A0A2K6BN14_MACNE Loading...

RBR-type E3 ubiquitin transferase

AlphaFold DB , UniProt , Accession A0A2K6BN14, Species MACNE (Macaca nemestrina, Pig-tailed macaque), Gene RNF19A, Length 838 aa.

						>A0A2K6BN14_MACNE|A0A2K6BN14|RNF19A
MQEQEIGFISKYNEGLCVNTDPDSILTNILDMSLHRQMGSDRDLQSSASSVSLPSVKKAPKKRRISIGSLFRRKKDSKRKSRELNGGVDGIASIESIHSEMCTDKNSIFSTNTSSDNGLTSISKQIGDFIECPLCLLRHSKDRFPDIMTCHHRSCVDCLRQYLRIEISESRVNISCPECTERFNPHDIRLILSDDVLMEKYEEFMLRRWLVADPDCRWCPAPDCGYAVIAFGCASCPKLTCGREGCGTEFCYHCKQIWHPNQTCDAARQERAQSLRLRTIRSSSISYSQESGAAADDIKPCPRCAAYIIKMNDGSCNHMTCAVCGCEFCWLCMKEISDLHYLSPSGCTFWGKKPWSRKKKILWQLGTLVGAPVGIALIAGIAIPAMIIGIPVYVGRKIHNRYEGKDVSKHKRNLAIAGGVTLSVIVSPVVAAVTVGIGVPIMLAYVYGVVPISLCRSGGCGVSAGNGKGVRIEFDDENDINVGGTNTAVDTTSVAEARHNPSIGEGSVGGLTGSLSASGSHMDRIGAIRDNLSETASTMALAGASITGSLSGSAMVNCFNRLEVQADVQKERYSLSGESGTVSLGTVSDNASTKAMAGSILNSYIPLDKEGNSMEVQVDIESKPSKFRHNSGSSSVDDGSATRSHAGGSSSGLPEGKSSATKWSKEATAGKKSKSGKLRKKGNMKINETREDMDAQLLEQQSTNSSEFEAPSLSDSMPSVADSHSSHFSEFSCSDLESMKTSCSHGSSDYHTRFATVNILPEVENDRLENSPHQCSISVVTQTASCSEVPQLNHIAEEHSKNGIKSNVDLYFGDTLKETNNNHSHQTMELKVAIQTEI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.6	Very low	31	Very low	241 Å²	241	179.1 Å²	179.1	100%	1.187	90%	0.904	S	S	*	*				0	147.1	0	-83.5	-178.9	156.4	0	0	107.7
2	Q	32	Very low	30.6	Very low	196 Å²	196	184.8 Å²	184.8	92%	0.916	91%	0.909	S	S	*	*			trans	58.5	70.2	-157	-67.3	-174.8	-46	0	0	113.3
3	E	31	Very low	30.2	Very low	196 Å²	196	182.7 Å²	182.7	92%	0.916	90%	0.904	S	S	*	*	S	Bend	trans	179.2	52.8	143.8	-103.3	-170.1	161.9	0	0	109.9
4	Q	29.1	Very low	29.9	Very low	202 Å²	202	183.6 Å²	183.6	94%	0.944	91%	0.905	S	S	*	*			trans	-154.7	40.5	-178.3	-140.6	168.4	21.9	0	0	114.8
5	E	32.5	Very low	30.3	Very low	195 Å²	195	176.6 Å²	176.6	91%	0.911	90%	0.899	S	S	*	*			trans	-138.5	27.2	175.6	-150.2	158.7	-146.8	0	0	113.1
6	I	35.2	Very low	30	Very low	179 Å²	179	175.1 Å²	175.1	92%	0.918	89%	0.892	S	S	*	*	S	Bend	trans	-118	80.4	168.6	-53.9	177.4	0	0	0	106.8
7	G	30.7	Very low	30	Very low	65 Å²	65	172.2 Å²	172.2	67%	0.67	89%	0.89	S	S	*	*	S	Bend	trans	-163.5	-11.6	-170.4	0	0	0	0	0	117.9
8	F	26.8	Very low	30.1	Very low	207 Å²	207	168.8 Å²	168.8	91%	0.908	88%	0.878	S	S	*	*	S	Bend	trans	-142	89.2	177.6	-95	-86.2	0	0	0	111.9
9	I	29	Very low	30.2	Very low	177 Å²	177	168.4 Å²	168.4	91%	0.908	88%	0.877	S	S	*	*			trans	-173.1	84.9	142.4	-88.5	145.4	0	0	0	105
10	S	29.2	Very low	30.4	Very low	116 Å²	116	165.4 Å²	165.4	81%	0.811	87%	0.866	S	S	*	*			trans	-158.9	63.3	173.2	-169.6	0	0	0	0	109.6
11	K	28.4	Very low	30.5	Very low	196 Å²	196	163.5 Å²	163.5	85%	0.852	86%	0.857	S	S	*	*			trans	-178.9	59.9	168.9	-108.8	171.4	-176.5	-178.3	0	112.1
12	Y	25.2	Very low	30.7	Very low	248 Å²	248	156.6 Å²	156.6	97%	0.973	83%	0.83	S	S	*	*			trans	-145.6	119.7	147.5	-95.8	-71.6	0	0	0	107.3
13	N	26.2	Very low	30.8	Very low	157 Å²	157	153.7 Å²	153.7	84%	0.84	82%	0.821	S	S	*	*			trans	-138.8	86.6	-172.9	177.2	69.3	0	0	0	108.7
14	E	25.2	Very low	30.9	Very low	195 Å²	195	147.7 Å²	147.7	91%	0.911	80%	0.801	S	S	*	*			trans	-148.2	147.1	164.8	-117.7	163.2	-143.5	0	0	108
