 PolarHBondContact O-N 3.29Å
9	E	40.1	Very low	37	Very low	127 Å²	127	137.6 Å²	137.6	59%	0.593	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-24.6	-179.6	-132	174.6	173.3	0	0	113	P6 M7 T13	P6-E9 PolarHBondContact O-N 3.06Å; M7-E9 VanDerWaalsContact C-N 3.28Å; M7-E9 PolarHBondContact O-N 2.86Å; E9-T13 PolarHBondContact O-OG1 3.1Å
10	L	34	Very low	36.7	Very low	114 Å²	114	137.6 Å²	137.6	60%	0.597	72%	0.716	S	S	*	*	H	α-helix	trans	-75.2	-30.4	176.5	-91.6	152.9	0	0	0	112.9
11	L	34.1	Very low	36.4	Very low	99 Å²	99	140 Å²	140	52%	0.518	72%	0.724	S	S	.	*	H	α-helix	trans	-78.3	-20.1	178.3	-94.3	111	0	0	0	113.8	N15	L11-N15 PolarHBondContact O-ND2 3.23Å
12	R	36.7	Very low	35.8	Very low	205 Å²	205	135 Å²	135	77%	0.774	71%	0.707	S	S	*	*	H	α-helix	trans	-74.1	-31.8	177	-95.4	179.7	166.4	175.7	-2.7	112.6
13	T	41.2	Very low	35.1	Very low	94 Å²	94	133.4 Å²	133.4	58%	0.577	70%	0.703	S	S	*	*	H	α-helix	trans	-81.9	-24	-174.3	-18.1	0	0	0	0	113.4	E9	E9-T13 PolarHBondContact O-OG1 3.1Å
14	E	36.5	Very low	34.3	Very low	141 Å²	141	134.1 Å²	134.1	66%	0.659	70%	0.697	S	S	*	*	H	α-helix	trans	-82.2	-35.1	175.6	-84.4	-161.6	131.1	0	0	113.4	Q16 K17	E14-Q16 VanDerWaalsContact C-N 3.26Å; E14-Q16 PolarHBondContact O-N 3.46Å; E14-K17 PolarHBondContact O-N 2.71Å
15	N	36	Very low	33.5	Very low	115 Å²	115	135.7 Å²	135.7	62%	0.615	70%	0.696	S	S	*	*	H	α-helix	trans	-72.1	-17.9	-178.7	-76.2	-57.6	0	0	0	113.5	L11	L11-N15 PolarHBondContact O-ND2 3.23Å
16	Q	37.2	Very low	32.8	Very low	175 Å²	175	140.8 Å²	140.8	82%	0.818	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-16.5	175.8	-125.7	176.1	6.8	0	0	113.5	E14	E14-Q16 VanDerWaalsContact C-N 3.26Å; E14-Q16 PolarHBondContact O-N 3.46Å
17	K	38.6	Very low	32.3	Very low	193 Å²	193	143.4 Å²	143.4	84%	0.839	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-18.2	177.1	-91.4	-179	174.3	178.2	0	113.8	E14	E14-K17 PolarHBondContact O-N 2.71Å
18	L	31.5	Very low	31.7	Very low	110 Å²	110	144.9 Å²	144.9	58%	0.576	74%	0.737	S	S	*	*	S	Bend	trans	-109.6	88	-177.7	-70.3	162.8	0	0	0	108	L20	L18-L20 HydrophobicContact CB-CD1 4.15Å; L18-L20 PolarHBondContact O-N 2.89Å
19	G	28	Very low	31.2	Very low	82 Å²	82	145.9 Å²	145.9	85%	0.845	74%	0.741	S	S	*	*			trans	-62.7	59.8	-177.8	0	0	0	0	0	115.5	H21	G19-H21 PolarHBondContact O-N 3.04Å
20	L	31.4	Very low	30.4	Very low	136 Å²	136	145 Å²	145	71%	0.712	75%	0.746	S	S	*	*			trans	-90	99.2	177.3	-91.5	115.7	0	0	0	110.4	L18 T22	L18-L20 HydrophobicContact CB-CD1 4.15Å; L18-L20 PolarHBondContact O-N 2.89Å; L20-T22 PolarHBondContact O-N 3.49Å
21	H	29.1	Very low	29.9	Very low	190 Å²	190	147.6 Å²	147.6	88%	0.88	76%	0.755	S	S	*	*			trans	-67.9	107.4	160.7	-94.8	-88	0	0	0	109.9	G19	G19-H21 PolarHBondContact O-N 3.04Å
22	T	30.3	Very low	29.5	Very low	132 Å²	132	146.9 Å²	146.9	81%	0.81	76%	0.756	S	S	*	*			trans	-89.4	106	175	-24.3	0	0	0	0	110.3	L20 R24	L20-T22 PolarHBondContact O-N 3.49Å; T22-R24 PolarHBondContact O-N 2.9Å
23	T	26.5	Very low	29	Very low	130 Å²	130	141.9 Å²	141.9	80%	0.798	74%	0.744	S	S	*	*			trans	-77.3	116	173	-19	0	0	0	0	109.7	Q25	T23-Q25 PolarHBondContact O-N 3.23Å
24	R	23.5	Very low	28.3	Very low	208 Å²	208	147.5 Å²	147.5	79%	0.785	76%	0.761	S	S	*	*			trans	-68.3	111.3	172.7	-79.9	177.8	166.2	-175	-7.9	110	T22 N189	T22-R24 PolarHBondContact O-N 2.9Å; R24-N189 PolarHBondContact NH1-OD1 2.78Å; R24-N189 PolarHBondContact NH2-OD1 2.93Å
25	Q	24.7	Very low	27.8	Very low	167 Å²	167	152.5 Å²	152.5	78%	0.78	77%	0.774	S	S	*	*			trans	-120.8	110	157.5	-77.8	-168.8	-11.3	0	0	109.3	T23 L27	T23-Q25 PolarHBondContact O-N 3.23Å; Q25-L27 PolarHBondContact O-N 3.2Å
26	L	22.4	Very low	27.2	Very low	184 Å²	184	150.7 Å²	150.7	96%	0.963	78%	0.782	S	S	*	*			trans	-64.4	106.5	169.9	-82.1	142.1	0	0	0	108.9
27	L	23.7	Very low	26.7	Very low	142 Å²	142	149.9 Å²	149.9	74%	0.743	79%	0.788	S	S	*	*			trans	-104.3	110.3	168	-101.4	125.9	0	0	0	109.1	Q25 I29	Q25-L27 PolarHBondContact O-N 3.2Å; L27-I29 PolarHBondContact O-N 3.14Å
28	N	22.9	Very low	26.1	Very low	166 Å²	166	142.4 Å²	142.4	89%	0.888	77%	0.766	S	S	*	*			trans	-55.1	110.6	164.4	-93.1	-26.9	0	0	0	109.6
29	I	26.3	Very low	26	Very low	153 Å²	153	147.2 Å²	147.2	79%	0.785	78%	0.783	S	S	*	*			trans	-97.8	113.8	173.1	-57	176.4	0	0	0	108.2	L27	L27-I29 PolarHBondContact O-N 3.14Å
30	P	24.1	Very low	26.3	Very low	108 Å²	108	147.7 Å²	147.7	70%	0.701	76%	0.763	S	S	*	*			trans	-72.2	134.5	175.2	28.9	-31.2	0	0	0	110.8	P32	P30-P32 VanDerWaalsContact O-CD 3.25Å; P30-P32 WeakPolarHBondContact O-CD 3.16Å
31	H	23.4	Very low	26.4	Very low	169 Å²	169	150.7 Å²	150.7	78%	0.782	76%	0.764	S	S	*	*			trans	-48.9	129.5	174.9	-92.6	-63.1	0	0	0	113.9
32	P	26	Very low	26.6	Very low	85 Å²	85	144.1 Å²	144.1	55%	0.552	74%	0.735	S	S	*	*			trans	-142.3	64.6	163	39.1	-18.9	0	0	0	112.6	P30 M138	P30-P32 VanDerWaalsContact O-CD 3.25Å; P30-P32 WeakPolarHBondContact O-CD 3.16Å; P32-M138 HydrophobicContact CG-SD 4.07Å
33	L	26	Very low	26.8	Very low	100 Å²	100	143.2 Å²	143.2	52%	0.524	72%	0.722	S	S	.	*			trans	-147	78.7	167.1	-73.1	177.3	0	0	0	110.3	A174 R178	L33-A174 HydrophobicContact CD1-CB 4.31Å; L33-R178 PolarHBondContact O-NH2 2.84Å; L33-R178 VanDerWaalsContact O-NH2 3.13Å
34	K	26.2	Very low	27.2	Very low	212 Å²	212	139 Å²	139	92%	0.922	70%	0.698	S	S	*	*	S	Bend	trans	-145	17.1	167.3	-130.8	-174.1	-171.2	-173.3	0	113.2
35	R	25.5	Very low	27.6	Very low	246 Å²	246	132.6 Å²	132.6	93%	0.928	69%	0.685	S	S	*	*	S	Bend	trans	-140.4	120.2	-177.2	-72.4	-175.2	-174.4	172.8	1.9	111.8
36	G	24.1	Very low	28	Very low	77 Å²	77	127 Å²	127	79%	0.794	67%	0.666	S	S	*	*			trans	84.8	100.7	149	0	0	0	0	0	115.9	G38	G36-G38 PolarHBondContact O-N 3.33Å
37	V	26.3	Very low	28.7	Very low	157 Å²	157	124.6 Å²	124.6	95%	0.952	65%	0.65	S	S	*	*			trans	-66.5	84.9	158	-171.4	0	0	0	0	107.3
38	G	26.1	Very low	29	Very low	36 Å²	36	126.7 Å²	126.7	37%	0.371	65%	0.653	S	S	.	*			trans	-65.6	135.8	167.4	0	0	0	0	0	109	G36 H40	G36-G38 PolarHBondContact O-N 3.33Å; G38-H40 PolarHBondContact O-CD2 3.17Å; G38-H40 PolarHBondContact O-N 2.78Å
39	K	28.9	Very low	29.5	Very low	212 Å²	212	125.7 Å²	125.7	92%	0.922	65%	0.648	S	S	*	*			trans	-67.6	77.9	176.7	-70.4	175.2	177.4	175.7	0	110	R41	K39-R41 PolarHBondContact O-N 3.23Å
40	H	35.2	Very low	29.4	Very low	92 Å²	92	123.7 Å²	123.7	43%	0.426	65%	0.647	S	S	.	*			trans	-81.9	115.2	174.9	-65.7	-77	0	0	0	109.5	G38 L42 Y129	G38-H40 PolarHBondContact O-CD2 3.17Å; G38-H40 PolarHBondContact O-N 2.78Å; H40-L42 PolarHBondContact O-N 2.91Å; H40-Y129 HydrophobicContact CB-CE2 4.24Å
41	R	32.7	Very low	29.4	Very low	198 Å²	198	125.2 Å²	125.2	75%	0.747	65%	0.649	S	S	*	*			trans	-85.5	93.8	-173.5	-171.4	-179.7	-172.9	-172.2	2.3	109.4	K39 Q43	K39-R41 PolarHBondContact O-N 3.23Å; R41-Q43 HydrophobicContact CG-CG 4.23Å; R41-Q43 PolarHBondContact O-N 2.84Å
42	L	34.5	Very low	29.5	Very low	52 Å²	52	125.6 Å²	125.6	27%	0.272	65%	0.649	S	S	.	*			trans	-60.8	122.3	164.4	-169.2	86.9	0	0	0	109	H40 C44 Y129 L166	H40-L42 PolarHBondContact O-N 2.91Å; L42-C44 WeakPolarHBondContact CD2-SG 3.04Å; L42-Y129 HydrophobicContact CD1-CD2 4.18Å; L42-L166 HydrophobicContact CD1-CD2 4.23Å; L42-L166 HydrophobicContact CD2-CD1 3.13Å; L42-L166 HydrophobicContact CD2-CD2 3.41Å; L42-L166 VanDerWaalsContact CD2-CD2 3.41Å; L42-L166 HydrophobicContact CD2-CG 3.84Å; L42-L166 HydrophobicContact CG-CD2 4.45Å
43	Q	32.9	Very low	29.3	Very low	114 Å²	114	130 Å²	130	53%	0.533	66%	0.659	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.5	122.1	171.7	-68.1	-168.5	24.5	0	0	109.3	R41 C127 E128	R41-Q43 HydrophobicContact CG-CG 4.23Å; R41-Q43 PolarHBondContact O-N 2.84Å; Q43-C127 WeakPolarHBondContact O-CA 3.35Å; Q43-E128 PolarHBondContact N-O 3.46Å; Q43-E128 PolarHBondContact O-N 3.34Å
