A0A5K4F3G8_SCHMA Loading...

Miff domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F3G8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 188 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.3	Very low	56	Low	221 Å²	221	152.6 Å²	152.6	100%	1.089	76%	0.761	S	S	*	*				0	88.4	0	-73	-58	-176.9	0	0	104.9
2	D	45.3	Very low	56.9	Low	148 Å²	148	149 Å²	149	79%	0.791	74%	0.74	S	S	*	*			trans	-97	133.4	-142.8	-55.4	-26.9	0	0	0	111.4	L4	D2-L4 PolarHBondContact O-N 3.04Å; D2-L4 VanDerWaalsContact O-N 3.12Å
3	H	52.7	Low	57.6	Low	179 Å²	179	144.2 Å²	144.2	83%	0.829	72%	0.717	S	S	*	*			trans	-61.8	105.3	-171.4	-67.8	-83.8	0	0	0	112	Y5	H3-Y5 PolarHBondContact O-N 3.08Å
4	L	54.9	Low	58.3	Low	173 Å²	173	141.6 Å²	141.6	91%	0.906	71%	0.707	S	S	*	*			trans	-84.5	14.8	170.7	-99.6	151.9	0	0	0	113.7	D2 S6	D2-L4 PolarHBondContact O-N 3.04Å; D2-L4 VanDerWaalsContact O-N 3.12Å; L4-S6 PolarHBondContact O-N 3.42Å
5	Y	54.3	Low	58.4	Low	204 Å²	204	141.8 Å²	141.8	80%	0.8	70%	0.698	S	S	*	*			trans	-87.4	108	171	-74.2	-82.5	0	0	0	109.1	H3 K7	H3-Y5 PolarHBondContact O-N 3.08Å; Y5-K7 PolarHBondContact O-N 3.13Å
6	S	55.3	Low	58.8	Low	108 Å²	108	136.8 Å²	136.8	76%	0.755	68%	0.678	S	S	*	*			trans	-54	106.3	156.6	-76.2	0	0	0	0	106.9	L4 L8	L4-S6 PolarHBondContact O-N 3.42Å; S6-L8 PolarHBondContact O-N 3.09Å
7	K	57.8	Low	59.4	Low	202 Å²	202	134.4 Å²	134.4	88%	0.878	67%	0.668	S	S	*	*			trans	-61.8	93.4	166.6	-91	179.7	171.7	177.5	0	106.5	Y5 S9	Y5-K7 PolarHBondContact O-N 3.13Å; K7-S9 PolarHBondContact O-N 3.46Å
8	L	59.5	Low	60.1	Low	84 Å²	84	130.8 Å²	130.8	44%	0.44	65%	0.652	S	S	.	*			trans	-54	129.7	160.2	-85.3	87.8	0	0	0	106.5	S6 E12	S6-L8 PolarHBondContact O-N 3.09Å; L8-E12 HydrophobicContact CB-CB 4.26Å; L8-E12 HydrophobicContact CD2-CB 3.93Å; L8-E12 HydrophobicContact CG-CB 4.29Å
9	S	65.3	Low	60.5	Low	70 Å²	70	127.9 Å²	127.9	49%	0.49	64%	0.638	S	S	.	*			trans	-57.5	146.6	167.9	175.8	0	0	0	0	108.4	K7 Y11 E12 L13	K7-S9 PolarHBondContact O-N 3.46Å; S9-Y11 PolarHBondContact O-N 3.33Å; S9-E12 PolarHBondContact O-N 3.49Å; S9-L13 PolarHBondContact O-N 2.79Å
10	T	66.2	Low	60.9	Low	114 Å²	114	126.9 Å²	126.9	70%	0.699	64%	0.635	S	S	*	*	H	α-helix	trans	-49.2	-34.2	175.5	-27.6	0	0	0	0	111.6	L13 D14	T10-L13 PolarHBondContact O-N 3.32Å; T10-D14 PolarHBondContact O-N 3.42Å
11	Y	63.5	Low	61.4	Low	176 Å²	176	129 Å²	129	69%	0.69	64%	0.64	S	S	*	*	H	α-helix	trans	-66	-36.1	175.8	-172.2	-94.3	0	0	0	114.3	S9 Y15	S9-Y11 PolarHBondContact O-N 3.33Å; Y11-Y15 PolarHBondContact O-N 3.38Å
12	E	66.7	Low	63	Low	109 Å²	109	125.7 Å²	125.7	51%	0.509	62%	0.62	S	S	.	*	H	α-helix	trans	-73.8	-32.5	177.5	-70.6	-166.9	147	0	0	111.8	L8 S9 Y15 T16	L8-E12 HydrophobicContact CB-CB 4.26Å; L8-E12 HydrophobicContact CD2-CB 3.93Å; L8-E12 HydrophobicContact CG-CB 4.29Å; S9-E12 PolarHBondContact O-N 3.49Å; E12-Y15 PolarHBondContact O-N 3.45Å; E12-T16 PolarHBondContact O-N 3.41Å; E12-T16 VanDerWaalsContact O-N 3.07Å; E12-T16 PolarHBondContact O-OG1 3.09Å
13	L	65.7	Low	64	Low	86 Å²	86	125.7 Å²	125.7	45%	0.45	62%	0.617	S	S	.	*	H	α-helix	trans	-67.8	-44.6	179.4	-145	147.5	0	0	0	110.9	S9 T10 Y15 T16 D17	S9-L13 PolarHBondContact O-N 2.79Å; T10-L13 PolarHBondContact O-N 3.32Å; L13-Y15 VanDerWaalsContact C-N 3.28Å; L13-Y15 PolarHBondContact O-N 3.32Å; L13-T16 PolarHBondContact O-N 3.23Å; L13-T16 PolarHBondContact O-OG1 3.05Å; L13-D17 PolarHBondContact O-N 3Å; L13-D17 VanDerWaalsContact O-N 3.07Å
14	D	67	Low	64.7	Low	108 Å²	108	125 Å²	125	58%	0.578	61%	0.607	S	S	*	*	H	α-helix	trans	-60	-37.6	174.2	-74.8	-19.1	0	0	0	112.2	T10 D18	T10-D14 PolarHBondContact O-N 3.42Å; D14-D18 PolarHBondContact O-N 2.69Å; D14-D18 VanDerWaalsContact O-N 3.09Å
15	Y	60.9	Low	65.2	Low	145 Å²	145	122.3 Å²	122.3	57%	0.569	60%	0.597	S	S	*	*	H	α-helix	trans	-69.4	-38.9	178.6	-157.1	-98.5	0	0	0	112.3	Y11 E12 L13 I19	Y11-Y15 PolarHBondContact O-N 3.38Å; E12-Y15 PolarHBondContact O-N 3.45Å; L13-Y15 VanDerWaalsContact C-N 3.28Å; L13-Y15 PolarHBondContact O-N 3.32Å; Y15-I19 HydrophobicContact CD1-CD1 3.64Å; Y15-I19 HydrophobicContact CD1-CG1 4.44Å; Y15-I19 HydrophobicContact CE1-CD1 3.48Å; Y15-I19 VanDerWaalsContact CE1-CD1 3.48Å; Y15-I19 HydrophobicContact CE1-CG1 4.35Å; Y15-I19 WeakPolarHBondContact O-CG1 3.35Å; Y15-I19 PolarHBondContact O-N 2.95Å
16	T	64.5	Low	65.7	Low	62 Å²	62	117.1 Å²	117.1	38%	0.38	59%	0.589	S	S	.	*	H	α-helix	trans	-68	-36.1	176.4	50	0	0	0	0	112.8	E12 L13 N20	E12-T16 PolarHBondContact O-N 3.41Å; E12-T16 VanDerWaalsContact O-N 3.07Å; E12-T16 PolarHBondContact O-OG1 3.09Å; L13-T16 PolarHBondContact O-N 3.23Å; L13-T16 PolarHBondContact O-OG1 3.05Å; T16-N20 WeakPolarHBondContact O-CB 3.43Å; T16-N20 VanDerWaalsContact O-CG 3.3Å; T16-N20 PolarHBondContact O-N 3.41Å; T16-N20 VanDerWaalsContact O-N 3.12Å; T16-N20 PolarHBondContact O-ND2 3.35Å; T16-N20 VanDerWaalsContact O-ND2 3.14Å
17	D	69.3	Low	66.1	Low	95 Å²	95	119.4 Å²	119.4	51%	0.508	59%	0.587	S	S	.	*	H	α-helix	trans	-72	-37.4	177.5	-81.8	-14	0	0	0	112.5	L13 N20 K21	L13-D17 PolarHBondContact O-N 3Å; L13-D17 VanDerWaalsContact O-N 3.07Å; D17-N20 PolarHBondContact O-N 3.28Å; D17-K21 WeakPolarHBondContact O-CB 3.35Å; D17-K21 PolarHBondContact O-N 2.96Å
18	D	71.2	Confident	66.1	Low	70 Å²	70	118.4 Å²	118.4	37%	0.374	58%	0.583	S	S	.	*	H	α-helix	trans	-65.5	-41.2	176.1	-173	46.2	0	0	0	112.2	D14 K21 K22	D14-D18 PolarHBondContact O-N 2.69Å; D14-D18 VanDerWaalsContact O-N 3.09Å; D18-K21 PolarHBondContact O-N 3.35Å; D18-K22 WeakPolarHBondContact O-CB 3.47Å; D18-K22 WeakPolarHBondContact O-CG 3.39Å; D18-K22 PolarHBondContact O-N 2.98Å; D18-K22 WeakPolarHBondContact OD1-CE 3.18Å; D18-K22 IonicContact OD1-NZ 3.35Å; D18-K22 PolarHBondContact OD1-NZ 3.48Å; D18-K22 WeakPolarHBondContact OD2-CE 3.5Å; D18-K22 IonicContact OD2-NZ 2.69Å; D18-K22 PolarHBondContact OD2-NZ 2.76Å
19	I	68.2	Low	65.9	Low	77 Å²	77	122.3 Å²	122.3	40%	0.395	60%	0.604	S	S	.	*	H	α-helix	trans	-63.1	-46.9	174.9	-69.4	171.7	0	0	0	110.6	Y15 K21 K22 M23	Y15-I19 HydrophobicContact CD1-CD1 3.64Å; Y15-I19 HydrophobicContact CD1-CG1 4.44Å; Y15-I19 HydrophobicContact CE1-CD1 3.48Å; Y15-I19 VanDerWaalsContact CE1-CD1 3.48Å; Y15-I19 HydrophobicContact CE1-CG1 4.35Å; Y15-I19 WeakPolarHBondContact O-CG1 3.35Å; Y15-I19 PolarHBondContact O-N 2.95Å; I19-K21 VanDerWaalsContact C-N 3.26Å; I19-K21 PolarHBondContact O-N 3.28Å; I19-K22 PolarHBondContact O-N 3.44Å; I19-M23 HydrophobicContact CG2-CG 4.03Å; I19-M23 VanDerWaalsContact O-CB 3.3Å; I19-M23 WeakPolarHBondContact O-CB 3.43Å; I19-M23 VanDerWaalsContact O-CG 3.22Å; I19-M23 WeakPolarHBondContact O-CG 3.48Å; I19-M23 PolarHBondContact O-N 3.37Å
20	N	69	Low	65.2	Low	106 Å²	106	123.5 Å²	123.5	57%	0.567	61%	0.612	S	S	*	*	H	α-helix	trans	-64	-33.3	179.8	-74.8	-29.9	0	0	0	112	T16 D17 R24	T16-N20 WeakPolarHBondContact O-CB 3.43Å; T16-N20 VanDerWaalsContact O-CG 3.3Å; T16-N20 PolarHBondContact O-N 3.41Å; T16-N20 VanDerWaalsContact O-N 3.12Å; T16-N20 PolarHBondContact O-ND2 3.35Å; T16-N20 VanDerWaalsContact O-ND2 3.14Å; D17-N20 PolarHBondContact O-N 3.28Å; N20-R24 WeakPolarHBondContact O-CB 3.48Å; N20-R24 PolarHBondContact O-N 3.5Å
