A0A2K5N2B6_CERAT Loading...

PAK4-inhibitor INKA2

Inhibitor of the serine/threonine-protein kinase PAK4. Acts by binding PAK4 in a substrate-like manner, inhibiting the protein kinase activity.

AlphaFold DB , UniProt , Accession A0A2K5N2B6, Species CERAT (Cercocebus atys, Sooty mangabey), Gene INKA2, Length 297 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	55.7	Low	80.7	Confident	214 Å²	214	126.7 Å²	126.7	100%	1.054	62%	0.624	S	S	*	*				0	-24.1	0	-68.4	-177.2	172.7	0	0	114.1
2	T	63.9	Low	82	Confident	108 Å²	108	125.8 Å²	125.8	66%	0.663	62%	0.622	S	S	*	*	H	α-helix	trans	-80	-21.7	-177.4	43.7	0	0	0	0	116.1
3	M	62.4	Low	83.1	Confident	127 Å²	127	127.3 Å²	127.3	63%	0.626	62%	0.616	S	S	*	*	H	α-helix	trans	-74.4	-45	-179.3	-61.2	-53.9	-167.9	0	0	112.4	S5 R6 E7	M3-S5 VanDerWaalsContact C-N 3.29Å; M3-S5 PolarHBondContact O-N 3.21Å; M3-R6 WeakPolarHBondContact O-CA 3.39Å; M3-R6 WeakPolarHBondContact O-CB 3.34Å; M3-R6 PolarHBondContact O-N 3.31Å; M3-E7 PolarHBondContact O-N 3.24Å
4	E	73.6	Confident	84.1	Confident	137 Å²	137	130.1 Å²	130.1	64%	0.64	62%	0.617	S	S	*	*	H	α-helix	trans	-57.3	-38.5	179.5	-167	174.1	-172.5	0	0	112.6	R6 E7 M8	E4-R6 VanDerWaalsContact C-N 3.34Å; E4-R6 PolarHBondContact O-N 3.1Å; E4-E7 PolarHBondContact O-N 3.24Å; E4-M8 PolarHBondContact O-N 3.47Å
5	S	78.8	Confident	85	Confident	71 Å²	71	128.9 Å²	128.9	50%	0.497	62%	0.615	S	S	.	*	H	α-helix	trans	-61.1	-40.1	171.8	-173.8	0	0	0	0	112.6	M3 M8 D9	M3-S5 VanDerWaalsContact C-N 3.29Å; M3-S5 PolarHBondContact O-N 3.21Å; S5-M8 PolarHBondContact O-N 2.85Å; S5-D9 PolarHBondContact O-N 2.81Å
6	R	86.9	Confident	85.8	Confident	174 Å²	174	130.1 Å²	130.1	66%	0.657	62%	0.617	S	S	*	*	H	α-helix	trans	-72.1	-34.5	-178.9	-68.4	177.1	171.6	-147.4	-2.8	112	M3 E4 C10	M3-R6 WeakPolarHBondContact O-CA 3.39Å; M3-R6 WeakPolarHBondContact O-CB 3.34Å; M3-R6 PolarHBondContact O-N 3.31Å; E4-R6 VanDerWaalsContact C-N 3.34Å; E4-R6 PolarHBondContact O-N 3.1Å; R6-C10 PolarHBondContact O-N 3.29Å; R6-C10 VanDerWaalsContact O-N 3.09Å; R6-C10 PolarHBondContact O-SG 2.85Å; R6-C10 VanDerWaalsContact O-SG 3.36Å
7	E	89.8	Confident	86.5	Confident	115 Å²	115	129.5 Å²	129.5	54%	0.537	61%	0.614	S	S	.	*	H	α-helix	trans	-65.6	-47.4	173.4	-71.4	167.3	-163.6	0	0	110.4	M3 E4 D9 C10 Y11	M3-E7 PolarHBondContact O-N 3.24Å; E4-E7 PolarHBondContact O-N 3.24Å; E7-D9 VanDerWaalsContact C-N 3.32Å; E7-D9 PolarHBondContact O-N 2.95Å; E7-C10 WeakPolarHBondContact O-CA 3.4Å; E7-C10 WeakPolarHBondContact O-CB 3.49Å; E7-C10 PolarHBondContact O-N 3.14Å; E7-Y11 WeakPolarHBondContact O-CD2 3.45Å; E7-Y11 PolarHBondContact O-N 3.4Å
8	M	92.3	Very high	87.1	Confident	132 Å²	132	127.5 Å²	127.5	65%	0.65	60%	0.604	S	S	*	*	H	α-helix	trans	-57.9	-42.7	174.5	-168.8	172.7	-66.2	0	0	112.4	E4 S5 C10 Y11 L12	E4-M8 PolarHBondContact O-N 3.47Å; S5-M8 PolarHBondContact O-N 2.85Å; M8-C10 VanDerWaalsContact C-N 3.29Å; M8-C10 PolarHBondContact O-N 3.02Å; M8-Y11 PolarHBondContact O-N 3.31Å; M8-L12 WeakPolarHBondContact O-CB 3.47Å; M8-L12 PolarHBondContact O-N 3.22Å
9	D	94.3	Very high	87.7	Confident	69 Å²	69	126.9 Å²	126.9	37%	0.369	60%	0.604	S	S	.	*	H	α-helix	trans	-61.6	-34.9	174	-70.6	-32.9	0	0	0	112.8	S5 E7 R13	S5-D9 PolarHBondContact O-N 2.81Å; E7-D9 VanDerWaalsContact C-N 3.32Å; E7-D9 PolarHBondContact O-N 2.95Å; D9-R13 WeakPolarHBondContact O-CB 3.48Å; D9-R13 WeakPolarHBondContact O-CG 3.24Å; D9-R13 PolarHBondContact O-N 3.04Å; D9-R13 PolarHBondContact O-NE 2.8Å
10	C	94.9	Very high	88.2	Confident	70 Å²	70	124.8 Å²	124.8	47%	0.473	60%	0.595	S	S	.	*	H	α-helix	trans	-67.6	-44.5	175.2	-76.5	0	0	0	0	111.8	R6 E7 M8 R13 R14	R6-C10 PolarHBondContact O-N 3.29Å; R6-C10 VanDerWaalsContact O-N 3.09Å; R6-C10 PolarHBondContact O-SG 2.85Å; R6-C10 VanDerWaalsContact O-SG 3.36Å; E7-C10 WeakPolarHBondContact O-CA 3.4Å; E7-C10 WeakPolarHBondContact O-CB 3.49Å; E7-C10 PolarHBondContact O-N 3.14Å; M8-C10 VanDerWaalsContact C-N 3.29Å; M8-C10 PolarHBondContact O-N 3.02Å; C10-R13 PolarHBondContact O-N 3.22Å; C10-R13 PolarHBondContact SG-NH2 3.13Å; C10-R14 WeakPolarHBondContact O-CB 3.09Å; C10-R14 PolarHBondContact O-N 2.99Å
11	Y	95	Very high	88.6	Confident	177 Å²	177	121.5 Å²	121.5	69%	0.694	59%	0.585	S	S	*	*	H	α-helix	trans	-61.9	-43.9	174.3	-70.6	-67.3	0	0	0	111.8	E7 M8 R14 L15	E7-Y11 WeakPolarHBondContact O-CD2 3.45Å; E7-Y11 PolarHBondContact O-N 3.4Å; M8-Y11 PolarHBondContact O-N 3.31Å; Y11-R14 PolarHBondContact O-N 2.75Å; Y11-L15 WeakPolarHBondContact O-CB 3.5Å; Y11-L15 PolarHBondContact O-N 3.33Å
12	L	96.2	Very high	90.6	Very high	116 Å²	116	117.9 Å²	117.9	61%	0.607	57%	0.567	S	S	*	*	H	α-helix	trans	-64.6	-41.9	178.7	-174.1	63.4	0	0	0	112.3	M8 R14 K16	M8-L12 WeakPolarHBondContact O-CB 3.47Å; M8-L12 PolarHBondContact O-N 3.22Å; L12-R14 VanDerWaalsContact C-N 3.34Å; L12-K16 WeakPolarHBondContact O-CB 3.41Å; L12-K16 PolarHBondContact O-N 3.26Å
13	R	96.9	Very high	92.2	Very high	145 Å²	145	118.2 Å²	118.2	55%	0.547	56%	0.56	S	S	.	*	H	α-helix	trans	-60.4	-43.1	172.5	-80.1	-175.7	-70.1	-93.9	-3.8	111.8	D9 C10 K16 Q17	D9-R13 WeakPolarHBondContact O-CB 3.48Å; D9-R13 WeakPolarHBondContact O-CG 3.24Å; D9-R13 PolarHBondContact O-N 3.04Å; D9-R13 PolarHBondContact O-NE 2.8Å; C10-R13 PolarHBondContact O-N 3.22Å; C10-R13 PolarHBondContact SG-NH2 3.13Å; R13-K16 PolarHBondContact O-N 3.29Å; R13-Q17 PolarHBondContact O-N 3.45Å
14	R	97.3	Very high	93.8	Very high	166 Å²	166	117.6 Å²	117.6	63%	0.626	56%	0.555	S	S	*	*	H	α-helix	trans	-67.2	-47.3	180	-177.9	161.6	-178.3	141.3	12.8	112.3	C10 Y11 L12 K16 Q17 E18	C10-R14 WeakPolarHBondContact O-CB 3.09Å; C10-R14 PolarHBondContact O-N 2.99Å; Y11-R14 PolarHBondContact O-N 2.75Å; L12-R14 VanDerWaalsContact C-N 3.34Å; R14-K16 VanDerWaalsContact C-N 3.28Å; R14-K16 PolarHBondContact O-N 2.75Å; R14-Q17 WeakPolarHBondContact O-CB 3.49Å; R14-Q17 PolarHBondContact O-N 3.28Å; R14-E18 HydrophobicContact CG-CG 4.47Å; R14-E18 IonicContact CZ-OE1 3.01Å; R14-E18 IonicContact NE-OE1 2.74Å; R14-E18 PolarHBondContact NE-OE1 2.91Å; R14-E18 IonicContact NH2-OE1 2.73Å; R14-E18 PolarHBondContact NH2-OE1 2.94Å; R14-E18 PolarHBondContact O-N 3.15Å
15	L	97.6	Very high	94.9	Very high	113 Å²	113	115.9 Å²	115.9	59%	0.592	55%	0.554	S	S	*	*	H	α-helix	trans	-58.8	-40.5	176.5	-176.4	66.9	0	0	0	111.5	Y11 E18 L19	Y11-L15 WeakPolarHBondContact O-CB 3.5Å; Y11-L15 PolarHBondContact O-N 3.33Å; L15-E18 PolarHBondContact O-N 3.01Å; L15-L19 WeakPolarHBondContact O-CB 3.44Å; L15-L19 PolarHBondContact O-N 3.5Å
16	K	97.8	Very high	95.7	Very high	147 Å²	147	114.3 Å²	114.3	64%	0.639	55%	0.549	S	S	*	.	H	α-helix	trans	-60.8	-43.5	173.4	-177.9	-178.2	175.8	-176	0	111.9	L12 R13 R14 L19 M20	L12-K16 WeakPolarHBondContact O-CB 3.41Å; L12-K16 PolarHBondContact O-N 3.26Å; R13-K16 PolarHBondContact O-N 3.29Å; R14-K16 VanDerWaalsContact C-N 3.28Å; R14-K16 PolarHBondContact O-N 2.75Å; K16-L19 PolarHBondContact O-N 3.03Å; K16-M20 VanDerWaalsContact O-CG 3.29Å; K16-M20 WeakPolarHBondContact O-CG 3.33Å; K16-M20 PolarHBondContact O-N 2.71Å
17	Q	97.9	Very high	96.2	Very high	121 Å²	121	109.3 Å²	109.3	57%	0.565	54%	0.535	S	S	*	.	H	α-helix	trans	-66	-41.3	178.8	-173.9	59.6	51.2	0	0	112.1	R13 R14 M20 S21	R13-Q17 PolarHBondContact O-N 3.45Å; R14-Q17 WeakPolarHBondContact O-CB 3.49Å; R14-Q17 PolarHBondContact O-N 3.28Å; Q17-M20 PolarHBondContact O-N 3.01Å; Q17-S21 WeakPolarHBondContact O-CB 3.29Å; Q17-S21 PolarHBondContact O-N 3.21Å
18	E	97.7	Very high	96.5	Very high	93 Å²	93	105.8 Å²	105.8	44%	0.435	53%	0.53	S	S	.	.	H	α-helix	trans	-66.4	-40.9	177.6	-72.3	172.5	-179.5	0	0	111.2	R14 L15 S21 M22	R14-E18 HydrophobicContact CG-CG 4.47Å; R14-E18 IonicContact CZ-OE1 3.01Å; R14-E18 IonicContact NE-OE1 2.74Å; R14-E18 PolarHBondContact NE-OE1 2.91Å; R14-E18 IonicContact NH2-OE1 2.73Å; R14-E18 PolarHBondContact NH2-OE1 2.94Å; R14-E18 PolarHBondContact O-N 3.15Å; L15-E18 PolarHBondContact O-N 3.01Å; E18-S21 PolarHBondContact O-N 2.99Å; E18-M22 WeakPolarHBondContact O-CB 3.28Å; E18-M22 PolarHBondContact O-N 2.96Å
19	L	97.8	Very high	96.8	Very high	117 Å²	117	104 Å²	104	61%	0.613	52%	0.522	S	S	*	.	H	α-helix	trans	-63.1	-42.5	174.3	-171.8	71	0	0	0	112.5	L15 K16 K23	L15-L19 WeakPolarHBondContact O-CB 3.44Å; L15-L19 PolarHBondContact O-N 3.5Å; K16-L19 PolarHBondContact O-N 3.03Å; L19-K23 WeakPolarHBondContact O-CB 3.26Å; L19-K23 PolarHBondContact O-N 3.4Å
20	M	96.9	Very high	97	Very high	83 Å²	83	105.3 Å²	105.3	41%	0.409	53%	0.526	S	S	.	.	H	α-helix	trans	-64.3	-46.4	175.9	-73.4	-63.6	-56.9	0	0	111.6	K16 Q17 M22 K23 E24	K16-M20 VanDerWaalsContact O-CG 3.29Å; K16-M20 WeakPolarHBondContact O-CG 3.33Å; K16-M20 PolarHBondContact O-N 2.71Å; Q17-M20 PolarHBondContact O-N 3.01Å; M20-M22 PolarHBondContact O-N 2.95Å; M20-K23 WeakPolarHBondContact O-CB 3.44Å; M20-K23 PolarHBondContact O-N 2.93Å; M20-E24 WeakPolarHBondContact O-CG 3.23Å; M20-E24 PolarHBondContact O-N 2.92Å
21	S	97.1	Very high	97.1	Very high	57 Å²	57	106.8 Å²	106.8	40%	0.399	53%	0.529	S	S	.	.	H	α-helix	trans	-62.1	-42.1	178.1	-179.9	0	0	0	0	112	Q17 E18 K23 E24 V25	Q17-S21 WeakPolarHBondContact O-CB 3.29Å; Q17-S21 PolarHBondContact O-N 3.21Å; E18-S21 PolarHBondContact O-N 2.99Å; S21-K23 VanDerWaalsContact C-N 3.31Å; S21-K23 PolarHBondContact O-N 3.17Å; S21-E24 PolarHBondContact O-N 3.35Å; S21-V25 WeakPolarHBondContact O-CG2 3.26Å; S21-V25 PolarHBondContact O-N 3.05Å
22	M	97.5	Very high	97.3	Very high	138 Å²	138	104.7 Å²	104.7	68%	0.68	53%	0.526	S	S	*	.	H	α-helix	trans	-68.4	-31.8	177.5	-161.8	174.5	74.5	0	0	112.1	E18 M20 G26	E18-M22 WeakPolarHBondContact O-CB 3.28Å; E18-M22 PolarHBondContact O-N 2.96Å; M20-M22 PolarHBondContact O-N 2.95Å; M22-G26 PolarHBondContact O-N 3.44Å
23	K	96.9	Very high	97.4	Very high	114 Å²	114	103.7 Å²	103.7	50%	0.496	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-50.1	170.3	-173	-160.5	176.6	-55.8	0	111.3	L19 M20 S21 V25 G26 D27	L19-K23 WeakPolarHBondContact O-CB 3.26Å; L19-K23 PolarHBondContact O-N 3.4Å; M20-K23 WeakPolarHBondContact O-CB 3.44Å; M20-K23 PolarHBondContact O-N 2.93Å; S21-K23 VanDerWaalsContact C-N 3.31Å; S21-K23 PolarHBondContact O-N 3.17Å; K23-V25 VanDerWaalsContact C-N 3.32Å; K23-V25 PolarHBondContact O-N 3.25Å; K23-G26 CarbonylContact O-C 3.54Å; K23-G26 WeakPolarHBondContact O-CA 3.38Å; K23-G26 PolarHBondContact O-N 3.09Å; K23-D27 IonicContact NZ-OD1 3.23Å; K23-D27 PolarHBondContact NZ-OD1 3.24Å; K23-D27 IonicContact NZ-OD2 2.8Å; K23-D27 PolarHBondContact NZ-OD2 3.23Å; K23-D27 VanDerWaalsContact O-CG 3.25Å; K23-D27 PolarHBondContact O-N 2.81Å
24	E	96.8	Very high	97.5	Very high	114 Å²	114	100 Å²	100	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-59.4	-41.4	-179.3	-72.1	165.3	-174.7	0	0	112	M20 S21 D27 G28	M20-E24 WeakPolarHBondContact O-CG 3.23Å; M20-E24 PolarHBondContact O-N 2.92Å; S21-E24 PolarHBondContact O-N 3.35Å; E24-D27 PolarHBondContact O-N 3.31Å; E24-G28 PolarHBondContact O-N 3.23Å; E24-G28 VanDerWaalsContact O-N 3.07Å
