A0A3Q0KPP2_SCHMA Loading...

Protein Dr1

AlphaFold DB , UniProt , Accession A0A3Q0KPP2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 219 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	49.2	Very low	52.9	Low	243 Å²	243	144.1 Å²	144.1	100%	1.197	79%	0.793	S	S	*	*				0	104.5	0	-79.8	149	83.3	0	0	106.4
2	S	59.4	Low	52.3	Low	121 Å²	121	140.3 Å²	140.3	85%	0.846	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-91	129.9	177.3	-58.4	0	0	0	0	108.2
3	P	61.8	Low	51.8	Low	126 Å²	126	140.8 Å²	140.8	82%	0.818	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-77.7	130.3	-178.6	30.6	-29.4	0	0	0	109.8
4	H	52	Low	51.8	Low	163 Å²	163	144.6 Å²	144.6	76%	0.755	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-69.2	119.2	167.6	-137.8	29.6	0	0	0	107.1	D6	H4-D6 IonicContact CD2-OD1 3.74Å; H4-D6 IonicContact CD2-OD2 3.95Å; H4-D6 PolarHBondContact CD2-OD2 3.07Å; H4-D6 IonicContact CG-OD2 3.58Å; H4-D6 IonicContact NE2-OD1 2.84Å; H4-D6 PolarHBondContact O-N 3.22Å
5	S	51.1	Low	51.6	Low	115 Å²	115	144.3 Å²	144.3	80%	0.804	78%	0.782	S	S	*	*			trans	-87.6	83.8	170.3	48	0	0	0	0	108.1
6	D	51.8	Low	51.8	Low	114 Å²	114	146 Å²	146	61%	0.61	79%	0.791	S	S	*	*			trans	-96.1	81.4	168.7	-67.7	-42.8	0	0	0	108.1	H4	H4-D6 IonicContact CD2-OD1 3.74Å; H4-D6 IonicContact CD2-OD2 3.95Å; H4-D6 PolarHBondContact CD2-OD2 3.07Å; H4-D6 IonicContact CG-OD2 3.58Å; H4-D6 IonicContact NE2-OD1 2.84Å; H4-D6 PolarHBondContact O-N 3.22Å
7	D	49.8	Very low	52.6	Low	151 Å²	151	143.4 Å²	143.4	81%	0.807	77%	0.772	S	S	*	*			trans	-151	60.6	170.8	-73.5	-55.9	0	0	0	109.3	D9	D7-D9 PolarHBondContact O-N 3.46Å
8	D	54.4	Low	54	Low	159 Å²	159	143.3 Å²	143.3	85%	0.85	78%	0.777	S	S	*	*			trans	-80.8	63.5	155.2	-94.8	-49.8	0	0	0	108	F10	D8-F10 VanDerWaalsContact C-N 3.31Å; D8-F10 PolarHBondContact O-N 3.03Å; D8-F10 VanDerWaalsContact O-N 3.08Å
9	D	48.8	Very low	55.7	Low	137 Å²	137	139.6 Å²	139.6	73%	0.733	76%	0.763	S	S	*	*			trans	-74.5	90.7	165.1	-171.4	43.2	0	0	0	106.7	D7 P11	D7-D9 PolarHBondContact O-N 3.46Å; D9-P11 WeakPolarHBondContact O-CD 3.32Å
10	F	55.9	Low	57.5	Low	173 Å²	173	136.3 Å²	136.3	76%	0.759	74%	0.744	S	S	*	*			trans	-65.7	109.6	169.4	-121.2	-94.6	0	0	0	106.7	D8 A12	D8-F10 VanDerWaalsContact C-N 3.31Å; D8-F10 PolarHBondContact O-N 3.03Å; D8-F10 VanDerWaalsContact O-N 3.08Å; F10-A12 PolarHBondContact O-N 3.46Å
11	P	47.6	Very low	59.2	Low	83 Å²	83	133.7 Å²	133.7	54%	0.539	73%	0.734	S	S	.	*			trans	-66.6	111.7	177.9	28.6	-31.5	0	0	0	106.7	D9 K13	D9-P11 WeakPolarHBondContact O-CD 3.32Å; P11-K13 HydrophobicContact CB-CG 4.36Å; P11-K13 PolarHBondContact O-N 3.35Å
12	A	45.9	Very low	61.4	Low	99 Å²	99	128.9 Å²	128.9	82%	0.818	70%	0.702	S	S	*	*			trans	-61.3	74.2	161.6	0	0	0	0	0	107.9	F10 E14	F10-A12 PolarHBondContact O-N 3.46Å; A12-E14 PolarHBondContact O-N 3.39Å
13	K	45.6	Very low	63	Low	146 Å²	146	126.6 Å²	126.6	64%	0.635	69%	0.691	S	S	*	*			trans	-76.2	114.7	162.6	-74.6	-175.8	-179.3	171	0	105	P11 E15	P11-K13 HydrophobicContact CB-CG 4.36Å; P11-K13 PolarHBondContact O-N 3.35Å; K13-E15 HydrophobicContact CB-CG 4.5Å; K13-E15 PolarHBondContact O-N 3.18Å
14	E	51.7	Low	64.7	Low	195 Å²	195	123.6 Å²	123.6	91%	0.911	67%	0.672	S	S	*	*			trans	-58.6	54.6	166.9	-58.3	171.9	155.4	0	0	110.8	A12	A12-E14 PolarHBondContact O-N 3.39Å
15	E	48.8	Very low	66.7	Low	139 Å²	139	116.5 Å²	116.5	65%	0.65	64%	0.64	S	S	*	*			trans	-64.9	133.9	158.5	-67.8	-173.8	-172.3	0	0	105.3	K13 E17	K13-E15 HydrophobicContact CB-CG 4.5Å; K13-E15 PolarHBondContact O-N 3.18Å; E15-E17 HydrophobicContact CB-CG 4.38Å; E15-E17 WeakPolarHBondContact O-CA 3.45Å; E15-E17 WeakPolarHBondContact O-CB 3.36Å; E15-E17 WeakPolarHBondContact O-CG 3.42Å; E15-E17 PolarHBondContact O-N 3.3Å
16	D	55.7	Low	68.7	Low	172 Å²	172	113.9 Å²	113.9	92%	0.92	62%	0.617	S	S	*	*			trans	-58.3	72	177.8	-73	-59.2	0	0	0	110.7	V18	D16-V18 PolarHBondContact O-N 3.2Å; D16-V18 VanDerWaalsContact O-N 3.17Å
17	E	63.9	Low	70.8	Confident	101 Å²	101	115 Å²	115	47%	0.472	62%	0.616	S	S	.	*			trans	-76.3	111.2	-161.4	-95.9	179.2	175.2	0	0	108.2	E15 S19 H51	E15-E17 HydrophobicContact CB-CG 4.38Å; E15-E17 WeakPolarHBondContact O-CA 3.45Å; E15-E17 WeakPolarHBondContact O-CB 3.36Å; E15-E17 WeakPolarHBondContact O-CG 3.42Å; E15-E17 PolarHBondContact O-N 3.3Å; E17-S19 PolarHBondContact O-N 3.2Å; E17-S19 PolarHBondContact O-OG 3.22Å; E17-H51 WeakPolarHBondContact CG-CE1 3.39Å; E17-H51 IonicContact OE1-CE1 3.71Å; E17-H51 IonicContact OE1-NE2 3.05Å; E17-H51 PolarHBondContact OE1-NE2 3.47Å; E17-H51 IonicContact OE2-CD2 3.7Å; E17-H51 IonicContact OE2-CE1 3.87Å; E17-H51 PolarHBondContact OE2-CE1 2.93Å; E17-H51 VanDerWaalsContact OE2-CE1 3.31Å; E17-H51 IonicContact OE2-CG 2.68Å; E17-H51 IonicContact OE2-ND1 3.24Å; E17-H51 IonicContact OE2-NE2 3.61Å; E17-H51 PolarHBondContact OE2-NE2 2.76Å
18	V	78.3	Confident	73	Confident	143 Å²	143	113.6 Å²	113.6	87%	0.867	60%	0.603	S	S	*	*			trans	-48.1	105.1	168.4	178.3	0	0	0	0	108	D16	D16-V18 PolarHBondContact O-N 3.2Å; D16-V18 VanDerWaalsContact O-N 3.17Å
19	S	86.4	Confident	75	Confident	73 Å²	73	106.6 Å²	106.6	51%	0.51	57%	0.566	S	S	.	*			trans	-117.9	155.4	-178.9	55.3	0	0	0	0	109.9	E17	E17-S19 PolarHBondContact O-N 3.2Å; E17-S19 PolarHBondContact O-OG 3.22Å
20	I	91.7	Very high	77.2	Confident	73 Å²	73	107.1 Å²	107.1	37%	0.374	56%	0.562	S	S	.	*			trans	-59.7	136.5	174.5	-59.5	177.1	0	0	0	108.2	R22 C50 I54	I20-R22 PolarHBondContact O-N 3.11Å; I20-C50 HydrophobicContact CD1-CB 4.16Å; I20-I54 HydrophobicContact CD1-CD1 4.26Å; I20-I54 HydrophobicContact CG1-CD1 4.43Å
21	P	94.1	Very high	79.1	Confident	82 Å²	82	104.9 Å²	104.9	53%	0.532	55%	0.554	S	S	.	*			trans	-54.2	131.5	179.5	-27.2	34.2	0	0	0	112.2	A23 S24 L25	P21-A23 PolarHBondContact O-N 2.92Å; P21-A23 VanDerWaalsContact O-N 3.08Å; P21-S24 WeakPolarHBondContact O-CA 3.36Å; P21-S24 WeakPolarHBondContact O-CB 3.45Å; P21-S24 PolarHBondContact O-N 3.38Å; P21-L25 PolarHBondContact O-N 3.25Å
22	R	93.8	Very high	81.4	Confident	142 Å²	142	105 Å²	105	54%	0.536	55%	0.553	S	S	.	*	H	α-helix	trans	-50.7	-37.8	177.8	-65.8	-177.4	162.1	-91.7	0.8	112.7	I20 L25 N26 D44 L47	I20-R22 PolarHBondContact O-N 3.11Å; R22-L25 PolarHBondContact O-N 3.04Å; R22-N26 WeakPolarHBondContact O-CB 3.43Å; R22-N26 VanDerWaalsContact O-CG 3.26Å; R22-N26 PolarHBondContact O-N 3.2Å; R22-N26 PolarHBondContact O-ND2 3.3Å; R22-D44 IonicContact CZ-OD1 3.31Å; R22-D44 IonicContact NH1-OD1 3.3Å; R22-D44 PolarHBondContact NH1-OD1 2.93Å; R22-D44 IonicContact NH2-OD1 3.68Å; R22-D44 PolarHBondContact NH2-OD1 2.87Å; R22-L47 HydrophobicContact CG-CD1 3.74Å
23	A	94.9	Very high	83.8	Confident	73 Å²	73	104.3 Å²	104.3	60%	0.603	54%	0.535	S	S	*	.	H	α-helix	trans	-62.3	-40.4	177.4	0	0	0	0	0	112.5	P21 N26 K27	P21-A23 PolarHBondContact O-N 2.92Å; P21-A23 VanDerWaalsContact O-N 3.08Å; A23-N26 PolarHBondContact O-N 2.89Å; A23-K27 WeakPolarHBondContact O-CB 3.24Å; A23-K27 PolarHBondContact O-N 3.42Å
24	S	95.7	Very high	86.1	Confident	62 Å²	62	101.9 Å²	101.9	43%	0.434	53%	0.534	S	S	.	.	H	α-helix	trans	-65.6	-44.8	177.8	-56.8	0	0	0	0	111.2	P21 N26 K27 F28	P21-S24 WeakPolarHBondContact O-CA 3.36Å; P21-S24 WeakPolarHBondContact O-CB 3.45Å; P21-S24 PolarHBondContact O-N 3.38Å; S24-N26 VanDerWaalsContact C-N 3.35Å; S24-N26 PolarHBondContact O-N 2.82Å; S24-K27 PolarHBondContact O-N 3.39Å; S24-F28 PolarHBondContact O-N 3.4Å
25	L	95	Very high	88.1	Confident	14 Å²	14	100.2 Å²	100.2	7%	0.073	53%	0.531	C	S	.	.	H	α-helix	trans	-62.1	-43.4	174.8	-176	71.3	0	0	0	111.3	P21 R22 K27 F28 V29 L46 L47	P21-L25 PolarHBondContact O-N 3.25Å; R22-L25 PolarHBondContact O-N 3.04Å; L25-K27 VanDerWaalsContact C-N 3.29Å; L25-K27 PolarHBondContact O-N 3.04Å; L25-F28 PolarHBondContact O-N 2.93Å; L25-V29 HydrophobicContact CD1-CG2 4.49Å; L25-V29 HydrophobicContact CG-CG2 4.33Å; L25-V29 WeakPolarHBondContact O-CG2 3.47Å; L25-V29 PolarHBondContact O-N 3.03Å; L25-L46 HydrophobicContact CD2-CB 3.86Å; L25-L47 HydrophobicContact CB-CD2 4.05Å; L25-L47 HydrophobicContact CD2-CB 4.45Å; L25-L47 HydrophobicContact CD2-CD1 4.47Å; L25-L47 HydrophobicContact CD2-CD2 3.56Å; L25-L47 HydrophobicContact CD2-CG 3.5Å; L25-L47 VanDerWaalsContact CD2-CG 3.5Å; L25-L47 HydrophobicContact CG-CD2 4.39Å
26	N	93.4	Very high	90.2	Very high	61 Å²	61	95.8 Å²	95.8	33%	0.326	52%	0.519	S	S	.	.	H	α-helix	trans	-61.5	-37.7	178	-78	-29.3	0	0	0	112.8	R22 A23 S24 K30 R43	R22-N26 WeakPolarHBondContact O-CB 3.43Å; R22-N26 VanDerWaalsContact O-CG 3.26Å; R22-N26 PolarHBondContact O-N 3.2Å; R22-N26 PolarHBondContact O-ND2 3.3Å; A23-N26 PolarHBondContact O-N 2.89Å; S24-N26 VanDerWaalsContact C-N 3.35Å; S24-N26 PolarHBondContact O-N 2.82Å; N26-K30 WeakPolarHBondContact O-CG 3.48Å; N26-K30 PolarHBondContact O-N 3.44Å; N26-R43 WeakPolarHBondContact OD1-CD 3.26Å; N26-R43 PolarHBondContact OD1-NE 2.84Å
27	K	95.6	Very high	92	Very high	137 Å²	137	99 Å²	99	60%	0.596	52%	0.518	S	S	*	.	H	α-helix	trans	-64.6	-50.3	174.2	-171.5	-173.3	178	-155	0	110.3	A23 S24 L25 V29 K30 E31	A23-K27 WeakPolarHBondContact O-CB 3.24Å; A23-K27 PolarHBondContact O-N 3.42Å; S24-K27 PolarHBondContact O-N 3.39Å; L25-K27 VanDerWaalsContact C-N 3.29Å; L25-K27 PolarHBondContact O-N 3.04Å; K27-V29 PolarHBondContact O-N 3.5Å; K27-K30 PolarHBondContact O-N 2.86Å; K27-K30 VanDerWaalsContact O-N 3.17Å; K27-E31 WeakPolarHBondContact CE-OE1 3.28Å; K27-E31 IonicContact NZ-OE1 2.86Å; K27-E31 WeakPolarHBondContact O-CG 3.5Å; K27-E31 PolarHBondContact O-N 3.16Å; K27-E31 VanDerWaalsContact O-N 3.09Å
28	F	95.9	Very high	93.5	Very high	121 Å²	121	96.1 Å²	96.1	53%	0.531	51%	0.505	S	S	.	.	H	α-helix	trans	-57.1	-46.4	178.2	177.1	-102.4	0	0	0	112.7	S24 L25 K30 E31 V32	S24-F28 PolarHBondContact O-N 3.4Å; L25-F28 PolarHBondContact O-N 2.93Å; F28-K30 VanDerWaalsContact C-N 3.3Å; F28-K30 PolarHBondContact O-N 3.17Å; F28-E31 PolarHBondContact O-N 3.43Å; F28-E31 VanDerWaalsContact O-N 3.12Å; F28-V32 HydrophobicContact CD1-CG2 4.46Å; F28-V32 HydrophobicContact CD2-CG2 4.29Å; F28-V32 HydrophobicContact CE1-CG2 4.04Å; F28-V32 HydrophobicContact CE2-CG2 3.85Å; F28-V32 HydrophobicContact CZ-CG2 3.71Å; F28-V32 WeakPolarHBondContact O-CG2 3.44Å; F28-V32 PolarHBondContact O-N 3.29Å
29	V	95.8	Very high	94.3	Very high	12 Å²	12	93.1 Å²	93.1	7%	0.073	49%	0.488	C	S	.	.	H	α-helix	trans	-58.1	-41.8	177.8	166.8	0	0	0	0	111.7	L25 K27 E31 V32 L33 L38 L46	L25-V29 HydrophobicContact CD1-CG2 4.49Å; L25-V29 HydrophobicContact CG-CG2 4.33Å; L25-V29 WeakPolarHBondContact O-CG2 3.47Å; L25-V29 PolarHBondContact O-N 3.03Å; K27-V29 PolarHBondContact O-N 3.5Å; V29-E31 VanDerWaalsContact C-N 3.34Å; V29-V32 PolarHBondContact O-N 2.98Å; V29-L33 WeakPolarHBondContact O-CA 3.42Å; V29-L33 PolarHBondContact O-N 2.89Å; V29-L38 HydrophobicContact CG1-CD1 3.49Å; V29-L38 VanDerWaalsContact CG1-CD1 3.49Å; V29-L38 HydrophobicContact CG1-CG 4.1Å; V29-L38 HydrophobicContact CG2-CD1 4.19Å; V29-L46 HydrophobicContact CG2-CD1 4.17Å
30	K	94.9	Very high	94.7	Very high	149 Å²	149	94.4 Å²	94.4	65%	0.648	49%	0.492	S	S	*	.	H	α-helix	trans	-70.9	-29.4	178.7	-73.2	-179.9	177.8	-176.6	0	113	N26 K27 F28 P34	N26-K30 WeakPolarHBondContact O-CG 3.48Å; N26-K30 PolarHBondContact O-N 3.44Å; K27-K30 PolarHBondContact O-N 2.86Å; K27-K30 VanDerWaalsContact O-N 3.17Å; F28-K30 VanDerWaalsContact C-N 3.3Å; F28-K30 PolarHBondContact O-N 3.17Å; K30-P34 WeakPolarHBondContact O-CA 3.39Å
