A0A5K4F2J3_SCHMA Loading...

Pre-mRNA-splicing factor SYF2

AlphaFold DB , UniProt , Accession A0A5K4F2J3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 243 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	39.6	Very low	45	Very low	244 Å²	244	118.3 Å²	118.3	100%	1.202	67%	0.665	S	S	*	*				0	107.1	0	-81.5	176.9	134.6	0	0	107
2	C	39.1	Very low	45.4	Very low	122 Å²	122	117.8 Å²	117.8	82%	0.824	66%	0.66	S	S	*	*			trans	-75.3	127.7	173.7	-69.9	0	0	0	0	107.6	L4	C2-L4 PolarHBondContact O-N 2.73Å
3	P	42.2	Very low	45.5	Very low	121 Å²	121	112.5 Å²	112.5	79%	0.786	64%	0.64	S	S	*	*			trans	-63.9	112.8	171.5	25.7	-29	0	0	0	106.9	S5	P3-S5 PolarHBondContact O-N 2.73Å
4	L	45.6	Very low	45.3	Very low	139 Å²	139	111.5 Å²	111.5	73%	0.728	63%	0.631	S	S	*	*			trans	-53.9	113	167.1	-75.5	161.5	0	0	0	105.8	C2 V6	C2-L4 PolarHBondContact O-N 2.73Å; L4-V6 PolarHBondContact O-N 3.33Å
5	S	44.8	Very low	45.3	Very low	63 Å²	63	113.4 Å²	113.4	44%	0.441	63%	0.63	S	S	.	*			trans	-60	133.3	-178.7	89.7	0	0	0	0	106.9	P3 N7 D8	P3-S5 PolarHBondContact O-N 2.73Å; S5-N7 PolarHBondContact O-N 3.41Å; S5-D8 PolarHBondContact O-N 2.94Å
6	V	49	Very low	45.6	Very low	116 Å²	116	110.8 Å²	110.8	70%	0.703	62%	0.622	S	S	*	*	H	α-helix	trans	-52.4	-18.1	-175.7	-179.8	0	0	0	0	112.4	L4 I10	L4-V6 PolarHBondContact O-N 3.33Å; V6-I10 HydrophobicContact CG1-CD1 4.28Å; V6-I10 WeakPolarHBondContact O-CG1 3.24Å
7	N	45.8	Very low	45.3	Very low	114 Å²	114	112.5 Å²	112.5	61%	0.61	62%	0.624	S	S	*	*	H	α-helix	trans	-67.2	-33.8	173.4	-82	-30.7	0	0	0	114.8	S5 I10 Q11	S5-N7 PolarHBondContact O-N 3.41Å; N7-I10 PolarHBondContact O-N 2.77Å; N7-Q11 WeakPolarHBondContact O-CG 3.01Å; N7-Q11 PolarHBondContact O-N 2.99Å
8	D	45.4	Very low	45	Very low	91 Å²	91	112.4 Å²	112.4	49%	0.487	62%	0.621	S	S	.	*	H	α-helix	trans	-71.5	-36.4	-176.4	-67.5	-32.7	0	0	0	111.2	S5 I10 Q11 D12	S5-D8 PolarHBondContact O-N 2.94Å; D8-I10 PolarHBondContact O-N 3.29Å; D8-Q11 PolarHBondContact O-N 3.08Å; D8-D12 PolarHBondContact O-N 2.77Å; D8-D12 VanDerWaalsContact O-N 3.13Å
9	V	48.8	Very low	44.7	Very low	98 Å²	98	117 Å²	117	59%	0.594	63%	0.628	S	S	*	*	H	α-helix	trans	-67.7	-37.6	179.3	-177.1	0	0	0	0	111.4	A13	V9-A13 PolarHBondContact O-N 2.82Å; V9-A13 VanDerWaalsContact O-N 3.16Å
10	I	47.8	Very low	44.6	Very low	88 Å²	88	118.6 Å²	118.6	45%	0.451	64%	0.637	S	S	.	*	H	α-helix	trans	-70.4	-36.8	179.2	-62.2	172.6	0	0	0	110.8	V6 N7 D8 A13 L14	V6-I10 HydrophobicContact CG1-CD1 4.28Å; V6-I10 WeakPolarHBondContact O-CG1 3.24Å; N7-I10 PolarHBondContact O-N 2.77Å; D8-I10 PolarHBondContact O-N 3.29Å; I10-A13 PolarHBondContact O-N 2.8Å; I10-L14 HydrophobicContact CG2-CD1 4.31Å; I10-L14 PolarHBondContact O-N 2.95Å; I10-L14 VanDerWaalsContact O-N 3.15Å
11	Q	47.4	Very low	44.6	Very low	105 Å²	105	119 Å²	119	49%	0.491	64%	0.639	S	S	.	*	H	α-helix	trans	-69	-37.6	178.7	-69.9	-65.1	-28.2	0	0	112.5	N7 D8 K15	N7-Q11 WeakPolarHBondContact O-CG 3.01Å; N7-Q11 PolarHBondContact O-N 2.99Å; D8-Q11 PolarHBondContact O-N 3.08Å; Q11-K15 WeakPolarHBondContact O-CB 3.42Å; Q11-K15 WeakPolarHBondContact O-CG 3.42Å; Q11-K15 PolarHBondContact O-N 3.08Å
12	D	49	Very low	44.7	Very low	112 Å²	112	111.3 Å²	111.3	60%	0.599	60%	0.602	S	S	*	*	H	α-helix	trans	-70.6	-36.5	176.5	-87.3	-1.8	0	0	0	112.3	D8 K15 S16	D8-D12 PolarHBondContact O-N 2.77Å; D8-D12 VanDerWaalsContact O-N 3.13Å; D12-K15 PolarHBondContact O-N 2.98Å; D12-S16 PolarHBondContact O-N 3.02Å; D12-S16 PolarHBondContact O-OG 2.8Å
13	A	46.5	Very low	44.7	Very low	49 Å²	49	113.7 Å²	113.7	41%	0.405	60%	0.601	S	S	.	*	H	α-helix	trans	-60	-50.6	174.2	0	0	0	0	0	111.1	V9 I10 K15 S16 E17	V9-A13 PolarHBondContact O-N 2.82Å; V9-A13 VanDerWaalsContact O-N 3.16Å; I10-A13 PolarHBondContact O-N 2.8Å; A13-K15 VanDerWaalsContact C-N 3.33Å; A13-K15 PolarHBondContact O-N 3.29Å; A13-S16 PolarHBondContact O-N 3.06Å; A13-S16 PolarHBondContact O-OG 3.29Å; A13-E17 PolarHBondContact O-N 2.85Å
14	L	43.2	Very low	44.7	Very low	99 Å²	99	113.3 Å²	113.3	52%	0.518	59%	0.592	S	S	.	*	H	α-helix	trans	-65.3	-33.7	178.9	-71.1	174.1	0	0	0	113.1	I10 L18	I10-L14 HydrophobicContact CG2-CD1 4.31Å; I10-L14 PolarHBondContact O-N 2.95Å; I10-L14 VanDerWaalsContact O-N 3.15Å; L14-L18 WeakPolarHBondContact O-CB 3.47Å; L14-L18 PolarHBondContact O-N 3.16Å
15	K	45.6	Very low	44.4	Very low	140 Å²	140	113.2 Å²	113.2	61%	0.609	59%	0.591	S	S	*	*	H	α-helix	trans	-68.1	-39.5	175	-84.8	178.5	-179.4	172.2	0	112.7	Q11 D12 A13 R19	Q11-K15 WeakPolarHBondContact O-CB 3.42Å; Q11-K15 WeakPolarHBondContact O-CG 3.42Å; Q11-K15 PolarHBondContact O-N 3.08Å; D12-K15 PolarHBondContact O-N 2.98Å; A13-K15 VanDerWaalsContact C-N 3.33Å; A13-K15 PolarHBondContact O-N 3.29Å; K15-R19 PolarHBondContact O-N 3.45Å
16	S	49.7	Very low	44	Very low	72 Å²	72	116.4 Å²	116.4	50%	0.503	60%	0.602	S	S	.	*	H	α-helix	trans	-72.6	-38.5	-179.4	70	0	0	0	0	112.1	D12 A13 L18 R19	D12-S16 PolarHBondContact O-N 3.02Å; D12-S16 PolarHBondContact O-OG 2.8Å; A13-S16 PolarHBondContact O-N 3.06Å; A13-S16 PolarHBondContact O-OG 3.29Å; S16-L18 VanDerWaalsContact C-N 3.33Å; S16-L18 PolarHBondContact O-N 3.14Å; S16-R19 PolarHBondContact O-N 3.49Å; S16-R19 VanDerWaalsContact O-N 3.07Å
17	E	39.9	Very low	43.7	Very low	140 Å²	140	117.5 Å²	117.5	65%	0.654	60%	0.604	S	S	*	*	H	α-helix	trans	-68	-35.9	179.2	-153	114.8	-141.5	0	0	111.4	A13 R19	A13-E17 PolarHBondContact O-N 2.85Å; E17-R19 VanDerWaalsContact C-N 3.31Å; E17-R19 PolarHBondContact O-N 2.88Å
18	L	40	Very low	43.2	Very low	110 Å²	110	118 Å²	118	58%	0.576	61%	0.606	S	S	*	*	H	α-helix	trans	-69.6	-27.8	172	-79.6	167.2	0	0	0	112.5	L14 S16 N20 N21 N22	L14-L18 WeakPolarHBondContact O-CB 3.47Å; L14-L18 PolarHBondContact O-N 3.16Å; S16-L18 VanDerWaalsContact C-N 3.33Å; S16-L18 PolarHBondContact O-N 3.14Å; L18-N20 VanDerWaalsContact C-N 3.31Å; L18-N20 PolarHBondContact O-N 3.08Å; L18-N21 PolarHBondContact O-N 3.48Å; L18-N22 WeakPolarHBondContact O-CB 3.5Å; L18-N22 PolarHBondContact O-N 2.75Å; L18-N22 VanDerWaalsContact O-N 3.14Å; L18-N22 PolarHBondContact O-ND2 2.84Å; L18-N22 PolarHBondContact O-OD1 2.69Å; L18-N22 VanDerWaalsContact O-OD1 3.1Å
19	R	39	Very low	42.8	Very low	200 Å²	200	121.8 Å²	121.8	76%	0.755	63%	0.627	S	S	*	*	H	α-helix	trans	-71	-26	-176.1	-147.6	175.5	-179.2	-159.9	-1.2	113.5	K15 S16 E17	K15-R19 PolarHBondContact O-N 3.45Å; S16-R19 PolarHBondContact O-N 3.49Å; S16-R19 VanDerWaalsContact O-N 3.07Å; E17-R19 VanDerWaalsContact C-N 3.31Å; E17-R19 PolarHBondContact O-N 2.88Å
20	N	42.9	Very low	41.9	Very low	149 Å²	149	119.3 Å²	119.3	80%	0.797	62%	0.621	S	S	*	*	H	α-helix	trans	-83.2	-16.4	178.3	-75.9	-7.9	0	0	0	113.7	L18	L18-N20 VanDerWaalsContact C-N 3.31Å; L18-N20 PolarHBondContact O-N 3.08Å
21	N	44.5	Very low	41.4	Very low	128 Å²	128	124 Å²	124	68%	0.684	64%	0.641	S	S	*	*	H	α-helix	trans	-110.2	4.8	179.2	-56.4	-21	0	0	0	112.4	L18 E23	L18-N21 PolarHBondContact O-N 3.48Å; N21-E23 PolarHBondContact O-N 3.05Å
22	N	41.8	Very low	40.8	Very low	81 Å²	81	124 Å²	124	43%	0.433	64%	0.644	S	S	.	*			trans	-75.9	64.4	175.2	-86.6	-9.8	0	0	0	110.5	L18 I24	L18-N22 WeakPolarHBondContact O-CB 3.5Å; L18-N22 PolarHBondContact O-N 2.75Å; L18-N22 VanDerWaalsContact O-N 3.14Å; L18-N22 PolarHBondContact O-ND2 2.84Å; L18-N22 PolarHBondContact O-OD1 2.69Å; L18-N22 VanDerWaalsContact O-OD1 3.1Å; N22-I24 HydrophobicContact CB-CD1 4.32Å; N22-I24 HydrophobicContact CB-CG1 3.54Å; N22-I24 PolarHBondContact O-N 3.41Å
23	E	39	Very low	40.3	Very low	173 Å²	173	126.3 Å²	126.3	81%	0.808	66%	0.656	S	S	*	*				-58.5	87.8	122.3	-81	-172.7	175.3	0	0	104.4	N21 L25	N21-E23 PolarHBondContact O-N 3.05Å; E23-L25 PolarHBondContact O-N 2.88Å
24	I	43.6	Very low	40.2	Very low	113 Å²	113	129.5 Å²	129.5	58%	0.579	67%	0.666	S	S	*	*			trans	-62.6	88.6	172.1	-56.3	-175.7	0	0	0	103.6	N22 L26	N22-I24 HydrophobicContact CB-CD1 4.32Å; N22-I24 HydrophobicContact CB-CG1 3.54Å; N22-I24 PolarHBondContact O-N 3.41Å; I24-L26 HydrophobicContact CG2-CD1 3.59Å; I24-L26 PolarHBondContact O-N 3.01Å
25	L	39.1	Very low	39.8	Very low	137 Å²	137	132.6 Å²	132.6	72%	0.717	68%	0.678	S	S	*	*			trans	-58.4	89.5	157.2	-78.8	168.8	0	0	0	103.8	E23 L27	E23-L25 PolarHBondContact O-N 2.88Å; L25-L27 HydrophobicContact CB-CG 4.31Å; L25-L27 PolarHBondContact O-N 3.05Å
26	L	36.4	Very low	39.7	Very low	129 Å²	129	133.7 Å²	133.7	68%	0.675	69%	0.69	S	S	*	*			trans	-66.2	72.8	172.3	-144.9	78.8	0	0	0	105.3	I24 N28	I24-L26 HydrophobicContact CG2-CD1 3.59Å; I24-L26 PolarHBondContact O-N 3.01Å; L26-N28 PolarHBondContact O-N 3.11Å
27	L	41.4	Very low	39.2	Very low	139 Å²	139	136.2 Å²	136.2	73%	0.728	70%	0.698	S	S	*	*			trans	-73.2	82.5	168.9	-65.4	176.1	0	0	0	104.6	L25 N29	L25-L27 HydrophobicContact CB-CG 4.31Å; L25-L27 PolarHBondContact O-N 3.05Å; L27-N29 PolarHBondContact O-N 3.27Å
28	N	35.4	Very low	39.4	Very low	124 Å²	124	134.9 Å²	134.9	66%	0.663	70%	0.702	S	S	*	*			trans	-47.3	116.4	166.7	-75.5	-35.2	0	0	0	107	L26 G30	L26-N28 PolarHBondContact O-N 3.11Å; N28-G30 PolarHBondContact O-N 2.9Å