25	V	96.5	Very high	97.5	Very high	102 Å²	102	96.7 Å²	96.7	62%	0.618	51%	0.512	S	S	*	.	H	α-helix	trans	-64.9	-38.9	173.2	173.2	0	0	0	0	111.6	S21 K23 L29	S21-V25 WeakPolarHBondContact O-CG2 3.26Å; S21-V25 PolarHBondContact O-N 3.05Å; K23-V25 VanDerWaalsContact C-N 3.32Å; K23-V25 PolarHBondContact O-N 3.25Å; V25-L29 PolarHBondContact O-N 3.32Å
26	G	96.6	Very high	97.5	Very high	37 Å²	37	96.8 Å²	96.8	38%	0.381	51%	0.511	S	S	.	.	H	α-helix	trans	-65.9	-42.6	175.6	0	0	0	0	0	113.5	M22 K23 L29 Q30	M22-G26 PolarHBondContact O-N 3.44Å; K23-G26 CarbonylContact O-C 3.54Å; K23-G26 WeakPolarHBondContact O-CA 3.38Å; K23-G26 PolarHBondContact O-N 3.09Å; G26-L29 PolarHBondContact O-N 3.4Å; G26-Q30 PolarHBondContact O-N 3.08Å
27	D	96.7	Very high	97.5	Very high	69 Å²	69	94.2 Å²	94.2	37%	0.369	50%	0.502	S	S	.	.	H	α-helix	trans	-61	-46.9	175.4	-60	-36	0	0	0	110.1	K23 E24 L29 Q30 D31	K23-D27 IonicContact NZ-OD1 3.23Å; K23-D27 PolarHBondContact NZ-OD1 3.24Å; K23-D27 IonicContact NZ-OD2 2.8Å; K23-D27 PolarHBondContact NZ-OD2 3.23Å; K23-D27 VanDerWaalsContact O-CG 3.25Å; K23-D27 PolarHBondContact O-N 2.81Å; E24-D27 PolarHBondContact O-N 3.31Å; D27-L29 VanDerWaalsContact C-N 3.34Å; D27-L29 PolarHBondContact O-N 2.85Å; D27-Q30 WeakPolarHBondContact O-CB 3.47Å; D27-Q30 PolarHBondContact O-N 3.14Å; D27-Q30 VanDerWaalsContact O-N 3.12Å; D27-D31 PolarHBondContact O-N 2.99Å
28	G	96.9	Very high	97.5	Very high	42 Å²	42	89.6 Å²	89.6	43%	0.433	49%	0.487	S	S	.	.	H	α-helix	trans	-63.2	-35.6	178.1	0	0	0	0	0	114	E24 Q32	E24-G28 PolarHBondContact O-N 3.23Å; E24-G28 VanDerWaalsContact O-N 3.07Å; G28-Q32 WeakPolarHBondContact O-CB 3.15Å; G28-Q32 PolarHBondContact O-N 3.31Å
29	L	98.2	Very high	97.6	Very high	94 Å²	94	87.7 Å²	87.7	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-67.5	-40.5	171.9	178.3	62.7	0	0	0	111.7	V25 G26 D27 Q32 M33	V25-L29 PolarHBondContact O-N 3.32Å; G26-L29 PolarHBondContact O-N 3.4Å; D27-L29 VanDerWaalsContact C-N 3.34Å; D27-L29 PolarHBondContact O-N 2.85Å; L29-Q32 PolarHBondContact O-N 3.39Å; L29-M33 HydrophobicContact CD1-CG 4.47Å; L29-M33 HydrophobicContact CG-SD 4.35Å; L29-M33 WeakPolarHBondContact O-CG 3.39Å; L29-M33 PolarHBondContact O-N 3.35Å
30	Q	98	Very high	97.6	Very high	97 Å²	97	87.1 Å²	87.1	45%	0.453	48%	0.484	S	S	.	.	H	α-helix	trans	-63	-42.3	177.1	-177.6	61.5	65.1	0	0	111.5	G26 D27 M33 N34	G26-Q30 PolarHBondContact O-N 3.08Å; D27-Q30 WeakPolarHBondContact O-CB 3.47Å; D27-Q30 PolarHBondContact O-N 3.14Å; D27-Q30 VanDerWaalsContact O-N 3.12Å; Q30-M33 PolarHBondContact O-N 2.8Å; Q30-N34 PolarHBondContact NE2-OD1 3.37Å; Q30-N34 WeakPolarHBondContact O-CB 3.3Å; Q30-N34 PolarHBondContact O-N 2.94Å; Q30-N34 PolarHBondContact O-ND2 2.94Å
31	D	97.8	Very high	97.6	Very high	100 Å²	100	89.1 Å²	89.1	54%	0.535	49%	0.492	S	S	.	.	H	α-helix	trans	-63.3	-43.3	174.2	-74.4	-20.3	0	0	0	111.5	D27 M33 N34 C35	D27-D31 PolarHBondContact O-N 2.99Å; D31-M33 PolarHBondContact O-N 3.49Å; D31-N34 PolarHBondContact O-N 2.82Å; D31-C35 PolarHBondContact O-N 3.2Å; D31-C35 PolarHBondContact O-SG 3.32Å; D31-C35 VanDerWaalsContact O-SG 3.39Å
32	Q	98.4	Very high	97.6	Very high	134 Å²	134	92.7 Å²	92.7	63%	0.626	50%	0.503	S	S	*	.	H	α-helix	trans	-59.2	-44.3	174.3	-173.2	-176.7	19.1	0	0	112.1	G28 L29 N34 C35 M36	G28-Q32 WeakPolarHBondContact O-CB 3.15Å; G28-Q32 PolarHBondContact O-N 3.31Å; L29-Q32 PolarHBondContact O-N 3.39Å; Q32-N34 VanDerWaalsContact C-N 3.34Å; Q32-C35 PolarHBondContact O-N 3.2Å; Q32-M36 WeakPolarHBondContact O-CB 3.39Å; Q32-M36 PolarHBondContact O-N 3.36Å
33	M	98.3	Very high	97.6	Very high	94 Å²	94	91.4 Å²	91.4	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-63	-40.4	176.3	-73.8	178.5	61.7	0	0	111.8	L29 Q30 D31 M36 M37	L29-M33 HydrophobicContact CD1-CG 4.47Å; L29-M33 HydrophobicContact CG-SD 4.35Å; L29-M33 WeakPolarHBondContact O-CG 3.39Å; L29-M33 PolarHBondContact O-N 3.35Å; Q30-M33 PolarHBondContact O-N 2.8Å; D31-M33 PolarHBondContact O-N 3.49Å; M33-M36 PolarHBondContact O-N 3.41Å; M33-M37 VanDerWaalsContact O-CB 3.24Å; M33-M37 WeakPolarHBondContact O-CB 3.37Å; M33-M37 PolarHBondContact O-N 3.13Å
34	N	98.1	Very high	97.7	Very high	67 Å²	67	92.8 Å²	92.8	36%	0.358	50%	0.504	S	S	.	.	H	α-helix	trans	-64.3	-44.8	176.5	-68.6	-22.8	0	0	0	111.5	Q30 D31 Q32 M37 G38	Q30-N34 PolarHBondContact NE2-OD1 3.37Å; Q30-N34 WeakPolarHBondContact O-CB 3.3Å; Q30-N34 PolarHBondContact O-N 2.94Å; Q30-N34 PolarHBondContact O-ND2 2.94Å; D31-N34 PolarHBondContact O-N 2.82Å; Q32-N34 VanDerWaalsContact C-N 3.34Å; N34-M37 PolarHBondContact O-N 3.19Å; N34-G38 PolarHBondContact O-N 2.78Å
35	C	98.1	Very high	97.7	Very high	97 Å²	97	92.1 Å²	92.1	66%	0.655	50%	0.504	S	S	*	.	H	α-helix	trans	-61.7	-44.6	175.2	-70.3	0	0	0	0	112.4	D31 Q32 M37 G38 A39	D31-C35 PolarHBondContact O-N 3.2Å; D31-C35 PolarHBondContact O-SG 3.32Å; D31-C35 VanDerWaalsContact O-SG 3.39Å; Q32-C35 PolarHBondContact O-N 3.2Å; C35-M37 VanDerWaalsContact C-N 3.34Å; C35-M37 PolarHBondContact O-N 3.2Å; C35-G38 PolarHBondContact O-N 3.37Å; C35-A39 PolarHBondContact O-N 2.87Å
36	M	98.4	Very high	97.7	Very high	116 Å²	116	91.9 Å²	91.9	57%	0.571	50%	0.498	S	S	*	.	H	α-helix	trans	-63	-41	176.2	-178.3	176.6	64.9	0	0	111.7	Q32 M33 A39 L40	Q32-M36 WeakPolarHBondContact O-CB 3.39Å; Q32-M36 PolarHBondContact O-N 3.36Å; M33-M36 PolarHBondContact O-N 3.41Å; M36-A39 PolarHBondContact O-N 2.95Å; M36-L40 HydrophobicContact CG-CD1 4.27Å; M36-L40 VanDerWaalsContact O-CG 3.31Å; M36-L40 WeakPolarHBondContact O-CG 3.39Å; M36-L40 PolarHBondContact O-N 2.87Å
37	M	98.1	Very high	97.7	Very high	92 Å²	92	96.9 Å²	96.9	45%	0.453	51%	0.512	S	S	.	.	H	α-helix	trans	-64.1	-39.9	176.8	179.2	-98.3	-68.8	0	0	111.9	M33 N34 C35 L40 Q41	M33-M37 VanDerWaalsContact O-CB 3.24Å; M33-M37 WeakPolarHBondContact O-CB 3.37Å; M33-M37 PolarHBondContact O-N 3.13Å; N34-M37 PolarHBondContact O-N 3.19Å; C35-M37 VanDerWaalsContact C-N 3.34Å; C35-M37 PolarHBondContact O-N 3.2Å; M37-L40 PolarHBondContact O-N 3.49Å; M37-Q41 WeakPolarHBondContact O-CG 3.32Å; M37-Q41 PolarHBondContact O-N 2.88Å; M37-Q41 VanDerWaalsContact O-N 3.11Å; M37-Q41 PolarHBondContact SD-NE2 3Å
38	G	97.9	Very high	97.6	Very high	24 Å²	24	97.2 Å²	97.2	25%	0.247	52%	0.516	C	S	.	.	H	α-helix	trans	-60.6	-50	171.2	0	0	0	0	0	112.7	N34 C35 L40 Q41 E42	N34-G38 PolarHBondContact O-N 2.78Å; C35-G38 PolarHBondContact O-N 3.37Å; G38-L40 VanDerWaalsContact C-N 3.29Å; G38-L40 PolarHBondContact O-N 2.96Å; G38-Q41 WeakPolarHBondContact O-CA 3.31Å; G38-Q41 WeakPolarHBondContact O-CB 3.48Å; G38-Q41 PolarHBondContact O-N 2.99Å; G38-E42 PolarHBondContact O-N 3.24Å
39	A	98.1	Very high	97.5	Very high	53 Å²	53	100 Å²	100	44%	0.438	52%	0.518	S	S	.	.	H	α-helix	trans	-60.1	-36.3	178.1	0	0	0	0	0	113	C35 M36 E42 L43	C35-A39 PolarHBondContact O-N 2.87Å; M36-A39 PolarHBondContact O-N 2.95Å; A39-E42 PolarHBondContact O-N 3.31Å; A39-L43 WeakPolarHBondContact O-CB 3.29Å; A39-L43 PolarHBondContact O-N 3.41Å
40	L	98.4	Very high	97.3	Very high	106 Å²	106	98.5 Å²	98.5	56%	0.555	51%	0.513	S	S	*	.	H	α-helix	trans	-67.7	-33.4	173.7	-71.6	170.8	0	0	0	112.7	M36 M37 G38 K44	M36-L40 HydrophobicContact CG-CD1 4.27Å; M36-L40 VanDerWaalsContact O-CG 3.31Å; M36-L40 WeakPolarHBondContact O-CG 3.39Å; M36-L40 PolarHBondContact O-N 2.87Å; M37-L40 PolarHBondContact O-N 3.49Å; G38-L40 VanDerWaalsContact C-N 3.29Å; G38-L40 PolarHBondContact O-N 2.96Å; L40-K44 WeakPolarHBondContact O-CB 3.44Å; L40-K44 PolarHBondContact O-N 2.94Å; L40-K44 VanDerWaalsContact O-N 3.1Å
41	Q	98	Very high	97	Very high	124 Å²	124	96.5 Å²	96.5	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-70	-43.6	173.5	-70.8	176.7	7.8	0	0	111.8	M37 G38 K44 L45	M37-Q41 WeakPolarHBondContact O-CG 3.32Å; M37-Q41 PolarHBondContact O-N 2.88Å; M37-Q41 VanDerWaalsContact O-N 3.11Å; M37-Q41 PolarHBondContact SD-NE2 3Å; G38-Q41 WeakPolarHBondContact O-CA 3.31Å; G38-Q41 WeakPolarHBondContact O-CB 3.48Å; G38-Q41 PolarHBondContact O-N 2.99Å; Q41-K44 PolarHBondContact O-N 3.47Å; Q41-L45 PolarHBondContact O-N 2.92Å
42	E	97.1	Very high	96.7	Very high	132 Å²	132	96.4 Å²	96.4	62%	0.617	51%	0.512	S	S	*	.	H	α-helix	trans	-60.9	-45.2	174.6	-70.7	178.5	-175.5	0	0	111.6	G38 A39 K44 L45 L46	G38-E42 PolarHBondContact O-N 3.24Å; A39-E42 PolarHBondContact O-N 3.31Å; E42-K44 VanDerWaalsContact C-N 3.32Å; E42-K44 PolarHBondContact O-N 3.33Å; E42-L45 WeakPolarHBondContact O-CB 3.48Å; E42-L45 PolarHBondContact O-N 3.43Å; E42-L45 VanDerWaalsContact O-N 3.16Å; E42-L46 WeakPolarHBondContact O-CG 3.44Å; E42-L46 PolarHBondContact O-N 2.94Å
43	L	97.6	Very high	96.3	Very high	112 Å²	112	95.5 Å²	95.5	59%	0.586	51%	0.508	S	S	*	.	H	α-helix	trans	-60.5	-41	176.3	-174	67.8	0	0	0	111.9	A39 L46 Q47	A39-L43 WeakPolarHBondContact O-CB 3.29Å; A39-L43 PolarHBondContact O-N 3.41Å; L43-L46 PolarHBondContact O-N 2.72Å; L43-Q47 WeakPolarHBondContact O-CB 3.17Å; L43-Q47 PolarHBondContact O-N 3.46Å
44	K	97.1	Very high	95.9	Very high	143 Å²	143	97.2 Å²	97.2	62%	0.622	51%	0.514	S	S	*	.	H	α-helix	trans	-65.9	-38.8	175.3	-175.4	178.1	179.6	179.9	0	112	L40 Q41 E42 Q47 V48	L40-K44 WeakPolarHBondContact O-CB 3.44Å; L40-K44 PolarHBondContact O-N 2.94Å; L40-K44 VanDerWaalsContact O-N 3.1Å; Q41-K44 PolarHBondContact O-N 3.47Å; E42-K44 VanDerWaalsContact C-N 3.32Å; E42-K44 PolarHBondContact O-N 3.33Å; K44-Q47 PolarHBondContact O-N 2.68Å; K44-V48 WeakPolarHBondContact O-CG2 3.46Å; K44-V48 PolarHBondContact O-N 3.05Å
45	L	97.3	Very high	95.1	Very high	100 Å²	100	99.9 Å²	99.9	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-64	-46.4	175.7	-179.7	62.1	0	0	0	111	Q41 E42 Q47 V48 Q49	Q41-L45 PolarHBondContact O-N 2.92Å; E42-L45 WeakPolarHBondContact O-CB 3.48Å; E42-L45 PolarHBondContact O-N 3.43Å; E42-L45 VanDerWaalsContact O-N 3.16Å; L45-Q47 PolarHBondContact O-N 2.99Å; L45-V48 PolarHBondContact O-N 3.29Å; L45-Q49 WeakPolarHBondContact O-CG 3.26Å; L45-Q49 PolarHBondContact O-N 2.97Å
46	L	96.6	Very high	93.9	Very high	97 Å²	97	102.7 Å²	102.7	51%	0.508	53%	0.531	S	S	.	.	H	α-helix	trans	-59	-45.3	174.5	-75.1	166.1	0	0	0	111.5	E42 L43 V48 Q49 T50	E42-L46 WeakPolarHBondContact O-CG 3.44Å; E42-L46 PolarHBondContact O-N 2.94Å; L43-L46 PolarHBondContact O-N 2.72Å; L46-V48 VanDerWaalsContact C-N 3.31Å; L46-V48 PolarHBondContact O-N 3.27Å; L46-Q49 PolarHBondContact O-N 3.32Å; L46-T50 PolarHBondContact O-N 3.01Å; L46-T50 PolarHBondContact O-OG1 2.67Å; L46-T50 VanDerWaalsContact O-OG1 3.13Å
47	Q	96.3	Very high	92.3	Very high	141 Å²	141	102.9 Å²	102.9	66%	0.659	53%	0.534	S	S	*	.	H	α-helix	trans	-58.8	-41.2	176.8	-172.9	-177.4	11.8	0	0	112.3	L43 K44 L45 A51	L43-Q47 WeakPolarHBondContact O-CB 3.17Å; L43-Q47 PolarHBondContact O-N 3.46Å; K44-Q47 PolarHBondContact O-N 2.68Å; L45-Q47 PolarHBondContact O-N 2.99Å; Q47-A51 WeakPolarHBondContact O-CB 3.38Å; Q47-A51 PolarHBondContact O-N 2.9Å
48	V	95.4	Very high	90.5	Very high	76 Å²	76	103.4 Å²	103.4	46%	0.461	55%	0.546	S	S	.	.	H	α-helix	trans	-67.4	-42.5	175.7	170.9	0	0	0	0	111.2	K44 L45 L46 A51 L52	K44-V48 WeakPolarHBondContact O-CG2 3.46Å; K44-V48 PolarHBondContact O-N 3.05Å; L45-V48 PolarHBondContact O-N 3.29Å; L46-V48 VanDerWaalsContact C-N 3.31Å; L46-V48 PolarHBondContact O-N 3.27Å; V48-A51 PolarHBondContact O-N 3.36Å; V48-L52 HydrophobicContact CG1-CD1 4.16Å; V48-L52 WeakPolarHBondContact O-CG 3.47Å; V48-L52 PolarHBondContact O-N 2.9Å
