G4LWV7_SCHMA Loading...

Shugoshin_C domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession G4LWV7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 743 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	43.5	Very low	55.6	Low	229 Å²	229	141.4 Å²	141.4	100%	1.128	80%	0.797	S	S	*	*				0	97.4	0	-78.6	-59.2	-174.9	0	0	108.1	G3	M1-G3 PolarHBondContact O-N 3.25Å
2	N	44.9	Very low	55.6	Low	167 Å²	167	145.8 Å²	145.8	89%	0.893	80%	0.802	S	S	*	*			trans	-92.8	103.2	-169.3	-66.7	14.2	0	0	0	109.7	S4	N2-S4 PolarHBondContact O-N 3.09Å
3	G	44.5	Very low	55.4	Low	75 Å²	75	152.2 Å²	152.2	77%	0.773	81%	0.807	S	S	*	*			trans	-69.3	98.4	-176.1	0	0	0	0	0	112.9	M1 K5	M1-G3 PolarHBondContact O-N 3.25Å; G3-K5 PolarHBondContact O-N 3.5Å
4	S	61.1	Low	55.4	Low	116 Å²	116	156.2 Å²	156.2	81%	0.811	81%	0.814	S	S	*	*			trans	-65.7	114.1	171.8	-173.5	0	0	0	0	110.5	N2	N2-S4 PolarHBondContact O-N 3.09Å
5	K	60.1	Low	55.4	Low	190 Å²	190	152.9 Å²	152.9	83%	0.826	81%	0.809	S	S	*	*			trans	-79.4	121.5	173.8	-69	179.8	179	176.5	0	109.2	G3 H7	G3-K5 PolarHBondContact O-N 3.5Å; K5-H7 PolarHBondContact O-N 3.42Å
6	P	61.8	Low	55.7	Low	118 Å²	118	156 Å²	156	77%	0.766	81%	0.813	S	S	*	*			trans	-68.8	120	179.8	26.9	-33.4	0	0	0	111.1	I8	P6-I8 PolarHBondContact O-N 2.98Å
7	H	60	Low	56.1	Low	175 Å²	175	160.1 Å²	160.1	81%	0.81	82%	0.815	S	S	*	*			trans	-82.4	104	-176.5	-176.1	-75.2	0	0	0	111.5	K5 S9	K5-H7 PolarHBondContact O-N 3.42Å; H7-S9 PolarHBondContact O-N 3.43Å; H7-S9 VanDerWaalsContact O-N 3.09Å
8	I	60.1	Low	56.3	Low	150 Å²	150	157.8 Å²	157.8	77%	0.769	81%	0.813	S	S	*	*			trans	-75.2	99.2	-175.9	-56.1	176.7	0	0	0	111.2	P6 I10	P6-I8 PolarHBondContact O-N 2.98Å; I8-I10 PolarHBondContact O-N 3.1Å
9	S	61.7	Low	56.6	Low	86 Å²	86	159.3 Å²	159.3	60%	0.601	81%	0.813	S	S	*	*			trans	-83	108.2	172.8	58.8	0	0	0	0	111.9	H7 T11	H7-S9 PolarHBondContact O-N 3.43Å; H7-S9 VanDerWaalsContact O-N 3.09Å; S9-T11 PolarHBondContact O-N 3.43Å
10	I	60	Low	56.9	Low	138 Å²	138	155.1 Å²	155.1	71%	0.708	79%	0.792	S	S	*	*			trans	-76.8	88.5	177	-55.5	178.1	0	0	0	110.3	I8 F12	I8-I10 PolarHBondContact O-N 3.1Å; I10-F12 PolarHBondContact O-N 3.38Å
11	T	54.2	Low	57.6	Low	111 Å²	111	153.2 Å²	153.2	68%	0.681	78%	0.784	S	S	*	*			trans	-78.1	111.1	170.4	58.8	0	0	0	0	110.4	S9 R13	S9-T11 PolarHBondContact O-N 3.43Å; T11-R13 PolarHBondContact O-N 3.14Å
12	F	55	Low	59	Low	194 Å²	194	147 Å²	147	85%	0.851	76%	0.755	S	S	*	*			trans	-64.7	92.4	170.5	-73.6	-84.5	0	0	0	110.7	I10 K14	I10-F12 PolarHBondContact O-N 3.38Å; F12-K14 PolarHBondContact O-N 3.02Å; F12-K14 VanDerWaalsContact O-N 3.15Å
13	R	52.9	Low	60.2	Low	230 Å²	230	142.4 Å²	142.4	87%	0.868	74%	0.736	S	S	*	*			trans	-56.7	120.6	167.6	-78.5	-172.1	171.8	-162.8	-2.1	108.3	T11 S15	T11-R13 PolarHBondContact O-N 3.14Å; R13-S15 VanDerWaalsContact C-N 3.32Å; R13-S15 PolarHBondContact O-N 3.03Å
14	K	56	Low	61.5	Low	208 Å²	208	141 Å²	141	90%	0.904	71%	0.713	S	S	*	*			trans	-57.5	96.4	167.6	-69.4	178.4	-179.6	174.6	0	107.9	F12 K16	F12-K14 PolarHBondContact O-N 3.02Å; F12-K14 VanDerWaalsContact O-N 3.15Å; K14-K16 PolarHBondContact O-N 3.21Å; K14-K16 VanDerWaalsContact O-N 3.11Å
15	S	54.8	Low	62	Low	106 Å²	106	139.7 Å²	139.7	74%	0.741	69%	0.69	S	S	*	*			trans	-66.6	115.8	-173.1	50.2	0	0	0	0	109.2	R13 R17	R13-S15 VanDerWaalsContact C-N 3.32Å; R13-S15 PolarHBondContact O-N 3.03Å; S15-R17 PolarHBondContact O-N 3.33Å
16	K	61.3	Low	62.6	Low	203 Å²	203	134.7 Å²	134.7	88%	0.883	67%	0.671	S	S	*	*			trans	-57.4	108.9	166.5	-68.6	-179	179.3	179	0	105.9	K14	K14-K16 PolarHBondContact O-N 3.21Å; K14-K16 VanDerWaalsContact O-N 3.11Å
17	R	62	Low	63.1	Low	225 Å²	225	134.7 Å²	134.7	85%	0.849	66%	0.663	S	S	*	*			trans	-49.3	126.4	174.1	-73.6	-175.1	177.1	-173.9	-0.6	107.1	S15 K19	S15-R17 PolarHBondContact O-N 3.33Å; R17-K19 PolarHBondContact O-N 3.38Å
18	P	60.1	Low	63.9	Low	119 Å²	119	133.2 Å²	133.2	77%	0.773	65%	0.65	S	S	*	*			trans	-59.7	111.1	-179.9	23.1	-32.2	0	0	0	108	L20	P18-L20 VanDerWaalsContact C-N 3.33Å; P18-L20 PolarHBondContact O-N 3.18Å
19	K	61.4	Low	64.8	Low	187 Å²	187	130 Å²	130	81%	0.813	63%	0.634	S	S	*	*			trans	-64.9	100.9	170.6	-74.9	-172.1	177.1	-174.1	0	105.7	R17 N21	R17-K19 PolarHBondContact O-N 3.38Å; K19-N21 PolarHBondContact O-N 3.28Å
20	L	63.3	Low	65.8	Low	74 Å²	74	133.7 Å²	133.7	39%	0.387	64%	0.635	S	S	.	*			trans	-48.5	132.3	168.4	-65.6	169.1	0	0	0	108.2	P18 D22 R25	P18-L20 VanDerWaalsContact C-N 3.33Å; P18-L20 PolarHBondContact O-N 3.18Å; L20-D22 PolarHBondContact O-N 3.02Å; L20-R25 VanDerWaalsContact O-CZ 3.32Å; L20-R25 PolarHBondContact O-NH2 3.46Å
21	N	70	Confident	67.1	Low	117 Å²	117	128.8 Å²	128.8	63%	0.626	62%	0.618	S	S	*	*			trans	-53.6	138.4	173.3	-68.2	-4.5	0	0	0	109.1	K19 S23 V24 R25	K19-N21 PolarHBondContact O-N 3.28Å; N21-S23 PolarHBondContact O-N 3.02Å; N21-S23 VanDerWaalsContact O-N 3.14Å; N21-V24 WeakPolarHBondContact O-CB 3.42Å; N21-V24 PolarHBondContact O-N 3.11Å; N21-R25 PolarHBondContact O-N 3.39Å; N21-R25 VanDerWaalsContact O-N 3.09Å
22	D	73.2	Confident	68.7	Low	99 Å²	99	128.6 Å²	128.6	53%	0.529	61%	0.613	S	S	.	*	H	α-helix	trans	-63.9	-25.2	-170.3	-70.7	-69.6	0	0	0	113.1	L20 R25 I26	L20-D22 PolarHBondContact O-N 3.02Å; D22-R25 WeakPolarHBondContact O-CB 3.35Å; D22-R25 PolarHBondContact O-N 2.74Å; D22-R25 IonicContact OD1-CZ 3.11Å; D22-R25 IonicContact OD1-NE 2.77Å; D22-R25 PolarHBondContact OD1-NE 2.96Å; D22-R25 IonicContact OD1-NH2 2.71Å; D22-R25 PolarHBondContact OD1-NH2 3.16Å; D22-R25 IonicContact OD2-NH2 3.54Å; D22-I26 WeakPolarHBondContact O-CB 3.43Å; D22-I26 WeakPolarHBondContact O-CD1 3.45Å; D22-I26 WeakPolarHBondContact O-CG1 3.45Å; D22-I26 PolarHBondContact O-N 3.45Å
23	S	71.6	Confident	70.4	Confident	70 Å²	70	125 Å²	125	49%	0.49	60%	0.602	S	S	.	*	H	α-helix	trans	-56	-48.8	166.7	54.2	0	0	0	0	113	N21 R25 I26 M27	N21-S23 PolarHBondContact O-N 3.02Å; N21-S23 VanDerWaalsContact O-N 3.14Å; S23-R25 VanDerWaalsContact C-N 3.31Å; S23-R25 PolarHBondContact O-N 2.93Å; S23-I26 PolarHBondContact O-N 3.46Å; S23-M27 WeakPolarHBondContact O-CG 3.47Å; S23-M27 PolarHBondContact O-N 3.25Å
24	V	70.7	Confident	72.2	Confident	46 Å²	46	119.2 Å²	119.2	28%	0.279	59%	0.588	S	S	.	*	H	α-helix	trans	-66.5	-34.8	176.6	-178.3	0	0	0	0	111.1	N21 M27 R28	N21-V24 WeakPolarHBondContact O-CB 3.42Å; N21-V24 PolarHBondContact O-N 3.11Å; V24-M27 HydrophobicContact CG2-CE 4.35Å; V24-R28 WeakPolarHBondContact O-CB 3.46Å; V24-R28 WeakPolarHBondContact O-CG 3.37Å; V24-R28 PolarHBondContact O-N 2.99Å; V24-R28 VanDerWaalsContact O-N 3.08Å
25	R	71.2	Confident	73.9	Confident	87 Å²	87	113 Å²	113	33%	0.328	57%	0.567	S	S	.	*	H	α-helix	trans	-64.2	-47.7	174.4	-147.9	-166.4	-46.1	-70.5	-3.8	110.8	L20 N21 D22 S23 R28 N29	L20-R25 VanDerWaalsContact O-CZ 3.32Å; L20-R25 PolarHBondContact O-NH2 3.46Å; N21-R25 PolarHBondContact O-N 3.39Å; N21-R25 VanDerWaalsContact O-N 3.09Å; D22-R25 WeakPolarHBondContact O-CB 3.35Å; D22-R25 PolarHBondContact O-N 2.74Å; D22-R25 IonicContact OD1-CZ 3.11Å; D22-R25 IonicContact OD1-NE 2.77Å; D22-R25 PolarHBondContact OD1-NE 2.96Å; D22-R25 IonicContact OD1-NH2 2.71Å; D22-R25 PolarHBondContact OD1-NH2 3.16Å; D22-R25 IonicContact OD2-NH2 3.54Å; S23-R25 VanDerWaalsContact C-N 3.31Å; S23-R25 PolarHBondContact O-N 2.93Å; R25-R28 PolarHBondContact O-N 3.37Å; R25-N29 WeakPolarHBondContact O-CB 3.23Å; R25-N29 PolarHBondContact O-N 3.49Å; R25-N29 PolarHBondContact O-OD1 2.94Å
26	I	73.2	Confident	75.7	Confident	85 Å²	85	110.8 Å²	110.8	44%	0.436	55%	0.552	S	S	.	*	H	α-helix	trans	-64.2	-44.3	178	-70	161.7	0	0	0	111.1	D22 S23 N29 R30	D22-I26 WeakPolarHBondContact O-CB 3.43Å; D22-I26 WeakPolarHBondContact O-CD1 3.45Å; D22-I26 WeakPolarHBondContact O-CG1 3.45Å; D22-I26 PolarHBondContact O-N 3.45Å; S23-I26 PolarHBondContact O-N 3.46Å; I26-N29 PolarHBondContact O-N 2.7Å; I26-R30 HydrophobicContact CG2-CG 4.49Å; I26-R30 WeakPolarHBondContact O-CG 3.35Å; I26-R30 PolarHBondContact O-N 3.4Å
27	M	72.7	Confident	77.2	Confident	119 Å²	119	109.9 Å²	109.9	59%	0.586	54%	0.543	S	S	*	.	H	α-helix	trans	-61.9	-44.3	176.9	-73.5	-168.7	-65.1	0	0	112.2	S23 V24 R30 G31	S23-M27 WeakPolarHBondContact O-CG 3.47Å; S23-M27 PolarHBondContact O-N 3.25Å; V24-M27 HydrophobicContact CG2-CE 4.35Å; M27-R30 PolarHBondContact O-N 2.95Å; M27-G31 PolarHBondContact O-N 3.46Å
28	R	75.6	Confident	78.8	Confident	144 Å²	144	107.5 Å²	107.5	54%	0.543	53%	0.534	S	S	.	.	H	α-helix	trans	-63.6	-41.4	175	-73.4	177.6	-180	166.1	2.9	111.7	V24 R25 R30 G31 L32	V24-R28 WeakPolarHBondContact O-CB 3.46Å; V24-R28 WeakPolarHBondContact O-CG 3.37Å; V24-R28 PolarHBondContact O-N 2.99Å; V24-R28 VanDerWaalsContact O-N 3.08Å; R25-R28 PolarHBondContact O-N 3.37Å; R28-R30 PolarHBondContact O-N 3.07Å; R28-G31 PolarHBondContact O-N 2.85Å; R28-L32 WeakPolarHBondContact O-CG 3.47Å; R28-L32 PolarHBondContact O-N 2.92Å
29	N	80.1	Confident	80.4	Confident	82 Å²	82	107.6 Å²	107.6	44%	0.439	53%	0.527	S	S	.	.	H	α-helix	trans	-63.4	-40.1	175.1	-70.1	1.4	0	0	0	112	R25 I26 L32 L33	R25-N29 WeakPolarHBondContact O-CB 3.23Å; R25-N29 PolarHBondContact O-N 3.49Å; R25-N29 PolarHBondContact O-OD1 2.94Å; I26-N29 PolarHBondContact O-N 2.7Å; N29-L32 PolarHBondContact O-N 3.5Å; N29-L33 WeakPolarHBondContact O-CB 3.36Å; N29-L33 VanDerWaalsContact O-CG 3.25Å; N29-L33 WeakPolarHBondContact O-CG 3.38Å; N29-L33 PolarHBondContact O-N 3.34Å
30	R	83.5	Confident	82	Confident	164 Å²	164	104.3 Å²	104.3	62%	0.619	52%	0.518	S	S	*	.	H	α-helix	trans	-61.4	-42.9	172.9	-74.3	176	177.9	176.6	-0.7	111.8	I26 M27 R28 L33 N34	I26-R30 HydrophobicContact CG2-CG 4.49Å; I26-R30 WeakPolarHBondContact O-CG 3.35Å; I26-R30 PolarHBondContact O-N 3.4Å; M27-R30 PolarHBondContact O-N 2.95Å; R28-R30 PolarHBondContact O-N 3.07Å; R30-L33 PolarHBondContact O-N 3.47Å; R30-N34 WeakPolarHBondContact O-CB 3.43Å; R30-N34 VanDerWaalsContact O-CG 3.26Å; R30-N34 PolarHBondContact O-N 2.92Å
31	G	86.4	Confident	83.5	Confident	35 Å²	35	106.2 Å²	106.2	36%	0.361	53%	0.525	S	S	.	.	H	α-helix	trans	-62.1	-42.4	174.2	0	0	0	0	0	113.4	M27 R28 N34 T35	M27-G31 PolarHBondContact O-N 3.46Å; R28-G31 PolarHBondContact O-N 2.85Å; G31-N34 PolarHBondContact O-N 2.85Å; G31-T35 PolarHBondContact O-N 3.34Å; G31-T35 PolarHBondContact O-OG1 2.96Å
32	L	87.8	Confident	84.8	Confident	107 Å²	107	107.4 Å²	107.4	56%	0.56	52%	0.524	S	S	*	.	H	α-helix	trans	-67	-38.8	175.5	-70.7	171.1	0	0	0	112.4	R28 N29 T35 S36	R28-L32 WeakPolarHBondContact O-CG 3.47Å; R28-L32 PolarHBondContact O-N 2.92Å; N29-L32 PolarHBondContact O-N 3.5Å; L32-T35 WeakPolarHBondContact CA-OG1 3.44Å; L32-T35 PolarHBondContact O-OG1 3.4Å; L32-T35 VanDerWaalsContact O-OG1 3.07Å; L32-S36 VanDerWaalsContact O-CB 3.24Å; L32-S36 WeakPolarHBondContact O-CB 3.34Å; L32-S36 PolarHBondContact O-N 2.92Å; L32-S36 PolarHBondContact O-OG 3.41Å
33	L	89.8	Confident	85.8	Confident	118 Å²	118	106 Å²	106	62%	0.618	52%	0.523	S	S	*	.	H	α-helix	trans	-68	-40.6	175	-72.9	168	0	0	0	112	N29 R30 S36 R37	N29-L33 WeakPolarHBondContact O-CB 3.36Å; N29-L33 VanDerWaalsContact O-CG 3.25Å; N29-L33 WeakPolarHBondContact O-CG 3.38Å; N29-L33 PolarHBondContact O-N 3.34Å; R30-L33 PolarHBondContact O-N 3.47Å; L33-S36 PolarHBondContact O-N 3.19Å; L33-R37 VanDerWaalsContact O-CB 3.29Å; L33-R37 WeakPolarHBondContact O-CB 3.3Å; L33-R37 PolarHBondContact O-N 2.75Å
34	N	91	Very high	86.9	Confident	108 Å²	108	107.2 Å²	107.2	58%	0.578	53%	0.527	S	S	*	.	H	α-helix	trans	-67.6	-41.3	177.4	-74.3	-6.1	0	0	0	112.1	R30 G31 R37 R38	R30-N34 WeakPolarHBondContact O-CB 3.43Å; R30-N34 VanDerWaalsContact O-CG 3.26Å; R30-N34 PolarHBondContact O-N 2.92Å; G31-N34 PolarHBondContact O-N 2.85Å; N34-R37 PolarHBondContact O-N 3.42Å; N34-R38 WeakPolarHBondContact O-CB 3.33Å; N34-R38 PolarHBondContact O-N 2.9Å
35	T	91.6	Very high	88.1	Confident	78 Å²	78	109.5 Å²	109.5	48%	0.479	54%	0.537	S	S	.	.	H	α-helix	trans	-67.3	-42.8	174.2	44.9	0	0	0	0	111.7	G31 L32 R37 R38 L39	G31-T35 PolarHBondContact O-N 3.34Å; G31-T35 PolarHBondContact O-OG1 2.96Å; L32-T35 WeakPolarHBondContact CA-OG1 3.44Å; L32-T35 PolarHBondContact O-OG1 3.4Å; L32-T35 VanDerWaalsContact O-OG1 3.07Å; T35-R37 PolarHBondContact O-N 2.9Å; T35-R38 PolarHBondContact O-N 3.13Å; T35-L39 WeakPolarHBondContact O-CG 3.42Å; T35-L39 PolarHBondContact O-N 2.82Å
36	S	92.4	Very high	89.3	Confident	59 Å²	59	111.1 Å²	111.1	41%	0.413	55%	0.549	S	S	.	.	H	α-helix	trans	-59.8	-44.9	173.5	-57.9	0	0	0	0	111.9	L32 L33 R38 L39 L40	L32-S36 VanDerWaalsContact O-CB 3.24Å; L32-S36 WeakPolarHBondContact O-CB 3.34Å; L32-S36 PolarHBondContact O-N 2.92Å; L32-S36 PolarHBondContact O-OG 3.41Å; L33-S36 PolarHBondContact O-N 3.19Å; S36-R38 PolarHBondContact O-N 3.3Å; S36-L39 PolarHBondContact O-N 2.91Å; S36-L40 WeakPolarHBondContact O-CB 3.36Å; S36-L40 WeakPolarHBondContact O-CG 3.33Å; S36-L40 PolarHBondContact O-N 2.88Å
37	R	94.2	Very high	90.3	Very high	184 Å²	184	110.8 Å²	110.8	69%	0.694	55%	0.554	S	S	*	*	H	α-helix	trans	-58.5	-44.4	174.3	-178.7	-178.2	-72.9	-159.7	-3	111.5	L33 N34 T35 L40 Q41	L33-R37 VanDerWaalsContact O-CB 3.29Å; L33-R37 WeakPolarHBondContact O-CB 3.3Å; L33-R37 PolarHBondContact O-N 2.75Å; N34-R37 PolarHBondContact O-N 3.42Å; T35-R37 PolarHBondContact O-N 2.9Å; R37-L40 PolarHBondContact O-N 2.81Å; R37-Q41 VanDerWaalsContact O-CB 3.32Å; R37-Q41 WeakPolarHBondContact O-CB 3.48Å; R37-Q41 PolarHBondContact O-N 3.36Å
38	R	94.3	Very high	91.3	Very high	175 Å²	175	112.3 Å²	112.3	66%	0.66	56%	0.557	S	S	*	*	H	α-helix	trans	-66.7	-35.8	178.7	-165.7	178	-172.9	-169.8	2.8	112.6	N34 T35 S36 K42	N34-R38 WeakPolarHBondContact O-CB 3.33Å; N34-R38 PolarHBondContact O-N 2.9Å; T35-R38 PolarHBondContact O-N 3.13Å; S36-R38 PolarHBondContact O-N 3.3Å; R38-K42 WeakPolarHBondContact O-CG 3.31Å; R38-K42 PolarHBondContact O-N 2.95Å
39	L	95	Very high	92.2	Very high	122 Å²	122	109.9 Å²	109.9	64%	0.639	56%	0.559	S	S	*	*	H	α-helix	trans	-69.8	-45.1	174.8	-70.8	172.1	0	0	0	111.8	T35 S36 Q41 K42 S43	T35-L39 WeakPolarHBondContact O-CG 3.42Å; T35-L39 PolarHBondContact O-N 2.82Å; S36-L39 PolarHBondContact O-N 2.91Å; L39-Q41 PolarHBondContact O-N 3.5Å; L39-K42 PolarHBondContact O-N 3.39Å; L39-S43 PolarHBondContact O-N 3.36Å
40	L	95.3	Very high	92.9	Very high	117 Å²	117	109.4 Å²	109.4	61%	0.613	56%	0.562	S	S	*	*	H	α-helix	trans	-60.4	-44.5	174	-71.3	169.9	0	0	0	111.4	S36 R37 K42 S43 V44	S36-L40 WeakPolarHBondContact O-CB 3.36Å; S36-L40 WeakPolarHBondContact O-CG 3.33Å; S36-L40 PolarHBondContact O-N 2.88Å; R37-L40 PolarHBondContact O-N 2.81Å; L40-K42 PolarHBondContact O-N 2.83Å; L40-S43 PolarHBondContact O-N 2.93Å; L40-V44 WeakPolarHBondContact O-CG2 3.48Å; L40-V44 PolarHBondContact O-N 3.35Å
41	Q	94.9	Very high	93.5	Very high	115 Å²	115	104 Å²	104	54%	0.537	55%	0.553	S	S	.	*	H	α-helix	trans	-61.9	-41.5	176.3	-170.7	179	15.1	0	0	112.1	R37 L39 V44 N45	R37-Q41 VanDerWaalsContact O-CB 3.32Å; R37-Q41 WeakPolarHBondContact O-CB 3.48Å; R37-Q41 PolarHBondContact O-N 3.36Å; L39-Q41 PolarHBondContact O-N 3.5Å; Q41-V44 PolarHBondContact O-N 3.49Å; Q41-N45 WeakPolarHBondContact O-CB 3.46Å; Q41-N45 PolarHBondContact O-N 2.87Å; Q41-N45 PolarHBondContact O-OD1 2.95Å
42	K	95.8	Very high	93.9	Very high	141 Å²	141	105.6 Å²	105.6	61%	0.613	56%	0.555	S	S	*	*	H	α-helix	trans	-59.9	-46.1	172	-82.2	-168.6	168.8	-156.4	0	112	R38 L39 L40 N45 Q46	R38-K42 WeakPolarHBondContact O-CG 3.31Å; R38-K42 PolarHBondContact O-N 2.95Å; L39-K42 PolarHBondContact O-N 3.39Å; L40-K42 PolarHBondContact O-N 2.83Å; K42-N45 PolarHBondContact O-N 3.11Å; K42-Q46 WeakPolarHBondContact O-CB 3.24Å; K42-Q46 PolarHBondContact O-N 3.21Å
43	S	94.9	Very high	94.3	Very high	70 Å²	70	103.6 Å²	103.6	49%	0.49	55%	0.55	S	S	.	*	H	α-helix	trans	-63.8	-41.5	179.7	-174.3	0	0	0	0	112.6	L39 L40 S47	L39-S43 PolarHBondContact O-N 3.36Å; L40-S43 PolarHBondContact O-N 2.93Å; S43-S47 WeakPolarHBondContact O-CB 3.5Å; S43-S47 PolarHBondContact O-N 2.75Å
44	V	95.2	Very high	94.5	Very high	96 Å²	96	102.9 Å²	102.9	58%	0.582	55%	0.547	S	S	*	.	H	α-helix	trans	-65.6	-45.7	176.2	169.7	0	0	0	0	110.7	L40 Q41 Q46 S47 F48	L40-V44 WeakPolarHBondContact O-CG2 3.48Å; L40-V44 PolarHBondContact O-N 3.35Å; Q41-V44 PolarHBondContact O-N 3.49Å; V44-Q46 PolarHBondContact O-N 2.93Å; V44-S47 PolarHBondContact O-N 2.91Å; V44-F48 PolarHBondContact O-N 3.48Å
45	N	95.7	Very high	94.8	Very high	93 Å²	93	107 Å²	107	50%	0.497	55%	0.554	S	S	.	*	H	α-helix	trans	-61.1	-45.2	176.7	-71.1	12.5	0	0	0	111.5	Q41 K42 S47 F48 T49	Q41-N45 WeakPolarHBondContact O-CB 3.46Å; Q41-N45 PolarHBondContact O-N 2.87Å; Q41-N45 PolarHBondContact O-OD1 2.95Å; K42-N45 PolarHBondContact O-N 3.11Å; N45-S47 VanDerWaalsContact C-N 3.34Å; N45-S47 PolarHBondContact O-N 3.19Å; N45-F48 WeakPolarHBondContact O-CB 3.39Å; N45-F48 PolarHBondContact O-N 2.81Å; N45-F48 VanDerWaalsContact O-N 3.16Å; N45-T49 PolarHBondContact O-N 3.17Å; N45-T49 PolarHBondContact O-OG1 3.01Å
46	Q	95.5	Very high	95	Very high	121 Å²	121	106.2 Å²	106.2	57%	0.565	56%	0.556	S	S	*	*	H	α-helix	trans	-61.2	-41.5	176.5	-173.5	177.2	19.5	0	0	112	K42 V44 F48 T49 S50	K42-Q46 WeakPolarHBondContact O-CB 3.24Å; K42-Q46 PolarHBondContact O-N 3.21Å; V44-Q46 PolarHBondContact O-N 2.93Å; Q46-F48 VanDerWaalsContact C-N 3.32Å; Q46-F48 PolarHBondContact O-N 2.89Å; Q46-T49 PolarHBondContact O-N 3.14Å; Q46-S50 WeakPolarHBondContact O-CB 3.29Å; Q46-S50 PolarHBondContact O-N 2.92Å; Q46-S50 PolarHBondContact O-OG 2.98Å
47	S	94.7	Very high	95.2	Very high	78 Å²	78	108.2 Å²	108.2	55%	0.545	56%	0.562	S	S	.	*	H	α-helix	trans	-63.7	-36.7	174.7	-170.4	0	0	0	0	112.2	S43 V44 N45 A51	S43-S47 WeakPolarHBondContact O-CB 3.5Å; S43-S47 PolarHBondContact O-N 2.75Å; V44-S47 PolarHBondContact O-N 2.91Å; N45-S47 VanDerWaalsContact C-N 3.34Å; N45-S47 PolarHBondContact O-N 3.19Å; S47-A51 VanDerWaalsContact O-CB 3.3Å; S47-A51 WeakPolarHBondContact O-CB 3.49Å; S47-A51 PolarHBondContact O-N 2.91Å
48	F	94.2	Very high	95.3	Very high	151 Å²	151	103.8 Å²	103.8	66%	0.662	55%	0.552	S	S	*	*	H	α-helix	trans	-69.2	-44.1	176.6	-176.9	-92.6	0	0	0	112.1	V44 N45 Q46 A51 T52	V44-F48 PolarHBondContact O-N 3.48Å; N45-F48 WeakPolarHBondContact O-CB 3.39Å; N45-F48 PolarHBondContact O-N 2.81Å; N45-F48 VanDerWaalsContact O-N 3.16Å; Q46-F48 VanDerWaalsContact C-N 3.32Å; Q46-F48 PolarHBondContact O-N 2.89Å; F48-A51 PolarHBondContact O-N 3.3Å; F48-T52 WeakPolarHBondContact O-CB 3.48Å; F48-T52 PolarHBondContact O-N 2.75Å; F48-T52 PolarHBondContact O-OG1 3.41Å
49	T	94.5	Very high	95.4	Very high	94 Å²	94	98.4 Å²	98.4	58%	0.577	55%	0.545	S	S	*	.	H	α-helix	trans	-59.6	-46.4	173	-58.2	0	0	0	0	111.1	N45 Q46 A51 T52 S53	N45-T49 PolarHBondContact O-N 3.17Å; N45-T49 PolarHBondContact O-OG1 3.01Å; Q46-T49 PolarHBondContact O-N 3.14Å; T49-A51 PolarHBondContact O-N 2.98Å; T49-T52 PolarHBondContact O-N 3.41Å; T49-S53 WeakPolarHBondContact O-CB 3.21Å; T49-S53 PolarHBondContact O-N 3.4Å
50	S	95.5	Very high	95.4	Very high	71 Å²	71	95.4 Å²	95.4	50%	0.497	53%	0.534	S	S	.	.	H	α-helix	trans	-63.2	-42.2	179	-54.8	0	0	0	0	112.3	Q46 T52 L54	Q46-S50 WeakPolarHBondContact O-CB 3.29Å; Q46-S50 PolarHBondContact O-N 2.92Å; Q46-S50 PolarHBondContact O-OG 2.98Å; S50-T52 VanDerWaalsContact C-N 3.32Å; S50-T52 PolarHBondContact O-N 2.88Å; S50-L54 WeakPolarHBondContact O-CB 3.17Å; S50-L54 PolarHBondContact O-N 3.08Å
51	A	94.9	Very high	95.5	Very high	52 Å²	52	94.1 Å²	94.1	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-66.5	-33.2	175.8	0	0	0	0	0	112.8	S47 F48 T49 R55	S47-A51 VanDerWaalsContact O-CB 3.3Å; S47-A51 WeakPolarHBondContact O-CB 3.49Å; S47-A51 PolarHBondContact O-N 2.91Å; F48-A51 PolarHBondContact O-N 3.3Å; T49-A51 PolarHBondContact O-N 2.98Å; A51-R55 WeakPolarHBondContact O-CB 3.35Å; A51-R55 PolarHBondContact O-N 3.37Å; A51-R55 VanDerWaalsContact O-N 3.08Å
52	T	95.5	Very high	95.6	Very high	67 Å²	67	91.4 Å²	91.4	41%	0.411	53%	0.525	S	S	.	.	H	α-helix	trans	-71.8	-46.1	176.6	-56	0	0	0	0	111	F48 T49 S50 L54 R55 A56	F48-T52 WeakPolarHBondContact O-CB 3.48Å; F48-T52 PolarHBondContact O-N 2.75Å; F48-T52 PolarHBondContact O-OG1 3.41Å; T49-T52 PolarHBondContact O-N 3.41Å; S50-T52 VanDerWaalsContact C-N 3.32Å; S50-T52 PolarHBondContact O-N 2.88Å; T52-L54 PolarHBondContact O-N 3.45Å; T52-R55 WeakPolarHBondContact O-CB 3.43Å; T52-R55 PolarHBondContact O-N 3.3Å; T52-A56 PolarHBondContact O-N 2.72Å
53	S	95.6	Very high	95.7	Very high	66 Å²	66	91.2 Å²	91.2	46%	0.462	52%	0.524	S	S	.	.	H	α-helix	trans	-59.5	-44.8	174	177.5	0	0	0	0	111.7	T49 R55 A56 N57	T49-S53 WeakPolarHBondContact O-CB 3.21Å; T49-S53 PolarHBondContact O-N 3.4Å; S53-R55 VanDerWaalsContact C-N 3.34Å; S53-R55 PolarHBondContact O-N 3.03Å; S53-A56 PolarHBondContact O-N 3.12Å; S53-N57 WeakPolarHBondContact O-CB 3.27Å; S53-N57 PolarHBondContact O-N 3.5Å
54	L	95.2	Very high	95.8	Very high	103 Å²	103	93.4 Å²	93.4	54%	0.539	53%	0.525	S	S	.	.	H	α-helix	trans	-61.5	-39.3	175.2	-178.5	60.9	0	0	0	112.4	S50 T52 N57 N58	S50-L54 WeakPolarHBondContact O-CB 3.17Å; S50-L54 PolarHBondContact O-N 3.08Å; T52-L54 PolarHBondContact O-N 3.45Å; L54-N57 PolarHBondContact O-N 2.97Å; L54-N58 WeakPolarHBondContact O-CB 3.41Å; L54-N58 VanDerWaalsContact O-CG 3.23Å; L54-N58 PolarHBondContact O-N 3.47Å; L54-N58 PolarHBondContact O-OD1 3.49Å
55	R	96	Very high	95.9	Very high	194 Å²	194	93.9 Å²	93.9	73%	0.732	52%	0.523	S	S	*	.	H	α-helix	trans	-64.3	-43	175.1	-173.9	-177.1	-66.1	169.2	-1.1	111.8	A51 T52 S53 A59	A51-R55 WeakPolarHBondContact O-CB 3.35Å; A51-R55 PolarHBondContact O-N 3.37Å; A51-R55 VanDerWaalsContact O-N 3.08Å; T52-R55 WeakPolarHBondContact O-CB 3.43Å; T52-R55 PolarHBondContact O-N 3.3Å; S53-R55 VanDerWaalsContact C-N 3.34Å; S53-R55 PolarHBondContact O-N 3.03Å; R55-A59 WeakPolarHBondContact O-CB 3.45Å; R55-A59 PolarHBondContact O-N 2.91Å
56	A	95.2	Very high	95.9	Very high	62 Å²	62	92.2 Å²	92.2	51%	0.512	52%	0.522	S	S	.	.	H	α-helix	trans	-65	-41.9	176.3	0	0	0	0	0	112	T52 S53 A59 S60	T52-A56 PolarHBondContact O-N 2.72Å; S53-A56 PolarHBondContact O-N 3.12Å; A56-A59 PolarHBondContact O-N 3.23Å; A56-S60 PolarHBondContact O-N 2.8Å
57	N	96.6	Very high	96	Very high	101 Å²	101	91 Å²	91	54%	0.54	52%	0.517	S	S	.	.	H	α-helix	trans	-61	-48.7	175.5	-167.2	-62.1	0	0	0	111.4	S53 L54 A59 S60 L61	S53-N57 WeakPolarHBondContact O-CB 3.27Å; S53-N57 PolarHBondContact O-N 3.5Å; L54-N57 PolarHBondContact O-N 2.97Å; N57-A59 VanDerWaalsContact C-N 3.3Å; N57-A59 PolarHBondContact O-N 3.15Å; N57-S60 WeakPolarHBondContact O-CB 3.45Å; N57-S60 PolarHBondContact O-N 3.45Å; N57-S60 VanDerWaalsContact O-N 3.13Å; N57-L61 WeakPolarHBondContact O-CB 3.23Å; N57-L61 PolarHBondContact O-N 3.41Å
58	N	96.8	Very high	96.2	Very high	90 Å²	90	93 Å²	93	48%	0.481	52%	0.52	S	S	.	.	H	α-helix	trans	-60.4	-37.5	176.6	-71.9	-4.5	0	0	0	112.5	L54 L61 A62	L54-N58 WeakPolarHBondContact O-CB 3.41Å; L54-N58 VanDerWaalsContact O-CG 3.23Å; L54-N58 PolarHBondContact O-N 3.47Å; L54-N58 PolarHBondContact O-OD1 3.49Å; N58-L61 PolarHBondContact O-N 2.93Å; N58-A62 WeakPolarHBondContact O-CB 3.46Å; N58-A62 PolarHBondContact O-N 3.49Å
59	A	96.4	Very high	96.3	Very high	63 Å²	63	90.4 Å²	90.4	52%	0.521	51%	0.51	S	S	.	.	H	α-helix	trans	-67.5	-41	174.4	0	0	0	0	0	112.3	R55 A56 N57 A62 K63	R55-A59 WeakPolarHBondContact O-CB 3.45Å; R55-A59 PolarHBondContact O-N 2.91Å; A56-A59 PolarHBondContact O-N 3.23Å; N57-A59 VanDerWaalsContact C-N 3.3Å; N57-A59 PolarHBondContact O-N 3.15Å; A59-A62 PolarHBondContact O-N 3Å; A59-K63 PolarHBondContact O-N 3.49Å
60	S	96.4	Very high	96.4	Very high	58 Å²	58	90 Å²	90	41%	0.406	51%	0.508	S	S	.	.	H	α-helix	trans	-63.2	-40.9	174	-169.1	0	0	0	0	111.9	A56 N57 K63 K64	A56-S60 PolarHBondContact O-N 2.8Å; N57-S60 WeakPolarHBondContact O-CB 3.45Å; N57-S60 PolarHBondContact O-N 3.45Å; N57-S60 VanDerWaalsContact O-N 3.13Å; S60-K63 PolarHBondContact O-N 3.35Å; S60-K64 WeakPolarHBondContact O-CG 3.23Å; S60-K64 PolarHBondContact O-N 3.16Å
61	L	97.4	Very high	96.5	Very high	91 Å²	91	92.1 Å²	92.1	48%	0.476	51%	0.51	S	S	.	.	H	α-helix	trans	-65.6	-44	175.2	-178.8	59.9	0	0	0	111.7	N57 N58 K63 K64 L65	N57-L61 WeakPolarHBondContact O-CB 3.23Å; N57-L61 PolarHBondContact O-N 3.41Å; N58-L61 PolarHBondContact O-N 2.93Å; L61-K63 VanDerWaalsContact C-N 3.33Å; L61-K63 PolarHBondContact O-N 3.47Å; L61-K64 PolarHBondContact O-N 3.45Å; L61-L65 HydrophobicContact CD1-CG 4.41Å; L61-L65 HydrophobicContact CG-CD1 4.21Å; L61-L65 WeakPolarHBondContact O-CG 3.29Å; L61-L65 PolarHBondContact O-N 2.96Å