21	K	70.4	Confident	64.3	Low	171 Å²	171	128.6 Å²	128.6	74%	0.743	62%	0.62	S	S	*	*	H	α-helix	trans	-72.8	-38.4	176.3	-167.1	175.4	-178.6	179.5	0	112.8	D17 D18 I19	D17-K21 WeakPolarHBondContact O-CB 3.35Å; D17-K21 PolarHBondContact O-N 2.96Å; D18-K21 PolarHBondContact O-N 3.35Å; I19-K21 VanDerWaalsContact C-N 3.26Å; I19-K21 PolarHBondContact O-N 3.28Å
22	K	74.9	Confident	63.7	Low	152 Å²	152	127.1 Å²	127.1	66%	0.661	62%	0.624	S	S	*	*	H	α-helix	trans	-77.3	-29.9	178.7	-73.4	172.3	177.4	165	0	113.5	D18 I19 R24	D18-K22 WeakPolarHBondContact O-CB 3.47Å; D18-K22 WeakPolarHBondContact O-CG 3.39Å; D18-K22 PolarHBondContact O-N 2.98Å; D18-K22 WeakPolarHBondContact OD1-CE 3.18Å; D18-K22 IonicContact OD1-NZ 3.35Å; D18-K22 PolarHBondContact OD1-NZ 3.48Å; D18-K22 WeakPolarHBondContact OD2-CE 3.5Å; D18-K22 IonicContact OD2-NZ 2.69Å; D18-K22 PolarHBondContact OD2-NZ 2.76Å; I19-K22 PolarHBondContact O-N 3.44Å; K22-R24 VanDerWaalsContact C-N 3.35Å
23	M	66.7	Low	63	Low	148 Å²	148	126.3 Å²	126.3	73%	0.729	63%	0.63	S	S	*	*	H	α-helix	trans	-83.7	-10.3	176.6	-66.5	-68.9	-73.1	0	0	113.1	I19 V25	I19-M23 HydrophobicContact CG2-CG 4.03Å; I19-M23 VanDerWaalsContact O-CB 3.3Å; I19-M23 WeakPolarHBondContact O-CB 3.43Å; I19-M23 VanDerWaalsContact O-CG 3.22Å; I19-M23 WeakPolarHBondContact O-CG 3.48Å; I19-M23 PolarHBondContact O-N 3.37Å; M23-V25 PolarHBondContact O-N 2.83Å; M23-V25 VanDerWaalsContact O-N 3.11Å
24	R	68.3	Low	62.4	Low	166 Å²	166	128.4 Å²	128.4	63%	0.626	64%	0.642	S	S	*	*	S	Bend	trans	-70.8	109.6	177.5	-163.9	171	-170.8	139.7	0	109.2	N20 K22 E27	N20-R24 WeakPolarHBondContact O-CB 3.48Å; N20-R24 PolarHBondContact O-N 3.5Å; K22-R24 VanDerWaalsContact C-N 3.35Å; R24-E27 IonicContact CZ-OE1 3.55Å; R24-E27 IonicContact NE-OE1 3.46Å; R24-E27 PolarHBondContact NE-OE1 2.95Å; R24-E27 IonicContact NH2-OE1 2.77Å; R24-E27 PolarHBondContact NH2-OE1 3.1Å
25	V	64.9	Low	61.4	Low	116 Å²	116	131 Å²	131	70%	0.703	66%	0.655	S	S	*	*			trans	-50.7	128.2	167.5	179.1	0	0	0	0	107.8	M23 E27	M23-V25 PolarHBondContact O-N 2.83Å; M23-V25 VanDerWaalsContact O-N 3.11Å; V25-E27 PolarHBondContact O-N 3.09Å
26	P	63.9	Low	60.6	Low	95 Å²	95	129 Å²	129	62%	0.617	66%	0.663	S	S	*	*			trans	-56.4	118.6	177.9	-20.2	29.8	0	0	0	109.3	K28	P26-K28 PolarHBondContact O-N 3.5Å
27	E	64.8	Low	59.7	Low	156 Å²	156	130 Å²	130	73%	0.729	68%	0.678	S	S	*	*	S	Bend	trans	-67.6	3.6	178.3	-84	174.4	-161.4	0	0	113.2	R24 V25	R24-E27 IonicContact CZ-OE1 3.55Å; R24-E27 IonicContact NE-OE1 3.46Å; R24-E27 PolarHBondContact NE-OE1 2.95Å; R24-E27 IonicContact NH2-OE1 2.77Å; R24-E27 PolarHBondContact NH2-OE1 3.1Å; V25-E27 PolarHBondContact O-N 3.09Å
28	K	57.7	Low	58.4	Low	180 Å²	180	132 Å²	132	78%	0.783	69%	0.693	S	S	*	*			trans	-137.5	78.7	-176.9	-59.4	-159.3	179.3	-165.4	0	112.5	P26	P26-K28 PolarHBondContact O-N 3.5Å
29	L	54.8	Low	57.3	Low	167 Å²	167	136.7 Å²	136.7	87%	0.874	72%	0.717	S	S	*	*			trans	-102.4	60.7	150.4	-87	155.3	0	0	0	107.5	Y31	L29-Y31 PolarHBondContact O-N 2.86Å
30	S	50.1	Low	56	Low	94 Å²	94	138 Å²	138	66%	0.657	73%	0.734	S	S	*	*			trans	-83.9	109.4	164.9	51.9	0	0	0	0	107.1	D32	S30-D32 PolarHBondContact O-N 3.2Å
31	Y	48.2	Very low	54.7	Low	222 Å²	222	142.4 Å²	142.4	87%	0.871	75%	0.751	S	S	*	*			trans	-68.1	113.1	172.8	-160.9	-91.4	0	0	0	108.1	L29 S33	L29-Y31 PolarHBondContact O-N 2.86Å; Y31-S33 PolarHBondContact O-N 2.74Å
32	D	50.2	Low	53.6	Low	145 Å²	145	137.7 Å²	137.7	78%	0.775	75%	0.751	S	S	*	*			trans	-67.3	116.4	169.9	-91.9	-28.8	0	0	0	108.6	S30 D34	S30-D32 PolarHBondContact O-N 3.2Å; D32-D34 VanDerWaalsContact C-N 3.33Å; D32-D34 PolarHBondContact O-N 2.74Å
33	S	53.6	Low	52.1	Low	92 Å²	92	138.6 Å²	138.6	64%	0.643	76%	0.757	S	S	*	*			trans	-87.1	10	-174.4	59	0	0	0	0	114.9	Y31 N35	Y31-S33 PolarHBondContact O-N 2.74Å; S33-N35 PolarHBondContact O-N 2.68Å
34	D	52	Low	51	Low	129 Å²	129	139.1 Å²	139.1	69%	0.69	76%	0.763	S	S	*	*			trans	-93.7	8.1	-160	-71.7	-8.6	0	0	0	116	D32	D32-D34 VanDerWaalsContact C-N 3.33Å; D32-D34 PolarHBondContact O-N 2.74Å
35	N	47.1	Very low	49.9	Very low	162 Å²	162	136.3 Å²	136.3	87%	0.866	76%	0.764	S	S	*	*			trans	-105.1	66.9	168.5	-85	-1.7	0	0	0	111.3	S33 A37	S33-N35 PolarHBondContact O-N 2.68Å; N35-A37 PolarHBondContact O-N 3.31Å
36	S	42.5	Very low	48.8	Very low	104 Å²	104	134 Å²	134	73%	0.727	75%	0.753	S	S	*	*			trans	-75.7	73.5	160.8	46.6	0	0	0	0	109.8	T38	S36-T38 PolarHBondContact O-N 3.29Å; S36-T38 VanDerWaalsContact O-N 3.08Å
37	A	46.2	Very low	48	Very low	84 Å²	84	138.9 Å²	138.9	69%	0.694	77%	0.765	S	S	*	*			trans	-76.5	94.6	167.2	0	0	0	0	0	109.1	N35 L39	N35-A37 PolarHBondContact O-N 3.31Å; A37-L39 PolarHBondContact O-N 2.8Å; A37-L39 VanDerWaalsContact O-N 3.13Å
38	T	42.5	Very low	47.3	Very low	136 Å²	136	142 Å²	142	83%	0.834	77%	0.77	S	S	*	*			trans	-17.8	101.4	157.1	52.9	0	0	0	0	114.7	S36	S36-T38 PolarHBondContact O-N 3.29Å; S36-T38 VanDerWaalsContact O-N 3.08Å
39	L	47	Very low	46.8	Very low	168 Å²	168	140.1 Å²	140.1	88%	0.88	77%	0.768	S	S	*	*			trans	-131.3	98.2	159.3	-89.2	167.6	0	0	0	109.2	A37	A37-L39 PolarHBondContact O-N 2.8Å; A37-L39 VanDerWaalsContact O-N 3.13Å
40	S	42.6	Very low	46.1	Very low	106 Å²	106	142.2 Å²	142.2	74%	0.741	77%	0.766	S	S	*	*			trans	22.2	102.1	154.1	-153.7	0	0	0	0	117.4	G42	S40-G42 PolarHBondContact O-N 3.07Å
41	E	40.7	Very low	46.2	Very low	198 Å²	198	143.3 Å²	143.3	93%	0.925	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-36.8	124.4	139.1	-164.3	165.8	-167.5	0	0	110.1
42	G	47.8	Very low	45.9	Very low	72 Å²	72	139.7 Å²	139.7	74%	0.742	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	141.4	-11.9	172.2	0	0	0	0	0	118.3	S40	S40-G42 PolarHBondContact O-N 3.07Å
43	H	42.4	Very low	45.8	Very low	171 Å²	171	136.1 Å²	136.1	79%	0.792	76%	0.763	S	S	*	*			trans	-110	94.8	176.4	-91.7	-62.5	0	0	0	112.3	V45	H43-V45 VanDerWaalsContact C-N 3.32Å; H43-V45 WeakPolarHBondContact O-CG2 3.4Å; H43-V45 PolarHBondContact O-N 3.23Å
44	D	43.9	Very low	45.1	Very low	159 Å²	159	139.6 Å²	139.6	85%	0.85	77%	0.774	S	S	*	*			trans	-54.1	99.6	150.9	-107.9	-26.9	0	0	0	107.5	S46	D44-S46 PolarHBondContact O-N 3.35Å
45	V	45	Very low	44.7	Very low	106 Å²	106	140.6 Å²	140.6	64%	0.642	78%	0.778	S	S	*	*			trans	-76.5	75.8	173.8	-166.7	0	0	0	0	107.5	H43 F47	H43-V45 VanDerWaalsContact C-N 3.32Å; H43-V45 WeakPolarHBondContact O-CG2 3.4Å; H43-V45 PolarHBondContact O-N 3.23Å; V45-F47 WeakPolarHBondContact O-CD2 3.46Å; V45-F47 PolarHBondContact O-N 3.25Å; V45-F47 VanDerWaalsContact O-N 3.09Å
46	S	42.9	Very low	44.1	Very low	69 Å²	69	136.3 Å²	136.3	48%	0.483	76%	0.761	S	S	.	*			trans	-58.8	105.1	160.5	165.1	0	0	0	0	108.1	D44 R48	D44-S46 PolarHBondContact O-N 3.35Å; S46-R48 PolarHBondContact O-N 3.35Å; S46-R48 WeakPolarHBondContact OG-CB 3.22Å; S46-R48 PolarHBondContact OG-N 3.07Å
47	F	46.2	Very low	44	Very low	196 Å²	196	135.6 Å²	135.6	86%	0.86	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	13.7	172	-72.2	-85.9	0	0	0	113.8	V45	V45-F47 WeakPolarHBondContact O-CD2 3.46Å; V45-F47 PolarHBondContact O-N 3.25Å; V45-F47 VanDerWaalsContact O-N 3.09Å