49	Q	95.1	Very high	88.4	Confident	100 Å²	100	105.5 Å²	105.5	47%	0.467	57%	0.568	S	S	.	*	H	α-helix	trans	-60.6	-48.5	176.3	-73.6	172.1	-16.1	0	0	111.5	L45 L46 A51 L52 E53	L45-Q49 WeakPolarHBondContact O-CG 3.26Å; L45-Q49 PolarHBondContact O-N 2.97Å; L46-Q49 PolarHBondContact O-N 3.32Å; Q49-A51 VanDerWaalsContact C-N 3.33Å; Q49-A51 PolarHBondContact O-N 3.5Å; Q49-L52 PolarHBondContact O-N 3.16Å; Q49-E53 PolarHBondContact O-N 3.01Å
50	T	93.9	Very high	86.4	Confident	64 Å²	64	105.9 Å²	105.9	39%	0.393	58%	0.577	S	S	.	*	H	α-helix	trans	-63	-36.4	176.3	-57.3	0	0	0	0	112.4	L46 E53 Q54	L46-T50 PolarHBondContact O-N 3.01Å; L46-T50 PolarHBondContact O-OG1 2.67Å; L46-T50 VanDerWaalsContact O-OG1 3.13Å; T50-E53 PolarHBondContact O-N 2.82Å; T50-Q54 WeakPolarHBondContact O-CB 3.46Å; T50-Q54 VanDerWaalsContact O-CG 3.29Å; T50-Q54 WeakPolarHBondContact O-CG 3.38Å; T50-Q54 PolarHBondContact O-N 2.9Å
51	A	91.5	Very high	84	Confident	54 Å²	54	104 Å²	104	45%	0.446	58%	0.584	S	S	.	*	H	α-helix	trans	-67.5	-36.6	176.2	0	0	0	0	0	112.6	Q47 V48 Q49 L55	Q47-A51 WeakPolarHBondContact O-CB 3.38Å; Q47-A51 PolarHBondContact O-N 2.9Å; V48-A51 PolarHBondContact O-N 3.36Å; Q49-A51 VanDerWaalsContact C-N 3.33Å; Q49-A51 PolarHBondContact O-N 3.5Å; A51-L55 PolarHBondContact O-N 3.29Å; A51-L55 VanDerWaalsContact O-N 3.14Å
52	L	91.6	Very high	81.9	Confident	98 Å²	98	104 Å²	104	51%	0.513	59%	0.594	S	S	.	*	H	α-helix	trans	-68.2	-44.8	173.3	-70.2	170.3	0	0	0	111.4	V48 Q49 Q54 L55 E56	V48-L52 HydrophobicContact CG1-CD1 4.16Å; V48-L52 WeakPolarHBondContact O-CG 3.47Å; V48-L52 PolarHBondContact O-N 2.9Å; Q49-L52 PolarHBondContact O-N 3.16Å; L52-Q54 PolarHBondContact O-N 2.84Å; L52-L55 WeakPolarHBondContact O-CB 3.4Å; L52-L55 PolarHBondContact O-N 3.4Å; L52-L55 VanDerWaalsContact O-N 3.08Å; L52-E56 PolarHBondContact O-N 3.06Å
53	E	90.6	Very high	79.4	Confident	116 Å²	116	102.4 Å²	102.4	54%	0.542	60%	0.603	S	S	.	*	H	α-helix	trans	-59.3	-43.6	175.9	-174.5	179.1	-167.1	0	0	111.8	Q49 T50 L55 E56 I57	Q49-E53 PolarHBondContact O-N 3.01Å; T50-E53 PolarHBondContact O-N 2.82Å; E53-L55 VanDerWaalsContact C-N 3.3Å; E53-L55 PolarHBondContact O-N 3.24Å; E53-E56 PolarHBondContact O-N 3.36Å; E53-I57 HydrophobicContact CG-CD1 3.97Å; E53-I57 WeakPolarHBondContact O-CD1 3.15Å; E53-I57 VanDerWaalsContact O-CG1 3.26Å; E53-I57 WeakPolarHBondContact O-CG1 3.4Å; E53-I57 PolarHBondContact O-N 3.32Å
54	Q	89.9	Confident	77.2	Confident	129 Å²	129	103.5 Å²	103.5	60%	0.603	62%	0.617	S	S	*	*	H	α-helix	trans	-61.6	-36	173.8	-75.2	178.2	15.7	0	0	112.8	T50 L52 S58	T50-Q54 WeakPolarHBondContact O-CB 3.46Å; T50-Q54 VanDerWaalsContact O-CG 3.29Å; T50-Q54 WeakPolarHBondContact O-CG 3.38Å; T50-Q54 PolarHBondContact O-N 2.9Å; L52-Q54 PolarHBondContact O-N 2.84Å; Q54-S58 VanDerWaalsContact O-CB 3.26Å; Q54-S58 WeakPolarHBondContact O-CB 3.23Å; Q54-S58 PolarHBondContact O-N 3.1Å
55	L	80.3	Confident	74.4	Confident	123 Å²	123	100.1 Å²	100.1	64%	0.644	62%	0.623	S	S	*	*	H	α-helix	trans	-70.9	-41	177.1	-173.9	64.8	0	0	0	111.9	A51 L52 E53 S58 G59	A51-L55 PolarHBondContact O-N 3.29Å; A51-L55 VanDerWaalsContact O-N 3.14Å; L52-L55 WeakPolarHBondContact O-CB 3.4Å; L52-L55 PolarHBondContact O-N 3.4Å; L52-L55 VanDerWaalsContact O-N 3.08Å; E53-L55 VanDerWaalsContact C-N 3.3Å; E53-L55 PolarHBondContact O-N 3.24Å; L55-S58 PolarHBondContact O-N 3.43Å; L55-G59 PolarHBondContact O-N 2.91Å
56	E	73.4	Confident	71.5	Confident	156 Å²	156	101.3 Å²	101.3	73%	0.729	64%	0.639	S	S	*	*	H	α-helix	trans	-63.6	-42.4	175.4	-71.7	-175.9	176.4	0	0	111.5	L52 E53 G59	L52-E56 PolarHBondContact O-N 3.06Å; E53-E56 PolarHBondContact O-N 3.36Å; E56-G59 PolarHBondContact O-N 3.46Å
57	I	63.8	Low	69.6	Low	121 Å²	121	101.8 Å²	101.8	62%	0.621	65%	0.649	S	S	*	*	H	α-helix	trans	-65.1	-40.9	174.4	-65.2	164.6	0	0	0	111	E53 G59 G60	E53-I57 HydrophobicContact CG-CD1 3.97Å; E53-I57 WeakPolarHBondContact O-CD1 3.15Å; E53-I57 VanDerWaalsContact O-CG1 3.26Å; E53-I57 WeakPolarHBondContact O-CG1 3.4Å; E53-I57 PolarHBondContact O-N 3.32Å; I57-G59 VanDerWaalsContact C-N 3.27Å; I57-G59 PolarHBondContact O-N 2.9Å; I57-G60 PolarHBondContact O-N 3.49Å
58	S	60.1	Low	66.7	Low	102 Å²	102	104.1 Å²	104.1	71%	0.713	66%	0.659	S	S	*	*	H	α-helix	trans	-72	-15.9	178.2	-170.8	0	0	0	0	114.2	Q54 L55	Q54-S58 VanDerWaalsContact O-CB 3.26Å; Q54-S58 WeakPolarHBondContact O-CB 3.23Å; Q54-S58 PolarHBondContact O-N 3.1Å; L55-S58 PolarHBondContact O-N 3.43Å
59	G	54.3	Low	63.7	Low	69 Å²	69	103.8 Å²	103.8	71%	0.711	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-12	174.7	0	0	0	0	0	114.6	L55 E56 I57	L55-G59 PolarHBondContact O-N 2.91Å; E56-G59 PolarHBondContact O-N 3.46Å; I57-G59 VanDerWaalsContact C-N 3.27Å; I57-G59 PolarHBondContact O-N 2.9Å
60	G	56	Low	61.3	Low	60 Å²	60	105.1 Å²	105.1	62%	0.619	69%	0.689	S	S	*	*			trans	-102.5	49.5	-170	0	0	0	0	0	115.9	I57	I57-G60 PolarHBondContact O-N 3.49Å
61	G	48.3	Very low	58.9	Low	68 Å²	68	114.1 Å²	114.1	70%	0.701	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-79.4	128.1	173.6	0	0	0	0	0	112.7
62	P	53.4	Low	56.2	Low	124 Å²	124	118.3 Å²	118.3	81%	0.805	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-77.2	132.8	-174.1	30.2	-34.8	0	0	0	112.9	P64	P62-P64 WeakPolarHBondContact O-CD 3.31Å
63	A	45.1	Very low	53.4	Low	97 Å²	97	121 Å²	121	80%	0.802	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-76.7	123.3	167.3	0	0	0	0	0	110.3	G65	A63-G65 PolarHBondContact O-N 2.91Å
64	P	52.1	Low	50.7	Low	136 Å²	136	127.2 Å²	127.2	88%	0.883	76%	0.764	S	S	*	*			trans	-82.2	110.7	178.9	30.9	-31.6	0	0	0	110.7	P62	P62-P64 WeakPolarHBondContact O-CD 3.31Å
65	G	37.7	Very low	47.9	Very low	71 Å²	71	128.1 Å²	128.1	73%	0.732	77%	0.768	S	S	*	*			trans	-169.3	63.3	-173.4	0	0	0	0	0	118	A63	A63-G65 PolarHBondContact O-N 2.91Å
66	S	35.9	Very low	45.7	Very low	125 Å²	125	130.8 Å²	130.8	87%	0.874	78%	0.777	S	S	*	*			trans	70.2	163.1	160.2	-96.6	0	0	0	0	119.8
67	P	56	Low	44.4	Very low	108 Å²	108	128.8 Å²	128.8	70%	0.701	78%	0.778	S	S	*	*			trans	-105.5	-176.3	-154.7	42.1	-38.2	0	0	0	115.9
68	E	37	Very low	43.1	Very low	189 Å²	189	128.9 Å²	128.9	88%	0.883	79%	0.788	S	S	*	*			trans	82.6	116.3	163.9	-129	70.9	-165.7	0	0	118.1
69	G	32.8	Very low	41.7	Very low	70 Å²	70	135.3 Å²	135.3	72%	0.722	80%	0.796	S	S	*	*			trans	162.8	122	171.2	0	0	0	0	0	113.3
70	P	44.3	Very low	40.7	Very low	127 Å²	127	141 Å²	141	83%	0.825	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-81.5	151.8	-163.3	31.2	-36.1	0	0	0	115.2	T72	P70-T72 PolarHBondContact O-N 3.16Å
71	R	42.2	Very low	39.7	Very low	254 Å²	254	141.7 Å²	141.7	96%	0.958	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-59.4	121.7	173.8	-69	-179.5	170.9	-137.9	-1.4	112
72	T	35.4	Very low	39.3	Very low	141 Å²	141	142 Å²	142	87%	0.865	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-89.4	129	158.5	-43.2	0	0	0	0	109.3	P70	P70-T72 PolarHBondContact O-N 3.16Å
73	Q	33.7	Very low	38.4	Very low	155 Å²	155	148 Å²	148	72%	0.724	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-59.9	152.7	173.7	-66.1	170.5	-27.3	0	0	111.7
74	R	32.1	Very low	37.9	Very low	247 Å²	247	146.9 Å²	146.9	93%	0.932	82%	0.819	S	S	*	*			trans	-120.2	108.9	145.4	-161.1	174.9	-169.6	170.5	3	106.7
75	E	31.7	Very low	38.3	Very low	147 Å²	147	146.7 Å²	146.7	69%	0.687	82%	0.817	S	S	*	*			trans	-68.2	144.2	-174.5	-67	-162.3	118.3	0	0	112.6
76	H	34.5	Very low	38	Very low	179 Å²	179	148.2 Å²	148.2	83%	0.829	82%	0.824	S	S	*	*			trans	-128.6	136.3	144.4	-94.6	-104.1	0	0	0	106.7	C78	H76-C78 PolarHBondContact O-N 2.92Å
77	P	46.4	Very low	38	Very low	115 Å²	115	154 Å²	154	75%	0.747	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-73.8	121.7	-160.6	-18.3	32.6	0	0	0	113.4
78	C	36.3	Very low	37.4	Very low	122 Å²	122	154.1 Å²	154.1	82%	0.824	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-81.6	126.7	159.8	-170.5	0	0	0	0	108.4	H76	H76-C78 PolarHBondContact O-N 2.92Å
79	W	29.6	Very low	37.1	Very low	238 Å²	238	150.8 Å²	150.8	90%	0.902	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-93.9	128.4	175	33.1	-92.2	0	0	0	109.8
80	E	34.5	Very low	37	Very low	189 Å²	189	153.5 Å²	153.5	88%	0.883	82%	0.822	S	S	*	*			trans	-126.1	144.7	-165.9	-175.7	169.1	-140.6	0	0	113.1
81	G	35.7	Very low	36.2	Very low	73 Å²	73	153.2 Å²	153.2	75%	0.753	82%	0.821	S	S	*	*			trans	83.3	83.7	139.6	0	0	0	0	0	119.3
82	G	39.6	Very low	36	Very low	76 Å²	76	146.7 Å²	146.7	78%	0.784	82%	0.815	S	S	*	*			trans	-74	-178.4	180	0	0	0	0	0	119.4
83	R	34.8	Very low	36.6	Very low	250 Å²	250	145.7 Å²	145.7	94%	0.943	81%	0.811	S	S	*	*			trans	-156.1	140.2	153.3	-96.2	-161.5	-75.3	-86.6	6.8	109.2
84	G	34.1	Very low	36.6	Very low	72 Å²	72	144.1 Å²	144.1	74%	0.742	82%	0.817	S	S	*	*			trans	-104.3	-158.2	169.7	0	0	0	0	0	111.7
85	P	60.3	Low	36.6	Very low	132 Å²	132	136 Å²	136	86%	0.857	81%	0.811	S	S	*	*			cis	-130.4	158.7	-9.3	40.2	-25.7	0	0	0	114.6
86	A	31.5	Very low	37	Very low	104 Å²	104	137.1 Å²	137.1	86%	0.86	82%	0.815	S	S	*	*			trans	-163.5	136.6	157.4	0	0	0	0	0	113.5
87	R	36.5	Very low	37.1	Very low	246 Å²	246	135 Å²	135	93%	0.928	82%	0.818	S	S	*	*			trans	-94.4	166.3	157.8	-95.7	-175.2	176.1	-137.6	0.3	107.9
88	P	42.6	Very low	36.5	Very low	111 Å²	111	133.2 Å²	133.2	72%	0.721	81%	0.808	S	S	*	*			cis	-149	-173.6	33.9	42.3	-20.8	0	0	0	118.3
89	T	29.6	Very low	36.3	Very low	118 Å²	118	135.7 Å²	135.7	72%	0.724	81%	0.812	S	S	*	*			trans	90.9	97.8	147.1	-54.8	0	0	0	0	120.9
90	V	31.1	Very low	36.3	Very low	127 Å²	127	128 Å²	128	77%	0.77	81%	0.807	S	S	*	*				49.4	118.5	127.5	-173.4	0	0	0	0	120.1
91	C	27.3	Very low	36.2	Very low	121 Å²	121	124.6 Å²	124.6	82%	0.818	80%	0.804	S	S	*	*				-173.4	122.9	115.5	-106.2	0	0	0	0	112.5
92	S	37.6	Very low	36.1	Very low	118 Å²	118	125.6 Å²	125.6	83%	0.825	80%	0.799	S	S	*	*			trans	-108.5	140.6	162.3	-59.5	0	0	0	0	108.9
93	P	48.1	Very low	35.8	Very low	119 Å²	119	128.3 Å²	128.3	77%	0.773	80%	0.801	S	S	*	*				-138.3	143.5	121.1	31.4	-16.8	0	0	0	110.6
94	S	34.3	Very low	35.8	Very low	123 Å²	123	125.8 Å²	125.8	86%	0.86	80%	0.797	S	S	*	*			cis	61.6	90.6	36.2	-158.8	0	0	0	0	114.4
95	G	32.1	Very low	36	Very low	77 Å²	77	132.4 Å²	132.4	79%	0.794	81%	0.805	S	S	*	*			trans	-159.4	108.6	171.7	0	0	0	0	0	110.8
96	Q	40.8	Very low	35.5	Very low	169 Å²	169	132.2 Å²	132.2	79%	0.79	80%	0.804	S	S	*	*			trans	-76.2	170	170.6	-59.4	-174.7	-87.4	0	0	110.7
97	P	37.1	Very low	35.7	Very low	135 Å²	135	132.8 Å²	132.8	88%	0.877	80%	0.802	S	S	*	*				-129.8	165.1	106.3	36.2	-29.8	0	0	0	113.9
98	S	33.5	Very low	35.6	Very low	78 Å²	78	129.2 Å²	129.2	55%	0.545	80%	0.795	S	S	.	*			trans	-135.9	160.8	-170.5	48.2	0	0	0	0	111.8
99	L	32.5	Very low	35.2	Very low	174 Å²	174	134.1 Å²	134.1	91%	0.911	80%	0.799	S	S	*	*			trans	65.5	140	-179.6	-55.1	106.3	0	0	0	115.6
100	G	28.1	Very low	35.4	Very low	76 Å²	76	134.2 Å²	134.2	78%	0.784	81%	0.805	S	S	*	*			cis	-172.2	146.8	-8.1	0	0	0	0	0	107.9
