A0A077ZKB5_TRITR Loading...

E1-E2 ATPase domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZKB5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 195 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	60.8	Low	53.6	Low	50 Å²	50	77.6 Å²	77.6	25%	0.246	43%	0.426	C	S	.	.				0	142.8	0	169.3	175.4	65.1	0	0	107.8	I3 I164 V165 I177 Q179 L183	M1-I3 HydrophobicContact CE-CD1 3.72Å; M1-I3 HydrophobicContact CE-CG1 4.15Å; M1-I3 HydrophobicContact CG-CG1 4.08Å; M1-I3 HydrophobicContact SD-CD1 4.17Å; M1-I3 HydrophobicContact SD-CG1 4.18Å; M1-I164 WeakPolarHBondContact O-CA 2.86Å; M1-V165 HydrophobicContact CE-CB 3.42Å; M1-V165 VanDerWaalsContact CE-CB 3.42Å; M1-V165 HydrophobicContact CE-CG1 3.51Å; M1-V165 HydrophobicContact CE-CG2 3.97Å; M1-V165 PolarHBondContact O-N 3.03Å; M1-V165 VanDerWaalsContact O-N 3.12Å; M1-I177 HydrophobicContact CG-CG2 4.27Å; M1-I177 HydrophobicContact SD-CG1 4.37Å; M1-I177 HydrophobicContact SD-CG2 4.37Å; M1-Q179 CarbonylContact C-O 3.42Å; M1-Q179 WeakPolarHBondContact CA-O 3.3Å; M1-Q179 WeakPolarHBondContact CG-O 3.42Å; M1-L183 HydrophobicContact CE-CD1 3.39Å; M1-L183 HydrophobicContact CE-CD2 4.14Å; M1-L183 HydrophobicContact CE-CG 4.32Å; M1-L183 HydrophobicContact SD-CB 4.09Å; M1-L183 HydrophobicContact SD-CD1 3.3Å; M1-L183 WeakPolarHBondContact SD-CD1 3.34Å; M1-L183 HydrophobicContact SD-CD2 3.19Å; M1-L183 WeakPolarHBondContact SD-CD2 3.46Å; M1-L183 HydrophobicContact SD-CG 3.64Å
2	V	68.5	Low	52.4	Low	24 Å²	24	87.8 Å²	87.8	15%	0.145	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.7	179.5	-177.4	0	0	0	0	108.4	I144 I162 C163 I164 I178 Q179	V2-I144 HydrophobicContact CG1-CD1 4.38Å; V2-I144 HydrophobicContact CG2-CD1 4.28Å; V2-I162 HydrophobicContact CG1-CB 4.5Å; V2-I162 HydrophobicContact CG1-CG2 3.06Å; V2-C163 WeakPolarHBondContact CA-O 3.35Å; V2-I164 HydrophobicContact CG2-CG1 4.39Å; V2-I178 HydrophobicContact CB-CB 4.31Å; V2-I178 HydrophobicContact CG1-CB 4.21Å; V2-I178 HydrophobicContact CG1-CD1 3.92Å; V2-I178 PolarHBondContact O-N 3.25Å; V2-Q179 HydrophobicContact CB-CB 4.49Å; V2-Q179 PolarHBondContact N-O 3.01Å; V2-Q179 PolarHBondContact O-N 3.17Å
3	I	73.2	Confident	50.8	Low	10 Å²	10	92.7 Å²	92.7	5%	0.051	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130	177.7	-54.3	-173.5	0	0	0	108.6	M1 C163 V165 V176 I177	M1-I3 HydrophobicContact CE-CD1 3.72Å; M1-I3 HydrophobicContact CE-CG1 4.15Å; M1-I3 HydrophobicContact CG-CG1 4.08Å; M1-I3 HydrophobicContact SD-CD1 4.17Å; M1-I3 HydrophobicContact SD-CG1 4.18Å; I3-C163 PolarHBondContact N-O 3.37Å; I3-C163 PolarHBondContact O-N 3.31Å; I3-V165 HydrophobicContact CD1-CG2 3.79Å; I3-V165 HydrophobicContact CG1-CG2 4.1Å; I3-V176 CarbonylContact C-O 3.55Å; I3-V176 VanDerWaalsContact CA-O 3.3Å; I3-V176 WeakPolarHBondContact CA-O 3.44Å; I3-I177 HydrophobicContact CD1-CG1 4.49Å; I3-I177 HydrophobicContact CG1-CG1 4.28Å
4	D	71.4	Confident	49.6	Very low	44 Å²	44	100.4 Å²	100.4	24%	0.235	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	124.8	168.1	-163.2	51	0	0	0	109.4	D6 G175 V176 I178	D4-D6 PolarHBondContact O-N 3.31Å; D4-G175 CarbonylContact O-C 3.36Å; D4-G175 WeakPolarHBondContact O-CA 3.29Å; D4-V176 PolarHBondContact N-O 3.42Å; D4-V176 PolarHBondContact O-N 3.26Å; D4-I178 HydrophobicContact CB-CD1 3.76Å; D4-I178 HydrophobicContact CB-CG1 4.15Å
5	L	63.8	Low	48.2	Very low	12 Å²	12	101 Å²	101	6%	0.063	54%	0.535	C	S	.	.			trans	-78.8	106.3	-179.4	-71.8	174.4	0	0	0	110.9	L157 V159 G160 D161 C163 A173	L5-L157 HydrophobicContact CD1-CB 4.17Å; L5-L157 HydrophobicContact CD1-CD1 4.38Å; L5-L157 HydrophobicContact CD1-CD2 4.44Å; L5-V159 WeakPolarHBondContact O-CG1 3.37Å; L5-G160 PolarHBondContact O-N 3.32Å; L5-D161 HydrophobicContact CD1-CB 4.33Å; L5-D161 PolarHBondContact N-O 3.27Å; L5-D161 VanDerWaalsContact N-O 3.16Å; L5-C163 VanDerWaalsContact CD1-SG 3.58Å; L5-A173 HydrophobicContact CD2-CB 3.99Å
6	D	55.4	Low	47.3	Very low	90 Å²	90	104.4 Å²	104.4	48%	0.481	54%	0.544	S	S	.	.			trans	-91.9	122.1	175.2	-101.1	-25.8	0	0	0	110.3	D4 G8 V176	D4-D6 PolarHBondContact O-N 3.31Å; D6-G8 PolarHBondContact O-N 2.8Å; D6-V176 HydrophobicContact CB-CG2 4.45Å; D6-V176 WeakPolarHBondContact OD2-CG2 3.34Å
7	C	41.7	Very low	46.2	Very low	109 Å²	109	110.3 Å²	110.3	74%	0.736	57%	0.565	S	S	*	*			trans	-82.4	71.9	170.1	-136.7	0	0	0	0	109.4	V159	C7-V159 HydrophobicContact CB-CB 3.94Å; C7-V159 HydrophobicContact CB-CG1 3.47Å; C7-V159 VanDerWaalsContact CB-CG1 3.47Å; C7-V159 HydrophobicContact CB-CG2 3.24Å; C7-V159 WeakPolarHBondContact SG-CG2 3.49Å
8	G	40.2	Very low	45.7	Very low	52 Å²	52	110.2 Å²	110.2	54%	0.536	57%	0.566	S	S	.	*			trans	-129.3	83.3	-174.3	0	0	0	0	0	111.6	D6	D6-G8 PolarHBondContact O-N 2.8Å
9	R	36.1	Very low	45.2	Very low	244 Å²	244	114.3 Å²	114.3	92%	0.921	57%	0.573	S	S	*	*			trans	66.1	78.1	154.5	-162.9	-175.2	-94.9	-166.3	-6.2	116.2
10	L	38.3	Very low	44.6	Very low	121 Å²	121	117.1 Å²	117.1	63%	0.634	58%	0.584	S	S	*	*			trans	-104.8	125.6	155	-83.5	169.4	0	0	0	111.1	E12 D174	L10-E12 PolarHBondContact O-N 2.97Å; L10-D174 HydrophobicContact CD1-CB 4.47Å; L10-D174 WeakPolarHBondContact CD1-OD2 3.43Å; L10-D174 WeakPolarHBondContact CD2-OD2 3.45Å; L10-D174 WeakPolarHBondContact CG-OD2 3.42Å
11	P	40.4	Very low	43.9	Very low	98 Å²	98	115.9 Å²	115.9	64%	0.636	58%	0.584	S	S	*	*			trans	-73.9	119.1	157.4	29.4	-26.3	0	0	0	108.4	I13	P11-I13 PolarHBondContact O-N 3.44Å
12	E	38.9	Very low	42.5	Very low	200 Å²	200	122 Å²	122	94%	0.935	61%	0.609	S	S	*	*			trans	-55.5	101	164.8	-85.7	-176.1	143.5	0	0	109.6	L10	L10-E12 PolarHBondContact O-N 2.97Å
13	I	31.3	Very low	40.7	Very low	151 Å²	151	129.8 Å²	129.8	77%	0.774	64%	0.641	S	S	*	*			trans	-124.6	76	157.2	-52.8	179	0	0	0	106.1	P11	P11-I13 PolarHBondContact O-N 3.44Å
14	K	34.3	Very low	38.7	Very low	201 Å²	201	134.6 Å²	134.6	87%	0.874	68%	0.682	S	S	*	*			trans	-107.4	96.9	157.8	-91.8	-174.9	177.1	175	0	108.9	K16	K14-K16 PolarHBondContact O-N 3.24Å
15	S	28.8	Very low	36.8	Very low	109 Å²	109	136.4 Å²	136.4	76%	0.762	70%	0.703	S	S	*	*			trans	-10.5	114.4	143.8	47.6	0	0	0	0	116.1
16	K	34.5	Very low	35.5	Very low	156 Å²	156	139.3 Å²	139.3	68%	0.678	73%	0.729	S	S	*	*			trans	-143.6	94.6	131.6	-150.2	170.9	-176	178.3	0	109	K14 D18 E125	K14-K16 PolarHBondContact O-N 3.24Å; K16-D18 PolarHBondContact O-N 3.27Å; K16-E125 IonicContact NZ-OE1 3.8Å
17	F	28.3	Very low	34.8	Very low	204 Å²	204	140.5 Å²	140.5	90%	0.895	74%	0.739	S	S	*	*			trans	-64.4	105.6	163.4	-163.6	-94.3	0	0	0	107.4
18	D	37.6	Very low	35	Very low	109 Å²	109	141 Å²	141	58%	0.583	73%	0.734	S	S	*	*			trans	-144.6	109.5	148.1	-155.8	33.8	0	0	0	109.9	K16	K16-D18 PolarHBondContact O-N 3.27Å
19	R	36.2	Very low	35.1	Very low	188 Å²	188	142.4 Å²	142.4	71%	0.709	75%	0.747	S	S	*	*			trans	36.6	108.1	148.2	-78	172.4	-82.3	-153.3	-5.2	116
20	E	32.1	Very low	35.9	Very low	169 Å²	169	138.1 Å²	138.1	79%	0.79	73%	0.732	S	S	*	*				50.7	113.2	93.2	-65.1	-152.9	143.3	0	0	111.4
21	T	30.9	Very low	36.1	Very low	93 Å²	93	136 Å²	136	57%	0.571	73%	0.726	S	S	*	*				157.7	90.6	117	-58.2	0	0	0	0	109.7	F23	T21-F23 VanDerWaalsContact O-CD2 3.27Å; T21-F23 WeakPolarHBondContact O-CD2 3.38Å; T21-F23 PolarHBondContact O-N 3.45Å
22	K	30.2	Very low	36.5	Very low	177 Å²	177	139 Å²	139	77%	0.77	74%	0.735	S	S	*	*				45	48.7	120.6	-53.5	175.2	-178.1	174.2	0	117.9
23	F	30.3	Very low	36.8	Very low	189 Å²	189	139.6 Å²	139.6	83%	0.829	73%	0.729	S	S	*	*	S	Bend	trans	-87.9	-17.3	173.6	-95.1	-80	0	0	0	115.4	T21	T21-F23 VanDerWaalsContact O-CD2 3.27Å; T21-F23 WeakPolarHBondContact O-CD2 3.38Å; T21-F23 PolarHBondContact O-N 3.45Å
24	A	32.4	Very low	37.7	Very low	111 Å²	111	134.8 Å²	134.8	92%	0.917	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-10.1	177.8	0	0	0	0	0	114.3
25	A	31.1	Very low	38.6	Very low	81 Å²	81	127.2 Å²	127.2	67%	0.669	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	3.2	-175.2	0	0	0	0	0	114.4	V27	A25-V27 PolarHBondContact O-N 3.29Å
26	A	36.1	Very low	40	Very low	74 Å²	74	126 Å²	126	61%	0.612	68%	0.675	S	S	*	*			trans	-101.1	39.2	-170.7	0	0	0	0	0	114	I28	A26-I28 VanDerWaalsContact C-N 3.26Å; A26-I28 PolarHBondContact O-N 3.17Å
27	V	41.5	Very low	41.2	Very low	115 Å²	115	128 Å²	128	70%	0.697	68%	0.679	S	S	*	*	S	Bend	trans	-91.4	78.7	150.2	-174.6	0	0	0	0	106.9	A25 G29	A25-V27 PolarHBondContact O-N 3.29Å; V27-G29 PolarHBondContact O-N 3.26Å
28	I	46	Very low	42.7	Very low	120 Å²	120	122.8 Å²	122.8	62%	0.615	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.8	57.8	153.4	-43.3	163.4	0	0	0	114.2	A26 Y30	A26-I28 VanDerWaalsContact C-N 3.26Å; A26-I28 PolarHBondContact O-N 3.17Å; I28-Y30 HydrophobicContact CB-CD2 3.72Å; I28-Y30 HydrophobicContact CB-CE2 3.61Å; I28-Y30 HydrophobicContact CD1-CE2 4.36Å; I28-Y30 HydrophobicContact CG2-CD2 4.04Å; I28-Y30 HydrophobicContact CG2-CE2 3.49Å; I28-Y30 VanDerWaalsContact CG2-CE2 3.49Å; I28-Y30 WeakPolarHBondContact O-CD2 3.41Å; I28-Y30 WeakPolarHBondContact O-CE2 3.3Å; I28-Y30 VanDerWaalsContact O-CG 3.26Å; I28-Y30 PolarHBondContact O-N 3.3Å
29	G	42.4	Very low	43.5	Very low	80 Å²	80	122.2 Å²	122.2	83%	0.825	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.9	20.3	162	0	0	0	0	0	116.3	V27	V27-G29 PolarHBondContact O-N 3.26Å
