A0A077YW45_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YW45, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 196 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.6	Very low	48.3	Very low	225 Å²	225	115.8 Å²	115.8	100%	1.108	68%	0.676	S	S	*	*				0	127	0	-70	-170.1	166.7	0	0	108.1	L3	M1-L3 PolarHBondContact O-N 3.27Å
2	P	43.3	Very low	49.1	Very low	132 Å²	132	111.2 Å²	111.2	86%	0.857	65%	0.65	S	S	*	*			trans	-76.3	122.3	178.7	31.2	-28.7	0	0	0	108.7	S4	P2-S4 PolarHBondContact O-N 3.45Å
3	L	49	Very low	50	Low	161 Å²	161	107.9 Å²	107.9	84%	0.843	63%	0.625	S	S	*	*			trans	-80.6	104.2	177.4	-72.2	168.2	0	0	0	109.2	M1 C5	M1-L3 PolarHBondContact O-N 3.27Å; L3-C5 PolarHBondContact O-N 3.28Å; L3-C5 VanDerWaalsContact O-N 3.17Å
4	S	43.8	Very low	50.8	Low	100 Å²	100	111.4 Å²	111.4	70%	0.699	62%	0.624	S	S	*	*			trans	-70.6	93.6	171.1	171	0	0	0	0	110.4	P2 N6	P2-S4 PolarHBondContact O-N 3.45Å; S4-N6 PolarHBondContact O-N 3.3Å
5	C	47.8	Very low	51.2	Low	57 Å²	57	111.7 Å²	111.7	39%	0.385	62%	0.623	S	S	.	*			trans	-90.2	75.3	161.9	-64.8	0	0	0	0	108.8	L3 C11	L3-C5 PolarHBondContact O-N 3.28Å; L3-C5 VanDerWaalsContact O-N 3.17Å; C5-C11 HydrophobicContact CB-CB 3.99Å; C5-C11 WeakPolarHBondContact CB-SG 3.4Å; C5-C11 WeakPolarHBondContact SG-CB 3.3Å; C5-C11 CovalentContact SG-SG 2.09Å; C5-C11 PolarHBondContact SG-SG 3.09Å
6	N	44	Very low	52.2	Low	143 Å²	143	112.4 Å²	112.4	77%	0.765	64%	0.638	S	S	*	*			trans	-111.5	80.1	173.4	-83.3	-21.4	0	0	0	109.5	S4	S4-N6 PolarHBondContact O-N 3.3Å
7	S	52.8	Low	53.2	Low	115 Å²	115	109.4 Å²	109.4	80%	0.804	64%	0.638	S	S	*	*	S	Bend	trans	169.7	-19	150.4	49.9	0	0	0	0	116.7
8	E	50.3	Low	53.6	Low	149 Å²	149	109.9 Å²	109.9	70%	0.696	64%	0.636	S	S	*	*			trans	-106.6	142.4	-171.4	-72.7	-169.1	145.9	0	0	114.8	S10	E8-S10 PolarHBondContact O-N 3.18Å; E8-S10 VanDerWaalsContact O-N 3.16Å
9	P	55.7	Low	54	Low	116 Å²	116	108.2 Å²	108.2	75%	0.753	63%	0.629	S	S	*	*	S	Bend	trans	-69	-8.6	-178.7	27.1	-33.4	0	0	0	114
10	S	53.5	Low	54	Low	37 Å²	37	106.6 Å²	106.6	26%	0.259	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-141.2	102.4	170	70.6	0	0	0	0	110.3	E8	E8-S10 PolarHBondContact O-N 3.18Å; E8-S10 VanDerWaalsContact O-N 3.16Å
11	C	52.5	Low	54.2	Low	39 Å²	39	110 Å²	110	26%	0.264	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.3	126.1	166.6	-145.2	0	0	0	0	107.1	C5 H13 V22	C5-C11 HydrophobicContact CB-CB 3.99Å; C5-C11 WeakPolarHBondContact CB-SG 3.4Å; C5-C11 WeakPolarHBondContact SG-CB 3.3Å; C5-C11 CovalentContact SG-SG 2.09Å; C5-C11 PolarHBondContact SG-SG 3.09Å; C11-H13 PolarHBondContact O-CD2 3.29Å; C11-V22 PolarHBondContact O-N 3.21Å
12	T	57.6	Low	55.1	Low	60 Å²	60	102.7 Å²	102.7	37%	0.368	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.5	117.5	172.4	-50.9	0	0	0	0	107.3	Y14 P19	T12-Y14 HydrophobicContact CG2-CE2 4.31Å; T12-P19 HydrophobicContact CG2-CB 3.98Å
13	H	61.7	Low	55.9	Low	69 Å²	69	100.6 Å²	100.6	32%	0.319	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.1	156	179	-69.1	-85.2	0	0	0	109.9	C11 P19 F20	C11-H13 PolarHBondContact O-CD2 3.29Å; H13-P19 WeakPolarHBondContact O-CA 3.48Å; H13-F20 HydrophobicContact CB-CD1 4.04Å; H13-F20 HydrophobicContact CB-CD2 4.09Å; H13-F20 HydrophobicContact CB-CE1 3.48Å; H13-F20 VanDerWaalsContact CB-CE1 3.48Å; H13-F20 HydrophobicContact CB-CE2 3.57Å; H13-F20 HydrophobicContact CB-CG 4.32Å; H13-F20 HydrophobicContact CB-CZ 3.23Å; H13-F20 PolarHBondContact N-O 3.27Å; H13-F20 WeakPolarHBondContact O-CD1 3.42Å; H13-F20 PolarHBondContact O-N 3.12Å; H13-F20 VanDerWaalsContact O-O 3.11Å
14	Y	60.6	Low	56.4	Low	156 Å²	156	101.2 Å²	101.2	61%	0.612	57%	0.569	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-121.9	122.7	178	-69.9	-95	0	0	0	109.2	T12 I18 P19	T12-Y14 HydrophobicContact CG2-CE2 4.31Å; Y14-I18 WeakPolarHBondContact CA-O 3.45Å; Y14-P19 HydrophobicContact CD1-CB 4.11Å; Y14-P19 HydrophobicContact CE1-CB 3.59Å; Y14-P19 HydrophobicContact CE1-CG 4.21Å
15	L	56.5	Low	57.2	Low	116 Å²	116	102.9 Å²	102.9	61%	0.607	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.6	118.9	169.2	-126.9	97.9	0	0	0	105.5	G17 I18 F20	L15-G17 PolarHBondContact O-N 3.22Å; L15-G17 VanDerWaalsContact O-N 3.13Å; L15-I18 PolarHBondContact N-O 3.06Å; L15-I18 PolarHBondContact O-N 3.21Å; L15-F20 HydrophobicContact CB-CD1 4.05Å; L15-F20 HydrophobicContact CB-CE1 3.61Å; L15-F20 HydrophobicContact CB-CZ 4.5Å; L15-F20 HydrophobicContact CD1-CE1 3.53Å; L15-F20 HydrophobicContact CD1-CZ 3.58Å; L15-F20 HydrophobicContact CG-CE1 4.19Å; L15-F20 VanDerWaalsContact N-CE1 3.34Å
16	S	67.2	Low	57.9	Low	123 Å²	123	109.1 Å²	109.1	86%	0.86	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	52.5	37	179.2	-52.3	0	0	0	0	114.3	I18	S16-I18 VanDerWaalsContact C-N 3.27Å; S16-I18 PolarHBondContact O-N 3.42Å
17	G	69.4	Low	58.6	Low	62 Å²	62	105.3 Å²	105.3	64%	0.639	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	80.5	-2.9	-179.8	0	0	0	0	0	115.5	L15	L15-G17 PolarHBondContact O-N 3.22Å; L15-G17 VanDerWaalsContact O-N 3.13Å
18	I	59.6	Low	58.8	Low	118 Å²	118	105.5 Å²	105.5	61%	0.605	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.1	121	177.9	-56.5	174.8	0	0	0	109	Y14 L15 S16 F20	Y14-I18 WeakPolarHBondContact CA-O 3.45Å; L15-I18 PolarHBondContact N-O 3.06Å; L15-I18 PolarHBondContact O-N 3.21Å; S16-I18 VanDerWaalsContact C-N 3.27Å; S16-I18 PolarHBondContact O-N 3.42Å; I18-F20 PolarHBondContact O-N 3.4Å
19	P	61.9	Low	59.5	Low	78 Å²	78	103.1 Å²	103.1	51%	0.506	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.4	126.5	174.6	26.3	-30.7	0	0	0	110.1	T12 H13 Y14	T12-P19 HydrophobicContact CG2-CB 3.98Å; H13-P19 WeakPolarHBondContact O-CA 3.48Å; Y14-P19 HydrophobicContact CD1-CB 4.11Å; Y14-P19 HydrophobicContact CE1-CB 3.59Å; Y14-P19 HydrophobicContact CE1-CG 4.21Å
20	F	55.1	Low	59.3	Low	76 Å²	76	106.3 Å²	106.3	33%	0.333	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.6	144.1	169.6	68.7	-82.7	0	0	0	110	H13 L15 I18 V22	H13-F20 HydrophobicContact CB-CD1 4.04Å; H13-F20 HydrophobicContact CB-CD2 4.09Å; H13-F20 HydrophobicContact CB-CE1 3.48Å; H13-F20 VanDerWaalsContact CB-CE1 3.48Å; H13-F20 HydrophobicContact CB-CE2 3.57Å; H13-F20 HydrophobicContact CB-CG 4.32Å; H13-F20 HydrophobicContact CB-CZ 3.23Å; H13-F20 PolarHBondContact N-O 3.27Å; H13-F20 WeakPolarHBondContact O-CD1 3.42Å; H13-F20 PolarHBondContact O-N 3.12Å; H13-F20 VanDerWaalsContact O-O 3.11Å; L15-F20 HydrophobicContact CB-CD1 4.05Å; L15-F20 HydrophobicContact CB-CE1 3.61Å; L15-F20 HydrophobicContact CB-CZ 4.5Å; L15-F20 HydrophobicContact CD1-CE1 3.53Å; L15-F20 HydrophobicContact CD1-CZ 3.58Å; L15-F20 HydrophobicContact CG-CE1 4.19Å; L15-F20 VanDerWaalsContact N-CE1 3.34Å; I18-F20 PolarHBondContact O-N 3.4Å; F20-V22 HydrophobicContact CD2-CG2 3.78Å; F20-V22 HydrophobicContact CE2-CG2 3.48Å; F20-V22 VanDerWaalsContact CE2-CG2 3.48Å
21	R	56.9	Low	59.5	Low	179 Å²	179	109.9 Å²	109.9	68%	0.675	61%	0.605	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.8	127.5	176.4	-76	-171.2	174.5	-167.3	-0.4	109.5