101	S	33	Very low	35.6	Very low	117 Å²	117	133.9 Å²	133.9	82%	0.818	80%	0.803	S	S	*	*				167.7	113.7	92.7	-177.5	0	0	0	0	106.7
102	S	33.3	Very low	35.9	Very low	94 Å²	94	134.6 Å²	134.6	66%	0.657	81%	0.808	S	S	*	*				65.9	103.1	94.8	-165.5	0	0	0	0	116.8
103	T	32.9	Very low	35.6	Very low	134 Å²	134	132.2 Å²	132.2	82%	0.822	80%	0.802	S	S	*	*				168.6	89	129.3	30	0	0	0	0	109
104	K	34.8	Very low	34.9	Very low	197 Å²	197	138.2 Å²	138.2	86%	0.857	81%	0.809	S	S	*	*				54.5	102	94	-77.1	-168.6	174.6	-178	0	115.7
105	F	39.3	Very low	35.1	Very low	210 Å²	210	139 Å²	139	92%	0.921	80%	0.804	S	S	*	*			trans	-60.6	145.5	160.8	-56.7	-89.9	0	0	0	112.2
106	P	48.4	Very low	35.3	Very low	128 Å²	128	143.6 Å²	143.6	83%	0.831	81%	0.809	S	S	*	*			trans	-98.3	130.1	155.5	33.8	-26.1	0	0	0	110.8
107	S	36.7	Very low	35	Very low	117 Å²	117	139.9 Å²	139.9	82%	0.818	81%	0.807	S	S	*	*			trans	-130.2	114.8	161.4	-179.8	0	0	0	0	107.2
108	H	35	Very low	35.4	Very low	170 Å²	170	139.4 Å²	139.4	79%	0.787	80%	0.804	S	S	*	*			trans	-161.5	117.1	170.5	-131	-106.5	0	0	0	113.9
109	R	33.4	Very low	35.8	Very low	214 Å²	214	142.5 Å²	142.5	81%	0.808	81%	0.814	S	S	*	*			trans	52.3	118	135	-173.1	-171.6	-109.4	-159.7	-3.7	119.6
110	S	34.7	Very low	36.2	Very low	121 Å²	121	140.3 Å²	140.3	85%	0.846	81%	0.81	S	S	*	*				-139.2	140.9	126.4	-169.8	0	0	0	0	110.6
111	V	34.6	Very low	36.5	Very low	120 Å²	120	147 Å²	147	73%	0.727	81%	0.812	S	S	*	*			trans	-128.7	125.7	177.5	166.4	0	0	0	0	107.3
112	C	34.7	Very low	36.5	Very low	136 Å²	136	147.9 Å²	147.9	92%	0.919	81%	0.812	S	S	*	*			trans	-160.2	133.2	150.7	-96.9	0	0	0	0	108.1
113	G	31.2	Very low	36.6	Very low	68 Å²	68	151.5 Å²	151.5	70%	0.701	82%	0.819	S	S	*	*			trans	-150.4	157.9	168	0	0	0	0	0	109.9
114	R	31.9	Very low	36.9	Very low	245 Å²	245	150 Å²	150	93%	0.925	81%	0.811	S	S	*	*			trans	-174.8	152.5	135.3	-144.1	165.3	-75.7	-120.6	3.1	110.5
115	D	38.2	Very low	36.9	Very low	140 Å²	140	150 Å²	150	75%	0.749	81%	0.814	S	S	*	*			trans	-57.9	155	176	-65.9	-83.6	0	0	0	115.4
116	L	37	Very low	37.1	Very low	173 Å²	173	147.8 Å²	147.8	91%	0.906	81%	0.807	S	S	*	*				176.8	143.4	102.7	-86.4	168.8	0	0	0	111.5
117	A	34.4	Very low	36.5	Very low	90 Å²	90	146.4 Å²	146.4	74%	0.744	80%	0.8	S	S	*	*			trans	-93.5	-176.6	172.4	0	0	0	0	0	110.7
118	P	45	Very low	36.6	Very low	126 Å²	126	146.4 Å²	146.4	82%	0.818	80%	0.798	S	S	*	*			cis	-138.4	-165.9	2.8	42.6	-21.8	0	0	0	116.3
119	L	41.8	Very low	36.9	Very low	142 Å²	142	142.2 Å²	142.2	74%	0.743	79%	0.794	S	S	*	*			trans	-43.8	162.3	179.8	-143.9	86.7	0	0	0	118.3	R121	L119-R121 HydrophobicContact CD2-CG 4.18Å
120	P	41.2	Very low	37.2	Very low	128 Å²	128	141 Å²	141	83%	0.831	80%	0.797	S	S	*	*				-137.6	173.3	109.7	39.4	-29.2	0	0	0	116.8
121	R	35.8	Very low	37.7	Very low	218 Å²	218	144.2 Å²	144.2	82%	0.823	80%	0.799	S	S	*	*			trans	-91.2	-179.3	-169.6	-105.1	177	168.1	157.2	-4.8	114.8	L119	L119-R121 HydrophobicContact CD2-CG 4.18Å
122	T	32.5	Very low	37.5	Very low	134 Å²	134	141.3 Å²	141.3	82%	0.822	79%	0.793	S	S	*	*			trans	71.8	142.2	166.2	29.7	0	0	0	0	116.5
123	Q	35.4	Very low	37.9	Very low	170 Å²	170	141.1 Å²	141.1	79%	0.794	79%	0.79	S	S	*	*			cis	-148.8	169.8	6.3	-126.1	-144	45	0	0	109.9
124	P	39.8	Very low	38.5	Very low	103 Å²	103	145.7 Å²	145.7	67%	0.669	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-85.4	139.6	-177.9	34.4	-33.1	0	0	0	113.3
125	H	33.8	Very low	39.2	Very low	196 Å²	196	144.8 Å²	144.8	91%	0.907	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-95	116.9	173.6	-136.2	-74	0	0	0	111.6
126	Q	43	Very low	39.9	Very low	165 Å²	165	143.3 Å²	143.3	77%	0.771	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-83.4	171.5	167.7	-66.6	-175.1	10.8	0	0	111.4
127	S	36.2	Very low	41	Very low	98 Å²	98	141.3 Å²	141.3	69%	0.685	77%	0.771	S	S	*	*			trans	89.5	97.6	153.6	-62.7	0	0	0	0	119.8
128	C	38.6	Very low	42.1	Very low	117 Å²	117	142.1 Å²	142.1	79%	0.791	77%	0.769	S	S	*	*				72.5	117.7	116.3	-63.9	0	0	0	0	121.1
129	A	42.4	Very low	43.1	Very low	83 Å²	83	142.5 Å²	142.5	69%	0.686	76%	0.764	S	S	*	*			trans	62.1	97.7	132.8	0	0	0	0	0	118.5
130	Q	39.4	Very low	44.9	Very low	188 Å²	188	139.9 Å²	139.9	88%	0.879	75%	0.751	S	S	*	*				-125.8	115.3	125.4	-73.7	-61.7	-10.2	0	0	109.3	G132	Q130-G132 PolarHBondContact O-N 2.86Å
131	Q	44	Very low	46.7	Very low	189 Å²	189	142.7 Å²	142.7	88%	0.883	75%	0.745	S	S	*	*			trans	-75.4	104.2	167.2	-73.4	176.3	-17.5	0	0	107.8
132	G	31.8	Very low	48.7	Very low	58 Å²	58	135.3 Å²	135.3	60%	0.598	72%	0.724	S	S	*	*			trans	-73.1	145.5	155.5	0	0	0	0	0	108.8	Q130 E134	Q130-G132 PolarHBondContact O-N 2.86Å; G132-E134 VanDerWaalsContact C-N 3.32Å; G132-E134 PolarHBondContact O-N 3.18Å
133	P	43.1	Very low	50.6	Low	132 Å²	132	131.8 Å²	131.8	86%	0.857	71%	0.705	S	S	*	*			trans	-67.2	97.1	171.2	28.4	-32.3	0	0	0	108.2	R135	P133-R135 PolarHBondContact O-N 3.13Å
134	E	43	Very low	52.7	Low	164 Å²	164	126.2 Å²	126.2	77%	0.766	68%	0.683	S	S	*	*			trans	-51.8	112.4	166.8	-172	179.6	138.6	0	0	107.1	G132 V136	G132-E134 VanDerWaalsContact C-N 3.32Å; G132-E134 PolarHBondContact O-N 3.18Å; E134-V136 PolarHBondContact O-N 3.33Å
135	R	47.2	Very low	54.5	Low	227 Å²	227	125.9 Å²	125.9	86%	0.857	68%	0.675	S	S	*	*			trans	-63.4	96.1	159	-84.8	-174.7	168.7	-116.6	0.3	104.9	P133 E137	P133-R135 PolarHBondContact O-N 3.13Å; R135-E137 VanDerWaalsContact C-N 3.26Å; R135-E137 PolarHBondContact O-N 2.86Å
136	V	52.5	Low	56.4	Low	109 Å²	109	122.3 Å²	122.3	66%	0.661	66%	0.66	S	S	*	*			trans	-56.7	99.9	165.9	174.1	0	0	0	0	105.4	E134 P138	E134-V136 PolarHBondContact O-N 3.33Å; V136-P138 WeakPolarHBondContact O-CD 3.41Å
137	E	60.5	Low	57.7	Low	130 Å²	130	118.7 Å²	118.7	61%	0.607	65%	0.653	S	S	*	*			trans	-63.9	124.2	176.2	-167.9	68.5	173.7	0	0	106.6	R135 D139	R135-E137 VanDerWaalsContact C-N 3.26Å; R135-E137 PolarHBondContact O-N 2.86Å; E137-D139 PolarHBondContact O-N 3.28Å
138	P	57.1	Low	59	Low	108 Å²	108	123.7 Å²	123.7	70%	0.701	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	106.2	-172.2	-24.3	35.1	0	0	0	111.3	V136	V136-P138 WeakPolarHBondContact O-CD 3.41Å
139	D	65.3	Low	60.3	Low	134 Å²	134	119.8 Å²	119.8	72%	0.717	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	59.1	68.3	175.3	-65.6	-66.8	0	0	0	115.6	E137 W141	E137-D139 PolarHBondContact O-N 3.28Å; D139-W141 VanDerWaalsContact C-N 3.29Å; D139-W141 PolarHBondContact O-N 2.75Å
140	D	79.8	Confident	61.4	Low	87 Å²	87	126.2 Å²	126.2	47%	0.465	64%	0.643	S	S	.	*			trans	-51.8	95.5	151.5	-101	-12.2	0	0	0	109.7	T142 S143 T144	D140-T142 PolarHBondContact O-N 2.79Å; D140-T142 VanDerWaalsContact O-N 3.16Å; D140-S143 WeakPolarHBondContact CB-OG 3.34Å; D140-S143 PolarHBondContact O-N 3.03Å; D140-S143 PolarHBondContact OD2-OG 3.19Å; D140-T144 PolarHBondContact O-N 3.24Å; D140-T144 PolarHBondContact O-OG1 3.24Å
141	W	80.1	Confident	62.4	Low	186 Å²	186	124.9 Å²	124.9	71%	0.705	64%	0.642	S	S	*	*	H	α-helix	trans	-57.6	-33.5	-178.4	68.7	-88.5	0	0	0	111.5	D139 L145	D139-W141 VanDerWaalsContact C-N 3.29Å; D139-W141 PolarHBondContact O-N 2.75Å; W141-L145 HydrophobicContact CE3-CD2 4.38Å; W141-L145 HydrophobicContact CZ3-CD2 4.05Å; W141-L145 WeakPolarHBondContact O-CB 3.03Å; W141-L145 PolarHBondContact O-N 2.89Å
142	T	76	Confident	63.7	Low	63 Å²	63	126 Å²	126	39%	0.387	64%	0.638	S	S	.	*	H	α-helix	trans	-63.2	-49	174.6	-34.9	0	0	0	0	110.9	D140 L145 M146	D140-T142 PolarHBondContact O-N 2.79Å; D140-T142 VanDerWaalsContact O-N 3.16Å; T142-L145 PolarHBondContact O-N 3.43Å; T142-M146 WeakPolarHBondContact O-CB 3.36Å; T142-M146 VanDerWaalsContact O-CG 3.23Å; T142-M146 WeakPolarHBondContact O-CG 3.45Å; T142-M146 PolarHBondContact O-N 3.21Å
143	S	72.4	Confident	65.5	Low	60 Å²	60	131.1 Å²	131.1	42%	0.42	65%	0.646	S	S	.	*	H	α-helix	trans	-65.9	-40.2	179.3	-59.1	0	0	0	0	111.2	D140 S147	D140-S143 WeakPolarHBondContact CB-OG 3.34Å; D140-S143 PolarHBondContact O-N 3.03Å; D140-S143 PolarHBondContact OD2-OG 3.19Å; S143-S147 WeakPolarHBondContact O-CB 3.44Å; S143-S147 PolarHBondContact O-N 2.83Å; S143-S147 PolarHBondContact O-OG 2.92Å
144	T	80	Confident	66.5	Low	54 Å²	54	130.3 Å²	130.3	33%	0.331	64%	0.641	S	S	.	*	H	α-helix	trans	-64.9	-42.6	173.6	-69.5	0	0	0	0	112.3	D140 R148	D140-T144 PolarHBondContact O-N 3.24Å; D140-T144 PolarHBondContact O-OG1 3.24Å; T144-R148 VanDerWaalsContact O-CB 3.31Å; T144-R148 WeakPolarHBondContact O-CB 3.35Å; T144-R148 WeakPolarHBondContact O-CG 3.26Å; T144-R148 PolarHBondContact O-N 2.99Å
145	L	77.4	Confident	67.6	Low	96 Å²	96	128.8 Å²	128.8	50%	0.503	64%	0.638	S	S	.	*	H	α-helix	trans	-64.8	-48.5	177.2	178.2	63.9	0	0	0	111.8	W141 T142 S147 G149	W141-L145 HydrophobicContact CE3-CD2 4.38Å; W141-L145 HydrophobicContact CZ3-CD2 4.05Å; W141-L145 WeakPolarHBondContact O-CB 3.03Å; W141-L145 PolarHBondContact O-N 2.89Å; T142-L145 PolarHBondContact O-N 3.43Å; L145-S147 VanDerWaalsContact C-N 3.34Å; L145-S147 PolarHBondContact O-N 3.42Å; L145-G149 WeakPolarHBondContact O-CA 3.4Å; L145-G149 PolarHBondContact O-N 3.18Å
146	M	75.3	Confident	68.4	Low	120 Å²	120	124.9 Å²	124.9	59%	0.591	64%	0.638	S	S	*	*	H	α-helix	trans	-67.6	-34.7	-179.5	-66.7	-60.5	143.5	0	0	112.2	T142	T142-M146 WeakPolarHBondContact O-CB 3.36Å; T142-M146 VanDerWaalsContact O-CG 3.23Å; T142-M146 WeakPolarHBondContact O-CG 3.45Å; T142-M146 PolarHBondContact O-N 3.21Å
147	S	69.6	Low	69	Low	89 Å²	89	122.8 Å²	122.8	62%	0.622	62%	0.623	S	S	*	*	H	α-helix	trans	-74	-43	177	-58.6	0	0	0	0	112.4	S143 L145	S143-S147 WeakPolarHBondContact O-CB 3.44Å; S143-S147 PolarHBondContact O-N 2.83Å; S143-S147 PolarHBondContact O-OG 2.92Å; L145-S147 VanDerWaalsContact C-N 3.34Å; L145-S147 PolarHBondContact O-N 3.42Å
148	R	64.1	Low	69.5	Low	203 Å²	203	118.5 Å²	118.5	77%	0.766	61%	0.614	S	S	*	*	H	α-helix	trans	-82.3	-19.9	-179.1	-66.2	-172.5	177.6	-164	1.7	114	T144 R150	T144-R148 VanDerWaalsContact O-CB 3.31Å; T144-R148 WeakPolarHBondContact O-CB 3.35Å; T144-R148 WeakPolarHBondContact O-CG 3.26Å; T144-R148 PolarHBondContact O-N 2.99Å; R148-R150 VanDerWaalsContact C-N 3.26Å; R148-R150 PolarHBondContact O-N 2.9Å
149	G	65	Low	70	Confident	35 Å²	35	121.2 Å²	121.2	36%	0.361	62%	0.623	S	S	.	*	G	3₁₀ helix	trans	-66.9	-21.5	-179.8	0	0	0	0	0	114.9	L145 N151	L145-G149 WeakPolarHBondContact O-CA 3.4Å; L145-G149 PolarHBondContact O-N 3.18Å; G149-N151 VanDerWaalsContact C-N 3.27Å; G149-N151 PolarHBondContact O-N 2.79Å
150	R	66.2	Low	69.9	Low	219 Å²	219	119.9 Å²	119.9	83%	0.826	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-76.1	-3.3	-171	-60.5	-178.2	71.4	94.2	0.7	115.6	R148	R148-R150 VanDerWaalsContact C-N 3.26Å; R148-R150 PolarHBondContact O-N 2.9Å
151	N	60.6	Low	69.3	Low	160 Å²	160	119.5 Å²	119.5	86%	0.856	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-116.6	21.2	-179.9	-91	-32.6	0	0	0	113.8	G149 Q153	G149-N151 VanDerWaalsContact C-N 3.27Å; G149-N151 PolarHBondContact O-N 2.79Å; N151-Q153 PolarHBondContact O-N 3.32Å
152	R	71.4	Confident	68.9	Low	213 Å²	213	117.3 Å²	117.3	80%	0.804	61%	0.612	S	S	*	*			trans	-79.4	116.4	168	-68.4	-174.5	175.2	-84.3	-1.4	108.8