30	Y	51.3	Low	44.8	Very low	155 Å²	155	121.1 Å²	121.1	61%	0.608	66%	0.657	S	S	*	*			trans	-93	123.6	-174	-76.4	-66.5	0	0	0	106.8	I28 L32	I28-Y30 HydrophobicContact CB-CD2 3.72Å; I28-Y30 HydrophobicContact CB-CE2 3.61Å; I28-Y30 HydrophobicContact CD1-CE2 4.36Å; I28-Y30 HydrophobicContact CG2-CD2 4.04Å; I28-Y30 HydrophobicContact CG2-CE2 3.49Å; I28-Y30 VanDerWaalsContact CG2-CE2 3.49Å; I28-Y30 WeakPolarHBondContact O-CD2 3.41Å; I28-Y30 WeakPolarHBondContact O-CE2 3.3Å; I28-Y30 VanDerWaalsContact O-CG 3.26Å; I28-Y30 PolarHBondContact O-N 3.3Å; Y30-L32 PolarHBondContact O-N 3.47Å
31	P	44.3	Very low	46.2	Very low	75 Å²	75	117 Å²	117	49%	0.487	64%	0.643	S	S	.	*			trans	-54.8	140.3	177.6	22.9	-36.1	0	0	0	110.9	W33 S34	P31-W33 VanDerWaalsContact O-CD1 3.27Å; P31-W33 PolarHBondContact O-N 3.42Å; P31-S34 PolarHBondContact O-N 3.48Å; P31-S34 PolarHBondContact O-OG 2.84Å
32	L	47.4	Very low	47.5	Very low	161 Å²	161	116.4 Å²	116.4	84%	0.843	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-24.9	-170.8	-80.4	154.9	0	0	0	115.3	Y30 S34 A35	Y30-L32 PolarHBondContact O-N 3.47Å; L32-S34 VanDerWaalsContact C-N 3.25Å; L32-S34 PolarHBondContact O-N 3.39Å; L32-A35 PolarHBondContact O-N 3.46Å
33	W	44.7	Very low	48.7	Very low	214 Å²	214	113.8 Å²	113.8	81%	0.811	62%	0.621	S	S	*	*	H	α-helix	trans	-59.6	-26.2	172.5	63.8	-26.4	0	0	0	114.5	P31	P31-W33 VanDerWaalsContact O-CD1 3.27Å; P31-W33 PolarHBondContact O-N 3.42Å
34	S	50.4	Low	50	Low	49 Å²	49	109.3 Å²	109.3	34%	0.343	61%	0.611	S	S	.	*	H	α-helix	trans	-80.1	-25.9	178.9	67	0	0	0	0	113.5	P31 L32	P31-S34 PolarHBondContact O-N 3.48Å; P31-S34 PolarHBondContact O-OG 2.84Å; L32-S34 VanDerWaalsContact C-N 3.25Å; L32-S34 PolarHBondContact O-N 3.39Å
35	A	54.2	Low	51.3	Low	42 Å²	42	111.4 Å²	111.4	35%	0.347	61%	0.606	S	S	.	*	H	α-helix	trans	-74.4	-31.3	-179.8	0	0	0	0	0	112.4	L32 W37 L38 L39	L32-A35 PolarHBondContact O-N 3.46Å; A35-W37 VanDerWaalsContact C-N 3.32Å; A35-W37 PolarHBondContact O-N 3.07Å; A35-L38 PolarHBondContact O-N 2.92Å; A35-L39 WeakPolarHBondContact O-CB 3.19Å; A35-L39 PolarHBondContact O-N 3.4Å
36	S	57.5	Low	52.5	Low	83 Å²	83	109.5 Å²	109.5	58%	0.58	59%	0.588	S	S	*	*	H	α-helix	trans	-63.3	-37.3	179.8	-179.4	0	0	0	0	112.6	K40	S36-K40 PolarHBondContact O-N 2.84Å
37	W	60.8	Low	53.6	Low	198 Å²	198	108.6 Å²	108.6	75%	0.75	58%	0.577	S	S	*	*	H	α-helix	trans	-71.1	-43.8	177	-162.1	80.6	0	0	0	110.9	A35 L39 K40 T41	A35-W37 VanDerWaalsContact C-N 3.32Å; A35-W37 PolarHBondContact O-N 3.07Å; W37-L39 PolarHBondContact O-N 2.78Å; W37-K40 PolarHBondContact O-N 3.17Å; W37-T41 PolarHBondContact O-N 3.12Å; W37-T41 PolarHBondContact O-OG1 2.76Å
38	L	58.3	Low	54.4	Low	96 Å²	96	108.2 Å²	108.2	50%	0.503	58%	0.575	S	S	.	*	H	α-helix	trans	-59.7	-44.6	176.8	-104.3	158	0	0	0	113.3	A35 K40 T41 I42	A35-L38 PolarHBondContact O-N 2.92Å; L38-K40 VanDerWaalsContact C-N 3.29Å; L38-K40 PolarHBondContact O-N 2.87Å; L38-T41 PolarHBondContact O-N 2.8Å; L38-I42 HydrophobicContact CD2-CD1 3.68Å; L38-I42 HydrophobicContact CD2-CG1 4.35Å; L38-I42 VanDerWaalsContact O-CG1 3.29Å; L38-I42 WeakPolarHBondContact O-CG1 3Å; L38-I42 PolarHBondContact O-N 3.01Å
39	L	56.1	Low	55	Low	97 Å²	97	107.4 Å²	107.4	51%	0.508	57%	0.572	S	S	.	*	H	α-helix	trans	-60.4	-40.5	176	-83.4	161	0	0	0	111.6	A35 W37 T41 W43	A35-L39 WeakPolarHBondContact O-CB 3.19Å; A35-L39 PolarHBondContact O-N 3.4Å; W37-L39 PolarHBondContact O-N 2.78Å; L39-T41 VanDerWaalsContact C-N 3.34Å; L39-W43 PolarHBondContact O-N 2.88Å
40	K	62.1	Low	55.8	Low	165 Å²	165	108.2 Å²	108.2	72%	0.717	55%	0.554	S	S	*	*	H	α-helix	trans	-72.8	-26.1	179.9	-149.6	169.3	-171.6	176.2	0	113	S36 W37 L38	S36-K40 PolarHBondContact O-N 2.84Å; W37-K40 PolarHBondContact O-N 3.17Å; L38-K40 VanDerWaalsContact C-N 3.29Å; L38-K40 PolarHBondContact O-N 2.87Å
41	T	62.1	Low	56	Low	82 Å²	82	102.1 Å²	102.1	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-80.8	-39.5	175	-48	0	0	0	0	112.6	W37 L38 L39	W37-T41 PolarHBondContact O-N 3.12Å; W37-T41 PolarHBondContact O-OG1 2.76Å; L38-T41 PolarHBondContact O-N 2.8Å; L39-T41 VanDerWaalsContact C-N 3.34Å
42	I	58.8	Low	56.6	Low	80 Å²	80	105.4 Å²	105.4	41%	0.41	54%	0.536	S	S	.	.	H	α-helix	trans	-80	-36	-175.6	-62.1	169.3	0	0	0	111.1	L38 P44	L38-I42 HydrophobicContact CD2-CD1 3.68Å; L38-I42 HydrophobicContact CD2-CG1 4.35Å; L38-I42 VanDerWaalsContact O-CG1 3.29Å; L38-I42 WeakPolarHBondContact O-CG1 3Å; L38-I42 PolarHBondContact O-N 3.01Å; I42-P44 WeakPolarHBondContact O-CD 3.42Å
43	W	55.1	Low	57.2	Low	122 Å²	122	101 Å²	101	46%	0.462	52%	0.516	S	S	.	.			trans	-126.6	71.4	-178.1	-71.4	77.9	0	0	0	111.1	L39 N45 C46 L54	L39-W43 PolarHBondContact O-N 2.88Å; W43-N45 PolarHBondContact O-N 2.94Å; W43-N45 VanDerWaalsContact O-N 3.09Å; W43-C46 HydrophobicContact CB-CB 4.3Å; W43-C46 HydrophobicContact CD2-CB 4.38Å; W43-C46 HydrophobicContact CE3-CB 3.54Å; W43-C46 HydrophobicContact CZ3-CB 4.2Å; W43-C46 WeakPolarHBondContact CZ3-SG 3.46Å; W43-L54 HydrophobicContact CH2-CD1 4.33Å
44	P	57.3	Low	57.5	Low	95 Å²	95	95.8 Å²	95.8	62%	0.617	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-15.5	-178.2	25.2	-33.3	0	0	0	113.6	I42	I42-P44 WeakPolarHBondContact O-CD 3.42Å
45	N	59.2	Low	57.5	Low	155 Å²	155	100.1 Å²	100.1	83%	0.829	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.6	10.8	-171.6	-66.6	-31.7	0	0	0	114.8	W43	W43-N45 PolarHBondContact O-N 2.94Å; W43-N45 VanDerWaalsContact O-N 3.09Å
46	C	55.9	Low	57.6	Low	42 Å²	42	104 Å²	104	28%	0.284	53%	0.534	S	S	.	.			trans	-107.3	141.4	171.5	-95.3	0	0	0	0	111.9	W43 E50 V51	W43-C46 HydrophobicContact CB-CB 4.3Å; W43-C46 HydrophobicContact CD2-CB 4.38Å; W43-C46 HydrophobicContact CE3-CB 3.54Å; W43-C46 HydrophobicContact CZ3-CB 4.2Å; W43-C46 WeakPolarHBondContact CZ3-SG 3.46Å; C46-E50 WeakPolarHBondContact CA-OE2 3.09Å; C46-E50 PolarHBondContact SG-OE2 3.04Å; C46-V51 HydrophobicContact CB-CG2 4.04Å
47	S	59.6	Low	57.2	Low	55 Å²	55	104.1 Å²	104.1	39%	0.385	52%	0.523	S	S	.	.			trans	-69.7	150	168.2	65.9	0	0	0	0	110	D49 E50 V51	S47-D49 PolarHBondContact O-N 3.45Å; S47-D49 VanDerWaalsContact O-N 3.17Å; S47-E50 PolarHBondContact N-OE2 3Å; S47-E50 PolarHBondContact O-N 3.48Å; S47-E50 VanDerWaalsContact O-N 3.16Å; S47-E50 VanDerWaalsContact OG-CG 3.29Å; S47-E50 WeakPolarHBondContact OG-CG 3.47Å; S47-E50 PolarHBondContact OG-N 2.99Å; S47-E50 PolarHBondContact OG-OE2 2.73Å; S47-V51 PolarHBondContact O-N 3.05Å
48	V	58.3	Low	56.8	Low	107 Å²	107	105.5 Å²	105.5	65%	0.648	53%	0.528	S	S	*	.	H	α-helix	trans	-58.3	-28.8	175.7	177.2	0	0	0	0	110.9	R52	V48-R52 WeakPolarHBondContact O-CB 3.37Å; V48-R52 PolarHBondContact O-N 2.99Å
49	D	59	Low	57	Low	102 Å²	102	103.5 Å²	103.5	55%	0.545	53%	0.531	S	S	.	.	H	α-helix	trans	-72.1	-39.8	178.9	-62.1	-40.4	0	0	0	112	S47 V51 R52 T53	S47-D49 PolarHBondContact O-N 3.45Å; S47-D49 VanDerWaalsContact O-N 3.17Å; D49-V51 VanDerWaalsContact C-N 3.35Å; D49-V51 PolarHBondContact O-N 3.48Å; D49-R52 PolarHBondContact O-N 3.35Å; D49-R52 IonicContact OD1-NH1 3.6Å; D49-T53 WeakPolarHBondContact O-CB 3.4Å; D49-T53 PolarHBondContact O-N 2.94Å; D49-T53 PolarHBondContact O-OG1 3.28Å
50	E	60	Low	56.9	Low	97 Å²	97	103.6 Å²	103.6	45%	0.453	54%	0.54	S	S	.	.	H	α-helix	trans	-62	-42	173.2	-76.5	168.2	149.7	0	0	111.9	C46 S47 T53 L54	C46-E50 WeakPolarHBondContact CA-OE2 3.09Å; C46-E50 PolarHBondContact SG-OE2 3.04Å; S47-E50 PolarHBondContact N-OE2 3Å; S47-E50 PolarHBondContact O-N 3.48Å; S47-E50 VanDerWaalsContact O-N 3.16Å; S47-E50 VanDerWaalsContact OG-CG 3.29Å; S47-E50 WeakPolarHBondContact OG-CG 3.47Å; S47-E50 PolarHBondContact OG-N 2.99Å; S47-E50 PolarHBondContact OG-OE2 2.73Å; E50-T53 PolarHBondContact O-N 2.96Å; E50-L54 WeakPolarHBondContact O-CB 3.49Å; E50-L54 WeakPolarHBondContact O-CG 3.3Å; E50-L54 PolarHBondContact O-N 3.32Å
51	V	54.6	Low	56.8	Low	27 Å²	27	101.9 Å²	101.9	16%	0.164	53%	0.534	C	S	.	.	H	α-helix	trans	-66.7	-40.8	177.2	-179.9	0	0	0	0	110.9	C46 S47 D49 L54 M55	C46-V51 HydrophobicContact CB-CG2 4.04Å; S47-V51 PolarHBondContact O-N 3.05Å; D49-V51 VanDerWaalsContact C-N 3.35Å; D49-V51 PolarHBondContact O-N 3.48Å; V51-L54 PolarHBondContact O-N 2.94Å; V51-M55 HydrophobicContact CG1-CG 4.38Å; V51-M55 HydrophobicContact CG1-SD 3.97Å; V51-M55 WeakPolarHBondContact O-CB 3.47Å; V51-M55 VanDerWaalsContact O-CG 3.23Å; V51-M55 WeakPolarHBondContact O-CG 3.34Å; V51-M55 PolarHBondContact O-N 3.33Å
52	R	58.1	Low	56.4	Low	145 Å²	145	99.2 Å²	99.2	55%	0.547	52%	0.52	S	S	.	.	H	α-helix	trans	-61.4	-46.2	174.1	179.7	177.4	-86.5	123.4	-7.2	110.9	V48 D49 L54 M55 D56	V48-R52 WeakPolarHBondContact O-CB 3.37Å; V48-R52 PolarHBondContact O-N 2.99Å; D49-R52 PolarHBondContact O-N 3.35Å; D49-R52 IonicContact OD1-NH1 3.6Å; R52-L54 VanDerWaalsContact C-N 3.29Å; R52-L54 PolarHBondContact O-N 2.79Å; R52-M55 CarbonylContact O-C 3.6Å; R52-M55 PolarHBondContact O-N 2.89Å; R52-M55 VanDerWaalsContact O-N 3.08Å; R52-D56 VanDerWaalsContact O-CG 3.31Å; R52-D56 PolarHBondContact O-N 3.1Å
53	T	59.1	Low	56.2	Low	69 Å²	69	105 Å²	105	42%	0.423	54%	0.537	S	S	.	.	H	α-helix	trans	-63.2	-39.1	179.3	-41	0	0	0	0	110.6	D49 E50 D56 Y57	D49-T53 WeakPolarHBondContact O-CB 3.4Å; D49-T53 PolarHBondContact O-N 2.94Å; D49-T53 PolarHBondContact O-OG1 3.28Å; E50-T53 PolarHBondContact O-N 2.96Å; T53-D56 PolarHBondContact O-N 3.1Å; T53-Y57 HydrophobicContact CG2-CE2 4.03Å; T53-Y57 WeakPolarHBondContact O-CD2 3.43Å; T53-Y57 VanDerWaalsContact O-CE2 3.23Å; T53-Y57 WeakPolarHBondContact O-CE2 3.41Å