44	C	35.3	Very low	29.2	Very low	42 Å²	42	134.3 Å²	134.3	28%	0.284	67%	0.67	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.1	123.6	175.3	-65.1	0	0	0	0	108.9	L42 V125 R126 C127 L162	L42-C44 WeakPolarHBondContact CD2-SG 3.04Å; C44-V125 HydrophobicContact CB-CG1 4.34Å; C44-R126 CarbonylContact C-O 3.55Å; C44-R126 VanDerWaalsContact CA-O 3.3Å; C44-R126 WeakPolarHBondContact CA-O 3.23Å; C44-C127 HydrophobicContact CB-CB 4.25Å; C44-C127 WeakPolarHBondContact CB-SG 3.45Å; C44-C127 WeakPolarHBondContact SG-CB 3.4Å; C44-C127 CovalentContact SG-SG 2.04Å; C44-C127 PolarHBondContact SG-SG 2.81Å; C44-L162 HydrophobicContact CB-CD2 4.24Å; C44-L162 VanDerWaalsContact SG-CD2 3.51Å
45	S	33.1	Very low	29	Very low	73 Å²	73	132.9 Å²	132.9	51%	0.51	67%	0.669	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.1	131.3	175.6	-170.9	0	0	0	0	109.4	R126	S45-R126 PolarHBondContact N-O 2.9Å; S45-R126 PolarHBondContact O-N 2.69Å
46	A	32.7	Very low	28.9	Very low	48 Å²	48	126.6 Å²	126.6	40%	0.397	66%	0.66	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.1	114.2	170.1	0	0	0	0	0	108	K48	A46-K48 PolarHBondContact O-N 2.94Å; A46-K48 VanDerWaalsContact O-N 3.1Å
47	H	36.9	Very low	29	Very low	135 Å²	135	130.6 Å²	130.6	63%	0.625	66%	0.661	S	S	*	*			trans	-75.4	101.4	170.2	-118.5	-99.3	0	0	0	108	N49	H47-N49 PolarHBondContact O-N 3.17Å
48	K	30.1	Very low	28.9	Very low	186 Å²	186	133.3 Å²	133.3	81%	0.809	66%	0.655	S	S	*	*			trans	-81.2	105.7	168.5	-74.4	-178.9	-179.9	177.4	0	107.7	A46 S50	A46-K48 PolarHBondContact O-N 2.94Å; A46-K48 VanDerWaalsContact O-N 3.1Å; K48-S50 PolarHBondContact O-N 3.38Å
49	N	32.7	Very low	28.8	Very low	145 Å²	145	134.8 Å²	134.8	78%	0.775	67%	0.67	S	S	*	*			trans	-64.1	127.4	159.4	-87.9	-8.4	0	0	0	108	H47	H47-N49 PolarHBondContact O-N 3.17Å
50	S	24.2	Very low	28.8	Very low	110 Å²	110	126.8 Å²	126.8	77%	0.769	64%	0.64	S	S	*	*	S	Bend	trans	-50.9	146.5	176.5	-175.8	0	0	0	0	111.2	K48	K48-S50 PolarHBondContact O-N 3.38Å
51	L	24.1	Very low	28.3	Very low	141 Å²	141	126.1 Å²	126.1	74%	0.738	66%	0.658	S	S	*	*			trans	86.9	146.4	-169.5	-65.6	121.7	0	0	0	115.2
52	F	26.6	Very low	28.1	Very low	177 Å²	177	126.3 Å²	126.3	78%	0.776	67%	0.665	S	S	*	*			trans	92.9	60	178	-53.7	-77	0	0	0	116.9
53	K	22.1	Very low	27.7	Very low	178 Å²	178	135.7 Å²	135.7	77%	0.774	70%	0.696	S	S	*	*			trans	-55.6	131	137.9	-128.2	172.8	-177.2	179.7	0	107.3
54	Y	23.2	Very low	27.2	Very low	189 Å²	189	133.9 Å²	133.9	74%	0.741	71%	0.708	S	S	*	*			trans	73.1	102.3	177	-48.3	-84.5	0	0	0	116
55	M	22	Very low	26.8	Very low	183 Å²	183	136.1 Å²	136.1	90%	0.901	72%	0.724	S	S	*	*			trans	179	149.5	135.7	-98.5	171.6	-175.2	0	0	113
56	P	22.8	Very low	26.7	Very low	114 Å²	114	137.8 Å²	137.8	74%	0.74	73%	0.732	S	S	*	*			trans	-78.4	143.4	-166.8	30.8	-34.1	0	0	0	114.2	R58	P56-R58 PolarHBondContact O-N 3.1Å; P56-R58 VanDerWaalsContact O-N 3.14Å
57	I	25.8	Very low	26.5	Very low	161 Å²	161	140.4 Å²	140.4	83%	0.826	74%	0.743	S	S	*	*			trans	-67.6	101.5	178.1	-56.1	166.4	0	0	0	109.1
58	R	24.8	Very low	26.1	Very low	214 Å²	214	141.4 Å²	141.4	81%	0.808	75%	0.746	S	S	*	*			trans	-114.2	133.7	166.5	-87.7	-173.6	167.6	162.1	-2.4	110.3	P56	P56-R58 PolarHBondContact O-N 3.1Å; P56-R58 VanDerWaalsContact O-N 3.14Å
59	G	24.4	Very low	26	Very low	67 Å²	67	134.7 Å²	134.7	69%	0.691	72%	0.722	S	S	*	*			trans	-63.5	141	-153.2	0	0	0	0	0	117.8	G61	G59-G61 PolarHBondContact O-N 2.86Å
60	C	28.2	Very low	26	Very low	43 Å²	43	131.6 Å²	131.6	29%	0.291	71%	0.705	S	S	.	*			trans	-70.7	112.2	154.4	-70.4	0	0	0	0	108.4	F62 H158	C60-F62 PolarHBondContact O-N 3.21Å; C60-H158 WeakPolarHBondContact CB-NE2 3.45Å; C60-H158 PolarHBondContact SG-NE2 3.48Å
61	G	24.4	Very low	26.4	Very low	79 Å²	79	129.1 Å²	129.1	81%	0.814	68%	0.683	S	S	*	*			trans	-67.7	99.7	178.5	0	0	0	0	0	111.9	G59	G59-G61 PolarHBondContact O-N 2.86Å
62	F	29.9	Very low	26.6	Very low	202 Å²	202	125 Å²	125	89%	0.886	67%	0.669	S	S	*	*			trans	-91.6	92	155.7	-91.9	-87.3	0	0	0	108.2	C60 G64	C60-F62 PolarHBondContact O-N 3.21Å; F62-G64 PolarHBondContact O-N 3.4Å
63	R	25.2	Very low	26.8	Very low	248 Å²	248	116.9 Å²	116.9	94%	0.936	64%	0.635	S	S	*	*			trans	-72.8	107.8	166.7	-129.4	179.8	175.4	-166.1	-1.8	107.2
64	G	23.7	Very low	27.4	Very low	76 Å²	76	112 Å²	112	78%	0.784	62%	0.617	S	S	*	*			trans	33.5	97.7	160.9	0	0	0	0	0	118.9	F62	F62-G64 PolarHBondContact O-N 3.4Å
65	S	25.7	Very low	27.8	Very low	89 Å²	89	105.5 Å²	105.5	62%	0.622	60%	0.602	S	S	*	*			trans	-150.1	103	146.6	-173.7	0	0	0	0	107.8	S69	S65-S69 PolarHBondContact OG-OG 2.81Å
66	T	30.9	Very low	28.2	Very low	108 Å²	108	99.6 Å²	99.6	66%	0.663	58%	0.582	S	S	*	*			trans	-60.6	130.8	-173.8	42.4	0	0	0	0	110.8	K68 S69	T66-K68 PolarHBondContact O-N 2.7Å; T66-S69 PolarHBondContact O-N 2.76Å
67	T	29.8	Very low	28.5	Very low	103 Å²	103	95.4 Å²	95.4	63%	0.632	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	20.2	-28.2	149.7	-24.2	0	0	0	0	121.4
68	K	28	Very low	28.8	Very low	157 Å²	157	93.4 Å²	93.4	68%	0.683	54%	0.543	S	S	*	.	H	α-helix	trans	-72.1	-34.9	172.8	-69.1	-177.5	174.8	-176.6	0	114	T66 I70 A72	T66-K68 PolarHBondContact O-N 2.7Å; K68-I70 VanDerWaalsContact C-N 3.34Å; K68-I70 PolarHBondContact O-N 2.9Å; K68-A72 VanDerWaalsContact O-CB 3.28Å; K68-A72 WeakPolarHBondContact O-CB 2.86Å; K68-A72 PolarHBondContact O-N 3.12Å
69	S	28.6	Very low	29	Very low	45 Å²	45	86.7 Å²	86.7	32%	0.315	53%	0.525	S	S	.	.	H	α-helix	trans	-71.8	-28.3	-176.9	45.9	0	0	0	0	113.2	S65 T66 G73	S65-S69 PolarHBondContact OG-OG 2.81Å; T66-S69 PolarHBondContact O-N 2.76Å; S69-G73 PolarHBondContact O-N 3.26Å
70	I	32.4	Very low	29.1	Very low	80 Å²	80	84.8 Å²	84.8	41%	0.41	51%	0.506	S	S	.	.	H	α-helix	trans	-79	-38.4	179.8	-60.8	171.6	0	0	0	111.1	K68 G73 L74 F165	K68-I70 VanDerWaalsContact C-N 3.34Å; K68-I70 PolarHBondContact O-N 2.9Å; I70-G73 PolarHBondContact O-N 3.44Å; I70-L74 PolarHBondContact O-N 3.19Å; I70-F165 HydrophobicContact CG2-CD2 3.88Å; I70-F165 HydrophobicContact CG2-CE2 3.52Å
71	L	31.4	Very low	29.2	Very low	58 Å²	58	86.3 Å²	86.3	30%	0.304	51%	0.506	S	S	.	.	H	α-helix	trans	-70.7	-35.4	173.1	-144.6	82.6	0	0	0	111.5	G73 A75 Y180	L71-G73 VanDerWaalsContact C-N 3.28Å; L71-G73 PolarHBondContact O-N 2.77Å; L71-A75 VanDerWaalsContact O-CB 3.29Å; L71-A75 WeakPolarHBondContact O-CB 3.45Å; L71-A75 PolarHBondContact O-N 3.25Å; L71-Y180 HydrophobicContact CD2-CD2 4.33Å; L71-Y180 HydrophobicContact CD2-CE2 4.18Å
72	A	29.3	Very low	29.4	Very low	54 Å²	54	90.7 Å²	90.7	45%	0.446	50%	0.502	S	S	.	.	H	α-helix	trans	-64.8	-30.9	169.2	0	0	0	0	0	112	K68 A76	K68-A72 VanDerWaalsContact O-CB 3.28Å; K68-A72 WeakPolarHBondContact O-CB 2.86Å; K68-A72 PolarHBondContact O-N 3.12Å; A72-A76 WeakPolarHBondContact O-CA 3.44Å; A72-A76 WeakPolarHBondContact O-CB 3.49Å; A72-A76 PolarHBondContact O-N 2.92Å
73	G	30	Very low	29.2	Very low	6 Å²	6	84.8 Å²	84.8	6%	0.062	49%	0.491	C	S	.	.	H	α-helix	trans	-69.2	-39.8	176.7	0	0	0	0	0	114.3	S69 I70 L71 G77 H92	S69-G73 PolarHBondContact O-N 3.26Å; I70-G73 PolarHBondContact O-N 3.44Å; L71-G73 VanDerWaalsContact C-N 3.28Å; L71-G73 PolarHBondContact O-N 2.77Å; G73-G77 PolarHBondContact O-N 2.74Å; G73-H92 WeakPolarHBondContact CA-CE1 3.38Å; G73-H92 WeakPolarHBondContact CA-NE2 3.49Å
74	L	35.1	Very low	29.3	Very low	77 Å²	77	76.5 Å²	76.5	40%	0.403	47%	0.468	S	S	.	.	H	α-helix	trans	-76.7	-36.9	175.7	-78.7	160.8	0	0	0	112.2	I70 Y78 F165	I70-L74 PolarHBondContact O-N 3.19Å; L74-Y78 PolarHBondContact O-N 2.96Å; L74-F165 HydrophobicContact CD1-CE2 4.4Å; L74-F165 HydrophobicContact CD1-CZ 4.06Å
75	A	31.4	Very low	29.4	Very low	52 Å²	52	82.8 Å²	82.8	43%	0.43	47%	0.474	S	S	.	.	H	α-helix	trans	-70.7	-39.1	173	0	0	0	0	0	112.5	L71 Y78 V79	L71-A75 VanDerWaalsContact O-CB 3.29Å; L71-A75 WeakPolarHBondContact O-CB 3.45Å; L71-A75 PolarHBondContact O-N 3.25Å; A75-Y78 PolarHBondContact O-N 3.09Å; A75-V79 VanDerWaalsContact O-CG2 3.29Å; A75-V79 WeakPolarHBondContact O-CG2 3.33Å; A75-V79 PolarHBondContact O-N 3.31Å