153	Q	68.3	Low	68.9	Low	164 Å²	164	116.2 Å²	116.2	77%	0.766	61%	0.609	S	S	*	*			trans	-55.4	135.6	166.1	-70.2	-179.7	-19.2	0	0	108.4	N151 L155	N151-Q153 PolarHBondContact O-N 3.32Å; Q153-L155 PolarHBondContact O-N 2.9Å
154	P	64.1	Low	68.9	Low	115 Å²	115	116.7 Å²	116.7	75%	0.747	61%	0.607	S	S	*	*			trans	-60.8	110.7	166.5	26.9	-31.7	0	0	0	106.1	V156	P154-V156 PolarHBondContact O-N 3.11Å
155	L	67	Low	68.9	Low	133 Å²	133	118 Å²	118	70%	0.696	61%	0.612	S	S	*	*			trans	-66.4	109.9	178	-60.7	171.9	0	0	0	106.1	Q153 L157	Q153-L155 PolarHBondContact O-N 2.9Å; L155-L157 VanDerWaalsContact C-N 3.28Å; L155-L157 HydrophobicContact CB-CD1 3.11Å; L155-L157 HydrophobicContact CD1-CD1 4.24Å; L155-L157 HydrophobicContact CG-CD1 4.3Å; L155-L157 WeakPolarHBondContact O-CD1 3.24Å; L155-L157 PolarHBondContact O-N 3.49Å
156	V	64.2	Low	68.6	Low	144 Å²	144	115.9 Å²	115.9	87%	0.873	60%	0.602	S	S	*	*			trans	-74.9	89.3	174.2	-178.4	0	0	0	0	106.8	P154 G158	P154-V156 PolarHBondContact O-N 3.11Å; V156-G158 PolarHBondContact O-N 3Å
157	L	64.4	Low	68.3	Low	65 Å²	65	110.3 Å²	110.3	34%	0.34	58%	0.576	S	S	.	*			trans	-80.2	105.1	-177.8	-89.9	67.7	0	0	0	109.4	L155 V161 F162	L155-L157 VanDerWaalsContact C-N 3.28Å; L155-L157 HydrophobicContact CB-CD1 3.11Å; L155-L157 HydrophobicContact CD1-CD1 4.24Å; L155-L157 HydrophobicContact CG-CD1 4.3Å; L155-L157 WeakPolarHBondContact O-CD1 3.24Å; L155-L157 PolarHBondContact O-N 3.49Å; L157-V161 HydrophobicContact CB-CB 4.32Å; L157-V161 HydrophobicContact CD2-CB 4.3Å; L157-V161 HydrophobicContact CD2-CG1 4.32Å; L157-V161 HydrophobicContact CG-CB 3.88Å; L157-V161 HydrophobicContact CG-CG1 3.91Å; L157-F162 VanDerWaalsContact CD2-CA 3.43Å; L157-F162 HydrophobicContact CD2-CB 3.49Å; L157-F162 VanDerWaalsContact CD2-CB 3.49Å; L157-F162 HydrophobicContact CD2-CD2 4.05Å; L157-F162 HydrophobicContact CD2-CG 4.26Å; L157-F162 VanDerWaalsContact CD2-N 3.31Å
158	G	71.4	Confident	68.3	Low	41 Å²	41	110.5 Å²	110.5	42%	0.423	57%	0.57	S	S	.	*			trans	-59.8	158.8	160.6	0	0	0	0	0	111.6	V156 N160 V161	V156-G158 PolarHBondContact O-N 3Å; G158-N160 PolarHBondContact O-N 3.45Å; G158-V161 PolarHBondContact O-N 3Å
159	D	66.8	Low	68.5	Low	165 Å²	165	110.1 Å²	110.1	88%	0.882	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.3	-12.3	-149.1	-46.5	-24.7	0	0	0	120.3
160	N	63.3	Low	68.7	Low	106 Å²	106	109.7 Å²	109.7	57%	0.567	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.8	-5.5	179.1	-71.6	-77.7	0	0	0	115.5	G158 F162 A163 D164	G158-N160 PolarHBondContact O-N 3.45Å; N160-F162 PolarHBondContact O-N 2.99Å; N160-A163 WeakPolarHBondContact O-CA 3.44Å; N160-A163 WeakPolarHBondContact O-CB 3.38Å; N160-A163 PolarHBondContact O-N 3.3Å; N160-D164 PolarHBondContact O-N 3.36Å
161	V	68.3	Low	68.8	Low	79 Å²	79	102.8 Å²	102.8	48%	0.479	54%	0.537	S	S	.	.	H	α-helix	trans	-61.9	-25.1	-171.9	177.7	0	0	0	0	112.7	L157 G158 L165	L157-V161 HydrophobicContact CB-CB 4.32Å; L157-V161 HydrophobicContact CD2-CB 4.3Å; L157-V161 HydrophobicContact CD2-CG1 4.32Å; L157-V161 HydrophobicContact CG-CB 3.88Å; L157-V161 HydrophobicContact CG-CG1 3.91Å; G158-V161 PolarHBondContact O-N 3Å; V161-L165 VanDerWaalsContact O-CB 3.26Å; V161-L165 WeakPolarHBondContact O-CB 3.4Å; V161-L165 PolarHBondContact O-N 3.02Å
162	F	71.3	Confident	68.6	Low	140 Å²	140	101.1 Å²	101.1	61%	0.614	53%	0.528	S	S	*	.	H	α-helix	trans	-71	-48.2	174.2	-172.3	-113.4	0	0	0	110.4	L157 N160 D164 L165 V166	L157-F162 VanDerWaalsContact CD2-CA 3.43Å; L157-F162 HydrophobicContact CD2-CB 3.49Å; L157-F162 VanDerWaalsContact CD2-CB 3.49Å; L157-F162 HydrophobicContact CD2-CD2 4.05Å; L157-F162 HydrophobicContact CD2-CG 4.26Å; L157-F162 VanDerWaalsContact CD2-N 3.31Å; N160-F162 PolarHBondContact O-N 2.99Å; F162-D164 VanDerWaalsContact C-N 3.25Å; F162-D164 PolarHBondContact O-N 2.86Å; F162-L165 PolarHBondContact O-N 3.26Å; F162-V166 HydrophobicContact CD1-CG2 4.31Å; F162-V166 HydrophobicContact CD2-CG2 4.19Å; F162-V166 HydrophobicContact CE1-CG2 4.01Å; F162-V166 HydrophobicContact CE2-CG2 3.87Å; F162-V166 HydrophobicContact CG-CG2 4.4Å; F162-V166 HydrophobicContact CZ-CG2 3.78Å; F162-V166 VanDerWaalsContact O-CB 3.28Å; F162-V166 WeakPolarHBondContact O-CB 3.48Å; F162-V166 VanDerWaalsContact O-CG2 3.29Å; F162-V166 WeakPolarHBondContact O-CG2 3.35Å; F162-V166 PolarHBondContact O-N 3.38Å
163	A	75.7	Confident	67.9	Low	40 Å²	40	96 Å²	96	33%	0.331	52%	0.523	S	S	.	.	H	α-helix	trans	-64.8	-32.1	179.7	0	0	0	0	0	111.5	N160 G167 R219	N160-A163 WeakPolarHBondContact O-CA 3.44Å; N160-A163 WeakPolarHBondContact O-CB 3.38Å; N160-A163 PolarHBondContact O-N 3.3Å; A163-G167 VanDerWaalsContact O-CA 3.23Å; A163-G167 WeakPolarHBondContact O-CA 3.24Å; A163-G167 PolarHBondContact O-N 2.93Å; A163-R219 PolarHBondContact O-NE 2.94Å; A163-R219 PolarHBondContact O-NH2 3.48Å
164	D	73.3	Confident	67.2	Low	69 Å²	69	93.1 Å²	93.1	37%	0.369	51%	0.509	S	S	.	.	H	α-helix	trans	-75.4	-44.2	173.7	-70.5	-35	0	0	0	112.8	N160 F162 G167 N168	N160-D164 PolarHBondContact O-N 3.36Å; F162-D164 VanDerWaalsContact C-N 3.25Å; F162-D164 PolarHBondContact O-N 2.86Å; D164-G167 CarbonylContact O-C 3.55Å; D164-G167 WeakPolarHBondContact O-CA 3.48Å; D164-G167 PolarHBondContact O-N 2.85Å; D164-N168 VanDerWaalsContact O-CG 3.23Å; D164-N168 PolarHBondContact O-N 3.45Å; D164-N168 PolarHBondContact O-ND2 3.44Å
165	L	78.8	Confident	66.5	Low	83 Å²	83	95.9 Å²	95.9	44%	0.435	52%	0.516	S	S	.	.	H	α-helix	trans	-63.2	-52.9	176.3	179.8	62.3	0	0	0	110.6	V161 F162 G167 N168 W169	V161-L165 VanDerWaalsContact O-CB 3.26Å; V161-L165 WeakPolarHBondContact O-CB 3.4Å; V161-L165 PolarHBondContact O-N 3.02Å; F162-L165 PolarHBondContact O-N 3.26Å; L165-G167 PolarHBondContact O-N 3.32Å; L165-N168 PolarHBondContact O-N 3.31Å; L165-W169 PolarHBondContact O-N 2.84Å; L165-W169 VanDerWaalsContact O-N 3.13Å
166	V	71.7	Confident	65.3	Low	50 Å²	50	98.1 Å²	98.1	30%	0.303	52%	0.523	S	S	.	.	H	α-helix	trans	-63.2	-21.3	172.3	179.2	0	0	0	0	110.8	F162 L170 R219	F162-V166 HydrophobicContact CD1-CG2 4.31Å; F162-V166 HydrophobicContact CD2-CG2 4.19Å; F162-V166 HydrophobicContact CE1-CG2 4.01Å; F162-V166 HydrophobicContact CE2-CG2 3.87Å; F162-V166 HydrophobicContact CG-CG2 4.4Å; F162-V166 HydrophobicContact CZ-CG2 3.78Å; F162-V166 VanDerWaalsContact O-CB 3.28Å; F162-V166 WeakPolarHBondContact O-CB 3.48Å; F162-V166 VanDerWaalsContact O-CG2 3.29Å; F162-V166 WeakPolarHBondContact O-CG2 3.35Å; F162-V166 PolarHBondContact O-N 3.38Å; V166-L170 HydrophobicContact CG1-CD1 3.83Å; V166-L170 HydrophobicContact CG1-CG 4.42Å; V166-L170 WeakPolarHBondContact O-CB 3.47Å; V166-L170 VanDerWaalsContact O-CD1 3.3Å; V166-L170 WeakPolarHBondContact O-CD1 3.46Å; V166-L170 WeakPolarHBondContact O-CG 3.42Å; V166-L170 PolarHBondContact O-N 2.76Å; V166-R219 PolarHBondContact O-NH2 3.24Å
167	G	68.8	Low	64.6	Low	3 Å²	3	101 Å²	101	3%	0.031	52%	0.524	C	S	.	.	H	α-helix	trans	-69.9	-59.9	175.7	0	0	0	0	0	110.9	A163 D164 L165 W169 L170 D171	A163-G167 VanDerWaalsContact O-CA 3.23Å; A163-G167 WeakPolarHBondContact O-CA 3.24Å; A163-G167 PolarHBondContact O-N 2.93Å; D164-G167 CarbonylContact O-C 3.55Å; D164-G167 WeakPolarHBondContact O-CA 3.48Å; D164-G167 PolarHBondContact O-N 2.85Å; L165-G167 PolarHBondContact O-N 3.32Å; G167-W169 PolarHBondContact O-N 3.5Å; G167-L170 CarbonylContact O-C 3.49Å; G167-L170 WeakPolarHBondContact O-CA 3.3Å; G167-L170 PolarHBondContact O-N 3.3Å; G167-D171 WeakPolarHBondContact O-CB 3.38Å; G167-D171 PolarHBondContact O-N 3.06Å
168	N	69.1	Low	63.1	Low	94 Å²	94	101.3 Å²	101.3	50%	0.503	54%	0.543	S	S	.	.	H	α-helix	trans	-57.1	-34.3	178.3	-62.4	-29	0	0	0	112.4	D164 L165 D171	D164-N168 VanDerWaalsContact O-CG 3.23Å; D164-N168 PolarHBondContact O-N 3.45Å; D164-N168 PolarHBondContact O-ND2 3.44Å; L165-N168 PolarHBondContact O-N 3.31Å; N168-D171 PolarHBondContact O-N 2.84Å
169	W	69.1	Low	61.8	Low	194 Å²	194	102.9 Å²	102.9	74%	0.735	56%	0.559	S	S	*	*	H	α-helix	trans	-72	-32.2	174.7	-79.9	60.7	0	0	0	113.6	L165 G167	L165-W169 PolarHBondContact O-N 2.84Å; L165-W169 VanDerWaalsContact O-N 3.13Å; G167-W169 PolarHBondContact O-N 3.5Å
170	L	70.1	Confident	60.2	Low	27 Å²	27	104.2 Å²	104.2	14%	0.141	56%	0.56	C	S	.	*	H	α-helix	trans	-82	-24.8	173.3	-69.4	168.8	0	0	0	111.9	V166 G167 L172 K212 L215 R216	V166-L170 HydrophobicContact CG1-CD1 3.83Å; V166-L170 HydrophobicContact CG1-CG 4.42Å; V166-L170 WeakPolarHBondContact O-CB 3.47Å; V166-L170 VanDerWaalsContact O-CD1 3.3Å; V166-L170 WeakPolarHBondContact O-CD1 3.46Å; V166-L170 WeakPolarHBondContact O-CG 3.42Å; V166-L170 PolarHBondContact O-N 2.76Å; G167-L170 CarbonylContact O-C 3.49Å; G167-L170 WeakPolarHBondContact O-CA 3.3Å; G167-L170 PolarHBondContact O-N 3.3Å; L170-L172 VanDerWaalsContact C-N 3.31Å; L170-L172 PolarHBondContact O-N 3.22Å; L170-K212 HydrophobicContact CD2-CG 3.91Å; L170-L215 HydrophobicContact CD1-CB 3.96Å; L170-L215 HydrophobicContact CD1-CD1 3.91Å; L170-L215 HydrophobicContact CD2-CD1 4.41Å; L170-R216 PolarHBondContact O-NH1 3.03Å
171	D	66.9	Low	59.3	Low	73 Å²	73	109.4 Å²	109.4	39%	0.39	58%	0.578	S	S	.	*			trans	-80.6	-2.3	-178.3	-83.6	-16.4	0	0	0	115.2	G167 N168 R216	G167-D171 WeakPolarHBondContact O-CB 3.38Å; G167-D171 PolarHBondContact O-N 3.06Å; N168-D171 PolarHBondContact O-N 2.84Å; D171-R216 IonicContact OD1-CZ 2.57Å; D171-R216 VanDerWaalsContact OD1-CZ 3.23Å; D171-R216 IonicContact OD1-NE 3.33Å; D171-R216 IonicContact OD1-NH1 2.84Å; D171-R216 IonicContact OD1-NH2 3.74Å; D171-R216 PolarHBondContact OD1-NH2 3.43Å
172	L	56.7	Low	57.7	Low	126 Å²	126	108.9 Å²	108.9	66%	0.66	59%	0.589	S	S	*	*	S	Bend	trans	-54.3	125.7	162.7	-73	165.5	0	0	0	109.1	L170	L170-L172 VanDerWaalsContact C-N 3.31Å; L170-L172 PolarHBondContact O-N 3.22Å
173	P	56.9	Low	56.2	Low	106 Å²	106	111.8 Å²	111.8	69%	0.688	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-59	144.3	-178.4	22.9	-32.5	0	0	0	110.3	L175	P173-L175 PolarHBondContact O-N 3.43Å
174	E	53.2	Low	54.2	Low	102 Å²	102	116.6 Å²	116.6	48%	0.477	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-55.7	116.8	163.1	-69.8	-174.2	144.5	0	0	106.8	E176 N209 K212	E174-E176 PolarHBondContact O-N 2.93Å; E174-N209 PolarHBondContact OE1-ND2 3.34Å; E174-N209 PolarHBondContact OE1-OD1 2.9Å; E174-K212 IonicContact OE1-NZ 3.7Å
175	L	49.7	Very low	52.2	Low	173 Å²	173	117.2 Å²	117.2	91%	0.906	65%	0.652	S	S	*	*			trans	-43.3	100.7	-172.2	-179.2	78.4	0	0	0	109.9	P173 K177	P173-L175 PolarHBondContact O-N 3.43Å; L175-K177 PolarHBondContact O-N 3.12Å
176	E	42.2	Very low	50.1	Low	180 Å²	180	117 Å²	117	84%	0.841	67%	0.67	S	S	*	*			trans	-62.9	131.1	-177.8	-97.9	-165.7	124.4	0	0	108.2	E174 G178	E174-E176 PolarHBondContact O-N 2.93Å; E176-G178 PolarHBondContact O-N 2.97Å
177	K	49.1	Very low	48.4	Very low	204 Å²	204	119.6 Å²	119.6	89%	0.887	70%	0.697	S	S	*	*			trans	-66.3	74.1	171.5	-178.1	-160.5	172.7	-171	0	109	L175 G179	L175-K177 PolarHBondContact O-N 3.12Å; K177-G179 PolarHBondContact O-N 3.3Å
178	G	33.5	Very low	46.7	Very low	72 Å²	72	130.6 Å²	130.6	74%	0.742	74%	0.737	S	S	*	*			trans	-59.3	120.2	152.7	0	0	0	0	0	107	E176	E176-G178 PolarHBondContact O-N 2.97Å