31	E	96.5	Very high	94.9	Very high	125 Å²	125	98.4 Å²	98.4	58%	0.584	51%	0.51	S	S	*	.	H	α-helix	trans	-70.9	-40.1	175.2	-72	172.4	179.9	0	0	111.2	K27 F28 V29	K27-E31 WeakPolarHBondContact CE-OE1 3.28Å; K27-E31 IonicContact NZ-OE1 2.86Å; K27-E31 WeakPolarHBondContact O-CG 3.5Å; K27-E31 PolarHBondContact O-N 3.16Å; K27-E31 VanDerWaalsContact O-N 3.09Å; F28-E31 PolarHBondContact O-N 3.43Å; F28-E31 VanDerWaalsContact O-N 3.12Å; V29-E31 VanDerWaalsContact C-N 3.34Å
32	V	96.3	Very high	95	Very high	86 Å²	86	97.1 Å²	97.1	52%	0.521	50%	0.5	S	S	.	.	H	α-helix	trans	-81.2	-38.6	179.6	-178.2	0	0	0	0	112.4	F28 V29	F28-V32 HydrophobicContact CD1-CG2 4.46Å; F28-V32 HydrophobicContact CD2-CG2 4.29Å; F28-V32 HydrophobicContact CE1-CG2 4.04Å; F28-V32 HydrophobicContact CE2-CG2 3.85Å; F28-V32 HydrophobicContact CZ-CG2 3.71Å; F28-V32 WeakPolarHBondContact O-CG2 3.44Å; F28-V32 PolarHBondContact O-N 3.29Å; V29-V32 PolarHBondContact O-N 2.98Å
33	L	95.2	Very high	95	Very high	85 Å²	85	93.3 Å²	93.3	45%	0.445	49%	0.486	S	S	.	.			trans	-131.8	74.6	-174.3	-59.9	176	0	0	0	111.1	V29 D35 A36	V29-L33 WeakPolarHBondContact O-CA 3.42Å; V29-L33 PolarHBondContact O-N 2.89Å; L33-D35 VanDerWaalsContact C-N 3.33Å; L33-D35 PolarHBondContact O-N 3.43Å; L33-A36 HydrophobicContact CB-CB 3.71Å; L33-A36 HydrophobicContact CD1-CB 4.28Å; L33-A36 PolarHBondContact O-N 3.28Å
34	P	94.4	Very high	95	Very high	94 Å²	94	92.1 Å²	92.1	61%	0.61	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-35.8	-173.2	22.6	-33.5	0	0	0	113.9	K30	K30-P34 WeakPolarHBondContact O-CA 3.39Å
35	D	94.6	Very high	95	Very high	160 Å²	160	94.1 Å²	94.1	86%	0.856	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-6.1	-175.6	-58.8	-47.9	0	0	0	113.5	L33	L33-D35 VanDerWaalsContact C-N 3.33Å; L33-D35 PolarHBondContact O-N 3.43Å
36	A	93	Very high	95	Very high	46 Å²	46	96.5 Å²	96.5	38%	0.38	49%	0.487	S	S	.	.			trans	-85	131.9	-174.8	0	0	0	0	0	112	L33	L33-A36 HydrophobicContact CB-CB 3.71Å; L33-A36 HydrophobicContact CD1-CB 4.28Å; L33-A36 PolarHBondContact O-N 3.28Å
37	R	93.4	Very high	95	Very high	240 Å²	240	94.3 Å²	94.3	91%	0.906	48%	0.475	S	S	*	.			trans	-98.5	99.2	170.9	-64.8	179.5	67.8	-172.7	0.9	109.6
38	L	94.4	Very high	95	Very high	40 Å²	40	92.5 Å²	92.5	21%	0.209	47%	0.472	C	S	.	.			trans	-77.2	150.7	169.3	-54.8	-170.6	0	0	0	110.7	V29 T42 R43 L46	V29-L38 HydrophobicContact CG1-CD1 3.49Å; V29-L38 VanDerWaalsContact CG1-CD1 3.49Å; V29-L38 HydrophobicContact CG1-CG 4.1Å; V29-L38 HydrophobicContact CG2-CD1 4.19Å; L38-T42 HydrophobicContact CD1-CG2 4.33Å; L38-T42 HydrophobicContact CD2-CG2 4.37Å; L38-R43 VanDerWaalsContact C-NH1 3.32Å; L38-R43 HydrophobicContact CB-CG 4.31Å; L38-R43 PolarHBondContact O-NH1 3.22Å; L38-R43 PolarHBondContact O-NH2 3.41Å; L38-L46 HydrophobicContact CD1-CD1 3.91Å
39	T	96	Very high	95	Very high	80 Å²	80	89.9 Å²	89.9	49%	0.491	47%	0.468	S	S	.	.			trans	-77.8	171	168.8	65	0	0	0	0	110.3	T42 R43	T39-T42 PolarHBondContact OG1-N 3Å; T39-T42 PolarHBondContact OG1-OG1 2.82Å; T39-R43 WeakPolarHBondContact O-CG 3.5Å; T39-R43 PolarHBondContact O-N 3.12Å; T39-R43 PolarHBondContact O-NH1 3.19Å
40	T	94.1	Very high	95	Very high	100 Å²	100	91.1 Å²	91.1	61%	0.613	48%	0.477	S	S	*	.	H	α-helix	trans	-64.7	-45	173.8	-53.4	0	0	0	0	110.7	T42 R43 D44	T40-T42 PolarHBondContact O-N 3.02Å; T40-R43 WeakPolarHBondContact O-CA 3.46Å; T40-R43 WeakPolarHBondContact O-CB 3.5Å; T40-R43 PolarHBondContact O-N 3.02Å; T40-D44 PolarHBondContact O-N 3.23Å
41	E	96	Very high	94.9	Very high	157 Å²	157	85 Å²	85	73%	0.734	45%	0.451	S	S	*	.	H	α-helix	trans	-58.3	-42.8	179.3	-174.2	179.3	-171.6	0	0	112.9	R43 D44 L45	E41-R43 VanDerWaalsContact C-N 3.26Å; E41-R43 PolarHBondContact O-N 3.26Å; E41-D44 PolarHBondContact O-N 3.11Å; E41-L45 PolarHBondContact O-N 3.46Å
42	T	96	Very high	94.8	Very high	55 Å²	55	82.8 Å²	82.8	34%	0.337	45%	0.448	S	S	.	.	H	α-helix	trans	-62.7	-34.6	175.3	-54.2	0	0	0	0	112	L38 T39 T40 L45 L46	L38-T42 HydrophobicContact CD1-CG2 4.33Å; L38-T42 HydrophobicContact CD2-CG2 4.37Å; T39-T42 PolarHBondContact OG1-N 3Å; T39-T42 PolarHBondContact OG1-OG1 2.82Å; T40-T42 PolarHBondContact O-N 3.02Å; T42-L45 PolarHBondContact O-N 3.37Å; T42-L46 WeakPolarHBondContact O-CG 3.45Å; T42-L46 PolarHBondContact O-N 2.89Å
43	R	94.6	Very high	94.8	Very high	63 Å²	63	83 Å²	83	24%	0.238	44%	0.442	C	S	.	.	H	α-helix	trans	-70.9	-38.8	176.7	-68.6	179.2	176.1	86.2	4.3	111.8	N26 L38 T39 T40 E41 L45 L46 L47	N26-R43 WeakPolarHBondContact OD1-CD 3.26Å; N26-R43 PolarHBondContact OD1-NE 2.84Å; L38-R43 VanDerWaalsContact C-NH1 3.32Å; L38-R43 HydrophobicContact CB-CG 4.31Å; L38-R43 PolarHBondContact O-NH1 3.22Å; L38-R43 PolarHBondContact O-NH2 3.41Å; T39-R43 WeakPolarHBondContact O-CG 3.5Å; T39-R43 PolarHBondContact O-N 3.12Å; T39-R43 PolarHBondContact O-NH1 3.19Å; T40-R43 WeakPolarHBondContact O-CA 3.46Å; T40-R43 WeakPolarHBondContact O-CB 3.5Å; T40-R43 PolarHBondContact O-N 3.02Å; E41-R43 VanDerWaalsContact C-N 3.26Å; E41-R43 PolarHBondContact O-N 3.26Å; R43-L45 VanDerWaalsContact C-N 3.32Å; R43-L46 PolarHBondContact O-N 3.08Å; R43-L47 WeakPolarHBondContact O-CG 3.38Å; R43-L47 PolarHBondContact O-N 2.95Å
44	D	93.7	Very high	94.8	Very high	47 Å²	47	83.1 Å²	83.1	25%	0.251	44%	0.442	S	S	.	.	H	α-helix	trans	-63	-42.3	174	-67	-36.9	0	0	0	110.9	R22 T40 E41 L46 L47 N48	R22-D44 IonicContact CZ-OD1 3.31Å; R22-D44 IonicContact NH1-OD1 3.3Å; R22-D44 PolarHBondContact NH1-OD1 2.93Å; R22-D44 IonicContact NH2-OD1 3.68Å; R22-D44 PolarHBondContact NH2-OD1 2.87Å; T40-D44 PolarHBondContact O-N 3.23Å; E41-D44 PolarHBondContact O-N 3.11Å; D44-L46 PolarHBondContact O-N 2.93Å; D44-L47 WeakPolarHBondContact O-CB 3.41Å; D44-L47 PolarHBondContact O-N 2.86Å; D44-N48 PolarHBondContact O-N 2.79Å
45	L	95.8	Very high	94.9	Very high	105 Å²	105	83.4 Å²	83.4	55%	0.55	44%	0.435	S	S	.	.	H	α-helix	trans	-59.6	-45.8	173.4	-178.8	62.4	0	0	0	111.9	E41 T42 R43 L47 N48 C49	E41-L45 PolarHBondContact O-N 3.46Å; T42-L45 PolarHBondContact O-N 3.37Å; R43-L45 VanDerWaalsContact C-N 3.32Å; L45-L47 VanDerWaalsContact C-N 3.33Å; L45-L47 PolarHBondContact O-N 3.45Å; L45-N48 PolarHBondContact O-N 3.16Å; L45-C49 PolarHBondContact O-N 3.18Å; L45-C49 PolarHBondContact O-SG 2.99Å
46	L	95.9	Very high	95	Very high	64 Å²	64	80.6 Å²	80.6	34%	0.335	42%	0.416	S	S	.	.	H	α-helix	trans	-61.7	-38.7	177.5	-75	172	0	0	0	112.4	L25 V29 L38 T42 R43 D44 C49 C50	L25-L46 HydrophobicContact CD2-CB 3.86Å; V29-L46 HydrophobicContact CG2-CD1 4.17Å; L38-L46 HydrophobicContact CD1-CD1 3.91Å; T42-L46 WeakPolarHBondContact O-CG 3.45Å; T42-L46 PolarHBondContact O-N 2.89Å; R43-L46 PolarHBondContact O-N 3.08Å; D44-L46 PolarHBondContact O-N 2.93Å; L46-C49 PolarHBondContact O-N 3.3Å; L46-C50 PolarHBondContact O-N 3.41Å; L46-C50 PolarHBondContact O-SG 3.22Å
47	L	94.1	Very high	95.2	Very high	14 Å²	14	79.6 Å²	79.6	7%	0.073	40%	0.404	C	S	.	.	H	α-helix	trans	-60.7	-46.5	174.2	-73.1	164.6	0	0	0	111.4	R22 L25 R43 D44 L45 C49 C50 H51	R22-L47 HydrophobicContact CG-CD1 3.74Å; L25-L47 HydrophobicContact CB-CD2 4.05Å; L25-L47 HydrophobicContact CD2-CB 4.45Å; L25-L47 HydrophobicContact CD2-CD1 4.47Å; L25-L47 HydrophobicContact CD2-CD2 3.56Å; L25-L47 HydrophobicContact CD2-CG 3.5Å; L25-L47 VanDerWaalsContact CD2-CG 3.5Å; L25-L47 HydrophobicContact CG-CD2 4.39Å; R43-L47 WeakPolarHBondContact O-CG 3.38Å; R43-L47 PolarHBondContact O-N 2.95Å; D44-L47 WeakPolarHBondContact O-CB 3.41Å; D44-L47 PolarHBondContact O-N 2.86Å; L45-L47 VanDerWaalsContact C-N 3.33Å; L45-L47 PolarHBondContact O-N 3.45Å; L47-C49 VanDerWaalsContact C-N 3.32Å; L47-C49 PolarHBondContact O-N 3.38Å; L47-C50 WeakPolarHBondContact O-CB 3.34Å; L47-C50 PolarHBondContact O-N 3.25Å; L47-H51 PolarHBondContact O-N 3.5Å
48	N	94.1	Very high	95.4	Very high	99 Å²	99	70.4 Å²	70.4	53%	0.529	38%	0.379	S	S	.	.	H	α-helix	trans	-63.1	-40.5	177.4	-65.6	-8.9	0	0	0	110.8	D44 L45 C50 H51 C52	D44-N48 PolarHBondContact O-N 2.79Å; L45-N48 PolarHBondContact O-N 3.16Å; N48-C50 PolarHBondContact O-N 2.94Å; N48-H51 WeakPolarHBondContact O-CB 3.32Å; N48-H51 PolarHBondContact O-N 3.34Å; N48-C52 WeakPolarHBondContact O-CB 3.28Å; N48-C52 PolarHBondContact O-N 3.42Å; N48-C52 PolarHBondContact O-SG 3.3Å; N48-C52 VanDerWaalsContact O-SG 3.32Å
49	C	95.6	Very high	95.6	Very high	67 Å²	67	72 Å²	72	45%	0.453	39%	0.39	S	S	.	.	H	α-helix	trans	-61.1	-42.9	173.6	-67.6	0	0	0	0	112.2	L45 L46 L47 H51 C52 F53	L45-C49 PolarHBondContact O-N 3.18Å; L45-C49 PolarHBondContact O-SG 2.99Å; L46-C49 PolarHBondContact O-N 3.3Å; L47-C49 VanDerWaalsContact C-N 3.32Å; L47-C49 PolarHBondContact O-N 3.38Å; C49-H51 VanDerWaalsContact C-N 3.34Å; C49-C52 PolarHBondContact O-N 3.46Å; C49-F53 WeakPolarHBondContact O-CB 3.41Å; C49-F53 PolarHBondContact O-N 2.86Å
50	C	95.7	Very high	95.7	Very high	37 Å²	37	69.8 Å²	69.8	25%	0.25	38%	0.375	C	S	.	.	H	α-helix	trans	-62.5	-41.6	175.6	-70.2	0	0	0	0	111.9	I20 L46 L47 N48 F53 I54	I20-C50 HydrophobicContact CD1-CB 4.16Å; L46-C50 PolarHBondContact O-N 3.41Å; L46-C50 PolarHBondContact O-SG 3.22Å; L47-C50 WeakPolarHBondContact O-CB 3.34Å; L47-C50 PolarHBondContact O-N 3.25Å; N48-C50 PolarHBondContact O-N 2.94Å; C50-F53 PolarHBondContact O-N 3.28Å; C50-I54 WeakPolarHBondContact O-CG1 3.29Å; C50-I54 PolarHBondContact O-N 2.84Å; C50-I54 VanDerWaalsContact O-N 3.13Å
51	H	93.5	Very high	95.9	Very high	22 Å²	22	65 Å²	65	10%	0.102	35%	0.345	C	S	.	.	H	α-helix	trans	-60.6	-56.9	175.5	-175.5	96.1	0	0	0	110.5	E17 L47 N48 C49 F53 I54 H55	E17-H51 WeakPolarHBondContact CG-CE1 3.39Å; E17-H51 IonicContact OE1-CE1 3.71Å; E17-H51 IonicContact OE1-NE2 3.05Å; E17-H51 PolarHBondContact OE1-NE2 3.47Å; E17-H51 IonicContact OE2-CD2 3.7Å; E17-H51 IonicContact OE2-CE1 3.87Å; E17-H51 PolarHBondContact OE2-CE1 2.93Å; E17-H51 VanDerWaalsContact OE2-CE1 3.31Å; E17-H51 IonicContact OE2-CG 2.68Å; E17-H51 IonicContact OE2-ND1 3.24Å; E17-H51 IonicContact OE2-NE2 3.61Å; E17-H51 PolarHBondContact OE2-NE2 2.76Å; L47-H51 PolarHBondContact O-N 3.5Å; N48-H51 WeakPolarHBondContact O-CB 3.32Å; N48-H51 PolarHBondContact O-N 3.34Å; C49-H51 VanDerWaalsContact C-N 3.34Å; H51-F53 PolarHBondContact O-N 3.28Å; H51-I54 PolarHBondContact O-N 2.97Å; H51-I54 VanDerWaalsContact O-N 3.13Å; H51-H55 AromaticContact CD2-CD2 3.48Å; H51-H55 PolarHBondContact CD2-CD2 3.36Å; H51-H55 VanDerWaalsContact CD2-CD2 3.48Å; H51-H55 AromaticContact CD2-NE2 3.97Å; H51-H55 AromaticContact CE1-CD2 3.65Å; H51-H55 AromaticContact CE1-NE2 3.32Å; H51-H55 PolarHBondContact CE1-NE2 3.49Å; H51-H55 VanDerWaalsContact CE1-NE2 3.32Å; H51-H55 AromaticContact NE2-CD2 3.06Å; H51-H55 PolarHBondContact NE2-CD2 2.9Å; H51-H55 AromaticContact NE2-NE2 3.1Å; H51-H55 PolarHBondContact NE2-NE2 2.98Å; H51-H55 VanDerWaalsContact NE2-NE2 3.1Å; H51-H55 PolarHBondContact O-CD2 3.37Å; H51-H55 VanDerWaalsContact O-CD2 3.3Å; H51-H55 PolarHBondContact O-N 3.3Å
52	C	94.1	Very high	96	Very high	78 Å²	78	61.4 Å²	61.4	53%	0.527	33%	0.331	S	S	.	.	H	α-helix	trans	-56.7	-37.6	177.8	-68.3	0	0	0	0	112.6	N48 C49 H55 K56	N48-C52 WeakPolarHBondContact O-CB 3.28Å; N48-C52 PolarHBondContact O-N 3.42Å; N48-C52 PolarHBondContact O-SG 3.3Å; N48-C52 VanDerWaalsContact O-SG 3.32Å; C49-C52 PolarHBondContact O-N 3.46Å; C52-H55 PolarHBondContact O-N 3.08Å; C52-K56 VanDerWaalsContact O-CB 3.3Å; C52-K56 WeakPolarHBondContact O-CB 3.1Å; C52-K56 PolarHBondContact O-N 3.41Å
53	F	96.9	Very high	96.1	Very high	90 Å²	90	61.8 Å²	61.8	40%	0.395	33%	0.33	S	S	.	.	H	α-helix	trans	-61.3	-47.5	177.3	173.6	-100.7	0	0	0	112.1	C49 C50 H51 H55 K56 L57 M85 L87	C49-F53 WeakPolarHBondContact O-CB 3.41Å; C49-F53 PolarHBondContact O-N 2.86Å; C50-F53 PolarHBondContact O-N 3.28Å; H51-F53 PolarHBondContact O-N 3.28Å; F53-H55 VanDerWaalsContact C-N 3.34Å; F53-H55 PolarHBondContact O-N 3.25Å; F53-K56 PolarHBondContact O-N 3Å; F53-L57 HydrophobicContact CE1-CD2 4.2Å; F53-L57 HydrophobicContact CZ-CD2 4.08Å; F53-L57 WeakPolarHBondContact O-CB 3.48Å; F53-L57 PolarHBondContact O-N 2.96Å; F53-M85 HydrophobicContact CD2-CE 3.78Å; F53-M85 HydrophobicContact CE2-CE 3.74Å; F53-L87 HydrophobicContact CE2-CD1 3.69Å