76	A	30.1	Very low	29.4	Very low	58 Å²	58	82.1 Å²	82.1	48%	0.479	48%	0.481	S	S	.	.	H	α-helix	trans	-74.1	-27.1	175.7	0	0	0	0	0	112.7	A72 Y78 G80	A72-A76 WeakPolarHBondContact O-CA 3.44Å; A72-A76 WeakPolarHBondContact O-CB 3.49Å; A72-A76 PolarHBondContact O-N 2.92Å; A76-Y78 VanDerWaalsContact C-N 3.34Å; A76-G80 WeakPolarHBondContact O-CA 3.27Å; A76-G80 PolarHBondContact O-N 2.93Å
77	G	30.4	Very low	29.1	Very low	26 Å²	26	83.2 Å²	83.2	27%	0.268	48%	0.481	S	S	.	.	H	α-helix	trans	-65.5	-38.5	168.4	0	0	0	0	0	112.1	G73 Y81	G73-G77 PolarHBondContact O-N 2.74Å; G77-Y81 VanDerWaalsContact O-CB 3.29Å; G77-Y81 WeakPolarHBondContact O-CB 3.33Å; G77-Y81 PolarHBondContact O-N 3.07Å; G77-Y81 VanDerWaalsContact O-N 3.12Å
78	Y	31.4	Very low	28.9	Very low	120 Å²	120	83.4 Å²	83.4	47%	0.471	49%	0.486	S	S	.	.	H	α-helix	trans	-76.3	-34.1	178.8	-160.6	-102.6	0	0	0	113.3	L74 A75 A76 M138	L74-Y78 PolarHBondContact O-N 2.96Å; A75-Y78 PolarHBondContact O-N 3.09Å; A76-Y78 VanDerWaalsContact C-N 3.34Å; Y78-M138 PolarHBondContact OH-O 3.14Å
79	V	28.2	Very low	28.8	Very low	73 Å²	73	84.1 Å²	84.1	44%	0.442	49%	0.485	S	S	.	.	H	α-helix	trans	-79.8	-37	174.3	176.4	0	0	0	0	111.6	A75 K82 A83 W184	A75-V79 VanDerWaalsContact O-CG2 3.29Å; A75-V79 WeakPolarHBondContact O-CG2 3.33Å; A75-V79 PolarHBondContact O-N 3.31Å; V79-K82 PolarHBondContact O-N 3.21Å; V79-A83 PolarHBondContact O-N 3.26Å; V79-W184 HydrophobicContact CG1-CH2 4.41Å; V79-W184 HydrophobicContact CG1-CZ3 4.43Å
80	G	27.6	Very low	28.9	Very low	27 Å²	27	85.7 Å²	85.7	28%	0.278	49%	0.489	S	S	.	.	H	α-helix	trans	-66.4	-38.8	177.3	0	0	0	0	0	112.9	A76 K82 A83 T84	A76-G80 WeakPolarHBondContact O-CA 3.27Å; A76-G80 PolarHBondContact O-N 2.93Å; G80-K82 VanDerWaalsContact C-N 3.28Å; G80-K82 PolarHBondContact O-N 3.37Å; G80-A83 PolarHBondContact O-N 3.44Å; G80-T84 PolarHBondContact O-N 2.93Å; G80-T84 PolarHBondContact O-OG1 3.22Å
81	Y	28.7	Very low	28.8	Very low	75 Å²	75	86.8 Å²	86.8	29%	0.294	49%	0.494	S	S	.	.	H	α-helix	trans	-64.3	-28.7	174.1	-177.7	-99.9	0	0	0	113.3	G77 L90 N140 I141 T142	G77-Y81 VanDerWaalsContact O-CB 3.29Å; G77-Y81 WeakPolarHBondContact O-CB 3.33Å; G77-Y81 PolarHBondContact O-N 3.07Å; G77-Y81 VanDerWaalsContact O-N 3.12Å; Y81-L90 HydrophobicContact CD2-CD1 4.3Å; Y81-N140 WeakPolarHBondContact CE1-O 3.48Å; Y81-I141 HydrophobicContact CE1-CG1 4.47Å; Y81-T142 PolarHBondContact OH-N 2.86Å; Y81-T142 PolarHBondContact OH-O 3.14Å; Y81-T142 PolarHBondContact OH-OG1 3.05Å
82	K	30.1	Very low	28.8	Very low	170 Å²	170	86.9 Å²	86.9	74%	0.739	49%	0.493	S	S	*	.	H	α-helix	trans	-79.1	-21.5	171.6	-81.4	-152.4	177.5	-172.7	0	113.7	V79 G80	V79-K82 PolarHBondContact O-N 3.21Å; G80-K82 VanDerWaalsContact C-N 3.28Å; G80-K82 PolarHBondContact O-N 3.37Å
83	A	26.1	Very low	28.8	Very low	78 Å²	78	91.3 Å²	91.3	65%	0.645	51%	0.509	S	S	*	.	H	α-helix	trans	-89.2	-29.1	177.4	0	0	0	0	0	112.8	V79 G80 K85	V79-A83 PolarHBondContact O-N 3.26Å; G80-A83 PolarHBondContact O-N 3.44Å; A83-K85 PolarHBondContact O-N 3.27Å
84	T	27.1	Very low	28.7	Very low	75 Å²	75	94 Å²	94	46%	0.46	54%	0.536	S	S	.	.			trans	-94.4	62	-178.6	55.1	0	0	0	0	112.1	G80 G86	G80-T84 PolarHBondContact O-N 2.93Å; G80-T84 PolarHBondContact O-OG1 3.22Å; T84-G86 PolarHBondContact O-N 3.09Å
85	K	25.4	Very low	28.6	Very low	208 Å²	208	95 Å²	95	90%	0.904	54%	0.541	S	S	*	.	S	Bend	trans	-59.4	95	153.5	-81.6	-168.2	176.6	-176.6	0	108	A83	A83-K85 PolarHBondContact O-N 3.27Å
86	G	24.8	Very low	28.7	Very low	74 Å²	74	97.3 Å²	97.3	76%	0.763	54%	0.539	S	S	*	.	S	Bend	trans	111.9	3.8	157.8	0	0	0	0	0	119	T84	T84-G86 PolarHBondContact O-N 3.09Å
87	I	24.4	Very low	28.9	Very low	131 Å²	131	99 Å²	99	67%	0.672	53%	0.533	S	S	*	.			trans	-137.8	107.3	-175	-53.5	177.1	0	0	0	112
88	S	25.9	Very low	29	Very low	107 Å²	107	101.7 Å²	101.7	75%	0.748	54%	0.536	S	S	*	.			trans	45.4	115	137.3	-54.5	0	0	0	0	119.9
89	R	27.5	Very low	29.1	Very low	173 Å²	173	97.3 Å²	97.3	65%	0.653	52%	0.522	S	S	*	.			trans	59.5	101.2	154.6	-66.8	179	167.2	157.4	0.9	115.9	M91	R89-M91 HydrophobicContact CB-CG 4.46Å; R89-M91 PolarHBondContact O-N 2.68Å
90	L	30.4	Very low	29.3	Very low	77 Å²	77	95.5 Å²	95.5	40%	0.403	52%	0.515	S	S	.	.			trans	-58.9	111.6	158.7	-116.1	91.2	0	0	0	108.3	Y81 Y97	Y81-L90 HydrophobicContact CD2-CD1 4.3Å; L90-Y97 HydrophobicContact CB-CD2 3.84Å; L90-Y97 HydrophobicContact CB-CG 4.17Å; L90-Y97 HydrophobicContact CD2-CD2 4.01Å; L90-Y97 HydrophobicContact CD2-CE2 4.47Å; L90-Y97 HydrophobicContact CD2-CG 4.17Å; L90-Y97 PolarHBondContact O-N 3.25Å; L90-Y97 VanDerWaalsContact O-N 3.09Å
91	M	28.7	Very low	29.5	Very low	104 Å²	104	98.7 Å²	98.7	51%	0.512	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.1	171.8	-79.7	-176	147.6	0	0	108.8	R89 I95 R96	R89-M91 HydrophobicContact CB-CG 4.46Å; R89-M91 PolarHBondContact O-N 2.68Å; M91-I95 WeakPolarHBondContact CA-O 3.32Å; M91-R96 HydrophobicContact CE-CG 3.69Å; M91-R96 HydrophobicContact CG-CG 4.37Å
92	H	33	Very low	29.6	Very low	59 Å²	59	97 Å²	97	27%	0.273	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	120.8	168.4	-173.1	58.1	0	0	0	108.7	G73 G94 I95 Y97	G73-H92 WeakPolarHBondContact CA-CE1 3.38Å; G73-H92 WeakPolarHBondContact CA-NE2 3.49Å; H92-G94 PolarHBondContact O-N 3.45Å; H92-G94 VanDerWaalsContact O-N 3.14Å; H92-I95 PolarHBondContact N-O 3.44Å; H92-I95 WeakPolarHBondContact O-CB 3.36Å; H92-I95 PolarHBondContact O-N 3.13Å; H92-Y97 HydrophobicContact CB-CE2 3.95Å
93	N	28.6	Very low	29.6	Very low	148 Å²	148	90.4 Å²	90.4	79%	0.791	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	34	-174.1	-68	-12.2	0	0	0	114.6	I95	N93-I95 VanDerWaalsContact C-N 3.33Å
94	G	28.5	Very low	29.9	Very low	61 Å²	61	94.6 Å²	94.6	63%	0.629	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.9	-1.5	-177.5	0	0	0	0	0	115.3	H92	H92-G94 PolarHBondContact O-N 3.45Å; H92-G94 VanDerWaalsContact O-N 3.14Å
95	I	32.6	Very low	30.1	Very low	99 Å²	99	95.9 Å²	95.9	51%	0.508	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	121.7	177.5	-54.2	176.7	0	0	0	109.2	M91 H92 N93	M91-I95 WeakPolarHBondContact CA-O 3.32Å; H92-I95 PolarHBondContact N-O 3.44Å; H92-I95 WeakPolarHBondContact O-CB 3.36Å; H92-I95 PolarHBondContact O-N 3.13Å; N93-I95 VanDerWaalsContact C-N 3.33Å
96	R	33.5	Very low	30.5	Very low	101 Å²	101	91.6 Å²	91.6	38%	0.381	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	125.8	177	-67.2	-179.8	-178.8	-157.1	1.7	109.8	M91 Y98	M91-R96 HydrophobicContact CE-CG 3.69Å; M91-R96 HydrophobicContact CG-CG 4.37Å; R96-Y98 HydrophobicContact CB-CD2 4.21Å; R96-Y98 HydrophobicContact CB-CE2 3.48Å; R96-Y98 VanDerWaalsContact CB-CE2 3.48Å; R96-Y98 VanDerWaalsContact CD-OH 3.25Å; R96-Y98 WeakPolarHBondContact CD-OH 3.33Å; R96-Y98 WeakPolarHBondContact O-CD2 3.26Å
97	Y	34.1	Very low	30.8	Very low	93 Å²	93	94.3 Å²	94.3	37%	0.365	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-88.4	130.8	169.7	-66.5	-95.2	0	0	0	109.6	L90 H92	L90-Y97 HydrophobicContact CB-CD2 3.84Å; L90-Y97 HydrophobicContact CB-CG 4.17Å; L90-Y97 HydrophobicContact CD2-CD2 4.01Å; L90-Y97 HydrophobicContact CD2-CE2 4.47Å; L90-Y97 HydrophobicContact CD2-CG 4.17Å; L90-Y97 PolarHBondContact O-N 3.25Å; L90-Y97 VanDerWaalsContact O-N 3.09Å; H92-Y97 HydrophobicContact CB-CE2 3.95Å
98	Y	33.2	Very low	31.2	Very low	82 Å²	82	92 Å²	92	32%	0.322	48%	0.479	S	S	.	.			trans	-116.9	145.5	179.3	-66.3	-92.2	0	0	0	110.6	R96 A100 Y103	R96-Y98 HydrophobicContact CB-CD2 4.21Å; R96-Y98 HydrophobicContact CB-CE2 3.48Å; R96-Y98 VanDerWaalsContact CB-CE2 3.48Å; R96-Y98 VanDerWaalsContact CD-OH 3.25Å; R96-Y98 WeakPolarHBondContact CD-OH 3.33Å; R96-Y98 WeakPolarHBondContact O-CD2 3.26Å; Y98-A100 PolarHBondContact O-N 2.89Å; Y98-Y103 HydrophobicContact CD2-CD2 4.32Å; Y98-Y103 HydrophobicContact CD2-CE2 4.07Å; Y98-Y103 HydrophobicContact CG-CD2 4.36Å