15	G	37.1	Very low	31.6	Very low	79 Å²	79	142.5 Å²	142.5	81%	0.814	78%	0.778	S	S	*	*			trans	-77.8	126.9	-157.4	0	0	0	0	0	114.4
16	L	25.6	Very low	32.1	Very low	153 Å²	153	139.4 Å²	139.4	80%	0.801	77%	0.768	S	S	*	*			trans	-135.8	114.7	164.8	-141.2	78.8	0	0	0	110.1	V18	L16-V18 PolarHBondContact O-N 2.99Å
17	C	29.8	Very low	32.1	Very low	126 Å²	126	135.1 Å²	135.1	85%	0.851	75%	0.75	S	S	*	*			trans	-77.7	114	164.5	-67.5	0	0	0	0	107.7	N19	C17-N19 PolarHBondContact O-N 2.99Å
18	V	30.8	Very low	32.2	Very low	111 Å²	111	136.6 Å²	136.6	67%	0.673	74%	0.742	S	S	*	*			trans	-81.9	108.3	-179.6	-179.1	0	0	0	0	109.2	L16 T20	L16-V18 PolarHBondContact O-N 2.99Å; V18-T20 HydrophobicContact CG1-CG2 4.11Å
19	N	32	Very low	33	Very low	160 Å²	160	132.3 Å²	132.3	86%	0.856	73%	0.728	S	S	*	*			trans	-71.3	135.9	160.5	-70.6	-16	0	0	0	108.7	C17	C17-N19 PolarHBondContact O-N 2.99Å
20	T	34.5	Very low	33.6	Very low	108 Å²	108	129.6 Å²	129.6	66%	0.663	71%	0.714	S	S	*	*			trans	-136	136.7	172.1	28.2	0	0	0	0	109.9	V18	V18-T20 HydrophobicContact CG1-CG2 4.11Å
21	D	32.1	Very low	33.7	Very low	127 Å²	127	128.5 Å²	128.5	68%	0.679	70%	0.7	S	S	*	*			trans	-71	140.2	-171.3	-54.9	-67.5	0	0	0	112.8	D23	D21-D23 PolarHBondContact O-N 3.38Å
22	P	41.3	Very low	34.1	Very low	96 Å²	96	126.1 Å²	126.1	62%	0.623	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-33.4	-170.8	25.9	-34.7	0	0	0	113.9	S24 I25	P22-S24 PolarHBondContact O-N 3.4Å; P22-I25 PolarHBondContact O-N 2.77Å
23	D	36	Very low	34.8	Very low	134 Å²	134	118.7 Å²	118.7	72%	0.717	68%	0.677	S	S	*	*	H	α-helix	trans	-66.5	-23.2	-173	-60.6	-23	0	0	0	113.3	D21 I25 T27	D21-D23 PolarHBondContact O-N 3.38Å; D23-I25 VanDerWaalsContact C-N 3.31Å; D23-I25 PolarHBondContact O-N 3.42Å; D23-T27 PolarHBondContact O-OG1 3.02Å; D23-T27 VanDerWaalsContact O-OG1 3.12Å
24	S	32.4	Very low	35.1	Very low	71 Å²	71	117.6 Å²	117.6	50%	0.497	67%	0.671	S	S	.	*	H	α-helix	trans	-67.3	-30.7	174.7	-174.9	0	0	0	0	112.5	P22 T27 N28	P22-S24 PolarHBondContact O-N 3.4Å; S24-T27 PolarHBondContact O-OG1 3.49Å; S24-N28 WeakPolarHBondContact O-CB 3.37Å; S24-N28 PolarHBondContact O-N 3.4Å; S24-N28 PolarHBondContact O-ND2 3.06Å
25	I	43.4	Very low	35.4	Very low	92 Å²	92	115.3 Å²	115.3	47%	0.472	66%	0.66	S	S	.	*	H	α-helix	trans	-83.7	-39.3	-172.6	-60.8	178.3	0	0	0	111.1	P22 D23 T27 N28 I29	P22-I25 PolarHBondContact O-N 2.77Å; D23-I25 VanDerWaalsContact C-N 3.31Å; D23-I25 PolarHBondContact O-N 3.42Å; I25-T27 VanDerWaalsContact C-N 3.32Å; I25-T27 PolarHBondContact O-N 3.23Å; I25-N28 PolarHBondContact O-N 3.2Å; I25-I29 HydrophobicContact CG2-CD1 3.55Å; I25-I29 HydrophobicContact CG2-CG1 4.18Å; I25-I29 WeakPolarHBondContact O-CG1 3.5Å; I25-I29 PolarHBondContact O-N 3.01Å; I25-I29 VanDerWaalsContact O-N 3.08Å
26	L	42	Very low	35.1	Very low	131 Å²	131	122.2 Å²	122.2	69%	0.686	66%	0.661	S	S	*	*	H	α-helix	trans	-63	-38.9	-178.3	-169.2	68.7	0	0	0	112.1	L30	L26-L30 WeakPolarHBondContact O-CD1 3.25Å; L26-L30 WeakPolarHBondContact O-CG 3.47Å
