A0A096LT09_POEFO Loading...

Plakophilin 4

AlphaFold DB , UniProt , Accession A0A096LT09, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 643 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	46.4	Very low	38.6	Very low	214 Å²	214	134.6 Å²	134.6	100%	1.054	77%	0.771	S	S	*	*				0	152.3	0	-71.2	-174.9	76.9	0	0	108.5	A3	M1-A3 HydrophobicContact CE-CB 3.94Å
2	P	42	Very low	38.4	Very low	135 Å²	135	138.5 Å²	138.5	88%	0.877	78%	0.778	S	S	*	*			cis	-73.1	-169.9	26.2	29.7	-37.4	0	0	0	116.7
3	A	30	Very low	37.8	Very low	75 Å²	75	133.6 Å²	133.6	62%	0.62	78%	0.777	S	S	*	*			trans	-124	172.7	-152.3	0	0	0	0	0	112.9	M1	M1-A3 HydrophobicContact CE-CB 3.94Å
4	P	59.8	Low	37.7	Very low	118 Å²	118	135.6 Å²	135.6	77%	0.766	78%	0.782	S	S	*	*			trans	-92.2	169.5	-177.9	38.5	-34.9	0	0	0	113.1
5	E	31.1	Very low	37.4	Very low	154 Å²	154	137.4 Å²	137.4	72%	0.72	79%	0.787	S	S	*	*			trans	-164.8	117.9	146.3	-97.2	-63.5	81.2	0	0	109.7
6	Q	31.9	Very low	37.2	Very low	147 Å²	147	138.7 Å²	138.7	69%	0.687	79%	0.789	S	S	*	*				39.9	120	129	-64.2	-167.4	74	0	0	121.4
7	S	32.2	Very low	37.1	Very low	108 Å²	108	138.5 Å²	138.5	76%	0.755	79%	0.792	S	S	*	*				96.1	161	65.1	-71.7	0	0	0	0	112.4
8	P	46.9	Very low	37.1	Very low	108 Å²	108	140.1 Å²	140.1	70%	0.701	80%	0.795	S	S	*	*			cis	-139.4	173.8	12.6	44.1	-26.7	0	0	0	118.5
9	V	36.1	Very low	37.1	Very low	127 Å²	127	144.5 Å²	144.5	77%	0.77	80%	0.798	S	S	*	*			trans	67.2	131.6	141.8	159.2	0	0	0	0	119.2
10	T	33.4	Very low	37.2	Very low	108 Å²	108	144.5 Å²	144.5	66%	0.663	80%	0.797	S	S	*	*			cis	-156.4	139.9	2.4	13.3	0	0	0	0	114.2
11	E	34.5	Very low	37.2	Very low	187 Å²	187	143 Å²	143	87%	0.874	80%	0.797	S	S	*	*			trans	58.8	157.2	138.5	-72.6	178.9	-177.6	0	0	124.4
12	E	36.4	Very low	37.1	Very low	181 Å²	181	136.9 Å²	136.9	85%	0.846	77%	0.774	S	S	*	*			trans	-115.8	172.5	-164.3	-55.7	-172.5	154.4	0	0	113.9
13	G	30.8	Very low	37.5	Very low	75 Å²	75	134.5 Å²	134.5	77%	0.773	77%	0.766	S	S	*	*			trans	-159.6	84.7	171.4	0	0	0	0	0	113.3
14	L	36.3	Very low	38.2	Very low	162 Å²	162	133.4 Å²	133.4	85%	0.848	76%	0.762	S	S	*	*			trans	-71.1	130.9	177.6	-74.1	164.5	0	0	0	112
15	L	33.5	Very low	38	Very low	162 Å²	162	137.1 Å²	137.1	85%	0.848	76%	0.761	S	S	*	*			trans	-121	98.4	177.1	-151	178.5	0	0	0	110.3
16	L	33.9	Very low	38.9	Very low	158 Å²	158	136.1 Å²	136.1	83%	0.827	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-82	140.4	177.1	-85.2	165.6	0	0	0	112.1
17	T	36	Very low	39.9	Very low	135 Å²	135	135.5 Å²	135.5	83%	0.828	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-84.1	120.9	-175.7	38.5	0	0	0	0	112.6
18	I	36.2	Very low	41	Very low	167 Å²	167	136.7 Å²	136.7	86%	0.856	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-86.9	134	171	-62.7	176.3	0	0	0	109.2
19	R	38.1	Very low	41.7	Very low	225 Å²	225	135.5 Å²	135.5	85%	0.849	74%	0.737	S	S	*	*			trans	-106.3	150.9	178.1	-163.8	174.1	-176.5	176	0.6	110.9
20	D	38.2	Very low	43.1	Very low	144 Å²	144	133 Å²	133	77%	0.77	72%	0.72	S	S	*	*			trans	-59.3	129.6	-162.2	-60.1	-94.1	0	0	0	116.8
21	S	36.8	Very low	45.2	Very low	114 Å²	114	132.4 Å²	132.4	80%	0.797	71%	0.712	S	S	*	*			trans	-112.6	41.2	165.3	-63.1	0	0	0	0	111.3
22	S	45.2	Very low	47.6	Very low	84 Å²	84	127.3 Å²	127.3	59%	0.587	69%	0.694	S	S	*	*			trans	-95.9	-32.3	-167.1	-169.2	0	0	0	0	114.5	G24	S22-G24 PolarHBondContact O-N 3.4Å
23	A	49.7	Very low	49.8	Very low	85 Å²	85	121.4 Å²	121.4	70%	0.702	68%	0.676	S	S	*	*	H	α-helix	trans	-65	-39.5	-165.9	0	0	0	0	0	115.3	K26	A23-K26 PolarHBondContact O-N 2.66Å
24	G	46.1	Very low	52.4	Low	52 Å²	52	122.4 Å²	122.4	54%	0.536	66%	0.664	S	S	.	*	H	α-helix	trans	-61.5	-53.1	-171.5	0	0	0	0	0	113.9	S22 K26 M27	S22-G24 PolarHBondContact O-N 3.4Å; G24-K26 PolarHBondContact O-N 2.76Å; G24-M27 PolarHBondContact O-N 3.4Å
25	R	54.1	Low	55	Low	196 Å²	196	120.1 Å²	120.1	74%	0.74	65%	0.653	S	S	*	*	H	α-helix	trans	-63.2	-27.4	-176.9	-88.5	-173.2	-76.9	-139.6	-4.4	113.8	T29	R25-T29 PolarHBondContact O-N 3.42Å; R25-T29 PolarHBondContact O-OG1 3.44Å
26	K	51.1	Low	57.7	Low	133 Å²	133	117.4 Å²	117.4	58%	0.578	64%	0.638	S	S	*	*	H	α-helix	trans	-70.2	-38.7	-177.5	-155.7	-174.5	178.6	-167.4	0	112	A23 G24 E28 T29 D30	A23-K26 PolarHBondContact O-N 2.66Å; G24-K26 PolarHBondContact O-N 2.76Å; K26-E28 VanDerWaalsContact C-N 3.32Å; K26-E28 PolarHBondContact O-N 3.36Å; K26-T29 WeakPolarHBondContact CA-OG1 3.41Å; K26-T29 PolarHBondContact O-N 3.28Å; K26-T29 PolarHBondContact O-OG1 3.28Å; K26-D30 WeakPolarHBondContact O-CB 3.39Å; K26-D30 PolarHBondContact O-N 3.27Å
27	M	51.9	Low	60.5	Low	134 Å²	134	114.3 Å²	114.3	66%	0.66	62%	0.621	S	S	*	*	H	α-helix	trans	-68.1	-31.6	-179.2	-165.1	160.3	64	0	0	112.5	G24 N31	G24-M27 PolarHBondContact O-N 3.4Å; M27-N31 WeakPolarHBondContact O-CB 3.38Å; M27-N31 VanDerWaalsContact O-CG 3.3Å; M27-N31 PolarHBondContact O-N 3.5Å; M27-N31 VanDerWaalsContact O-N 3.09Å; M27-N31 PolarHBondContact O-ND2 2.81Å
28	E	55.6	Low	63.1	Low	134 Å²	134	110.6 Å²	110.6	63%	0.626	60%	0.604	S	S	*	*	H	α-helix	trans	-72.9	-41.3	173.7	-64.5	-178.6	131.9	0	0	112.5	K26 T32	K26-E28 VanDerWaalsContact C-N 3.32Å; K26-E28 PolarHBondContact O-N 3.36Å; E28-T32 WeakPolarHBondContact O-CB 3.27Å; E28-T32 PolarHBondContact O-N 3.06Å; E28-T32 PolarHBondContact O-OG1 3.15Å
29	T	61.3	Low	65.8	Low	82 Å²	82	105 Å²	105	50%	0.503	58%	0.581	S	S	.	*	H	α-helix	trans	-65.7	-40.9	175.4	52.4	0	0	0	0	111.9	R25 K26 T32 A33	R25-T29 PolarHBondContact O-N 3.42Å; R25-T29 PolarHBondContact O-OG1 3.44Å; K26-T29 WeakPolarHBondContact CA-OG1 3.41Å; K26-T29 PolarHBondContact O-N 3.28Å; K26-T29 PolarHBondContact O-OG1 3.28Å; T29-T32 PolarHBondContact O-N 3.22Å; T29-A33 WeakPolarHBondContact O-CB 3.24Å; T29-A33 PolarHBondContact O-N 3.07Å
30	D	66.4	Low	68.5	Low	76 Å²	76	97.2 Å²	97.2	41%	0.406	56%	0.558	S	S	.	*	H	α-helix	trans	-68.8	-40.9	-178.9	-64.9	-8.2	0	0	0	110.4	K26 A33 N34	K26-D30 WeakPolarHBondContact O-CB 3.39Å; K26-D30 PolarHBondContact O-N 3.27Å; D30-A33 PolarHBondContact O-N 3.18Å; D30-N34 WeakPolarHBondContact O-CB 3.21Å; D30-N34 VanDerWaalsContact O-CG 3.23Å; D30-N34 PolarHBondContact O-N 3.31Å; D30-N34 PolarHBondContact O-ND2 3.09Å; D30-N34 VanDerWaalsContact O-ND2 3.08Å
31	N	77.8	Confident	71.2	Confident	94 Å²	94	96.3 Å²	96.3	50%	0.503	55%	0.547	S	S	.	.	H	α-helix	trans	-62.1	-41.2	170.7	-80	-14.8	0	0	0	112.8	M27 N34 N35	M27-N31 WeakPolarHBondContact O-CB 3.38Å; M27-N31 VanDerWaalsContact O-CG 3.3Å; M27-N31 PolarHBondContact O-N 3.5Å; M27-N31 VanDerWaalsContact O-N 3.09Å; M27-N31 PolarHBondContact O-ND2 2.81Å; N31-N34 PolarHBondContact O-N 3.06Å; N31-N35 PolarHBondContact O-N 3.18Å; N31-N35 PolarHBondContact O-ND2 3.11Å; N31-N35 VanDerWaalsContact O-ND2 3.12Å
32	T	83.5	Confident	73.9	Confident	81 Å²	81	96.4 Å²	96.4	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-64.7	-43.7	177.9	-56.2	0	0	0	0	111.2	E28 T29 N35 I36	E28-T32 WeakPolarHBondContact O-CB 3.27Å; E28-T32 PolarHBondContact O-N 3.06Å; E28-T32 PolarHBondContact O-OG1 3.15Å; T29-T32 PolarHBondContact O-N 3.22Å; T32-N35 PolarHBondContact O-N 2.96Å; T32-I36 HydrophobicContact CG2-CD1 4.14Å; T32-I36 WeakPolarHBondContact O-CG1 3.38Å; T32-I36 PolarHBondContact O-N 2.87Å
33	A	82.9	Confident	76.3	Confident	56 Å²	56	98.3 Å²	98.3	46%	0.463	53%	0.534	S	S	.	.	H	α-helix	trans	-63.3	-40.9	175.7	0	0	0	0	0	112.3	T29 D30 I36 L37	T29-A33 WeakPolarHBondContact O-CB 3.24Å; T29-A33 PolarHBondContact O-N 3.07Å; D30-A33 PolarHBondContact O-N 3.18Å; A33-I36 PolarHBondContact O-N 3.2Å; A33-L37 WeakPolarHBondContact O-CB 3.19Å; A33-L37 PolarHBondContact O-N 3.4Å
34	N	86.5	Confident	78.5	Confident	96 Å²	96	100 Å²	100	51%	0.513	53%	0.528	S	S	.	.	H	α-helix	trans	-63.4	-42	175.5	-74.7	-34.1	0	0	0	112.3	D30 N31 L37 A38	D30-N34 WeakPolarHBondContact O-CB 3.21Å; D30-N34 VanDerWaalsContact O-CG 3.23Å; D30-N34 PolarHBondContact O-N 3.31Å; D30-N34 PolarHBondContact O-ND2 3.09Å; D30-N34 VanDerWaalsContact O-ND2 3.08Å; N31-N34 PolarHBondContact O-N 3.06Å; N34-L37 PolarHBondContact O-N 2.9Å; N34-A38 WeakPolarHBondContact O-CB 3.46Å; N34-A38 PolarHBondContact O-N 3.25Å
35	N	89.8	Confident	80.9	Confident	115 Å²	115	102.6 Å²	102.6	62%	0.615	53%	0.529	S	S	*	.	H	α-helix	trans	-64.1	-40.8	175.6	-75.2	-39.3	0	0	0	112.2	N31 T32 A38 S39	N31-N35 PolarHBondContact O-N 3.18Å; N31-N35 PolarHBondContact O-ND2 3.11Å; N31-N35 VanDerWaalsContact O-ND2 3.12Å; T32-N35 PolarHBondContact O-N 2.96Å; N35-A38 PolarHBondContact O-N 3.31Å; N35-S39 WeakPolarHBondContact O-CB 3.27Å; N35-S39 PolarHBondContact O-N 2.69Å
36	I	91.4	Very high	82.8	Confident	105 Å²	105	97.9 Å²	97.9	54%	0.538	52%	0.515	S	S	.	.	H	α-helix	trans	-62.9	-46.9	174.3	-67.9	165.1	0	0	0	110.3	T32 A33 A38 S39 V40	T32-I36 HydrophobicContact CG2-CD1 4.14Å; T32-I36 WeakPolarHBondContact O-CG1 3.38Å; T32-I36 PolarHBondContact O-N 2.87Å; A33-I36 PolarHBondContact O-N 3.2Å; I36-A38 VanDerWaalsContact C-N 3.33Å; I36-A38 PolarHBondContact O-N 3.11Å; I36-S39 PolarHBondContact O-N 3.42Å; I36-V40 HydrophobicContact CG2-CG2 4.4Å; I36-V40 WeakPolarHBondContact O-CG2 3.32Å; I36-V40 PolarHBondContact O-N 3.11Å
37	L	91.8	Very high	85	Confident	92 Å²	92	98.5 Å²	98.5	48%	0.482	52%	0.518	S	S	.	.	H	α-helix	trans	-63.9	-36.2	179.1	-177.8	60.6	0	0	0	112.6	A33 N34 K41	A33-L37 WeakPolarHBondContact O-CB 3.19Å; A33-L37 PolarHBondContact O-N 3.4Å; N34-L37 PolarHBondContact O-N 2.9Å; L37-K41 WeakPolarHBondContact O-CG 3.23Å; L37-K41 PolarHBondContact O-N 2.81Å; L37-K41 VanDerWaalsContact O-N 3.09Å
38	A	89.9	Confident	87.1	Confident	57 Å²	57	96.6 Å²	96.6	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-65	-45.6	173.2	0	0	0	0	0	111.6	N34 N35 I36 K41 E42	N34-A38 WeakPolarHBondContact O-CB 3.46Å; N34-A38 PolarHBondContact O-N 3.25Å; N35-A38 PolarHBondContact O-N 3.31Å; I36-A38 VanDerWaalsContact C-N 3.33Å; I36-A38 PolarHBondContact O-N 3.11Å; A38-K41 PolarHBondContact O-N 2.81Å; A38-E42 PolarHBondContact O-N 3.24Å
39	S	92.9	Very high	89.1	Confident	51 Å²	51	97.5 Å²	97.5	36%	0.357	51%	0.505	S	S	.	.	H	α-helix	trans	-66.3	-37	178.3	-168.9	0	0	0	0	112.8	N35 I36 E42 Q43	N35-S39 WeakPolarHBondContact O-CB 3.27Å; N35-S39 PolarHBondContact O-N 2.69Å; I36-S39 PolarHBondContact O-N 3.42Å; S39-E42 PolarHBondContact O-N 3.36Å; S39-Q43 VanDerWaalsContact O-CG 3.3Å; S39-Q43 WeakPolarHBondContact O-CG 3.48Å; S39-Q43 PolarHBondContact O-N 3.22Å
40	V	95.8	Very high	90.8	Very high	60 Å²	60	98.1 Å²	98.1	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-62.9	-46.4	172.8	170	0	0	0	0	110.9	I36 E42 Q43 E44	I36-V40 HydrophobicContact CG2-CG2 4.4Å; I36-V40 WeakPolarHBondContact O-CG2 3.32Å; I36-V40 PolarHBondContact O-N 3.11Å; V40-E42 VanDerWaalsContact C-N 3.3Å; V40-E42 PolarHBondContact O-N 3.09Å; V40-Q43 PolarHBondContact O-N 2.76Å; V40-Q43 VanDerWaalsContact O-N 3.12Å; V40-E44 HydrophobicContact CG1-CG 4.42Å; V40-E44 WeakPolarHBondContact O-CG 3.46Å; V40-E44 PolarHBondContact O-N 2.9Å
41	K	94.1	Very high	92.2	Very high	125 Å²	125	97.6 Å²	97.6	54%	0.543	51%	0.505	S	S	.	.	H	α-helix	trans	-62.4	-35.1	176	-75.4	178.5	176.6	-175	0	113.2	L37 A38 L45	L37-K41 WeakPolarHBondContact O-CG 3.23Å; L37-K41 PolarHBondContact O-N 2.81Å; L37-K41 VanDerWaalsContact O-N 3.09Å; A38-K41 PolarHBondContact O-N 2.81Å; K41-L45 WeakPolarHBondContact O-CB 3.43Å; K41-L45 PolarHBondContact O-N 3.13Å
42	E	94.3	Very high	93	Very high	116 Å²	116	99.4 Å²	99.4	54%	0.542	50%	0.504	S	S	.	.	H	α-helix	trans	-65.6	-45	172.2	-174.1	175.4	-165.7	0	0	111	A38 S39 V40 E44 L45 Q46	A38-E42 PolarHBondContact O-N 3.24Å; S39-E42 PolarHBondContact O-N 3.36Å; V40-E42 VanDerWaalsContact C-N 3.3Å; V40-E42 PolarHBondContact O-N 3.09Å; E42-E44 PolarHBondContact O-N 2.73Å; E42-L45 WeakPolarHBondContact O-CB 3.43Å; E42-L45 PolarHBondContact O-N 2.67Å; E42-Q46 HydrophobicContact CG-CG 4.48Å; E42-Q46 VanDerWaalsContact O-CG 3.31Å; E42-Q46 WeakPolarHBondContact O-CG 3.44Å; E42-Q46 PolarHBondContact O-N 2.96Å
43	Q	95.8	Very high	93.6	Very high	124 Å²	124	100.9 Å²	100.9	58%	0.579	51%	0.506	S	S	*	.	H	α-helix	trans	-62.5	-39.3	176.3	-71.2	172.2	17	0	0	112.5	S39 V40 Q46 F47	S39-Q43 VanDerWaalsContact O-CG 3.3Å; S39-Q43 WeakPolarHBondContact O-CG 3.48Å; S39-Q43 PolarHBondContact O-N 3.22Å; V40-Q43 PolarHBondContact O-N 2.76Å; V40-Q43 VanDerWaalsContact O-N 3.12Å; Q43-Q46 PolarHBondContact O-N 3.25Å; Q43-F47 WeakPolarHBondContact O-CB 3.44Å; Q43-F47 PolarHBondContact O-N 3.19Å
44	E	95	Very high	94.2	Very high	122 Å²	122	102.7 Å²	102.7	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-59.9	-45.6	172.1	-72.2	172.9	155.9	0	0	111.3	V40 E42 F47 E48	V40-E44 HydrophobicContact CG1-CG 4.42Å; V40-E44 WeakPolarHBondContact O-CG 3.46Å; V40-E44 PolarHBondContact O-N 2.9Å; E42-E44 PolarHBondContact O-N 2.73Å; E44-F47 PolarHBondContact O-N 3.44Å; E44-E48 PolarHBondContact O-N 3.19Å
45	L	96.8	Very high	94.7	Very high	105 Å²	105	102.5 Å²	102.5	55%	0.55	50%	0.503	S	S	.	.	H	α-helix	trans	-63.6	-42.2	176.7	-172	77.5	0	0	0	112.4	K41 E42 E48 R49	K41-L45 WeakPolarHBondContact O-CB 3.43Å; K41-L45 PolarHBondContact O-N 3.13Å; E42-L45 WeakPolarHBondContact O-CB 3.43Å; E42-L45 PolarHBondContact O-N 2.67Å; L45-E48 PolarHBondContact O-N 3.22Å; L45-R49 WeakPolarHBondContact O-CB 3.42Å; L45-R49 PolarHBondContact O-N 2.84Å
46	Q	95.1	Very high	95.1	Very high	97 Å²	97	101.2 Å²	101.2	45%	0.453	50%	0.499	S	S	.	.	H	α-helix	trans	-66.4	-39.3	176.5	-63.1	-62.8	-8.3	0	0	111.3	E42 Q43 R49 L50	E42-Q46 HydrophobicContact CG-CG 4.48Å; E42-Q46 VanDerWaalsContact O-CG 3.31Å; E42-Q46 WeakPolarHBondContact O-CG 3.44Å; E42-Q46 PolarHBondContact O-N 2.96Å; Q43-Q46 PolarHBondContact O-N 3.25Å; Q46-R49 PolarHBondContact O-N 2.99Å; Q46-L50 WeakPolarHBondContact O-CB 3.44Å; Q46-L50 PolarHBondContact O-N 3.42Å
47	F	97.4	Very high	95.3	Very high	146 Å²	146	101.8 Å²	101.8	64%	0.64	50%	0.5	S	S	*	.	H	α-helix	trans	-65	-43.8	175.2	179.7	-95.5	0	0	0	112	Q43 E44 R49 L50 T51	Q43-F47 WeakPolarHBondContact O-CB 3.44Å; Q43-F47 PolarHBondContact O-N 3.19Å; E44-F47 PolarHBondContact O-N 3.44Å; F47-R49 VanDerWaalsContact C-N 3.34Å; F47-R49 PolarHBondContact O-N 3.31Å; F47-L50 PolarHBondContact O-N 2.91Å; F47-T51 WeakPolarHBondContact O-CB 3.26Å; F47-T51 PolarHBondContact O-N 3.47Å; F47-T51 PolarHBondContact O-OG1 2.97Å
48	E	96.3	Very high	95.5	Very high	95 Å²	95	105 Å²	105	44%	0.444	51%	0.505	S	S	.	.	H	α-helix	trans	-63.7	-40.8	176.4	-155.7	-146.8	148.4	0	0	111.3	E44 L45 T51 R52	E44-E48 PolarHBondContact O-N 3.19Å; L45-E48 PolarHBondContact O-N 3.22Å; E48-T51 PolarHBondContact O-N 2.97Å; E48-R52 WeakPolarHBondContact O-CG 3.34Å; E48-R52 PolarHBondContact O-N 2.68Å; E48-R52 IonicContact OE1-CZ 3.66Å; E48-R52 IonicContact OE1-NE 2.76Å; E48-R52 PolarHBondContact OE1-NE 3.21Å; E48-R52 IonicContact OE1-NH2 3.71Å; E48-R52 PolarHBondContact OE1-NH2 3.19Å; E48-R52 IonicContact OE2-CZ 3.38Å; E48-R52 IonicContact OE2-NH2 2.67Å; E48-R52 PolarHBondContact OE2-NH2 3.1Å
49	R	96.3	Very high	95.7	Very high	153 Å²	153	107.9 Å²	107.9	58%	0.577	51%	0.509	S	S	*	.	H	α-helix	trans	-60.5	-51.6	174.5	-177.3	179.3	-178.3	159.2	4.4	111.7	L45 Q46 F47 T51 R52 E53	L45-R49 WeakPolarHBondContact O-CB 3.42Å; L45-R49 PolarHBondContact O-N 2.84Å; Q46-R49 PolarHBondContact O-N 2.99Å; F47-R49 VanDerWaalsContact C-N 3.34Å; F47-R49 PolarHBondContact O-N 3.31Å; R49-T51 VanDerWaalsContact C-N 3.28Å; R49-T51 PolarHBondContact O-N 2.94Å; R49-R52 PolarHBondContact O-N 3.02Å; R49-E53 WeakPolarHBondContact O-CB 3.26Å; R49-E53 PolarHBondContact O-N 3.23Å
50	L	96.3	Very high	95.9	Very high	94 Å²	94	110.4 Å²	110.4	49%	0.492	52%	0.517	S	S	.	.	H	α-helix	trans	-61.5	-37.5	178.9	-176.2	66.2	0	0	0	111.7	Q46 F47 E53 L54	Q46-L50 WeakPolarHBondContact O-CB 3.44Å; Q46-L50 PolarHBondContact O-N 3.42Å; F47-L50 PolarHBondContact O-N 2.91Å; L50-E53 PolarHBondContact O-N 3.16Å; L50-L54 HydrophobicContact CD1-CD1 4.48Å; L50-L54 HydrophobicContact CD1-CG 4.48Å; L50-L54 HydrophobicContact CG-CD1 4.09Å; L50-L54 WeakPolarHBondContact O-CB 3.24Å; L50-L54 WeakPolarHBondContact O-CG 3.29Å; L50-L54 PolarHBondContact O-N 3.2Å
51	T	96.4	Very high	95.9	Very high	66 Å²	66	111.2 Å²	111.2	41%	0.405	52%	0.522	S	S	.	.	H	α-helix	trans	-64.2	-43.4	176.2	-58.5	0	0	0	0	111.4	F47 E48 R49 E55	F47-T51 WeakPolarHBondContact O-CB 3.26Å; F47-T51 PolarHBondContact O-N 3.47Å; F47-T51 PolarHBondContact O-OG1 2.97Å; E48-T51 PolarHBondContact O-N 2.97Å; R49-T51 VanDerWaalsContact C-N 3.28Å; R49-T51 PolarHBondContact O-N 2.94Å; T51-E55 PolarHBondContact O-N 3.43Å; T51-E55 VanDerWaalsContact O-N 3.08Å
52	R	96.1	Very high	95.8	Very high	132 Å²	132	107.4 Å²	107.4	50%	0.498	51%	0.514	S	S	.	.	H	α-helix	trans	-66.7	-36.6	175	-70.4	-167.8	-112.4	101.7	-12.8	112.3	E48 R49 V56	E48-R52 WeakPolarHBondContact O-CG 3.34Å; E48-R52 PolarHBondContact O-N 2.68Å; E48-R52 IonicContact OE1-CZ 3.66Å; E48-R52 IonicContact OE1-NE 2.76Å; E48-R52 PolarHBondContact OE1-NE 3.21Å; E48-R52 IonicContact OE1-NH2 3.71Å; E48-R52 PolarHBondContact OE1-NH2 3.19Å; E48-R52 IonicContact OE2-CZ 3.38Å; E48-R52 IonicContact OE2-NH2 2.67Å; E48-R52 PolarHBondContact OE2-NH2 3.1Å; R49-R52 PolarHBondContact O-N 3.02Å; R52-V56 WeakPolarHBondContact O-CG2 3.43Å; R52-V56 PolarHBondContact O-N 3.07Å; R52-V56 VanDerWaalsContact O-N 3.11Å
53	E	95.9	Very high	95.8	Very high	111 Å²	111	105 Å²	105	52%	0.519	51%	0.505	S	S	.	.	H	α-helix	trans	-68	-44.2	177.4	-168	158.7	-165.2	0	0	111.9	R49 L50 E55 V56 E57	R49-E53 WeakPolarHBondContact O-CB 3.26Å; R49-E53 PolarHBondContact O-N 3.23Å; L50-E53 PolarHBondContact O-N 3.16Å; E53-E55 PolarHBondContact O-N 3.34Å; E53-V56 WeakPolarHBondContact O-CB 3.19Å; E53-V56 PolarHBondContact O-N 3.02Å; E53-E57 PolarHBondContact O-N 3.4Å
54	L	95.4	Very high	95.6	Very high	95 Å²	95	104.9 Å²	104.9	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-64.7	-36.2	174.8	-74.4	170.3	0	0	0	113.3	L50 V56 E57 R58	L50-L54 HydrophobicContact CD1-CD1 4.48Å; L50-L54 HydrophobicContact CD1-CG 4.48Å; L50-L54 HydrophobicContact CG-CD1 4.09Å; L50-L54 WeakPolarHBondContact O-CB 3.24Å; L50-L54 WeakPolarHBondContact O-CG 3.29Å; L50-L54 PolarHBondContact O-N 3.2Å; L54-V56 VanDerWaalsContact C-N 3.34Å; L54-E57 PolarHBondContact O-N 3.46Å; L54-R58 VanDerWaalsContact O-CB 3.27Å; L54-R58 WeakPolarHBondContact O-CB 3.27Å; L54-R58 PolarHBondContact O-N 3.02Å
55	E	96.4	Very high	95.3	Very high	92 Å²	92	104.5 Å²	104.5	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-69.8	-33.3	174.7	-172.1	65	-177.5	0	0	111.5	T51 E53 R58 Q59	T51-E55 PolarHBondContact O-N 3.43Å; T51-E55 VanDerWaalsContact O-N 3.08Å; E53-E55 PolarHBondContact O-N 3.34Å; E55-R58 PolarHBondContact O-N 3.3Å; E55-R58 IonicContact OE1-CZ 2.75Å; E55-R58 IonicContact OE1-NH1 2.76Å; E55-R58 PolarHBondContact OE1-NH1 2.88Å; E55-R58 WeakPolarHBondContact OE2-CD 3.48Å; E55-R58 IonicContact OE2-CZ 3.23Å; E55-R58 IonicContact OE2-NH1 2.89Å; E55-R58 PolarHBondContact OE2-NH1 3.13Å; E55-Q59 WeakPolarHBondContact O-CB 3.3Å; E55-Q59 PolarHBondContact O-N 3.23Å
56	V	97.1	Very high	94.9	Very high	88 Å²	88	104.5 Å²	104.5	53%	0.533	50%	0.503	S	S	.	.	H	α-helix	trans	-66.9	-45.5	171.1	168.2	0	0	0	0	111.3	R52 E53 L54 R58 Q59 I60	R52-V56 WeakPolarHBondContact O-CG2 3.43Å; R52-V56 PolarHBondContact O-N 3.07Å; R52-V56 VanDerWaalsContact O-N 3.11Å; E53-V56 WeakPolarHBondContact O-CB 3.19Å; E53-V56 PolarHBondContact O-N 3.02Å; L54-V56 VanDerWaalsContact C-N 3.34Å; V56-R58 VanDerWaalsContact C-N 3.34Å; V56-R58 PolarHBondContact O-N 3.01Å; V56-Q59 PolarHBondContact O-N 3.31Å; V56-I60 HydrophobicContact CG1-CD1 3.8Å; V56-I60 HydrophobicContact CG1-CG1 4.47Å; V56-I60 VanDerWaalsContact O-CG1 3.28Å; V56-I60 WeakPolarHBondContact O-CG1 3.36Å; V56-I60 PolarHBondContact O-N 3.31Å
57	E	95.7	Very high	94.2	Very high	117 Å²	117	108.3 Å²	108.3	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-58.6	-45.6	173.1	-73.4	-162.2	140.8	0	0	111.5	E53 L54 Q59 I60 V61	E53-E57 PolarHBondContact O-N 3.4Å; L54-E57 PolarHBondContact O-N 3.46Å; E57-Q59 VanDerWaalsContact C-N 3.32Å; E57-Q59 PolarHBondContact O-N 2.88Å; E57-I60 PolarHBondContact O-N 2.83Å; E57-V61 WeakPolarHBondContact O-CG2 3.29Å; E57-V61 PolarHBondContact O-N 3.22Å
58	R	95.9	Very high	93.3	Very high	159 Å²	159	105.3 Å²	105.3	60%	0.6	51%	0.51	S	S	*	.	H	α-helix	trans	-58.8	-42.1	176	175.6	174.7	162.6	-116.1	-15	111.8	L54 E55 V56 V61 A62	L54-R58 VanDerWaalsContact O-CB 3.27Å; L54-R58 WeakPolarHBondContact O-CB 3.27Å; L54-R58 PolarHBondContact O-N 3.02Å; E55-R58 PolarHBondContact O-N 3.3Å; E55-R58 IonicContact OE1-CZ 2.75Å; E55-R58 IonicContact OE1-NH1 2.76Å; E55-R58 PolarHBondContact OE1-NH1 2.88Å; E55-R58 WeakPolarHBondContact OE2-CD 3.48Å; E55-R58 IonicContact OE2-CZ 3.23Å; E55-R58 IonicContact OE2-NH1 2.89Å; E55-R58 PolarHBondContact OE2-NH1 3.13Å; V56-R58 VanDerWaalsContact C-N 3.34Å; V56-R58 PolarHBondContact O-N 3.01Å; R58-V61 PolarHBondContact O-N 2.88Å; R58-A62 VanDerWaalsContact O-CB 3.3Å; R58-A62 WeakPolarHBondContact O-CB 3.29Å; R58-A62 PolarHBondContact O-N 3.08Å
59	Q	95.6	Very high	92.5	Very high	117 Å²	117	109 Å²	109	55%	0.547	52%	0.519	S	S	.	.	H	α-helix	trans	-69.5	-36.5	177.5	-172.9	59.4	30.1	0	0	112.4	E55 V56 E57 A62 N63	E55-Q59 WeakPolarHBondContact O-CB 3.3Å; E55-Q59 PolarHBondContact O-N 3.23Å; V56-Q59 PolarHBondContact O-N 3.31Å; E57-Q59 VanDerWaalsContact C-N 3.32Å; E57-Q59 PolarHBondContact O-N 2.88Å; Q59-A62 PolarHBondContact O-N 3.48Å; Q59-N63 PolarHBondContact O-N 2.87Å