99	P	32	Very low	31.7	Very low	29 Å²	29	91.5 Å²	91.5	19%	0.188	47%	0.474	C	S	.	.			trans	-51.9	138.3	163	-18.8	27.5	0	0	0	110.4	S101 S102 Y103 M143	P99-S101 PolarHBondContact O-N 3.25Å; P99-S102 WeakPolarHBondContact CB-OG 3.32Å; P99-S102 WeakPolarHBondContact CG-OG 3.48Å; P99-S102 PolarHBondContact O-N 3.1Å; P99-Y103 PolarHBondContact O-N 2.87Å; P99-Y103 VanDerWaalsContact O-N 3.14Å; P99-M143 HydrophobicContact CB-CE 3.97Å; P99-M143 HydrophobicContact CB-CG 4.41Å; P99-M143 HydrophobicContact CB-SD 3.36Å; P99-M143 WeakPolarHBondContact CB-SD 2.97Å; P99-M143 HydrophobicContact CG-SD 3.49Å; P99-M143 WeakPolarHBondContact CG-SD 3.15Å
100	A	33.8	Very low	31.7	Very low	35 Å²	35	87.6 Å²	87.6	29%	0.289	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-30	179.4	0	0	0	0	0	112.9	Y98 K151 I153	Y98-A100 PolarHBondContact O-N 2.89Å; A100-K151 HydrophobicContact CB-CB 4.28Å; A100-I153 HydrophobicContact CB-CD1 3.9Å
101	S	30.7	Very low	31.7	Very low	93 Å²	93	93.5 Å²	93.5	65%	0.65	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-21.3	175.8	56.5	0	0	0	0	114.6	P99	P99-S101 PolarHBondContact O-N 3.25Å
102	S	30.9	Very low	31.7	Very low	41 Å²	41	92.2 Å²	92.2	29%	0.287	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-15.4	-179.1	-49	0	0	0	0	112.7	P99 Y104 S105	P99-S102 WeakPolarHBondContact CB-OG 3.32Å; P99-S102 WeakPolarHBondContact CG-OG 3.48Å; P99-S102 PolarHBondContact O-N 3.1Å; S102-Y104 PolarHBondContact O-N 3.01Å; S102-S105 PolarHBondContact O-N 2.96Å
103	Y	31.1	Very low	31.5	Very low	31 Å²	31	98.1 Å²	98.1	12%	0.122	52%	0.52	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.3	-173.9	-148	-81.6	0	0	0	113.3	Y98 P99 Y107 R126 I153 E155	Y98-Y103 HydrophobicContact CD2-CD2 4.32Å; Y98-Y103 HydrophobicContact CD2-CE2 4.07Å; Y98-Y103 HydrophobicContact CG-CD2 4.36Å; P99-Y103 PolarHBondContact O-N 2.87Å; P99-Y103 VanDerWaalsContact O-N 3.14Å; Y103-Y107 HydrophobicContact CE1-CD2 4.4Å; Y103-R126 VanDerWaalsContact CD1-NH1 3.29Å; Y103-I153 HydrophobicContact CD2-CD1 4.11Å; Y103-I153 HydrophobicContact CE2-CG2 4.25Å; Y103-I153 HydrophobicContact CG-CD1 4.33Å; Y103-E155 WeakPolarHBondContact CE1-OE1 3.43Å; Y103-E155 WeakPolarHBondContact OH-CG 3.36Å; Y103-E155 PolarHBondContact OH-OE1 2.94Å
104	Y	32.2	Very low	31.4	Very low	166 Å²	166	96 Å²	96	65%	0.651	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-12.1	-177.1	-77.9	-79.4	0	0	0	114.2	S102	S102-Y104 PolarHBondContact O-N 3.01Å
105	S	30.1	Very low	31.3	Very low	102 Å²	102	98.1 Å²	98.1	71%	0.713	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-25.5	-175.3	-168.5	0	0	0	0	113.9	S102	S102-S105 PolarHBondContact O-N 2.96Å
106	D	34.1	Very low	31.1	Very low	118 Å²	118	99.4 Å²	99.4	63%	0.631	53%	0.532	S	S	*	.	S	Bend	trans	-103.3	3.6	178.7	-73.4	-27	0	0	0	112.9	N108	D106-N108 PolarHBondContact O-N 2.83Å
107	Y	31.5	Very low	30.7	Very low	131 Å²	131	104.5 Å²	104.5	51%	0.514	55%	0.553	S	S	.	*			trans	-80.4	68.5	176.1	-147.5	-84.8	0	0	0	110.1	Y103 P109	Y103-Y107 HydrophobicContact CE1-CD2 4.4Å; Y107-P109 VanDerWaalsContact O-CD 3.27Å; Y107-P109 WeakPolarHBondContact O-CD 3.42Å
108	N	32.4	Very low	30.4	Very low	81 Å²	81	106.1 Å²	106.1	43%	0.433	58%	0.578	S	S	.	*			trans	-78.5	114.1	167.6	-166.5	-10	0	0	0	107.9	D106 S110 Y111	D106-N108 PolarHBondContact O-N 2.83Å; N108-S110 PolarHBondContact O-N 2.85Å; N108-S110 WeakPolarHBondContact OD1-CB 3.39Å; N108-S110 PolarHBondContact OD1-N 3.34Å; N108-S110 PolarHBondContact OD1-OG 3.41Å; N108-Y111 HydrophobicContact CB-CD2 4.14Å; N108-Y111 PolarHBondContact O-N 3.19Å
109	P	36	Very low	30.3	Very low	98 Å²	98	106.9 Å²	106.9	64%	0.636	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-9.4	174.2	25.1	-33.6	0	0	0	112.7	Y107 S112	Y107-P109 VanDerWaalsContact O-CD 3.27Å; Y107-P109 WeakPolarHBondContact O-CD 3.42Å; P109-S112 PolarHBondContact O-OG 2.8Å
110	S	29.1	Very low	30.4	Very low	90 Å²	90	109 Å²	109	63%	0.629	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-8.8	173.5	-52.3	0	0	0	0	115.2	N108	N108-S110 PolarHBondContact O-N 2.85Å; N108-S110 WeakPolarHBondContact OD1-CB 3.39Å; N108-S110 PolarHBondContact OD1-N 3.34Å; N108-S110 PolarHBondContact OD1-OG 3.41Å
111	Y	28.7	Very low	30.4	Very low	202 Å²	202	113 Å²	113	79%	0.792	63%	0.631	S	S	*	*	S	Bend	trans	-102.3	-0.2	175.9	-90.1	-82.5	0	0	0	114.4	N108 Q113	N108-Y111 HydrophobicContact CB-CD2 4.14Å; N108-Y111 PolarHBondContact O-N 3.19Å; Y111-Q113 VanDerWaalsContact C-N 3.34Å; Y111-Q113 PolarHBondContact O-N 2.57Å; Y111-Q113 VanDerWaalsContact O-N 3.09Å
112	S	29.9	Very low	30.9	Very low	76 Å²	76	113.4 Å²	113.4	53%	0.531	62%	0.624	S	S	.	*	S	Bend	trans	-69.3	100.1	151	48.2	0	0	0	0	106.6	P109 P114	P109-S112 PolarHBondContact O-OG 2.8Å; S112-P114 WeakPolarHBondContact O-CD 3.33Å
113	Q	29.2	Very low	31.3	Very low	184 Å²	184	115.4 Å²	115.4	86%	0.86	63%	0.634	S	S	*	*			trans	-42.3	119.2	175.6	-80.5	-169.4	-21.7	0	0	109.4	Y111 S115	Y111-Q113 VanDerWaalsContact C-N 3.34Å; Y111-Q113 PolarHBondContact O-N 2.57Å; Y111-Q113 VanDerWaalsContact O-N 3.09Å; Q113-S115 PolarHBondContact O-N 3.21Å
114	P	26.6	Very low	31.9	Very low	102 Å²	102	119.3 Å²	119.3	66%	0.662	65%	0.648	S	S	*	*			trans	-68.6	121.4	170.6	28.6	-29.3	0	0	0	106.4	S112	S112-P114 WeakPolarHBondContact O-CD 3.33Å
115	S	26.7	Very low	32.4	Very low	106 Å²	106	111.5 Å²	111.5	74%	0.741	62%	0.618	S	S	*	*			trans	44.1	96.9	145.4	59.9	0	0	0	0	117	Q113	Q113-S115 PolarHBondContact O-N 3.21Å
116	T	26.9	Very low	33.1	Very low	127 Å²	127	108.2 Å²	108.2	78%	0.779	59%	0.59	S	S	*	*	S	Bend	trans	-147.2	116.4	139.7	-19.1	0	0	0	0	106.7
117	Y	25.7	Very low	33.5	Very low	208 Å²	208	102.7 Å²	102.7	82%	0.816	56%	0.56	S	S	*	*	S	Bend	trans	80.5	89.9	-171.4	-67.1	-92.8	0	0	0	117.1	S119	Y117-S119 PolarHBondContact O-N 3.31Å
118	S	28	Very low	34.1	Very low	127 Å²	127	99.1 Å²	99.1	89%	0.888	55%	0.548	S	S	*	.			trans	38.1	76.7	130.2	-179.5	0	0	0	0	115.9
119	S	31.7	Very low	34.8	Very low	98 Å²	98	96.4 Å²	96.4	69%	0.685	53%	0.532	S	S	*	.			trans	-150.7	135	165.5	45.6	0	0	0	0	111.4	Y117	Y117-S119 PolarHBondContact O-N 3.31Å
120	T	32.4	Very low	35.4	Very low	74 Å²	74	95.5 Å²	95.5	45%	0.454	52%	0.522	S	S	.	.			trans	-42.4	145.9	-179	28.1	0	0	0	0	114	M122	T120-M122 PolarHBondContact O-N 3.17Å
121	P	34.3	Very low	36.3	Very low	118 Å²	118	91.6 Å²	91.6	77%	0.766	49%	0.494	S	S	*	.			trans	-61.7	107.8	176.6	24.9	-31.9	0	0	0	109.7	V123	P121-V123 PolarHBondContact O-N 2.92Å
122	M	42	Very low	37.2	Very low	102 Å²	102	83 Å²	83	50%	0.502	46%	0.463	S	S	.	.			trans	-77.7	112.6	-177.8	-66.5	-173.6	173.1	0	0	110.1	T120 R124	T120-M122 PolarHBondContact O-N 3.17Å; M122-R124 PolarHBondContact O-N 3.02Å
123	V	39	Very low	38.2	Very low	83 Å²	83	86.6 Å²	86.6	50%	0.503	47%	0.471	S	S	.	.			trans	-73.4	109.4	170.3	179.2	0	0	0	0	108.4	P121 V125 C157	P121-V123 PolarHBondContact O-N 2.92Å; V123-V125 HydrophobicContact CG1-CG2 4.48Å; V123-C157 CarbonylContact O-C 3.24Å; V123-C157 VanDerWaalsContact O-C 3.24Å; V123-C157 VanDerWaalsContact O-O 3.05Å
124	R	44.4	Very low	39.2	Very low	113 Å²	113	82.3 Å²	82.3	43%	0.426	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-84.1	118.9	173.6	-63.5	-170.5	-174.6	-171.8	6.4	109.8	M122 E155	M122-R124 PolarHBondContact O-N 3.02Å; R124-E155 IonicContact NH1-OE2 3.53Å
125	V	41.4	Very low	40.1	Very low	1 Å²	1	80 Å²	80	1%	0.006	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	119.8	172.8	-178.8	0	0	0	0	107.6	C44 V123 E155 C156 F159 L162	C44-V125 HydrophobicContact CB-CG1 4.34Å; V123-V125 HydrophobicContact CG1-CG2 4.48Å; V125-E155 CarbonylContact O-C 3.55Å; V125-E155 WeakPolarHBondContact O-CA 3.39Å; V125-C156 PolarHBondContact N-O 3.12Å; V125-C156 PolarHBondContact O-N 2.77Å; V125-F159 HydrophobicContact CG1-CD2 4.24Å; V125-F159 HydrophobicContact CG2-CB 4Å; V125-F159 HydrophobicContact CG2-CD2 4.24Å; V125-L162 HydrophobicContact CG1-CD2 4.04Å