48	R	50.4	Low	43.8	Very low	222 Å²	222	139.1 Å²	139.1	84%	0.838	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-7.1	-172.1	-81.1	-169.6	163.6	-138.6	-1.3	116.4	S46	S46-R48 PolarHBondContact O-N 3.35Å; S46-R48 WeakPolarHBondContact OG-CB 3.22Å; S46-R48 PolarHBondContact OG-N 3.07Å
49	N	47.6	Very low	43.6	Very low	140 Å²	140	139.7 Å²	139.7	75%	0.749	77%	0.767	S	S	*	*			trans	-122.9	40	-168.4	-68.1	-22.3	0	0	0	114.7
50	Y	39.9	Very low	43	Very low	212 Å²	212	139.4 Å²	139.4	83%	0.831	77%	0.766	S	S	*	*	S	Bend	trans	-97	123.3	160.3	-83.5	-82.6	0	0	0	109.8	V52	Y50-V52 PolarHBondContact O-N 3.33Å
51	P	51.6	Low	42.7	Very low	116 Å²	116	138.2 Å²	138.2	75%	0.753	76%	0.757	S	S	*	*			trans	-62.4	122.6	-179.5	25.4	-31.6	0	0	0	108.5	A53	P51-A53 PolarHBondContact O-N 2.82Å
52	V	42.8	Very low	42.5	Very low	146 Å²	146	134.3 Å²	134.3	89%	0.885	75%	0.747	S	S	*	*			trans	-62.6	90.7	172.1	-179.2	0	0	0	0	106.7	Y50 D54	Y50-V52 PolarHBondContact O-N 3.33Å; V52-D54 PolarHBondContact O-N 3.46Å
53	A	48.2	Very low	41.9	Very low	71 Å²	71	141 Å²	141	59%	0.587	75%	0.751	S	S	*	*			trans	-61.1	126.2	171.9	0	0	0	0	0	107.5	P51 L55	P51-A53 PolarHBondContact O-N 2.82Å; A53-L55 HydrophobicContact CB-CD1 4.41Å; A53-L55 PolarHBondContact O-N 2.77Å
54	D	37.3	Very low	41.7	Very low	164 Å²	164	142.8 Å²	142.8	88%	0.877	76%	0.757	S	S	*	*			trans	-62.3	75.7	-175.3	-145.7	-2.4	0	0	0	110.9	V52	V52-D54 PolarHBondContact O-N 3.46Å
55	L	43.8	Very low	41.6	Very low	151 Å²	151	139.8 Å²	139.8	79%	0.791	75%	0.754	S	S	*	*			trans	-128.3	107.2	162.7	-76.7	97.5	0	0	0	105	A53	A53-L55 HydrophobicContact CB-CD1 4.41Å; A53-L55 PolarHBondContact O-N 2.77Å
56	S	35.1	Very low	41.4	Very low	72 Å²	72	142.1 Å²	142.1	50%	0.503	77%	0.768	S	S	.	*			cis	-172.9	151.2	15.3	34.5	0	0	0	0	106.8	K58	S56-K58 PolarHBondContact O-N 3.14Å; S56-K58 PolarHBondContact OG-O 3.12Å
57	G	40.3	Very low	41.2	Very low	88 Å²	88	146.9 Å²	146.9	91%	0.907	79%	0.787	S	S	*	*	S	Bend	trans	-62.4	51.7	158.5	0	0	0	0	0	112.9
58	K	41.2	Very low	40.6	Very low	158 Å²	158	145 Å²	145	69%	0.687	79%	0.786	S	S	*	*	S	Bend	trans	-173.3	120.4	-174.9	-95.4	146.7	-173.9	-174.6	0	107.2	S56	S56-K58 PolarHBondContact O-N 3.14Å; S56-K58 PolarHBondContact OG-O 3.12Å
59	L	38.8	Very low	40.1	Very low	148 Å²	148	139.5 Å²	139.5	78%	0.775	79%	0.788	S	S	*	*			trans	74.3	67.2	163.8	-56.8	142.3	0	0	0	115.8
60	N	33.6	Very low	39.8	Very low	162 Å²	162	142 Å²	142	87%	0.866	79%	0.793	S	S	*	*				0.2	80	83.3	-129.7	3.8	0	0	0	115.8
61	C	36.9	Very low	39.8	Very low	81 Å²	81	143.1 Å²	143.1	55%	0.547	80%	0.795	S	S	.	*			trans	-155	98.2	162.7	-90.6	0	0	0	0	112
62	T	37	Very low	39.1	Very low	116 Å²	116	142.3 Å²	142.3	71%	0.712	79%	0.792	S	S	*	*	S	Bend		70.5	49.4	123	-9.7	0	0	0	0	120.4
63	Y	35.5	Very low	38.9	Very low	214 Å²	214	140.5 Å²	140.5	84%	0.839	79%	0.786	S	S	*	*	S	Bend	trans	-138.2	136.4	144.8	-93.2	-98.6	0	0	0	105.2
64	F	37	Very low	38.6	Very low	208 Å²	208	146 Å²	146	91%	0.912	80%	0.799	S	S	*	*	S	Bend	trans	80.9	57.5	-176.7	-47.3	-82	0	0	0	117.8
65	A	41.9	Very low	38.6	Very low	96 Å²	96	149 Å²	149	79%	0.793	80%	0.8	S	S	*	*			trans	-157.7	27.5	164	0	0	0	0	0	115.8
66	V	40.7	Very low	38.5	Very low	154 Å²	154	146.3 Å²	146.3	93%	0.933	80%	0.8	S	S	*	*			trans	-101.3	9	178	-167.7	0	0	0	0	112.5
67	L	40.1	Very low	38.8	Very low	169 Å²	169	149 Å²	149	89%	0.885	82%	0.816	S	S	*	*	S	Bend	trans	-105.1	117.8	169.5	-70.6	163.4	0	0	0	106.9
68	D	33.7	Very low	38.6	Very low	158 Å²	158	147.9 Å²	147.9	85%	0.845	80%	0.804	S	S	*	*			trans	97.6	68.2	169.2	-140	13	0	0	0	117.1
69	A	39.9	Very low	38.5	Very low	106 Å²	106	150 Å²	150	88%	0.876	81%	0.809	S	S	*	*			trans	-126.7	51.7	162.7	0	0	0	0	0	111.2	R71	A69-R71 PolarHBondContact O-N 3.22Å
70	K	39.5	Very low	38.9	Very low	193 Å²	193	147.1 Å²	147.1	84%	0.839	80%	0.801	S	S	*	*			trans	-83	90.7	151.9	-93.7	-165.5	177.9	-176.1	0	107.7
71	R	40.3	Very low	40	Very low	235 Å²	235	144.8 Å²	144.8	89%	0.887	80%	0.795	S	S	*	*			trans	169.6	129.9	143.8	-98.7	165.1	171.2	159	-1.7	111.7	A69	A69-R71 PolarHBondContact O-N 3.22Å
72	S	38	Very low	40.8	Very low	98 Å²	98	148.8 Å²	148.8	69%	0.685	81%	0.811	S	S	*	*			trans	48.5	103	151	58.3	0	0	0	0	117.4
73	S	37.6	Very low	41.4	Very low	108 Å²	108	149 Å²	149	76%	0.755	81%	0.806	S	S	*	*				52.7	75.6	83.1	78.3	0	0	0	0	113.6
74	E	43.2	Very low	42.4	Very low	186 Å²	186	144.7 Å²	144.7	87%	0.869	80%	0.797	S	S	*	*			trans	176.1	121.4	138.5	-104.1	167	147.6	0	0	109.8
75	Y	36.9	Very low	42.9	Very low	227 Å²	227	139.6 Å²	139.6	89%	0.89	78%	0.78	S	S	*	*			trans	48.9	90.1	141.3	-113.6	-95.8	0	0	0	118.9
76	A	41.1	Very low	43.2	Very low	96 Å²	96	140.6 Å²	140.6	79%	0.793	77%	0.771	S	S	*	*			trans	-158.7	102.4	150	0	0	0	0	0	111.4
77	P	40.9	Very low	43.8	Very low	129 Å²	129	136.6 Å²	136.6	84%	0.838	75%	0.75	S	S	*	*			trans	-84.7	112.9	175.2	32.2	-26.2	0	0	0	108.7
78	G	36.5	Very low	44.3	Very low	63 Å²	63	133.2 Å²	133.2	65%	0.649	73%	0.733	S	S	*	*			trans	-167.5	-2.8	-176.7	0	0	0	0	0	119
79	Y	38.7	Very low	45.1	Very low	202 Å²	202	131.4 Å²	131.4	79%	0.792	72%	0.722	S	S	*	*			trans	-132.9	93.2	175.9	-83	-88.9	0	0	0	109.7
80	S	48.9	Very low	45.5	Very low	88 Å²	88	136.7 Å²	136.7	62%	0.615	72%	0.72	S	S	*	*			trans	-103.7	115.3	172.4	-77.7	0	0	0	0	108.9	I83	S80-I83 VanDerWaalsContact OG-CD1 3.22Å; S80-I83 WeakPolarHBondContact OG-CD1 3.3Å
81	P	55.1	Low	45.8	Very low	114 Å²	114	130.9 Å²	130.9	74%	0.74	70%	0.703	S	S	*	*			trans	-71.6	129.4	172.3	31.3	-29.6	0	0	0	107.6	I83	P81-I83 VanDerWaalsContact C-N 3.3Å; P81-I83 PolarHBondContact O-N 3.27Å
82	D	53.8	Low	46.1	Very low	165 Å²	165	128.3 Å²	128.3	88%	0.882	70%	0.699	S	S	*	*			trans	13.1	70.2	173.9	-74.5	-21.4	0	0	0	114.5	L84	D82-L84 PolarHBondContact O-N 2.9Å
83	I	50.2	Low	47	Very low	120 Å²	120	129 Å²	129	62%	0.615	69%	0.694	S	S	*	*			trans	-73.5	94.3	170.2	-62.4	176.5	0	0	0	104.6	S80 P81 N85	S80-I83 VanDerWaalsContact OG-CD1 3.22Å; S80-I83 WeakPolarHBondContact OG-CD1 3.3Å; P81-I83 VanDerWaalsContact C-N 3.3Å; P81-I83 PolarHBondContact O-N 3.27Å; I83-N85 VanDerWaalsContact C-N 3.33Å; I83-N85 PolarHBondContact O-N 3.34Å
84	L	56.2	Low	47.8	Very low	124 Å²	124	128.5 Å²	128.5	65%	0.649	68%	0.682	S	S	*	*			trans	-42.9	107.1	155.8	-72	167.6	0	0	0	106.4	D82	D82-L84 PolarHBondContact O-N 2.9Å
85	N	47.3	Very low	48.5	Very low	101 Å²	101	122.6 Å²	122.6	54%	0.54	66%	0.66	S	S	.	*			trans	-64.1	145.4	-177.2	-171.3	0.5	0	0	0	107.2	I83 S87 D88	I83-N85 VanDerWaalsContact C-N 3.33Å; I83-N85 PolarHBondContact O-N 3.34Å; N85-S87 WeakPolarHBondContact CB-OG 3.47Å; N85-S87 VanDerWaalsContact CG-OG 3.31Å; N85-S87 PolarHBondContact ND2-OG 3.07Å; N85-S87 PolarHBondContact O-N 3.11Å; N85-D88 PolarHBondContact O-N 3.02Å
86	N	49.5	Very low	49.8	Very low	116 Å²	116	116.5 Å²	116.5	62%	0.62	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-8.5	177.3	-79.8	-43.1	0	0	0	112.9	R90	N86-R90 WeakPolarHBondContact O-CG 3.28Å; N86-R90 PolarHBondContact O-N 2.92Å
87	S	51.8	Low	50.7	Low	70 Å²	70	116.2 Å²	116.2	49%	0.49	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.1	-33.7	166.1	55.8	0	0	0	0	114	N85 R90	N85-S87 WeakPolarHBondContact CB-OG 3.47Å; N85-S87 VanDerWaalsContact CG-OG 3.31Å; N85-S87 PolarHBondContact ND2-OG 3.07Å; N85-S87 PolarHBondContact O-N 3.11Å; S87-R90 PolarHBondContact O-N 2.93Å