27	T	36.1	Very low	35.7	Very low	89 Å²	89	123.3 Å²	123.3	55%	0.546	66%	0.662	S	S	.	*	H	α-helix	trans	-70.7	-53	176.5	42.7	0	0	0	0	111.9	D23 S24 I25 I29 L30 D31	D23-T27 PolarHBondContact O-OG1 3.02Å; D23-T27 VanDerWaalsContact O-OG1 3.12Å; S24-T27 PolarHBondContact O-OG1 3.49Å; I25-T27 VanDerWaalsContact C-N 3.32Å; I25-T27 PolarHBondContact O-N 3.23Å; T27-I29 VanDerWaalsContact C-N 3.35Å; T27-I29 PolarHBondContact O-N 3.33Å; T27-L30 PolarHBondContact O-N 3.4Å; T27-D31 PolarHBondContact O-N 3.12Å
28	N	33.5	Very low	35.7	Very low	95 Å²	95	125.6 Å²	125.6	51%	0.508	66%	0.663	S	S	.	*	H	α-helix	trans	-63.2	-33.9	-176.4	-81.1	-76	0	0	0	114	S24 I25 M32	S24-N28 WeakPolarHBondContact O-CB 3.37Å; S24-N28 PolarHBondContact O-N 3.4Å; S24-N28 PolarHBondContact O-ND2 3.06Å; I25-N28 PolarHBondContact O-N 3.2Å; N28-M32 WeakPolarHBondContact O-CB 3.47Å; N28-M32 WeakPolarHBondContact O-CG 3.45Å; N28-M32 PolarHBondContact O-N 3.48Å
29	I	43.8	Very low	35.5	Very low	118 Å²	118	124.1 Å²	124.1	61%	0.605	67%	0.67	S	S	*	*	H	α-helix	trans	-71.3	-35.5	177.9	-69	179.8	0	0	0	111.9	I25 T27	I25-I29 HydrophobicContact CG2-CD1 3.55Å; I25-I29 HydrophobicContact CG2-CG1 4.18Å; I25-I29 WeakPolarHBondContact O-CG1 3.5Å; I25-I29 PolarHBondContact O-N 3.01Å; I25-I29 VanDerWaalsContact O-N 3.08Å; T27-I29 VanDerWaalsContact C-N 3.35Å; T27-I29 PolarHBondContact O-N 3.33Å
30	L	40.7	Very low	35.2	Very low	119 Å²	119	122.5 Å²	122.5	62%	0.623	67%	0.671	S	S	*	*	H	α-helix	trans	-71.5	-42.4	175.6	-69.5	172.6	0	0	0	111.5	L26 T27 S33 L34	L26-L30 WeakPolarHBondContact O-CD1 3.25Å; L26-L30 WeakPolarHBondContact O-CG 3.47Å; T27-L30 PolarHBondContact O-N 3.4Å; L30-S33 VanDerWaalsContact O-CB 3.32Å; L30-S33 WeakPolarHBondContact O-CB 2.99Å; L30-S33 PolarHBondContact O-N 3.37Å; L30-S33 VanDerWaalsContact O-N 3.11Å; L30-L34 PolarHBondContact O-N 2.79Å
31	D	32.3	Very low	34.9	Very low	94 Å²	94	125 Å²	125	50%	0.503	68%	0.68	S	S	.	*	H	α-helix	trans	-70.3	-34.4	-177.6	-152	26.5	0	0	0	112.4	T27 S33 L34 H35	T27-D31 PolarHBondContact O-N 3.12Å; D31-S33 PolarHBondContact O-N 3.43Å; D31-L34 PolarHBondContact O-N 3.19Å; D31-L34 VanDerWaalsContact O-N 3.11Å; D31-H35 PolarHBondContact O-N 3.44Å
32	M	36	Very low	35	Very low	145 Å²	145	128.6 Å²	128.6	71%	0.714	68%	0.684	S	S	*	*	H	α-helix	trans	-58.6	-24	169.4	-86.8	-115.2	63.9	0	0	114.1	N28	N28-M32 WeakPolarHBondContact O-CB 3.47Å; N28-M32 WeakPolarHBondContact O-CG 3.45Å; N28-M32 PolarHBondContact O-N 3.48Å
33	S	39	Very low	34.4	Very low	92 Å²	92	128.9 Å²	128.9	64%	0.643	68%	0.681	S	S	*	*	H	α-helix	trans	-80.5	-44.2	173	-163	0	0	0	0	111.2	L30 D31	L30-S33 VanDerWaalsContact O-CB 3.32Å; L30-S33 WeakPolarHBondContact O-CB 2.99Å; L30-S33 PolarHBondContact O-N 3.37Å; L30-S33 VanDerWaalsContact O-N 3.11Å; D31-S33 PolarHBondContact O-N 3.43Å
34	L	33.5	Very low	33.9	Very low	135 Å²	135	129 Å²	129	71%	0.707	68%	0.681	S	S	*	*	H	α-helix	trans	-67.7	-40	-176.6	-128	164.4	0	0	0	112.4	L30 D31 R36	L30-L34 PolarHBondContact O-N 2.79Å; D31-L34 PolarHBondContact O-N 3.19Å; D31-L34 VanDerWaalsContact O-N 3.11Å; L34-R36 PolarHBondContact O-N 3.33Å; L34-R36 VanDerWaalsContact O-N 3.17Å