126	R	44.8	Very low	41	Very low	33 Å²	33	76.4 Å²	76.4	13%	0.125	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.9	175.6	176.8	173.7	165.1	160.7	-3	108.7	C44 S45 Y103 E128 I153 Y154 E155	C44-R126 CarbonylContact C-O 3.55Å; C44-R126 VanDerWaalsContact CA-O 3.3Å; C44-R126 WeakPolarHBondContact CA-O 3.23Å; S45-R126 PolarHBondContact N-O 2.9Å; S45-R126 PolarHBondContact O-N 2.69Å; Y103-R126 VanDerWaalsContact CD1-NH1 3.29Å; R126-E128 HydrophobicContact CG-CG 4.38Å; R126-E128 IonicContact CZ-OE1 3.07Å; R126-E128 IonicContact NE-OE1 2.76Å; R126-E128 PolarHBondContact NE-OE1 3.24Å; R126-E128 IonicContact NH2-OE1 2.7Å; R126-E128 PolarHBondContact NH2-OE1 3.27Å; R126-I153 HydrophobicContact CG-CG2 3.88Å; R126-Y154 CarbonylContact C-O 3.55Å; R126-Y154 WeakPolarHBondContact CA-O 3.34Å; R126-E155 HydrophobicContact CB-CG 4.48Å
127	C	43	Very low	41.9	Very low	2 Å²	2	75.6 Å²	75.6	1%	0.014	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	132	172	-64.8	0	0	0	0	110.1	Q43 C44 I153 Y154 L162	Q43-C127 WeakPolarHBondContact O-CA 3.35Å; C44-C127 HydrophobicContact CB-CB 4.25Å; C44-C127 WeakPolarHBondContact CB-SG 3.45Å; C44-C127 WeakPolarHBondContact SG-CB 3.4Å; C44-C127 CovalentContact SG-SG 2.04Å; C44-C127 PolarHBondContact SG-SG 2.81Å; C127-I153 WeakPolarHBondContact O-CA 3.25Å; C127-Y154 PolarHBondContact N-O 3.43Å; C127-Y154 PolarHBondContact O-N 2.85Å; C127-L162 HydrophobicContact CB-CD1 4.02Å; C127-L162 WeakPolarHBondContact SG-CD1 3.29Å; C127-L162 WeakPolarHBondContact SG-CD2 3.38Å
128	E	44.8	Very low	42.6	Very low	56 Å²	56	69 Å²	69	26%	0.262	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	132.3	177	-55.7	-170.4	178.1	0	0	108.1	Q43 R126 L152 I153	Q43-E128 PolarHBondContact N-O 3.46Å; Q43-E128 PolarHBondContact O-N 3.34Å; R126-E128 HydrophobicContact CG-CG 4.38Å; R126-E128 IonicContact CZ-OE1 3.07Å; R126-E128 IonicContact NE-OE1 2.76Å; R126-E128 PolarHBondContact NE-OE1 3.24Å; R126-E128 IonicContact NH2-OE1 2.7Å; R126-E128 PolarHBondContact NH2-OE1 3.27Å; E128-L152 WeakPolarHBondContact CA-O 3.3Å; E128-I153 HydrophobicContact CG-CG1 4.37Å
129	Y	46.3	Very low	43.2	Very low	25 Å²	25	64.7 Å²	64.7	10%	0.098	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	113.4	173.8	-179.3	-98.1	0	0	0	108.2	H40 L42 L131 E135 K151 L152 F170	H40-Y129 HydrophobicContact CB-CE2 4.24Å; L42-Y129 HydrophobicContact CD1-CD2 4.18Å; Y129-L131 HydrophobicContact CD1-CD2 4.47Å; Y129-L131 HydrophobicContact CD1-CG 4.39Å; Y129-L131 HydrophobicContact CE1-CD2 4.17Å; Y129-L131 HydrophobicContact CE1-CG 4.43Å; Y129-L131 PolarHBondContact O-N 3.13Å; Y129-E135 WeakPolarHBondContact CE1-OE2 3.25Å; Y129-E135 PolarHBondContact OH-OE1 2.79Å; Y129-E135 PolarHBondContact OH-OE2 2.86Å; Y129-K151 CarbonylContact O-C 3.55Å; Y129-K151 WeakPolarHBondContact O-CA 3.4Å; Y129-L152 HydrophobicContact CD1-CD1 4.16Å; Y129-L152 PolarHBondContact N-O 3.32Å; Y129-L152 PolarHBondContact O-N 2.58Å; Y129-F170 HydrophobicContact CD2-CZ 4.4Å; Y129-F170 AromaticContact CE2-CZ 3.95Å; Y129-F170 HydrophobicContact CE2-CZ 3.95Å
130	D	48.1	Very low	43.8	Very low	78 Å²	78	65.7 Å²	65.7	42%	0.417	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	119.2	170.3	-63.6	-57.5	0	0	0	108.4	P132 K151	D130-P132 WeakPolarHBondContact O-CD 3.43Å; D130-K151 VanDerWaalsContact OD1-CD 3.26Å; D130-K151 WeakPolarHBondContact OD1-CD 3.45Å; D130-K151 WeakPolarHBondContact OD1-CE 3.45Å; D130-K151 WeakPolarHBondContact OD1-CG 3.3Å; D130-K151 IonicContact OD1-NZ 2.69Å; D130-K151 PolarHBondContact OD1-NZ 3.25Å; D130-K151 IonicContact OD2-NZ 3.99Å
131	L	48.8	Very low	44.3	Very low	8 Å²	8	64.4 Å²	64.4	4%	0.042	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-70.6	121.6	173.9	-75.8	152.3	0	0	0	107.5	Y129 E135 M136 A149 T150 L152	Y129-L131 HydrophobicContact CD1-CD2 4.47Å; Y129-L131 HydrophobicContact CD1-CG 4.39Å; Y129-L131 HydrophobicContact CE1-CD2 4.17Å; Y129-L131 HydrophobicContact CE1-CG 4.43Å; Y129-L131 PolarHBondContact O-N 3.13Å; L131-E135 HydrophobicContact CD2-CB 4.12Å; L131-M136 HydrophobicContact CB-CG 3.79Å; L131-M136 WeakPolarHBondContact O-CE 3.11Å; L131-A149 WeakPolarHBondContact CD1-O 2.91Å; L131-T150 PolarHBondContact N-O 3.38Å; L131-L152 HydrophobicContact CD1-CD1 4.33Å; L131-L152 HydrophobicContact CD1-CD2 4.4Å; L131-L152 HydrophobicContact CD1-CG 3.92Å; L131-L152 HydrophobicContact CD2-CD1 4Å; L131-L152 HydrophobicContact CD2-CG 4.47Å; L131-L152 HydrophobicContact CG-CD1 4.21Å; L131-L152 HydrophobicContact CG-CG 4.17Å
132	P	47.9	Very low	44.7	Very low	22 Å²	22	61.6 Å²	61.6	14%	0.143	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-69.1	154.8	171.3	33.2	-37.6	0	0	0	110.4	D130 D134 E135 M136	D130-P132 WeakPolarHBondContact O-CD 3.43Å; P132-D134 WeakPolarHBondContact CB-OD1 3.43Å; P132-D134 WeakPolarHBondContact CG-OD1 3.03Å; P132-D134 PolarHBondContact O-N 3.25Å; P132-D134 VanDerWaalsContact O-N 3.17Å; P132-E135 VanDerWaalsContact CD-OE2 3.3Å; P132-E135 WeakPolarHBondContact CD-OE2 3.34Å; P132-E135 HydrophobicContact CG-CB 3.89Å; P132-E135 HydrophobicContact CG-CG 3.68Å; P132-E135 CarbonylContact O-C 3.56Å; P132-E135 WeakPolarHBondContact O-CA 3.34Å; P132-E135 WeakPolarHBondContact O-CB 3.39Å; P132-E135 PolarHBondContact O-N 3.22Å; P132-M136 WeakPolarHBondContact O-CG 3.44Å; P132-M136 PolarHBondContact O-N 2.04Å
133	E	51	Low	44.5	Very low	151 Å²	151	58.8 Å²	58.8	71%	0.706	30%	0.298	S	S	*	.	H	α-helix	trans	-58.7	-32.3	-169.7	-68.2	-173.1	165	0	0	113.9	M136 N137	E133-M136 HydrophobicContact CG-CE 4.44Å; E133-M136 PolarHBondContact O-N 2.84Å; E133-N137 VanDerWaalsContact O-CG 3.25Å; E133-N137 PolarHBondContact O-N 2.8Å; E133-N137 VanDerWaalsContact O-N 3.1Å; E133-N137 PolarHBondContact O-ND2 2.94Å; E133-N137 VanDerWaalsContact O-ND2 3.1Å
134	D	48.7	Very low	44.5	Very low	94 Å²	94	61.1 Å²	61.1	50%	0.503	32%	0.318	S	S	.	.	H	α-helix	trans	-64.2	-42.2	172.9	57.9	-40.3	0	0	0	111.8	P132 N137 M138	P132-D134 WeakPolarHBondContact CB-OD1 3.43Å; P132-D134 WeakPolarHBondContact CG-OD1 3.03Å; P132-D134 PolarHBondContact O-N 3.25Å; P132-D134 VanDerWaalsContact O-N 3.17Å; D134-N137 PolarHBondContact O-N 3.36Å; D134-M138 WeakPolarHBondContact O-CG 3.33Å; D134-M138 PolarHBondContact O-N 2.94Å
135	E	45.6	Very low	44.2	Very low	54 Å²	54	61 Å²	61	25%	0.252	33%	0.325	S	S	.	.	H	α-helix	trans	-70.7	-36.3	172.3	-69.8	-178.7	-173	0	0	112.3	Y129 L131 P132 N137 M138 V139	Y129-E135 WeakPolarHBondContact CE1-OE2 3.25Å; Y129-E135 PolarHBondContact OH-OE1 2.79Å; Y129-E135 PolarHBondContact OH-OE2 2.86Å; L131-E135 HydrophobicContact CD2-CB 4.12Å; P132-E135 VanDerWaalsContact CD-OE2 3.3Å; P132-E135 WeakPolarHBondContact CD-OE2 3.34Å; P132-E135 HydrophobicContact CG-CB 3.89Å; P132-E135 HydrophobicContact CG-CG 3.68Å; P132-E135 CarbonylContact O-C 3.56Å; P132-E135 WeakPolarHBondContact O-CA 3.34Å; P132-E135 WeakPolarHBondContact O-CB 3.39Å; P132-E135 PolarHBondContact O-N 3.22Å; E135-N137 PolarHBondContact O-N 3.27Å; E135-M138 HydrophobicContact CB-CE 4.25Å; E135-M138 HydrophobicContact CG-CE 3.72Å; E135-M138 PolarHBondContact O-N 2.94Å; E135-M138 VanDerWaalsContact O-N 3.12Å; E135-V139 VanDerWaalsContact O-CB 3.23Å; E135-V139 WeakPolarHBondContact O-CB 3.13Å; E135-V139 WeakPolarHBondContact O-CG2 3.19Å; E135-V139 PolarHBondContact O-N 3.02Å