54	I	95.6	Very high	96.2	Very high	88 Å²	88	59.1 Å²	59.1	45%	0.451	32%	0.322	S	S	.	.	H	α-helix	trans	-60.1	-46.7	178.7	-69.1	166.8	0	0	0	110.2	I20 C50 H51 L57 A58	I20-I54 HydrophobicContact CD1-CD1 4.26Å; I20-I54 HydrophobicContact CG1-CD1 4.43Å; C50-I54 WeakPolarHBondContact O-CG1 3.29Å; C50-I54 PolarHBondContact O-N 2.84Å; C50-I54 VanDerWaalsContact O-N 3.13Å; H51-I54 PolarHBondContact O-N 2.97Å; H51-I54 VanDerWaalsContact O-N 3.13Å; I54-L57 PolarHBondContact O-N 3.18Å; I54-A58 VanDerWaalsContact O-CB 3.25Å; I54-A58 WeakPolarHBondContact O-CB 3.47Å; I54-A58 PolarHBondContact O-N 3.16Å
55	H	95.3	Very high	96.4	Very high	100 Å²	100	57 Å²	57	46%	0.463	31%	0.31	S	S	.	.	H	α-helix	trans	-65.4	-41.1	179.9	-78.8	-81.8	0	0	0	112.7	H51 C52 F53 A58 T59	H51-H55 AromaticContact CD2-CD2 3.48Å; H51-H55 PolarHBondContact CD2-CD2 3.36Å; H51-H55 VanDerWaalsContact CD2-CD2 3.48Å; H51-H55 AromaticContact CD2-NE2 3.97Å; H51-H55 AromaticContact CE1-CD2 3.65Å; H51-H55 AromaticContact CE1-NE2 3.32Å; H51-H55 PolarHBondContact CE1-NE2 3.49Å; H51-H55 VanDerWaalsContact CE1-NE2 3.32Å; H51-H55 AromaticContact NE2-CD2 3.06Å; H51-H55 PolarHBondContact NE2-CD2 2.9Å; H51-H55 AromaticContact NE2-NE2 3.1Å; H51-H55 PolarHBondContact NE2-NE2 2.98Å; H51-H55 VanDerWaalsContact NE2-NE2 3.1Å; H51-H55 PolarHBondContact O-CD2 3.37Å; H51-H55 VanDerWaalsContact O-CD2 3.3Å; H51-H55 PolarHBondContact O-N 3.3Å; C52-H55 PolarHBondContact O-N 3.08Å; F53-H55 VanDerWaalsContact C-N 3.34Å; F53-H55 PolarHBondContact O-N 3.25Å; H55-A58 PolarHBondContact O-N 2.88Å; H55-T59 WeakPolarHBondContact O-CB 3.42Å; H55-T59 PolarHBondContact O-N 3.28Å; H55-T59 PolarHBondContact O-OG1 2.99Å
56	K	97.1	Very high	96.5	Very high	101 Å²	101	55.2 Å²	55.2	44%	0.439	31%	0.307	S	S	.	.	H	α-helix	trans	-64.3	-47.7	176.8	-176.1	54.8	170.1	166.7	0	111.2	C52 F53 A58 T59 E60 M85	C52-K56 VanDerWaalsContact O-CB 3.3Å; C52-K56 WeakPolarHBondContact O-CB 3.1Å; C52-K56 PolarHBondContact O-N 3.41Å; F53-K56 PolarHBondContact O-N 3Å; K56-A58 PolarHBondContact O-N 3.45Å; K56-T59 WeakPolarHBondContact O-CB 3.34Å; K56-T59 PolarHBondContact O-N 3.46Å; K56-E60 HydrophobicContact CD-CG 4.45Å; K56-E60 WeakPolarHBondContact CE-OE1 3.24Å; K56-E60 IonicContact NZ-OE1 3.18Å; K56-E60 PolarHBondContact NZ-OE1 3.23Å; K56-E60 WeakPolarHBondContact O-CG 3.35Å; K56-E60 PolarHBondContact O-N 2.81Å; K56-M85 HydrophobicContact CB-CE 4.16Å; K56-M85 HydrophobicContact CG-CE 3.77Å; K56-M85 HydrophobicContact CG-CG 4.42Å; K56-M85 HydrophobicContact CG-SD 4.09Å
57	L	97.7	Very high	96.6	Very high	25 Å²	25	60 Å²	60	13%	0.131	33%	0.325	C	S	.	.	H	α-helix	trans	-62.9	-42.1	177.9	-179.3	59.3	0	0	0	111.9	F53 I54 T59 E60 A61 I78 L82 M85	F53-L57 HydrophobicContact CE1-CD2 4.2Å; F53-L57 HydrophobicContact CZ-CD2 4.08Å; F53-L57 WeakPolarHBondContact O-CB 3.48Å; F53-L57 PolarHBondContact O-N 2.96Å; I54-L57 PolarHBondContact O-N 3.18Å; L57-T59 VanDerWaalsContact C-N 3.3Å; L57-T59 PolarHBondContact O-N 3.45Å; L57-E60 PolarHBondContact O-N 2.92Å; L57-A61 VanDerWaalsContact O-CB 3.27Å; L57-A61 WeakPolarHBondContact O-CB 3.37Å; L57-A61 PolarHBondContact O-N 3.37Å; L57-I78 HydrophobicContact CD1-CG2 4.43Å; L57-I78 HydrophobicContact CD2-CG2 4.23Å; L57-L82 HydrophobicContact CD1-CD2 3.9Å; L57-L82 HydrophobicContact CD1-CG 4.09Å; L57-L82 HydrophobicContact CD2-CD2 4.31Å; L57-M85 VanDerWaalsContact CA-SD 3.58Å; L57-M85 HydrophobicContact CB-SD 3.84Å; L57-M85 HydrophobicContact CD1-SD 3.84Å; L57-M85 HydrophobicContact CG-SD 4.45Å
58	A	97.1	Very high	96.7	Very high	46 Å²	46	61.5 Å²	61.5	38%	0.38	34%	0.339	S	S	.	.	H	α-helix	trans	-61	-39.8	175.4	0	0	0	0	0	111.8	I54 H55 K56 N62	I54-A58 VanDerWaalsContact O-CB 3.25Å; I54-A58 WeakPolarHBondContact O-CB 3.47Å; I54-A58 PolarHBondContact O-N 3.16Å; H55-A58 PolarHBondContact O-N 2.88Å; K56-A58 PolarHBondContact O-N 3.45Å; A58-N62 WeakPolarHBondContact O-CB 3.21Å; A58-N62 PolarHBondContact O-N 2.94Å
59	T	97.9	Very high	96.8	Very high	74 Å²	74	64.1 Å²	64.1	45%	0.454	35%	0.353	S	S	.	.	H	α-helix	trans	-63.7	-49.6	176.3	-58.5	0	0	0	0	111.4	H55 K56 L57 A61 N62 I63	H55-T59 WeakPolarHBondContact O-CB 3.42Å; H55-T59 PolarHBondContact O-N 3.28Å; H55-T59 PolarHBondContact O-OG1 2.99Å; K56-T59 WeakPolarHBondContact O-CB 3.34Å; K56-T59 PolarHBondContact O-N 3.46Å; L57-T59 VanDerWaalsContact C-N 3.3Å; L57-T59 PolarHBondContact O-N 3.45Å; T59-A61 PolarHBondContact O-N 3.47Å; T59-N62 PolarHBondContact O-N 2.98Å; T59-I63 HydrophobicContact CG2-CD1 4.2Å; T59-I63 WeakPolarHBondContact O-CG1 3.12Å; T59-I63 PolarHBondContact O-N 3.13Å
60	E	98.2	Very high	96.9	Very high	34 Å²	34	66.5 Å²	66.5	16%	0.159	36%	0.356	C	S	.	.	H	α-helix	trans	-64.5	-41.7	179.2	-63.9	-55.4	151.1	0	0	112.2	K56 L57 N62 I63 A64 A84 M85	K56-E60 HydrophobicContact CD-CG 4.45Å; K56-E60 WeakPolarHBondContact CE-OE1 3.24Å; K56-E60 IonicContact NZ-OE1 3.18Å; K56-E60 PolarHBondContact NZ-OE1 3.23Å; K56-E60 WeakPolarHBondContact O-CG 3.35Å; K56-E60 PolarHBondContact O-N 2.81Å; L57-E60 PolarHBondContact O-N 2.92Å; E60-N62 VanDerWaalsContact C-N 3.33Å; E60-N62 PolarHBondContact O-N 3.28Å; E60-I63 WeakPolarHBondContact O-CB 3.48Å; E60-I63 PolarHBondContact O-N 3.03Å; E60-A64 PolarHBondContact O-N 3.11Å; E60-A84 HydrophobicContact CB-CB 4.33Å; E60-A84 HydrophobicContact CG-CB 4.32Å; E60-M85 HydrophobicContact CG-CG 3.89Å; E60-M85 HydrophobicContact CG-SD 4.43Å
61	A	98.3	Very high	96.9	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-65.4	-35.6	175.6	0	0	0	0	0	112.6	L57 T59 A64 C65 I73 H77 I78	L57-A61 VanDerWaalsContact O-CB 3.27Å; L57-A61 WeakPolarHBondContact O-CB 3.37Å; L57-A61 PolarHBondContact O-N 3.37Å; T59-A61 PolarHBondContact O-N 3.47Å; A61-A64 PolarHBondContact O-N 2.98Å; A61-C65 WeakPolarHBondContact O-CB 3.3Å; A61-C65 PolarHBondContact O-N 3.36Å; A61-I73 HydrophobicContact CB-CG2 4.18Å; A61-H77 WeakPolarHBondContact CA-O 3.39Å; A61-I78 HydrophobicContact CB-CD1 3.74Å
62	N	98.1	Very high	97.1	Very high	81 Å²	81	79.1 Å²	79.1	43%	0.433	42%	0.416	S	S	.	.	H	α-helix	trans	-67.7	-37.9	174.6	-173	56.5	0	0	0	111.7	A58 T59 E60 C65 S66 I73	A58-N62 WeakPolarHBondContact O-CB 3.21Å; A58-N62 PolarHBondContact O-N 2.94Å; T59-N62 PolarHBondContact O-N 2.98Å; E60-N62 VanDerWaalsContact C-N 3.33Å; E60-N62 PolarHBondContact O-N 3.28Å; N62-C65 WeakPolarHBondContact O-CB 3.18Å; N62-C65 PolarHBondContact O-N 3.35Å; N62-S66 WeakPolarHBondContact O-CB 3.02Å; N62-S66 PolarHBondContact O-N 3.35Å; N62-S66 PolarHBondContact O-OG 3.39Å; N62-I73 HydrophobicContact CB-CD1 4.13Å
63	I	98.1	Very high	97.3	Very high	63 Å²	63	78.9 Å²	78.9	32%	0.323	41%	0.408	S	S	.	.	H	α-helix	trans	-61.4	-46.6	172.5	-68.8	165.2	0	0	0	110.2	T59 E60 S66 K67	T59-I63 HydrophobicContact CG2-CD1 4.2Å; T59-I63 WeakPolarHBondContact O-CG1 3.12Å; T59-I63 PolarHBondContact O-N 3.13Å; E60-I63 WeakPolarHBondContact O-CB 3.48Å; E60-I63 PolarHBondContact O-N 3.03Å; I63-S66 PolarHBondContact O-N 3.13Å; I63-K67 HydrophobicContact CG2-CD 4.04Å; I63-K67 VanDerWaalsContact CG2-CE 3.49Å; I63-K67 HydrophobicContact CG2-CG 4.46Å; I63-K67 WeakPolarHBondContact O-CB 3.37Å; I63-K67 VanDerWaalsContact O-CG 3.3Å; I63-K67 WeakPolarHBondContact O-CG 3.42Å; I63-K67 PolarHBondContact O-N 3.45Å
64	A	97.8	Very high	97.3	Very high	7 Å²	7	76.2 Å²	76.2	6%	0.058	40%	0.401	C	S	.	.	H	α-helix	trans	-59.3	-45.7	175.3	0	0	0	0	0	112.3	E60 A61 S66 K67 A68 H77 E80	E60-A64 PolarHBondContact O-N 3.11Å; A61-A64 PolarHBondContact O-N 2.98Å; A64-S66 VanDerWaalsContact C-N 3.34Å; A64-S66 PolarHBondContact O-N 2.86Å; A64-K67 PolarHBondContact O-N 3.29Å; A64-A68 PolarHBondContact O-N 3Å; A64-H77 HydrophobicContact CB-CB 4.11Å; A64-E80 HydrophobicContact CB-CB 3.93Å; A64-E80 WeakPolarHBondContact CB-OE2 3.48Å
65	C	98.2	Very high	97.3	Very high	2 Å²	2	75.4 Å²	75.4	1%	0.014	40%	0.401	C	S	.	.	H	α-helix	trans	-58.2	-45.1	175.4	-171.5	0	0	0	0	112.6	A61 N62 A68 N69 K70 T72 I73 H77	A61-C65 WeakPolarHBondContact O-CB 3.3Å; A61-C65 PolarHBondContact O-N 3.36Å; N62-C65 WeakPolarHBondContact O-CB 3.18Å; N62-C65 PolarHBondContact O-N 3.35Å; C65-A68 PolarHBondContact O-N 3.05Å; C65-N69 PolarHBondContact O-N 3.24Å; C65-K70 PolarHBondContact O-N 3.06Å; C65-K70 PolarHBondContact SG-O 3.33Å; C65-T72 PolarHBondContact SG-O 3.25Å; C65-I73 HydrophobicContact CB-CG1 4.03Å; C65-H77 HydrophobicContact CB-CB 4.48Å; C65-H77 WeakPolarHBondContact CB-ND1 3.31Å; C65-H77 VanDerWaalsContact SG-CE1 3.55Å
66	S	97.6	Very high	97.3	Very high	67 Å²	67	75.5 Å²	75.5	47%	0.469	40%	0.402	S	S	.	.	H	α-helix	trans	-66.6	-41	179.1	-58.6	0	0	0	0	111.5	N62 I63 A64 A68 N69	N62-S66 WeakPolarHBondContact O-CB 3.02Å; N62-S66 PolarHBondContact O-N 3.35Å; N62-S66 PolarHBondContact O-OG 3.39Å; I63-S66 PolarHBondContact O-N 3.13Å; A64-S66 VanDerWaalsContact C-N 3.34Å; A64-S66 PolarHBondContact O-N 2.86Å; S66-A68 VanDerWaalsContact C-N 3.26Å; S66-A68 PolarHBondContact O-N 3.07Å; S66-N69 PolarHBondContact O-N 3.2Å
67	K	97.3	Very high	97.4	Very high	165 Å²	165	70.9 Å²	70.9	72%	0.717	38%	0.382	S	S	*	.	H	α-helix	trans	-60.5	-34.8	173.5	-75	171.5	179.2	172.4	0	112.3	I63 A64 N69	I63-K67 HydrophobicContact CG2-CD 4.04Å; I63-K67 VanDerWaalsContact CG2-CE 3.49Å; I63-K67 HydrophobicContact CG2-CG 4.46Å; I63-K67 WeakPolarHBondContact O-CB 3.37Å; I63-K67 VanDerWaalsContact O-CG 3.3Å; I63-K67 WeakPolarHBondContact O-CG 3.42Å; I63-K67 PolarHBondContact O-N 3.45Å; A64-K67 PolarHBondContact O-N 3.29Å; K67-N69 PolarHBondContact O-N 3.29Å
68	A	96.8	Very high	97.4	Very high	45 Å²	45	72.5 Å²	72.5	37%	0.372	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	3.8	175	0	0	0	0	0	114	A64 C65 S66 K70	A64-A68 PolarHBondContact O-N 3Å; C65-A68 PolarHBondContact O-N 3.05Å; S66-A68 VanDerWaalsContact C-N 3.26Å; S66-A68 PolarHBondContact O-N 3.07Å; A68-K70 HydrophobicContact CB-CD 4.28Å; A68-K70 HydrophobicContact CB-CG 4.32Å; A68-K70 PolarHBondContact O-N 2.99Å
69	N	96.7	Very high	97.4	Very high	155 Å²	155	71 Å²	71	83%	0.829	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	33.4	-174.2	-61.9	-73.3	0	0	0	113.6	C65 S66 K67	C65-N69 PolarHBondContact O-N 3.24Å; S66-N69 PolarHBondContact O-N 3.2Å; K67-N69 PolarHBondContact O-N 3.29Å
70	K	97.2	Very high	97.4	Very high	117 Å²	117	71.2 Å²	71.2	51%	0.509	37%	0.371	S	S	.	.			trans	-105.2	149.3	178	-70.5	177.8	-178.6	175.9	0	110.7	C65 A68	C65-K70 PolarHBondContact O-N 3.06Å; C65-K70 PolarHBondContact SG-O 3.33Å; A68-K70 HydrophobicContact CB-CD 4.28Å; A68-K70 HydrophobicContact CB-CG 4.32Å; A68-K70 PolarHBondContact O-N 2.99Å
71	K	96.5	Very high	97.3	Very high	213 Å²	213	69.6 Å²	69.6	93%	0.926	36%	0.364	S	S	*	.	S	Bend	trans	-94.8	-13.6	177.1	-62.8	-177.2	-179.4	178.4	0	113.7
72	T	97.4	Very high	97.3	Very high	111 Å²	111	70.2 Å²	70.2	68%	0.681	37%	0.367	S	S	*	.	S	Bend	trans	-121	125.8	-177.2	-53.6	0	0	0	0	109.7	C65 S74	C65-T72 PolarHBondContact SG-O 3.25Å; T72-S74 PolarHBondContact O-N 3.12Å
73	I	97.5	Very high	97.3	Very high	73 Å²	73	69 Å²	69	37%	0.374	36%	0.361	S	S	.	.			trans	-67.8	120.2	175.9	-58.2	177.6	0	0	0	108.4	A61 N62 C65 H77 I78	A61-I73 HydrophobicContact CB-CG2 4.18Å; N62-I73 HydrophobicContact CB-CD1 4.13Å; C65-I73 HydrophobicContact CB-CG1 4.03Å; I73-H77 HydrophobicContact CG2-CB 4.08Å; I73-I78 HydrophobicContact CG2-CD1 3.95Å; I73-I78 HydrophobicContact CG2-CG1 4.48Å