29	N	36.8	Very low	39.6	Very low	172 Å²	172	135 Å²	135	92%	0.92	71%	0.707	S	S	*	*			trans	-69.9	47.1	170.6	-78.8	-22.5	0	0	0	110.7	L27	L27-N29 PolarHBondContact O-N 3.27Å
30	G	31.5	Very low	40.1	Very low	45 Å²	45	134.2 Å²	134.2	46%	0.464	71%	0.712	S	S	.	*			trans	-106.3	81	-178.6	0	0	0	0	0	110.5	N28 N32	N28-G30 PolarHBondContact O-N 2.9Å; G30-N32 VanDerWaalsContact C-N 3.28Å; G30-N32 PolarHBondContact O-N 2.91Å
31	Q	35.8	Very low	40.2	Very low	188 Å²	188	133.6 Å²	133.6	88%	0.879	71%	0.709	S	S	*	*			trans	55.6	21.2	143.8	-54	-171.2	-81	0	0	119.6	N33	Q31-N33 PolarHBondContact O-N 3.17Å
32	N	35.9	Very low	40.5	Very low	105 Å²	105	133 Å²	133	56%	0.561	70%	0.701	S	S	*	*			trans	-79.6	103.1	163.5	43.9	-12	0	0	0	108.3	G30 N34	G30-N32 VanDerWaalsContact C-N 3.28Å; G30-N32 PolarHBondContact O-N 2.91Å; N32-N34 PolarHBondContact ND2-ND2 2.8Å; N32-N34 PolarHBondContact O-N 2.89Å
33	N	39	Very low	41	Very low	160 Å²	160	134.3 Å²	134.3	86%	0.856	71%	0.713	S	S	*	*			trans	-60.8	59.3	158.1	-60	-40.6	0	0	0	109.3	Q31 E35	Q31-N33 PolarHBondContact O-N 3.17Å; N33-E35 PolarHBondContact O-N 3.32Å
34	N	42.7	Very low	41.5	Very low	115 Å²	115	136.7 Å²	136.7	62%	0.615	72%	0.716	S	S	*	*			trans	-69.7	80.2	164.6	-76.5	1.7	0	0	0	104.5	N32 L36	N32-N34 PolarHBondContact ND2-ND2 2.8Å; N32-N34 PolarHBondContact O-N 2.89Å; N34-L36 PolarHBondContact O-N 2.8Å
35	E	36.3	Very low	41.8	Very low	164 Å²	164	136.6 Å²	136.6	77%	0.766	72%	0.716	S	S	*	*			trans	-34.3	99.9	143.2	-167.7	165.7	-156.6	0	0	105.2	N33 N37	N33-E35 PolarHBondContact O-N 3.32Å; E35-N37 PolarHBondContact O-N 2.95Å
36	L	43.1	Very low	42.4	Very low	164 Å²	164	134.8 Å²	134.8	86%	0.859	72%	0.715	S	S	*	*			trans	-64.8	86.2	177.7	-80.9	163.7	0	0	0	104.5	N34 P38	N34-L36 PolarHBondContact O-N 2.8Å; L36-P38 VanDerWaalsContact O-CD 3.24Å; L36-P38 WeakPolarHBondContact O-CD 3.41Å
37	N	38.3	Very low	43.4	Very low	124 Å²	124	134.3 Å²	134.3	66%	0.663	71%	0.714	S	S	*	*			trans	-53.4	115.3	164.2	-78	-35.9	0	0	0	104.6	E35 T39	E35-N37 PolarHBondContact O-N 2.95Å; N37-T39 VanDerWaalsContact C-N 3.33Å; N37-T39 PolarHBondContact O-N 2.92Å
38	P	45.8	Very low	44.3	Very low	113 Å²	113	135 Å²	135	73%	0.734	72%	0.718	S	S	*	*			trans	-59.8	106.4	177.3	24	-30.7	0	0	0	105.6	L36 E40	L36-P38 VanDerWaalsContact O-CD 3.24Å; L36-P38 WeakPolarHBondContact O-CD 3.41Å; P38-E40 PolarHBondContact O-N 3.13Å
39	T	43	Very low	45.4	Very low	113 Å²	113	133.2 Å²	133.2	69%	0.693	72%	0.715	S	S	*	*			trans	-50.7	113.9	176.2	-55.6	0	0	0	0	106.7	N37 N41	N37-T39 VanDerWaalsContact C-N 3.33Å; N37-T39 PolarHBondContact O-N 2.92Å; T39-N41 HydrophobicContact CG2-CB 4.43Å; T39-N41 PolarHBondContact O-N 3.48Å
40	E	49.1	Very low	47	Very low	182 Å²	182	127.8 Å²	127.8	85%	0.85	69%	0.686	S	S	*	*			trans	-68.4	47.3	-179.2	-60	178.7	170.9	0	0	111.4	P38 E42	P38-E40 PolarHBondContact O-N 3.13Å; E40-E42 PolarHBondContact O-N 3.38Å; E40-E42 VanDerWaalsContact O-N 3.16Å
41	N	46.5	Very low	49.2	Very low	137 Å²	137	127.6 Å²	127.6	73%	0.733	68%	0.681	S	S	*	*			trans	-86.2	47.9	166.7	-71.6	-4	0	0	0	108.6	T39 T43	T39-N41 HydrophobicContact CG2-CB 4.43Å; T39-N41 PolarHBondContact O-N 3.48Å; N41-T43 VanDerWaalsContact C-N 3.34Å; N41-T43 PolarHBondContact O-N 3.49Å; N41-T43 VanDerWaalsContact O-N 3.16Å
42	E	51.2	Low	51.4	Low	114 Å²	114	125.2 Å²	125.2	53%	0.533	66%	0.664	S	S	.	*			trans	-82	91.3	168.1	-73.6	-100.1	143.1	0	0	106.3	E40 Y44 R54	E40-E42 PolarHBondContact O-N 3.38Å; E40-E42 VanDerWaalsContact O-N 3.16Å; E42-Y44 PolarHBondContact O-N 2.89Å; E42-R54 IonicContact OE1-NE 3.51Å; E42-R54 IonicContact OE2-CZ 3.1Å; E42-R54 IonicContact OE2-NE 2.69Å; E42-R54 PolarHBondContact OE2-NE 3.22Å; E42-R54 IonicContact OE2-NH2 3.05Å; E42-R54 PolarHBondContact OE2-NH2 3.2Å
43	T	50.6	Low	53.8	Low	110 Å²	110	123.6 Å²	123.6	68%	0.675	66%	0.658	S	S	*	*			trans	-44.1	114.7	162.2	-49.2	0	0	0	0	107.7	N41 D45	N41-T43 VanDerWaalsContact C-N 3.34Å; N41-T43 PolarHBondContact O-N 3.49Å; N41-T43 VanDerWaalsContact O-N 3.16Å; T43-D45 PolarHBondContact O-N 3.3Å
44	Y	50.1	Low	56	Low	223 Å²	223	120 Å²	120	88%	0.875	63%	0.633	S	S	*	*			trans	-74.8	63.9	-168.7	-154	-90.9	0	0	0	110.5	E42 S46	E42-Y44 PolarHBondContact O-N 2.89Å; Y44-S46 PolarHBondContact O-N 2.82Å; Y44-S46 VanDerWaalsContact O-N 3.12Å
45	D	51	Low	58.2	Low	110 Å²	110	121.4 Å²	121.4	59%	0.588	63%	0.629	S	S	*	*			trans	-81.4	95.9	171.7	-82.3	-17.2	0	0	0	108.4	T43 D47	T43-D45 PolarHBondContact O-N 3.3Å; D45-D47 PolarHBondContact O-N 3.02Å
46	S	51.3	Low	60.9	Low	99 Å²	99	117.6 Å²	117.6	69%	0.692	61%	0.608	S	S	*	*			trans	-48.1	91.6	166.4	167	0	0	0	0	111.2	Y44	Y44-S46 PolarHBondContact O-N 2.82Å; Y44-S46 VanDerWaalsContact O-N 3.12Å
47	D	56.1	Low	63.3	Low	120 Å²	120	113.3 Å²	113.3	64%	0.642	59%	0.589	S	S	*	*			trans	-164.2	115.5	156	-87.2	-33.3	0	0	0	107.1	D45 S49 N50 A51	D45-D47 PolarHBondContact O-N 3.02Å; D47-S49 PolarHBondContact O-N 3.22Å; D47-N50 WeakPolarHBondContact O-CA 3.1Å; D47-N50 WeakPolarHBondContact O-CB 3.46Å; D47-N50 PolarHBondContact O-N 2.89Å; D47-A51 PolarHBondContact O-N 2.95Å
48	D	60.1	Low	65.8	Low	153 Å²	153	110.3 Å²	110.3	82%	0.818	58%	0.581	S	S	*	*	H	α-helix	trans	-51.1	-26	178.4	-73.7	-33.2	0	0	0	113.2	N50 A51 Y52	D48-N50 VanDerWaalsContact C-N 3.32Å; D48-N50 PolarHBondContact O-N 3.26Å; D48-A51 PolarHBondContact O-N 3.3Å; D48-Y52 PolarHBondContact O-N 3.36Å
49	S	59.9	Low	68	Low	87 Å²	87	108.6 Å²	108.6	61%	0.608	56%	0.563	S	S	*	*	H	α-helix	trans	-58.4	-42.9	171.9	-171	0	0	0	0	112.1	D47 Y52 V53	D47-S49 PolarHBondContact O-N 3.22Å; S49-Y52 PolarHBondContact O-N 2.76Å; S49-V53 VanDerWaalsContact O-CG2 3.31Å; S49-V53 WeakPolarHBondContact O-CG2 3.34Å; S49-V53 PolarHBondContact O-N 3.05Å
50	N	70	Confident	70.5	Confident	57 Å²	57	107 Å²	107	31%	0.305	55%	0.55	S	S	.	.	H	α-helix	trans	-67.5	-38	178.3	-165.9	0.2	0	0	0	110.6	D47 D48 Y52 V53 R54	D47-N50 WeakPolarHBondContact O-CA 3.1Å; D47-N50 WeakPolarHBondContact O-CB 3.46Å; D47-N50 PolarHBondContact O-N 2.89Å; D48-N50 VanDerWaalsContact C-N 3.32Å; D48-N50 PolarHBondContact O-N 3.26Å; N50-Y52 PolarHBondContact O-N 3.4Å; N50-V53 PolarHBondContact O-N 2.85Å; N50-R54 VanDerWaalsContact CB-NH1 3.34Å; N50-R54 PolarHBondContact ND2-NH1 3.47Å; N50-R54 VanDerWaalsContact ND2-NH1 3.15Å; N50-R54 VanDerWaalsContact O-CG 3.32Å; N50-R54 WeakPolarHBondContact O-CG 3.19Å; N50-R54 PolarHBondContact O-N 3.44Å; N50-R54 PolarHBondContact O-NH1 3.19Å; N50-R54 PolarHBondContact OD1-NH1 3.07Å
51	A	77.4	Confident	72.5	Confident	42 Å²	42	102.7 Å²	102.7	35%	0.347	53%	0.532	S	S	.	.	H	α-helix	trans	-63.3	-41.9	175.2	0	0	0	0	0	112.4	D47 D48 R55	D47-A51 PolarHBondContact O-N 2.95Å; D48-A51 PolarHBondContact O-N 3.3Å; A51-R55 WeakPolarHBondContact O-CB 3.31Å; A51-R55 PolarHBondContact O-N 3.47Å
52	Y	82.8	Confident	74.6	Confident	137 Å²	137	100.9 Å²	100.9	54%	0.537	52%	0.523	S	S	.	.	H	α-helix	trans	-61.5	-45.9	173.4	174.6	-93.6	0	0	0	111.8	D48 S49 N50 R55 R56	D48-Y52 PolarHBondContact O-N 3.36Å; S49-Y52 PolarHBondContact O-N 2.76Å; N50-Y52 PolarHBondContact O-N 3.4Å; Y52-R55 PolarHBondContact O-N 3.24Å; Y52-R56 HydrophobicContact CE1-CB 4.42Å; Y52-R56 WeakPolarHBondContact O-CB 3.31Å; Y52-R56 PolarHBondContact O-N 3.37Å
53	V	85.7	Confident	76.4	Confident	72 Å²	72	100.2 Å²	100.2	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-61	-47.5	179.4	171.4	0	0	0	0	110.6	S49 N50 R55 R56 V57	S49-V53 VanDerWaalsContact O-CG2 3.31Å; S49-V53 WeakPolarHBondContact O-CG2 3.34Å; S49-V53 PolarHBondContact O-N 3.05Å; N50-V53 PolarHBondContact O-N 2.85Å; V53-R55 PolarHBondContact O-N 2.97Å; V53-R56 PolarHBondContact O-N 3.36Å; V53-V57 HydrophobicContact CG1-CG2 4.37Å; V53-V57 VanDerWaalsContact O-CG2 3.29Å; V53-V57 WeakPolarHBondContact O-CG2 3.47Å; V53-V57 PolarHBondContact O-N 3.01Å
54	R	84.8	Confident	78.1	Confident	83 Å²	83	99 Å²	99	31%	0.313	51%	0.508	S	S	.	.	H	α-helix	trans	-60.9	-45.2	178	-68.9	-168.3	-51.6	-90.1	17.7	112	E42 N50 R56 V57 A58	E42-R54 IonicContact OE1-NE 3.51Å; E42-R54 IonicContact OE2-CZ 3.1Å; E42-R54 IonicContact OE2-NE 2.69Å; E42-R54 PolarHBondContact OE2-NE 3.22Å; E42-R54 IonicContact OE2-NH2 3.05Å; E42-R54 PolarHBondContact OE2-NH2 3.2Å; N50-R54 VanDerWaalsContact CB-NH1 3.34Å; N50-R54 PolarHBondContact ND2-NH1 3.47Å; N50-R54 VanDerWaalsContact ND2-NH1 3.15Å; N50-R54 VanDerWaalsContact O-CG 3.32Å; N50-R54 WeakPolarHBondContact O-CG 3.19Å; N50-R54 PolarHBondContact O-N 3.44Å; N50-R54 PolarHBondContact O-NH1 3.19Å; N50-R54 PolarHBondContact OD1-NH1 3.07Å; R54-R56 PolarHBondContact O-N 2.92Å; R54-V57 PolarHBondContact O-N 3Å; R54-A58 PolarHBondContact O-N 3.04Å
55	R	89.7	Confident	79.7	Confident	146 Å²	146	91.7 Å²	91.7	55%	0.551	49%	0.49	S	S	*	.	H	α-helix	trans	-59	-46.4	174.5	-177.3	171.9	64.2	-138.1	0.2	111.5	A51 Y52 V53 V57 A58 E59	A51-R55 WeakPolarHBondContact O-CB 3.31Å; A51-R55 PolarHBondContact O-N 3.47Å; Y52-R55 PolarHBondContact O-N 3.24Å; V53-R55 PolarHBondContact O-N 2.97Å; R55-V57 PolarHBondContact O-N 3.18Å; R55-A58 PolarHBondContact O-N 2.98Å; R55-E59 WeakPolarHBondContact CG-OE1 3.49Å; R55-E59 WeakPolarHBondContact O-CG 3.34Å; R55-E59 PolarHBondContact O-N 3.16Å