88	D	51.2	Low	52.2	Low	99 Å²	99	116 Å²	116	53%	0.529	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.5	-30.3	178	-73.3	-28.6	0	0	0	111.9	N85 R90 S91	N85-D88 PolarHBondContact O-N 3.02Å; D88-R90 VanDerWaalsContact C-N 3.27Å; D88-R90 PolarHBondContact O-N 2.97Å; D88-S91 PolarHBondContact O-OG 3.15Å
89	I	51.2	Low	53.3	Low	120 Å²	120	117.1 Å²	117.1	62%	0.615	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-16	177.8	-58.6	170.7	0	0	0	111.4
90	R	47.1	Very low	54.7	Low	216 Å²	216	112.8 Å²	112.8	82%	0.815	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	10.4	178.9	-77	-173.9	175.6	-154.6	1.1	114.7	N86 S87 D88 K92	N86-R90 WeakPolarHBondContact O-CG 3.28Å; N86-R90 PolarHBondContact O-N 2.92Å; S87-R90 PolarHBondContact O-N 2.93Å; D88-R90 VanDerWaalsContact C-N 3.27Å; D88-R90 PolarHBondContact O-N 2.97Å; R90-K92 PolarHBondContact O-N 3.31Å
91	S	45.5	Very low	55.1	Low	71 Å²	71	113.1 Å²	113.1	50%	0.497	63%	0.627	S	S	.	*			trans	-69.3	86.5	167.8	61.7	0	0	0	0	109.2	D88 L93	D88-S91 PolarHBondContact O-OG 3.15Å; S91-L93 VanDerWaalsContact C-N 3.34Å; S91-L93 PolarHBondContact O-N 3.01Å
92	K	48	Very low	55.7	Low	181 Å²	181	110.9 Å²	110.9	79%	0.787	61%	0.614	S	S	*	*			trans	-62.8	100.8	172.1	-151.8	179.8	-171.6	-174.1	0	105.9	R90 I94	R90-K92 PolarHBondContact O-N 3.31Å; K92-I94 VanDerWaalsContact C-N 3.32Å; K92-I94 PolarHBondContact O-N 3.25Å
93	L	55.5	Low	55.8	Low	112 Å²	112	108.1 Å²	108.1	59%	0.586	61%	0.608	S	S	*	*			trans	-64.6	96.9	175.1	-150.5	87.7	0	0	0	106.7	S91 C95 T122	S91-L93 VanDerWaalsContact C-N 3.34Å; S91-L93 PolarHBondContact O-N 3.01Å; L93-C95 WeakPolarHBondContact CD2-SG 3.42Å; L93-C95 PolarHBondContact O-N 2.88Å; L93-T122 HydrophobicContact CD1-CG2 4.44Å
94	I	56	Low	56.2	Low	99 Å²	99	109.4 Å²	109.4	51%	0.508	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.2	97.7	173.1	-59.8	171.6	0	0	0	105.6	K92	K92-I94 VanDerWaalsContact C-N 3.32Å; K92-I94 PolarHBondContact O-N 3.25Å
95	C	58.1	Low	55.9	Low	61 Å²	61	109.6 Å²	109.6	41%	0.412	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.2	112	170.1	-61.1	0	0	0	0	107.9	L93 V118 C120	L93-C95 WeakPolarHBondContact CD2-SG 3.42Å; L93-C95 PolarHBondContact O-N 2.88Å; C95-V118 HydrophobicContact CB-CG1 4.38Å; C95-C120 PolarHBondContact SG-SG 2.9Å
96	N	62.4	Low	56.1	Low	100 Å²	100	108.2 Å²	108.2	54%	0.535	63%	0.625	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.2	116.4	168.7	-73.2	-22.4	0	0	0	108	F119	N96-F119 PolarHBondContact N-O 3.49Å; N96-F119 PolarHBondContact O-N 2.8Å
97	A	61.7	Low	56.2	Low	89 Å²	89	110.7 Å²	110.7	74%	0.736	64%	0.639	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.5	120.7	167.4	0	0	0	0	0	108
98	Q	71.2	Confident	56.6	Low	124 Å²	124	111.8 Å²	111.8	58%	0.579	66%	0.661	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.5	120.7	173.5	-167.8	171.7	21.3	0	0	108.5	H100 G117	Q98-H100 PolarHBondContact NE2-NE2 2.91Å; Q98-G117 PolarHBondContact N-O 3.3Å; Q98-G117 PolarHBondContact O-N 3.19Å
99	A	60	Low	56.4	Low	88 Å²	88	110.1 Å²	110.1	73%	0.727	66%	0.657	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-108.6	122.9	170.1	0	0	0	0	0	108.1	S115	A99-S115 WeakPolarHBondContact CA-O 3.4Å
100	H	67.3	Low	56.5	Low	110 Å²	110	109.3 Å²	109.3	51%	0.509	67%	0.668	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.6	123.3	170.4	-88	-75.1	0	0	0	108.9	Q98 A114 S115	Q98-H100 PolarHBondContact NE2-NE2 2.91Å; H100-A114 WeakPolarHBondContact O-CA 3.48Å; H100-S115 PolarHBondContact N-O 3.08Å; H100-S115 PolarHBondContact O-N 2.85Å
101	A	59.1	Low	56.7	Low	95 Å²	95	106.4 Å²	106.4	79%	0.785	66%	0.661	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.4	118.4	168.6	0	0	0	0	0	107.6
102	S	67.6	Low	57.3	Low	68 Å²	68	107.2 Å²	107.2	48%	0.476	67%	0.673	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.7	121.8	173.5	176.5	0	0	0	0	108.4	N113	S102-N113 PolarHBondContact N-O 2.82Å; S102-N113 PolarHBondContact O-N 2.86Å; S102-N113 VanDerWaalsContact O-N 3.07Å
103	S	56	Low	57.6	Low	107 Å²	107	104.7 Å²	104.7	75%	0.748	67%	0.667	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.4	119.9	164.5	53.8	0	0	0	0	108
104	Q	58.5	Low	57.7	Low	147 Å²	147	104 Å²	104	69%	0.687	68%	0.678	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.7	118	165.2	-85.2	-179.7	-11.8	0	0	107.8	K111	Q104-K111 PolarHBondContact N-O 3.37Å
105	S	48.2	Very low	58	Low	127 Å²	127	102.7 Å²	102.7	89%	0.888	68%	0.678	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104	98	168.5	177.1	0	0	0	0	107.3
106	A	52.5	Low	57.9	Low	73 Å²	73	104.5 Å²	104.5	60%	0.603	70%	0.697	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-132.7	123.8	167.3	0	0	0	0	0	107.6
107	D	52.4	Low	57.8	Low	168 Å²	168	101.6 Å²	101.6	90%	0.898	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	36.7	82.3	171.9	-60.3	-20.7	0	0	0	116	S109	D107-S109 VanDerWaalsContact C-N 3.28Å; D107-S109 PolarHBondContact O-N 3.16Å; D107-S109 VanDerWaalsContact O-N 3.09Å
108	G	58.7	Low	57.7	Low	93 Å²	93	102.5 Å²	102.5	96%	0.959	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.7	-3	160.2	0	0	0	0	0	117.5
109	S	47.3	Very low	57.4	Low	64 Å²	64	101.2 Å²	101.2	45%	0.448	68%	0.68	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.4	102	179.1	157.9	0	0	0	0	111.1	D107 K111	D107-S109 VanDerWaalsContact C-N 3.28Å; D107-S109 PolarHBondContact O-N 3.16Å; D107-S109 VanDerWaalsContact O-N 3.09Å; S109-K111 PolarHBondContact O-N 3.15Å
110	A	53.8	Low	57.3	Low	102 Å²	102	99.7 Å²	99.7	84%	0.843	66%	0.663	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.8	114.3	171.5	0	0	0	0	0	110.5
111	K	51.2	Low	56.7	Low	155 Å²	155	100.5 Å²	100.5	67%	0.674	67%	0.667	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.7	120.2	167.9	-76.1	-178.7	179.6	175.2	0	109.3	Q104 S109	Q104-K111 PolarHBondContact N-O 3.37Å; S109-K111 PolarHBondContact O-N 3.15Å
112	A	57.8	Low	56.5	Low	89 Å²	89	98.5 Å²	98.5	74%	0.736	65%	0.645	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.7	123.9	170.5	0	0	0	0	0	108.3
113	N	55.3	Low	55.8	Low	127 Å²	127	100.8 Å²	100.8	68%	0.679	66%	0.661	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.1	125.7	170	-92.6	-12.8	0	0	0	109	S102	S102-N113 PolarHBondContact N-O 2.82Å; S102-N113 PolarHBondContact O-N 2.86Å; S102-N113 VanDerWaalsContact O-N 3.07Å
114	A	55.9	Low	55.4	Low	97 Å²	97	98.3 Å²	98.3	80%	0.802	64%	0.644	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.3	124.1	170.7	0	0	0	0	0	108.4	H100	H100-A114 WeakPolarHBondContact O-CA 3.48Å
115	S	63.6	Low	55	Low	73 Å²	73	99.9 Å²	99.9	51%	0.51	65%	0.651	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.4	130.8	169.7	62.2	0	0	0	0	109.7	A99 H100	A99-S115 WeakPolarHBondContact CA-O 3.4Å; H100-S115 PolarHBondContact N-O 3.08Å; H100-S115 PolarHBondContact O-N 2.85Å
116	A	56.1	Low	54.9	Low	99 Å²	99	103.9 Å²	103.9	82%	0.818	65%	0.646	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.4	122.2	172.7	0	0	0	0	0	108
117	G	60.5	Low	54.8	Low	39 Å²	39	102 Å²	102	40%	0.402	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.8	141.3	175.3	0	0	0	0	0	110.2	Q98	Q98-G117 PolarHBondContact N-O 3.3Å; Q98-G117 PolarHBondContact O-N 3.19Å