74	S	96	Very high	97.2	Very high	33 Å²	33	68.8 Å²	68.8	23%	0.231	37%	0.369	C	S	.	.			trans	-98.8	161.2	176.3	74	0	0	0	0	110.2	T72 Q76 H77 I78	T72-S74 PolarHBondContact O-N 3.12Å; S74-Q76 PolarHBondContact O-N 3.4Å; S74-Q76 VanDerWaalsContact O-N 3.12Å; S74-H77 PolarHBondContact N-ND1 3.27Å; S74-H77 WeakPolarHBondContact O-CB 3.45Å; S74-H77 PolarHBondContact O-N 3.23Å; S74-H77 PolarHBondContact OG-CE1 3.1Å; S74-H77 PolarHBondContact OG-ND1 3.44Å; S74-H77 PolarHBondContact OG-NE2 2.87Å; S74-I78 PolarHBondContact O-N 3.21Å
75	P	96.2	Very high	97.1	Very high	72 Å²	72	70.2 Å²	70.2	47%	0.468	37%	0.374	S	S	.	.	H	α-helix	trans	-54.2	-32.1	175.3	-27.2	35.4	0	0	0	113.4	H77 I78 L79	P75-H77 VanDerWaalsContact C-N 3.3Å; P75-H77 PolarHBondContact O-N 3.42Å; P75-I78 WeakPolarHBondContact O-CB 3.47Å; P75-I78 PolarHBondContact O-N 2.9Å; P75-I78 VanDerWaalsContact O-N 3.11Å; P75-L79 PolarHBondContact O-N 2.86Å
76	Q	96.4	Very high	97.1	Very high	102 Å²	102	77.1 Å²	77.1	48%	0.477	41%	0.411	S	S	.	.	H	α-helix	trans	-61.4	-38.4	176.2	-173.2	59.1	33.8	0	0	112.4	S74 I78 L79 E80	S74-Q76 PolarHBondContact O-N 3.4Å; S74-Q76 VanDerWaalsContact O-N 3.12Å; Q76-I78 VanDerWaalsContact C-N 3.26Å; Q76-I78 PolarHBondContact O-N 3.24Å; Q76-L79 WeakPolarHBondContact O-CB 3.46Å; Q76-L79 PolarHBondContact O-N 2.96Å; Q76-E80 PolarHBondContact O-N 3.49Å
77	H	97.9	Very high	97.1	Very high	3 Å²	3	76 Å²	76	1%	0.014	40%	0.4	C	S	.	.	H	α-helix	trans	-68.3	-28.3	177.8	-51.1	152.4	0	0	0	111.7	A61 A64 C65 I73 S74 P75 G81	A61-H77 WeakPolarHBondContact CA-O 3.39Å; A64-H77 HydrophobicContact CB-CB 4.11Å; C65-H77 HydrophobicContact CB-CB 4.48Å; C65-H77 WeakPolarHBondContact CB-ND1 3.31Å; C65-H77 VanDerWaalsContact SG-CE1 3.55Å; I73-H77 HydrophobicContact CG2-CB 4.08Å; S74-H77 PolarHBondContact N-ND1 3.27Å; S74-H77 WeakPolarHBondContact O-CB 3.45Å; S74-H77 PolarHBondContact O-N 3.23Å; S74-H77 PolarHBondContact OG-CE1 3.1Å; S74-H77 PolarHBondContact OG-ND1 3.44Å; S74-H77 PolarHBondContact OG-NE2 2.87Å; P75-H77 VanDerWaalsContact C-N 3.3Å; P75-H77 PolarHBondContact O-N 3.42Å; H77-G81 PolarHBondContact O-N 2.67Å
78	I	97.7	Very high	97	Very high	60 Å²	60	71 Å²	71	31%	0.308	39%	0.386	S	S	.	.	H	α-helix	trans	-66.2	-43.6	172.7	-54.1	-65.2	0	0	0	110	L57 A61 I73 S74 P75 Q76 E80 G81 L82	L57-I78 HydrophobicContact CD1-CG2 4.43Å; L57-I78 HydrophobicContact CD2-CG2 4.23Å; A61-I78 HydrophobicContact CB-CD1 3.74Å; I73-I78 HydrophobicContact CG2-CD1 3.95Å; I73-I78 HydrophobicContact CG2-CG1 4.48Å; S74-I78 PolarHBondContact O-N 3.21Å; P75-I78 WeakPolarHBondContact O-CB 3.47Å; P75-I78 PolarHBondContact O-N 2.9Å; P75-I78 VanDerWaalsContact O-N 3.11Å; Q76-I78 VanDerWaalsContact C-N 3.26Å; Q76-I78 PolarHBondContact O-N 3.24Å; I78-E80 PolarHBondContact O-N 3.01Å; I78-G81 PolarHBondContact O-N 2.84Å; I78-G81 VanDerWaalsContact O-N 3.16Å; I78-L82 WeakPolarHBondContact O-CG 3.48Å; I78-L82 PolarHBondContact O-N 2.9Å
79	L	97.4	Very high	97	Very high	14 Å²	14	73.2 Å²	73.2	7%	0.073	40%	0.398	C	S	.	.	H	α-helix	trans	-63.4	-40.7	177.5	-61.9	177	0	0	0	112.2	P75 Q76 G81 L82 D83 K91 A94 E95	P75-L79 PolarHBondContact O-N 2.86Å; Q76-L79 WeakPolarHBondContact O-CB 3.46Å; Q76-L79 PolarHBondContact O-N 2.96Å; L79-G81 VanDerWaalsContact C-N 3.34Å; L79-L82 HydrophobicContact CD2-CD1 4.43Å; L79-L82 PolarHBondContact O-N 3.44Å; L79-D83 PolarHBondContact O-N 3.27Å; L79-D83 VanDerWaalsContact O-N 3.16Å; L79-K91 HydrophobicContact CD2-CB 4.27Å; L79-K91 HydrophobicContact CD2-CG 4.18Å; L79-A94 HydrophobicContact CD2-CB 3.83Å; L79-E95 HydrophobicContact CD1-CG 3.69Å; L79-E95 HydrophobicContact CD2-CG 4.01Å
80	E	97.3	Very high	97	Very high	78 Å²	78	72.3 Å²	72.3	36%	0.364	38%	0.384	S	S	.	.	H	α-helix	trans	-65.4	-36.9	172.7	-70.7	172.7	-150.9	0	0	112	A64 Q76 I78 D83 A84	A64-E80 HydrophobicContact CB-CB 3.93Å; A64-E80 WeakPolarHBondContact CB-OE2 3.48Å; Q76-E80 PolarHBondContact O-N 3.49Å; I78-E80 PolarHBondContact O-N 3.01Å; E80-D83 PolarHBondContact O-N 3.01Å; E80-A84 PolarHBondContact O-N 2.86Å
81	G	97.8	Very high	97	Very high	1 Å²	1	69 Å²	69	1%	0.01	37%	0.37	C	S	.	.	H	α-helix	trans	-63.1	-39.5	173.5	0	0	0	0	0	112.7	H77 I78 L79 D83 A84 M85	H77-G81 PolarHBondContact O-N 2.67Å; I78-G81 PolarHBondContact O-N 2.84Å; I78-G81 VanDerWaalsContact O-N 3.16Å; L79-G81 VanDerWaalsContact C-N 3.34Å; G81-D83 VanDerWaalsContact C-N 3.34Å; G81-D83 PolarHBondContact O-N 3.43Å; G81-A84 PolarHBondContact O-N 3.23Å; G81-M85 WeakPolarHBondContact O-CG 3.33Å; G81-M85 PolarHBondContact O-N 3.44Å
82	L	97.8	Very high	97	Very high	13 Å²	13	65.7 Å²	65.7	7%	0.068	36%	0.357	C	S	.	.	H	α-helix	trans	-62.3	-40.9	173.4	-69.9	173.7	0	0	0	111.8	L57 I78 L79 M85 N86 L87 K91 A94	L57-L82 HydrophobicContact CD1-CD2 3.9Å; L57-L82 HydrophobicContact CD1-CG 4.09Å; L57-L82 HydrophobicContact CD2-CD2 4.31Å; I78-L82 WeakPolarHBondContact O-CG 3.48Å; I78-L82 PolarHBondContact O-N 2.9Å; L79-L82 HydrophobicContact CD2-CD1 4.43Å; L79-L82 PolarHBondContact O-N 3.44Å; L82-M85 PolarHBondContact O-N 3.26Å; L82-N86 PolarHBondContact O-N 3.46Å; L82-L87 HydrophobicContact CB-CB 4.43Å; L82-L87 HydrophobicContact CD2-CB 4.14Å; L82-L87 HydrophobicContact CD2-CD1 4.38Å; L82-L87 WeakPolarHBondContact O-CA 3.46Å; L82-L87 PolarHBondContact O-N 2.83Å; L82-K91 HydrophobicContact CB-CG 4.29Å; L82-K91 HydrophobicContact CD1-CG 4.25Å; L82-A94 HydrophobicContact CD1-CB 4.09Å
83	D	97.1	Very high	96.9	Very high	56 Å²	56	66.7 Å²	66.7	30%	0.299	35%	0.354	S	S	.	.	H	α-helix	trans	-61.8	-44.1	174.2	-72.6	-35	0	0	0	111.4	L79 E80 G81 M85 N86 S88 K91	L79-D83 PolarHBondContact O-N 3.27Å; L79-D83 VanDerWaalsContact O-N 3.16Å; E80-D83 PolarHBondContact O-N 3.01Å; G81-D83 VanDerWaalsContact C-N 3.34Å; G81-D83 PolarHBondContact O-N 3.43Å; D83-M85 PolarHBondContact O-N 2.94Å; D83-N86 PolarHBondContact O-N 2.95Å; D83-S88 WeakPolarHBondContact OD1-CB 3.21Å; D83-S88 PolarHBondContact OD1-OG 2.98Å; D83-K91 WeakPolarHBondContact OD1-CD 3.42Å; D83-K91 IonicContact OD1-NZ 3.77Å; D83-K91 IonicContact OD2-NZ 2.67Å; D83-K91 PolarHBondContact OD2-NZ 3.06Å
84	A	97	Very high	96.8	Very high	58 Å²	58	64.8 Å²	64.8	48%	0.479	35%	0.35	S	S	.	.	H	α-helix	trans	-62.7	-28.3	177.6	0	0	0	0	0	113.2	E60 E80 G81 N86	E60-A84 HydrophobicContact CB-CB 4.33Å; E60-A84 HydrophobicContact CG-CB 4.32Å; E80-A84 PolarHBondContact O-N 2.86Å; G81-A84 PolarHBondContact O-N 3.23Å; A84-N86 VanDerWaalsContact C-N 3.31Å
85	M	96.2	Very high	96.9	Very high	36 Å²	36	68 Å²	68	18%	0.177	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	2.3	175.2	-66.5	176.5	65.1	0	0	113.8	F53 K56 L57 E60 G81 L82 D83 L87	F53-M85 HydrophobicContact CD2-CE 3.78Å; F53-M85 HydrophobicContact CE2-CE 3.74Å; K56-M85 HydrophobicContact CB-CE 4.16Å; K56-M85 HydrophobicContact CG-CE 3.77Å; K56-M85 HydrophobicContact CG-CG 4.42Å; K56-M85 HydrophobicContact CG-SD 4.09Å; L57-M85 VanDerWaalsContact CA-SD 3.58Å; L57-M85 HydrophobicContact CB-SD 3.84Å; L57-M85 HydrophobicContact CD1-SD 3.84Å; L57-M85 HydrophobicContact CG-SD 4.45Å; E60-M85 HydrophobicContact CG-CG 3.89Å; E60-M85 HydrophobicContact CG-SD 4.43Å; G81-M85 WeakPolarHBondContact O-CG 3.33Å; G81-M85 PolarHBondContact O-N 3.44Å; L82-M85 PolarHBondContact O-N 3.26Å; D83-M85 PolarHBondContact O-N 2.94Å; M85-L87 VanDerWaalsContact C-N 3.28Å; M85-L87 HydrophobicContact CB-CB 4.45Å; M85-L87 HydrophobicContact CB-CD1 3.96Å; M85-L87 HydrophobicContact CB-CG 4.03Å; M85-L87 HydrophobicContact CE-CD1 3.91Å; M85-L87 PolarHBondContact O-N 3.05Å
86	N	97.2	Very high	96.9	Very high	148 Å²	148	68.2 Å²	68.2	79%	0.791	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	35.3	-171.4	-55.1	-67.4	0	0	0	113.4	L82 D83 A84	L82-N86 PolarHBondContact O-N 3.46Å; D83-N86 PolarHBondContact O-N 2.95Å; A84-N86 VanDerWaalsContact C-N 3.31Å
87	L	97	Very high	96.9	Very high	43 Å²	43	65.7 Å²	65.7	23%	0.225	36%	0.357	C	S	.	.			trans	-113.2	27.3	-179.6	-65.9	178.9	0	0	0	112	F53 L82 M85 S89 Y90	F53-L87 HydrophobicContact CE2-CD1 3.69Å; L82-L87 HydrophobicContact CB-CB 4.43Å; L82-L87 HydrophobicContact CD2-CB 4.14Å; L82-L87 HydrophobicContact CD2-CD1 4.38Å; L82-L87 WeakPolarHBondContact O-CA 3.46Å; L82-L87 PolarHBondContact O-N 2.83Å; M85-L87 VanDerWaalsContact C-N 3.28Å; M85-L87 HydrophobicContact CB-CB 4.45Å; M85-L87 HydrophobicContact CB-CD1 3.96Å; M85-L87 HydrophobicContact CB-CG 4.03Å; M85-L87 HydrophobicContact CE-CD1 3.91Å; M85-L87 PolarHBondContact O-N 3.05Å; L87-S89 PolarHBondContact O-N 3.18Å; L87-Y90 HydrophobicContact CB-CD2 3.93Å; L87-Y90 HydrophobicContact CD2-CD2 4.03Å; L87-Y90 HydrophobicContact CD2-CE2 3.78Å; L87-Y90 HydrophobicContact CG-CD2 4.48Å; L87-Y90 PolarHBondContact O-N 3.4Å
88	S	96.1	Very high	96.8	Very high	61 Å²	61	67.1 Å²	67.1	43%	0.427	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-55	-27.8	-178.1	-54	0	0	0	0	113.9	D83 Y90 K91	D83-S88 WeakPolarHBondContact OD1-CB 3.21Å; D83-S88 PolarHBondContact OD1-OG 2.98Å; S88-Y90 PolarHBondContact O-N 3.08Å; S88-K91 WeakPolarHBondContact O-CB 3.4Å; S88-K91 PolarHBondContact O-N 2.98Å; S88-K91 VanDerWaalsContact O-N 3.16Å
89	S	97.2	Very high	96.7	Very high	90 Å²	90	68.7 Å²	68.7	63%	0.629	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-61.2	-22.2	176.1	56.6	0	0	0	0	113.7	L87	L87-S89 PolarHBondContact O-N 3.18Å
90	Y	96.8	Very high	96.6	Very high	137 Å²	137	73.8 Å²	73.8	54%	0.537	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-91	-4.9	-179.8	-62.9	-76.2	0	0	0	113.5	L87 S88 E92 H93 A94	L87-Y90 HydrophobicContact CB-CD2 3.93Å; L87-Y90 HydrophobicContact CD2-CD2 4.03Å; L87-Y90 HydrophobicContact CD2-CE2 3.78Å; L87-Y90 HydrophobicContact CG-CD2 4.48Å; L87-Y90 PolarHBondContact O-N 3.4Å; S88-Y90 PolarHBondContact O-N 3.08Å; Y90-E92 PolarHBondContact O-N 3.3Å; Y90-H93 PolarHBondContact O-N 3.27Å; Y90-A94 PolarHBondContact O-N 3.17Å
91	K	96.3	Very high	96.5	Very high	47 Å²	47	72.1 Å²	72.1	20%	0.204	40%	0.396	C	S	.	.	H	α-helix	trans	-62.1	-42.5	-176.5	-75.4	178.3	56.9	171.6	0	112.9	L79 L82 D83 S88 H93 A94 E95	L79-K91 HydrophobicContact CD2-CB 4.27Å; L79-K91 HydrophobicContact CD2-CG 4.18Å; L82-K91 HydrophobicContact CB-CG 4.29Å; L82-K91 HydrophobicContact CD1-CG 4.25Å; D83-K91 WeakPolarHBondContact OD1-CD 3.42Å; D83-K91 IonicContact OD1-NZ 3.77Å; D83-K91 IonicContact OD2-NZ 2.67Å; D83-K91 PolarHBondContact OD2-NZ 3.06Å; S88-K91 WeakPolarHBondContact O-CB 3.4Å; S88-K91 PolarHBondContact O-N 2.98Å; S88-K91 VanDerWaalsContact O-N 3.16Å; K91-H93 VanDerWaalsContact C-N 3.32Å; K91-H93 PolarHBondContact O-N 2.99Å; K91-A94 PolarHBondContact O-N 3.41Å; K91-A94 VanDerWaalsContact O-N 3.12Å; K91-E95 WeakPolarHBondContact O-CG 3.47Å; K91-E95 PolarHBondContact O-N 3.39Å
92	E	96	Very high	96.4	Very high	143 Å²	143	77.7 Å²	77.7	67%	0.668	42%	0.42	S	S	*	.	H	α-helix	trans	-57.1	-46.9	177.6	-177	177.5	-171.9	0	0	111.1	Y90 A94 E95 V96	Y90-E92 PolarHBondContact O-N 3.3Å; E92-A94 PolarHBondContact O-N 3.09Å; E92-E95 PolarHBondContact O-N 3.29Å; E92-V96 WeakPolarHBondContact O-CG2 3.48Å; E92-V96 PolarHBondContact O-N 2.84Å; E92-V96 VanDerWaalsContact O-N 3.08Å
93	H	96.2	Very high	96.3	Very high	133 Å²	133	82.5 Å²	82.5	62%	0.616	44%	0.442	S	S	*	.	H	α-helix	trans	-63.7	-39.3	176.3	-65.8	-62	0	0	0	112.7	Y90 K91 A97	Y90-H93 PolarHBondContact O-N 3.27Å; K91-H93 VanDerWaalsContact C-N 3.32Å; K91-H93 PolarHBondContact O-N 2.99Å; H93-A97 PolarHBondContact O-N 3.02Å; H93-A97 VanDerWaalsContact O-N 3.08Å