54	L	50.4	Low	56.5	Low	103 Å²	103	106.1 Å²	106.1	54%	0.539	55%	0.547	S	S	.	.	H	α-helix	trans	-66.6	-34.5	173.8	-83.1	162	0	0	0	113.3	W43 E50 V51 R52	W43-L54 HydrophobicContact CH2-CD1 4.33Å; E50-L54 WeakPolarHBondContact O-CB 3.49Å; E50-L54 WeakPolarHBondContact O-CG 3.3Å; E50-L54 PolarHBondContact O-N 3.32Å; V51-L54 PolarHBondContact O-N 2.94Å; R52-L54 VanDerWaalsContact C-N 3.29Å; R52-L54 PolarHBondContact O-N 2.79Å
55	M	50.9	Low	56.6	Low	140 Å²	140	106.9 Å²	106.9	69%	0.69	54%	0.541	S	S	*	.	H	α-helix	trans	-78	-23.1	177.4	-72.3	179.7	71.9	0	0	113.2	V51 R52 Y57	V51-M55 HydrophobicContact CG1-CG 4.38Å; V51-M55 HydrophobicContact CG1-SD 3.97Å; V51-M55 WeakPolarHBondContact O-CB 3.47Å; V51-M55 VanDerWaalsContact O-CG 3.23Å; V51-M55 WeakPolarHBondContact O-CG 3.34Å; V51-M55 PolarHBondContact O-N 3.33Å; R52-M55 CarbonylContact O-C 3.6Å; R52-M55 PolarHBondContact O-N 2.89Å; R52-M55 VanDerWaalsContact O-N 3.08Å; M55-Y57 VanDerWaalsContact C-N 3.33Å
56	D	56.2	Low	56.5	Low	124 Å²	124	104.5 Å²	104.5	66%	0.663	53%	0.527	S	S	*	.	H	α-helix	trans	-74.9	-22.4	175.5	-74	-22.2	0	0	0	112.3	R52 T53 R58	R52-D56 VanDerWaalsContact O-CG 3.31Å; R52-D56 PolarHBondContact O-N 3.1Å; T53-D56 PolarHBondContact O-N 3.1Å; D56-R58 PolarHBondContact O-N 3.42Å
57	Y	48.5	Very low	56.7	Low	86 Å²	86	108.7 Å²	108.7	34%	0.337	55%	0.547	S	S	.	.			trans	-75.3	90.2	170.8	-65.3	-70.5	0	0	0	111.2	T53 M55 K65	T53-Y57 HydrophobicContact CG2-CE2 4.03Å; T53-Y57 WeakPolarHBondContact O-CD2 3.43Å; T53-Y57 VanDerWaalsContact O-CE2 3.23Å; T53-Y57 WeakPolarHBondContact O-CE2 3.41Å; M55-Y57 VanDerWaalsContact C-N 3.33Å; Y57-K65 HydrophobicContact CE1-CD 4.07Å; Y57-K65 PolarHBondContact OH-NZ 3.31Å
58	R	54.4	Low	56.9	Low	226 Å²	226	109.8 Å²	109.8	85%	0.853	56%	0.559	S	S	*	*			trans	-106.4	128.9	164.5	-85.1	-167.6	-176.8	-124.6	3.4	111	D56	D56-R58 PolarHBondContact O-N 3.42Å
59	G	61.7	Low	56.9	Low	55 Å²	55	111 Å²	111	57%	0.567	56%	0.562	S	S	*	*	S	Bend	trans	109.7	-150.2	167.5	0	0	0	0	0	115	E61 A62	G59-E61 VanDerWaalsContact C-N 3.34Å; G59-E61 PolarHBondContact O-N 3.22Å; G59-A62 PolarHBondContact O-N 3.29Å
60	S	53.6	Low	56.5	Low	99 Å²	99	107.6 Å²	107.6	69%	0.692	55%	0.546	S	S	*	.	H	α-helix	trans	-66.5	-30.5	-175.7	46.5	0	0	0	0	113.6	A62 R63 E64	S60-A62 VanDerWaalsContact C-N 3.29Å; S60-A62 PolarHBondContact O-N 3.44Å; S60-R63 WeakPolarHBondContact O-CB 3.47Å; S60-R63 PolarHBondContact O-N 3.22Å; S60-R63 VanDerWaalsContact O-N 3.09Å; S60-E64 PolarHBondContact O-N 3.44Å; S60-E64 VanDerWaalsContact O-N 3.1Å
61	E	60.3	Low	56.4	Low	129 Å²	129	109.6 Å²	109.6	60%	0.603	56%	0.564	S	S	*	*	H	α-helix	trans	-60.8	-35.8	177.7	-79	-173.2	139.1	0	0	113	G59 R63 E64 K65	G59-E61 VanDerWaalsContact C-N 3.34Å; G59-E61 PolarHBondContact O-N 3.22Å; E61-R63 VanDerWaalsContact C-N 3.33Å; E61-R63 PolarHBondContact O-N 2.98Å; E61-E64 PolarHBondContact O-N 3.18Å; E61-K65 PolarHBondContact O-N 3.01Å; E61-K65 VanDerWaalsContact O-N 3.14Å
62	A	54	Low	56.2	Low	26 Å²	26	113.2 Å²	113.2	22%	0.215	58%	0.583	C	S	.	*	H	α-helix	trans	-64.7	-39.3	175.6	0	0	0	0	0	111.4	G59 S60 I66	G59-A62 PolarHBondContact O-N 3.29Å; S60-A62 VanDerWaalsContact C-N 3.29Å; S60-A62 PolarHBondContact O-N 3.44Å; A62-I66 WeakPolarHBondContact O-CB 3.35Å; A62-I66 WeakPolarHBondContact O-CD1 3.43Å; A62-I66 WeakPolarHBondContact O-CG1 3.27Å; A62-I66 PolarHBondContact O-N 3.07Å
63	R	54.2	Low	56.1	Low	202 Å²	202	112 Å²	112	76%	0.762	59%	0.591	S	S	*	*	H	α-helix	trans	-67.6	-37.8	177.8	-83.4	174	78.6	155.8	1	111.6	S60 E61 N67	S60-R63 WeakPolarHBondContact O-CB 3.47Å; S60-R63 PolarHBondContact O-N 3.22Å; S60-R63 VanDerWaalsContact O-N 3.09Å; E61-R63 VanDerWaalsContact C-N 3.33Å; E61-R63 PolarHBondContact O-N 2.98Å; R63-N67 WeakPolarHBondContact O-CB 3.27Å; R63-N67 PolarHBondContact O-N 2.95Å
64	E	60.9	Low	56	Low	145 Å²	145	114.2 Å²	114.2	68%	0.678	60%	0.6	S	S	*	*	H	α-helix	trans	-71.1	-40.4	-178.5	-161.2	165	-160.7	0	0	111.8	S60 E61 N67 A68	S60-E64 PolarHBondContact O-N 3.44Å; S60-E64 VanDerWaalsContact O-N 3.1Å; E61-E64 PolarHBondContact O-N 3.18Å; E64-N67 PolarHBondContact O-N 3.01Å; E64-A68 VanDerWaalsContact O-CB 3.25Å; E64-A68 WeakPolarHBondContact O-CB 3.49Å; E64-A68 PolarHBondContact O-N 2.82Å
65	K	59.5	Low	56.2	Low	110 Å²	110	113.9 Å²	113.9	48%	0.478	60%	0.596	S	S	.	*	H	α-helix	trans	-66.8	-40.2	172.2	-76.3	-168.4	176.3	-174.3	0	113.2	Y57 E61 N67 A68 D69	Y57-K65 HydrophobicContact CE1-CD 4.07Å; Y57-K65 PolarHBondContact OH-NZ 3.31Å; E61-K65 PolarHBondContact O-N 3.01Å; E61-K65 VanDerWaalsContact O-N 3.14Å; K65-N67 VanDerWaalsContact C-N 3.29Å; K65-N67 PolarHBondContact O-N 3.28Å; K65-A68 PolarHBondContact O-N 2.8Å; K65-D69 WeakPolarHBondContact O-CB 3.49Å; K65-D69 PolarHBondContact O-N 3.09Å
66	I	58.1	Low	56.3	Low	105 Å²	105	110.6 Å²	110.6	54%	0.538	58%	0.581	S	S	.	*	H	α-helix	trans	-64.4	-36.1	175.3	-69.9	166.4	0	0	0	111	A62 C70	A62-I66 WeakPolarHBondContact O-CB 3.35Å; A62-I66 WeakPolarHBondContact O-CD1 3.43Å; A62-I66 WeakPolarHBondContact O-CG1 3.27Å; A62-I66 PolarHBondContact O-N 3.07Å; I66-C70 WeakPolarHBondContact O-CB 3.08Å; I66-C70 PolarHBondContact O-N 3.4Å
67	N	58.9	Low	56.3	Low	131 Å²	131	108.3 Å²	108.3	70%	0.701	57%	0.574	S	S	*	*	H	α-helix	trans	-80.5	-25.9	179.6	-152.8	30.9	0	0	0	112.7	R63 E64 K65	R63-N67 WeakPolarHBondContact O-CB 3.27Å; R63-N67 PolarHBondContact O-N 2.95Å; E64-N67 PolarHBondContact O-N 3.01Å; K65-N67 VanDerWaalsContact C-N 3.29Å; K65-N67 PolarHBondContact O-N 3.28Å
68	A	63.2	Low	56.8	Low	78 Å²	78	110.7 Å²	110.7	65%	0.645	59%	0.586	S	S	*	*	H	α-helix	trans	-74.8	-35.8	173.2	0	0	0	0	0	112.3	E64 K65	E64-A68 VanDerWaalsContact O-CB 3.25Å; E64-A68 WeakPolarHBondContact O-CB 3.49Å; E64-A68 PolarHBondContact O-N 2.82Å; K65-A68 PolarHBondContact O-N 2.8Å
69	D	59.3	Low	56.9	Low	133 Å²	133	109.6 Å²	109.6	71%	0.711	58%	0.582	S	S	*	*	H	α-helix	trans	-93.6	-9.5	-177.1	-75.8	-20.1	0	0	0	114.2	K65	K65-D69 WeakPolarHBondContact O-CB 3.49Å; K65-D69 PolarHBondContact O-N 3.09Å
70	C	51	Low	56.5	Low	30 Å²	30	112.1 Å²	112.1	20%	0.203	58%	0.582	C	S	.	*			trans	-136.1	102.9	-176.4	-69.8	0	0	0	0	112.4	I66 D72 L76	I66-C70 WeakPolarHBondContact O-CB 3.08Å; I66-C70 PolarHBondContact O-N 3.4Å; C70-D72 VanDerWaalsContact C-N 3.29Å; C70-D72 PolarHBondContact O-N 3.38Å; C70-L76 HydrophobicContact CB-CD1 4.19Å; C70-L76 WeakPolarHBondContact SG-CD1 3.26Å
71	V	56.5	Low	56.5	Low	139 Å²	139	116.8 Å²	116.8	84%	0.842	59%	0.589	S	S	*	*	S	Bend	trans	-71.7	-22.6	175.4	179	0	0	0	0	112.3
72	D	52.1	Low	56.3	Low	103 Å²	103	115 Å²	115	55%	0.551	59%	0.587	S	S	*	*			trans	-145	135.2	-176.8	-96.1	-41.4	0	0	0	112.9	C70 L74 E75 L76	C70-D72 VanDerWaalsContact C-N 3.29Å; C70-D72 PolarHBondContact O-N 3.38Å; D72-L74 HydrophobicContact CB-CB 4.46Å; D72-L74 PolarHBondContact O-N 2.83Å; D72-E75 PolarHBondContact O-N 3.45Å; D72-L76 PolarHBondContact O-N 3.12Å
73	T	54.7	Low	55.9	Low	119 Å²	119	117.1 Å²	117.1	73%	0.73	60%	0.601	S	S	*	*	H	α-helix	trans	-55.7	-23.5	171.3	47.2	0	0	0	0	112.7	C77	T73-C77 PolarHBondContact O-N 3.3Å
74	L	56.9	Low	55.9	Low	115 Å²	115	111.3 Å²	111.3	60%	0.602	60%	0.596	S	S	*	*	H	α-helix	trans	-73.3	-32.2	179.4	-140.2	110.1	0	0	0	112.7	D72 K78	D72-L74 HydrophobicContact CB-CB 4.46Å; D72-L74 PolarHBondContact O-N 2.83Å; L74-K78 PolarHBondContact O-N 3.33Å; L74-K78 VanDerWaalsContact O-N 3.11Å
75	E	55.4	Low	55.6	Low	97 Å²	97	111.7 Å²	111.7	45%	0.453	60%	0.602	S	S	.	*	H	α-helix	trans	-80.2	-31.9	-179.4	-156.8	61.1	-159.6	0	0	111.2	D72 K78 R79	D72-E75 PolarHBondContact O-N 3.45Å; E75-K78 PolarHBondContact O-N 3.15Å; E75-K78 WeakPolarHBondContact OE2-CD 3.45Å; E75-K78 IonicContact OE2-NZ 3.83Å; E75-R79 PolarHBondContact O-N 3.18Å
76	L	53.2	Low	55.1	Low	71 Å²	71	117 Å²	117	37%	0.372	62%	0.62	S	S	.	*	H	α-helix	trans	-59.6	-46.2	168.6	-153.3	91.5	0	0	0	110.8	C70 D72 K78 R79 L80	C70-L76 HydrophobicContact CB-CD1 4.19Å; C70-L76 WeakPolarHBondContact SG-CD1 3.26Å; D72-L76 PolarHBondContact O-N 3.12Å; L76-K78 VanDerWaalsContact C-N 3.33Å; L76-K78 PolarHBondContact O-N 3.35Å; L76-R79 PolarHBondContact O-N 2.92Å; L76-L80 HydrophobicContact CD2-CD1 4.09Å; L76-L80 HydrophobicContact CG-CD1 3.99Å; L76-L80 VanDerWaalsContact O-CB 3.3Å; L76-L80 WeakPolarHBondContact O-CB 3.4Å; L76-L80 WeakPolarHBondContact O-CD1 3.49Å; L76-L80 WeakPolarHBondContact O-CG 3.49Å; L76-L80 PolarHBondContact O-N 3.38Å
77	C	55.5	Low	54.7	Low	76 Å²	76	113.4 Å²	113.4	51%	0.514	61%	0.605	S	S	.	*	H	α-helix	trans	-65.7	-31.9	176.1	-77.1	0	0	0	0	113.3	T73	T73-C77 PolarHBondContact O-N 3.3Å
78	K	59.8	Low	54.4	Low	135 Å²	135	113.4 Å²	113.4	59%	0.587	61%	0.605	S	S	*	*	H	α-helix	trans	-72.4	-43.7	173.7	-86.4	172.7	175.6	173.5	0	112.7	L74 E75 L76 L80 K81	L74-K78 PolarHBondContact O-N 3.33Å; L74-K78 VanDerWaalsContact O-N 3.11Å; E75-K78 PolarHBondContact O-N 3.15Å; E75-K78 WeakPolarHBondContact OE2-CD 3.45Å; E75-K78 IonicContact OE2-NZ 3.83Å; L76-K78 VanDerWaalsContact C-N 3.33Å; L76-K78 PolarHBondContact O-N 3.35Å; K78-L80 VanDerWaalsContact C-N 3.31Å; K78-L80 PolarHBondContact O-N 3.12Å; K78-K81 PolarHBondContact O-N 2.94Å
79	R	55.7	Low	54.1	Low	204 Å²	204	118.6 Å²	118.6	77%	0.77	62%	0.616	S	S	*	*	H	α-helix	trans	-68.5	-30.5	177.9	-70.8	-169.3	93.2	-177.8	5.9	112.4	E75 L76 K81	E75-R79 PolarHBondContact O-N 3.18Å; L76-R79 PolarHBondContact O-N 2.92Å; R79-K81 VanDerWaalsContact C-N 3.3Å; R79-K81 PolarHBondContact O-N 2.81Å