136	M	46.6	Very low	44.1	Very low	31 Å²	31	63.4 Å²	63.4	15%	0.153	35%	0.351	C	S	.	.	H	α-helix	trans	-62.1	-27.3	174.2	-62.5	-174.6	-156	0	0	112.8	L131 P132 E133 R148 T150	L131-M136 HydrophobicContact CB-CG 3.79Å; L131-M136 WeakPolarHBondContact O-CE 3.11Å; P132-M136 WeakPolarHBondContact O-CG 3.44Å; P132-M136 PolarHBondContact O-N 2.04Å; E133-M136 HydrophobicContact CG-CE 4.44Å; E133-M136 PolarHBondContact O-N 2.84Å; M136-R148 VanDerWaalsContact C-NH2 3.26Å; M136-R148 PolarHBondContact O-NH2 2.96Å; M136-T150 HydrophobicContact CE-CG2 3.75Å; M136-T150 HydrophobicContact SD-CG2 3.79Å
137	N	44.6	Very low	44	Very low	109 Å²	109	63.9 Å²	63.9	58%	0.583	36%	0.362	S	S	*	.	H	α-helix	trans	-81.6	-32	175.6	-69.8	-32.3	0	0	0	111.7	E133 D134 E135 R148	E133-N137 VanDerWaalsContact O-CG 3.25Å; E133-N137 PolarHBondContact O-N 2.8Å; E133-N137 VanDerWaalsContact O-N 3.1Å; E133-N137 PolarHBondContact O-ND2 2.94Å; E133-N137 VanDerWaalsContact O-ND2 3.1Å; D134-N137 PolarHBondContact O-N 3.36Å; E135-N137 PolarHBondContact O-N 3.27Å; N137-R148 PolarHBondContact OD1-NH1 3.49Å; N137-R148 PolarHBondContact OD1-NH2 3.34Å
138	M	41.3	Very low	44.1	Very low	71 Å²	71	69.7 Å²	69.7	35%	0.35	38%	0.383	S	S	.	.	H	α-helix	trans	-74.9	-34.9	174.2	-69.2	-172.4	-71.3	0	0	112.1	P32 Y78 D134 E135	P32-M138 HydrophobicContact CG-SD 4.07Å; Y78-M138 PolarHBondContact OH-O 3.14Å; D134-M138 WeakPolarHBondContact O-CG 3.33Å; D134-M138 PolarHBondContact O-N 2.94Å; E135-M138 HydrophobicContact CB-CE 4.25Å; E135-M138 HydrophobicContact CG-CE 3.72Å; E135-M138 PolarHBondContact O-N 2.94Å; E135-M138 VanDerWaalsContact O-N 3.12Å
139	V	40.6	Very low	44.3	Very low	35 Å²	35	67.4 Å²	67.4	21%	0.212	37%	0.374	C	S	.	.	S	Bend	trans	-103.4	85	-177.6	-178.6	0	0	0	0	107	E135 I141	E135-V139 VanDerWaalsContact O-CB 3.23Å; E135-V139 WeakPolarHBondContact O-CB 3.13Å; E135-V139 WeakPolarHBondContact O-CG2 3.19Å; E135-V139 PolarHBondContact O-N 3.02Å; V139-I141 HydrophobicContact CG1-CB 4.22Å; V139-I141 HydrophobicContact CG1-CD1 3.16Å; V139-I141 HydrophobicContact CG1-CG1 3.39Å; V139-I141 PolarHBondContact O-N 2.75Å
140	N	43.2	Very low	44.4	Very low	119 Å²	119	69.4 Å²	69.4	64%	0.636	39%	0.389	S	S	*	.			trans	-72.8	60.3	179.3	-165.8	18.5	0	0	0	111.3	Y81	Y81-N140 WeakPolarHBondContact CE1-O 3.48Å
141	I	44.3	Very low	44.3	Very low	47 Å²	47	69.3 Å²	69.3	24%	0.241	39%	0.385	C	S	.	.			trans	-93.3	101	175.4	-62.3	172.4	0	0	0	107.3	Y81 V139 A149	Y81-I141 HydrophobicContact CE1-CG1 4.47Å; V139-I141 HydrophobicContact CG1-CB 4.22Å; V139-I141 HydrophobicContact CG1-CD1 3.16Å; V139-I141 HydrophobicContact CG1-CG1 3.39Å; V139-I141 PolarHBondContact O-N 2.75Å; I141-A149 HydrophobicContact CB-CB 3.84Å; I141-A149 HydrophobicContact CG2-CB 3.58Å; I141-A149 WeakPolarHBondContact O-CB 3.35Å; I141-A149 PolarHBondContact O-N 3.07Å
142	T	42.4	Very low	44.5	Very low	59 Å²	59	71.3 Å²	71.3	36%	0.362	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-96.2	127.9	164.1	45	0	0	0	0	109.3	Y81 A147	Y81-T142 PolarHBondContact OH-N 2.86Å; Y81-T142 PolarHBondContact OH-O 3.14Å; Y81-T142 PolarHBondContact OH-OG1 3.05Å; T142-A147 CarbonylContact C-O 3.59Å; T142-A147 WeakPolarHBondContact CA-O 3.35Å
143	M	38.2	Very low	44.5	Very low	44 Å²	44	71.5 Å²	71.5	22%	0.217	40%	0.395	C	S	.	.			trans	-61.4	162.7	169.6	-66.2	-73.4	165.6	0	0	110	P99 N145 G146 A147 A149	P99-M143 HydrophobicContact CB-CE 3.97Å; P99-M143 HydrophobicContact CB-CG 4.41Å; P99-M143 HydrophobicContact CB-SD 3.36Å; P99-M143 WeakPolarHBondContact CB-SD 2.97Å; P99-M143 HydrophobicContact CG-SD 3.49Å; P99-M143 WeakPolarHBondContact CG-SD 3.15Å; M143-N145 WeakPolarHBondContact CB-OD1 3.29Å; M143-N145 PolarHBondContact O-N 3.39Å; M143-G146 PolarHBondContact O-N 3.39Å; M143-A147 HydrophobicContact CB-CB 4.29Å; M143-A147 WeakPolarHBondContact CB-O 3.38Å; M143-A147 WeakPolarHBondContact CG-O 3.31Å; M143-A147 PolarHBondContact N-O 3.45Å; M143-A149 HydrophobicContact CE-CB 3.85Å
144	S	38.5	Very low	44.3	Very low	132 Å²	132	67.1 Å²	67.1	92%	0.923	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.7	179.6	51.8	0	0	0	0	114	G146	S144-G146 VanDerWaalsContact C-N 3.33Å
145	N	38.3	Very low	44.1	Very low	109 Å²	109	65.2 Å²	65.2	58%	0.583	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	9.7	174.8	64.7	-6	0	0	0	113.6	M143 A147	M143-N145 WeakPolarHBondContact CB-OD1 3.29Å; M143-N145 PolarHBondContact O-N 3.39Å; N145-A147 PolarHBondContact O-N 3.19Å; N145-A147 WeakPolarHBondContact OD1-CB 3.29Å; N145-A147 PolarHBondContact OD1-N 2.85Å
146	G	38	Very low	44	Very low	53 Å²	53	64.1 Å²	64.1	55%	0.546	36%	0.358	S	S	.	.	S	Bend	trans	76.4	-1.7	-176.2	0	0	0	0	0	114.7	M143 S144	M143-G146 PolarHBondContact O-N 3.39Å; S144-G146 VanDerWaalsContact C-N 3.33Å
147	A	43	Very low	43.6	Very low	43 Å²	43	65.6 Å²	65.6	36%	0.355	37%	0.371	S	S	.	.			trans	-71.3	139.4	177.3	0	0	0	0	0	110.9	T142 M143 N145	T142-A147 CarbonylContact C-O 3.59Å; T142-A147 WeakPolarHBondContact CA-O 3.35Å; M143-A147 HydrophobicContact CB-CB 4.29Å; M143-A147 WeakPolarHBondContact CB-O 3.38Å; M143-A147 WeakPolarHBondContact CG-O 3.31Å; M143-A147 PolarHBondContact N-O 3.45Å; N145-A147 PolarHBondContact O-N 3.19Å; N145-A147 WeakPolarHBondContact OD1-CB 3.29Å; N145-A147 PolarHBondContact OD1-N 2.85Å
148	R	46.8	Very low	43.3	Very low	123 Å²	123	63.5 Å²	63.5	46%	0.464	36%	0.358	S	S	.	.	B	Isolated β-bridge	trans	-72.2	136.3	175.2	-61.4	-177.8	69.2	176.2	3.2	109.9	M136 N137 T150	M136-R148 VanDerWaalsContact C-NH2 3.26Å; M136-R148 PolarHBondContact O-NH2 2.96Å; N137-R148 PolarHBondContact OD1-NH1 3.49Å; N137-R148 PolarHBondContact OD1-NH2 3.34Å; R148-T150 PolarHBondContact O-N 2.76Å
149	A	47.4	Very low	43	Very low	8 Å²	8	65.9 Å²	65.9	7%	0.066	37%	0.366	C	S	.	.			trans	-70.6	113.9	171.7	0	0	0	0	0	109.4	L131 I141 M143	L131-A149 WeakPolarHBondContact CD1-O 2.91Å; I141-A149 HydrophobicContact CB-CB 3.84Å; I141-A149 HydrophobicContact CG2-CB 3.58Å; I141-A149 WeakPolarHBondContact O-CB 3.35Å; I141-A149 PolarHBondContact O-N 3.07Å; M143-A149 HydrophobicContact CE-CB 3.85Å
150	T	48.5	Very low	42.7	Very low	67 Å²	67	70.2 Å²	70.2	41%	0.411	38%	0.384	S	S	.	.			trans	-102.8	-10.9	178.1	56.9	0	0	0	0	112.7	L131 M136 R148	L131-T150 PolarHBondContact N-O 3.38Å; M136-T150 HydrophobicContact CE-CG2 3.75Å; M136-T150 HydrophobicContact SD-CG2 3.79Å; R148-T150 PolarHBondContact O-N 2.76Å
151	K	47.6	Very low	42.5	Very low	77 Å²	77	67 Å²	67	34%	0.335	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	142.4	-176.6	-56.7	-166.6	-179.2	-129	0	112	A100 Y129 D130	A100-K151 HydrophobicContact CB-CB 4.28Å; Y129-K151 CarbonylContact O-C 3.55Å; Y129-K151 WeakPolarHBondContact O-CA 3.4Å; D130-K151 VanDerWaalsContact OD1-CD 3.26Å; D130-K151 WeakPolarHBondContact OD1-CD 3.45Å; D130-K151 WeakPolarHBondContact OD1-CE 3.45Å; D130-K151 WeakPolarHBondContact OD1-CG 3.3Å; D130-K151 IonicContact OD1-NZ 2.69Å; D130-K151 PolarHBondContact OD1-NZ 3.25Å; D130-K151 IonicContact OD2-NZ 3.99Å
152	L	51.5	Low	42.1	Very low	49 Å²	49	64.9 Å²	64.9	26%	0.257	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.8	168.6	-64	170.1	0	0	0	108.8	E128 Y129 L131 Y154	E128-L152 WeakPolarHBondContact CA-O 3.3Å; Y129-L152 HydrophobicContact CD1-CD1 4.16Å; Y129-L152 PolarHBondContact N-O 3.32Å; Y129-L152 PolarHBondContact O-N 2.58Å; L131-L152 HydrophobicContact CD1-CD1 4.33Å; L131-L152 HydrophobicContact CD1-CD2 4.4Å; L131-L152 HydrophobicContact CD1-CG 3.92Å; L131-L152 HydrophobicContact CD2-CD1 4Å; L131-L152 HydrophobicContact CD2-CG 4.47Å; L131-L152 HydrophobicContact CG-CD1 4.21Å; L131-L152 HydrophobicContact CG-CG 4.17Å; L152-Y154 HydrophobicContact CB-CD2 4.44Å; L152-Y154 HydrophobicContact CB-CE2 3.62Å; L152-Y154 HydrophobicContact CD1-CE2 4.47Å