118	V	58.7	Low	54.7	Low	108 Å²	108	97.5 Å²	97.5	66%	0.655	60%	0.604	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.3	118	167.1	-178.6	0	0	0	0	106.9	C95	C95-V118 HydrophobicContact CB-CG1 4.38Å
119	F	64.4	Low	54.1	Low	97 Å²	97	100.3 Å²	100.3	43%	0.425	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.7	115.8	172.4	-168.3	-97.6	0	0	0	108.2	N96 E121	N96-F119 PolarHBondContact N-O 3.49Å; N96-F119 PolarHBondContact O-N 2.8Å; F119-E121 HydrophobicContact CD1-CB 4.21Å; F119-E121 HydrophobicContact CE1-CB 3.81Å; F119-E121 HydrophobicContact CE1-CG 4.06Å
120	C	58.8	Low	54.1	Low	55 Å²	55	106.7 Å²	106.7	37%	0.372	61%	0.607	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104	108.1	173	-59.9	0	0	0	0	107.5	C95 T122	C95-C120 PolarHBondContact SG-SG 2.9Å; C120-T122 PolarHBondContact O-N 2.89Å
121	E	53.9	Low	53.8	Low	128 Å²	128	108.2 Å²	108.2	60%	0.598	60%	0.6	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-88	99	173.9	-159.5	163.8	-170.8	0	0	108.2	F119	F119-E121 HydrophobicContact CD1-CB 4.21Å; F119-E121 HydrophobicContact CE1-CB 3.81Å; F119-E121 HydrophobicContact CE1-CG 4.06Å
122	T	55.1	Low	53.4	Low	52 Å²	52	109.6 Å²	109.6	32%	0.319	60%	0.601	S	S	.	*			trans	-81.5	124.7	169.2	57.5	0	0	0	0	107.8	L93 C120 S124	L93-T122 HydrophobicContact CD1-CG2 4.44Å; C120-T122 PolarHBondContact O-N 2.89Å; T122-S124 PolarHBondContact O-N 3.42Å
123	S	53.3	Low	52.8	Low	116 Å²	116	111.1 Å²	111.1	81%	0.811	60%	0.601	S	S	*	*	S	Bend	trans	-63.9	12.9	173.1	56	0	0	0	0	114.6
124	S	47.1	Very low	52.2	Low	56 Å²	56	109.2 Å²	109.2	39%	0.392	60%	0.597	S	S	.	*			trans	-98.3	98.8	168.1	172.2	0	0	0	0	108.9	T122 R126 A127	T122-S124 PolarHBondContact O-N 3.42Å; S124-R126 PolarHBondContact O-N 3.04Å; S124-A127 PolarHBondContact O-N 3Å; S124-A127 VanDerWaalsContact O-N 3.1Å
125	H	50	Low	51.3	Low	180 Å²	180	114 Å²	114	83%	0.833	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.9	-4.6	171.7	-154.8	-72.3	0	0	0	113
126	R	46.9	Very low	49.8	Very low	211 Å²	211	114.9 Å²	114.9	80%	0.796	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-11.2	-178.2	-139.5	173.7	-169.5	154.3	2.2	114.2	S124	S124-R126 PolarHBondContact O-N 3.04Å
127	A	49.9	Very low	48.9	Very low	34 Å²	34	115.4 Å²	115.4	28%	0.281	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.5	-23.9	179.4	0	0	0	0	0	113.3	S124 E129 R130	S124-A127 PolarHBondContact O-N 3Å; S124-A127 VanDerWaalsContact O-N 3.1Å; A127-E129 PolarHBondContact O-N 2.91Å; A127-R130 PolarHBondContact O-N 3.43Å
128	Q	49.5	Very low	47.8	Very low	73 Å²	73	118.2 Å²	118.2	34%	0.341	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.5	-22.3	-173.7	-151.5	171.8	31.5	0	0	113.9
129	E	46.8	Very low	46.9	Very low	152 Å²	152	120.6 Å²	120.6	71%	0.71	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-28.7	171.9	-86.2	-177.6	151.3	0	0	113.1	A127 V133	A127-E129 PolarHBondContact O-N 2.91Å; E129-V133 WeakPolarHBondContact O-CG2 3.48Å
130	R	46.4	Very low	46.1	Very low	198 Å²	198	118.2 Å²	118.2	75%	0.747	64%	0.636	S	S	*	*	H	α-helix	trans	-80.4	-21.9	-178.8	-75	-174.7	171.8	150	-3.3	114	A127 S134	A127-R130 PolarHBondContact O-N 3.43Å; R130-S134 PolarHBondContact O-OG 3.45Å
131	L	49.1	Very low	45.8	Very low	134 Å²	134	121.6 Å²	121.6	70%	0.702	65%	0.65	S	S	*	*	H	α-helix	trans	-85.2	-16.5	180	-90.8	152.2	0	0	0	114.2
132	R	43.2	Very low	45.8	Very low	184 Å²	184	121.7 Å²	121.7	69%	0.694	66%	0.655	S	S	*	*	H	α-helix	trans	-98.2	-13.7	174.6	-77.2	-172.5	175.9	122.9	-3.4	114.2
133	V	45.2	Very low	45.6	Very low	120 Å²	120	126.2 Å²	126.2	73%	0.727	67%	0.672	S	S	*	*	H	α-helix	trans	-94.4	-10.7	177.9	178.7	0	0	0	0	112.8	E129 K135	E129-V133 WeakPolarHBondContact O-CG2 3.48Å; V133-K135 PolarHBondContact O-N 2.9Å
134	S	42.3	Very low	45.5	Very low	87 Å²	87	126.6 Å²	126.6	61%	0.608	66%	0.661	S	S	*	*			trans	-91.5	11.7	-177.1	34.5	0	0	0	0	114.5	R130 S136	R130-S134 PolarHBondContact O-OG 3.45Å; S134-S136 PolarHBondContact O-N 3.04Å
135	K	37.4	Very low	45.9	Very low	198 Å²	198	127.8 Å²	127.8	86%	0.861	67%	0.665	S	S	*	*	S	Bend	trans	-101.9	51.7	179.5	-150.1	173.6	-174	177.2	0	111.9	V133	V133-K135 PolarHBondContact O-N 2.9Å
136	S	32.1	Very low	46.4	Very low	91 Å²	91	122.1 Å²	122.1	64%	0.636	65%	0.646	S	S	*	*	S	Bend	trans	-166.9	127.8	161.3	56.7	0	0	0	0	109.6	S134	S134-S136 PolarHBondContact O-N 3.04Å
137	S	36	Very low	47.2	Very low	111 Å²	111	116.1 Å²	116.1	78%	0.776	63%	0.629	S	S	*	*			trans	58.2	92.2	158	69.1	0	0	0	0	118.4
138	S	37.1	Very low	47.8	Very low	98 Å²	98	118.5 Å²	118.5	69%	0.685	64%	0.637	S	S	*	*				175.6	93	128.5	42	0	0	0	0	109.4	G140	S138-G140 PolarHBondContact O-N 3.2Å
139	T	39.3	Very low	48.4	Very low	157 Å²	157	120.7 Å²	120.7	96%	0.963	65%	0.647	S	S	*	*			trans	-63.1	113.4	162.7	-43.3	0	0	0	0	107.5
140	G	49.1	Very low	49.6	Very low	48 Å²	48	121.8 Å²	121.8	50%	0.495	65%	0.645	S	S	.	*	S	Bend	trans	160.1	-56.7	172.6	0	0	0	0	0	116.4	S138	S138-G140 PolarHBondContact O-N 3.2Å
141	D	52.9	Low	50.7	Low	125 Å²	125	117 Å²	117	67%	0.668	63%	0.633	S	S	*	*	S	Bend	trans	-103.4	-9.8	-159.5	-67.5	-34.1	0	0	0	115.9
142	N	52.2	Low	51.7	Low	131 Å²	131	115.5 Å²	115.5	70%	0.701	63%	0.625	S	S	*	*	H	α-helix	trans	-83.2	-11	-178.3	-73.3	-52.3	0	0	0	114.2
143	E	50.8	Low	53	Low	147 Å²	147	114.5 Å²	114.5	69%	0.687	62%	0.621	S	S	*	*	H	α-helix	trans	-76	-36.1	176.3	-68.2	-168.7	152.5	0	0	111.8	S146 I147	E143-S146 WeakPolarHBondContact O-CB 3.39Å; E143-S146 PolarHBondContact O-N 3.34Å; E143-I147 VanDerWaalsContact O-CG1 3.28Å; E143-I147 WeakPolarHBondContact O-CG1 3.29Å; E143-I147 PolarHBondContact O-N 3.06Å
144	H	52	Low	54.4	Low	124 Å²	124	113.1 Å²	113.1	57%	0.574	61%	0.61	S	S	*	*	H	α-helix	trans	-62.6	-45.9	180	-78.6	-75.8	0	0	0	112.5	S146 I147 D148	H144-S146 VanDerWaalsContact C-N 3.26Å; H144-S146 PolarHBondContact O-N 2.81Å; H144-I147 PolarHBondContact O-N 3.26Å; H144-I147 VanDerWaalsContact O-N 3.15Å; H144-D148 VanDerWaalsContact O-CG 3.31Å; H144-D148 PolarHBondContact O-N 3.25Å
145	V	56.4	Low	55.9	Low	80 Å²	80	115.4 Å²	115.4	49%	0.485	61%	0.611	S	S	.	*	H	α-helix	trans	-64.9	-32.9	178.5	-175.8	0	0	0	0	111.7	H149	V145-H149 PolarHBondContact O-CD2 3.27Å; V145-H149 PolarHBondContact O-N 2.89Å; V145-H149 VanDerWaalsContact O-N 3.16Å
146	S	59.5	Low	57.4	Low	62 Å²	62	113.8 Å²	113.8	43%	0.434	60%	0.603	S	S	.	*	H	α-helix	trans	-68.8	-39.7	175.3	131.1	0	0	0	0	112.1	E143 H144 R150	E143-S146 WeakPolarHBondContact O-CB 3.39Å; E143-S146 PolarHBondContact O-N 3.34Å; H144-S146 VanDerWaalsContact C-N 3.26Å; H144-S146 PolarHBondContact O-N 2.81Å; S146-R150 WeakPolarHBondContact O-CG 3.27Å; S146-R150 PolarHBondContact O-N 2.8Å
147	I	63.8	Low	59.4	Low	85 Å²	85	117.1 Å²	117.1	44%	0.436	60%	0.602	S	S	.	*	H	α-helix	trans	-69.5	-41.1	178	-66.3	164	0	0	0	110.1	E143 H144 H149 R150 L151	E143-I147 VanDerWaalsContact O-CG1 3.28Å; E143-I147 WeakPolarHBondContact O-CG1 3.29Å; E143-I147 PolarHBondContact O-N 3.06Å; H144-I147 PolarHBondContact O-N 3.26Å; H144-I147 VanDerWaalsContact O-N 3.15Å; I147-H149 PolarHBondContact O-N 2.89Å; I147-R150 CarbonylContact O-C 3.56Å; I147-R150 WeakPolarHBondContact O-CA 3.49Å; I147-R150 WeakPolarHBondContact O-CB 3.44Å; I147-R150 PolarHBondContact O-N 2.84Å; I147-R150 VanDerWaalsContact O-N 3.08Å; I147-L151 HydrophobicContact CG2-CD1 3.92Å; I147-L151 HydrophobicContact CG2-CG 4.34Å; I147-L151 PolarHBondContact O-N 3.19Å