80	L	53.9	Low	53.8	Low	108 Å²	108	116.8 Å²	116.8	57%	0.565	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-2.1	178.7	-75.8	163.9	0	0	0	114.5	L76 K78 T82	L76-L80 HydrophobicContact CD2-CD1 4.09Å; L76-L80 HydrophobicContact CG-CD1 3.99Å; L76-L80 VanDerWaalsContact O-CB 3.3Å; L76-L80 WeakPolarHBondContact O-CB 3.4Å; L76-L80 WeakPolarHBondContact O-CD1 3.49Å; L76-L80 WeakPolarHBondContact O-CG 3.49Å; L76-L80 PolarHBondContact O-N 3.38Å; K78-L80 VanDerWaalsContact C-N 3.31Å; K78-L80 PolarHBondContact O-N 3.12Å; L80-T82 HydrophobicContact CB-CG2 4.19Å; L80-T82 VanDerWaalsContact O-CG2 3.23Å; L80-T82 WeakPolarHBondContact O-CG2 3.32Å; L80-T82 PolarHBondContact O-N 3.07Å
81	K	53.5	Low	54.9	Low	196 Å²	196	121.9 Å²	121.9	85%	0.852	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.8	17	179.8	-84.8	-174.8	177.5	175.5	0	115.1	K78 R79 S83	K78-K81 PolarHBondContact O-N 2.94Å; R79-K81 VanDerWaalsContact C-N 3.3Å; R79-K81 PolarHBondContact O-N 2.81Å; K81-S83 PolarHBondContact O-N 3.41Å; K81-S83 VanDerWaalsContact O-N 3.15Å
82	T	55.3	Low	55.3	Low	91 Å²	91	119.5 Å²	119.5	56%	0.558	62%	0.616	S	S	*	*			trans	-87.7	90.7	-178.7	68	0	0	0	0	109.2	L80 A84	L80-T82 HydrophobicContact CB-CG2 4.19Å; L80-T82 VanDerWaalsContact O-CG2 3.23Å; L80-T82 WeakPolarHBondContact O-CG2 3.32Å; L80-T82 PolarHBondContact O-N 3.07Å; T82-A84 PolarHBondContact O-N 3.45Å
83	S	46.2	Very low	56.1	Low	72 Å²	72	118.1 Å²	118.1	50%	0.503	61%	0.608	S	S	.	*			trans	-62.8	103.4	167.6	63.4	0	0	0	0	109	K81 N85 R86	K81-S83 PolarHBondContact O-N 3.41Å; K81-S83 VanDerWaalsContact O-N 3.15Å; S83-N85 PolarHBondContact O-N 3.01Å; S83-R86 PolarHBondContact O-N 2.75Å
84	A	53.8	Low	56.9	Low	79 Å²	79	116.2 Å²	116.2	65%	0.653	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	-16.1	-171.4	0	0	0	0	0	115.6	T82	T82-A84 PolarHBondContact O-N 3.45Å
85	N	55.3	Low	57.9	Low	153 Å²	153	114.6 Å²	114.6	82%	0.818	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.6	-6.2	-174.2	-64.1	-13.4	0	0	0	114.7	S83	S83-N85 PolarHBondContact O-N 3.01Å
86	R	49.7	Very low	58.9	Low	223 Å²	223	114.3 Å²	114.3	84%	0.842	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	-14.7	-179.2	-88.3	-176.8	179.1	-143.6	-0	115	S83 L88	S83-R86 PolarHBondContact O-N 2.75Å; R86-L88 VanDerWaalsContact C-N 3.33Å; R86-L88 PolarHBondContact O-N 3.31Å
87	A	49.4	Very low	60.1	Low	29 Å²	29	114.6 Å²	114.6	24%	0.24	59%	0.593	C	S	.	*	G	3₁₀ helix	trans	-86.4	2.3	-178.6	0	0	0	0	0	114.3	Q89 D90 L93	A87-Q89 VanDerWaalsContact C-N 3.25Å; A87-Q89 PolarHBondContact O-N 3.2Å; A87-D90 PolarHBondContact O-N 3.26Å; A87-L93 HydrophobicContact CB-CD1 4.38Å; A87-L93 HydrophobicContact CB-CD2 4.19Å
88	L	52.2	Low	61.1	Low	131 Å²	131	118.9 Å²	118.9	69%	0.686	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-75.7	-5.5	-172.3	-125.7	102.2	0	0	0	114.8	R86	R86-L88 VanDerWaalsContact C-N 3.33Å; R86-L88 PolarHBondContact O-N 3.31Å
89	Q	56.3	Low	62.1	Low	187 Å²	187	115 Å²	115	87%	0.874	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-100.6	-5.1	175.1	-77	-173.3	-22.2	0	0	113.9	A87 I91	A87-Q89 VanDerWaalsContact C-N 3.25Å; A87-Q89 PolarHBondContact O-N 3.2Å; Q89-I91 PolarHBondContact O-N 2.87Å
90	D	54.3	Low	63.3	Low	94 Å²	94	108.2 Å²	108.2	50%	0.503	58%	0.579	S	S	.	*			trans	-83	114.7	178.7	-72.7	-36.7	0	0	0	110.5	A87 T92 L93 I94	A87-D90 PolarHBondContact O-N 3.26Å; D90-T92 PolarHBondContact O-N 2.8Å; D90-L93 PolarHBondContact O-N 3.16Å; D90-I94 PolarHBondContact O-N 3.42Å
91	I	72.8	Confident	64.5	Low	137 Å²	137	108.3 Å²	108.3	70%	0.703	58%	0.579	S	S	*	*	H	α-helix	trans	-49.2	-32.3	175.4	-72.1	164.1	0	0	0	111.6	Q89 I94 T95	Q89-I91 PolarHBondContact O-N 2.87Å; I91-I94 PolarHBondContact O-N 3.29Å; I91-T95 PolarHBondContact O-N 2.92Å; I91-T95 VanDerWaalsContact O-N 3.1Å; I91-T95 PolarHBondContact O-OG1 3.35Å
92	T	66	Low	65.7	Low	90 Å²	90	104.1 Å²	104.1	55%	0.552	56%	0.564	S	S	*	*	H	α-helix	trans	-66.3	-40.1	178.7	54.4	0	0	0	0	113.3	D90 I94 T95 L96	D90-T92 PolarHBondContact O-N 2.8Å; T92-I94 VanDerWaalsContact C-N 3.34Å; T92-T95 WeakPolarHBondContact CA-OG1 3.3Å; T92-T95 PolarHBondContact O-N 3.23Å; T92-T95 PolarHBondContact O-OG1 3.17Å; T92-L96 WeakPolarHBondContact O-CB 3.3Å; T92-L96 VanDerWaalsContact O-CG 3.3Å; T92-L96 WeakPolarHBondContact O-CG 3.28Å; T92-L96 PolarHBondContact O-N 3.09Å
93	L	68.2	Low	66.7	Low	74 Å²	74	103.5 Å²	103.5	39%	0.387	56%	0.564	S	S	.	*	H	α-helix	trans	-68.5	-38.6	179	-161.9	96.6	0	0	0	110.4	A87 D90 L96 V97	A87-L93 HydrophobicContact CB-CD1 4.38Å; A87-L93 HydrophobicContact CB-CD2 4.19Å; D90-L93 PolarHBondContact O-N 3.16Å; L93-L96 PolarHBondContact O-N 3.41Å; L93-V97 WeakPolarHBondContact O-CG2 3.05Å; L93-V97 PolarHBondContact O-N 3.28Å
94	I	71.3	Confident	68.1	Low	79 Å²	79	105.2 Å²	105.2	41%	0.405	57%	0.567	S	S	.	*	H	α-helix	trans	-64.4	-43.2	176.7	-64	172	0	0	0	110.9	D90 I91 T92 R98	D90-I94 PolarHBondContact O-N 3.42Å; I91-I94 PolarHBondContact O-N 3.29Å; T92-I94 VanDerWaalsContact C-N 3.34Å; I94-R98 WeakPolarHBondContact O-CB 3.04Å; I94-R98 WeakPolarHBondContact O-CG 3.01Å; I94-R98 PolarHBondContact O-N 3.08Å
95	T	78	Confident	69.2	Low	80 Å²	80	103.4 Å²	103.4	49%	0.491	56%	0.556	S	S	.	*	H	α-helix	trans	-65.8	-38.3	175	33.2	0	0	0	0	112.3	I91 T92 R98 A99	I91-T95 PolarHBondContact O-N 2.92Å; I91-T95 VanDerWaalsContact O-N 3.1Å; I91-T95 PolarHBondContact O-OG1 3.35Å; T92-T95 WeakPolarHBondContact CA-OG1 3.3Å; T92-T95 PolarHBondContact O-N 3.23Å; T92-T95 PolarHBondContact O-OG1 3.17Å; T95-R98 PolarHBondContact O-N 2.82Å; T95-A99 WeakPolarHBondContact O-CB 3.15Å; T95-A99 PolarHBondContact O-N 2.96Å
96	L	77.2	Confident	69.9	Low	91 Å²	91	101.5 Å²	101.5	48%	0.476	55%	0.545	S	S	.	.	H	α-helix	trans	-64.3	-46.8	175.7	-74.9	173.8	0	0	0	112.5	T92 L93 R98 A99 A100	T92-L96 WeakPolarHBondContact O-CB 3.3Å; T92-L96 VanDerWaalsContact O-CG 3.3Å; T92-L96 WeakPolarHBondContact O-CG 3.28Å; T92-L96 PolarHBondContact O-N 3.09Å; L93-L96 PolarHBondContact O-N 3.41Å; L96-R98 PolarHBondContact O-N 2.89Å; L96-A99 PolarHBondContact O-N 2.81Å; L96-A100 WeakPolarHBondContact O-CB 3.49Å; L96-A100 PolarHBondContact O-N 3.44Å
97	V	77.9	Confident	70.9	Confident	78 Å²	78	95.7 Å²	95.7	47%	0.473	54%	0.538	S	S	.	.	H	α-helix	trans	-63.9	-41.5	177.8	172.2	0	0	0	0	110.9	L93 A100 I101	L93-V97 WeakPolarHBondContact O-CG2 3.05Å; L93-V97 PolarHBondContact O-N 3.28Å; V97-A100 PolarHBondContact O-N 3.34Å; V97-I101 HydrophobicContact CG1-CD1 3.87Å; V97-I101 HydrophobicContact CG1-CG1 4.48Å; V97-I101 VanDerWaalsContact O-CG1 3.3Å; V97-I101 WeakPolarHBondContact O-CG1 3.24Å; V97-I101 PolarHBondContact O-N 2.81Å
98	R	76.8	Confident	71.7	Confident	166 Å²	166	102 Å²	102	63%	0.626	56%	0.561	S	S	*	*	H	α-helix	trans	-61.9	-43.9	174.4	-77.3	178.2	172	174.5	-1.4	112.2	I94 T95 L96 A100 I101 I102	I94-R98 WeakPolarHBondContact O-CB 3.04Å; I94-R98 WeakPolarHBondContact O-CG 3.01Å; I94-R98 PolarHBondContact O-N 3.08Å; T95-R98 PolarHBondContact O-N 2.82Å; L96-R98 PolarHBondContact O-N 2.89Å; R98-A100 VanDerWaalsContact C-N 3.35Å; R98-I101 PolarHBondContact O-N 3.49Å; R98-I102 VanDerWaalsContact O-CG1 3.28Å; R98-I102 WeakPolarHBondContact O-CG1 3.15Å; R98-I102 PolarHBondContact O-N 3.18Å
99	A	79.4	Confident	71.6	Confident	54 Å²	54	103 Å²	103	45%	0.446	56%	0.557	S	S	.	*	H	α-helix	trans	-63.3	-40.5	176.5	0	0	0	0	0	111.8	T95 L96 I102 S103	T95-A99 WeakPolarHBondContact O-CB 3.15Å; T95-A99 PolarHBondContact O-N 2.96Å; L96-A99 PolarHBondContact O-N 2.81Å; A99-I102 PolarHBondContact O-N 3.47Å; A99-S103 VanDerWaalsContact O-CB 3.25Å; A99-S103 WeakPolarHBondContact O-CB 2.96Å; A99-S103 PolarHBondContact O-N 3.35Å
100	A	81	Confident	71.6	Confident	60 Å²	60	99.2 Å²	99.2	50%	0.496	55%	0.55	S	S	.	*	H	α-helix	trans	-63.4	-43.3	175.5	0	0	0	0	0	112.1	L96 V97 R98 S103 L104	L96-A100 WeakPolarHBondContact O-CB 3.49Å; L96-A100 PolarHBondContact O-N 3.44Å; V97-A100 PolarHBondContact O-N 3.34Å; R98-A100 VanDerWaalsContact C-N 3.35Å; A100-S103 PolarHBondContact O-N 3.48Å; A100-L104 VanDerWaalsContact O-CB 3.31Å; A100-L104 WeakPolarHBondContact O-CB 3.14Å; A100-L104 PolarHBondContact O-N 3.24Å
101	I	80	Confident	71.5	Confident	111 Å²	111	98.9 Å²	98.9	57%	0.569	55%	0.554	S	S	*	*	H	α-helix	trans	-64.6	-43.5	176.5	-67.3	166.5	0	0	0	111.2	V97 R98 L104 G105	V97-I101 HydrophobicContact CG1-CD1 3.87Å; V97-I101 HydrophobicContact CG1-CG1 4.48Å; V97-I101 VanDerWaalsContact O-CG1 3.3Å; V97-I101 WeakPolarHBondContact O-CG1 3.24Å; V97-I101 PolarHBondContact O-N 2.81Å; R98-I101 PolarHBondContact O-N 3.49Å; I101-L104 PolarHBondContact O-N 2.92Å; I101-G105 PolarHBondContact O-N 2.91Å
102	I	77.7	Confident	70.2	Confident	107 Å²	107	97.6 Å²	97.6	55%	0.549	55%	0.554	S	S	.	*	H	α-helix	trans	-64.3	-43.8	176.8	-67.7	163.4	0	0	0	110.4	R98 A99 G105 L106	R98-I102 VanDerWaalsContact O-CG1 3.28Å; R98-I102 WeakPolarHBondContact O-CG1 3.15Å; R98-I102 PolarHBondContact O-N 3.18Å; A99-I102 PolarHBondContact O-N 3.47Å; I102-G105 CarbonylContact O-C 3.6Å; I102-G105 PolarHBondContact O-N 3.49Å; I102-L106 HydrophobicContact CG2-CD1 3.97Å; I102-L106 HydrophobicContact CG2-CG 4.33Å; I102-L106 WeakPolarHBondContact O-CB 3.29Å; I102-L106 WeakPolarHBondContact O-CG 3.49Å; I102-L106 PolarHBondContact O-N 3.09Å
103	S	77.6	Confident	69.4	Low	78 Å²	78	97.2 Å²	97.2	55%	0.545	56%	0.56	S	S	.	*	H	α-helix	trans	-61.2	-45.1	177.2	-176.2	0	0	0	0	111.6	A99 A100 L106 S107	A99-S103 VanDerWaalsContact O-CB 3.25Å; A99-S103 WeakPolarHBondContact O-CB 2.96Å; A99-S103 PolarHBondContact O-N 3.35Å; A100-S103 PolarHBondContact O-N 3.48Å; S103-L106 PolarHBondContact O-N 3.38Å; S103-S107 PolarHBondContact O-N 3.14Å