56	R	93.4	Very high	81.1	Confident	83 Å²	83	92.5 Å²	92.5	31%	0.313	49%	0.488	S	S	.	.	H	α-helix	trans	-67.1	-36.6	-178.8	-173.3	59.4	-173.3	145.3	6.6	112.5	Y52 V53 R54 E59 L60 E63	Y52-R56 HydrophobicContact CE1-CB 4.42Å; Y52-R56 WeakPolarHBondContact O-CB 3.31Å; Y52-R56 PolarHBondContact O-N 3.37Å; V53-R56 PolarHBondContact O-N 3.36Å; R54-R56 PolarHBondContact O-N 2.92Å; R56-E59 WeakPolarHBondContact CD-OE2 3.12Å; R56-E59 IonicContact CZ-OE2 2.98Å; R56-E59 IonicContact NH1-OE2 2.84Å; R56-E59 PolarHBondContact NH1-OE2 3.35Å; R56-E59 PolarHBondContact O-N 3.49Å; R56-L60 HydrophobicContact CG-CD1 4.29Å; R56-L60 VanDerWaalsContact NH2-CD2 3.33Å; R56-L60 WeakPolarHBondContact O-CB 3.49Å; R56-L60 WeakPolarHBondContact O-CG 3.44Å; R56-L60 PolarHBondContact O-N 2.9Å; R56-E63 IonicContact CZ-OE1 3.78Å; R56-E63 IonicContact NH1-OE1 3.88Å; R56-E63 PolarHBondContact NH1-OE1 3.48Å; R56-E63 IonicContact NH2-OE1 3.96Å; R56-E63 IonicContact NH2-OE2 2.8Å
57	V	91.9	Very high	82.2	Confident	75 Å²	75	92.7 Å²	92.7	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-62.9	-43.7	173.5	169.4	0	0	0	0	110.7	V53 R54 R55 L60 N61	V53-V57 HydrophobicContact CG1-CG2 4.37Å; V53-V57 VanDerWaalsContact O-CG2 3.29Å; V53-V57 WeakPolarHBondContact O-CG2 3.47Å; V53-V57 PolarHBondContact O-N 3.01Å; R54-V57 PolarHBondContact O-N 3Å; R55-V57 PolarHBondContact O-N 3.18Å; V57-L60 PolarHBondContact O-N 3.09Å; V57-N61 WeakPolarHBondContact O-CB 3.43Å; V57-N61 VanDerWaalsContact O-CG 3.24Å; V57-N61 PolarHBondContact O-N 3.01Å; V57-N61 PolarHBondContact O-ND2 3.15Å
58	A	90.7	Very high	82.9	Confident	60 Å²	60	93.8 Å²	93.8	50%	0.496	48%	0.477	S	S	.	.	H	α-helix	trans	-62.9	-42.6	176.2	0	0	0	0	0	112.4	R54 R55 N61 L62	R54-A58 PolarHBondContact O-N 3.04Å; R55-A58 PolarHBondContact O-N 2.98Å; A58-N61 PolarHBondContact O-N 3.19Å; A58-L62 PolarHBondContact O-N 3.3Å
59	E	92.7	Very high	83.3	Confident	78 Å²	78	92.6 Å²	92.6	36%	0.364	47%	0.467	S	S	.	.	H	α-helix	trans	-60.5	-48.7	174.8	-72.8	169.6	-168.4	0	0	112.1	R55 R56 N61 L62 E63	R55-E59 WeakPolarHBondContact CG-OE1 3.49Å; R55-E59 WeakPolarHBondContact O-CG 3.34Å; R55-E59 PolarHBondContact O-N 3.16Å; R56-E59 WeakPolarHBondContact CD-OE2 3.12Å; R56-E59 IonicContact CZ-OE2 2.98Å; R56-E59 IonicContact NH1-OE2 2.84Å; R56-E59 PolarHBondContact NH1-OE2 3.35Å; R56-E59 PolarHBondContact O-N 3.49Å; E59-N61 VanDerWaalsContact C-N 3.31Å; E59-N61 PolarHBondContact O-N 2.91Å; E59-L62 WeakPolarHBondContact O-CB 3.43Å; E59-L62 PolarHBondContact O-N 3.39Å; E59-L62 VanDerWaalsContact O-N 3.13Å; E59-E63 WeakPolarHBondContact O-CG 3.46Å; E59-E63 PolarHBondContact O-N 3.48Å
60	L	95.1	Very high	83.2	Confident	78 Å²	78	96.7 Å²	96.7	41%	0.408	47%	0.47	S	S	.	.	H	α-helix	trans	-61.5	-39.6	178.6	-76	172	0	0	0	112	R56 V57 L62 E63 L64	R56-L60 HydrophobicContact CG-CD1 4.29Å; R56-L60 VanDerWaalsContact NH2-CD2 3.33Å; R56-L60 WeakPolarHBondContact O-CB 3.49Å; R56-L60 WeakPolarHBondContact O-CG 3.44Å; R56-L60 PolarHBondContact O-N 2.9Å; V57-L60 PolarHBondContact O-N 3.09Å; L60-L62 VanDerWaalsContact C-N 3.31Å; L60-L62 PolarHBondContact O-N 3.17Å; L60-E63 PolarHBondContact O-N 3.1Å; L60-L64 WeakPolarHBondContact O-CB 3.34Å; L60-L64 PolarHBondContact O-N 3.11Å
61	N	92.4	Very high	82.7	Confident	92 Å²	92	98.7 Å²	98.7	49%	0.492	48%	0.476	S	S	.	.	H	α-helix	trans	-65.4	-36	176	-73.5	-22.7	0	0	0	112.1	V57 A58 E59 S65	V57-N61 WeakPolarHBondContact O-CB 3.43Å; V57-N61 VanDerWaalsContact O-CG 3.24Å; V57-N61 PolarHBondContact O-N 3.01Å; V57-N61 PolarHBondContact O-ND2 3.15Å; A58-N61 PolarHBondContact O-N 3.19Å; E59-N61 VanDerWaalsContact C-N 3.31Å; E59-N61 PolarHBondContact O-N 2.91Å; N61-S65 WeakPolarHBondContact O-CB 3.23Å; N61-S65 PolarHBondContact O-N 2.74Å; N61-S65 PolarHBondContact O-OG 2.69Å
62	L	90.1	Very high	81.7	Confident	100 Å²	100	99.7 Å²	99.7	52%	0.524	48%	0.484	S	S	.	.	H	α-helix	trans	-69.3	-42.7	174.9	-178	65.2	0	0	0	111.8	A58 E59 L60 S65 K66	A58-L62 PolarHBondContact O-N 3.3Å; E59-L62 WeakPolarHBondContact O-CB 3.43Å; E59-L62 PolarHBondContact O-N 3.39Å; E59-L62 VanDerWaalsContact O-N 3.13Å; L60-L62 VanDerWaalsContact C-N 3.31Å; L60-L62 PolarHBondContact O-N 3.17Å; L62-S65 PolarHBondContact O-N 3.29Å; L62-K66 WeakPolarHBondContact O-CG 3.43Å; L62-K66 PolarHBondContact O-N 2.88Å
63	E	89.5	Confident	80.5	Confident	100 Å²	100	98.3 Å²	98.3	47%	0.467	49%	0.486	S	S	.	.	H	α-helix	trans	-59	-49.1	174.2	-71.2	170.2	-151.7	0	0	110.8	R56 E59 L60 S65 K66 E67	R56-E63 IonicContact CZ-OE1 3.78Å; R56-E63 IonicContact NH1-OE1 3.88Å; R56-E63 PolarHBondContact NH1-OE1 3.48Å; R56-E63 IonicContact NH2-OE1 3.96Å; R56-E63 IonicContact NH2-OE2 2.8Å; E59-E63 WeakPolarHBondContact O-CG 3.46Å; E59-E63 PolarHBondContact O-N 3.48Å; L60-E63 PolarHBondContact O-N 3.1Å; E63-S65 VanDerWaalsContact C-N 3.29Å; E63-S65 PolarHBondContact O-N 2.72Å; E63-K66 PolarHBondContact O-N 3.1Å; E63-E67 PolarHBondContact O-N 3.33Å
64	L	86.4	Confident	79.1	Confident	83 Å²	83	97.6 Å²	97.6	44%	0.435	48%	0.484	S	S	.	.	H	α-helix	trans	-62.3	-35.5	178.8	-176	65.7	0	0	0	112.7	L60 E67 K68	L60-L64 WeakPolarHBondContact O-CB 3.34Å; L60-L64 PolarHBondContact O-N 3.11Å; L64-E67 PolarHBondContact O-N 3.37Å; L64-K68 WeakPolarHBondContact O-CG 3.38Å; L64-K68 PolarHBondContact O-N 3.46Å
65	S	82.9	Confident	77.6	Confident	71 Å²	71	102 Å²	102	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-67.6	-41.6	178.1	-61.5	0	0	0	0	111.7	N61 L62 E63 E67 K68 E69	N61-S65 WeakPolarHBondContact O-CB 3.23Å; N61-S65 PolarHBondContact O-N 2.74Å; N61-S65 PolarHBondContact O-OG 2.69Å; L62-S65 PolarHBondContact O-N 3.29Å; E63-S65 VanDerWaalsContact C-N 3.29Å; E63-S65 PolarHBondContact O-N 2.72Å; S65-E67 VanDerWaalsContact C-N 3.34Å; S65-E67 PolarHBondContact O-N 2.91Å; S65-K68 PolarHBondContact O-N 3Å; S65-E69 PolarHBondContact O-N 2.92Å
66	K	80.7	Confident	75.8	Confident	127 Å²	127	102.8 Å²	102.8	55%	0.552	51%	0.512	S	S	*	.	H	α-helix	trans	-66.3	-35.6	176	-69.4	173.2	-178.9	176.6	0	112.5	L62 E63 E69 Y70	L62-K66 WeakPolarHBondContact O-CG 3.43Å; L62-K66 PolarHBondContact O-N 2.88Å; E63-K66 PolarHBondContact O-N 3.1Å; K66-E69 PolarHBondContact O-N 3.14Å; K66-Y70 PolarHBondContact O-N 2.98Å
67	E	74.6	Confident	74.1	Confident	103 Å²	103	107.8 Å²	107.8	48%	0.481	54%	0.536	S	S	.	.	H	α-helix	trans	-64.4	-43.9	175.9	-177.2	176.5	-161.7	0	0	111.4	E63 L64 S65 E69 Y70 F71	E63-E67 PolarHBondContact O-N 3.33Å; L64-E67 PolarHBondContact O-N 3.37Å; S65-E67 VanDerWaalsContact C-N 3.34Å; S65-E67 PolarHBondContact O-N 2.91Å; E67-E69 VanDerWaalsContact C-N 3.29Å; E67-E69 PolarHBondContact O-N 3.31Å; E67-Y70 PolarHBondContact O-N 3.23Å; E67-F71 HydrophobicContact CG-CD2 3.83Å; E67-F71 HydrophobicContact CG-CE2 3.43Å; E67-F71 VanDerWaalsContact CG-CE2 3.43Å; E67-F71 WeakPolarHBondContact O-CD2 3.42Å; E67-F71 PolarHBondContact O-N 3.37Å; E67-F71 VanDerWaalsContact O-N 3.11Å
68	K	70.7	Confident	72.4	Confident	143 Å²	143	112.5 Å²	112.5	62%	0.622	55%	0.551	S	S	*	*	H	α-helix	trans	-60.7	-38.6	175.4	-72.4	178.9	-179.8	179.1	0	112.5	L64 S65 F71 A72	L64-K68 WeakPolarHBondContact O-CG 3.38Å; L64-K68 PolarHBondContact O-N 3.46Å; S65-K68 PolarHBondContact O-N 3Å; K68-F71 PolarHBondContact O-N 3.5Å; K68-A72 PolarHBondContact O-N 3.17Å; K68-A72 VanDerWaalsContact O-N 3.1Å
69	E	68.5	Low	70.7	Confident	127 Å²	127	115 Å²	115	59%	0.593	56%	0.56	S	S	*	*	H	α-helix	trans	-65.4	-44.1	175.5	-170.8	174.9	-169.8	0	0	111.7	S65 K66 E67 F71 A72 D73	S65-E69 PolarHBondContact O-N 2.92Å; K66-E69 PolarHBondContact O-N 3.14Å; E67-E69 VanDerWaalsContact C-N 3.29Å; E67-E69 PolarHBondContact O-N 3.31Å; E69-F71 VanDerWaalsContact C-N 3.27Å; E69-F71 PolarHBondContact O-N 2.7Å; E69-A72 PolarHBondContact O-N 2.75Å; E69-A72 VanDerWaalsContact O-N 3.17Å; E69-D73 PolarHBondContact O-N 3.36Å
70	Y	58.4	Low	68.8	Low	174 Å²	174	113.9 Å²	113.9	68%	0.682	57%	0.569	S	S	*	*	H	α-helix	trans	-60.4	-36.4	177.5	-173.2	-98.9	0	0	0	112.8	K66 E67	K66-Y70 PolarHBondContact O-N 2.98Å; E67-Y70 PolarHBondContact O-N 3.23Å
71	F	58.6	Low	66.9	Low	99 Å²	99	120.7 Å²	120.7	43%	0.434	59%	0.589	S	S	.	*	H	α-helix	trans	-74	-37.6	175.8	-72.6	-63.7	0	0	0	112.9	E67 K68 E69 D73 S74 Y75	E67-F71 HydrophobicContact CG-CD2 3.83Å; E67-F71 HydrophobicContact CG-CE2 3.43Å; E67-F71 VanDerWaalsContact CG-CE2 3.43Å; E67-F71 WeakPolarHBondContact O-CD2 3.42Å; E67-F71 PolarHBondContact O-N 3.37Å; E67-F71 VanDerWaalsContact O-N 3.11Å; K68-F71 PolarHBondContact O-N 3.5Å; E69-F71 VanDerWaalsContact C-N 3.27Å; E69-F71 PolarHBondContact O-N 2.7Å; F71-D73 VanDerWaalsContact C-N 3.34Å; F71-D73 PolarHBondContact O-N 3.38Å; F71-S74 PolarHBondContact O-N 3.17Å; F71-Y75 HydrophobicContact CB-CE2 4.48Å; F71-Y75 HydrophobicContact CD1-CE2 4.41Å; F71-Y75 WeakPolarHBondContact O-CD2 3.33Å; F71-Y75 PolarHBondContact O-N 2.86Å