179	G	43.7	Very low	45.3	Very low	74 Å²	74	133.4 Å²	133.4	76%	0.763	75%	0.747	S	S	*	*			cis	111.7	8.9	15.9	0	0	0	0	0	112.1	K177 K181	K177-G179 PolarHBondContact O-N 3.3Å; G179-K181 PolarHBondContact O-N 2.91Å
180	E	33.5	Very low	43.9	Very low	193 Å²	193	129.8 Å²	129.8	90%	0.902	75%	0.749	S	S	*	*			trans	-78.3	102	165.6	61.1	-170.9	144.9	0	0	110.6	G182	E180-G182 PolarHBondContact O-N 3.4Å
181	K	44.4	Very low	42.7	Very low	215 Å²	215	138 Å²	138	94%	0.935	78%	0.783	S	S	*	*			trans	-73.7	108.7	150.2	-84.5	-170.9	170.8	-170.3	0	107.2	G179	G179-K181 PolarHBondContact O-N 2.91Å
182	G	33.8	Very low	41.3	Very low	69 Å²	69	137.2 Å²	137.2	71%	0.711	79%	0.792	S	S	*	*			trans	-140.2	99.6	169.8	0	0	0	0	0	109.4	E180 T184	E180-G182 PolarHBondContact O-N 3.4Å; G182-T184 PolarHBondContact O-N 2.95Å
183	E	40.5	Very low	40.9	Very low	200 Å²	200	141 Å²	141	94%	0.935	81%	0.807	S	S	*	*			trans	-72.3	114.4	176.5	-69.4	172.5	99.3	0	0	110.6
184	T	33	Very low	40.3	Very low	142 Å²	142	144.2 Å²	144.2	87%	0.871	81%	0.81	S	S	*	*			trans	-149.4	122.2	145.6	-50.5	0	0	0	0	108.2	G182	G182-T184 PolarHBondContact O-N 2.95Å
185	G	31.8	Very low	40.3	Very low	82 Å²	82	142.3 Å²	142.3	85%	0.845	82%	0.818	S	S	*	*			trans	-79.4	164.7	-173.6	0	0	0	0	0	114
186	G	33.8	Very low	40.6	Very low	77 Å²	77	140.5 Å²	140.5	79%	0.794	81%	0.805	S	S	*	*			trans	160.4	100.9	173.7	0	0	0	0	0	112
187	A	36.2	Very low	41	Very low	106 Å²	106	136.7 Å²	136.7	88%	0.876	80%	0.795	S	S	*	*			trans	-52.7	141.9	179.6	0	0	0	0	0	113.7
188	R	32.8	Very low	41.4	Very low	234 Å²	234	132.6 Å²	132.6	88%	0.883	78%	0.78	S	S	*	*				177.4	121.2	110.7	-176.5	166.6	-176.6	-154.9	2.5	112.1	P190	R188-P190 WeakPolarHBondContact O-CD 3.11Å
189	E	40.5	Very low	42.6	Very low	153 Å²	153	132.5 Å²	132.5	72%	0.715	76%	0.76	S	S	*	*			trans	-51.7	140.2	162.2	-93.7	-84.9	135.1	0	0	112.3	K191	E189-K191 PolarHBondContact OE2-N 3.2Å
190	P	40.4	Very low	43.4	Very low	117 Å²	117	132.6 Å²	132.6	76%	0.76	74%	0.743	S	S	*	*			trans	-124.3	106.4	136.1	33.9	-24.5	0	0	0	111.4	R188 G192	R188-P190 WeakPolarHBondContact O-CD 3.11Å; P190-G192 PolarHBondContact O-N 3.46Å; P190-G192 VanDerWaalsContact O-N 3.09Å
191	K	44.5	Very low	44.7	Very low	200 Å²	200	125.3 Å²	125.3	87%	0.87	72%	0.719	S	S	*	*			trans	-44.1	116.7	152.2	-83.8	-173.6	171.3	-176.9	0	109.4	E189	E189-K191 PolarHBondContact OE2-N 3.2Å
192	G	36.5	Very low	45.8	Very low	56 Å²	56	121.3 Å²	121.3	58%	0.577	70%	0.698	S	S	*	*			trans	-156.7	118.5	174.3	0	0	0	0	0	109.4	P190 K194	P190-G192 PolarHBondContact O-N 3.46Å; P190-G192 VanDerWaalsContact O-N 3.09Å; G192-K194 PolarHBondContact O-N 3.39Å
193	E	48.6	Very low	47.1	Very low	206 Å²	206	125 Å²	125	96%	0.963	69%	0.691	S	S	*	*			trans	-63.4	113.3	-168.8	-65.9	159.1	112.4	0	0	112
194	K	45.1	Very low	48.3	Very low	173 Å²	173	122.7 Å²	122.7	75%	0.752	68%	0.678	S	S	*	*			trans	-130.6	45.5	177	-67	-173.6	-179.3	-178.9	0	112.2	G192 Q196	G192-K194 PolarHBondContact O-N 3.39Å; K194-Q196 PolarHBondContact O-N 3.33Å
195	G	52.4	Low	49.8	Very low	63 Å²	63	118.1 Å²	118.1	65%	0.649	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	3.2	-169.6	0	0	0	0	0	117.9
196	Q	56.5	Low	51.2	Low	134 Å²	134	119.7 Å²	119.7	63%	0.626	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.4	-53.1	-172.1	-96.4	-85.9	-33.8	0	0	114.4	K194 Q198 E199 L200	K194-Q196 PolarHBondContact O-N 3.33Å; Q196-Q198 PolarHBondContact O-N 2.96Å; Q196-E199 WeakPolarHBondContact O-CB 3.47Å; Q196-E199 PolarHBondContact O-N 3.43Å; Q196-L200 PolarHBondContact O-N 2.9Å; Q196-L200 VanDerWaalsContact O-N 3.11Å
197	P	49.6	Very low	52.8	Low	100 Å²	100	120.5 Å²	120.5	65%	0.649	63%	0.632	S	S	*	*	H	α-helix	trans	-69	-39.7	-174.7	-20.8	33.5	0	0	0	113.2	E199 G201	P197-E199 VanDerWaalsContact C-N 3.31Å; P197-E199 PolarHBondContact O-N 3.49Å; P197-G201 PolarHBondContact O-N 3.03Å
198	Q	57.4	Low	54.5	Low	119 Å²	119	117.5 Å²	117.5	56%	0.556	61%	0.608	S	S	*	*	H	α-helix	trans	-72.9	-27.6	-179.7	-151.3	-170.4	46.2	0	0	112.1	Q196 R202	Q196-Q198 PolarHBondContact O-N 2.96Å; Q198-R202 WeakPolarHBondContact O-CB 3.48Å; Q198-R202 WeakPolarHBondContact O-CG 3.35Å; Q198-R202 PolarHBondContact O-N 2.83Å; Q198-R202 PolarHBondContact O-NE 3.31Å; Q198-R202 VanDerWaalsContact OE1-CZ 3.29Å
199	E	59.5	Low	56.3	Low	70 Å²	70	108.8 Å²	108.8	33%	0.327	58%	0.579	S	S	.	*	H	α-helix	trans	-69.4	-48.7	175.4	-172.4	66.7	-166	0	0	110.7	Q196 P197 R202 R203	Q196-E199 WeakPolarHBondContact O-CB 3.47Å; Q196-E199 PolarHBondContact O-N 3.43Å; P197-E199 VanDerWaalsContact C-N 3.31Å; P197-E199 PolarHBondContact O-N 3.49Å; E199-R202 PolarHBondContact O-N 2.99Å; E199-R203 VanDerWaalsContact O-CG 3.31Å; E199-R203 WeakPolarHBondContact O-CG 3.43Å; E199-R203 PolarHBondContact O-N 3Å; E199-R203 IonicContact OE1-CZ 3.44Å; E199-R203 IonicContact OE1-NE 3.72Å; E199-R203 PolarHBondContact OE1-NE 3.15Å; E199-R203 IonicContact OE1-NH2 3.84Å; E199-R203 PolarHBondContact OE1-NH2 3.05Å
200	L	61.3	Low	58	Low	76 Å²	76	106.6 Å²	106.6	40%	0.398	57%	0.571	S	S	.	*	H	α-helix	trans	-61.3	-45.3	172.2	-68.5	172.9	0	0	0	111.3	Q196 R202 R203 F204	Q196-L200 PolarHBondContact O-N 2.9Å; Q196-L200 VanDerWaalsContact O-N 3.11Å; L200-R202 VanDerWaalsContact C-N 3.3Å; L200-R202 PolarHBondContact O-N 3.09Å; L200-R203 PolarHBondContact O-N 3.34Å; L200-R203 VanDerWaalsContact O-N 3.09Å; L200-F204 HydrophobicContact CB-CD2 4.38Å; L200-F204 HydrophobicContact CB-CE2 4.46Å; L200-F204 VanDerWaalsContact O-CD2 3.24Å; L200-F204 WeakPolarHBondContact O-CD2 3.24Å; L200-F204 PolarHBondContact O-N 3.38Å
201	G	59.7	Low	59.7	Low	40 Å²	40	106.9 Å²	106.9	41%	0.412	56%	0.56	S	S	.	*	H	α-helix	trans	-55.9	-42	175.3	0	0	0	0	0	113.1	P197 A205	P197-G201 PolarHBondContact O-N 3.03Å; G201-A205 WeakPolarHBondContact O-CB 3.42Å; G201-A205 PolarHBondContact O-N 3.19Å
202	R	66.9	Low	61.1	Low	130 Å²	130	100 Å²	100	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-66.6	-39.3	173.9	-80.5	-175.1	-79.7	-98.3	-0.2	113.1	Q198 E199 L200 A205 L206	Q198-R202 WeakPolarHBondContact O-CB 3.48Å; Q198-R202 WeakPolarHBondContact O-CG 3.35Å; Q198-R202 PolarHBondContact O-N 2.83Å; Q198-R202 PolarHBondContact O-NE 3.31Å; Q198-R202 VanDerWaalsContact OE1-CZ 3.29Å; E199-R202 PolarHBondContact O-N 2.99Å; L200-R202 VanDerWaalsContact C-N 3.3Å; L200-R202 PolarHBondContact O-N 3.09Å; R202-A205 PolarHBondContact O-N 3.46Å; R202-L206 WeakPolarHBondContact O-CB 3.19Å; R202-L206 PolarHBondContact O-N 2.91Å
203	R	62.1	Low	62.8	Low	147 Å²	147	103.7 Å²	103.7	56%	0.555	53%	0.531	S	S	*	.	H	α-helix	trans	-67	-46.6	177	-68.9	169.7	-168.8	-161.6	4.3	111.7	E199 L200 L206 T207	E199-R203 VanDerWaalsContact O-CG 3.31Å; E199-R203 WeakPolarHBondContact O-CG 3.43Å; E199-R203 PolarHBondContact O-N 3Å; E199-R203 IonicContact OE1-CZ 3.44Å; E199-R203 IonicContact OE1-NE 3.72Å; E199-R203 PolarHBondContact OE1-NE 3.15Å; E199-R203 IonicContact OE1-NH2 3.84Å; E199-R203 PolarHBondContact OE1-NH2 3.05Å; L200-R203 PolarHBondContact O-N 3.34Å; L200-R203 VanDerWaalsContact O-N 3.09Å; R203-L206 PolarHBondContact O-N 3.01Å; R203-T207 PolarHBondContact O-N 3.04Å; R203-T207 PolarHBondContact O-OG1 2.81Å
204	F	64.9	Low	64.1	Low	151 Å²	151	99.9 Å²	99.9	66%	0.662	51%	0.511	S	S	*	.	H	α-helix	trans	-62.9	-41.5	174	-79.3	-69.1	0	0	0	111.9	L200 A208	L200-F204 HydrophobicContact CB-CD2 4.38Å; L200-F204 HydrophobicContact CB-CE2 4.46Å; L200-F204 VanDerWaalsContact O-CD2 3.24Å; L200-F204 WeakPolarHBondContact O-CD2 3.24Å; L200-F204 PolarHBondContact O-N 3.38Å; F204-A208 WeakPolarHBondContact O-CB 3.35Å; F204-A208 PolarHBondContact O-N 3.48Å
205	A	64.4	Low	65.5	Low	46 Å²	46	94.2 Å²	94.2	38%	0.38	49%	0.489	S	S	.	.	H	α-helix	trans	-63.4	-43.3	175.5	0	0	0	0	0	112.6	G201 R202 A208 N209	G201-A205 WeakPolarHBondContact O-CB 3.42Å; G201-A205 PolarHBondContact O-N 3.19Å; R202-A205 PolarHBondContact O-N 3.46Å; A205-A208 PolarHBondContact O-N 3.37Å; A205-N209 VanDerWaalsContact O-CB 3.3Å; A205-N209 WeakPolarHBondContact O-CB 3.37Å; A205-N209 PolarHBondContact O-N 3.38Å; A205-N209 PolarHBondContact O-ND2 2.91Å; A205-N209 PolarHBondContact O-OD1 3.06Å
206	L	62.4	Low	66.3	Low	115 Å²	115	96.5 Å²	96.5	60%	0.602	48%	0.478	S	S	*	.	H	α-helix	trans	-63	-48.1	178.4	-174.8	63.9	0	0	0	111.4	R202 R203 N209 I210	R202-L206 WeakPolarHBondContact O-CB 3.19Å; R202-L206 PolarHBondContact O-N 2.91Å; R203-L206 PolarHBondContact O-N 3.01Å; L206-N209 PolarHBondContact O-N 2.94Å; L206-I210 HydrophobicContact CG-CD1 4.42Å; L206-I210 WeakPolarHBondContact O-CG1 3.31Å; L206-I210 PolarHBondContact O-N 3.07Å
207	T	67.9	Low	66.8	Low	94 Å²	94	94.3 Å²	94.3	58%	0.577	48%	0.478	S	S	*	.	H	α-helix	trans	-65.1	-41.6	177.1	-56	0	0	0	0	111.8	R203 N209 I210 F211	R203-T207 PolarHBondContact O-N 3.04Å; R203-T207 PolarHBondContact O-OG1 2.81Å; T207-N209 VanDerWaalsContact C-N 3.33Å; T207-N209 PolarHBondContact O-N 3.39Å; T207-I210 PolarHBondContact O-N 3.04Å; T207-F211 WeakPolarHBondContact O-CB 3.37Å; T207-F211 PolarHBondContact O-N 3.32Å
208	A	71.1	Confident	67.4	Low	44 Å²	44	94.1 Å²	94.1	36%	0.364	47%	0.474	S	S	.	.	H	α-helix	trans	-64.7	-35.8	175.6	0	0	0	0	0	112.2	F204 A205 F211 K212	F204-A208 WeakPolarHBondContact O-CB 3.35Å; F204-A208 PolarHBondContact O-N 3.48Å; A205-A208 PolarHBondContact O-N 3.37Å; A208-F211 PolarHBondContact O-N 3.03Å; A208-K212 WeakPolarHBondContact O-CB 3.43Å; A208-K212 WeakPolarHBondContact O-CE 3.41Å; A208-K212 VanDerWaalsContact O-CG 3.24Å; A208-K212 WeakPolarHBondContact O-CG 3.29Å; A208-K212 PolarHBondContact O-N 3.48Å
209	N	70.2	Confident	67.6	Low	50 Å²	50	91.7 Å²	91.7	27%	0.267	46%	0.46	S	S	.	.	H	α-helix	trans	-68.9	-37.9	175.7	-70.8	-5	0	0	0	111.8	E174 A205 L206 T207 K212 K213	E174-N209 PolarHBondContact OE1-ND2 3.34Å; E174-N209 PolarHBondContact OE1-OD1 2.9Å; A205-N209 VanDerWaalsContact O-CB 3.3Å; A205-N209 WeakPolarHBondContact O-CB 3.37Å; A205-N209 PolarHBondContact O-N 3.38Å; A205-N209 PolarHBondContact O-ND2 2.91Å; A205-N209 PolarHBondContact O-OD1 3.06Å; L206-N209 PolarHBondContact O-N 2.94Å; T207-N209 VanDerWaalsContact C-N 3.33Å; T207-N209 PolarHBondContact O-N 3.39Å; N209-K212 WeakPolarHBondContact OD1-CE 3.41Å; N209-K212 PolarHBondContact OD1-NZ 3.37Å; N209-K213 WeakPolarHBondContact O-CB 3.43Å; N209-K213 VanDerWaalsContact O-CG 3.26Å; N209-K213 WeakPolarHBondContact O-CG 3.49Å; N209-K213 PolarHBondContact O-N 3.29Å
210	I	75.6	Confident	67.6	Low	107 Å²	107	93.3 Å²	93.3	55%	0.549	48%	0.477	S	S	.	.	H	α-helix	trans	-63.7	-46.7	171.9	-65.3	163	0	0	0	110.4	L206 T207 K213 F214	L206-I210 HydrophobicContact CG-CD1 4.42Å; L206-I210 WeakPolarHBondContact O-CG1 3.31Å; L206-I210 PolarHBondContact O-N 3.07Å; T207-I210 PolarHBondContact O-N 3.04Å; I210-K213 PolarHBondContact O-N 3.5Å; I210-F214 PolarHBondContact O-N 3.11Å