104	L	75.8	Confident	68.2	Low	108 Å²	108	101.2 Å²	101.2	57%	0.565	58%	0.577	S	S	*	*	H	α-helix	trans	-62.8	-44.7	174.9	-165.1	71.3	0	0	0	110.7	A100 I101 L106 S107 F108	A100-L104 VanDerWaalsContact O-CB 3.31Å; A100-L104 WeakPolarHBondContact O-CB 3.14Å; A100-L104 PolarHBondContact O-N 3.24Å; I101-L104 PolarHBondContact O-N 2.92Å; L104-L106 PolarHBondContact O-N 3.1Å; L104-S107 WeakPolarHBondContact O-CB 3.43Å; L104-S107 PolarHBondContact O-N 2.86Å; L104-F108 HydrophobicContact CD1-CD2 4.39Å; L104-F108 HydrophobicContact CD1-CE2 3.77Å; L104-F108 HydrophobicContact CD2-CE2 4.48Å; L104-F108 HydrophobicContact CG-CD2 4.05Å; L104-F108 HydrophobicContact CG-CE2 3.8Å; L104-F108 WeakPolarHBondContact O-CD2 3.32Å; L104-F108 PolarHBondContact O-N 3.4Å; L104-F108 VanDerWaalsContact O-N 3.08Å
105	G	76.2	Confident	66.9	Low	41 Å²	41	100.3 Å²	100.3	42%	0.423	58%	0.581	S	S	.	*	H	α-helix	trans	-58.6	-43	175.8	0	0	0	0	0	112.8	I101 I102 F108 Y109	I101-G105 PolarHBondContact O-N 2.91Å; I102-G105 CarbonylContact O-C 3.6Å; I102-G105 PolarHBondContact O-N 3.49Å; G105-F108 CarbonylContact O-C 3.48Å; G105-F108 PolarHBondContact O-N 3.43Å; G105-Y109 VanDerWaalsContact O-CB 3.29Å; G105-Y109 WeakPolarHBondContact O-CB 3.27Å; G105-Y109 PolarHBondContact O-N 2.95Å
106	L	70.1	Confident	65.5	Low	114 Å²	114	104.9 Å²	104.9	60%	0.597	60%	0.597	S	S	*	*	H	α-helix	trans	-68.7	-34.4	175.6	-71	172	0	0	0	112.5	I102 S103 L104 F108 Y109	I102-L106 HydrophobicContact CG2-CD1 3.97Å; I102-L106 HydrophobicContact CG2-CG 4.33Å; I102-L106 WeakPolarHBondContact O-CB 3.29Å; I102-L106 WeakPolarHBondContact O-CG 3.49Å; I102-L106 PolarHBondContact O-N 3.09Å; S103-L106 PolarHBondContact O-N 3.38Å; L104-L106 PolarHBondContact O-N 3.1Å; L106-F108 PolarHBondContact O-N 2.96Å; L106-Y109 PolarHBondContact O-N 2.87Å; L106-Y109 VanDerWaalsContact O-N 3.17Å
107	S	70.5	Confident	64.3	Low	100 Å²	100	107.6 Å²	107.6	70%	0.699	61%	0.607	S	S	*	*	H	α-helix	trans	-65.9	-28.7	173.6	-171.3	0	0	0	0	112.6	S103 L104	S103-S107 PolarHBondContact O-N 3.14Å; L104-S107 WeakPolarHBondContact O-CB 3.43Å; L104-S107 PolarHBondContact O-N 2.86Å
108	F	67.1	Low	62.9	Low	163 Å²	163	108.6 Å²	108.6	72%	0.715	61%	0.613	S	S	*	*	H	α-helix	trans	-93.7	-9.2	172.6	-70	-70.3	0	0	0	113.1	L104 G105 L106 S110	L104-F108 HydrophobicContact CD1-CD2 4.39Å; L104-F108 HydrophobicContact CD1-CE2 3.77Å; L104-F108 HydrophobicContact CD2-CE2 4.48Å; L104-F108 HydrophobicContact CG-CD2 4.05Å; L104-F108 HydrophobicContact CG-CE2 3.8Å; L104-F108 WeakPolarHBondContact O-CD2 3.32Å; L104-F108 PolarHBondContact O-N 3.4Å; L104-F108 VanDerWaalsContact O-N 3.08Å; G105-F108 CarbonylContact O-C 3.48Å; G105-F108 PolarHBondContact O-N 3.43Å; L106-F108 PolarHBondContact O-N 2.96Å; F108-S110 PolarHBondContact O-N 3.44Å; F108-S110 VanDerWaalsContact O-N 3.09Å
109	Y	48.6	Very low	61.7	Low	152 Å²	152	104.2 Å²	104.2	60%	0.596	61%	0.607	S	S	*	*			trans	-80.5	91.4	177.3	-168.4	-96.4	0	0	0	109.7	G105 L106 P111	G105-Y109 VanDerWaalsContact O-CB 3.29Å; G105-Y109 WeakPolarHBondContact O-CB 3.27Å; G105-Y109 PolarHBondContact O-N 2.95Å; L106-Y109 PolarHBondContact O-N 2.87Å; L106-Y109 VanDerWaalsContact O-N 3.17Å; Y109-P111 HydrophobicContact CE1-CB 4.03Å; Y109-P111 WeakPolarHBondContact O-CD 3.47Å
110	S	56.1	Low	60.9	Low	106 Å²	106	105.5 Å²	105.5	74%	0.741	61%	0.606	S	S	*	*			trans	-81.4	115.5	161	-121.8	0	0	0	0	107.9	F108 P112	F108-S110 PolarHBondContact O-N 3.44Å; F108-S110 VanDerWaalsContact O-N 3.09Å; S110-P112 VanDerWaalsContact O-CD 3.24Å; S110-P112 WeakPolarHBondContact O-CD 3.15Å
111	P	52.6	Low	60.1	Low	88 Å²	88	107 Å²	107	57%	0.571	61%	0.606	S	S	*	*			trans	-65.9	120.6	179	25.9	-32.3	0	0	0	110.2	Y109 A113	Y109-P111 HydrophobicContact CE1-CB 4.03Å; Y109-P111 WeakPolarHBondContact O-CD 3.47Å; P111-A113 PolarHBondContact O-N 3.01Å
112	P	45.4	Very low	59.2	Low	109 Å²	109	108.1 Å²	108.1	71%	0.708	60%	0.604	S	S	*	*			trans	-95.9	74.5	177.2	35.6	-27.3	0	0	0	110.2	S110	S110-P112 VanDerWaalsContact O-CD 3.24Å; S110-P112 WeakPolarHBondContact O-CD 3.15Å
113	A	50.1	Low	58.8	Low	82 Å²	82	106 Å²	106	68%	0.678	60%	0.596	S	S	*	*	S	Bend	trans	166.9	82.8	167.1	0	0	0	0	0	106.6	P111	P111-A113 PolarHBondContact O-N 3.01Å
114	E	42.7	Very low	58.3	Low	158 Å²	158	106.5 Å²	106.5	74%	0.738	59%	0.589	S	S	*	*	S	Bend		-139.2	66.2	68.5	-68.6	162.7	-166	0	0	109.9	H116 T118	E114-H116 PolarHBondContact O-N 3.03Å; E114-H116 VanDerWaalsContact O-N 3.15Å; E114-T118 PolarHBondContact O-OG1 3.37Å
115	A	45.1	Very low	57.9	Low	60 Å²	60	104.7 Å²	104.7	50%	0.496	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.2	2.3	-175.3	0	0	0	0	0	114.3	C119	A115-C119 WeakPolarHBondContact O-CB 3.46Å
116	H	47.9	Very low	57.3	Low	177 Å²	177	110.8 Å²	110.8	82%	0.819	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-28.3	-179.3	-141.3	-90.9	0	0	0	113.2	E114	E114-H116 PolarHBondContact O-N 3.03Å; E114-H116 VanDerWaalsContact O-N 3.15Å
117	E	52.4	Low	57.3	Low	147 Å²	147	111.9 Å²	111.9	69%	0.687	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-42.8	-179.3	-60.6	-168.6	170.9	0	0	111.8	N120 D121	E117-N120 PolarHBondContact O-N 3.49Å; E117-D121 PolarHBondContact O-N 3.17Å
118	T	48.2	Very low	57	Low	99 Å²	99	113.2 Å²	113.2	61%	0.607	58%	0.583	S	S	*	*	H	α-helix	trans	-72.7	-29.7	179.3	52.8	0	0	0	0	113.9	E114 Y122	E114-T118 PolarHBondContact O-OG1 3.37Å; T118-Y122 PolarHBondContact O-N 3.4Å
119	C	51.3	Low	57	Low	74 Å²	74	112.2 Å²	112.2	50%	0.5	57%	0.574	S	S	.	*	H	α-helix	trans	-68.6	-39.6	174.2	-175.1	0	0	0	0	111.3	A115 D121 Y122 T123	A115-C119 WeakPolarHBondContact O-CB 3.46Å; C119-D121 VanDerWaalsContact C-N 3.34Å; C119-D121 PolarHBondContact O-N 3.02Å; C119-Y122 PolarHBondContact O-N 2.84Å; C119-T123 PolarHBondContact O-N 3.43Å; C119-T123 PolarHBondContact O-OG1 3.34Å
120	N	62.3	Low	57.9	Low	81 Å²	81	106.6 Å²	106.6	43%	0.433	56%	0.563	S	S	.	*	H	α-helix	trans	-63.2	-43	178.8	-162.7	14.4	0	0	0	110.9	E117 T123 K124	E117-N120 PolarHBondContact O-N 3.49Å; N120-T123 WeakPolarHBondContact CA-OG1 3.17Å; N120-T123 PolarHBondContact O-N 3.29Å; N120-T123 PolarHBondContact O-OG1 3.33Å; N120-K124 PolarHBondContact ND2-NZ 3.44Å; N120-K124 VanDerWaalsContact O-CG 3.27Å; N120-K124 WeakPolarHBondContact O-CG 3.3Å; N120-K124 PolarHBondContact O-N 2.89Å; N120-K124 WeakPolarHBondContact OD1-CE 3.31Å
121	D	65.4	Low	58.4	Low	93 Å²	93	106.5 Å²	106.5	50%	0.497	55%	0.554	S	S	.	*	H	α-helix	trans	-71.1	-34.7	179	-69.1	-13.3	0	0	0	112.7	E117 C119 K124 E125	E117-D121 PolarHBondContact O-N 3.17Å; C119-D121 VanDerWaalsContact C-N 3.34Å; C119-D121 PolarHBondContact O-N 3.02Å; D121-K124 PolarHBondContact O-N 3.48Å; D121-K124 IonicContact OD1-NZ 3Å; D121-K124 PolarHBondContact OD1-NZ 2.9Å; D121-E125 WeakPolarHBondContact O-CB 3.48Å; D121-E125 PolarHBondContact O-N 3.49Å
122	Y	61.1	Low	58.9	Low	134 Å²	134	107 Å²	107	53%	0.525	55%	0.548	S	S	.	.	H	α-helix	trans	-63.5	-42.2	170.9	-177.1	-99	0	0	0	112.1	T118 C119 R126	T118-Y122 PolarHBondContact O-N 3.4Å; C119-Y122 PolarHBondContact O-N 2.84Å; Y122-R126 WeakPolarHBondContact O-CB 3.14Å; Y122-R126 PolarHBondContact O-N 3.47Å; Y122-R126 PolarHBondContact OH-NE 2.91Å
123	T	68.8	Low	59.7	Low	62 Å²	62	107.6 Å²	107.6	38%	0.38	54%	0.542	S	S	.	.	H	α-helix	trans	-65.4	-37	175	38.6	0	0	0	0	112.7	C119 N120 Q127	C119-T123 PolarHBondContact O-N 3.43Å; C119-T123 PolarHBondContact O-OG1 3.34Å; N120-T123 WeakPolarHBondContact CA-OG1 3.17Å; N120-T123 PolarHBondContact O-N 3.29Å; N120-T123 PolarHBondContact O-OG1 3.33Å; T123-Q127 WeakPolarHBondContact O-CG 3.33Å; T123-Q127 PolarHBondContact O-N 3.36Å
124	K	66.1	Low	60.2	Low	88 Å²	88	110.8 Å²	110.8	38%	0.383	54%	0.54	S	S	.	.	H	α-helix	trans	-65.3	-50.5	175	-71.4	171.8	-163.6	156.5	0	111.3	N120 D121 R126 Q127 F128	N120-K124 PolarHBondContact ND2-NZ 3.44Å; N120-K124 VanDerWaalsContact O-CG 3.27Å; N120-K124 WeakPolarHBondContact O-CG 3.3Å; N120-K124 PolarHBondContact O-N 2.89Å; N120-K124 WeakPolarHBondContact OD1-CE 3.31Å; D121-K124 PolarHBondContact O-N 3.48Å; D121-K124 IonicContact OD1-NZ 3Å; D121-K124 PolarHBondContact OD1-NZ 2.9Å; K124-R126 VanDerWaalsContact C-N 3.28Å; K124-R126 PolarHBondContact O-N 3.01Å; K124-Q127 WeakPolarHBondContact O-CB 3.28Å; K124-Q127 PolarHBondContact O-N 2.89Å; K124-Q127 VanDerWaalsContact O-N 3.1Å; K124-F128 VanDerWaalsContact O-CD2 3.26Å; K124-F128 WeakPolarHBondContact O-CD2 3.25Å; K124-F128 PolarHBondContact O-N 3.08Å; K124-F128 VanDerWaalsContact O-N 3.1Å
125	E	67.1	Low	61	Low	70 Å²	70	108.3 Å²	108.3	33%	0.327	53%	0.531	S	S	.	.	H	α-helix	trans	-60	-38	178.8	178.8	65.5	-167.4	0	0	111.5	K16 D121 Q127 F128 R129	K16-E125 IonicContact NZ-OE1 3.8Å; D121-E125 WeakPolarHBondContact O-CB 3.48Å; D121-E125 PolarHBondContact O-N 3.49Å; E125-Q127 VanDerWaalsContact C-N 3.33Å; E125-Q127 PolarHBondContact O-N 3.34Å; E125-F128 PolarHBondContact O-N 2.84Å; E125-R129 WeakPolarHBondContact O-CG 3.33Å; E125-R129 PolarHBondContact O-N 3.38Å; E125-R129 IonicContact OE1-CZ 3.69Å; E125-R129 IonicContact OE1-NE 3.01Å; E125-R129 PolarHBondContact OE1-NE 3.45Å; E125-R129 IonicContact OE1-NH2 3.45Å; E125-R129 PolarHBondContact OE1-NH2 2.63Å
126	R	64.5	Low	61.7	Low	169 Å²	169	111.6 Å²	111.6	64%	0.638	54%	0.536	S	S	*	.	H	α-helix	trans	-62.4	-39.2	175.8	-121.1	-179	179.9	178.1	1.4	112.8	Y122 K124 G130	Y122-R126 WeakPolarHBondContact O-CB 3.14Å; Y122-R126 PolarHBondContact O-N 3.47Å; Y122-R126 PolarHBondContact OH-NE 2.91Å; K124-R126 VanDerWaalsContact C-N 3.28Å; K124-R126 PolarHBondContact O-N 3.01Å; R126-G130 PolarHBondContact O-N 2.88Å