72	A	57	Low	65.4	Low	62 Å²	62	121.4 Å²	121.4	51%	0.512	60%	0.597	S	S	.	*	H	α-helix	trans	-58.1	-45.4	179.4	0	0	0	0	0	112	K68 E69 S74	K68-A72 PolarHBondContact O-N 3.17Å; K68-A72 VanDerWaalsContact O-N 3.1Å; E69-A72 PolarHBondContact O-N 2.75Å; E69-A72 VanDerWaalsContact O-N 3.17Å; A72-S74 VanDerWaalsContact C-N 3.33Å; A72-S74 PolarHBondContact O-N 2.92Å
73	D	56.3	Low	64	Low	109 Å²	109	122.9 Å²	122.9	58%	0.583	61%	0.605	S	S	*	*	H	α-helix	trans	-68.3	-29.1	-177.9	-81.8	-3.6	0	0	0	113.9	E69 F71	E69-D73 PolarHBondContact O-N 3.36Å; F71-D73 VanDerWaalsContact C-N 3.34Å; F71-D73 PolarHBondContact O-N 3.38Å
74	S	56.3	Low	62.3	Low	57 Å²	57	126.9 Å²	126.9	40%	0.399	62%	0.621	S	S	.	*	H	α-helix	trans	-77.1	-34.4	-177	-173.8	0	0	0	0	112.7	F71 A72	F71-S74 PolarHBondContact O-N 3.17Å; A72-S74 VanDerWaalsContact C-N 3.33Å; A72-S74 PolarHBondContact O-N 2.92Å
75	Y	53.5	Low	60.7	Low	174 Å²	174	128.7 Å²	128.7	68%	0.682	63%	0.627	S	S	*	*	H	α-helix	trans	-76.6	-31.2	-178.6	-76.9	-72.5	0	0	0	113.1	F71	F71-Y75 HydrophobicContact CB-CE2 4.48Å; F71-Y75 HydrophobicContact CD1-CE2 4.41Å; F71-Y75 WeakPolarHBondContact O-CD2 3.33Å; F71-Y75 PolarHBondContact O-N 2.86Å
76	E	53.4	Low	59.5	Low	164 Å²	164	130.5 Å²	130.5	77%	0.766	64%	0.637	S	S	*	*	H	α-helix	trans	-71	-36.4	-176.2	-132.5	179.6	-160.9	0	0	112.5
77	K	55.7	Low	58.3	Low	188 Å²	188	131.7 Å²	131.7	82%	0.817	65%	0.645	S	S	*	*	H	α-helix	trans	-81.1	-16	-176.7	-71.1	-178.3	-177.4	171.2	0	115.3
78	K	56.8	Low	57.4	Low	174 Å²	174	132.9 Å²	132.9	76%	0.757	65%	0.654	S	S	*	*	H	α-helix	trans	-105.6	1.6	-174.8	-72.2	-169.6	-179.1	178.5	0	115.3	G80	K78-G80 PolarHBondContact O-N 3.35Å
79	T	54.9	Low	56.7	Low	112 Å²	112	134.5 Å²	134.5	69%	0.687	66%	0.661	S	S	*	*			trans	-77	52.1	164.9	61.6	0	0	0	0	110.5	R81	T79-R81 VanDerWaalsContact C-N 3.32Å; T79-R81 PolarHBondContact O-N 3.44Å
80	G	53.1	Low	56.2	Low	54 Å²	54	138.6 Å²	138.6	56%	0.557	67%	0.673	S	S	*	*			trans	-53.6	109.1	152.9	0	0	0	0	0	105.3	K78 V82	K78-G80 PolarHBondContact O-N 3.35Å; G80-V82 VanDerWaalsContact C-N 3.33Å; G80-V82 WeakPolarHBondContact O-CG2 3.24Å; G80-V82 PolarHBondContact O-N 3.17Å
81	R	55.8	Low	56	Low	222 Å²	222	135.2 Å²	135.2	84%	0.838	68%	0.675	S	S	*	*			trans	-49.3	101.1	-177.6	-165.2	175.4	-177.5	152.1	-0.5	106.8	T79 N83	T79-R81 VanDerWaalsContact C-N 3.32Å; T79-R81 PolarHBondContact O-N 3.44Å; R81-N83 PolarHBondContact O-N 3.31Å
82	V	60.6	Low	55.7	Low	106 Å²	106	139.6 Å²	139.6	64%	0.642	69%	0.688	S	S	*	*			trans	-68.6	95.6	177.7	178.7	0	0	0	0	103.9	G80 F84	G80-V82 VanDerWaalsContact C-N 3.33Å; G80-V82 WeakPolarHBondContact O-CG2 3.24Å; G80-V82 PolarHBondContact O-N 3.17Å; V82-F84 HydrophobicContact CB-CD2 4.41Å; V82-F84 HydrophobicContact CB-CE2 4.23Å; V82-F84 HydrophobicContact CG1-CD2 4.02Å; V82-F84 HydrophobicContact CG1-CE2 3.9Å; V82-F84 HydrophobicContact CG1-CG 4.48Å; V82-F84 HydrophobicContact CG1-CZ 4.27Å; V82-F84 WeakPolarHBondContact O-CD2 3.38Å; V82-F84 PolarHBondContact O-N 3.34Å
83	N	59.8	Low	55.6	Low	131 Å²	131	144 Å²	144	70%	0.701	70%	0.702	S	S	*	*			trans	-65.6	91	169.6	-72.5	-27.2	0	0	0	105.2	R81 H85	R81-N83 PolarHBondContact O-N 3.31Å; N83-H85 PolarHBondContact O-N 2.92Å
84	F	55.3	Low	55.5	Low	184 Å²	184	145.2 Å²	145.2	81%	0.807	71%	0.707	S	S	*	*			trans	-59.3	96.6	165.1	-80.3	-86.2	0	0	0	106.1	V82 P86	V82-F84 HydrophobicContact CB-CD2 4.41Å; V82-F84 HydrophobicContact CB-CE2 4.23Å; V82-F84 HydrophobicContact CG1-CD2 4.02Å; V82-F84 HydrophobicContact CG1-CE2 3.9Å; V82-F84 HydrophobicContact CG1-CG 4.48Å; V82-F84 HydrophobicContact CG1-CZ 4.27Å; V82-F84 WeakPolarHBondContact O-CD2 3.38Å; V82-F84 PolarHBondContact O-N 3.34Å; F84-P86 VanDerWaalsContact O-CD 3.24Å; F84-P86 WeakPolarHBondContact O-CD 3.44Å
85	H	52.1	Low	55.2	Low	121 Å²	121	145.3 Å²	145.3	56%	0.56	71%	0.708	S	S	*	*			trans	-75.8	113.3	168.2	-153.1	-61.4	0	0	0	105.2	N83 Q87 L88	N83-H85 PolarHBondContact O-N 2.92Å; H85-Q87 PolarHBondContact O-N 3.39Å; H85-L88 PolarHBondContact O-N 2.71Å
86	P	57.1	Low	55.4	Low	109 Å²	109	146 Å²	146	71%	0.708	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	9	-173.8	27.2	-35.4	0	0	0	113.6	F84 F89	F84-P86 VanDerWaalsContact O-CD 3.24Å; F84-P86 WeakPolarHBondContact O-CD 3.44Å; P86-F89 WeakPolarHBondContact O-CD2 3.43Å; P86-F89 WeakPolarHBondContact O-CE2 3.39Å
87	Q	55.5	Low	55.6	Low	152 Å²	152	145.7 Å²	145.7	71%	0.71	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	-0.5	-171.2	-147.2	154	4.1	0	0	113.4	H85 F89	H85-Q87 PolarHBondContact O-N 3.39Å; Q87-F89 PolarHBondContact O-N 3.47Å
88	L	57.1	Low	55.4	Low	129 Å²	129	138.5 Å²	138.5	68%	0.675	69%	0.694	S	S	*	*			trans	-80.8	56.7	167.2	-60.6	179.5	0	0	0	110.2	H85 Y90	H85-L88 PolarHBondContact O-N 2.71Å; L88-Y90 PolarHBondContact O-N 3.17Å
89	F	55.7	Low	55.4	Low	176 Å²	176	136 Å²	136	77%	0.772	70%	0.697	S	S	*	*			trans	-76.3	105.7	160.2	-71.7	-77.8	0	0	0	106.5	P86 Q87 S91	P86-F89 WeakPolarHBondContact O-CD2 3.43Å; P86-F89 WeakPolarHBondContact O-CE2 3.39Å; Q87-F89 PolarHBondContact O-N 3.47Å; F89-S91 PolarHBondContact O-N 2.82Å
90	Y	58	Low	55.5	Low	213 Å²	213	136 Å²	136	84%	0.835	69%	0.69	S	S	*	*			trans	-65.6	89.5	165.7	-65.3	-81.3	0	0	0	107.8	L88 R92	L88-Y90 PolarHBondContact O-N 3.17Å; Y90-R92 VanDerWaalsContact C-N 3.3Å; Y90-R92 PolarHBondContact O-N 3.25Å
91	S	53.4	Low	55.6	Low	104 Å²	104	138.7 Å²	138.7	73%	0.727	69%	0.691	S	S	*	*			trans	-68.8	94.1	166.6	45	0	0	0	0	107.6	F89 I93	F89-S91 PolarHBondContact O-N 2.82Å; S91-I93 PolarHBondContact O-N 2.77Å; S91-I93 VanDerWaalsContact O-N 3.16Å
92	R	51.6	Low	55.7	Low	190 Å²	190	134.4 Å²	134.4	72%	0.717	68%	0.684	S	S	*	*			trans	-65.5	109.9	162.2	-177.4	174.1	-68.6	-157.7	1.7	106.1	Y90 I94 E100	Y90-R92 VanDerWaalsContact C-N 3.3Å; Y90-R92 PolarHBondContact O-N 3.25Å; R92-I94 VanDerWaalsContact C-N 3.33Å; R92-I94 PolarHBondContact O-N 3.37Å; R92-E100 IonicContact NH1-OE2 3.67Å
93	I	55.5	Low	55.5	Low	156 Å²	156	135.1 Å²	135.1	80%	0.8	68%	0.684	S	S	*	*			trans	-67.3	101.2	168.5	-58.1	173.3	0	0	0	105	S91 S95	S91-I93 PolarHBondContact O-N 2.77Å; S91-I93 VanDerWaalsContact O-N 3.16Å; I93-S95 PolarHBondContact O-N 3.06Å; I93-S95 VanDerWaalsContact O-N 3.08Å
94	I	53.7	Low	55.2	Low	133 Å²	133	136.3 Å²	136.3	68%	0.682	69%	0.691	S	S	*	*			trans	-68	105.5	168.8	-56.8	168.6	0	0	0	104.6	R92 Q96	R92-I94 VanDerWaalsContact C-N 3.33Å; R92-I94 PolarHBondContact O-N 3.37Å; I94-Q96 PolarHBondContact O-N 3.35Å
95	S	51.2	Low	55	Low	60 Å²	60	133.6 Å²	133.6	42%	0.42	68%	0.679	S	S	.	*			trans	-58.4	126.9	168.2	-176.6	0	0	0	0	106.8	I93 D97 S98	I93-S95 PolarHBondContact O-N 3.06Å; I93-S95 VanDerWaalsContact O-N 3.08Å; S95-D97 PolarHBondContact O-N 3.48Å; S95-S98 PolarHBondContact O-N 3.07Å
96	Q	57.3	Low	55.2	Low	188 Å²	188	131 Å²	131	88%	0.879	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-18	-179	-68.8	-172.2	-10.3	0	0	112.5	I94	I94-Q96 PolarHBondContact O-N 3.35Å
97	D	57.1	Low	55.2	Low	157 Å²	157	133.6 Å²	133.6	84%	0.84	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-8.4	177.3	-50.6	-31.1	0	0	0	112.7	S95 C99	S95-D97 PolarHBondContact O-N 3.48Å; D97-C99 PolarHBondContact O-N 3.43Å
98	S	52	Low	55.4	Low	38 Å²	38	132.1 Å²	132.1	27%	0.266	67%	0.674	S	S	.	*			trans	-95.5	79.3	173.7	-170	0	0	0	0	109.3	S95 E100	S95-S98 PolarHBondContact O-N 3.07Å; S98-E100 PolarHBondContact O-N 2.91Å; S98-E100 WeakPolarHBondContact OG-CG 3.38Å; S98-E100 PolarHBondContact OG-OE1 3.23Å
99	C	56.2	Low	55.3	Low	122 Å²	122	131 Å²	131	82%	0.824	67%	0.665	S	S	*	*			trans	-71.5	84	145.9	-77.9	0	0	0	0	105.8	D97 D101	D97-C99 PolarHBondContact O-N 3.43Å; C99-D101 VanDerWaalsContact C-N 3.26Å; C99-D101 PolarHBondContact O-N 2.96Å
100	E	56.9	Low	55.5	Low	112 Å²	112	128.1 Å²	128.1	52%	0.523	66%	0.655	S	S	.	*			trans	-55.5	104.4	155.1	-82.2	134.8	-135.4	0	0	105	R92 S98 L102	R92-E100 IonicContact NH1-OE2 3.67Å; S98-E100 PolarHBondContact O-N 2.91Å; S98-E100 WeakPolarHBondContact OG-CG 3.38Å; S98-E100 PolarHBondContact OG-OE1 3.23Å; E100-L102 HydrophobicContact CB-CD2 4.32Å; E100-L102 PolarHBondContact O-N 3.48Å
101	D	55.6	Low	55.5	Low	110 Å²	110	121.9 Å²	121.9	59%	0.588	64%	0.637	S	S	*	*			trans	-66.5	91.3	177.2	-146.4	-11.6	0	0	0	105.7	C99 N103 D104	C99-D101 VanDerWaalsContact C-N 3.26Å; C99-D101 PolarHBondContact O-N 2.96Å; D101-N103 PolarHBondContact O-N 3.22Å; D101-N103 PolarHBondContact OD1-ND2 3.45Å; D101-D104 PolarHBondContact O-N 2.95Å
102	L	58.3	Low	55.7	Low	131 Å²	131	122.3 Å²	122.3	69%	0.686	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	9.3	178	-61.8	-179.4	0	0	0	111.9	E100 D104 F105	E100-L102 HydrophobicContact CB-CD2 4.32Å; E100-L102 PolarHBondContact O-N 3.48Å; L102-D104 VanDerWaalsContact C-N 3.26Å; L102-F105 VanDerWaalsContact O-CD2 3.31Å; L102-F105 WeakPolarHBondContact O-CD2 3.37Å; L102-F105 VanDerWaalsContact O-CE2 3.31Å; L102-F105 WeakPolarHBondContact O-CE2 3.48Å
103	N	56	Low	55.9	Low	122 Å²	122	118.6 Å²	118.6	65%	0.652	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	15.3	172.7	-64.5	-48.2	0	0	0	113.2	D101 F105	D101-N103 PolarHBondContact O-N 3.22Å; D101-N103 PolarHBondContact OD1-ND2 3.45Å; N103-F105 PolarHBondContact O-N 3Å