211	F	76.6	Confident	67.7	Low	124 Å²	124	93 Å²	93	54%	0.544	48%	0.475	S	S	.	.	H	α-helix	trans	-62.2	-44.7	178	-177.8	-108.4	0	0	0	112.6	T207 A208 K213 F214 L215	T207-F211 WeakPolarHBondContact O-CB 3.37Å; T207-F211 PolarHBondContact O-N 3.32Å; A208-F211 PolarHBondContact O-N 3.03Å; F211-K213 VanDerWaalsContact C-N 3.33Å; F211-K213 PolarHBondContact O-N 3.3Å; F211-F214 PolarHBondContact O-N 2.57Å; F211-L215 HydrophobicContact CD1-CD1 3.99Å; F211-L215 HydrophobicContact CD1-CG 4.47Å; F211-L215 HydrophobicContact CE1-CD1 3.42Å; F211-L215 VanDerWaalsContact CE1-CD1 3.42Å; F211-L215 HydrophobicContact CE1-CG 4.16Å; F211-L215 HydrophobicContact CE2-CD1 4.36Å; F211-L215 HydrophobicContact CE2-CD2 4.47Å; F211-L215 HydrophobicContact CE2-CG 4.33Å; F211-L215 HydrophobicContact CZ-CD1 3.64Å; F211-L215 HydrophobicContact CZ-CD2 4.34Å; F211-L215 HydrophobicContact CZ-CG 4.08Å; F211-L215 WeakPolarHBondContact O-CG 3.38Å; F211-L215 PolarHBondContact O-N 2.84Å
212	K	74.9	Confident	67.6	Low	56 Å²	56	97.9 Å²	97.9	24%	0.243	48%	0.481	C	S	.	.	H	α-helix	trans	-60	-40.3	173.1	-75	-177.6	-64.3	167.2	0	112.1	L170 E174 A208 N209 R216	L170-K212 HydrophobicContact CD2-CG 3.91Å; E174-K212 IonicContact OE1-NZ 3.7Å; A208-K212 WeakPolarHBondContact O-CB 3.43Å; A208-K212 WeakPolarHBondContact O-CE 3.41Å; A208-K212 VanDerWaalsContact O-CG 3.24Å; A208-K212 WeakPolarHBondContact O-CG 3.29Å; A208-K212 PolarHBondContact O-N 3.48Å; N209-K212 WeakPolarHBondContact OD1-CE 3.41Å; N209-K212 PolarHBondContact OD1-NZ 3.37Å; K212-R216 WeakPolarHBondContact O-CB 3.46Å; K212-R216 WeakPolarHBondContact O-CG 3.47Å; K212-R216 PolarHBondContact O-N 3.48Å
213	K	71.1	Confident	67.1	Low	133 Å²	133	97 Å²	97	58%	0.578	49%	0.486	S	S	*	.	H	α-helix	trans	-65.5	-41.3	175.4	-76.7	175.3	-179.4	-176	0	111.8	N209 I210 F211 R216 S217	N209-K213 WeakPolarHBondContact O-CB 3.43Å; N209-K213 VanDerWaalsContact O-CG 3.26Å; N209-K213 WeakPolarHBondContact O-CG 3.49Å; N209-K213 PolarHBondContact O-N 3.29Å; I210-K213 PolarHBondContact O-N 3.5Å; F211-K213 VanDerWaalsContact C-N 3.33Å; F211-K213 PolarHBondContact O-N 3.3Å; K213-R216 WeakPolarHBondContact O-CB 3.44Å; K213-R216 PolarHBondContact O-N 3.04Å; K213-S217 PolarHBondContact O-N 2.94Å; K213-S217 PolarHBondContact O-OG 2.95Å
214	F	75.4	Confident	66.9	Low	125 Å²	125	97.7 Å²	97.7	55%	0.548	49%	0.489	S	S	.	.	H	α-helix	trans	-63	-48.8	175.1	-177.2	-101.1	0	0	0	112.1	I210 F211 R216 S217 V218	I210-F214 PolarHBondContact O-N 3.11Å; F211-F214 PolarHBondContact O-N 2.57Å; F214-R216 PolarHBondContact O-N 3.48Å; F214-S217 WeakPolarHBondContact CA-OG 3.39Å; F214-S217 PolarHBondContact O-N 3.02Å; F214-S217 PolarHBondContact O-OG 3.42Å; F214-V218 HydrophobicContact CD1-CG2 4.3Å; F214-V218 HydrophobicContact CE1-CG2 3.91Å; F214-V218 HydrophobicContact CE2-CG2 4.13Å; F214-V218 HydrophobicContact CZ-CG2 3.82Å; F214-V218 WeakPolarHBondContact O-CG2 3.46Å; F214-V218 PolarHBondContact O-N 3.5Å
215	L	75.4	Confident	66.3	Low	55 Å²	55	96.3 Å²	96.3	29%	0.288	49%	0.488	S	S	.	.	H	α-helix	trans	-63.3	-26.5	175.7	-69	-174.3	0	0	0	113.4	L170 F211	L170-L215 HydrophobicContact CD1-CB 3.96Å; L170-L215 HydrophobicContact CD1-CD1 3.91Å; L170-L215 HydrophobicContact CD2-CD1 4.41Å; F211-L215 HydrophobicContact CD1-CD1 3.99Å; F211-L215 HydrophobicContact CD1-CG 4.47Å; F211-L215 HydrophobicContact CE1-CD1 3.42Å; F211-L215 VanDerWaalsContact CE1-CD1 3.42Å; F211-L215 HydrophobicContact CE1-CG 4.16Å; F211-L215 HydrophobicContact CE2-CD1 4.36Å; F211-L215 HydrophobicContact CE2-CD2 4.47Å; F211-L215 HydrophobicContact CE2-CG 4.33Å; F211-L215 HydrophobicContact CZ-CD1 3.64Å; F211-L215 HydrophobicContact CZ-CD2 4.34Å; F211-L215 HydrophobicContact CZ-CG 4.08Å; F211-L215 WeakPolarHBondContact O-CG 3.38Å; F211-L215 PolarHBondContact O-N 2.84Å
216	R	69.7	Low	65.9	Low	110 Å²	110	100.8 Å²	100.8	42%	0.415	51%	0.505	S	S	.	.	H	α-helix	trans	-71.9	-45.3	168.2	-80.9	177.4	133.4	97.6	-1.6	112.1	L170 D171 K212 K213 F214 V218 R219	L170-R216 PolarHBondContact O-NH1 3.03Å; D171-R216 IonicContact OD1-CZ 2.57Å; D171-R216 VanDerWaalsContact OD1-CZ 3.23Å; D171-R216 IonicContact OD1-NE 3.33Å; D171-R216 IonicContact OD1-NH1 2.84Å; D171-R216 IonicContact OD1-NH2 3.74Å; D171-R216 PolarHBondContact OD1-NH2 3.43Å; K212-R216 WeakPolarHBondContact O-CB 3.46Å; K212-R216 WeakPolarHBondContact O-CG 3.47Å; K212-R216 PolarHBondContact O-N 3.48Å; K213-R216 WeakPolarHBondContact O-CB 3.44Å; K213-R216 PolarHBondContact O-N 3.04Å; F214-R216 PolarHBondContact O-N 3.48Å; R216-V218 VanDerWaalsContact C-N 3.28Å; R216-V218 PolarHBondContact O-N 3.34Å; R216-R219 PolarHBondContact O-N 2.94Å
217	S	66.5	Low	65.6	Low	89 Å²	89	104.1 Å²	104.1	62%	0.622	51%	0.514	S	S	*	.	H	α-helix	trans	-68.8	-23.1	-178.7	58.1	0	0	0	0	114.5	K213 F214 R219	K213-S217 PolarHBondContact O-N 2.94Å; K213-S217 PolarHBondContact O-OG 2.95Å; F214-S217 WeakPolarHBondContact CA-OG 3.39Å; F214-S217 PolarHBondContact O-N 3.02Å; F214-S217 PolarHBondContact O-OG 3.42Å; S217-R219 VanDerWaalsContact C-N 3.34Å
218	V	62.2	Low	64.9	Low	95 Å²	95	106.4 Å²	106.4	58%	0.576	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-12.8	176.2	175.3	0	0	0	0	112	F214 R216	F214-V218 HydrophobicContact CD1-CG2 4.3Å; F214-V218 HydrophobicContact CE1-CG2 3.91Å; F214-V218 HydrophobicContact CE2-CG2 4.13Å; F214-V218 HydrophobicContact CZ-CG2 3.82Å; F214-V218 WeakPolarHBondContact O-CG2 3.46Å; F214-V218 PolarHBondContact O-N 3.5Å; R216-V218 VanDerWaalsContact C-N 3.28Å; R216-V218 PolarHBondContact O-N 3.34Å
219	R	62.6	Low	63.9	Low	69 Å²	69	113.5 Å²	113.5	26%	0.26	54%	0.541	S	S	.	.	S	Bend	trans	-76.4	135.5	169.9	-76.2	-165.9	174.5	81.8	4.3	110.7	A163 V166 R216 S217 D221	A163-R219 PolarHBondContact O-NE 2.94Å; A163-R219 PolarHBondContact O-NH2 3.48Å; V166-R219 PolarHBondContact O-NH2 3.24Å; R216-R219 PolarHBondContact O-N 2.94Å; S217-R219 VanDerWaalsContact C-N 3.34Å; R219-D221 PolarHBondContact O-N 3.32Å
220	P	58.1	Low	63.1	Low	104 Å²	104	115.9 Å²	115.9	68%	0.675	56%	0.559	S	S	*	*			trans	-53.9	125.2	158.3	-22.6	34.2	0	0	0	109.3	R222 L225	P220-R222 PolarHBondContact O-N 2.86Å; P220-R222 VanDerWaalsContact O-N 3.09Å; P220-L225 HydrophobicContact CB-CD1 4.45Å
221	D	63.1	Low	61.9	Low	70 Å²	70	114.1 Å²	114.1	37%	0.374	57%	0.568	S	S	.	*			trans	-56.6	110.1	-173.5	-173.4	-11	0	0	0	111	R219 D223 R224 L225	R219-D221 PolarHBondContact O-N 3.32Å; D221-D223 PolarHBondContact O-N 3.04Å; D221-D223 PolarHBondContact OD1-N 2.92Å; D221-R224 HydrophobicContact CB-CB 4.09Å; D221-R224 HydrophobicContact CB-CG 3.76Å; D221-R224 WeakPolarHBondContact O-CA 3.11Å; D221-R224 WeakPolarHBondContact O-CB 3.33Å; D221-R224 PolarHBondContact O-N 3.42Å; D221-R224 WeakPolarHBondContact OD2-CG 3.43Å; D221-R224 IonicContact OD2-CZ 2.67Å; D221-R224 IonicContact OD2-NE 3.3Å; D221-R224 PolarHBondContact OD2-NE 3.45Å; D221-R224 IonicContact OD2-NH2 3.6Å; D221-L225 PolarHBondContact O-N 3.01Å
222	R	58.3	Low	60.1	Low	141 Å²	141	119.1 Å²	119.1	53%	0.532	58%	0.583	S	S	.	*	H	α-helix	trans	-59.2	-29.3	-176.9	-109.2	-179.7	65.5	-178.4	-3.1	112.1	P220 R224 L225 L226	P220-R222 PolarHBondContact O-N 2.86Å; P220-R222 VanDerWaalsContact O-N 3.09Å; R222-R224 VanDerWaalsContact C-N 3.34Å; R222-L225 PolarHBondContact O-N 2.73Å; R222-L226 PolarHBondContact O-N 3.41Å
223	D	56.9	Low	58.6	Low	111 Å²	111	122.8 Å²	122.8	59%	0.594	61%	0.61	S	S	*	*	H	α-helix	trans	-78.3	-19.2	177.5	-70.8	-29.2	0	0	0	112.8	D221 K227	D221-D223 PolarHBondContact O-N 3.04Å; D221-D223 PolarHBondContact OD1-N 2.92Å; D223-K227 WeakPolarHBondContact O-CG 3.38Å; D223-K227 PolarHBondContact O-N 3Å
224	R	57.8	Low	57	Low	163 Å²	163	121.8 Å²	121.8	62%	0.615	62%	0.615	S	S	*	*	H	α-helix	trans	-76.8	-41.2	167.9	-66	-180	-158.2	-143.3	-1.3	111.3	D221 R222 L226 K227 E228	D221-R224 HydrophobicContact CB-CB 4.09Å; D221-R224 HydrophobicContact CB-CG 3.76Å; D221-R224 WeakPolarHBondContact O-CA 3.11Å; D221-R224 WeakPolarHBondContact O-CB 3.33Å; D221-R224 PolarHBondContact O-N 3.42Å; D221-R224 WeakPolarHBondContact OD2-CG 3.43Å; D221-R224 IonicContact OD2-CZ 2.67Å; D221-R224 IonicContact OD2-NE 3.3Å; D221-R224 PolarHBondContact OD2-NE 3.45Å; D221-R224 IonicContact OD2-NH2 3.6Å; R222-R224 VanDerWaalsContact C-N 3.34Å; R224-L226 PolarHBondContact O-N 2.74Å; R224-K227 PolarHBondContact O-N 3.38Å; R224-E228 WeakPolarHBondContact O-CB 3.47Å; R224-E228 PolarHBondContact O-N 2.92Å
225	L	52.9	Low	55.3	Low	122 Å²	122	121.3 Å²	121.3	64%	0.639	62%	0.624	S	S	*	*	H	α-helix	trans	-63.6	-25.4	176.5	-78.7	161	0	0	0	113.6	P220 D221 R222	P220-L225 HydrophobicContact CB-CD1 4.45Å; D221-L225 PolarHBondContact O-N 3.01Å; R222-L225 PolarHBondContact O-N 2.73Å
226	L	54.6	Low	53.5	Low	140 Å²	140	126.9 Å²	126.9	73%	0.733	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-17.1	172.4	-71.4	174.3	0	0	0	114.1	R222 R224	R222-L226 PolarHBondContact O-N 3.41Å; R224-L226 PolarHBondContact O-N 2.74Å
227	K	56.1	Low	52	Low	185 Å²	185	128 Å²	128	80%	0.804	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-34	178	-75	179.4	177.6	174.5	0	113.2	D223 R224 K229	D223-K227 WeakPolarHBondContact O-CG 3.38Å; D223-K227 PolarHBondContact O-N 3Å; R224-K227 PolarHBondContact O-N 3.38Å; K227-K229 PolarHBondContact O-N 3.28Å
228	E	54.8	Low	50.8	Low	141 Å²	141	128.7 Å²	128.7	66%	0.659	67%	0.672	S	S	*	*			trans	-92.2	81.8	173.1	-65.6	-168	-166.7	0	0	109.5	R224 P230	R224-E228 WeakPolarHBondContact O-CB 3.47Å; R224-E228 PolarHBondContact O-N 2.92Å; E228-P230 VanDerWaalsContact O-CD 3.24Å; E228-P230 WeakPolarHBondContact O-CD 3.44Å
229	K	48.5	Very low	49.5	Very low	194 Å²	194	131.2 Å²	131.2	84%	0.843	68%	0.678	S	S	*	*			trans	-63.7	120.1	158.2	-113.5	-163.5	173.3	-168.6	0	107.9	K227 G231	K227-K229 PolarHBondContact O-N 3.28Å; K229-G231 PolarHBondContact O-N 3.38Å; K229-G231 VanDerWaalsContact O-N 3.14Å
230	P	53.8	Low	48.2	Very low	99 Å²	99	133.7 Å²	133.7	64%	0.643	70%	0.703	S	S	*	*			trans	-61.2	121.4	166.6	-19.2	33.4	0	0	0	107.9	E228 W232	E228-P230 VanDerWaalsContact O-CD 3.24Å; E228-P230 WeakPolarHBondContact O-CD 3.44Å; P230-W232 VanDerWaalsContact C-N 3.3Å; P230-W232 PolarHBondContact O-N 2.92Å
231	G	50.1	Low	47.2	Very low	71 Å²	71	138.6 Å²	138.6	73%	0.732	71%	0.708	S	S	*	*			trans	-70.5	82.5	-177.5	0	0	0	0	0	111.6	K229 V233	K229-G231 PolarHBondContact O-N 3.38Å; K229-G231 VanDerWaalsContact O-N 3.14Å; G231-V233 PolarHBondContact O-N 2.97Å
232	W	38.6	Very low	45.8	Very low	228 Å²	228	141.5 Å²	141.5	86%	0.864	73%	0.728	S	S	*	*			trans	-68.7	85	164	-74.3	94.6	0	0	0	109.2	P230 T234	P230-W232 VanDerWaalsContact C-N 3.3Å; P230-W232 PolarHBondContact O-N 2.92Å; W232-T234 PolarHBondContact O-N 3.45Å
233	V	44.3	Very low	44.7	Very low	134 Å²	134	138.2 Å²	138.2	81%	0.812	74%	0.739	S	S	*	*			trans	-63.8	110.2	161.6	173.9	0	0	0	0	107.1	G231	G231-V233 PolarHBondContact O-N 2.97Å
234	T	37.1	Very low	43.6	Very low	112 Å²	112	143.3 Å²	143.3	69%	0.687	75%	0.75	S	S	*	*			trans	-115.4	129.7	164.7	-55.5	0	0	0	0	107.6	W232	W232-T234 PolarHBondContact O-N 3.45Å
235	P	40.2	Very low	42.6	Very low	114 Å²	114	142.5 Å²	142.5	74%	0.74	76%	0.756	S	S	*	*			trans	-63.3	154.3	-176	24	-33.5	0	0	0	113	V237	P235-V237 PolarHBondContact O-N 3.44Å
236	M	37.9	Very low	41.7	Very low	172 Å²	172	144 Å²	144	85%	0.847	76%	0.76	S	S	*	*			trans	-52	131.3	-172.1	-73.7	178	64.6	0	0	114.7