60	I	96.5	Very high	91	Very high	104 Å²	104	107.1 Å²	107.1	53%	0.533	52%	0.52	S	S	.	.	H	α-helix	trans	-63.9	-47	173.1	-70.1	164.5	0	0	0	110.4	V56 E57 N63 Q64	V56-I60 HydrophobicContact CG1-CD1 3.8Å; V56-I60 HydrophobicContact CG1-CG1 4.47Å; V56-I60 VanDerWaalsContact O-CG1 3.28Å; V56-I60 WeakPolarHBondContact O-CG1 3.36Å; V56-I60 PolarHBondContact O-N 3.31Å; E57-I60 PolarHBondContact O-N 2.83Å; I60-N63 PolarHBondContact O-N 3.37Å; I60-Q64 WeakPolarHBondContact O-CB 3.4Å; I60-Q64 PolarHBondContact O-N 3.43Å
61	V	95.9	Very high	89.2	Confident	77 Å²	77	106.1 Å²	106.1	47%	0.467	53%	0.532	S	S	.	.	H	α-helix	trans	-63.7	-40.9	176.9	171.1	0	0	0	0	111.1	E57 R58 Q64 L65	E57-V61 WeakPolarHBondContact O-CG2 3.29Å; E57-V61 PolarHBondContact O-N 3.22Å; R58-V61 PolarHBondContact O-N 2.88Å; V61-Q64 PolarHBondContact O-N 3.34Å; V61-L65 HydrophobicContact CG1-CD1 4.01Å; V61-L65 HydrophobicContact CG1-CG 4.47Å; V61-L65 WeakPolarHBondContact O-CB 3.47Å; V61-L65 VanDerWaalsContact O-CG 3.31Å; V61-L65 WeakPolarHBondContact O-CG 3.34Å; V61-L65 PolarHBondContact O-N 2.86Å
62	A	92.7	Very high	87.2	Confident	45 Å²	45	107 Å²	107	37%	0.372	55%	0.546	S	S	.	.	H	α-helix	trans	-60.9	-47.4	175.4	0	0	0	0	0	111.9	R58 Q59 Q64 L65 E66	R58-A62 VanDerWaalsContact O-CB 3.3Å; R58-A62 WeakPolarHBondContact O-CB 3.29Å; R58-A62 PolarHBondContact O-N 3.08Å; Q59-A62 PolarHBondContact O-N 3.48Å; A62-Q64 VanDerWaalsContact C-N 3.35Å; A62-Q64 PolarHBondContact O-N 3.11Å; A62-L65 PolarHBondContact O-N 3.31Å; A62-E66 WeakPolarHBondContact O-CB 3.49Å; A62-E66 PolarHBondContact O-N 3.17Å
63	N	92.8	Very high	85	Confident	66 Å²	66	106 Å²	106	35%	0.353	55%	0.547	S	S	.	.	H	α-helix	trans	-69.4	-31.2	176.6	-174.4	-108.4	0	0	0	112.6	Q59 I60 E66 R67	Q59-N63 PolarHBondContact O-N 2.87Å; I60-N63 PolarHBondContact O-N 3.37Å; N63-E66 PolarHBondContact ND2-OE2 3.41Å; N63-E66 PolarHBondContact O-N 3.42Å; N63-R67 WeakPolarHBondContact O-CB 3.45Å; N63-R67 VanDerWaalsContact O-CG 3.24Å; N63-R67 WeakPolarHBondContact O-CG 3.46Å; N63-R67 PolarHBondContact O-N 2.84Å; N63-R67 WeakPolarHBondContact OD1-CD 3.45Å
64	Q	91.6	Very high	82.5	Confident	121 Å²	121	106 Å²	106	57%	0.565	56%	0.559	S	S	*	*	H	α-helix	trans	-65.9	-41.6	172.6	-170.1	174.7	14.2	0	0	111.3	I60 V61 A62 R67 C68	I60-Q64 WeakPolarHBondContact O-CB 3.4Å; I60-Q64 PolarHBondContact O-N 3.43Å; V61-Q64 PolarHBondContact O-N 3.34Å; A62-Q64 VanDerWaalsContact C-N 3.35Å; A62-Q64 PolarHBondContact O-N 3.11Å; Q64-R67 PolarHBondContact O-N 3.39Å; Q64-C68 WeakPolarHBondContact O-CB 3.18Å; Q64-C68 PolarHBondContact O-N 3.29Å; Q64-C68 PolarHBondContact O-SG 3.01Å
65	L	89.5	Confident	80.4	Confident	115 Å²	115	106.9 Å²	106.9	60%	0.602	57%	0.571	S	S	*	*	H	α-helix	trans	-65.3	-41.7	174.1	-72.1	168.2	0	0	0	112	V61 A62 C68 R69	V61-L65 HydrophobicContact CG1-CD1 4.01Å; V61-L65 HydrophobicContact CG1-CG 4.47Å; V61-L65 WeakPolarHBondContact O-CB 3.47Å; V61-L65 VanDerWaalsContact O-CG 3.31Å; V61-L65 WeakPolarHBondContact O-CG 3.34Å; V61-L65 PolarHBondContact O-N 2.86Å; A62-L65 PolarHBondContact O-N 3.31Å; L65-C68 PolarHBondContact O-N 3.02Å; L65-R69 WeakPolarHBondContact O-CB 3.26Å; L65-R69 PolarHBondContact O-N 2.86Å
66	E	87.6	Confident	77.8	Confident	105 Å²	105	111 Å²	111	49%	0.491	60%	0.596	S	S	.	*	H	α-helix	trans	-59.1	-45.5	172.9	-180	178.9	-139.2	0	0	111.6	A62 N63 R69 L70	A62-E66 WeakPolarHBondContact O-CB 3.49Å; A62-E66 PolarHBondContact O-N 3.17Å; N63-E66 PolarHBondContact ND2-OE2 3.41Å; N63-E66 PolarHBondContact O-N 3.42Å; E66-R69 WeakPolarHBondContact O-CB 3.49Å; E66-R69 PolarHBondContact O-N 3.23Å; E66-L70 HydrophobicContact CG-CD1 4.2Å; E66-L70 WeakPolarHBondContact O-CG 3.36Å; E66-L70 PolarHBondContact O-N 2.83Å
67	R	81.1	Confident	75.3	Confident	176 Å²	176	114.3 Å²	114.3	66%	0.664	61%	0.611	S	S	*	*	H	α-helix	trans	-67.4	-36.3	176	-71.9	176.8	66.1	-176.5	0.6	113	N63 Q64 R69 G71	N63-R67 WeakPolarHBondContact O-CB 3.45Å; N63-R67 VanDerWaalsContact O-CG 3.24Å; N63-R67 WeakPolarHBondContact O-CG 3.46Å; N63-R67 PolarHBondContact O-N 2.84Å; N63-R67 WeakPolarHBondContact OD1-CD 3.45Å; Q64-R67 PolarHBondContact O-N 3.39Å; R67-R69 VanDerWaalsContact C-N 3.33Å; R67-G71 PolarHBondContact O-N 3.27Å
68	C	77.7	Confident	72.7	Confident	84 Å²	84	111.9 Å²	111.9	57%	0.568	62%	0.617	S	S	*	*	H	α-helix	trans	-65.9	-36.1	171.8	-73.3	0	0	0	0	112	Q64 L65	Q64-C68 WeakPolarHBondContact O-CB 3.18Å; Q64-C68 PolarHBondContact O-N 3.29Å; Q64-C68 PolarHBondContact O-SG 3.01Å; L65-C68 PolarHBondContact O-N 3.02Å
69	R	80.1	Confident	69.7	Low	171 Å²	171	110.3 Å²	110.3	65%	0.645	63%	0.631	S	S	*	*	H	α-helix	trans	-66.9	-50.1	174.3	179	-179.3	175.2	148.4	6.2	111.6	L65 E66 R67 G71 A72 E73	L65-R69 WeakPolarHBondContact O-CB 3.26Å; L65-R69 PolarHBondContact O-N 2.86Å; E66-R69 WeakPolarHBondContact O-CB 3.49Å; E66-R69 PolarHBondContact O-N 3.23Å; R67-R69 VanDerWaalsContact C-N 3.33Å; R69-G71 PolarHBondContact O-N 3.39Å; R69-A72 WeakPolarHBondContact O-CA 3.3Å; R69-A72 WeakPolarHBondContact O-CB 3.41Å; R69-A72 PolarHBondContact O-N 3.22Å; R69-E73 IonicContact CZ-OE2 3.93Å; R69-E73 IonicContact NE-OE2 2.94Å; R69-E73 PolarHBondContact NE-OE2 3.26Å; R69-E73 IonicContact NH2-OE2 2.72Å; R69-E73 PolarHBondContact NH2-OE2 3.49Å; R69-E73 PolarHBondContact O-N 3.5Å
70	L	65.6	Low	67	Low	115 Å²	115	111 Å²	111	60%	0.602	65%	0.648	S	S	*	*	H	α-helix	trans	-63.5	-30.7	177.7	-68	170.6	0	0	0	111.9	E66 A72 E73	E66-L70 HydrophobicContact CG-CD1 4.2Å; E66-L70 WeakPolarHBondContact O-CG 3.36Å; E66-L70 PolarHBondContact O-N 2.83Å; L70-A72 PolarHBondContact O-N 3.25Å; L70-E73 PolarHBondContact O-N 2.96Å
71	G	58.2	Low	63.8	Low	72 Å²	72	111.5 Å²	111.5	74%	0.742	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-4.4	169.7	0	0	0	0	0	115.4	R67 R69	R67-G71 PolarHBondContact O-N 3.27Å; R69-G71 PolarHBondContact O-N 3.39Å
72	A	53.5	Low	60.9	Low	84 Å²	84	112.7 Å²	112.7	69%	0.694	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	-2.7	174.3	0	0	0	0	0	113.6	R69 L70	R69-A72 WeakPolarHBondContact O-CA 3.3Å; R69-A72 WeakPolarHBondContact O-CB 3.41Å; R69-A72 PolarHBondContact O-N 3.22Å; L70-A72 PolarHBondContact O-N 3.25Å
73	E	50.9	Low	58	Low	111 Å²	111	115.6 Å²	115.6	52%	0.519	69%	0.69	S	S	.	*	S	Bend	trans	-119.2	54	-176.1	-67.9	-168.1	74.1	0	0	112.7	R69 L70	R69-E73 IonicContact CZ-OE2 3.93Å; R69-E73 IonicContact NE-OE2 2.94Å; R69-E73 PolarHBondContact NE-OE2 3.26Å; R69-E73 IonicContact NH2-OE2 2.72Å; R69-E73 PolarHBondContact NH2-OE2 3.49Å; R69-E73 PolarHBondContact O-N 3.5Å; L70-E73 PolarHBondContact O-N 2.96Å
74	S	43.4	Very low	55.1	Low	111 Å²	111	119 Å²	119	78%	0.776	70%	0.704	S	S	*	*	S	Bend	trans	178.9	143.2	158.2	-87.9	0	0	0	0	113.5
75	P	50.5	Low	52.2	Low	115 Å²	115	120.5 Å²	120.5	75%	0.747	71%	0.709	S	S	*	*				-131.5	148.3	-63.5	31.1	-13.6	0	0	0	112.8	D77	P75-D77 PolarHBondContact O-N 2.95Å
76	D	41	Very low	49.5	Very low	179 Å²	179	120.4 Å²	120.4	96%	0.957	72%	0.718	S	S	*	*			trans	-75.7	108.6	160.4	-101.6	-47.1	0	0	0	108.8
77	D	44.6	Very low	47.3	Very low	157 Å²	157	123.2 Å²	123.2	84%	0.84	74%	0.735	S	S	*	*			trans	-141.9	132.8	158.5	-149.4	-11	0	0	0	109.9	P75	P75-D77 PolarHBondContact O-N 2.95Å
78	G	41.1	Very low	45.2	Very low	65 Å²	65	119.8 Å²	119.8	67%	0.67	74%	0.736	S	S	*	*			trans	-88.9	134	-154.9	0	0	0	0	0	114.7
79	S	33.1	Very low	42.8	Very low	127 Å²	127	128.3 Å²	128.3	89%	0.888	76%	0.756	S	S	*	*			trans	-151.3	106.7	161.9	-84	0	0	0	0	112.9
80	S	39	Very low	40.6	Very low	130 Å²	130	130 Å²	130	91%	0.909	76%	0.762	S	S	*	*			trans	-78.7	125.1	171.7	-48.3	0	0	0	0	111.2
81	S	30.5	Very low	38.8	Very low	115 Å²	115	130.7 Å²	130.7	80%	0.804	77%	0.771	S	S	*	*			trans	-164.2	130.7	147.1	-157.5	0	0	0	0	115
82	S	34.2	Very low	37.4	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	77%	0.771	S	S	*	*			trans	48.5	104.1	139.2	-178.3	0	0	0	0	121.7
83	S	32.3	Very low	36.2	Very low	107 Å²	107	134.6 Å²	134.6	75%	0.748	78%	0.776	S	S	*	*			trans	67.1	147.1	132.4	-128.3	0	0	0	0	119.1
84	E	32.4	Very low	35.3	Very low	137 Å²	137	135.9 Å²	135.9	64%	0.64	79%	0.792	S	S	*	*			cis	-136.4	171.6	19.9	-46.2	-165.7	82.4	0	0	115.4
85	K	30.9	Very low	34.6	Very low	153 Å²	153	136.3 Å²	136.3	67%	0.665	80%	0.795	S	S	*	*			trans	-10	150.7	149.7	76.2	-148.4	174.7	-152.8	0	117.9
86	S	31.6	Very low	33.6	Very low	113 Å²	113	135.2 Å²	135.2	79%	0.79	80%	0.795	S	S	*	*			cis	-168.4	150.8	-13.6	-95.3	0	0	0	0	108.4
87	L	42.5	Very low	33	Very low	164 Å²	164	132.7 Å²	132.7	86%	0.859	79%	0.792	S	S	*	*			trans	-66	151.6	163.3	-59.5	169.6	0	0	0	109.7
88	P	35.9	Very low	32.3	Very low	103 Å²	103	128.5 Å²	128.5	67%	0.669	79%	0.786	S	S	*	*				-154.9	124.6	94.9	35.7	-15.6	0	0	0	116.3	R90	P88-R90 HydrophobicContact CB-CB 4.47Å; P88-R90 HydrophobicContact CB-CG 4.21Å; P88-R90 PolarHBondContact O-N 3.18Å
89	W	26.9	Very low	31.8	Very low	263 Å²	263	132.5 Å²	132.5	100%	0.996	79%	0.792	S	S	*	*			trans	-84.5	84.1	148.1	-74.7	111	0	0	0	108.9
90	R	33.8	Very low	31.7	Very low	207 Å²	207	131.2 Å²	131.2	78%	0.781	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-90.2	124.2	171.8	-97	-77.1	-174.9	162.7	0.8	109.8	P88	P88-R90 HydrophobicContact CB-CB 4.47Å; P88-R90 HydrophobicContact CB-CG 4.21Å; P88-R90 PolarHBondContact O-N 3.18Å
91	T	29.4	Very low	31.5	Very low	129 Å²	129	133.9 Å²	133.9	79%	0.791	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-59.4	145.6	164.9	-41.7	0	0	0	0	109.8
92	A	28.4	Very low	31.6	Very low	90 Å²	90	133.9 Å²	133.9	74%	0.744	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-71	138.5	-171.5	0	0	0	0	0	114.2
93	D	26.7	Very low	31.5	Very low	148 Å²	148	139.9 Å²	139.9	79%	0.791	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-100.6	147.6	161	-72.9	-56.3	0	0	0	109.6
94	T	32.9	Very low	31.5	Very low	139 Å²	139	139.9 Å²	139.9	85%	0.853	78%	0.777	S	S	*	*			trans	-106.7	116.2	-166.9	52.3	0	0	0	0	114.8
95	S	29.6	Very low	31.7	Very low	120 Å²	120	139.2 Å²	139.2	84%	0.839	78%	0.782	S	S	*	*			trans	-171.3	155.3	162.3	54.1	0	0	0	0	110.4
96	A	29.3	Very low	31.6	Very low	91 Å²	91	138.7 Å²	138.7	75%	0.752	79%	0.786	S	S	*	*			cis	-169	160.3	-24.8	0	0	0	0	0	108.9
97	S	28.1	Very low	31.5	Very low	126 Å²	126	137.7 Å²	137.7	88%	0.881	78%	0.78	S	S	*	*			trans	65.5	122	158	-159	0	0	0	0	121.1
98	G	30	Very low	30.8	Very low	70 Å²	70	136 Å²	136	72%	0.722	78%	0.781	S	S	*	*			trans	79.6	162.9	151.8	0	0	0	0	0	118.5
99	D	30.6	Very low	30.5	Very low	148 Å²	148	139.7 Å²	139.7	79%	0.791	79%	0.79	S	S	*	*			cis	-161.9	166.7	-25.5	-143.6	-36.7	0	0	0	111.6
100	T	31.4	Very low	30.6	Very low	101 Å²	101	132.1 Å²	132.1	62%	0.62	78%	0.777	S	S	*	*			trans	64.8	111.2	159.1	56.9	0	0	0	0	122.4
101	K	34	Very low	30.8	Very low	186 Å²	186	127.7 Å²	127.7	81%	0.809	78%	0.775	S	S	*	*				68.4	123.8	122.3	-67.4	176.1	177.8	171.5	0	123
102	S	32.4	Very low	30.6	Very low	115 Å²	115	125.5 Å²	125.5	80%	0.804	77%	0.765	S	S	*	*				83.3	150.8	125.9	76.9	0	0	0	0	119.4
103	R	31.8	Very low	30.6	Very low	227 Å²	227	131.8 Å²	131.8	86%	0.857	77%	0.771	S	S	*	*			cis	-172.9	163.9	-12.5	156.2	175.8	-173.3	-173.9	3.8	109.7
104	V	33.8	Very low	30.6	Very low	108 Å²	108	135.2 Å²	135.2	66%	0.655	77%	0.773	S	S	*	*			trans	74.8	116.7	167.5	150.7	0	0	0	0	113.6
105	T	36.4	Very low	30.5	Very low	123 Å²	123	135 Å²	135	76%	0.755	77%	0.765	S	S	*	*				73.7	138.4	52.8	66.2	0	0	0	0	114.2
106	D	27.7	Very low	30.3	Very low	141 Å²	141	140.1 Å²	140.1	75%	0.754	77%	0.766	S	S	*	*			cis	-169.2	168.5	-11.2	176.6	46.4	0	0	0	109.8
107	S	29.1	Very low	30.2	Very low	93 Å²	93	139.6 Å²	139.6	65%	0.65	76%	0.762	S	S	*	*			trans	50.9	124.9	156	-75.1	0	0	0	0	123
108	S	28.1	Very low	30.2	Very low	127 Å²	127	142.3 Å²	142.3	89%	0.888	76%	0.76	S	S	*	*				-176.7	171.6	120.7	36	0	0	0	0	112.2
109	Q	30.8	Very low	30.1	Very low	182 Å²	182	143.2 Å²	143.2	85%	0.85	76%	0.756	S	S	*	*			trans	-132.1	159.1	-164.1	-74.4	-174.3	-20	0	0	115.2
110	S	27.5	Very low	30.3	Very low	103 Å²	103	143.7 Å²	143.7	72%	0.72	75%	0.753	S	S	*	*			trans	68.5	172.9	154.7	-62.3	0	0	0	0	116.4
111	P	38.3	Very low	30.2	Very low	114 Å²	114	146.1 Å²	146.1	74%	0.74	76%	0.757	S	S	*	*			cis	-122.8	-158.4	-3.4	43.3	-28.6	0	0	0	111.8
112	S	26	Very low	29.8	Very low	83 Å²	83	143.3 Å²	143.3	58%	0.58	76%	0.756	S	S	*	*				-177.1	162	-52.6	-73	0	0	0	0	106.7
113	Y	28.3	Very low	29.9	Very low	222 Å²	222	143.1 Å²	143.1	87%	0.871	76%	0.755	S	S	*	*			trans	60.4	174.2	162.3	69.7	-106	0	0	0	121.4
114	R	26.9	Very low	29.8	Very low	221 Å²	221	139.4 Å²	139.4	83%	0.834	75%	0.751	S	S	*	*				-172.1	154.6	-63.9	-148.4	-171.8	-171.6	-174.9	3.9	112.4
115	I	30.1	Very low	29.3	Very low	135 Å²	135	144 Å²	144	69%	0.692	76%	0.758	S	S	*	*			trans	74.6	139.5	159	-18.9	-178.4	0	0	0	121.8
116	R	26.1	Very low	29.1	Very low	226 Å²	226	143 Å²	143	85%	0.853	76%	0.756	S	S	*	*			trans	98.2	154.7	139.2	-160.8	166.2	-80.5	-170.1	-6.3	118.4
117	A	27.5	Very low	29.8	Very low	81 Å²	81	141.4 Å²	141.4	67%	0.669	75%	0.753	S	S	*	*				-167	-170.2	-56.9	0	0	0	0	0	109.3
118	E	27.3	Very low	30	Very low	182 Å²	182	145.2 Å²	145.2	85%	0.85	76%	0.761	S	S	*	*			trans	73	155.1	167.9	-61.8	-178.8	-176.2	0	0	116.7
119	S	29	Very low	30.2	Very low	90 Å²	90	147.2 Å²	147.2	63%	0.629	76%	0.756	S	S	*	*			cis	-166.7	155.1	-23.2	-96.1	0	0	0	0	111.5
120	E	33.5	Very low	29.9	Very low	158 Å²	158	144.3 Å²	144.3	74%	0.738	76%	0.756	S	S	*	*			trans	38.7	155.2	134	-56.4	-156.4	123.1	0	0	122.8
121	Q	29	Very low	30	Very low	151 Å²	151	144.5 Å²	144.5	71%	0.706	76%	0.757	S	S	*	*			cis	-168.3	-170.5	-9	-115.5	-161.4	53.4	0	0	110
122	V	26.8	Very low	29.6	Very low	128 Å²	128	146.9 Å²	146.9	78%	0.776	76%	0.763	S	S	*	*			trans	95.5	135.1	154.6	-167.6	0	0	0	0	118.7
123	S	35	Very low	29.8	Very low	111 Å²	111	150.3 Å²	150.3	78%	0.776	77%	0.769	S	S	*	*			trans	-140.9	153	172.5	167.8	0	0	0	0	108.1
124	L	28.6	Very low	30	Very low	148 Å²	148	146.6 Å²	146.6	78%	0.775	76%	0.76	S	S	*	*			trans	-162.7	133.9	164.8	-110.3	173.7	0	0	0	115.1
125	Y	24.3	Very low	30.1	Very low	204 Å²	204	148.2 Å²	148.2	80%	0.8	77%	0.766	S	S	*	*			trans	79.4	147.6	145.5	-123.7	-111	0	0	0	123.8
126	S	30.4	Very low	30.2	Very low	103 Å²	103	147.2 Å²	147.2	72%	0.72	77%	0.771	S	S	*	*			trans	-160.9	139.5	170.3	173.3	0	0	0	0	108.5
127	P	44.3	Very low	30.5	Very low	107 Å²	107	141.2 Å²	141.2	70%	0.695	77%	0.77	S	S	*	*			trans	-135.3	152.8	159	37.1	-22.9	0	0	0	114.5
128	E	32.7	Very low	30.6	Very low	174 Å²	174	140.8 Å²	140.8	81%	0.813	77%	0.773	S	S	*	*			trans	-86.9	162.1	169.6	-60.8	-174.8	134.9	0	0	112.4
129	Q	31	Very low	30.8	Very low	168 Å²	168	139.9 Å²	139.9	79%	0.785	77%	0.774	S	S	*	*				157	152.1	110	-82.3	-162.2	8.5	0	0	115.4
130	S	26.4	Very low	31.2	Very low	122 Å²	122	141 Å²	141	85%	0.853	78%	0.782	S	S	*	*			trans	75.9	168.5	149.5	74.5	0	0	0	0	120.2
131	S	28.1	Very low	31.2	Very low	106 Å²	106	140.3 Å²	140.3	74%	0.741	79%	0.793	S	S	*	*			trans	-153.6	160.4	-153.4	57.2	0	0	0	0	113.5
132	L	30.7	Very low	31.1	Very low	165 Å²	165	136.2 Å²	136.2	86%	0.864	79%	0.792	S	S	*	*			trans	179	143.6	136.3	-104.5	164	0	0	0	117.5
133	H	30.9	Very low	31.6	Very low	155 Å²	155	136.2 Å²	136.2	72%	0.718	80%	0.797	S	S	*	*			trans	85.4	167	143.6	-144.4	47.5	0	0	0	122.6
134	E	32.3	Very low	31.3	Very low	144 Å²	144	134.9 Å²	134.9	67%	0.673	79%	0.793	S	S	*	*			trans	-114.3	158.3	-146.2	-57.1	169	69.7	0	0	116.4
135	R	28.2	Very low	31.6	Very low	254 Å²	254	136.5 Å²	136.5	96%	0.958	80%	0.796	S	S	*	*				-164.9	-179.8	117.5	-106	169.2	-177.3	-110.3	-4.2	112.8
136	S	33	Very low	31.9	Very low	115 Å²	115	134 Å²	134	80%	0.804	79%	0.794	S	S	*	*			trans	-143.2	174.6	-140.5	-169.5	0	0	0	0	116.5
137	A	32	Very low	31.9	Very low	99 Å²	99	135.4 Å²	135.4	82%	0.818	79%	0.794	S	S	*	*			trans	83.1	145.2	169.4	0	0	0	0	0	119.3
138	G	29.7	Very low	31.2	Very low	72 Å²	72	134.8 Å²	134.8	74%	0.742	79%	0.791	S	S	*	*			trans	-176.5	-38.2	179.5	0	0	0	0	0	118
139	N	32	Very low	31.3	Very low	163 Å²	163	137.2 Å²	137.2	87%	0.872	80%	0.795	S	S	*	*			trans	62.7	152.7	168.2	-69.3	13.6	0	0	0	121.6
140	S	36.4	Very low	31.6	Very low	114 Å²	114	134 Å²	134	80%	0.797	79%	0.791	S	S	*	*			trans	-83.1	161.2	-173.5	-30.1	0	0	0	0	115.8
141	C	33.3	Very low	31.6	Very low	144 Å²	144	136.3 Å²	136.3	97%	0.973	79%	0.793	S	S	*	*			trans	-173.6	179.9	132.1	-97.3	0	0	0	0	111.2
142	G	28	Very low	32.2	Very low	65 Å²	65	135.9 Å²	135.9	67%	0.67	79%	0.79	S	S	*	*			trans	-163	-157.9	179.4	0	0	0	0	0	114.8
143	S	35.6	Very low	32.2	Very low	128 Å²	128	131.1 Å²	131.1	90%	0.895	78%	0.782	S	S	*	*			trans	82.2	169.8	174	81.7	0	0	0	0	119.3
144	A	29.9	Very low	32.5	Very low	83 Å²	83	133.2 Å²	133.2	69%	0.686	79%	0.785	S	S	*	*			trans	69.8	119.7	-179.2	0	0	0	0	0	116.5
145	Q	34.2	Very low	32.7	Very low	181 Å²	181	134.2 Å²	134.2	85%	0.846	79%	0.789	S	S	*	*				71.5	133.7	69.2	-71.1	-176.1	-41.5	0	0	113.1
146	M	30.3	Very low	32.9	Very low	152 Å²	152	128.5 Å²	128.5	75%	0.749	78%	0.778	S	S	*	*				-176.4	170.4	68.4	-132.9	151	55.3	0	0	114.1
147	N	31.2	Very low	32.9	Very low	133 Å²	133	127.1 Å²	127.1	71%	0.711	77%	0.774	S	S	*	*			trans	65.3	119.7	163.3	-57.7	-12.3	0	0	0	118.9
148	S	30.6	Very low	32.8	Very low	93 Å²	93	127.4 Å²	127.4	65%	0.65	77%	0.77	S	S	*	*			cis	88.2	116.9	12.4	-163.3	0	0	0	0	118.1
149	Y	32.8	Very low	32.7	Very low	226 Å²	226	128.8 Å²	128.8	89%	0.886	77%	0.768	S	S	*	*			trans	-179.5	161.5	139.9	-83.2	-58.5	0	0	0	108.6
150	S	37.8	Very low	32.6	Very low	100 Å²	100	124 Å²	124	70%	0.699	76%	0.757	S	S	*	*				-176.3	120.2	-55.3	-93.3	0	0	0	0	109.5
151	D	27.4	Very low	32.3	Very low	170 Å²	170	129.5 Å²	129.5	91%	0.909	76%	0.762	S	S	*	*			trans	-159.7	168	149.9	-155.1	9.7	0	0	0	112.1
152	S	39.4	Very low	32.3	Very low	97 Å²	97	130.6 Å²	130.6	68%	0.678	76%	0.757	S	S	*	*				-145.9	173.3	-122	-168.6	0	0	0	0	114
153	G	32.2	Very low	32.1	Very low	66 Å²	66	132.5 Å²	132.5	68%	0.68	76%	0.76	S	S	*	*			trans	118.7	82.8	-179	0	0	0	0	0	113.4
154	Y	35.6	Very low	31.6	Very low	199 Å²	199	136.7 Å²	136.7	78%	0.78	76%	0.756	S	S	*	*				59.1	132.1	58.3	-85.6	-55.4	0	0	0	113.7
155	Q	37.8	Very low	31.5	Very low	165 Å²	165	140 Å²	140	77%	0.771	76%	0.758	S	S	*	*			cis	-133.4	146.3	8.3	-96.2	165.4	1	0	0	110.5
156	D	31.5	Very low	31.2	Very low	133 Å²	133	138.3 Å²	138.3	71%	0.711	76%	0.755	S	S	*	*				77.3	148.1	67.1	-144.5	23.3	0	0	0	111.9
157	A	33.3	Very low	31.2	Very low	87 Å²	87	140.4 Å²	140.4	72%	0.719	76%	0.762	S	S	*	*			cis	-159.5	-175	18.2	0	0	0	0	0	110.8
158	S	30.6	Very low	31.1	Very low	105 Å²	105	137.9 Å²	137.9	73%	0.734	77%	0.768	S	S	*	*			cis	-177.4	-179.8	-45.6	-168.2	0	0	0	0	109
159	S	27.7	Very low	31.3	Very low	100 Å²	100	143.6 Å²	143.6	70%	0.699	78%	0.781	S	S	*	*			trans	68.4	140.3	177.1	-137.9	0	0	0	0	116.9
160	G	29.5	Very low	31.2	Very low	63 Å²	63	137.7 Å²	137.7	65%	0.649	78%	0.779	S	S	*	*			cis	104.2	123.9	-5.2	0	0	0	0	0	114.6
161	Y	28.8	Very low	30.7	Very low	230 Å²	230	141.3 Å²	141.3	90%	0.902	79%	0.785	S	S	*	*			trans	175.3	164.7	144.2	-101.8	-65.2	0	0	0	111.7
162	L	33.9	Very low	30.9	Very low	167 Å²	167	140.4 Å²	140.4	87%	0.874	78%	0.779	S	S	*	*			trans	-141.7	147	-175.6	-87.1	168.7	0	0	0	113.3
163	S	25.1	Very low	30.4	Very low	105 Å²	105	144.1 Å²	144.1	73%	0.734	78%	0.783	S	S	*	*			trans	89.2	145.7	147.8	-150.1	0	0	0	0	121.8
164	R	24.7	Very low	30.3	Very low	215 Å²	215	147.1 Å²	147.1	81%	0.811	78%	0.781	S	S	*	*			trans	69.9	156.7	170.1	-52.1	-169	175.6	-151.5	0.6	116.8
165	Q	27.9	Very low	30	Very low	154 Å²	154	145 Å²	145	72%	0.72	78%	0.778	S	S	*	*			cis	-145.4	165.4	4.6	-159.2	154.1	-78.9	0	0	113.3
166	N	27.9	Very low	29.6	Very low	145 Å²	145	146.4 Å²	146.4	78%	0.775	79%	0.785	S	S	*	*			trans	-61.7	147.9	170.2	-66	-26.3	0	0	0	113.9
167	Q	29.2	Very low	29.5	Very low	195 Å²	195	145.2 Å²	145.2	91%	0.911	79%	0.787	S	S	*	*				171.7	162.2	116	-93.8	178.2	46.3	0	0	112.6
168	G	30	Very low	29.5	Very low	80 Å²	80	150.7 Å²	150.7	83%	0.825	79%	0.794	S	S	*	*			trans	131.5	104.5	165.5	0	0	0	0	0	115.7
169	K	33.7	Very low	30.5	Very low	213 Å²	213	151.7 Å²	151.7	93%	0.926	80%	0.798	S	S	*	*			trans	-104.6	146.9	161.9	-73	-175	178	-176.2	0	109.6
170	A	31	Very low	30.6	Very low	103 Å²	103	150.5 Å²	150.5	85%	0.851	80%	0.802	S	S	*	*			trans	-149.8	152.1	155.5	0	0	0	0	0	109.4
171	E	27.4	Very low	30.7	Very low	176 Å²	176	152.8 Å²	152.8	82%	0.822	82%	0.815	S	S	*	*			trans	-120.6	-174	-175.2	-60.3	179.3	97.4	0	0	111.7
172	L	31.3	Very low	30.8	Very low	150 Å²	150	145.1 Å²	145.1	79%	0.785	81%	0.806	S	S	*	*			trans	82.6	97.7	151.5	-67.3	160.4	0	0	0	120.7
173	K	29.6	Very low	30.7	Very low	175 Å²	175	143.9 Å²	143.9	76%	0.761	81%	0.805	S	S	*	*				106.5	137.6	99.1	-165.5	-179.9	176.4	-173.1	0	120.3
174	M	29	Very low	31.1	Very low	130 Å²	130	142.3 Å²	142.3	64%	0.64	81%	0.806	S	S	*	*			trans	81.8	101.3	155.4	-97.4	174.1	141.5	0	0	122.8
175	Q	29.7	Very low	31.6	Very low	154 Å²	154	138.1 Å²	138.1	72%	0.72	81%	0.805	S	S	*	*				21.9	135.1	114.8	-58.2	169.7	-35.3	0	0	119.9
176	H	29.5	Very low	32	Very low	195 Å²	195	137.8 Å²	137.8	90%	0.903	81%	0.807	S	S	*	*			trans	-153.3	171.3	131.9	-93.4	-66.9	0	0	0	109.9
177	S	29.9	Very low	32	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	80%	0.802	S	S	*	*			trans	-124.7	158.4	-154.7	-56.5	0	0	0	0	116.7
178	F	33.1	Very low	32.2	Very low	201 Å²	201	136.9 Å²	136.9	88%	0.882	79%	0.792	S	S	*	*			trans	-1	153.7	140.8	-73.8	-67.1	0	0	0	119.7
179	P	50.8	Low	32.2	Very low	126 Å²	126	139.9 Å²	139.9	82%	0.818	79%	0.789	S	S	*	*				-160.9	167.5	59.6	43	-21.3	0	0	0	122.9