104	D	53.6	Low	56	Low	156 Å²	156	114.5 Å²	114.5	83%	0.834	60%	0.603	S	S	*	*			trans	-69.5	25.8	162.4	-80.1	-8.4	0	0	0	112.6	D101 L102 S106	D101-D104 PolarHBondContact O-N 2.95Å; L102-D104 VanDerWaalsContact C-N 3.26Å; D104-S106 VanDerWaalsContact C-N 3.3Å; D104-S106 PolarHBondContact O-N 3.33Å
105	F	51.5	Low	56.1	Low	127 Å²	127	114.5 Å²	114.5	56%	0.557	60%	0.598	S	S	*	*			trans	-68.1	97.5	156.8	-69	-74.2	0	0	0	106.8	L102 N103 E107 E109	L102-F105 VanDerWaalsContact O-CD2 3.31Å; L102-F105 WeakPolarHBondContact O-CD2 3.37Å; L102-F105 VanDerWaalsContact O-CE2 3.31Å; L102-F105 WeakPolarHBondContact O-CE2 3.48Å; N103-F105 PolarHBondContact O-N 3Å; F105-E107 PolarHBondContact O-N 3.18Å; F105-E109 WeakPolarHBondContact CD1-OE2 3.39Å
106	S	55.7	Low	56.1	Low	67 Å²	67	118.9 Å²	118.9	47%	0.469	62%	0.616	S	S	.	*			trans	-48.3	135.4	170.4	64.3	0	0	0	0	109.1	D104 D108 E109	D104-S106 VanDerWaalsContact C-N 3.3Å; D104-S106 PolarHBondContact O-N 3.33Å; S106-D108 PolarHBondContact O-N 3.33Å; S106-E109 PolarHBondContact O-N 3.44Å
107	E	58.1	Low	55.9	Low	163 Å²	163	114 Å²	114	76%	0.762	60%	0.603	S	S	*	*	H	α-helix	trans	-52.1	-24.7	-179.4	-68.3	-175.8	173.4	0	0	112.7	F105 E109 M110 N111	F105-E107 PolarHBondContact O-N 3.18Å; E107-E109 VanDerWaalsContact C-N 3.33Å; E107-E109 PolarHBondContact O-N 3.03Å; E107-M110 PolarHBondContact O-N 3.28Å; E107-N111 WeakPolarHBondContact O-CB 3.35Å; E107-N111 PolarHBondContact O-N 3.43Å
108	D	59.2	Low	55.3	Low	120 Å²	120	113.9 Å²	113.9	64%	0.642	60%	0.597	S	S	*	*	H	α-helix	trans	-57.7	-41.1	173.8	-67.6	-18.5	0	0	0	112.5	S106 N111 E112	S106-D108 PolarHBondContact O-N 3.33Å; D108-N111 PolarHBondContact O-N 3.16Å; D108-E112 WeakPolarHBondContact O-CG 3.37Å; D108-E112 PolarHBondContact O-N 3.43Å
109	E	55.6	Low	55	Low	106 Å²	106	118.4 Å²	118.4	50%	0.495	62%	0.618	S	S	.	*	H	α-helix	trans	-71.9	-37.9	-177.3	-164.2	169	-163	0	0	111.9	F105 S106 E107 N111 E112 L113	F105-E109 WeakPolarHBondContact CD1-OE2 3.39Å; S106-E109 PolarHBondContact O-N 3.44Å; E107-E109 VanDerWaalsContact C-N 3.33Å; E107-E109 PolarHBondContact O-N 3.03Å; E109-N111 VanDerWaalsContact C-N 3.34Å; E109-E112 PolarHBondContact O-N 3.34Å; E109-L113 PolarHBondContact O-N 2.82Å; E109-L113 VanDerWaalsContact O-N 3.17Å
110	M	58.2	Low	54.5	Low	115 Å²	115	120.1 Å²	120.1	57%	0.567	62%	0.619	S	S	*	*	H	α-helix	trans	-69.9	-32.2	173.9	-71.3	-65.1	-79.6	0	0	112.2	E107 L113 T114	E107-M110 PolarHBondContact O-N 3.28Å; M110-L113 PolarHBondContact O-N 3.39Å; M110-L113 HydrophobicContact SD-CD1 4.3Å; M110-T114 PolarHBondContact O-N 2.81Å; M110-T114 PolarHBondContact O-OG1 3.47Å
111	N	58.2	Low	53.5	Low	82 Å²	82	118.8 Å²	118.8	44%	0.439	64%	0.635	S	S	.	*	H	α-helix	trans	-69.2	-36.5	172.8	-84.4	-17.2	0	0	0	112.4	E107 D108 E109 L113 T114 K115	E107-N111 WeakPolarHBondContact O-CB 3.35Å; E107-N111 PolarHBondContact O-N 3.43Å; D108-N111 PolarHBondContact O-N 3.16Å; E109-N111 VanDerWaalsContact C-N 3.34Å; N111-L113 VanDerWaalsContact C-N 3.34Å; N111-T114 WeakPolarHBondContact CA-OG1 3.46Å; N111-T114 PolarHBondContact O-N 3.05Å; N111-T114 PolarHBondContact O-OG1 3.42Å; N111-K115 WeakPolarHBondContact O-CB 3.43Å; N111-K115 VanDerWaalsContact O-CG 3.23Å; N111-K115 WeakPolarHBondContact O-CG 3.29Å; N111-K115 PolarHBondContact O-N 3.14Å
112	E	57.8	Low	52.9	Low	113 Å²	113	120.5 Å²	120.5	53%	0.528	64%	0.644	S	S	.	*	H	α-helix	trans	-65.9	-37.7	174.5	-70.1	-57.7	118.3	0	0	111.6	D108 E109 K115 L116	D108-E112 WeakPolarHBondContact O-CG 3.37Å; D108-E112 PolarHBondContact O-N 3.43Å; E109-E112 PolarHBondContact O-N 3.34Å; E112-K115 IonicContact OE1-NZ 3.92Å; E112-K115 PolarHBondContact OE1-NZ 3.43Å; E112-L116 PolarHBondContact O-N 3.32Å
113	L	55.3	Low	52	Low	113 Å²	113	119.9 Å²	119.9	59%	0.592	65%	0.646	S	S	*	*	H	α-helix	trans	-67.9	-41.1	175	-69.1	175.1	0	0	0	112.8	E109 M110 N111 L116 S117	E109-L113 PolarHBondContact O-N 2.82Å; E109-L113 VanDerWaalsContact O-N 3.17Å; M110-L113 PolarHBondContact O-N 3.39Å; M110-L113 HydrophobicContact SD-CD1 4.3Å; N111-L113 VanDerWaalsContact C-N 3.34Å; L113-L116 PolarHBondContact O-N 3.26Å; L113-S117 PolarHBondContact O-N 3.4Å
114	T	58	Low	51.4	Low	69 Å²	69	120.6 Å²	120.6	42%	0.423	66%	0.655	S	S	.	*	H	α-helix	trans	-71.5	-33.5	178.2	39.3	0	0	0	0	112.6	M110 N111 L116 S117 H118	M110-T114 PolarHBondContact O-N 2.81Å; M110-T114 PolarHBondContact O-OG1 3.47Å; N111-T114 WeakPolarHBondContact CA-OG1 3.46Å; N111-T114 PolarHBondContact O-N 3.05Å; N111-T114 PolarHBondContact O-OG1 3.42Å; T114-L116 VanDerWaalsContact C-N 3.29Å; T114-L116 PolarHBondContact O-N 3.04Å; T114-S117 PolarHBondContact O-N 3.41Å; T114-H118 PolarHBondContact O-N 3.38Å; T114-H118 PolarHBondContact O-ND1 2.88Å
115	K	55.5	Low	50.7	Low	133 Å²	133	118.5 Å²	118.5	58%	0.578	65%	0.653	S	S	*	*	H	α-helix	trans	-63	-34.8	171.8	-74.7	172.4	-162.2	165.2	0	112.3	N111 E112 S117 H118	N111-K115 WeakPolarHBondContact O-CB 3.43Å; N111-K115 VanDerWaalsContact O-CG 3.23Å; N111-K115 WeakPolarHBondContact O-CG 3.29Å; N111-K115 PolarHBondContact O-N 3.14Å; E112-K115 IonicContact OE1-NZ 3.92Å; E112-K115 PolarHBondContact OE1-NZ 3.43Å; K115-S117 VanDerWaalsContact C-N 3.27Å; K115-S117 PolarHBondContact O-N 3Å; K115-H118 PolarHBondContact O-N 3.13Å
116	L	52.5	Low	50.1	Low	153 Å²	153	120.7 Å²	120.7	80%	0.801	66%	0.662	S	S	*	*	H	α-helix	trans	-69.3	-26.8	176.5	-141	80.2	0	0	0	112.5	E112 L113 T114	E112-L116 PolarHBondContact O-N 3.32Å; L113-L116 PolarHBondContact O-N 3.26Å; T114-L116 VanDerWaalsContact C-N 3.29Å; T114-L116 PolarHBondContact O-N 3.04Å
117	S	51.9	Low	49.5	Very low	86 Å²	86	122.7 Å²	122.7	60%	0.601	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	0.3	-180	-176.1	0	0	0	0	114.5	L113 T114 K115 N119	L113-S117 PolarHBondContact O-N 3.4Å; T114-S117 PolarHBondContact O-N 3.41Å; K115-S117 VanDerWaalsContact C-N 3.27Å; K115-S117 PolarHBondContact O-N 3Å; S117-N119 PolarHBondContact O-N 3.42Å; S117-N119 VanDerWaalsContact O-N 3.1Å
118	H	45.7	Very low	48.6	Very low	153 Å²	153	121.7 Å²	121.7	71%	0.708	67%	0.672	S	S	*	*			trans	-83.7	31.5	-176.3	-91.9	65.1	0	0	0	114.9	T114 K115	T114-H118 PolarHBondContact O-N 3.38Å; T114-H118 PolarHBondContact O-ND1 2.88Å; K115-H118 PolarHBondContact O-N 3.13Å
119	N	45.3	Very low	47.5	Very low	134 Å²	134	124.2 Å²	124.2	72%	0.717	68%	0.682	S	S	*	*	S	Bend	trans	-122.4	119.5	159.5	-63.1	-64.6	0	0	0	106.5	S117	S117-N119 PolarHBondContact O-N 3.42Å; S117-N119 VanDerWaalsContact O-N 3.1Å
120	D	45	Very low	46.6	Very low	158 Å²	158	125.4 Å²	125.4	85%	0.845	69%	0.691	S	S	*	*	S	Bend	trans	98	85.8	-179.8	-48.5	-30.2	0	0	0	113.4	D122	D120-D122 PolarHBondContact O-N 2.95Å; D120-D122 VanDerWaalsContact O-N 3.14Å
121	G	37.4	Very low	45.5	Very low	83 Å²	83	124.2 Å²	124.2	86%	0.856	70%	0.7	S	S	*	*			trans	-62.2	111.7	166.6	0	0	0	0	0	110.3
122	D	42.6	Very low	44.2	Very low	146 Å²	146	127 Å²	127	78%	0.781	72%	0.715	S	S	*	*			trans	-166.9	135.1	138.8	-126.1	-23	0	0	0	111.3	D120	D120-D122 PolarHBondContact O-N 2.95Å; D120-D122 VanDerWaalsContact O-N 3.14Å
123	T	39.9	Very low	43.1	Very low	119 Å²	119	129.7 Å²	129.7	73%	0.73	73%	0.732	S	S	*	*			trans	62.8	104.2	159.6	53.3	0	0	0	0	120	S125	T123-S125 PolarHBondContact O-N 2.8Å
124	V	42.3	Very low	42.2	Very low	136 Å²	136	134 Å²	134	82%	0.824	74%	0.74	S	S	*	*			trans	-46.1	93.4	155.8	-176.4	0	0	0	0	111.2	K126	V124-K126 HydrophobicContact CG1-CG 4.4Å; V124-K126 PolarHBondContact O-N 3.43Å
125	S	38.7	Very low	41.2	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	75%	0.752	S	S	*	*			trans	-85.6	97.1	167.2	43.1	0	0	0	0	108.5	T123	T123-S125 PolarHBondContact O-N 2.8Å
126	K	38.9	Very low	40.2	Very low	172 Å²	172	137 Å²	137	75%	0.748	77%	0.765	S	S	*	*			trans	-55.7	136.4	171.4	-70.1	175.7	177.6	177.2	0	109.5	V124 I128	V124-K126 HydrophobicContact CG1-CG 4.4Å; V124-K126 PolarHBondContact O-N 3.43Å; K126-I128 PolarHBondContact O-N 3.47Å; K126-I128 VanDerWaalsContact O-N 3.09Å
127	P	43.2	Very low	39.7	Very low	110 Å²	110	136.8 Å²	136.8	71%	0.714	76%	0.76	S	S	*	*			trans	-65.9	112.6	172	25.3	-30.1	0	0	0	108.5	M129	P127-M129 VanDerWaalsContact C-N 3.31Å; P127-M129 PolarHBondContact O-N 3.42Å
128	I	39.5	Very low	38.8	Very low	142 Å²	142	142 Å²	142	73%	0.728	77%	0.774	S	S	*	*			trans	-71.2	92.1	175.1	-60.3	175.8	0	0	0	107	K126 N130	K126-I128 PolarHBondContact O-N 3.47Å; K126-I128 VanDerWaalsContact O-N 3.09Å; I128-N130 PolarHBondContact O-N 2.79Å
129	M	35.6	Very low	38.4	Very low	173 Å²	173	144.4 Å²	144.4	85%	0.852	78%	0.777	S	S	*	*			trans	-65.1	83.1	165.9	-74.3	-176.1	-163.8	0	0	109.1	P127 A131	P127-M129 VanDerWaalsContact C-N 3.31Å; P127-M129 PolarHBondContact O-N 3.42Å; M129-A131 PolarHBondContact O-N 3.1Å
130	N	37.1	Very low	38.1	Very low	130 Å²	130	143.9 Å²	143.9	70%	0.695	78%	0.779	S	S	*	*			trans	-80.7	80.4	166.4	-83.4	-22.4	0	0	0	109.2	I128 N132	I128-N130 PolarHBondContact O-N 2.79Å; N130-N132 PolarHBondContact O-N 3.14Å; N130-N132 VanDerWaalsContact O-N 3.11Å
131	A	35.4	Very low	37.9	Very low	90 Å²	90	141.6 Å²	141.6	74%	0.744	78%	0.776	S	S	*	*			trans	-67.4	95	161.9	0	0	0	0	0	109.2	M129	M129-A131 PolarHBondContact O-N 3.1Å