127	Q	69.1	Low	62.3	Low	137 Å²	137	109 Å²	109	64%	0.64	52%	0.524	S	S	*	.	H	α-helix	trans	-66.9	-40.4	176.9	-71.5	174.3	-0.7	0	0	111.1	T123 K124 E125 G130 L131	T123-Q127 WeakPolarHBondContact O-CG 3.33Å; T123-Q127 PolarHBondContact O-N 3.36Å; K124-Q127 WeakPolarHBondContact O-CB 3.28Å; K124-Q127 PolarHBondContact O-N 2.89Å; K124-Q127 VanDerWaalsContact O-N 3.1Å; E125-Q127 VanDerWaalsContact C-N 3.33Å; E125-Q127 PolarHBondContact O-N 3.34Å; Q127-G130 PolarHBondContact O-N 3.36Å; Q127-L131 WeakPolarHBondContact O-CG 3.35Å; Q127-L131 PolarHBondContact O-N 2.84Å
128	F	66.1	Low	62.9	Low	128 Å²	128	109.4 Å²	109.4	56%	0.561	53%	0.526	S	S	*	.	H	α-helix	trans	-64.6	-41.1	175.7	-82.6	-76.3	0	0	0	112.9	K124 E125 G130 L131 Q132	K124-F128 VanDerWaalsContact O-CD2 3.26Å; K124-F128 WeakPolarHBondContact O-CD2 3.25Å; K124-F128 PolarHBondContact O-N 3.08Å; K124-F128 VanDerWaalsContact O-N 3.1Å; E125-F128 PolarHBondContact O-N 2.84Å; F128-G130 VanDerWaalsContact C-N 3.35Å; F128-G130 PolarHBondContact O-N 3.04Å; F128-L131 PolarHBondContact O-N 3.05Å; F128-Q132 PolarHBondContact O-N 3.49Å
129	R	67.1	Low	64.2	Low	142 Å²	142	107.2 Å²	107.2	54%	0.536	51%	0.511	S	S	.	.	H	α-helix	trans	-63.6	-39.2	177.8	-72.1	-177.4	-177	-150.4	4.1	112.9	E125 L131 Q132 Q133	E125-R129 WeakPolarHBondContact O-CG 3.33Å; E125-R129 PolarHBondContact O-N 3.38Å; E125-R129 IonicContact OE1-CZ 3.69Å; E125-R129 IonicContact OE1-NE 3.01Å; E125-R129 PolarHBondContact OE1-NE 3.45Å; E125-R129 IonicContact OE1-NH2 3.45Å; E125-R129 PolarHBondContact OE1-NH2 2.63Å; R129-L131 VanDerWaalsContact C-N 3.29Å; R129-L131 PolarHBondContact O-N 3.49Å; R129-Q132 PolarHBondContact O-N 3.1Å; R129-Q133 WeakPolarHBondContact O-CG 3.25Å; R129-Q133 PolarHBondContact O-N 3.45Å
130	G	65.6	Low	65.6	Low	34 Å²	34	111.2 Å²	111.2	35%	0.351	52%	0.515	S	S	.	.	H	α-helix	trans	-66.2	-31	175.9	0	0	0	0	0	113.2	R126 Q127 F128	R126-G130 PolarHBondContact O-N 2.88Å; Q127-G130 PolarHBondContact O-N 3.36Å; F128-G130 VanDerWaalsContact C-N 3.35Å; F128-G130 PolarHBondContact O-N 3.04Å
131	L	66.6	Low	66.7	Low	105 Å²	105	107.7 Å²	107.7	55%	0.55	50%	0.496	S	S	.	.	H	α-helix	trans	-74.5	-42.8	174.6	-67.6	171.3	0	0	0	111.5	Q127 F128 R129 Q133 K134 I135	Q127-L131 WeakPolarHBondContact O-CG 3.35Å; Q127-L131 PolarHBondContact O-N 2.84Å; F128-L131 PolarHBondContact O-N 3.05Å; R129-L131 VanDerWaalsContact C-N 3.29Å; R129-L131 PolarHBondContact O-N 3.49Å; L131-Q133 PolarHBondContact O-N 3.43Å; L131-K134 PolarHBondContact O-N 2.91Å; L131-I135 WeakPolarHBondContact O-CG1 3.46Å; L131-I135 PolarHBondContact O-N 3.31Å
132	Q	64.4	Low	67.7	Low	99 Å²	99	104 Å²	104	46%	0.463	48%	0.478	S	S	.	.	H	α-helix	trans	-61.7	-42.6	178	-78.4	169.2	-18.8	0	0	112.1	F128 R129 K134 I135 E136	F128-Q132 PolarHBondContact O-N 3.49Å; R129-Q132 PolarHBondContact O-N 3.1Å; Q132-K134 VanDerWaalsContact C-N 3.29Å; Q132-K134 PolarHBondContact O-N 3.32Å; Q132-I135 PolarHBondContact O-N 2.94Å; Q132-E136 WeakPolarHBondContact O-CG 3.33Å; Q132-E136 PolarHBondContact O-N 3.27Å
133	Q	61.2	Low	69.1	Low	121 Å²	121	98 Å²	98	57%	0.565	46%	0.456	S	S	*	.	H	α-helix	trans	-61.5	-34.5	177.8	-77.8	-174	-39.5	0	0	113.3	R129 L131 H137	R129-Q133 WeakPolarHBondContact O-CG 3.25Å; R129-Q133 PolarHBondContact O-N 3.45Å; L131-Q133 PolarHBondContact O-N 3.43Å; Q133-H137 PolarHBondContact O-CD2 3.23Å; Q133-H137 PolarHBondContact O-N 3.16Å
134	K	60.1	Low	70	Confident	149 Å²	149	97.7 Å²	97.7	65%	0.648	45%	0.451	S	S	*	.	H	α-helix	trans	-70.3	-37.6	177.1	-76	-175.4	177	-174.7	0	112.2	L131 Q132 E138	L131-K134 PolarHBondContact O-N 2.91Å; Q132-K134 VanDerWaalsContact C-N 3.29Å; Q132-K134 PolarHBondContact O-N 3.32Å; K134-E138 PolarHBondContact O-N 2.98Å
135	I	60.7	Low	70.9	Confident	106 Å²	106	95.3 Å²	95.3	54%	0.544	45%	0.451	S	S	.	.	H	α-helix	trans	-71.4	-37.7	-179.5	-61.6	165.4	0	0	0	110.5	L131 Q132 H137 N139	L131-I135 WeakPolarHBondContact O-CG1 3.46Å; L131-I135 PolarHBondContact O-N 3.31Å; Q132-I135 PolarHBondContact O-N 2.94Å; I135-H137 PolarHBondContact O-N 3.46Å; I135-N139 PolarHBondContact O-OD1 2.98Å
136	E	60.5	Low	71.6	Confident	128 Å²	128	100.7 Å²	100.7	60%	0.598	48%	0.482	S	S	*	.	H	α-helix	trans	-66.7	-35.4	179	-74.7	174.7	-179.7	0	0	113	Q132	Q132-E136 WeakPolarHBondContact O-CG 3.33Å; Q132-E136 PolarHBondContact O-N 3.27Å
137	H	59.2	Low	72.6	Confident	123 Å²	123	96.2 Å²	96.2	57%	0.569	49%	0.489	S	S	*	.	H	α-helix	trans	-82.1	-15.9	-178.2	-75	-57.6	0	0	0	114.8	Q133 I135 L153	Q133-H137 PolarHBondContact O-CD2 3.23Å; Q133-H137 PolarHBondContact O-N 3.16Å; I135-H137 PolarHBondContact O-N 3.46Å; H137-L153 WeakPolarHBondContact O-CD2 3.39Å
138	E	66.3	Low	73.5	Confident	156 Å²	156	96.5 Å²	96.5	73%	0.729	49%	0.49	S	S	*	.	H	α-helix	trans	-97.7	-5.7	-177.7	-73.9	-173.4	169.2	0	0	114.2	K134 R140	K134-E138 PolarHBondContact O-N 2.98Å; E138-R140 PolarHBondContact O-N 2.6Å; E138-R140 VanDerWaalsContact O-N 3.07Å
139	N	74.2	Confident	74.6	Confident	53 Å²	53	95.7 Å²	95.7	28%	0.283	49%	0.488	S	S	.	.			trans	-77.1	102.2	179.5	-71.2	-15.4	0	0	0	111.1	I135 F141 I154	I135-N139 PolarHBondContact O-OD1 2.98Å; N139-F141 HydrophobicContact CB-CE2 4.44Å; N139-I154 HydrophobicContact CB-CD1 3.29Å; N139-I154 HydrophobicContact CB-CG1 3.81Å; N139-I154 WeakPolarHBondContact O-CG1 3.33Å; N139-I154 PolarHBondContact O-N 3.3Å
140	R	80.7	Confident	75.6	Confident	157 Å²	157	92.6 Å²	92.6	59%	0.592	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	137.8	172.6	-62.2	-178.9	-177.2	-174.8	-1.3	110.3	E138 E151 V152	E138-R140 PolarHBondContact O-N 2.6Å; E138-R140 VanDerWaalsContact O-N 3.07Å; R140-E151 HydrophobicContact CB-CB 4.43Å; R140-E151 IonicContact NH1-OE2 3.87Å; R140-V152 CarbonylContact C-O 3.51Å; R140-V152 VanDerWaalsContact CA-O 3.3Å; R140-V152 WeakPolarHBondContact CA-O 3.44Å
141	F	84.8	Confident	76.7	Confident	8 Å²	8	96.9 Å²	96.9	4%	0.035	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	142.6	174.1	-76.8	-93.3	0	0	0	109.9	N139 V143 E151 V152 I154 L157 D169 L170 P172	N139-F141 HydrophobicContact CB-CE2 4.44Å; F141-V143 PolarHBondContact O-N 3.41Å; F141-E151 WeakPolarHBondContact O-CA 2.94Å; F141-V152 PolarHBondContact N-O 3.48Å; F141-V152 PolarHBondContact O-N 3.02Å; F141-I154 HydrophobicContact CD2-CD1 4.36Å; F141-I154 HydrophobicContact CD2-CG1 3.57Å; F141-I154 HydrophobicContact CE2-CD1 3.69Å; F141-I154 HydrophobicContact CE2-CG1 3.42Å; F141-I154 VanDerWaalsContact CE2-CG1 3.42Å; F141-L157 HydrophobicContact CB-CD1 4.39Å; F141-L157 HydrophobicContact CB-CD2 4.41Å; F141-L157 HydrophobicContact CD2-CD1 4.24Å; F141-L157 HydrophobicContact CG-CD1 4.38Å; F141-D169 HydrophobicContact CE1-CB 4.06Å; F141-D169 HydrophobicContact CZ-CB 4.43Å; F141-L170 WeakPolarHBondContact CZ-O 3.23Å; F141-P172 HydrophobicContact CD2-CG 4.33Å; F141-P172 HydrophobicContact CE1-CG 4.49Å; F141-P172 HydrophobicContact CE2-CG 4.22Å; F141-P172 HydrophobicContact CZ-CG 4.32Å
142	A	87	Confident	77.7	Confident	14 Å²	14	93.5 Å²	93.5	12%	0.116	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	109.9	173.9	0	0	0	0	0	108.9	Q149 I164	A142-Q149 HydrophobicContact CB-CG 4.22Å; A142-I164 HydrophobicContact CB-CB 4.32Å; A142-I164 PolarHBondContact O-N 2.99Å
143	V	90.1	Very high	78.7	Confident	10 Å²	10	91.4 Å²	91.4	6%	0.061	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.8	177.4	-177.9	0	0	0	0	109.4	F141 Q149 T150 V152 L157 D161 I162	F141-V143 PolarHBondContact O-N 3.41Å; V143-Q149 WeakPolarHBondContact O-CA 3.36Å; V143-T150 PolarHBondContact N-O 3Å; V143-T150 PolarHBondContact O-N 3.44Å; V143-V152 HydrophobicContact CB-CG2 4.17Å; V143-V152 HydrophobicContact CG2-CB 4Å; V143-V152 HydrophobicContact CG2-CG2 3.94Å; V143-L157 HydrophobicContact CG2-CD2 3.49Å; V143-L157 VanDerWaalsContact CG2-CD2 3.49Å; V143-D161 HydrophobicContact CG1-CB 3.84Å; V143-I162 CarbonylContact C-O 3.51Å; V143-I162 WeakPolarHBondContact CA-O 3.41Å
144	I	88.6	Confident	79.8	Confident	55 Å²	55	88.3 Å²	88.3	28%	0.282	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	114.3	172.4	-59	162.9	0	0	0	108.3	V2 E148 Q149 I162 I164	V2-I144 HydrophobicContact CG1-CD1 4.38Å; V2-I144 HydrophobicContact CG2-CD1 4.28Å; I144-E148 WeakPolarHBondContact CA-O 3.23Å; I144-Q149 HydrophobicContact CG1-CG 4.37Å; I144-I162 HydrophobicContact CB-CB 4.27Å; I144-I162 HydrophobicContact CB-CG2 4.08Å; I144-I162 HydrophobicContact CD1-CG2 3.86Å; I144-I162 HydrophobicContact CG1-CG2 4.41Å; I144-I162 PolarHBondContact N-O 3.11Å; I144-I164 HydrophobicContact CD1-CD1 3.47Å; I144-I164 VanDerWaalsContact CD1-CD1 3.47Å; I144-I164 HydrophobicContact CD1-CG1 3.64Å; I144-I164 HydrophobicContact CG1-CD1 3.46Å; I144-I164 VanDerWaalsContact CG1-CD1 3.46Å; I144-I164 HydrophobicContact CG1-CG1 3.9Å
145	G	85.9	Confident	80.9	Confident	38 Å²	38	86.1 Å²	86.1	39%	0.392	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	134.6	173.1	0	0	0	0	0	110.1	G147 E148	G145-G147 PolarHBondContact O-N 3.25Å; G145-E148 PolarHBondContact N-O 2.98Å; G145-E148 PolarHBondContact O-N 2.88Å; G145-E148 VanDerWaalsContact O-O 3.08Å
146	N	81.2	Confident	82	Confident	183 Å²	183	85.4 Å²	85.4	98%	0.979	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	24.5	-179.9	-62	-28.5	0	0	0	115.5	E148	N146-E148 VanDerWaalsContact C-N 3.3Å
147	G	85.2	Confident	83.2	Confident	75 Å²	75	80.8 Å²	80.8	77%	0.773	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	1.6	-176.7	0	0	0	0	0	114.8	G145	G145-G147 PolarHBondContact O-N 3.25Å