35	H	31.3	Very low	33.6	Very low	146 Å²	146	135.2 Å²	135.2	68%	0.676	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-6.1	-174.7	-143.3	-37.8	0	0	0	114.5	D31 Q37	D31-H35 PolarHBondContact O-N 3.44Å; H35-Q37 PolarHBondContact O-N 2.75Å
36	R	31.6	Very low	32.9	Very low	225 Å²	225	135.9 Å²	135.9	85%	0.849	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	4.6	-177.6	-143.9	180	-165.5	-84.6	0.4	114.8	L34	L34-R36 PolarHBondContact O-N 3.33Å; L34-R36 VanDerWaalsContact O-N 3.17Å
37	Q	36.5	Very low	32.2	Very low	176 Å²	176	135.7 Å²	135.7	82%	0.822	72%	0.724	S	S	*	*	S	Bend	trans	-133.9	11.9	-171.6	-155	157	1.4	0	0	116.4	H35	H35-Q37 PolarHBondContact O-N 2.75Å
38	M	31.7	Very low	31.7	Very low	174 Å²	174	135.6 Å²	135.6	86%	0.857	73%	0.733	S	S	*	*			trans	-139.1	128.7	166.1	-76.7	-169.4	163.1	0	0	110.4
39	G	24.8	Very low	31.4	Very low	80 Å²	80	136.2 Å²	136.2	83%	0.825	74%	0.744	S	S	*	*			trans	161.5	36.9	177.2	0	0	0	0	0	121.1
40	S	26.4	Very low	30.6	Very low	125 Å²	125	135.9 Å²	135.9	87%	0.874	75%	0.753	S	S	*	*			trans	-161.1	127.7	147.1	58	0	0	0	0	113
41	D	28.5	Very low	29.9	Very low	161 Å²	161	136.4 Å²	136.4	86%	0.861	76%	0.76	S	S	*	*			trans	-159	166.1	160.3	-152	-19.8	0	0	0	108.1
42	R	33.3	Very low	29.6	Very low	202 Å²	202	136.7 Å²	136.7	76%	0.762	77%	0.769	S	S	*	*			trans	77.4	144.6	-175	-67.7	-177.1	163.6	-96.8	-4.1	117
43	D	29	Very low	29.4	Very low	102 Å²	102	137.8 Å²	137.8	55%	0.545	78%	0.777	S	S	.	*			cis	-146.6	151.8	4.1	-118.3	-29	0	0	0	114.9
44	L	26.6	Very low	29.2	Very low	137 Å²	137	139.1 Å²	139.1	72%	0.717	78%	0.784	S	S	*	*			trans	49.6	116.4	150	-63	167.9	0	0	0	122.3
45	Q	25.4	Very low	28.8	Very low	202 Å²	202	138.3 Å²	138.3	94%	0.944	79%	0.789	S	S	*	*				-159.5	150	107.8	-109.3	175	6.8	0	0	112.2
46	S	28	Very low	28.6	Very low	105 Å²	105	136.8 Å²	136.8	73%	0.734	79%	0.79	S	S	*	*			trans	-126.2	144.7	-172.2	-49.3	0	0	0	0	112.6
47	S	27.8	Very low	28.5	Very low	127 Å²	127	135 Å²	135	89%	0.888	79%	0.789	S	S	*	*			trans	-165.2	137.5	159.1	-86.9	0	0	0	0	115.2
48	A	26.6	Very low	28.1	Very low	88 Å²	88	136.9 Å²	136.9	73%	0.727	79%	0.794	S	S	*	*			trans	57.3	79.6	146.4	0	0	0	0	0	122.1
49	S	26.5	Very low	28.1	Very low	107 Å²	107	132.9 Å²	132.9	75%	0.748	79%	0.788	S	S	*	*				39.4	150.6	113.9	65.3	0	0	0	0	124.5
50	S	27.2	Very low	29	Very low	112 Å²	112	134.6 Å²	134.6	78%	0.783	79%	0.785	S	S	*	*			trans	94.2	149.7	149	89.7	0	0	0	0	118.1
51	V	25.3	Very low	29.4	Very low	130 Å²	130	138.1 Å²	138.1	79%	0.788	79%	0.785	S	S	*	*			cis	-160.6	149.2	-14.6	119.6	0	0	0	0	111.9
52	S	26.1	Very low	29.5	Very low	99 Å²	99	140.4 Å²	140.4	69%	0.692	79%	0.787	S	S	*	*			trans	32.9	139.3	161	73.8	0	0	0	0	124.5
53	L	32.3	Very low	29.4	Very low	168 Å²	168	142.1 Å²	142.1	88%	0.88	79%	0.794	S	S	*	*			trans	-70.5	147.7	155.5	-65.9	165.9	0	0	0	112.9
54	P	34.3	Very low	29.4	Very low	121 Å²	121	147.6 Å²	147.6	79%	0.786	81%	0.807	S	S	*	*			trans	-110.8	-176.6	139	25.9	-14.8	0	0	0	112
55	S	25.9	Very low	29.5	Very low	117 Å²	117	146.6 Å²	146.6	82%	0.818	80%	0.801	S	S	*	*			trans	-160	-170	-167	-169.5	0	0	0	0	114.8