132	N	31.6	Very low	37.9	Very low	141 Å²	141	143.4 Å²	143.4	75%	0.754	77%	0.769	S	S	*	*			trans	-116.7	78.4	162.3	-81.3	-52.9	0	0	0	109.8	N130 R134	N130-N132 PolarHBondContact O-N 3.14Å; N130-N132 VanDerWaalsContact O-N 3.11Å; N132-R134 VanDerWaalsContact C-N 3.31Å; N132-R134 PolarHBondContact O-N 2.98Å; N132-R134 VanDerWaalsContact O-N 3.08Å
133	L	33.8	Very low	37.7	Very low	170 Å²	170	143.2 Å²	143.2	89%	0.89	77%	0.767	S	S	*	*			trans	-71.1	82.2	162.9	-172.4	79.3	0	0	0	108.7
134	R	35.7	Very low	37.8	Very low	203 Å²	203	143.2 Å²	143.2	77%	0.766	77%	0.769	S	S	*	*			trans	-142	100.9	169.5	-71.7	-72.2	-173.4	160.9	-2.8	112.1	N132	N132-R134 VanDerWaalsContact C-N 3.31Å; N132-R134 PolarHBondContact O-N 2.98Å; N132-R134 VanDerWaalsContact O-N 3.08Å
135	H	38.6	Very low	37.3	Very low	145 Å²	145	139.1 Å²	139.1	67%	0.671	75%	0.754	S	S	*	*			trans	66.5	112.7	141.7	-57.7	63.9	0	0	0	117	Q137	H135-Q137 VanDerWaalsContact C-N 3.27Å; H135-Q137 PolarHBondContact O-N 2.78Å
136	S	34.5	Very low	37.6	Very low	121 Å²	121	139.7 Å²	139.7	85%	0.846	76%	0.756	S	S	*	*			trans	-53.2	84.1	165.1	61.4	0	0	0	0	111.4	Q138	S136-Q138 PolarHBondContact O-N 3.04Å
137	Q	40.3	Very low	37.8	Very low	148 Å²	148	137.4 Å²	137.4	69%	0.692	76%	0.756	S	S	*	*			trans	-85.2	100.8	160.5	-70.7	-172.2	6.7	0	0	106.4	H135 R139	H135-Q137 VanDerWaalsContact C-N 3.27Å; H135-Q137 PolarHBondContact O-N 2.78Å; Q137-R139 HydrophobicContact CB-CG 4.49Å; Q137-R139 PolarHBondContact O-N 3.44Å
138	Q	33.5	Very low	37.6	Very low	194 Å²	194	139.1 Å²	139.1	91%	0.907	76%	0.759	S	S	*	*			trans	-52.1	82.5	160.6	-67.4	172.4	-23.5	0	0	108.5	S136	S136-Q138 PolarHBondContact O-N 3.04Å
139	R	38.6	Very low	37.7	Very low	205 Å²	205	140 Å²	140	77%	0.774	76%	0.763	S	S	*	*			trans	-107.2	101.3	165.6	-76.1	-172.1	147.5	-172.5	-6.3	105	Q137 S141	Q137-R139 HydrophobicContact CB-CG 4.49Å; Q137-R139 PolarHBondContact O-N 3.44Å; R139-S141 PolarHBondContact O-N 2.94Å; R139-S141 VanDerWaalsContact O-N 3.08Å
140	T	37.6	Very low	37.9	Very low	122 Å²	122	137.3 Å²	137.3	75%	0.748	76%	0.757	S	S	*	*			trans	-22.2	113.7	158.1	47.6	0	0	0	0	109.3	V142	T140-V142 PolarHBondContact O-N 3.02Å
141	S	41.7	Very low	38	Very low	111 Å²	111	140.3 Å²	140.3	78%	0.776	77%	0.767	S	S	*	*			trans	-60.1	88.8	173.1	173.8	0	0	0	0	107.6	R139 I143	R139-S141 PolarHBondContact O-N 2.94Å; R139-S141 VanDerWaalsContact O-N 3.08Å; S141-I143 PolarHBondContact O-N 3.01Å
142	V	36	Very low	37.8	Very low	120 Å²	120	142.5 Å²	142.5	73%	0.727	77%	0.766	S	S	*	*			trans	-73.7	107.8	161.2	-176.5	0	0	0	0	103.2	T140 P144	T140-V142 PolarHBondContact O-N 3.02Å; V142-P144 WeakPolarHBondContact O-CD 3.41Å; V142-P144 VanDerWaalsContact O-N 3.12Å
143	I	40.3	Very low	38.2	Very low	143 Å²	143	143.5 Å²	143.5	73%	0.733	77%	0.771	S	S	*	*			trans	-43.1	120.6	175.1	-62.7	169.9	0	0	0	107.5	S141 G145	S141-I143 PolarHBondContact O-N 3.01Å; I143-G145 PolarHBondContact O-N 3.23Å
144	P	41.7	Very low	38.4	Very low	119 Å²	119	144.3 Å²	144.3	77%	0.773	78%	0.776	S	S	*	*			trans	-56.5	112	175.7	-24.3	33.8	0	0	0	108.7	V142	V142-P144 WeakPolarHBondContact O-CD 3.41Å; V142-P144 VanDerWaalsContact O-N 3.12Å
145	G	31.2	Very low	38.2	Very low	50 Å²	50	138.1 Å²	138.1	52%	0.515	77%	0.774	S	S	.	*			trans	-62.3	157.4	172.1	0	0	0	0	0	110.3	I143 V147	I143-G145 PolarHBondContact O-N 3.23Å; G145-V147 PolarHBondContact O-N 3.36Å
146	P	45.2	Very low	38.2	Very low	125 Å²	125	142.1 Å²	142.1	81%	0.812	78%	0.784	S	S	*	*			trans	-56.2	118.1	-179.5	23	-32.4	0	0	0	109.9	N148	P146-N148 PolarHBondContact O-N 3.46Å; P146-N148 VanDerWaalsContact O-N 3.14Å
147	V	41.9	Very low	38.2	Very low	124 Å²	124	145.5 Å²	145.5	75%	0.752	79%	0.786	S	S	*	*			trans	-70.7	107.9	171.8	177.2	0	0	0	0	106.6	G145 I149	G145-V147 PolarHBondContact O-N 3.36Å; V147-I149 VanDerWaalsContact C-N 3.31Å; V147-I149 PolarHBondContact O-N 2.95Å
148	N	39.1	Very low	38.1	Very low	145 Å²	145	143 Å²	143	78%	0.775	79%	0.79	S	S	*	*			trans	-63.6	95.1	168.1	-79.6	-33.4	0	0	0	108	P146 T150	P146-N148 PolarHBondContact O-N 3.46Å; P146-N148 VanDerWaalsContact O-N 3.14Å; N148-T150 PolarHBondContact O-N 3.41Å
149	I	43.2	Very low	38.3	Very low	160 Å²	160	139.2 Å²	139.2	82%	0.821	79%	0.786	S	S	*	*			trans	-69	87.1	162.5	6.5	173.2	0	0	0	106.1	V147 E151	V147-I149 VanDerWaalsContact C-N 3.31Å; V147-I149 PolarHBondContact O-N 2.95Å; I149-E151 PolarHBondContact O-N 3.29Å
150	T	39	Very low	38.3	Very low	118 Å²	118	137.1 Å²	137.1	72%	0.724	79%	0.789	S	S	*	*			trans	-56.6	124.5	163.9	16.8	0	0	0	0	108	N148 N152	N148-T150 PolarHBondContact O-N 3.41Å; T150-N152 VanDerWaalsContact C-N 3.31Å; T150-N152 PolarHBondContact O-N 3.47Å
151	E	38.5	Very low	38.1	Very low	192 Å²	192	139 Å²	139	90%	0.897	79%	0.793	S	S	*	*	S	Bend	trans	-47	89.8	169.7	-61.9	170.8	-173.3	0	0	110.6	I149	I149-E151 PolarHBondContact O-N 3.29Å
152	N	32.8	Very low	38	Very low	136 Å²	136	140.4 Å²	140.4	73%	0.727	79%	0.791	S	S	*	*			trans	-157.5	81.8	170.1	-103.3	-23.9	0	0	0	105.4	T150	T150-N152 VanDerWaalsContact C-N 3.31Å; T150-N152 PolarHBondContact O-N 3.47Å
153	N	38.3	Very low	38	Very low	162 Å²	162	144.7 Å²	144.7	87%	0.866	80%	0.8	S	S	*	*	S	Bend	trans	178.8	-0.8	151.1	-83.9	-32	0	0	0	113.6	G155	N153-G155 PolarHBondContact O-N 2.88Å
154	L	38.4	Very low	37.7	Very low	188 Å²	188	144.7 Å²	144.7	98%	0.984	80%	0.796	S	S	*	*			trans	-77.8	29.1	167.9	-118.2	80.6	0	0	0	113.3
155	G	31.5	Very low	37.3	Very low	72 Å²	72	145.3 Å²	145.3	74%	0.742	79%	0.793	S	S	*	*	S	Bend	trans	-96.5	10.1	-177.6	0	0	0	0	0	115.4	N153	N153-G155 PolarHBondContact O-N 2.88Å
156	R	38.3	Very low	37.9	Very low	230 Å²	230	150.7 Å²	150.7	87%	0.868	81%	0.81	S	S	*	*	S	Bend	trans	-138	9.8	-171.3	-69.6	-163.4	-170.8	-108	2.9	118.7
157	Q	36	Very low	37.5	Very low	192 Å²	192	150.8 Å²	150.8	90%	0.897	81%	0.808	S	S	*	*	S	Bend	trans	-139.7	49.9	178.3	-63.1	-76.7	5.6	0	0	112.1
158	A	36.6	Very low	37.3	Very low	94 Å²	94	153.5 Å²	153.5	78%	0.777	81%	0.813	S	S	*	*			trans	-149.2	66.1	169	0	0	0	0	0	110.2
159	S	39.1	Very low	37.3	Very low	116 Å²	116	154.5 Å²	154.5	81%	0.811	81%	0.813	S	S	*	*			trans	-161.3	53.2	168.6	-81.9	0	0	0	0	111.1
160	L	37.2	Very low	37.1	Very low	160 Å²	160	152.6 Å²	152.6	84%	0.838	81%	0.811	S	S	*	*			trans	-139.2	132.7	158.5	-68.6	174.5	0	0	0	104.9
161	I	35	Very low	37	Very low	163 Å²	163	153.7 Å²	153.7	84%	0.836	81%	0.812	S	S	*	*	S	Bend	trans	103	90.7	-176.8	-51.2	153.9	0	0	0	112.5
162	L	38.9	Very low	36.8	Very low	140 Å²	140	155.2 Å²	155.2	73%	0.733	81%	0.81	S	S	*	*			trans	155.5	73.8	145.2	-86.2	150.1	0	0	0	107.6	E164	L162-E164 HydrophobicContact CD2-CG 3.83Å; L162-E164 WeakPolarHBondContact CD2-OE1 3.4Å
163	K	36	Very low	36.8	Very low	210 Å²	210	154.8 Å²	154.8	91%	0.913	81%	0.807	S	S	*	*			trans	-118	86.4	152.6	-154.2	161.9	-174.5	176	0	106.5
164	E	34.6	Very low	36.7	Very low	142 Å²	142	152.1 Å²	152.1	66%	0.664	80%	0.802	S	S	*	*			trans	-58.8	131.3	174.9	-62.9	177.5	155.6	0	0	109.6	L162	L162-E164 HydrophobicContact CD2-CG 3.83Å; L162-E164 WeakPolarHBondContact CD2-OE1 3.4Å
165	N	33.4	Very low	36.3	Very low	133 Å²	133	149.2 Å²	149.2	71%	0.711	79%	0.792	S	S	*	*			trans	45.8	88.1	135.4	-52.6	-35.8	0	0	0	117.5
166	N	42.7	Very low	36.5	Very low	163 Å²	163	152.3 Å²	152.3	87%	0.872	79%	0.791	S	S	*	*			trans	-102.9	87.2	141.4	-73.2	-27.7	0	0	0	107.1	E168	N166-E168 VanDerWaalsContact C-N 3.32Å; N166-E168 PolarHBondContact O-N 3.35Å
167	V	38	Very low	36.1	Very low	126 Å²	126	148.7 Å²	148.7	76%	0.764	79%	0.789	S	S	*	*			trans	-77.5	91	164	176.7	0	0	0	0	105.6
168	E	37.8	Very low	36.1	Very low	182 Å²	182	145.8 Å²	145.8	85%	0.85	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-82.9	119.7	167	-166.2	166.7	-173.2	0	0	107.2	N166 P170	N166-E168 VanDerWaalsContact C-N 3.32Å; N166-E168 PolarHBondContact O-N 3.35Å; E168-P170 WeakPolarHBondContact O-CD 3.32Å
169	E	37.4	Very low	36	Very low	166 Å²	166	147.9 Å²	147.9	78%	0.776	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-56.1	126.8	-177.6	-73.9	-166.2	136.1	0	0	111.5	D171	E169-D171 PolarHBondContact O-N 3.37Å
170	P	40	Very low	35.8	Very low	119 Å²	119	150.7 Å²	150.7	77%	0.773	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-74.4	123.4	163.8	28.1	-29.1	0	0	0	109.6	E168	E168-P170 WeakPolarHBondContact O-CD 3.32Å
171	D	36.6	Very low	35.7	Very low	142 Å²	142	148.7 Å²	148.7	76%	0.759	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-48.5	138.2	177.8	-157.4	-1.2	0	0	0	112.8	E169 N173	E169-D171 PolarHBondContact O-N 3.37Å; D171-N173 VanDerWaalsContact CG-OD1 3.28Å; D171-N173 PolarHBondContact O-N 3.16Å; D171-N173 PolarHBondContact OD1-OD1 3.35Å
172	R	34.1	Very low	35.5	Very low	224 Å²	224	151.5 Å²	151.5	85%	0.845	78%	0.781	S	S	*	*			trans	-89.2	76.5	-168.5	-67.5	-162.5	-179	-158.9	2.7	111.8
173	N	32.2	Very low	35.4	Very low	126 Å²	126	151.1 Å²	151.1	67%	0.674	79%	0.785	S	S	*	*			trans	-166.6	85.4	175.6	6.5	32.3	0	0	0	112.6	D171	D171-N173 VanDerWaalsContact CG-OD1 3.28Å; D171-N173 PolarHBondContact O-N 3.16Å; D171-N173 PolarHBondContact OD1-OD1 3.35Å