62	A	96	Very high	96.6	Very high	58 Å²	58	93.2 Å²	93.2	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-60.8	-40.7	175.2	0	0	0	0	0	112.1	N58 A59 L65 A66	N58-A62 WeakPolarHBondContact O-CB 3.46Å; N58-A62 PolarHBondContact O-N 3.49Å; A59-A62 PolarHBondContact O-N 3Å; A62-L65 PolarHBondContact O-N 3.37Å; A62-A66 PolarHBondContact O-N 3.01Å
63	K	97.1	Very high	96.6	Very high	137 Å²	137	93.6 Å²	93.6	60%	0.596	51%	0.508	S	S	*	.	H	α-helix	trans	-60.1	-49	173.1	-169.5	-170.4	-178.3	-160	0	111.4	A59 S60 L61 L65 A66 E67	A59-K63 PolarHBondContact O-N 3.49Å; S60-K63 PolarHBondContact O-N 3.35Å; L61-K63 VanDerWaalsContact C-N 3.33Å; L61-K63 PolarHBondContact O-N 3.47Å; K63-L65 VanDerWaalsContact C-N 3.33Å; K63-L65 PolarHBondContact O-N 3.19Å; K63-A66 WeakPolarHBondContact O-CB 3.48Å; K63-A66 PolarHBondContact O-N 3.17Å; K63-A66 VanDerWaalsContact O-N 3.14Å; K63-E67 WeakPolarHBondContact CE-OE1 3.45Å; K63-E67 IonicContact NZ-OE1 2.69Å; K63-E67 WeakPolarHBondContact O-CG 3.32Å; K63-E67 PolarHBondContact O-N 3.41Å
64	K	97.8	Very high	96.7	Very high	116 Å²	116	94.2 Å²	94.2	50%	0.504	51%	0.506	S	S	.	.	H	α-helix	trans	-63	-35.5	177.9	-73.6	176.9	179.2	179.2	0	113.2	S60 L61 E67 L68	S60-K64 WeakPolarHBondContact O-CG 3.23Å; S60-K64 PolarHBondContact O-N 3.16Å; L61-K64 PolarHBondContact O-N 3.45Å; K64-E67 PolarHBondContact O-N 3.46Å; K64-L68 WeakPolarHBondContact O-CB 3.31Å; K64-L68 VanDerWaalsContact O-CG 3.25Å; K64-L68 WeakPolarHBondContact O-CG 3.24Å; K64-L68 PolarHBondContact O-N 3Å
65	L	97.6	Very high	96.8	Very high	105 Å²	105	95.2 Å²	95.2	55%	0.55	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-38.4	173.9	-72.7	170.6	0	0	0	111.7	L61 A62 K63 Q69	L61-L65 HydrophobicContact CD1-CG 4.41Å; L61-L65 HydrophobicContact CG-CD1 4.21Å; L61-L65 WeakPolarHBondContact O-CG 3.29Å; L61-L65 PolarHBondContact O-N 2.96Å; A62-L65 PolarHBondContact O-N 3.37Å; K63-L65 VanDerWaalsContact C-N 3.33Å; K63-L65 PolarHBondContact O-N 3.19Å; L65-Q69 VanDerWaalsContact O-CB 3.27Å; L65-Q69 WeakPolarHBondContact O-CB 3.48Å; L65-Q69 PolarHBondContact O-N 2.99Å
66	A	96.5	Very high	96.8	Very high	58 Å²	58	91.3 Å²	91.3	48%	0.479	50%	0.496	S	S	.	.	H	α-helix	trans	-66.5	-43.1	173	0	0	0	0	0	112.2	A62 K63 Q69 V70	A62-A66 PolarHBondContact O-N 3.01Å; K63-A66 WeakPolarHBondContact O-CB 3.48Å; K63-A66 PolarHBondContact O-N 3.17Å; K63-A66 VanDerWaalsContact O-N 3.14Å; A66-Q69 PolarHBondContact O-N 3.47Å; A66-V70 WeakPolarHBondContact O-CG2 3.29Å; A66-V70 PolarHBondContact O-N 2.8Å
67	E	96.5	Very high	96.9	Very high	97 Å²	97	94 Å²	94	45%	0.453	50%	0.501	S	S	.	.	H	α-helix	trans	-59	-47.8	174.8	-70.8	165	174.6	0	0	111.3	K63 K64 Q69 V70 E71	K63-E67 WeakPolarHBondContact CE-OE1 3.45Å; K63-E67 IonicContact NZ-OE1 2.69Å; K63-E67 WeakPolarHBondContact O-CG 3.32Å; K63-E67 PolarHBondContact O-N 3.41Å; K64-E67 PolarHBondContact O-N 3.46Å; E67-Q69 PolarHBondContact O-N 3.07Å; E67-V70 PolarHBondContact O-N 2.72Å; E67-E71 PolarHBondContact O-N 3.21Å
68	L	98	Very high	96.8	Very high	118 Å²	118	92 Å²	92	62%	0.618	50%	0.499	S	S	*	.	H	α-helix	trans	-65.3	-34.1	176.1	-71.8	169.3	0	0	0	113.2	K64 E71 L72	K64-L68 WeakPolarHBondContact O-CB 3.31Å; K64-L68 VanDerWaalsContact O-CG 3.25Å; K64-L68 WeakPolarHBondContact O-CG 3.24Å; K64-L68 PolarHBondContact O-N 3Å; L68-E71 PolarHBondContact O-N 2.62Å; L68-L72 WeakPolarHBondContact O-CB 3.08Å; L68-L72 PolarHBondContact O-N 2.98Å
69	Q	97.1	Very high	96.7	Very high	97 Å²	97	91.3 Å²	91.3	45%	0.453	50%	0.498	S	S	.	.	H	α-helix	trans	-69.7	-35.2	176.4	-178.7	57.9	85	0	0	112.1	L65 A66 E67 N73	L65-Q69 VanDerWaalsContact O-CB 3.27Å; L65-Q69 WeakPolarHBondContact O-CB 3.48Å; L65-Q69 PolarHBondContact O-N 2.99Å; A66-Q69 PolarHBondContact O-N 3.47Å; E67-Q69 PolarHBondContact O-N 3.07Å; Q69-N73 PolarHBondContact NE2-ND2 3.17Å; Q69-N73 PolarHBondContact NE2-OD1 2.94Å; Q69-N73 PolarHBondContact O-N 3.41Å; Q69-N73 PolarHBondContact O-ND2 3.42Å
70	V	97.2	Very high	96.6	Very high	86 Å²	86	94 Å²	94	52%	0.521	50%	0.499	S	S	.	.	H	α-helix	trans	-66	-47.2	170.7	170.4	0	0	0	0	110.1	A66 E67 L72 N73 N74	A66-V70 WeakPolarHBondContact O-CG2 3.29Å; A66-V70 PolarHBondContact O-N 2.8Å; E67-V70 PolarHBondContact O-N 2.72Å; V70-L72 PolarHBondContact O-N 2.97Å; V70-N73 WeakPolarHBondContact O-CB 3.4Å; V70-N73 PolarHBondContact O-N 3.14Å; V70-N74 VanDerWaalsContact O-CG 3.3Å; V70-N74 PolarHBondContact O-N 3.41Å
71	E	96.5	Very high	96.7	Very high	115 Å²	115	95.7 Å²	95.7	54%	0.537	50%	0.501	S	S	.	.	H	α-helix	trans	-65	-38.9	-178.2	-170.8	58.1	-167.7	0	0	113.1	E67 L68 N73 N74 Q75	E67-E71 PolarHBondContact O-N 3.21Å; L68-E71 PolarHBondContact O-N 2.62Å; E71-N73 PolarHBondContact O-N 3.49Å; E71-N74 WeakPolarHBondContact O-CB 3.45Å; E71-N74 PolarHBondContact O-N 3.42Å; E71-N74 PolarHBondContact OE2-ND2 3.24Å; E71-N74 VanDerWaalsContact OE2-ND2 3.09Å; E71-Q75 WeakPolarHBondContact O-CB 3.5Å; E71-Q75 PolarHBondContact O-N 2.98Å
72	L	96.6	Very high	96.6	Very high	75 Å²	75	93.8 Å²	93.8	39%	0.393	50%	0.498	S	S	.	.	H	α-helix	trans	-60.5	-34.7	172.1	178.9	60.9	0	0	0	112.4	L68 V70 K76	L68-L72 WeakPolarHBondContact O-CB 3.08Å; L68-L72 PolarHBondContact O-N 2.98Å; V70-L72 PolarHBondContact O-N 2.97Å; L72-K76 VanDerWaalsContact O-CG 3.3Å; L72-K76 WeakPolarHBondContact O-CG 3.27Å; L72-K76 PolarHBondContact O-N 3.37Å; L72-K76 VanDerWaalsContact O-N 3.15Å
73	N	97.2	Very high	96.6	Very high	76 Å²	76	95.6 Å²	95.6	41%	0.406	50%	0.5	S	S	.	.	H	α-helix	trans	-76.1	-38.2	177	-69.6	-15.8	0	0	0	111.6	Q69 V70 E71 Q75 K76 L77	Q69-N73 PolarHBondContact NE2-ND2 3.17Å; Q69-N73 PolarHBondContact NE2-OD1 2.94Å; Q69-N73 PolarHBondContact O-N 3.41Å; Q69-N73 PolarHBondContact O-ND2 3.42Å; V70-N73 WeakPolarHBondContact O-CB 3.4Å; V70-N73 PolarHBondContact O-N 3.14Å; E71-N73 PolarHBondContact O-N 3.49Å; N73-Q75 VanDerWaalsContact C-N 3.35Å; N73-Q75 PolarHBondContact O-N 3.13Å; N73-K76 PolarHBondContact O-N 3.46Å; N73-L77 PolarHBondContact O-N 3.26Å
74	N	97.1	Very high	96.6	Very high	79 Å²	79	93.3 Å²	93.3	42%	0.422	49%	0.493	S	S	.	.	H	α-helix	trans	-58.4	-46.2	171.1	-64.4	-21.9	0	0	0	111.1	V70 E71 K76 L77 A78	V70-N74 VanDerWaalsContact O-CG 3.3Å; V70-N74 PolarHBondContact O-N 3.41Å; E71-N74 WeakPolarHBondContact O-CB 3.45Å; E71-N74 PolarHBondContact O-N 3.42Å; E71-N74 PolarHBondContact OE2-ND2 3.24Å; E71-N74 VanDerWaalsContact OE2-ND2 3.09Å; N74-K76 PolarHBondContact O-N 3.25Å; N74-L77 PolarHBondContact O-N 3Å; N74-A78 WeakPolarHBondContact O-CB 3.29Å; N74-A78 PolarHBondContact O-N 2.65Å
75	Q	96.5	Very high	96.5	Very high	124 Å²	124	92.7 Å²	92.7	58%	0.579	49%	0.493	S	S	*	.	H	α-helix	trans	-63.8	-39.5	179.2	-168.2	-178.8	22.8	0	0	112.2	E71 N73 T79	E71-Q75 WeakPolarHBondContact O-CB 3.5Å; E71-Q75 PolarHBondContact O-N 2.98Å; N73-Q75 VanDerWaalsContact C-N 3.35Å; N73-Q75 PolarHBondContact O-N 3.13Å; Q75-T79 WeakPolarHBondContact O-CB 3.44Å; Q75-T79 PolarHBondContact O-N 3.48Å; Q75-T79 PolarHBondContact O-OG1 2.97Å
76	K	96.9	Very high	96.4	Very high	112 Å²	112	91.7 Å²	91.7	49%	0.487	49%	0.487	S	S	.	.	H	α-helix	trans	-61.6	-47.1	173	-75.5	170.6	-179	178.8	0	111.7	L72 N73 N74 T79 Q80	L72-K76 VanDerWaalsContact O-CG 3.3Å; L72-K76 WeakPolarHBondContact O-CG 3.27Å; L72-K76 PolarHBondContact O-N 3.37Å; L72-K76 VanDerWaalsContact O-N 3.15Å; N73-K76 PolarHBondContact O-N 3.46Å; N74-K76 PolarHBondContact O-N 3.25Å; K76-T79 PolarHBondContact O-N 2.75Å; K76-Q80 WeakPolarHBondContact O-CG 3.27Å; K76-Q80 PolarHBondContact O-N 2.99Å
77	L	96	Very high	96.4	Very high	117 Å²	117	92.6 Å²	92.6	61%	0.613	48%	0.484	S	S	*	.	H	α-helix	trans	-61.5	-45.3	178.2	-174.3	69.8	0	0	0	111.6	N73 N74 T79 Q80 Q81	N73-L77 PolarHBondContact O-N 3.26Å; N74-L77 PolarHBondContact O-N 3Å; L77-T79 VanDerWaalsContact C-N 3.3Å; L77-T79 PolarHBondContact O-N 2.97Å; L77-Q80 PolarHBondContact O-N 3.16Å; L77-Q81 WeakPolarHBondContact O-CB 3.32Å; L77-Q81 PolarHBondContact O-N 3.05Å
78	A	94.8	Very high	96.3	Very high	61 Å²	61	92 Å²	92	50%	0.504	48%	0.483	S	S	.	.	H	α-helix	trans	-62.1	-36.6	175.8	0	0	0	0	0	112.5	N74 A82	N74-A78 WeakPolarHBondContact O-CB 3.29Å; N74-A78 PolarHBondContact O-N 2.65Å; A78-A82 WeakPolarHBondContact O-CB 3.42Å; A78-A82 PolarHBondContact O-N 3.23Å
79	T	94.7	Very high	96.2	Very high	74 Å²	74	90 Å²	90	45%	0.454	48%	0.479	S	S	.	.	H	α-helix	trans	-68.5	-40.4	175.6	-54.1	0	0	0	0	111.6	Q75 K76 L77 A82 N83	Q75-T79 WeakPolarHBondContact O-CB 3.44Å; Q75-T79 PolarHBondContact O-N 3.48Å; Q75-T79 PolarHBondContact O-OG1 2.97Å; K76-T79 PolarHBondContact O-N 2.75Å; L77-T79 VanDerWaalsContact C-N 3.3Å; L77-T79 PolarHBondContact O-N 2.97Å; T79-A82 PolarHBondContact O-N 3.45Å; T79-N83 VanDerWaalsContact O-CG 3.29Å; T79-N83 PolarHBondContact O-N 3.47Å; T79-N83 PolarHBondContact O-ND2 3.16Å
80	Q	95.8	Very high	96.2	Very high	119 Å²	119	92.8 Å²	92.8	56%	0.556	49%	0.485	S	S	*	.	H	α-helix	trans	-63.4	-45.1	174.2	-73.2	174.1	-37.3	0	0	111.5	K76 L77 N83 I84	K76-Q80 WeakPolarHBondContact O-CG 3.27Å; K76-Q80 PolarHBondContact O-N 2.99Å; L77-Q80 PolarHBondContact O-N 3.16Å; Q80-N83 PolarHBondContact O-N 3.09Å; Q80-I84 WeakPolarHBondContact O-CG1 3.49Å; Q80-I84 PolarHBondContact O-N 3.16Å; Q80-I84 VanDerWaalsContact O-N 3.07Å
81	Q	96.7	Very high	96	Very high	94 Å²	94	92.7 Å²	92.7	44%	0.439	48%	0.48	S	S	.	.	H	α-helix	trans	-60.2	-46.5	175.9	-179.3	59.6	28.2	0	0	112	L77 N83 I84 E85	L77-Q81 WeakPolarHBondContact O-CB 3.32Å; L77-Q81 PolarHBondContact O-N 3.05Å; Q81-N83 VanDerWaalsContact C-N 3.27Å; Q81-N83 PolarHBondContact O-N 3.06Å; Q81-I84 PolarHBondContact O-N 3.01Å; Q81-I84 VanDerWaalsContact O-N 3.15Å; Q81-E85 WeakPolarHBondContact CG-OE1 3.42Å; Q81-E85 PolarHBondContact NE2-OE1 3.01Å; Q81-E85 PolarHBondContact O-N 3.48Å
82	A	95.7	Very high	95.9	Very high	51 Å²	51	91.1 Å²	91.1	42%	0.421	47%	0.473	S	S	.	.	H	α-helix	trans	-61.9	-33.2	176.9	0	0	0	0	0	113	A78 T79 L86	A78-A82 WeakPolarHBondContact O-CB 3.42Å; A78-A82 PolarHBondContact O-N 3.23Å; T79-A82 PolarHBondContact O-N 3.45Å; A82-L86 VanDerWaalsContact O-CB 3.31Å; A82-L86 WeakPolarHBondContact O-CB 3.27Å; A82-L86 PolarHBondContact O-N 2.76Å
83	N	97	Very high	95.9	Very high	97 Å²	97	92.2 Å²	92.2	52%	0.519	48%	0.482	S	S	.	.	H	α-helix	trans	-70.5	-36.6	174.6	-73.6	-20.7	0	0	0	112.6	T79 Q80 Q81 L86 L87	T79-N83 VanDerWaalsContact O-CG 3.29Å; T79-N83 PolarHBondContact O-N 3.47Å; T79-N83 PolarHBondContact O-ND2 3.16Å; Q80-N83 PolarHBondContact O-N 3.09Å; Q81-N83 VanDerWaalsContact C-N 3.27Å; Q81-N83 PolarHBondContact O-N 3.06Å; N83-L86 PolarHBondContact O-N 2.89Å; N83-L87 PolarHBondContact O-N 3.37Å
84	I	95.8	Very high	95.7	Very high	88 Å²	88	91.1 Å²	91.1	45%	0.451	48%	0.484	S	S	.	.	H	α-helix	trans	-65.3	-45.3	173.5	-66.3	164.2	0	0	0	110.1	Q80 Q81 L86 L87 N88	Q80-I84 WeakPolarHBondContact O-CG1 3.49Å; Q80-I84 PolarHBondContact O-N 3.16Å; Q80-I84 VanDerWaalsContact O-N 3.07Å; Q81-I84 PolarHBondContact O-N 3.01Å; Q81-I84 VanDerWaalsContact O-N 3.15Å; I84-L86 PolarHBondContact O-N 2.75Å; I84-L87 PolarHBondContact O-N 2.97Å; I84-N88 VanDerWaalsContact O-CG 3.32Å; I84-N88 PolarHBondContact O-N 3.17Å; I84-N88 PolarHBondContact O-ND2 2.95Å
85	E	95.5	Very high	95.7	Very high	104 Å²	104	92.7 Å²	92.7	49%	0.486	48%	0.484	S	S	.	.	H	α-helix	trans	-62.3	-41	175.7	-71.8	172.5	-159.9	0	0	112.1	Q81 L87 N88 C89	Q81-E85 WeakPolarHBondContact CG-OE1 3.42Å; Q81-E85 PolarHBondContact NE2-OE1 3.01Å; Q81-E85 PolarHBondContact O-N 3.48Å; E85-L87 PolarHBondContact O-N 3.41Å; E85-N88 PolarHBondContact O-N 2.91Å; E85-C89 WeakPolarHBondContact O-CB 3.39Å; E85-C89 PolarHBondContact O-N 3.1Å; E85-C89 PolarHBondContact O-SG 2.58Å; E85-C89 VanDerWaalsContact O-SG 3.37Å
86	L	96.2	Very high	95.7	Very high	84 Å²	84	91 Å²	91	44%	0.44	48%	0.478	S	S	.	.	H	α-helix	trans	-62.6	-39.6	174.1	178.7	61.4	0	0	0	112.5	A82 N83 I84 R90	A82-L86 VanDerWaalsContact O-CB 3.31Å; A82-L86 WeakPolarHBondContact O-CB 3.27Å; A82-L86 PolarHBondContact O-N 2.76Å; N83-L86 PolarHBondContact O-N 2.89Å; I84-L86 PolarHBondContact O-N 2.75Å; L86-R90 WeakPolarHBondContact O-CG 3.41Å; L86-R90 PolarHBondContact O-N 2.92Å
87	L	96.1	Very high	95.6	Very high	77 Å²	77	89.5 Å²	89.5	40%	0.403	47%	0.473	S	S	.	.	H	α-helix	trans	-65.3	-46	175.6	-177.9	60.9	0	0	0	111.1	N83 I84 E85 C89 R90 M91 V185	N83-L87 PolarHBondContact O-N 3.37Å; I84-L87 PolarHBondContact O-N 2.97Å; E85-L87 PolarHBondContact O-N 3.41Å; L87-C89 VanDerWaalsContact C-N 3.34Å; L87-C89 PolarHBondContact O-N 2.91Å; L87-R90 WeakPolarHBondContact O-CB 3.3Å; L87-R90 PolarHBondContact O-N 3.14Å; L87-R90 VanDerWaalsContact O-N 3.08Å; L87-M91 HydrophobicContact CG-CE 4.4Å; L87-M91 WeakPolarHBondContact O-CG 3.48Å; L87-M91 PolarHBondContact O-N 3.23Å; L87-V185 HydrophobicContact CD1-CG1 4.18Å
88	N	95.4	Very high	95.5	Very high	83 Å²	83	86.3 Å²	86.3	44%	0.444	46%	0.464	S	S	.	.	H	α-helix	trans	-58.5	-44.5	175.7	-69.4	-20.2	0	0	0	111.8	I84 E85 R90 M91 E92	I84-N88 VanDerWaalsContact O-CG 3.32Å; I84-N88 PolarHBondContact O-N 3.17Å; I84-N88 PolarHBondContact O-ND2 2.95Å; E85-N88 PolarHBondContact O-N 2.91Å; N88-R90 VanDerWaalsContact C-N 3.33Å; N88-R90 PolarHBondContact O-N 3.37Å; N88-M91 PolarHBondContact O-N 3.42Å; N88-M91 VanDerWaalsContact OD1-CE 3.26Å; N88-M91 WeakPolarHBondContact OD1-CE 3.4Å; N88-E92 WeakPolarHBondContact O-CB 3.47Å; N88-E92 PolarHBondContact O-N 2.79Å
89	C	94.8	Very high	95.5	Very high	78 Å²	78	90.6 Å²	90.6	53%	0.527	47%	0.468	S	S	.	.	H	α-helix	trans	-62	-36.6	174.1	-73.6	0	0	0	0	112.9	E85 L87 V93	E85-C89 WeakPolarHBondContact O-CB 3.39Å; E85-C89 PolarHBondContact O-N 3.1Å; E85-C89 PolarHBondContact O-SG 2.58Å; E85-C89 VanDerWaalsContact O-SG 3.37Å; L87-C89 VanDerWaalsContact C-N 3.34Å; L87-C89 PolarHBondContact O-N 2.91Å; C89-V93 WeakPolarHBondContact O-CB 3.42Å; C89-V93 VanDerWaalsContact O-CG2 3.27Å; C89-V93 WeakPolarHBondContact O-CG2 3.37Å; C89-V93 PolarHBondContact O-N 3.25Å
90	R	96.7	Very high	95.5	Very high	154 Å²	154	93 Å²	93	58%	0.581	47%	0.472	S	S	*	.	H	α-helix	trans	-67.6	-43.2	175.7	-75.5	171.6	176.2	-169.8	-1	112.1	L86 L87 N88 V93 A94	L86-R90 WeakPolarHBondContact O-CG 3.41Å; L86-R90 PolarHBondContact O-N 2.92Å; L87-R90 WeakPolarHBondContact O-CB 3.3Å; L87-R90 PolarHBondContact O-N 3.14Å; L87-R90 VanDerWaalsContact O-N 3.08Å; N88-R90 VanDerWaalsContact C-N 3.33Å; N88-R90 PolarHBondContact O-N 3.37Å; R90-V93 PolarHBondContact O-N 3.19Å; R90-A94 WeakPolarHBondContact O-CB 3.35Å; R90-A94 PolarHBondContact O-N 2.88Å
91	M	94	Very high	95.5	Very high	85 Å²	85	91.2 Å²	91.2	42%	0.419	46%	0.464	S	S	.	.	H	α-helix	trans	-62.5	-43.6	175.6	-66	-171.3	-63.5	0	0	111.4	L87 N88 A94 R95	L87-M91 HydrophobicContact CG-CE 4.4Å; L87-M91 WeakPolarHBondContact O-CG 3.48Å; L87-M91 PolarHBondContact O-N 3.23Å; N88-M91 PolarHBondContact O-N 3.42Å; N88-M91 VanDerWaalsContact OD1-CE 3.26Å; N88-M91 WeakPolarHBondContact OD1-CE 3.4Å; M91-A94 PolarHBondContact O-N 2.72Å; M91-R95 WeakPolarHBondContact O-CB 3.41Å; M91-R95 PolarHBondContact O-N 2.82Å
92	E	94.6	Very high	95.2	Very high	81 Å²	81	89.8 Å²	89.8	38%	0.379	46%	0.462	S	S	.	.	H	α-helix	trans	-65.2	-39.2	177	177	59	-172	0	0	112.5	N88 R95 L96	N88-E92 WeakPolarHBondContact O-CB 3.47Å; N88-E92 PolarHBondContact O-N 2.79Å; E92-R95 VanDerWaalsContact CD-NH2 3.34Å; E92-R95 PolarHBondContact O-N 2.9Å; E92-R95 IonicContact OE1-CZ 3.63Å; E92-R95 IonicContact OE1-NE 3.74Å; E92-R95 IonicContact OE1-NH2 2.7Å; E92-R95 PolarHBondContact OE1-NH2 2.86Å; E92-R95 IonicContact OE2-CZ 3.39Å; E92-R95 IonicContact OE2-NE 2.72Å; E92-R95 PolarHBondContact OE2-NE 3.07Å; E92-R95 IonicContact OE2-NH2 3.22Å; E92-R95 PolarHBondContact OE2-NH2 3.47Å; E92-L96 HydrophobicContact CG-CD1 4.08Å; E92-L96 WeakPolarHBondContact O-CB 3.24Å; E92-L96 VanDerWaalsContact O-CG 3.27Å; E92-L96 WeakPolarHBondContact O-CG 3.4Å; E92-L96 PolarHBondContact O-N 2.98Å
93	V	95.3	Very high	95.1	Very high	98 Å²	98	93.7 Å²	93.7	59%	0.594	47%	0.469	S	S	*	.	H	α-helix	trans	-64.9	-42.5	173.4	167.1	0	0	0	0	111.7	C89 R90 L96 Q97	C89-V93 WeakPolarHBondContact O-CB 3.42Å; C89-V93 VanDerWaalsContact O-CG2 3.27Å; C89-V93 WeakPolarHBondContact O-CG2 3.37Å; C89-V93 PolarHBondContact O-N 3.25Å; R90-V93 PolarHBondContact O-N 3.19Å; V93-L96 PolarHBondContact O-N 3.31Å; V93-Q97 WeakPolarHBondContact O-CB 3.38Å; V93-Q97 PolarHBondContact O-N 2.84Å
94	A	94.7	Very high	95	Very high	54 Å²	54	93 Å²	93	45%	0.446	46%	0.462	S	S	.	.	H	α-helix	trans	-62.4	-43	175.7	0	0	0	0	0	111.7	R90 M91 Q97 A98	R90-A94 WeakPolarHBondContact O-CB 3.35Å; R90-A94 PolarHBondContact O-N 2.88Å; M91-A94 PolarHBondContact O-N 2.72Å; A94-Q97 PolarHBondContact O-N 2.86Å; A94-A98 PolarHBondContact O-N 3.24Å; A94-A98 VanDerWaalsContact O-N 3.08Å
95	R	96.3	Very high	94.8	Very high	112 Å²	112	92.8 Å²	92.8	42%	0.423	46%	0.456	S	S	.	.	H	α-helix	trans	-58	-52	173.3	-170.2	-169.5	71.6	82.1	3.8	111.2	M91 E92 Q97 A98 Y99	M91-R95 WeakPolarHBondContact O-CB 3.41Å; M91-R95 PolarHBondContact O-N 2.82Å; E92-R95 VanDerWaalsContact CD-NH2 3.34Å; E92-R95 PolarHBondContact O-N 2.9Å; E92-R95 IonicContact OE1-CZ 3.63Å; E92-R95 IonicContact OE1-NE 3.74Å; E92-R95 IonicContact OE1-NH2 2.7Å; E92-R95 PolarHBondContact OE1-NH2 2.86Å; E92-R95 IonicContact OE2-CZ 3.39Å; E92-R95 IonicContact OE2-NE 2.72Å; E92-R95 PolarHBondContact OE2-NE 3.07Å; E92-R95 IonicContact OE2-NH2 3.22Å; E92-R95 PolarHBondContact OE2-NH2 3.47Å; R95-Q97 VanDerWaalsContact C-N 3.32Å; R95-Q97 PolarHBondContact O-N 2.96Å; R95-A98 PolarHBondContact O-N 3.38Å; R95-Y99 HydrophobicContact CG-CD2 4.05Å; R95-Y99 HydrophobicContact CG-CE2 3.78Å; R95-Y99 VanDerWaalsContact O-CD2 3.24Å; R95-Y99 WeakPolarHBondContact O-CD2 3.48Å; R95-Y99 PolarHBondContact O-N 3.38Å; R95-Y99 VanDerWaalsContact O-N 3.1Å
96	L	96	Very high	94.7	Very high	87 Å²	87	91.9 Å²	91.9	46%	0.455	45%	0.454	S	S	.	.	H	α-helix	trans	-63	-35.5	-179.9	-73	170.5	0	0	0	112.8	E92 V93 Y99 K100	E92-L96 HydrophobicContact CG-CD1 4.08Å; E92-L96 WeakPolarHBondContact O-CB 3.24Å; E92-L96 VanDerWaalsContact O-CG 3.27Å; E92-L96 WeakPolarHBondContact O-CG 3.4Å; E92-L96 PolarHBondContact O-N 2.98Å; V93-L96 PolarHBondContact O-N 3.31Å; L96-Y99 PolarHBondContact O-N 3.45Å; L96-K100 WeakPolarHBondContact O-CB 3.42Å; L96-K100 PolarHBondContact O-N 3.4Å
97	Q	96.3	Very high	94.7	Very high	82 Å²	82	92.3 Å²	92.3	38%	0.383	45%	0.452	S	S	.	.	H	α-helix	trans	-63.8	-43.2	173.8	175.8	61.1	21.6	0	0	111.5	V93 A94 R95 Y99 K100 E101	V93-Q97 WeakPolarHBondContact O-CB 3.38Å; V93-Q97 PolarHBondContact O-N 2.84Å; A94-Q97 PolarHBondContact O-N 2.86Å; R95-Q97 VanDerWaalsContact C-N 3.32Å; R95-Q97 PolarHBondContact O-N 2.96Å; Q97-Y99 PolarHBondContact O-N 3.21Å; Q97-K100 WeakPolarHBondContact O-CB 3.26Å; Q97-K100 PolarHBondContact O-N 3.49Å; Q97-E101 PolarHBondContact NE2-OE1 3.4Å; Q97-E101 PolarHBondContact O-N 2.9Å
98	A	92.2	Very high	94.5	Very high	50 Å²	50	90.5 Å²	90.5	41%	0.413	45%	0.448	S	S	.	.	H	α-helix	trans	-62.5	-39.6	175	0	0	0	0	0	112.5	A94 R95 T102	A94-A98 PolarHBondContact O-N 3.24Å; A94-A98 VanDerWaalsContact O-N 3.08Å; R95-A98 PolarHBondContact O-N 3.38Å; A98-T102 WeakPolarHBondContact O-CB 3.4Å; A98-T102 PolarHBondContact O-N 3.08Å; A98-T102 PolarHBondContact O-OG1 3.1Å
99	Y	94.6	Very high	94.4	Very high	150 Å²	150	88.2 Å²	88.2	59%	0.588	44%	0.438	S	S	*	.	H	α-helix	trans	-65.6	-37.9	172.6	-80.7	-74	0	0	0	112.7	R95 L96 Q97 K103	R95-Y99 HydrophobicContact CG-CD2 4.05Å; R95-Y99 HydrophobicContact CG-CE2 3.78Å; R95-Y99 VanDerWaalsContact O-CD2 3.24Å; R95-Y99 WeakPolarHBondContact O-CD2 3.48Å; R95-Y99 PolarHBondContact O-N 3.38Å; R95-Y99 VanDerWaalsContact O-N 3.1Å; L96-Y99 PolarHBondContact O-N 3.45Å; Q97-Y99 PolarHBondContact O-N 3.21Å; Y99-K103 WeakPolarHBondContact O-CB 3.4Å; Y99-K103 PolarHBondContact O-N 2.61Å
100	K	96.1	Very high	94.3	Very high	125 Å²	125	89.8 Å²	89.8	54%	0.543	44%	0.44	S	S	.	.	H	α-helix	trans	-61.8	-51.4	174.1	-179.4	-172	172.7	-170.5	0	110.8	L96 Q97 T102 K103 E104	L96-K100 WeakPolarHBondContact O-CB 3.42Å; L96-K100 PolarHBondContact O-N 3.4Å; Q97-K100 WeakPolarHBondContact O-CB 3.26Å; Q97-K100 PolarHBondContact O-N 3.49Å; K100-T102 VanDerWaalsContact C-N 3.33Å; K100-T102 PolarHBondContact O-N 2.78Å; K100-K103 WeakPolarHBondContact O-CB 3.45Å; K100-K103 PolarHBondContact O-N 3.35Å; K100-K103 VanDerWaalsContact O-N 3.14Å; K100-E104 WeakPolarHBondContact O-CG 3.2Å; K100-E104 PolarHBondContact O-N 3.04Å
101	E	94.4	Very high	94.2	Very high	82 Å²	82	88 Å²	88	38%	0.383	44%	0.441	S	S	.	.	H	α-helix	trans	-59.4	-43.2	177.7	-73.2	176.6	-149.7	0	0	112.2	Q97 K103 E104 R105	Q97-E101 PolarHBondContact NE2-OE1 3.4Å; Q97-E101 PolarHBondContact O-N 2.9Å; E101-K103 VanDerWaalsContact C-N 3.31Å; E101-K103 PolarHBondContact O-N 3.36Å; E101-E104 PolarHBondContact O-N 2.9Å; E101-R105 WeakPolarHBondContact O-CG 3.49Å; E101-R105 PolarHBondContact O-N 3.09Å; E101-R105 IonicContact OE2-NH2 3.75Å
102	T	91.5	Very high	94.2	Very high	64 Å²	64	87.1 Å²	87.1	39%	0.393	44%	0.438	S	S	.	.	H	α-helix	trans	-60.5	-41.2	175.8	-55.2	0	0	0	0	111.3	A98 K100 R105 I106	A98-T102 WeakPolarHBondContact O-CB 3.4Å; A98-T102 PolarHBondContact O-N 3.08Å; A98-T102 PolarHBondContact O-OG1 3.1Å; K100-T102 VanDerWaalsContact C-N 3.33Å; K100-T102 PolarHBondContact O-N 2.78Å; T102-R105 PolarHBondContact O-N 3.5Å; T102-I106 HydrophobicContact CG2-CD1 4.07Å; T102-I106 VanDerWaalsContact O-CG1 3.3Å; T102-I106 WeakPolarHBondContact O-CG1 3.42Å; T102-I106 PolarHBondContact O-N 3.07Å
103	K	94.4	Very high	94.2	Very high	132 Å²	132	86.1 Å²	86.1	57%	0.574	44%	0.438	S	S	*	.	H	α-helix	trans	-63.1	-42.2	175.7	-176.2	-178.7	-179.9	-179.3	0	112.2	Y99 K100 E101 I106 K107	Y99-K103 WeakPolarHBondContact O-CB 3.4Å; Y99-K103 PolarHBondContact O-N 2.61Å; K100-K103 WeakPolarHBondContact O-CB 3.45Å; K100-K103 PolarHBondContact O-N 3.35Å; K100-K103 VanDerWaalsContact O-N 3.14Å; E101-K103 VanDerWaalsContact C-N 3.31Å; E101-K103 PolarHBondContact O-N 3.36Å; K103-I106 PolarHBondContact O-N 3.03Å; K103-K107 PolarHBondContact O-N 3.33Å
104	E	93.7	Very high	94.2	Very high	82 Å²	82	87.4 Å²	87.4	38%	0.383	44%	0.437	S	S	.	.	H	α-helix	trans	-69.6	-37.2	177.9	-58.4	-50	128.5	0	0	112	K100 E101 I106 K107 A108	K100-E104 WeakPolarHBondContact O-CG 3.2Å; K100-E104 PolarHBondContact O-N 3.04Å; E101-E104 PolarHBondContact O-N 2.9Å; E104-I106 PolarHBondContact O-N 3.12Å; E104-K107 WeakPolarHBondContact O-CB 3.25Å; E104-K107 PolarHBondContact O-N 2.98Å; E104-K107 VanDerWaalsContact OE1-CE 3.29Å; E104-K107 WeakPolarHBondContact OE1-CE 3.27Å; E104-K107 IonicContact OE1-NZ 2.75Å; E104-K107 PolarHBondContact OE1-NZ 3.02Å; E104-K107 WeakPolarHBondContact OE2-CD 3.42Å; E104-K107 WeakPolarHBondContact OE2-CE 3.44Å; E104-K107 IonicContact OE2-NZ 2.65Å; E104-K107 PolarHBondContact OE2-NZ 3.11Å; E104-A108 PolarHBondContact O-N 2.87Å
105	R	90.9	Very high	94.1	Very high	84 Å²	84	91 Å²	91	32%	0.317	45%	0.445	S	S	.	.	H	α-helix	trans	-60.1	-43	170.1	-67.2	-179.6	-151.7	-164.9	9.1	112	E101 T102 K107 A108 C109 E172	E101-R105 WeakPolarHBondContact O-CG 3.49Å; E101-R105 PolarHBondContact O-N 3.09Å; E101-R105 IonicContact OE2-NH2 3.75Å; T102-R105 PolarHBondContact O-N 3.5Å; R105-K107 VanDerWaalsContact C-N 3.35Å; R105-K107 PolarHBondContact O-N 3.15Å; R105-A108 PolarHBondContact O-N 3.02Å; R105-C109 PolarHBondContact O-N 3.15Å; R105-E172 PolarHBondContact NH1-O 3.3Å
106	I	94.4	Very high	93.9	Very high	85 Å²	85	87.7 Å²	87.7	44%	0.436	44%	0.435	S	S	.	.	H	α-helix	trans	-62.1	-41	176.2	-70.9	165.6	0	0	0	111.1	T102 K103 E104 C109 I110	T102-I106 HydrophobicContact CG2-CD1 4.07Å; T102-I106 VanDerWaalsContact O-CG1 3.3Å; T102-I106 WeakPolarHBondContact O-CG1 3.42Å; T102-I106 PolarHBondContact O-N 3.07Å; K103-I106 PolarHBondContact O-N 3.03Å; E104-I106 PolarHBondContact O-N 3.12Å; I106-C109 PolarHBondContact O-N 2.9Å; I106-I110 HydrophobicContact CG2-CD1 3.83Å; I106-I110 VanDerWaalsContact O-CG1 3.27Å; I106-I110 WeakPolarHBondContact O-CG1 3.45Å; I106-I110 PolarHBondContact O-N 2.96Å