22	V	57.9	Low	59.6	Low	71 Å²	71	111.9 Å²	111.9	43%	0.43	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100	105.2	166.3	-176.9	0	0	0	0	107	C11 F20	C11-V22 PolarHBondContact O-N 3.21Å; F20-V22 HydrophobicContact CD2-CG2 3.78Å; F20-V22 HydrophobicContact CE2-CG2 3.48Å; F20-V22 VanDerWaalsContact CE2-CG2 3.48Å
23	S	59.2	Low	59.5	Low	88 Å²	88	117.5 Å²	117.5	62%	0.615	64%	0.64	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.6	126.4	170.1	-57.6	0	0	0	0	108.1	L25	S23-L25 PolarHBondContact O-N 3.04Å
24	K	59.7	Low	59.2	Low	173 Å²	173	120.5 Å²	120.5	75%	0.752	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-63.1	129.6	165.4	-74.3	-176	179.8	178.3	0	107.6	L26	K24-L26 PolarHBondContact O-N 3.13Å
25	L	61.5	Low	58.9	Low	136 Å²	136	118.2 Å²	118.2	71%	0.712	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-58.9	125.3	170.9	-70.2	161.8	0	0	0	107.8	S23 A27 V29	S23-L25 PolarHBondContact O-N 3.04Å; L25-A27 WeakPolarHBondContact CB-O 3.41Å; L25-A27 PolarHBondContact O-N 2.9Å; L25-V29 HydrophobicContact CD1-CG2 3.73Å; L25-V29 HydrophobicContact CD2-CG2 4.47Å
26	L	63.1	Low	58.8	Low	188 Å²	188	116.7 Å²	116.7	98%	0.984	64%	0.644	S	S	*	*	S	Bend	trans	-64.5	-21.9	-175.2	-141	84.6	0	0	0	112.2	K24	K24-L26 PolarHBondContact O-N 3.13Å
27	A	57.6	Low	58.4	Low	63 Å²	63	117.9 Å²	117.9	52%	0.521	64%	0.64	S	S	.	*	S	Bend	trans	-139.5	150.3	174.7	0	0	0	0	0	109.1	L25 V29	L25-A27 WeakPolarHBondContact CB-O 3.41Å; L25-A27 PolarHBondContact O-N 2.9Å; A27-V29 PolarHBondContact O-N 3.49Å
28	P	58.2	Low	58.2	Low	119 Å²	119	118.6 Å²	118.6	77%	0.773	63%	0.63	S	S	*	*			trans	-54.3	132.4	168.2	22.5	-30.8	0	0	0	109.2	Q30	P28-Q30 PolarHBondContact O-N 2.82Å
29	V	63.6	Low	58.7	Low	99 Å²	99	117.1 Å²	117.1	60%	0.6	63%	0.628	S	S	*	*			trans	-61.5	111.5	169.5	169.5	0	0	0	0	106.1	L25 A27 V31	L25-V29 HydrophobicContact CD1-CG2 3.73Å; L25-V29 HydrophobicContact CD2-CG2 4.47Å; A27-V29 PolarHBondContact O-N 3.49Å; V29-V31 VanDerWaalsContact C-N 3.32Å; V29-V31 PolarHBondContact O-N 3.24Å
30	Q	51.3	Low	59.2	Low	183 Å²	183	119.7 Å²	119.7	86%	0.855	63%	0.633	S	S	*	*			trans	-66.6	100.3	168.5	-71.4	-178.7	17.1	0	0	106.4	P28 P32	P28-Q30 PolarHBondContact O-N 2.82Å; Q30-P32 WeakPolarHBondContact O-CD 3.46Å
31	V	57.8	Low	60	Low	112 Å²	112	119.7 Å²	119.7	68%	0.679	64%	0.639	S	S	*	*			trans	-68	119.3	161.1	-178.4	0	0	0	0	104.5	V29 E33	V29-V31 VanDerWaalsContact C-N 3.32Å; V29-V31 PolarHBondContact O-N 3.24Å; V31-E33 PolarHBondContact O-N 3.5Å
32	P	55.6	Low	60.5	Low	80 Å²	80	113.8 Å²	113.8	52%	0.519	62%	0.621	S	S	.	*			trans	-55.4	118.2	171.3	20.9	-28.5	0	0	0	106.9	Q30 F34	Q30-P32 WeakPolarHBondContact O-CD 3.46Å; P32-F34 VanDerWaalsContact C-N 3.3Å; P32-F34 HydrophobicContact CG-CE2 4.05Å; P32-F34 HydrophobicContact CG-CZ 4.1Å; P32-F34 VanDerWaalsContact O-CD2 3.28Å; P32-F34 WeakPolarHBondContact O-CD2 3.44Å; P32-F34 PolarHBondContact O-N 3.2Å
33	E	54.6	Low	61.3	Low	178 Å²	178	114.7 Å²	114.7	83%	0.832	62%	0.623	S	S	*	*			trans	-64.8	101.1	170.9	-164.8	170.3	-155.1	0	0	105.2	V31 V35	V31-E33 PolarHBondContact O-N 3.5Å; E33-V35 VanDerWaalsContact C-N 3.28Å; E33-V35 PolarHBondContact O-N 3Å
34	F	56.6	Low	62.1	Low	133 Å²	133	114.2 Å²	114.2	58%	0.583	61%	0.613	S	S	*	*			trans	-67.2	98.8	171.8	-68	-84.3	0	0	0	105.5	P32 E36	P32-F34 VanDerWaalsContact C-N 3.3Å; P32-F34 HydrophobicContact CG-CE2 4.05Å; P32-F34 HydrophobicContact CG-CZ 4.1Å; P32-F34 VanDerWaalsContact O-CD2 3.28Å; P32-F34 WeakPolarHBondContact O-CD2 3.44Å; P32-F34 PolarHBondContact O-N 3.2Å; F34-E36 HydrophobicContact CB-CG 3.95Å; F34-E36 PolarHBondContact O-N 3.19Å
35	V	53.8	Low	62.7	Low	108 Å²	108	110.5 Å²	110.5	66%	0.655	60%	0.6	S	S	*	*			trans	-69.9	80.2	165.8	-176.7	0	0	0	0	105.9	E33 D37	E33-V35 VanDerWaalsContact C-N 3.28Å; E33-V35 PolarHBondContact O-N 3Å; V35-D37 VanDerWaalsContact C-N 3.26Å; V35-D37 PolarHBondContact O-N 2.86Å; V35-D37 VanDerWaalsContact O-N 3.1Å
36	E	54.2	Low	63.2	Low	83 Å²	83	110 Å²	110	39%	0.388	59%	0.588	S	S	.	*			trans	-81.7	74.4	177.3	-83.2	162.2	161.1	0	0	108.8	F34 D38 L42	F34-E36 HydrophobicContact CB-CG 3.95Å; F34-E36 PolarHBondContact O-N 3.19Å; E36-D38 PolarHBondContact O-N 2.91Å; E36-L42 HydrophobicContact CB-CD1 3.75Å; E36-L42 HydrophobicContact CB-CG 4.17Å; E36-L42 VanDerWaalsContact CD-CD2 3.41Å; E36-L42 HydrophobicContact CG-CD1 3.99Å; E36-L42 HydrophobicContact CG-CD2 4.46Å; E36-L42 HydrophobicContact CG-CG 3.84Å; E36-L42 WeakPolarHBondContact OE1-CD2 3.47Å; E36-L42 WeakPolarHBondContact OE1-CG 3.21Å; E36-L42 WeakPolarHBondContact OE2-CD1 3.44Å; E36-L42 WeakPolarHBondContact OE2-CD2 3.31Å
37	D	58.4	Low	63.7	Low	148 Å²	148	106.9 Å²	106.9	79%	0.791	57%	0.567	S	S	*	*			trans	-74.7	-11.9	174.8	-80.9	-27.4	0	0	0	112.7	V35	V35-D37 VanDerWaalsContact C-N 3.26Å; V35-D37 PolarHBondContact O-N 2.86Å; V35-D37 VanDerWaalsContact O-N 3.1Å
38	D	65.6	Low	64.3	Low	77 Å²	77	110.9 Å²	110.9	41%	0.412	58%	0.575	S	S	.	*			trans	-118.3	107.4	178.7	-167.3	-11.8	0	0	0	112.4	E36 Q40 V41	E36-D38 PolarHBondContact O-N 2.91Å; D38-Q40 PolarHBondContact O-N 3.36Å; D38-Q40 VanDerWaalsContact O-N 3.14Å; D38-Q40 WeakPolarHBondContact OD1-CB 3.46Å; D38-Q40 PolarHBondContact OD1-N 3.47Å; D38-V41 HydrophobicContact CB-CB 4.5Å; D38-V41 HydrophobicContact CB-CG2 3.93Å; D38-V41 PolarHBondContact O-N 3.04Å; D38-V41 VanDerWaalsContact O-N 3.14Å
39	P	69.6	Low	64.8	Low	88 Å²	88	111.5 Å²	111.5	57%	0.571	57%	0.567	S	S	*	*	H	α-helix	trans	-62.1	-19.6	177.8	25.6	-33.8	0	0	0	113.5	L43	P39-L43 WeakPolarHBondContact O-CG 3.33Å; P39-L43 PolarHBondContact O-N 3.2Å
40	Q	73.6	Confident	64.6	Low	132 Å²	132	115.3 Å²	115.3	62%	0.617	57%	0.571	S	S	*	*	H	α-helix	trans	-70.2	-38.7	174.6	-73.8	-156.2	-13.7	0	0	112.6	D38 L42 L43 D44	D38-Q40 PolarHBondContact O-N 3.36Å; D38-Q40 VanDerWaalsContact O-N 3.14Å; D38-Q40 WeakPolarHBondContact OD1-CB 3.46Å; D38-Q40 PolarHBondContact OD1-N 3.47Å; Q40-L42 VanDerWaalsContact C-N 3.29Å; Q40-L42 PolarHBondContact O-N 3.36Å; Q40-L43 PolarHBondContact O-N 3.28Å; Q40-L43 VanDerWaalsContact O-N 3.14Å; Q40-D44 PolarHBondContact O-N 3.12Å
41	V	70.5	Confident	65	Low	76 Å²	76	109.9 Å²	109.9	46%	0.461	55%	0.553	S	S	.	*	H	α-helix	trans	-63.2	-40.8	179.3	178	0	0	0	0	110.4	D38 L43 D44 M45	D38-V41 HydrophobicContact CB-CB 4.5Å; D38-V41 HydrophobicContact CB-CG2 3.93Å; D38-V41 PolarHBondContact O-N 3.04Å; D38-V41 VanDerWaalsContact O-N 3.14Å; V41-L43 PolarHBondContact O-N 3.23Å; V41-D44 PolarHBondContact O-N 3.04Å; V41-M45 HydrophobicContact CG1-SD 4.4Å; V41-M45 WeakPolarHBondContact O-CB 3.46Å; V41-M45 WeakPolarHBondContact O-CG 3.48Å; V41-M45 PolarHBondContact O-N 2.87Å
42	L	69.1	Low	64.9	Low	55 Å²	55	111.6 Å²	111.6	29%	0.288	55%	0.549	S	S	.	.	H	α-helix	trans	-58.6	-44.6	172.6	-100.9	164.7	0	0	0	112.9	E36 Q40 R46	E36-L42 HydrophobicContact CB-CD1 3.75Å; E36-L42 HydrophobicContact CB-CG 4.17Å; E36-L42 VanDerWaalsContact CD-CD2 3.41Å; E36-L42 HydrophobicContact CG-CD1 3.99Å; E36-L42 HydrophobicContact CG-CD2 4.46Å; E36-L42 HydrophobicContact CG-CG 3.84Å; E36-L42 WeakPolarHBondContact OE1-CD2 3.47Å; E36-L42 WeakPolarHBondContact OE1-CG 3.21Å; E36-L42 WeakPolarHBondContact OE2-CD1 3.44Å; E36-L42 WeakPolarHBondContact OE2-CD2 3.31Å; Q40-L42 VanDerWaalsContact C-N 3.29Å; Q40-L42 PolarHBondContact O-N 3.36Å; L42-R46 WeakPolarHBondContact O-CB 3.37Å; L42-R46 PolarHBondContact O-N 3.02Å