180	G	29.7	Very low	32.3	Very low	76 Å²	76	133.8 Å²	133.8	78%	0.784	78%	0.778	S	S	*	*			trans	85.2	161	144.5	0	0	0	0	0	119.4
181	A	32.7	Very low	32.4	Very low	110 Å²	110	140.9 Å²	140.9	91%	0.909	78%	0.783	S	S	*	*			cis	-176	157.4	-21.9	0	0	0	0	0	108.1
182	G	31.5	Very low	32.6	Very low	70 Å²	70	135.9 Å²	135.9	72%	0.722	77%	0.772	S	S	*	*			cis	-145.9	-119.3	-9.3	0	0	0	0	0	109.2
183	T	31.3	Very low	32.5	Very low	140 Å²	140	138.2 Å²	138.2	86%	0.859	78%	0.779	S	S	*	*			cis	-166.1	106.9	-9	43.7	0	0	0	0	112.1
184	G	33	Very low	32.7	Very low	73 Å²	73	133.4 Å²	133.4	75%	0.753	78%	0.779	S	S	*	*			trans	78.4	159.8	152.6	0	0	0	0	0	121
185	T	36.1	Very low	32.8	Very low	127 Å²	127	136.2 Å²	136.2	78%	0.779	79%	0.791	S	S	*	*			cis	-166.2	160.2	-6.6	-20.8	0	0	0	0	113.2
186	L	35.4	Very low	33	Very low	147 Å²	147	133.5 Å²	133.5	77%	0.77	80%	0.795	S	S	*	*			trans	72.5	148.9	163	-55.7	167.2	0	0	0	116.2
187	M	28.9	Very low	33.2	Very low	135 Å²	135	130 Å²	130	67%	0.665	79%	0.792	S	S	*	*			cis	-165.5	168.6	-0.9	-117.4	-161.1	-152.6	0	0	107.9
188	R	32.7	Very low	33.3	Very low	185 Å²	185	128.5 Å²	128.5	70%	0.698	79%	0.786	S	S	*	*			cis	-169.7	158.6	-17.7	-141.1	-171.2	-170.4	152.7	-2	109.7
189	N	30.6	Very low	33	Very low	143 Å²	143	128 Å²	128	77%	0.765	79%	0.787	S	S	*	*			trans	63.5	164	159.1	-59.7	-8.7	0	0	0	119.7
190	A	34.6	Very low	32.2	Very low	85 Å²	85	128.1 Å²	128.1	70%	0.702	78%	0.784	S	S	*	*			cis	-174	140.7	-43.1	0	0	0	0	0	112.1
191	R	33	Very low	33.2	Very low	252 Å²	252	130.3 Å²	130.3	95%	0.951	79%	0.785	S	S	*	*			trans	66.2	162.9	163	-115.1	-173	169.1	96.7	-1.7	116
192	A	31.4	Very low	33.1	Very low	72 Å²	72	129.4 Å²	129.4	60%	0.595	78%	0.777	S	S	*	*			cis	-151.7	168.3	1.2	0	0	0	0	0	113.8
193	E	30.4	Very low	33.2	Very low	199 Å²	199	132.3 Å²	132.3	93%	0.93	78%	0.781	S	S	*	*			trans	71.9	136.5	153.6	-51	-131	128.7	0	0	121.6
194	G	32.5	Very low	33.2	Very low	74 Å²	74	131.7 Å²	131.7	76%	0.763	78%	0.777	S	S	*	*			trans	-167.9	149.9	164.5	0	0	0	0	0	109.2
195	Q	32.5	Very low	33.2	Very low	189 Å²	189	132.7 Å²	132.7	88%	0.883	78%	0.778	S	S	*	*			trans	-117	122.7	173.1	-65.5	176.8	-17.6	0	0	106.3
196	A	33.8	Very low	33	Very low	97 Å²	97	131.5 Å²	131.5	80%	0.802	78%	0.781	S	S	*	*				62.6	129.5	72.1	0	0	0	0	0	112
197	S	33.9	Very low	33	Very low	120 Å²	120	132.4 Å²	132.4	84%	0.839	79%	0.786	S	S	*	*			cis	-164.9	-179.1	-2.7	-142.9	0	0	0	0	108.9
198	A	30.7	Very low	33.9	Very low	77 Å²	77	131.9 Å²	131.9	64%	0.636	79%	0.793	S	S	*	*			cis	-157.3	145.9	5.3	0	0	0	0	0	113
199	Q	28	Very low	33.9	Very low	192 Å²	192	126.7 Å²	126.7	90%	0.897	80%	0.797	S	S	*	*			trans	58.7	154.8	134.3	-147.2	157.3	-4.2	0	0	123.8
200	V	34.1	Very low	34.3	Very low	127 Å²	127	132 Å²	132	77%	0.77	81%	0.806	S	S	*	*			trans	-104.4	167.7	-173	-140.3	0	0	0	0	111.6
201	P	49	Very low	34.2	Very low	123 Å²	123	132.7 Å²	132.7	80%	0.799	81%	0.812	S	S	*	*				-148.9	-174.8	86.8	37.8	-17.2	0	0	0	116.4
202	A	32.6	Very low	34.1	Very low	90 Å²	90	130.1 Å²	130.1	74%	0.744	81%	0.813	S	S	*	*			trans	-87.2	179.4	-176.4	0	0	0	0	0	113.9
203	V	32.8	Very low	34.5	Very low	132 Å²	132	138.2 Å²	138.2	80%	0.8	83%	0.828	S	S	*	*				-171.4	160.7	78.3	155.9	0	0	0	0	112
204	T	32.1	Very low	34.9	Very low	126 Å²	126	139.8 Å²	139.8	77%	0.773	83%	0.825	S	S	*	*			trans	-27.8	146.3	178.7	59	0	0	0	0	121.4
205	A	31.8	Very low	34.8	Very low	94 Å²	94	143.3 Å²	143.3	78%	0.777	83%	0.832	S	S	*	*				166.6	153.4	105.1	0	0	0	0	0	116.3
206	A	32.5	Very low	34.6	Very low	103 Å²	103	140.1 Å²	140.1	85%	0.851	83%	0.83	S	S	*	*			trans	67	150	152.7	0	0	0	0	0	123.5
207	L	35.1	Very low	34.6	Very low	166 Å²	166	140.8 Å²	140.8	87%	0.869	83%	0.829	S	S	*	*			trans	-117	171.3	170.1	-86.1	162.9	0	0	0	108.6
208	P	47.9	Very low	35	Very low	123 Å²	123	141.4 Å²	141.4	80%	0.799	83%	0.827	S	S	*	*			cis	-126	166.6	-15.1	36.9	-22	0	0	0	113.6
209	G	32.3	Very low	35.4	Very low	77 Å²	77	143.4 Å²	143.4	79%	0.794	83%	0.834	S	S	*	*			trans	-155.2	143.8	174.1	0	0	0	0	0	114.4
210	R	38.3	Very low	35.6	Very low	255 Å²	255	140.1 Å²	140.1	96%	0.962	83%	0.832	S	S	*	*			trans	-73.8	123	178.9	-75.6	173	165	164	-6.8	112
211	A	33.3	Very low	35.5	Very low	98 Å²	98	144.5 Å²	144.5	81%	0.81	84%	0.835	S	S	*	*			trans	176.3	104.4	134.9	0	0	0	0	0	111.3
212	M	31.9	Very low	34.8	Very low	198 Å²	198	144.2 Å²	144.2	98%	0.975	84%	0.836	S	S	*	*			trans	-94.3	109.3	173.6	-166.4	173.8	-73.4	0	0	110.2
213	R	39.3	Very low	34.8	Very low	243 Å²	243	148.1 Å²	148.1	92%	0.917	84%	0.839	S	S	*	*			trans	-106.3	136.8	174.2	-108.1	-178.5	176	175	-1.1	110.8
214	R	37.6	Very low	34.6	Very low	231 Å²	231	147.4 Å²	147.4	87%	0.872	84%	0.839	S	S	*	*			trans	-28	127.9	-177.8	-59.5	174.9	178.5	-177.7	-2	116.7
215	V	31.3	Very low	35.4	Very low	149 Å²	149	147.2 Å²	147.2	90%	0.903	84%	0.84	S	S	*	*				-127.4	135.7	128.7	-78.3	0	0	0	0	107.6
216	S	29.2	Very low	35.4	Very low	121 Å²	121	147.5 Å²	147.5	85%	0.846	84%	0.842	S	S	*	*			trans	-103.6	126.2	-171.6	-58.4	0	0	0	0	111.3
217	S	32.5	Very low	35.5	Very low	111 Å²	111	153.7 Å²	153.7	78%	0.776	85%	0.845	S	S	*	*			trans	-125.7	128.3	168.7	47.1	0	0	0	0	111.7
218	V	43.6	Very low	35.6	Very low	133 Å²	133	150.5 Å²	150.5	81%	0.806	84%	0.843	S	S	*	*			trans	21.6	106.7	159.3	-162.7	0	0	0	0	119
219	P	37.7	Very low	34.9	Very low	120 Å²	120	149.9 Å²	149.9	78%	0.779	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-85.1	134.9	153.8	-5.4	24.5	0	0	0	111.1
220	S	32.3	Very low	35	Very low	122 Å²	122	150.7 Å²	150.7	85%	0.853	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-80.2	135.7	166.5	-65.4	0	0	0	0	110.4
221	R	32.1	Very low	35.2	Very low	219 Å²	219	146.9 Å²	146.9	83%	0.826	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-95.6	124.8	173.2	-71	-179.4	68.6	-169.4	2.2	110.6
222	S	33.9	Very low	35.1	Very low	118 Å²	118	147.1 Å²	147.1	83%	0.825	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-69.6	147.2	159.3	43.9	0	0	0	0	110.2
223	H	33.8	Very low	36	Very low	172 Å²	172	143.7 Å²	143.7	80%	0.796	82%	0.82	S	S	*	*			trans	-108.5	132	176.9	-81.2	-107.2	0	0	0	110.6
224	S	29.1	Very low	35.9	Very low	116 Å²	116	138 Å²	138	81%	0.811	82%	0.818	S	S	*	*			trans	-127.5	145.8	157.7	-66	0	0	0	0	108
225	P	47.9	Very low	36.3	Very low	122 Å²	122	139 Å²	139	79%	0.792	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-81.7	146.7	-169	32.3	-35.4	0	0	0	112.7
226	A	32.7	Very low	36.7	Very low	100 Å²	100	136 Å²	136	83%	0.826	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-95.3	131.2	169.7	0	0	0	0	0	110.3
227	Y	34.8	Very low	36.6	Very low	233 Å²	233	136 Å²	136	91%	0.914	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-77.2	148.3	164.1	-84.8	-104.3	0	0	0	110.2
228	A	36.1	Very low	37.1	Very low	99 Å²	99	138.2 Å²	138.2	82%	0.818	82%	0.823	S	S	*	*			trans	-138.7	107.7	165.9	0	0	0	0	0	109.6
229	S	33.9	Very low	36.8	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	83%	0.827	S	S	*	*			trans	-61.4	132.9	172.4	-94.3	0	0	0	0	110.9
230	S	32.9	Very low	36.6	Very low	95 Å²	95	144.3 Å²	144.3	66%	0.664	83%	0.832	S	S	*	*				70	102.2	67.7	85	0	0	0	0	113.5
231	I	42.9	Very low	36.7	Very low	174 Å²	174	143.6 Å²	143.6	89%	0.892	83%	0.827	S	S	*	*			trans	-98.1	132.3	168.7	-72	170.9	0	0	0	108.3
232	S	31.5	Very low	36.9	Very low	103 Å²	103	140.5 Å²	140.5	72%	0.72	83%	0.832	S	S	*	*			trans	-109.5	148.1	179.3	-68.1	0	0	0	0	111.9
233	P	51.3	Low	36.7	Very low	126 Å²	126	139.9 Å²	139.9	82%	0.818	83%	0.834	S	S	*	*			trans	-93.1	150.6	-173	36.1	-35.5	0	0	0	113.9
234	S	37.4	Very low	36.3	Very low	125 Å²	125	137.7 Å²	137.7	87%	0.874	84%	0.838	S	S	*	*			trans	-113.7	140.1	173.2	-68	0	0	0	0	112
235	R	44.6	Very low	36.6	Very low	252 Å²	252	135.8 Å²	135.8	95%	0.951	83%	0.83	S	S	*	*			trans	-98.4	145.2	177.6	-62.1	173.8	70.4	141.6	-0.1	110.3
236	G	39.6	Very low	35.9	Very low	84 Å²	84	141.3 Å²	141.3	87%	0.866	84%	0.836	S	S	*	*			trans	-86.9	173.9	-175.5	0	0	0	0	0	115.8
237	S	29	Very low	35.7	Very low	122 Å²	122	140 Å²	140	85%	0.853	83%	0.832	S	S	*	*			trans	-147	178.6	170.8	-165.1	0	0	0	0	111.1
238	L	41.5	Very low	35.7	Very low	157 Å²	157	134.6 Å²	134.6	82%	0.822	83%	0.829	S	S	*	*			trans	-123.1	166.5	-161.9	-69.9	168.4	0	0	0	114.7
239	R	37.3	Very low	36.5	Very low	238 Å²	238	136.1 Å²	136.1	90%	0.898	83%	0.83	S	S	*	*			trans	81.2	150.5	175.1	-54.8	-179.1	178.9	-86.4	-1.7	112.7
240	T	34.9	Very low	36.4	Very low	144 Å²	144	137.2 Å²	137.2	88%	0.883	83%	0.832	S	S	*	*			cis	-119.7	-158.9	29.9	58.2	0	0	0	0	115
241	S	32.7	Very low	36.3	Very low	107 Å²	107	139 Å²	139	75%	0.748	84%	0.838	S	S	*	*			trans	-148.7	144.2	-160.1	55.2	0	0	0	0	113.3
242	V	36.3	Very low	35.8	Very low	153 Å²	153	136.3 Å²	136.3	93%	0.927	83%	0.831	S	S	*	*			trans	-139.3	156.4	157	-79.9	0	0	0	0	109.4
243	A	29.6	Very low	35.9	Very low	105 Å²	105	137.9 Å²	137.9	87%	0.868	83%	0.826	S	S	*	*			trans	-139.3	149.6	-174.9	0	0	0	0	0	111.9
244	S	26.2	Very low	35.8	Very low	127 Å²	127	137.6 Å²	137.6	89%	0.888	83%	0.825	S	S	*	*			trans	-158.2	171	154.5	-161.8	0	0	0	0	109.8
245	A	35.8	Very low	35.8	Very low	76 Å²	76	137.7 Å²	137.7	63%	0.628	81%	0.809	S	S	*	*			trans	-136.8	-167.4	-170	0	0	0	0	0	112.6
246	Y	32.2	Very low	35.9	Very low	237 Å²	237	131.8 Å²	131.8	93%	0.929	80%	0.803	S	S	*	*			trans	71.7	140.6	-170.4	-52.7	-84.6	0	0	0	114.2
247	G	28.6	Very low	35.5	Very low	72 Å²	72	135.1 Å²	135.1	74%	0.742	80%	0.801	S	S	*	*			cis	-177.1	153.7	-7.6	0	0	0	0	0	111.6
248	S	34.8	Very low	35.6	Very low	120 Å²	120	134 Å²	134	84%	0.839	79%	0.793	S	S	*	*			trans	-91.7	162.5	177.3	-52.2	0	0	0	0	112.5
249	P	53.5	Low	35	Very low	131 Å²	131	133.6 Å²	133.6	85%	0.851	79%	0.791	S	S	*	*				-132.4	179.3	125.7	37.7	-29.3	0	0	0	114.2
250	V	31.1	Very low	34.7	Very low	134 Å²	134	129.2 Å²	129.2	81%	0.812	78%	0.784	S	S	*	*			trans	-114.2	146.4	-168.5	166	0	0	0	0	112
251	V	30.9	Very low	34.6	Very low	131 Å²	131	129.3 Å²	129.3	79%	0.794	77%	0.774	S	S	*	*			trans	-168.7	142.4	160.7	124.2	0	0	0	0	108.5
252	T	34.3	Very low	34.4	Very low	119 Å²	119	132.4 Å²	132.4	73%	0.73	78%	0.775	S	S	*	*			cis	-158.1	154.2	-32	16.4	0	0	0	0	107.6
253	E	33.2	Very low	34.1	Very low	135 Å²	135	130.8 Å²	130.8	63%	0.631	77%	0.765	S	S	*	*			trans	-87.5	159.8	160.4	-150.7	-165.5	-173	0	0	109.5	K255	E253-K255 WeakPolarHBondContact OE1-CG 3.29Å; E253-K255 IonicContact OE1-NZ 2.66Å; E253-K255 PolarHBondContact OE1-NZ 2.59Å; E253-K255 IonicContact OE2-NZ 2.76Å; E253-K255 PolarHBondContact OE2-NZ 2.96Å
254	P	49.1	Very low	34.4	Very low	120 Å²	120	132.2 Å²	132.2	78%	0.779	76%	0.763	S	S	*	*				-145.7	162	102.8	38.5	-24.1	0	0	0	116.1
255	K	37.3	Very low	34.7	Very low	128 Å²	128	134.2 Å²	134.2	56%	0.557	76%	0.763	S	S	*	*			trans	-77	176.8	170.2	-64.9	168.9	174	51.3	0	111.9	E253	E253-K255 WeakPolarHBondContact OE1-CG 3.29Å; E253-K255 IonicContact OE1-NZ 2.66Å; E253-K255 PolarHBondContact OE1-NZ 2.59Å; E253-K255 IonicContact OE2-NZ 2.76Å; E253-K255 PolarHBondContact OE2-NZ 2.96Å
256	P	46.3	Very low	35.7	Very low	127 Å²	127	135.6 Å²	135.6	83%	0.825	77%	0.766	S	S	*	*				-124.5	161.7	111.4	36.3	-34.1	0	0	0	114.8
257	L	30.8	Very low	35.8	Very low	154 Å²	154	129.4 Å²	129.4	81%	0.806	76%	0.757	S	S	*	*			trans	-92.1	-176.9	167.7	-60	163.8	0	0	0	108.1
258	S	30.8	Very low	36	Very low	98 Å²	98	131.4 Å²	131.4	69%	0.685	76%	0.755	S	S	*	*			cis	-168.4	153.8	24.7	53.8	0	0	0	0	113.1
259	N	29.1	Very low	35.9	Very low	149 Å²	149	134.1 Å²	134.1	80%	0.797	75%	0.754	S	S	*	*			trans	47.6	129.1	148.8	-60.4	-4.6	0	0	0	120.2
260	I	32.4	Very low	34.9	Very low	147 Å²	147	138.3 Å²	138.3	75%	0.754	75%	0.753	S	S	*	*				-174.6	143.3	96	-96.8	170.8	0	0	0	107.6
261	H	31.6	Very low	34.8	Very low	145 Å²	145	138.3 Å²	138.3	67%	0.671	75%	0.754	S	S	*	*			cis	-155.9	-141.6	-0.1	-128	-16.6	0	0	0	113.5
262	F	29.3	Very low	34.7	Very low	173 Å²	173	135.6 Å²	135.6	76%	0.759	75%	0.752	S	S	*	*			trans	-68.7	167	-179.8	-61.5	-83.2	0	0	0	114.9
263	T	29.7	Very low	34.5	Very low	119 Å²	119	135.2 Å²	135.2	73%	0.73	75%	0.754	S	S	*	*			cis	-146.2	156.3	31.1	47.6	0	0	0	0	116.7
264	T	36.3	Very low	34.4	Very low	134 Å²	134	136.5 Å²	136.5	82%	0.822	76%	0.764	S	S	*	*			trans	69.3	139.8	153.3	43.9	0	0	0	0	122.1
265	L	31.5	Very low	33.4	Very low	169 Å²	169	134 Å²	134	89%	0.885	76%	0.759	S	S	*	*			trans	-160	175.7	-173.3	-82.9	179.6	0	0	0	107.6
266	P	56.9	Low	33	Very low	106 Å²	106	131.8 Å²	131.8	69%	0.688	77%	0.773	S	S	*	*			cis	-138.7	-154.7	-33.4	37.6	-17	0	0	0	112.7
267	S	34.1	Very low	32.2	Very low	106 Å²	106	129.5 Å²	129.5	74%	0.741	77%	0.772	S	S	*	*			trans	89.7	148.4	151.3	-75.4	0	0	0	0	121.2
268	V	33.3	Very low	32.3	Very low	115 Å²	115	128 Å²	128	70%	0.697	78%	0.775	S	S	*	*			cis	-173.1	162.2	-33.7	116.9	0	0	0	0	110.8
269	Q	33.1	Very low	32.9	Very low	176 Å²	176	129 Å²	129	82%	0.822	78%	0.779	S	S	*	*			trans	66.3	136.5	169.6	-83.4	158.3	15.7	0	0	118
270	R	32.4	Very low	33.1	Very low	220 Å²	220	132.3 Å²	132.3	83%	0.83	78%	0.782	S	S	*	*			cis	121.7	133.1	4.6	-171.8	-147.4	-98.8	-138.7	-2.2	111.8
271	T	28.4	Very low	33.3	Very low	134 Å²	134	131.3 Å²	131.3	82%	0.822	78%	0.783	S	S	*	*			trans	88.7	145.2	168.3	76.9	0	0	0	0	116.8
272	G	29.6	Very low	34.5	Very low	73 Å²	73	129.3 Å²	129.3	75%	0.753	78%	0.783	S	S	*	*			trans	140.9	68.7	167.8	0	0	0	0	0	119.1
273	S	29.8	Very low	34.6	Very low	112 Å²	112	128.5 Å²	128.5	78%	0.783	78%	0.781	S	S	*	*			trans	9.7	152.9	144.8	-145.3	0	0	0	0	123.8
274	I	30.5	Very low	34.5	Very low	162 Å²	162	130.8 Å²	130.8	83%	0.831	78%	0.781	S	S	*	*			trans	69.6	140.7	164.3	-39	-177.4	0	0	0	115.5
275	G	28.6	Very low	34.4	Very low	67 Å²	67	130.4 Å²	130.4	69%	0.691	78%	0.779	S	S	*	*			cis	142.7	137.4	-11	0	0	0	0	0	114.3
276	G	28	Very low	34.4	Very low	82 Å²	82	127.5 Å²	127.5	85%	0.845	77%	0.772	S	S	*	*			trans	85.3	147.7	160.2	0	0	0	0	0	118.9
277	G	29.7	Very low	34.5	Very low	78 Å²	78	128.2 Å²	128.2	80%	0.804	78%	0.777	S	S	*	*			trans	86.1	97.2	150.9	0	0	0	0	0	118.6
278	S	33.9	Very low	34.6	Very low	123 Å²	123	128.1 Å²	128.1	86%	0.86	78%	0.783	S	S	*	*			trans	-102.2	115.6	154.4	-179.4	0	0	0	0	109.3
279	P	42.7	Very low	34.8	Very low	118 Å²	118	126 Å²	126	77%	0.766	78%	0.784	S	S	*	*			trans	-96.8	155.5	176.8	36.2	-32.3	0	0	0	113
280	Y	34.1	Very low	34.8	Very low	219 Å²	219	125 Å²	125	86%	0.859	78%	0.783	S	S	*	*			trans	-90.8	177.8	176.3	-104.3	-94.6	0	0	0	112.9
281	T	36.4	Very low	35.1	Very low	126 Å²	126	125.2 Å²	125.2	77%	0.773	79%	0.785	S	S	*	*			trans	89.2	157.8	159.2	77.7	0	0	0	0	118
282	P	56.4	Low	35.4	Very low	104 Å²	104	129.7 Å²	129.7	68%	0.675	79%	0.786	S	S	*	*			cis	-143.4	-175.3	-40.5	37.9	-20.7	0	0	0	115.7
283	Q	30.5	Very low	35.6	Very low	155 Å²	155	133.5 Å²	133.5	72%	0.724	79%	0.788	S	S	*	*			trans	72	145.9	162.4	-70	-172.9	5.3	0	0	116.4
284	K	29.2	Very low	35.5	Very low	168 Å²	168	132.8 Å²	132.8	73%	0.73	78%	0.783	S	S	*	*			cis	-149.2	176.1	7.6	-108.8	146.4	177.4	149.4	0	107
285	T	32.9	Very low	35.6	Very low	126 Å²	126	129.9 Å²	129.9	77%	0.773	78%	0.777	S	S	*	*			cis	-153.5	-164.9	13.6	-20.3	0	0	0	0	110
286	S	31.7	Very low	35.9	Very low	107 Å²	107	133 Å²	133	75%	0.748	78%	0.783	S	S	*	*			trans	-147.6	162	161.3	-55.2	0	0	0	0	110.2
287	P	58.2	Low	36.1	Very low	121 Å²	121	136 Å²	136	79%	0.786	78%	0.78	S	S	*	*				-132.7	163.1	90.6	14.8	8.5	0	0	0	112.6
288	A	37.6	Very low	36.1	Very low	104 Å²	104	138.2 Å²	138.2	86%	0.86	78%	0.782	S	S	*	*			cis	79.7	132.3	36.1	0	0	0	0	0	114.5
289	G	37.8	Very low	36.3	Very low	71 Å²	71	143.8 Å²	143.8	73%	0.732	78%	0.784	S	S	*	*			cis	-144	-156	-3.4	0	0	0	0	0	111.1
290	L	32.9	Very low	36.4	Very low	154 Å²	154	144 Å²	144	81%	0.806	79%	0.786	S	S	*	*			cis	-156.9	151.9	19.4	-84.4	163.8	0	0	0	113.4
291	R	38.7	Very low	36.1	Very low	226 Å²	226	137.3 Å²	137.3	85%	0.853	78%	0.784	S	S	*	*			trans	2.6	151.4	148.2	-55.2	171.6	-179.8	162.3	-1.3	119.4
292	R	33.8	Very low	35.8	Very low	228 Å²	228	136.1 Å²	136.1	86%	0.86	78%	0.78	S	S	*	*			cis	-168.9	-171	45	-135.2	-167.1	-60.8	-154.2	3.8	107.9
293	I	33.6	Very low	34.7	Very low	153 Å²	153	136.9 Å²	136.9	79%	0.785	78%	0.783	S	S	*	*			cis	-130.2	-117.5	7.2	-35.4	167.1	0	0	0	112.4
294	S	28.5	Very low	34.9	Very low	96 Å²	96	134.3 Å²	134.3	67%	0.671	78%	0.782	S	S	*	*			trans	-162.6	146.8	-162.5	56.4	0	0	0	0	116.1
295	S	33.4	Very low	35	Very low	101 Å²	101	137.6 Å²	137.6	71%	0.706	79%	0.79	S	S	*	*			trans	5.2	138.7	153.5	58.5	0	0	0	0	123.7
296	T	33.8	Very low	34.9	Very low	134 Å²	134	137 Å²	137	82%	0.822	79%	0.786	S	S	*	*				-177.1	158.9	110.9	23.6	0	0	0	0	115.7
297	N	32.3	Very low	35	Very low	145 Å²	145	137.9 Å²	137.9	78%	0.775	79%	0.787	S	S	*	*			trans	2.5	134	166.7	-61.1	-4.5	0	0	0	122.4
298	S	30.4	Very low	33.6	Very low	123 Å²	123	137 Å²	137	86%	0.86	78%	0.784	S	S	*	*				175.9	148.8	100.5	-74.6	0	0	0	0	115.4
299	R	37.4	Very low	34.1	Very low	240 Å²	240	137.3 Å²	137.3	91%	0.906	78%	0.778	S	S	*	*			trans	-124.8	154.2	157.8	-107.6	-175	176.9	-164.6	0.6	105.7
300	P	44.1	Very low	33.5	Very low	124 Å²	124	143.9 Å²	143.9	81%	0.805	78%	0.782	S	S	*	*				-156.5	176.3	61.6	42.4	-21.9	0	0	0	118.4
301	G	29.2	Very low	33.4	Very low	78 Å²	78	144.6 Å²	144.6	80%	0.804	78%	0.781	S	S	*	*			trans	74.9	168.8	151.9	0	0	0	0	0	118.5
302	S	30.4	Very low	32.9	Very low	100 Å²	100	139 Å²	139	70%	0.699	77%	0.772	S	S	*	*			cis	-168.6	152	-20.1	179.5	0	0	0	0	110.3
303	T	33.3	Very low	32.7	Very low	120 Å²	120	133 Å²	133	74%	0.736	77%	0.765	S	S	*	*			trans	56	121.1	157.3	38.2	0	0	0	0	118.9
304	S	33.5	Very low	32.6	Very low	101 Å²	101	130.9 Å²	130.9	71%	0.706	77%	0.77	S	S	*	*				85.8	132.4	55	-64.2	0	0	0	0	115.6
305	R	31.9	Very low	32.7	Very low	237 Å²	237	130.1 Å²	130.1	89%	0.894	78%	0.778	S	S	*	*			trans	72.4	156.9	164.6	-61.4	177.7	-173.8	-161.3	1.2	114.5
306	T	30	Very low	32.6	Very low	114 Å²	114	131.3 Å²	131.3	70%	0.699	79%	0.786	S	S	*	*			cis	-156.7	169.4	5.9	-9	0	0	0	0	112.7
307	T	33.7	Very low	32.6	Very low	125 Å²	125	129.5 Å²	129.5	77%	0.767	78%	0.784	S	S	*	*			trans	56.2	124.8	148.7	53.1	0	0	0	0	123.5
308	S	29.9	Very low	32.7	Very low	103 Å²	103	128.2 Å²	128.2	72%	0.72	79%	0.787	S	S	*	*				-10.6	151.4	127.3	-132.6	0	0	0	0	116.4
309	P	47.7	Very low	33	Very low	111 Å²	111	125.8 Å²	125.8	72%	0.721	78%	0.781	S	S	*	*			cis	-154.5	173.3	47.7	43.2	-21.9	0	0	0	119.9
310	Y	25.6	Very low	32.8	Very low	209 Å²	209	125.2 Å²	125.2	82%	0.82	78%	0.779	S	S	*	*			trans	29.5	155.8	142.6	-83.2	-92.2	0	0	0	124.6
311	Q	29.8	Very low	32.5	Very low	169 Å²	169	127.3 Å²	127.3	79%	0.79	78%	0.78	S	S	*	*			trans	75.7	143.5	152.2	-84.2	-178.8	73.2	0	0	117.8
312	T	28.1	Very low	32.6	Very low	108 Å²	108	127 Å²	127	66%	0.663	78%	0.777	S	S	*	*			cis	-161.8	172.1	-23.6	-0.7	0	0	0	0	111
313	S	29.8	Very low	32.9	Very low	102 Å²	102	127.9 Å²	127.9	71%	0.713	78%	0.783	S	S	*	*			trans	58.9	123.1	143.1	63.1	0	0	0	0	122.3
314	A	31.8	Very low	33.9	Very low	109 Å²	109	127.4 Å²	127.4	90%	0.901	78%	0.782	S	S	*	*			trans	62.2	128.8	134.3	0	0	0	0	0	120.8
315	G	31.3	Very low	34.1	Very low	80 Å²	80	130.1 Å²	130.1	83%	0.825	79%	0.788	S	S	*	*			trans	162.8	68.5	171.7	0	0	0	0	0	114
316	S	31.5	Very low	34.4	Very low	125 Å²	125	124.2 Å²	124.2	87%	0.874	78%	0.778	S	S	*	*			trans	-75.2	143.8	174	-61.8	0	0	0	0	111.9
317	A	33.7	Very low	34.5	Very low	96 Å²	96	125.9 Å²	125.9	79%	0.793	78%	0.782	S	S	*	*			trans	22.8	143.3	151.6	0	0	0	0	0	120.2
318	S	34.5	Very low	34.5	Very low	118 Å²	118	125.6 Å²	125.6	83%	0.825	78%	0.78	S	S	*	*			cis	-168.4	165.8	41.8	-162.4	0	0	0	0	113.4
319	G	36.1	Very low	34.6	Very low	72 Å²	72	127.4 Å²	127.4	74%	0.742	78%	0.781	S	S	*	*			trans	-84.2	142	171.4	0	0	0	0	0	113.8
320	R	32.7	Very low	35.3	Very low	228 Å²	228	126.8 Å²	126.8	86%	0.86	78%	0.778	S	S	*	*			trans	-72.7	159.3	164.5	-76.6	-173.4	175.7	-156.8	-0.5	110.3
321	M	37.4	Very low	36.7	Very low	168 Å²	168	122.1 Å²	122.1	83%	0.828	77%	0.773	S	S	*	*			cis	-166.2	160.9	-4.3	-100.7	-98.5	-166.2	0	0	107.6
322	G	31.3	Very low	36.8	Very low	71 Å²	71	121.2 Å²	121.2	73%	0.732	77%	0.773	S	S	*	*			trans	151.9	119.2	162.2	0	0	0	0	0	116.5
323	S	36.6	Very low	37	Very low	120 Å²	120	122.3 Å²	122.3	84%	0.839	77%	0.773	S	S	*	*			trans	-147.1	165.6	168.8	-51.7	0	0	0	0	108.3
324	P	55.4	Low	37	Very low	110 Å²	110	126.7 Å²	126.7	71%	0.714	78%	0.779	S	S	*	*				-155	147.3	92.5	33.5	-12.4	0	0	0	118.5
325	L	36.5	Very low	37	Very low	157 Å²	157	130.1 Å²	130.1	82%	0.822	78%	0.777	S	S	*	*			trans	62.7	148	143.7	-55.1	167.6	0	0	0	119
326	T	38.6	Very low	37.6	Very low	114 Å²	114	131.4 Å²	131.4	70%	0.699	77%	0.77	S	S	*	*			cis	-162.3	-170.1	-5.1	15.9	0	0	0	0	108.2
327	L	33	Very low	37.5	Very low	148 Å²	148	130 Å²	130	78%	0.775	76%	0.757	S	S	*	*			cis	-158.1	-178.6	14.9	-156.4	60.1	0	0	0	111.1
328	V	34.2	Very low	37.6	Very low	119 Å²	119	133.6 Å²	133.6	72%	0.721	76%	0.757	S	S	*	*			trans	5.7	127.3	156.7	166	0	0	0	0	119.2
329	D	30.9	Very low	37.4	Very low	141 Å²	141	133.2 Å²	133.2	75%	0.754	75%	0.754	S	S	*	*			cis	94.9	167.3	19.5	-145	43.6	0	0	0	114.6
330	P	63.4	Low	37.4	Very low	99 Å²	99	135 Å²	135	64%	0.643	76%	0.756	S	S	*	*				-121.2	-148.3	-88.7	44.1	-29.4	0	0	0	112.5
331	P	55.1	Low	37.5	Very low	110 Å²	110	129.6 Å²	129.6	71%	0.714	75%	0.753	S	S	*	*			cis	-141	-179.8	-11.7	45.6	-27.8	0	0	0	117.6
332	L	30.3	Very low	38.2	Very low	150 Å²	150	127.9 Å²	127.9	79%	0.785	75%	0.754	S	S	*	*			trans	64.8	130.9	141.8	-139.3	70.2	0	0	0	124.2
333	I	32.4	Very low	38.3	Very low	132 Å²	132	131.3 Å²	131.3	68%	0.677	76%	0.76	S	S	*	*			trans	86.3	129.8	140.8	-102.6	171.3	0	0	0	122.9