107	K	95.8	Very high	93.8	Very high	94 Å²	94	87.8 Å²	87.8	41%	0.409	44%	0.436	S	S	.	.	H	α-helix	trans	-60.9	-46.2	173.4	-67.5	-177.4	-160.4	163.7	0	112.1	K103 E104 R105 C109 I110 L111	K103-K107 PolarHBondContact O-N 3.33Å; E104-K107 WeakPolarHBondContact O-CB 3.25Å; E104-K107 PolarHBondContact O-N 2.98Å; E104-K107 VanDerWaalsContact OE1-CE 3.29Å; E104-K107 WeakPolarHBondContact OE1-CE 3.27Å; E104-K107 IonicContact OE1-NZ 2.75Å; E104-K107 PolarHBondContact OE1-NZ 3.02Å; E104-K107 WeakPolarHBondContact OE2-CD 3.42Å; E104-K107 WeakPolarHBondContact OE2-CE 3.44Å; E104-K107 IonicContact OE2-NZ 2.65Å; E104-K107 PolarHBondContact OE2-NZ 3.11Å; R105-K107 VanDerWaalsContact C-N 3.35Å; R105-K107 PolarHBondContact O-N 3.15Å; K107-C109 VanDerWaalsContact C-N 3.35Å; K107-C109 PolarHBondContact O-N 3.45Å; K107-I110 PolarHBondContact O-N 3.26Å; K107-L111 WeakPolarHBondContact O-CG 3.32Å; K107-L111 PolarHBondContact O-N 3.16Å
108	A	93.2	Very high	93.7	Very high	38 Å²	38	86.1 Å²	86.1	31%	0.314	43%	0.433	S	S	.	.	H	α-helix	trans	-60	-46	178.8	0	0	0	0	0	111.1	E104 R105 I110 L111 N112	E104-A108 PolarHBondContact O-N 2.87Å; R105-A108 PolarHBondContact O-N 3.02Å; A108-I110 VanDerWaalsContact C-N 3.33Å; A108-I110 PolarHBondContact O-N 3.27Å; A108-L111 PolarHBondContact O-N 3.38Å; A108-L111 VanDerWaalsContact O-N 3.16Å; A108-N112 PolarHBondContact O-N 3.05Å; A108-N112 PolarHBondContact O-OD1 3.29Å
109	C	92.2	Very high	93.7	Very high	35 Å²	35	86.6 Å²	86.6	24%	0.236	43%	0.433	C	S	.	.	H	α-helix	trans	-58.7	-40.9	174.2	-173.6	0	0	0	0	112.7	R105 I106 K107 N112 V113	R105-C109 PolarHBondContact O-N 3.15Å; I106-C109 PolarHBondContact O-N 2.9Å; K107-C109 VanDerWaalsContact C-N 3.35Å; K107-C109 PolarHBondContact O-N 3.45Å; C109-N112 PolarHBondContact O-N 3.27Å; C109-V113 WeakPolarHBondContact O-CB 3.45Å; C109-V113 VanDerWaalsContact O-CG2 3.29Å; C109-V113 WeakPolarHBondContact O-CG2 3.2Å; C109-V113 PolarHBondContact O-N 2.88Å
110	I	93.9	Very high	93.5	Very high	111 Å²	111	84 Å²	84	57%	0.569	43%	0.426	S	S	*	.	H	α-helix	trans	-64.5	-40	176.3	-70.9	165.2	0	0	0	111.3	I106 K107 A108 V113 H114	I106-I110 HydrophobicContact CG2-CD1 3.83Å; I106-I110 VanDerWaalsContact O-CG1 3.27Å; I106-I110 WeakPolarHBondContact O-CG1 3.45Å; I106-I110 PolarHBondContact O-N 2.96Å; K107-I110 PolarHBondContact O-N 3.26Å; A108-I110 VanDerWaalsContact C-N 3.33Å; A108-I110 PolarHBondContact O-N 3.27Å; I110-V113 PolarHBondContact O-N 3Å; I110-H114 WeakPolarHBondContact O-CB 3.2Å; I110-H114 PolarHBondContact O-N 3.2Å
111	L	94.6	Very high	93.4	Very high	117 Å²	117	83.1 Å²	83.1	61%	0.613	43%	0.426	S	S	*	.	H	α-helix	trans	-65.8	-46.4	176	-69.6	171	0	0	0	111.5	K107 A108 V113 H114 E115	K107-L111 WeakPolarHBondContact O-CG 3.32Å; K107-L111 PolarHBondContact O-N 3.16Å; A108-L111 PolarHBondContact O-N 3.38Å; A108-L111 VanDerWaalsContact O-N 3.16Å; L111-V113 VanDerWaalsContact C-N 3.3Å; L111-V113 PolarHBondContact O-N 3.32Å; L111-H114 WeakPolarHBondContact O-CB 3.46Å; L111-H114 PolarHBondContact O-N 3.09Å; L111-H114 VanDerWaalsContact O-N 3.08Å; L111-E115 PolarHBondContact O-N 2.94Å
112	N	93.5	Very high	93.2	Very high	66 Å²	66	84.8 Å²	84.8	35%	0.353	43%	0.434	S	S	.	.	H	α-helix	trans	-60.7	-38.5	177.3	-62	-0.3	0	0	0	111.8	A108 C109 L116	A108-N112 PolarHBondContact O-N 3.05Å; A108-N112 PolarHBondContact O-OD1 3.29Å; C109-N112 PolarHBondContact O-N 3.27Å; N112-L116 WeakPolarHBondContact O-CB 3.27Å; N112-L116 PolarHBondContact O-N 2.9Å
113	V	94.2	Very high	93.2	Very high	61 Å²	61	87.1 Å²	87.1	37%	0.37	44%	0.442	S	S	.	.	H	α-helix	trans	-68	-38.3	174.5	169	0	0	0	0	111.5	C109 I110 L111 L117	C109-V113 WeakPolarHBondContact O-CB 3.45Å; C109-V113 VanDerWaalsContact O-CG2 3.29Å; C109-V113 WeakPolarHBondContact O-CG2 3.2Å; C109-V113 PolarHBondContact O-N 2.88Å; I110-V113 PolarHBondContact O-N 3Å; L111-V113 VanDerWaalsContact C-N 3.3Å; L111-V113 PolarHBondContact O-N 3.32Å; V113-L117 HydrophobicContact CG1-CD1 4.04Å; V113-L117 WeakPolarHBondContact O-CB 3.48Å; V113-L117 VanDerWaalsContact O-CG 3.27Å; V113-L117 WeakPolarHBondContact O-CG 3.47Å; V113-L117 PolarHBondContact O-N 3.31Å
114	H	94.4	Very high	93	Very high	125 Å²	125	82.5 Å²	82.5	58%	0.579	43%	0.431	S	S	*	.	H	α-helix	trans	-65.2	-43.3	175	-174	-64.9	0	0	0	111.8	I110 L111 L117 C118	I110-H114 WeakPolarHBondContact O-CB 3.2Å; I110-H114 PolarHBondContact O-N 3.2Å; L111-H114 WeakPolarHBondContact O-CB 3.46Å; L111-H114 PolarHBondContact O-N 3.09Å; L111-H114 VanDerWaalsContact O-N 3.08Å; H114-L117 PolarHBondContact O-N 3.01Å; H114-C118 VanDerWaalsContact CE1-SG 3.5Å; H114-C118 PolarHBondContact O-N 2.97Å; H114-C118 PolarHBondContact O-SG 2.85Å; H114-C118 VanDerWaalsContact O-SG 3.41Å
115	E	93.4	Very high	92.9	Very high	129 Å²	129	83.4 Å²	83.4	60%	0.603	44%	0.437	S	S	*	.	H	α-helix	trans	-62.5	-43	176.2	-175.9	173.2	-162.8	0	0	112	L111 L117 C118 S119	L111-E115 PolarHBondContact O-N 2.94Å; E115-L117 PolarHBondContact O-N 3.34Å; E115-C118 PolarHBondContact O-N 2.95Å; E115-S119 WeakPolarHBondContact O-CB 3.38Å; E115-S119 PolarHBondContact O-N 3.39Å; E115-S119 PolarHBondContact O-OG 3.2Å
116	L	92.5	Very high	92.8	Very high	42 Å²	42	82.2 Å²	82.2	22%	0.22	44%	0.441	C	S	.	.	H	α-helix	trans	-62.8	-40.9	174	-179.3	60.5	0	0	0	112.1	N112 S119 Q120 V160 L165	N112-L116 WeakPolarHBondContact O-CB 3.27Å; N112-L116 PolarHBondContact O-N 2.9Å; L116-S119 PolarHBondContact O-N 3.42Å; L116-Q120 HydrophobicContact CD1-CG 4.43Å; L116-Q120 WeakPolarHBondContact O-CB 3.26Å; L116-Q120 VanDerWaalsContact O-CG 3.31Å; L116-Q120 WeakPolarHBondContact O-CG 3.31Å; L116-Q120 PolarHBondContact O-N 3.24Å; L116-V160 HydrophobicContact CD1-CG1 4.33Å; L116-L165 HydrophobicContact CD2-CD1 3.96Å; L116-L165 HydrophobicContact CD2-CD2 3.84Å; L116-L165 HydrophobicContact CD2-CG 4.37Å
117	L	94.7	Very high	92.5	Very high	90 Å²	90	83.8 Å²	83.8	47%	0.471	45%	0.448	S	S	.	.	H	α-helix	trans	-66.4	-41.4	176.2	-74.6	169.4	0	0	0	112	V113 H114 E115 Q120 I121	V113-L117 HydrophobicContact CG1-CD1 4.04Å; V113-L117 WeakPolarHBondContact O-CB 3.48Å; V113-L117 VanDerWaalsContact O-CG 3.27Å; V113-L117 WeakPolarHBondContact O-CG 3.47Å; V113-L117 PolarHBondContact O-N 3.31Å; H114-L117 PolarHBondContact O-N 3.01Å; E115-L117 PolarHBondContact O-N 3.34Å; L117-Q120 PolarHBondContact O-N 3.37Å; L117-I121 WeakPolarHBondContact O-CB 3.42Å; L117-I121 WeakPolarHBondContact O-CD1 3.49Å; L117-I121 VanDerWaalsContact O-CG1 3.24Å; L117-I121 WeakPolarHBondContact O-CG1 3.41Å; L117-I121 PolarHBondContact O-N 3.43Å
118	C	92.9	Very high	92.1	Very high	47 Å²	47	85.4 Å²	85.4	32%	0.318	46%	0.459	S	S	.	.	H	α-helix	trans	-57.6	-49.6	171.5	-73.6	0	0	0	0	111.2	H114 E115 Q120 I121 E122	H114-C118 VanDerWaalsContact CE1-SG 3.5Å; H114-C118 PolarHBondContact O-N 2.97Å; H114-C118 PolarHBondContact O-SG 2.85Å; H114-C118 VanDerWaalsContact O-SG 3.41Å; E115-C118 PolarHBondContact O-N 2.95Å; C118-Q120 VanDerWaalsContact C-N 3.32Å; C118-Q120 PolarHBondContact O-N 3.26Å; C118-I121 PolarHBondContact O-N 2.96Å; C118-I121 VanDerWaalsContact O-N 3.11Å; C118-E122 WeakPolarHBondContact O-CG 3.33Å; C118-E122 PolarHBondContact O-N 2.7Å
119	S	92.5	Very high	91.9	Very high	60 Å²	60	86.9 Å²	86.9	42%	0.42	46%	0.464	S	S	.	.	H	α-helix	trans	-59.3	-40.6	178.7	-54.7	0	0	0	0	112.5	E115 L116 E122 M123	E115-S119 WeakPolarHBondContact O-CB 3.38Å; E115-S119 PolarHBondContact O-N 3.39Å; E115-S119 PolarHBondContact O-OG 3.2Å; L116-S119 PolarHBondContact O-N 3.42Å; S119-E122 PolarHBondContact O-N 3.22Å; S119-M123 WeakPolarHBondContact O-CB 3.48Å; S119-M123 PolarHBondContact O-N 2.72Å
120	Q	90.8	Very high	91.5	Very high	95 Å²	95	88.8 Å²	88.8	44%	0.444	47%	0.467	S	S	.	.	H	α-helix	trans	-68	-37.1	175.7	-74.2	177.4	8.6	0	0	112.7	L116 L117 C118 G124	L116-Q120 HydrophobicContact CD1-CG 4.43Å; L116-Q120 WeakPolarHBondContact O-CB 3.26Å; L116-Q120 VanDerWaalsContact O-CG 3.31Å; L116-Q120 WeakPolarHBondContact O-CG 3.31Å; L116-Q120 PolarHBondContact O-N 3.24Å; L117-Q120 PolarHBondContact O-N 3.37Å; C118-Q120 VanDerWaalsContact C-N 3.32Å; C118-Q120 PolarHBondContact O-N 3.26Å; Q120-G124 PolarHBondContact O-N 2.95Å
121	I	92.8	Very high	91.3	Very high	107 Å²	107	87 Å²	87	55%	0.549	46%	0.461	S	S	.	.	H	α-helix	trans	-67	-44.5	174.8	-69.9	163.7	0	0	0	110.4	L117 C118 G124 M125	L117-I121 WeakPolarHBondContact O-CB 3.42Å; L117-I121 WeakPolarHBondContact O-CD1 3.49Å; L117-I121 VanDerWaalsContact O-CG1 3.24Å; L117-I121 WeakPolarHBondContact O-CG1 3.41Å; L117-I121 PolarHBondContact O-N 3.43Å; C118-I121 PolarHBondContact O-N 2.96Å; C118-I121 VanDerWaalsContact O-N 3.11Å; I121-G124 CarbonylContact O-C 3.59Å; I121-G124 PolarHBondContact O-N 2.94Å; I121-M125 HydrophobicContact CG2-CG 4.49Å; I121-M125 WeakPolarHBondContact O-CG 3.23Å; I121-M125 PolarHBondContact O-N 3.49Å
122	E	91.6	Very high	91	Very high	116 Å²	116	88 Å²	88	54%	0.542	46%	0.46	S	S	.	.	H	α-helix	trans	-63.9	-42.5	177.8	-72.6	172.4	-173.9	0	0	112.1	C118 S119 G124 M125 S126	C118-E122 WeakPolarHBondContact O-CG 3.33Å; C118-E122 PolarHBondContact O-N 2.7Å; S119-E122 PolarHBondContact O-N 3.22Å; E122-G124 VanDerWaalsContact C-N 3.35Å; E122-M125 PolarHBondContact O-N 3.08Å; E122-S126 WeakPolarHBondContact O-CB 3.45Å; E122-S126 PolarHBondContact O-N 2.58Å; E122-S126 PolarHBondContact O-OG 3.07Å
123	M	90.2	Very high	90.5	Very high	114 Å²	114	89 Å²	89	56%	0.562	47%	0.465	S	S	*	.	H	α-helix	trans	-60.9	-43	170.9	-176.7	178.4	67	0	0	111.6	S119 S126 M127	S119-M123 WeakPolarHBondContact O-CB 3.48Å; S119-M123 PolarHBondContact O-N 2.72Å; M123-S126 PolarHBondContact O-N 3.2Å; M123-M127 PolarHBondContact O-N 3.23Å
124	G	91.8	Very high	89.8	Confident	34 Å²	34	87 Å²	87	35%	0.351	46%	0.455	S	S	.	.	H	α-helix	trans	-62.7	-43.7	176.2	0	0	0	0	0	113.2	Q120 I121 E122 M127 M128	Q120-G124 PolarHBondContact O-N 2.95Å; I121-G124 CarbonylContact O-C 3.59Å; I121-G124 PolarHBondContact O-N 2.94Å; E122-G124 VanDerWaalsContact C-N 3.35Å; G124-M127 PolarHBondContact O-N 3.26Å; G124-M128 WeakPolarHBondContact O-CB 3.38Å; G124-M128 PolarHBondContact O-N 2.98Å
125	M	90.4	Very high	89.2	Confident	102 Å²	102	86 Å²	86	50%	0.502	45%	0.452	S	S	.	.	H	α-helix	trans	-64.8	-38.3	173.8	-69.3	-157.8	-53.6	0	0	112.2	I121 E122 M128 T129	I121-M125 HydrophobicContact CG2-CG 4.49Å; I121-M125 WeakPolarHBondContact O-CG 3.23Å; I121-M125 PolarHBondContact O-N 3.49Å; E122-M125 PolarHBondContact O-N 3.08Å; M125-M128 PolarHBondContact O-N 3.46Å; M125-T129 WeakPolarHBondContact O-CB 3.5Å; M125-T129 PolarHBondContact O-N 3.42Å; M125-T129 PolarHBondContact O-OG1 3.24Å
126	S	88.5	Confident	88.5	Confident	58 Å²	58	82.1 Å²	82.1	41%	0.406	44%	0.44	S	S	.	.	H	α-helix	trans	-64.6	-45.1	177	-58.3	0	0	0	0	111.2	E122 M123 T129 Y130	E122-S126 WeakPolarHBondContact O-CB 3.45Å; E122-S126 PolarHBondContact O-N 2.58Å; E122-S126 PolarHBondContact O-OG 3.07Å; M123-S126 PolarHBondContact O-N 3.2Å; S126-T129 PolarHBondContact O-N 3.08Å; S126-Y130 WeakPolarHBondContact O-CB 3.45Å; S126-Y130 PolarHBondContact O-N 3.49Å
127	M	88.5	Confident	87.6	Confident	118 Å²	118	82.4 Å²	82.4	58%	0.581	44%	0.443	S	S	*	.	H	α-helix	trans	-67.6	-36.9	175.8	-171	169.5	64.8	0	0	112.5	M123 G124 Y130 V131	M123-M127 PolarHBondContact O-N 3.23Å; G124-M127 PolarHBondContact O-N 3.26Å; M127-Y130 PolarHBondContact O-N 3.5Å; M127-V131 WeakPolarHBondContact O-CG2 3.3Å; M127-V131 PolarHBondContact O-N 2.8Å
128	M	88	Confident	86.4	Confident	128 Å²	128	82.3 Å²	82.3	63%	0.631	44%	0.442	S	S	*	.	H	α-helix	trans	-64.6	-40.7	173.4	-177.8	176.4	62.9	0	0	112	G124 M125 V131 K132	G124-M128 WeakPolarHBondContact O-CB 3.38Å; G124-M128 PolarHBondContact O-N 2.98Å; M125-M128 PolarHBondContact O-N 3.46Å; M128-V131 PolarHBondContact O-N 3.48Å; M128-K132 WeakPolarHBondContact O-CB 3.45Å; M128-K132 PolarHBondContact O-N 2.96Å
129	T	89.2	Confident	85.3	Confident	69 Å²	69	86.5 Å²	86.5	42%	0.423	46%	0.461	S	S	.	.	H	α-helix	trans	-62.2	-48.8	173.5	-57.7	0	0	0	0	110.4	M125 S126 V131 K132 D133	M125-T129 WeakPolarHBondContact O-CB 3.5Å; M125-T129 PolarHBondContact O-N 3.42Å; M125-T129 PolarHBondContact O-OG1 3.24Å; S126-T129 PolarHBondContact O-N 3.08Å; T129-V131 VanDerWaalsContact C-N 3.35Å; T129-V131 PolarHBondContact O-N 2.93Å; T129-K132 WeakPolarHBondContact O-CB 3.45Å; T129-K132 PolarHBondContact O-N 3.37Å; T129-K132 VanDerWaalsContact O-N 3.13Å; T129-D133 VanDerWaalsContact O-CG 3.28Å; T129-D133 PolarHBondContact O-N 2.74Å
130	Y	84.1	Confident	84	Confident	76 Å²	76	90 Å²	90	30%	0.298	47%	0.469	S	S	.	.	H	α-helix	trans	-55.5	-44.4	175.7	175.8	-98.8	0	0	0	113.5	S126 M127 D133 S134 P150	S126-Y130 WeakPolarHBondContact O-CB 3.45Å; S126-Y130 PolarHBondContact O-N 3.49Å; M127-Y130 PolarHBondContact O-N 3.5Å; Y130-D133 PolarHBondContact O-N 2.92Å; Y130-S134 WeakPolarHBondContact O-CB 3.46Å; Y130-S134 PolarHBondContact O-N 3.4Å; Y130-S134 PolarHBondContact O-OG 3.4Å; Y130-P150 HydrophobicContact CE2-CB 3.64Å; Y130-P150 HydrophobicContact CE2-CG 3.78Å; Y130-P150 WeakPolarHBondContact OH-CG 3.38Å
131	V	88.2	Confident	82.3	Confident	74 Å²	74	93 Å²	93	45%	0.448	49%	0.488	S	S	.	.	H	α-helix	trans	-65.9	-43	176.4	168.8	0	0	0	0	111.3	M127 M128 T129 D133 S134 I135	M127-V131 WeakPolarHBondContact O-CG2 3.3Å; M127-V131 PolarHBondContact O-N 2.8Å; M128-V131 PolarHBondContact O-N 3.48Å; T129-V131 VanDerWaalsContact C-N 3.35Å; T129-V131 PolarHBondContact O-N 2.93Å; V131-D133 PolarHBondContact O-N 3.36Å; V131-S134 PolarHBondContact O-N 2.83Å; V131-I135 HydrophobicContact CG1-CD1 3.85Å; V131-I135 VanDerWaalsContact O-CG1 3.3Å; V131-I135 WeakPolarHBondContact O-CG1 3.48Å; V131-I135 PolarHBondContact O-N 3.03Å
132	K	88.1	Confident	80.4	Confident	138 Å²	138	93.3 Å²	93.3	60%	0.6	49%	0.491	S	S	*	.	H	α-helix	trans	-61.5	-43.2	176.5	-178.8	-170.4	173.5	-166.5	0	111.9	M128 T129 I135 S136	M128-K132 WeakPolarHBondContact O-CB 3.45Å; M128-K132 PolarHBondContact O-N 2.96Å; T129-K132 WeakPolarHBondContact O-CB 3.45Å; T129-K132 PolarHBondContact O-N 3.37Å; T129-K132 VanDerWaalsContact O-N 3.13Å; K132-I135 PolarHBondContact O-N 2.88Å; K132-S136 WeakPolarHBondContact O-CB 3.21Å; K132-S136 PolarHBondContact O-N 3.38Å; K132-S136 PolarHBondContact O-OG 3.32Å
133	D	83.6	Confident	78.6	Confident	85 Å²	85	91.5 Å²	91.5	46%	0.455	49%	0.491	S	S	.	.	H	α-helix	trans	-68.6	-40.6	178.7	-65.9	-18.9	0	0	0	110.7	T129 Y130 V131 I135 S136 V137	T129-D133 VanDerWaalsContact O-CG 3.28Å; T129-D133 PolarHBondContact O-N 2.74Å; Y130-D133 PolarHBondContact O-N 2.92Å; V131-D133 PolarHBondContact O-N 3.36Å; D133-I135 PolarHBondContact O-N 2.88Å; D133-S136 CarbonylContact O-C 3.6Å; D133-S136 WeakPolarHBondContact O-CA 3.31Å; D133-S136 WeakPolarHBondContact O-CB 3.41Å; D133-S136 PolarHBondContact O-N 3.49Å; D133-S136 VanDerWaalsContact O-N 3.07Å; D133-V137 PolarHBondContact O-N 2.95Å
134	S	79.9	Confident	77	Confident	21 Å²	21	92 Å²	92	15%	0.147	50%	0.496	C	S	.	.	H	α-helix	trans	-58.4	-45.7	173.4	-59.7	0	0	0	0	112.2	Y130 V131 S136 V137 L138	Y130-S134 WeakPolarHBondContact O-CB 3.46Å; Y130-S134 PolarHBondContact O-N 3.4Å; Y130-S134 PolarHBondContact O-OG 3.4Å; V131-S134 PolarHBondContact O-N 2.83Å; S134-S136 VanDerWaalsContact C-N 3.3Å; S134-S136 PolarHBondContact O-N 3.1Å; S134-V137 PolarHBondContact O-N 3.46Å; S134-L138 WeakPolarHBondContact O-CG 3.34Å; S134-L138 PolarHBondContact O-N 3.26Å; S134-L138 VanDerWaalsContact O-N 3.14Å
135	I	81.1	Confident	75.3	Confident	103 Å²	103	96.7 Å²	96.7	53%	0.528	51%	0.513	S	S	.	.	H	α-helix	trans	-62.9	-38.9	174	-67.6	164.1	0	0	0	110.8	V131 K132 D133 V137 L138 D139	V131-I135 HydrophobicContact CG1-CD1 3.85Å; V131-I135 VanDerWaalsContact O-CG1 3.3Å; V131-I135 WeakPolarHBondContact O-CG1 3.48Å; V131-I135 PolarHBondContact O-N 3.03Å; K132-I135 PolarHBondContact O-N 2.88Å; D133-I135 PolarHBondContact O-N 2.88Å; I135-V137 PolarHBondContact O-N 3.09Å; I135-L138 PolarHBondContact O-N 3.43Å; I135-D139 PolarHBondContact O-N 3.06Å
136	S	79.9	Confident	73.7	Confident	48 Å²	48	98.5 Å²	98.5	34%	0.336	52%	0.524	S	S	.	.	H	α-helix	trans	-72	-10	179	-54.5	0	0	0	0	114.3	K132 D133 S134 K140	K132-S136 WeakPolarHBondContact O-CB 3.21Å; K132-S136 PolarHBondContact O-N 3.38Å; K132-S136 PolarHBondContact O-OG 3.32Å; D133-S136 CarbonylContact O-C 3.6Å; D133-S136 WeakPolarHBondContact O-CA 3.31Å; D133-S136 WeakPolarHBondContact O-CB 3.41Å; D133-S136 PolarHBondContact O-N 3.49Å; D133-S136 VanDerWaalsContact O-N 3.07Å; S134-S136 VanDerWaalsContact C-N 3.3Å; S134-S136 PolarHBondContact O-N 3.1Å; S136-K140 WeakPolarHBondContact O-CD 3.49Å; S136-K140 VanDerWaalsContact O-CE 3.23Å; S136-K140 WeakPolarHBondContact O-CE 3.42Å
137	V	72.4	Confident	72.1	Confident	48 Å²	48	98.1 Å²	98.1	29%	0.291	52%	0.517	S	S	.	.	H	α-helix	trans	-89.6	-45.3	166.6	173.9	0	0	0	0	110.2	D133 S134 I135 D139 K140 L147	D133-V137 PolarHBondContact O-N 2.95Å; S134-V137 PolarHBondContact O-N 3.46Å; I135-V137 PolarHBondContact O-N 3.09Å; V137-D139 VanDerWaalsContact C-N 3.3Å; V137-D139 PolarHBondContact O-N 2.95Å; V137-K140 WeakPolarHBondContact O-CB 3.44Å; V137-K140 PolarHBondContact O-N 3.43Å; V137-L147 HydrophobicContact CB-CD1 4.19Å; V137-L147 HydrophobicContact CG1-CD1 3.67Å
138	L	69.4	Low	70.5	Confident	88 Å²	88	96.8 Å²	96.8	46%	0.461	52%	0.519	S	S	.	.	H	α-helix	trans	-59.2	-38.3	178.8	-68.2	170.9	0	0	0	113	S134 I135 K140 N141 L144 L147	S134-L138 WeakPolarHBondContact O-CG 3.34Å; S134-L138 PolarHBondContact O-N 3.26Å; S134-L138 VanDerWaalsContact O-N 3.14Å; I135-L138 PolarHBondContact O-N 3.43Å; L138-K140 PolarHBondContact O-N 3.39Å; L138-N141 PolarHBondContact O-N 2.71Å; L138-L144 HydrophobicContact CD2-CD1 3.63Å; L138-L147 HydrophobicContact CD1-CD2 4.36Å; L138-L147 HydrophobicContact CD2-CD1 4.47Å; L138-L147 HydrophobicContact CD2-CD2 4.25Å; L138-L147 HydrophobicContact CG-CD2 4.21Å
139	D	69.7	Low	68.8	Low	134 Å²	134	97.6 Å²	97.6	72%	0.717	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.1	176.5	-167.7	53.7	0	0	0	113.5	I135 V137	I135-D139 PolarHBondContact O-N 3.06Å; V137-D139 VanDerWaalsContact C-N 3.3Å; V137-D139 PolarHBondContact O-N 2.95Å
140	K	65.1	Low	66.9	Low	135 Å²	135	96.4 Å²	96.4	59%	0.587	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-5	-176.3	-67.2	176.5	-177	167.3	0	114.7	S136 V137 L138 D142	S136-K140 WeakPolarHBondContact O-CD 3.49Å; S136-K140 VanDerWaalsContact O-CE 3.23Å; S136-K140 WeakPolarHBondContact O-CE 3.42Å; V137-K140 WeakPolarHBondContact O-CB 3.44Å; V137-K140 PolarHBondContact O-N 3.43Å; L138-K140 PolarHBondContact O-N 3.39Å; K140-D142 PolarHBondContact O-N 3.48Å; K140-D142 VanDerWaalsContact O-N 3.1Å
141	N	56.1	Low	65.1	Low	156 Å²	156	98.4 Å²	98.4	83%	0.834	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	7.9	-176.1	-59.3	-83.3	0	0	0	115.6	L138	L138-N141 PolarHBondContact O-N 2.71Å
142	D	52.8	Low	63.2	Low	114 Å²	114	100.2 Å²	100.2	61%	0.61	55%	0.55	S	S	*	*			trans	-72.5	146.3	172.2	-70.8	-48.5	0	0	0	110.6	K140 L144	K140-D142 PolarHBondContact O-N 3.48Å; K140-D142 VanDerWaalsContact O-N 3.1Å; D142-L144 PolarHBondContact O-N 2.97Å
143	S	54.9	Low	61.3	Low	79 Å²	79	99 Å²	99	55%	0.552	56%	0.559	S	S	*	*			trans	-49.3	131.1	-163.7	-68.9	0	0	0	0	115.8	D145 L146	S143-D145 PolarHBondContact O-N 3.15Å; S143-L146 PolarHBondContact O-N 3.22Å
144	L	55.8	Low	59.5	Low	124 Å²	124	100 Å²	100	65%	0.649	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-51.4	-26.9	178.6	-162.3	76.4	0	0	0	113.9	L138 D142 L146 L147	L138-L144 HydrophobicContact CD2-CD1 3.63Å; D142-L144 PolarHBondContact O-N 2.97Å; L144-L146 PolarHBondContact O-N 2.96Å; L144-L146 VanDerWaalsContact O-N 3.09Å; L144-L147 PolarHBondContact O-N 3.44Å
145	D	56.6	Low	57.9	Low	133 Å²	133	105.5 Å²	105.5	71%	0.711	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-56.1	-24.7	-178.5	-56	-52.5	0	0	0	113.8	S143 L147 S148	S143-D145 PolarHBondContact O-N 3.15Å; D145-L147 VanDerWaalsContact C-N 3.31Å; D145-L147 PolarHBondContact O-N 3.07Å; D145-S148 PolarHBondContact O-N 3.33Å
146	L	55.9	Low	56.1	Low	140 Å²	140	103.6 Å²	103.6	73%	0.733	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-68.7	-23.6	176	-99.4	72.6	0	0	0	114	S143 L144 S148	S143-L146 PolarHBondContact O-N 3.22Å; L144-L146 PolarHBondContact O-N 2.96Å; L144-L146 VanDerWaalsContact O-N 3.09Å; L146-S148 VanDerWaalsContact C-N 3.3Å; L146-S148 PolarHBondContact O-N 3.43Å
147	L	55.2	Low	54.4	Low	50 Å²	50	110.5 Å²	110.5	26%	0.262	62%	0.623	S	S	.	*	G	3₁₀ helix	trans	-79	-8.8	-179.2	-84.7	81.1	0	0	0	113.6	V137 L138 L144 D145 N149 P150	V137-L147 HydrophobicContact CB-CD1 4.19Å; V137-L147 HydrophobicContact CG1-CD1 3.67Å; L138-L147 HydrophobicContact CD1-CD2 4.36Å; L138-L147 HydrophobicContact CD2-CD1 4.47Å; L138-L147 HydrophobicContact CD2-CD2 4.25Å; L138-L147 HydrophobicContact CG-CD2 4.21Å; L144-L147 PolarHBondContact O-N 3.44Å; D145-L147 VanDerWaalsContact C-N 3.31Å; D145-L147 PolarHBondContact O-N 3.07Å; L147-N149 PolarHBondContact O-N 3.45Å; L147-P150 WeakPolarHBondContact O-CD 3.25Å
148	S	54.8	Low	53	Low	90 Å²	90	112.6 Å²	112.6	63%	0.629	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-77.9	-14	-165.5	-168.7	0	0	0	0	116	D145 L146	D145-S148 PolarHBondContact O-N 3.33Å; L146-S148 VanDerWaalsContact C-N 3.3Å; L146-S148 PolarHBondContact O-N 3.43Å
149	N	51.7	Low	51.7	Low	144 Å²	144	113.2 Å²	113.2	77%	0.77	65%	0.654	S	S	*	*	S	Bend	trans	-139.3	58.4	-172	-71.4	-65.9	0	0	0	117.7	L147	L147-N149 PolarHBondContact O-N 3.45Å
150	P	50.2	Low	50.7	Low	45 Å²	45	111.4 Å²	111.4	29%	0.292	65%	0.648	S	S	.	*			trans	-110.8	-23.5	165.1	-8.3	31	0	0	0	115.6	Y130 L147 S152 S153	Y130-P150 HydrophobicContact CE2-CB 3.64Å; Y130-P150 HydrophobicContact CE2-CG 3.78Å; Y130-P150 WeakPolarHBondContact OH-CG 3.38Å; L147-P150 WeakPolarHBondContact O-CD 3.25Å; P150-S152 PolarHBondContact O-N 3.35Å; P150-S152 VanDerWaalsContact O-N 3.11Å; P150-S153 PolarHBondContact O-N 3.43Å
151	I	46.7	Very low	49.8	Very low	117 Å²	117	108.6 Å²	108.6	60%	0.6	64%	0.639	S	S	*	*	H	α-helix	trans	-58.5	-34.6	-166	-61.2	174.7	0	0	0	112.5	S153 L154	I151-S153 PolarHBondContact O-N 2.88Å; I151-S153 VanDerWaalsContact O-N 3.16Å; I151-L154 PolarHBondContact O-N 3.47Å
152	S	48.1	Very low	49.6	Very low	113 Å²	113	106.1 Å²	106.1	79%	0.79	63%	0.632	S	S	*	*	H	α-helix	trans	-63.4	-15.6	178.3	-51.6	0	0	0	0	115	P150	P150-S152 PolarHBondContact O-N 3.35Å; P150-S152 VanDerWaalsContact O-N 3.11Å
153	S	47.6	Very low	49.4	Very low	112 Å²	112	105.6 Å²	105.6	78%	0.783	63%	0.629	S	S	*	*	H	α-helix	trans	-99.8	-17.3	-178.8	-169	0	0	0	0	114.4	P150 I151	P150-S153 PolarHBondContact O-N 3.43Å; I151-S153 PolarHBondContact O-N 2.88Å; I151-S153 VanDerWaalsContact O-N 3.16Å
154	L	45.7	Very low	49.4	Very low	105 Å²	105	104 Å²	104	55%	0.55	62%	0.62	S	S	.	*	H	α-helix	trans	-99.5	-19.2	-178	-166.3	66.7	0	0	0	112.6	I151	I151-L154 PolarHBondContact O-N 3.47Å
155	L	47.1	Very low	49	Very low	138 Å²	138	101.9 Å²	101.9	72%	0.723	61%	0.609	S	S	*	*	S	Bend	trans	-104	14	-174.4	-154.1	68.2	0	0	0	113.3
156	G	43.4	Very low	48.7	Very low	63 Å²	63	98.7 Å²	98.7	65%	0.649	59%	0.592	S	S	*	*	S	Bend	trans	-78.9	-30.9	-162.4	0	0	0	0	0	117.2
157	E	44.1	Very low	48.4	Very low	192 Å²	192	94.2 Å²	94.2	90%	0.897	57%	0.573	S	S	*	*	S	Bend	trans	-133.1	-7.7	-170.7	-92	179.9	147.7	0	0	115.5	A159	E157-A159 PolarHBondContact O-N 3.09Å
158	T	42.2	Very low	48.1	Very low	92 Å²	92	95 Å²	95	56%	0.564	58%	0.579	S	S	*	*			trans	-101.6	58.3	-177.6	46.6	0	0	0	0	112.6	V160	T158-V160 PolarHBondContact O-N 3.32Å
159	A	41.6	Very low	47.8	Very low	101 Å²	101	92.4 Å²	92.4	84%	0.835	56%	0.561	S	S	*	*			trans	-71.2	68.2	168.6	0	0	0	0	0	111.1	E157 D161	E157-A159 PolarHBondContact O-N 3.09Å; A159-D161 VanDerWaalsContact C-N 3.31Å; A159-D161 PolarHBondContact O-N 3.45Å
160	V	48.2	Very low	47.8	Very low	96 Å²	96	92.3 Å²	92.3	58%	0.582	55%	0.55	S	S	*	.			trans	-70.9	86.3	178.1	-176.4	0	0	0	0	109.1	L116 T158 P162	L116-V160 HydrophobicContact CD1-CG1 4.33Å; T158-V160 PolarHBondContact O-N 3.32Å; V160-P162 WeakPolarHBondContact O-CD 3.47Å