43	L	73.6	Confident	65.1	Low	90 Å²	90	110.5 Å²	110.5	47%	0.471	54%	0.543	S	S	.	.	H	α-helix	trans	-66.2	-40.6	178.6	-75	168.8	0	0	0	111.6	P39 Q40 V41 R46 K47	P39-L43 WeakPolarHBondContact O-CG 3.33Å; P39-L43 PolarHBondContact O-N 3.2Å; Q40-L43 PolarHBondContact O-N 3.28Å; Q40-L43 VanDerWaalsContact O-N 3.14Å; V41-L43 PolarHBondContact O-N 3.23Å; L43-R46 PolarHBondContact O-N 3.02Å; L43-K47 VanDerWaalsContact O-CG 3.32Å; L43-K47 WeakPolarHBondContact O-CG 3.29Å; L43-K47 PolarHBondContact O-N 2.85Å
44	D	76	Confident	65.2	Low	78 Å²	78	109.6 Å²	109.6	42%	0.417	54%	0.536	S	S	.	.	H	α-helix	trans	-72.9	-38.7	-179.6	-72.7	-14.3	0	0	0	112.4	Q40 V41 R46 K47 Q48	Q40-D44 PolarHBondContact O-N 3.12Å; V41-D44 PolarHBondContact O-N 3.04Å; D44-R46 VanDerWaalsContact C-N 3.3Å; D44-R46 PolarHBondContact O-N 2.96Å; D44-K47 PolarHBondContact O-N 2.98Å; D44-K47 IonicContact OD1-NZ 3.49Å; D44-K47 PolarHBondContact OD1-NZ 3.13Å; D44-Q48 PolarHBondContact O-N 2.98Å
45	M	72.2	Confident	65.3	Low	94 Å²	94	110.3 Å²	110.3	46%	0.463	54%	0.541	S	S	.	.	H	α-helix	trans	-58.1	-43.9	169.2	-79.3	-174.8	57.2	0	0	111.4	V41 Q48 Q49	V41-M45 HydrophobicContact CG1-SD 4.4Å; V41-M45 WeakPolarHBondContact O-CB 3.46Å; V41-M45 WeakPolarHBondContact O-CG 3.48Å; V41-M45 PolarHBondContact O-N 2.87Å; M45-Q48 PolarHBondContact O-N 2.81Å; M45-Q49 PolarHBondContact O-N 3.44Å
46	R	72.1	Confident	65.5	Low	125 Å²	125	109.4 Å²	109.4	47%	0.472	53%	0.529	S	S	.	.	H	α-helix	trans	-64.1	-42.1	177.5	-171.6	-179.9	-63.9	167.1	2.1	112.1	L42 L43 D44 Q48 Q49 W50	L42-R46 WeakPolarHBondContact O-CB 3.37Å; L42-R46 PolarHBondContact O-N 3.02Å; L43-R46 PolarHBondContact O-N 3.02Å; D44-R46 VanDerWaalsContact C-N 3.3Å; D44-R46 PolarHBondContact O-N 2.96Å; R46-Q48 PolarHBondContact O-N 3.36Å; R46-Q49 PolarHBondContact O-N 3.01Å; R46-W50 HydrophobicContact CG-CD2 4.43Å; R46-W50 HydrophobicContact CG-CZ2 4.18Å; R46-W50 PolarHBondContact O-N 3.34Å
47	K	73.8	Confident	65.7	Low	123 Å²	123	111.3 Å²	111.3	54%	0.535	54%	0.538	S	S	.	.	H	α-helix	trans	-61.4	-42.4	175.7	-73	171.5	-164.5	157	0	112	L43 D44 W50 S51	L43-K47 VanDerWaalsContact O-CG 3.32Å; L43-K47 WeakPolarHBondContact O-CG 3.29Å; L43-K47 PolarHBondContact O-N 2.85Å; D44-K47 PolarHBondContact O-N 2.98Å; D44-K47 IonicContact OD1-NZ 3.49Å; D44-K47 PolarHBondContact OD1-NZ 3.13Å; K47-W50 PolarHBondContact O-N 3.39Å; K47-S51 PolarHBondContact O-N 3.45Å; K47-S51 PolarHBondContact O-OG 3.03Å
48	Q	70.7	Confident	65.6	Low	148 Å²	148	106.1 Å²	106.1	69%	0.692	52%	0.519	S	S	*	.	H	α-helix	trans	-64.3	-43.5	176.2	-79.7	-176.3	-11.3	0	0	111.7	D44 M45 R46 W50 S51 Y52	D44-Q48 PolarHBondContact O-N 2.98Å; M45-Q48 PolarHBondContact O-N 2.81Å; R46-Q48 PolarHBondContact O-N 3.36Å; Q48-W50 VanDerWaalsContact C-N 3.32Å; Q48-W50 PolarHBondContact O-N 3.49Å; Q48-S51 PolarHBondContact O-N 3.2Å; Q48-Y52 PolarHBondContact O-N 2.95Å
49	Q	68.5	Low	65.3	Low	132 Å²	132	107.4 Å²	107.4	62%	0.617	52%	0.523	S	S	*	.	H	α-helix	trans	-60.8	-41.9	177.6	-170.7	-178.8	-3.5	0	0	111.7	M45 R46 Y52 S53	M45-Q49 PolarHBondContact O-N 3.44Å; R46-Q49 PolarHBondContact O-N 3.01Å; Q49-Y52 PolarHBondContact O-N 3.04Å; Q49-S53 PolarHBondContact O-N 3.19Å; Q49-S53 VanDerWaalsContact O-N 3.12Å; Q49-S53 PolarHBondContact O-OG 2.92Å
50	W	58.4	Low	64.8	Low	178 Å²	178	108.4 Å²	108.4	67%	0.674	52%	0.522	S	S	*	.	H	α-helix	trans	-66	-38.4	176.8	-71.4	2.9	0	0	0	112.8	R46 K47 Q48 S53 F54	R46-W50 HydrophobicContact CG-CD2 4.43Å; R46-W50 HydrophobicContact CG-CZ2 4.18Å; R46-W50 PolarHBondContact O-N 3.34Å; K47-W50 PolarHBondContact O-N 3.39Å; Q48-W50 VanDerWaalsContact C-N 3.32Å; Q48-W50 PolarHBondContact O-N 3.49Å; W50-S53 PolarHBondContact O-N 3.09Å; W50-F54 PolarHBondContact O-N 3.01Å; W50-F54 VanDerWaalsContact O-N 3.11Å
51	S	59.8	Low	64	Low	69 Å²	69	106.8 Å²	106.8	48%	0.483	52%	0.521	S	S	.	.	H	α-helix	trans	-63	-43.1	176.8	-53.9	0	0	0	0	111.2	K47 Q48 S53 F54 E55	K47-S51 PolarHBondContact O-N 3.45Å; K47-S51 PolarHBondContact O-OG 3.03Å; Q48-S51 PolarHBondContact O-N 3.2Å; S51-S53 PolarHBondContact O-N 2.8Å; S51-F54 PolarHBondContact O-N 3.42Å; S51-E55 PolarHBondContact O-N 2.81Å
52	Y	56.8	Low	63.5	Low	149 Å²	149	106 Å²	106	58%	0.584	52%	0.519	S	S	*	.	H	α-helix	trans	-64	-39	176.9	-172.5	-97.6	0	0	0	112.8	Q48 Q49 K56	Q48-Y52 PolarHBondContact O-N 2.95Å; Q49-Y52 PolarHBondContact O-N 3.04Å; Y52-K56 HydrophobicContact CD1-CG 4.28Å; Y52-K56 HydrophobicContact CE1-CG 3.89Å; Y52-K56 WeakPolarHBondContact O-CB 3.23Å; Y52-K56 WeakPolarHBondContact O-CG 3.41Å; Y52-K56 PolarHBondContact O-N 3.45Å; Y52-K56 VanDerWaalsContact O-N 3.16Å; Y52-K56 VanDerWaalsContact OH-CE 3.3Å; Y52-K56 WeakPolarHBondContact OH-CE 3.41Å
53	S	59.2	Low	63	Low	56 Å²	56	108.7 Å²	108.7	39%	0.392	53%	0.533	S	S	.	.	H	α-helix	trans	-65.2	-41.5	177.4	-64.3	0	0	0	0	112.3	Q49 W50 S51 K56 E57	Q49-S53 PolarHBondContact O-N 3.19Å; Q49-S53 VanDerWaalsContact O-N 3.12Å; Q49-S53 PolarHBondContact O-OG 2.92Å; W50-S53 PolarHBondContact O-N 3.09Å; S51-S53 PolarHBondContact O-N 2.8Å; S53-K56 PolarHBondContact O-N 3.26Å; S53-E57 PolarHBondContact O-N 3.16Å
54	F	56	Low	62.2	Low	159 Å²	159	112 Å²	112	70%	0.697	54%	0.543	S	S	*	.	H	α-helix	trans	-69.8	-39.3	-177.3	-140.1	-89.5	0	0	0	112.3	W50 S51 E57 G58	W50-F54 PolarHBondContact O-N 3.01Å; W50-F54 VanDerWaalsContact O-N 3.11Å; S51-F54 PolarHBondContact O-N 3.42Å; F54-E57 PolarHBondContact O-N 3.37Å; F54-G58 PolarHBondContact O-N 3.1Å; F54-G58 VanDerWaalsContact O-N 3.1Å
55	E	58.7	Low	61.4	Low	148 Å²	148	114.7 Å²	114.7	69%	0.692	55%	0.554	S	S	*	*	H	α-helix	trans	-64.1	-41	174.1	-71.5	-178.5	176.3	0	0	111.6	S51 G58 E59	S51-E55 PolarHBondContact O-N 2.81Å; E55-G58 PolarHBondContact O-N 3.23Å; E55-E59 PolarHBondContact O-N 3.21Å; E55-E59 VanDerWaalsContact O-N 3.16Å
56	K	59.3	Low	60.6	Low	89 Å²	89	117.8 Å²	117.8	39%	0.387	56%	0.564	S	S	.	*	H	α-helix	trans	-65.7	-39.3	176.4	-83.1	-76.2	177.8	-163.4	0	112.9	Y52 S53 E59 I60	Y52-K56 HydrophobicContact CD1-CG 4.28Å; Y52-K56 HydrophobicContact CE1-CG 3.89Å; Y52-K56 WeakPolarHBondContact O-CB 3.23Å; Y52-K56 WeakPolarHBondContact O-CG 3.41Å; Y52-K56 PolarHBondContact O-N 3.45Å; Y52-K56 VanDerWaalsContact O-N 3.16Å; Y52-K56 VanDerWaalsContact OH-CE 3.3Å; Y52-K56 WeakPolarHBondContact OH-CE 3.41Å; S53-K56 PolarHBondContact O-N 3.26Å; K56-E59 IonicContact NZ-OE2 2.86Å; K56-E59 PolarHBondContact NZ-OE2 3.14Å; K56-E59 PolarHBondContact O-N 3.43Å; K56-I60 VanDerWaalsContact O-CG1 3.31Å; K56-I60 WeakPolarHBondContact O-CG1 3.3Å; K56-I60 PolarHBondContact O-N 2.94Å; K56-I60 VanDerWaalsContact O-N 3.14Å
57	E	57.1	Low	59.8	Low	124 Å²	124	115.1 Å²	115.1	58%	0.579	57%	0.565	S	S	*	*	H	α-helix	trans	-66.4	-40.6	176.4	-78.7	-173.8	164.6	0	0	112	S53 F54 E59 I60 V61	S53-E57 PolarHBondContact O-N 3.16Å; F54-E57 PolarHBondContact O-N 3.37Å; E57-E59 VanDerWaalsContact C-N 3.29Å; E57-E59 PolarHBondContact O-N 2.95Å; E57-I60 PolarHBondContact O-N 3.37Å; E57-V61 WeakPolarHBondContact O-CG2 3.32Å; E57-V61 PolarHBondContact O-N 2.98Å