174	S	37.2	Very low	35.6	Very low	107 Å²	107	147.5 Å²	147.5	75%	0.748	78%	0.775	S	S	*	*			trans	-159.3	97.9	134.1	-156.5	0	0	0	0	109.9	D176	S174-D176 PolarHBondContact O-N 3.02Å
175	T	29.8	Very low	35.9	Very low	126 Å²	126	148.1 Å²	148.1	77%	0.773	78%	0.783	S	S	*	*			trans	-75.2	102.2	166.3	-55.9	0	0	0	0	107.3
176	D	34.9	Very low	36.4	Very low	137 Å²	137	147.4 Å²	147.4	73%	0.733	78%	0.783	S	S	*	*			trans	-134.1	105	159	-87.1	-34.5	0	0	0	109.7	S174 V178	S174-D176 PolarHBondContact O-N 3.02Å; D176-V178 PolarHBondContact O-N 3.14Å
177	N	30.1	Very low	36.1	Very low	155 Å²	155	145.2 Å²	145.2	83%	0.829	78%	0.776	S	S	*	*			trans	-55.5	103	171	-77.9	-20.2	0	0	0	110.2
178	V	37.6	Very low	36.6	Very low	130 Å²	130	148.2 Å²	148.2	79%	0.788	78%	0.779	S	S	*	*			trans	-116.7	96.4	162.8	-174.3	0	0	0	0	109.1	D176	D176-V178 PolarHBondContact O-N 3.14Å
179	N	34.5	Very low	36.7	Very low	138 Å²	138	148.8 Å²	148.8	74%	0.738	78%	0.779	S	S	*	*			trans	16.3	107.6	155.9	-62.5	-30.4	0	0	0	117.7	T181	N179-T181 PolarHBondContact O-N 2.73Å; N179-T181 PolarHBondContact O-OG1 3.42Å
180	I	34.7	Very low	36.9	Very low	175 Å²	175	149.6 Å²	149.6	90%	0.897	78%	0.78	S	S	*	*			trans	-57.4	95.8	164.8	-58	159.8	0	0	0	108.1	R182	I180-R182 PolarHBondContact O-N 3.21Å
181	T	33.6	Very low	37.2	Very low	119 Å²	119	153.4 Å²	153.4	73%	0.73	78%	0.784	S	S	*	*			trans	-87.2	102.2	169.3	-42.3	0	0	0	0	106.8	N179 T183	N179-T181 PolarHBondContact O-N 2.73Å; N179-T181 PolarHBondContact O-OG1 3.42Å; T181-T183 PolarHBondContact O-N 2.84Å
182	R	32.4	Very low	37.4	Very low	222 Å²	222	154.5 Å²	154.5	84%	0.838	78%	0.784	S	S	*	*			trans	-37.6	105	172.2	-169.1	179	-170.3	171	1.7	110.9	I180	I180-R182 PolarHBondContact O-N 3.21Å
183	T	36.9	Very low	37.7	Very low	132 Å²	132	155.6 Å²	155.6	81%	0.81	79%	0.788	S	S	*	*			trans	-83.1	117.1	171.9	34.3	0	0	0	0	108.7	T181 D185	T181-T183 PolarHBondContact O-N 2.84Å; T183-D185 PolarHBondContact O-N 2.69Å
184	D	40.1	Very low	38.4	Very low	133 Å²	133	155.9 Å²	155.9	71%	0.711	80%	0.795	S	S	*	*			trans	-56.4	133.2	178.6	-63.8	-50.8	0	0	0	111.4	V186	D184-V186 PolarHBondContact O-N 2.98Å
185	D	40.1	Very low	38.8	Very low	155 Å²	155	154.6 Å²	154.6	83%	0.829	79%	0.791	S	S	*	*			trans	-56.2	93.2	173.5	-85.8	-44	0	0	0	110.6	T183 T187	T183-D185 PolarHBondContact O-N 2.69Å; D185-T187 PolarHBondContact O-N 3.47Å
186	V	43	Very low	39.6	Very low	118 Å²	118	153.5 Å²	153.5	72%	0.715	79%	0.789	S	S	*	*			trans	-75.3	80.1	168.2	-174.7	0	0	0	0	107.6	D184 K188	D184-V186 PolarHBondContact O-N 2.98Å; V186-K188 VanDerWaalsContact C-N 3.3Å; V186-K188 HydrophobicContact CG1-CG 3.98Å; V186-K188 PolarHBondContact O-N 3.36Å
187	T	37.9	Very low	40.1	Very low	118 Å²	118	153.9 Å²	153.9	72%	0.724	79%	0.789	S	S	*	*			trans	-62.5	94.2	165.1	50.2	0	0	0	0	108.5	D185 K189	D185-T187 PolarHBondContact O-N 3.47Å; T187-K189 VanDerWaalsContact C-N 3.33Å; T187-K189 PolarHBondContact O-N 2.85Å
188	K	48.3	Very low	40.6	Very low	188 Å²	188	153.1 Å²	153.1	82%	0.817	79%	0.785	S	S	*	*			trans	-69.9	89.7	172.3	-65.3	-177.1	-176.4	176.9	0	108.3	V186 K190	V186-K188 VanDerWaalsContact C-N 3.3Å; V186-K188 HydrophobicContact CG1-CG 3.98Å; V186-K188 PolarHBondContact O-N 3.36Å; K188-K190 PolarHBondContact O-N 2.9Å
189	K	40.4	Very low	41.1	Very low	194 Å²	194	154.5 Å²	154.5	84%	0.843	78%	0.783	S	S	*	*			trans	-60	108.8	166.5	-82.4	-175	176.2	178.2	0	108.4	T187 K191	T187-K189 VanDerWaalsContact C-N 3.33Å; T187-K189 PolarHBondContact O-N 2.85Å; K189-K191 PolarHBondContact O-N 3.21Å
190	K	40.7	Very low	41.6	Very low	184 Å²	184	156 Å²	156	80%	0.8	79%	0.786	S	S	*	*			trans	-63.9	102.3	176.3	-153	175	-174.3	178.4	0	107.9	K188 H192	K188-K190 PolarHBondContact O-N 2.9Å; K190-H192 PolarHBondContact O-N 3.27Å; K190-H192 VanDerWaalsContact O-N 3.14Å
191	K	45.8	Very low	42.1	Very low	199 Å²	199	152.5 Å²	152.5	87%	0.865	77%	0.768	S	S	*	*			trans	-69.2	107	173.8	-72	-175.2	179	-178.9	0	108	K189 R193	K189-K191 PolarHBondContact O-N 3.21Å; K191-R193 PolarHBondContact O-N 3.01Å
192	H	40.5	Very low	42.8	Very low	165 Å²	165	151.8 Å²	151.8	76%	0.764	76%	0.76	S	S	*	*			trans	-63.1	118	167.1	-71.3	-82.7	0	0	0	108.1	K190 T194	K190-H192 PolarHBondContact O-N 3.27Å; K190-H192 VanDerWaalsContact O-N 3.14Å; H192-T194 PolarHBondContact O-N 3.09Å; H192-T194 VanDerWaalsContact O-N 3.16Å
193	R	41.5	Very low	43.5	Very low	246 Å²	246	146.3 Å²	146.3	93%	0.928	75%	0.747	S	S	*	*			trans	-72.8	102.2	166.7	-77	175.7	78.9	177.2	3.4	106.7	K191 A195	K191-R193 PolarHBondContact O-N 3.01Å; R193-A195 VanDerWaalsContact C-N 3.35Å; R193-A195 PolarHBondContact O-N 3.36Å; R193-A195 VanDerWaalsContact O-N 3.12Å
194	T	45.8	Very low	44.1	Very low	132 Å²	132	143.9 Å²	143.9	81%	0.81	73%	0.732	S	S	*	*			trans	-72.4	96.4	162	-37.9	0	0	0	0	106.1	H192 S196	H192-T194 PolarHBondContact O-N 3.09Å; H192-T194 VanDerWaalsContact O-N 3.16Å; T194-S196 PolarHBondContact O-N 3.16Å
195	A	46.4	Very low	44.5	Very low	81 Å²	81	141.5 Å²	141.5	67%	0.669	72%	0.723	S	S	*	*			trans	-69.4	112.6	167.5	0	0	0	0	0	106.7	R193 I197	R193-A195 VanDerWaalsContact C-N 3.35Å; R193-A195 PolarHBondContact O-N 3.36Å; R193-A195 VanDerWaalsContact O-N 3.12Å; A195-I197 PolarHBondContact O-N 3.3Å; A195-I197 VanDerWaalsContact O-N 3.1Å
196	S	45.6	Very low	44.9	Very low	103 Å²	103	141 Å²	141	72%	0.72	71%	0.713	S	S	*	*			trans	-59.3	115.7	169.4	-65	0	0	0	0	107.9	T194 N198	T194-S196 PolarHBondContact O-N 3.16Å; S196-N198 PolarHBondContact O-N 3.16Å
197	I	45.3	Very low	45.1	Very low	145 Å²	145	139.8 Å²	139.8	74%	0.744	70%	0.702	S	S	*	*			trans	-72.2	78.5	173.9	-39	164.7	0	0	0	105.7	A195 D201	A195-I197 PolarHBondContact O-N 3.3Å; A195-I197 VanDerWaalsContact O-N 3.1Å; I197-D201 WeakPolarHBondContact CG2-OD2 3.41Å
198	N	41.1	Very low	45.7	Very low	138 Å²	138	139 Å²	139	74%	0.738	69%	0.692	S	S	*	*			trans	-105.2	126.3	177.9	-117.2	-3.3	0	0	0	109.2	S196 Q200	S196-N198 PolarHBondContact O-N 3.16Å; N198-Q200 PolarHBondContact O-N 3.02Å
199	E	47.6	Very low	45.7	Very low	159 Å²	159	134.3 Å²	134.3	74%	0.743	68%	0.679	S	S	*	*	S	Bend	trans	80.3	-27.3	159.2	-108.4	169.6	176.1	0	0	121.4
200	Q	45	Very low	46	Very low	171 Å²	171	132.6 Å²	132.6	80%	0.799	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-28.4	-174.2	-139.3	150.4	-7.8	0	0	114.3	N198 N202 N203	N198-Q200 PolarHBondContact O-N 3.02Å; Q200-N202 VanDerWaalsContact C-N 3.25Å; Q200-N202 PolarHBondContact O-N 3.29Å; Q200-N203 PolarHBondContact O-N 3.04Å
201	D	45.4	Very low	46.1	Very low	100 Å²	100	130.5 Å²	130.5	54%	0.535	66%	0.664	S	S	.	*	H	α-helix	trans	-73.9	-13.9	178.9	-71	-20.3	0	0	0	113.9	I197 N203 T205	I197-D201 WeakPolarHBondContact CG2-OD2 3.41Å; D201-N203 PolarHBondContact O-N 3.31Å; D201-T205 PolarHBondContact O-N 3.27Å; D201-T205 PolarHBondContact O-OG1 3.48Å; D201-T205 VanDerWaalsContact O-OG1 3.09Å
202	N	48.6	Very low	46.4	Very low	105 Å²	105	125.3 Å²	125.3	56%	0.561	65%	0.649	S	S	*	*	H	α-helix	trans	-70.3	-21	174.4	-76.1	-15.3	0	0	0	112.5	Q200 K206	Q200-N202 VanDerWaalsContact C-N 3.25Å; Q200-N202 PolarHBondContact O-N 3.29Å; N202-K206 WeakPolarHBondContact O-CG 3.31Å; N202-K206 PolarHBondContact O-N 2.78Å
203	N	47.8	Very low	46.8	Very low	106 Å²	106	120.8 Å²	120.8	57%	0.567	64%	0.636	S	S	*	*	H	α-helix	trans	-79.8	-40.6	177.6	-154.7	1.5	0	0	0	111.7	Q200 D201 T205 K206 I207	Q200-N203 PolarHBondContact O-N 3.04Å; D201-N203 PolarHBondContact O-N 3.31Å; N203-T205 VanDerWaalsContact C-N 3.3Å; N203-T205 PolarHBondContact O-N 3.49Å; N203-K206 PolarHBondContact O-N 3.12Å; N203-K206 VanDerWaalsContact O-N 3.14Å; N203-I207 WeakPolarHBondContact O-CG1 3.5Å; N203-I207 PolarHBondContact O-N 3.15Å
204	V	48	Very low	46.9	Very low	82 Å²	82	114.6 Å²	114.6	50%	0.497	62%	0.622	S	S	.	*	H	α-helix	trans	-61	-42.7	177.2	-175.1	0	0	0	0	110.6	K206 I207 I208	V204-K206 VanDerWaalsContact C-N 3.3Å; V204-K206 PolarHBondContact O-N 3.48Å; V204-I207 PolarHBondContact O-N 3.36Å; V204-I207 VanDerWaalsContact O-N 3.16Å; V204-I208 HydrophobicContact CG1-CD1 4.08Å; V204-I208 WeakPolarHBondContact O-CG1 3.32Å; V204-I208 PolarHBondContact O-N 2.95Å
205	T	49.6	Very low	46.9	Very low	83 Å²	83	115.6 Å²	115.6	51%	0.509	62%	0.617	S	S	.	*	H	α-helix	trans	-63.1	-36.3	178.3	-50.6	0	0	0	0	111.9	D201 N203 T209	D201-T205 PolarHBondContact O-N 3.27Å; D201-T205 PolarHBondContact O-OG1 3.48Å; D201-T205 VanDerWaalsContact O-OG1 3.09Å; N203-T205 VanDerWaalsContact C-N 3.3Å; N203-T205 PolarHBondContact O-N 3.49Å; T205-T209 PolarHBondContact O-N 3.43Å; T205-T209 PolarHBondContact O-OG1 2.77Å
206	K	47.6	Very low	46.9	Very low	144 Å²	144	117.3 Å²	117.3	63%	0.626	62%	0.615	S	S	*	*	H	α-helix	trans	-68.7	-36.9	175	-76.9	179.6	-177.8	178.4	0	112.7	N202 N203 V204 T209 K210	N202-K206 WeakPolarHBondContact O-CG 3.31Å; N202-K206 PolarHBondContact O-N 2.78Å; N203-K206 PolarHBondContact O-N 3.12Å; N203-K206 VanDerWaalsContact O-N 3.14Å; V204-K206 VanDerWaalsContact C-N 3.3Å; V204-K206 PolarHBondContact O-N 3.48Å; K206-T209 PolarHBondContact O-N 2.93Å; K206-K210 PolarHBondContact O-N 3.1Å