334	K	31.3	Very low	38.8	Very low	194 Å²	194	137.1 Å²	137.1	84%	0.843	76%	0.764	S	S	*	*			trans	61.7	136.8	153.3	-67.9	173.7	-174.6	175.8	0	123.3
335	Q	30.1	Very low	37.6	Very low	180 Å²	180	136.2 Å²	136.2	84%	0.841	77%	0.766	S	S	*	*			trans	-49.3	163.5	157.1	-107.1	-179.3	-4	0	0	114.3
336	P	44	Very low	37.3	Very low	107 Å²	107	133.8 Å²	133.8	70%	0.695	76%	0.762	S	S	*	*				-149.1	168.8	55.6	43.7	-24	0	0	0	120.2
337	T	31.1	Very low	37.4	Very low	96 Å²	96	136.6 Å²	136.6	59%	0.589	77%	0.769	S	S	*	*			trans	11.8	132.3	150.2	60.1	0	0	0	0	119.6
338	H	33.8	Very low	37.9	Very low	171 Å²	171	136.4 Å²	136.4	79%	0.792	77%	0.774	S	S	*	*				-164.2	170.7	56.9	-89.6	-77.9	0	0	0	115.1
339	S	31.9	Very low	37.8	Very low	110 Å²	110	135.6 Å²	135.6	77%	0.769	78%	0.78	S	S	*	*			trans	93.7	135.4	156.7	80.5	0	0	0	0	120.8
340	S	35.1	Very low	38.1	Very low	111 Å²	111	135.7 Å²	135.7	78%	0.776	79%	0.785	S	S	*	*			trans	69.5	62.6	158.4	-19.4	0	0	0	0	120.9
341	S	34.6	Very low	37	Very low	114 Å²	114	135.9 Å²	135.9	80%	0.797	79%	0.786	S	S	*	*			trans	-15.4	162.9	138.8	-52	0	0	0	0	119.9
342	P	52.6	Low	35.9	Very low	132 Å²	132	137.6 Å²	137.6	86%	0.857	79%	0.785	S	S	*	*			cis	-135.8	-161	-23.9	35.9	-15	0	0	0	113.6
343	V	34.5	Very low	36	Very low	142 Å²	142	137.3 Å²	137.3	86%	0.861	78%	0.779	S	S	*	*			trans	-110.9	147.6	-159.3	170	0	0	0	0	115.5
344	R	45.5	Very low	35.8	Very low	243 Å²	243	141.5 Å²	141.5	92%	0.917	79%	0.788	S	S	*	*			trans	-55.1	133.2	168.1	168.5	-163.7	-172.7	-178.3	4.7	115
345	A	31.1	Very low	35.7	Very low	91 Å²	91	137.2 Å²	137.2	75%	0.752	78%	0.783	S	S	*	*			trans	-152.2	157.9	163.3	0	0	0	0	0	114.6
346	S	30.8	Very low	35.7	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	77%	0.774	S	S	*	*			trans	-7.9	127.3	165.3	47.8	0	0	0	0	119
347	M	40.3	Very low	35.5	Very low	174 Å²	174	133.8 Å²	133.8	86%	0.857	78%	0.776	S	S	*	*				63.7	103	69.5	-70.7	-135.4	71.5	0	0	116
348	T	43.9	Very low	35.7	Very low	144 Å²	144	137 Å²	137	88%	0.883	79%	0.789	S	S	*	*			trans	176.3	139.3	130.3	34	0	0	0	0	109.8
349	A	30.7	Very low	36.4	Very low	101 Å²	101	134.4 Å²	134.4	84%	0.835	79%	0.787	S	S	*	*			trans	-157.5	141	162	0	0	0	0	0	111.5
350	V	37.4	Very low	36.4	Very low	143 Å²	143	140.9 Å²	140.9	87%	0.867	80%	0.795	S	S	*	*			trans	-108.9	139.7	175.5	176.6	0	0	0	0	108.7
351	P	40.2	Very low	36.1	Very low	103 Å²	103	140.9 Å²	140.9	67%	0.669	80%	0.795	S	S	*	*			trans	-102.8	114.7	179.7	34.5	-28.1	0	0	0	113.4
352	Q	32.5	Very low	36	Very low	146 Å²	146	141.3 Å²	141.3	68%	0.682	79%	0.786	S	S	*	*			trans	-169.6	138.6	145.3	-96.3	-22.5	-72.4	0	0	115.5
353	H	31.3	Very low	34.7	Very low	145 Å²	145	142.2 Å²	142.2	67%	0.671	78%	0.783	S	S	*	*			trans	76.4	130.5	153.1	-52.6	-34.6	0	0	0	123.6
354	Y	29.3	Very low	34.6	Very low	219 Å²	219	141.6 Å²	141.6	86%	0.859	77%	0.77	S	S	*	*			trans	64	150.8	156.6	-67.4	-58.8	0	0	0	119.8
355	S	29.7	Very low	33.8	Very low	105 Å²	105	136.2 Å²	136.2	73%	0.734	76%	0.76	S	S	*	*			cis	-169	176	-20.2	-160.7	0	0	0	0	112.2
356	S	29.4	Very low	33.7	Very low	93 Å²	93	137.3 Å²	137.3	65%	0.65	76%	0.757	S	S	*	*			trans	90.7	119	143.3	-141.6	0	0	0	0	124.7
357	T	39	Very low	33.7	Very low	122 Å²	122	140 Å²	140	75%	0.748	76%	0.763	S	S	*	*			trans	57.9	125.5	133.6	53.9	0	0	0	0	125.7
358	L	35.2	Very low	33.5	Very low	163 Å²	163	136.9 Å²	136.9	85%	0.853	76%	0.756	S	S	*	*				12.9	153.4	129.4	-70.7	173.8	0	0	0	120.8
359	P	48.6	Very low	32.9	Very low	117 Å²	117	141 Å²	141	76%	0.76	76%	0.757	S	S	*	*			cis	-150.7	175.2	38.3	43.3	-23.9	0	0	0	119.3
360	R	33.8	Very low	32.8	Very low	245 Å²	245	139.4 Å²	139.4	93%	0.925	75%	0.751	S	S	*	*			trans	-164.1	158.3	140.5	-124.3	-179.9	-178.1	117.8	0.8	113.6
361	S	28.5	Very low	33	Very low	111 Å²	111	138.2 Å²	138.2	78%	0.776	75%	0.746	S	S	*	*			trans	-165.3	-177.4	-179.9	62.4	0	0	0	0	107.9
362	M	31.1	Very low	32.4	Very low	123 Å²	123	141.9 Å²	141.9	61%	0.606	75%	0.754	S	S	*	*			cis	-160.3	145	2.1	-155.9	-74.3	-66.4	0	0	107.8
363	L	26.8	Very low	32.2	Very low	152 Å²	152	140.6 Å²	140.6	80%	0.796	76%	0.761	S	S	*	*			trans	-162	119.2	147.2	-134.1	70.5	0	0	0	114.5
364	H	31.3	Very low	32.2	Very low	129 Å²	129	144.7 Å²	144.7	60%	0.597	77%	0.772	S	S	*	*			trans	27.9	147	141.6	-65.7	-50.2	0	0	0	121.9
365	N	28.1	Very low	32.3	Very low	130 Å²	130	142.2 Å²	142.2	70%	0.695	77%	0.774	S	S	*	*			cis	-168.2	168.5	-1.5	-117.5	4	0	0	0	107.6
366	T	29.7	Very low	32.4	Very low	114 Å²	114	144.7 Å²	144.7	70%	0.699	78%	0.777	S	S	*	*			cis	-143.9	146.7	7.1	39.8	0	0	0	0	110.4
367	D	30.6	Very low	32.5	Very low	161 Å²	161	152 Å²	152	86%	0.861	79%	0.792	S	S	*	*			trans	-117.5	161.5	152.4	-90.9	-37.5	0	0	0	109.1
368	P	36.8	Very low	32	Very low	108 Å²	108	153 Å²	153	70%	0.701	79%	0.789	S	S	*	*			trans	-133.8	118.5	140.4	34.5	-20.7	0	0	0	113.1
369	Y	31.3	Very low	31.9	Very low	230 Å²	230	155.5 Å²	155.5	90%	0.902	79%	0.787	S	S	*	*			trans	69.9	114.9	171.4	-58	-84.7	0	0	0	118.6
370	G	27.8	Very low	30.9	Very low	69 Å²	69	158.7 Å²	158.7	71%	0.711	79%	0.794	S	S	*	*			trans	-94.3	-157.8	151.4	0	0	0	0	0	111.2
371	P	41.4	Very low	30.8	Very low	117 Å²	117	153 Å²	153	76%	0.76	79%	0.786	S	S	*	*			cis	-127.2	-144.1	8.1	42.9	-25.7	0	0	0	112.5
372	Q	29.4	Very low	31	Very low	181 Å²	181	157.2 Å²	157.2	85%	0.846	79%	0.785	S	S	*	*			trans	77.3	112.5	171.6	-126.8	82.4	-4.4	0	0	117.2
373	S	27.4	Very low	31.4	Very low	119 Å²	119	157.4 Å²	157.4	83%	0.832	80%	0.795	S	S	*	*			trans	-155.5	65.2	171.5	52.6	0	0	0	0	114.3
374	Y	31.7	Very low	31.5	Very low	230 Å²	230	155.9 Å²	155.9	90%	0.902	79%	0.788	S	S	*	*			trans	-139.2	95.4	158.4	-99	-85.6	0	0	0	107.6
375	D	29.9	Very low	31.5	Very low	168 Å²	168	155.5 Å²	155.5	90%	0.898	80%	0.8	S	S	*	*			trans	173.3	64.2	161.8	-93.7	-21.6	0	0	0	110.6
376	I	31.8	Very low	31.9	Very low	156 Å²	156	157 Å²	157	80%	0.8	81%	0.807	S	S	*	*			trans	-139.3	84	172.2	-49.2	178.4	0	0	0	110.9
377	Y	31.9	Very low	32.2	Very low	246 Å²	246	158.6 Å²	158.6	97%	0.965	82%	0.817	S	S	*	*	S	Bend	trans	-157.1	48.3	143.1	-92.8	-56.5	0	0	0	111
378	E	28.8	Very low	32.1	Very low	144 Å²	144	158.4 Å²	158.4	67%	0.673	82%	0.816	S	S	*	*			trans	-129	139	167.3	-140.9	-168.6	-116.5	0	0	111.2
379	R	32.5	Very low	31.9	Very low	216 Å²	216	157.1 Å²	157.1	82%	0.815	81%	0.814	S	S	*	*			trans	72.5	95	167.2	-49	179	-148.5	131.6	13	119
380	M	27.5	Very low	32.1	Very low	184 Å²	184	153 Å²	153	91%	0.906	81%	0.808	S	S	*	*			trans	-137.5	138.1	132.3	-102.3	-178.1	-83	0	0	106.1
381	T	33.3	Very low	32.5	Very low	126 Å²	126	156.7 Å²	156.7	77%	0.773	81%	0.809	S	S	*	*			cis	-137.6	159.6	6.2	46.9	0	0	0	0	111.8
382	R	32.6	Very low	32.1	Very low	198 Å²	198	159 Å²	159	75%	0.747	82%	0.816	S	S	*	*			trans	-77.5	167.8	161.5	-83.8	-165.9	-179.1	-176.9	1	111.6	D384	R382-D384 VanDerWaalsContact CD-OD1 3.24Å; R382-D384 WeakPolarHBondContact CD-OD1 3.46Å; R382-D384 IonicContact CZ-OD1 3.26Å; R382-D384 IonicContact NE-OD1 2.88Å; R382-D384 IonicContact NH1-OD1 3.87Å; R382-D384 PolarHBondContact NH1-OD1 3.01Å
383	P	39.8	Very low	32.2	Very low	127 Å²	127	153.7 Å²	153.7	83%	0.825	81%	0.809	S	S	*	*				-120.8	162.8	110.6	36.2	-35.1	0	0	0	113
384	D	28.1	Very low	32.4	Very low	121 Å²	121	154.9 Å²	154.9	65%	0.647	81%	0.806	S	S	*	*			trans	-99.4	155.4	-178.8	-56.7	-69	0	0	0	112.9	R382	R382-D384 VanDerWaalsContact CD-OD1 3.24Å; R382-D384 WeakPolarHBondContact CD-OD1 3.46Å; R382-D384 IonicContact CZ-OD1 3.26Å; R382-D384 IonicContact NE-OD1 2.88Å; R382-D384 IonicContact NH1-OD1 3.87Å; R382-D384 PolarHBondContact NH1-OD1 3.01Å
385	S	31.4	Very low	32.6	Very low	121 Å²	121	150.2 Å²	150.2	85%	0.846	80%	0.795	S	S	*	*			trans	-153.7	153.8	142.7	-166	0	0	0	0	110.1
386	L	36.3	Very low	32.8	Very low	161 Å²	161	152.1 Å²	152.1	84%	0.843	80%	0.795	S	S	*	*			trans	-91.3	142.4	-171.8	-62.7	126.7	0	0	0	112.3
387	T	35.1	Very low	32.7	Very low	148 Å²	148	147.9 Å²	147.9	91%	0.908	79%	0.791	S	S	*	*				-157.2	122.2	121.4	33	0	0	0	0	109.3
388	D	28.9	Very low	32.7	Very low	156 Å²	156	143.9 Å²	143.9	83%	0.834	78%	0.784	S	S	*	*			trans	-106.3	135.1	163.7	168.9	34.2	0	0	0	108
389	A	33.6	Very low	32.8	Very low	81 Å²	81	147.8 Å²	147.8	67%	0.669	79%	0.793	S	S	*	*			trans	-171.5	107.1	164.3	0	0	0	0	0	114.6
390	L	34.5	Very low	32.6	Very low	145 Å²	145	142.5 Å²	142.5	76%	0.759	79%	0.789	S	S	*	*				66.9	125	122.7	-60.1	177.3	0	0	0	123.4
391	I	36.9	Very low	32.9	Very low	145 Å²	145	138.9 Å²	138.9	74%	0.744	78%	0.782	S	S	*	*			trans	80.2	102.1	130.1	-64.6	172.1	0	0	0	119.5
392	D	33.1	Very low	32.6	Very low	167 Å²	167	143.4 Å²	143.4	89%	0.893	79%	0.786	S	S	*	*				45.7	146	111.7	-156.1	25.7	0	0	0	122
393	G	31.3	Very low	32.3	Very low	68 Å²	68	138.7 Å²	138.7	70%	0.701	79%	0.789	S	S	*	*			trans	136.2	88.1	164.2	0	0	0	0	0	119.4
394	D	32.5	Very low	31.7	Very low	144 Å²	144	137.5 Å²	137.5	77%	0.77	78%	0.784	S	S	*	*			trans	12.9	129.4	151.1	-98.5	8.8	0	0	0	125.1
395	I	35.5	Very low	31.9	Very low	132 Å²	132	139.8 Å²	139.8	68%	0.677	79%	0.791	S	S	*	*			trans	28.3	113.6	130.6	-32.5	170.5	0	0	0	120.5
396	K	33.5	Very low	31.8	Very low	208 Å²	208	141.5 Å²	141.5	90%	0.904	79%	0.786	S	S	*	*				173.3	149.7	118.3	-93.2	155.8	-168.4	164.4	0	111.5
397	G	29.9	Very low	31.5	Very low	68 Å²	68	137.9 Å²	137.9	70%	0.701	77%	0.773	S	S	*	*			trans	-118.2	-156.3	-174.3	0	0	0	0	0	115.3
398	I	31.8	Very low	31.3	Very low	162 Å²	162	138.6 Å²	138.6	83%	0.831	77%	0.766	S	S	*	*			trans	92.8	122.6	164.5	-54.9	171.8	0	0	0	117.3
399	R	31.6	Very low	31.3	Very low	225 Å²	225	139.7 Å²	139.7	85%	0.849	77%	0.766	S	S	*	*			trans	80.4	115.1	152.7	-87	171.2	173.6	-96.9	-0.9	122.9
400	S	28.2	Very low	31.2	Very low	105 Å²	105	139.1 Å²	139.1	73%	0.734	77%	0.767	S	S	*	*				99.7	130.4	112.4	-158.7	0	0	0	0	120.3
401	S	32.2	Very low	31	Very low	109 Å²	109	140.8 Å²	140.8	76%	0.762	77%	0.772	S	S	*	*			trans	-60.9	148.7	177.5	-29.5	0	0	0	0	115.7
402	Y	27	Very low	30.8	Very low	220 Å²	220	140.2 Å²	140.2	86%	0.863	77%	0.77	S	S	*	*			trans	-163.3	135	130	-140.7	-96.2	0	0	0	113
403	A	26.5	Very low	30.7	Very low	99 Å²	99	139.9 Å²	139.9	82%	0.818	77%	0.765	S	S	*	*			trans	-179.8	115.6	150.5	0	0	0	0	0	110.4
404	S	27.4	Very low	30.7	Very low	102 Å²	102	147.2 Å²	147.2	71%	0.713	77%	0.771	S	S	*	*			trans	-158.6	133.7	170	174.2	0	0	0	0	108.9
405	Q	32.8	Very low	30.8	Very low	170 Å²	170	145.5 Å²	145.5	79%	0.794	77%	0.771	S	S	*	*			trans	-151.6	116.6	164.8	-76.5	-153.5	-0.4	0	0	112.4
406	H	29.6	Very low	30.5	Very low	157 Å²	157	145.9 Å²	145.9	73%	0.727	78%	0.779	S	S	*	*				59.4	152	129.5	-60.2	-52.4	0	0	0	123.1
407	S	29.2	Very low	30.3	Very low	84 Å²	84	143.8 Å²	143.8	59%	0.587	78%	0.777	S	S	*	*			cis	-178.1	179.9	-28	-99.4	0	0	0	0	109.5
408	H	31.8	Very low	30.6	Very low	164 Å²	164	145.5 Å²	145.5	76%	0.759	78%	0.778	S	S	*	*			trans	90.4	141.1	172.5	-53.9	-75.1	0	0	0	116.7
409	H	29.6	Very low	31.1	Very low	179 Å²	179	144.4 Å²	144.4	83%	0.829	78%	0.781	S	S	*	*			cis	-165.3	153.5	-28.5	-111.6	26	0	0	0	104.4
410	G	30.1	Very low	31.1	Very low	68 Å²	68	139.7 Å²	139.7	70%	0.701	77%	0.773	S	S	*	*			trans	-148.7	176.5	-174.9	0	0	0	0	0	114.5
411	Q	30.5	Very low	31.3	Very low	181 Å²	181	143.7 Å²	143.7	85%	0.846	77%	0.772	S	S	*	*			trans	-168.3	123.8	166.6	-110.4	165.1	-28.1	0	0	115.2
412	D	32.1	Very low	31.3	Very low	133 Å²	133	146.6 Å²	146.6	71%	0.711	77%	0.773	S	S	*	*				66.1	120.4	129.9	-62.7	-8.3	0	0	0	126.7
413	M	32.8	Very low	31.6	Very low	159 Å²	159	143.9 Å²	143.9	78%	0.783	77%	0.772	S	S	*	*				96.6	113.7	128.2	-71.9	-75.7	-168.4	0	0	125.2
414	R	30.8	Very low	31.6	Very low	222 Å²	222	143.4 Å²	143.4	84%	0.838	77%	0.767	S	S	*	*			trans	67.1	106.8	134.5	-84.4	-177.5	165.4	-145.8	-2.8	124.4
415	S	33.6	Very low	32.5	Very low	108 Å²	108	143.9 Å²	143.9	76%	0.755	77%	0.768	S	S	*	*				31.9	132	120.7	-44.1	0	0	0	0	123.6
416	T	30.4	Very low	32.5	Very low	140 Å²	140	142.8 Å²	142.8	86%	0.859	77%	0.766	S	S	*	*				-168.2	142.3	126.5	12.3	0	0	0	0	115
417	I	28.7	Very low	32.6	Very low	165 Å²	165	145.6 Å²	145.6	85%	0.846	77%	0.772	S	S	*	*			trans	29.4	144.8	148	-139.8	69.7	0	0	0	123.9
418	S	35.4	Very low	32.8	Very low	104 Å²	104	149.3 Å²	149.3	73%	0.727	78%	0.78	S	S	*	*			trans	-88.9	165.4	170.6	-40.1	0	0	0	0	114.2
419	P	42.4	Very low	33	Very low	138 Å²	138	148 Å²	148	90%	0.896	78%	0.778	S	S	*	*			trans	-126.6	-163.9	138.9	38.3	-28.4	0	0	0	113.5
420	D	32.3	Very low	33.3	Very low	126 Å²	126	148.8 Å²	148.8	67%	0.674	77%	0.774	S	S	*	*			trans	-138.5	164.7	-148.3	178	30.9	0	0	0	113.7
421	R	32.8	Very low	33.3	Very low	190 Å²	190	151.5 Å²	151.5	72%	0.717	78%	0.777	S	S	*	*			trans	73.1	160	166.8	-39.2	-171.3	179.9	179.7	-5.8	117.4
422	H	31.4	Very low	33.3	Very low	169 Å²	169	152.8 Å²	152.8	78%	0.782	78%	0.78	S	S	*	*			cis	-145.3	-175.8	26.3	-102	-73.6	0	0	0	114.3
423	I	32.8	Very low	33.2	Very low	164 Å²	164	157.5 Å²	157.5	84%	0.841	79%	0.788	S	S	*	*			trans	-131.5	165.2	-168.2	-68.7	169.8	0	0	0	110.6
424	A	28	Very low	33.1	Very low	88 Å²	88	153.1 Å²	153.1	73%	0.727	78%	0.784	S	S	*	*			trans	102.9	160	157.8	0	0	0	0	0	117.3
425	P	46.4	Very low	33.4	Very low	112 Å²	112	148.9 Å²	148.9	73%	0.727	79%	0.785	S	S	*	*				-143.8	-148.8	-120.6	35.8	-9.1	0	0	0	114.6
426	I	31.8	Very low	33.2	Very low	148 Å²	148	152.2 Å²	152.2	76%	0.759	79%	0.793	S	S	*	*			trans	111.4	131.2	156.2	-60.6	158.8	0	0	0	116.7
427	Y	32.4	Very low	33.1	Very low	215 Å²	215	156.7 Å²	156.7	84%	0.843	80%	0.796	S	S	*	*			trans	-7	137	163.6	-75.8	-111.4	0	0	0	120
428	E	33.4	Very low	33.1	Very low	162 Å²	162	160.5 Å²	160.5	76%	0.757	80%	0.8	S	S	*	*				-128.8	146	126.9	-92	-146.9	172.7	0	0	110.7	R430	E428-R430 IonicContact OE2-NH2 3.29Å; E428-R430 PolarHBondContact OE2-NH2 3.38Å
429	D	35.4	Very low	32.6	Very low	136 Å²	136	160.5 Å²	160.5	73%	0.727	80%	0.8	S	S	*	*			trans	-91.8	130.5	176.9	177.7	16.3	0	0	0	110.4
430	R	35.2	Very low	32.3	Very low	196 Å²	196	159.2 Å²	159.2	74%	0.74	79%	0.792	S	S	*	*			trans	-151.3	103.3	173.1	-157	153.4	-66.9	-137.5	7.2	114.6	E428 F432	E428-R430 IonicContact OE2-NH2 3.29Å; E428-R430 PolarHBondContact OE2-NH2 3.38Å; R430-F432 PolarHBondContact O-N 2.9Å
431	T	30.6	Very low	32.1	Very low	125 Å²	125	158.7 Å²	158.7	77%	0.767	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-51.3	129.8	172.5	58.2	0	0	0	0	114
432	F	30.9	Very low	32.1	Very low	208 Å²	208	158.6 Å²	158.6	91%	0.912	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-94.1	119.7	171.5	-115.3	-91.1	0	0	0	111.3	R430	R430-F432 PolarHBondContact O-N 2.9Å
433	R	30.3	Very low	32	Very low	233 Å²	233	156 Å²	156	88%	0.879	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-77.2	137.9	166.5	-75.5	-174.5	176.6	-125.5	5.4	110.2
434	G	30.4	Very low	32	Very low	67 Å²	67	156.9 Å²	156.9	69%	0.691	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-72.3	147	164.4	0	0	0	0	0	111.9
435	P	35.8	Very low	32.2	Very low	132 Å²	132	161.7 Å²	161.7	86%	0.857	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-77.2	145	175.9	31.8	-34.4	0	0	0	111.9
436	L	30.2	Very low	31.4	Very low	178 Å²	178	160.1 Å²	160.1	93%	0.932	81%	0.814	S	S	*	*			trans	-107.3	148.8	169.5	-86.8	168	0	0	0	111
437	Y	29	Very low	31.4	Very low	234 Å²	234	159.2 Å²	159.2	92%	0.918	82%	0.816	S	S	*	*			trans	-62.1	149.1	-178.3	-102.2	-113.4	0	0	0	113.3
438	R	27.8	Very low	31.4	Very low	245 Å²	245	156.8 Å²	156.8	93%	0.925	82%	0.816	S	S	*	*			trans	-126	123.3	159.3	-171.3	179.6	-172.9	-171.6	2.8	108.9
439	S	26	Very low	31.2	Very low	105 Å²	105	159.6 Å²	159.6	73%	0.734	82%	0.821	S	S	*	*			trans	-108	153	174	-157	0	0	0	0	110.6
440	P	36	Very low	30.8	Very low	110 Å²	110	164.9 Å²	164.9	71%	0.714	83%	0.831	S	S	*	*			trans	-88.4	169.7	-170.9	-10.1	29.7	0	0	0	115.8
441	S	27.9	Very low	30.5	Very low	115 Å²	115	161.1 Å²	161.1	80%	0.804	84%	0.835	S	S	*	*			trans	57.2	100.7	155.3	56.3	0	0	0	0	120
442	H	33	Very low	30.5	Very low	189 Å²	189	158.6 Å²	158.6	88%	0.875	83%	0.833	S	S	*	*				-138.2	145.9	119.5	-151.3	-66.9	0	0	0	109.2
443	T	29.3	Very low	30.6	Very low	115 Å²	115	155.1 Å²	155.1	71%	0.706	84%	0.835	S	S	*	*			trans	-107.6	146.8	177.9	46.9	0	0	0	0	111.5
444	Q	33.2	Very low	30.8	Very low	181 Å²	181	147.4 Å²	147.4	85%	0.846	83%	0.828	S	S	*	*			trans	176.9	164.5	138.8	-93.8	-61.2	-5.2	0	0	108.5
445	Q	31.3	Very low	31.2	Very low	189 Å²	189	151.5 Å²	151.5	88%	0.883	84%	0.839	S	S	*	*			trans	-107.7	151	-163.1	-61.8	172.3	-12.8	0	0	113.8
446	G	29.9	Very low	31.1	Very low	80 Å²	80	149 Å²	149	83%	0.825	84%	0.838	S	S	*	*			trans	179.6	93.4	178.7	0	0	0	0	0	114.5
447	T	32.3	Very low	31.4	Very low	129 Å²	129	146.3 Å²	146.3	79%	0.791	83%	0.833	S	S	*	*			trans	-61.8	159.6	-173.6	46.3	0	0	0	0	118.6
448	L	31.6	Very low	31.7	Very low	163 Å²	163	143.4 Å²	143.4	85%	0.853	83%	0.833	S	S	*	*			trans	107.7	133.9	154	-68	159.1	0	0	0	119.9
449	Y	28.1	Very low	32.1	Very low	221 Å²	221	140.8 Å²	140.8	87%	0.867	83%	0.831	S	S	*	*			trans	-52.9	141.5	-175.5	-69.9	-105.8	0	0	0	118
450	R	28.5	Very low	32.5	Very low	248 Å²	248	147.5 Å²	147.5	94%	0.936	84%	0.84	S	S	*	*				-163	153.2	122.5	-176.1	160.2	-92.3	-108.8	1.6	111.4
451	S	28.1	Very low	32.3	Very low	116 Å²	116	149 Å²	149	81%	0.811	85%	0.848	S	S	*	*			trans	-88.3	153.7	-172.5	-40.5	0	0	0	0	115.2
452	G	31.7	Very low	32.6	Very low	72 Å²	72	148.5 Å²	148.5	74%	0.742	84%	0.844	S	S	*	*				115.4	126	122.5	0	0	0	0	0	119.9
453	S	33.1	Very low	32.6	Very low	136 Å²	136	145.4 Å²	145.4	95%	0.951	84%	0.844	S	S	*	*			trans	68.3	170.6	156.5	-154.7	0	0	0	0	118.8
454	G	34.2	Very low	33	Very low	70 Å²	70	147.8 Å²	147.8	72%	0.722	85%	0.847	S	S	*	*			trans	100.2	86.2	163.2	0	0	0	0	0	116.7	G456	G454-G456 PolarHBondContact O-N 3.32Å
455	V	38.8	Very low	32.9	Very low	154 Å²	154	151.2 Å²	151.2	93%	0.933	85%	0.852	S	S	*	*			trans	-74.4	114.7	161.5	-79.7	0	0	0	0	110.3
456	G	33.2	Very low	33	Very low	80 Å²	80	146.7 Å²	146.7	83%	0.825	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-81.2	117.3	174	0	0	0	0	0	111.9	G454	G454-G456 PolarHBondContact O-N 3.32Å
457	S	37.4	Very low	33.2	Very low	120 Å²	120	147.8 Å²	147.8	84%	0.839	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-87.5	128	170.2	47.2	0	0	0	0	111
458	L	34.5	Very low	33.4	Very low	174 Å²	174	150 Å²	150	91%	0.911	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-72.4	144.6	170.9	-80.8	161.3	0	0	0	110.4
459	Q	35.2	Very low	33.6	Very low	189 Å²	189	148.8 Å²	148.8	88%	0.883	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-62.3	139.3	-177.5	-68.1	-172.9	-11.1	0	0	112.3
460	R	35.3	Very low	33.6	Very low	246 Å²	246	149.6 Å²	149.6	93%	0.928	85%	0.849	S	S	*	*			trans	-113.3	132.4	156.5	-99	-173.8	164.6	-139.3	-3.3	108.9
461	T	32.3	Very low	33.7	Very low	142 Å²	142	146.2 Å²	146.2	87%	0.871	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-70.9	131.7	178.2	41.9	0	0	0	0	110.9
462	S	34.5	Very low	33.8	Very low	105 Å²	105	151.3 Å²	151.3	73%	0.734	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-88	118.8	174.1	42.5	0	0	0	0	110.4	Q464	S462-Q464 PolarHBondContact O-N 3.27Å
463	S	32.1	Very low	33.6	Very low	124 Å²	124	154.3 Å²	154.3	87%	0.867	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-75.1	116.6	169.4	-173.9	0	0	0	0	109.2	R465	S463-R465 PolarHBondContact O-N 3.32Å
464	Q	37.5	Very low	33.4	Very low	165 Å²	165	154.8 Å²	154.8	77%	0.771	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-79.2	117.8	-178.7	-67.9	-174.4	-0.4	0	0	110.8	S462 S466	S462-Q464 PolarHBondContact O-N 3.27Å; Q464-S466 PolarHBondContact O-N 3.4Å
465	R	30.9	Very low	33.4	Very low	252 Å²	252	162.4 Å²	162.4	95%	0.951	85%	0.845	S	S	*	*			trans	-88.9	84.1	174.1	-150.4	-179.5	-161.5	-118.8	6.3	109.3	S463 A467	S463-R465 PolarHBondContact O-N 3.32Å; R465-A467 PolarHBondContact O-N 2.8Å
466	S	33	Very low	33.1	Very low	94 Å²	94	160 Å²	160	66%	0.657	84%	0.841	S	S	*	*			trans	-72	120.6	177.7	-61.7	0	0	0	0	111.3	Q464	Q464-S466 PolarHBondContact O-N 3.4Å
467	A	35.5	Very low	33.1	Very low	104 Å²	104	164.3 Å²	164.3	86%	0.86	84%	0.844	S	S	*	*			trans	-79.8	127.7	167.2	0	0	0	0	0	109.4	R465	R465-A467 PolarHBondContact O-N 2.8Å
468	M	35.4	Very low	32.8	Very low	174 Å²	174	166.6 Å²	166.6	86%	0.857	85%	0.847	S	S	*	*			trans	-106.5	128.1	174.3	-72.5	-173.1	169.6	0	0	110.4
469	T	35.6	Very low	32.7	Very low	138 Å²	138	164 Å²	164	85%	0.847	84%	0.838	S	S	*	*			trans	-80.4	139.5	174	39.9	0	0	0	0	110.6	Q471	T469-Q471 PolarHBondContact O-N 3.07Å
470	Y	28.4	Very low	32.6	Very low	239 Å²	239	161.3 Å²	161.3	94%	0.937	84%	0.835	S	S	*	*			trans	-70.5	121	178.1	-78.1	-90.3	0	0	0	111.4
471	Q	30.4	Very low	32.6	Very low	176 Å²	176	153.8 Å²	153.8	82%	0.822	83%	0.826	S	S	*	*			trans	-96.5	111.7	171.3	-166.3	170.4	2.5	0	0	110.3	T469	T469-Q471 PolarHBondContact O-N 3.07Å
472	R	30.5	Very low	32.6	Very low	224 Å²	224	153.6 Å²	153.6	85%	0.845	82%	0.819	S	S	*	*			trans	-78.3	118	176.7	173.1	-169.9	-81.6	168.4	-8.1	109.8
473	N	28.1	Very low	32.4	Very low	135 Å²	135	158.2 Å²	158.2	72%	0.722	82%	0.822	S	S	*	*			trans	-104.7	131.3	166.2	-84.8	-7	0	0	0	110.9
474	N	29.4	Very low	32.4	Very low	146 Å²	146	156.4 Å²	156.4	78%	0.781	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-83.6	145.5	171.7	-68.4	-10.6	0	0	0	110.2
475	Y	33.4	Very low	32	Very low	230 Å²	230	156 Å²	156	90%	0.902	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-92.8	126.4	159.5	-74.7	-82.3	0	0	0	109.3
476	A	32.6	Very low	32.7	Very low	102 Å²	102	148.5 Å²	148.5	84%	0.843	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-88.3	125.4	172.3	0	0	0	0	0	110
477	L	33.5	Very low	32.5	Very low	172 Å²	172	154 Å²	154	90%	0.901	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-75.6	146.4	164.2	-73.3	163.3	0	0	0	109.3