58	G	57.9	Low	58.9	Low	38 Å²	38	113.6 Å²	113.6	39%	0.392	57%	0.57	S	S	.	*	H	α-helix	trans	-60.8	-36.6	174.3	0	0	0	0	0	113.3	F54 E55 S62	F54-G58 PolarHBondContact O-N 3.1Å; F54-G58 VanDerWaalsContact O-N 3.1Å; E55-G58 PolarHBondContact O-N 3.23Å; G58-S62 WeakPolarHBondContact O-CB 3.41Å; G58-S62 PolarHBondContact O-N 3.46Å; G58-S62 VanDerWaalsContact O-N 3.09Å; G58-S62 PolarHBondContact O-OG 3.18Å
59	E	58	Low	58	Low	105 Å²	105	113 Å²	113	49%	0.491	57%	0.57	S	S	.	*	H	α-helix	trans	-66.9	-40.5	175.8	-164.5	177.2	-161	0	0	111.8	E55 K56 E57 S62 L63	E55-E59 PolarHBondContact O-N 3.21Å; E55-E59 VanDerWaalsContact O-N 3.16Å; K56-E59 IonicContact NZ-OE2 2.86Å; K56-E59 PolarHBondContact NZ-OE2 3.14Å; K56-E59 PolarHBondContact O-N 3.43Å; E57-E59 VanDerWaalsContact C-N 3.29Å; E57-E59 PolarHBondContact O-N 2.95Å; E59-S62 PolarHBondContact O-N 3.33Å; E59-L63 HydrophobicContact CG-CD1 4.39Å; E59-L63 PolarHBondContact O-N 3.03Å
60	I	58.8	Low	57.3	Low	109 Å²	109	113.9 Å²	113.9	56%	0.559	58%	0.579	S	S	*	*	H	α-helix	trans	-67.9	-41.6	178.2	-65.6	164.4	0	0	0	111.3	K56 E57 S62 L63 K64	K56-I60 VanDerWaalsContact O-CG1 3.31Å; K56-I60 WeakPolarHBondContact O-CG1 3.3Å; K56-I60 PolarHBondContact O-N 2.94Å; K56-I60 VanDerWaalsContact O-N 3.14Å; E57-I60 PolarHBondContact O-N 3.37Å; I60-S62 VanDerWaalsContact C-N 3.32Å; I60-S62 PolarHBondContact O-N 3Å; I60-L63 PolarHBondContact O-N 3Å; I60-K64 PolarHBondContact O-N 2.98Å
61	V	57.4	Low	57	Low	97 Å²	97	109.8 Å²	109.8	59%	0.588	58%	0.577	S	S	*	*	H	α-helix	trans	-62.8	-42.1	175.9	175.4	0	0	0	0	110.6	E57 L63 K64 E65	E57-V61 WeakPolarHBondContact O-CG2 3.32Å; E57-V61 PolarHBondContact O-N 2.98Å; V61-L63 PolarHBondContact O-N 3.09Å; V61-K64 PolarHBondContact O-N 3.48Å; V61-E65 PolarHBondContact O-N 2.89Å
62	S	60.8	Low	56.5	Low	61 Å²	61	109.4 Å²	109.4	43%	0.427	59%	0.585	S	S	.	*	H	α-helix	trans	-65.5	-35	178	-59.1	0	0	0	0	113.2	G58 E59 I60 K66	G58-S62 WeakPolarHBondContact O-CB 3.41Å; G58-S62 PolarHBondContact O-N 3.46Å; G58-S62 VanDerWaalsContact O-N 3.09Å; G58-S62 PolarHBondContact O-OG 3.18Å; E59-S62 PolarHBondContact O-N 3.33Å; I60-S62 VanDerWaalsContact C-N 3.32Å; I60-S62 PolarHBondContact O-N 3Å; S62-K66 WeakPolarHBondContact O-CG 3.28Å; S62-K66 PolarHBondContact O-N 3.17Å
63	L	57.5	Low	56	Low	111 Å²	111	110.1 Å²	110.1	58%	0.581	60%	0.598	S	S	*	*	H	α-helix	trans	-71.2	-34.9	174.3	-83.6	158.5	0	0	0	112.4	E59 I60 V61 S67	E59-L63 HydrophobicContact CG-CD1 4.39Å; E59-L63 PolarHBondContact O-N 3.03Å; I60-L63 PolarHBondContact O-N 3Å; V61-L63 PolarHBondContact O-N 3.09Å; L63-S67 PolarHBondContact O-N 2.09Å; L63-S67 VanDerWaalsContact O-N 3.12Å; L63-S67 PolarHBondContact O-OG 3.43Å
64	K	58.2	Low	55.3	Low	159 Å²	159	113 Å²	113	69%	0.691	62%	0.618	S	S	*	*	H	α-helix	trans	-70.5	-34.8	177.2	-161.8	175.2	179.7	-175.8	0	112.4	I60 V61 S67 S68	I60-K64 PolarHBondContact O-N 2.98Å; V61-K64 PolarHBondContact O-N 3.48Å; K64-S67 WeakPolarHBondContact CA-OG 3.14Å; K64-S67 PolarHBondContact O-OG 3.36Å; K64-S68 PolarHBondContact O-N 3.42Å
65	E	58.1	Low	54.8	Low	135 Å²	135	110.8 Å²	110.8	63%	0.631	62%	0.623	S	S	*	*	H	α-helix	trans	-69.8	-41.6	175.2	-166.4	174.8	-177.4	0	0	111.9	V61 S67 S68	V61-E65 PolarHBondContact O-N 2.89Å; E65-S67 PolarHBondContact O-N 2.82Å; E65-S68 PolarHBondContact O-N 3.35Å
66	K	56.5	Low	54	Low	158 Å²	158	110 Å²	110	69%	0.687	63%	0.628	S	S	*	*	H	α-helix	trans	-67.5	-33.7	177.4	-73.7	174.6	176.7	173.9	0	113.5	S62	S62-K66 WeakPolarHBondContact O-CG 3.28Å; S62-K66 PolarHBondContact O-N 3.17Å
67	S	55.3	Low	53.2	Low	70 Å²	70	110.7 Å²	110.7	49%	0.49	64%	0.644	S	S	.	*	H	α-helix	trans	-78.6	-20.5	177.4	50.7	0	0	0	0	114	L63 K64 E65 I69 S71	L63-S67 PolarHBondContact O-N 2.09Å; L63-S67 VanDerWaalsContact O-N 3.12Å; L63-S67 PolarHBondContact O-OG 3.43Å; K64-S67 WeakPolarHBondContact CA-OG 3.14Å; K64-S67 PolarHBondContact O-OG 3.36Å; E65-S67 PolarHBondContact O-N 2.82Å; S67-I69 VanDerWaalsContact C-N 3.32Å; S67-S71 PolarHBondContact O-OG 3.34Å
68	S	53.5	Low	52.2	Low	90 Å²	90	116 Å²	116	63%	0.629	66%	0.659	S	S	*	*	H	α-helix	trans	-75	-18.9	174.7	-175.2	0	0	0	0	113.6	K64 E65	K64-S68 PolarHBondContact O-N 3.42Å; E65-S68 PolarHBondContact O-N 3.35Å
69	I	53.2	Low	51.2	Low	135 Å²	135	119.5 Å²	119.5	69%	0.692	68%	0.676	S	S	*	*	H	α-helix	trans	-90.5	-30.5	-179.2	-63.3	166.7	0	0	0	111.1	S67	S67-I69 VanDerWaalsContact C-N 3.32Å
70	D	52.6	Low	50.3	Low	151 Å²	151	120.3 Å²	120.3	81%	0.807	69%	0.693	S	S	*	*	H	α-helix	trans	-89.1	-9.2	-179	-105.5	-14.8	0	0	0	114.9	G72	D70-G72 PolarHBondContact O-N 3.49Å
71	S	53.1	Low	49.8	Very low	92 Å²	92	119.5 Å²	119.5	64%	0.643	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	7.1	-177.7	45.4	0	0	0	0	114.9	S67	S67-S71 PolarHBondContact O-OG 3.34Å
72	G	47.6	Very low	48.9	Very low	62 Å²	62	120.4 Å²	120.4	64%	0.639	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-16.7	-176	0	0	0	0	0	117.1	D70	D70-G72 PolarHBondContact O-N 3.49Å
73	N	47.5	Very low	47.9	Very low	163 Å²	163	127.6 Å²	127.6	87%	0.872	73%	0.732	S	S	*	*			trans	-143	63.7	-168.7	-83.9	-10.5	0	0	0	113.7
74	S	44.1	Very low	46.9	Very low	116 Å²	116	128 Å²	128	81%	0.811	74%	0.743	S	S	*	*			trans	-131.5	83.4	158	71.9	0	0	0	0	111.5	V76	S74-V76 PolarHBondContact O-N 3.37Å
75	S	45.3	Very low	45.9	Very low	113 Å²	113	123.8 Å²	123.8	79%	0.79	75%	0.746	S	S	*	*			trans	-57.9	118.5	160.6	51.1	0	0	0	0	109.8	S77	S75-S77 PolarHBondContact O-N 3.11Å
76	V	42.1	Very low	44.8	Very low	133 Å²	133	121.3 Å²	121.3	81%	0.806	76%	0.757	S	S	*	*			trans	-5.8	106.4	152	-166.1	0	0	0	0	114.2	S74	S74-V76 PolarHBondContact O-N 3.37Å
77	S	41.9	Very low	43.9	Very low	102 Å²	102	119.5 Å²	119.5	71%	0.713	76%	0.764	S	S	*	*			trans	-128.5	108.5	154.8	-176	0	0	0	0	109.1	S75 C79	S75-S77 PolarHBondContact O-N 3.11Å; S77-C79 PolarHBondContact O-N 3.16Å
78	R	37.1	Very low	42.9	Very low	236 Å²	236	121 Å²	121	89%	0.891	77%	0.774	S	S	*	*			trans	-68.7	106.8	165.8	-70.6	177.7	-177.5	166.8	0.5	107.5
79	C	36.7	Very low	42.2	Very low	112 Å²	112	123.2 Å²	123.2	76%	0.757	78%	0.778	S	S	*	*			trans	-125.4	102	160.9	-92	0	0	0	0	109.9	S77	S77-C79 PolarHBondContact O-N 3.16Å
80	S	39.9	Very low	41.3	Very low	122 Å²	122	123.2 Å²	123.2	85%	0.853	78%	0.784	S	S	*	*			trans	-53.9	124.1	156.3	-38.3	0	0	0	0	109.7
81	S	47.4	Very low	40.4	Very low	91 Å²	91	119.7 Å²	119.7	64%	0.636	78%	0.783	S	S	*	*			trans	-157.9	106	152.4	60.5	0	0	0	0	110.5	F83	S81-F83 PolarHBondContact O-N 3.2Å
82	S	38.4	Very low	39.9	Very low	117 Å²	117	125 Å²	125	82%	0.818	80%	0.795	S	S	*	*			trans	-21.2	119.9	152.2	41.1	0	0	0	0	115.5
83	F	40	Very low	39.3	Very low	212 Å²	212	130.3 Å²	130.3	93%	0.93	81%	0.807	S	S	*	*			trans	-106.1	98.1	152.5	-99.8	-88.5	0	0	0	108.8	S81	S81-F83 PolarHBondContact O-N 3.2Å
84	S	36.5	Very low	38.6	Very low	118 Å²	118	126.2 Å²	126.2	83%	0.825	80%	0.804	S	S	*	*			trans	-93.1	125.6	158.5	161.7	0	0	0	0	106.1
85	G	38	Very low	38	Very low	72 Å²	72	126.8 Å²	126.8	74%	0.742	80%	0.802	S	S	*	*			trans	177.7	67	-178.2	0	0	0	0	0	111.1