153	I	48	Very low	41.7	Very low	26 Å²	26	65.4 Å²	65.4	13%	0.133	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.5	178.4	-58.2	167.9	0	0	0	107.8	A100 Y103 R126 C127 E128	A100-I153 HydrophobicContact CB-CD1 3.9Å; Y103-I153 HydrophobicContact CD2-CD1 4.11Å; Y103-I153 HydrophobicContact CE2-CG2 4.25Å; Y103-I153 HydrophobicContact CG-CD1 4.33Å; R126-I153 HydrophobicContact CG-CG2 3.88Å; C127-I153 WeakPolarHBondContact O-CA 3.25Å; E128-I153 HydrophobicContact CG-CG1 4.37Å
154	Y	47.9	Very low	41.5	Very low	59 Å²	59	68 Å²	68	23%	0.231	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	129	176.9	-59.6	-84	0	0	0	110	R126 C127 L152	R126-Y154 CarbonylContact C-O 3.55Å; R126-Y154 WeakPolarHBondContact CA-O 3.34Å; C127-Y154 PolarHBondContact N-O 3.43Å; C127-Y154 PolarHBondContact O-N 2.85Å; L152-Y154 HydrophobicContact CB-CD2 4.44Å; L152-Y154 HydrophobicContact CB-CE2 3.62Å; L152-Y154 HydrophobicContact CD1-CE2 4.47Å
155	E	43.5	Very low	41.5	Very low	54 Å²	54	64.4 Å²	64.4	25%	0.252	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.6	168.9	-71	-169.3	180	0	0	110.3	Y103 R124 V125 R126	Y103-E155 WeakPolarHBondContact CE1-OE1 3.43Å; Y103-E155 WeakPolarHBondContact OH-CG 3.36Å; Y103-E155 PolarHBondContact OH-OE1 2.94Å; R124-E155 IonicContact NH1-OE2 3.53Å; V125-E155 CarbonylContact O-C 3.55Å; V125-E155 WeakPolarHBondContact O-CA 3.39Å; R126-E155 HydrophobicContact CB-CG 4.48Å
156	C	43	Very low	41.4	Very low	32 Å²	32	60.3 Å²	60.3	22%	0.216	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.8	173	-77.3	0	0	0	0	109.9	V125 H158 L162	V125-C156 PolarHBondContact N-O 3.12Å; V125-C156 PolarHBondContact O-N 2.77Å; C156-H158 PolarHBondContact O-N 3.38Å; C156-L162 HydrophobicContact CB-CB 4.14Å; C156-L162 HydrophobicContact CB-CD1 4.07Å
157	C	38.2	Very low	41.1	Very low	61 Å²	61	63 Å²	63	41%	0.412	32%	0.318	S	S	.	.	S	Bend	trans	-73.9	-1.6	176	-56.1	0	0	0	0	113.7	V123	V123-C157 CarbonylContact O-C 3.24Å; V123-C157 VanDerWaalsContact O-C 3.24Å; V123-C157 VanDerWaalsContact O-O 3.05Å
158	H	39.2	Very low	40.5	Very low	66 Å²	66	68.9 Å²	68.9	31%	0.306	33%	0.332	S	S	.	.			trans	-146.8	135.4	178.7	-91.4	-86.9	0	0	0	111.9	C60 C156 H160 S161 L162	C60-H158 WeakPolarHBondContact CB-NE2 3.45Å; C60-H158 PolarHBondContact SG-NE2 3.48Å; C156-H158 PolarHBondContact O-N 3.38Å; H158-H160 VanDerWaalsContact C-N 3.28Å; H158-H160 PolarHBondContact O-N 3.48Å; H158-S161 WeakPolarHBondContact CB-OG 3.44Å; H158-S161 PolarHBondContact O-OG 2.86Å; H158-L162 PolarHBondContact O-N 3.49Å
159	F	35.5	Very low	39.9	Very low	120 Å²	120	65.5 Å²	65.5	53%	0.526	32%	0.324	S	S	.	.	H	α-helix	trans	-64.3	-32.5	173.2	-171.7	-98.1	0	0	0	112.5	V125 M163	V125-F159 HydrophobicContact CG1-CD2 4.24Å; V125-F159 HydrophobicContact CG2-CB 4Å; V125-F159 HydrophobicContact CG2-CD2 4.24Å; F159-M163 HydrophobicContact CD1-CG 4.32Å; F159-M163 HydrophobicContact CE1-CG 3.95Å; F159-M163 HydrophobicContact CZ-CE 4.31Å; F159-M163 HydrophobicContact CZ-CG 4.31Å; F159-M163 PolarHBondContact O-N 3.06Å
160	H	34	Very low	39	Very low	127 Å²	127	71 Å²	71	59%	0.588	35%	0.346	S	S	*	.	H	α-helix	trans	-72.9	-40	-177.8	-163.6	73.2	0	0	0	112.9	H158 L162 M163 Q164	H158-H160 VanDerWaalsContact C-N 3.28Å; H158-H160 PolarHBondContact O-N 3.48Å; H160-L162 VanDerWaalsContact C-N 3.29Å; H160-L162 PolarHBondContact O-N 3.46Å; H160-M163 PolarHBondContact O-N 3.49Å; H160-Q164 PolarHBondContact NE2-NE2 3.35Å; H160-Q164 VanDerWaalsContact NE2-NE2 3.15Å; H160-Q164 WeakPolarHBondContact O-CG 3.2Å; H160-Q164 PolarHBondContact O-N 3.47Å
161	S	38.3	Very low	38	Very low	52 Å²	52	73.1 Å²	73.1	36%	0.364	36%	0.359	S	S	.	.	H	α-helix	trans	-67.8	-33.9	176.1	51.4	0	0	0	0	111.5	H158 F165	H158-S161 WeakPolarHBondContact CB-OG 3.44Å; H158-S161 PolarHBondContact O-OG 2.86Å; S161-F165 WeakPolarHBondContact O-CB 3.19Å; S161-F165 PolarHBondContact O-N 2.9Å
162	L	37	Very low	37	Very low	2 Å²	2	71.4 Å²	71.4	1%	0.01	36%	0.359	C	S	.	.	H	α-helix	trans	-66.7	-47.3	173.4	-176.2	105.3	0	0	0	111.9	C44 V125 C127 C156 H158 H160 Q164 F165 L166	C44-L162 HydrophobicContact CB-CD2 4.24Å; C44-L162 VanDerWaalsContact SG-CD2 3.51Å; V125-L162 HydrophobicContact CG1-CD2 4.04Å; C127-L162 HydrophobicContact CB-CD1 4.02Å; C127-L162 WeakPolarHBondContact SG-CD1 3.29Å; C127-L162 WeakPolarHBondContact SG-CD2 3.38Å; C156-L162 HydrophobicContact CB-CB 4.14Å; C156-L162 HydrophobicContact CB-CD1 4.07Å; H158-L162 PolarHBondContact O-N 3.49Å; H160-L162 VanDerWaalsContact C-N 3.29Å; H160-L162 PolarHBondContact O-N 3.46Å; L162-Q164 VanDerWaalsContact C-N 3.31Å; L162-Q164 PolarHBondContact O-N 3.21Å; L162-F165 WeakPolarHBondContact O-CB 3.46Å; L162-F165 PolarHBondContact O-N 3.49Å; L162-L166 HydrophobicContact CD2-CD1 3.7Å; L162-L166 HydrophobicContact CG-CD1 3.84Å; L162-L166 HydrophobicContact CG-CG 4.43Å; L162-L166 WeakPolarHBondContact O-CB 3.19Å; L162-L166 WeakPolarHBondContact O-CD1 3.1Å; L162-L166 WeakPolarHBondContact O-CG 3.42Å; L162-L166 PolarHBondContact O-N 3Å
163	M	32.5	Very low	35.9	Very low	70 Å²	70	74.3 Å²	74.3	35%	0.345	38%	0.375	S	S	.	.	H	α-helix	trans	-63.2	-35.5	176.7	-79.7	-71.5	133.1	0	0	112.8	F159 H160 L166 N167	F159-M163 HydrophobicContact CD1-CG 4.32Å; F159-M163 HydrophobicContact CE1-CG 3.95Å; F159-M163 HydrophobicContact CZ-CE 4.31Å; F159-M163 HydrophobicContact CZ-CG 4.31Å; F159-M163 PolarHBondContact O-N 3.06Å; H160-M163 PolarHBondContact O-N 3.49Å; M163-L166 HydrophobicContact CE-CD1 3.92Å; M163-N167 VanDerWaalsContact O-CB 3.31Å; M163-N167 WeakPolarHBondContact O-CB 3.21Å; M163-N167 PolarHBondContact O-N 3.42Å
164	Q	35.2	Very low	35	Very low	99 Å²	99	74.5 Å²	74.5	46%	0.463	38%	0.38	S	S	.	.	H	α-helix	trans	-67	-45.3	171	-75	-177.1	-3.5	0	0	111.7	H160 L162 L166 N167 Y168	H160-Q164 PolarHBondContact NE2-NE2 3.35Å; H160-Q164 VanDerWaalsContact NE2-NE2 3.15Å; H160-Q164 WeakPolarHBondContact O-CG 3.2Å; H160-Q164 PolarHBondContact O-N 3.47Å; L162-Q164 VanDerWaalsContact C-N 3.31Å; L162-Q164 PolarHBondContact O-N 3.21Å; Q164-L166 VanDerWaalsContact C-N 3.26Å; Q164-L166 PolarHBondContact O-N 3Å; Q164-N167 PolarHBondContact O-N 3.05Å; Q164-Y168 HydrophobicContact CB-CD2 4.48Å; Q164-Y168 WeakPolarHBondContact O-CB 3.28Å; Q164-Y168 WeakPolarHBondContact O-CD2 3.31Å; Q164-Y168 PolarHBondContact O-N 2.92Å
165	F	37.6	Very low	34.1	Very low	55 Å²	55	75.4 Å²	75.4	24%	0.241	39%	0.392	C	S	.	.	H	α-helix	trans	-57.6	-41.2	175.9	177.5	-92.3	0	0	0	111.4	I70 L74 S161 L162 N169	I70-F165 HydrophobicContact CG2-CD2 3.88Å; I70-F165 HydrophobicContact CG2-CE2 3.52Å; L74-F165 HydrophobicContact CD1-CE2 4.4Å; L74-F165 HydrophobicContact CD1-CZ 4.06Å; S161-F165 WeakPolarHBondContact O-CB 3.19Å; S161-F165 PolarHBondContact O-N 2.9Å; L162-F165 WeakPolarHBondContact O-CB 3.46Å; L162-F165 PolarHBondContact O-N 3.49Å; F165-N169 VanDerWaalsContact CD2-ND2 3.28Å; F165-N169 WeakPolarHBondContact CD2-ND2 3.28Å; F165-N169 WeakPolarHBondContact O-CB 3.33Å; F165-N169 PolarHBondContact O-N 3.27Å; F165-N169 PolarHBondContact O-ND2 3.48Å
166	L	37.5	Very low	33.6	Very low	24 Å²	24	75.5 Å²	75.5	13%	0.126	40%	0.398	C	S	.	.	H	α-helix	trans	-73.2	-46.8	178.9	-65.6	164	0	0	0	112	L42 L162 M163 Q164 Y168 N169 F170	L42-L166 HydrophobicContact CD1-CD2 4.23Å; L42-L166 HydrophobicContact CD2-CD1 3.13Å; L42-L166 HydrophobicContact CD2-CD2 3.41Å; L42-L166 VanDerWaalsContact CD2-CD2 3.41Å; L42-L166 HydrophobicContact CD2-CG 3.84Å; L42-L166 HydrophobicContact CG-CD2 4.45Å; L162-L166 HydrophobicContact CD2-CD1 3.7Å; L162-L166 HydrophobicContact CG-CD1 3.84Å; L162-L166 HydrophobicContact CG-CG 4.43Å; L162-L166 WeakPolarHBondContact O-CB 3.19Å; L162-L166 WeakPolarHBondContact O-CD1 3.1Å; L162-L166 WeakPolarHBondContact O-CG 3.42Å; L162-L166 PolarHBondContact O-N 3Å; M163-L166 HydrophobicContact CE-CD1 3.92Å; Q164-L166 VanDerWaalsContact C-N 3.26Å; Q164-L166 PolarHBondContact O-N 3Å; L166-Y168 PolarHBondContact O-N 3.27Å; L166-N169 PolarHBondContact O-N 3.11Å; L166-F170 HydrophobicContact CD2-CD2 4.2Å; L166-F170 HydrophobicContact CD2-CE2 4.13Å; L166-F170 WeakPolarHBondContact O-CB 3.34Å; L166-F170 PolarHBondContact O-N 3.42Å