237	V	37.4	Very low	41	Very low	134 Å²	134	145.8 Å²	145.8	81%	0.812	76%	0.762	S	S	*	*			trans	-129.3	121	139.4	179.8	0	0	0	0	107.1	P235 E239	P235-V237 PolarHBondContact O-N 3.44Å; V237-E239 PolarHBondContact O-N 3.41Å
238	P	40.8	Very low	39.9	Very low	104 Å²	104	143.5 Å²	143.5	68%	0.675	76%	0.763	S	S	*	*			trans	-74.9	108.5	176.3	28.5	-31.7	0	0	0	110.7	P240	P238-P240 WeakPolarHBondContact O-CD 3.38Å
239	E	36	Very low	39.1	Very low	147 Å²	147	145.9 Å²	145.9	69%	0.687	77%	0.771	S	S	*	*			trans	-79.8	118.4	166.9	-170.9	-154.4	-170.6	0	0	109.7	V237 R241	V237-E239 PolarHBondContact O-N 3.41Å; E239-R241 PolarHBondContact O-N 3.02Å; E239-R241 VanDerWaalsContact O-N 3.1Å; E239-R241 IonicContact OE2-NE 3.8Å
240	P	35.3	Very low	38.7	Very low	122 Å²	122	144.5 Å²	144.5	79%	0.792	77%	0.766	S	S	*	*			trans	-80.1	92	173.7	32.3	-33.1	0	0	0	110.7	P238 T242	P238-P240 WeakPolarHBondContact O-CD 3.38Å; P240-T242 PolarHBondContact O-N 3.02Å
241	R	37.8	Very low	37.6	Very low	206 Å²	206	150.4 Å²	150.4	78%	0.777	78%	0.775	S	S	*	*			trans	-68.2	112.3	162.7	-72.3	-171.9	174.1	-160.8	-2.4	110.4	E239	E239-R241 PolarHBondContact O-N 3.02Å; E239-R241 VanDerWaalsContact O-N 3.1Å; E239-R241 IonicContact OE2-NE 3.8Å
242	T	33.8	Very low	37	Very low	131 Å²	131	152.1 Å²	152.1	80%	0.804	78%	0.775	S	S	*	*			trans	-157.6	109.1	146.6	-73.6	0	0	0	0	109.9	P240	P240-T242 PolarHBondContact O-N 3.02Å
243	G	35.2	Very low	37.3	Very low	73 Å²	73	149.2 Å²	149.2	75%	0.753	78%	0.776	S	S	*	*			trans	-91.6	117.2	159	0	0	0	0	0	109.9
244	R	33.7	Very low	37.1	Very low	218 Å²	218	148.9 Å²	148.9	82%	0.823	78%	0.78	S	S	*	*			trans	178.3	134.9	145.8	-99.6	170.1	-157.2	-84.4	1	110.7
245	L	36.6	Very low	37.6	Very low	145 Å²	145	153.6 Å²	153.6	76%	0.759	79%	0.791	S	S	*	*			trans	39	120.6	143.1	-82.5	89.6	0	0	0	117.8
246	Q	34.3	Very low	37.2	Very low	153 Å²	153	151.9 Å²	151.9	72%	0.715	79%	0.794	S	S	*	*				-168.1	159.4	55.8	-70.9	-162.9	35.9	0	0	113.1
247	K	38	Very low	37.2	Very low	179 Å²	179	149.7 Å²	149.7	78%	0.778	80%	0.795	S	S	*	*			trans	16.6	127	148.4	-54.4	177.3	-179.6	175.5	0	118.6
248	V	34.1	Very low	37	Very low	136 Å²	136	146.4 Å²	146.4	82%	0.824	79%	0.789	S	S	*	*				-175	133.7	94.5	151.6	0	0	0	0	112.1
249	K	38.2	Very low	36.8	Very low	191 Å²	191	149.9 Å²	149.9	83%	0.83	80%	0.796	S	S	*	*			trans	-23.4	139.5	160.1	-165.2	155.1	175.3	168.6	0	117.1
250	K	40	Very low	37.3	Very low	166 Å²	166	151.5 Å²	151.5	72%	0.722	80%	0.801	S	S	*	*				143	116.8	108	-164.3	179.1	-174.1	-176.3	0	115
251	R	31	Very low	38.3	Very low	223 Å²	223	150.7 Å²	150.7	84%	0.842	80%	0.796	S	S	*	*			trans	59.2	157.7	156.3	-78.2	-177	-177.7	170.3	0.3	116.7
252	S	35.8	Very low	38.4	Very low	106 Å²	106	149.8 Å²	149.8	74%	0.741	80%	0.798	S	S	*	*			cis	-155.4	167.2	-0	22.7	0	0	0	0	110.6
253	L	46.7	Very low	39.2	Very low	167 Å²	167	149.2 Å²	149.2	87%	0.874	80%	0.796	S	S	*	*			trans	-45.6	146.5	162.8	-63.3	132.5	0	0	0	113.5
254	S	39.5	Very low	39.1	Very low	127 Å²	127	148.8 Å²	148.8	89%	0.888	79%	0.792	S	S	*	*				-156.4	154.1	126.2	50	0	0	0	0	111.2
255	K	48	Very low	39.1	Very low	211 Å²	211	145.9 Å²	145.9	92%	0.917	80%	0.799	S	S	*	*			trans	-133.7	153	-169	176.2	179.4	178.9	179.2	0	108.3
256	G	31.9	Very low	39	Very low	78 Å²	78	142.6 Å²	142.6	80%	0.804	80%	0.8	S	S	*	*			trans	94.7	159.8	-174.6	0	0	0	0	0	111.4
257	S	36.9	Very low	39.1	Very low	126 Å²	126	143.5 Å²	143.5	88%	0.881	80%	0.804	S	S	*	*			cis	-149.4	142.6	2.7	-169.5	0	0	0	0	104.9
258	G	33.3	Very low	39	Very low	66 Å²	66	141.5 Å²	141.5	68%	0.68	80%	0.797	S	S	*	*				104.8	129	51.3	0	0	0	0	0	109.7
259	H	37.1	Very low	39.1	Very low	177 Å²	177	143.6 Å²	143.6	82%	0.819	79%	0.79	S	S	*	*			trans	90.2	113.6	164.2	-144.7	-103.8	0	0	0	120.4
260	F	46.7	Very low	38.8	Very low	180 Å²	180	143.8 Å²	143.8	79%	0.789	79%	0.785	S	S	*	*			trans	-80.9	153.4	154	-91.8	-95.2	0	0	0	109.9
261	P	55.1	Low	38.3	Very low	106 Å²	106	139.1 Å²	139.1	69%	0.688	79%	0.785	S	S	*	*			trans	-138.9	140.8	131.5	32.9	-18.7	0	0	0	114.8
262	F	39.9	Very low	38.4	Very low	187 Å²	187	137.5 Å²	137.5	82%	0.82	79%	0.787	S	S	*	*			trans	-80.5	161.1	154.7	-90.6	-91.3	0	0	0	110.3
263	P	51.5	Low	38.2	Very low	119 Å²	119	139.6 Å²	139.6	77%	0.773	79%	0.79	S	S	*	*			trans	-133.3	153.8	130.5	35.5	-24.8	0	0	0	113.9
264	G	32.4	Very low	38.8	Very low	64 Å²	64	137 Å²	137	66%	0.66	78%	0.783	S	S	*	*			trans	-76.3	-165.1	160	0	0	0	0	0	111.3
265	T	35	Very low	39.6	Very low	157 Å²	157	135.9 Å²	135.9	96%	0.963	77%	0.773	S	S	*	*			cis	-168.1	158.1	11.8	-3	0	0	0	0	107.6
266	G	32.9	Very low	38.7	Very low	76 Å²	76	131.8 Å²	131.8	78%	0.784	77%	0.766	S	S	*	*			trans	173.1	98.7	171	0	0	0	0	0	115.5
267	E	36.7	Very low	38.6	Very low	172 Å²	172	133.1 Å²	133.1	80%	0.804	76%	0.762	S	S	*	*			trans	-77.4	178.6	170.1	-58.7	-177.3	92.2	0	0	110.8
268	H	36.2	Very low	38.7	Very low	136 Å²	136	133.1 Å²	133.1	63%	0.63	76%	0.761	S	S	*	*			cis	179.6	155.7	40	-151	-177.2	0	0	0	112.7
269	R	37.1	Very low	39.4	Very low	180 Å²	180	136.2 Å²	136.2	68%	0.679	77%	0.769	S	S	*	*			trans	79.8	148.8	151.2	-60.1	-126.3	-85.1	-139.9	-4	119.1
270	R	30.3	Very low	39.3	Very low	195 Å²	195	137.3 Å²	137.3	74%	0.736	77%	0.772	S	S	*	*			cis	-169.7	151	1.5	148.6	-156.8	-58.9	-87.4	15.1	111.9
271	G	31.3	Very low	38.7	Very low	69 Å²	69	132.8 Å²	132.8	71%	0.711	77%	0.767	S	S	*	*			trans	83.5	147.1	155.1	0	0	0	0	0	116.2
272	E	31.1	Very low	38.4	Very low	188 Å²	188	135.7 Å²	135.7	88%	0.879	78%	0.776	S	S	*	*			cis	-155.7	172.5	6.5	-151.2	161.1	123.7	0	0	110.7
273	N	33	Very low	38.2	Very low	150 Å²	150	134.5 Å²	134.5	80%	0.802	77%	0.773	S	S	*	*			trans	-146.8	-179.3	-174.5	-81.2	-79.4	0	0	0	109.8
274	P	59.7	Low	37.8	Very low	113 Å²	113	133.8 Å²	133.8	73%	0.734	77%	0.769	S	S	*	*			cis	-119.6	-107.1	-40.2	28.2	-6.7	0	0	0	110.3
275	P	55.6	Low	38.4	Very low	103 Å²	103	135.9 Å²	135.9	67%	0.669	77%	0.773	S	S	*	*				-125.7	176.4	-59.7	31	-11.2	0	0	0	115.8
276	T	29.2	Very low	39.3	Very low	126 Å²	126	134.2 Å²	134.2	77%	0.773	77%	0.765	S	S	*	*				132.5	136.1	128.8	-44.8	0	0	0	0	117.8
277	S	29.3	Very low	40.3	Very low	105 Å²	105	136.8 Å²	136.8	73%	0.734	77%	0.771	S	S	*	*			trans	93.1	118.8	158.3	77.7	0	0	0	0	119.9
278	C	39	Very low	41.2	Very low	126 Å²	126	131.6 Å²	131.6	85%	0.851	76%	0.764	S	S	*	*			trans	-92.9	153.3	145.1	-52.5	0	0	0	0	107.9
279	P	48.6	Very low	42.6	Very low	131 Å²	131	132.4 Å²	132.4	85%	0.851	77%	0.766	S	S	*	*				-135.4	-171.6	121.8	37.5	-26.7	0	0	0	113.7
280	K	34.4	Very low	44.2	Very low	201 Å²	201	127.5 Å²	127.5	87%	0.874	75%	0.753	S	S	*	*			trans	-105.3	155.2	-155.6	-167.9	179.4	-176.1	175.3	0	111.5
281	A	35	Very low	46.3	Very low	84 Å²	84	123.9 Å²	123.9	69%	0.694	75%	0.747	S	S	*	*			trans	92.3	136.2	150.1	0	0	0	0	0	121.1
282	L	47.7	Very low	47.8	Very low	167 Å²	167	127.4 Å²	127.4	87%	0.874	75%	0.75	S	S	*	*			trans	61.2	105.2	162.1	-83.2	77.1	0	0	0	120.1
283	E	36.2	Very low	49.6	Very low	162 Å²	162	123.1 Å²	123.1	76%	0.757	74%	0.736	S	S	*	*				-169.2	130	119.9	-110.9	-65.3	111.4	0	0	109.4	S285	E283-S285 PolarHBondContact O-N 3.01Å
284	P	43.6	Very low	51.6	Low	105 Å²	105	117.2 Å²	117.2	68%	0.682	71%	0.708	S	S	*	*			trans	-79.9	104.2	173.7	31.3	-30.6	0	0	0	110.4
285	S	44.9	Very low	51.6	Low	108 Å²	108	118 Å²	118	76%	0.755	71%	0.711	S	S	*	*			trans	-54.9	135.3	173.7	-50.6	0	0	0	0	111	E283 S287	E283-S285 PolarHBondContact O-N 3.01Å; S285-S287 PolarHBondContact O-N 3.22Å; S285-S287 VanDerWaalsContact O-N 3.13Å
286	P	52.7	Low	52	Low	122 Å²	122	123.9 Å²	123.9	79%	0.792	72%	0.72	S	S	*	*			trans	-65.4	117.6	175.5	26.7	-32.9	0	0	0	108.8	G288	P286-G288 PolarHBondContact O-N 2.97Å
287	S	55.6	Low	53.1	Low	129 Å²	129	127.8 Å²	127.8	90%	0.902	74%	0.743	S	S	*	*			trans	-75.9	61.8	172	66.2	0	0	0	0	110.5	S285	S285-S287 PolarHBondContact O-N 3.22Å; S285-S287 VanDerWaalsContact O-N 3.13Å
288	G	55.2	Low	54.3	Low	64 Å²	64	128.9 Å²	128.9	66%	0.66	74%	0.743	S	S	*	*			trans	-79.6	114.2	167.4	0	0	0	0	0	109.2	P286 D290	P286-G288 PolarHBondContact O-N 2.97Å; G288-D290 PolarHBondContact O-N 3.09Å
289	F	66.1	Low	55.1	Low	153 Å²	153	129.1 Å²	129.1	67%	0.671	74%	0.738	S	S	*	*			trans	-63.8	114.5	165.8	174.8	-93.8	0	0	0	108.3	I291 A294	F289-I291 HydrophobicContact CD1-CD1 3.89Å; F289-I291 HydrophobicContact CE1-CD1 4.23Å; F289-I291 PolarHBondContact O-N 3.28Å; F289-I291 VanDerWaalsContact O-N 3.15Å; F289-A294 HydrophobicContact CE1-CB 4.24Å; F289-A294 HydrophobicContact CZ-CB 4.1Å
290	D	70.4	Confident	55.4	Low	77 Å²	77	128.9 Å²	128.9	41%	0.412	73%	0.731	S	S	.	*			trans	-77.6	102.1	-179.4	-176.3	10.3	0	0	0	110.5	G288 N292 T293	G288-D290 PolarHBondContact O-N 3.09Å; D290-N292 PolarHBondContact O-N 3.07Å; D290-N292 WeakPolarHBondContact OD1-CB 3.46Å; D290-N292 PolarHBondContact OD1-N 3.09Å; D290-N292 PolarHBondContact OD1-ND2 3.18Å; D290-T293 HydrophobicContact CB-CG2 4.36Å; D290-T293 PolarHBondContact O-N 3.48Å; D290-T293 PolarHBondContact O-OG1 3.06Å
291	I	72.8	Confident	56.7	Low	118 Å²	118	124.7 Å²	124.7	61%	0.605	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-50.6	-29.7	175.5	-104.7	85.6	0	0	0	112.1	F289 T293 A294	F289-I291 HydrophobicContact CD1-CD1 3.89Å; F289-I291 HydrophobicContact CE1-CD1 4.23Å; F289-I291 PolarHBondContact O-N 3.28Å; F289-I291 VanDerWaalsContact O-N 3.15Å; I291-T293 PolarHBondContact O-N 2.9Å; I291-A294 WeakPolarHBondContact O-CB 3.32Å; I291-A294 PolarHBondContact O-N 3.36Å
292	N	63.1	Low	58	Low	144 Å²	144	127.3 Å²	127.3	77%	0.77	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-72.7	-13	-178.3	-54.3	-72.6	0	0	0	113.3	D290	D290-N292 PolarHBondContact O-N 3.07Å; D290-N292 WeakPolarHBondContact OD1-CB 3.46Å; D290-N292 PolarHBondContact OD1-N 3.09Å; D290-N292 PolarHBondContact OD1-ND2 3.18Å
293	T	68.8	Low	58.7	Low	98 Å²	98	124.6 Å²	124.6	60%	0.601	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-100.5	-1.1	174.7	63.6	0	0	0	0	113.5	D290 I291 V295	D290-T293 HydrophobicContact CB-CG2 4.36Å; D290-T293 PolarHBondContact O-N 3.48Å; D290-T293 PolarHBondContact O-OG1 3.06Å; I291-T293 PolarHBondContact O-N 2.9Å; T293-V295 PolarHBondContact O-N 3.4Å
294	A	74.8	Confident	60.3	Low	26 Å²	26	121.9 Å²	121.9	22%	0.215	71%	0.712	C	S	.	*			trans	-72.5	97.4	-179.8	0	0	0	0	0	111.5	F289 I291 W296	F289-A294 HydrophobicContact CE1-CB 4.24Å; F289-A294 HydrophobicContact CZ-CB 4.1Å; I291-A294 WeakPolarHBondContact O-CB 3.32Å; I291-A294 PolarHBondContact O-N 3.36Å; A294-W296 HydrophobicContact CB-CZ2 4.15Å; A294-W296 PolarHBondContact O-N 3.34Å; A294-W296 PolarHBondContact O-NE1 3.19Å
295	V	61.5	Low	61.6	Low	130 Å²	130	123.2 Å²	123.2	79%	0.788	71%	0.714	S	S	*	*			trans	-77.1	110.9	164.5	-178.8	0	0	0	0	108.2	T293	T293-V295 PolarHBondContact O-N 3.4Å
296	W	63.8	Low	63	Low	225 Å²	225	124.5 Å²	124.5	85%	0.852	71%	0.711	S	S	*	*			trans	-80.2	129.5	174.8	-53.9	88	0	0	0	109.3	A294	A294-W296 HydrophobicContact CB-CZ2 4.15Å; A294-W296 PolarHBondContact O-N 3.34Å; A294-W296 PolarHBondContact O-NE1 3.19Å
297	V	51.4	Low	64	Low	208 Å²	208	124.7 Å²	124.7	100%	1.261	70%	0.703	S	S	*	*			trans	-111	0	178	-177.9	0	0	0	0	109.1

Retrieved 297 of 297 residues in 241 ms (Link to these results)

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