86	G	33.5	Very low	37.9	Very low	83 Å²	83	129.2 Å²	129.2	86%	0.856	81%	0.805	S	S	*	*			trans	-65.4	138.2	164.6	0	0	0	0	0	110.5
87	S	38.5	Very low	37.8	Very low	119 Å²	119	128.3 Å²	128.3	83%	0.832	80%	0.802	S	S	*	*			trans	-156.8	136.9	144.4	-166	0	0	0	0	109.9
88	S	33.3	Very low	37.5	Very low	102 Å²	102	128.5 Å²	128.5	71%	0.713	81%	0.81	S	S	*	*			trans	-72.8	177.3	-173.7	-178.9	0	0	0	0	112.1
89	I	39.9	Very low	37.3	Very low	137 Å²	137	121.8 Å²	121.8	70%	0.703	81%	0.805	S	S	*	*			trans	103.5	92.5	152.3	-44.7	150.4	0	0	0	116
90	T	33.2	Very low	37	Very low	135 Å²	135	119.6 Å²	119.6	83%	0.828	80%	0.802	S	S	*	*			trans	41.1	120.3	137.3	58.1	0	0	0	0	120.4
91	G	33.9	Very low	36.7	Very low	76 Å²	76	121.2 Å²	121.2	78%	0.784	80%	0.799	S	S	*	*			trans	-152.8	80.2	169.6	0	0	0	0	0	114.5
92	K	44	Very low	35.9	Very low	205 Å²	205	126.9 Å²	126.9	89%	0.891	81%	0.808	S	S	*	*			trans	58.6	98.7	151.2	-61.6	178.2	-180	178.6	0	119.1	G94	K92-G94 PolarHBondContact O-N 3.37Å
93	L	34.7	Very low	35.6	Very low	172 Å²	172	125.9 Å²	125.9	90%	0.901	81%	0.806	S	S	*	*			trans	-53.1	114	140.3	-93.6	108.3	0	0	0	108.6	V95	L93-V95 PolarHBondContact O-N 3.47Å; L93-V95 VanDerWaalsContact O-N 3.13Å
94	G	32.2	Very low	35.2	Very low	77 Å²	77	123.2 Å²	123.2	79%	0.794	80%	0.802	S	S	*	*			trans	-74.4	95.6	170.7	0	0	0	0	0	110.5	K92 L96	K92-G94 PolarHBondContact O-N 3.37Å; G94-L96 PolarHBondContact O-N 3.2Å
95	V	32.5	Very low	35.1	Very low	129 Å²	129	125.3 Å²	125.3	78%	0.782	80%	0.804	S	S	*	*			trans	-69.9	114.3	164	174.2	0	0	0	0	107.7	L93	L93-V95 PolarHBondContact O-N 3.47Å; L93-V95 VanDerWaalsContact O-N 3.13Å
96	L	43	Very low	35	Very low	163 Å²	163	131 Å²	131	85%	0.853	81%	0.808	S	S	*	*			trans	-84.2	139.4	164.1	-81.3	165.2	0	0	0	109.1	G94	G94-L96 PolarHBondContact O-N 3.2Å
97	P	39.5	Very low	35.3	Very low	114 Å²	114	131.5 Å²	131.5	74%	0.74	80%	0.804	S	S	*	*			trans	-77.1	136.2	-163.4	30.7	-33.7	0	0	0	112.2
98	A	34.9	Very low	35.6	Very low	107 Å²	107	131.7 Å²	131.7	88%	0.884	80%	0.803	S	S	*	*			trans	-86.1	107.8	159.9	0	0	0	0	0	108.6
99	A	33.8	Very low	35.9	Very low	94 Å²	94	132.9 Å²	132.9	78%	0.777	81%	0.805	S	S	*	*			trans	-173.6	116.4	155.3	0	0	0	0	0	111
100	G	30	Very low	36.2	Very low	67 Å²	67	131.3 Å²	131.3	69%	0.691	80%	0.804	S	S	*	*			trans	46.9	130.8	140.3	0	0	0	0	0	120.4
101	I	32.9	Very low	36.6	Very low	155 Å²	155	132.4 Å²	132.4	80%	0.795	80%	0.804	S	S	*	*				165.9	111.4	116.1	-80.8	153.3	0	0	0	108.3
102	Y	30.4	Very low	37	Very low	211 Å²	211	135.5 Å²	135.5	83%	0.827	80%	0.802	S	S	*	*			trans	55.3	111	143.9	-71.1	-100.8	0	0	0	120.5
103	A	32.2	Very low	36.9	Very low	95 Å²	95	131.8 Å²	131.8	79%	0.785	79%	0.792	S	S	*	*				28.6	99.3	126.6	0	0	0	0	0	117.1
104	N	33.3	Very low	37.2	Very low	156 Å²	156	129 Å²	129	83%	0.834	79%	0.785	S	S	*	*			trans	-148.8	118.6	139.7	-140.5	-45	0	0	0	109.4	K106	N104-K106 VanDerWaalsContact C-N 3.31Å; N104-K106 PolarHBondContact O-N 3.12Å
105	D	32.6	Very low	37.6	Very low	163 Å²	163	131.1 Å²	131.1	87%	0.872	78%	0.783	S	S	*	*			trans	-66.8	80.6	179.5	-71.3	-46	0	0	0	111
106	K	36.7	Very low	38.2	Very low	192 Å²	192	129.7 Å²	129.7	84%	0.835	78%	0.778	S	S	*	*			trans	-148.2	111.7	154.8	-77.5	-160.5	172.2	-179.6	0	108.4	N104	N104-K106 VanDerWaalsContact C-N 3.31Å; N104-K106 PolarHBondContact O-N 3.12Å
107	A	40	Very low	38.3	Very low	92 Å²	92	127.6 Å²	127.6	76%	0.76	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-48.1	132.3	176.5	0	0	0	0	0	110.4	V109	A107-V109 PolarHBondContact O-N 3.15Å; A107-V109 VanDerWaalsContact O-N 3.13Å
108	P	44.5	Very low	39	Very low	124 Å²	124	129.9 Å²	129.9	81%	0.805	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-66.9	117	178.8	26.4	-30.4	0	0	0	108.5
109	V	39.2	Very low	39.8	Very low	126 Å²	126	131.6 Å²	131.6	76%	0.764	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-57.5	126	168.5	178.6	0	0	0	0	107.3	A107 L111	A107-V109 PolarHBondContact O-N 3.15Å; A107-V109 VanDerWaalsContact O-N 3.13Å; V109-L111 PolarHBondContact O-N 2.77Å
110	P	45.9	Very low	40.7	Very low	105 Å²	105	132.8 Å²	132.8	68%	0.682	77%	0.771	S	S	*	*			trans	-66.6	112.7	177	18.4	-16.7	0	0	0	108.1	L112	P110-L112 VanDerWaalsContact C-N 3.34Å; P110-L112 PolarHBondContact O-N 2.88Å
111	L	43.2	Very low	41.5	Very low	157 Å²	157	134.9 Å²	134.9	82%	0.822	78%	0.775	S	S	*	*			trans	-60.8	99.7	164.9	-102.3	120.1	0	0	0	107.6	V109 N113	V109-L111 PolarHBondContact O-N 2.77Å; L111-N113 PolarHBondContact O-N 2.84Å
112	L	40.5	Very low	42.4	Very low	142 Å²	142	135 Å²	135	74%	0.743	78%	0.775	S	S	*	*			trans	-69.1	84.3	167.9	-71.7	169	0	0	0	107.9	P110 C114	P110-L112 VanDerWaalsContact C-N 3.34Å; P110-L112 PolarHBondContact O-N 2.88Å; L112-C114 PolarHBondContact O-N 3.49Å
113	N	42.8	Very low	43.3	Very low	127 Å²	127	130.7 Å²	130.7	68%	0.679	77%	0.771	S	S	*	*			trans	-68.6	88.9	163.7	-99.9	-6.6	0	0	0	107.8	L111 T115	L111-N113 PolarHBondContact O-N 2.84Å; N113-T115 PolarHBondContact O-N 3.28Å
114	C	40.1	Very low	44.1	Very low	113 Å²	113	130.4 Å²	130.4	76%	0.764	77%	0.768	S	S	*	*			trans	-72.2	33.9	177.2	-63.1	0	0	0	0	113.4	L112	L112-C114 PolarHBondContact O-N 3.49Å
115	T	42.4	Very low	44.8	Very low	122 Å²	122	129.2 Å²	129.2	75%	0.748	77%	0.766	S	S	*	*			trans	-113	49	175	60	0	0	0	0	110.6	N113	N113-T115 PolarHBondContact O-N 3.28Å
116	S	43.2	Very low	45.3	Very low	98 Å²	98	126.5 Å²	126.5	69%	0.685	76%	0.76	S	S	*	*			trans	-102.9	77	163.8	70.2	0	0	0	0	108.9	L118	S116-L118 PolarHBondContact O-N 2.67Å; S116-L118 VanDerWaalsContact O-N 3.15Å
117	V	47	Very low	45.4	Very low	119 Å²	119	122.2 Å²	122.2	72%	0.721	76%	0.761	S	S	*	*			trans	-66.3	110.7	153.2	179.2	0	0	0	0	104.6	L119	V117-L119 HydrophobicContact CG1-CG 4.39Å; V117-L119 PolarHBondContact O-N 3.44Å
118	L	53.8	Low	45.1	Very low	162 Å²	162	127 Å²	127	85%	0.848	77%	0.767	S	S	*	*			trans	-64.2	86.4	170.8	-73.3	170.6	0	0	0	107.5	S116	S116-L118 PolarHBondContact O-N 2.67Å; S116-L118 VanDerWaalsContact O-N 3.15Å
119	L	52.2	Low	45.1	Very low	144 Å²	144	125.2 Å²	125.2	75%	0.754	76%	0.763	S	S	*	*			trans	-66.8	128.6	169.8	-75.3	162	0	0	0	107.4	V117 S121	V117-L119 HydrophobicContact CG1-CG 4.39Å; V117-L119 PolarHBondContact O-N 3.44Å; L119-S121 PolarHBondContact O-N 2.86Å
120	P	50.7	Low	45.1	Very low	119 Å²	119	129.1 Å²	129.1	77%	0.773	77%	0.773	S	S	*	*			trans	-60.7	112.7	174.6	22.4	-29.5	0	0	0	108.8	I122	P120-I122 PolarHBondContact O-N 2.9Å
121	S	48	Very low	45.2	Very low	110 Å²	110	130.2 Å²	130.2	77%	0.769	78%	0.777	S	S	*	*			trans	-70.9	117.8	172	-178.4	0	0	0	0	108.6	L119 V123	L119-S121 PolarHBondContact O-N 2.86Å; S121-V123 PolarHBondContact O-N 3Å
122	I	51.7	Low	45.3	Very low	158 Å²	158	132 Å²	132	81%	0.81	78%	0.778	S	S	*	*			trans	-68.6	111.9	172.9	-60.8	169.9	0	0	0	107	P120 A124	P120-I122 PolarHBondContact O-N 2.9Å; I122-A124 PolarHBondContact O-N 3.33Å
123	V	49.7	Very low	45.4	Very low	121 Å²	121	130.3 Å²	130.3	73%	0.733	79%	0.785	S	S	*	*			trans	-69	103.5	167.8	-177.7	0	0	0	0	106.9	S121 V125	S121-V123 PolarHBondContact O-N 3Å; V123-V125 PolarHBondContact O-N 3.39Å