478	N	30.5	Very low	32.5	Very low	168 Å²	168	156.9 Å²	156.9	90%	0.898	81%	0.805	S	S	*	*			trans	-134.1	147.6	178	-155.3	1.7	0	0	0	110.5
479	T	33	Very low	32.2	Very low	119 Å²	119	153.7 Å²	153.7	73%	0.73	80%	0.8	S	S	*	*			trans	-129	125.1	-152	-59.8	0	0	0	0	114.5
480	T	33.4	Very low	32	Very low	133 Å²	133	151.6 Å²	151.6	82%	0.816	80%	0.796	S	S	*	*			trans	-151.7	112.6	154.5	46.7	0	0	0	0	106.9
481	A	34.5	Very low	32.1	Very low	88 Å²	88	149.3 Å²	149.3	73%	0.727	79%	0.794	S	S	*	*				62.7	135.6	84.4	0	0	0	0	0	113.3
482	N	31.7	Very low	32	Very low	137 Å²	137	151.8 Å²	151.8	73%	0.733	80%	0.797	S	S	*	*			cis	-161.6	173.8	19.8	-154.1	13.3	0	0	0	114
483	Y	31.3	Very low	32.1	Very low	203 Å²	203	151.4 Å²	151.4	80%	0.796	80%	0.796	S	S	*	*			trans	81	113.1	165.7	-84.8	-82.5	0	0	0	122.7
484	A	32.2	Very low	32.8	Very low	86 Å²	86	149.5 Å²	149.5	71%	0.711	79%	0.791	S	S	*	*			trans	43.9	147.5	131.8	0	0	0	0	0	122.2
485	D	28	Very low	32.8	Very low	155 Å²	155	148.2 Å²	148.2	83%	0.829	79%	0.793	S	S	*	*			cis	-155.2	163.3	-1.9	-136.9	19.1	0	0	0	109.9
486	P	45.6	Very low	32.9	Very low	95 Å²	95	144.4 Å²	144.4	62%	0.617	79%	0.789	S	S	*	*			trans	-99.8	155.1	-178	37.7	-32.3	0	0	0	114
487	Y	30.5	Very low	33.3	Very low	209 Å²	209	144.4 Å²	144.4	82%	0.82	78%	0.78	S	S	*	*			trans	168.4	143.2	135	-101.5	-67.3	0	0	0	113.7
488	H	33.8	Very low	33.1	Very low	165 Å²	165	142.4 Å²	142.4	76%	0.764	77%	0.77	S	S	*	*			trans	60.1	153.3	160.4	-77.4	-73.4	0	0	0	118.8
489	S	29.6	Very low	33.1	Very low	108 Å²	108	144.9 Å²	144.9	76%	0.755	77%	0.769	S	S	*	*			cis	-149.9	163.9	-2.4	-123.5	0	0	0	0	110.7
490	A	31.4	Very low	33	Very low	93 Å²	93	143.4 Å²	143.4	77%	0.769	77%	0.769	S	S	*	*			trans	-106.9	137.1	179.6	0	0	0	0	0	113.4
491	Q	31.5	Very low	33	Very low	192 Å²	192	148.3 Å²	148.3	90%	0.897	77%	0.772	S	S	*	*			trans	-169.7	138.4	166.7	-98.2	152.2	5.9	0	0	106
492	Y	28.5	Very low	32.7	Very low	227 Å²	227	153.4 Å²	153.4	89%	0.89	78%	0.781	S	S	*	*			cis	-149	170	-3.6	-167.6	-96.5	0	0	0	107.9
493	R	30.9	Very low	32.7	Very low	216 Å²	216	152.4 Å²	152.4	82%	0.815	78%	0.78	S	S	*	*			trans	-132.5	-175.3	-171.8	-147	-151.8	164.5	174	-3.5	112.8
494	P	44.6	Very low	33	Very low	95 Å²	95	150.6 Å²	150.6	62%	0.617	78%	0.782	S	S	*	*				-101.6	172.7	-93.9	37.2	-25	0	0	0	115.4
495	S	29.3	Very low	33.3	Very low	119 Å²	119	152.5 Å²	152.5	83%	0.832	79%	0.785	S	S	*	*			trans	-162.2	111.1	146.2	58.8	0	0	0	0	113.4
496	D	34	Very low	33.8	Very low	151 Å²	151	153.6 Å²	153.6	81%	0.807	79%	0.787	S	S	*	*			trans	-71.1	166.9	154.4	-77.7	-67.8	0	0	0	109.7
497	P	40.9	Very low	33.2	Very low	102 Å²	102	156.6 Å²	156.6	66%	0.662	80%	0.798	S	S	*	*			cis	-151	-169.7	32.3	44.2	-22.7	0	0	0	118.7
498	N	29.5	Very low	33.2	Very low	129 Å²	129	153.6 Å²	153.6	69%	0.69	80%	0.796	S	S	*	*			trans	86.8	96.2	150.4	-69.7	-17.1	0	0	0	122.1
499	Y	30.9	Very low	33.7	Very low	221 Å²	221	149 Å²	149	87%	0.867	79%	0.793	S	S	*	*				74.4	150.3	127.5	-87	-88.6	0	0	0	123.1
500	A	31.3	Very low	33.9	Very low	88 Å²	88	146.8 Å²	146.8	73%	0.727	78%	0.781	S	S	*	*			trans	73.8	65.8	156.8	0	0	0	0	0	120.2
501	R	32.5	Very low	34.5	Very low	236 Å²	236	148.5 Å²	148.5	89%	0.891	79%	0.785	S	S	*	*				179.3	111.7	121.7	-100.1	171.2	-177.3	-174	2.2	111.8
502	Q	29.1	Very low	35	Very low	194 Å²	194	149.8 Å²	149.8	91%	0.907	78%	0.781	S	S	*	*			trans	-88.7	102.3	157.8	-85.5	-175.7	-20.2	0	0	109.2
503	T	32.2	Very low	35.3	Very low	116 Å²	116	144 Å²	144	71%	0.712	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-77.3	119.8	158.8	44.7	0	0	0	0	108.4	V505	T503-V505 PolarHBondContact O-N 3.36Å
504	I	36.8	Very low	36.2	Very low	166 Å²	166	139.5 Å²	139.5	85%	0.851	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-68.8	120.3	175	-64.4	176.8	0	0	0	108.6
505	V	37.9	Very low	36.2	Very low	125 Å²	125	138.8 Å²	138.8	76%	0.758	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-79.9	139.7	173.9	173.6	0	0	0	0	108.8	T503	T503-V505 PolarHBondContact O-N 3.36Å
506	M	39.8	Very low	37.4	Very low	179 Å²	179	139.5 Å²	139.5	88%	0.882	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-78.9	125.6	169.6	-55.4	170.7	73.7	0	0	108.9
507	D	32	Very low	38.1	Very low	157 Å²	157	138.5 Å²	138.5	84%	0.84	76%	0.758	S	S	*	*			trans	-157	151.9	146.3	-149.2	8.1	0	0	0	115.1
508	D	29.7	Very low	38.6	Very low	146 Å²	146	136.3 Å²	136.3	78%	0.781	75%	0.745	S	S	*	*			trans	46	140.1	163.2	-150.7	20.9	0	0	0	123
509	G	44.5	Very low	39.6	Very low	68 Å²	68	136.7 Å²	136.7	70%	0.701	75%	0.746	S	S	*	*			trans	-102.2	99.8	-175.6	0	0	0	0	0	113.6
510	A	34.3	Very low	40.3	Very low	62 Å²	62	135.1 Å²	135.1	51%	0.512	75%	0.746	S	S	.	*			trans	-120.8	126.5	161.9	0	0	0	0	0	109.8	R512	A510-R512 VanDerWaalsContact C-N 3.27Å; A510-R512 PolarHBondContact O-N 3.17Å
511	P	43.3	Very low	41.2	Very low	129 Å²	129	136.3 Å²	136.3	84%	0.838	74%	0.735	S	S	*	*			trans	-72.5	83.3	178.1	30.6	-34.6	0	0	0	110	S513	P511-S513 PolarHBondContact O-N 3.04Å
512	R	42.4	Very low	41.6	Very low	220 Å²	220	128.5 Å²	128.5	83%	0.83	71%	0.711	S	S	*	*			trans	-59.8	111.4	169.3	-75.5	-177.4	168	83.2	-1	108	A510	A510-R512 VanDerWaalsContact C-N 3.27Å; A510-R512 PolarHBondContact O-N 3.17Å
513	S	34.8	Very low	42.9	Very low	105 Å²	105	124.1 Å²	124.1	73%	0.734	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-53.1	135.6	173	-48.4	0	0	0	0	109.3	P511 S515	P511-S513 PolarHBondContact O-N 3.04Å; S513-S515 PolarHBondContact O-N 2.98Å
514	P	49.6	Very low	44.1	Very low	122 Å²	122	127.2 Å²	127.2	79%	0.792	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-58	125	176.7	24.3	-32.9	0	0	0	108.9
515	S	45.5	Very low	44.8	Very low	80 Å²	80	125.1 Å²	125.1	56%	0.559	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-66.5	146.2	-173.9	46.8	0	0	0	0	111.3	S513 D517 S518	S513-S515 PolarHBondContact O-N 2.98Å; S515-D517 PolarHBondContact O-N 3.48Å; S515-S518 PolarHBondContact O-N 3.42Å
516	I	54.3	Low	45.5	Very low	134 Å²	134	125.3 Å²	125.3	69%	0.687	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-66.4	-17.3	-164.5	-152.2	166.6	0	0	0	113.2	S518 I519	I516-S518 PolarHBondContact O-N 2.88Å; I516-I519 HydrophobicContact CG1-CD1 3.7Å; I516-I519 WeakPolarHBondContact O-CB 3.43Å; I516-I519 WeakPolarHBondContact O-CG1 3.2Å; I516-I519 PolarHBondContact O-N 3.27Å; I516-I519 VanDerWaalsContact O-N 3.15Å
517	D	49.6	Very low	46.4	Very low	129 Å²	129	119.9 Å²	119.9	69%	0.69	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-61.6	-22	174	-44.2	-73.2	0	0	0	113	S515 I519	S515-D517 PolarHBondContact O-N 3.48Å; D517-I519 PolarHBondContact O-N 2.94Å
518	S	50.8	Low	47.9	Very low	57 Å²	57	123 Å²	123	40%	0.399	66%	0.659	S	S	.	*	G	3₁₀ helix	trans	-71.1	-7.8	176.2	-168.1	0	0	0	0	113.8	S515 I516	S515-S518 PolarHBondContact O-N 3.42Å; I516-S518 PolarHBondContact O-N 2.88Å
519	I	51.1	Low	50.4	Low	137 Å²	137	124 Å²	124	70%	0.703	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-82	-15.1	-177.6	-59.6	-178.2	0	0	0	112.1	I516 D517	I516-I519 HydrophobicContact CG1-CD1 3.7Å; I516-I519 WeakPolarHBondContact O-CB 3.43Å; I516-I519 WeakPolarHBondContact O-CG1 3.2Å; I516-I519 PolarHBondContact O-N 3.27Å; I516-I519 VanDerWaalsContact O-N 3.15Å; D517-I519 PolarHBondContact O-N 2.94Å
520	Q	45.6	Very low	52.2	Low	188 Å²	188	126.6 Å²	126.6	88%	0.879	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-104.7	10.3	-178.7	-151.4	172.6	6.6	0	0	114.2
521	K	49.8	Very low	54.8	Low	113 Å²	113	125.3 Å²	125.3	49%	0.491	64%	0.636	S	S	.	*	S	Bend	trans	-74	139.9	166.5	-103.4	178.5	172.4	-81.6	0	110.3	E525 F526	K521-E525 IonicContact NZ-OE2 2.69Å; K521-E525 PolarHBondContact NZ-OE2 3.49Å; K521-F526 HydrophobicContact CB-CD2 4.14Å; K521-F526 HydrophobicContact CB-CE2 3.71Å; K521-F526 HydrophobicContact CD-CE2 3.8Å; K521-F526 HydrophobicContact CD-CZ 4.34Å; K521-F526 HydrophobicContact CG-CE2 4.4Å
522	D	41.7	Very low	57.1	Low	72 Å²	72	124.7 Å²	124.7	39%	0.385	62%	0.622	S	S	.	*			trans	-58.8	131.2	-178.6	-151	-63.6	0	0	0	109.9	R524 E525	D522-R524 PolarHBondContact O-N 2.75Å; D522-R524 IonicContact OD1-CZ 3.68Å; D522-R524 PolarHBondContact OD1-N 3.25Å; D522-R524 IonicContact OD1-NE 3.69Å; D522-R524 PolarHBondContact OD1-NE 2.96Å; D522-R524 IonicContact OD1-NH2 2.69Å; D522-R524 PolarHBondContact OD1-NH2 3.38Å; D522-R524 IonicContact OD2-NH2 3.9Å; D522-E525 HydrophobicContact CB-CG 4.42Å; D522-E525 PolarHBondContact O-N 2.92Å
523	P	54.9	Low	59.5	Low	102 Å²	102	115.8 Å²	115.8	66%	0.662	59%	0.59	S	S	*	*	H	α-helix	trans	-54.5	-24.1	179	-28.9	36.1	0	0	0	113.7	F526 A527	P523-F526 PolarHBondContact O-N 3.43Å; P523-A527 VanDerWaalsContact O-CB 3.29Å; P523-A527 WeakPolarHBondContact O-CB 3.36Å; P523-A527 PolarHBondContact O-N 2.88Å
524	R	57	Low	62.3	Low	181 Å²	181	113.8 Å²	113.8	68%	0.683	57%	0.574	S	S	*	*	H	α-helix	trans	-68.9	-27	174.7	-81.3	163.4	-79.8	-121.8	-1.6	114.7	D522 F526	D522-R524 PolarHBondContact O-N 2.75Å; D522-R524 IonicContact OD1-CZ 3.68Å; D522-R524 PolarHBondContact OD1-N 3.25Å; D522-R524 IonicContact OD1-NE 3.69Å; D522-R524 PolarHBondContact OD1-NE 2.96Å; D522-R524 IonicContact OD1-NH2 2.69Å; D522-R524 PolarHBondContact OD1-NH2 3.38Å; D522-R524 IonicContact OD2-NH2 3.9Å; R524-F526 VanDerWaalsContact C-N 3.35Å
525	E	53.3	Low	64.5	Low	122 Å²	122	112.1 Å²	112.1	57%	0.57	56%	0.556	S	S	*	*	H	α-helix	trans	-74.9	-26.5	174.2	-66.5	-167.6	159.5	0	0	112.5	K521 D522	K521-E525 IonicContact NZ-OE2 2.69Å; K521-E525 PolarHBondContact NZ-OE2 3.49Å; D522-E525 HydrophobicContact CB-CG 4.42Å; D522-E525 PolarHBondContact O-N 2.92Å
526	F	51.7	Low	66.9	Low	129 Å²	129	108.4 Å²	108.4	57%	0.566	53%	0.53	S	S	*	.	H	α-helix	trans	-89.8	-27.2	176.6	-85.5	-77.8	0	0	0	113.6	K521 P523 R524 W528	K521-F526 HydrophobicContact CB-CD2 4.14Å; K521-F526 HydrophobicContact CB-CE2 3.71Å; K521-F526 HydrophobicContact CD-CE2 3.8Å; K521-F526 HydrophobicContact CD-CZ 4.34Å; K521-F526 HydrophobicContact CG-CE2 4.4Å; P523-F526 PolarHBondContact O-N 3.43Å; R524-F526 VanDerWaalsContact C-N 3.35Å; F526-W528 VanDerWaalsContact C-N 3.32Å; F526-W528 PolarHBondContact O-N 3.01Å
527	A	58.2	Low	68.9	Low	65 Å²	65	102.4 Å²	102.4	54%	0.537	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-16.5	-171.7	0	0	0	0	0	115.7	P523	P523-A527 VanDerWaalsContact O-CB 3.29Å; P523-A527 WeakPolarHBondContact O-CB 3.36Å; P523-A527 PolarHBondContact O-N 2.88Å
528	W	63.1	Low	71.1	Confident	222 Å²	222	102 Å²	102	84%	0.841	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.1	30.5	-169.1	-56.2	109.9	0	0	0	114.2	F526	F526-W528 VanDerWaalsContact C-N 3.32Å; F526-W528 PolarHBondContact O-N 3.01Å
529	R	83.6	Confident	73.3	Confident	168 Å²	168	102.1 Å²	102.1	63%	0.634	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-80.1	131	166.5	-178.2	-170.8	165.4	112.2	-2.7	109.4	P531 E532	R529-P531 WeakPolarHBondContact O-CD 3.35Å; R529-E532 IonicContact NH2-OE1 3.93Å; R529-E532 PolarHBondContact NH2-OE1 3.35Å
530	D	82.1	Confident	75.5	Confident	122 Å²	122	95.7 Å²	95.7	65%	0.652	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-62.4	118.9	164.7	-75.4	-56.6	0	0	0	110.2	Y554	D530-Y554 PolarHBondContact OD1-OH 2.76Å
531	P	88	Confident	77.9	Confident	34 Å²	34	91.8 Å²	91.8	22%	0.221	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-69.3	144.3	178.2	29.1	-34.8	0	0	0	110.4	R529 E535 V536 M539 Y554	R529-P531 WeakPolarHBondContact O-CD 3.35Å; P531-E535 WeakPolarHBondContact CA-OE2 3.35Å; P531-E535 HydrophobicContact CB-CG 4.5Å; P531-E535 WeakPolarHBondContact CB-OE2 3.46Å; P531-V536 HydrophobicContact CB-CG2 3.85Å; P531-V536 HydrophobicContact CG-CG2 3.62Å; P531-M539 HydrophobicContact CB-CE 4.4Å; P531-Y554 HydrophobicContact CG-CD1 4.31Å; P531-Y554 HydrophobicContact CG-CE1 3.79Å
532	E	91.4	Very high	80.1	Confident	116 Å²	116	90.1 Å²	90.1	54%	0.542	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-69.6	148	178.7	-73.1	180	-149.1	0	0	110.6	R529 T534 E535 V536	R529-E532 IonicContact NH2-OE1 3.93Å; R529-E532 PolarHBondContact NH2-OE1 3.35Å; E532-T534 PolarHBondContact O-N 3.29Å; E532-T534 VanDerWaalsContact O-N 3.07Å; E532-E535 HydrophobicContact CB-CB 4.46Å; E532-E535 PolarHBondContact N-OE2 2.89Å; E532-E535 WeakPolarHBondContact O-CA 3.43Å; E532-E535 WeakPolarHBondContact O-CB 3.4Å; E532-E535 PolarHBondContact O-N 3.32Å; E532-V536 PolarHBondContact O-N 3.39Å
533	L	93.2	Very high	82.6	Confident	33 Å²	33	95.3 Å²	95.3	17%	0.173	45%	0.452	C	S	.	.	H	α-helix	trans	-56.8	-34.7	-173.6	-170.1	65	0	0	0	113	I537 L555 L558 V565 E568 V569 L572	L533-I537 HydrophobicContact CG-CD1 4.47Å; L533-I537 WeakPolarHBondContact O-CG1 3.41Å; L533-I537 PolarHBondContact O-N 2.9Å; L533-L555 HydrophobicContact CD1-CD2 3.48Å; L533-L555 VanDerWaalsContact CD1-CD2 3.48Å; L533-L558 HydrophobicContact CD1-CD1 4.02Å; L533-V565 HydrophobicContact CD1-CG1 4.02Å; L533-V565 HydrophobicContact CD2-CG1 3.98Å; L533-E568 HydrophobicContact CD2-CB 3.84Å; L533-E568 HydrophobicContact CD2-CG 3.57Å; L533-V569 HydrophobicContact CD1-CG2 3.81Å; L533-V569 HydrophobicContact CD2-CG2 3.99Å; L533-V569 HydrophobicContact CG-CG2 4.17Å; L533-L572 HydrophobicContact CD2-CD1 4.3Å; L533-L572 HydrophobicContact CG-CD1 4.3Å
534	T	94.4	Very high	84.6	Confident	64 Å²	64	96.7 Å²	96.7	39%	0.393	45%	0.447	S	S	.	.	H	α-helix	trans	-61.7	-43.3	171.5	-52.4	0	0	0	0	112.1	E532 I537 H538	E532-T534 PolarHBondContact O-N 3.29Å; E532-T534 VanDerWaalsContact O-N 3.07Å; T534-I537 PolarHBondContact O-N 2.96Å; T534-H538 PolarHBondContact O-N 3.46Å; T534-H538 PolarHBondContact O-ND1 2.93Å
535	E	95.1	Very high	86.5	Confident	87 Å²	87	89.9 Å²	89.9	41%	0.407	43%	0.427	S	S	.	.	H	α-helix	trans	-63.5	-46.3	178.6	-170.4	-174.5	177.7	0	0	110.8	P531 E532 I537 H538 M539	P531-E535 WeakPolarHBondContact CA-OE2 3.35Å; P531-E535 HydrophobicContact CB-CG 4.5Å; P531-E535 WeakPolarHBondContact CB-OE2 3.46Å; E532-E535 HydrophobicContact CB-CB 4.46Å; E532-E535 PolarHBondContact N-OE2 2.89Å; E532-E535 WeakPolarHBondContact O-CA 3.43Å; E532-E535 WeakPolarHBondContact O-CB 3.4Å; E532-E535 PolarHBondContact O-N 3.32Å; E535-I537 VanDerWaalsContact C-N 3.28Å; E535-I537 PolarHBondContact O-N 2.85Å; E535-H538 CarbonylContact O-C 3.58Å; E535-H538 WeakPolarHBondContact O-CA 3.46Å; E535-H538 WeakPolarHBondContact O-CB 3.45Å; E535-H538 PolarHBondContact O-N 3.48Å; E535-M539 HydrophobicContact CG-CE 3.86Å; E535-M539 WeakPolarHBondContact O-CG 3.32Å; E535-M539 PolarHBondContact O-N 3.23Å; E535-M539 WeakPolarHBondContact OE1-CE 3.18Å
536	V	96.1	Very high	88.5	Confident	2 Å²	2	87.2 Å²	87.2	1%	0.012	42%	0.422	C	S	.	.	H	α-helix	trans	-58.9	-39.4	176.8	-175.3	0	0	0	0	111.7	P531 E532 H538 M539 L540 A551 Y554 L555	P531-V536 HydrophobicContact CB-CG2 3.85Å; P531-V536 HydrophobicContact CG-CG2 3.62Å; E532-V536 PolarHBondContact O-N 3.39Å; V536-H538 VanDerWaalsContact C-N 3.3Å; V536-H538 PolarHBondContact O-N 2.88Å; V536-M539 WeakPolarHBondContact O-CB 3.39Å; V536-M539 PolarHBondContact O-N 2.91Å; V536-M539 VanDerWaalsContact O-N 3.13Å; V536-L540 PolarHBondContact O-N 3.4Å; V536-A551 HydrophobicContact CG1-CB 3.95Å; V536-Y554 HydrophobicContact CB-CD1 4.49Å; V536-Y554 HydrophobicContact CG1-CD1 4.04Å; V536-Y554 HydrophobicContact CG2-CD1 3.64Å; V536-Y554 HydrophobicContact CG2-CE1 3.74Å; V536-L555 HydrophobicContact CB-CD2 4.31Å; V536-L555 HydrophobicContact CG1-CD1 4.22Å; V536-L555 HydrophobicContact CG1-CD2 3.76Å; V536-L555 HydrophobicContact CG1-CG 3.64Å
537	I	95.9	Very high	90.6	Very high	7 Å²	7	83 Å²	83	4%	0.036	41%	0.406	C	S	.	.	H	α-helix	trans	-67.5	-29.7	176.6	-70.9	169	0	0	0	112	L533 T534 E535 L555 V569 L572	L533-I537 HydrophobicContact CG-CD1 4.47Å; L533-I537 WeakPolarHBondContact O-CG1 3.41Å; L533-I537 PolarHBondContact O-N 2.9Å; T534-I537 PolarHBondContact O-N 2.96Å; E535-I537 VanDerWaalsContact C-N 3.28Å; E535-I537 PolarHBondContact O-N 2.85Å; I537-L555 HydrophobicContact CG1-CD1 4.39Å; I537-V569 HydrophobicContact CD1-CG1 4.35Å; I537-V569 HydrophobicContact CD1-CG2 4.45Å; I537-L572 HydrophobicContact CD1-CB 3.51Å; I537-L572 HydrophobicContact CD1-CD1 3.87Å; I537-L572 HydrophobicContact CD1-CG 4.35Å
538	H	96.2	Very high	92.5	Very high	121 Å²	121	80.9 Å²	80.9	56%	0.56	39%	0.385	S	S	*	.	H	α-helix	trans	-73.6	-36.1	168.9	-69.5	84.4	0	0	0	111.9	T534 E535 V536 L540 Q541	T534-H538 PolarHBondContact O-N 3.46Å; T534-H538 PolarHBondContact O-ND1 2.93Å; E535-H538 CarbonylContact O-C 3.58Å; E535-H538 WeakPolarHBondContact O-CA 3.46Å; E535-H538 WeakPolarHBondContact O-CB 3.45Å; E535-H538 PolarHBondContact O-N 3.48Å; V536-H538 VanDerWaalsContact C-N 3.3Å; V536-H538 PolarHBondContact O-N 2.88Å; H538-L540 PolarHBondContact O-N 3.41Å; H538-Q541 WeakPolarHBondContact O-CB 3.31Å; H538-Q541 PolarHBondContact O-N 2.88Å
539	M	96.4	Very high	94.1	Very high	60 Å²	60	70.3 Å²	70.3	30%	0.296	35%	0.345	S	S	.	.	H	α-helix	trans	-61.5	-26.9	176.1	-67.5	-176.9	-179.1	0	0	113.4	P531 E535 V536 Q541 H542 V547 A551	P531-M539 HydrophobicContact CB-CE 4.4Å; E535-M539 HydrophobicContact CG-CE 3.86Å; E535-M539 WeakPolarHBondContact O-CG 3.32Å; E535-M539 PolarHBondContact O-N 3.23Å; E535-M539 WeakPolarHBondContact OE1-CE 3.18Å; V536-M539 WeakPolarHBondContact O-CB 3.39Å; V536-M539 PolarHBondContact O-N 2.91Å; V536-M539 VanDerWaalsContact O-N 3.13Å; M539-Q541 PolarHBondContact O-N 2.76Å; M539-H542 VanDerWaalsContact O-CB 3.24Å; M539-H542 WeakPolarHBondContact O-CB 3.48Å; M539-H542 PolarHBondContact O-N 3.32Å; M539-H542 VanDerWaalsContact O-N 3.09Å; M539-V547 HydrophobicContact CB-CG1 4.01Å; M539-V547 HydrophobicContact CG-CG1 4.34Å; M539-A551 HydrophobicContact CB-CB 3.69Å
540	L	96.7	Very high	94.7	Very high	2 Å²	2	67.3 Å²	67.3	1%	0.01	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-27.3	170.3	-63.2	179.4	0	0	0	113.3	V536 H538 Q548 A551 A552 L555 H577 L578 L581	V536-L540 PolarHBondContact O-N 3.4Å; H538-L540 PolarHBondContact O-N 3.41Å; L540-Q548 WeakPolarHBondContact O-CG 3.37Å; L540-Q548 PolarHBondContact O-NE2 3.33Å; L540-A551 HydrophobicContact CD2-CB 3.92Å; L540-A552 HydrophobicContact CD2-CB 4.09Å; L540-L555 HydrophobicContact CD1-CD1 3.78Å; L540-L555 HydrophobicContact CD2-CD1 4.19Å; L540-L555 HydrophobicContact CG-CD1 4.24Å; L540-H577 HydrophobicContact CB-CB 4.09Å; L540-H577 HydrophobicContact CD1-CB 3.81Å; L540-L578 HydrophobicContact CD1-CD2 3.83Å; L540-L578 HydrophobicContact CD1-CG 3.81Å; L540-L578 HydrophobicContact CD2-CD2 3.77Å; L540-L578 HydrophobicContact CG-CD2 4.48Å; L540-L581 HydrophobicContact CB-CD1 4.06Å; L540-L581 HydrophobicContact CD2-CD1 3.88Å; L540-L581 HydrophobicContact CG-CD1 4.47Å
541	Q	96.3	Very high	95.4	Very high	106 Å²	106	61.8 Å²	61.8	50%	0.495	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	0.8	179.8	-62.7	176.2	76.8	0	0	113.1	H538 M539 H577	H538-Q541 WeakPolarHBondContact O-CB 3.31Å; H538-Q541 PolarHBondContact O-N 2.88Å; M539-Q541 PolarHBondContact O-N 2.76Å; Q541-H577 VanDerWaalsContact CD-CD2 3.49Å; Q541-H577 PolarHBondContact NE2-NE2 3.22Å
542	H	96.4	Very high	95.9	Very high	78 Å²	78	60.1 Å²	60.1	36%	0.361	30%	0.302	S	S	.	.			trans	-67.2	141	-174.6	-159.5	-74.8	0	0	0	112.7	M539 F544 V547 Q548	M539-H542 VanDerWaalsContact O-CB 3.24Å; M539-H542 WeakPolarHBondContact O-CB 3.48Å; M539-H542 PolarHBondContact O-N 3.32Å; M539-H542 VanDerWaalsContact O-N 3.09Å; H542-F544 AromaticContact CE1-CD2 3.27Å; H542-F544 WeakPolarHBondContact CE1-CD2 3.33Å; H542-F544 AromaticContact CE1-CE2 3.73Å; H542-F544 AromaticContact CE1-CG 3.96Å; H542-F544 AromaticContact ND1-CD2 3.54Å; H542-F544 AromaticContact ND1-CG 3.8Å; H542-F544 PolarHBondContact ND1-N 3.47Å; H542-F544 PolarHBondContact O-N 2.83Å; H542-V547 HydrophobicContact CB-CB 4.02Å; H542-V547 HydrophobicContact CB-CG1 3.66Å; H542-Q548 WeakPolarHBondContact O-CG 3.36Å; H542-Q548 PolarHBondContact O-NE2 3.18Å
543	H	95.1	Very high	96.1	Very high	181 Å²	181	56.3 Å²	56.3	84%	0.838	29%	0.29	S	S	*	.	S	Bend	trans	-62.5	-0.2	179	-62.5	-59.1	0	0	0	116.2
544	F	96.4	Very high	96.3	Very high	130 Å²	130	57.6 Å²	57.6	57%	0.57	29%	0.294	S	S	*	.			trans	-114.6	116	-177.2	-66.6	-38.7	0	0	0	110.2	H542 S546 V547 Q548	H542-F544 AromaticContact CE1-CD2 3.27Å; H542-F544 WeakPolarHBondContact CE1-CD2 3.33Å; H542-F544 AromaticContact CE1-CE2 3.73Å; H542-F544 AromaticContact CE1-CG 3.96Å; H542-F544 AromaticContact ND1-CD2 3.54Å; H542-F544 AromaticContact ND1-CG 3.8Å; H542-F544 PolarHBondContact ND1-N 3.47Å; H542-F544 PolarHBondContact O-N 2.83Å; F544-S546 PolarHBondContact O-N 3.46Å; F544-S546 VanDerWaalsContact O-N 3.11Å; F544-V547 HydrophobicContact CB-CB 4.34Å; F544-V547 HydrophobicContact CB-CG2 3.94Å; F544-V547 HydrophobicContact CD2-CG2 4.43Å; F544-V547 WeakPolarHBondContact O-CB 3.47Å; F544-V547 PolarHBondContact O-N 3.32Å; F544-Q548 PolarHBondContact O-N 2.86Å
545	P	96	Very high	96.4	Very high	38 Å²	38	54.6 Å²	54.6	25%	0.247	28%	0.275	C	S	.	.	H	α-helix	trans	-55.9	-30.8	-177.6	-30.6	37.7	0	0	0	114.7	Q548 A549 V589	P545-Q548 PolarHBondContact O-N 2.8Å; P545-A549 VanDerWaalsContact O-CB 3.26Å; P545-A549 WeakPolarHBondContact O-CB 3.48Å; P545-A549 PolarHBondContact O-N 3.43Å; P545-V589 HydrophobicContact CB-CG2 3.97Å; P545-V589 VanDerWaalsContact O-CG2 3.24Å; P545-V589 WeakPolarHBondContact O-CG2 3.24Å