56	V	27.8	Very low	29.5	Very low	114 Å²	114	142.4 Å²	142.4	69%	0.691	79%	0.794	S	S	*	*			trans	97.8	101.2	159.8	-169.7	0	0	0	0	120
57	K	29.1	Very low	29.8	Very low	189 Å²	189	145 Å²	145	82%	0.822	80%	0.798	S	S	*	*			trans	28.7	132.2	130.3	-51	170.7	-176.9	172.5	0	120.5
58	K	27	Very low	29.8	Very low	215 Å²	215	141.8 Å²	141.8	94%	0.935	79%	0.785	S	S	*	*				-177.8	154	110	-97.2	156.3	-174.2	173.7	0	113.7
59	A	33.2	Very low	29.9	Very low	89 Å²	89	143 Å²	143	74%	0.736	79%	0.788	S	S	*	*			trans	-123.3	166.3	165.5	0	0	0	0	0	109.2
60	P	43.4	Very low	30	Very low	117 Å²	117	144.8 Å²	144.8	76%	0.76	79%	0.788	S	S	*	*				-157	139.8	106.4	36.6	-16.9	0	0	0	119.1
61	K	34.7	Very low	30.3	Very low	198 Å²	198	147.4 Å²	147.4	86%	0.861	79%	0.786	S	S	*	*			trans	39.6	128.2	133.8	-57.3	174.3	179.9	174.1	0	121.4
62	K	29	Very low	30.5	Very low	210 Å²	210	151.8 Å²	151.8	91%	0.913	79%	0.788	S	S	*	*				-163.3	163.4	114.7	-109	164	-173.3	175.4	0	115
63	R	31.2	Very low	30.6	Very low	238 Å²	238	158 Å²	158	90%	0.898	80%	0.796	S	S	*	*			trans	-66.3	172.6	-178.4	-52.1	161.6	-176.3	162.9	-2.1	110.8
64	R	29.1	Very low	30.3	Very low	217 Å²	217	158.6 Å²	158.6	82%	0.819	79%	0.792	S	S	*	*			cis	-160.4	175.4	26.7	-155	-171.9	170.4	-149.8	-4.9	106
65	I	29.1	Very low	30.3	Very low	115 Å²	115	162.3 Å²	162.3	59%	0.59	80%	0.796	S	S	*	*			cis	-153.1	172.1	17.4	-21.7	174.1	0	0	0	109.8	I67	I65-I67 HydrophobicContact CG2-CG1 4.44Å
66	S	26.9	Very low	30.4	Very low	114 Å²	114	162.6 Å²	162.6	80%	0.797	79%	0.788	S	S	*	*			trans	-133.6	157.4	145	63.5	0	0	0	0	110.1
67	I	32.6	Very low	30.4	Very low	160 Å²	160	162.4 Å²	162.4	82%	0.821	79%	0.792	S	S	*	*			trans	-138.7	151.2	176.7	-69.8	179.2	0	0	0	107.7	I65	I65-I67 HydrophobicContact CG2-CG1 4.44Å
68	G	28.7	Very low	30.2	Very low	60 Å²	60	163.9 Å²	163.9	62%	0.619	80%	0.798	S	S	*	*			trans	-175.3	-168.6	172.7	0	0	0	0	0	115.5
69	S	29.4	Very low	30.3	Very low	114 Å²	114	165.2 Å²	165.2	80%	0.797	80%	0.797	S	S	*	*			trans	71	115.7	168.4	72.9	0	0	0	0	120
70	L	28	Very low	29.9	Very low	143 Å²	143	169.1 Å²	169.1	75%	0.749	80%	0.798	S	S	*	*			trans	-146.2	140.1	135.6	-69.3	-179.2	0	0	0	106
71	F	32.3	Very low	29.2	Very low	167 Å²	167	167.6 Å²	167.6	73%	0.732	79%	0.79	S	S	*	*			cis	-106.6	-166.1	-10.5	-71.7	-78.1	0	0	0	108.7
72	R	30.2	Very low	29.1	Very low	223 Å²	223	167.1 Å²	167.1	84%	0.842	78%	0.783	S	S	*	*			cis	67.2	126.8	27.9	-112.8	-170.7	-81.1	-109	8.3	113.5
73	R	27.5	Very low	28.9	Very low	228 Å²	228	163.5 Å²	163.5	86%	0.86	77%	0.769	S	S	*	*			cis	-131.9	136.1	20.3	-74.1	171.4	170.2	160.5	-4.1	111
74	K	26.8	Very low	28.9	Very low	182 Å²	182	159.8 Å²	159.8	79%	0.791	77%	0.766	S	S	*	*				66.2	112.1	88.6	-160.5	-173	-179.2	-174.1	0	115.4	D76	K74-D76 WeakPolarHBondContact CE-OD2 3.41Å; K74-D76 IonicContact NZ-OD2 2.67Å
75	K	34.1	Very low	28.8	Very low	198 Å²	198	157.7 Å²	157.7	86%	0.861	77%	0.771	S	S	*	*			trans	-102.7	139	163.6	168.1	-176.7	178.1	179.6	0	108.6