167	N	31.5	Very low	33	Very low	109 Å²	109	79.6 Å²	79.6	58%	0.583	42%	0.417	S	S	*	.	H	α-helix	trans	-63.5	-38.7	178.1	-97.4	-46.1	0	0	0	112.8	M163 Q164 V171	M163-N167 VanDerWaalsContact O-CB 3.31Å; M163-N167 WeakPolarHBondContact O-CB 3.21Å; M163-N167 PolarHBondContact O-N 3.42Å; Q164-N167 PolarHBondContact O-N 3.05Å; N167-V171 WeakPolarHBondContact O-CB 3.37Å; N167-V171 WeakPolarHBondContact O-CG2 3.17Å
168	Y	29.6	Very low	32.6	Very low	166 Å²	166	82 Å²	82	65%	0.651	42%	0.418	S	S	*	.	H	α-helix	trans	-79.1	-33.2	179.9	-84.2	-82.8	0	0	0	113.1	Q164 L166 A172	Q164-Y168 HydrophobicContact CB-CD2 4.48Å; Q164-Y168 WeakPolarHBondContact O-CB 3.28Å; Q164-Y168 WeakPolarHBondContact O-CD2 3.31Å; Q164-Y168 PolarHBondContact O-N 2.92Å; L166-Y168 PolarHBondContact O-N 3.27Å; Y168-A172 WeakPolarHBondContact O-CB 3.21Å; Y168-A172 PolarHBondContact O-N 2.88Å
169	N	34.5	Very low	32.1	Very low	52 Å²	52	87 Å²	87	28%	0.278	44%	0.438	S	S	.	.	H	α-helix	trans	-93.4	-28.4	-174.9	-65.2	-64.5	0	0	0	114.4	F165 L166	F165-N169 VanDerWaalsContact CD2-ND2 3.28Å; F165-N169 WeakPolarHBondContact CD2-ND2 3.28Å; F165-N169 WeakPolarHBondContact O-CB 3.33Å; F165-N169 PolarHBondContact O-N 3.27Å; F165-N169 PolarHBondContact O-ND2 3.48Å; L166-N169 PolarHBondContact O-N 3.11Å
170	F	29.2	Very low	31.8	Very low	124 Å²	124	88.1 Å²	88.1	54%	0.544	44%	0.44	S	S	.	.	H	α-helix	trans	-78.8	-27.4	171.7	-91.8	-94.3	0	0	0	112.5	Y129 L166	Y129-F170 HydrophobicContact CD2-CZ 4.4Å; Y129-F170 AromaticContact CE2-CZ 3.95Å; Y129-F170 HydrophobicContact CE2-CZ 3.95Å; L166-F170 HydrophobicContact CD2-CD2 4.2Å; L166-F170 HydrophobicContact CD2-CE2 4.13Å; L166-F170 WeakPolarHBondContact O-CB 3.34Å; L166-F170 PolarHBondContact O-N 3.42Å
171	V	27.2	Very low	31.5	Very low	112 Å²	112	84.5 Å²	84.5	68%	0.679	43%	0.432	S	S	*	.	H	α-helix	trans	-82.5	-21.4	174	-178.7	0	0	0	0	111.6	N167 D173	N167-V171 WeakPolarHBondContact O-CB 3.37Å; N167-V171 WeakPolarHBondContact O-CG2 3.17Å; V171-D173 PolarHBondContact O-N 3Å
172	A	26.3	Very low	31.1	Very low	40 Å²	40	85.1 Å²	85.1	33%	0.331	44%	0.441	S	S	.	.	S	Bend	trans	-77.4	42.7	166.8	0	0	0	0	0	112.6	Y168 A174	Y168-A172 WeakPolarHBondContact O-CB 3.21Å; Y168-A172 PolarHBondContact O-N 2.88Å; A172-A174 PolarHBondContact O-N 2.91Å
173	D	28.8	Very low	30.8	Very low	111 Å²	111	87.6 Å²	87.6	59%	0.594	47%	0.466	S	S	*	.			trans	-9.4	112.9	153.4	-179.7	24.5	0	0	0	114.4	V171 T175	V171-D173 PolarHBondContact O-N 3Å; D173-T175 WeakPolarHBondContact O-CA 3.4Å; D173-T175 WeakPolarHBondContact O-CB 3.47Å; D173-T175 PolarHBondContact O-N 3.39Å; D173-T175 PolarHBondContact O-OG1 3.5Å
174	A	28.3	Very low	30.7	Very low	29 Å²	29	93.8 Å²	93.8	24%	0.24	49%	0.486	C	S	.	.	T	Hydrogen-bonded Turn	trans	29.3	4.2	151.7	0	0	0	0	0	121.8	L33 A172 R178	L33-A174 HydrophobicContact CD1-CB 4.31Å; A172-A174 PolarHBondContact O-N 2.91Å; A174-R178 WeakPolarHBondContact O-CG 3.22Å; A174-R178 PolarHBondContact O-NE 2.87Å
175	T	30.1	Very low	30.6	Very low	78 Å²	78	96.1 Å²	96.1	48%	0.479	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.3	-37.3	-158.3	-39.3	0	0	0	0	108.9	D173 R178 K179	D173-T175 WeakPolarHBondContact O-CA 3.4Å; D173-T175 WeakPolarHBondContact O-CB 3.47Å; D173-T175 PolarHBondContact O-N 3.39Å; D173-T175 PolarHBondContact O-OG1 3.5Å; T175-R178 PolarHBondContact O-N 3.26Å; T175-K179 PolarHBondContact O-N 3.4Å
176	S	31.4	Very low	30.2	Very low	56 Å²	56	97.2 Å²	97.2	39%	0.392	52%	0.521	S	S	.	.	H	α-helix	trans	-68.1	-35	171.2	-61.4	0	0	0	0	112.1	R178 K179	S176-R178 VanDerWaalsContact C-N 3.34Å; S176-R178 PolarHBondContact O-N 3.36Å; S176-K179 PolarHBondContact O-N 3.45Å
177	I	31.8	Very low	29.8	Very low	119 Å²	119	100 Å²	100	61%	0.61	55%	0.548	S	S	*	.	H	α-helix	trans	-67.1	-35.1	176.2	-60.4	174.6	0	0	0	111.1	K179 Y180 A181	I177-K179 PolarHBondContact O-N 3.14Å; I177-Y180 PolarHBondContact O-N 3.27Å; I177-A181 PolarHBondContact O-N 2.59Å
178	R	28.5	Very low	29.6	Very low	112 Å²	112	100.7 Å²	100.7	42%	0.423	56%	0.558	S	S	.	*	H	α-helix	trans	-66.7	-35.8	178.7	-67.1	-177.7	-149.3	-153.3	2.2	112.9	L33 A174 T175 S176 Y180 A181 A182	L33-R178 PolarHBondContact O-NH2 2.84Å; L33-R178 VanDerWaalsContact O-NH2 3.13Å; A174-R178 WeakPolarHBondContact O-CG 3.22Å; A174-R178 PolarHBondContact O-NE 2.87Å; T175-R178 PolarHBondContact O-N 3.26Å; S176-R178 VanDerWaalsContact C-N 3.34Å; S176-R178 PolarHBondContact O-N 3.36Å; R178-Y180 VanDerWaalsContact C-N 3.34Å; R178-A181 PolarHBondContact O-N 3.04Å; R178-A182 WeakPolarHBondContact O-CB 3.42Å; R178-A182 PolarHBondContact O-N 3.42Å
179	K	29.7	Very low	29.7	Very low	169 Å²	169	98.7 Å²	98.7	74%	0.735	56%	0.558	S	S	*	*	H	α-helix	trans	-67.3	-35.7	177.2	-77.2	-176.1	175.8	179.8	0	112.2	T175 S176 I177 G183	T175-K179 PolarHBondContact O-N 3.4Å; S176-K179 PolarHBondContact O-N 3.45Å; I177-K179 PolarHBondContact O-N 3.14Å; K179-G183 PolarHBondContact O-N 2.89Å
180	Y	28.9	Very low	29.5	Very low	144 Å²	144	108.6 Å²	108.6	57%	0.565	60%	0.603	S	S	*	*	H	α-helix	trans	-75.1	-34.8	176.3	-85.8	-84.9	0	0	0	112.9	L71 I177 R178	L71-Y180 HydrophobicContact CD2-CD2 4.33Å; L71-Y180 HydrophobicContact CD2-CE2 4.18Å; I177-Y180 PolarHBondContact O-N 3.27Å; R178-Y180 VanDerWaalsContact C-N 3.34Å
181	A	28.3	Very low	29.6	Very low	52 Å²	52	107.9 Å²	107.9	43%	0.43	61%	0.606	S	S	.	*	H	α-helix	trans	-74.9	-34.5	175.2	0	0	0	0	0	113.4	I177 R178 W184 N185	I177-A181 PolarHBondContact O-N 2.59Å; R178-A181 PolarHBondContact O-N 3.04Å; A181-W184 PolarHBondContact O-N 3.15Å; A181-N185 PolarHBondContact O-N 3.24Å
182	A	29.4	Very low	29.7	Very low	65 Å²	65	107.6 Å²	107.6	54%	0.537	60%	0.602	S	S	.	*	H	α-helix	trans	-72.5	-30.2	177.6	0	0	0	0	0	113	R178 W184	R178-A182 WeakPolarHBondContact O-CB 3.42Å; R178-A182 PolarHBondContact O-N 3.42Å; A182-W184 VanDerWaalsContact C-N 3.29Å; A182-W184 PolarHBondContact O-N 3.27Å
183	G	31.1	Very low	29.9	Very low	53 Å²	53	111.4 Å²	111.4	55%	0.546	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.5	-16.2	174.1	0	0	0	0	0	114.5	K179	K179-G183 PolarHBondContact O-N 2.89Å
184	W	29.4	Very low	29.9	Very low	200 Å²	200	111.4 Å²	111.4	76%	0.758	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-18.6	178.9	-105.6	60.2	0	0	0	114	V79 A181 A182	V79-W184 HydrophobicContact CG1-CH2 4.41Å; V79-W184 HydrophobicContact CG1-CZ3 4.43Å; A181-W184 PolarHBondContact O-N 3.15Å; A182-W184 VanDerWaalsContact C-N 3.29Å; A182-W184 PolarHBondContact O-N 3.27Å
185	N	32.7	Very low	30	Very low	148 Å²	148	116.6 Å²	116.6	79%	0.791	64%	0.642	S	S	*	*	S	Bend	trans	-93.9	5.7	173.1	-72.4	-35.5	0	0	0	113	A181	A181-N185 PolarHBondContact O-N 3.24Å
186	A	30.2	Very low	30	Very low	79 Å²	79	119.1 Å²	119.1	65%	0.653	65%	0.653	S	S	*	*			trans	-109.8	63.6	178.9	0	0	0	0	0	110.6
187	A	28.7	Very low	29.9	Very low	83 Å²	83	123.6 Å²	123.6	69%	0.686	67%	0.672	S	S	*	*	S	Bend	trans	-127.1	125.1	161.4	0	0	0	0	0	107.8
188	P	27.9	Very low	29.8	Very low	122 Å²	122	124 Å²	124	79%	0.792	68%	0.677	S	S	*	*			trans	-72.1	135.7	-159.9	26.6	-31.5	0	0	0	112.4	Q190	P188-Q190 PolarHBondContact O-N 3.46Å; P188-Q190 VanDerWaalsContact O-N 3.11Å
189	N	30.3	Very low	29.9	Very low	124 Å²	124	125 Å²	125	66%	0.663	70%	0.698	S	S	*	*			trans	-62	101.7	156.3	-79.6	-44.3	0	0	0	108.2	R24	R24-N189 PolarHBondContact NH1-OD1 2.78Å; R24-N189 PolarHBondContact NH2-OD1 2.93Å
190	Q	32.3	Very low	29.9	Very low	261 Å²	261	121 Å²	121	100%	1.22	70%	0.695	S	S	*	*			trans	-147.5	0	150.4	-76.8	-158.1	-23	0	0	109	P188	P188-Q190 PolarHBondContact O-N 3.46Å; P188-Q190 VanDerWaalsContact O-N 3.11Å

Retrieved 190 of 190 residues in 64.5 ms (Link to these results)

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