546	S	95.7	Very high	96.4	Very high	67 Å²	67	53 Å²	53	47%	0.469	27%	0.268	S	S	.	.	H	α-helix	trans	-66	-39.4	174.9	47.8	0	0	0	0	112.9	F544 N550	F544-S546 PolarHBondContact O-N 3.46Å; F544-S546 VanDerWaalsContact O-N 3.11Å; S546-N550 WeakPolarHBondContact O-CB 3.34Å; S546-N550 VanDerWaalsContact O-CG 3.23Å; S546-N550 PolarHBondContact O-N 3.5Å; S546-N550 PolarHBondContact O-ND2 2.89Å
547	V	96.3	Very high	96.3	Very high	39 Å²	39	59.5 Å²	59.5	24%	0.236	30%	0.298	C	S	.	.	H	α-helix	trans	-66.4	-42.9	175.1	178.5	0	0	0	0	110	M539 H542 F544 N550 A551	M539-V547 HydrophobicContact CB-CG1 4.01Å; M539-V547 HydrophobicContact CG-CG1 4.34Å; H542-V547 HydrophobicContact CB-CB 4.02Å; H542-V547 HydrophobicContact CB-CG1 3.66Å; F544-V547 HydrophobicContact CB-CB 4.34Å; F544-V547 HydrophobicContact CB-CG2 3.94Å; F544-V547 HydrophobicContact CD2-CG2 4.43Å; F544-V547 WeakPolarHBondContact O-CB 3.47Å; F544-V547 PolarHBondContact O-N 3.32Å; V547-N550 PolarHBondContact O-N 3.26Å; V547-A551 VanDerWaalsContact O-CB 3.26Å; V547-A551 WeakPolarHBondContact O-CB 3.44Å; V547-A551 PolarHBondContact O-N 3.01Å
548	Q	97.4	Very high	96.2	Very high	21 Å²	21	61.6 Å²	61.6	10%	0.098	31%	0.308	C	S	.	.	H	α-helix	trans	-64.3	-43.3	176.9	-58	179.5	-61.3	0	0	112.1	L540 H542 F544 P545 A552 L581 V589	L540-Q548 WeakPolarHBondContact O-CG 3.37Å; L540-Q548 PolarHBondContact O-NE2 3.33Å; H542-Q548 WeakPolarHBondContact O-CG 3.36Å; H542-Q548 PolarHBondContact O-NE2 3.18Å; F544-Q548 PolarHBondContact O-N 2.86Å; P545-Q548 PolarHBondContact O-N 2.8Å; Q548-A552 VanDerWaalsContact O-CB 3.29Å; Q548-A552 WeakPolarHBondContact O-CB 3.49Å; Q548-A552 PolarHBondContact O-N 3.4Å; Q548-L581 HydrophobicContact CB-CD1 4.49Å; Q548-L581 HydrophobicContact CB-CD2 4.37Å; Q548-L581 HydrophobicContact CG-CD2 4.47Å; Q548-L581 VanDerWaalsContact NE2-CD2 3.33Å; Q548-V589 HydrophobicContact CB-CG1 4.32Å; Q548-V589 HydrophobicContact CB-CG2 4.36Å
549	A	97.3	Very high	96.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.5	-44.6	177.1	0	0	0	0	0	112.2	P545 A552 A553 E588 V589 N592	P545-A549 VanDerWaalsContact O-CB 3.26Å; P545-A549 WeakPolarHBondContact O-CB 3.48Å; P545-A549 PolarHBondContact O-N 3.43Å; A549-A552 PolarHBondContact O-N 3.26Å; A549-A553 WeakPolarHBondContact O-CB 3.46Å; A549-A553 PolarHBondContact O-N 2.92Å; A549-E588 HydrophobicContact CB-CG 3.97Å; A549-V589 HydrophobicContact CB-CG2 4Å; A549-N592 PolarHBondContact O-ND2 3.19Å
550	N	96.6	Very high	95.7	Very high	106 Å²	106	60.5 Å²	60.5	57%	0.567	30%	0.301	S	S	*	.	H	α-helix	trans	-66.8	-44.2	177.5	-73.5	-15.7	0	0	0	111.8	S546 V547 A552 A553 Y554	S546-N550 WeakPolarHBondContact O-CB 3.34Å; S546-N550 VanDerWaalsContact O-CG 3.23Å; S546-N550 PolarHBondContact O-N 3.5Å; S546-N550 PolarHBondContact O-ND2 2.89Å; V547-N550 PolarHBondContact O-N 3.26Å; N550-A552 PolarHBondContact O-N 2.93Å; N550-A553 PolarHBondContact O-N 3.33Å; N550-Y554 WeakPolarHBondContact O-CB 3.19Å; N550-Y554 PolarHBondContact O-N 3.25Å
551	A	97.3	Very high	95.1	Very high	5 Å²	5	63.2 Å²	63.2	4%	0.041	33%	0.329	C	S	.	.	H	α-helix	trans	-62	-42.4	176.1	0	0	0	0	0	111.9	V536 M539 L540 V547 Y554 L555	V536-A551 HydrophobicContact CG1-CB 3.95Å; M539-A551 HydrophobicContact CB-CB 3.69Å; L540-A551 HydrophobicContact CD2-CB 3.92Å; V547-A551 VanDerWaalsContact O-CB 3.26Å; V547-A551 WeakPolarHBondContact O-CB 3.44Å; V547-A551 PolarHBondContact O-N 3.01Å; A551-Y554 PolarHBondContact O-N 3.22Å; A551-L555 WeakPolarHBondContact O-CG 3.35Å; A551-L555 PolarHBondContact O-N 2.97Å
552	A	97.6	Very high	94.9	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64.9	-40.5	174.8	0	0	0	0	0	112.4	L540 Q548 A549 N550 L555 Q556 L578 N592	L540-A552 HydrophobicContact CD2-CB 4.09Å; Q548-A552 VanDerWaalsContact O-CB 3.29Å; Q548-A552 WeakPolarHBondContact O-CB 3.49Å; Q548-A552 PolarHBondContact O-N 3.4Å; A549-A552 PolarHBondContact O-N 3.26Å; N550-A552 PolarHBondContact O-N 2.93Å; A552-L555 PolarHBondContact O-N 3.29Å; A552-Q556 WeakPolarHBondContact O-CB 3.37Å; A552-Q556 PolarHBondContact O-N 3.27Å; A552-L578 HydrophobicContact CB-CD2 4.07Å; A552-N592 HydrophobicContact CB-CB 3.8Å
553	A	96.7	Very high	94.7	Very high	35 Å²	35	60.9 Å²	60.9	29%	0.289	32%	0.323	S	S	.	.	H	α-helix	trans	-65.6	-39.7	175.5	0	0	0	0	0	112.5	A549 N550 Q556 H557 N592	A549-A553 WeakPolarHBondContact O-CB 3.46Å; A549-A553 PolarHBondContact O-N 2.92Å; N550-A553 PolarHBondContact O-N 3.33Å; A553-Q556 WeakPolarHBondContact O-CB 3.46Å; A553-Q556 PolarHBondContact O-N 3.45Å; A553-H557 PolarHBondContact O-N 3.24Å; A553-N592 HydrophobicContact CB-CB 4.45Å
554	Y	96.2	Very high	94.7	Very high	61 Å²	61	61.7 Å²	61.7	24%	0.239	32%	0.318	C	S	.	.	H	α-helix	trans	-64.8	-43.9	175.3	-172.6	-108.3	0	0	0	111.3	D530 P531 V536 N550 A551 Q556 H557 L558	D530-Y554 PolarHBondContact OD1-OH 2.76Å; P531-Y554 HydrophobicContact CG-CD1 4.31Å; P531-Y554 HydrophobicContact CG-CE1 3.79Å; V536-Y554 HydrophobicContact CB-CD1 4.49Å; V536-Y554 HydrophobicContact CG1-CD1 4.04Å; V536-Y554 HydrophobicContact CG2-CD1 3.64Å; V536-Y554 HydrophobicContact CG2-CE1 3.74Å; N550-Y554 WeakPolarHBondContact O-CB 3.19Å; N550-Y554 PolarHBondContact O-N 3.25Å; A551-Y554 PolarHBondContact O-N 3.22Å; Y554-Q556 VanDerWaalsContact C-N 3.34Å; Y554-Q556 PolarHBondContact O-N 2.96Å; Y554-H557 PolarHBondContact O-N 3.25Å; Y554-L558 HydrophobicContact CD1-CD1 3.91Å; Y554-L558 HydrophobicContact CD1-CG 4.39Å; Y554-L558 HydrophobicContact CE1-CD1 3.55Å; Y554-L558 HydrophobicContact CE1-CG 4.21Å; Y554-L558 WeakPolarHBondContact O-CG 3.48Å; Y554-L558 PolarHBondContact O-N 2.67Å
555	L	96.1	Very high	94.6	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60.9	-40.8	170.8	-69	179.9	0	0	0	112.3	L533 V536 I537 L540 A551 A552 H557 L558 C559 V569 L578 A596	L533-L555 HydrophobicContact CD1-CD2 3.48Å; L533-L555 VanDerWaalsContact CD1-CD2 3.48Å; V536-L555 HydrophobicContact CB-CD2 4.31Å; V536-L555 HydrophobicContact CG1-CD1 4.22Å; V536-L555 HydrophobicContact CG1-CD2 3.76Å; V536-L555 HydrophobicContact CG1-CG 3.64Å; I537-L555 HydrophobicContact CG1-CD1 4.39Å; L540-L555 HydrophobicContact CD1-CD1 3.78Å; L540-L555 HydrophobicContact CD2-CD1 4.19Å; L540-L555 HydrophobicContact CG-CD1 4.24Å; A551-L555 WeakPolarHBondContact O-CG 3.35Å; A551-L555 PolarHBondContact O-N 2.97Å; A552-L555 PolarHBondContact O-N 3.29Å; L555-H557 VanDerWaalsContact C-N 3.31Å; L555-H557 PolarHBondContact O-N 3.29Å; L555-L558 PolarHBondContact O-N 2.87Å; L555-C559 WeakPolarHBondContact O-CB 3.44Å; L555-C559 PolarHBondContact O-N 3.12Å; L555-C559 PolarHBondContact O-SG 3.44Å; L555-V569 HydrophobicContact CD2-CG2 4.02Å; L555-L578 HydrophobicContact CD1-CD1 4.25Å; L555-L578 HydrophobicContact CD1-CD2 4.38Å; L555-A596 HydrophobicContact CB-CB 4.43Å
556	Q	95.5	Very high	94.5	Very high	54 Å²	54	55.2 Å²	55.2	25%	0.252	29%	0.288	S	S	.	.	H	α-helix	trans	-58.9	-42.5	175.7	-176.4	-179.5	8.9	0	0	111.8	A552 A553 Y554 F560 A596 N599	A552-Q556 WeakPolarHBondContact O-CB 3.37Å; A552-Q556 PolarHBondContact O-N 3.27Å; A553-Q556 WeakPolarHBondContact O-CB 3.46Å; A553-Q556 PolarHBondContact O-N 3.45Å; Y554-Q556 VanDerWaalsContact C-N 3.34Å; Y554-Q556 PolarHBondContact O-N 2.96Å; Q556-F560 PolarHBondContact O-N 3.41Å; Q556-A596 HydrophobicContact CB-CB 4.01Å; Q556-N599 WeakPolarHBondContact CG-ND2 3.42Å; Q556-N599 PolarHBondContact O-ND2 2.87Å
557	H	95	Very high	94.5	Very high	139 Å²	139	54.6 Å²	54.6	64%	0.644	28%	0.284	S	S	*	.	H	α-helix	trans	-64.1	-54.9	176	176.3	70.4	0	0	0	111.7	A553 Y554 L555 C559 F560	A553-H557 PolarHBondContact O-N 3.24Å; Y554-H557 PolarHBondContact O-N 3.25Å; L555-H557 VanDerWaalsContact C-N 3.31Å; L555-H557 PolarHBondContact O-N 3.29Å; H557-C559 VanDerWaalsContact C-N 3.26Å; H557-C559 PolarHBondContact O-N 2.9Å; H557-F560 VanDerWaalsContact O-CB 3.24Å; H557-F560 WeakPolarHBondContact O-CB 3.41Å; H557-F560 PolarHBondContact O-N 3.43Å
558	L	93.2	Very high	94.5	Very high	50 Å²	50	55.8 Å²	55.8	26%	0.262	29%	0.287	S	S	.	.	H	α-helix	trans	-59.3	-37.4	-179.7	-63.5	179.8	0	0	0	112.3	L533 Y554 L555 F560 V565	L533-L558 HydrophobicContact CD1-CD1 4.02Å; Y554-L558 HydrophobicContact CD1-CD1 3.91Å; Y554-L558 HydrophobicContact CD1-CG 4.39Å; Y554-L558 HydrophobicContact CE1-CD1 3.55Å; Y554-L558 HydrophobicContact CE1-CG 4.21Å; Y554-L558 WeakPolarHBondContact O-CG 3.48Å; Y554-L558 PolarHBondContact O-N 2.67Å; L555-L558 PolarHBondContact O-N 2.87Å; L558-F560 VanDerWaalsContact C-N 3.28Å; L558-F560 PolarHBondContact O-N 2.68Å; L558-V565 HydrophobicContact CB-CG1 3.95Å
559	C	93.2	Very high	94.4	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	0.6	178.1	-65.7	0	0	0	0	114.4	L555 H557 K566 N599 L600	L555-C559 WeakPolarHBondContact O-CB 3.44Å; L555-C559 PolarHBondContact O-N 3.12Å; L555-C559 PolarHBondContact O-SG 3.44Å; H557-C559 VanDerWaalsContact C-N 3.26Å; H557-C559 PolarHBondContact O-N 2.9Å; C559-K566 HydrophobicContact CB-CG 3.96Å; C559-K566 WeakPolarHBondContact O-CE 3.29Å; C559-N599 HydrophobicContact CB-CB 4.05Å; C559-L600 HydrophobicContact CB-CD2 4.36Å; C559-L600 HydrophobicContact CB-CG 4.32Å; C559-L600 WeakPolarHBondContact SG-CD2 3.43Å
560	F	89.4	Confident	94.3	Very high	159 Å²	159	56.3 Å²	56.3	70%	0.697	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-48.1	179.4	-174.6	-108.3	0	0	0	111.9	Q556 H557 L558	Q556-F560 PolarHBondContact O-N 3.41Å; H557-F560 VanDerWaalsContact O-CB 3.24Å; H557-F560 WeakPolarHBondContact O-CB 3.41Å; H557-F560 PolarHBondContact O-N 3.43Å; L558-F560 VanDerWaalsContact C-N 3.28Å; L558-F560 PolarHBondContact O-N 2.68Å
561	G	83.6	Confident	94.3	Very high	58 Å²	58	59.2 Å²	59.2	60%	0.598	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-37.5	-176.1	0	0	0	0	0	115.8	N563	G561-N563 PolarHBondContact O-N 3.27Å
562	D	91.8	Very high	94.2	Very high	64 Å²	64	61.1 Å²	61.1	34%	0.342	31%	0.305	S	S	.	.			trans	-91	108.2	-168.3	-167.7	-1.8	0	0	0	113.6	R564 V565 K566	D562-R564 PolarHBondContact O-N 3.17Å; D562-R564 WeakPolarHBondContact OD1-CA 3.47Å; D562-R564 VanDerWaalsContact OD1-CB 3.23Å; D562-R564 WeakPolarHBondContact OD1-CB 3.2Å; D562-R564 WeakPolarHBondContact OD1-CG 3.43Å; D562-R564 PolarHBondContact OD1-N 3.36Å; D562-V565 HydrophobicContact CB-CB 4.26Å; D562-V565 HydrophobicContact CB-CG2 4.06Å; D562-V565 PolarHBondContact O-N 3.27Å; D562-K566 WeakPolarHBondContact O-CG 3.37Å; D562-K566 PolarHBondContact O-N 2.91Å
563	N	93.4	Very high	94	Very high	72 Å²	72	62.5 Å²	62.5	39%	0.385	32%	0.319	S	S	.	.	H	α-helix	trans	-67	-20	174.6	-60.9	-40.6	0	0	0	113.3	G561 K566 S567 M606	G561-N563 PolarHBondContact O-N 3.27Å; N563-K566 PolarHBondContact OD1-NZ 3.36Å; N563-S567 WeakPolarHBondContact O-CB 3.42Å; N563-S567 PolarHBondContact O-N 2.87Å; N563-S567 PolarHBondContact O-OG 3.38Å; N563-M606 HydrophobicContact CB-CE 4.27Å; N563-M606 HydrophobicContact CB-SD 4.29Å
564	R	94	Very high	94	Very high	197 Å²	197	60.9 Å²	60.9	74%	0.743	31%	0.306	S	S	*	.	H	α-helix	trans	-69.3	-48.7	172.1	-57.9	175.9	66.7	-132.4	0.9	110.1	D562 K566 S567 E568	D562-R564 PolarHBondContact O-N 3.17Å; D562-R564 WeakPolarHBondContact OD1-CA 3.47Å; D562-R564 VanDerWaalsContact OD1-CB 3.23Å; D562-R564 WeakPolarHBondContact OD1-CB 3.2Å; D562-R564 WeakPolarHBondContact OD1-CG 3.43Å; D562-R564 PolarHBondContact OD1-N 3.36Å; R564-K566 VanDerWaalsContact C-N 3.35Å; R564-K566 PolarHBondContact O-N 2.94Å; R564-S567 WeakPolarHBondContact O-CB 3.44Å; R564-S567 PolarHBondContact O-N 2.88Å; R564-E568 WeakPolarHBondContact O-CB 3.39Å; R564-E568 PolarHBondContact O-N 3.23Å
565	V	94.6	Very high	94.1	Very high	27 Å²	27	58.2 Å²	58.2	16%	0.164	30%	0.295	C	S	.	.	H	α-helix	trans	-60.6	-44.5	174.1	177.6	0	0	0	0	110.8	L533 L558 D562 S567 E568 V569	L533-V565 HydrophobicContact CD1-CG1 4.02Å; L533-V565 HydrophobicContact CD2-CG1 3.98Å; L558-V565 HydrophobicContact CB-CG1 3.95Å; D562-V565 HydrophobicContact CB-CB 4.26Å; D562-V565 HydrophobicContact CB-CG2 4.06Å; D562-V565 PolarHBondContact O-N 3.27Å; V565-S567 VanDerWaalsContact C-N 3.27Å; V565-S567 PolarHBondContact O-N 3.46Å; V565-E568 PolarHBondContact O-N 3.45Å; V565-E568 VanDerWaalsContact O-N 3.12Å; V565-V569 HydrophobicContact CG1-CG2 4.1Å; V565-V569 WeakPolarHBondContact O-CG2 3.25Å; V565-V569 PolarHBondContact O-N 3.07Å
566	K	94.7	Very high	94.1	Very high	5 Å²	5	63.3 Å²	63.3	2%	0.022	32%	0.318	C	S	.	.	H	α-helix	trans	-56	-41.2	175.3	-66.5	177.4	-165.7	166.5	0	113	C559 D562 N563 R564 C570 N599 L600 Y602 M606 N609	C559-K566 HydrophobicContact CB-CG 3.96Å; C559-K566 WeakPolarHBondContact O-CE 3.29Å; D562-K566 WeakPolarHBondContact O-CG 3.37Å; D562-K566 PolarHBondContact O-N 2.91Å; N563-K566 PolarHBondContact OD1-NZ 3.36Å; R564-K566 VanDerWaalsContact C-N 3.35Å; R564-K566 PolarHBondContact O-N 2.94Å; K566-C570 PolarHBondContact O-N 3.38Å; K566-N599 WeakPolarHBondContact CD-O 3.37Å; K566-N599 WeakPolarHBondContact CE-O 3.24Å; K566-L600 HydrophobicContact CB-CD2 4.17Å; K566-L600 HydrophobicContact CG-CD2 4.35Å; K566-Y602 PolarHBondContact NZ-O 2.92Å; K566-M606 HydrophobicContact CB-SD 3.5Å; K566-M606 VanDerWaalsContact CB-SD 3.5Å; K566-M606 HydrophobicContact CD-CG 3.92Å; K566-M606 HydrophobicContact CD-SD 3.77Å; K566-M606 HydrophobicContact CG-SD 4.32Å; K566-N609 PolarHBondContact O-ND2 3.4Å
567	S	95.3	Very high	94.2	Very high	54 Å²	54	62.7 Å²	62.7	38%	0.378	32%	0.315	S	S	.	.	H	α-helix	trans	-68.8	-39.9	177.2	-54.7	0	0	0	0	111.5	N563 R564 V565 C570 R571	N563-S567 WeakPolarHBondContact O-CB 3.42Å; N563-S567 PolarHBondContact O-N 2.87Å; N563-S567 PolarHBondContact O-OG 3.38Å; R564-S567 WeakPolarHBondContact O-CB 3.44Å; R564-S567 PolarHBondContact O-N 2.88Å; V565-S567 VanDerWaalsContact C-N 3.27Å; V565-S567 PolarHBondContact O-N 3.46Å; S567-C570 WeakPolarHBondContact O-CB 3.47Å; S567-C570 PolarHBondContact O-N 2.91Å; S567-R571 PolarHBondContact O-N 3.08Å
568	E	95.7	Very high	94.3	Very high	64 Å²	64	56 Å²	56	30%	0.299	28%	0.284	S	S	.	.	H	α-helix	trans	-70.2	-39	-179	-173	66	-179.5	0	0	112.3	L533 R564 V565 C570 R571 L572	L533-E568 HydrophobicContact CD2-CB 3.84Å; L533-E568 HydrophobicContact CD2-CG 3.57Å; R564-E568 WeakPolarHBondContact O-CB 3.39Å; R564-E568 PolarHBondContact O-N 3.23Å; V565-E568 PolarHBondContact O-N 3.45Å; V565-E568 VanDerWaalsContact O-N 3.12Å; E568-C570 VanDerWaalsContact C-N 3.25Å; E568-C570 PolarHBondContact O-N 3.26Å; E568-R571 VanDerWaalsContact CD-NE 3.35Å; E568-R571 PolarHBondContact O-N 3.49Å; E568-R571 VanDerWaalsContact O-N 3.17Å; E568-R571 IonicContact OE1-CZ 2.95Å; E568-R571 IonicContact OE1-NE 3.79Å; E568-R571 PolarHBondContact OE1-NE 3.18Å; E568-R571 IonicContact OE1-NH2 2.59Å; E568-R571 PolarHBondContact OE1-NH2 3.25Å; E568-R571 IonicContact OE2-CZ 3.52Å; E568-R571 IonicContact OE2-NE 3.13Å; E568-R571 PolarHBondContact OE2-NE 3.37Å; E568-R571 IonicContact OE2-NH2 3.18Å; E568-L572 HydrophobicContact CG-CD1 3.92Å; E568-L572 HydrophobicContact CG-CG 4.38Å; E568-L572 WeakPolarHBondContact O-CB 3.5Å; E568-L572 VanDerWaalsContact O-CG 3.32Å; E568-L572 WeakPolarHBondContact O-CG 3.46Å; E568-L572 PolarHBondContact O-N 2.83Å
569	V	95.8	Very high	94.5	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-35.6	171.7	174.5	0	0	0	0	111.4	L533 I537 L555 V565 G573 G574 L600	L533-V569 HydrophobicContact CD1-CG2 3.81Å; L533-V569 HydrophobicContact CD2-CG2 3.99Å; L533-V569 HydrophobicContact CG-CG2 4.17Å; I537-V569 HydrophobicContact CD1-CG1 4.35Å; I537-V569 HydrophobicContact CD1-CG2 4.45Å; L555-V569 HydrophobicContact CD2-CG2 4.02Å; V565-V569 HydrophobicContact CG1-CG2 4.1Å; V565-V569 WeakPolarHBondContact O-CG2 3.25Å; V565-V569 PolarHBondContact O-N 3.07Å; V569-G573 PolarHBondContact O-N 3.23Å; V569-G574 PolarHBondContact O-N 3.28Å; V569-L600 HydrophobicContact CB-CD2 3.74Å; V569-L600 HydrophobicContact CG1-CD1 3.91Å; V569-L600 HydrophobicContact CG1-CD2 3.75Å; V569-L600 HydrophobicContact CG1-CG 4.49Å; V569-L600 HydrophobicContact CG2-CD2 4.35Å
570	C	95.4	Very high	94.6	Very high	32 Å²	32	57.6 Å²	57.6	22%	0.216	29%	0.293	C	S	.	.	H	α-helix	trans	-66.8	-48.8	171.8	-173.5	0	0	0	0	111.3	K566 S567 E568 L572 G573 I575 N609 A612	K566-C570 PolarHBondContact O-N 3.38Å; S567-C570 WeakPolarHBondContact O-CB 3.47Å; S567-C570 PolarHBondContact O-N 2.91Å; E568-C570 VanDerWaalsContact C-N 3.25Å; E568-C570 PolarHBondContact O-N 3.26Å; C570-L572 VanDerWaalsContact C-N 3.28Å; C570-L572 PolarHBondContact O-N 3.15Å; C570-G573 PolarHBondContact O-N 3.31Å; C570-I575 HydrophobicContact CB-CD1 3.7Å; C570-N609 WeakPolarHBondContact CB-OD1 3.16Å; C570-A612 VanDerWaalsContact SG-CB 3.58Å
571	R	95.8	Very high	95	Very high	167 Å²	167	50.6 Å²	50.6	63%	0.63	26%	0.262	S	S	*	.	H	α-helix	trans	-58.7	-36.6	178.5	-165.2	-168.5	70	75.4	-3.5	113	S567 E568 G573	S567-R571 PolarHBondContact O-N 3.08Å; E568-R571 VanDerWaalsContact CD-NE 3.35Å; E568-R571 PolarHBondContact O-N 3.49Å; E568-R571 VanDerWaalsContact O-N 3.17Å; E568-R571 IonicContact OE1-CZ 2.95Å; E568-R571 IonicContact OE1-NE 3.79Å; E568-R571 PolarHBondContact OE1-NE 3.18Å; E568-R571 IonicContact OE1-NH2 2.59Å; E568-R571 PolarHBondContact OE1-NH2 3.25Å; E568-R571 IonicContact OE2-CZ 3.52Å; E568-R571 IonicContact OE2-NE 3.13Å; E568-R571 PolarHBondContact OE2-NE 3.37Å; E568-R571 IonicContact OE2-NH2 3.18Å; R571-G573 VanDerWaalsContact C-N 3.29Å
572	L	95.3	Very high	95.6	Very high	45 Å²	45	47.8 Å²	47.8	24%	0.236	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	3.7	177.6	-66.9	173.1	0	0	0	113.5	L533 I537 E568 C570 G574	L533-L572 HydrophobicContact CD2-CD1 4.3Å; L533-L572 HydrophobicContact CG-CD1 4.3Å; I537-L572 HydrophobicContact CD1-CB 3.51Å; I537-L572 HydrophobicContact CD1-CD1 3.87Å; I537-L572 HydrophobicContact CD1-CG 4.35Å; E568-L572 HydrophobicContact CG-CD1 3.92Å; E568-L572 HydrophobicContact CG-CG 4.38Å; E568-L572 WeakPolarHBondContact O-CB 3.5Å; E568-L572 VanDerWaalsContact O-CG 3.32Å; E568-L572 WeakPolarHBondContact O-CG 3.46Å; E568-L572 PolarHBondContact O-N 2.83Å; C570-L572 VanDerWaalsContact C-N 3.28Å; C570-L572 PolarHBondContact O-N 3.15Å; L572-G574 VanDerWaalsContact C-N 3.26Å; L572-G574 PolarHBondContact O-N 2.8Å
573	G	94.6	Very high	95.7	Very high	30 Å²	30	48.6 Å²	48.6	31%	0.309	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	11.1	177.2	0	0	0	0	0	115.3	V569 C570 R571 I575 K576 H577	V569-G573 PolarHBondContact O-N 3.23Å; C570-G573 PolarHBondContact O-N 3.31Å; R571-G573 VanDerWaalsContact C-N 3.29Å; G573-I575 PolarHBondContact O-N 2.94Å; G573-K576 PolarHBondContact O-N 2.93Å; G573-K576 VanDerWaalsContact O-N 3.16Å; G573-H577 PolarHBondContact O-ND1 3.07Å; G573-H577 VanDerWaalsContact O-ND1 3.1Å
574	G	96.3	Very high	95.8	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.1	-29.7	-179.9	0	0	0	0	0	113.6	V569 L572 K576 H577 L578	V569-G574 PolarHBondContact O-N 3.28Å; L572-G574 VanDerWaalsContact C-N 3.26Å; L572-G574 PolarHBondContact O-N 2.8Å; G574-K576 VanDerWaalsContact C-N 3.32Å; G574-K576 PolarHBondContact O-N 3.48Å; G574-H577 PolarHBondContact O-N 3.28Å; G574-L578 WeakPolarHBondContact O-CG 3.5Å; G574-L578 PolarHBondContact O-N 3.23Å
575	I	96.8	Very high	95.8	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-55.8	-42	175.3	-72.4	175.7	0	0	0	112.3	C570 G573 L578 V579 L597 L600 N609 A612 V613 A616	C570-I575 HydrophobicContact CB-CD1 3.7Å; G573-I575 PolarHBondContact O-N 2.94Å; I575-L578 PolarHBondContact O-N 3.19Å; I575-V579 WeakPolarHBondContact O-CG2 3.49Å; I575-V579 PolarHBondContact O-N 2.88Å; I575-L597 HydrophobicContact CG2-CD2 4.33Å; I575-L600 HydrophobicContact CG1-CD1 4.19Å; I575-N609 HydrophobicContact CD1-CB 4.11Å; I575-A612 HydrophobicContact CD1-CB 3.85Å; I575-A612 HydrophobicContact CG2-CB 4.35Å; I575-V613 HydrophobicContact CD1-CG2 4.46Å; I575-V613 HydrophobicContact CG2-CB 4.32Å; I575-V613 HydrophobicContact CG2-CG2 3.58Å; I575-A616 HydrophobicContact CG2-CB 4.46Å
576	K	96.8	Very high	95.8	Very high	107 Å²	107	47.2 Å²	47.2	47%	0.465	24%	0.236	S	C	.	.	H	α-helix	trans	-62.9	-48.6	178.8	167.7	163.5	167.4	45.5	0	110.8	G573 G574 L578 V579 D580 A616	G573-K576 PolarHBondContact O-N 2.93Å; G573-K576 VanDerWaalsContact O-N 3.16Å; G574-K576 VanDerWaalsContact C-N 3.32Å; G574-K576 PolarHBondContact O-N 3.48Å; K576-L578 VanDerWaalsContact C-N 3.32Å; K576-L578 PolarHBondContact O-N 2.82Å; K576-V579 WeakPolarHBondContact O-CB 3.41Å; K576-V579 PolarHBondContact O-N 3.23Å; K576-D580 WeakPolarHBondContact CG-OD2 3.44Å; K576-D580 IonicContact NZ-OD1 3.27Å; K576-D580 PolarHBondContact NZ-OD1 3.2Å; K576-D580 IonicContact NZ-OD2 2.68Å; K576-D580 PolarHBondContact NZ-OD2 2.9Å; K576-D580 VanDerWaalsContact O-CG 3.29Å; K576-D580 PolarHBondContact O-N 3.13Å; K576-A616 HydrophobicContact CB-CB 4.43Å
577	H	97.4	Very high	95.8	Very high	41 Å²	41	49.7 Å²	49.7	19%	0.19	25%	0.252	C	S	.	.	H	α-helix	trans	-60.6	-42.3	-179.3	-56.1	102.7	0	0	0	111.5	L540 Q541 G573 G574 V579 D580 L581	L540-H577 HydrophobicContact CB-CB 4.09Å; L540-H577 HydrophobicContact CD1-CB 3.81Å; Q541-H577 VanDerWaalsContact CD-CD2 3.49Å; Q541-H577 PolarHBondContact NE2-NE2 3.22Å; G573-H577 PolarHBondContact O-ND1 3.07Å; G573-H577 VanDerWaalsContact O-ND1 3.1Å; G574-H577 PolarHBondContact O-N 3.28Å; H577-V579 VanDerWaalsContact C-N 3.33Å; H577-V579 PolarHBondContact O-N 2.87Å; H577-D580 PolarHBondContact O-N 2.9Å; H577-L581 VanDerWaalsContact O-CG 3.27Å; H577-L581 WeakPolarHBondContact O-CG 3.34Å; H577-L581 PolarHBondContact O-N 2.96Å