124	A	47.9	Very low	45.9	Very low	89 Å²	89	133.6 Å²	133.6	74%	0.736	79%	0.793	S	S	*	*			trans	-62.7	102.5	170.4	0	0	0	0	0	108.3	I122 S126	I122-A124 PolarHBondContact O-N 3.33Å; A124-S126 PolarHBondContact O-N 3.34Å
125	V	48.4	Very low	46.4	Very low	130 Å²	130	134.9 Å²	134.9	79%	0.788	80%	0.798	S	S	*	*			trans	-71.6	99.7	172.3	-179.6	0	0	0	0	106.8	V123 A127	V123-V125 PolarHBondContact O-N 3.39Å; V125-A127 PolarHBondContact O-N 2.88Å
126	S	42.9	Very low	47.1	Very low	107 Å²	107	133.5 Å²	133.5	75%	0.748	79%	0.793	S	S	*	*			trans	-61	118.6	167.6	46	0	0	0	0	108.4	A124 Q128	A124-S126 PolarHBondContact O-N 3.34Å; S126-Q128 PolarHBondContact O-N 2.82Å
127	A	38.9	Very low	48.1	Very low	102 Å²	102	134 Å²	134	84%	0.843	79%	0.794	S	S	*	*			trans	-66.7	92.5	179.7	0	0	0	0	0	110.3	V125	V125-A127 PolarHBondContact O-N 2.88Å
128	Q	35.1	Very low	48.9	Very low	192 Å²	192	133 Å²	133	90%	0.897	80%	0.798	S	S	*	*			trans	-158.2	83.1	164	-134.3	-173.8	17.6	0	0	112.1	S126	S126-Q128 PolarHBondContact O-N 2.82Å
129	A	42.8	Very low	49.4	Very low	86 Å²	86	130.2 Å²	130.2	71%	0.711	79%	0.788	S	S	*	*			trans	-169.1	111.1	148.3	0	0	0	0	0	108.9	V131	A129-V131 HydrophobicContact CB-CG2 4.4Å; A129-V131 PolarHBondContact O-N 3.35Å
130	Q	39.2	Very low	50.1	Low	208 Å²	208	126.5 Å²	126.5	97%	0.972	77%	0.768	S	S	*	*			trans	-60.2	100.8	168.1	-71.8	-177.3	-14.9	0	0	109.3
131	V	48.3	Very low	50.8	Low	128 Å²	128	126.5 Å²	126.5	78%	0.776	76%	0.761	S	S	*	*			trans	-114.6	115.5	168.6	-176.2	0	0	0	0	107.7	A129 A133	A129-V131 HydrophobicContact CB-CG2 4.4Å; A129-V131 PolarHBondContact O-N 3.35Å; V131-A133 PolarHBondContact O-N 2.93Å
132	K	46.7	Very low	51.6	Low	195 Å²	195	127.8 Å²	127.8	85%	0.848	75%	0.754	S	S	*	*			trans	-32.8	123.8	179.9	-71.9	173.7	173	179	0	112.4	K134	K132-K134 PolarHBondContact O-N 3.49Å
133	A	42.1	Very low	52	Low	106 Å²	106	126.6 Å²	126.6	88%	0.876	75%	0.745	S	S	*	*			trans	-50.8	100.8	172.2	0	0	0	0	0	110.5	V131	V131-A133 PolarHBondContact O-N 2.93Å
134	K	52.3	Low	52.5	Low	197 Å²	197	127.7 Å²	127.7	86%	0.857	74%	0.741	S	S	*	*			trans	-88.6	112.6	156.1	-71.5	-176	176.9	-178.6	0	105.3	K132 S136	K132-K134 PolarHBondContact O-N 3.49Å; K134-S136 PolarHBondContact O-N 3.16Å
135	T	51.2	Low	53.2	Low	140 Å²	140	130.2 Å²	130.2	86%	0.859	74%	0.737	S	S	*	*			trans	-40.4	109.8	169.8	41.6	0	0	0	0	110.2
136	S	58.1	Low	53.6	Low	92 Å²	92	131.4 Å²	131.4	64%	0.643	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-60	141.8	167.8	174.7	0	0	0	0	108.9	K134 A138	K134-S136 PolarHBondContact O-N 3.16Å; S136-A138 PolarHBondContact O-N 2.83Å
137	P	62.5	Low	54.3	Low	109 Å²	109	132.3 Å²	132.3	71%	0.708	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-55.7	137.9	165	26.1	-31.9	0	0	0	108.3	V139	P137-V139 PolarHBondContact O-N 3.04Å; P137-V139 VanDerWaalsContact O-N 3.12Å
138	A	64.8	Low	55.3	Low	98 Å²	98	134.9 Å²	134.9	81%	0.81	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-56.8	118.5	173.6	0	0	0	0	0	107.8	S136 N140	S136-A138 PolarHBondContact O-N 2.83Å; A138-N140 PolarHBondContact O-N 3.23Å
139	V	64	Low	56.6	Low	104 Å²	104	129.6 Å²	129.6	63%	0.63	72%	0.716	S	S	*	*			trans	-64.4	110	172.8	176.2	0	0	0	0	106.3	P137 I141 F144	P137-V139 PolarHBondContact O-N 3.04Å; P137-V139 VanDerWaalsContact O-N 3.12Å; V139-I141 PolarHBondContact O-N 3.42Å; V139-F144 HydrophobicContact CG1-CE2 4.03Å
140	N	66.9	Low	57.4	Low	65 Å²	65	129.1 Å²	129.1	35%	0.348	70%	0.704	S	S	.	*			trans	-75	105.2	173.4	-170.6	3.5	0	0	0	108.3	A138 E142 E143	A138-N140 PolarHBondContact O-N 3.23Å; N140-E142 PolarHBondContact O-N 3Å; N140-E142 VanDerWaalsContact OD1-CB 3.3Å; N140-E142 WeakPolarHBondContact OD1-CB 3.38Å; N140-E142 PolarHBondContact OD1-N 3.42Å; N140-E142 PolarHBondContact OD1-OE2 3.33Å; N140-E143 HydrophobicContact CB-CG 4.12Å; N140-E143 PolarHBondContact O-N 2.96Å
141	I	65.5	Low	58.6	Low	119 Å²	119	124.2 Å²	124.2	61%	0.61	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-66.4	-23.8	-179.2	-55.7	170	0	0	0	110.2	V139 E143 F144	V139-I141 PolarHBondContact O-N 3.42Å; I141-E143 PolarHBondContact O-N 3.04Å; I141-F144 PolarHBondContact O-N 3.43Å; I141-F144 VanDerWaalsContact O-N 3.09Å
142	E	64.1	Low	59.5	Low	137 Å²	137	125.2 Å²	125.2	64%	0.64	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-66.8	-22.9	177.3	-59.2	166	170.9	0	0	112.5	N140 F144	N140-E142 PolarHBondContact O-N 3Å; N140-E142 VanDerWaalsContact OD1-CB 3.3Å; N140-E142 WeakPolarHBondContact OD1-CB 3.38Å; N140-E142 PolarHBondContact OD1-N 3.42Å; N140-E142 PolarHBondContact OD1-OE2 3.33Å; E142-F144 VanDerWaalsContact C-N 3.25Å; E142-F144 PolarHBondContact O-N 3.5Å
143	E	61.8	Low	60.1	Low	133 Å²	133	123.3 Å²	123.3	62%	0.621	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-73.6	-17.7	174.9	-71.9	178.8	-166.1	0	0	112.8	N140 I141	N140-E143 HydrophobicContact CB-CG 4.12Å; N140-E143 PolarHBondContact O-N 2.96Å; I141-E143 PolarHBondContact O-N 3.04Å
144	F	59.4	Low	61.1	Low	144 Å²	144	129.7 Å²	129.7	63%	0.632	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-14.8	178.3	-69.1	-87.6	0	0	0	113.2	V139 I141 E142	V139-F144 HydrophobicContact CG1-CE2 4.03Å; I141-F144 PolarHBondContact O-N 3.43Å; I141-F144 VanDerWaalsContact O-N 3.09Å; E142-F144 VanDerWaalsContact C-N 3.25Å; E142-F144 PolarHBondContact O-N 3.5Å
145	E	61.8	Low	61.7	Low	142 Å²	142	125.6 Å²	125.6	66%	0.664	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-6.2	179	-67.6	-174.2	169.5	0	0	113.3
146	M	58.5	Low	62.3	Low	156 Å²	156	127.2 Å²	127.2	77%	0.768	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	17.7	179.3	-74.9	-162.9	-62.2	0	0	115.4
147	L	56.9	Low	62.7	Low	126 Å²	126	130.1 Å²	130.1	66%	0.66	67%	0.672	S	S	*	*			trans	-109.6	48.2	177.1	-71.1	167	0	0	0	112.1	S149	L147-S149 PolarHBondContact O-N 2.89Å; L147-S149 VanDerWaalsContact O-N 3.13Å
148	D	58.8	Low	62.9	Low	155 Å²	155	133.4 Å²	133.4	83%	0.829	68%	0.675	S	S	*	*			trans	-65.1	-7.3	170.5	-79.7	-22.7	0	0	0	113.4	T150	D148-T150 PolarHBondContact O-N 3.18Å
149	S	62.4	Low	62.7	Low	81 Å²	81	135.3 Å²	135.3	57%	0.566	68%	0.677	S	S	*	*	S	Bend	trans	-84.7	89	167.5	65.5	0	0	0	0	109.7	L147	L147-S149 PolarHBondContact O-N 2.89Å; L147-S149 VanDerWaalsContact O-N 3.13Å
150	T	59.7	Low	62.9	Low	76 Å²	76	134.3 Å²	134.3	47%	0.466	67%	0.668	S	S	.	*			trans	-50.6	143.1	164.9	59.9	0	0	0	0	109.2	D148 F152 H153	D148-T150 PolarHBondContact O-N 3.18Å; T150-F152 PolarHBondContact O-N 3.16Å; T150-H153 WeakPolarHBondContact O-CB 3.28Å; T150-H153 PolarHBondContact O-N 3.41Å
151	P	64.6	Low	63.3	Low	106 Å²	106	135.7 Å²	135.7	69%	0.688	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-57.9	-15.8	178.8	21.9	-32.3	0	0	0	112.9
152	F	66.9	Low	63.8	Low	148 Å²	148	138 Å²	138	65%	0.649	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-79.5	-17.1	175.3	-53.8	-72.6	0	0	0	114.1	T150 R154 L155	T150-F152 PolarHBondContact O-N 3.16Å; F152-R154 PolarHBondContact O-N 3.35Å; F152-L155 HydrophobicContact CD1-CD1 3.91Å; F152-L155 PolarHBondContact O-N 3.23Å
153	H	61.1	Low	64.4	Low	155 Å²	155	137.1 Å²	137.1	72%	0.718	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-69	-16.4	-179	-136.9	62.8	0	0	0	113.4	T150	T150-H153 WeakPolarHBondContact O-CB 3.28Å; T150-H153 PolarHBondContact O-N 3.41Å