148	D	62.3	Low	61.2	Low	83 Å²	83	116 Å²	116	44%	0.444	59%	0.587	S	S	.	*	H	α-helix	trans	-62.8	-44.4	177.9	-69.2	-21.2	0	0	0	111.9	H144 R150 L151 I152	H144-D148 VanDerWaalsContact O-CG 3.31Å; H144-D148 PolarHBondContact O-N 3.25Å; D148-R150 PolarHBondContact O-N 2.89Å; D148-L151 PolarHBondContact O-N 2.79Å; D148-I152 VanDerWaalsContact O-CG1 3.27Å; D148-I152 WeakPolarHBondContact O-CG1 3.41Å; D148-I152 PolarHBondContact O-N 3.46Å
149	H	62.7	Low	62.6	Low	120 Å²	120	114.4 Å²	114.4	56%	0.556	58%	0.575	S	S	*	*	H	α-helix	trans	-63	-31	174.1	-77.8	-50.7	0	0	0	113.2	V145 I147 R153	V145-H149 PolarHBondContact O-CD2 3.27Å; V145-H149 PolarHBondContact O-N 2.89Å; V145-H149 VanDerWaalsContact O-N 3.16Å; I147-H149 PolarHBondContact O-N 2.89Å; H149-R153 WeakPolarHBondContact O-CB 3.35Å; H149-R153 PolarHBondContact O-N 3.12Å
150	R	71.4	Confident	64.1	Low	174 Å²	174	112.2 Å²	112.2	66%	0.657	55%	0.554	S	S	*	*	H	α-helix	trans	-73.3	-41.3	173.8	-77.4	177.4	155.4	-160.2	-4.4	111.7	S146 I147 D148 R153 L154	S146-R150 WeakPolarHBondContact O-CG 3.27Å; S146-R150 PolarHBondContact O-N 2.8Å; I147-R150 CarbonylContact O-C 3.56Å; I147-R150 WeakPolarHBondContact O-CA 3.49Å; I147-R150 WeakPolarHBondContact O-CB 3.44Å; I147-R150 PolarHBondContact O-N 2.84Å; I147-R150 VanDerWaalsContact O-N 3.08Å; D148-R150 PolarHBondContact O-N 2.89Å; R150-R153 PolarHBondContact O-N 2.85Å; R150-L154 WeakPolarHBondContact O-CB 3.48Å; R150-L154 VanDerWaalsContact O-CG 3.29Å; R150-L154 WeakPolarHBondContact O-CG 3.43Å; R150-L154 PolarHBondContact O-N 2.82Å
151	L	69.8	Low	65.2	Low	97 Å²	97	115 Å²	115	51%	0.508	56%	0.557	S	S	.	*	H	α-helix	trans	-61.5	-50.1	175.8	-79.9	166.8	0	0	0	111.2	I147 D148 R153 L154 E155	I147-L151 HydrophobicContact CG2-CD1 3.92Å; I147-L151 HydrophobicContact CG2-CG 4.34Å; I147-L151 PolarHBondContact O-N 3.19Å; D148-L151 PolarHBondContact O-N 2.79Å; L151-R153 VanDerWaalsContact C-N 3.25Å; L151-R153 PolarHBondContact O-N 2.87Å; L151-L154 CarbonylContact O-C 3.6Å; L151-L154 WeakPolarHBondContact O-CB 3.35Å; L151-L154 PolarHBondContact O-N 2.96Å; L151-E155 WeakPolarHBondContact O-CB 3.48Å; L151-E155 PolarHBondContact O-N 3.46Å
152	I	70.4	Confident	66.1	Low	104 Å²	104	114.8 Å²	114.8	53%	0.533	55%	0.552	S	S	.	*	H	α-helix	trans	-59.1	-39.3	177.8	-65	163.1	0	0	0	110.8	D148 K156	D148-I152 VanDerWaalsContact O-CG1 3.27Å; D148-I152 WeakPolarHBondContact O-CG1 3.41Å; D148-I152 PolarHBondContact O-N 3.46Å; I152-K156 WeakPolarHBondContact O-CB 3.42Å; I152-K156 PolarHBondContact O-N 3.3Å
153	R	71.1	Confident	67.1	Low	162 Å²	162	115 Å²	115	61%	0.611	55%	0.547	S	S	*	.	H	α-helix	trans	-69.2	-36.8	177	-171.9	-180	-64.3	168.2	1.1	112.2	H149 R150 L151 R157	H149-R153 WeakPolarHBondContact O-CB 3.35Å; H149-R153 PolarHBondContact O-N 3.12Å; R150-R153 PolarHBondContact O-N 2.85Å; L151-R153 VanDerWaalsContact C-N 3.25Å; L151-R153 PolarHBondContact O-N 2.87Å; R153-R157 WeakPolarHBondContact O-CG 3.46Å; R153-R157 PolarHBondContact O-N 2.92Å
154	L	73.6	Confident	68.2	Low	92 Å²	92	112.8 Å²	112.8	48%	0.482	54%	0.536	S	S	.	.	H	α-helix	trans	-69.4	-45.1	176.3	-77.1	167	0	0	0	111	R150 L151 K156 R157 I158	R150-L154 WeakPolarHBondContact O-CB 3.48Å; R150-L154 VanDerWaalsContact O-CG 3.29Å; R150-L154 WeakPolarHBondContact O-CG 3.43Å; R150-L154 PolarHBondContact O-N 2.82Å; L151-L154 CarbonylContact O-C 3.6Å; L151-L154 WeakPolarHBondContact O-CB 3.35Å; L151-L154 PolarHBondContact O-N 2.96Å; L154-K156 VanDerWaalsContact C-N 3.3Å; L154-K156 PolarHBondContact O-N 3.37Å; L154-R157 CarbonylContact O-C 3.56Å; L154-R157 WeakPolarHBondContact O-CA 3.34Å; L154-R157 WeakPolarHBondContact O-CB 3.44Å; L154-R157 PolarHBondContact O-N 2.93Å; L154-I158 WeakPolarHBondContact O-CG1 3.22Å; L154-I158 PolarHBondContact O-N 3.16Å
155	E	72.9	Confident	69.2	Low	135 Å²	135	111.9 Å²	111.9	63%	0.631	53%	0.532	S	S	*	.	H	α-helix	trans	-59.6	-41	176.9	-169.5	-179.9	176	0	0	111.7	L151 R157 I158 S159	L151-E155 WeakPolarHBondContact O-CB 3.48Å; L151-E155 PolarHBondContact O-N 3.46Å; E155-R157 VanDerWaalsContact C-N 3.27Å; E155-R157 PolarHBondContact O-N 3.32Å; E155-I158 PolarHBondContact O-N 3.34Å; E155-S159 WeakPolarHBondContact O-CB 3.41Å; E155-S159 PolarHBondContact O-N 3.26Å; E155-S159 PolarHBondContact O-OG 3.06Å
156	K	70	Confident	69.9	Low	163 Å²	163	111 Å²	111	71%	0.709	53%	0.533	S	S	*	.	H	α-helix	trans	-63.3	-31.6	173.2	-168.1	171.1	-175.7	173.2	0	113	I152 L154 S159 H160	I152-K156 WeakPolarHBondContact O-CB 3.42Å; I152-K156 PolarHBondContact O-N 3.3Å; L154-K156 VanDerWaalsContact C-N 3.3Å; L154-K156 PolarHBondContact O-N 3.37Å; K156-S159 PolarHBondContact O-OG 3.31Å; K156-H160 PolarHBondContact O-N 3.02Å
157	R	74.5	Confident	70.6	Confident	161 Å²	161	113.3 Å²	113.3	61%	0.608	54%	0.54	S	S	*	.	H	α-helix	trans	-78.3	-39.8	175.7	-73.2	177.8	178.9	-170.7	-1.1	111.9	R153 L154 E155 H160 L161	R153-R157 WeakPolarHBondContact O-CG 3.46Å; R153-R157 PolarHBondContact O-N 2.92Å; L154-R157 CarbonylContact O-C 3.56Å; L154-R157 WeakPolarHBondContact O-CA 3.34Å; L154-R157 WeakPolarHBondContact O-CB 3.44Å; L154-R157 PolarHBondContact O-N 2.93Å; E155-R157 VanDerWaalsContact C-N 3.27Å; E155-R157 PolarHBondContact O-N 3.32Å; R157-H160 PolarHBondContact O-N 3.41Å; R157-L161 WeakPolarHBondContact O-CG 3.34Å; R157-L161 PolarHBondContact O-N 3.45Å
158	I	73.6	Confident	71.1	Confident	89 Å²	89	116.4 Å²	116.4	46%	0.456	56%	0.555	S	S	.	*	H	α-helix	trans	-63.7	-48.4	178.2	-67.9	164.4	0	0	0	109.8	L154 E155 H160 L161 E162	L154-I158 WeakPolarHBondContact O-CG1 3.22Å; L154-I158 PolarHBondContact O-N 3.16Å; E155-I158 PolarHBondContact O-N 3.34Å; I158-H160 VanDerWaalsContact C-N 3.31Å; I158-H160 PolarHBondContact O-N 3.47Å; I158-L161 PolarHBondContact O-N 2.82Å; I158-E162 HydrophobicContact CG2-CG 4.24Å; I158-E162 WeakPolarHBondContact O-CG 3.4Å; I158-E162 PolarHBondContact O-N 3.46Å
159	S	66.7	Low	71.9	Confident	63 Å²	63	118 Å²	118	44%	0.441	56%	0.557	S	S	.	*	H	α-helix	trans	-60.6	-37.9	177.9	54.2	0	0	0	0	113	E155 K156 F163	E155-S159 WeakPolarHBondContact O-CB 3.41Å; E155-S159 PolarHBondContact O-N 3.26Å; E155-S159 PolarHBondContact O-OG 3.06Å; K156-S159 PolarHBondContact O-OG 3.31Å; S159-F163 WeakPolarHBondContact O-CB 3.44Å; S159-F163 PolarHBondContact O-N 2.97Å
160	H	71.3	Confident	72.4	Confident	111 Å²	111	113.7 Å²	113.7	51%	0.514	55%	0.546	S	S	.	.	H	α-helix	trans	-66.5	-38.6	174.3	-171.4	-88.8	0	0	0	112.3	K156 R157 I158 Q164	K156-H160 PolarHBondContact O-N 3.02Å; R157-H160 PolarHBondContact O-N 3.41Å; I158-H160 VanDerWaalsContact C-N 3.31Å; I158-H160 PolarHBondContact O-N 3.47Å; H160-Q164 PolarHBondContact CE1-NE2 3.3Å; H160-Q164 VanDerWaalsContact CE1-NE2 3.32Å; H160-Q164 WeakPolarHBondContact O-CG 3.28Å; H160-Q164 PolarHBondContact O-N 2.8Å; H160-Q164 VanDerWaalsContact O-N 3.1Å