161	D	46.2	Very low	47.7	Very low	77 Å²	77	97.1 Å²	97.1	41%	0.412	57%	0.566	S	S	.	*			trans	-59.3	116.8	171.4	171.2	26.7	0	0	0	109.6	A159 N163 A164	A159-D161 VanDerWaalsContact C-N 3.31Å; A159-D161 PolarHBondContact O-N 3.45Å; D161-N163 PolarHBondContact O-N 3.05Å; D161-N163 VanDerWaalsContact OD1-CB 3.29Å; D161-N163 WeakPolarHBondContact OD1-CB 3.27Å; D161-N163 PolarHBondContact OD1-N 3.08Å; D161-N163 PolarHBondContact OD1-ND2 3.35Å; D161-N163 WeakPolarHBondContact OD2-CB 3.34Å; D161-A164 HydrophobicContact CB-CB 4.08Å; D161-A164 WeakPolarHBondContact O-CB 3.43Å; D161-A164 PolarHBondContact O-N 3.08Å; D161-A164 PolarHBondContact OD2-N 3.36Å
162	P	52.1	Low	47.7	Very low	104 Å²	104	95.4 Å²	95.4	68%	0.675	56%	0.556	S	S	*	*	H	α-helix	trans	-63.5	-22.4	177.2	26.9	-34.7	0	0	0	112	V160 A164	V160-P162 WeakPolarHBondContact O-CD 3.47Å; P162-A164 VanDerWaalsContact C-N 3.28Å
163	N	50.3	Low	47.6	Very low	103 Å²	103	96.3 Å²	96.3	55%	0.551	55%	0.545	S	S	*	.	H	α-helix	trans	-74.9	-16.8	173	-49.1	-85.7	0	0	0	112.1	D161 D166 S167	D161-N163 PolarHBondContact O-N 3.05Å; D161-N163 VanDerWaalsContact OD1-CB 3.29Å; D161-N163 WeakPolarHBondContact OD1-CB 3.27Å; D161-N163 PolarHBondContact OD1-N 3.08Å; D161-N163 PolarHBondContact OD1-ND2 3.35Å; D161-N163 WeakPolarHBondContact OD2-CB 3.34Å; N163-D166 CarbonylContact O-C 3.49Å; N163-D166 PolarHBondContact O-N 3.18Å; N163-S167 WeakPolarHBondContact O-CB 3.45Å; N163-S167 PolarHBondContact O-N 3.05Å
164	A	53.6	Low	47.4	Very low	44 Å²	44	95.9 Å²	95.9	36%	0.364	54%	0.538	S	S	.	.	H	α-helix	trans	-68.4	-39.2	176.2	0	0	0	0	0	111.8	D161 P162 D166 S167 V168	D161-A164 HydrophobicContact CB-CB 4.08Å; D161-A164 WeakPolarHBondContact O-CB 3.43Å; D161-A164 PolarHBondContact O-N 3.08Å; D161-A164 PolarHBondContact OD2-N 3.36Å; P162-A164 VanDerWaalsContact C-N 3.28Å; A164-D166 VanDerWaalsContact C-N 3.34Å; A164-D166 PolarHBondContact O-N 3.05Å; A164-S167 WeakPolarHBondContact O-CB 3.5Å; A164-S167 PolarHBondContact O-N 2.96Å; A164-V168 WeakPolarHBondContact O-CG2 3.38Å; A164-V168 PolarHBondContact O-N 3.34Å
165	L	47.2	Very low	47.1	Very low	81 Å²	81	98.9 Å²	98.9	42%	0.424	55%	0.547	S	S	.	.	H	α-helix	trans	-60.8	-44.9	173.4	-179.9	62.9	0	0	0	111.2	L116 S167 C169	L116-L165 HydrophobicContact CD2-CD1 3.96Å; L116-L165 HydrophobicContact CD2-CD2 3.84Å; L116-L165 HydrophobicContact CD2-CG 4.37Å; L165-S167 VanDerWaalsContact C-N 3.31Å; L165-S167 PolarHBondContact O-N 3.15Å; L165-C169 PolarHBondContact O-N 3.25Å; L165-C169 VanDerWaalsContact O-N 3.15Å; L165-C169 PolarHBondContact O-SG 2.93Å; L165-C169 VanDerWaalsContact O-SG 3.41Å
166	D	51	Low	46.4	Very low	65 Å²	65	97.3 Å²	97.3	35%	0.348	55%	0.548	S	S	.	.	H	α-helix	trans	-70.9	-27.6	177.5	-152.5	1.8	0	0	0	111.7	N163 A164 R170	N163-D166 CarbonylContact O-C 3.49Å; N163-D166 PolarHBondContact O-N 3.18Å; A164-D166 VanDerWaalsContact C-N 3.34Å; A164-D166 PolarHBondContact O-N 3.05Å; D166-R170 VanDerWaalsContact O-CB 3.23Å; D166-R170 WeakPolarHBondContact O-CB 3.46Å; D166-R170 VanDerWaalsContact O-CG 3.32Å; D166-R170 WeakPolarHBondContact O-CG 3.39Å; D166-R170 PolarHBondContact O-N 3.47Å; D166-R170 IonicContact OD1-CZ 3.1Å; D166-R170 IonicContact OD1-NE 3.65Å; D166-R170 IonicContact OD1-NH1 2.8Å; D166-R170 PolarHBondContact OD1-NH1 3.21Å; D166-R170 IonicContact OD1-NH2 3.52Å; D166-R170 IonicContact OD2-CZ 3.02Å; D166-R170 IonicContact OD2-NH1 2.72Å; D166-R170 PolarHBondContact OD2-NH1 2.9Å; D166-R170 IonicContact OD2-NH2 2.72Å; D166-R170 PolarHBondContact OD2-NH2 2.92Å
167	S	50.2	Low	46	Very low	47 Å²	47	98.2 Å²	98.2	33%	0.329	55%	0.549	S	S	.	.	H	α-helix	trans	-74.8	-41.9	174.5	-159.9	0	0	0	0	112.6	N163 A164 L165 R170 K171	N163-S167 WeakPolarHBondContact O-CB 3.45Å; N163-S167 PolarHBondContact O-N 3.05Å; A164-S167 WeakPolarHBondContact O-CB 3.5Å; A164-S167 PolarHBondContact O-N 2.96Å; L165-S167 VanDerWaalsContact C-N 3.31Å; L165-S167 PolarHBondContact O-N 3.15Å; S167-R170 PolarHBondContact O-N 2.97Å; S167-K171 VanDerWaalsContact O-CB 3.23Å; S167-K171 WeakPolarHBondContact O-CB 3.45Å; S167-K171 WeakPolarHBondContact O-CG 3.41Å; S167-K171 PolarHBondContact O-N 3.01Å
168	V	48.8	Very low	45.6	Very low	65 Å²	65	97.5 Å²	97.5	39%	0.394	55%	0.546	S	S	.	.	H	α-helix	trans	-60.3	-53.5	174.5	167.2	0	0	0	0	109.2	A164 R170 E172	A164-V168 WeakPolarHBondContact O-CG2 3.38Å; A164-V168 PolarHBondContact O-N 3.34Å; V168-R170 PolarHBondContact O-N 3.4Å; V168-E172 WeakPolarHBondContact O-CG 3.1Å; V168-E172 PolarHBondContact O-N 2.77Å; V168-E172 VanDerWaalsContact O-N 3.14Å
169	C	48.3	Very low	45.2	Very low	36 Å²	36	100.8 Å²	100.8	24%	0.243	55%	0.554	C	S	.	*	H	α-helix	trans	-54.8	-56.3	174	-70.8	0	0	0	0	111.6	L165 K171 E172 F173	L165-C169 PolarHBondContact O-N 3.25Å; L165-C169 VanDerWaalsContact O-N 3.15Å; L165-C169 PolarHBondContact O-SG 2.93Å; L165-C169 VanDerWaalsContact O-SG 3.41Å; C169-K171 PolarHBondContact O-N 3.27Å; C169-E172 PolarHBondContact O-N 3.34Å; C169-F173 WeakPolarHBondContact O-CD2 3.36Å; C169-F173 PolarHBondContact O-N 2.82Å; C169-F173 VanDerWaalsContact O-N 3.13Å
170	R	50.4	Low	44.8	Very low	143 Å²	143	101.1 Å²	101.1	54%	0.54	54%	0.541	S	S	.	.	H	α-helix	trans	-69.8	-31.7	-174.3	-70.3	-162.9	-72.5	-107.9	-1.3	114.2	D166 S167 V168 T174	D166-R170 VanDerWaalsContact O-CB 3.23Å; D166-R170 WeakPolarHBondContact O-CB 3.46Å; D166-R170 VanDerWaalsContact O-CG 3.32Å; D166-R170 WeakPolarHBondContact O-CG 3.39Å; D166-R170 PolarHBondContact O-N 3.47Å; D166-R170 IonicContact OD1-CZ 3.1Å; D166-R170 IonicContact OD1-NE 3.65Å; D166-R170 IonicContact OD1-NH1 2.8Å; D166-R170 PolarHBondContact OD1-NH1 3.21Å; D166-R170 IonicContact OD1-NH2 3.52Å; D166-R170 IonicContact OD2-CZ 3.02Å; D166-R170 IonicContact OD2-NH1 2.72Å; D166-R170 PolarHBondContact OD2-NH1 2.9Å; D166-R170 IonicContact OD2-NH2 2.72Å; D166-R170 PolarHBondContact OD2-NH2 2.92Å; S167-R170 PolarHBondContact O-N 2.97Å; V168-R170 PolarHBondContact O-N 3.4Å; R170-T174 VanDerWaalsContact O-CB 3.29Å; R170-T174 WeakPolarHBondContact O-CB 3.41Å; R170-T174 VanDerWaalsContact O-CG2 3.24Å; R170-T174 WeakPolarHBondContact O-CG2 3.35Å; R170-T174 PolarHBondContact O-N 3.44Å; R170-T174 PolarHBondContact O-OG1 3.3Å
171	K	49.1	Very low	44.2	Very low	145 Å²	145	99.6 Å²	99.6	63%	0.63	53%	0.532	S	S	*	.	H	α-helix	trans	-69.8	-39.1	174.7	-81.6	176.1	172.3	168.7	0	112.5	S167 C169 K175	S167-K171 VanDerWaalsContact O-CB 3.23Å; S167-K171 WeakPolarHBondContact O-CB 3.45Å; S167-K171 WeakPolarHBondContact O-CG 3.41Å; S167-K171 PolarHBondContact O-N 3.01Å; C169-K171 PolarHBondContact O-N 3.27Å; K171-K175 PolarHBondContact O-N 3.26Å
172	E	46.7	Very low	43.7	Very low	82 Å²	82	103.3 Å²	103.3	38%	0.383	55%	0.547	S	S	.	.	H	α-helix	trans	-72.4	-29.3	178.9	-69.4	-168.7	177.2	0	0	113.3	R105 V168 C169	R105-E172 PolarHBondContact NH1-O 3.3Å; V168-E172 WeakPolarHBondContact O-CG 3.1Å; V168-E172 PolarHBondContact O-N 2.77Å; V168-E172 VanDerWaalsContact O-N 3.14Å; C169-E172 PolarHBondContact O-N 3.34Å
173	F	44.8	Very low	42.9	Very low	132 Å²	132	104.8 Å²	104.8	58%	0.579	55%	0.545	S	S	*	.	H	α-helix	trans	-87.5	-17.9	174	-67	-57.5	0	0	0	114.8	C169	C169-F173 WeakPolarHBondContact O-CD2 3.36Å; C169-F173 PolarHBondContact O-N 2.82Å; C169-F173 VanDerWaalsContact O-N 3.13Å
174	T	44	Very low	42.3	Very low	103 Å²	103	104.2 Å²	104.2	63%	0.632	54%	0.542	S	S	*	.	H	α-helix	trans	-95.2	-11.6	176.1	53.4	0	0	0	0	114.7	R170 S176	R170-T174 VanDerWaalsContact O-CB 3.29Å; R170-T174 WeakPolarHBondContact O-CB 3.41Å; R170-T174 VanDerWaalsContact O-CG2 3.24Å; R170-T174 WeakPolarHBondContact O-CG2 3.35Å; R170-T174 PolarHBondContact O-N 3.44Å; R170-T174 PolarHBondContact O-OG1 3.3Å; T174-S176 PolarHBondContact O-N 3.24Å
175	K	38.9	Very low	41.6	Very low	167 Å²	167	105.5 Å²	105.5	73%	0.726	55%	0.545	S	S	*	.	S	Bend	trans	-64.7	106.2	169.6	-169	175	-171.9	177.1	0	108.9	K171 A177	K171-K175 PolarHBondContact O-N 3.26Å; K175-A177 PolarHBondContact O-N 3.3Å
176	S	32.9	Very low	41.1	Very low	106 Å²	106	106.8 Å²	106.8	74%	0.741	56%	0.56	S	S	*	*			trans	-47.4	111.2	-170.8	-49	0	0	0	0	111.5	T174 Q178	T174-S176 PolarHBondContact O-N 3.24Å; S176-Q178 PolarHBondContact O-N 2.97Å; S176-Q178 VanDerWaalsContact O-N 3.16Å
177	A	35.2	Very low	40.4	Very low	82 Å²	82	110.4 Å²	110.4	68%	0.678	57%	0.574	S	S	*	*			trans	-54.9	121.9	153.9	0	0	0	0	0	105.7	K175 Q179	K175-A177 PolarHBondContact O-N 3.3Å; A177-Q179 PolarHBondContact O-N 3.24Å
178	Q	35.9	Very low	39.6	Very low	177 Å²	177	115.1 Å²	115.1	83%	0.827	60%	0.595	S	S	*	*			trans	-56.8	112.8	178.6	-77.4	178.5	-50.4	0	0	107.1	S176 I180	S176-Q178 PolarHBondContact O-N 2.97Å; S176-Q178 VanDerWaalsContact O-N 3.16Å; Q178-I180 VanDerWaalsContact C-N 3.28Å; Q178-I180 PolarHBondContact O-N 3.46Å
179	Q	33.7	Very low	38.7	Very low	160 Å²	160	117.1 Å²	117.1	75%	0.748	61%	0.612	S	S	*	*			trans	-71.7	95.5	178.7	-164.5	167	13	0	0	105.9	A177 T181	A177-Q179 PolarHBondContact O-N 3.24Å; Q179-T181 PolarHBondContact O-N 3.06Å; Q179-T181 PolarHBondContact O-OG1 3.44Å
180	I	34	Very low	37.9	Very low	108 Å²	108	121.9 Å²	121.9	55%	0.554	63%	0.634	S	S	*	*			trans	-74.1	69.6	170.3	-53.1	176.1	0	0	0	106.3	Q178 V185	Q178-I180 VanDerWaalsContact C-N 3.28Å; Q178-I180 PolarHBondContact O-N 3.46Å; I180-V185 HydrophobicContact CG2-CG2 3.53Å
181	T	34.3	Very low	36.9	Very low	65 Å²	65	121.4 Å²	121.4	40%	0.399	65%	0.646	S	S	.	*			trans	-52.3	143.5	156.9	-10.3	0	0	0	0	107.4	Q179 E183 N184	Q179-T181 PolarHBondContact O-N 3.06Å; Q179-T181 PolarHBondContact O-OG1 3.44Å; T181-E183 PolarHBondContact O-N 3.42Å; T181-N184 PolarHBondContact O-N 3.18Å
182	E	35.9	Very low	36	Very low	155 Å²	155	119 Å²	119	72%	0.724	65%	0.647	S	S	*	*	H	α-helix	trans	-58.6	-26.3	-171.1	-61.2	178.3	138.6	0	0	112.3	N184 V185 C186	E182-N184 VanDerWaalsContact C-N 3.3Å; E182-N184 PolarHBondContact O-N 2.62Å; E182-V185 PolarHBondContact O-N 2.59Å; E182-C186 PolarHBondContact O-N 3.06Å; E182-C186 PolarHBondContact O-SG 3.12Å
183	E	35.7	Very low	35.4	Very low	135 Å²	135	120.5 Å²	120.5	63%	0.631	66%	0.663	S	S	*	*	H	α-helix	trans	-51.4	-40.7	169.8	-58.1	-178.3	124.1	0	0	113.9	T181 V185 C186 Q187	T181-E183 PolarHBondContact O-N 3.42Å; E183-V185 VanDerWaalsContact C-N 3.28Å; E183-V185 PolarHBondContact O-N 3.48Å; E183-C186 PolarHBondContact O-N 3.33Å; E183-C186 VanDerWaalsContact O-N 3.16Å; E183-Q187 WeakPolarHBondContact O-CG 3.5Å; E183-Q187 PolarHBondContact O-N 3.22Å
184	N	36.7	Very low	34.7	Very low	90 Å²	90	122.6 Å²	122.6	48%	0.481	68%	0.675	S	S	.	*	H	α-helix	trans	-71.4	-21	-180	-81.5	-43.9	0	0	0	113	T181 E182	T181-N184 PolarHBondContact O-N 3.18Å; E182-N184 VanDerWaalsContact C-N 3.3Å; E182-N184 PolarHBondContact O-N 2.62Å
185	V	39.2	Very low	34.2	Very low	71 Å²	71	125 Å²	125	43%	0.43	68%	0.682	S	S	.	*	H	α-helix	trans	-80.6	-29.4	172.4	-173.2	0	0	0	0	110.6	L87 I180 E182 E183	L87-V185 HydrophobicContact CD1-CG1 4.18Å; I180-V185 HydrophobicContact CG2-CG2 3.53Å; E182-V185 PolarHBondContact O-N 2.59Å; E183-V185 VanDerWaalsContact C-N 3.28Å; E183-V185 PolarHBondContact O-N 3.48Å
186	C	37.1	Very low	33.7	Very low	109 Å²	109	124.5 Å²	124.5	74%	0.736	68%	0.683	S	S	*	*	H	α-helix	trans	-79	-19.2	179.6	-65.4	0	0	0	0	114.8	E182 E183	E182-C186 PolarHBondContact O-N 3.06Å; E182-C186 PolarHBondContact O-SG 3.12Å; E183-C186 PolarHBondContact O-N 3.33Å; E183-C186 VanDerWaalsContact O-N 3.16Å
187	Q	37.6	Very low	33.6	Very low	141 Å²	141	124.7 Å²	124.7	66%	0.659	68%	0.684	S	S	*	*	S	Bend	trans	-84.9	-13.8	-177.2	-71.9	-177.4	20.4	0	0	114.9	E183 S189	E183-Q187 WeakPolarHBondContact O-CG 3.5Å; E183-Q187 PolarHBondContact O-N 3.22Å; Q187-S189 PolarHBondContact O-N 3.02Å
188	L	33	Very low	33.5	Very low	146 Å²	146	126.5 Å²	126.5	76%	0.764	69%	0.689	S	S	*	*	S	Bend	trans	-71.6	95.6	172.8	-98.1	160.5	0	0	0	110	I190	L188-I190 PolarHBondContact O-N 3.26Å
189	S	29.1	Very low	33.1	Very low	107 Å²	107	123.9 Å²	123.9	75%	0.748	69%	0.69	S	S	*	*			trans	-60	92.7	-172.7	-68.2	0	0	0	0	112.9	Q187 V191	Q187-S189 PolarHBondContact O-N 3.02Å; S189-V191 PolarHBondContact O-N 3Å; S189-V191 VanDerWaalsContact O-N 3.09Å
190	I	32.1	Very low	33	Very low	136 Å²	136	121 Å²	121	70%	0.697	69%	0.688	S	S	*	*			trans	-67.5	105.5	159.8	-59.1	178.9	0	0	0	106.5	L188 C192	L188-I190 PolarHBondContact O-N 3.26Å; I190-C192 PolarHBondContact O-N 3.11Å
191	V	29.1	Very low	32.6	Very low	133 Å²	133	121.6 Å²	121.6	81%	0.806	70%	0.701	S	S	*	*			trans	-70.1	78.8	172.1	-176.2	0	0	0	0	108.7	S189	S189-V191 PolarHBondContact O-N 3Å; S189-V191 VanDerWaalsContact O-N 3.09Å
192	C	29.9	Very low	32.3	Very low	95 Å²	95	125.2 Å²	125.2	64%	0.642	72%	0.717	S	S	*	*			trans	-63.8	128.2	164.3	-73.3	0	0	0	0	108.2	I190 E194	I190-C192 PolarHBondContact O-N 3.11Å; C192-E194 PolarHBondContact O-N 2.7Å
193	P	35.4	Very low	32	Very low	112 Å²	112	122.7 Å²	122.7	73%	0.727	72%	0.716	S	S	*	*			trans	-61.6	127.5	173.7	25.5	-32.9	0	0	0	109.5	I195	P193-I195 PolarHBondContact O-N 3.48Å
194	E	28.8	Very low	31.7	Very low	177 Å²	177	123.6 Å²	123.6	83%	0.827	72%	0.724	S	S	*	*			trans	-67.3	93.8	-171	-172.5	-179.2	178.3	0	0	111.6	C192 Q196	C192-E194 PolarHBondContact O-N 2.7Å; E194-Q196 PolarHBondContact O-N 2.77Å
195	I	33.5	Very low	31.4	Very low	152 Å²	152	125 Å²	125	78%	0.779	74%	0.736	S	S	*	*			trans	-93	93.9	167.1	-59.5	175.4	0	0	0	108.1	P193 S197	P193-I195 PolarHBondContact O-N 3.48Å; I195-S197 PolarHBondContact O-N 3.13Å
196	Q	29.6	Very low	31.1	Very low	158 Å²	158	128.2 Å²	128.2	74%	0.738	76%	0.756	S	S	*	*			trans	-46	102.8	177.6	-172.7	171.1	66.5	0	0	112.9	E194 P198	E194-Q196 PolarHBondContact O-N 2.77Å; Q196-P198 WeakPolarHBondContact O-CD 3.4Å
197	S	29.7	Very low	30.7	Very low	110 Å²	110	125.7 Å²	125.7	77%	0.769	75%	0.748	S	S	*	*			trans	-67.2	122.2	175.5	-67.1	0	0	0	0	111	I195 S199	I195-S197 PolarHBondContact O-N 3.13Å; S197-S199 PolarHBondContact O-N 2.83Å
198	P	33.3	Very low	30.2	Very low	119 Å²	119	125.4 Å²	125.4	77%	0.773	76%	0.759	S	S	*	*			trans	-68.6	122.9	173.5	27.8	-33	0	0	0	110	Q196 S200	Q196-P198 WeakPolarHBondContact O-CD 3.4Å; P198-S200 PolarHBondContact O-N 3.11Å
199	S	27.3	Very low	30.1	Very low	123 Å²	123	125.5 Å²	125.5	86%	0.86	77%	0.765	S	S	*	*			trans	-73.9	108.2	179.9	-173	0	0	0	0	111.4	S197	S197-S199 PolarHBondContact O-N 2.83Å
200	S	31.1	Very low	30.1	Very low	99 Å²	99	130.2 Å²	130.2	69%	0.692	77%	0.772	S	S	*	*			trans	-151.3	116	161.4	57.9	0	0	0	0	111.3	P198 I202	P198-S200 PolarHBondContact O-N 3.11Å; S200-I202 PolarHBondContact O-N 3.11Å
201	S	26.4	Very low	29.7	Very low	120 Å²	120	132 Å²	132	84%	0.839	78%	0.779	S	S	*	*			trans	-71.4	124.2	-173.1	-47.6	0	0	0	0	112.5
202	I	28.7	Very low	29.6	Very low	142 Å²	142	130.2 Å²	130.2	73%	0.728	78%	0.779	S	S	*	*			trans	-126.3	85.8	164.2	-52.6	-176.9	0	0	0	109.3	S200 L204	S200-I202 PolarHBondContact O-N 3.11Å; I202-L204 HydrophobicContact CG2-CG 4.23Å; I202-L204 PolarHBondContact O-N 3.31Å; I202-L204 VanDerWaalsContact O-N 3.15Å
203	S	29.4	Very low	29.3	Very low	102 Å²	102	134.6 Å²	134.6	71%	0.713	79%	0.788	S	S	*	*			trans	-76.8	91	174	171.3	0	0	0	0	110.5	V205	S203-V205 PolarHBondContact O-N 2.79Å
204	L	28.5	Very low	28.8	Very low	153 Å²	153	134.1 Å²	134.1	80%	0.801	78%	0.783	S	S	*	*			trans	-75.6	70.7	173.5	-84.1	166.6	0	0	0	111.9	I202	I202-L204 HydrophobicContact CG2-CG 4.23Å; I202-L204 PolarHBondContact O-N 3.31Å; I202-L204 VanDerWaalsContact O-N 3.15Å
205	V	31.6	Very low	28.7	Very low	121 Å²	121	131.7 Å²	131.7	73%	0.733	78%	0.782	S	S	*	*			trans	-92.3	99.4	166.9	175.4	0	0	0	0	108.5	S203 G207	S203-V205 PolarHBondContact O-N 2.79Å; V205-G207 PolarHBondContact O-N 2.79Å
206	T	32	Very low	28.4	Very low	137 Å²	137	131.4 Å²	131.4	84%	0.84	78%	0.775	S	S	*	*			trans	-80.5	96	175	47.1	0	0	0	0	111
207	G	29.2	Very low	28.5	Very low	56 Å²	56	128.5 Å²	128.5	58%	0.577	77%	0.765	S	S	*	*			trans	-148.4	125.5	172.3	0	0	0	0	0	111.3	V205	V205-G207 PolarHBondContact O-N 2.79Å
208	P	27.2	Very low	28.6	Very low	136 Å²	136	130.8 Å²	130.8	88%	0.883	76%	0.763	S	S	*	*			trans	-89.5	121.3	-171.3	32.8	-33.2	0	0	0	113.3
209	V	30.6	Very low	28.6	Very low	147 Å²	147	130.2 Å²	130.2	89%	0.891	76%	0.762	S	S	*	*			trans	-128.8	148.2	170.8	-175.4	0	0	0	0	110
210	K	29.7	Very low	28.8	Very low	206 Å²	206	131.9 Å²	131.9	90%	0.896	76%	0.761	S	S	*	*			trans	-84.8	160	-164.7	-80.6	-179.8	175.1	176.2	0	115.5
211	M	23.9	Very low	28.9	Very low	173 Å²	173	131.2 Å²	131.2	85%	0.852	76%	0.761	S	S	*	*			trans	-70.1	148.2	178.4	-57.2	-92.9	-76.5	0	0	114.3
212	A	25.5	Very low	29.2	Very low	97 Å²	97	132.2 Å²	132.2	80%	0.802	76%	0.758	S	S	*	*			trans	-154.9	84.3	164.1	0	0	0	0	0	114.9
213	F	24	Very low	29.5	Very low	186 Å²	186	133.1 Å²	133.1	82%	0.816	76%	0.758	S	S	*	*			trans	20.4	147.5	141.2	-75.7	-75.9	0	0	0	126.4
214	V	24.2	Very low	29.8	Very low	103 Å²	103	134.7 Å²	134.7	62%	0.624	76%	0.757	S	S	*	*			trans	78.3	122.6	146.5	167.3	0	0	0	0	116.8	K216	V214-K216 HydrophobicContact CG1-CB 3.94Å; V214-K216 HydrophobicContact CG1-CD 3.92Å; V214-K216 HydrophobicContact CG1-CG 3.93Å
215	P	26.8	Very low	30	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	76%	0.755	S	S	*	*				-105.8	161.6	73.8	-9.9	30.6	0	0	0	114
216	K	28.7	Very low	30.2	Very low	146 Å²	146	136.9 Å²	136.9	64%	0.635	75%	0.753	S	S	*	*			cis	66.2	128.5	15.1	-77.1	-174.4	133.5	-93.8	0	115.7	V214	V214-K216 HydrophobicContact CG1-CB 3.94Å; V214-K216 HydrophobicContact CG1-CD 3.92Å; V214-K216 HydrophobicContact CG1-CG 3.93Å
217	D	31.5	Very low	30.2	Very low	97 Å²	97	136.5 Å²	136.5	52%	0.519	75%	0.746	S	S	.	*			cis	-157.5	164	19	-101	-37.8	0	0	0	112.6
218	H	32.1	Very low	29.9	Very low	158 Å²	158	143.5 Å²	143.5	73%	0.731	76%	0.755	S	S	*	*			trans	49.7	113.7	151.9	-52.2	-36.1	0	0	0	124.4
219	S	31.5	Very low	30.2	Very low	107 Å²	107	145.4 Å²	145.4	75%	0.748	76%	0.757	S	S	*	*				111	127.3	125.8	78.6	0	0	0	0	121.5
220	N	32.3	Very low	30.1	Very low	157 Å²	157	142 Å²	142	84%	0.84	73%	0.734	S	S	*	*			trans	67.7	116.7	150.6	-62.3	-8.9	0	0	0	123.2
221	A	33.2	Very low	30	Very low	85 Å²	85	138.3 Å²	138.3	70%	0.702	73%	0.728	S	S	*	*			trans	84.9	91.6	141	0	0	0	0	0	121.5
222	N	33.2	Very low	30.2	Very low	142 Å²	142	138.1 Å²	138.1	76%	0.759	73%	0.725	S	S	*	*				74.1	110.1	127.1	-62.3	-5.9	0	0	0	121.9
223	H	35	Very low	30.2	Very low	160 Å²	160	139.1 Å²	139.1	74%	0.741	72%	0.723	S	S	*	*			trans	58.1	100.8	149.2	-57.5	-68.1	0	0	0	119
224	I	34.6	Very low	30.6	Very low	136 Å²	136	138.4 Å²	138.4	70%	0.697	73%	0.726	S	S	*	*				67.5	95.2	67.5	-58.6	166.1	0	0	0	110.8
225	Y	33.8	Very low	30.8	Very low	191 Å²	191	138.6 Å²	138.6	75%	0.749	73%	0.729	S	S	*	*				55.9	136.8	70.5	-81.6	-84.6	0	0	0	113.3	N227	Y225-N227 WeakPolarHBondContact CD1-OD1 3.48Å
226	N	35.1	Very low	30.8	Very low	128 Å²	128	140.5 Å²	140.5	68%	0.684	73%	0.732	S	S	*	*			cis	-155.7	174	32.1	-69.3	-85.4	0	0	0	108.8
227	N	31.9	Very low	30.8	Very low	130 Å²	130	140.4 Å²	140.4	70%	0.695	74%	0.737	S	S	*	*			cis	-159.1	153.4	-29.4	-96.4	-11.5	0	0	0	107.5	Y225	Y225-N227 WeakPolarHBondContact CD1-OD1 3.48Å
228	R	23.7	Very low	30.9	Very low	202 Å²	202	143.5 Å²	143.5	76%	0.762	75%	0.748	S	S	*	*			trans	-146.4	136.4	174.1	-179.6	178.3	177.6	-176.3	-3.5	109.3	D230	R228-D230 WeakPolarHBondContact CG-OD1 3.39Å; R228-D230 IonicContact CZ-OD1 2.72Å; R228-D230 IonicContact CZ-OD2 3.5Å; R228-D230 VanDerWaalsContact NE-CG 3.33Å; R228-D230 IonicContact NE-OD1 3.26Å; R228-D230 PolarHBondContact NE-OD1 2.76Å; R228-D230 IonicContact NE-OD2 3.4Å; R228-D230 PolarHBondContact NE-OD2 3.3Å; R228-D230 IonicContact NH2-OD1 3.48Å; R228-D230 PolarHBondContact NH2-OD1 3.23Å; R228-D230 IonicContact NH2-OD2 3.46Å; R228-D230 PolarHBondContact NH2-OD2 3.33Å
229	L	32.8	Very low	30.7	Very low	177 Å²	177	141.1 Å²	141.1	93%	0.927	75%	0.745	S	S	*	*			trans	-129.3	79.1	172.6	-95.4	165.7	0	0	0	110.2
230	D	27.8	Very low	30.8	Very low	76 Å²	76	144 Å²	144	41%	0.406	75%	0.751	S	S	.	*			trans	-73	172.9	145.6	-64.2	39.4	0	0	0	106.9	R228	R228-D230 WeakPolarHBondContact CG-OD1 3.39Å; R228-D230 IonicContact CZ-OD1 2.72Å; R228-D230 IonicContact CZ-OD2 3.5Å; R228-D230 VanDerWaalsContact NE-CG 3.33Å; R228-D230 IonicContact NE-OD1 3.26Å; R228-D230 PolarHBondContact NE-OD1 2.76Å; R228-D230 IonicContact NE-OD2 3.4Å; R228-D230 PolarHBondContact NE-OD2 3.3Å; R228-D230 IonicContact NH2-OD1 3.48Å; R228-D230 PolarHBondContact NH2-OD1 3.23Å; R228-D230 IonicContact NH2-OD2 3.46Å; R228-D230 PolarHBondContact NH2-OD2 3.33Å
231	V	29	Very low	30.7	Very low	127 Å²	127	142.6 Å²	142.6	77%	0.77	74%	0.744	S	S	*	*			cis	-164.4	118.3	49.6	168.1	0	0	0	0	105.5
232	Q	27.4	Very low	30.9	Very low	170 Å²	170	145.2 Å²	145.2	79%	0.794	75%	0.751	S	S	*	*				72.5	141.2	88.4	-91.6	-174	36	0	0	117.6
233	P	26.1	Very low	30.6	Very low	118 Å²	118	145.1 Å²	145.1	77%	0.766	75%	0.75	S	S	*	*			trans	-113.3	160	-172.5	42	-33.9	0	0	0	116.2
234	I	31.1	Very low	30.6	Very low	170 Å²	170	143 Å²	143	87%	0.872	74%	0.744	S	S	*	*			trans	-145	151.6	173.9	-63.5	-173.8	0	0	0	111
235	P	28.5	Very low	30.6	Very low	108 Å²	108	145.4 Å²	145.4	70%	0.701	75%	0.749	S	S	*	*			trans	-133.3	162	-160.8	43.2	-27.2	0	0	0	120.2
236	L	26.9	Very low	30.6	Very low	166 Å²	166	141.2 Å²	141.2	87%	0.869	75%	0.748	S	S	*	*			trans	63.1	169.2	143.7	-89.7	167.1	0	0	0	123.5
237	I	30.6	Very low	30.5	Very low	143 Å²	143	139.7 Å²	139.7	73%	0.733	75%	0.747	S	S	*	*			trans	80	136	172.1	-70.8	166.8	0	0	0	114.8
238	E	32	Very low	30.6	Very low	162 Å²	162	142.7 Å²	142.7	76%	0.757	76%	0.757	S	S	*	*			cis	-137.4	-131.8	4.5	-156.5	71.4	-66.8	0	0	113.7
239	T	29.5	Very low	30.8	Very low	109 Å²	109	138.2 Å²	138.2	67%	0.669	76%	0.756	S	S	*	*			trans	-161.6	159.6	-175.9	-43.6	0	0	0	0	112.1
240	L	33.3	Very low	30.8	Very low	167 Å²	167	137.3 Å²	137.3	87%	0.874	75%	0.751	S	S	*	*			trans	-168.4	169.4	143.5	-105.5	166.6	0	0	0	112.8
241	N	30.6	Very low	30.8	Very low	128 Å²	128	144.4 Å²	144.4	68%	0.684	77%	0.772	S	S	*	*			trans	-128.9	-178.5	-154.4	-64.4	-58.7	0	0	0	116.5
242	T	35.5	Very low	31.1	Very low	139 Å²	139	146.5 Å²	146.5	85%	0.853	77%	0.774	S	S	*	*			trans	109.8	147.3	154.3	65.9	0	0	0	0	118.7
243	D	28.5	Very low	31.3	Very low	140 Å²	140	147.3 Å²	147.3	75%	0.749	78%	0.777	S	S	*	*			cis	-171.7	176.9	-29.8	-165.9	8.3	0	0	0	110.5
244	L	35.1	Very low	31.6	Very low	115 Å²	115	147 Å²	147	60%	0.602	78%	0.776	S	S	*	*			trans	86.7	110.1	159.5	-52.2	158.1	0	0	0	119.2
245	K	34.3	Very low	31.6	Very low	188 Å²	188	147.3 Å²	147.3	82%	0.817	78%	0.778	S	S	*	*				87	163.2	93.2	-78.3	179.3	-169.1	160.6	0	115.9
246	S	33.5	Very low	31.6	Very low	102 Å²	102	147.8 Å²	147.8	71%	0.713	78%	0.779	S	S	*	*			cis	172.2	157	-21.7	-179.2	0	0	0	0	109
247	S	32.6	Very low	31.8	Very low	97 Å²	97	146.3 Å²	146.3	68%	0.678	78%	0.776	S	S	*	*			cis	-173.9	176.2	-24.2	-75.5	0	0	0	0	110.5
248	Q	33.9	Very low	31.8	Very low	193 Å²	193	145 Å²	145	90%	0.902	77%	0.774	S	S	*	*			trans	74.8	154.5	167.4	-63.9	165.2	-25.8	0	0	118
249	S	28.4	Very low	31.9	Very low	107 Å²	107	142.3 Å²	142.3	75%	0.748	77%	0.773	S	S	*	*			cis	123	152.8	-4	-168.1	0	0	0	0	114.2
250	I	32.2	Very low	32.1	Very low	159 Å²	159	141.4 Å²	141.4	82%	0.815	77%	0.772	S	S	*	*			trans	111.1	149	-179.6	-65.7	158.6	0	0	0	114.2
251	R	28.1	Very low	32.2	Very low	224 Å²	224	138.4 Å²	138.4	85%	0.845	76%	0.763	S	S	*	*			cis	-173.7	-176	-41.9	-144.9	-179.3	-169.4	-166.4	1.2	109.9
252	E	35.4	Very low	32.4	Very low	172 Å²	172	140.1 Å²	140.1	80%	0.804	77%	0.768	S	S	*	*			trans	75.4	168	165.1	-65.1	162.6	-150.2	0	0	119.2
253	E	32.5	Very low	32.5	Very low	187 Å²	187	141.5 Å²	141.5	87%	0.874	76%	0.764	S	S	*	*				-152.1	168.3	-79.4	-111	-167.7	-177	0	0	111.5
254	P	31.7	Very low	32.9	Very low	112 Å²	112	140 Å²	140	73%	0.727	76%	0.76	S	S	*	*			trans	-105.9	175	-166.2	40.9	-37	0	0	0	117
255	L	31.7	Very low	32.8	Very low	176 Å²	176	141.6 Å²	141.6	92%	0.921	77%	0.768	S	S	*	*			trans	-138.5	172.2	171.4	-142.8	84.2	0	0	0	113.5
256	V	27.6	Very low	33.1	Very low	118 Å²	118	138.4 Å²	138.4	72%	0.715	77%	0.767	S	S	*	*			trans	-129.6	151.1	-155.1	171.5	0	0	0	0	113.3	V258	V256-V258 HydrophobicContact CG1-CG2 3.81Å
257	V	31.2	Very low	33.1	Very low	134 Å²	134	140.7 Å²	140.7	81%	0.812	77%	0.766	S	S	*	*			trans	-172.9	124.4	147.1	146.2	0	0	0	0	106
258	V	30.8	Very low	33.3	Very low	115 Å²	115	144.4 Å²	144.4	70%	0.697	78%	0.777	S	S	*	*			cis	85.4	129.8	40.4	176.5	0	0	0	0	111.8	V256	V256-V258 HydrophobicContact CG1-CG2 3.81Å