154	R	61.8	Low	65.3	Low	241 Å²	241	134.5 Å²	134.5	91%	0.909	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-95.1	-6.4	172.2	-72.9	-178.2	160.3	-168.7	-4.5	113.8	F152 E156	F152-R154 PolarHBondContact O-N 3.35Å; R154-E156 VanDerWaalsContact C-N 3.32Å; R154-E156 PolarHBondContact O-N 3.13Å
155	L	65.4	Low	66.2	Low	111 Å²	111	132.7 Å²	132.7	58%	0.581	66%	0.664	S	S	*	*			trans	-89.6	74.1	176.9	-77.8	160.6	0	0	0	108.5	F152 L157	F152-L155 HydrophobicContact CD1-CD1 3.91Å; F152-L155 PolarHBondContact O-N 3.23Å; L155-L157 PolarHBondContact O-N 3.22Å
156	E	62.7	Low	67.1	Low	173 Å²	173	130.2 Å²	130.2	81%	0.808	66%	0.655	S	S	*	*			trans	-65.9	101.4	159.6	-73	-177	177.5	0	0	107.6	R154 K158	R154-E156 VanDerWaalsContact C-N 3.32Å; R154-E156 PolarHBondContact O-N 3.13Å; E156-K158 PolarHBondContact O-N 2.86Å
157	L	66.8	Low	68	Low	154 Å²	154	130.4 Å²	130.4	81%	0.806	65%	0.647	S	S	*	*			trans	-62.3	102.3	167.7	-69	170.6	0	0	0	107.2	L155 T159	L155-L157 PolarHBondContact O-N 3.22Å; L157-T159 PolarHBondContact O-N 3.33Å
158	K	67.1	Low	69.1	Low	177 Å²	177	130.2 Å²	130.2	77%	0.77	64%	0.643	S	S	*	*			trans	-66	104.9	162.5	-72.4	-179.1	178.6	177.3	0	106.3	E156 L160	E156-K158 PolarHBondContact O-N 2.86Å; K158-L160 HydrophobicContact CB-CD1 4.38Å; K158-L160 PolarHBondContact O-N 2.94Å
159	T	61.4	Low	70.1	Confident	139 Å²	139	126.6 Å²	126.6	85%	0.853	63%	0.626	S	S	*	*			trans	-67.5	84.5	163.5	31.7	0	0	0	0	107.5	L157	L157-T159 PolarHBondContact O-N 3.33Å
160	L	66.6	Low	70.8	Confident	83 Å²	83	126.9 Å²	126.9	44%	0.435	62%	0.621	S	S	.	*			trans	-67.9	132.1	164.4	-116.8	88.8	0	0	0	107.4	K158 E162 D164 E165	K158-L160 HydrophobicContact CB-CD1 4.38Å; K158-L160 PolarHBondContact O-N 2.94Å; L160-E162 PolarHBondContact O-N 2.99Å; L160-D164 HydrophobicContact CD2-CB 4.45Å; L160-E165 HydrophobicContact CB-CG 3.82Å; L160-E165 WeakPolarHBondContact CB-OE1 3.44Å; L160-E165 HydrophobicContact CD2-CG 3.53Å; L160-E165 HydrophobicContact CG-CG 4.29Å
161	N	76.2	Confident	71.6	Confident	93 Å²	93	126.3 Å²	126.3	50%	0.497	62%	0.617	S	S	.	*			trans	-62.2	131.4	171.4	-177.6	7	0	0	0	108.2	M163 D164 E165	N161-M163 PolarHBondContact O-N 2.94Å; N161-D164 HydrophobicContact CB-CB 4.33Å; N161-D164 WeakPolarHBondContact O-CA 3.32Å; N161-D164 WeakPolarHBondContact O-CB 3.46Å; N161-D164 PolarHBondContact O-N 3.36Å; N161-E165 PolarHBondContact O-N 3.35Å
162	E	77	Confident	71.9	Confident	167 Å²	167	130.6 Å²	130.6	78%	0.78	62%	0.62	S	S	*	*	H	α-helix	trans	-51.7	-34.1	-179	-65	176.9	177.5	0	0	111.9	L160 E165 L166	L160-E162 PolarHBondContact O-N 2.99Å; E162-E165 PolarHBondContact O-N 3.44Å; E162-L166 WeakPolarHBondContact O-CB 3.35Å; E162-L166 PolarHBondContact O-N 2.89Å
163	M	76.4	Confident	71.7	Confident	120 Å²	120	128.6 Å²	128.6	59%	0.591	62%	0.616	S	S	*	*	H	α-helix	trans	-65.5	-34.9	175.3	-76.8	-59.2	-45.6	0	0	113.8	N161 R167	N161-M163 PolarHBondContact O-N 2.94Å; M163-R167 WeakPolarHBondContact O-CB 3.41Å; M163-R167 PolarHBondContact O-N 3.28Å
164	D	79.3	Confident	71.7	Confident	77 Å²	77	125.5 Å²	125.5	41%	0.412	60%	0.604	S	S	.	*	H	α-helix	trans	-75.6	-34.5	178.6	-73	-35.5	0	0	0	111.7	L160 N161 H168	L160-D164 HydrophobicContact CD2-CB 4.45Å; N161-D164 HydrophobicContact CB-CB 4.33Å; N161-D164 WeakPolarHBondContact O-CA 3.32Å; N161-D164 WeakPolarHBondContact O-CB 3.46Å; N161-D164 PolarHBondContact O-N 3.36Å; D164-H168 PolarHBondContact O-N 3.48Å; D164-H168 PolarHBondContact O-ND1 3.11Å
165	E	78.9	Confident	71.3	Confident	106 Å²	106	118.3 Å²	118.3	50%	0.495	59%	0.587	S	S	.	*	H	α-helix	trans	-64.2	-48.7	170.3	-66	-168.2	178	0	0	110.7	L160 N161 E162 R167 H168 V169	L160-E165 HydrophobicContact CB-CG 3.82Å; L160-E165 WeakPolarHBondContact CB-OE1 3.44Å; L160-E165 HydrophobicContact CD2-CG 3.53Å; L160-E165 HydrophobicContact CG-CG 4.29Å; N161-E165 PolarHBondContact O-N 3.35Å; E162-E165 PolarHBondContact O-N 3.44Å; E165-R167 VanDerWaalsContact C-N 3.29Å; E165-R167 PolarHBondContact O-N 2.93Å; E165-H168 WeakPolarHBondContact O-CB 3.32Å; E165-H168 PolarHBondContact O-N 2.88Å; E165-H168 VanDerWaalsContact O-N 3.09Å; E165-V169 WeakPolarHBondContact O-CG2 3.33Å; E165-V169 PolarHBondContact O-N 3.01Å
166	L	80.1	Confident	70.7	Confident	91 Å²	91	119 Å²	119	48%	0.476	60%	0.595	S	S	.	*	H	α-helix	trans	-60	-41.6	177.6	-174.7	62.8	0	0	0	111.2	E162 H168 V169 L170	E162-L166 WeakPolarHBondContact O-CB 3.35Å; E162-L166 PolarHBondContact O-N 2.89Å; L166-H168 PolarHBondContact O-N 3.42Å; L166-V169 PolarHBondContact O-N 3.31Å; L166-L170 HydrophobicContact CD1-CD1 4.27Å; L166-L170 HydrophobicContact CD1-CG 4.27Å; L166-L170 HydrophobicContact CG-CD1 3.97Å; L166-L170 HydrophobicContact CG-CG 4.38Å; L166-L170 WeakPolarHBondContact O-CB 3.33Å; L166-L170 VanDerWaalsContact O-CG 3.32Å; L166-L170 WeakPolarHBondContact O-CG 3.46Å; L166-L170 PolarHBondContact O-N 3.41Å
167	R	78.9	Confident	70.3	Confident	160 Å²	160	115.2 Å²	115.2	60%	0.604	59%	0.588	S	S	*	*	H	α-helix	trans	-60.9	-42.7	174.2	-176.4	178.8	176.7	-92	-3.2	111.9	M163 E165 T171	M163-R167 WeakPolarHBondContact O-CB 3.41Å; M163-R167 PolarHBondContact O-N 3.28Å; E165-R167 VanDerWaalsContact C-N 3.29Å; E165-R167 PolarHBondContact O-N 2.93Å; R167-T171 VanDerWaalsContact O-CB 3.28Å; R167-T171 WeakPolarHBondContact O-CB 3.17Å; R167-T171 PolarHBondContact O-N 2.93Å; R167-T171 PolarHBondContact O-OG1 3.23Å
168	H	79.7	Confident	69.4	Low	122 Å²	122	111.8 Å²	111.8	57%	0.565	57%	0.57	S	S	*	*	H	α-helix	trans	-63.6	-43.9	176.4	-89.1	76.8	0	0	0	112.1	D164 E165 L166 T171 R172	D164-H168 PolarHBondContact O-N 3.48Å; D164-H168 PolarHBondContact O-ND1 3.11Å; E165-H168 WeakPolarHBondContact O-CB 3.32Å; E165-H168 PolarHBondContact O-N 2.88Å; E165-H168 VanDerWaalsContact O-N 3.09Å; L166-H168 PolarHBondContact O-N 3.42Å; H168-T171 PolarHBondContact O-N 2.92Å; H168-R172 WeakPolarHBondContact O-CB 3.41Å; H168-R172 PolarHBondContact O-N 3.02Å
169	V	79.6	Confident	68.5	Low	78 Å²	78	106.5 Å²	106.5	47%	0.473	57%	0.566	S	S	.	*	H	α-helix	trans	-65	-46.4	178.6	173.7	0	0	0	0	111	E165 L166 R172 N173	E165-V169 WeakPolarHBondContact O-CG2 3.33Å; E165-V169 PolarHBondContact O-N 3.01Å; L166-V169 PolarHBondContact O-N 3.31Å; V169-R172 PolarHBondContact O-N 3.2Å; V169-N173 WeakPolarHBondContact CG1-ND2 3.42Å; V169-N173 PolarHBondContact O-N 3.39Å; V169-N173 PolarHBondContact O-ND2 3.14Å
170	L	77.6	Confident	67.8	Low	87 Å²	87	107.3 Å²	107.3	46%	0.455	57%	0.565	S	S	.	*	H	α-helix	trans	-65.1	-43.1	177.7	-71.8	173.8	0	0	0	111.5	L166 R172 N173 I174	L166-L170 HydrophobicContact CD1-CD1 4.27Å; L166-L170 HydrophobicContact CD1-CG 4.27Å; L166-L170 HydrophobicContact CG-CD1 3.97Å; L166-L170 HydrophobicContact CG-CG 4.38Å; L166-L170 WeakPolarHBondContact O-CB 3.33Å; L166-L170 VanDerWaalsContact O-CG 3.32Å; L166-L170 WeakPolarHBondContact O-CG 3.46Å; L166-L170 PolarHBondContact O-N 3.41Å; L170-R172 VanDerWaalsContact C-N 3.34Å; L170-R172 PolarHBondContact O-N 3.44Å; L170-N173 PolarHBondContact O-N 3.14Å; L170-I174 HydrophobicContact CB-CD1 4.22Å; L170-I174 VanDerWaalsContact O-CB 3.28Å; L170-I174 WeakPolarHBondContact O-CB 3.42Å; L170-I174 WeakPolarHBondContact O-CD1 3.18Å; L170-I174 WeakPolarHBondContact O-CG1 3.4Å; L170-I174 PolarHBondContact O-N 3.14Å