161	L	71.8	Confident	72.9	Confident	106 Å²	106	107.6 Å²	107.6	56%	0.555	54%	0.537	S	S	*	.	H	α-helix	trans	-69.6	-40.7	176.1	-73.3	169.8	0	0	0	112.2	R157 I158 Q164 Q165	R157-L161 WeakPolarHBondContact O-CG 3.34Å; R157-L161 PolarHBondContact O-N 3.45Å; I158-L161 PolarHBondContact O-N 2.82Å; L161-Q164 PolarHBondContact O-N 3.46Å; L161-Q165 WeakPolarHBondContact O-CB 3.37Å; L161-Q165 PolarHBondContact O-N 2.87Å
162	E	72	Confident	73.5	Confident	121 Å²	121	107.9 Å²	107.9	57%	0.565	54%	0.539	S	S	*	.	H	α-helix	trans	-64.5	-40.7	176	-73.8	-176.9	166.6	0	0	111.5	I158 Q165 A166	I158-E162 HydrophobicContact CG2-CG 4.24Å; I158-E162 WeakPolarHBondContact O-CG 3.4Å; I158-E162 PolarHBondContact O-N 3.46Å; E162-Q165 PolarHBondContact O-N 3.33Å; E162-A166 VanDerWaalsContact O-CB 3.28Å; E162-A166 WeakPolarHBondContact O-CB 3.41Å; E162-A166 PolarHBondContact O-N 2.95Å
163	F	72.7	Confident	74.1	Confident	136 Å²	136	107 Å²	107	60%	0.596	54%	0.538	S	S	*	.	H	α-helix	trans	-62.5	-44.9	174.4	-175.4	-100.5	0	0	0	111.7	S159 Q165 A166 L167	S159-F163 WeakPolarHBondContact O-CB 3.44Å; S159-F163 PolarHBondContact O-N 2.97Å; F163-Q165 VanDerWaalsContact C-N 3.34Å; F163-Q165 PolarHBondContact O-N 3.1Å; F163-A166 PolarHBondContact O-N 3.32Å; F163-L167 HydrophobicContact CE1-CD1 3.71Å; F163-L167 HydrophobicContact CZ-CD1 3.89Å; F163-L167 WeakPolarHBondContact O-CB 3.41Å; F163-L167 PolarHBondContact O-N 3.37Å
164	Q	73.1	Confident	74.7	Confident	101 Å²	101	104 Å²	104	47%	0.472	54%	0.537	S	S	.	.	H	α-helix	trans	-62.8	-40.7	175.6	-75.7	-172	-23.3	0	0	112.2	H160 L161 L167 M168	H160-Q164 PolarHBondContact CE1-NE2 3.3Å; H160-Q164 VanDerWaalsContact CE1-NE2 3.32Å; H160-Q164 WeakPolarHBondContact O-CG 3.28Å; H160-Q164 PolarHBondContact O-N 2.8Å; H160-Q164 VanDerWaalsContact O-N 3.1Å; L161-Q164 PolarHBondContact O-N 3.46Å; Q164-L167 PolarHBondContact O-N 2.79Å; Q164-M168 WeakPolarHBondContact O-CB 3.22Å; Q164-M168 VanDerWaalsContact O-CG 3.32Å; Q164-M168 WeakPolarHBondContact O-CG 3.22Å; Q164-M168 PolarHBondContact O-N 3.47Å
165	Q	74.3	Confident	75.3	Confident	105 Å²	105	106.2 Å²	106.2	49%	0.491	54%	0.541	S	S	.	.	H	α-helix	trans	-68.9	-39.6	178.3	-162.6	-174.1	22.5	0	0	111.5	L161 E162 F163 L167 M168 K169	L161-Q165 WeakPolarHBondContact O-CB 3.37Å; L161-Q165 PolarHBondContact O-N 2.87Å; E162-Q165 PolarHBondContact O-N 3.33Å; F163-Q165 VanDerWaalsContact C-N 3.34Å; F163-Q165 PolarHBondContact O-N 3.1Å; Q165-L167 VanDerWaalsContact C-N 3.33Å; Q165-M168 PolarHBondContact O-N 2.93Å; Q165-K169 VanDerWaalsContact CD-NZ 3.32Å; Q165-K169 HydrophobicContact CG-CD 4.03Å; Q165-K169 HydrophobicContact CG-CG 4.35Å; Q165-K169 VanDerWaalsContact NE2-CE 3.29Å; Q165-K169 VanDerWaalsContact NE2-NZ 3.11Å; Q165-K169 VanDerWaalsContact O-CB 3.22Å; Q165-K169 WeakPolarHBondContact O-CB 3.48Å; Q165-K169 WeakPolarHBondContact O-CG 3.32Å; Q165-K169 PolarHBondContact O-N 2.83Å
166	A	71.3	Confident	76	Confident	61 Å²	61	103.7 Å²	103.7	50%	0.504	53%	0.531	S	S	.	.	H	α-helix	trans	-63.8	-39.9	175.7	0	0	0	0	0	111.4	E162 F163 G170	E162-A166 VanDerWaalsContact O-CB 3.28Å; E162-A166 WeakPolarHBondContact O-CB 3.41Å; E162-A166 PolarHBondContact O-N 2.95Å; F163-A166 PolarHBondContact O-N 3.32Å; A166-G170 WeakPolarHBondContact O-CA 3.39Å; A166-G170 PolarHBondContact O-N 3.43Å
167	L	73.9	Confident	76.9	Confident	110 Å²	110	101.3 Å²	101.3	58%	0.576	53%	0.525	S	S	*	.	H	α-helix	trans	-70.3	-41.5	178.2	-148.8	153.1	0	0	0	111.5	F163 Q164 Q165 G171	F163-L167 HydrophobicContact CE1-CD1 3.71Å; F163-L167 HydrophobicContact CZ-CD1 3.89Å; F163-L167 WeakPolarHBondContact O-CB 3.41Å; F163-L167 PolarHBondContact O-N 3.37Å; Q164-L167 PolarHBondContact O-N 2.79Å; Q165-L167 VanDerWaalsContact C-N 3.33Å; L167-G171 PolarHBondContact O-N 2.81Å
168	M	74.7	Confident	77.7	Confident	150 Å²	150	100.2 Å²	100.2	74%	0.739	52%	0.522	S	S	*	.	H	α-helix	trans	-66	-44.1	174.1	-75.4	-70	-162.8	0	0	112.3	Q164 Q165 L172	Q164-M168 WeakPolarHBondContact O-CB 3.22Å; Q164-M168 VanDerWaalsContact O-CG 3.32Å; Q164-M168 WeakPolarHBondContact O-CG 3.22Å; Q164-M168 PolarHBondContact O-N 3.47Å; Q165-M168 PolarHBondContact O-N 2.93Å; M168-L172 VanDerWaalsContact O-CB 3.22Å; M168-L172 WeakPolarHBondContact O-CB 3.22Å; M168-L172 PolarHBondContact O-N 3.46Å
169	K	77.5	Confident	78.5	Confident	116 Å²	116	104.1 Å²	104.1	50%	0.504	53%	0.531	S	S	.	.	H	α-helix	trans	-63.9	-47	175.7	-75.9	174.2	175.8	170.6	0	110.7	Q165 L172 T173	Q165-K169 VanDerWaalsContact CD-NZ 3.32Å; Q165-K169 HydrophobicContact CG-CD 4.03Å; Q165-K169 HydrophobicContact CG-CG 4.35Å; Q165-K169 VanDerWaalsContact NE2-CE 3.29Å; Q165-K169 VanDerWaalsContact NE2-NZ 3.11Å; Q165-K169 VanDerWaalsContact O-CB 3.22Å; Q165-K169 WeakPolarHBondContact O-CB 3.48Å; Q165-K169 WeakPolarHBondContact O-CG 3.32Å; Q165-K169 PolarHBondContact O-N 2.83Å; K169-L172 PolarHBondContact O-N 3.01Å; K169-T173 VanDerWaalsContact O-CG2 3.24Å; K169-T173 WeakPolarHBondContact O-CG2 3.37Å; K169-T173 PolarHBondContact O-N 3.18Å; K169-T173 PolarHBondContact O-OG1 3.41Å
170	G	74.9	Confident	79.6	Confident	31 Å²	31	105.6 Å²	105.6	32%	0.32	53%	0.533	S	S	.	.	H	α-helix	trans	-58.7	-51.7	176.4	0	0	0	0	0	111.9	A166 L172 T173 V174	A166-G170 WeakPolarHBondContact O-CA 3.39Å; A166-G170 PolarHBondContact O-N 3.43Å; G170-L172 PolarHBondContact O-N 2.75Å; G170-T173 PolarHBondContact O-N 3.25Å; G170-T173 PolarHBondContact O-OG1 3.39Å; G170-V174 WeakPolarHBondContact O-CG2 3.24Å; G170-V174 PolarHBondContact O-N 2.92Å
171	G	81.5	Confident	80.6	Confident	45 Å²	45	105.3 Å²	105.3	46%	0.464	53%	0.534	S	S	.	.	H	α-helix	trans	-59.8	-43.2	177.6	0	0	0	0	0	113.1	L167 V174 Y175	L167-G171 PolarHBondContact O-N 2.81Å; G171-V174 PolarHBondContact O-N 3.4Å; G171-Y175 WeakPolarHBondContact O-CB 3.4Å; G171-Y175 PolarHBondContact O-N 2.88Å
172	L	81.7	Confident	81.4	Confident	104 Å²	104	108.1 Å²	108.1	55%	0.545	54%	0.538	S	S	.	.	H	α-helix	trans	-63.7	-43.9	176.8	-172.7	72.3	0	0	0	111.6	M168 K169 G170 Y175 I176	M168-L172 VanDerWaalsContact O-CB 3.22Å; M168-L172 WeakPolarHBondContact O-CB 3.22Å; M168-L172 PolarHBondContact O-N 3.46Å; K169-L172 PolarHBondContact O-N 3.01Å; G170-L172 PolarHBondContact O-N 2.75Å; L172-Y175 PolarHBondContact O-N 3.4Å; L172-I176 HydrophobicContact CD1-CD1 4.43Å; L172-I176 HydrophobicContact CD2-CD1 4.38Å; L172-I176 HydrophobicContact CG-CD1 3.89Å; L172-I176 HydrophobicContact CG-CG1 4.49Å; L172-I176 VanDerWaalsContact O-CG1 3.26Å; L172-I176 WeakPolarHBondContact O-CG1 3.35Å; L172-I176 PolarHBondContact O-N 2.9Å
173	T	84	Confident	82.3	Confident	85 Å²	85	110.3 Å²	110.3	52%	0.521	54%	0.541	S	S	.	.	H	α-helix	trans	-63.3	-42.7	178.6	57	0	0	0	0	112.2	K169 G170 I176 L177	K169-T173 VanDerWaalsContact O-CG2 3.24Å; K169-T173 WeakPolarHBondContact O-CG2 3.37Å; K169-T173 PolarHBondContact O-N 3.18Å; K169-T173 PolarHBondContact O-OG1 3.41Å; G170-T173 PolarHBondContact O-N 3.25Å; G170-T173 PolarHBondContact O-OG1 3.39Å; T173-I176 PolarHBondContact O-N 2.91Å; T173-L177 WeakPolarHBondContact O-CB 3.33Å; T173-L177 PolarHBondContact O-N 3.29Å