259	S	33.3	Very low	33.2	Very low	106 Å²	106	141.4 Å²	141.4	74%	0.741	77%	0.766	S	S	*	*			cis	-130.6	-143.3	4.9	-155.5	0	0	0	0	109.5
260	S	35.3	Very low	33.6	Very low	91 Å²	91	143.4 Å²	143.4	64%	0.636	77%	0.774	S	S	*	*			cis	-171.6	150.5	-1.4	25.4	0	0	0	0	110.6
261	C	34	Very low	33.6	Very low	103 Å²	103	140.6 Å²	140.6	70%	0.696	77%	0.769	S	S	*	*			trans	52.1	138.7	147.4	-53.9	0	0	0	0	121.2
262	E	35.7	Very low	33.9	Very low	165 Å²	165	135.9 Å²	135.9	77%	0.771	77%	0.767	S	S	*	*			cis	-171.8	172.7	-18	-131.7	71.6	-88	0	0	104.7
263	E	36.5	Very low	33.8	Very low	168 Å²	168	134.6 Å²	134.6	79%	0.785	76%	0.764	S	S	*	*			cis	-152.5	-177.7	-3.5	-145.6	-162.8	164.7	0	0	104.3
264	V	36.8	Very low	33.8	Very low	108 Å²	108	132.5 Å²	132.5	66%	0.655	76%	0.764	S	S	*	*			cis	-154.6	-179.3	-1.1	73	0	0	0	0	107.7
265	L	33.4	Very low	33.8	Very low	148 Å²	148	132.1 Å²	132.1	78%	0.775	76%	0.763	S	S	*	*			trans	-134.7	162.9	176	-75.7	170.5	0	0	0	112.1
266	P	40	Very low	33.9	Very low	121 Å²	121	131.9 Å²	131.9	79%	0.786	76%	0.761	S	S	*	*				-131.3	144.9	85.6	36.5	-25.4	0	0	0	112.6
267	E	34	Very low	34.2	Very low	150 Å²	150	130.9 Å²	130.9	70%	0.701	76%	0.759	S	S	*	*			cis	78.4	91	45.3	-165.6	-180	-128.6	0	0	115
268	I	37.7	Very low	34.4	Very low	176 Å²	176	133.8 Å²	133.8	90%	0.903	76%	0.764	S	S	*	*			trans	-139.6	131.4	142.3	-59.6	-174.9	0	0	0	107.9
269	L	31.3	Very low	34.6	Very low	129 Å²	129	134.6 Å²	134.6	68%	0.675	76%	0.764	S	S	*	*			trans	-100.8	146.3	-176.8	-70.5	154.9	0	0	0	112.4
270	T	37	Very low	34.6	Very low	149 Å²	149	136.4 Å²	136.4	91%	0.914	77%	0.765	S	S	*	*				-165.9	131.3	125.8	10.5	0	0	0	0	112.7
271	S	32.8	Very low	34.6	Very low	101 Å²	101	139.2 Å²	139.2	71%	0.706	77%	0.772	S	S	*	*			trans	-89.8	-174.5	-168.6	-37.9	0	0	0	0	112.5
272	P	33.9	Very low	34.6	Very low	125 Å²	125	140.4 Å²	140.4	81%	0.812	78%	0.776	S	S	*	*			cis	-134	163.5	-0.5	39.5	-21.8	0	0	0	117.1
273	I	33.3	Very low	34.4	Very low	145 Å²	145	138 Å²	138	74%	0.744	78%	0.777	S	S	*	*			trans	-99.3	135.8	166.2	-55.8	168.4	0	0	0	108.4	C275	I273-C275 PolarHBondContact O-N 3.05Å
274	T	32.8	Very low	34.3	Very low	143 Å²	143	139.7 Å²	139.7	88%	0.877	78%	0.782	S	S	*	*			trans	-81.4	89.3	162.5	43.5	0	0	0	0	110
275	C	30.5	Very low	34	Very low	103 Å²	103	143 Å²	143	70%	0.696	79%	0.79	S	S	*	*			trans	-78	131	170.9	-59	0	0	0	0	110.4	I273	I273-C275 PolarHBondContact O-N 3.05Å
276	I	33.6	Very low	33.7	Very low	171 Å²	171	141.4 Å²	141.4	88%	0.877	79%	0.791	S	S	*	*			trans	-105.9	127	155.5	-60.8	177.7	0	0	0	105.7
277	S	33.8	Very low	33.1	Very low	97 Å²	97	142.7 Å²	142.7	68%	0.678	79%	0.79	S	S	*	*			trans	-89.8	118.4	-170.2	55.5	0	0	0	0	112.7
278	E	35	Very low	32.9	Very low	195 Å²	195	141.1 Å²	141.1	91%	0.911	79%	0.793	S	S	*	*			trans	-77.2	130.5	152.2	-67.3	-169.7	134.8	0	0	108.7
279	N	35.3	Very low	32.3	Very low	133 Å²	133	137.9 Å²	137.9	71%	0.711	78%	0.781	S	S	*	*			trans	-132.2	116.8	-176.1	-122.5	-12	0	0	0	111.1
280	N	34.1	Very low	32.3	Very low	143 Å²	143	137 Å²	137	77%	0.765	78%	0.781	S	S	*	*			trans	52	85.4	159.8	-66.3	-42.8	0	0	0	119.9
281	I	34.7	Very low	31.9	Very low	151 Å²	151	135.7 Å²	135.7	77%	0.774	77%	0.773	S	S	*	*				-16.3	128.2	121.1	-23.2	173.3	0	0	0	114.1
282	T	33.9	Very low	31.8	Very low	127 Å²	127	135.9 Å²	135.9	78%	0.779	77%	0.769	S	S	*	*				161.2	108	113.7	40.4	0	0	0	0	115.5
283	S	31.3	Very low	31.7	Very low	114 Å²	114	139 Å²	139	80%	0.797	77%	0.766	S	S	*	*			trans	-152	104.9	142.6	58.3	0	0	0	0	107.4
284	K	34.8	Very low	31.5	Very low	204 Å²	204	138.2 Å²	138.2	89%	0.887	77%	0.768	S	S	*	*				55.2	58.6	75.2	-70.8	-163.6	175.3	-179.2	0	115
285	Q	30.7	Very low	31.7	Very low	178 Å²	178	138.5 Å²	138.5	83%	0.832	76%	0.764	S	S	*	*			trans	-145.7	107.2	134.8	-106.2	168.9	2.1	0	0	107.2
286	C	26.5	Very low	31.8	Very low	115 Å²	115	140.1 Å²	140.1	78%	0.777	77%	0.766	S	S	*	*				80.1	104.6	94	-72.9	0	0	0	0	112.2
287	L	28	Very low	32	Very low	148 Å²	148	137.1 Å²	137.1	78%	0.775	76%	0.756	S	S	*	*			trans	-62.3	134.2	163.8	-69.8	85.8	0	0	0	109	T289	L287-T289 PolarHBondContact O-N 3.47Å
288	P	29.5	Very low	32.3	Very low	116 Å²	116	139.9 Å²	139.9	75%	0.753	76%	0.763	S	S	*	*			trans	-77.6	78.2	155.8	33.5	-31.4	0	0	0	108.3	V290	P288-V290 HydrophobicContact CB-CG2 4.09Å; P288-V290 PolarHBondContact O-N 3.25Å
289	T	26.4	Very low	32.5	Very low	108 Å²	108	136.5 Å²	136.5	66%	0.663	75%	0.75	S	S	*	*			trans	-71.7	76.3	166.1	-59	0	0	0	0	108.5	L287 V291	L287-T289 PolarHBondContact O-N 3.47Å; T289-V291 HydrophobicContact CG2-CG2 4.26Å; T289-V291 PolarHBondContact O-N 2.89Å
290	V	31.2	Very low	32.8	Very low	111 Å²	111	138 Å²	138	67%	0.673	76%	0.758	S	S	*	*			trans	-77.9	72	177.5	-174.7	0	0	0	0	108.8	P288 T292	P288-V290 HydrophobicContact CB-CG2 4.09Å; P288-V290 PolarHBondContact O-N 3.25Å; V290-T292 WeakPolarHBondContact CG1-OG1 3.3Å; V290-T292 PolarHBondContact O-N 3.49Å
291	V	26.9	Very low	33.1	Very low	122 Å²	122	137.3 Å²	137.3	74%	0.739	76%	0.755	S	S	*	*			trans	-73.2	102.6	149.2	175.9	0	0	0	0	105.2	T289	T289-V291 HydrophobicContact CG2-CG2 4.26Å; T289-V291 PolarHBondContact O-N 2.89Å
292	T	32.1	Very low	33.6	Very low	104 Å²	104	138 Å²	138	64%	0.638	76%	0.76	S	S	*	*			trans	-136.1	99.2	174.8	-62.9	0	0	0	0	109.4	V290	V290-T292 WeakPolarHBondContact CG1-OG1 3.3Å; V290-T292 PolarHBondContact O-N 3.49Å
293	Y	31.6	Very low	34.1	Very low	191 Å²	191	138.6 Å²	138.6	75%	0.749	76%	0.758	S	S	*	*			trans	19.8	115.2	148.8	-62	-84.3	0	0	0	117.7	N295	Y293-N295 PolarHBondContact O-N 2.91Å; Y293-N295 VanDerWaalsContact O-N 3.15Å
294	V	29.3	Very low	34.9	Very low	129 Å²	129	140.5 Å²	140.5	78%	0.782	76%	0.759	S	S	*	*			trans	-53.6	115.7	143.7	178.1	0	0	0	0	107.5
295	N	36.6	Very low	35.5	Very low	149 Å²	149	136.1 Å²	136.1	80%	0.797	75%	0.746	S	S	*	*			trans	-127	135.8	163.1	-100.4	-17.2	0	0	0	107.2	Y293	Y293-N295 PolarHBondContact O-N 2.91Å; Y293-N295 VanDerWaalsContact O-N 3.15Å
296	N	32.8	Very low	36.3	Very low	137 Å²	137	135 Å²	135	73%	0.733	74%	0.738	S	S	*	*			trans	-90	-178.3	-173.5	-58.1	-36.4	0	0	0	111.3
297	V	38.5	Very low	37.1	Very low	108 Å²	108	135.8 Å²	135.8	66%	0.655	73%	0.734	S	S	*	*			trans	78.7	89.9	167.5	-165.6	0	0	0	0	114.6	L299	V297-L299 HydrophobicContact CG1-CD1 3.56Å; V297-L299 HydrophobicContact CG1-CG 3.86Å
298	D	38.5	Very low	37.5	Very low	154 Å²	154	135.2 Å²	135.2	82%	0.824	73%	0.732	S	S	*	*				-138	124.4	94.8	-77	-41.6	0	0	0	106
299	L	39.3	Very low	38	Very low	124 Å²	124	135.7 Å²	135.7	65%	0.649	73%	0.733	S	S	*	*				66.6	74.7	58.5	-68	176.2	0	0	0	114.1	V297	V297-L299 HydrophobicContact CG1-CD1 3.56Å; V297-L299 HydrophobicContact CG1-CG 3.86Å
300	D	42.3	Very low	38.4	Very low	165 Å²	165	138.7 Å²	138.7	88%	0.882	74%	0.739	S	S	*	*				-141.9	155	126.7	-105.3	-36.5	0	0	0	108.9
301	N	39.5	Very low	38.9	Very low	129 Å²	129	142.8 Å²	142.8	69%	0.69	75%	0.748	S	S	*	*			trans	-107.3	148.1	-169.4	-49.8	-89.3	0	0	0	111.5
302	D	46.6	Very low	39.3	Very low	165 Å²	165	143.8 Å²	143.8	88%	0.882	75%	0.749	S	S	*	*			trans	-157.5	133.4	146.4	-96.5	-32.9	0	0	0	108.1
303	D	44.2	Very low	39.4	Very low	140 Å²	140	147.1 Å²	147.1	75%	0.749	76%	0.762	S	S	*	*			trans	-69.6	168.4	-152.3	-59.4	-52.8	0	0	0	119.3
304	D	48.3	Very low	39.4	Very low	153 Å²	153	142.7 Å²	142.7	82%	0.818	76%	0.759	S	S	*	*			trans	59.1	132.5	158.5	-61	-27.2	0	0	0	119.3
305	D	46.8	Very low	39.6	Very low	112 Å²	112	142.8 Å²	142.8	60%	0.599	76%	0.762	S	S	*	*			cis	-157.8	135.3	24.7	-151.2	10.1	0	0	0	115.6
306	K	46.8	Very low	39.4	Very low	156 Å²	156	143.9 Å²	143.9	68%	0.678	77%	0.766	S	S	*	*			trans	54.8	131	154.1	-74.5	165.2	-163.6	80.2	0	125.3
307	D	43.9	Very low	39.2	Very low	130 Å²	130	145 Å²	145	70%	0.695	77%	0.766	S	S	*	*			trans	62.1	104.9	145	-57.9	-34.9	0	0	0	121.4
308	N	35.9	Very low	38.7	Very low	137 Å²	137	148.4 Å²	148.4	73%	0.733	77%	0.772	S	S	*	*				60.8	128.5	73.7	-67.9	-54	0	0	0	114.5
309	T	41	Very low	38.4	Very low	126 Å²	126	146 Å²	146	77%	0.773	77%	0.768	S	S	*	*				-161.9	142	54.9	-54.7	0	0	0	0	112.9
310	H	34	Very low	37.9	Very low	170 Å²	170	147 Å²	147	79%	0.787	78%	0.779	S	S	*	*			trans	-90.3	144.4	172.5	-76.9	-96.1	0	0	0	114.4
311	K	41.6	Very low	37.3	Very low	197 Å²	197	144.1 Å²	144.1	86%	0.857	77%	0.769	S	S	*	*			trans	-145	108.7	147.3	-64.7	-172.4	-179	176.9	0	108.3
312	N	35.4	Very low	36.9	Very low	144 Å²	144	143.1 Å²	143.1	77%	0.77	77%	0.772	S	S	*	*				60.7	106.7	75.9	-78.5	-16.9	0	0	0	115.4
313	I	34.5	Very low	35.9	Very low	174 Å²	174	142.9 Å²	142.9	89%	0.892	77%	0.77	S	S	*	*			trans	-156.3	141	137.7	-94.4	146.3	0	0	0	106.8
314	S	31.2	Very low	35.3	Very low	98 Å²	98	145.4 Å²	145.4	69%	0.685	78%	0.777	S	S	*	*			trans	-110.5	159.1	-174.3	-59.6	0	0	0	0	111.7
315	P	33.7	Very low	34.2	Very low	131 Å²	131	146.6 Å²	146.6	85%	0.851	78%	0.778	S	S	*	*			trans	-78.9	149.3	-170.4	31.8	-36.1	0	0	0	113.6
316	I	33.5	Very low	33.4	Very low	171 Å²	171	146.9 Å²	146.9	88%	0.877	79%	0.789	S	S	*	*			trans	-128.9	145.4	171.6	-64.5	-178.9	0	0	0	109.5
317	H	28.1	Very low	32.4	Very low	161 Å²	161	144.5 Å²	144.5	75%	0.745	79%	0.791	S	S	*	*			trans	-85.6	144.9	-172.5	-148.4	-105.3	0	0	0	111.7
318	F	28	Very low	31.5	Very low	179 Å²	179	145.9 Å²	145.9	79%	0.785	80%	0.797	S	S	*	*			trans	155.8	135	132.6	-98.2	-86.1	0	0	0	115.2
319	S	31.4	Very low	31.1	Very low	105 Å²	105	143.5 Å²	143.5	73%	0.734	79%	0.791	S	S	*	*			trans	33.2	131.2	153.4	-59.4	0	0	0	0	124.1
320	V	28.8	Very low	30.4	Very low	143 Å²	143	144.4 Å²	144.4	87%	0.867	80%	0.795	S	S	*	*			trans	-71.8	139.8	170.4	177.9	0	0	0	0	112.1
321	P	29.5	Very low	30.2	Very low	105 Å²	105	143 Å²	143	68%	0.682	79%	0.794	S	S	*	*				-143.1	156.1	122.3	37.4	-24.5	0	0	0	115.9
322	S	31.3	Very low	29.5	Very low	109 Å²	109	143.1 Å²	143.1	76%	0.762	79%	0.794	S	S	*	*			trans	71.5	143.5	158.7	71.1	0	0	0	0	120.6
323	L	25.9	Very low	29	Very low	160 Å²	160	141.8 Å²	141.8	84%	0.838	80%	0.796	S	S	*	*			trans	-68.1	141.9	165.5	-86.8	61.1	0	0	0	110.2
324	Q	31.6	Very low	28.8	Very low	192 Å²	192	138.4 Å²	138.4	90%	0.897	79%	0.788	S	S	*	*			trans	-110.5	115.2	147.2	-78.2	-160.8	-19.9	0	0	110.2	S326	Q324-S326 PolarHBondContact O-N 3.43Å
325	Q	26.4	Very low	28.7	Very low	178 Å²	178	139.7 Å²	139.7	83%	0.832	79%	0.791	S	S	*	*			trans	-87.7	92.1	179.8	-172.8	175.3	33.3	0	0	108.7	C327	Q325-C327 PolarHBondContact O-N 3.41Å; Q325-C327 VanDerWaalsContact O-N 3.16Å
326	S	28.8	Very low	28.5	Very low	119 Å²	119	138.9 Å²	138.9	83%	0.832	78%	0.784	S	S	*	*			trans	-77.9	104	-177.9	64.9	0	0	0	0	112	Q324	Q324-S326 PolarHBondContact O-N 3.43Å
327	C	26.2	Very low	28.2	Very low	105 Å²	105	136 Å²	136	71%	0.709	77%	0.77	S	S	*	*			trans	-36.8	143.3	173.5	-53.1	0	0	0	0	116.8	Q325	Q325-C327 PolarHBondContact O-N 3.41Å; Q325-C327 VanDerWaalsContact O-N 3.16Å
328	I	24.4	Very low	28.3	Very low	160 Å²	160	131.4 Å²	131.4	82%	0.821	76%	0.756	S	S	*	*			trans	46.6	111.7	130.8	-51.5	166.8	0	0	0	117.6
329	S	27.2	Very low	28.4	Very low	87 Å²	87	130.7 Å²	130.7	61%	0.608	75%	0.753	S	S	*	*			trans	-154	107.6	143.1	178.5	0	0	0	0	112.2	N331	S329-N331 PolarHBondContact O-N 2.89Å; S329-N331 PolarHBondContact OG-ND2 3Å
330	V	26.2	Very low	28.3	Very low	144 Å²	144	133.1 Å²	133.1	87%	0.873	76%	0.758	S	S	*	*			trans	-88.8	81.7	165.6	-178	0	0	0	0	108.2
331	N	30.9	Very low	28.4	Very low	141 Å²	141	132.8 Å²	132.8	75%	0.754	75%	0.749	S	S	*	*			trans	-103.8	119.7	178.5	-91.9	-14.7	0	0	0	112.1	S329	S329-N331 PolarHBondContact O-N 2.89Å; S329-N331 PolarHBondContact OG-ND2 3Å
332	K	26	Very low	28.4	Very low	200 Å²	200	135.1 Å²	135.1	87%	0.87	76%	0.756	S	S	*	*			trans	-74.9	167.5	159.5	-68	175.6	175.6	175.8	0	109.7
333	S	25.5	Very low	28.4	Very low	115 Å²	115	138.5 Å²	138.5	80%	0.804	76%	0.76	S	S	*	*			trans	76	134.6	-177	-148.6	0	0	0	0	112.3
334	S	30.9	Very low	28.4	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	76%	0.76	S	S	*	*			cis	-96.6	134.8	27.9	55.7	0	0	0	0	116.9	V336	S334-V336 PolarHBondContact O-N 3.09Å
335	V	27.9	Very low	28.4	Very low	125 Å²	125	134.9 Å²	134.9	76%	0.758	75%	0.751	S	S	*	*			trans	-72.7	115.7	159.6	173	0	0	0	0	109.1	D337	V335-D337 HydrophobicContact CG1-CB 3.91Å
336	V	30.9	Very low	28.7	Very low	114 Å²	114	133.4 Å²	133.4	69%	0.691	75%	0.754	S	S	*	*			trans	-106.1	93.5	158.8	179.8	0	0	0	0	106.7	S334 S338	S334-V336 PolarHBondContact O-N 3.09Å; V336-S338 VanDerWaalsContact C-N 3.29Å; V336-S338 PolarHBondContact O-N 2.87Å
337	D	25.7	Very low	28.7	Very low	111 Å²	111	132.7 Å²	132.7	59%	0.594	75%	0.749	S	S	*	*			trans	-78.6	77.1	-177.6	-168.2	0.2	0	0	0	110.4	V335 K339	V335-D337 HydrophobicContact CG1-CB 3.91Å; D337-K339 WeakPolarHBondContact OD1-CE 3.49Å; D337-K339 WeakPolarHBondContact OD1-CG 3.45Å; D337-K339 IonicContact OD1-NZ 2.62Å; D337-K339 PolarHBondContact OD1-NZ 3.42Å; D337-K339 IonicContact OD2-NZ 3.15Å; D337-K339 PolarHBondContact OD2-NZ 3.29Å
338	S	31.2	Very low	29	Very low	65 Å²	65	135.3 Å²	135.3	46%	0.455	76%	0.756	S	S	.	*			trans	-113	77	176.9	58.5	0	0	0	0	111.2	V336 N340	V336-S338 VanDerWaalsContact C-N 3.29Å; V336-S338 PolarHBondContact O-N 2.87Å; S338-N340 PolarHBondContact O-N 3.05Å
339	K	29.8	Very low	29.3	Very low	163 Å²	163	134.8 Å²	134.8	71%	0.709	75%	0.754	S	S	*	*			trans	-64.1	67.8	173	-64.3	169.6	178.8	97.7	0	112.4	D337	D337-K339 WeakPolarHBondContact OD1-CE 3.49Å; D337-K339 WeakPolarHBondContact OD1-CG 3.45Å; D337-K339 IonicContact OD1-NZ 2.62Å; D337-K339 PolarHBondContact OD1-NZ 3.42Å; D337-K339 IonicContact OD2-NZ 3.15Å; D337-K339 PolarHBondContact OD2-NZ 3.29Å
340	N	29.8	Very low	29.5	Very low	157 Å²	157	135.7 Å²	135.7	84%	0.84	76%	0.755	S	S	*	*			trans	-176.9	57.8	167.7	-96.2	-37.2	0	0	0	112.6	S338	S338-N340 PolarHBondContact O-N 3.05Å
341	I	30.8	Very low	29.8	Very low	135 Å²	135	136.5 Å²	136.5	69%	0.692	76%	0.755	S	S	*	*			trans	-124.7	28.3	168.8	-36.6	-176.2	0	0	0	111.7
342	D	29.8	Very low	29.7	Very low	154 Å²	154	134.5 Å²	134.5	82%	0.824	75%	0.752	S	S	*	*	S	Bend	trans	-116.7	42.5	167.6	-93.4	-44.5	0	0	0	110.6
343	Q	30.2	Very low	29.9	Very low	180 Å²	180	129.8 Å²	129.8	84%	0.841	74%	0.744	S	S	*	*	S	Bend	trans	-179.2	69.7	164.3	-105.3	152.5	101.1	0	0	113.4
344	L	27.2	Very low	30.1	Very low	160 Å²	160	130 Å²	130	84%	0.838	75%	0.746	S	S	*	*			trans	-168.8	139.4	162.9	-126.2	79.4	0	0	0	106.7
345	V	31.5	Very low	30.4	Very low	116 Å²	116	130.1 Å²	130.1	70%	0.703	75%	0.746	S	S	*	*	S	Bend	cis	-138.5	116.6	4.8	176.6	0	0	0	0	109.7
346	V	31.2	Very low	30.9	Very low	147 Å²	147	133 Å²	133	89%	0.891	75%	0.749	S	S	*	*			trans	-149.9	93.6	135.3	-177.3	0	0	0	0	107.2
347	S	29.3	Very low	31.2	Very low	104 Å²	104	134.4 Å²	134.4	73%	0.727	75%	0.752	S	S	*	*			trans	-123.9	105.5	178.8	-70.7	0	0	0	0	110.9
348	N	32	Very low	31.6	Very low	160 Å²	160	138.6 Å²	138.6	86%	0.856	77%	0.765	S	S	*	*			trans	-165.6	133.9	160.2	-88	-39.8	0	0	0	106.3
349	L	31.6	Very low	31.8	Very low	150 Å²	150	144.2 Å²	144.2	79%	0.785	78%	0.784	S	S	*	*			cis	-147.8	122.2	8	177.6	65.4	0	0	0	111.9
350	V	31.6	Very low	31.7	Very low	106 Å²	106	146.9 Å²	146.9	64%	0.642	79%	0.791	S	S	*	*			trans	8.3	123.3	150.9	-179.7	0	0	0	0	119.3
351	N	32.5	Very low	32	Very low	161 Å²	161	145.7 Å²	145.7	86%	0.861	79%	0.789	S	S	*	*				-160.7	145.7	115.3	-105.4	-55	0	0	0	114.3
352	S	27.9	Very low	32	Very low	98 Å²	98	144.4 Å²	144.4	69%	0.685	79%	0.788	S	S	*	*			trans	-74.6	171.3	-165.7	-49.1	0	0	0	0	114.4
353	S	30.2	Very low	32.3	Very low	101 Å²	101	144.8 Å²	144.8	71%	0.706	79%	0.79	S	S	*	*			cis	-163.6	149.1	26.8	-40.5	0	0	0	0	114.6
354	S	30.3	Very low	32.4	Very low	120 Å²	120	141.2 Å²	141.2	84%	0.839	78%	0.781	S	S	*	*			trans	63	150.4	148.5	69.2	0	0	0	0	119.8
355	S	37.9	Very low	32.6	Very low	105 Å²	105	140.8 Å²	140.8	73%	0.734	78%	0.778	S	S	*	*			cis	-152.5	151.2	5.6	58.4	0	0	0	0	113.8
356	K	37.5	Very low	32.7	Very low	186 Å²	186	141.8 Å²	141.8	81%	0.809	78%	0.779	S	S	*	*			trans	20.3	138	136.2	-61.3	179.3	-177	178.5	0	118.8
357	N	37.1	Very low	32.9	Very low	144 Å²	144	143 Å²	143	77%	0.77	77%	0.774	S	S	*	*			cis	-157.5	173.9	19.9	-116.7	-0.8	0	0	0	113.7
358	K	35	Very low	33.2	Very low	199 Å²	199	146.2 Å²	146.2	87%	0.865	78%	0.778	S	S	*	*			trans	-51.2	156.8	174.7	-56.6	177.9	178.2	-178.3	0	113.3
359	E	33.7	Very low	33.3	Very low	182 Å²	182	145 Å²	145	85%	0.85	77%	0.771	S	S	*	*				-155.6	162.6	71.2	-167.7	151	-127.8	0	0	114.3
360	Y	27.9	Very low	33.7	Very low	219 Å²	219	146.1 Å²	146.1	86%	0.859	77%	0.772	S	S	*	*			trans	-132.5	135.5	-177.2	-115.1	-94.8	0	0	0	109.4
361	V	35.8	Very low	33.8	Very low	132 Å²	132	148 Å²	148	80%	0.8	77%	0.774	S	S	*	*			trans	-130.7	131.5	167.1	178.6	0	0	0	0	108.3
362	V	31.9	Very low	34.1	Very low	108 Å²	108	148.9 Å²	148.9	66%	0.655	78%	0.776	S	S	*	*			trans	-101.8	137.3	177.1	174.4	0	0	0	0	108.8	T364	V362-T364 HydrophobicContact CG1-CG2 4.14Å
363	N	35.5	Very low	34.7	Very low	163 Å²	163	150.8 Å²	150.8	87%	0.872	78%	0.775	S	S	*	*			trans	-135.4	155.4	154	-99.8	-19.3	0	0	0	108.5
364	T	31.6	Very low	35.4	Very low	105 Å²	105	149.9 Å²	149.9	64%	0.644	77%	0.768	S	S	*	*			trans	-125.1	168.3	-166.9	51.2	0	0	0	0	111.3	V362	V362-T364 HydrophobicContact CG1-CG2 4.14Å
365	I	33.1	Very low	36.2	Very low	151 Å²	151	148.2 Å²	148.2	77%	0.774	76%	0.762	S	S	*	*			trans	75.6	138.5	175.8	-48.8	162	0	0	0	110.1
366	D	33.2	Very low	36.6	Very low	137 Å²	137	153.7 Å²	153.7	73%	0.733	77%	0.766	S	S	*	*			cis	-138	-177	19.1	-141.9	-31.6	0	0	0	113.9
367	H	35.3	Very low	37.2	Very low	172 Å²	172	147.8 Å²	147.8	80%	0.796	75%	0.747	S	S	*	*			trans	-68.3	127.3	170.2	-69.7	-94.4	0	0	0	113.1
368	H	35.4	Very low	37.9	Very low	172 Å²	172	146.9 Å²	146.9	80%	0.796	74%	0.738	S	S	*	*			trans	-167.4	169.4	136.5	-111.3	-52	0	0	0	113.6
369	D	33.9	Very low	38.9	Very low	134 Å²	134	143.4 Å²	143.4	72%	0.717	73%	0.728	S	S	*	*			trans	-85.6	110.2	-162.9	-47.8	-100.3	0	0	0	113.3
370	H	40.1	Very low	40.4	Very low	173 Å²	173	138.2 Å²	138.2	80%	0.801	71%	0.709	S	S	*	*			trans	-136	86.8	167	-80.2	-52.1	0	0	0	113.4	I372	H370-I372 PolarHBondContact O-N 3.1Å
371	E	33.3	Very low	41.7	Very low	145 Å²	145	136.2 Å²	136.2	68%	0.678	70%	0.7	S	S	*	*				30	92.5	129.8	-171.3	168.7	-142.9	0	0	117.5	Q373	E371-Q373 HydrophobicContact CG-CB 4.2Å; E371-Q373 HydrophobicContact CG-CG 3.75Å; E371-Q373 PolarHBondContact O-N 2.92Å; E371-Q373 PolarHBondContact OE1-NE2 3.28Å
372	I	40.4	Very low	42.8	Very low	180 Å²	180	134.7 Å²	134.7	92%	0.923	68%	0.684	S	S	*	*			trans	-78.1	70.4	171.1	-52.1	-179.6	0	0	0	110	H370 S374	H370-I372 PolarHBondContact O-N 3.1Å; I372-S374 PolarHBondContact O-N 2.74Å
373	Q	39.4	Very low	43.9	Very low	139 Å²	139	132.5 Å²	132.5	65%	0.65	68%	0.677	S	S	*	*			trans	-72.4	119.8	175.1	-102.1	-167.9	46	0	0	112.2	E371 A375	E371-Q373 HydrophobicContact CG-CB 4.2Å; E371-Q373 HydrophobicContact CG-CG 3.75Å; E371-Q373 PolarHBondContact O-N 2.92Å; E371-Q373 PolarHBondContact OE1-NE2 3.28Å; Q373-A375 PolarHBondContact O-N 3.23Å
374	S	44.3	Very low	45	Very low	81 Å²	81	133.9 Å²	133.9	57%	0.566	67%	0.67	S	S	*	*			trans	64.9	46.7	136.2	-141.3	0	0	0	0	119.2	I372 R376 P377	I372-S374 PolarHBondContact O-N 2.74Å; S374-R376 PolarHBondContact O-N 2.94Å; S374-P377 VanDerWaalsContact O-CD 3.23Å; S374-P377 WeakPolarHBondContact O-CD 3.36Å; S374-P377 WeakPolarHBondContact OG-CD 3.34Å; S374-P377 WeakPolarHBondContact OG-CG 3.4Å
375	A	48.7	Very low	46.4	Very low	86 Å²	86	135.8 Å²	135.8	71%	0.711	68%	0.675	S	S	*	*	S	Bend	trans	-66.5	-26.5	162.6	0	0	0	0	0	113.1	Q373 H378	Q373-A375 PolarHBondContact O-N 3.23Å; A375-H378 PolarHBondContact O-N 3.46Å
376	R	46.1	Very low	47.8	Very low	219 Å²	219	135.1 Å²	135.1	83%	0.826	67%	0.674	S	S	*	*	H	α-helix	trans	-61.7	-39.1	-170	-141.6	173.4	-170.4	175.3	3.1	115.5	S374 H378 V380	S374-R376 PolarHBondContact O-N 2.94Å; R376-H378 VanDerWaalsContact C-N 3.33Å; R376-H378 PolarHBondContact O-N 3.25Å; R376-V380 WeakPolarHBondContact O-CG2 3.47Å
377	P	48.8	Very low	48.8	Very low	62 Å²	62	132.2 Å²	132.2	40%	0.403	66%	0.664	S	S	.	*	H	α-helix	trans	-68.9	-27.5	179.7	-20.6	34.3	0	0	0	114	S374 V380 R381	S374-P377 VanDerWaalsContact O-CD 3.23Å; S374-P377 WeakPolarHBondContact O-CD 3.36Å; S374-P377 WeakPolarHBondContact OG-CD 3.34Å; S374-P377 WeakPolarHBondContact OG-CG 3.4Å; P377-V380 PolarHBondContact O-N 3.27Å; P377-R381 WeakPolarHBondContact O-CG 3.4Å; P377-R381 PolarHBondContact O-N 3.32Å; P377-R381 VanDerWaalsContact O-N 3.09Å
378	H	53.2	Low	50.2	Low	125 Å²	125	133 Å²	133	58%	0.579	67%	0.665	S	S	*	*	H	α-helix	trans	-72.2	-42.6	-174.4	-145.7	-86.5	0	0	0	111.6	A375 R376 V380 R381 Q382	A375-H378 PolarHBondContact O-N 3.46Å; R376-H378 VanDerWaalsContact C-N 3.33Å; R376-H378 PolarHBondContact O-N 3.25Å; H378-V380 VanDerWaalsContact C-N 3.33Å; H378-V380 PolarHBondContact O-N 2.91Å; H378-R381 PolarHBondContact O-N 3Å; H378-Q382 PolarHBondContact O-N 3.44Å
379	L	56.3	Low	51.1	Low	127 Å²	127	129.7 Å²	129.7	67%	0.665	66%	0.659	S	S	*	*	H	α-helix	trans	-59.5	-42.6	173	-127.3	71.8	0	0	0	111.9	R381 Q382 A383	L379-R381 VanDerWaalsContact C-N 3.31Å; L379-R381 PolarHBondContact O-N 3.46Å; L379-Q382 PolarHBondContact O-N 2.92Å; L379-A383 PolarHBondContact O-N 3.05Å
380	V	63.6	Low	51.9	Low	72 Å²	72	131.4 Å²	131.4	44%	0.436	67%	0.666	S	S	.	*	H	α-helix	trans	-66.5	-31.2	178.1	176.2	0	0	0	0	111.9	R376 P377 H378 R384	R376-V380 WeakPolarHBondContact O-CG2 3.47Å; P377-V380 PolarHBondContact O-N 3.27Å; H378-V380 VanDerWaalsContact C-N 3.33Å; H378-V380 PolarHBondContact O-N 2.91Å; V380-R384 VanDerWaalsContact O-CG 3.31Å; V380-R384 WeakPolarHBondContact O-CG 3.49Å; V380-R384 PolarHBondContact O-N 3.39Å
381	R	56.6	Low	52.3	Low	177 Å²	177	129 Å²	129	67%	0.668	66%	0.658	S	S	*	*	H	α-helix	trans	-69.4	-43.6	171.6	-73.4	-177.7	-177	-149.9	3.2	111.9	P377 H378 L379 R384 L385	P377-R381 WeakPolarHBondContact O-CG 3.4Å; P377-R381 PolarHBondContact O-N 3.32Å; P377-R381 VanDerWaalsContact O-N 3.09Å; H378-R381 PolarHBondContact O-N 3Å; L379-R381 VanDerWaalsContact C-N 3.31Å; L379-R381 PolarHBondContact O-N 3.46Å; R381-R384 PolarHBondContact O-N 2.87Å; R381-L385 WeakPolarHBondContact O-CG 3.36Å; R381-L385 PolarHBondContact O-N 3.29Å; R381-L385 VanDerWaalsContact O-N 3.11Å
382	Q	58.1	Low	52.6	Low	100 Å²	100	127.1 Å²	127.1	47%	0.467	65%	0.653	S	S	.	*	H	α-helix	trans	-63.4	-43.4	177.1	-74.8	175.4	-33.7	0	0	112.4	H378 L379 R384 L385 N386	H378-Q382 PolarHBondContact O-N 3.44Å; L379-Q382 PolarHBondContact O-N 2.92Å; Q382-R384 VanDerWaalsContact C-N 3.27Å; Q382-R384 PolarHBondContact O-N 3.43Å; Q382-L385 PolarHBondContact O-N 3.14Å; Q382-L385 VanDerWaalsContact O-N 3.1Å; Q382-N386 PolarHBondContact O-N 2.87Å
383	A	55.4	Low	52.9	Low	62 Å²	62	123.2 Å²	123.2	51%	0.512	64%	0.637	S	S	.	*	H	α-helix	trans	-58.9	-36.7	175.1	0	0	0	0	0	112.9	L379 S387	L379-A383 PolarHBondContact O-N 3.05Å; A383-S387 PolarHBondContact O-N 3.4Å; A383-S387 PolarHBondContact O-OG 3.38Å
384	R	57.9	Low	53.4	Low	192 Å²	192	120.9 Å²	120.9	73%	0.725	64%	0.637	S	S	*	*	H	α-helix	trans	-74.8	-20.9	176.4	-75.2	175.7	175	-178.5	-0.9	114.6	V380 R381 Q382 S387	V380-R384 VanDerWaalsContact O-CG 3.31Å; V380-R384 WeakPolarHBondContact O-CG 3.49Å; V380-R384 PolarHBondContact O-N 3.39Å; R381-R384 PolarHBondContact O-N 2.87Å; Q382-R384 VanDerWaalsContact C-N 3.27Å; Q382-R384 PolarHBondContact O-N 3.43Å; R384-S387 WeakPolarHBondContact CA-OG 3.39Å; R384-S387 PolarHBondContact O-OG 3.13Å
385	L	60.7	Low	53.6	Low	145 Å²	145	121.6 Å²	121.6	76%	0.759	64%	0.642	S	S	*	*	H	α-helix	trans	-86.6	-29.3	174.9	-70.6	168.2	0	0	0	112	R381 Q382	R381-L385 WeakPolarHBondContact O-CG 3.36Å; R381-L385 PolarHBondContact O-N 3.29Å; R381-L385 VanDerWaalsContact O-N 3.11Å; Q382-L385 PolarHBondContact O-N 3.14Å; Q382-L385 VanDerWaalsContact O-N 3.1Å
386	N	62.3	Low	53.3	Low	138 Å²	138	125.4 Å²	125.4	74%	0.738	64%	0.642	S	S	*	*	H	α-helix	trans	-85.4	-18	179.3	-67.4	-10.3	0	0	0	113.6	Q382 K388	Q382-N386 PolarHBondContact O-N 2.87Å; N386-K388 PolarHBondContact O-N 3.45Å
387	S	55.8	Low	53	Low	75 Å²	75	122.3 Å²	122.3	52%	0.524	64%	0.639	S	S	.	*	S	Bend	trans	-78.3	105.3	175.4	35	0	0	0	0	111	A383 R384	A383-S387 PolarHBondContact O-N 3.4Å; A383-S387 PolarHBondContact O-OG 3.38Å; R384-S387 WeakPolarHBondContact CA-OG 3.39Å; R384-S387 PolarHBondContact O-OG 3.13Å