148	E	88.7	Confident	84.4	Confident	143 Å²	143	80.6 Å²	80.6	67%	0.668	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	147.7	175	-167	172.5	-175.9	0	0	110.8	I144 G145 N146	I144-E148 WeakPolarHBondContact CA-O 3.23Å; G145-E148 PolarHBondContact N-O 2.98Å; G145-E148 PolarHBondContact O-N 2.88Å; G145-E148 VanDerWaalsContact O-O 3.08Å; N146-E148 VanDerWaalsContact C-N 3.3Å
149	Q	87.8	Confident	85.4	Confident	111 Å²	111	77.4 Å²	77.4	52%	0.519	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	116.5	-179.3	-140.9	-173.2	-23.8	0	0	109.1	A142 V143 I144 I164	A142-Q149 HydrophobicContact CB-CG 4.22Å; V143-Q149 WeakPolarHBondContact O-CA 3.36Å; I144-Q149 HydrophobicContact CG1-CG 4.37Å; Q149-I164 HydrophobicContact CG-CD1 3.71Å
150	T	89.2	Confident	85.9	Confident	76 Å²	76	77 Å²	77	47%	0.466	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.2	-179.2	-56	0	0	0	0	110.3	V143 V152	V143-T150 PolarHBondContact N-O 3Å; V143-T150 PolarHBondContact O-N 3.44Å; T150-V152 HydrophobicContact CG2-CG2 4.46Å
151	E	89.2	Confident	86.1	Confident	125 Å²	125	71.5 Å²	71.5	58%	0.584	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	123.1	173.1	-70.9	-173.1	175	0	0	110.9	R140 F141	R140-E151 HydrophobicContact CB-CB 4.43Å; R140-E151 IonicContact NH1-OE2 3.87Å; F141-E151 WeakPolarHBondContact O-CA 2.94Å
152	V	86.9	Confident	86.4	Confident	34 Å²	34	73.8 Å²	73.8	21%	0.206	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	144	-178.9	-176.1	0	0	0	0	109	R140 F141 V143 T150 D156 L157	R140-V152 CarbonylContact C-O 3.51Å; R140-V152 VanDerWaalsContact CA-O 3.3Å; R140-V152 WeakPolarHBondContact CA-O 3.44Å; F141-V152 PolarHBondContact N-O 3.48Å; F141-V152 PolarHBondContact O-N 3.02Å; V143-V152 HydrophobicContact CB-CG2 4.17Å; V143-V152 HydrophobicContact CG2-CB 4Å; V143-V152 HydrophobicContact CG2-CG2 3.94Å; T150-V152 HydrophobicContact CG2-CG2 4.46Å; V152-D156 HydrophobicContact CG1-CB 3.59Å; V152-L157 HydrophobicContact CB-CD2 4.49Å; V152-L157 HydrophobicContact CG1-CD2 4.48Å
153	L	85.4	Confident	86.4	Confident	55 Å²	55	73.3 Å²	73.3	29%	0.288	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	149.2	174.8	-75.9	117.5	0	0	0	110.7	H137 T155 D156 L157	H137-L153 WeakPolarHBondContact O-CD2 3.39Å; L153-T155 PolarHBondContact O-N 2.98Å; L153-T155 VanDerWaalsContact O-N 3.12Å; L153-D156 PolarHBondContact O-N 3.33Å; L153-L157 PolarHBondContact O-N 3.3Å
154	I	83.5	Confident	86.4	Confident	55 Å²	55	74.4 Å²	74.4	28%	0.282	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-50.5	-39	172.8	-68.8	177.7	0	0	0	111.5	N139 F141 D156 L157 P172	N139-I154 HydrophobicContact CB-CD1 3.29Å; N139-I154 HydrophobicContact CB-CG1 3.81Å; N139-I154 WeakPolarHBondContact O-CG1 3.33Å; N139-I154 PolarHBondContact O-N 3.3Å; F141-I154 HydrophobicContact CD2-CD1 4.36Å; F141-I154 HydrophobicContact CD2-CG1 3.57Å; F141-I154 HydrophobicContact CE2-CD1 3.69Å; F141-I154 HydrophobicContact CE2-CG1 3.42Å; F141-I154 VanDerWaalsContact CE2-CG1 3.42Å; I154-D156 PolarHBondContact O-N 3.49Å; I154-L157 PolarHBondContact O-N 2.96Å; I154-P172 HydrophobicContact CD1-CB 4.18Å; I154-P172 HydrophobicContact CG1-CB 4.07Å; I154-P172 HydrophobicContact CG2-CB 3.8Å
155	T	82.9	Confident	86.3	Confident	103 Å²	103	72.6 Å²	72.6	63%	0.632	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-63.6	-21.6	-179.1	55.1	0	0	0	0	113.9	L153	L153-T155 PolarHBondContact O-N 2.98Å; L153-T155 VanDerWaalsContact O-N 3.12Å
156	D	85.7	Confident	86.3	Confident	92 Å²	92	77 Å²	77	49%	0.492	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-107	1	-173.8	-60.6	-5.7	0	0	0	111.7	V152 L153 I154	V152-D156 HydrophobicContact CG1-CB 3.59Å; L153-D156 PolarHBondContact O-N 3.33Å; I154-D156 PolarHBondContact O-N 3.49Å
157	L	83.7	Confident	86.5	Confident	30 Å²	30	77.8 Å²	77.8	16%	0.157	42%	0.421	C	S	.	.			trans	-67.6	130.7	176.5	-72.3	175.2	0	0	0	110.9	L5 F141 V143 V152 L153 I154 P172	L5-L157 HydrophobicContact CD1-CB 4.17Å; L5-L157 HydrophobicContact CD1-CD1 4.38Å; L5-L157 HydrophobicContact CD1-CD2 4.44Å; F141-L157 HydrophobicContact CB-CD1 4.39Å; F141-L157 HydrophobicContact CB-CD2 4.41Å; F141-L157 HydrophobicContact CD2-CD1 4.24Å; F141-L157 HydrophobicContact CG-CD1 4.38Å; V143-L157 HydrophobicContact CG2-CD2 3.49Å; V143-L157 VanDerWaalsContact CG2-CD2 3.49Å; V152-L157 HydrophobicContact CB-CD2 4.49Å; V152-L157 HydrophobicContact CG1-CD2 4.48Å; L153-L157 PolarHBondContact O-N 3.3Å; I154-L157 PolarHBondContact O-N 2.96Å; L157-P172 HydrophobicContact CD1-CB 4.07Å; L157-P172 HydrophobicContact CD1-CG 3.5Å
158	L	86.3	Confident	86.4	Confident	119 Å²	119	78.1 Å²	78.1	62%	0.623	42%	0.424	S	S	*	.			trans	-110.3	164.1	178	-61.1	178.5	0	0	0	111.4	D161	L158-D161 PolarHBondContact N-OD2 3.48Å; L158-D161 VanDerWaalsContact O-CB 3.3Å; L158-D161 WeakPolarHBondContact O-CB 3.35Å; L158-D161 PolarHBondContact O-N 2.9Å
159	V	86.6	Confident	86.2	Confident	90 Å²	90	74.5 Å²	74.5	55%	0.545	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	132.8	176.1	178.4	0	0	0	0	109.2	L5 C7 D161	L5-V159 WeakPolarHBondContact O-CG1 3.37Å; C7-V159 HydrophobicContact CB-CB 3.94Å; C7-V159 HydrophobicContact CB-CG1 3.47Å; C7-V159 VanDerWaalsContact CB-CG1 3.47Å; C7-V159 HydrophobicContact CB-CG2 3.24Å; C7-V159 WeakPolarHBondContact SG-CG2 3.49Å; V159-D161 VanDerWaalsContact C-N 3.31Å
160	G	84.5	Confident	85.9	Confident	43 Å²	43	75.3 Å²	75.3	44%	0.443	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	4.6	-173.9	0	0	0	0	0	113.8	L5	L5-G160 PolarHBondContact O-N 3.32Å
161	D	85.7	Confident	85.6	Confident	43 Å²	43	75.4 Å²	75.4	23%	0.23	41%	0.414	C	S	.	.			trans	-74.7	135.5	170	-74.2	-16.5	0	0	0	110.2	L5 V143 L158 V159 C163	L5-D161 HydrophobicContact CD1-CB 4.33Å; L5-D161 PolarHBondContact N-O 3.27Å; L5-D161 VanDerWaalsContact N-O 3.16Å; V143-D161 HydrophobicContact CG1-CB 3.84Å; L158-D161 PolarHBondContact N-OD2 3.48Å; L158-D161 VanDerWaalsContact O-CB 3.3Å; L158-D161 WeakPolarHBondContact O-CB 3.35Å; L158-D161 PolarHBondContact O-N 2.9Å; V159-D161 VanDerWaalsContact C-N 3.31Å; D161-C163 PolarHBondContact O-N 3.4Å
162	I	89.7	Confident	85.2	Confident	55 Å²	55	71.8 Å²	71.8	28%	0.282	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	102.9	178.9	-64.2	-178.3	0	0	0	108.5	V2 V143 I144 I178	V2-I162 HydrophobicContact CG1-CB 4.5Å; V2-I162 HydrophobicContact CG1-CG2 3.06Å; V143-I162 CarbonylContact C-O 3.51Å; V143-I162 WeakPolarHBondContact CA-O 3.41Å; I144-I162 HydrophobicContact CB-CB 4.27Å; I144-I162 HydrophobicContact CB-CG2 4.08Å; I144-I162 HydrophobicContact CD1-CG2 3.86Å; I144-I162 HydrophobicContact CG1-CG2 4.41Å; I144-I162 PolarHBondContact N-O 3.11Å; I162-I178 HydrophobicContact CD1-CD1 4.36Å; I162-I178 HydrophobicContact CG1-CD1 4.33Å; I162-I178 HydrophobicContact CG2-CD1 4.37Å
163	C	88.6	Confident	85	Confident	4 Å²	4	72.4 Å²	72.4	3%	0.027	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	137.7	-177.2	-64.3	0	0	0	0	112.1	V2 I3 L5 D161	V2-C163 WeakPolarHBondContact CA-O 3.35Å; I3-C163 PolarHBondContact N-O 3.37Å; I3-C163 PolarHBondContact O-N 3.31Å; L5-C163 VanDerWaalsContact CD1-SG 3.58Å; D161-C163 PolarHBondContact O-N 3.4Å
164	I	88.4	Confident	85	Confident	33 Å²	33	73.6 Å²	73.6	17%	0.169	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	120.3	169.9	-66.8	166.8	0	0	0	109.1	M1 V2 A142 I144 Q149	M1-I164 WeakPolarHBondContact O-CA 2.86Å; V2-I164 HydrophobicContact CG2-CG1 4.39Å; A142-I164 HydrophobicContact CB-CB 4.32Å; A142-I164 PolarHBondContact O-N 2.99Å; I144-I164 HydrophobicContact CD1-CD1 3.47Å; I144-I164 VanDerWaalsContact CD1-CD1 3.47Å; I144-I164 HydrophobicContact CD1-CG1 3.64Å; I144-I164 HydrophobicContact CG1-CD1 3.46Å; I144-I164 VanDerWaalsContact CG1-CD1 3.46Å; I144-I164 HydrophobicContact CG1-CG1 3.9Å; Q149-I164 HydrophobicContact CG-CD1 3.71Å
165	V	87.8	Confident	85.1	Confident	17 Å²	17	72.6 Å²	72.6	10%	0.103	42%	0.42	C	S	.	.			trans	-106.6	132.2	179.9	-176.6	0	0	0	0	109.8	M1 I3 D169	M1-V165 HydrophobicContact CE-CB 3.42Å; M1-V165 VanDerWaalsContact CE-CB 3.42Å; M1-V165 HydrophobicContact CE-CG1 3.51Å; M1-V165 HydrophobicContact CE-CG2 3.97Å; M1-V165 PolarHBondContact O-N 3.03Å; M1-V165 VanDerWaalsContact O-N 3.12Å; I3-V165 HydrophobicContact CD1-CG2 3.79Å; I3-V165 HydrophobicContact CG1-CG2 4.1Å; V165-D169 HydrophobicContact CG1-CB 3.98Å
166	K	85.4	Confident	85.3	Confident	132 Å²	132	71.1 Å²	71.1	57%	0.574	41%	0.41	S	S	*	.			trans	-104.7	168.4	175.2	-61.5	174.3	-176.6	167.2	0	110.7	G168 D169	K166-G168 PolarHBondContact O-N 2.97Å; K166-D169 WeakPolarHBondContact CA-OD2 3.3Å; K166-D169 WeakPolarHBondContact CB-OD2 3.48Å; K166-D169 PolarHBondContact N-OD2 3.36Å; K166-D169 PolarHBondContact O-N 3.07Å
167	Y	84.5	Confident	85.5	Confident	198 Å²	198	70.6 Å²	70.6	78%	0.776	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	125	174.4	-69.6	-82.3	0	0	0	110.5
168	G	83.2	Confident	85.8	Confident	82 Å²	82	73.9 Å²	73.9	85%	0.845	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.5	-4.6	-179.4	0	0	0	0	0	114.9	K166	K166-G168 PolarHBondContact O-N 2.97Å
169	D	84.1	Confident	85.9	Confident	67 Å²	67	74.8 Å²	74.8	36%	0.358	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-76.5	142.4	176.8	-65.2	-12.1	0	0	0	111	F141 V165 K166	F141-D169 HydrophobicContact CE1-CB 4.06Å; F141-D169 HydrophobicContact CZ-CB 4.43Å; V165-D169 HydrophobicContact CG1-CB 3.98Å; K166-D169 WeakPolarHBondContact CA-OD2 3.3Å; K166-D169 WeakPolarHBondContact CB-OD2 3.48Å; K166-D169 PolarHBondContact N-OD2 3.36Å; K166-D169 PolarHBondContact O-N 3.07Å