171	T	75.5	Confident	67.1	Low	65 Å²	65	109.3 Å²	109.3	40%	0.399	58%	0.575	S	S	.	*	H	α-helix	trans	-59.5	-48.2	176.4	-54.8	0	0	0	0	109.9	R167 H168 N173 I174 T175	R167-T171 VanDerWaalsContact O-CB 3.28Å; R167-T171 WeakPolarHBondContact O-CB 3.17Å; R167-T171 PolarHBondContact O-N 2.93Å; R167-T171 PolarHBondContact O-OG1 3.23Å; H168-T171 PolarHBondContact O-N 2.92Å; T171-N173 VanDerWaalsContact C-N 3.32Å; T171-N173 PolarHBondContact O-N 3.04Å; T171-I174 PolarHBondContact O-N 2.91Å; T171-T175 HydrophobicContact CG2-CG2 4.04Å; T171-T175 WeakPolarHBondContact O-CB 3.44Å; T171-T175 WeakPolarHBondContact O-CG2 3.41Å; T171-T175 PolarHBondContact O-N 2.99Å; T171-T175 PolarHBondContact O-OG1 2.95Å
172	R	72.2	Confident	65.9	Low	195 Å²	195	112.5 Å²	112.5	74%	0.736	59%	0.592	S	S	*	*	H	α-helix	trans	-60.5	-39.2	179.3	-167.7	179.8	-175.5	134.5	1.1	112.6	H168 V169 L170 V176	H168-R172 WeakPolarHBondContact O-CB 3.41Å; H168-R172 PolarHBondContact O-N 3.02Å; V169-R172 PolarHBondContact O-N 3.2Å; L170-R172 VanDerWaalsContact C-N 3.34Å; L170-R172 PolarHBondContact O-N 3.44Å; R172-V176 WeakPolarHBondContact O-CG2 3.4Å
173	N	61.7	Low	64.4	Low	106 Å²	106	111.5 Å²	111.5	57%	0.567	59%	0.592	S	S	*	*	H	α-helix	trans	-78.6	-34.3	180	-73.2	-54.7	0	0	0	113.1	V169 L170 T171	V169-N173 WeakPolarHBondContact CG1-ND2 3.42Å; V169-N173 PolarHBondContact O-N 3.39Å; V169-N173 PolarHBondContact O-ND2 3.14Å; L170-N173 PolarHBondContact O-N 3.14Å; T171-N173 VanDerWaalsContact C-N 3.32Å; T171-N173 PolarHBondContact O-N 3.04Å
174	I	60.1	Low	62.8	Low	90 Å²	90	114.1 Å²	114.1	46%	0.462	60%	0.603	S	S	.	*	H	α-helix	trans	-76.8	-36.1	179.4	-64	165.4	0	0	0	110.7	L170 T171 V176 S177 N178	L170-I174 HydrophobicContact CB-CD1 4.22Å; L170-I174 VanDerWaalsContact O-CB 3.28Å; L170-I174 WeakPolarHBondContact O-CB 3.42Å; L170-I174 WeakPolarHBondContact O-CD1 3.18Å; L170-I174 WeakPolarHBondContact O-CG1 3.4Å; L170-I174 PolarHBondContact O-N 3.14Å; T171-I174 PolarHBondContact O-N 2.91Å; I174-V176 VanDerWaalsContact C-N 3.31Å; I174-V176 PolarHBondContact O-N 3.13Å; I174-S177 PolarHBondContact O-N 3.44Å; I174-N178 VanDerWaalsContact CG2-ND2 3.33Å; I174-N178 WeakPolarHBondContact CG2-ND2 3.39Å; I174-N178 WeakPolarHBondContact O-CB 3.28Å; I174-N178 PolarHBondContact O-N 3.1Å; I174-N178 VanDerWaalsContact O-N 3.16Å
175	T	53.6	Low	61.3	Low	91 Å²	91	121.5 Å²	121.5	56%	0.558	63%	0.625	S	S	*	*	H	α-helix	trans	-76.5	-15.2	-179.8	57.2	0	0	0	0	114	T171 S177	T171-T175 HydrophobicContact CG2-CG2 4.04Å; T171-T175 WeakPolarHBondContact O-CB 3.44Å; T171-T175 WeakPolarHBondContact O-CG2 3.41Å; T171-T175 PolarHBondContact O-N 2.99Å; T171-T175 PolarHBondContact O-OG1 2.95Å; T175-S177 VanDerWaalsContact C-N 3.33Å
176	V	53.6	Low	59.9	Low	125 Å²	125	124.3 Å²	124.3	76%	0.758	64%	0.635	S	S	*	*	H	α-helix	trans	-81.3	-17.7	170.5	-177.9	0	0	0	0	111.2	R172 I174	R172-V176 WeakPolarHBondContact O-CG2 3.4Å; I174-V176 VanDerWaalsContact C-N 3.31Å; I174-V176 PolarHBondContact O-N 3.13Å
177	S	53.8	Low	58.3	Low	93 Å²	93	129.6 Å²	129.6	65%	0.65	66%	0.655	S	S	*	*	H	α-helix	trans	-100.7	-7.4	176.5	-174.2	0	0	0	0	114.5	I174 T175	I174-S177 PolarHBondContact O-N 3.44Å; T175-S177 VanDerWaalsContact C-N 3.33Å
178	N	49	Very low	57.2	Low	83 Å²	83	130.4 Å²	130.4	44%	0.444	66%	0.663	S	S	.	*			trans	-111.7	33.2	-173.9	-75.5	-6.2	0	0	0	113.9	I174	I174-N178 VanDerWaalsContact CG2-ND2 3.33Å; I174-N178 WeakPolarHBondContact CG2-ND2 3.39Å; I174-N178 WeakPolarHBondContact O-CB 3.28Å; I174-N178 PolarHBondContact O-N 3.1Å; I174-N178 VanDerWaalsContact O-N 3.16Å
179	G	47	Very low	55.6	Low	66 Å²	66	130.5 Å²	130.5	68%	0.68	68%	0.675	S	S	*	*	S	Bend	trans	-76.4	117.5	151	0	0	0	0	0	108.2
180	D	46.3	Very low	53.8	Low	155 Å²	155	129.9 Å²	129.9	83%	0.829	68%	0.684	S	S	*	*	S	Bend	trans	78.3	54.3	172.1	-75.2	-23.2	0	0	0	120.4
181	I	53.8	Low	52.4	Low	126 Å²	126	135.4 Å²	135.4	65%	0.646	71%	0.705	S	S	*	*			trans	-118	13.6	155.6	45.1	169.7	0	0	0	115.1	N183	I181-N183 VanDerWaalsContact C-N 3.33Å; I181-N183 PolarHBondContact O-N 2.83Å
182	N	49.7	Very low	51.2	Low	159 Å²	159	139.8 Å²	139.8	85%	0.85	73%	0.726	S	S	*	*			trans	-89.8	23.7	175.9	-71.8	-12.1	0	0	0	114.8
183	N	46	Very low	49.9	Very low	147 Å²	147	134.1 Å²	134.1	79%	0.786	73%	0.728	S	S	*	*	S	Bend	trans	-97.9	91.8	169.3	-87.1	-15.8	0	0	0	111	I181	I181-N183 VanDerWaalsContact C-N 3.33Å; I181-N183 PolarHBondContact O-N 2.83Å
184	E	43.2	Very low	49	Very low	174 Å²	174	138.4 Å²	138.4	81%	0.813	75%	0.745	S	S	*	*			trans	34.4	90.3	142.3	-55.5	-160.3	153.3	0	0	117.4
185	R	47.7	Very low	48.3	Very low	232 Å²	232	140 Å²	140	88%	0.875	76%	0.764	S	S	*	*			trans	-135.9	101.7	144.8	-149.1	177	-72.9	-174.4	-0.5	110.1	F187	R185-F187 PolarHBondContact O-N 2.92Å; R185-F187 VanDerWaalsContact O-N 3.11Å
186	K	48.9	Very low	47.8	Very low	165 Å²	165	148.4 Å²	148.4	72%	0.717	80%	0.796	S	S	*	*			trans	-50.4	106.1	179.5	-61.2	178.1	179.9	-178.4	0	111.1	F188	K186-F188 HydrophobicContact CB-CD2 4.26Å; K186-F188 HydrophobicContact CB-CE2 4.07Å; K186-F188 HydrophobicContact CD-CE2 4.17Å; K186-F188 HydrophobicContact CD-CZ 4.24Å; K186-F188 PolarHBondContact O-N 2.9Å
187	F	46.9	Very low	47.6	Very low	203 Å²	203	149.6 Å²	149.6	89%	0.89	80%	0.798	S	S	*	*			trans	-81.7	102.1	154.9	-86.6	-89.4	0	0	0	107.2	R185	R185-F187 PolarHBondContact O-N 2.92Å; R185-F187 VanDerWaalsContact O-N 3.11Å
188	F	55.5	Low	47.2	Very low	176 Å²	176	152.5 Å²	152.5	77%	0.772	81%	0.806	S	S	*	*			trans	-68.2	127.6	166.9	-76.5	-86.5	0	0	0	108.7	K186	K186-F188 HydrophobicContact CB-CD2 4.26Å; K186-F188 HydrophobicContact CB-CE2 4.07Å; K186-F188 HydrophobicContact CD-CE2 4.17Å; K186-F188 HydrophobicContact CD-CZ 4.24Å; K186-F188 PolarHBondContact O-N 2.9Å
189	P	45.9	Very low	47.1	Very low	124 Å²	124	156.4 Å²	156.4	81%	0.805	83%	0.826	S	S	*	*			trans	-85.5	136.6	169.9	33.1	-28.5	0	0	0	110
190	G	41.9	Very low	47.1	Very low	66 Å²	66	161.7 Å²	161.7	68%	0.68	84%	0.835	S	S	*	*			trans	80.3	113	151.8	0	0	0	0	0	117.3
191	K	48	Very low	47.2	Very low	203 Å²	203	162.1 Å²	162.1	88%	0.883	84%	0.835	S	S	*	*				-146.5	106.3	119.2	-78.4	-147.7	176	-175.7	0	109.4
192	D	50.6	Low	46.8	Very low	156 Å²	156	164.5 Å²	164.5	83%	0.834	85%	0.848	S	S	*	*			trans	6.5	138.8	137.9	-52.3	-54.7	0	0	0	118
193	G	44.7	Very low	46.5	Very low	76 Å²	76	164.9 Å²	164.9	78%	0.784	85%	0.848	S	S	*	*			trans	-61.1	159.8	-176.1	0	0	0	0	0	115.4
194	Q	43.2	Very low	46.6	Very low	197 Å²	197	166.3 Å²	166.3	92%	0.921	85%	0.853	S	S	*	*			trans	-142.7	114.8	146.7	-112.3	-179.4	-19.8	0	0	107.4
195	S	44.7	Very low	46.9	Very low	123 Å²	123	165.7 Å²	165.7	86%	0.86	86%	0.856	S	S	*	*			trans	-66.4	130.3	165.5	-56	0	0	0	0	109.9
196	Q	44.7	Very low	46.8	Very low	267 Å²	267	159.6 Å²	159.6	100%	1.248	85%	0.854	S	S	*	*				-159.9	0	120.3	-135.7	176.1	-0.3	0	0	109.7

Retrieved 196 of 196 residues in 104.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).