388	K	63.1	Low	52.7	Low	188 Å²	188	127.4 Å²	127.4	82%	0.817	66%	0.657	S	S	*	*			trans	-58.9	133.8	170	-67.7	179.9	179.9	176.4	0	109.6	N386 I390	N386-K388 PolarHBondContact O-N 3.45Å; K388-I390 PolarHBondContact O-N 3.15Å
389	P	55.8	Low	51.9	Low	104 Å²	104	126.3 Å²	126.3	68%	0.675	66%	0.664	S	S	*	*			trans	-66.2	124.5	173.1	27.5	-33.2	0	0	0	109.6	I391	P389-I391 VanDerWaalsContact C-N 3.32Å; P389-I391 HydrophobicContact CB-CG1 4.4Å; P389-I391 PolarHBondContact O-N 2.92Å
390	I	51.1	Low	50.8	Low	170 Å²	170	129.6 Å²	129.6	87%	0.872	67%	0.673	S	S	*	*			trans	-75.3	90.8	169.5	-57	176.3	0	0	0	106.9	K388 D392	K388-I390 PolarHBondContact O-N 3.15Å; I390-D392 PolarHBondContact O-N 3.48Å
391	I	46.8	Very low	49.7	Very low	121 Å²	121	131.8 Å²	131.8	62%	0.621	69%	0.687	S	S	*	*			trans	-77.5	104.1	172.3	-58.5	176.6	0	0	0	107.1	P389 T393	P389-I391 VanDerWaalsContact C-N 3.32Å; P389-I391 HydrophobicContact CB-CG1 4.4Å; P389-I391 PolarHBondContact O-N 2.92Å; I391-T393 HydrophobicContact CG2-CG2 4.11Å; I391-T393 PolarHBondContact O-N 2.94Å
392	D	40.6	Very low	48.6	Very low	107 Å²	107	129 Å²	129	57%	0.572	69%	0.689	S	S	*	*			trans	-71.1	96.1	171.1	-171.8	-12.4	0	0	0	109.6	I390 S394	I390-D392 PolarHBondContact O-N 3.48Å; D392-S394 PolarHBondContact O-N 3.41Å; D392-S394 WeakPolarHBondContact OD1-CB 3.47Å; D392-S394 PolarHBondContact OD1-N 2.92Å; D392-S394 PolarHBondContact OD1-OG 3.24Å
393	T	45.9	Very low	47.3	Very low	97 Å²	97	133 Å²	133	60%	0.595	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-73.9	-8.3	-178.2	51.6	0	0	0	0	113.4	I391 S395 F396	I391-T393 HydrophobicContact CG2-CG2 4.11Å; I391-T393 PolarHBondContact O-N 2.94Å; T393-S395 PolarHBondContact O-N 3.44Å; T393-F396 PolarHBondContact O-N 2.97Å; T393-F396 VanDerWaalsContact O-N 3.12Å
394	S	51.3	Low	46.4	Very low	91 Å²	91	136 Å²	136	64%	0.636	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-61.2	-29.6	179.8	70.1	0	0	0	0	112.8	D392 F396	D392-S394 PolarHBondContact O-N 3.41Å; D392-S394 WeakPolarHBondContact OD1-CB 3.47Å; D392-S394 PolarHBondContact OD1-N 2.92Å; D392-S394 PolarHBondContact OD1-OG 3.24Å; S394-F396 VanDerWaalsContact C-N 3.35Å; S394-F396 PolarHBondContact O-N 3.39Å
395	S	46.8	Very low	45.1	Very low	96 Å²	96	133 Å²	133	67%	0.671	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-79.3	-8.5	178.8	-170.5	0	0	0	0	114.8	T393	T393-S395 PolarHBondContact O-N 3.44Å
396	F	42.5	Very low	43.9	Very low	166 Å²	166	132.9 Å²	132.9	73%	0.728	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-108.8	4.9	-171.6	-80.2	-83.3	0	0	0	114.8	T393 S394	T393-F396 PolarHBondContact O-N 2.97Å; T393-F396 VanDerWaalsContact O-N 3.12Å; S394-F396 VanDerWaalsContact C-N 3.35Å; S394-F396 PolarHBondContact O-N 3.39Å
397	M	41.4	Very low	42.4	Very low	154 Å²	154	132.7 Å²	132.7	76%	0.759	73%	0.73	S	S	*	*			trans	-94.7	2.4	179.9	-69.9	-85.6	77.3	0	0	114.8	S399	M397-S399 PolarHBondContact O-N 3.49Å; M397-S399 VanDerWaalsContact O-N 3.13Å
398	E	40.5	Very low	41.4	Very low	168 Å²	168	139.2 Å²	139.2	79%	0.785	75%	0.749	S	S	*	*	S	Bend	trans	-68.9	111.9	172.5	-172	155.9	-143.2	0	0	110.3	F400	E398-F400 WeakPolarHBondContact O-CD2 3.38Å; E398-F400 PolarHBondContact O-N 3Å; E398-F400 VanDerWaalsContact O-N 3.11Å
399	S	37.1	Very low	40	Very low	102 Å²	102	138.5 Å²	138.5	71%	0.713	75%	0.748	S	S	*	*			trans	-73.4	105.7	-167.2	-65.2	0	0	0	0	112.3	M397 V401	M397-S399 PolarHBondContact O-N 3.49Å; M397-S399 VanDerWaalsContact O-N 3.13Å; S399-V401 VanDerWaalsContact C-N 3.31Å; S399-V401 PolarHBondContact O-N 2.85Å
400	F	34.4	Very low	39.1	Very low	196 Å²	196	143.6 Å²	143.6	86%	0.86	76%	0.76	S	S	*	*			trans	-64.3	83.9	171.8	-75.7	-90.3	0	0	0	112	E398 V402	E398-F400 WeakPolarHBondContact O-CD2 3.38Å; E398-F400 PolarHBondContact O-N 3Å; E398-F400 VanDerWaalsContact O-N 3.11Å; F400-V402 VanDerWaalsContact C-N 3.32Å; F400-V402 PolarHBondContact O-N 3.17Å
401	V	38.5	Very low	38.5	Very low	119 Å²	119	144.7 Å²	144.7	72%	0.721	76%	0.758	S	S	*	*			trans	-73.1	86.6	172.4	-177.7	0	0	0	0	109.6	S399 K403	S399-V401 VanDerWaalsContact C-N 3.31Å; S399-V401 PolarHBondContact O-N 2.85Å; V401-K403 PolarHBondContact O-N 3.13Å; V401-K403 VanDerWaalsContact O-N 3.11Å
402	V	34.2	Very low	37.9	Very low	119 Å²	119	148.3 Å²	148.3	72%	0.721	77%	0.769	S	S	*	*			trans	-62.3	109.2	173.9	177.3	0	0	0	0	109.8	F400 T404	F400-V402 VanDerWaalsContact C-N 3.32Å; F400-V402 PolarHBondContact O-N 3.17Å; V402-T404 HydrophobicContact CG1-CG2 4.25Å; V402-T404 PolarHBondContact O-N 3.15Å
403	K	31	Very low	38	Very low	183 Å²	183	153.3 Å²	153.3	80%	0.796	79%	0.786	S	S	*	*			trans	-84.3	88.9	173.8	-69.6	177.5	-179.4	170.9	0	110.7	V401	V401-K403 PolarHBondContact O-N 3.13Å; V401-K403 VanDerWaalsContact O-N 3.11Å
404	T	37.5	Very low	37.5	Very low	124 Å²	124	154.8 Å²	154.8	76%	0.761	80%	0.795	S	S	*	*			trans	-85.8	120.4	161.9	39.7	0	0	0	0	110	V402	V402-T404 HydrophobicContact CG1-CG2 4.25Å; V402-T404 PolarHBondContact O-N 3.15Å
405	T	29	Very low	36.9	Very low	130 Å²	130	153.8 Å²	153.8	80%	0.798	80%	0.799	S	S	*	*			trans	-97.8	104.6	-172.5	49.5	0	0	0	0	112.2
406	T	35.5	Very low	36.4	Very low	143 Å²	143	158.9 Å²	158.9	88%	0.877	81%	0.809	S	S	*	*			trans	-131.9	104.2	164.4	38.5	0	0	0	0	111.5
407	T	30.8	Very low	36.1	Very low	134 Å²	134	160 Å²	160	82%	0.822	82%	0.816	S	S	*	*			trans	-66.6	138.1	174.8	50.4	0	0	0	0	112.4
408	K	36.6	Very low	36	Very low	212 Å²	212	163.6 Å²	163.6	92%	0.922	82%	0.822	S	S	*	*				-154	128.4	125.5	-70.4	-152.7	178.3	177.9	0	110.5
409	E	32.6	Very low	35.7	Very low	173 Å²	173	162.8 Å²	162.8	81%	0.808	82%	0.822	S	S	*	*			trans	-76.6	144.9	173.8	-54.6	-175	120.9	0	0	112.1
410	K	36.4	Very low	36.1	Very low	211 Å²	211	165 Å²	165	92%	0.917	82%	0.824	S	S	*	*			trans	-140.8	141.5	145	-73.4	-161.8	176	179.3	0	110.8
411	K	38.2	Very low	36.2	Very low	193 Å²	193	166.2 Å²	166.2	84%	0.839	82%	0.823	S	S	*	*			trans	-83.4	146.3	-165.4	-66.7	174.4	178	173.7	0	113.4
412	K	35	Very low	36.4	Very low	197 Å²	197	166.8 Å²	166.8	86%	0.857	83%	0.827	S	S	*	*			trans	-58.8	142.5	164.4	-81.9	-178.1	172.6	177.8	0	111.1
413	K	42	Very low	36.8	Very low	212 Å²	212	171.1 Å²	171.1	92%	0.922	83%	0.83	S	S	*	*			trans	-111.4	129.6	152.6	-87.8	-172.9	173.9	-178.5	0	108.8
414	T	37.3	Very low	37.2	Very low	127 Å²	127	168.2 Å²	168.2	78%	0.779	82%	0.823	S	S	*	*			trans	-104.1	103.7	175.4	50.2	0	0	0	0	110
415	G	36.9	Very low	37.4	Very low	71 Å²	71	168 Å²	168	73%	0.732	83%	0.827	S	S	*	*			trans	-85.7	116	176.4	0	0	0	0	0	112.1
416	K	36.4	Very low	38.1	Very low	202 Å²	202	169.7 Å²	169.7	88%	0.878	83%	0.831	S	S	*	*			trans	-101.1	116.9	162.8	-66.4	-178.9	-179.4	178.7	0	108
417	H	37.4	Very low	38.6	Very low	190 Å²	190	171 Å²	171	88%	0.88	83%	0.832	S	S	*	*			trans	-112	142.1	170.6	-82.8	-98	0	0	0	111.3
418	R	39.5	Very low	39	Very low	229 Å²	229	173.3 Å²	173.3	86%	0.864	83%	0.834	S	S	*	*			trans	-91.9	151.8	-174.9	-69.8	163.6	65.7	-173.5	1.6	110.1
419	L	34.1	Very low	39.4	Very low	151 Å²	151	168.9 Å²	168.9	79%	0.791	83%	0.83	S	S	*	*			trans	-64.2	131.3	173.3	-157.6	80.8	0	0	0	110.6
420	I	45.6	Very low	39.8	Very low	150 Å²	150	169 Å²	169	77%	0.769	83%	0.831	S	S	*	*			trans	-129.2	144.7	168.6	-60.5	179.7	0	0	0	107.4
421	R	36	Very low	40	Very low	220 Å²	220	166.1 Å²	166.1	83%	0.83	83%	0.825	S	S	*	*			trans	-132.8	113.9	173.6	-63.9	-174.8	-170.6	173.4	3	110.4
422	V	42.2	Very low	40.3	Very low	131 Å²	131	164.6 Å²	164.6	79%	0.794	83%	0.826	S	S	*	*			trans	-144.8	114.6	157.8	-171.8	0	0	0	0	103.4
423	R	42.5	Very low	40.3	Very low	210 Å²	210	160.8 Å²	160.8	79%	0.792	82%	0.815	S	S	*	*				82.3	111.1	60.1	-102.1	-158.1	140.8	171.5	0.4	114.5
424	D	39.5	Very low	40.4	Very low	122 Å²	122	156.7 Å²	156.7	65%	0.652	81%	0.808	S	S	*	*			trans	73.1	157.2	145.9	-44.1	-23.4	0	0	0	117.3
425	S	41.2	Very low	40.3	Very low	121 Å²	121	156.4 Å²	156.4	85%	0.846	80%	0.801	S	S	*	*			trans	65.8	106.4	-160.3	-64.7	0	0	0	0	113.9
426	D	44.5	Very low	40.5	Very low	165 Å²	165	160.3 Å²	160.3	88%	0.882	81%	0.806	S	S	*	*			cis	74.4	86.7	18.6	-131.2	38.9	0	0	0	113.2
427	D	45.2	Very low	40.4	Very low	169 Å²	169	160 Å²	160	90%	0.904	80%	0.804	S	S	*	*			trans	-164	157.5	138.7	-127.8	-31.2	0	0	0	110.9
428	E	40.8	Very low	40.3	Very low	183 Å²	183	154.5 Å²	154.5	86%	0.855	80%	0.799	S	S	*	*			trans	-106	143.1	-172	-66.4	-88.8	-164.3	0	0	113
429	S	44.6	Very low	40.2	Very low	120 Å²	120	149.5 Å²	149.5	84%	0.839	79%	0.789	S	S	*	*			trans	-165	141.1	152.4	64.6	0	0	0	0	112.7
430	E	41.6	Very low	40.4	Very low	176 Å²	176	150 Å²	150	82%	0.822	79%	0.785	S	S	*	*			trans	-84.5	169.3	-171.5	-61.2	168.2	129.6	0	0	114.3
431	D	39.3	Very low	40	Very low	149 Å²	149	149.3 Å²	149.3	80%	0.797	78%	0.782	S	S	*	*			trans	47.8	131.5	153.6	-60.4	-12.1	0	0	0	120.4
432	D	43.9	Very low	39.9	Very low	161 Å²	161	147.1 Å²	147.1	86%	0.861	78%	0.779	S	S	*	*				-159.2	160.2	77.7	-130.5	-29.6	0	0	0	114.7
433	D	36.1	Very low	39.3	Very low	118 Å²	118	148 Å²	148	63%	0.631	78%	0.779	S	S	*	*			trans	-97.2	119.5	-177.6	179.3	-1.2	0	0	0	112.7	N435	D433-N435 PolarHBondContact OD1-N 3.24Å; D433-N435 PolarHBondContact OD1-ND2 3.26Å; D433-N435 PolarHBondContact OD2-ND2 3.3Å
434	V	44.5	Very low	38.8	Very low	126 Å²	126	145.8 Å²	145.8	76%	0.764	78%	0.783	S	S	*	*			trans	-127	75.8	168.3	-168.2	0	0	0	0	111.7	N436	V434-N436 PolarHBondContact O-N 2.81Å
435	N	34.8	Very low	38.4	Very low	121 Å²	121	148.9 Å²	148.9	65%	0.647	80%	0.798	S	S	*	*			trans	-53.2	120.1	160.1	-93.1	-96.9	0	0	0	111.5	D433	D433-N435 PolarHBondContact OD1-N 3.24Å; D433-N435 PolarHBondContact OD1-ND2 3.26Å; D433-N435 PolarHBondContact OD2-ND2 3.3Å
436	N	41.6	Very low	37.9	Very low	153 Å²	153	146.1 Å²	146.1	82%	0.818	79%	0.788	S	S	*	*			trans	-135.9	109.2	168.2	-144.5	-15.6	0	0	0	110.4	V434	V434-N436 PolarHBondContact O-N 2.81Å
437	K	34.6	Very low	37.2	Very low	195 Å²	195	145.4 Å²	145.4	85%	0.848	79%	0.789	S	S	*	*			trans	-103.4	125.8	-176	-79.5	-174.7	178	175.6	0	111.5
438	G	35.4	Very low	36.7	Very low	75 Å²	75	144 Å²	144	77%	0.773	79%	0.786	S	S	*	*			trans	148.5	148.9	168.7	0	0	0	0	0	111.5
439	D	37	Very low	36	Very low	123 Å²	123	139.1 Å²	139.1	66%	0.658	79%	0.785	S	S	*	*			cis	-160.7	171.8	-12.2	-170.2	12.5	0	0	0	108.2
440	K	38.4	Very low	35.3	Very low	161 Å²	161	137 Å²	137	70%	0.7	78%	0.782	S	S	*	*			trans	62	83.8	161.8	-72.4	148.8	-174.4	135.4	0	118.6
441	L	36.6	Very low	34.8	Very low	137 Å²	137	137.4 Å²	137.4	72%	0.717	79%	0.79	S	S	*	*				53.4	124.4	108.7	-65	164.1	0	0	0	120.6
442	K	33.2	Very low	34.6	Very low	174 Å²	174	133.5 Å²	133.5	76%	0.757	79%	0.785	S	S	*	*			trans	54.6	96.8	132.7	-60.2	177.4	179.9	176.5	0	118.1
443	N	29.6	Very low	34.2	Very low	148 Å²	148	132.9 Å²	132.9	79%	0.791	78%	0.782	S	S	*	*				-178	118.7	102.2	-88.7	-20.8	0	0	0	110.6
444	N	32.5	Very low	34.2	Very low	165 Å²	165	130.8 Å²	130.8	88%	0.882	79%	0.788	S	S	*	*			trans	158.1	92	158	-86.6	-35.2	0	0	0	109.3	G446	N444-G446 PolarHBondContact O-N 3.08Å
445	I	31.7	Very low	33.7	Very low	187 Å²	187	128 Å²	128	96%	0.959	79%	0.785	S	S	*	*			trans	-80.1	89.5	171.4	-64.2	177.5	0	0	0	108
446	G	30.6	Very low	33.7	Very low	62 Å²	62	124.5 Å²	124.5	64%	0.639	78%	0.778	S	S	*	*			trans	-113	126.2	176.9	0	0	0	0	0	111.3	N444 V448	N444-G446 PolarHBondContact O-N 3.08Å; G446-V448 PolarHBondContact O-N 3.2Å
447	V	29.8	Very low	33.5	Very low	150 Å²	150	126.8 Å²	126.8	91%	0.909	78%	0.775	S	S	*	*			trans	-67.7	117.9	-172.4	178.3	0	0	0	0	112.7
448	V	33.3	Very low	33.8	Very low	140 Å²	140	119.9 Å²	119.9	85%	0.848	75%	0.749	S	S	*	*			trans	-141.4	125.3	160.5	-176.6	0	0	0	0	110.8	G446	G446-V448 PolarHBondContact O-N 3.2Å
449	G	27.5	Very low	33.9	Very low	80 Å²	80	119.7 Å²	119.7	83%	0.825	73%	0.729	S	S	*	*			trans	18	117.4	160.7	0	0	0	0	0	121.8
450	G	29.2	Very low	33.9	Very low	75 Å²	75	116.4 Å²	116.4	77%	0.773	71%	0.71	S	S	*	*			trans	-146.1	129.6	153.4	0	0	0	0	0	109.5	G452	G450-G452 PolarHBondContact O-N 3.4Å
451	D	30.7	Very low	34.2	Very low	185 Å²	185	110.4 Å²	110.4	99%	0.989	69%	0.687	S	S	*	*			trans	-75	103.3	-174.5	-66	-56.4	0	0	0	111.6
452	G	35.3	Very low	34.4	Very low	68 Å²	68	105.7 Å²	105.7	70%	0.701	67%	0.665	S	S	*	*			trans	-140.6	137.8	176.3	0	0	0	0	0	111.7	G450 G454	G450-G452 PolarHBondContact O-N 3.4Å; G452-G454 PolarHBondContact O-N 3.45Å
453	D	37	Very low	34.8	Very low	148 Å²	148	104.6 Å²	104.6	79%	0.791	66%	0.66	S	S	*	*			trans	-81.6	53.4	-167	-156.3	9	0	0	0	113.1	G455	D453-G455 PolarHBondContact O-N 3.04Å; D453-G455 VanDerWaalsContact O-N 3.15Å
454	G	35.9	Very low	35.9	Very low	74 Å²	74	106.2 Å²	106.2	76%	0.763	66%	0.655	S	S	*	*			trans	-78.4	90.3	-178.5	0	0	0	0	0	112.5	G452 G456	G452-G454 PolarHBondContact O-N 3.45Å; G454-G456 PolarHBondContact O-N 3.34Å
455	G	32.4	Very low	36.3	Very low	68 Å²	68	106.6 Å²	106.6	70%	0.701	64%	0.644	S	S	*	*			trans	-69.4	48.9	-174.8	0	0	0	0	0	117.2	D453 R457	D453-G455 PolarHBondContact O-N 3.04Å; D453-G455 VanDerWaalsContact O-N 3.15Å; G455-R457 PolarHBondContact O-N 3.3Å
456	G	34.8	Very low	36.7	Very low	47 Å²	47	104.3 Å²	104.3	49%	0.485	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-59.6	119.7	-179.2	0	0	0	0	0	113.5	G454	G454-G456 PolarHBondContact O-N 3.34Å
457	R	38.5	Very low	37.1	Very low	200 Å²	200	104.9 Å²	104.9	76%	0.755	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-84.3	121.5	-179.1	-65.6	-176.7	-114.6	-165.6	-1.3	111.1	G455	G455-R457 PolarHBondContact O-N 3.3Å
458	V	39.9	Very low	37.4	Very low	51 Å²	51	101.4 Å²	101.4	31%	0.309	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.9	120.4	173.4	-178.4	0	0	0	0	109.6	Y673	V458-Y673 HydrophobicContact CG2-CE1 4.4Å
459	I	37.4	Very low	37.7	Very low	70 Å²	70	101.4 Å²	101.4	36%	0.359	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.6	122.8	173.6	-55.5	177	0	0	0	108.2	T461 F471	I459-T461 HydrophobicContact CG2-CG2 4.1Å; I459-F471 HydrophobicContact CG2-CD1 4.43Å
460	E	37.8	Very low	38.3	Very low	55 Å²	55	101.1 Å²	101.1	26%	0.257	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.2	115.8	171.2	-66.1	-164.8	155.1	0	0	109.9	R671	E460-R671 HydrophobicContact CG-CG 4.49Å; E460-R671 IonicContact OE1-CZ 2.76Å; E460-R671 IonicContact OE1-NE 3.6Å; E460-R671 PolarHBondContact OE1-NE 2.79Å; E460-R671 IonicContact OE1-NH2 2.74Å; E460-R671 PolarHBondContact OE1-NH2 3.48Å
461	T	44.8	Very low	38.8	Very low	35 Å²	35	104.1 Å²	104.1	22%	0.215	58%	0.584	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.7	147.7	176.4	55.8	0	0	0	0	110.8	I459	I459-T461 HydrophobicContact CG2-CG2 4.1Å
462	C	39.9	Very low	39.2	Very low	37 Å²	37	105 Å²	105	25%	0.25	57%	0.574	C	S	.	*			trans	-141.4	106.1	177.5	-174.7	0	0	0	0	110.4	R464 R667 F669	C462-R464 PolarHBondContact O-N 2.94Å; C462-R667 PolarHBondContact SG-NH1 3.09Å; C462-F669 HydrophobicContact CB-CE1 4.23Å
463	F	42.9	Very low	39.6	Very low	151 Å²	151	107.3 Å²	107.3	66%	0.662	57%	0.574	S	S	*	*			trans	-66.2	119.9	171.6	-56	-77.5	0	0	0	109.5	F469	F463-F469 HydrophobicContact CE1-CE1 4.3Å
464	R	53.2	Low	39.8	Very low	182 Å²	182	104 Å²	104	69%	0.687	56%	0.556	S	S	*	*	S	Bend	trans	-93.9	-42.3	171.5	-81.4	-172.3	167.1	-153.8	-3.5	111.9	C462 E468	C462-R464 PolarHBondContact O-N 2.94Å; R464-E468 HydrophobicContact CB-CB 4.45Å; R464-E468 WeakPolarHBondContact CB-OE2 3.4Å
465	R	40.5	Very low	40.2	Very low	174 Å²	174	104.9 Å²	104.9	66%	0.657	55%	0.551	S	S	*	*	S	Bend	trans	-146.8	163.2	173.1	-67.3	-174.3	175.6	122.2	-8.9	109	G467 E468	R465-G467 PolarHBondContact O-N 3.49Å; R465-E468 HydrophobicContact CB-CG 4.5Å; R465-E468 PolarHBondContact O-N 2.86Å
466	P	39.9	Very low	40.9	Very low	138 Å²	138	109.3 Å²	109.3	90%	0.896	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.7	124.9	165.4	-22.8	34.1	0	0	0	110
467	G	39.1	Very low	41.2	Very low	74 Å²	74	114 Å²	114	76%	0.763	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	94.5	-15.6	-179.2	0	0	0	0	0	116.6	R465	R465-G467 PolarHBondContact O-N 3.49Å
468	E	35.9	Very low	41	Very low	78 Å²	78	109.7 Å²	109.7	36%	0.364	56%	0.56	S	S	.	*			trans	-92.7	115.3	176.7	-76.4	-174.1	134.9	0	0	112.2	R464 R465	R464-E468 HydrophobicContact CB-CB 4.45Å; R464-E468 WeakPolarHBondContact CB-OE2 3.4Å; R465-E468 HydrophobicContact CB-CG 4.5Å; R465-E468 PolarHBondContact O-N 2.86Å
469	F	39.3	Very low	40.7	Very low	140 Å²	140	113.8 Å²	113.8	61%	0.614	58%	0.58	S	S	*	*			trans	-103.9	127.4	168.8	-68.8	-89.6	0	0	0	110.8	F463 F471	F463-F469 HydrophobicContact CE1-CE1 4.3Å; F469-F471 HydrophobicContact CB-CE2 4.32Å; F469-F471 HydrophobicContact CB-CZ 4.14Å
470	V	39.3	Very low	40.4	Very low	74 Å²	74	116.3 Å²	116.3	45%	0.448	60%	0.601	S	S	.	*			trans	-131.2	122.6	171.3	-178.1	0	0	0	0	108.7
471	F	39.8	Very low	40.3	Very low	137 Å²	137	118.8 Å²	118.8	60%	0.601	63%	0.625	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.9	143.6	-179.6	-51.6	-79.5	0	0	0	111	I459 F469	I459-F471 HydrophobicContact CG2-CD1 4.43Å; F469-F471 HydrophobicContact CB-CE2 4.32Å; F469-F471 HydrophobicContact CB-CZ 4.14Å
472	R	39.9	Very low	39.9	Very low	205 Å²	205	123 Å²	123	77%	0.774	66%	0.656	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-131.5	129.1	160.2	-72	-171.3	172	-151.7	-5.4	109.1
473	V	42.5	Very low	39.4	Very low	116 Å²	116	128 Å²	128	70%	0.703	69%	0.685	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99	120.8	175.2	-179.1	0	0	0	0	107.4	S475	V473-S475 PolarHBondContact O-N 3.23Å
474	D	43	Very low	38.9	Very low	79 Å²	79	128.8 Å²	128.8	42%	0.422	70%	0.696	S	S	.	*			trans	-81.2	108.5	177.5	-165.8	9.3	0	0	0	110.1	K476	D474-K476 PolarHBondContact O-N 3.07Å; D474-K476 IonicContact OD1-NZ 2.79Å; D474-K476 PolarHBondContact OD1-NZ 2.92Å; D474-K476 IonicContact OD2-NZ 2.7Å; D474-K476 PolarHBondContact OD2-NZ 3.21Å
475	S	44.6	Very low	37.7	Very low	92 Å²	92	123.9 Å²	123.9	64%	0.643	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-67.8	6.1	-166.6	-38	0	0	0	0	115.8	V473 N477	V473-S475 PolarHBondContact O-N 3.23Å; S475-N477 PolarHBondContact O-N 2.97Å
476	K	45.9	Very low	37.3	Very low	161 Å²	161	122.6 Å²	122.6	70%	0.7	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-79.4	-12.3	-165.2	-62.6	-174.6	-171.1	78.4	0	115.4	D474	D474-K476 PolarHBondContact O-N 3.07Å; D474-K476 IonicContact OD1-NZ 2.79Å; D474-K476 PolarHBondContact OD1-NZ 2.92Å; D474-K476 IonicContact OD2-NZ 2.7Å; D474-K476 PolarHBondContact OD2-NZ 3.21Å
477	N	41.8	Very low	36.7	Very low	145 Å²	145	121.1 Å²	121.1	78%	0.775	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-110.8	18.1	-179.6	-71.4	20.6	0	0	0	113.4	S475 N479	S475-N477 PolarHBondContact O-N 2.97Å; N477-N479 PolarHBondContact O-N 2.89Å
478	V	34	Very low	36.5	Very low	109 Å²	109	124.3 Å²	124.3	66%	0.661	71%	0.706	S	S	*	*			trans	-82.9	111.6	178.4	-178.7	0	0	0	0	110.4	P480	V478-P480 WeakPolarHBondContact O-CD 3.24Å
479	N	34	Very low	36.4	Very low	137 Å²	137	127.7 Å²	127.7	73%	0.733	72%	0.722	S	S	*	*			trans	-72.1	117.9	165.8	-96.4	-35.2	0	0	0	109.8	N477 S481	N477-N479 PolarHBondContact O-N 2.89Å; N479-S481 PolarHBondContact O-N 3.34Å; N479-S481 VanDerWaalsContact O-N 3.17Å
480	P	31.2	Very low	36.1	Very low	124 Å²	124	127.1 Å²	127.1	81%	0.805	73%	0.725	S	S	*	*			trans	-83.2	93.7	-178.9	32.6	-32.8	0	0	0	110.8	V478	V478-P480 WeakPolarHBondContact O-CD 3.24Å
481	S	36.2	Very low	35.9	Very low	107 Å²	107	130.4 Å²	130.4	75%	0.748	74%	0.738	S	S	*	*			trans	-145.4	61.7	-179.1	-174.3	0	0	0	0	114.8	N479	N479-S481 PolarHBondContact O-N 3.34Å; N479-S481 VanDerWaalsContact O-N 3.17Å
482	S	34.6	Very low	35.6	Very low	123 Å²	123	129 Å²	129	86%	0.86	74%	0.737	S	S	*	*			trans	-169.2	106.5	143.3	19.2	0	0	0	0	110.6
483	T	29.4	Very low	35.3	Very low	142 Å²	142	128.8 Å²	128.8	87%	0.871	74%	0.737	S	S	*	*			trans	-86.1	110.8	168.2	46.7	0	0	0	0	109.9
484	N	32.8	Very low	34.8	Very low	168 Å²	168	132.1 Å²	132.1	90%	0.898	74%	0.744	S	S	*	*			trans	-131.2	113.7	148.5	-97.8	-15.7	0	0	0	106.4
485	G	27.5	Very low	34.5	Very low	79 Å²	79	131.8 Å²	131.8	81%	0.814	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-87.9	135.8	-173.8	0	0	0	0	0	111.9
486	V	32.2	Very low	34.1	Very low	146 Å²	146	133.8 Å²	133.8	89%	0.885	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-99.6	124.1	143.3	-179.3	0	0	0	0	105.5
487	S	29	Very low	33.5	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-78.2	138	179.6	51.6	0	0	0	0	110.6
488	D	34.6	Very low	33	Very low	140 Å²	140	136 Å²	136	75%	0.749	77%	0.771	S	S	*	*			trans	-142	131.9	150.9	-110.1	-38.9	0	0	0	113.3
489	H	32.9	Very low	33.2	Very low	150 Å²	150	139.8 Å²	139.8	69%	0.694	78%	0.778	S	S	*	*			trans	27.1	115.8	160.3	-75.9	-62	0	0	0	123.2
490	N	33.2	Very low	33.3	Very low	127 Å²	127	138.6 Å²	138.6	68%	0.679	78%	0.781	S	S	*	*				101.5	144	111.1	-78	-2.2	0	0	0	122.7
491	I	35.3	Very low	33.4	Very low	143 Å²	143	142 Å²	142	73%	0.733	78%	0.783	S	S	*	*			trans	78.9	95.3	146.9	-69.3	159.7	0	0	0	118.1
492	D	32.4	Very low	33.2	Very low	109 Å²	109	143.2 Å²	143.2	58%	0.583	79%	0.788	S	S	*	*				88.6	137.4	129.2	-89.8	11.6	0	0	0	124.5
493	R	34.2	Very low	33.1	Very low	200 Å²	200	143 Å²	143	76%	0.755	79%	0.787	S	S	*	*			trans	69.4	105.6	151.5	-66.9	160.8	-145.8	-123.6	-5	115.8
494	Q	33.3	Very low	33.1	Very low	186 Å²	186	142.1 Å²	142.1	87%	0.869	78%	0.781	S	S	*	*				70.2	138.1	79.3	-73	-173.4	53	0	0	112.4
495	A	34.8	Very low	33.2	Very low	72 Å²	72	140.4 Å²	140.4	60%	0.595	78%	0.777	S	S	*	*			cis	-154.2	162.5	18.4	0	0	0	0	0	114.7
496	T	37.5	Very low	33.5	Very low	134 Å²	134	141.3 Å²	141.3	82%	0.822	77%	0.767	S	S	*	*			trans	71.4	151.2	160.2	84.8	0	0	0	0	117.4
497	R	31.9	Very low	33.8	Very low	243 Å²	243	142.2 Å²	142.2	92%	0.917	77%	0.765	S	S	*	*			cis	-145.8	131.9	-5.6	-148.4	167.6	172.6	173.1	-4.2	110.4
498	S	33	Very low	34.1	Very low	108 Å²	108	143.5 Å²	143.5	76%	0.755	76%	0.764	S	S	*	*			trans	-87.3	155.7	-178.1	52.8	0	0	0	0	114
499	K	36.7	Very low	34.3	Very low	190 Å²	190	146 Å²	146	83%	0.826	77%	0.771	S	S	*	*			trans	-176	124.8	131.6	-106	171.4	-175.1	-172.6	0	114.6
500	S	36.6	Very low	34.6	Very low	112 Å²	112	146.5 Å²	146.5	78%	0.783	77%	0.773	S	S	*	*			trans	54.5	150.4	142.9	58.8	0	0	0	0	122.3
501	K	33.3	Very low	34.7	Very low	196 Å²	196	146.7 Å²	146.7	85%	0.852	78%	0.784	S	S	*	*			cis	-171.3	140.1	-26.1	-161.2	171.3	-175.1	-176.6	0	105.6
502	P	31.5	Very low	34.6	Very low	131 Å²	131	150.5 Å²	150.5	85%	0.851	79%	0.79	S	S	*	*			trans	-84	165	-173.6	33.6	-36.8	0	0	0	114.1
503	S	32.1	Very low	34.8	Very low	119 Å²	119	151.3 Å²	151.3	83%	0.832	80%	0.804	S	S	*	*			trans	-142.6	125.2	172.7	59.9	0	0	0	0	112.9
504	T	29.7	Very low	34.7	Very low	123 Å²	123	151.9 Å²	151.9	76%	0.755	81%	0.812	S	S	*	*			trans	-71.3	152.5	-178.5	-34.2	0	0	0	0	114.2
505	T	35.6	Very low	34.8	Very low	133 Å²	133	148.9 Å²	148.9	82%	0.816	81%	0.812	S	S	*	*			trans	-172.4	101.2	143.1	-70.8	0	0	0	0	106.1
506	T	33	Very low	34.7	Very low	98 Å²	98	154.9 Å²	154.9	60%	0.601	82%	0.824	S	S	*	*				69.9	114.6	73.3	-48.9	0	0	0	0	114.3
507	I	40.2	Very low	34.7	Very low	164 Å²	164	154 Å²	154	84%	0.841	82%	0.821	S	S	*	*			trans	-163.3	138.2	143.4	-98.7	150.6	0	0	0	107.6
508	N	33.9	Very low	34.9	Very low	136 Å²	136	150.4 Å²	150.4	73%	0.727	81%	0.814	S	S	*	*			trans	-111	141.1	-177.5	-64.6	-51.9	0	0	0	111.4
509	Q	40.4	Very low	34.6	Very low	192 Å²	192	150.9 Å²	150.9	90%	0.897	81%	0.812	S	S	*	*			trans	-155	101.2	140.7	-62.3	-164.4	28.6	0	0	105.4
510	Q	37.3	Very low	34.4	Very low	161 Å²	161	147.9 Å²	147.9	75%	0.752	81%	0.81	S	S	*	*				72.1	99.7	52	-146.8	-177.8	45.6	0	0	114.2
511	S	36.6	Very low	33.9	Very low	130 Å²	130	149.2 Å²	149.2	91%	0.909	81%	0.814	S	S	*	*			trans	-150.8	142.7	150.7	-83.1	0	0	0	0	108
512	R	32	Very low	34	Very low	223 Å²	223	145 Å²	145	84%	0.842	81%	0.809	S	S	*	*			trans	-115.4	145.9	-167	-75.6	171	161.2	172.6	-7.1	111.4
513	S	36.8	Very low	33.8	Very low	126 Å²	126	146.3 Å²	146.3	88%	0.881	81%	0.809	S	S	*	*			trans	-156.8	139.5	137.2	-83.8	0	0	0	0	109.6
514	K	32.1	Very low	34	Very low	212 Å²	212	148.6 Å²	148.6	92%	0.922	81%	0.81	S	S	*	*			trans	-142	141	175.4	-85.1	-168.1	175.8	-173.4	0	108.5
515	S	36.9	Very low	34	Very low	124 Å²	124	149.8 Å²	149.8	87%	0.867	81%	0.812	S	S	*	*			trans	-145.7	143	153.9	51.7	0	0	0	0	110