76	D	27.7	Very low	28.7	Very low	124 Å²	124	155.8 Å²	155.8	66%	0.663	78%	0.78	S	S	*	*			trans	-167.3	143.8	160.7	-103.9	-38.7	0	0	0	114.9	K74	K74-D76 WeakPolarHBondContact CE-OD2 3.41Å; K74-D76 IonicContact NZ-OD2 2.67Å
77	S	28.3	Very low	28.8	Very low	110 Å²	110	154 Å²	154	77%	0.769	78%	0.779	S	S	*	*			trans	51.2	121.2	156.7	68	0	0	0	0	122.9
78	K	25.5	Very low	28.7	Very low	219 Å²	219	152.4 Å²	152.4	95%	0.952	78%	0.777	S	S	*	*				-158.4	172.6	119.6	-127.8	175.7	-178.1	177.9	0	112.5
79	R	28	Very low	28.6	Very low	243 Å²	243	157 Å²	157	92%	0.917	79%	0.788	S	S	*	*			trans	-150.1	122.2	-154.6	176.2	-170.7	-175.1	-165.8	4.1	113.1
80	K	26.1	Very low	28.5	Very low	172 Å²	172	154.7 Å²	154.7	75%	0.748	78%	0.781	S	S	*	*			trans	-172.4	126.5	169	-170.9	-92.9	-179.7	-151.8	0	108	R82	K80-R82 PolarHBondContact NZ-O 2.99Å
81	S	27.9	Very low	28.5	Very low	85 Å²	85	156.4 Å²	156.4	59%	0.594	79%	0.789	S	S	*	*			cis	86.1	141.1	10.6	84.1	0	0	0	0	118.8
82	R	32	Very low	28.4	Very low	188 Å²	188	152.8 Å²	152.8	71%	0.709	79%	0.79	S	S	*	*			trans	64.7	138.2	-179.3	-60.5	-177.2	90.7	135.4	10.7	115.9	K80	K80-R82 PolarHBondContact NZ-O 2.99Å
83	E	25	Very low	28.4	Very low	133 Å²	133	147.6 Å²	147.6	62%	0.621	79%	0.788	S	S	*	*			cis	-149.7	146.2	-6.5	-101.8	144.6	158.3	0	0	106.4
84	L	32.6	Very low	28.5	Very low	160 Å²	160	145.2 Å²	145.2	84%	0.838	79%	0.791	S	S	*	*				75.3	104.3	54.1	-102.7	178.3	0	0	0	116
85	N	26.5	Very low	28.7	Very low	173 Å²	173	144.7 Å²	144.7	93%	0.925	79%	0.791	S	S	*	*			trans	178.4	152.4	151	-91.9	-14.7	0	0	0	109.3
86	G	27	Very low	28.5	Very low	75 Å²	75	139.3 Å²	139.3	77%	0.773	78%	0.779	S	S	*	*			cis	162.5	48.8	-8	0	0	0	0	0	118.9
87	G	28.1	Very low	28.5	Very low	76 Å²	76	141.5 Å²	141.5	78%	0.784	79%	0.788	S	S	*	*			trans	80.6	178.3	170.1	0	0	0	0	0	116.7
88	V	30.1	Very low	28.5	Very low	127 Å²	127	143 Å²	143	77%	0.77	78%	0.783	S	S	*	*			cis	-164.6	147.9	-9	114.5	0	0	0	0	109.9
89	D	27.9	Very low	28.5	Very low	158 Å²	158	137.4 Å²	137.4	85%	0.845	77%	0.771	S	S	*	*			trans	48.3	154	167	-55.3	-15	0	0	0	121.3
90	G	27.7	Very low	28.7	Very low	64 Å²	64	132.7 Å²	132.7	66%	0.66	76%	0.76	S	S	*	*			cis	165.8	163.7	-7.6	0	0	0	0	0	112.7
91	I	28.4	Very low	29.1	Very low	180 Å²	180	131.9 Å²	131.9	92%	0.923	76%	0.76	S	S	*	*			trans	71.8	139.9	169.4	-57.4	170.7	0	0	0	114.9
92	A	28.6	Very low	29.1	Very low	91 Å²	91	133.3 Å²	133.3	75%	0.752	77%	0.769	S	S	*	*			cis	-135.5	164.3	8.3	0	0	0	0	0	113.7
93	S	30.5	Very low	29.1	Very low	114 Å²	114	129.3 Å²	129.3	80%	0.797	77%	0.766	S	S	*	*			trans	-107.2	151.8	163.5	-47.6	0	0	0	0	111
94	I	30	Very low	29.2	Very low	177 Å²	177	128.9 Å²	128.9	91%	0.908	77%	0.768	S	S	*	*			trans	-135.7	150.4	142.2	-60	-174.3	0	0	0	107.2
95	E	31	Very low	29.4	Very low	171 Å²	171	128.8 Å²	128.8	80%	0.799	76%	0.761	S	S	*	*			trans	-132.5	163.1	-161	-161.4	-162.7	128.5	0	0	111.2
96	S	29	Very low	29.6	Very low	86 Å²	86	127.6 Å²	127.6	60%	0.601	75%	0.754	S	S	*	*			trans	68.8	141.8	150.1	-157.8	0	0	0	0	119.9
97	I	27.6	Very low	29.8	Very low	169 Å²	169	128.6 Å²	128.6	87%	0.867	75%	0.749	S	S	*	*				-155.3	138.9	111.7	-98.9	158.3	0	0	0	108.8