207	I	48.9	Very low	46.9	Very low	93 Å²	93	117.8 Å²	117.8	48%	0.477	61%	0.61	S	S	.	*	H	α-helix	trans	-65.3	-44.8	176.4	-63.9	166	0	0	0	110.1	N203 V204 T209 K210 H211	N203-I207 WeakPolarHBondContact O-CG1 3.5Å; N203-I207 PolarHBondContact O-N 3.15Å; V204-I207 PolarHBondContact O-N 3.36Å; V204-I207 VanDerWaalsContact O-N 3.16Å; I207-T209 VanDerWaalsContact C-N 3.34Å; I207-T209 PolarHBondContact O-N 2.93Å; I207-K210 PolarHBondContact O-N 3.29Å; I207-H211 PolarHBondContact O-CD2 3.16Å; I207-H211 PolarHBondContact O-N 3.23Å
208	I	49.7	Very low	46.7	Very low	101 Å²	101	118.3 Å²	118.3	52%	0.518	61%	0.609	S	S	.	*	H	α-helix	trans	-63.8	-41.2	177.9	-61.9	169.8	0	0	0	110.7	V204 K210 H211 V212	V204-I208 HydrophobicContact CG1-CD1 4.08Å; V204-I208 WeakPolarHBondContact O-CG1 3.32Å; V204-I208 PolarHBondContact O-N 2.95Å; I208-K210 VanDerWaalsContact C-N 3.31Å; I208-K210 PolarHBondContact O-N 2.86Å; I208-H211 PolarHBondContact O-N 3.12Å; I208-H211 VanDerWaalsContact O-N 3.14Å; I208-V212 HydrophobicContact CG2-CG2 4.32Å; I208-V212 PolarHBondContact O-N 3.24Å; I208-V212 VanDerWaalsContact O-N 3.16Å
209	T	48.7	Very low	46.7	Very low	89 Å²	89	121.8 Å²	121.8	55%	0.546	61%	0.612	S	S	.	*	H	α-helix	trans	-64.5	-34.9	-177.4	-53.8	0	0	0	0	112.5	T205 K206 I207 S213	T205-T209 PolarHBondContact O-N 3.43Å; T205-T209 PolarHBondContact O-OG1 2.77Å; K206-T209 PolarHBondContact O-N 2.93Å; I207-T209 VanDerWaalsContact C-N 3.34Å; I207-T209 PolarHBondContact O-N 2.93Å; T209-S213 PolarHBondContact O-N 3.19Å
210	K	46.6	Very low	46.7	Very low	159 Å²	159	120.1 Å²	120.1	69%	0.691	61%	0.607	S	S	*	*	H	α-helix	trans	-68.2	-35	175.9	-73.3	-169.3	-179.8	-176.9	0	112.6	K206 I207 I208	K206-K210 PolarHBondContact O-N 3.1Å; I207-K210 PolarHBondContact O-N 3.29Å; I208-K210 VanDerWaalsContact C-N 3.31Å; I208-K210 PolarHBondContact O-N 2.86Å
211	H	43	Very low	46.7	Very low	139 Å²	139	122.3 Å²	122.3	64%	0.644	61%	0.607	S	S	*	*	H	α-helix	trans	-75.2	-29.8	179.9	-76.6	-58.9	0	0	0	113.7	I207 I208	I207-H211 PolarHBondContact O-CD2 3.16Å; I207-H211 PolarHBondContact O-N 3.23Å; I208-H211 PolarHBondContact O-N 3.12Å; I208-H211 VanDerWaalsContact O-N 3.14Å
212	V	50.9	Low	46.6	Very low	90 Å²	90	124.3 Å²	124.3	55%	0.545	62%	0.618	S	S	.	*	H	α-helix	trans	-76.5	-33.7	176.3	-175.3	0	0	0	0	111.9	I208 N214 Q215	I208-V212 HydrophobicContact CG2-CG2 4.32Å; I208-V212 PolarHBondContact O-N 3.24Å; I208-V212 VanDerWaalsContact O-N 3.16Å; V212-N214 PolarHBondContact O-N 3.21Å; V212-Q215 PolarHBondContact O-N 3.14Å
213	S	48.8	Very low	46.4	Very low	71 Å²	71	124 Å²	124	50%	0.497	62%	0.624	S	S	.	*	H	α-helix	trans	-65.7	-35.9	-179.5	-171.4	0	0	0	0	113.2	T209 Q215	T209-S213 PolarHBondContact O-N 3.19Å; S213-Q215 VanDerWaalsContact C-N 3.33Å; S213-Q215 PolarHBondContact O-N 3.02Å
214	N	44	Very low	46	Very low	116 Å²	116	127 Å²	127	62%	0.62	64%	0.635	S	S	*	*	H	α-helix	trans	-73.2	-21.9	-177	-77.9	-3.8	0	0	0	114	V212	V212-N214 PolarHBondContact O-N 3.21Å
215	Q	45.5	Very low	45.8	Very low	153 Å²	153	127.9 Å²	127.9	72%	0.715	65%	0.645	S	S	*	*	H	α-helix	trans	-78.3	-26.8	-180	-66.8	-133.6	-30.6	0	0	113.7	V212 S213	V212-Q215 PolarHBondContact O-N 3.14Å; S213-Q215 VanDerWaalsContact C-N 3.33Å; S213-Q215 PolarHBondContact O-N 3.02Å
216	N	46.9	Very low	45.4	Very low	116 Å²	116	132.4 Å²	132.4	62%	0.62	66%	0.66	S	S	*	*	H	α-helix	trans	-77.4	-22.8	179.9	-80.7	-17.4	0	0	0	113.5
217	N	45.9	Very low	45.1	Very low	114 Å²	114	136 Å²	136	61%	0.61	67%	0.671	S	S	*	*	H	α-helix	trans	-87.8	-21.7	179.9	-75.3	-15.9	0	0	0	113.9
218	E	41.2	Very low	44.7	Very low	155 Å²	155	136.6 Å²	136.6	72%	0.724	68%	0.684	S	S	*	*	H	α-helix	trans	-78.6	-27.3	177.5	-114.7	177.9	177.5	0	0	112.8	I220	E218-I220 VanDerWaalsContact C-N 3.29Å; E218-I220 PolarHBondContact O-N 3.05Å
219	R	41.5	Very low	44.5	Very low	212 Å²	212	139 Å²	139	80%	0.8	70%	0.697	S	S	*	*	H	α-helix	trans	-69.8	-23.3	-178.3	-154.6	173.4	-164.9	170.9	4.9	113.8
220	I	47.6	Very low	44.5	Very low	124 Å²	124	142.8 Å²	142.8	64%	0.636	71%	0.714	S	S	*	*	H	α-helix	trans	-82.5	-25.8	-176.4	-57.3	178.4	0	0	0	112.2	E218 N222	E218-I220 VanDerWaalsContact C-N 3.29Å; E218-I220 PolarHBondContact O-N 3.05Å; I220-N222 PolarHBondContact O-N 2.93Å
221	R	45	Very low	44.6	Very low	216 Å²	216	144.3 Å²	144.3	82%	0.815	72%	0.721	S	S	*	*	H	α-helix	trans	-77.4	-20.6	-175.5	-74.6	-167.1	-176.5	-169.5	2.6	115.3
222	N	41.6	Very low	45.3	Very low	143 Å²	143	143.2 Å²	143.2	77%	0.765	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	3.4	-175.9	-71.8	-8.4	0	0	0	114.9	I220	I220-N222 PolarHBondContact O-N 2.93Å
223	S	44.7	Very low	45.4	Very low	97 Å²	97	144.5 Å²	144.5	68%	0.678	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	-2.5	-179	-51.8	0	0	0	0	114.6
224	Q	40.8	Very low	45.8	Very low	170 Å²	170	145.6 Å²	145.6	79%	0.794	73%	0.733	S	S	*	*	S	Bend	trans	-105.4	3.7	-170.7	-160.3	155.8	-7.1	0	0	115.3
225	S	42.2	Very low	46.4	Very low	101 Å²	101	148.1 Å²	148.1	71%	0.706	74%	0.741	S	S	*	*	S	Bend	trans	-114.7	38.1	-175.1	62.3	0	0	0	0	115.1
226	Q	42	Very low	46.8	Very low	178 Å²	178	149.4 Å²	149.4	83%	0.832	75%	0.745	S	S	*	*			trans	-143.8	56.8	165.6	-69.7	-161	-5.9	0	0	112.6
227	Y	42.2	Very low	47.1	Very low	220 Å²	220	149.5 Å²	149.5	86%	0.863	74%	0.741	S	S	*	*			trans	-131.7	74.6	161.6	-74.3	-78.9	0	0	0	108.7
228	S	39.9	Very low	47.6	Very low	105 Å²	105	150.6 Å²	150.6	73%	0.734	74%	0.74	S	S	*	*			trans	-155.6	103.8	168.2	-67.8	0	0	0	0	108
229	N	46.1	Very low	48.2	Very low	151 Å²	151	150.9 Å²	150.9	81%	0.807	74%	0.742	S	S	*	*			trans	156.8	9.9	130.7	-73.2	-27.2	0	0	0	115.7	K231	N229-K231 PolarHBondContact O-N 2.85Å
230	D	47.5	Very low	48.8	Very low	169 Å²	169	147.5 Å²	147.5	90%	0.904	74%	0.74	S	S	*	*			trans	-82.4	78.3	166.2	-66.2	-20.6	0	0	0	109.3
231	K	49.8	Very low	48.9	Very low	190 Å²	190	146.6 Å²	146.6	83%	0.826	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-60.9	128.6	162.8	-83.4	-175.1	178.5	-179.9	0	107.4	N229 L233	N229-K231 PolarHBondContact O-N 2.85Å; K231-L233 PolarHBondContact O-N 2.89Å
232	P	56.7	Low	48.9	Very low	116 Å²	116	143.5 Å²	143.5	75%	0.753	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-60.7	125.3	175.7	22.6	-30.5	0	0	0	109.5	T234	P232-T234 PolarHBondContact O-N 2.84Å
233	L	53.4	Low	48.9	Very low	117 Å²	117	148.7 Å²	148.7	61%	0.613	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-51	124.6	169.8	-73.5	159.1	0	0	0	108.7	K231 E237	K231-L233 PolarHBondContact O-N 2.89Å; L233-E237 HydrophobicContact CD2-CB 4.36Å; L233-E237 WeakPolarHBondContact CD2-OE2 3.48Å
234	T	56.5	Low	49.1	Very low	95 Å²	95	151.3 Å²	151.3	58%	0.583	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-69.9	147	176.2	43.3	0	0	0	0	109.8	P232 K236 E237	P232-T234 PolarHBondContact O-N 2.84Å; T234-K236 PolarHBondContact O-N 3.07Å; T234-E237 PolarHBondContact O-N 3.33Å
235	E	57.3	Low	49.5	Very low	168 Å²	168	150.3 Å²	150.3	79%	0.785	77%	0.765	S	S	*	*	H	α-helix	trans	-50.3	-29.1	-176	-100.8	172.5	166.6	0	0	113.9	E237 K238	E235-E237 VanDerWaalsContact C-N 3.27Å; E235-E237 PolarHBondContact O-N 3.48Å; E235-K238 PolarHBondContact O-N 3.06Å
236	K	54.2	Low	49.9	Very low	181 Å²	181	153 Å²	153	79%	0.787	77%	0.768	S	S	*	*	H	α-helix	trans	-66	-23.9	176.9	-67.6	-148.1	174.9	-168.3	0	114.7	T234	T234-K236 PolarHBondContact O-N 3.07Å
237	E	53.4	Low	50.4	Low	118 Å²	118	151.5 Å²	151.5	55%	0.551	76%	0.764	S	S	*	*	H	α-helix	trans	-85.1	-18.5	176	-71.4	177.4	155.9	0	0	112.3	L233 T234 E235	L233-E237 HydrophobicContact CD2-CB 4.36Å; L233-E237 WeakPolarHBondContact CD2-OE2 3.48Å; T234-E237 PolarHBondContact O-N 3.33Å; E235-E237 VanDerWaalsContact C-N 3.27Å; E235-E237 PolarHBondContact O-N 3.48Å
238	K	56	Low	50.9	Low	136 Å²	136	147.3 Å²	147.3	59%	0.591	76%	0.758	S	S	*	*	H	α-helix	trans	-76.6	-31.7	176.4	-73.4	-176.3	178.6	177.5	0	113	E235 N240 S241	E235-K238 PolarHBondContact O-N 3.06Å; K238-N240 PolarHBondContact O-N 2.91Å; K238-S241 PolarHBondContact O-N 3.4Å
239	E	54.8	Low	51.6	Low	162 Å²	162	150.1 Å²	150.1	76%	0.757	76%	0.76	S	S	*	*	H	α-helix	trans	-72.4	-25.3	-179.3	-87.5	-177.1	159.1	0	0	113.9	S241	E239-S241 VanDerWaalsContact C-N 3.33Å; E239-S241 PolarHBondContact O-N 3.36Å
240	N	52.7	Low	52	Low	141 Å²	141	150 Å²	150	75%	0.754	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-1.9	177.7	-89.2	-5	0	0	0	114.5	K238	K238-N240 PolarHBondContact O-N 2.91Å
241	S	49.4	Very low	52.4	Low	105 Å²	105	148.5 Å²	148.5	73%	0.734	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-2.1	178.4	-151.7	0	0	0	0	113.1	K238 E239	K238-S241 PolarHBondContact O-N 3.4Å; E239-S241 VanDerWaalsContact C-N 3.33Å; E239-S241 PolarHBondContact O-N 3.36Å
242	I	45.8	Very low	52.6	Low	150 Å²	150	145.1 Å²	145.1	77%	0.769	74%	0.738	S	S	*	*			trans	-125.8	72.7	178	-47.7	174.9	0	0	0	108.5
243	Q	41.4	Very low	52.3	Low	252 Å²	252	147.7 Å²	147.7	100%	1.178	74%	0.737	S	S	*	*			trans	-135.2	0	159.4	-103.3	-174.5	-4.8	0	0	109.9

Retrieved 243 of 243 residues in 271.7 ms (Link to these results)

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