516	K	31.5	Very low	34.1	Very low	198 Å²	198	148.1 Å²	148.1	86%	0.861	81%	0.806	S	S	*	*			trans	-163.9	132.3	174.1	-111	-164.4	176.7	-167.3	0	107.2
517	P	37.4	Very low	34.3	Very low	115 Å²	115	149.6 Å²	149.6	75%	0.747	81%	0.81	S	S	*	*			trans	-106	147.1	133.3	-12.4	31.6	0	0	0	109.2
518	H	36.5	Very low	34.1	Very low	167 Å²	167	147.5 Å²	147.5	77%	0.773	80%	0.801	S	S	*	*				55.5	101.2	65.9	-84.4	-51.6	0	0	0	112.8
519	T	26.6	Very low	34.2	Very low	118 Å²	118	147.3 Å²	147.3	72%	0.724	80%	0.799	S	S	*	*				80.9	117.4	68.9	-63.7	0	0	0	0	112.3
520	T	33	Very low	34.2	Very low	128 Å²	128	143.8 Å²	143.8	79%	0.785	79%	0.787	S	S	*	*				-173.7	143.7	120.9	-73.6	0	0	0	0	109.5
521	T	25.9	Very low	34.3	Very low	139 Å²	139	143.5 Å²	143.5	85%	0.853	78%	0.783	S	S	*	*			trans	-98.5	130.6	172.1	43.7	0	0	0	0	110.9
522	S	35	Very low	34.4	Very low	109 Å²	109	142.8 Å²	142.8	76%	0.762	77%	0.773	S	S	*	*			trans	-153.7	122.6	160.9	58.5	0	0	0	0	111.4
523	N	28	Very low	34.8	Very low	158 Å²	158	138.6 Å²	138.6	85%	0.845	77%	0.768	S	S	*	*			trans	-66.5	149.9	158.9	-63.3	-14.6	0	0	0	108.6
524	I	35.5	Very low	35.1	Very low	167 Å²	167	142.5 Å²	142.5	86%	0.856	77%	0.769	S	S	*	*			trans	-172.2	148.7	132.3	-99	153.5	0	0	0	108.6
525	N	30.7	Very low	35.4	Very low	148 Å²	148	140.8 Å²	140.8	79%	0.791	76%	0.764	S	S	*	*			trans	-75.9	158.3	-177.6	-60.2	-26.4	0	0	0	111.9
526	S	36.9	Very low	35.7	Very low	98 Å²	98	143.6 Å²	143.6	69%	0.685	77%	0.768	S	S	*	*				136.2	144.9	110.1	74.4	0	0	0	0	115.9
527	N	36.2	Very low	35.9	Very low	129 Å²	129	139.1 Å²	139.1	69%	0.69	75%	0.754	S	S	*	*			trans	69.7	103.6	138.6	-63.9	-0.3	0	0	0	121.5
528	N	37.8	Very low	36.2	Very low	120 Å²	120	141.9 Å²	141.9	64%	0.642	76%	0.76	S	S	*	*				84.5	113.4	110.1	-62.4	-6.1	0	0	0	121.1
529	N	35	Very low	36.3	Very low	131 Å²	131	139.9 Å²	139.9	70%	0.701	76%	0.755	S	S	*	*				82	153.9	123.9	-60.9	-0	0	0	0	120.6
530	D	39.7	Very low	36.7	Very low	118 Å²	118	136.9 Å²	136.9	63%	0.631	75%	0.748	S	S	*	*			trans	70	138.6	153.4	-72.4	-2.4	0	0	0	117.6
531	K	40.1	Very low	36.8	Very low	155 Å²	155	141.3 Å²	141.3	67%	0.674	76%	0.757	S	S	*	*			cis	-165.6	173.3	-5.8	-127.5	163.2	-164.5	145.3	0	111
532	T	39.6	Very low	37.4	Very low	115 Å²	115	143.7 Å²	143.7	71%	0.706	76%	0.756	S	S	*	*			trans	68.2	160.5	161.9	72.5	0	0	0	0	118.6
533	D	38.9	Very low	37.6	Very low	135 Å²	135	148.1 Å²	148.1	72%	0.722	76%	0.761	S	S	*	*			cis	-171.2	136.9	-44.7	-90.7	-35.1	0	0	0	107.2
534	K	44.2	Very low	37.9	Very low	209 Å²	209	149.4 Å²	149.4	91%	0.909	77%	0.767	S	S	*	*			trans	-179.7	138.6	136.1	-100.7	149.8	-169.7	170	0	112.2
535	E	38.8	Very low	37.7	Very low	176 Å²	176	145.9 Å²	145.9	82%	0.822	76%	0.757	S	S	*	*			trans	-79.5	153.1	179.9	-56.9	152.8	102.3	0	0	111.4
536	L	42.6	Very low	38	Very low	182 Å²	182	148.4 Å²	148.4	95%	0.953	76%	0.761	S	S	*	*				-149.1	130	126.8	-109.7	170.3	0	0	0	108.4
537	N	34.8	Very low	37.8	Very low	105 Å²	105	150.4 Å²	150.4	56%	0.561	77%	0.769	S	S	*	*			trans	-117.9	116.3	-161.1	173.7	11.9	0	0	0	110.9	N539	N537-N539 PolarHBondContact OD1-N 3.07Å; N537-N539 PolarHBondContact OD1-ND2 2.69Å; N537-N539 VanDerWaalsContact OD1-ND2 3.13Å
538	I	44.1	Very low	37.6	Very low	172 Å²	172	151.3 Å²	151.3	88%	0.882	78%	0.779	S	S	*	*			trans	-131.8	90.1	163.8	-55.1	-178.5	0	0	0	107.7	G540	I538-G540 PolarHBondContact O-N 3.5Å
539	N	39.2	Very low	37.2	Very low	125 Å²	125	149.2 Å²	149.2	67%	0.668	79%	0.786	S	S	*	*			trans	-73.3	120.7	177.3	-84.8	-48.2	0	0	0	111.6	N537	N537-N539 PolarHBondContact OD1-N 3.07Å; N537-N539 PolarHBondContact OD1-ND2 2.69Å; N537-N539 VanDerWaalsContact OD1-ND2 3.13Å
540	G	34.6	Very low	37.1	Very low	56 Å²	56	147.4 Å²	147.4	58%	0.577	79%	0.789	S	S	*	*			trans	-149.6	144.9	162.8	0	0	0	0	0	109.4	I538	I538-G540 PolarHBondContact O-N 3.5Å
541	F	36.1	Very low	36.8	Very low	221 Å²	221	149.9 Å²	149.9	97%	0.969	80%	0.797	S	S	*	*			trans	58.7	55.8	175.7	-58.5	-79.9	0	0	0	117.2
542	K	37.5	Very low	36.7	Very low	189 Å²	189	149 Å²	149	82%	0.822	80%	0.804	S	S	*	*			trans	-110.6	86.4	155.3	-83.2	-176.6	177	171.2	0	111.4
543	K	39.3	Very low	36.7	Very low	202 Å²	202	151.5 Å²	151.5	88%	0.878	81%	0.805	S	S	*	*			trans	-151.5	25.7	165.1	-128	174.6	-175.3	-179.6	0	116.1
544	L	34.4	Very low	36.7	Very low	184 Å²	184	151.3 Å²	151.3	96%	0.963	81%	0.809	S	S	*	*			trans	-122.8	92.7	162.6	-71.4	177.3	0	0	0	109.2
545	S	31.9	Very low	36.6	Very low	94 Å²	94	147.5 Å²	147.5	66%	0.657	80%	0.803	S	S	*	*			trans	-144.5	144.1	175.1	66.2	0	0	0	0	108.5
546	K	36.2	Very low	36.9	Very low	201 Å²	201	144 Å²	144	87%	0.874	79%	0.79	S	S	*	*	S	Bend	trans	66.4	91.5	-161.6	-42.5	169.1	-175.8	-179.5	0	109.1
547	V	33	Very low	37.3	Very low	139 Å²	139	142 Å²	142	84%	0.842	78%	0.779	S	S	*	*			cis	-128.6	125.3	45.3	180	0	0	0	0	111.8
548	V	30.9	Very low	38	Very low	148 Å²	148	145.1 Å²	145.1	90%	0.897	79%	0.788	S	S	*	*			trans	-129.3	110.3	164.9	176.2	0	0	0	0	105.9
549	G	30.4	Very low	38	Very low	77 Å²	77	141.3 Å²	141.3	79%	0.794	77%	0.769	S	S	*	*			trans	167.2	40.1	-167.4	0	0	0	0	0	114.4
550	A	33	Very low	38.6	Very low	92 Å²	92	141.9 Å²	141.9	76%	0.76	77%	0.771	S	S	*	*			trans	-141.8	116.6	170.9	0	0	0	0	0	108.6	V552	A550-V552 PolarHBondContact O-N 3.4Å
551	E	33.3	Very low	39.5	Very low	170 Å²	170	143.7 Å²	143.7	79%	0.794	78%	0.775	S	S	*	*			trans	-71.5	119.2	178.9	-63.9	-178	153.4	0	0	110.3	K553	E551-K553 PolarHBondContact O-N 2.72Å
552	V	37.5	Very low	40.2	Very low	138 Å²	138	140.9 Å²	140.9	84%	0.836	77%	0.767	S	S	*	*			trans	-74.8	83	171.1	-176.1	0	0	0	0	108.5	A550 T554	A550-V552 PolarHBondContact O-N 3.4Å; V552-T554 PolarHBondContact O-N 2.96Å
553	K	39.6	Very low	40.5	Very low	167 Å²	167	138 Å²	138	73%	0.726	76%	0.761	S	S	*	*			trans	-62.3	107.4	169.9	-76.3	-177.2	176.3	175.9	0	108.7	E551 V555	E551-K553 PolarHBondContact O-N 2.72Å; K553-V555 PolarHBondContact O-N 3.45Å
554	T	38.4	Very low	40.8	Very low	131 Å²	131	140 Å²	140	80%	0.804	76%	0.763	S	S	*	*			trans	-61	108.9	175.2	49.3	0	0	0	0	109.3	V552 N556	V552-T554 PolarHBondContact O-N 2.96Å; T554-N556 PolarHBondContact O-N 3.27Å
555	V	42.6	Very low	41	Very low	129 Å²	129	137.2 Å²	137.2	78%	0.782	75%	0.754	S	S	*	*			trans	-62.7	117.7	-178.1	178.6	0	0	0	0	109.4	K553 I557	K553-V555 PolarHBondContact O-N 3.45Å; V555-I557 PolarHBondContact O-N 3.41Å; V555-I557 VanDerWaalsContact O-N 3.08Å
556	N	44.5	Very low	41.7	Very low	103 Å²	103	136.4 Å²	136.4	55%	0.551	75%	0.752	S	S	*	*			trans	-73.5	101.1	173.5	-178.3	11.6	0	0	0	109.3	T554 F558 D559	T554-N556 PolarHBondContact O-N 3.27Å; N556-F558 PolarHBondContact O-N 2.96Å; N556-F558 PolarHBondContact OD1-N 2.92Å; N556-D559 HydrophobicContact CB-CB 4.47Å; N556-D559 PolarHBondContact O-N 3.48Å
557	I	51.7	Low	42	Very low	140 Å²	140	132.5 Å²	132.5	72%	0.718	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	0.2	-180	48	172.7	0	0	0	115.7	V555	V555-I557 PolarHBondContact O-N 3.41Å; V555-I557 VanDerWaalsContact O-N 3.08Å
558	F	48.9	Very low	42.7	Very low	169 Å²	169	133.1 Å²	133.1	74%	0.741	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	2	172.4	-66	-77.5	0	0	0	114.5	N556 L560	N556-F558 PolarHBondContact O-N 2.96Å; N556-F558 PolarHBondContact OD1-N 2.92Å; F558-L560 PolarHBondContact O-N 2.94Å; F558-L560 VanDerWaalsContact O-N 3.09Å
559	D	45.9	Very low	43.5	Very low	92 Å²	92	130.4 Å²	130.4	49%	0.492	73%	0.727	S	S	.	*			trans	-81.6	89.4	179.6	-162.4	-19	0	0	0	112.2	N556 S561	N556-D559 HydrophobicContact CB-CB 4.47Å; N556-D559 PolarHBondContact O-N 3.48Å; D559-S561 PolarHBondContact O-N 2.78Å; D559-S561 WeakPolarHBondContact OD1-CB 3.37Å; D559-S561 PolarHBondContact OD1-N 3.45Å; D559-S561 PolarHBondContact OD1-OG 2.95Å
560	L	50.5	Low	44.9	Very low	137 Å²	137	132.5 Å²	132.5	72%	0.717	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-71.9	-4.8	178.9	-65.6	172.7	0	0	0	114	F558 M562 N563	F558-L560 PolarHBondContact O-N 2.94Å; F558-L560 VanDerWaalsContact O-N 3.09Å; L560-M562 PolarHBondContact O-N 3.48Å; L560-N563 PolarHBondContact O-N 3.16Å
561	S	54.3	Low	46.6	Very low	95 Å²	95	135.1 Å²	135.1	66%	0.664	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-66.4	-20.6	-176	68.1	0	0	0	0	114.3	D559 N563	D559-S561 PolarHBondContact O-N 2.78Å; D559-S561 WeakPolarHBondContact OD1-CB 3.37Å; D559-S561 PolarHBondContact OD1-N 3.45Å; D559-S561 PolarHBondContact OD1-OG 2.95Å; S561-N563 VanDerWaalsContact C-N 3.31Å; S561-N563 PolarHBondContact O-N 2.93Å
562	M	50.8	Low	48.5	Very low	162 Å²	162	132 Å²	132	80%	0.798	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-71.4	-19.4	177.6	-79.1	-79.9	-74.1	0	0	114.1	L560 R564	L560-M562 PolarHBondContact O-N 3.48Å; M562-R564 VanDerWaalsContact C-N 3.34Å; M562-R564 PolarHBondContact O-N 2.89Å
563	N	44	Very low	50.3	Low	129 Å²	129	129.6 Å²	129.6	69%	0.69	71%	0.706	S	S	*	*			trans	-77.1	82.2	-178.8	-77.2	-36.8	0	0	0	111.4	L560 S561 T565	L560-N563 PolarHBondContact O-N 3.16Å; S561-N563 VanDerWaalsContact C-N 3.31Å; S561-N563 PolarHBondContact O-N 2.93Å; N563-T565 PolarHBondContact O-N 3.21Å
564	R	45.4	Very low	52.3	Low	242 Å²	242	125.2 Å²	125.2	91%	0.913	69%	0.693	S	S	*	*			trans	-58.1	103.2	170.1	-78	-174	173	-173.4	-1	110.9	M562 A566	M562-R564 VanDerWaalsContact C-N 3.34Å; M562-R564 PolarHBondContact O-N 2.89Å; R564-A566 PolarHBondContact O-N 3.15Å; R564-A566 VanDerWaalsContact O-N 3.07Å
565	T	37.7	Very low	54.2	Low	127 Å²	127	125.2 Å²	125.2	78%	0.779	69%	0.688	S	S	*	*			trans	16.2	78.1	155.1	-40.8	0	0	0	0	116	N563	N563-T565 PolarHBondContact O-N 3.21Å
566	A	48	Very low	56	Low	76 Å²	76	123.4 Å²	123.4	63%	0.628	67%	0.674	S	S	*	*			trans	-65.6	137.4	144.1	0	0	0	0	0	107.4	R564 L568	R564-A566 PolarHBondContact O-N 3.15Å; R564-A566 VanDerWaalsContact O-N 3.07Å; A566-L568 VanDerWaalsContact C-N 3.31Å; A566-L568 PolarHBondContact O-N 3.37Å
567	D	41.9	Very low	57.8	Low	120 Å²	120	121.9 Å²	121.9	64%	0.642	67%	0.665	S	S	*	*			trans	-79.2	79.5	-172.1	-152.8	-32.2	0	0	0	111.5	S569 V570	D567-S569 PolarHBondContact O-N 2.9Å; D567-S569 VanDerWaalsContact OD1-CB 3.27Å; D567-S569 WeakPolarHBondContact OD1-CB 3.37Å; D567-S569 PolarHBondContact OD1-N 3.04Å; D567-S569 PolarHBondContact OD1-OG 3Å; D567-V570 PolarHBondContact O-N 3.21Å
568	L	46.5	Very low	59.4	Low	151 Å²	151	119.6 Å²	119.6	79%	0.791	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	8.7	-178.9	-62.3	178.8	0	0	0	113.8	A566 V570	A566-L568 VanDerWaalsContact C-N 3.31Å; A566-L568 PolarHBondContact O-N 3.37Å; L568-V570 PolarHBondContact O-N 3.05Å
569	S	48.7	Very low	61.1	Low	91 Å²	91	119.3 Å²	119.3	64%	0.636	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-26.4	170.1	63.7	0	0	0	0	112.6	D567 L571	D567-S569 PolarHBondContact O-N 2.9Å; D567-S569 VanDerWaalsContact OD1-CB 3.27Å; D567-S569 WeakPolarHBondContact OD1-CB 3.37Å; D567-S569 PolarHBondContact OD1-N 3.04Å; D567-S569 PolarHBondContact OD1-OG 3Å; S569-L571 PolarHBondContact O-N 3.48Å
570	V	60.1	Low	62.8	Low	121 Å²	121	118.4 Å²	118.4	73%	0.733	64%	0.643	S	S	*	*	S	Bend	trans	-91.8	88.3	176.9	-172.3	0	0	0	0	110.3	D567 L568	D567-V570 PolarHBondContact O-N 3.21Å; L568-V570 PolarHBondContact O-N 3.05Å
571	L	67.8	Low	64.4	Low	147 Å²	147	118.8 Å²	118.8	77%	0.77	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-61.1	140.4	167.2	-72.7	172.2	0	0	0	110.5	S569	S569-L571 PolarHBondContact O-N 3.48Å
572	P	73.2	Confident	65.7	Low	104 Å²	104	119.1 Å²	119.1	68%	0.675	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-61.7	142	174.3	26.3	-33.9	0	0	0	110.6	T574	P572-T574 PolarHBondContact O-N 2.81Å
573	P	76.4	Confident	67.2	Low	89 Å²	89	118.3 Å²	118.3	58%	0.578	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-59.8	133.8	-172.4	23.3	-34	0	0	0	111.6	D577	P573-D577 HydrophobicContact CB-CB 4.12Å
574	T	81.8	Confident	68.9	Low	75 Å²	75	117.2 Å²	117.2	46%	0.46	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-71.4	165.2	-176.2	73.7	0	0	0	0	111.6	P572 N576 D577 L578	P572-T574 PolarHBondContact O-N 2.81Å; T574-N576 PolarHBondContact O-N 2.84Å; T574-N576 PolarHBondContact OG1-N 3.47Å; T574-N576 VanDerWaalsContact OG1-N 3.15Å; T574-D577 WeakPolarHBondContact CA-OD2 3.48Å; T574-D577 VanDerWaalsContact CB-OD2 3.26Å; T574-D577 WeakPolarHBondContact CB-OD2 2.97Å; T574-D577 WeakPolarHBondContact CG2-OD2 3.25Å; T574-D577 PolarHBondContact N-OD2 2.68Å; T574-D577 PolarHBondContact O-N 3.26Å; T574-D577 VanDerWaalsContact OG1-CG 3.24Å; T574-D577 PolarHBondContact OG1-N 3.24Å; T574-D577 PolarHBondContact OG1-OD2 2.89Å; T574-L578 PolarHBondContact O-N 3.46Å
575	L	77.3	Confident	70.4	Confident	130 Å²	130	111.7 Å²	111.7	68%	0.681	60%	0.597	S	S	*	*	H	α-helix	trans	-57.6	-15.8	169	-77.1	172.2	0	0	0	113.7	L578 R579	L575-L578 HydrophobicContact CD2-CD1 4.48Å; L575-R579 VanDerWaalsContact O-CD 3.25Å; L575-R579 WeakPolarHBondContact O-CD 3.49Å; L575-R579 WeakPolarHBondContact O-CG 3.29Å
576	N	81.4	Confident	72.1	Confident	91 Å²	91	112.7 Å²	112.7	49%	0.487	59%	0.586	S	S	.	*	H	α-helix	trans	-83	-41.1	173.4	-160.5	57.6	0	0	0	111.5	T574 L578 R579 I580	T574-N576 PolarHBondContact O-N 2.84Å; T574-N576 PolarHBondContact OG1-N 3.47Å; T574-N576 VanDerWaalsContact OG1-N 3.15Å; N576-L578 PolarHBondContact O-N 3.09Å; N576-R579 WeakPolarHBondContact O-CB 3.32Å; N576-R579 PolarHBondContact O-N 3.35Å; N576-R579 VanDerWaalsContact O-N 3.09Å; N576-I580 WeakPolarHBondContact O-CG1 3.38Å; N576-I580 PolarHBondContact O-N 3.18Å
577	D	82.6	Confident	72.9	Confident	71 Å²	71	115.6 Å²	115.6	38%	0.38	59%	0.587	S	S	.	*	H	α-helix	trans	-66.8	-39.6	179.6	-48.3	-46.7	0	0	0	110.9	P573 T574 R579 I580 K581	P573-D577 HydrophobicContact CB-CB 4.12Å; T574-D577 WeakPolarHBondContact CA-OD2 3.48Å; T574-D577 VanDerWaalsContact CB-OD2 3.26Å; T574-D577 WeakPolarHBondContact CB-OD2 2.97Å; T574-D577 WeakPolarHBondContact CG2-OD2 3.25Å; T574-D577 PolarHBondContact N-OD2 2.68Å; T574-D577 PolarHBondContact O-N 3.26Å; T574-D577 VanDerWaalsContact OG1-CG 3.24Å; T574-D577 PolarHBondContact OG1-N 3.24Å; T574-D577 PolarHBondContact OG1-OD2 2.89Å; D577-R579 VanDerWaalsContact C-N 3.29Å; D577-R579 PolarHBondContact O-N 3.05Å; D577-I580 PolarHBondContact O-N 3.41Å; D577-K581 WeakPolarHBondContact O-CB 3.46Å; D577-K581 PolarHBondContact O-N 3.44Å
578	L	83.9	Confident	73.7	Confident	93 Å²	93	116.3 Å²	116.3	49%	0.487	59%	0.586	S	S	.	*	H	α-helix	trans	-60.7	-35.2	171.3	-68.2	170.2	0	0	0	112.7	T574 L575 N576 H582	T574-L578 PolarHBondContact O-N 3.46Å; L575-L578 HydrophobicContact CD2-CD1 4.48Å; N576-L578 PolarHBondContact O-N 3.09Å; L578-H582 WeakPolarHBondContact O-CB 3.38Å; L578-H582 PolarHBondContact O-N 3.19Å; L578-H582 VanDerWaalsContact O-N 3.1Å
579	R	84	Confident	74.2	Confident	162 Å²	162	113.8 Å²	113.8	61%	0.611	58%	0.577	S	S	*	*	H	α-helix	trans	-73.2	-33.3	175.2	-73.8	167.7	-177.4	167.7	1.1	112.7	L575 N576 D577 K583	L575-R579 VanDerWaalsContact O-CD 3.25Å; L575-R579 WeakPolarHBondContact O-CD 3.49Å; L575-R579 WeakPolarHBondContact O-CG 3.29Å; N576-R579 WeakPolarHBondContact O-CB 3.32Å; N576-R579 PolarHBondContact O-N 3.35Å; N576-R579 VanDerWaalsContact O-N 3.09Å; D577-R579 VanDerWaalsContact C-N 3.29Å; D577-R579 PolarHBondContact O-N 3.05Å; R579-K583 WeakPolarHBondContact O-CG 3.39Å; R579-K583 PolarHBondContact O-N 3.4Å
580	I	82.9	Confident	74.4	Confident	73 Å²	73	115 Å²	115	37%	0.374	57%	0.572	S	S	.	*	H	α-helix	trans	-67.2	-52.9	174.6	-68.1	164.8	0	0	0	108.9	N576 D577 H582 K583 E584	N576-I580 WeakPolarHBondContact O-CG1 3.38Å; N576-I580 PolarHBondContact O-N 3.18Å; D577-I580 PolarHBondContact O-N 3.41Å; I580-H582 VanDerWaalsContact C-N 3.31Å; I580-H582 PolarHBondContact O-N 3.46Å; I580-K583 WeakPolarHBondContact O-CA 3.43Å; I580-K583 WeakPolarHBondContact O-CB 3.4Å; I580-K583 PolarHBondContact O-N 2.97Å; I580-E584 HydrophobicContact CG2-CG 4.39Å; I580-E584 WeakPolarHBondContact CG2-OE1 3.38Å; I580-E584 PolarHBondContact O-N 2.82Å
581	K	84.1	Confident	74	Confident	145 Å²	145	112.6 Å²	112.6	63%	0.63	56%	0.561	S	S	*	*	H	α-helix	trans	-56.1	-41.6	178.7	-166.4	170.1	-174.5	173.5	0	112.9	D577 K583 E584 Q585	D577-K581 WeakPolarHBondContact O-CB 3.46Å; D577-K581 PolarHBondContact O-N 3.44Å; K581-K583 VanDerWaalsContact C-N 3.33Å; K581-K583 PolarHBondContact O-N 3.27Å; K581-E584 PolarHBondContact O-N 2.88Å; K581-Q585 VanDerWaalsContact O-CB 3.27Å; K581-Q585 WeakPolarHBondContact O-CB 3.41Å; K581-Q585 PolarHBondContact O-N 3.49Å
582	H	81.3	Confident	73.1	Confident	103 Å²	103	111.9 Å²	111.9	48%	0.477	56%	0.558	S	S	.	*	H	α-helix	trans	-71	-21.7	175.3	179.3	-97.2	0	0	0	114	L578 I580 R586	L578-H582 WeakPolarHBondContact O-CB 3.38Å; L578-H582 PolarHBondContact O-N 3.19Å; L578-H582 VanDerWaalsContact O-N 3.1Å; I580-H582 VanDerWaalsContact C-N 3.31Å; I580-H582 PolarHBondContact O-N 3.46Å; H582-R586 PolarHBondContact CE1-NE 2.87Å; H582-R586 WeakPolarHBondContact O-CG 3.18Å
583	K	82.6	Confident	71.9	Confident	144 Å²	144	110.5 Å²	110.5	63%	0.626	56%	0.555	S	S	*	*	H	α-helix	trans	-77.8	-45.4	170.5	-79.5	-179.7	175	-173.8	0	111.7	R579 I580 K581 R586 Q587	R579-K583 WeakPolarHBondContact O-CG 3.39Å; R579-K583 PolarHBondContact O-N 3.4Å; I580-K583 WeakPolarHBondContact O-CA 3.43Å; I580-K583 WeakPolarHBondContact O-CB 3.4Å; I580-K583 PolarHBondContact O-N 2.97Å; K581-K583 VanDerWaalsContact C-N 3.33Å; K581-K583 PolarHBondContact O-N 3.27Å; K583-R586 PolarHBondContact O-N 3.48Å; K583-R586 VanDerWaalsContact O-N 3.16Å; K583-Q587 PolarHBondContact O-N 3.5Å
584	E	79.6	Confident	70.2	Confident	107 Å²	107	114.6 Å²	114.6	50%	0.5	57%	0.566	S	S	.	*	H	α-helix	trans	-60.2	-46.3	177.4	-68.1	167.1	161.4	0	0	110.9	I580 K581 R586 Q587 Q588	I580-E584 HydrophobicContact CG2-CG 4.39Å; I580-E584 WeakPolarHBondContact CG2-OE1 3.38Å; I580-E584 PolarHBondContact O-N 2.82Å; K581-E584 PolarHBondContact O-N 2.88Å; E584-R586 PolarHBondContact O-N 3.11Å; E584-Q587 PolarHBondContact O-N 2.94Å; E584-Q588 PolarHBondContact O-N 2.93Å
585	Q	77.5	Confident	68.1	Low	125 Å²	125	116.6 Å²	116.6	58%	0.584	58%	0.578	S	S	*	*	H	α-helix	trans	-63	-26.3	177.3	-165	171.9	36.7	0	0	113	K581 V589	K581-Q585 VanDerWaalsContact O-CB 3.27Å; K581-Q585 WeakPolarHBondContact O-CB 3.41Å; K581-Q585 PolarHBondContact O-N 3.49Å; Q585-V589 VanDerWaalsContact O-CG2 3.31Å; Q585-V589 WeakPolarHBondContact O-CG2 3.36Å
586	R	72.3	Confident	66.4	Low	149 Å²	149	119.6 Å²	119.6	56%	0.562	59%	0.589	S	S	*	*	H	α-helix	trans	-76.1	-41.4	169	-79.5	-177.3	169.4	-132	-4	112.4	H582 K583 E584 Q588 V589 H590	H582-R586 PolarHBondContact CE1-NE 2.87Å; H582-R586 WeakPolarHBondContact O-CG 3.18Å; K583-R586 PolarHBondContact O-N 3.48Å; K583-R586 VanDerWaalsContact O-N 3.16Å; E584-R586 PolarHBondContact O-N 3.11Å; R586-Q588 PolarHBondContact O-N 3.21Å; R586-V589 PolarHBondContact O-N 2.93Å; R586-H590 PolarHBondContact O-CD2 2.91Å; R586-H590 VanDerWaalsContact O-CG 3.25Å; R586-H590 PolarHBondContact O-N 3.03Å
587	Q	65.7	Low	64.3	Low	137 Å²	137	125.2 Å²	125.2	64%	0.64	61%	0.609	S	S	*	*	H	α-helix	trans	-62.9	-40.4	179.7	-72.3	178.4	-5	0	0	112.2	K583 E584 V589 H590 S591	K583-Q587 PolarHBondContact O-N 3.5Å; E584-Q587 PolarHBondContact O-N 2.94Å; Q587-V589 VanDerWaalsContact C-N 3.32Å; Q587-V589 PolarHBondContact O-N 3.27Å; Q587-H590 PolarHBondContact O-N 3.18Å; Q587-S591 PolarHBondContact O-N 2.91Å; Q587-S591 PolarHBondContact O-OG 2.92Å
588	Q	58.3	Low	62.2	Low	135 Å²	135	129.1 Å²	129.1	63%	0.631	63%	0.63	S	S	*	*	H	α-helix	trans	-64.1	-31.8	173.5	-74.9	-175.5	-36.5	0	0	113.9	E584 R586 H590 S591 N592	E584-Q588 PolarHBondContact O-N 2.93Å; R586-Q588 PolarHBondContact O-N 3.21Å; Q588-H590 PolarHBondContact O-N 3.48Å; Q588-S591 PolarHBondContact O-OG 3.33Å; Q588-S591 VanDerWaalsContact O-OG 3.12Å; Q588-N592 PolarHBondContact O-OD1 3.25Å
589	V	57.8	Low	60.3	Low	97 Å²	97	130.6 Å²	130.6	59%	0.588	64%	0.643	S	S	*	*	H	α-helix	trans	-74.9	-16.7	174.6	172	0	0	0	0	111.9	Q585 R586 Q587	Q585-V589 VanDerWaalsContact O-CG2 3.31Å; Q585-V589 WeakPolarHBondContact O-CG2 3.36Å; R586-V589 PolarHBondContact O-N 2.93Å; Q587-V589 VanDerWaalsContact C-N 3.32Å; Q587-V589 PolarHBondContact O-N 3.27Å
590	H	52.2	Low	58	Low	117 Å²	117	129.1 Å²	129.1	54%	0.542	65%	0.652	S	S	.	*	H	α-helix	trans	-94.6	-37.2	177.6	-60.3	-27.9	0	0	0	112.6	R586 Q587 Q588 N592 A593	R586-H590 PolarHBondContact O-CD2 2.91Å; R586-H590 VanDerWaalsContact O-CG 3.25Å; R586-H590 PolarHBondContact O-N 3.03Å; Q587-H590 PolarHBondContact O-N 3.18Å; Q588-H590 PolarHBondContact O-N 3.48Å; H590-N592 PolarHBondContact O-N 2.86Å; H590-A593 PolarHBondContact O-N 3.3Å
591	S	51.7	Low	55.8	Low	71 Å²	71	129.7 Å²	129.7	50%	0.497	67%	0.668	S	S	.	*	H	α-helix	trans	-61.6	-31.2	175.1	56	0	0	0	0	113.6	Q587 Q588 A593	Q587-S591 PolarHBondContact O-N 2.91Å; Q587-S591 PolarHBondContact O-OG 2.92Å; Q588-S591 PolarHBondContact O-OG 3.33Å; Q588-S591 VanDerWaalsContact O-OG 3.12Å; S591-A593 VanDerWaalsContact C-N 3.3Å; S591-A593 PolarHBondContact O-N 3.28Å
592	N	48	Very low	53.4	Low	132 Å²	132	132.3 Å²	132.3	71%	0.706	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	7.4	-173.5	-62	13	0	0	0	113.1	Q588 H590	Q588-N592 PolarHBondContact O-OD1 3.25Å; H590-N592 PolarHBondContact O-N 2.86Å
593	A	47.6	Very low	51.1	Low	74 Å²	74	136.9 Å²	136.9	61%	0.612	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.7	3.5	-176.2	0	0	0	0	0	113.9	H590 S591	H590-A593 PolarHBondContact O-N 3.3Å; S591-A593 VanDerWaalsContact C-N 3.3Å; S591-A593 PolarHBondContact O-N 3.28Å
594	E	40.7	Very low	48.7	Very low	176 Å²	176	135.5 Å²	135.5	82%	0.822	71%	0.707	S	S	*	*	S	Bend	trans	-95.8	-0.9	-171.9	-159.3	152.3	-144	0	0	113.6
595	T	39	Very low	46.4	Very low	116 Å²	116	138.4 Å²	138.4	71%	0.712	72%	0.723	S	S	*	*	S	Bend	trans	-108.2	143.9	167.6	48	0	0	0	0	111.1
596	Q	41.1	Very low	44.4	Very low	193 Å²	193	139 Å²	139	90%	0.902	74%	0.735	S	S	*	*	S	Bend	trans	76.7	46.4	-178.7	-52.9	-173.1	-15.9	0	0	118.1
597	K	37.8	Very low	42.6	Very low	210 Å²	210	141.9 Å²	141.9	91%	0.913	75%	0.752	S	S	*	*			trans	-137.3	75.4	156.1	-74.9	-160.8	175.9	177.8	0	114
598	D	38.4	Very low	41.4	Very low	153 Å²	153	147.2 Å²	147.2	82%	0.818	77%	0.766	S	S	*	*			trans	-119.9	161.2	162.6	-123.8	-42.5	0	0	0	110.9
599	T	43.8	Very low	40.4	Very low	124 Å²	124	151 Å²	151	76%	0.761	78%	0.78	S	S	*	*	S	Bend	trans	75.4	142.2	-175.8	76.9	0	0	0	0	118.3
600	T	35.9	Very low	39.2	Very low	130 Å²	130	157.7 Å²	157.7	80%	0.798	80%	0.795	S	S	*	*			trans	55.8	69.5	161.5	-34.5	0	0	0	0	117
601	A	36.5	Very low	38.5	Very low	85 Å²	85	157.5 Å²	157.5	70%	0.702	81%	0.806	S	S	*	*				72.1	102.6	60	0	0	0	0	0	116.4
602	K	33	Very low	37.8	Very low	200 Å²	200	160.1 Å²	160.1	87%	0.87	82%	0.819	S	S	*	*			trans	46.8	108.1	142	-56.8	174.3	-175.9	172.9	0	119.6
603	M	32.9	Very low	37	Very low	200 Å²	200	162.5 Å²	162.5	99%	0.985	83%	0.831	S	S	*	*			trans	-142	154.8	130.2	-148.9	170.7	179.6	0	0	111
604	T	33	Very low	36.3	Very low	115 Å²	115	162.5 Å²	162.5	71%	0.706	84%	0.838	S	S	*	*			trans	-125.2	140.7	-146.4	-31.2	0	0	0	0	112.9
605	M	30.8	Very low	35.9	Very low	168 Å²	168	163 Å²	163	83%	0.828	84%	0.84	S	S	*	*			trans	32.4	117.2	153.7	-66.8	-73.3	-167.7	0	0	119.2
606	T	36.4	Very low	35.7	Very low	136 Å²	136	165.2 Å²	165.2	83%	0.834	85%	0.847	S	S	*	*				-176.7	132.9	106.7	25	0	0	0	0	111.8
607	K	34.7	Very low	35.4	Very low	211 Å²	211	162.2 Å²	162.2	92%	0.917	84%	0.841	S	S	*	*			trans	-123.1	109.6	165.1	-76.2	-172.3	175.5	-178.5	0	109.5
608	R	39	Very low	35.1	Very low	249 Å²	249	160.4 Å²	160.4	94%	0.94	84%	0.836	S	S	*	*			trans	-95.7	174.6	165.4	-83.7	-176.4	171.8	161.4	-1.5	110.6
609	K	37.8	Very low	34.8	Very low	213 Å²	213	162.1 Å²	162.1	93%	0.926	84%	0.839	S	S	*	*			trans	-91.5	169.4	-156.3	-65.9	178.8	179.1	177.4	0	114.3
610	R	32.7	Very low	34.2	Very low	239 Å²	239	164.1 Å²	164.1	90%	0.902	84%	0.84	S	S	*	*			trans	-64.1	147.2	-176.7	-53	166.2	177	150.9	-5.5	115.2
611	S	37.5	Very low	34.2	Very low	112 Å²	112	165.4 Å²	165.4	78%	0.783	84%	0.842	S	S	*	*			trans	-157.1	120	130.8	47.4	0	0	0	0	106.4
612	V	36.3	Very low	34	Very low	127 Å²	127	168.8 Å²	168.8	77%	0.77	84%	0.843	S	S	*	*				76.5	101.3	62.1	177.2	0	0	0	0	112.6
613	L	31.3	Very low	34	Very low	182 Å²	182	168 Å²	168	95%	0.953	84%	0.84	S	S	*	*			trans	57.2	131.8	144	-152.3	75.5	0	0	0	120.1