170	L	81.7	Confident	85.9	Confident	128 Å²	128	73.5 Å²	73.5	67%	0.67	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-87.8	125.2	173.6	-67.1	172.7	0	0	0	110	F141 P172	F141-L170 WeakPolarHBondContact CZ-O 3.23Å; L170-P172 VanDerWaalsContact O-CD 3.32Å; L170-P172 WeakPolarHBondContact O-CD 3.36Å
171	I	83.6	Confident	85.9	Confident	78 Å²	78	77.7 Å²	77.7	40%	0.4	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-68.4	118.6	179.9	-60.9	174.2	0	0	0	109.3	A173 V185	I171-A173 WeakPolarHBondContact CG2-O 3.4Å; I171-V185 HydrophobicContact CD1-CG1 4.33Å
172	P	79.9	Confident	85.9	Confident	49 Å²	49	82.3 Å²	82.3	32%	0.318	46%	0.457	S	S	.	.			trans	-78.2	-26.6	-172.5	28.9	-33.2	0	0	0	113.7	F141 I154 L157 L170	F141-P172 HydrophobicContact CD2-CG 4.33Å; F141-P172 HydrophobicContact CE1-CG 4.49Å; F141-P172 HydrophobicContact CE2-CG 4.22Å; F141-P172 HydrophobicContact CZ-CG 4.32Å; I154-P172 HydrophobicContact CD1-CB 4.18Å; I154-P172 HydrophobicContact CG1-CB 4.07Å; I154-P172 HydrophobicContact CG2-CB 3.8Å; L157-P172 HydrophobicContact CD1-CB 4.07Å; L157-P172 HydrophobicContact CD1-CG 3.5Å; L170-P172 VanDerWaalsContact O-CD 3.32Å; L170-P172 WeakPolarHBondContact O-CD 3.36Å
173	A	84.1	Confident	85.5	Confident	48 Å²	48	82.7 Å²	82.7	40%	0.397	46%	0.459	S	S	.	.	S	Bend	trans	-154.8	162.9	-180	0	0	0	0	0	109.9	L5 I171	L5-A173 HydrophobicContact CD2-CB 3.99Å; I171-A173 WeakPolarHBondContact CG2-O 3.4Å
174	D	84	Confident	85.3	Confident	80 Å²	80	90.4 Å²	90.4	43%	0.428	49%	0.492	S	S	.	.			trans	-63.8	149.3	174.7	-69.7	-19.5	0	0	0	111.3	L10	L10-D174 HydrophobicContact CD1-CB 4.47Å; L10-D174 WeakPolarHBondContact CD1-OD2 3.43Å; L10-D174 WeakPolarHBondContact CD2-OD2 3.45Å; L10-D174 WeakPolarHBondContact CG-OD2 3.42Å
175	G	85.9	Confident	85	Confident	34 Å²	34	92.2 Å²	92.2	35%	0.351	51%	0.505	S	S	.	.			trans	-166.2	172.7	178.4	0	0	0	0	0	113.1	D4	D4-G175 CarbonylContact O-C 3.36Å; D4-G175 WeakPolarHBondContact O-CA 3.29Å
176	V	87.7	Confident	84.8	Confident	71 Å²	71	96.6 Å²	96.6	43%	0.43	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126.6	-178.6	179	0	0	0	0	109.3	I3 D4 D6 I178	I3-V176 CarbonylContact C-O 3.55Å; I3-V176 VanDerWaalsContact CA-O 3.3Å; I3-V176 WeakPolarHBondContact CA-O 3.44Å; D4-V176 PolarHBondContact N-O 3.42Å; D4-V176 PolarHBondContact O-N 3.26Å; D6-V176 HydrophobicContact CB-CG2 4.45Å; D6-V176 WeakPolarHBondContact OD2-CG2 3.34Å; V176-I178 PolarHBondContact O-N 3.49Å
177	I	89.6	Confident	84.5	Confident	82 Å²	82	95.9 Å²	95.9	42%	0.421	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	116.8	177.1	-60	157.1	0	0	0	109	M1 I3 L183	M1-I177 HydrophobicContact CG-CG2 4.27Å; M1-I177 HydrophobicContact SD-CG1 4.37Å; M1-I177 HydrophobicContact SD-CG2 4.37Å; I3-I177 HydrophobicContact CD1-CG1 4.49Å; I3-I177 HydrophobicContact CG1-CG1 4.28Å; I177-L183 HydrophobicContact CD1-CD2 3.37Å; I177-L183 HydrophobicContact CG1-CD2 4.19Å
178	I	89.6	Confident	84.3	Confident	98 Å²	98	88.4 Å²	88.4	50%	0.503	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-44.4	175	-62.5	164.8	0	0	0	110.4	V2 D4 I162 V176	V2-I178 HydrophobicContact CB-CB 4.31Å; V2-I178 HydrophobicContact CG1-CB 4.21Å; V2-I178 HydrophobicContact CG1-CD1 3.92Å; V2-I178 PolarHBondContact O-N 3.25Å; D4-I178 HydrophobicContact CB-CD1 3.76Å; D4-I178 HydrophobicContact CB-CG1 4.15Å; I162-I178 HydrophobicContact CD1-CD1 4.36Å; I162-I178 HydrophobicContact CG1-CD1 4.33Å; I162-I178 HydrophobicContact CG2-CD1 4.37Å; V176-I178 PolarHBondContact O-N 3.49Å
179	Q	88.5	Confident	83.9	Confident	138 Å²	138	90.1 Å²	90.1	65%	0.645	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.6	128.7	-177.7	-172.6	179.9	-3.5	0	0	111	M1 V2	M1-Q179 CarbonylContact C-O 3.42Å; M1-Q179 WeakPolarHBondContact CA-O 3.3Å; M1-Q179 WeakPolarHBondContact CG-O 3.42Å; V2-Q179 HydrophobicContact CB-CB 4.49Å; V2-Q179 PolarHBondContact N-O 3.01Å; V2-Q179 PolarHBondContact O-N 3.17Å
180	S	87.2	Confident	83.4	Confident	63 Å²	63	94.2 Å²	94.2	44%	0.441	52%	0.523	S	S	.	.			trans	-137.7	160.5	176.5	61	0	0	0	0	111.6
181	N	84.8	Confident	83.1	Confident	131 Å²	131	91.7 Å²	91.7	70%	0.701	51%	0.513	S	S	*	.	S	Bend	trans	-134.8	110.9	168	-167.7	28.2	0	0	0	106.3	L183	N181-L183 VanDerWaalsContact C-N 3.34Å; N181-L183 PolarHBondContact O-N 3.22Å
182	D	85.4	Confident	82.6	Confident	140 Å²	140	91 Å²	91	75%	0.749	53%	0.525	S	S	*	.	S	Bend	trans	46.8	50.4	-176.1	-59.1	-37	0	0	0	114.3	K184	D182-K184 PolarHBondContact O-N 2.92Å
183	L	81.8	Confident	82.3	Confident	63 Å²	63	95.1 Å²	95.1	33%	0.33	54%	0.54	S	S	.	.			trans	-65.5	123.3	174.4	176	65.2	0	0	0	110.2	M1 I177 N181 V185	M1-L183 HydrophobicContact CE-CD1 3.39Å; M1-L183 HydrophobicContact CE-CD2 4.14Å; M1-L183 HydrophobicContact CE-CG 4.32Å; M1-L183 HydrophobicContact SD-CB 4.09Å; M1-L183 HydrophobicContact SD-CD1 3.3Å; M1-L183 WeakPolarHBondContact SD-CD1 3.34Å; M1-L183 HydrophobicContact SD-CD2 3.19Å; M1-L183 WeakPolarHBondContact SD-CD2 3.46Å; M1-L183 HydrophobicContact SD-CG 3.64Å; I177-L183 HydrophobicContact CD1-CD2 3.37Å; I177-L183 HydrophobicContact CG1-CD2 4.19Å; N181-L183 VanDerWaalsContact C-N 3.34Å; N181-L183 PolarHBondContact O-N 3.22Å; L183-V185 HydrophobicContact CD1-CG2 3.89Å; L183-V185 HydrophobicContact CD2-CG2 3.81Å; L183-V185 HydrophobicContact CG-CG2 3.8Å
184	K	84.4	Confident	81.6	Confident	166 Å²	166	98 Å²	98	72%	0.722	56%	0.557	S	S	*	*			trans	-118.1	123.9	165.3	-144	-178.8	-178.4	-158.3	0	108	D182	D182-K184 PolarHBondContact O-N 2.92Å
185	V	82.6	Confident	80.3	Confident	72 Å²	72	103.5 Å²	103.5	44%	0.436	59%	0.587	S	S	.	*			trans	-108.5	134.3	177.3	-179.3	0	0	0	0	107.7	I171 L183 E187	I171-V185 HydrophobicContact CD1-CG1 4.33Å; L183-V185 HydrophobicContact CD1-CG2 3.89Å; L183-V185 HydrophobicContact CD2-CG2 3.81Å; L183-V185 HydrophobicContact CG-CG2 3.8Å; V185-E187 PolarHBondContact O-N 3.25Å
186	D	82.2	Confident	80	Confident	109 Å²	109	107 Å²	107	58%	0.583	60%	0.599	S	S	*	*			trans	-82.7	106.7	174.2	-179.9	13	0	0	0	109.7	S188	D186-S188 VanDerWaalsContact C-N 3.31Å; D186-S188 WeakPolarHBondContact OD1-CB 3.29Å; D186-S188 PolarHBondContact OD1-N 3.15Å; D186-S188 PolarHBondContact OD1-OG 3.39Å; D186-S188 PolarHBondContact OD2-OG 3.27Å
187	E	80	Confident	79.6	Confident	117 Å²	117	108.9 Å²	108.9	55%	0.547	61%	0.608	S	S	.	*			trans	-87.7	2.8	178.8	-65.6	-173.9	-173.9	0	0	113.1	V185 S189 L190 T191	V185-E187 PolarHBondContact O-N 3.25Å; E187-S189 PolarHBondContact O-N 2.94Å; E187-L190 PolarHBondContact O-N 2.96Å; E187-T191 HydrophobicContact CB-CG2 4.38Å; E187-T191 PolarHBondContact O-N 3.02Å; E187-T191 PolarHBondContact O-OG1 3.18Å; E187-T191 VanDerWaalsContact O-OG1 3.12Å
188	S	80.5	Confident	79.1	Confident	41 Å²	41	110.4 Å²	110.4	29%	0.287	62%	0.618	S	S	.	*	H	α-helix	trans	-55.6	-26.9	-179.7	65	0	0	0	0	113.2	D186 L190 G192 E193	D186-S188 VanDerWaalsContact C-N 3.31Å; D186-S188 WeakPolarHBondContact OD1-CB 3.29Å; D186-S188 PolarHBondContact OD1-N 3.15Å; D186-S188 PolarHBondContact OD1-OG 3.39Å; D186-S188 PolarHBondContact OD2-OG 3.27Å; S188-L190 VanDerWaalsContact C-N 3.32Å; S188-L190 PolarHBondContact O-N 2.85Å; S188-G192 VanDerWaalsContact O-CA 3.28Å; S188-G192 WeakPolarHBondContact O-CA 3.45Å; S188-G192 PolarHBondContact O-N 3.39Å; S188-E193 VanDerWaalsContact CA-O 3.27Å; S188-E193 WeakPolarHBondContact CA-O 3.45Å; S188-E193 WeakPolarHBondContact CB-O 3.23Å
189	S	74.3	Confident	78.4	Confident	117 Å²	117	111.1 Å²	111.1	82%	0.818	63%	0.625	S	S	*	*	H	α-helix	trans	-66.9	-30.1	174.9	-58.4	0	0	0	0	113.6	E187	E187-S189 PolarHBondContact O-N 2.94Å
190	L	74.2	Confident	77.8	Confident	154 Å²	154	109.4 Å²	109.4	81%	0.806	62%	0.624	S	S	*	*	H	α-helix	trans	-102.2	-41.5	-174.6	-174.8	64.6	0	0	0	112	E187 S188	E187-L190 PolarHBondContact O-N 2.96Å; S188-L190 VanDerWaalsContact C-N 3.32Å; S188-L190 PolarHBondContact O-N 2.85Å
191	T	75.8	Confident	77.2	Confident	74 Å²	74	112.5 Å²	112.5	45%	0.454	64%	0.636	S	S	.	*	H	α-helix	trans	-101.1	-20	-173.6	62.3	0	0	0	0	113	E187 E193	E187-T191 HydrophobicContact CB-CG2 4.38Å; E187-T191 PolarHBondContact O-N 3.02Å; E187-T191 PolarHBondContact O-OG1 3.18Å; E187-T191 VanDerWaalsContact O-OG1 3.12Å; T191-E193 PolarHBondContact O-N 3.36Å; T191-E193 PolarHBondContact OG1-N 3.09Å
192	G	72.3	Confident	76.6	Confident	65 Å²	65	111.2 Å²	111.2	67%	0.67	63%	0.631	S	S	*	*	S	Bend	trans	71.8	2.7	-172.6	0	0	0	0	0	114	S188	S188-G192 VanDerWaalsContact O-CA 3.28Å; S188-G192 WeakPolarHBondContact O-CA 3.45Å; S188-G192 PolarHBondContact O-N 3.39Å
193	E	72.5	Confident	76	Confident	135 Å²	135	109 Å²	109	63%	0.631	62%	0.622	S	S	*	*			trans	-97.6	136.4	175.5	-62.5	-171	157	0	0	109.1	S188 T191	S188-E193 VanDerWaalsContact CA-O 3.27Å; S188-E193 WeakPolarHBondContact CA-O 3.45Å; S188-E193 WeakPolarHBondContact CB-O 3.23Å; T191-E193 PolarHBondContact O-N 3.36Å; T191-E193 PolarHBondContact OG1-N 3.09Å
194	S	70.3	Confident	75.5	Confident	108 Å²	108	112.8 Å²	112.8	76%	0.755	65%	0.646	S	S	*	*			trans	-110.7	96.9	177.4	27.2	0	0	0	0	108.4
195	D	56.9	Low	74.7	Confident	196 Å²	196	108 Å²	108	100%	1.048	64%	0.64	S	S	*	*			trans	-101.6	0	175.2	-82.1	-24.5	0	0	0	113.2

Retrieved 195 of 195 residues in 72.9 ms (Link to these results)

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