174	V	82.4	Confident	83.2	Confident	98 Å²	98	107.6 Å²	107.6	59%	0.594	54%	0.535	S	S	*	.	H	α-helix	trans	-65.4	-40.1	175.9	176.5	0	0	0	0	111	G170 G171 L177 Y178	G170-V174 WeakPolarHBondContact O-CG2 3.24Å; G170-V174 PolarHBondContact O-N 2.92Å; G171-V174 PolarHBondContact O-N 3.4Å; V174-L177 PolarHBondContact O-N 2.93Å; V174-Y178 WeakPolarHBondContact O-CB 3.26Å; V174-Y178 PolarHBondContact O-N 2.95Å
175	Y	87.4	Confident	83.9	Confident	140 Å²	140	108.5 Å²	108.5	55%	0.549	54%	0.542	S	S	.	.	H	α-helix	trans	-63.6	-44.1	176.5	178.6	-98.1	0	0	0	112.4	G171 L172 Y178 R179	G171-Y175 WeakPolarHBondContact O-CB 3.4Å; G171-Y175 PolarHBondContact O-N 2.88Å; L172-Y175 PolarHBondContact O-N 3.4Å; Y175-Y178 PolarHBondContact O-N 3.4Å; Y175-R179 WeakPolarHBondContact O-CB 3.47Å; Y175-R179 PolarHBondContact O-N 2.94Å
176	I	87.7	Confident	84.4	Confident	82 Å²	82	111.9 Å²	111.9	42%	0.421	56%	0.555	S	S	.	*	H	α-helix	trans	-62.7	-46.4	176.2	-67.9	165.7	0	0	0	110	L172 T173 Y178 R179 I180	L172-I176 HydrophobicContact CD1-CD1 4.43Å; L172-I176 HydrophobicContact CD2-CD1 4.38Å; L172-I176 HydrophobicContact CG-CD1 3.89Å; L172-I176 HydrophobicContact CG-CG1 4.49Å; L172-I176 VanDerWaalsContact O-CG1 3.26Å; L172-I176 WeakPolarHBondContact O-CG1 3.35Å; L172-I176 PolarHBondContact O-N 2.9Å; T173-I176 PolarHBondContact O-N 2.91Å; I176-Y178 PolarHBondContact O-N 2.89Å; I176-R179 PolarHBondContact O-N 3.41Å; I176-I180 HydrophobicContact CG2-CD1 3.82Å; I176-I180 HydrophobicContact CG2-CG1 4.45Å; I176-I180 WeakPolarHBondContact O-CG1 3.39Å; I176-I180 PolarHBondContact O-N 2.93Å
177	L	88.9	Confident	84.8	Confident	112 Å²	112	114.2 Å²	114.2	59%	0.586	56%	0.559	S	S	*	*	H	α-helix	trans	-60.2	-45.9	178.1	-171.7	71.5	0	0	0	111.6	T173 V174 R179 I180 L181	T173-L177 WeakPolarHBondContact O-CB 3.33Å; T173-L177 PolarHBondContact O-N 3.29Å; V174-L177 PolarHBondContact O-N 2.93Å; L177-R179 VanDerWaalsContact C-N 3.31Å; L177-R179 PolarHBondContact O-N 3.17Å; L177-I180 PolarHBondContact O-N 2.88Å; L177-L181 WeakPolarHBondContact O-CB 3.29Å; L177-L181 PolarHBondContact O-N 3Å
178	Y	90	Very high	84.6	Confident	139 Å²	139	116.1 Å²	116.1	55%	0.545	58%	0.582	S	S	.	*	H	α-helix	trans	-60.2	-40.5	175.5	175.5	-99.5	0	0	0	112	V174 Y175 I176 L181 R182	V174-Y178 WeakPolarHBondContact O-CB 3.26Å; V174-Y178 PolarHBondContact O-N 2.95Å; Y175-Y178 PolarHBondContact O-N 3.4Å; I176-Y178 PolarHBondContact O-N 2.89Å; Y178-L181 PolarHBondContact O-N 3.33Å; Y178-R182 VanDerWaalsContact O-CB 3.29Å; Y178-R182 WeakPolarHBondContact O-CB 3.33Å; Y178-R182 PolarHBondContact O-N 3.28Å
179	R	90.3	Very high	85.1	Confident	171 Å²	171	114.5 Å²	114.5	65%	0.645	57%	0.574	S	S	*	*	H	α-helix	trans	-65.8	-40.4	178	-167.7	178.5	-176.5	171.7	1.9	111.9	Y175 I176 L177 W183	Y175-R179 WeakPolarHBondContact O-CB 3.47Å; Y175-R179 PolarHBondContact O-N 2.94Å; I176-R179 PolarHBondContact O-N 3.41Å; L177-R179 VanDerWaalsContact C-N 3.31Å; L177-R179 PolarHBondContact O-N 3.17Å; R179-W183 WeakPolarHBondContact O-CB 3.47Å; R179-W183 PolarHBondContact O-N 3.24Å
180	I	91	Very high	85.5	Confident	93 Å²	93	114.4 Å²	114.4	48%	0.477	58%	0.578	S	S	.	*	H	α-helix	trans	-64.4	-48.8	174.6	-65.7	165.2	0	0	0	109.8	I176 L177 R182 W183 V184	I176-I180 HydrophobicContact CG2-CD1 3.82Å; I176-I180 HydrophobicContact CG2-CG1 4.45Å; I176-I180 WeakPolarHBondContact O-CG1 3.39Å; I176-I180 PolarHBondContact O-N 2.93Å; L177-I180 PolarHBondContact O-N 2.88Å; I180-R182 VanDerWaalsContact C-N 3.32Å; I180-R182 PolarHBondContact O-N 3.46Å; I180-W183 WeakPolarHBondContact O-CB 3.39Å; I180-W183 PolarHBondContact O-N 3.44Å; I180-W183 VanDerWaalsContact O-N 3.08Å; I180-V184 HydrophobicContact CG2-CG2 4.42Å; I180-V184 WeakPolarHBondContact O-CG2 3.37Å; I180-V184 PolarHBondContact O-N 3.36Å
181	L	90.6	Very high	86.1	Confident	105 Å²	105	119 Å²	119	55%	0.55	59%	0.592	S	S	.	*	H	α-helix	trans	-58.8	-44.2	179.2	-141	84.8	0	0	0	111.6	L177 Y178 W183 V184 I185	L177-L181 WeakPolarHBondContact O-CB 3.29Å; L177-L181 PolarHBondContact O-N 3Å; Y178-L181 PolarHBondContact O-N 3.33Å; L181-W183 VanDerWaalsContact C-N 3.31Å; L181-W183 PolarHBondContact O-N 2.91Å; L181-V184 PolarHBondContact O-N 3.01Å; L181-I185 VanDerWaalsContact O-CG1 3.32Å; L181-I185 WeakPolarHBondContact O-CG1 3.17Å; L181-I185 PolarHBondContact O-N 3.18Å
182	R	89.9	Confident	86.4	Confident	166 Å²	166	123.4 Å²	123.4	63%	0.626	60%	0.599	S	S	*	*	H	α-helix	trans	-64.6	-35.2	176.7	-173.1	174.8	-176	-176.9	2.3	112.4	Y178 I180 K186	Y178-R182 VanDerWaalsContact O-CB 3.29Å; Y178-R182 WeakPolarHBondContact O-CB 3.33Å; Y178-R182 PolarHBondContact O-N 3.28Å; I180-R182 VanDerWaalsContact C-N 3.32Å; I180-R182 PolarHBondContact O-N 3.46Å; R182-K186 WeakPolarHBondContact O-CB 3.41Å; R182-K186 PolarHBondContact O-N 3.02Å
183	W	91.3	Very high	86.7	Confident	166 Å²	166	124.6 Å²	124.6	63%	0.629	60%	0.603	S	S	*	*	H	α-helix	trans	-69.6	-42.5	175.8	-172.9	79.8	0	0	0	111.6	R179 I180 L181 K186 N187	R179-W183 WeakPolarHBondContact O-CB 3.47Å; R179-W183 PolarHBondContact O-N 3.24Å; I180-W183 WeakPolarHBondContact O-CB 3.39Å; I180-W183 PolarHBondContact O-N 3.44Å; I180-W183 VanDerWaalsContact O-N 3.08Å; L181-W183 VanDerWaalsContact C-N 3.31Å; L181-W183 PolarHBondContact O-N 2.91Å; W183-K186 PolarHBondContact O-N 3.44Å; W183-N187 WeakPolarHBondContact CZ2-ND2 3.32Å; W183-N187 WeakPolarHBondContact O-CB 3.47Å; W183-N187 PolarHBondContact O-N 3.08Å
184	V	90.1	Very high	86.9	Confident	79 Å²	79	127.2 Å²	127.2	48%	0.479	61%	0.608	S	S	.	*	H	α-helix	trans	-61.2	-45.8	175.9	173.5	0	0	0	0	111.3	I180 L181 K186 N187 S188	I180-V184 HydrophobicContact CG2-CG2 4.42Å; I180-V184 WeakPolarHBondContact O-CG2 3.37Å; I180-V184 PolarHBondContact O-N 3.36Å; L181-V184 PolarHBondContact O-N 3.01Å; V184-K186 VanDerWaalsContact C-N 3.27Å; V184-K186 PolarHBondContact O-N 2.97Å; V184-N187 PolarHBondContact O-N 3.32Å; V184-S188 WeakPolarHBondContact O-CB 3.34Å; V184-S188 PolarHBondContact O-N 3.36Å
185	I	88.5	Confident	87.2	Confident	121 Å²	121	129.3 Å²	129.3	62%	0.621	61%	0.609	S	S	*	*	H	α-helix	trans	-64.8	-32.1	178.3	-66.4	163.6	0	0	0	111.9	L181	L181-I185 VanDerWaalsContact O-CG1 3.32Å; L181-I185 WeakPolarHBondContact O-CG1 3.17Å; L181-I185 PolarHBondContact O-N 3.18Å
186	K	84.4	Confident	87.2	Confident	175 Å²	175	128.5 Å²	128.5	76%	0.761	61%	0.614	S	S	*	*	H	α-helix	trans	-80	-25.5	-179.6	-168.9	177.6	175.1	-173.1	0	113	R182 W183 V184	R182-K186 WeakPolarHBondContact O-CB 3.41Å; R182-K186 PolarHBondContact O-N 3.02Å; W183-K186 PolarHBondContact O-N 3.44Å; V184-K186 VanDerWaalsContact C-N 3.27Å; V184-K186 PolarHBondContact O-N 2.97Å
187	N	80.8	Confident	87.2	Confident	111 Å²	111	132.3 Å²	132.3	59%	0.594	63%	0.63	S	S	*	*	H	α-helix	trans	-100.3	-6	-179.7	-87.7	15.6	0	0	0	114	W183 V184	W183-N187 WeakPolarHBondContact CZ2-ND2 3.32Å; W183-N187 WeakPolarHBondContact O-CB 3.47Å; W183-N187 PolarHBondContact O-N 3.08Å; V184-N187 PolarHBondContact O-N 3.32Å
188	S	70.2	Confident	87	Confident	150 Å²	150	134.2 Å²	134.2	100%	1.049	63%	0.634	S	S	*	*			trans	-92.3	0	168.7	-175.6	0	0	0	0	111	V184	V184-S188 WeakPolarHBondContact O-CB 3.34Å; V184-S188 PolarHBondContact O-N 3.36Å

Retrieved 188 of 188 residues in 211.1 ms (Link to these results)

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