614	G	33.8	Very low	34.1	Very low	73 Å²	73	165.6 Å²	165.6	75%	0.753	83%	0.83	S	S	*	*			trans	157.4	124.3	165.9	0	0	0	0	0	113
615	E	32.6	Very low	33.8	Very low	186 Å²	186	166 Å²	166	87%	0.869	84%	0.838	S	S	*	*			trans	-69.1	156.9	-179.9	-58.1	135.4	133.5	0	0	113
616	L	33.8	Very low	33.9	Very low	163 Å²	163	162.7 Å²	162.7	85%	0.853	83%	0.831	S	S	*	*			trans	-166.1	98.8	142.8	-109.2	156.6	0	0	0	112.9
617	V	34.8	Very low	33.7	Very low	130 Å²	130	162.3 Å²	162.3	79%	0.788	83%	0.828	S	S	*	*			trans	60.5	139.6	138.2	172.2	0	0	0	0	120.8
618	Q	31.9	Very low	33.6	Very low	173 Å²	173	160.3 Å²	160.3	81%	0.808	83%	0.826	S	S	*	*			trans	-63.1	144.3	172.3	-61.1	148.2	-68.8	0	0	112.3
619	Q	33.4	Very low	33.5	Very low	189 Å²	189	157.5 Å²	157.5	88%	0.883	82%	0.82	S	S	*	*			trans	-140	114.7	142.7	-163.2	166.7	19.6	0	0	109.3
620	E	30.9	Very low	33.2	Very low	166 Å²	166	154.2 Å²	154.2	78%	0.776	81%	0.813	S	S	*	*			trans	-70.1	139.4	172	-60	172.4	137.1	0	0	109.4
621	N	34.5	Very low	33.3	Very low	157 Å²	157	151 Å²	151	84%	0.84	81%	0.812	S	S	*	*			trans	-167.1	162.3	136.1	-109.3	-74.2	0	0	0	111.1
622	E	32.4	Very low	33	Very low	156 Å²	156	151.9 Å²	151.9	73%	0.729	81%	0.808	S	S	*	*			trans	-78	172.9	-165.8	-51.8	176.6	132	0	0	114.7
623	K	32.7	Very low	32.8	Very low	183 Å²	183	153.6 Å²	153.6	80%	0.796	81%	0.811	S	S	*	*			trans	76.3	99.7	167.3	-53.7	159.1	-172.4	166.4	0	115.9
624	L	35.8	Very low	33	Very low	150 Å²	150	151.2 Å²	151.2	79%	0.785	80%	0.804	S	S	*	*			trans	-161.3	65.8	136.4	-110.7	173.4	0	0	0	112.4	S626	L624-S626 PolarHBondContact O-N 3.49Å
625	S	27.1	Very low	32.9	Very low	124 Å²	124	155.4 Å²	155.4	87%	0.867	81%	0.809	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	81.4	173.2	39.4	0	0	0	0	112
626	S	32.9	Very low	33.2	Very low	97 Å²	97	154.6 Å²	154.6	68%	0.678	81%	0.805	S	S	*	*	T	Hydrogen-bonded Turn	trans	-165.4	10.6	170.8	40.8	0	0	0	0	118.2	L624	L624-S626 PolarHBondContact O-N 3.49Å
627	V	31.9	Very low	33.2	Very low	128 Å²	128	155.2 Å²	155.2	78%	0.776	80%	0.803	S	S	*	*			trans	-122.9	52.2	-173.8	-158	0	0	0	0	114.3
628	I	32.2	Very low	33.2	Very low	169 Å²	169	160.3 Å²	160.3	87%	0.867	81%	0.808	S	S	*	*			trans	-134.2	88.8	160.7	-53.1	-179.8	0	0	0	109.1
629	K	37.6	Very low	33.2	Very low	190 Å²	190	163.1 Å²	163.1	83%	0.826	81%	0.812	S	S	*	*			trans	-137	128.3	161.4	-79.5	-171.1	172.5	-177.3	0	108.9
630	N	30.9	Very low	33.3	Very low	144 Å²	144	161.9 Å²	161.9	77%	0.77	81%	0.81	S	S	*	*			trans	53.6	73.7	158.3	-52.2	17.5	0	0	0	115.9
631	I	34.7	Very low	33.4	Very low	171 Å²	171	159 Å²	159	88%	0.877	81%	0.808	S	S	*	*			trans	-103.8	74.7	150.5	-53.2	-179.5	0	0	0	107.6
632	D	31.2	Very low	33.3	Very low	132 Å²	132	157 Å²	157	71%	0.706	80%	0.802	S	S	*	*			trans	-87.9	169.5	157.7	-84.1	-61.4	0	0	0	109.7
633	I	33.3	Very low	33.2	Very low	163 Å²	163	155.2 Å²	155.2	84%	0.836	80%	0.801	S	S	*	*			trans	80	146.2	172.5	-42.2	165.7	0	0	0	114.6
634	V	34.2	Very low	33.2	Very low	132 Å²	132	153.8 Å²	153.8	80%	0.8	80%	0.801	S	S	*	*			trans	80.9	78.2	174.7	-159.5	0	0	0	0	117
635	D	32.6	Very low	33.2	Very low	161 Å²	161	151.9 Å²	151.9	86%	0.861	80%	0.796	S	S	*	*			trans	-135.1	59.3	139.4	-165.7	13.9	0	0	0	111.3
636	E	39.4	Very low	33.7	Very low	168 Å²	168	151 Å²	151	79%	0.785	79%	0.787	S	S	*	*			trans	-98.9	106.8	170.2	-80.7	-154.5	136.7	0	0	111.9	R638	E636-R638 VanDerWaalsContact C-N 3.27Å; E636-R638 PolarHBondContact O-N 2.91Å
637	H	33.1	Very low	33.9	Very low	176 Å²	176	153.9 Å²	153.9	82%	0.815	79%	0.794	S	S	*	*			trans	32.1	36.7	138.9	-62	-37	0	0	0	120.6	R639	H637-R639 VanDerWaalsContact C-N 3.28Å; H637-R639 PolarHBondContact O-N 3.47Å
638	R	34.4	Very low	34	Very low	237 Å²	237	153.1 Å²	153.1	89%	0.894	79%	0.792	S	S	*	*			trans	-76.5	72.7	-178.6	-149.2	176.5	-158.9	-155.8	6.2	112.9	E636 L640	E636-R638 VanDerWaalsContact C-N 3.27Å; E636-R638 PolarHBondContact O-N 2.91Å; R638-L640 PolarHBondContact O-N 3.07Å
639	R	33.4	Very low	34.3	Very low	233 Å²	233	152 Å²	152	88%	0.879	79%	0.789	S	S	*	*			trans	-55.3	108.5	175	-71.1	-178.5	67.9	177.6	1.6	110.5	H637 S641	H637-R639 VanDerWaalsContact C-N 3.28Å; H637-R639 PolarHBondContact O-N 3.47Å; R639-S641 PolarHBondContact O-N 2.98Å
640	L	34.4	Very low	34.1	Very low	162 Å²	162	151.9 Å²	151.9	85%	0.848	79%	0.791	S	S	*	*			trans	-66.1	101	173.8	-73.6	167.4	0	0	0	110.4	R638 V642	R638-L640 PolarHBondContact O-N 3.07Å; L640-V642 PolarHBondContact O-N 2.78Å; L640-V642 VanDerWaalsContact O-N 3.11Å
641	S	32.8	Very low	34.6	Very low	105 Å²	105	153.2 Å²	153.2	73%	0.734	80%	0.798	S	S	*	*			trans	-72.6	97.9	172.5	57.4	0	0	0	0	110.4	R639 V643	R639-S641 PolarHBondContact O-N 2.98Å; S641-V643 PolarHBondContact O-N 3.48Å; S641-V643 VanDerWaalsContact O-N 3.12Å
642	V	33.2	Very low	34.6	Very low	117 Å²	117	153.2 Å²	153.2	71%	0.709	79%	0.794	S	S	*	*			trans	-73.3	101.8	173.9	-177.9	0	0	0	0	109.2	L640 L644	L640-V642 PolarHBondContact O-N 2.78Å; L640-V642 VanDerWaalsContact O-N 3.11Å; V642-L644 HydrophobicContact CG1-CD2 3.85Å; V642-L644 HydrophobicContact CG1-CG 4.2Å; V642-L644 PolarHBondContact O-N 2.9Å
643	V	30.3	Very low	35.1	Very low	117 Å²	117	151.5 Å²	151.5	71%	0.709	79%	0.79	S	S	*	*			trans	-78.6	108.7	169.1	178.5	0	0	0	0	108.3	S641 T645	S641-V643 PolarHBondContact O-N 3.48Å; S641-V643 VanDerWaalsContact O-N 3.12Å; V643-T645 PolarHBondContact O-N 2.83Å
644	L	32.5	Very low	35.2	Very low	153 Å²	153	149.3 Å²	149.3	80%	0.801	79%	0.787	S	S	*	*			trans	-84.2	90.2	173.4	-66.8	177.1	0	0	0	109.9	V642	V642-L644 HydrophobicContact CG1-CD2 3.85Å; V642-L644 HydrophobicContact CG1-CG 4.2Å; V642-L644 PolarHBondContact O-N 2.9Å
645	T	36.2	Very low	35.3	Very low	111 Å²	111	151.9 Å²	151.9	68%	0.681	79%	0.787	S	S	*	*			trans	-69.3	129.1	166.7	-47.2	0	0	0	0	109	V643 I647	V643-T645 PolarHBondContact O-N 2.83Å; T645-I647 PolarHBondContact O-N 3.38Å
646	P	36.5	Very low	35.3	Very low	105 Å²	105	152.1 Å²	152.1	68%	0.682	79%	0.789	S	S	*	*			trans	-64.4	131.3	176.4	26.2	-33.7	0	0	0	110.6	C648	P646-C648 PolarHBondContact O-N 2.99Å; P646-C648 VanDerWaalsContact O-N 3.1Å
647	I	36.7	Very low	34.9	Very low	158 Å²	158	147.7 Å²	147.7	81%	0.81	78%	0.781	S	S	*	*			trans	-74.8	101.5	176.6	-59.3	173.4	0	0	0	107.9	T645 N649	T645-I647 PolarHBondContact O-N 3.38Å; I647-N649 PolarHBondContact O-N 2.85Å
648	C	35.7	Very low	34.9	Very low	111 Å²	111	147.6 Å²	147.6	75%	0.75	78%	0.781	S	S	*	*			trans	-72.7	121.6	167.4	-63.5	0	0	0	0	108.4	P646 E650	P646-C648 PolarHBondContact O-N 2.99Å; P646-C648 VanDerWaalsContact O-N 3.1Å; C648-E650 PolarHBondContact O-N 3.27Å
649	N	36.6	Very low	34.7	Very low	147 Å²	147	144.3 Å²	144.3	79%	0.786	78%	0.779	S	S	*	*			trans	-63.8	130.7	172.3	-77.5	-18.3	0	0	0	109.8	I647 N651	I647-N649 PolarHBondContact O-N 2.85Å; N649-N651 PolarHBondContact O-N 3.49Å
650	E	34.3	Very low	34.9	Very low	187 Å²	187	138.1 Å²	138.1	87%	0.874	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	105.8	175.6	-62.2	175.3	128.9	0	0	109.6	C648	C648-E650 PolarHBondContact O-N 3.27Å
651	N	41	Very low	34.7	Very low	171 Å²	171	138 Å²	138	91%	0.914	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	173.4	0.8	157.2	-97.2	-51.9	0	0	0	114.2	N649	N649-N651 PolarHBondContact O-N 3.49Å
652	Q	36.1	Very low	34.8	Very low	171 Å²	171	138.3 Å²	138.3	80%	0.799	77%	0.774	S	S	*	*			trans	-129.6	119.6	-179.3	-151.9	168.8	15.6	0	0	111.6
653	P	40.7	Very low	34.9	Very low	96 Å²	96	142.6 Å²	142.6	62%	0.623	78%	0.783	S	S	*	*			trans	-72.5	145.8	176.8	29.9	-34.1	0	0	0	110.9	F655	P653-F655 PolarHBondContact O-N 3.32Å
654	P	36.2	Very low	35.3	Very low	118 Å²	118	143.3 Å²	143.3	77%	0.766	78%	0.783	S	S	*	*			trans	-63.8	135.2	170.5	28.3	-33.7	0	0	0	109.9	D656	P654-D656 VanDerWaalsContact C-N 3.32Å; P654-D656 PolarHBondContact O-N 3.26Å
655	F	35.5	Very low	35.3	Very low	185 Å²	185	144.6 Å²	144.6	81%	0.811	79%	0.79	S	S	*	*			trans	-81.1	71.9	-172.2	-113.2	-88.5	0	0	0	112.5	P653 A657	P653-F655 PolarHBondContact O-N 3.32Å; F655-A657 VanDerWaalsContact C-N 3.26Å; F655-A657 HydrophobicContact CD1-CB 3.88Å; F655-A657 HydrophobicContact CE1-CB 4.49Å; F655-A657 PolarHBondContact O-N 2.71Å
656	D	31.8	Very low	35.5	Very low	166 Å²	166	147.6 Å²	147.6	89%	0.888	79%	0.794	S	S	*	*			trans	-70.7	83.6	161.5	-96.9	-38.7	0	0	0	109.7	P654	P654-D656 VanDerWaalsContact C-N 3.32Å; P654-D656 PolarHBondContact O-N 3.26Å
657	A	32.3	Very low	35.7	Very low	75 Å²	75	151.1 Å²	151.1	62%	0.62	79%	0.794	S	S	*	*			trans	-118.3	87.3	-179.7	0	0	0	0	0	111.4	F655	F655-A657 VanDerWaalsContact C-N 3.26Å; F655-A657 HydrophobicContact CD1-CB 3.88Å; F655-A657 HydrophobicContact CE1-CB 4.49Å; F655-A657 PolarHBondContact O-N 2.71Å
658	Q	32.1	Very low	35.9	Very low	175 Å²	175	152.4 Å²	152.4	82%	0.818	80%	0.797	S	S	*	*			trans	-17.4	135.3	172.5	-61.8	174.6	-4.2	0	0	117.8	S660	Q658-S660 PolarHBondContact O-N 2.71Å
659	I	30.5	Very low	36.1	Very low	167 Å²	167	152.2 Å²	152.2	86%	0.856	78%	0.783	S	S	*	*			trans	-63	92.4	167.1	-57.9	169.1	0	0	0	109.3
660	S	36.8	Very low	36.3	Very low	104 Å²	104	155.1 Å²	155.1	73%	0.727	78%	0.783	S	S	*	*			trans	-93.4	119.5	176.7	44.2	0	0	0	0	110.8	Q658 S662	Q658-S660 PolarHBondContact O-N 2.71Å; S660-S662 PolarHBondContact O-N 3.32Å
661	N	31.2	Very low	36.5	Very low	160 Å²	160	152.2 Å²	152.2	86%	0.856	76%	0.764	S	S	*	*			trans	-66.7	113.1	-172.9	-72.8	-62.1	0	0	0	112.5
662	S	34.9	Very low	36.6	Very low	110 Å²	110	149.5 Å²	149.5	77%	0.769	75%	0.749	S	S	*	*			trans	-128	124.9	163.6	65.6	0	0	0	0	111.9	S660 N664	S660-S662 PolarHBondContact O-N 3.32Å; S662-N664 PolarHBondContact O-N 2.75Å; S662-N664 VanDerWaalsContact O-N 3.08Å
663	K	35.3	Very low	36.7	Very low	208 Å²	208	148.3 Å²	148.3	90%	0.904	74%	0.738	S	S	*	*			trans	-81.4	84.6	-169.5	-63	173	-177.9	174.2	0	111.3
664	N	39.7	Very low	36.7	Very low	131 Å²	131	149.7 Å²	149.7	70%	0.701	74%	0.74	S	S	*	*			trans	-148.9	77.5	172.6	-101.7	-54.1	0	0	0	113.4	S662 K666	S662-N664 PolarHBondContact O-N 2.75Å; S662-N664 VanDerWaalsContact O-N 3.08Å; N664-K666 PolarHBondContact O-N 3.14Å
665	N	31.9	Very low	37.1	Very low	180 Å²	180	152.1 Å²	152.1	96%	0.963	74%	0.738	S	S	*	*			trans	-73.6	65	179.2	-103.7	-24.8	0	0	0	113.4
666	K	41	Very low	37.5	Very low	174 Å²	174	149.7 Å²	149.7	76%	0.757	73%	0.734	S	S	*	*			trans	-99.6	99.4	167.6	-73.2	-176	179	176.1	0	109.7	N664 Q668	N664-K666 PolarHBondContact O-N 3.14Å; K666-Q668 PolarHBondContact O-N 3.44Å; K666-Q668 VanDerWaalsContact O-N 3.08Å
667	R	39.9	Very low	38	Very low	179 Å²	179	149.9 Å²	149.9	68%	0.675	73%	0.729	S	S	*	*			trans	-51.4	112.2	175.1	-74.5	178.4	170.6	-115.7	-3.4	110.4	C462 F669	C462-R667 PolarHBondContact SG-NH1 3.09Å; R667-F669 HydrophobicContact CB-CE2 4.18Å; R667-F669 PolarHBondContact O-N 2.92Å
668	Q	41.6	Very low	38.4	Very low	186 Å²	186	154 Å²	154	87%	0.869	74%	0.736	S	S	*	*			trans	-83.9	100.1	173.9	-65.1	-172.9	9.8	0	0	109.7	K666 R670	K666-Q668 PolarHBondContact O-N 3.44Å; K666-Q668 VanDerWaalsContact O-N 3.08Å; Q668-R670 PolarHBondContact O-N 2.88Å
669	F	38.1	Very low	38.9	Very low	107 Å²	107	152.7 Å²	152.7	47%	0.469	74%	0.735	S	S	.	*			trans	-71.7	121.4	167	-64.8	-87.7	0	0	0	109	C462 R667 R671	C462-F669 HydrophobicContact CB-CE1 4.23Å; R667-F669 HydrophobicContact CB-CE2 4.18Å; R667-F669 PolarHBondContact O-N 2.92Å; F669-R671 PolarHBondContact O-N 3.33Å
670	R	42.5	Very low	39.5	Very low	208 Å²	208	152.4 Å²	152.4	79%	0.785	73%	0.729	S	S	*	*			trans	-82.9	111.8	169.7	-68.6	-171.9	-179.4	-169.3	2.3	108.2	Q668	Q668-R670 PolarHBondContact O-N 2.88Å
671	R	38.7	Very low	39.6	Very low	126 Å²	126	153.9 Å²	153.9	48%	0.475	73%	0.729	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.7	118.9	170	-73	-175.6	169.8	-160	-7.5	109	E460 F669 Y673	E460-R671 HydrophobicContact CG-CG 4.49Å; E460-R671 IonicContact OE1-CZ 2.76Å; E460-R671 IonicContact OE1-NE 3.6Å; E460-R671 PolarHBondContact OE1-NE 2.79Å; E460-R671 IonicContact OE1-NH2 2.74Å; E460-R671 PolarHBondContact OE1-NH2 3.48Å; F669-R671 PolarHBondContact O-N 3.33Å; R671-Y673 HydrophobicContact CB-CE2 4.11Å
672	L	41.2	Very low	40.1	Very low	113 Å²	113	153.3 Å²	153.3	59%	0.592	73%	0.726	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.2	131.1	169	-61.5	177.3	0	0	0	108.2
673	Y	38.2	Very low	40.4	Very low	147 Å²	147	155 Å²	155	58%	0.576	73%	0.727	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.5	110.8	172.3	-66.1	-89.1	0	0	0	107.5	V458 R671	V458-Y673 HydrophobicContact CG2-CE1 4.4Å; R671-Y673 HydrophobicContact CB-CE2 4.11Å
674	L	42.4	Very low	40.5	Very low	125 Å²	125	152.7 Å²	152.7	65%	0.654	72%	0.724	S	S	*	*			trans	-85.6	117.4	166.5	-73.1	160.7	0	0	0	106.9
675	F	42.8	Very low	40.4	Very low	169 Å²	169	153.1 Å²	153.1	74%	0.741	73%	0.726	S	S	*	*			trans	-96.4	115	168	-70.4	-85.2	0	0	0	107.3	Q677	F675-Q677 PolarHBondContact O-N 2.79Å
676	D	44.4	Very low	40.6	Very low	134 Å²	134	150.5 Å²	150.5	72%	0.717	72%	0.717	S	S	*	*			trans	-72.2	78.1	169.5	-64.9	-38.9	0	0	0	107.9	E678	D676-E678 PolarHBondContact O-N 3.43Å
677	Q	43.6	Very low	40.6	Very low	170 Å²	170	148.8 Å²	148.8	79%	0.794	72%	0.716	S	S	*	*			trans	-80.8	100.8	177.6	-171.9	164.7	10.3	0	0	108.8	F675 N679	F675-Q677 PolarHBondContact O-N 2.79Å; Q677-N679 PolarHBondContact O-N 2.94Å
678	E	39.9	Very low	40.2	Very low	162 Å²	162	146.4 Å²	146.4	76%	0.757	72%	0.717	S	S	*	*			trans	-61.8	121.8	173.5	-62	-176.2	145.3	0	0	109.2	D676 E680	D676-E678 PolarHBondContact O-N 3.43Å; E678-E680 PolarHBondContact O-N 3.46Å
679	N	42.5	Very low	40.2	Very low	147 Å²	147	144 Å²	144	79%	0.786	71%	0.714	S	S	*	*			trans	-73.9	96.6	175	-81.2	-16.4	0	0	0	109	Q677 D681	Q677-N679 PolarHBondContact O-N 2.94Å; N679-D681 PolarHBondContact O-N 3.22Å
680	E	42.3	Very low	40	Very low	160 Å²	160	145.4 Å²	145.4	75%	0.748	73%	0.726	S	S	*	*			trans	-66.1	107.6	165.7	-81.9	-76.2	-174.2	0	0	109.9	E678 N682	E678-E680 PolarHBondContact O-N 3.46Å; E680-N682 VanDerWaalsContact C-N 3.28Å; E680-N682 PolarHBondContact O-N 2.98Å; E680-N682 PolarHBondContact O-ND2 2.83Å
681	D	39.5	Very low	39.9	Very low	136 Å²	136	143.3 Å²	143.3	73%	0.727	73%	0.731	S	S	*	*			trans	-64.9	81.7	177	-77.5	-38.3	0	0	0	110.9	N679 N683	N679-D681 PolarHBondContact O-N 3.22Å; D681-N683 VanDerWaalsContact C-N 3.31Å; D681-N683 PolarHBondContact O-N 3.28Å; D681-N683 PolarHBondContact O-ND2 3.28Å
682	N	42.1	Very low	39.7	Very low	148 Å²	148	143.2 Å²	143.2	79%	0.791	74%	0.736	S	S	*	*			trans	-68.5	87.9	174.8	-82.8	-90.2	0	0	0	110.1	E680 D684	E680-N682 VanDerWaalsContact C-N 3.28Å; E680-N682 PolarHBondContact O-N 2.98Å; E680-N682 PolarHBondContact O-ND2 2.83Å; N682-D684 PolarHBondContact O-N 3.29Å
683	N	40.9	Very low	39.7	Very low	145 Å²	145	149.4 Å²	149.4	78%	0.775	75%	0.753	S	S	*	*			trans	-58.8	130.6	173.2	-79.9	-99.8	0	0	0	110.5	D681 N685	D681-N683 VanDerWaalsContact C-N 3.31Å; D681-N683 PolarHBondContact O-N 3.28Å; D681-N683 PolarHBondContact O-ND2 3.28Å; N683-N685 PolarHBondContact O-N 3.08Å
684	D	36.6	Very low	39.4	Very low	160 Å²	160	150.8 Å²	150.8	86%	0.856	76%	0.757	S	S	*	*			trans	-59	123.5	175.9	-70.6	-64.8	0	0	0	111.7	N682	N682-D684 PolarHBondContact O-N 3.29Å
685	N	39.1	Very low	39.2	Very low	139 Å²	139	152.7 Å²	152.7	74%	0.743	77%	0.767	S	S	*	*			trans	-132.8	88	168.5	-165.7	-13.7	0	0	0	110.3	N683 N687	N683-N685 PolarHBondContact O-N 3.08Å; N685-N687 PolarHBondContact O-N 3.04Å; N685-N687 PolarHBondContact OD1-ND2 3.37Å
686	V	36.2	Very low	39	Very low	126 Å²	126	151.7 Å²	151.7	76%	0.764	76%	0.763	S	S	*	*			trans	-72.3	112.2	-176.6	177.5	0	0	0	0	110.8
687	N	39.5	Very low	38.7	Very low	138 Å²	138	152.1 Å²	152.1	74%	0.738	77%	0.765	S	S	*	*			trans	-142.2	75.9	168	-87.9	-70.5	0	0	0	112.9	N685	N685-N687 PolarHBondContact O-N 3.04Å; N685-N687 PolarHBondContact OD1-ND2 3.37Å
688	N	32.8	Very low	38.5	Very low	129 Å²	129	149.9 Å²	149.9	69%	0.69	76%	0.763	S	S	*	*			trans	20.3	114.2	133.1	-174.7	41.2	0	0	0	119.6
689	V	41.5	Very low	38.4	Very low	134 Å²	134	151.1 Å²	151.1	81%	0.812	77%	0.766	S	S	*	*			trans	-156	129	137.4	165.1	0	0	0	0	108.5
690	D	34.2	Very low	38.2	Very low	137 Å²	137	149.4 Å²	149.4	73%	0.733	76%	0.76	S	S	*	*			trans	-72.2	149.9	172.3	-59.7	-76.7	0	0	0	113.1
691	N	39.7	Very low	37.9	Very low	164 Å²	164	148.2 Å²	148.2	88%	0.877	76%	0.76	S	S	*	*			trans	-158.8	127.9	141.3	-110	-53.3	0	0	0	113.8
692	E	35.3	Very low	37.8	Very low	124 Å²	124	148.2 Å²	148.2	58%	0.579	76%	0.764	S	S	*	*			trans	-70	140.2	-179.5	176.2	-174.7	-176.9	0	0	112.5	R694	E692-R694 HydrophobicContact CG-CB 4.13Å; E692-R694 WeakPolarHBondContact OE1-CD 3.36Å; E692-R694 IonicContact OE1-NE 2.71Å; E692-R694 IonicContact OE1-NH1 3.96Å; E692-R694 PolarHBondContact OE1-NH1 2.81Å
693	Y	39.4	Very low	37.6	Very low	243 Å²	243	144.9 Å²	144.9	95%	0.953	77%	0.765	S	S	*	*			trans	-143	137.8	145.1	-101.1	-73.9	0	0	0	110.8
694	R	32.3	Very low	37.3	Very low	177 Å²	177	145.6 Å²	145.6	67%	0.668	77%	0.769	S	S	*	*			trans	-142.8	120.5	-152	166.4	-176.6	171.2	-167.3	2.8	112.7	E692	E692-R694 HydrophobicContact CG-CB 4.13Å; E692-R694 WeakPolarHBondContact OE1-CD 3.36Å; E692-R694 IonicContact OE1-NE 2.71Å; E692-R694 IonicContact OE1-NH1 3.96Å; E692-R694 PolarHBondContact OE1-NH1 2.81Å
695	L	38.4	Very low	37.4	Very low	164 Å²	164	144.6 Å²	144.6	86%	0.859	77%	0.768	S	S	*	*			trans	-165.7	138	169.6	-137.6	66.9	0	0	0	110.6
696	K	39.3	Very low	37.2	Very low	149 Å²	149	141.6 Å²	141.6	65%	0.648	76%	0.763	S	S	*	*			cis	-167.1	146.3	-40.2	-128.6	-175.5	-177.1	176.9	0	108.9
697	N	38.2	Very low	37.1	Very low	143 Å²	143	141 Å²	141	77%	0.765	77%	0.765	S	S	*	*			trans	68.3	150	165.8	-42.7	-21.3	0	0	0	115.3
698	T	38.6	Very low	37.2	Very low	122 Å²	122	144.1 Å²	144.1	75%	0.748	77%	0.771	S	S	*	*			cis	-125	138.2	-2.2	41.4	0	0	0	0	109.3
699	K	37.4	Very low	37.1	Very low	189 Å²	189	145.5 Å²	145.5	82%	0.822	77%	0.774	S	S	*	*				46.5	127.7	93.6	-79.7	-165.2	173	-167.4	0	113.6
700	T	38.4	Very low	36.8	Very low	110 Å²	110	146.6 Å²	146.6	68%	0.675	77%	0.774	S	S	*	*			cis	-160.4	171.1	14.9	14.5	0	0	0	0	109
701	D	35.9	Very low	36.6	Very low	136 Å²	136	146.8 Å²	146.8	73%	0.727	77%	0.768	S	S	*	*			cis	-153.6	169.4	3.2	-127.1	-27.3	0	0	0	114.7
702	V	37.8	Very low	36	Very low	136 Å²	136	147.3 Å²	147.3	82%	0.824	76%	0.759	S	S	*	*			trans	16.6	130.8	155.5	174.5	0	0	0	0	121.2
703	G	38.9	Very low	36.1	Very low	78 Å²	78	148.2 Å²	148.2	80%	0.804	77%	0.768	S	S	*	*			trans	-173.3	31.1	165.4	0	0	0	0	0	116.3
704	N	33.6	Very low	35.9	Very low	160 Å²	160	144.4 Å²	144.4	86%	0.856	77%	0.765	S	S	*	*			trans	-96.8	119.2	-160.5	-142.9	8.3	0	0	0	113.6
705	T	39.5	Very low	36.1	Very low	138 Å²	138	141.8 Å²	141.8	85%	0.847	77%	0.77	S	S	*	*			trans	-161.3	158.6	147.5	41	0	0	0	0	111.5
706	A	34.4	Very low	35.7	Very low	77 Å²	77	140.2 Å²	140.2	64%	0.636	77%	0.767	S	S	*	*			cis	-170.2	140.5	-46.2	0	0	0	0	0	109.8
707	S	34.5	Very low	35.4	Very low	114 Å²	114	139 Å²	139	80%	0.797	78%	0.778	S	S	*	*			trans	70.9	151.8	165	-35.4	0	0	0	0	116.6
708	K	41.4	Very low	35.2	Very low	202 Å²	202	136.8 Å²	136.8	88%	0.878	77%	0.774	S	S	*	*			cis	-125.9	136.1	3.6	-69.3	174.4	179.8	177.3	0	110.9
709	Q	31	Very low	34.7	Very low	159 Å²	159	138.8 Å²	138.8	74%	0.743	78%	0.778	S	S	*	*			trans	-85.1	153.7	155.5	-68.5	-171.9	25.9	0	0	109.9
710	L	34.6	Very low	34.5	Very low	156 Å²	156	132.9 Å²	132.9	82%	0.817	77%	0.771	S	S	*	*			trans	171.9	107.5	144.1	-93.6	157.5	0	0	0	105	Y712	L710-Y712 HydrophobicContact CD2-CD2 4.08Å
711	K	29.3	Very low	34.4	Very low	141 Å²	141	136.3 Å²	136.3	61%	0.613	78%	0.777	S	S	*	*			cis	70.6	133.7	33	-153.8	177.4	-176.6	176	0	112.8
712	Y	28.2	Very low	34.1	Very low	175 Å²	175	137 Å²	137	69%	0.686	78%	0.78	S	S	*	*			trans	95.3	144.5	174.6	-59.3	-69.2	0	0	0	119.1	L710	L710-Y712 HydrophobicContact CD2-CD2 4.08Å
713	N	37	Very low	34	Very low	144 Å²	144	137 Å²	137	77%	0.77	78%	0.775	S	S	*	*			trans	77.3	95.2	160.1	-55.6	-18.6	0	0	0	119.5
714	N	35.2	Very low	33.6	Very low	163 Å²	163	138.9 Å²	138.9	87%	0.872	77%	0.766	S	S	*	*			trans	-53.5	145.7	134.9	-77.1	-16.1	0	0	0	109.5
715	P	37.4	Very low	33.8	Very low	121 Å²	121	139.5 Å²	139.5	79%	0.786	77%	0.769	S	S	*	*			trans	-125.5	132.1	130.8	34	-27.3	0	0	0	111.9
716	T	28.8	Very low	33.5	Very low	131 Å²	131	140.8 Å²	140.8	80%	0.804	77%	0.766	S	S	*	*			trans	-59.5	131	170.3	19.7	0	0	0	0	111.8
717	S	33.5	Very low	33.5	Very low	124 Å²	124	142.6 Å²	142.6	87%	0.867	77%	0.771	S	S	*	*			trans	-107	77.8	164.6	-169.4	0	0	0	0	110.2
718	S	33.8	Very low	33.4	Very low	97 Å²	97	141.8 Å²	141.8	68%	0.678	76%	0.761	S	S	*	*			trans	-117.5	94.3	172.4	56.8	0	0	0	0	109.1
719	I	29.2	Very low	33.2	Very low	163 Å²	163	138.6 Å²	138.6	84%	0.836	76%	0.759	S	S	*	*			trans	-138.9	135.9	177.6	-91.4	161.6	0	0	0	109.2
720	G	33.2	Very low	33.4	Very low	65 Å²	65	135.9 Å²	135.9	67%	0.67	75%	0.754	S	S	*	*			trans	134.6	68.4	-168.2	0	0	0	0	0	109.8
721	K	35.1	Very low	33.3	Very low	183 Å²	183	135.5 Å²	135.5	80%	0.796	75%	0.752	S	S	*	*				56.3	103.6	89	-60.1	-170.9	177.2	-170	0	110.6
722	L	29.3	Very low	33.9	Very low	151 Å²	151	133.8 Å²	133.8	79%	0.791	76%	0.756	S	S	*	*			cis	69.3	73.7	26.5	-148.8	171.3	0	0	0	113.4
723	D	35.4	Very low	34.4	Very low	135 Å²	135	134.7 Å²	134.7	72%	0.722	76%	0.763	S	S	*	*			trans	-149.7	122.3	153.6	-87.8	-54.6	0	0	0	105.8
724	N	30.7	Very low	34.7	Very low	118 Å²	118	133.4 Å²	133.4	63%	0.631	76%	0.76	S	S	*	*				84.1	92	65.7	-72.9	-38.9	0	0	0	114
725	N	37.5	Very low	34.8	Very low	172 Å²	172	131.2 Å²	131.2	92%	0.92	75%	0.753	S	S	*	*				-179.3	160.8	125.2	-89.2	-35.7	0	0	0	114.2
726	Q	34.1	Very low	35	Very low	165 Å²	165	131.7 Å²	131.7	77%	0.771	75%	0.754	S	S	*	*			trans	-92.7	-178.4	-170.7	-86.1	-168.5	36.3	0	0	114	V728	Q726-V728 HydrophobicContact CG-CG2 4.2Å
727	P	35.5	Very low	35.2	Very low	116 Å²	116	131.1 Å²	131.1	75%	0.753	76%	0.755	S	S	*	*			cis	-116.9	158.2	2.4	16.8	8.2	0	0	0	114.3
728	V	31.5	Very low	35.5	Very low	96 Å²	96	137.5 Å²	137.5	58%	0.582	76%	0.76	S	S	*	*				73.8	98.6	55.4	-176.5	0	0	0	0	114.9	Q726 T730	Q726-V728 HydrophobicContact CG-CG2 4.2Å; V728-T730 HydrophobicContact CG1-CG2 4.15Å
729	T	37.8	Very low	35.6	Very low	136 Å²	136	138 Å²	138	83%	0.834	76%	0.764	S	S	*	*			trans	-173.5	87.8	143.1	20.3	0	0	0	0	108
730	T	34.6	Very low	36	Very low	102 Å²	102	141.8 Å²	141.8	63%	0.626	77%	0.767	S	S	*	*				69	126.7	78.9	63.9	0	0	0	0	117.3	V728	V728-T730 HydrophobicContact CG1-CG2 4.15Å
731	N	33.1	Very low	36.5	Very low	147 Å²	147	148.1 Å²	148.1	79%	0.786	78%	0.777	S	S	*	*			trans	85.5	150.8	147.3	-67.1	-18.1	0	0	0	120.8
732	P	41.8	Very low	36.5	Very low	106 Å²	106	148.7 Å²	148.7	69%	0.688	78%	0.779	S	S	*	*				-143.1	-168.7	-62	35.8	-15.4	0	0	0	114.4
733	K	38.8	Very low	37.4	Very low	193 Å²	193	152.9 Å²	152.9	84%	0.839	80%	0.802	S	S	*	*			trans	88.2	140	160.1	-71.3	-174.2	175.3	179.9	0	119
734	V	42.1	Very low	37.5	Very low	117 Å²	117	153.8 Å²	153.8	71%	0.709	81%	0.806	S	S	*	*			cis	-161.2	144.6	-27.8	95.8	0	0	0	0	110
735	T	38.2	Very low	37.9	Very low	117 Å²	117	155.7 Å²	155.7	72%	0.718	82%	0.816	S	S	*	*			trans	15.3	153	157.2	62.2	0	0	0	0	121.7
736	T	40.8	Very low	37.9	Very low	132 Å²	132	154.8 Å²	154.8	81%	0.81	81%	0.81	S	S	*	*			cis	-146.7	153.7	37.8	42.8	0	0	0	0	113.8
737	S	33	Very low	38.1	Very low	119 Å²	119	154.2 Å²	154.2	83%	0.832	81%	0.812	S	S	*	*			trans	-97.7	148.3	179.1	-38.5	0	0	0	0	111.9
738	R	39.4	Very low	38.3	Very low	258 Å²	258	156.6 Å²	156.6	97%	0.974	82%	0.816	S	S	*	*			trans	-150.9	137.5	146	-129.8	173.8	-174.4	-178.4	1.8	113.3
739	S	36	Very low	38.7	Very low	108 Å²	108	160.6 Å²	160.6	76%	0.755	83%	0.831	S	S	*	*			trans	-100	142.7	-179.3	169.5	0	0	0	0	111.7
740	R	39.3	Very low	38.8	Very low	241 Å²	241	162.4 Å²	162.4	91%	0.909	83%	0.831	S	S	*	*			trans	-155.7	111.1	153	-93.8	163.3	-172.7	-165.3	-1.6	104.7
741	K	41.7	Very low	39.1	Very low	198 Å²	198	167 Å²	167	86%	0.861	85%	0.847	S	S	*	*				80.3	134.8	62.8	-165.8	176.1	-177.7	-176	0	111.7
742	K	35.2	Very low	39.6	Very low	196 Å²	196	168.7 Å²	168.7	85%	0.852	85%	0.852	S	S	*	*			trans	-53.7	150.3	-174.2	-64.4	-178.4	175.3	-176.1	0	113.9
743	N	48.9	Very low	39.4	Very low	239 Å²	239	174.4 Å²	174.4	100%	1.278	87%	0.867	S	S	*	*				-112.7	0	126.6	-102.7	-2	0	0	0	107.8

Retrieved 743 of 743 residues in 276.2 ms (Link to these results)

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