94	A	96.2	Very high	96.2	Very high	33 Å²	33	84.9 Å²	84.9	27%	0.273	45%	0.452	S	S	.	.	H	α-helix	trans	-67.7	-35.9	177.5	0	0	0	0	0	112.5	L79 L82 Y90 K91 E92 C98	L79-A94 HydrophobicContact CD2-CB 3.83Å; L82-A94 HydrophobicContact CD1-CB 4.09Å; Y90-A94 PolarHBondContact O-N 3.17Å; K91-A94 PolarHBondContact O-N 3.41Å; K91-A94 VanDerWaalsContact O-N 3.12Å; E92-A94 PolarHBondContact O-N 3.09Å; A94-C98 VanDerWaalsContact O-CB 3.28Å; A94-C98 WeakPolarHBondContact O-CB 3.29Å; A94-C98 PolarHBondContact O-N 3.12Å
95	E	96.7	Very high	96	Very high	99 Å²	99	86.5 Å²	86.5	46%	0.463	45%	0.451	S	S	.	.	H	α-helix	trans	-66.8	-44.2	176.1	-76	174.1	-169.9	0	0	111.7	L79 K91 E92 C98 Q99	L79-E95 HydrophobicContact CD1-CG 3.69Å; L79-E95 HydrophobicContact CD2-CG 4.01Å; K91-E95 WeakPolarHBondContact O-CG 3.47Å; K91-E95 PolarHBondContact O-N 3.39Å; E92-E95 PolarHBondContact O-N 3.29Å; E95-C98 WeakPolarHBondContact O-CB 3.48Å; E95-C98 PolarHBondContact O-N 3.08Å; E95-Q99 PolarHBondContact O-N 3.31Å
96	V	97	Very high	95.9	Very high	77 Å²	77	91.4 Å²	91.4	47%	0.467	47%	0.472	S	S	.	.	H	α-helix	trans	-59.4	-50.3	174.4	173.8	0	0	0	0	110.7	E92 C98 Q99 E100	E92-V96 WeakPolarHBondContact O-CG2 3.48Å; E92-V96 PolarHBondContact O-N 2.84Å; E92-V96 VanDerWaalsContact O-N 3.08Å; V96-C98 VanDerWaalsContact C-N 3.27Å; V96-C98 PolarHBondContact O-N 2.96Å; V96-Q99 WeakPolarHBondContact O-CB 3.17Å; V96-Q99 PolarHBondContact O-N 3.45Å; V96-E100 WeakPolarHBondContact O-CG 3.33Å; V96-E100 PolarHBondContact O-N 3.12Å
97	A	95.9	Very high	95.6	Very high	50 Å²	50	85.8 Å²	85.8	41%	0.413	45%	0.449	S	S	.	.	H	α-helix	trans	-61.1	-35.6	178.1	0	0	0	0	0	112.7	H93 A101	H93-A97 PolarHBondContact O-N 3.02Å; H93-A97 VanDerWaalsContact O-N 3.08Å; A97-A101 WeakPolarHBondContact O-CB 3.43Å; A97-A101 PolarHBondContact O-N 3.08Å
98	C	95.1	Very high	95.4	Very high	32 Å²	32	91.7 Å²	91.7	22%	0.216	47%	0.468	C	S	.	.	H	α-helix	trans	-65	-39.5	174.8	-178.3	0	0	0	0	111.8	A94 E95 V96 K102	A94-C98 VanDerWaalsContact O-CB 3.28Å; A94-C98 WeakPolarHBondContact O-CB 3.29Å; A94-C98 PolarHBondContact O-N 3.12Å; E95-C98 WeakPolarHBondContact O-CB 3.48Å; E95-C98 PolarHBondContact O-N 3.08Å; V96-C98 VanDerWaalsContact C-N 3.27Å; V96-C98 PolarHBondContact O-N 2.96Å; C98-K102 VanDerWaalsContact O-CG 3.29Å; C98-K102 WeakPolarHBondContact O-CG 3.28Å; C98-K102 PolarHBondContact O-N 3.43Å
99	Q	96.4	Very high	95.2	Very high	93 Å²	93	95.4 Å²	95.4	44%	0.435	48%	0.476	S	S	.	.	H	α-helix	trans	-67.6	-46.3	177.2	-176.6	57	26.2	0	0	111.5	E95 V96 A101 K102 E103	E95-Q99 PolarHBondContact O-N 3.31Å; V96-Q99 WeakPolarHBondContact O-CB 3.17Å; V96-Q99 PolarHBondContact O-N 3.45Å; Q99-A101 VanDerWaalsContact C-N 3.32Å; Q99-A101 PolarHBondContact O-N 2.95Å; Q99-K102 WeakPolarHBondContact O-CB 3.41Å; Q99-K102 PolarHBondContact O-N 3.28Å; Q99-E103 PolarHBondContact NE2-OE1 3.3Å; Q99-E103 WeakPolarHBondContact O-CG 3.33Å; Q99-E103 PolarHBondContact O-N 3.32Å
100	E	96.2	Very high	94.8	Very high	121 Å²	121	95.3 Å²	95.3	57%	0.565	47%	0.467	S	S	*	.	H	α-helix	trans	-58	-44.4	175.3	-68.7	176.3	164.4	0	0	111.4	V96 K102 E103 E104	V96-E100 WeakPolarHBondContact O-CG 3.33Å; V96-E100 PolarHBondContact O-N 3.12Å; E100-K102 PolarHBondContact O-N 3.24Å; E100-E103 PolarHBondContact O-N 3.34Å; E100-E104 PolarHBondContact O-N 3.32Å
101	A	94.8	Very high	94.4	Very high	43 Å²	43	95.5 Å²	95.5	36%	0.355	48%	0.477	S	S	.	.	H	α-helix	trans	-63.5	-39.1	177.1	0	0	0	0	0	112.7	A97 Q99 E104 I105	A97-A101 WeakPolarHBondContact O-CB 3.43Å; A97-A101 PolarHBondContact O-N 3.08Å; Q99-A101 VanDerWaalsContact C-N 3.32Å; Q99-A101 PolarHBondContact O-N 2.95Å; A101-E104 PolarHBondContact O-N 3.23Å; A101-I105 WeakPolarHBondContact O-CB 3.49Å; A101-I105 WeakPolarHBondContact O-CD1 3.48Å; A101-I105 WeakPolarHBondContact O-CG1 3.45Å; A101-I105 PolarHBondContact O-N 2.94Å
102	K	94.8	Very high	94.1	Very high	118 Å²	118	95.8 Å²	95.8	51%	0.513	49%	0.485	S	S	.	.	H	α-helix	trans	-63.6	-42.5	175.3	-76.2	170.1	-177.3	170.5	0	111.6	C98 Q99 E100 I105 K106	C98-K102 VanDerWaalsContact O-CG 3.29Å; C98-K102 WeakPolarHBondContact O-CG 3.28Å; C98-K102 PolarHBondContact O-N 3.43Å; Q99-K102 WeakPolarHBondContact O-CB 3.41Å; Q99-K102 PolarHBondContact O-N 3.28Å; E100-K102 PolarHBondContact O-N 3.24Å; K102-I105 PolarHBondContact O-N 3.47Å; K102-K106 WeakPolarHBondContact O-CB 3.38Å; K102-K106 PolarHBondContact O-N 3.36Å
103	E	95.6	Very high	93.7	Very high	115 Å²	115	92.8 Å²	92.8	54%	0.537	48%	0.484	S	S	.	.	H	α-helix	trans	-64.9	-43.1	177.2	-72.1	175.3	-167.7	0	0	111.5	Q99 E100 K106 G107	Q99-E103 PolarHBondContact NE2-OE1 3.3Å; Q99-E103 WeakPolarHBondContact O-CG 3.33Å; Q99-E103 PolarHBondContact O-N 3.32Å; E100-E103 PolarHBondContact O-N 3.34Å; E103-K106 PolarHBondContact O-N 2.86Å; E103-G107 PolarHBondContact O-N 2.88Å
104	E	94.7	Very high	93.4	Very high	105 Å²	105	89.7 Å²	89.7	49%	0.491	48%	0.478	S	S	.	.	H	α-helix	trans	-61.2	-46.4	175.4	-168.5	-169.6	151.3	0	0	111.7	E100 A101 K106 G107 R108	E100-E104 PolarHBondContact O-N 3.32Å; A101-E104 PolarHBondContact O-N 3.23Å; E104-K106 VanDerWaalsContact C-N 3.32Å; E104-K106 PolarHBondContact O-N 2.96Å; E104-G107 PolarHBondContact O-N 3.37Å; E104-R108 WeakPolarHBondContact O-CG 3.44Å; E104-R108 PolarHBondContact O-N 3.03Å; E104-R108 IonicContact OE1-CZ 3.82Å; E104-R108 IonicContact OE1-NE 2.76Å; E104-R108 PolarHBondContact OE1-NE 3.28Å; E104-R108 IonicContact OE1-NH2 3.3Å; E104-R108 PolarHBondContact OE1-NH2 3.16Å
105	I	93.6	Very high	93.1	Very high	92 Å²	92	92.3 Å²	92.3	47%	0.472	48%	0.481	S	S	.	.	H	α-helix	trans	-61.9	-41.6	177.1	-69.2	165.1	0	0	0	110.6	A101 K102 R108 K109	A101-I105 WeakPolarHBondContact O-CB 3.49Å; A101-I105 WeakPolarHBondContact O-CD1 3.48Å; A101-I105 WeakPolarHBondContact O-CG1 3.45Å; A101-I105 PolarHBondContact O-N 2.94Å; K102-I105 PolarHBondContact O-N 3.47Å; I105-R108 PolarHBondContact O-N 3.19Å; I105-K109 HydrophobicContact CG2-CD 4.19Å; I105-K109 HydrophobicContact CG2-CG 4.45Å; I105-K109 WeakPolarHBondContact O-CB 3.1Å; I105-K109 VanDerWaalsContact O-CG 3.31Å; I105-K109 WeakPolarHBondContact O-CG 3.36Å; I105-K109 PolarHBondContact O-N 3.44Å
106	K	93.2	Very high	92.5	Very high	140 Å²	140	96.2 Å²	96.2	61%	0.609	49%	0.492	S	S	*	.	H	α-helix	trans	-61.5	-46.1	175.5	-175.5	-179.1	177.2	-177.1	0	110.9	K102 E103 E104 R108 K109 M110	K102-K106 WeakPolarHBondContact O-CB 3.38Å; K102-K106 PolarHBondContact O-N 3.36Å; E103-K106 PolarHBondContact O-N 2.86Å; E104-K106 VanDerWaalsContact C-N 3.32Å; E104-K106 PolarHBondContact O-N 2.96Å; K106-R108 PolarHBondContact O-N 2.97Å; K106-K109 PolarHBondContact O-N 3.19Å; K106-M110 HydrophobicContact CG-SD 4.36Å; K106-M110 WeakPolarHBondContact O-CG 3.34Å; K106-M110 PolarHBondContact O-N 3.24Å
107	G	92.1	Very high	91.9	Very high	30 Å²	30	98.3 Å²	98.3	31%	0.309	50%	0.495	S	S	.	.	H	α-helix	trans	-58	-47.9	175.6	0	0	0	0	0	112.2	E103 E104 K109 M110 L111	E103-G107 PolarHBondContact O-N 2.88Å; E104-G107 PolarHBondContact O-N 3.37Å; G107-K109 VanDerWaalsContact C-N 3.34Å; G107-K109 PolarHBondContact O-N 2.82Å; G107-M110 PolarHBondContact O-N 3.48Å; G107-L111 WeakPolarHBondContact O-CG 3.19Å; G107-L111 PolarHBondContact O-N 3.21Å; G107-L111 VanDerWaalsContact O-N 3.13Å
108	R	92.7	Very high	91.3	Very high	166 Å²	166	103.2 Å²	103.2	63%	0.626	51%	0.507	S	S	*	.	H	α-helix	trans	-61	-40.7	176.1	-71.3	177.5	-175.6	-84.5	1.8	112.5	E104 I105 K106 L111 S112	E104-R108 WeakPolarHBondContact O-CG 3.44Å; E104-R108 PolarHBondContact O-N 3.03Å; E104-R108 IonicContact OE1-CZ 3.82Å; E104-R108 IonicContact OE1-NE 2.76Å; E104-R108 PolarHBondContact OE1-NE 3.28Å; E104-R108 IonicContact OE1-NH2 3.3Å; E104-R108 PolarHBondContact OE1-NH2 3.16Å; I105-R108 PolarHBondContact O-N 3.19Å; K106-R108 PolarHBondContact O-N 2.97Å; R108-L111 PolarHBondContact O-N 3.11Å; R108-S112 PolarHBondContact O-N 3.39Å
109	K	91.4	Very high	90.7	Very high	139 Å²	139	107.4 Å²	107.4	60%	0.604	52%	0.523	S	S	*	.	H	α-helix	trans	-61.9	-44.8	175.5	-77.1	178.5	177.5	-173.8	0	111.3	I105 K106 G107 L111 S112 Y115	I105-K109 HydrophobicContact CG2-CD 4.19Å; I105-K109 HydrophobicContact CG2-CG 4.45Å; I105-K109 WeakPolarHBondContact O-CB 3.1Å; I105-K109 VanDerWaalsContact O-CG 3.31Å; I105-K109 WeakPolarHBondContact O-CG 3.36Å; I105-K109 PolarHBondContact O-N 3.44Å; K106-K109 PolarHBondContact O-N 3.19Å; G107-K109 VanDerWaalsContact C-N 3.34Å; G107-K109 PolarHBondContact O-N 2.82Å; K109-L111 VanDerWaalsContact C-N 3.26Å; K109-L111 PolarHBondContact O-N 3.47Å; K109-S112 WeakPolarHBondContact O-CB 3.45Å; K109-S112 PolarHBondContact O-N 3.39Å; K109-S112 VanDerWaalsContact O-N 3.1Å; K109-Y115 WeakPolarHBondContact O-CB 3.4Å
110	M	88.5	Confident	89.9	Confident	88 Å²	88	105.9 Å²	105.9	43%	0.433	52%	0.516	S	S	.	.	H	α-helix	trans	-64.6	-29.5	179.3	-69.6	-179.8	70.2	0	0	113.4	K106 G107 S112 Y115	K106-M110 HydrophobicContact CG-SD 4.36Å; K106-M110 WeakPolarHBondContact O-CG 3.34Å; K106-M110 PolarHBondContact O-N 3.24Å; G107-M110 PolarHBondContact O-N 3.48Å; M110-S112 VanDerWaalsContact C-N 3.34Å; M110-Y115 VanDerWaalsContact CA-CD1 3.47Å; M110-Y115 HydrophobicContact CB-CD1 4.18Å; M110-Y115 HydrophobicContact CB-CE1 4.06Å; M110-Y115 HydrophobicContact CE-CE1 4.42Å; M110-Y115 HydrophobicContact CG-CD1 4.41Å; M110-Y115 HydrophobicContact CG-CE1 3.93Å; M110-Y115 HydrophobicContact CG-CE2 4.4Å; M110-Y115 VanDerWaalsContact O-CD1 3.24Å; M110-Y115 WeakPolarHBondContact O-CD1 3.47Å
111	L	89.3	Confident	89.2	Confident	141 Å²	141	106 Å²	106	74%	0.738	52%	0.52	S	S	*	.	H	α-helix	trans	-82.5	-12	176.3	-63.6	173.5	0	0	0	113.5	G107 R108 K109	G107-L111 WeakPolarHBondContact O-CG 3.19Å; G107-L111 PolarHBondContact O-N 3.21Å; G107-L111 VanDerWaalsContact O-N 3.13Å; R108-L111 PolarHBondContact O-N 3.11Å; K109-L111 VanDerWaalsContact C-N 3.26Å; K109-L111 PolarHBondContact O-N 3.47Å
112	S	89.9	Confident	88.6	Confident	54 Å²	54	108.6 Å²	108.6	38%	0.378	54%	0.536	S	S	.	.	S	Bend	trans	-62.8	139.5	179.6	178.2	0	0	0	0	111.1	R108 K109 M110 S114 Y115 R116	R108-S112 PolarHBondContact O-N 3.39Å; K109-S112 WeakPolarHBondContact O-CB 3.45Å; K109-S112 PolarHBondContact O-N 3.39Å; K109-S112 VanDerWaalsContact O-N 3.1Å; M110-S112 VanDerWaalsContact C-N 3.34Å; S112-S114 PolarHBondContact O-N 2.95Å; S112-S114 PolarHBondContact OG-N 3.12Å; S112-Y115 PolarHBondContact O-N 3.46Å; S112-R116 PolarHBondContact O-N 3.27Å
113	A	88.4	Confident	88.2	Confident	79 Å²	79	110.7 Å²	110.7	65%	0.653	55%	0.547	S	S	*	.	H	α-helix	trans	-54.5	-36	172.9	0	0	0	0	0	111.7	R116 F117	A113-R116 PolarHBondContact O-N 3.05Å; A113-F117 WeakPolarHBondContact O-CB 3.4Å; A113-F117 PolarHBondContact O-N 3.03Å
114	S	89	Confident	87.8	Confident	69 Å²	69	108.3 Å²	108.3	48%	0.483	54%	0.536	S	S	.	.	H	α-helix	trans	-65.7	-40.3	177.4	177.9	0	0	0	0	112.5	S112 K118	S112-S114 PolarHBondContact O-N 2.95Å; S112-S114 PolarHBondContact OG-N 3.12Å; S114-K118 WeakPolarHBondContact O-CG 3.47Å; S114-K118 PolarHBondContact O-N 3.37Å