98	H	29.4	Very low	29.9	Very low	142 Å²	142	132.3 Å²	132.3	66%	0.657	75%	0.75	S	S	*	*			trans	-127.3	136.6	175.9	176.7	-89.7	0	0	0	108.2	E100	H98-E100 IonicContact CE1-OE1 2.74Å; H98-E100 PolarHBondContact CE1-OE1 3.02Å; H98-E100 IonicContact ND1-OE1 2.68Å; H98-E100 PolarHBondContact ND1-OE1 3.38Å
99	S	26.4	Very low	30.2	Very low	101 Å²	101	135.2 Å²	135.2	71%	0.706	75%	0.752	S	S	*	*			trans	-162.3	131.7	166.2	-66.2	0	0	0	0	107.4
100	E	30.7	Very low	30.4	Very low	144 Å²	144	132.2 Å²	132.2	67%	0.673	74%	0.744	S	S	*	*			cis	73.2	147.6	40.4	-60.2	172.1	-140.2	0	0	114.4	H98	H98-E100 IonicContact CE1-OE1 2.74Å; H98-E100 PolarHBondContact CE1-OE1 3.02Å; H98-E100 IonicContact ND1-OE1 2.68Å; H98-E100 PolarHBondContact ND1-OE1 3.38Å
101	M	34.2	Very low	30.6	Very low	155 Å²	155	135.6 Å²	135.6	76%	0.764	75%	0.751	S	S	*	*			cis	-175.2	149.9	-27.7	178.8	171.4	63.5	0	0	108
102	C	29	Very low	30.9	Very low	116 Å²	116	134 Å²	134	78%	0.784	75%	0.745	S	S	*	*			trans	-178.8	120.9	154.8	-96.9	0	0	0	0	108.1
103	T	32.2	Very low	31.2	Very low	103 Å²	103	136 Å²	136	63%	0.632	75%	0.748	S	S	*	*				67.5	137.8	69.5	62.9	0	0	0	0	114
104	D	27.2	Very low	31.4	Very low	124 Å²	124	135.8 Å²	135.8	66%	0.663	75%	0.746	S	S	*	*			cis	-147.7	-175.2	41.7	-134.9	-50.5	0	0	0	117.4
105	K	36.9	Very low	32.1	Very low	159 Å²	159	132.5 Å²	132.5	69%	0.691	74%	0.739	S	S	*	*			trans	-87.9	159.8	-153.3	-54.7	144	-168.4	92	0	118.1
106	N	29.4	Very low	32.4	Very low	148 Å²	148	131.3 Å²	131.3	79%	0.791	74%	0.738	S	S	*	*				176.5	111.9	126.6	-89.1	-16.7	0	0	0	109.7
107	S	32.5	Very low	33.3	Very low	96 Å²	96	134.7 Å²	134.7	67%	0.671	75%	0.75	S	S	*	*				71.6	136.6	78.9	80	0	0	0	0	113.9
108	I	30.4	Very low	33.6	Very low	154 Å²	154	130 Å²	130	79%	0.79	74%	0.743	S	S	*	*			cis	-148.9	161.6	15.9	-37.3	157.6	0	0	0	109.5
109	F	34.4	Very low	34.6	Very low	188 Å²	188	130.8 Å²	130.8	83%	0.825	75%	0.752	S	S	*	*			trans	-137	150.7	158.1	-166.4	-90	0	0	0	110.6
110	S	32.2	Very low	35.7	Very low	95 Å²	95	132.2 Å²	132.2	66%	0.664	76%	0.756	S	S	*	*			trans	-133.7	119.3	-170.4	-62.9	0	0	0	0	114.2
111	T	31.8	Very low	36.5	Very low	134 Å²	134	130.3 Å²	130.3	82%	0.822	76%	0.758	S	S	*	*			trans	-164.9	156.8	145.5	0.5	0	0	0	0	110.2
112	N	35.1	Very low	37.4	Very low	146 Å²	146	130.7 Å²	130.7	78%	0.781	76%	0.762	S	S	*	*			trans	-112.5	157.2	-162.3	-92.1	-14.7	0	0	0	114.4
113	T	34.8	Very low	38.5	Very low	134 Å²	134	130.4 Å²	130.4	82%	0.822	76%	0.761	S	S	*	*			trans	64.1	143	154.4	45.9	0	0	0	0	118.3
114	S	36.2	Very low	39.5	Very low	109 Å²	109	134.3 Å²	134.3	76%	0.762	77%	0.77	S	S	*	*			cis	-160.3	174.1	-3	41.7	0	0	0	0	111.2
115	S	42.8	Very low	40.7	Very low	108 Å²	108	136.7 Å²	136.7	76%	0.755	78%	0.776	S	S	*	*			trans	-44.1	155.9	174.7	-42.4	0	0	0	0	114.4
116	D	37.9	Very low	41.6	Very low	146 Å²	146	137.5 Å²	137.5	78%	0.781	79%	0.786	S	S	*	*			cis	-156.5	-170.4	48.6	-142.4	-46.4	0	0	0	114.7
117	N	47.6	Very low	43.2	Very low	158 Å²	158	132 Å²	132	85%	0.845	77%	0.765	S	S	*	*			trans	-71.4	149.4	-167.7	-72.7	-90.3	0	0	0	116.1