578	L	97.3	Very high	95.8	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-33.6	174.5	-68.1	170.5	0	0	0	113.3	L540 A552 L555 G574 I575 K576 A596 L597 L600	L540-L578 HydrophobicContact CD1-CD2 3.83Å; L540-L578 HydrophobicContact CD1-CG 3.81Å; L540-L578 HydrophobicContact CD2-CD2 3.77Å; L540-L578 HydrophobicContact CG-CD2 4.48Å; A552-L578 HydrophobicContact CB-CD2 4.07Å; L555-L578 HydrophobicContact CD1-CD1 4.25Å; L555-L578 HydrophobicContact CD1-CD2 4.38Å; G574-L578 WeakPolarHBondContact O-CG 3.5Å; G574-L578 PolarHBondContact O-N 3.23Å; I575-L578 PolarHBondContact O-N 3.19Å; K576-L578 VanDerWaalsContact C-N 3.32Å; K576-L578 PolarHBondContact O-N 2.82Å; L578-A596 HydrophobicContact CD1-CB 3.93Å; L578-A596 HydrophobicContact CD2-CB 4.07Å; L578-L597 HydrophobicContact CB-CD1 4.17Å; L578-L597 HydrophobicContact CB-CD2 3.74Å; L578-L597 HydrophobicContact CB-CG 3.76Å; L578-L597 HydrophobicContact CD1-CD2 4.25Å; L578-L597 HydrophobicContact CD1-CG 4.45Å; L578-L600 HydrophobicContact CD1-CD1 3.4Å; L578-L600 VanDerWaalsContact CD1-CD1 3.4Å
579	V	97.3	Very high	95.9	Very high	6 Å²	6	48.8 Å²	48.8	4%	0.036	24%	0.241	C	C	.	.	H	α-helix	trans	-69.3	-43.9	173	166.9	0	0	0	0	111.3	I575 K576 H577 L581 L582 L597 A616 A621	I575-V579 WeakPolarHBondContact O-CG2 3.49Å; I575-V579 PolarHBondContact O-N 2.88Å; K576-V579 WeakPolarHBondContact O-CB 3.41Å; K576-V579 PolarHBondContact O-N 3.23Å; H577-V579 VanDerWaalsContact C-N 3.33Å; H577-V579 PolarHBondContact O-N 2.87Å; V579-L581 PolarHBondContact O-N 3.46Å; V579-L582 WeakPolarHBondContact O-CB 3.43Å; V579-L582 WeakPolarHBondContact O-CG 3.35Å; V579-L582 PolarHBondContact O-N 2.88Å; V579-L582 VanDerWaalsContact O-N 3.13Å; V579-L597 HydrophobicContact CG2-CD1 3.87Å; V579-L597 HydrophobicContact CG2-CD2 4.16Å; V579-A616 HydrophobicContact CB-CB 4.46Å; V579-A616 HydrophobicContact CG2-CB 4.29Å; V579-A621 HydrophobicContact CG1-CB 4.1Å
580	D	96.5	Very high	95.9	Very high	76 Å²	76	49.9 Å²	49.9	41%	0.406	25%	0.247	S	C	.	.	H	α-helix	trans	-60.9	-32.8	176.3	-61.3	-40	0	0	0	111.5	K576 H577 L582 D583	K576-D580 WeakPolarHBondContact CG-OD2 3.44Å; K576-D580 IonicContact NZ-OD1 3.27Å; K576-D580 PolarHBondContact NZ-OD1 3.2Å; K576-D580 IonicContact NZ-OD2 2.68Å; K576-D580 PolarHBondContact NZ-OD2 2.9Å; K576-D580 VanDerWaalsContact O-CG 3.29Å; K576-D580 PolarHBondContact O-N 3.13Å; H577-D580 PolarHBondContact O-N 2.9Å; D580-L582 VanDerWaalsContact C-N 3.31Å; D580-L582 PolarHBondContact O-N 3.32Å; D580-D583 PolarHBondContact O-N 2.89Å
581	L	96.8	Very high	95.9	Very high	12 Å²	12	51.1 Å²	51.1	6%	0.063	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-72	-15.4	177	-71.1	176.2	0	0	0	114.9	L540 Q548 H577 V579 D583 H584 V589 S593	L540-L581 HydrophobicContact CB-CD1 4.06Å; L540-L581 HydrophobicContact CD2-CD1 3.88Å; L540-L581 HydrophobicContact CG-CD1 4.47Å; Q548-L581 HydrophobicContact CB-CD1 4.49Å; Q548-L581 HydrophobicContact CB-CD2 4.37Å; Q548-L581 HydrophobicContact CG-CD2 4.47Å; Q548-L581 VanDerWaalsContact NE2-CD2 3.33Å; H577-L581 VanDerWaalsContact O-CG 3.27Å; H577-L581 WeakPolarHBondContact O-CG 3.34Å; H577-L581 PolarHBondContact O-N 2.96Å; V579-L581 PolarHBondContact O-N 3.46Å; L581-D583 PolarHBondContact O-N 3.4Å; L581-H584 VanDerWaalsContact O-CB 3.23Å; L581-H584 WeakPolarHBondContact O-CB 3.37Å; L581-H584 PolarHBondContact O-N 3.49Å; L581-H584 VanDerWaalsContact O-N 3.09Å; L581-V589 HydrophobicContact CB-CG1 4.04Å; L581-V589 HydrophobicContact CD1-CG1 4.39Å; L581-V589 HydrophobicContact CD2-CG1 3.86Å; L581-V589 HydrophobicContact CG-CG1 4.31Å; L581-S593 VanDerWaalsContact CB-OG 3.3Å; L581-S593 WeakPolarHBondContact CB-OG 3.48Å
582	L	95.9	Very high	95.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-63.2	-23	172.3	-60.7	176.1	0	0	0	112.1	V579 D580 H584 Q590 C594 L597 A621 L622 L625	V579-L582 WeakPolarHBondContact O-CB 3.43Å; V579-L582 WeakPolarHBondContact O-CG 3.35Å; V579-L582 PolarHBondContact O-N 2.88Å; V579-L582 VanDerWaalsContact O-N 3.13Å; D580-L582 VanDerWaalsContact C-N 3.31Å; D580-L582 PolarHBondContact O-N 3.32Å; L582-H584 VanDerWaalsContact C-N 3.33Å; L582-Q590 PolarHBondContact O-NE2 2.85Å; L582-C594 HydrophobicContact CD2-CB 3.87Å; L582-L597 HydrophobicContact CD1-CD1 3.9Å; L582-L597 HydrophobicContact CD2-CD1 4.18Å; L582-L597 HydrophobicContact CG-CD1 4.18Å; L582-A621 HydrophobicContact CB-CB 4.42Å; L582-A621 HydrophobicContact CD1-CB 3.88Å; L582-L622 HydrophobicContact CD1-CD2 3.83Å; L582-L622 HydrophobicContact CD1-CG 3.94Å; L582-L622 HydrophobicContact CD2-CD2 4.47Å; L582-L625 HydrophobicContact CB-CD2 4.33Å; L582-L625 HydrophobicContact CD2-CD2 3.89Å
583	D	94.7	Very high	96	Very high	81 Å²	81	42 Å²	42	43%	0.433	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-84.5	-9.8	178.4	-73.1	33.1	0	0	0	112.8	D580 L581 R624	D580-D583 PolarHBondContact O-N 2.89Å; L581-D583 PolarHBondContact O-N 3.4Å; D583-R624 VanDerWaalsContact CG-CZ 3.49Å; D583-R624 IonicContact OD1-CZ 2.68Å; D583-R624 IonicContact OD1-NH1 2.73Å; D583-R624 PolarHBondContact OD1-NH1 2.89Å; D583-R624 IonicContact OD1-NH2 3.7Å; D583-R624 PolarHBondContact OD1-NH2 3.31Å; D583-R624 IonicContact OD2-CZ 3.47Å; D583-R624 IonicContact OD2-NH1 2.82Å; D583-R624 PolarHBondContact OD2-NH1 3.3Å; D583-R624 IonicContact OD2-NH2 3.19Å; D583-R624 PolarHBondContact OD2-NH2 2.84Å
584	H	95.4	Very high	96	Very high	39 Å²	39	40.6 Å²	40.6	18%	0.181	20%	0.196	C	C	.	.			trans	-67.2	140.5	-172.9	-169.7	-103.1	0	0	0	112.4	L581 L582 T586 V589 Q590	L581-H584 VanDerWaalsContact O-CB 3.23Å; L581-H584 WeakPolarHBondContact O-CB 3.37Å; L581-H584 PolarHBondContact O-N 3.49Å; L581-H584 VanDerWaalsContact O-N 3.09Å; L582-H584 VanDerWaalsContact C-N 3.33Å; H584-T586 PolarHBondContact CE1-OG1 3.48Å; H584-T586 VanDerWaalsContact CE1-OG1 3.25Å; H584-T586 PolarHBondContact ND1-N 2.86Å; H584-T586 PolarHBondContact O-N 3.47Å; H584-T586 VanDerWaalsContact O-N 3.11Å; H584-V589 HydrophobicContact CB-CB 4.34Å; H584-V589 HydrophobicContact CB-CG1 3.87Å; H584-Q590 WeakPolarHBondContact O-CG 3.45Å; H584-Q590 PolarHBondContact O-NE2 3.37Å; H584-Q590 VanDerWaalsContact O-NE2 3.11Å
585	K	93.4	Very high	96	Very high	181 Å²	181	40.6 Å²	40.6	79%	0.787	20%	0.196	S	C	*	.	S	Bend	trans	-67.5	-9.3	-173.9	64.7	-171	173.7	-174.1	0	115.7
586	T	95.4	Very high	95.9	Very high	46 Å²	46	40.3 Å²	40.3	28%	0.282	20%	0.195	S	C	.	.			trans	-104	117.4	-178.4	-57.6	0	0	0	0	109.9	H584 E588 V589 Q590	H584-T586 PolarHBondContact CE1-OG1 3.48Å; H584-T586 VanDerWaalsContact CE1-OG1 3.25Å; H584-T586 PolarHBondContact ND1-N 2.86Å; H584-T586 PolarHBondContact O-N 3.47Å; H584-T586 VanDerWaalsContact O-N 3.11Å; T586-E588 HydrophobicContact CG2-CB 4.07Å; T586-E588 PolarHBondContact O-N 3.19Å; T586-V589 HydrophobicContact CG2-CG2 4.32Å; T586-V589 WeakPolarHBondContact O-CB 3.24Å; T586-V589 PolarHBondContact O-N 3.38Å; T586-Q590 PolarHBondContact O-N 2.91Å
587	V	94.6	Very high	95.9	Very high	57 Å²	57	35.2 Å²	35.2	35%	0.345	17%	0.173	S	C	.	.	H	α-helix	trans	-58.2	-33.1	-175.1	-169.9	0	0	0	0	112.9	Q590 R591 D631 V634	V587-Q590 PolarHBondContact O-N 3.27Å; V587-R591 VanDerWaalsContact O-CB 3.29Å; V587-R591 WeakPolarHBondContact O-CB 3.44Å; V587-R591 PolarHBondContact O-N 3.29Å; V587-D631 HydrophobicContact CG1-CB 3.71Å; V587-D631 WeakPolarHBondContact CG1-OD2 3.44Å; V587-V634 HydrophobicContact CG1-CG2 3.82Å
588	E	95.4	Very high	95.8	Very high	99 Å²	99	37.5 Å²	37.5	46%	0.463	18%	0.18	S	C	.	.	H	α-helix	trans	-60.9	-45.7	174.1	-170.1	-175.7	-174.1	0	0	112.5	A549 T586 Q590 R591 N592	A549-E588 HydrophobicContact CB-CG 3.97Å; T586-E588 HydrophobicContact CG2-CB 4.07Å; T586-E588 PolarHBondContact O-N 3.19Å; E588-Q590 VanDerWaalsContact C-N 3.32Å; E588-Q590 PolarHBondContact O-N 3.05Å; E588-R591 PolarHBondContact O-N 3.32Å; E588-N592 WeakPolarHBondContact O-CB 3.47Å; E588-N592 PolarHBondContact O-N 3.49Å; E588-N592 PolarHBondContact O-OD1 3.17Å
589	V	96.9	Very high	95.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.6	-40.9	175.5	177.1	0	0	0	0	110.5	P545 Q548 A549 L581 H584 T586 S593	P545-V589 HydrophobicContact CB-CG2 3.97Å; P545-V589 VanDerWaalsContact O-CG2 3.24Å; P545-V589 WeakPolarHBondContact O-CG2 3.24Å; Q548-V589 HydrophobicContact CB-CG1 4.32Å; Q548-V589 HydrophobicContact CB-CG2 4.36Å; A549-V589 HydrophobicContact CB-CG2 4Å; L581-V589 HydrophobicContact CB-CG1 4.04Å; L581-V589 HydrophobicContact CD1-CG1 4.39Å; L581-V589 HydrophobicContact CD2-CG1 3.86Å; L581-V589 HydrophobicContact CG-CG1 4.31Å; H584-V589 HydrophobicContact CB-CB 4.34Å; H584-V589 HydrophobicContact CB-CG1 3.87Å; T586-V589 HydrophobicContact CG2-CG2 4.32Å; T586-V589 WeakPolarHBondContact O-CB 3.24Å; T586-V589 PolarHBondContact O-N 3.38Å; V589-S593 WeakPolarHBondContact O-CB 3.37Å; V589-S593 PolarHBondContact O-N 3.02Å; V589-S593 PolarHBondContact O-OG 3.3Å
590	Q	96.1	Very high	95.5	Very high	24 Å²	24	38.1 Å²	38.1	11%	0.112	18%	0.183	C	C	.	.	H	α-helix	trans	-66.4	-45.1	178.1	-61.2	178.9	-57.2	0	0	112	L582 H584 T586 V587 E588 C594 L625	L582-Q590 PolarHBondContact O-NE2 2.85Å; H584-Q590 WeakPolarHBondContact O-CG 3.45Å; H584-Q590 PolarHBondContact O-NE2 3.37Å; H584-Q590 VanDerWaalsContact O-NE2 3.11Å; T586-Q590 PolarHBondContact O-N 2.91Å; V587-Q590 PolarHBondContact O-N 3.27Å; E588-Q590 VanDerWaalsContact C-N 3.32Å; E588-Q590 PolarHBondContact O-N 3.05Å; Q590-C594 WeakPolarHBondContact O-CB 3.31Å; Q590-C594 PolarHBondContact O-N 3.01Å; Q590-L625 HydrophobicContact CB-CD1 4.29Å; Q590-L625 HydrophobicContact CB-CD2 4.47Å; Q590-L625 HydrophobicContact CG-CD1 4.36Å; Q590-L625 VanDerWaalsContact NE2-CD1 3.27Å
591	R	95.3	Very high	95.3	Very high	57 Å²	57	35.2 Å²	35.2	22%	0.215	17%	0.168	C	C	.	.	H	α-helix	trans	-56.7	-55.4	175.7	179.2	-170.2	-95.8	83.3	-6.3	110.8	V587 E588 S593 C594 G595 D631 E633 V634 L637	V587-R591 VanDerWaalsContact O-CB 3.29Å; V587-R591 WeakPolarHBondContact O-CB 3.44Å; V587-R591 PolarHBondContact O-N 3.29Å; E588-R591 PolarHBondContact O-N 3.32Å; R591-S593 PolarHBondContact O-N 3.39Å; R591-C594 PolarHBondContact O-N 2.73Å; R591-G595 PolarHBondContact O-N 2.74Å; R591-D631 IonicContact CZ-OD1 3.14Å; R591-D631 IonicContact CZ-OD2 2.81Å; R591-D631 VanDerWaalsContact CZ-OD2 3.26Å; R591-D631 IonicContact NH1-OD1 3.24Å; R591-D631 IonicContact NH1-OD2 3.12Å; R591-D631 PolarHBondContact NH1-OD2 3.3Å; R591-D631 IonicContact NH2-OD1 2.69Å; R591-D631 PolarHBondContact NH2-OD1 3.04Å; R591-D631 IonicContact NH2-OD2 2.67Å; R591-D631 PolarHBondContact NH2-OD2 3.5Å; R591-E633 IonicContact CZ-OE2 2.81Å; R591-E633 IonicContact NE-OE2 2.73Å; R591-E633 PolarHBondContact NE-OE2 3.06Å; R591-E633 IonicContact NH2-OE2 3.17Å; R591-E633 PolarHBondContact NH2-OE2 3.36Å; R591-V634 HydrophobicContact CB-CG2 3.83Å; R591-V634 HydrophobicContact CG-CG2 4.48Å; R591-L637 HydrophobicContact CG-CD1 3.9Å
592	N	96.5	Very high	95.1	Very high	21 Å²	21	41.7 Å²	41.7	11%	0.112	19%	0.192	C	C	.	.	H	α-helix	trans	-68.3	-38.5	-175.2	-60.4	3.6	0	0	0	111.1	A549 A552 A553 E588 G595 A596	A549-N592 PolarHBondContact O-ND2 3.19Å; A552-N592 HydrophobicContact CB-CB 3.8Å; A553-N592 HydrophobicContact CB-CB 4.45Å; E588-N592 WeakPolarHBondContact O-CB 3.47Å; E588-N592 PolarHBondContact O-N 3.49Å; E588-N592 PolarHBondContact O-OD1 3.17Å; N592-G595 PolarHBondContact O-N 3.41Å; N592-A596 WeakPolarHBondContact O-CB 3.36Å; N592-A596 PolarHBondContact O-N 3.41Å
593	S	96.6	Very high	94.7	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-68.9	-40.5	177.2	-54.2	0	0	0	0	112.4	L581 V589 R591 A596 L597	L581-S593 VanDerWaalsContact CB-OG 3.3Å; L581-S593 WeakPolarHBondContact CB-OG 3.48Å; V589-S593 WeakPolarHBondContact O-CB 3.37Å; V589-S593 PolarHBondContact O-N 3.02Å; V589-S593 PolarHBondContact O-OG 3.3Å; R591-S593 PolarHBondContact O-N 3.39Å; S593-A596 PolarHBondContact O-N 2.85Å; S593-L597 WeakPolarHBondContact O-CB 3.37Å; S593-L597 VanDerWaalsContact O-CG 3.31Å; S593-L597 WeakPolarHBondContact O-CG 3.5Å; S593-L597 PolarHBondContact O-N 2.68Å
594	C	95.6	Very high	94.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.1	-39.4	174	-170	0	0	0	0	111.8	L582 Q590 R591 L597 R598	L582-C594 HydrophobicContact CD2-CB 3.87Å; Q590-C594 WeakPolarHBondContact O-CB 3.31Å; Q590-C594 PolarHBondContact O-N 3.01Å; R591-C594 PolarHBondContact O-N 2.73Å; C594-L597 PolarHBondContact O-N 2.89Å; C594-R598 WeakPolarHBondContact O-CB 3.45Å; C594-R598 PolarHBondContact O-N 2.86Å
595	G	95	Very high	93.8	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-44.9	173.9	0	0	0	0	0	112.9	R591 N592 R598 N599	R591-G595 PolarHBondContact O-N 2.74Å; N592-G595 PolarHBondContact O-N 3.41Å; G595-R598 PolarHBondContact O-N 2.97Å; G595-N599 PolarHBondContact O-N 3.47Å
596	A	96.1	Very high	93.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.1	-47.2	174.2	0	0	0	0	0	111.9	L555 Q556 L578 N592 S593 R598 N599 L600	L555-A596 HydrophobicContact CB-CB 4.43Å; Q556-A596 HydrophobicContact CB-CB 4.01Å; L578-A596 HydrophobicContact CD1-CB 3.93Å; L578-A596 HydrophobicContact CD2-CB 4.07Å; N592-A596 WeakPolarHBondContact O-CB 3.36Å; N592-A596 PolarHBondContact O-N 3.41Å; S593-A596 PolarHBondContact O-N 2.85Å; A596-R598 PolarHBondContact O-N 2.87Å; A596-N599 PolarHBondContact O-N 3.22Å; A596-L600 WeakPolarHBondContact O-CB 3.47Å; A596-L600 VanDerWaalsContact O-CG 3.29Å; A596-L600 WeakPolarHBondContact O-CG 3.14Å; A596-L600 PolarHBondContact O-N 3.49Å
597	L	95.9	Very high	93.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.9	-42.2	176.7	-74.7	172.6	0	0	0	112.6	I575 L578 V579 L582 S593 C594 N599 L600 V601 V613 W641	I575-L597 HydrophobicContact CG2-CD2 4.33Å; L578-L597 HydrophobicContact CB-CD1 4.17Å; L578-L597 HydrophobicContact CB-CD2 3.74Å; L578-L597 HydrophobicContact CB-CG 3.76Å; L578-L597 HydrophobicContact CD1-CD2 4.25Å; L578-L597 HydrophobicContact CD1-CG 4.45Å; V579-L597 HydrophobicContact CG2-CD1 3.87Å; V579-L597 HydrophobicContact CG2-CD2 4.16Å; L582-L597 HydrophobicContact CD1-CD1 3.9Å; L582-L597 HydrophobicContact CD2-CD1 4.18Å; L582-L597 HydrophobicContact CG-CD1 4.18Å; S593-L597 WeakPolarHBondContact O-CB 3.37Å; S593-L597 VanDerWaalsContact O-CG 3.31Å; S593-L597 WeakPolarHBondContact O-CG 3.5Å; S593-L597 PolarHBondContact O-N 2.68Å; C594-L597 PolarHBondContact O-N 2.89Å; L597-N599 PolarHBondContact O-N 3.23Å; L597-L600 HydrophobicContact CD2-CD1 4.42Å; L597-L600 WeakPolarHBondContact O-CB 3.45Å; L597-L600 PolarHBondContact O-N 2.87Å; L597-V601 WeakPolarHBondContact O-CG2 3.39Å; L597-V601 PolarHBondContact O-N 3.45Å; L597-V601 VanDerWaalsContact O-N 3.08Å; L597-V613 HydrophobicContact CD2-CG2 4.04Å; L597-W641 HydrophobicContact CB-CH2 3.84Å; L597-W641 HydrophobicContact CB-CZ2 3.62Å
598	R	94.3	Very high	93.5	Very high	89 Å²	89	47.9 Å²	47.9	34%	0.336	24%	0.235	S	C	.	.	H	α-helix	trans	-58.9	-46.4	175.1	-177.5	177.2	177.4	-95.4	1.3	111.4	C594 G595 A596 V601 Y602 G640	C594-R598 WeakPolarHBondContact O-CB 3.45Å; C594-R598 PolarHBondContact O-N 2.86Å; G595-R598 PolarHBondContact O-N 2.97Å; A596-R598 PolarHBondContact O-N 2.87Å; R598-V601 WeakPolarHBondContact O-CG2 3.04Å; R598-V601 PolarHBondContact O-N 2.89Å; R598-Y602 WeakPolarHBondContact O-CB 3.47Å; R598-Y602 PolarHBondContact O-N 3.21Å; R598-Y602 VanDerWaalsContact O-N 3.17Å; R598-G640 PolarHBondContact NE-O 3.4Å
599	N	94.3	Very high	93.4	Very high	19 Å²	19	43.4 Å²	43.4	10%	0.102	21%	0.214	C	C	.	.	H	α-helix	trans	-66	-37.2	177.1	-73	6.9	0	0	0	112	Q556 C559 K566 G595 A596 L597 V601 Y602	Q556-N599 WeakPolarHBondContact CG-ND2 3.42Å; Q556-N599 PolarHBondContact O-ND2 2.87Å; C559-N599 HydrophobicContact CB-CB 4.05Å; K566-N599 WeakPolarHBondContact CD-O 3.37Å; K566-N599 WeakPolarHBondContact CE-O 3.24Å; G595-N599 PolarHBondContact O-N 3.47Å; A596-N599 PolarHBondContact O-N 3.22Å; L597-N599 PolarHBondContact O-N 3.23Å; N599-V601 PolarHBondContact O-N 2.9Å; N599-Y602 PolarHBondContact O-N 3.46Å
600	L	94.2	Very high	93.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.4	-37.4	177.7	-80.6	163	0	0	0	114	C559 K566 V569 I575 L578 A596 L597 N609	C559-L600 HydrophobicContact CB-CD2 4.36Å; C559-L600 HydrophobicContact CB-CG 4.32Å; C559-L600 WeakPolarHBondContact SG-CD2 3.43Å; K566-L600 HydrophobicContact CB-CD2 4.17Å; K566-L600 HydrophobicContact CG-CD2 4.35Å; V569-L600 HydrophobicContact CB-CD2 3.74Å; V569-L600 HydrophobicContact CG1-CD1 3.91Å; V569-L600 HydrophobicContact CG1-CD2 3.75Å; V569-L600 HydrophobicContact CG1-CG 4.49Å; V569-L600 HydrophobicContact CG2-CD2 4.35Å; I575-L600 HydrophobicContact CG1-CD1 4.19Å; L578-L600 HydrophobicContact CD1-CD1 3.4Å; L578-L600 VanDerWaalsContact CD1-CD1 3.4Å; A596-L600 WeakPolarHBondContact O-CB 3.47Å; A596-L600 VanDerWaalsContact O-CG 3.29Å; A596-L600 WeakPolarHBondContact O-CG 3.14Å; A596-L600 PolarHBondContact O-N 3.49Å; L597-L600 HydrophobicContact CD2-CD1 4.42Å; L597-L600 WeakPolarHBondContact O-CB 3.45Å; L597-L600 PolarHBondContact O-N 2.87Å; L600-N609 WeakPolarHBondContact O-CB 3.3Å; L600-N609 PolarHBondContact O-ND2 2.69Å
601	V	93.5	Very high	93.2	Very high	15 Å²	15	49.6 Å²	49.6	9%	0.091	24%	0.244	C	C	.	.	H	α-helix	trans	-86.7	-12.6	176.9	-59.5	0	0	0	0	113.5	L597 R598 N599 G603 K610 V613 W641	L597-V601 WeakPolarHBondContact O-CG2 3.39Å; L597-V601 PolarHBondContact O-N 3.45Å; L597-V601 VanDerWaalsContact O-N 3.08Å; R598-V601 WeakPolarHBondContact O-CG2 3.04Å; R598-V601 PolarHBondContact O-N 2.89Å; N599-V601 PolarHBondContact O-N 2.9Å; V601-G603 PolarHBondContact O-N 3.11Å; V601-K610 HydrophobicContact CB-CG 3.85Å; V601-K610 HydrophobicContact CG1-CG 4.11Å; V601-K610 WeakPolarHBondContact O-CE 2.85Å; V601-V613 HydrophobicContact CG1-CB 4.4Å; V601-V613 HydrophobicContact CG1-CG2 3.73Å; V601-W641 HydrophobicContact CB-CZ3 4.4Å; V601-W641 HydrophobicContact CG1-CH2 4.21Å; V601-W641 HydrophobicContact CG1-CZ3 3.86Å; V601-W641 HydrophobicContact CG2-CD2 4.43Å; V601-W641 HydrophobicContact CG2-CE3 3.86Å; V601-W641 HydrophobicContact CG2-CH2 4.23Å; V601-W641 HydrophobicContact CG2-CZ3 3.75Å
602	Y	91.3	Very high	93.2	Very high	147 Å²	147	48.1 Å²	48.1	58%	0.576	24%	0.244	S	C	*	.			trans	-72	123.4	-174.8	-173.9	-102.2	0	0	0	112.4	K566 R598 N599	K566-Y602 PolarHBondContact NZ-O 2.92Å; R598-Y602 WeakPolarHBondContact O-CB 3.47Å; R598-Y602 PolarHBondContact O-N 3.21Å; R598-Y602 VanDerWaalsContact O-N 3.17Å; N599-Y602 PolarHBondContact O-N 3.46Å
603	G	88.4	Confident	93.2	Very high	29 Å²	29	47.3 Å²	47.3	30%	0.299	24%	0.239	S	C	.	.	S	Bend	trans	124.1	152	177.5	0	0	0	0	0	113.4	V601 A605 M606 K610	V601-G603 PolarHBondContact O-N 3.11Å; G603-A605 VanDerWaalsContact C-N 3.28Å; G603-A605 PolarHBondContact O-N 2.89Å; G603-M606 PolarHBondContact O-N 2.77Å; G603-K610 PolarHBondContact O-NZ 3.22Å
604	K	85.7	Confident	93.1	Very high	198 Å²	198	55.4 Å²	55.4	86%	0.861	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-26.6	179.4	-172	175.8	179.2	-178.6	0	113.3
605	A	85.1	Confident	93.1	Very high	76 Å²	76	61.2 Å²	61.2	63%	0.628	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-8.2	-179.3	0	0	0	0	0	114.3	G603 D607	G603-A605 VanDerWaalsContact C-N 3.28Å; G603-A605 PolarHBondContact O-N 2.89Å; A605-D607 PolarHBondContact O-N 3.48Å
606	M	91.4	Very high	93.1	Very high	12 Å²	12	62.8 Å²	62.8	6%	0.059	31%	0.314	C	S	.	.			trans	-98.6	37.1	-170.5	-60.3	-71	84.8	0	0	112.8	N563 K566 G603 N609 K610	N563-M606 HydrophobicContact CB-CE 4.27Å; N563-M606 HydrophobicContact CB-SD 4.29Å; K566-M606 HydrophobicContact CB-SD 3.5Å; K566-M606 VanDerWaalsContact CB-SD 3.5Å; K566-M606 HydrophobicContact CD-CG 3.92Å; K566-M606 HydrophobicContact CD-SD 3.77Å; K566-M606 HydrophobicContact CG-SD 4.32Å; G603-M606 PolarHBondContact O-N 2.77Å; M606-N609 HydrophobicContact CB-CB 4.25Å; M606-N609 WeakPolarHBondContact O-CB 3.28Å; M606-N609 PolarHBondContact O-N 3.43Å; M606-K610 WeakPolarHBondContact O-CG 3.47Å; M606-K610 PolarHBondContact O-N 3.08Å
607	D	91.9	Very high	93.1	Very high	85 Å²	85	64 Å²	64	46%	0.455	33%	0.327	S	S	.	.	H	α-helix	trans	-69.7	-34.5	-179.6	-70.1	-20.7	0	0	0	112.3	A605 N609 K610 I611	A605-D607 PolarHBondContact O-N 3.48Å; D607-N609 VanDerWaalsContact C-N 3.29Å; D607-N609 PolarHBondContact O-N 2.83Å; D607-K610 WeakPolarHBondContact O-CB 3.27Å; D607-K610 PolarHBondContact O-N 2.94Å; D607-K610 VanDerWaalsContact O-N 3.13Å; D607-K610 WeakPolarHBondContact OD1-CD 3.24Å; D607-K610 WeakPolarHBondContact OD1-CE 3.41Å; D607-K610 IonicContact OD1-NZ 2.85Å; D607-K610 PolarHBondContact OD1-NZ 2.89Å; D607-I611 WeakPolarHBondContact O-CG1 3.49Å; D607-I611 PolarHBondContact O-N 3.01Å
608	E	93.4	Very high	93.1	Very high	135 Å²	135	64 Å²	64	63%	0.631	33%	0.327	S	S	*	.	H	α-helix	trans	-58.6	-39.4	170	-65.3	-56	146.6	0	0	112	K610 I611 A612	E608-K610 PolarHBondContact O-N 3.34Å; E608-I611 PolarHBondContact O-N 2.74Å; E608-A612 WeakPolarHBondContact O-CB 3.41Å; E608-A612 PolarHBondContact O-N 3.4Å
609	N	94.4	Very high	93.1	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.021	33%	0.333	C	S	.	.	H	α-helix	trans	-66.6	-37.4	176.3	-71.1	16.1	0	0	0	111.6	K566 C570 I575 L600 M606 D607 A612 V613	K566-N609 PolarHBondContact O-ND2 3.4Å; C570-N609 WeakPolarHBondContact CB-OD1 3.16Å; I575-N609 HydrophobicContact CD1-CB 4.11Å; L600-N609 WeakPolarHBondContact O-CB 3.3Å; L600-N609 PolarHBondContact O-ND2 2.69Å; M606-N609 HydrophobicContact CB-CB 4.25Å; M606-N609 WeakPolarHBondContact O-CB 3.28Å; M606-N609 PolarHBondContact O-N 3.43Å; D607-N609 VanDerWaalsContact C-N 3.29Å; D607-N609 PolarHBondContact O-N 2.83Å; N609-A612 PolarHBondContact O-N 3.39Å; N609-V613 WeakPolarHBondContact O-CG2 3.48Å; N609-V613 PolarHBondContact O-N 2.69Å