115	Y	89.1	Confident	87.5	Confident	88 Å²	88	106.5 Å²	106.5	35%	0.345	53%	0.53	S	S	.	.	H	α-helix	trans	-67.8	-46.3	176.5	-177.4	-91.6	0	0	0	110.9	K109 M110 S112 F117 K118 H119	K109-Y115 WeakPolarHBondContact O-CB 3.4Å; M110-Y115 VanDerWaalsContact CA-CD1 3.47Å; M110-Y115 HydrophobicContact CB-CD1 4.18Å; M110-Y115 HydrophobicContact CB-CE1 4.06Å; M110-Y115 HydrophobicContact CE-CE1 4.42Å; M110-Y115 HydrophobicContact CG-CD1 4.41Å; M110-Y115 HydrophobicContact CG-CE1 3.93Å; M110-Y115 HydrophobicContact CG-CE2 4.4Å; M110-Y115 VanDerWaalsContact O-CD1 3.24Å; M110-Y115 WeakPolarHBondContact O-CD1 3.47Å; S112-Y115 PolarHBondContact O-N 3.46Å; Y115-F117 VanDerWaalsContact C-N 3.31Å; Y115-F117 PolarHBondContact O-N 3.49Å; Y115-K118 PolarHBondContact O-N 3.37Å; Y115-H119 AromaticContact CD1-CD2 3.76Å; Y115-H119 AromaticContact CD2-CD2 3.61Å; Y115-H119 AromaticContact CD2-NE2 3.73Å; Y115-H119 AromaticContact CE1-CD2 3.48Å; Y115-H119 VanDerWaalsContact CE1-CD2 3.48Å; Y115-H119 WeakPolarHBondContact CE1-CD2 3.25Å; Y115-H119 AromaticContact CE2-CD2 3.3Å; Y115-H119 WeakPolarHBondContact CE2-CD2 3.27Å; Y115-H119 AromaticContact CE2-NE2 3.12Å; Y115-H119 WeakPolarHBondContact CE2-NE2 3.44Å; Y115-H119 AromaticContact CG-CD2 3.83Å; Y115-H119 AromaticContact CZ-CD2 3.22Å; Y115-H119 AromaticContact CZ-NE2 3.35Å; Y115-H119 VanDerWaalsContact CZ-NE2 3.35Å; Y115-H119 PolarHBondContact O-CD2 3.49Å; Y115-H119 VanDerWaalsContact O-CD2 3.25Å; Y115-H119 PolarHBondContact O-N 3.2Å; Y115-H119 VanDerWaalsContact O-N 3.12Å
116	R	85.1	Confident	87.3	Confident	180 Å²	180	108.9 Å²	108.9	68%	0.679	54%	0.539	S	S	*	.	H	α-helix	trans	-58.3	-43.9	176.8	-69.4	179.5	63.9	-170.7	-1.9	111.7	S112 A113 H119 Q120	S112-R116 PolarHBondContact O-N 3.27Å; A113-R116 PolarHBondContact O-N 3.05Å; R116-H119 CarbonylContact O-C 3.44Å; R116-H119 PolarHBondContact O-N 3.31Å; R116-Q120 WeakPolarHBondContact O-CG 3.49Å; R116-Q120 PolarHBondContact O-N 2.67Å; R116-Q120 VanDerWaalsContact O-N 3.11Å
117	F	83.5	Confident	87.3	Confident	121 Å²	121	109.2 Å²	109.2	53%	0.531	54%	0.536	S	S	.	.	H	α-helix	trans	-61.4	-45.7	177.3	-177.6	-101.6	0	0	0	112.4	A113 Y115 H119 Q120 L125	A113-F117 WeakPolarHBondContact O-CB 3.4Å; A113-F117 PolarHBondContact O-N 3.03Å; Y115-F117 VanDerWaalsContact C-N 3.31Å; Y115-F117 PolarHBondContact O-N 3.49Å; F117-H119 PolarHBondContact O-N 3.02Å; F117-Q120 PolarHBondContact O-N 2.68Å; F117-L125 HydrophobicContact CE2-CD2 4.4Å; F117-L125 HydrophobicContact CZ-CD2 4.5Å
118	K	84.7	Confident	87.2	Confident	154 Å²	154	110.8 Å²	110.8	67%	0.67	54%	0.537	S	S	*	.	H	α-helix	trans	-65.8	-23.5	177.8	-73.6	-174.5	178.3	-163	0	113.9	S114 Y115	S114-K118 WeakPolarHBondContact O-CG 3.47Å; S114-K118 PolarHBondContact O-N 3.37Å; Y115-K118 PolarHBondContact O-N 3.37Å
119	H	82.6	Confident	87.2	Confident	120 Å²	120	105.5 Å²	105.5	56%	0.556	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	19.6	-179.1	-67.5	-66.7	0	0	0	113	Y115 R116 F117	Y115-H119 AromaticContact CD1-CD2 3.76Å; Y115-H119 AromaticContact CD2-CD2 3.61Å; Y115-H119 AromaticContact CD2-NE2 3.73Å; Y115-H119 AromaticContact CE1-CD2 3.48Å; Y115-H119 VanDerWaalsContact CE1-CD2 3.48Å; Y115-H119 WeakPolarHBondContact CE1-CD2 3.25Å; Y115-H119 AromaticContact CE2-CD2 3.3Å; Y115-H119 WeakPolarHBondContact CE2-CD2 3.27Å; Y115-H119 AromaticContact CE2-NE2 3.12Å; Y115-H119 WeakPolarHBondContact CE2-NE2 3.44Å; Y115-H119 AromaticContact CG-CD2 3.83Å; Y115-H119 AromaticContact CZ-CD2 3.22Å; Y115-H119 AromaticContact CZ-NE2 3.35Å; Y115-H119 VanDerWaalsContact CZ-NE2 3.35Å; Y115-H119 PolarHBondContact O-CD2 3.49Å; Y115-H119 VanDerWaalsContact O-CD2 3.25Å; Y115-H119 PolarHBondContact O-N 3.2Å; Y115-H119 VanDerWaalsContact O-N 3.12Å; R116-H119 CarbonylContact O-C 3.44Å; R116-H119 PolarHBondContact O-N 3.31Å; F117-H119 PolarHBondContact O-N 3.02Å
120	Q	77.7	Confident	87.4	Confident	60 Å²	60	106.3 Å²	106.3	28%	0.28	53%	0.533	S	S	.	.	S	Bend	trans	-67.2	151.4	167.9	-73.9	-171.2	-71.7	0	0	110.5	R116 F117 E124 L125	R116-Q120 WeakPolarHBondContact O-CG 3.49Å; R116-Q120 PolarHBondContact O-N 2.67Å; R116-Q120 VanDerWaalsContact O-N 3.11Å; F117-Q120 PolarHBondContact O-N 2.68Å; Q120-E124 PolarHBondContact NE2-OE2 3.45Å; Q120-L125 HydrophobicContact CB-CG 4.38Å
121	D	82.5	Confident	87.6	Confident	124 Å²	124	107 Å²	107	66%	0.663	54%	0.535	S	S	*	.			trans	-62.4	141.1	176.6	-66.4	-38.9	0	0	0	110.2	E123 E124 L125	D121-E123 PolarHBondContact O-N 2.83Å; D121-E123 VanDerWaalsContact O-N 3.13Å; D121-E124 PolarHBondContact O-N 3.44Å; D121-L125 PolarHBondContact O-N 2.88Å
122	S	83.1	Confident	87.9	Confident	98 Å²	98	105.6 Å²	105.6	69%	0.685	53%	0.525	S	S	*	.	H	α-helix	trans	-56.7	-32.7	-178.1	-167.2	0	0	0	0	112.6	L125 E126	S122-L125 PolarHBondContact O-N 3.37Å; S122-E126 PolarHBondContact O-N 3.43Å
123	E	85.7	Confident	88.2	Confident	161 Å²	161	107.1 Å²	107.1	75%	0.752	53%	0.526	S	S	*	.	H	α-helix	trans	-67.4	-36.1	177.5	-63	-176.8	179.2	0	0	112.4	D121 E126 R127	D121-E123 PolarHBondContact O-N 2.83Å; D121-E123 VanDerWaalsContact O-N 3.13Å; E123-E126 PolarHBondContact O-N 3.28Å; E123-R127 PolarHBondContact O-N 3.34Å
124	E	87	Confident	88.5	Confident	66 Å²	66	109.1 Å²	109.1	31%	0.308	52%	0.521	S	S	.	.	H	α-helix	trans	-69.2	-41.9	177.3	-179.4	163.5	-140.1	0	0	110.4	Q120 D121 E126 R127 L128	Q120-E124 PolarHBondContact NE2-OE2 3.45Å; D121-E124 PolarHBondContact O-N 3.44Å; E124-E126 VanDerWaalsContact C-N 3.34Å; E124-E126 PolarHBondContact O-N 3.13Å; E124-R127 PolarHBondContact O-N 3.16Å; E124-R127 IonicContact OE1-NH2 3.91Å; E124-R127 PolarHBondContact OE1-NH2 3.39Å; E124-L128 HydrophobicContact CG-CD1 3.71Å; E124-L128 WeakPolarHBondContact O-CD1 3.35Å; E124-L128 PolarHBondContact O-N 2.89Å
125	L	88.2	Confident	88.8	Confident	67 Å²	67	110.3 Å²	110.3	35%	0.351	52%	0.522	S	S	.	.	H	α-helix	trans	-60.7	-42	174.4	-69.6	173.2	0	0	0	112	F117 Q120 D121 S122 L128 A129	F117-L125 HydrophobicContact CE2-CD2 4.4Å; F117-L125 HydrophobicContact CZ-CD2 4.5Å; Q120-L125 HydrophobicContact CB-CG 4.38Å; D121-L125 PolarHBondContact O-N 2.88Å; S122-L125 PolarHBondContact O-N 3.37Å; L125-L128 PolarHBondContact O-N 3.18Å; L125-A129 WeakPolarHBondContact O-CB 3.46Å; L125-A129 PolarHBondContact O-N 2.57Å
126	E	90.7	Very high	89.1	Confident	142 Å²	142	111 Å²	111	66%	0.664	53%	0.527	S	S	*	.	H	α-helix	trans	-64.4	-42.2	176.1	-172.6	179.2	179.8	0	0	111.9	S122 E123 E124 L128 A129 K130	S122-E126 PolarHBondContact O-N 3.43Å; E123-E126 PolarHBondContact O-N 3.28Å; E124-E126 VanDerWaalsContact C-N 3.34Å; E124-E126 PolarHBondContact O-N 3.13Å; E126-L128 PolarHBondContact O-N 2.89Å; E126-A129 PolarHBondContact O-N 3.06Å; E126-K130 PolarHBondContact O-N 2.93Å
127	R	91.6	Very high	89.5	Confident	146 Å²	146	107.1 Å²	107.1	55%	0.551	52%	0.516	S	S	*	.	H	α-helix	trans	-59.5	-47	174.4	-171	-169	74.3	-155.5	-10.1	111.3	E123 E124 A129 K130 E131	E123-R127 PolarHBondContact O-N 3.34Å; E124-R127 PolarHBondContact O-N 3.16Å; E124-R127 IonicContact OE1-NH2 3.91Å; E124-R127 PolarHBondContact OE1-NH2 3.39Å; R127-A129 VanDerWaalsContact C-N 3.34Å; R127-A129 PolarHBondContact O-N 2.93Å; R127-K130 PolarHBondContact O-N 3.5Å; R127-E131 WeakPolarHBondContact O-CB 3.49Å; R127-E131 PolarHBondContact O-N 3Å
128	L	91.1	Very high	89.9	Confident	64 Å²	64	106.9 Å²	106.9	34%	0.335	52%	0.517	S	S	.	.	H	α-helix	trans	-62.5	-40.5	178	-93.4	77.6	0	0	0	111.6	E124 L125 E126 E131 Q132	E124-L128 HydrophobicContact CG-CD1 3.71Å; E124-L128 WeakPolarHBondContact O-CD1 3.35Å; E124-L128 PolarHBondContact O-N 2.89Å; L125-L128 PolarHBondContact O-N 3.18Å; E126-L128 PolarHBondContact O-N 2.89Å; L128-E131 PolarHBondContact O-N 3.26Å; L128-Q132 WeakPolarHBondContact O-CB 3.36Å; L128-Q132 PolarHBondContact O-N 3.38Å
129	A	92.4	Very high	90.3	Very high	55 Å²	55	102.3 Å²	102.3	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-64	-41.2	177.5	0	0	0	0	0	111.9	L125 E126 R127 Q132 Q133	L125-A129 WeakPolarHBondContact O-CB 3.46Å; L125-A129 PolarHBondContact O-N 2.57Å; E126-A129 PolarHBondContact O-N 3.06Å; R127-A129 VanDerWaalsContact C-N 3.34Å; R127-A129 PolarHBondContact O-N 2.93Å; A129-Q132 PolarHBondContact O-N 3.02Å; A129-Q133 WeakPolarHBondContact O-CB 3.44Å; A129-Q133 PolarHBondContact O-N 3.37Å
130	K	94.6	Very high	90.6	Very high	156 Å²	156	102.5 Å²	102.5	68%	0.678	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-44.4	175.3	-173.7	-179	177.6	-177	0	111.9	E126 R127 Q133 E134	E126-K130 PolarHBondContact O-N 2.93Å; R127-K130 PolarHBondContact O-N 3.5Å; K130-Q133 PolarHBondContact O-N 3.27Å; K130-E134 PolarHBondContact O-N 3.16Å
131	E	94	Very high	91.3	Very high	103 Å²	103	102.4 Å²	102.4	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-61.4	-44.2	176.5	-176.6	175.8	-174.2	0	0	111.3	R127 L128 Q133 E134 I135	R127-E131 WeakPolarHBondContact O-CB 3.49Å; R127-E131 PolarHBondContact O-N 3Å; L128-E131 PolarHBondContact O-N 3.26Å; E131-Q133 VanDerWaalsContact C-N 3.32Å; E131-Q133 PolarHBondContact O-N 3.06Å; E131-E134 PolarHBondContact O-N 3.38Å; E131-I135 HydrophobicContact CG-CD1 4.09Å; E131-I135 VanDerWaalsContact O-CG1 3.28Å; E131-I135 WeakPolarHBondContact O-CG1 3.36Å; E131-I135 PolarHBondContact O-N 3Å
132	Q	95.6	Very high	91.5	Very high	111 Å²	111	100.8 Å²	100.8	52%	0.519	50%	0.504	S	S	.	.	H	α-helix	trans	-59	-43.7	174.7	-177.2	179.1	16.1	0	0	111.9	L128 A129 I135 F136	L128-Q132 WeakPolarHBondContact O-CB 3.36Å; L128-Q132 PolarHBondContact O-N 3.38Å; A129-Q132 PolarHBondContact O-N 3.02Å; Q132-I135 PolarHBondContact O-N 3.36Å; Q132-F136 HydrophobicContact CG-CD2 4.08Å; Q132-F136 HydrophobicContact CG-CE2 3.59Å; Q132-F136 HydrophobicContact CG-CZ 3.86Å; Q132-F136 WeakPolarHBondContact O-CD2 3.21Å; Q132-F136 WeakPolarHBondContact O-CG 3.47Å; Q132-F136 PolarHBondContact O-N 3Å
133	Q	95.4	Very high	91.6	Very high	86 Å²	86	103 Å²	103	40%	0.402	50%	0.502	S	S	.	.	H	α-helix	trans	-64.7	-41.3	178.3	-179.7	61.7	20.8	0	0	112.1	A129 K130 E131 F136 E137	A129-Q133 WeakPolarHBondContact O-CB 3.44Å; A129-Q133 PolarHBondContact O-N 3.37Å; K130-Q133 PolarHBondContact O-N 3.27Å; E131-Q133 VanDerWaalsContact C-N 3.32Å; E131-Q133 PolarHBondContact O-N 3.06Å; Q133-F136 PolarHBondContact O-N 3.22Å; Q133-E137 PolarHBondContact NE2-OE1 2.98Å; Q133-E137 WeakPolarHBondContact O-CG 3.48Å; Q133-E137 PolarHBondContact O-N 3.36Å
134	E	96	Very high	91.6	Very high	120 Å²	120	99.5 Å²	99.5	56%	0.561	49%	0.487	S	S	*	.	H	α-helix	trans	-62.9	-43.6	175.7	-176.3	171.9	-171.1	0	0	111.5	K130 E131 F136 E137 Q138	K130-E134 PolarHBondContact O-N 3.16Å; E131-E134 PolarHBondContact O-N 3.38Å; E134-F136 VanDerWaalsContact C-N 3.32Å; E134-F136 PolarHBondContact O-N 3.28Å; E134-E137 WeakPolarHBondContact O-CB 3.48Å; E134-E137 PolarHBondContact O-N 3.26Å; E134-E137 VanDerWaalsContact O-N 3.16Å; E134-Q138 WeakPolarHBondContact O-CB 3.46Å; E134-Q138 PolarHBondContact O-N 3.45Å
135	I	94.5	Very high	91.3	Very high	95 Å²	95	97.6 Å²	97.6	49%	0.487	49%	0.485	S	S	.	.	H	α-helix	trans	-60.5	-42.6	174.7	-68.4	165.5	0	0	0	110.8	E131 Q132 Q138 A139	E131-I135 HydrophobicContact CG-CD1 4.09Å; E131-I135 VanDerWaalsContact O-CG1 3.28Å; E131-I135 WeakPolarHBondContact O-CG1 3.36Å; E131-I135 PolarHBondContact O-N 3Å; Q132-I135 PolarHBondContact O-N 3.36Å; I135-Q138 PolarHBondContact O-N 2.64Å; I135-A139 WeakPolarHBondContact O-CB 3.47Å; I135-A139 PolarHBondContact O-N 3.17Å
136	F	95.1	Very high	90.7	Very high	103 Å²	103	101.3 Å²	101.3	45%	0.452	50%	0.501	S	S	.	.	H	α-helix	trans	-66.5	-36.3	175.7	-69.5	-25.8	0	0	0	112.7	Q132 Q133 E134 R140	Q132-F136 HydrophobicContact CG-CD2 4.08Å; Q132-F136 HydrophobicContact CG-CE2 3.59Å; Q132-F136 HydrophobicContact CG-CZ 3.86Å; Q132-F136 WeakPolarHBondContact O-CD2 3.21Å; Q132-F136 WeakPolarHBondContact O-CG 3.47Å; Q132-F136 PolarHBondContact O-N 3Å; Q133-F136 PolarHBondContact O-N 3.22Å; E134-F136 VanDerWaalsContact C-N 3.32Å; E134-F136 PolarHBondContact O-N 3.28Å; F136-R140 VanDerWaalsContact O-CG 3.29Å; F136-R140 WeakPolarHBondContact O-CG 3.48Å; F136-R140 PolarHBondContact O-N 2.59Å; F136-R140 VanDerWaalsContact O-N 3.08Å; F136-R140 PolarHBondContact O-NH1 2.98Å
137	E	93.7	Very high	90	Very high	97 Å²	97	99.9 Å²	99.9	45%	0.453	49%	0.489	S	S	.	.	H	α-helix	trans	-64.4	-45.8	174.2	-82.4	169.8	-162.1	0	0	111.8	Q133 E134 R140 A141	Q133-E137 PolarHBondContact NE2-OE1 2.98Å; Q133-E137 WeakPolarHBondContact O-CG 3.48Å; Q133-E137 PolarHBondContact O-N 3.36Å; E134-E137 WeakPolarHBondContact O-CB 3.48Å; E134-E137 PolarHBondContact O-N 3.26Å; E134-E137 VanDerWaalsContact O-N 3.16Å; E137-R140 PolarHBondContact O-N 3.33Å; E137-R140 IonicContact OE1-NH2 2.67Å; E137-A141 PolarHBondContact O-N 3.49Å
138	Q	92.7	Very high	89.1	Confident	117 Å²	117	96.9 Å²	96.9	55%	0.547	48%	0.484	S	S	.	.	H	α-helix	trans	-62.3	-46.5	177	-173.8	163.6	11.5	0	0	111.5	E134 I135 R140 A141 D142	E134-Q138 WeakPolarHBondContact O-CB 3.46Å; E134-Q138 PolarHBondContact O-N 3.45Å; I135-Q138 PolarHBondContact O-N 2.64Å; Q138-R140 VanDerWaalsContact C-N 3.28Å; Q138-R140 PolarHBondContact O-N 2.76Å; Q138-A141 PolarHBondContact O-N 3.25Å; Q138-A141 VanDerWaalsContact O-N 3.08Å; Q138-D142 PolarHBondContact O-N 3.46Å
139	A	91.4	Very high	88.3	Confident	58 Å²	58	99.3 Å²	99.3	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-61	-35.1	176.4	0	0	0	0	0	112.8	I135 F143	I135-A139 WeakPolarHBondContact O-CB 3.47Å; I135-A139 PolarHBondContact O-N 3.17Å; A139-F143 WeakPolarHBondContact O-CB 3.38Å; A139-F143 PolarHBondContact O-N 3.22Å
140	R	90.8	Very high	87.8	Confident	124 Å²	124	103 Å²	103	47%	0.468	50%	0.499	S	S	.	.	H	α-helix	trans	-68.3	-40.8	173.1	-73.7	-170.5	-50.5	-97.3	15.1	112	F136 E137 Q138 I144	F136-R140 VanDerWaalsContact O-CG 3.29Å; F136-R140 WeakPolarHBondContact O-CG 3.48Å; F136-R140 PolarHBondContact O-N 2.59Å; F136-R140 VanDerWaalsContact O-N 3.08Å; F136-R140 PolarHBondContact O-NH1 2.98Å; E137-R140 PolarHBondContact O-N 3.33Å; E137-R140 IonicContact OE1-NH2 2.67Å; Q138-R140 VanDerWaalsContact C-N 3.28Å; Q138-R140 PolarHBondContact O-N 2.76Å; R140-I144 VanDerWaalsContact O-CG1 3.32Å; R140-I144 WeakPolarHBondContact O-CG1 3.34Å; R140-I144 PolarHBondContact O-N 2.99Å; R140-I144 VanDerWaalsContact O-N 3.16Å
141	A	90.7	Very high	86.9	Confident	57 Å²	57	99 Å²	99	47%	0.471	48%	0.483	S	S	.	.	H	α-helix	trans	-66.7	-45.4	178.8	0	0	0	0	0	111.7	E137 Q138 F143 I144 G145	E137-A141 PolarHBondContact O-N 3.49Å; Q138-A141 PolarHBondContact O-N 3.25Å; Q138-A141 VanDerWaalsContact O-N 3.08Å; A141-F143 VanDerWaalsContact C-N 3.35Å; A141-F143 PolarHBondContact O-N 3.02Å; A141-I144 PolarHBondContact O-N 3.42Å; A141-G145 PolarHBondContact O-N 3.3Å
142	D	88.1	Confident	86.2	Confident	91 Å²	91	99.2 Å²	99.2	49%	0.487	49%	0.487	S	S	.	.	H	α-helix	trans	-61	-44	177.7	-68.5	-14.4	0	0	0	111	Q138 I144 G145 E146	Q138-D142 PolarHBondContact O-N 3.46Å; D142-I144 VanDerWaalsContact C-N 3.32Å; D142-I144 PolarHBondContact O-N 3.32Å; D142-G145 PolarHBondContact O-N 2.89Å; D142-E146 WeakPolarHBondContact O-CG 3.37Å; D142-E146 PolarHBondContact O-N 3.05Å
143	F	84.4	Confident	85.3	Confident	144 Å²	144	100.3 Å²	100.3	63%	0.632	50%	0.496	S	S	*	.	H	α-helix	trans	-61	-38.2	176	-179.2	-99.5	0	0	0	113.1	A139 A141 R147	A139-F143 WeakPolarHBondContact O-CB 3.38Å; A139-F143 PolarHBondContact O-N 3.22Å; A141-F143 VanDerWaalsContact C-N 3.35Å; A141-F143 PolarHBondContact O-N 3.02Å; F143-R147 PolarHBondContact O-N 2.9Å
144	I	85.4	Confident	84.8	Confident	88 Å²	88	100.4 Å²	100.4	45%	0.451	50%	0.499	S	S	.	.	H	α-helix	trans	-73.5	-42.6	176.3	-67.7	168.5	0	0	0	110.5	R140 A141 D142 R147 L148	R140-I144 VanDerWaalsContact O-CG1 3.32Å; R140-I144 WeakPolarHBondContact O-CG1 3.34Å; R140-I144 PolarHBondContact O-N 2.99Å; R140-I144 VanDerWaalsContact O-N 3.16Å; A141-I144 PolarHBondContact O-N 3.42Å; D142-I144 VanDerWaalsContact C-N 3.32Å; D142-I144 PolarHBondContact O-N 3.32Å; I144-R147 WeakPolarHBondContact O-CB 3.45Å; I144-R147 PolarHBondContact O-N 3.31Å; I144-L148 HydrophobicContact CG2-CD1 3.91Å; I144-L148 HydrophobicContact CG2-CG 4.32Å; I144-L148 WeakPolarHBondContact O-CG 3.48Å; I144-L148 PolarHBondContact O-N 3.22Å
145	G	81.1	Confident	84.3	Confident	26 Å²	26	97 Å²	97	27%	0.268	49%	0.491	S	S	.	.	H	α-helix	trans	-59.5	-50.8	178.9	0	0	0	0	0	112	A141 D142 R147 L148 D149	A141-G145 PolarHBondContact O-N 3.3Å; D142-G145 PolarHBondContact O-N 2.89Å; G145-R147 PolarHBondContact O-N 2.85Å; G145-L148 PolarHBondContact O-N 3.31Å; G145-L148 VanDerWaalsContact O-N 3.11Å; G145-D149 WeakPolarHBondContact O-CB 3.3Å; G145-D149 PolarHBondContact O-N 3.26Å
146	E	74.9	Confident	83.6	Confident	144 Å²	144	95.4 Å²	95.4	67%	0.673	49%	0.492	S	S	*	.	H	α-helix	trans	-59	-34	175.8	-73.2	-174.7	169.5	0	0	112.4	D142 R150	D142-E146 WeakPolarHBondContact O-CG 3.37Å; D142-E146 PolarHBondContact O-N 3.05Å; E146-R150 VanDerWaalsContact O-CB 3.28Å; E146-R150 WeakPolarHBondContact O-CB 3.19Å; E146-R150 PolarHBondContact O-N 3.23Å; E146-R150 VanDerWaalsContact O-N 3.12Å
147	R	76.5	Confident	83.1	Confident	113 Å²	113	94.1 Å²	94.1	43%	0.426	50%	0.496	S	S	.	.	H	α-helix	trans	-71.2	-41.5	176.7	-167.5	174	77.2	99.1	-8.7	112	F143 I144 G145 E151	F143-R147 PolarHBondContact O-N 2.9Å; I144-R147 WeakPolarHBondContact O-CB 3.45Å; I144-R147 PolarHBondContact O-N 3.31Å; G145-R147 PolarHBondContact O-N 2.85Å; R147-E151 IonicContact CZ-OE1 3.15Å; R147-E151 IonicContact NH1-OE1 2.64Å; R147-E151 PolarHBondContact NH1-OE1 3.47Å; R147-E151 IonicContact NH1-OE2 3.54Å; R147-E151 WeakPolarHBondContact O-CG 3.43Å; R147-E151 PolarHBondContact O-N 3.47Å
148	L	72.5	Confident	82.6	Confident	83 Å²	83	94.7 Å²	94.7	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-66.5	-48.3	176.5	-71.9	171.8	0	0	0	110.9	I144 G145 R150 E151 D152	I144-L148 HydrophobicContact CG2-CD1 3.91Å; I144-L148 HydrophobicContact CG2-CG 4.32Å; I144-L148 WeakPolarHBondContact O-CG 3.48Å; I144-L148 PolarHBondContact O-N 3.22Å; G145-L148 PolarHBondContact O-N 3.31Å; G145-L148 VanDerWaalsContact O-N 3.11Å; L148-R150 PolarHBondContact O-N 2.93Å; L148-E151 PolarHBondContact O-N 3.19Å; L148-D152 WeakPolarHBondContact O-CB 3.49Å; L148-D152 PolarHBondContact O-N 3.32Å
149	D	75	Confident	82.1	Confident	115 Å²	115	92.6 Å²	92.6	62%	0.615	50%	0.5	S	S	*	.	H	α-helix	trans	-56.6	-39.8	176.9	-73.6	-28.7	0	0	0	111.5	G145 L153	G145-D149 WeakPolarHBondContact O-CB 3.3Å; G145-D149 PolarHBondContact O-N 3.26Å; D149-L153 VanDerWaalsContact O-CB 3.24Å; D149-L153 WeakPolarHBondContact O-CB 3.44Å; D149-L153 PolarHBondContact O-N 2.87Å
150	R	80.5	Confident	81.6	Confident	132 Å²	132	92.8 Å²	92.8	50%	0.498	50%	0.501	S	S	.	.	H	α-helix	trans	-66.9	-42.6	175	-172	-170.5	68.5	77.8	8	112.5	E146 L148 L154	E146-R150 VanDerWaalsContact O-CB 3.28Å; E146-R150 WeakPolarHBondContact O-CB 3.19Å; E146-R150 PolarHBondContact O-N 3.23Å; E146-R150 VanDerWaalsContact O-N 3.12Å; L148-R150 PolarHBondContact O-N 2.93Å; R150-L154 HydrophobicContact CG-CD1 4.46Å; R150-L154 VanDerWaalsContact O-CG 3.26Å; R150-L154 WeakPolarHBondContact O-CG 3.34Å; R150-L154 PolarHBondContact O-N 3.06Å; R150-L154 VanDerWaalsContact O-N 3.17Å
151	E	77	Confident	81.1	Confident	73 Å²	73	89.8 Å²	89.8	34%	0.341	50%	0.503	S	S	.	.	H	α-helix	trans	-68.3	-41.9	179.2	-76.9	173.9	-165.7	0	0	111.5	R147 L148 L154 A155	R147-E151 IonicContact CZ-OE1 3.15Å; R147-E151 IonicContact NH1-OE1 2.64Å; R147-E151 PolarHBondContact NH1-OE1 3.47Å; R147-E151 IonicContact NH1-OE2 3.54Å; R147-E151 WeakPolarHBondContact O-CG 3.43Å; R147-E151 PolarHBondContact O-N 3.47Å; L148-E151 PolarHBondContact O-N 3.19Å; E151-L154 PolarHBondContact O-N 3.48Å; E151-A155 WeakPolarHBondContact O-CB 3.2Å; E151-A155 PolarHBondContact O-N 3.1Å
152	D	79.4	Confident	80.5	Confident	107 Å²	107	89.7 Å²	89.7	57%	0.572	50%	0.499	S	S	*	.	H	α-helix	trans	-66.1	-41.6	177.1	-75.1	-15.2	0	0	0	111.8	L148 L154 A155 A156	L148-D152 WeakPolarHBondContact O-CB 3.49Å; L148-D152 PolarHBondContact O-N 3.32Å; D152-L154 VanDerWaalsContact C-N 3.31Å; D152-L154 PolarHBondContact O-N 3.3Å; D152-A155 PolarHBondContact O-N 3.32Å; D152-A156 WeakPolarHBondContact O-CB 3.35Å; D152-A156 PolarHBondContact O-N 2.84Å
153	L	75.7	Confident	79.9	Confident	133 Å²	133	90 Å²	90	70%	0.696	50%	0.501	S	S	*	.	H	α-helix	trans	-61.6	-40.1	174.7	-164.6	83.1	0	0	0	111.6	D149 S157	D149-L153 VanDerWaalsContact O-CB 3.24Å; D149-L153 WeakPolarHBondContact O-CB 3.44Å; D149-L153 PolarHBondContact O-N 2.87Å; L153-S157 WeakPolarHBondContact O-CB 3.47Å; L153-S157 PolarHBondContact O-N 2.88Å
154	L	84.6	Confident	79.3	Confident	88 Å²	88	88.7 Å²	88.7	46%	0.461	50%	0.499	S	S	.	.	H	α-helix	trans	-68	-41.5	175.8	-73.6	171	0	0	0	111.9	R150 E151 D152 S157 N158	R150-L154 HydrophobicContact CG-CD1 4.46Å; R150-L154 VanDerWaalsContact O-CG 3.26Å; R150-L154 WeakPolarHBondContact O-CG 3.34Å; R150-L154 PolarHBondContact O-N 3.06Å; R150-L154 VanDerWaalsContact O-N 3.17Å; E151-L154 PolarHBondContact O-N 3.48Å; D152-L154 VanDerWaalsContact C-N 3.31Å; D152-L154 PolarHBondContact O-N 3.3Å; L154-S157 PolarHBondContact O-N 3.46Å; L154-N158 PolarHBondContact O-N 2.8Å; L154-N158 PolarHBondContact O-ND2 3.5Å
155	A	85.4	Confident	78.7	Confident	49 Å²	49	87.7 Å²	87.7	41%	0.405	50%	0.5	S	S	.	.	H	α-helix	trans	-63.8	-45.5	176.6	0	0	0	0	0	111.5	E151 D152 S157 N158 C159	E151-A155 WeakPolarHBondContact O-CB 3.2Å; E151-A155 PolarHBondContact O-N 3.1Å; D152-A155 PolarHBondContact O-N 3.32Å; A155-S157 VanDerWaalsContact C-N 3.32Å; A155-S157 PolarHBondContact O-N 3.43Å; A155-N158 PolarHBondContact O-N 3.19Å; A155-N158 VanDerWaalsContact O-N 3.16Å; A155-C159 PolarHBondContact O-N 3.13Å; A155-C159 PolarHBondContact O-SG 3.21Å; A155-C159 VanDerWaalsContact O-SG 3.4Å
156	A	81	Confident	78.1	Confident	62 Å²	62	91.6 Å²	91.6	51%	0.512	52%	0.515	S	S	.	.	H	α-helix	trans	-60.1	-41.9	175.7	0	0	0	0	0	111.9	D152 N158 A160	D152-A156 WeakPolarHBondContact O-CB 3.35Å; D152-A156 PolarHBondContact O-N 2.84Å; A156-N158 PolarHBondContact O-N 3.36Å; A156-A160 WeakPolarHBondContact O-CB 3.3Å; A156-A160 PolarHBondContact O-N 3.2Å
157	S	84.5	Confident	77.4	Confident	75 Å²	75	94.6 Å²	94.6	52%	0.524	52%	0.521	S	S	.	.	H	α-helix	trans	-62.1	-41.3	174.4	-175.2	0	0	0	0	112.4	L153 L154 A155 A161	L153-S157 WeakPolarHBondContact O-CB 3.47Å; L153-S157 PolarHBondContact O-N 2.88Å; L154-S157 PolarHBondContact O-N 3.46Å; A155-S157 VanDerWaalsContact C-N 3.32Å; A155-S157 PolarHBondContact O-N 3.43Å; S157-A161 WeakPolarHBondContact O-CB 3.37Å; S157-A161 PolarHBondContact O-N 2.91Å
158	N	84.1	Confident	76.6	Confident	110 Å²	110	97 Å²	97	59%	0.588	54%	0.539	S	S	*	.	H	α-helix	trans	-69.4	-42.8	179.8	-75.1	-22.2	0	0	0	112.2	L154 A155 A156 A161 S162	L154-N158 PolarHBondContact O-N 2.8Å; L154-N158 PolarHBondContact O-ND2 3.5Å; A155-N158 PolarHBondContact O-N 3.19Å; A155-N158 VanDerWaalsContact O-N 3.16Å; A156-N158 PolarHBondContact O-N 3.36Å; N158-A161 PolarHBondContact O-N 3.47Å; N158-S162 PolarHBondContact O-N 3.5Å; N158-S162 PolarHBondContact O-OG 2.95Å
159	C	80.7	Confident	76	Confident	73 Å²	73	98.5 Å²	98.5	49%	0.493	55%	0.553	S	S	.	*	H	α-helix	trans	-62	-44.8	175.8	-68.8	0	0	0	0	111.3	A155 A161 S162 D163	A155-C159 PolarHBondContact O-N 3.13Å; A155-C159 PolarHBondContact O-SG 3.21Å; A155-C159 VanDerWaalsContact O-SG 3.4Å; C159-A161 VanDerWaalsContact C-N 3.3Å; C159-A161 PolarHBondContact O-N 3.26Å; C159-S162 WeakPolarHBondContact CA-OG 3.48Å; C159-S162 PolarHBondContact O-N 2.99Å; C159-S162 PolarHBondContact O-OG 3.48Å; C159-D163 PolarHBondContact O-N 3.01Å
160	A	80.3	Confident	74.9	Confident	62 Å²	62	96 Å²	96	51%	0.512	55%	0.553	S	S	.	*	H	α-helix	trans	-61.3	-37.9	175.8	0	0	0	0	0	112.3	A156 L164	A156-A160 WeakPolarHBondContact O-CB 3.3Å; A156-A160 PolarHBondContact O-N 3.2Å; A160-L164 PolarHBondContact O-N 3.48Å