610	K	93.3	Very high	93.1	Very high	80 Å²	80	67.1 Å²	67.1	35%	0.348	35%	0.354	S	S	.	.	H	α-helix	trans	-64.5	-41.3	174.3	-64.3	164.1	-154.8	163.9	0	111	V601 G603 M606 D607 E608 R614	V601-K610 HydrophobicContact CB-CG 3.85Å; V601-K610 HydrophobicContact CG1-CG 4.11Å; V601-K610 WeakPolarHBondContact O-CE 2.85Å; G603-K610 PolarHBondContact O-NZ 3.22Å; M606-K610 WeakPolarHBondContact O-CG 3.47Å; M606-K610 PolarHBondContact O-N 3.08Å; D607-K610 WeakPolarHBondContact O-CB 3.27Å; D607-K610 PolarHBondContact O-N 2.94Å; D607-K610 VanDerWaalsContact O-N 3.13Å; D607-K610 WeakPolarHBondContact OD1-CD 3.24Å; D607-K610 WeakPolarHBondContact OD1-CE 3.41Å; D607-K610 IonicContact OD1-NZ 2.85Å; D607-K610 PolarHBondContact OD1-NZ 2.89Å; E608-K610 PolarHBondContact O-N 3.34Å; K610-R614 WeakPolarHBondContact O-CB 3.36Å; K610-R614 PolarHBondContact O-N 2.88Å
611	I	94.4	Very high	93.2	Very high	75 Å²	75	67.3 Å²	67.3	39%	0.385	36%	0.355	S	S	.	.	H	α-helix	trans	-64.3	-45.2	174.7	-67.6	163.8	0	0	0	110.4	D607 E608 R614 N615	D607-I611 WeakPolarHBondContact O-CG1 3.49Å; D607-I611 PolarHBondContact O-N 3.01Å; E608-I611 PolarHBondContact O-N 2.74Å; I611-R614 WeakPolarHBondContact O-CB 3.5Å; I611-R614 PolarHBondContact O-N 3.41Å; I611-N615 WeakPolarHBondContact CG2-ND2 3.36Å; I611-N615 WeakPolarHBondContact O-CB 3.34Å; I611-N615 PolarHBondContact O-N 3.47Å; I611-N615 PolarHBondContact O-ND2 2.96Å; I611-N615 PolarHBondContact O-OD1 3.4Å
612	A	95.8	Very high	93.2	Very high	26 Å²	26	67.2 Å²	67.2	22%	0.215	35%	0.354	C	S	.	.	H	α-helix	trans	-61.7	-44.2	177	0	0	0	0	0	112.4	C570 I575 E608 N609 R614 N615 A616	C570-A612 VanDerWaalsContact SG-CB 3.58Å; I575-A612 HydrophobicContact CD1-CB 3.85Å; I575-A612 HydrophobicContact CG2-CB 4.35Å; E608-A612 WeakPolarHBondContact O-CB 3.41Å; E608-A612 PolarHBondContact O-N 3.4Å; N609-A612 PolarHBondContact O-N 3.39Å; A612-R614 PolarHBondContact O-N 2.91Å; A612-N615 PolarHBondContact O-N 3.49Å; A612-A616 VanDerWaalsContact O-CB 3.29Å; A612-A616 WeakPolarHBondContact O-CB 3.42Å; A612-A616 PolarHBondContact O-N 3.34Å
613	V	95.9	Very high	93.3	Very high	3 Å²	3	64.5 Å²	64.5	2%	0.018	35%	0.349	C	S	.	.	H	α-helix	trans	-60.8	-44.6	173.9	170.3	0	0	0	0	111.3	I575 L597 V601 N609 A616 G617 G618 W641	I575-V613 HydrophobicContact CD1-CG2 4.46Å; I575-V613 HydrophobicContact CG2-CB 4.32Å; I575-V613 HydrophobicContact CG2-CG2 3.58Å; L597-V613 HydrophobicContact CD2-CG2 4.04Å; V601-V613 HydrophobicContact CG1-CB 4.4Å; V601-V613 HydrophobicContact CG1-CG2 3.73Å; N609-V613 WeakPolarHBondContact O-CG2 3.48Å; N609-V613 PolarHBondContact O-N 2.69Å; V613-A616 PolarHBondContact O-N 2.89Å; V613-G617 PolarHBondContact O-N 2.9Å; V613-G618 WeakPolarHBondContact O-CA 3.46Å; V613-G618 PolarHBondContact O-N 2.93Å; V613-W641 HydrophobicContact CG1-CH2 3.85Å; V613-W641 HydrophobicContact CG1-CZ3 3.89Å; V613-W641 HydrophobicContact CG2-CH2 4.46Å
614	R	94.8	Very high	93.6	Very high	171 Å²	171	67.4 Å²	67.4	65%	0.645	35%	0.351	S	S	*	.	H	α-helix	trans	-59.2	-48.3	176	175.9	-177.2	174.5	-156.4	-2.9	111.2	K610 I611 A612 A616 G617 I619	K610-R614 WeakPolarHBondContact O-CB 3.36Å; K610-R614 PolarHBondContact O-N 2.88Å; I611-R614 WeakPolarHBondContact O-CB 3.5Å; I611-R614 PolarHBondContact O-N 3.41Å; A612-R614 PolarHBondContact O-N 2.91Å; R614-A616 VanDerWaalsContact C-N 3.33Å; R614-A616 PolarHBondContact O-N 3.4Å; R614-G617 PolarHBondContact O-N 2.9Å; R614-G617 VanDerWaalsContact O-N 3.11Å; R614-I619 HydrophobicContact CB-CD1 4.31Å; R614-I619 HydrophobicContact CG-CD1 4.11Å
615	N	96.2	Very high	94	Very high	121 Å²	121	58.1 Å²	58.1	65%	0.647	31%	0.311	S	S	*	.	H	α-helix	trans	-69.1	-30.6	-177.2	-66.7	-8.8	0	0	0	112.5	I611 A612 G617	I611-N615 WeakPolarHBondContact CG2-ND2 3.36Å; I611-N615 WeakPolarHBondContact O-CB 3.34Å; I611-N615 PolarHBondContact O-N 3.47Å; I611-N615 PolarHBondContact O-ND2 2.96Å; I611-N615 PolarHBondContact O-OD1 3.4Å; A612-N615 PolarHBondContact O-N 3.49Å; N615-G617 PolarHBondContact O-N 3.43Å
616	A	95.6	Very high	94.4	Very high	33 Å²	33	57.4 Å²	57.4	27%	0.273	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-3.8	172.5	0	0	0	0	0	114	I575 K576 V579 A612 V613 R614	I575-A616 HydrophobicContact CG2-CB 4.46Å; K576-A616 HydrophobicContact CB-CB 4.43Å; V579-A616 HydrophobicContact CB-CB 4.46Å; V579-A616 HydrophobicContact CG2-CB 4.29Å; A612-A616 VanDerWaalsContact O-CB 3.29Å; A612-A616 WeakPolarHBondContact O-CB 3.42Å; A612-A616 PolarHBondContact O-N 3.34Å; V613-A616 PolarHBondContact O-N 2.89Å; R614-A616 VanDerWaalsContact C-N 3.33Å; R614-A616 PolarHBondContact O-N 3.4Å
617	G	95.8	Very high	94.4	Very high	27 Å²	27	67.2 Å²	67.2	28%	0.278	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	18.8	-177.1	0	0	0	0	0	114.4	V613 R614 N615 I619 P620 A621	V613-G617 PolarHBondContact O-N 2.9Å; R614-G617 PolarHBondContact O-N 2.9Å; R614-G617 VanDerWaalsContact O-N 3.11Å; N615-G617 PolarHBondContact O-N 3.43Å; G617-I619 VanDerWaalsContact C-N 3.32Å; G617-I619 PolarHBondContact O-N 3.19Å; G617-P620 WeakPolarHBondContact O-CD 3.35Å; G617-P620 VanDerWaalsContact O-CG 3.26Å; G617-P620 WeakPolarHBondContact O-CG 3.23Å; G617-A621 WeakPolarHBondContact O-CB 3.47Å; G617-A621 PolarHBondContact O-N 3.45Å
618	G	94.7	Very high	94.5	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-58.7	-38.3	-178.4	0	0	0	0	0	113.9	V613 A621 L622	V613-G618 WeakPolarHBondContact O-CA 3.46Å; V613-G618 PolarHBondContact O-N 2.93Å; G618-A621 PolarHBondContact O-N 2.72Å; G618-L622 WeakPolarHBondContact O-CB 3.37Å; G618-L622 WeakPolarHBondContact O-CD1 3.46Å; G618-L622 WeakPolarHBondContact O-CG 3.31Å; G618-L622 PolarHBondContact O-N 2.85Å
619	I	94.2	Very high	94.3	Very high	90 Å²	90	64.7 Å²	64.7	46%	0.462	32%	0.316	S	S	.	.	H	α-helix	trans	-60	-56.5	179.8	-58.9	175.1	0	0	0	112.1	R614 G617 A621 L622 L623	R614-I619 HydrophobicContact CB-CD1 4.31Å; R614-I619 HydrophobicContact CG-CD1 4.11Å; G617-I619 VanDerWaalsContact C-N 3.32Å; G617-I619 PolarHBondContact O-N 3.19Å; I619-A621 VanDerWaalsContact C-N 3.3Å; I619-A621 PolarHBondContact O-N 2.94Å; I619-L622 PolarHBondContact O-N 3.04Å; I619-L623 HydrophobicContact CG2-CD1 4.12Å; I619-L623 WeakPolarHBondContact O-CG 3.33Å; I619-L623 PolarHBondContact O-N 3.12Å
620	P	95.4	Very high	94.2	Very high	82 Å²	82	71.1 Å²	71.1	53%	0.532	36%	0.356	S	S	.	.	H	α-helix	trans	-65.2	-29.2	175.9	23	-32.2	0	0	0	113.6	G617 R624	G617-P620 WeakPolarHBondContact O-CD 3.35Å; G617-P620 VanDerWaalsContact O-CG 3.26Å; G617-P620 WeakPolarHBondContact O-CG 3.23Å; P620-R624 VanDerWaalsContact O-CB 3.27Å; P620-R624 WeakPolarHBondContact O-CB 3.49Å; P620-R624 PolarHBondContact O-N 3.35Å
621	A	95.3	Very high	94.1	Very high	4 Å²	4	69 Å²	69	3%	0.033	35%	0.348	C	S	.	.	H	α-helix	trans	-65.1	-49.1	173.8	0	0	0	0	0	112	V579 L582 G617 G618 I619 L623 R624 L625	V579-A621 HydrophobicContact CG1-CB 4.1Å; L582-A621 HydrophobicContact CB-CB 4.42Å; L582-A621 HydrophobicContact CD1-CB 3.88Å; G617-A621 WeakPolarHBondContact O-CB 3.47Å; G617-A621 PolarHBondContact O-N 3.45Å; G618-A621 PolarHBondContact O-N 2.72Å; I619-A621 VanDerWaalsContact C-N 3.3Å; I619-A621 PolarHBondContact O-N 2.94Å; A621-L623 PolarHBondContact O-N 2.85Å; A621-R624 PolarHBondContact O-N 3.09Å; A621-L625 WeakPolarHBondContact O-CB 3.46Å; A621-L625 PolarHBondContact O-N 2.95Å
622	L	93.9	Very high	93.9	Very high	13 Å²	13	68.4 Å²	68.4	7%	0.068	36%	0.355	C	S	.	.	H	α-helix	trans	-59.7	-45.3	175.2	-70.9	165.2	0	0	0	111.9	L582 G618 I619 R624 L625 L626 V638 W641	L582-L622 HydrophobicContact CD1-CD2 3.83Å; L582-L622 HydrophobicContact CD1-CG 3.94Å; L582-L622 HydrophobicContact CD2-CD2 4.47Å; G618-L622 WeakPolarHBondContact O-CB 3.37Å; G618-L622 WeakPolarHBondContact O-CD1 3.46Å; G618-L622 WeakPolarHBondContact O-CG 3.31Å; G618-L622 PolarHBondContact O-N 2.85Å; I619-L622 PolarHBondContact O-N 3.04Å; L622-R624 VanDerWaalsContact C-N 3.3Å; L622-R624 PolarHBondContact O-N 3.37Å; L622-L625 WeakPolarHBondContact O-CB 3.38Å; L622-L625 PolarHBondContact O-N 3.23Å; L622-L626 WeakPolarHBondContact O-CB 3.35Å; L622-L626 PolarHBondContact O-N 2.99Å; L622-V638 HydrophobicContact CB-CG1 4.1Å; L622-V638 HydrophobicContact CD2-CG1 4.29Å; L622-V638 HydrophobicContact CD2-CG2 3.94Å; L622-W641 HydrophobicContact CD1-CD2 4.09Å; L622-W641 HydrophobicContact CD1-CE3 4.18Å; L622-W641 HydrophobicContact CD1-CH2 3.78Å; L622-W641 HydrophobicContact CD1-CZ2 3.64Å; L622-W641 HydrophobicContact CD1-CZ3 4.04Å; L622-W641 HydrophobicContact CD2-CZ2 4.09Å; L622-W641 HydrophobicContact CG-CZ2 4.49Å
623	L	94.1	Very high	93.5	Very high	90 Å²	90	72.4 Å²	72.4	47%	0.471	37%	0.369	S	S	.	.	H	α-helix	trans	-62.9	-35.7	176.7	-71.9	172	0	0	0	112.7	I619 A621 R627	I619-L623 HydrophobicContact CG2-CD1 4.12Å; I619-L623 WeakPolarHBondContact O-CG 3.33Å; I619-L623 PolarHBondContact O-N 3.12Å; A621-L623 PolarHBondContact O-N 2.85Å; L623-R627 VanDerWaalsContact O-CG 3.3Å; L623-R627 WeakPolarHBondContact O-CG 3.3Å; L623-R627 PolarHBondContact O-N 3.31Å
624	R	94.3	Very high	93.2	Very high	91 Å²	91	72.2 Å²	72.2	34%	0.343	37%	0.368	S	S	.	.	H	α-helix	trans	-76.2	-32.6	175.7	176.7	172.7	42.4	53.5	-7.2	112.3	D583 P620 A621 L622 K628	D583-R624 VanDerWaalsContact CG-CZ 3.49Å; D583-R624 IonicContact OD1-CZ 2.68Å; D583-R624 IonicContact OD1-NH1 2.73Å; D583-R624 PolarHBondContact OD1-NH1 2.89Å; D583-R624 IonicContact OD1-NH2 3.7Å; D583-R624 PolarHBondContact OD1-NH2 3.31Å; D583-R624 IonicContact OD2-CZ 3.47Å; D583-R624 IonicContact OD2-NH1 2.82Å; D583-R624 PolarHBondContact OD2-NH1 3.3Å; D583-R624 IonicContact OD2-NH2 3.19Å; D583-R624 PolarHBondContact OD2-NH2 2.84Å; P620-R624 VanDerWaalsContact O-CB 3.27Å; P620-R624 WeakPolarHBondContact O-CB 3.49Å; P620-R624 PolarHBondContact O-N 3.35Å; A621-R624 PolarHBondContact O-N 3.09Å; L622-R624 VanDerWaalsContact C-N 3.3Å; L622-R624 PolarHBondContact O-N 3.37Å; R624-K628 HydrophobicContact CG-CD 4.11Å; R624-K628 WeakPolarHBondContact O-CB 3.4Å; R624-K628 WeakPolarHBondContact O-CG 3.37Å; R624-K628 PolarHBondContact O-N 2.88Å
625	L	93.8	Very high	93	Very high	3 Å²	3	69 Å²	69	2%	0.016	36%	0.355	C	S	.	.	H	α-helix	trans	-63.8	-48.8	170.6	178.1	55.9	0	0	0	110.6	L582 Q590 A621 L622 R627 K628 T629 V634 V638	L582-L625 HydrophobicContact CB-CD2 4.33Å; L582-L625 HydrophobicContact CD2-CD2 3.89Å; Q590-L625 HydrophobicContact CB-CD1 4.29Å; Q590-L625 HydrophobicContact CB-CD2 4.47Å; Q590-L625 HydrophobicContact CG-CD1 4.36Å; Q590-L625 VanDerWaalsContact NE2-CD1 3.27Å; A621-L625 WeakPolarHBondContact O-CB 3.46Å; A621-L625 PolarHBondContact O-N 2.95Å; L622-L625 WeakPolarHBondContact O-CB 3.38Å; L622-L625 PolarHBondContact O-N 3.23Å; L625-R627 VanDerWaalsContact C-N 3.27Å; L625-R627 PolarHBondContact O-N 3.42Å; L625-K628 CarbonylContact O-C 3.59Å; L625-K628 PolarHBondContact O-N 3.44Å; L625-T629 WeakPolarHBondContact O-CB 3.37Å; L625-T629 WeakPolarHBondContact O-CG2 3.35Å; L625-T629 PolarHBondContact O-N 2.89Å; L625-V634 HydrophobicContact CD1-CG1 3.95Å; L625-V634 HydrophobicContact CD2-CG1 3.86Å; L625-V634 HydrophobicContact CG-CG1 3.91Å; L625-V638 HydrophobicContact CD2-CG2 3.91Å; L625-V638 HydrophobicContact CG-CG2 4.25Å
626	L	93.1	Very high	92.7	Very high	60 Å²	60	69.9 Å²	69.9	31%	0.314	36%	0.356	S	S	.	.	H	α-helix	trans	-55.4	-40	177.6	-169.7	68.4	0	0	0	112.6	L622 K628 R635 V638 T639	L622-L626 WeakPolarHBondContact O-CB 3.35Å; L622-L626 PolarHBondContact O-N 2.99Å; L626-K628 VanDerWaalsContact C-N 3.34Å; L626-R635 HydrophobicContact CD1-CG 3.73Å; L626-V638 HydrophobicContact CB-CG1 4.07Å; L626-V638 HydrophobicContact CD1-CB 4.28Å; L626-V638 HydrophobicContact CD1-CG1 4.08Å; L626-V638 HydrophobicContact CG-CG1 4.48Å; L626-T639 HydrophobicContact CD1-CG2 4.16Å
627	R	93.3	Very high	92.4	Very high	218 Å²	218	70 Å²	70	82%	0.823	35%	0.351	S	S	*	.	H	α-helix	trans	-74.3	-18	176.8	-71.5	172.7	-177.4	-173.7	1.2	114.5	L623 L625	L623-R627 VanDerWaalsContact O-CG 3.3Å; L623-R627 WeakPolarHBondContact O-CG 3.3Å; L623-R627 PolarHBondContact O-N 3.31Å; L625-R627 VanDerWaalsContact C-N 3.27Å; L625-R627 PolarHBondContact O-N 3.42Å
628	K	92.6	Very high	92	Very high	152 Å²	152	69.4 Å²	69.4	66%	0.661	34%	0.343	S	S	*	.	H	α-helix	trans	-107.5	-17.7	-177.1	-71.7	179.6	69	-175	0	113.7	R624 L625 L626	R624-K628 HydrophobicContact CG-CD 4.11Å; R624-K628 WeakPolarHBondContact O-CB 3.4Å; R624-K628 WeakPolarHBondContact O-CG 3.37Å; R624-K628 PolarHBondContact O-N 2.88Å; L625-K628 CarbonylContact O-C 3.59Å; L625-K628 PolarHBondContact O-N 3.44Å; L626-K628 VanDerWaalsContact C-N 3.34Å
629	T	90.5	Very high	91.6	Very high	15 Å²	15	73 Å²	73	9%	0.092	37%	0.365	C	S	.	.			trans	-86.6	119.5	-173.1	-169.1	0	0	0	0	113.7	L625 D631 V634 R635	L625-T629 WeakPolarHBondContact O-CB 3.37Å; L625-T629 WeakPolarHBondContact O-CG2 3.35Å; L625-T629 PolarHBondContact O-N 2.89Å; T629-D631 WeakPolarHBondContact OG1-CB 3.4Å; T629-D631 PolarHBondContact OG1-N 2.92Å; T629-D631 PolarHBondContact OG1-O 3.37Å; T629-V634 HydrophobicContact CG2-CB 4.42Å; T629-V634 HydrophobicContact CG2-CG1 4.1Å; T629-R635 HydrophobicContact CG2-CB 4.21Å; T629-R635 PolarHBondContact O-NH2 3.35Å; T629-R635 VanDerWaalsContact O-NH2 3.08Å
630	V	90.6	Very high	90.9	Very high	139 Å²	139	69.8 Å²	69.8	84%	0.842	35%	0.354	S	S	*	.			trans	-80.5	-22.2	165.5	-63.8	0	0	0	0	112.2	R635	V630-R635 PolarHBondContact O-NH2 3.08Å
631	D	91.4	Very high	89.7	Confident	36 Å²	36	69.3 Å²	69.3	19%	0.193	34%	0.342	C	S	.	.			trans	-67.3	132.5	178.1	-175.8	-59.7	0	0	0	111.1	V587 R591 T629 E633 V634 R635	V587-D631 HydrophobicContact CG1-CB 3.71Å; V587-D631 WeakPolarHBondContact CG1-OD2 3.44Å; R591-D631 IonicContact CZ-OD1 3.14Å; R591-D631 IonicContact CZ-OD2 2.81Å; R591-D631 VanDerWaalsContact CZ-OD2 3.26Å; R591-D631 IonicContact NH1-OD1 3.24Å; R591-D631 IonicContact NH1-OD2 3.12Å; R591-D631 PolarHBondContact NH1-OD2 3.3Å; R591-D631 IonicContact NH2-OD1 2.69Å; R591-D631 PolarHBondContact NH2-OD1 3.04Å; R591-D631 IonicContact NH2-OD2 2.67Å; R591-D631 PolarHBondContact NH2-OD2 3.5Å; T629-D631 WeakPolarHBondContact OG1-CB 3.4Å; T629-D631 PolarHBondContact OG1-N 2.92Å; T629-D631 PolarHBondContact OG1-O 3.37Å; D631-E633 PolarHBondContact OD1-N 2.98Å; D631-V634 HydrophobicContact CB-CB 4.17Å; D631-V634 HydrophobicContact CB-CG2 4.07Å; D631-V634 PolarHBondContact OD1-N 3.12Å; D631-R635 WeakPolarHBondContact O-CB 3.43Å; D631-R635 PolarHBondContact O-N 3.27Å; D631-R635 PolarHBondContact O-NH2 2.95Å
632	A	90.1	Very high	87.6	Confident	63 Å²	63	74.5 Å²	74.5	52%	0.521	38%	0.377	S	S	.	.	H	α-helix	trans	-78	-38.6	-175.5	0	0	0	0	0	113.2	R635 E636	A632-R635 WeakPolarHBondContact O-CB 3.41Å; A632-R635 PolarHBondContact O-N 3.38Å; A632-E636 PolarHBondContact O-N 2.89Å
633	E	88.1	Confident	84.8	Confident	109 Å²	109	80.7 Å²	80.7	51%	0.509	43%	0.43	S	S	.	.	H	α-helix	trans	-71.6	-38.6	-179.8	-61.6	-178.7	161.1	0	0	110.5	R591 D631 R635 E636 L637	R591-E633 IonicContact CZ-OE2 2.81Å; R591-E633 IonicContact NE-OE2 2.73Å; R591-E633 PolarHBondContact NE-OE2 3.06Å; R591-E633 IonicContact NH2-OE2 3.17Å; R591-E633 PolarHBondContact NH2-OE2 3.36Å; D631-E633 PolarHBondContact OD1-N 2.98Å; E633-R635 VanDerWaalsContact C-N 3.26Å; E633-R635 PolarHBondContact O-N 2.75Å; E633-E636 PolarHBondContact O-N 3.42Å; E633-L637 WeakPolarHBondContact O-CB 3.35Å; E633-L637 VanDerWaalsContact O-CG 3.25Å; E633-L637 WeakPolarHBondContact O-CG 3.49Å; E633-L637 PolarHBondContact O-N 2.89Å
634	V	89.8	Confident	84.3	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-62.4	-36.3	171.8	178.6	0	0	0	0	110.9	V587 R591 L625 T629 D631 V638	V587-V634 HydrophobicContact CG1-CG2 3.82Å; R591-V634 HydrophobicContact CB-CG2 3.83Å; R591-V634 HydrophobicContact CG-CG2 4.48Å; L625-V634 HydrophobicContact CD1-CG1 3.95Å; L625-V634 HydrophobicContact CD2-CG1 3.86Å; L625-V634 HydrophobicContact CG-CG1 3.91Å; T629-V634 HydrophobicContact CG2-CB 4.42Å; T629-V634 HydrophobicContact CG2-CG1 4.1Å; D631-V634 HydrophobicContact CB-CB 4.17Å; D631-V634 HydrophobicContact CB-CG2 4.07Å; D631-V634 PolarHBondContact OD1-N 3.12Å; V634-V638 VanDerWaalsContact O-CG2 3.24Å; V634-V638 WeakPolarHBondContact O-CG2 3.34Å; V634-V638 PolarHBondContact O-N 2.97Å
635	R	90.8	Very high	83.8	Confident	102 Å²	102	79.6 Å²	79.6	39%	0.385	43%	0.433	S	S	.	.	H	α-helix	trans	-65.4	-46.1	175.7	-166.9	-177	-58.1	119.3	15.3	111.3	L626 T629 V630 D631 A632 E633 V638 T639	L626-R635 HydrophobicContact CD1-CG 3.73Å; T629-R635 HydrophobicContact CG2-CB 4.21Å; T629-R635 PolarHBondContact O-NH2 3.35Å; T629-R635 VanDerWaalsContact O-NH2 3.08Å; V630-R635 PolarHBondContact O-NH2 3.08Å; D631-R635 WeakPolarHBondContact O-CB 3.43Å; D631-R635 PolarHBondContact O-N 3.27Å; D631-R635 PolarHBondContact O-NH2 2.95Å; A632-R635 WeakPolarHBondContact O-CB 3.41Å; A632-R635 PolarHBondContact O-N 3.38Å; E633-R635 VanDerWaalsContact C-N 3.26Å; E633-R635 PolarHBondContact O-N 2.75Å; R635-V638 PolarHBondContact O-N 3.34Å; R635-T639 PolarHBondContact O-N 3.24Å; R635-T639 VanDerWaalsContact O-N 3.07Å; R635-T639 PolarHBondContact O-OG1 3.44Å
636	E	90.2	Very high	83.3	Confident	140 Å²	140	83.9 Å²	83.9	65%	0.654	46%	0.456	S	S	*	.	H	α-helix	trans	-63.6	-45.3	176.5	-172.2	-176.9	160.4	0	0	112.3	A632 E633 V638 T639 G640	A632-E636 PolarHBondContact O-N 2.89Å; E633-E636 PolarHBondContact O-N 3.42Å; E636-V638 PolarHBondContact O-N 3.34Å; E636-T639 PolarHBondContact O-N 3.09Å; E636-T639 PolarHBondContact O-OG1 3.44Å; E636-G640 WeakPolarHBondContact O-CA 3.44Å; E636-G640 PolarHBondContact O-N 2.93Å
637	L	88.9	Confident	82.7	Confident	35 Å²	35	85.3 Å²	85.3	18%	0.183	46%	0.464	C	S	.	.	H	α-helix	trans	-61.3	-29.7	177.3	-75	170.8	0	0	0	112.9	R591 E633 W641	R591-L637 HydrophobicContact CG-CD1 3.9Å; E633-L637 WeakPolarHBondContact O-CB 3.35Å; E633-L637 VanDerWaalsContact O-CG 3.25Å; E633-L637 WeakPolarHBondContact O-CG 3.49Å; E633-L637 PolarHBondContact O-N 2.89Å; L637-W641 PolarHBondContact O-NE1 3.39Å
638	V	88	Confident	82	Confident	15 Å²	15	77 Å²	77	9%	0.091	44%	0.442	C	S	.	.	H	α-helix	trans	-80	-39.9	175.2	173.5	0	0	0	0	112	L622 L625 L626 V634 R635 E636 W641	L622-V638 HydrophobicContact CB-CG1 4.1Å; L622-V638 HydrophobicContact CD2-CG1 4.29Å; L622-V638 HydrophobicContact CD2-CG2 3.94Å; L625-V638 HydrophobicContact CD2-CG2 3.91Å; L625-V638 HydrophobicContact CG-CG2 4.25Å; L626-V638 HydrophobicContact CB-CG1 4.07Å; L626-V638 HydrophobicContact CD1-CB 4.28Å; L626-V638 HydrophobicContact CD1-CG1 4.08Å; L626-V638 HydrophobicContact CG-CG1 4.48Å; V634-V638 VanDerWaalsContact O-CG2 3.24Å; V634-V638 WeakPolarHBondContact O-CG2 3.34Å; V634-V638 PolarHBondContact O-N 2.97Å; R635-V638 PolarHBondContact O-N 3.34Å; E636-V638 PolarHBondContact O-N 3.34Å; V638-W641 VanDerWaalsContact O-CD1 3.24Å
639	T	86.3	Confident	81.3	Confident	76 Å²	76	72 Å²	72	47%	0.466	43%	0.427	S	S	.	.	H	α-helix	trans	-75	-31.7	177.8	53	0	0	0	0	112.8	L626 R635 E636 W641 S642	L626-T639 HydrophobicContact CD1-CG2 4.16Å; R635-T639 PolarHBondContact O-N 3.24Å; R635-T639 VanDerWaalsContact O-N 3.07Å; R635-T639 PolarHBondContact O-OG1 3.44Å; E636-T639 PolarHBondContact O-N 3.09Å; E636-T639 PolarHBondContact O-OG1 3.44Å; T639-W641 PolarHBondContact O-N 3.41Å; T639-S642 PolarHBondContact O-N 3.21Å; T639-S642 PolarHBondContact O-OG 3.34Å
640	G	79.1	Confident	80.7	Confident	23 Å²	23	76.1 Å²	76.1	24%	0.237	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	17.1	-179.7	0	0	0	0	0	116.2	R598 E636 S642	R598-G640 PolarHBondContact NE-O 3.4Å; E636-G640 WeakPolarHBondContact O-CA 3.44Å; E636-G640 PolarHBondContact O-N 2.93Å; G640-S642 VanDerWaalsContact C-N 3.34Å
641	W	70.3	Confident	79.9	Confident	72 Å²	72	71.2 Å²	71.2	27%	0.273	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-8.9	166.3	-72.2	58	0	0	0	112.7	L597 V601 V613 L622 L637 V638 T639	L597-W641 HydrophobicContact CB-CH2 3.84Å; L597-W641 HydrophobicContact CB-CZ2 3.62Å; V601-W641 HydrophobicContact CB-CZ3 4.4Å; V601-W641 HydrophobicContact CG1-CH2 4.21Å; V601-W641 HydrophobicContact CG1-CZ3 3.86Å; V601-W641 HydrophobicContact CG2-CD2 4.43Å; V601-W641 HydrophobicContact CG2-CE3 3.86Å; V601-W641 HydrophobicContact CG2-CH2 4.23Å; V601-W641 HydrophobicContact CG2-CZ3 3.75Å; V613-W641 HydrophobicContact CG1-CH2 3.85Å; V613-W641 HydrophobicContact CG1-CZ3 3.89Å; V613-W641 HydrophobicContact CG2-CH2 4.46Å; L622-W641 HydrophobicContact CD1-CD2 4.09Å; L622-W641 HydrophobicContact CD1-CE3 4.18Å; L622-W641 HydrophobicContact CD1-CH2 3.78Å; L622-W641 HydrophobicContact CD1-CZ2 3.64Å; L622-W641 HydrophobicContact CD1-CZ3 4.04Å; L622-W641 HydrophobicContact CD2-CZ2 4.09Å; L622-W641 HydrophobicContact CG-CZ2 4.49Å; L637-W641 PolarHBondContact O-NE1 3.39Å; V638-W641 VanDerWaalsContact O-CD1 3.24Å; T639-W641 PolarHBondContact O-N 3.41Å
642	S	50.1	Low	78.9	Confident	112 Å²	112	74.2 Å²	74.2	78%	0.783	44%	0.44	S	S	*	.			trans	-102.3	22	-165.9	-41.9	0	0	0	0	114.2	T639 G640	T639-S642 PolarHBondContact O-N 3.21Å; T639-S642 PolarHBondContact O-OG 3.34Å; G640-S642 VanDerWaalsContact C-N 3.34Å
643	A	35.8	Very low	77.9	Confident	143 Å²	143	75.2 Å²	75.2	100%	1.182	43%	0.433	S	S	*	.			trans	-134.2	0	-173.1	0	0	0	0	0	111.9

Retrieved 643 of 643 residues in 114.8 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).