161	A	80.8	Confident	73.2	Confident	60 Å²	60	99.6 Å²	99.6	50%	0.496	58%	0.576	S	S	.	*	H	α-helix	trans	-68	-39.4	174.9	0	0	0	0	0	112.6	S157 N158 C159 S165	S157-A161 WeakPolarHBondContact O-CB 3.37Å; S157-A161 PolarHBondContact O-N 2.91Å; N158-A161 PolarHBondContact O-N 3.47Å; C159-A161 VanDerWaalsContact C-N 3.3Å; C159-A161 PolarHBondContact O-N 3.26Å; A161-S165 PolarHBondContact O-N 3.36Å; A161-S165 VanDerWaalsContact O-N 3.11Å
162	S	79.2	Confident	71.6	Confident	55 Å²	55	99.5 Å²	99.5	39%	0.385	59%	0.594	S	S	.	*	H	α-helix	trans	-69.7	-38.1	176.6	56.5	0	0	0	0	112.9	N158 C159 L164 S165 N166	N158-S162 PolarHBondContact O-N 3.5Å; N158-S162 PolarHBondContact O-OG 2.95Å; C159-S162 WeakPolarHBondContact CA-OG 3.48Å; C159-S162 PolarHBondContact O-N 2.99Å; C159-S162 PolarHBondContact O-OG 3.48Å; S162-L164 VanDerWaalsContact C-N 3.32Å; S162-L164 PolarHBondContact O-N 2.84Å; S162-S165 WeakPolarHBondContact O-CB 3.39Å; S162-S165 PolarHBondContact O-N 3.01Å; S162-N166 PolarHBondContact O-N 3.06Å
163	D	75.6	Confident	69.9	Low	99 Å²	99	100.5 Å²	100.5	53%	0.529	61%	0.61	S	S	.	*	H	α-helix	trans	-63.6	-40.1	176.7	-76.8	-18.3	0	0	0	111.2	C159 N166 Y167	C159-D163 PolarHBondContact O-N 3.01Å; D163-N166 PolarHBondContact O-N 2.89Å; D163-Y167 PolarHBondContact O-N 3.5Å
164	L	71.3	Confident	68.3	Low	115 Å²	115	99.2 Å²	99.2	60%	0.602	61%	0.612	S	S	*	*	H	α-helix	trans	-65.1	-39.7	174.7	-173	61.6	0	0	0	112	A160 S162 Y167 M168	A160-L164 PolarHBondContact O-N 3.48Å; S162-L164 VanDerWaalsContact C-N 3.32Å; S162-L164 PolarHBondContact O-N 2.84Å; L164-Y167 PolarHBondContact O-N 2.97Å; L164-M168 WeakPolarHBondContact O-CG 3.15Å; L164-M168 PolarHBondContact O-N 3.25Å
165	S	73.2	Confident	66.5	Low	67 Å²	67	103.9 Å²	103.9	47%	0.469	63%	0.631	S	S	.	*	H	α-helix	trans	-63.3	-42.7	175.4	-175.8	0	0	0	0	112.2	A161 S162 Y167 M168 T169	A161-S165 PolarHBondContact O-N 3.36Å; A161-S165 VanDerWaalsContact O-N 3.11Å; S162-S165 WeakPolarHBondContact O-CB 3.39Å; S162-S165 PolarHBondContact O-N 3.01Å; S165-Y167 VanDerWaalsContact C-N 3.33Å; S165-Y167 PolarHBondContact O-N 3.45Å; S165-M168 PolarHBondContact O-N 2.83Å; S165-T169 PolarHBondContact O-N 3.27Å; S165-T169 PolarHBondContact O-OG1 3.27Å
166	N	67.8	Low	64.5	Low	109 Å²	109	106.7 Å²	106.7	58%	0.583	65%	0.648	S	S	*	*	H	α-helix	trans	-63.7	-39.5	176.2	-76.1	-17.1	0	0	0	111.6	S162 D163 M168 T169 G170	S162-N166 PolarHBondContact O-N 3.06Å; D163-N166 PolarHBondContact O-N 2.89Å; N166-M168 VanDerWaalsContact C-N 3.34Å; N166-M168 PolarHBondContact O-N 2.9Å; N166-T169 PolarHBondContact O-N 3.26Å; N166-G170 PolarHBondContact O-N 3.31Å
167	Y	60.3	Low	62.4	Low	206 Å²	206	108.1 Å²	108.1	81%	0.808	65%	0.654	S	S	*	*	H	α-helix	trans	-66.3	-31.2	175.1	-101.4	-81.7	0	0	0	113.7	D163 L164 S165	D163-Y167 PolarHBondContact O-N 3.5Å; L164-Y167 PolarHBondContact O-N 2.97Å; S165-Y167 VanDerWaalsContact C-N 3.33Å; S165-Y167 PolarHBondContact O-N 3.45Å
168	M	60	Low	60.4	Low	163 Å²	163	111.9 Å²	111.9	80%	0.803	67%	0.668	S	S	*	*	H	α-helix	trans	-79	-17.4	176.8	-63.6	-133	99.9	0	0	113.6	L164 S165 N166	L164-M168 WeakPolarHBondContact O-CG 3.15Å; L164-M168 PolarHBondContact O-N 3.25Å; S165-M168 PolarHBondContact O-N 2.83Å; N166-M168 VanDerWaalsContact C-N 3.34Å; N166-M168 PolarHBondContact O-N 2.9Å
169	T	60.7	Low	58.1	Low	116 Å²	116	117.5 Å²	117.5	71%	0.712	68%	0.683	S	S	*	*	H	α-helix	trans	-109.5	-10.6	-172.3	-35.6	0	0	0	0	113.9	S165 N166	S165-T169 PolarHBondContact O-N 3.27Å; S165-T169 PolarHBondContact O-OG1 3.27Å; N166-T169 PolarHBondContact O-N 3.26Å
170	G	50	Low	56.5	Low	61 Å²	61	119.6 Å²	119.6	63%	0.629	70%	0.695	S	S	*	*			trans	-121.5	68.9	-169.7	0	0	0	0	0	116.1	N166	N166-G170 PolarHBondContact O-N 3.31Å
171	H	45.4	Very low	54.5	Low	209 Å²	209	124.5 Å²	124.5	97%	0.968	71%	0.713	S	S	*	*			trans	-98.4	102.9	163.3	-130.4	-62.4	0	0	0	108.5
172	G	43.6	Very low	52.8	Low	71 Å²	71	126.6 Å²	126.6	73%	0.732	73%	0.731	S	S	*	*			trans	163.8	78.6	173.5	0	0	0	0	0	118.3
173	S	42.9	Very low	50.9	Low	128 Å²	128	131.6 Å²	131.6	90%	0.895	75%	0.753	S	S	*	*			trans	77.7	115.4	146.2	-135.8	0	0	0	0	120.7
174	S	43.8	Very low	49.4	Very low	106 Å²	106	132.1 Å²	132.1	74%	0.741	76%	0.764	S	S	*	*			trans	-69.3	138.7	168.4	31.7	0	0	0	0	114.9
175	Q	45.9	Very low	48.1	Very low	186 Å²	186	130.2 Å²	130.2	87%	0.869	77%	0.772	S	S	*	*				165	132.8	116.5	-98.8	-174.6	1	0	0	114.2
176	S	42.5	Very low	46.4	Very low	107 Å²	107	134.6 Å²	134.6	75%	0.748	79%	0.791	S	S	*	*			trans	70.7	116.3	140.3	-157.6	0	0	0	0	120.7
177	S	37.8	Very low	45.5	Very low	92 Å²	92	137.7 Å²	137.7	64%	0.643	81%	0.805	S	S	*	*				159.8	146.4	95.5	53.6	0	0	0	0	114.3
178	N	43.4	Very low	44.6	Very low	155 Å²	155	134.8 Å²	134.8	83%	0.829	80%	0.804	S	S	*	*			trans	92.2	108.7	149.9	-58	-24.1	0	0	0	121.7
179	Y	35.6	Very low	43.3	Very low	228 Å²	228	133.7 Å²	133.7	89%	0.894	81%	0.806	S	S	*	*			trans	-78.5	176.3	143.2	-74	-80.2	0	0	0	109.7
180	P	46.1	Very low	42.4	Very low	116 Å²	116	132.4 Å²	132.4	75%	0.753	81%	0.808	S	S	*	*			cis	-146.2	-176.3	20.3	39.2	-15.3	0	0	0	118.3
181	D	38.1	Very low	41.6	Very low	165 Å²	165	136.4 Å²	136.4	88%	0.882	82%	0.82	S	S	*	*			trans	-0.3	138.2	160.2	-78.8	-42.9	0	0	0	122.5
182	A	45.4	Very low	41.6	Very low	105 Å²	105	135.1 Å²	135.1	87%	0.868	81%	0.814	S	S	*	*			trans	-162.8	136.7	134.4	0	0	0	0	0	112.8
183	N	40	Very low	41.3	Very low	159 Å²	159	137.2 Å²	137.2	85%	0.85	82%	0.818	S	S	*	*			trans	-83.8	162.2	-176.9	-177	28.6	0	0	0	113.3
184	S	44.7	Very low	41.4	Very low	111 Å²	111	136.3 Å²	136.3	78%	0.776	81%	0.812	S	S	*	*			trans	90.6	121.8	150.4	-153.9	0	0	0	0	119.7
185	G	42.1	Very low	41.4	Very low	74 Å²	74	137.4 Å²	137.4	76%	0.763	81%	0.814	S	S	*	*			trans	165.1	82.3	162.3	0	0	0	0	0	113.5
186	D	37.6	Very low	41.6	Very low	160 Å²	160	135.3 Å²	135.3	86%	0.856	81%	0.808	S	S	*	*			trans	-54.2	146.3	162.5	-72	-55.9	0	0	0	111.4
187	I	49.2	Very low	41.8	Very low	174 Å²	174	135.8 Å²	135.8	89%	0.892	81%	0.808	S	S	*	*			trans	-165	131.4	138.9	-92.3	145.9	0	0	0	109.7
188	N	41.6	Very low	42	Very low	145 Å²	145	137.4 Å²	137.4	78%	0.775	81%	0.814	S	S	*	*			trans	-77	162.5	-175.3	-90.1	-42	0	0	0	115.1
189	T	33.2	Very low	42.2	Very low	139 Å²	139	134.6 Å²	134.6	85%	0.853	81%	0.813	S	S	*	*			trans	63.4	113.9	148	24.2	0	0	0	0	119.8
190	A	41.1	Very low	42.7	Very low	90 Å²	90	130.3 Å²	130.3	74%	0.744	81%	0.811	S	S	*	*				-163.9	120.8	121.2	0	0	0	0	0	110.8	E192	A190-E192 PolarHBondContact O-N 3.41Å
191	T	34.6	Very low	42.5	Very low	144 Å²	144	128 Å²	128	88%	0.883	81%	0.808	S	S	*	*			trans	-40.5	119.8	155.6	30.2	0	0	0	0	112.7
192	E	44.3	Very low	42.7	Very low	182 Å²	182	126.5 Å²	126.5	85%	0.85	81%	0.811	S	S	*	*			trans	-131.9	110.9	157.3	-76.1	-165.8	157.2	0	0	110.4	A190 S194	A190-E192 PolarHBondContact O-N 3.41Å; E192-S194 PolarHBondContact O-N 2.9Å
193	S	38.5	Very low	42.4	Very low	116 Å²	116	125.1 Å²	125.1	81%	0.811	81%	0.807	S	S	*	*			trans	-49	106.8	162.1	40.9	0	0	0	0	111.4	T195	S193-T195 PolarHBondContact O-N 2.72Å
194	S	43.7	Very low	42.7	Very low	109 Å²	109	129 Å²	129	76%	0.762	81%	0.809	S	S	*	*			trans	-90	99.4	168	-171.8	0	0	0	0	109.2	E192 L196	E192-S194 PolarHBondContact O-N 2.9Å; S194-L196 PolarHBondContact O-N 3.38Å
195	T	44.6	Very low	42.8	Very low	129 Å²	129	131 Å²	131	79%	0.791	81%	0.81	S	S	*	*			trans	-64	114.7	163.3	34.7	0	0	0	0	109	S193	S193-T195 PolarHBondContact O-N 2.72Å
196	L	50	Low	43.2	Very low	142 Å²	142	135.8 Å²	135.8	74%	0.743	82%	0.817	S	S	*	*			trans	-64.3	144	175.6	-75.6	164.3	0	0	0	111	S194 T198	S194-L196 PolarHBondContact O-N 3.38Å; L196-T198 PolarHBondContact O-N 2.68Å
197	P	46.3	Very low	43.5	Very low	116 Å²	116	131.8 Å²	131.8	75%	0.753	81%	0.813	S	S	*	*			trans	-74.5	120.8	179.8	29.8	-31.2	0	0	0	110.2	A199	P197-A199 PolarHBondContact O-N 3.24Å
198	T	42.2	Very low	43.2	Very low	126 Å²	126	129.2 Å²	129.2	77%	0.773	81%	0.811	S	S	*	*			trans	-67.2	93.7	168.1	-50.6	0	0	0	0	109	L196 T200	L196-T198 PolarHBondContact O-N 2.68Å; T198-T200 HydrophobicContact CG2-CG2 4.46Å; T198-T200 PolarHBondContact O-N 2.92Å
199	A	47.6	Very low	43.5	Very low	97 Å²	97	127.1 Å²	127.1	80%	0.802	81%	0.807	S	S	*	*			trans	-73.5	95.5	169.8	0	0	0	0	0	109.2	P197 G201	P197-A199 PolarHBondContact O-N 3.24Å; A199-G201 PolarHBondContact O-N 2.71Å
200	T	45	Very low	44.3	Very low	137 Å²	137	127 Å²	127	84%	0.84	81%	0.807	S	S	*	*			trans	-68.1	102	166.7	37.5	0	0	0	0	109.4	T198	T198-T200 HydrophobicContact CG2-CG2 4.46Å; T198-T200 PolarHBondContact O-N 2.92Å
201	G	42.5	Very low	44.9	Very low	67 Å²	67	130 Å²	130	69%	0.691	81%	0.808	S	S	*	*			trans	-157.8	88.6	179.8	0	0	0	0	0	113.2	A199	A199-G201 PolarHBondContact O-N 2.71Å
202	S	41.7	Very low	45.6	Very low	135 Å²	135	125.5 Å²	125.5	94%	0.944	79%	0.791	S	S	*	*			trans	42.5	87.7	153.9	-69.1	0	0	0	0	118.8
203	G	40.9	Very low	45.9	Very low	76 Å²	76	124.6 Å²	124.6	78%	0.784	79%	0.792	S	S	*	*			trans	-159.6	85.5	160.2	0	0	0	0	0	109.4
204	R	45.2	Very low	46.7	Very low	240 Å²	240	125.9 Å²	125.9	91%	0.906	79%	0.79	S	S	*	*			trans	-66.6	142.7	174.2	-72.2	-177.9	162.1	-171.8	-4.8	109
205	I	46.4	Very low	46.9	Very low	154 Å²	154	128.7 Å²	128.7	79%	0.79	80%	0.796	S	S	*	*			trans	87.5	91.3	159.3	-41.4	-159.5	0	0	0	115.3
206	L	51.6	Low	47.3	Very low	173 Å²	173	129.8 Å²	129.8	91%	0.906	80%	0.797	S	S	*	*				-177.7	140	123.3	-91.3	158.9	0	0	0	109.2	S208	L206-S208 PolarHBondContact O-N 3.08Å
207	G	43	Very low	47.3	Very low	76 Å²	76	133.2 Å²	133.2	78%	0.784	80%	0.802	S	S	*	*			trans	-65	122.2	-154	0	0	0	0	0	115.9
208	S	42.4	Very low	48	Very low	121 Å²	121	135.2 Å²	135.2	85%	0.846	81%	0.806	S	S	*	*			trans	-90.6	89.6	152.4	-174.9	0	0	0	0	106.8	L206	L206-S208 PolarHBondContact O-N 3.08Å
209	S	48.2	Very low	48.5	Very low	100 Å²	100	142.1 Å²	142.1	70%	0.699	83%	0.829	S	S	*	*			trans	-100.8	117.5	159.9	-70.4	0	0	0	0	106.1	I211	S209-I211 PolarHBondContact O-N 3.32Å
210	V	50.2	Low	48.5	Very low	138 Å²	138	144.4 Å²	144.4	84%	0.836	83%	0.831	S	S	*	*			trans	-52.3	107.1	157.9	171.5	0	0	0	0	105.9	G212	V210-G212 VanDerWaalsContact C-N 3.32Å; V210-G212 PolarHBondContact O-N 3.19Å
211	I	53.3	Low	48.7	Very low	151 Å²	151	144.7 Å²	144.7	77%	0.774	83%	0.83	S	S	*	*			trans	-72.3	96.2	173.6	-62.7	177.1	0	0	0	105.2	S209	S209-I211 PolarHBondContact O-N 3.32Å
212	G	49	Very low	49.1	Very low	50 Å²	50	149.1 Å²	149.1	52%	0.515	84%	0.838	S	S	.	*			trans	-78.2	129.8	165.2	0	0	0	0	0	108.6	V210 D214	V210-G212 VanDerWaalsContact C-N 3.32Å; V210-G212 PolarHBondContact O-N 3.19Å; G212-D214 PolarHBondContact O-N 3.05Å
213	D	52.5	Low	49.5	Very low	164 Å²	164	149.9 Å²	149.9	88%	0.877	83%	0.832	S	S	*	*	S	Bend	trans	-68.6	65.2	175.7	-70.9	-42.4	0	0	0	111.9
214	D	53.6	Low	50	Low	143 Å²	143	154.5 Å²	154.5	77%	0.765	84%	0.835	S	S	*	*			trans	-138.8	21.8	-174.6	-129.9	-2.4	0	0	0	115.5	G212	G212-D214 PolarHBondContact O-N 3.05Å
215	D	48	Very low	50.4	Low	168 Å²	168	148.8 Å²	148.8	90%	0.898	83%	0.83	S	S	*	*			trans	-105.4	63.4	174.1	-70.9	-28.2	0	0	0	111.4
216	N	53.4	Low	50.6	Low	152 Å²	152	148.4 Å²	148.4	81%	0.813	83%	0.833	S	S	*	*			trans	-107.6	84.7	160.9	-174.4	43.2	0	0	0	109.4
217	Y	50	Low	50.6	Low	214 Å²	214	146.5 Å²	146.5	84%	0.839	83%	0.827	S	S	*	*			trans	-130.6	108.1	165.3	-91.8	-89.5	0	0	0	108.2
218	D	62	Low	51.2	Low	158 Å²	158	152.4 Å²	152.4	85%	0.845	83%	0.831	S	S	*	*			trans	-179.6	99.6	139.3	-88.5	-20.8	0	0	0	108.9
219	E	51.8	Low	52	Low	270 Å²	270	155.3 Å²	155.3	100%	1.262	83%	0.829	S	S	*	*			trans	-83.2	0	146	-93.2	-172.7	159.2	0	0	109.5

Retrieved 219 of 219 residues in 54.3 ms (Link to these results)

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