118	G	35.6	Very low	45.2	Very low	71 Å²	71	131.7 Å²	131.7	73%	0.732	76%	0.756	S	S	*	*			trans	-174.2	60.5	176.9	0	0	0	0	0	116.5	T120	G118-T120 PolarHBondContact O-N 2.96Å
119	L	48.8	Very low	47.9	Very low	158 Å²	158	131.6 Å²	131.6	83%	0.827	75%	0.75	S	S	*	*			trans	-74.7	82.6	-177.3	-175.7	72.7	0	0	0	113.8
120	T	49.5	Very low	50.7	Low	130 Å²	130	125.1 Å²	125.1	80%	0.798	72%	0.724	S	S	*	*			trans	-149.5	95.1	164.7	50.3	0	0	0	0	113	G118	G118-T120 PolarHBondContact O-N 2.96Å
121	S	48.5	Very low	53.7	Low	104 Å²	104	125 Å²	125	73%	0.727	71%	0.712	S	S	*	*			trans	171.7	-1.6	152.6	46.4	0	0	0	0	116.8	S123	S121-S123 PolarHBondContact O-N 3.03Å
122	I	51.8	Low	56.7	Low	164 Å²	164	118.7 Å²	118.7	84%	0.841	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	69	-179.4	-46.3	-179.5	0	0	0	111.8
123	S	52.5	Low	59.5	Low	109 Å²	109	114.8 Å²	114.8	76%	0.762	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.4	16.2	175.1	64.7	0	0	0	0	114.2	S121	S121-S123 PolarHBondContact O-N 3.03Å
124	K	52.6	Low	62.4	Low	186 Å²	186	112.1 Å²	112.1	81%	0.809	64%	0.637	S	S	*	*			trans	-145.6	38	-173.4	-146.3	-179.4	-178.1	-175.7	0	116.2
125	Q	52.8	Low	65.2	Low	173 Å²	173	108.9 Å²	108.9	81%	0.808	61%	0.614	S	S	*	*			trans	-134.5	64.3	168.5	-69.7	-67	8	0	0	110.5
126	I	57.1	Low	67.7	Low	176 Å²	176	109.6 Å²	109.6	90%	0.903	61%	0.608	S	S	*	*			trans	-122.2	34.9	172.2	-52.4	178.6	0	0	0	108.5
127	G	61.4	Low	70.4	Confident	33 Å²	33	107.6 Å²	107.6	34%	0.34	60%	0.597	S	S	.	*			trans	-151.3	147.2	172.7	0	0	0	0	0	108.2
128	D	74.8	Confident	72.7	Confident	90 Å²	90	108.3 Å²	108.3	48%	0.481	59%	0.588	S	S	.	*			cis	-136.7	113.6	-0.4	-66.6	-51.1	0	0	0	109.8	K141	D128-K141 HydrophobicContact CB-CD 3.69Å; D128-K141 VanDerWaalsContact CB-CE 3.42Å; D128-K141 HydrophobicContact CB-CG 3.98Å; D128-K141 PolarHBondContact O-N 3.03Å; D128-K141 WeakPolarHBondContact OD2-CE 3.42Å; D128-K141 IonicContact OD2-NZ 3.33Å; D128-K141 PolarHBondContact OD2-NZ 3.01Å
129	F	87.8	Confident	75.5	Confident	152 Å²	152	106.1 Å²	106.1	67%	0.667	56%	0.558	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.9	122.8	171.7	-72.7	-88.4	0	0	0	109.8	R138 H139	F129-R138 HydrophobicContact CB-CB 4.4Å; F129-H139 CarbonylContact C-O 3.59Å; F129-H139 VanDerWaalsContact CA-O 3.3Å; F129-H139 WeakPolarHBondContact CA-O 3.49Å
130	I	92.9	Very high	77.6	Confident	52 Å²	52	100.5 Å²	100.5	27%	0.267	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	142.1	175.5	-62.1	-177	0	0	0	108.5	R138 H139 K141 F144	I130-R138 WeakPolarHBondContact O-CA 3.35Å; I130-H139 PolarHBondContact N-O 3.04Å; I130-H139 PolarHBondContact O-N 3.39Å; I130-K141 HydrophobicContact CD1-CD 4.45Å; I130-K141 HydrophobicContact CD1-CG 3.69Å; I130-K141 HydrophobicContact CG1-CG 4.15Å; I130-F144 HydrophobicContact CB-CD2 4.38Å; I130-F144 HydrophobicContact CB-CE2 3.71Å; I130-F144 HydrophobicContact CB-CZ 3.88Å; I130-F144 HydrophobicContact CG2-CE1 4.16Å; I130-F144 HydrophobicContact CG2-CE2 4.09Å; I130-F144 HydrophobicContact CG2-CZ 3.78Å; I130-F144 WeakPolarHBondContact O-CZ 3.43Å
131	E	94.6	Very high	79.6	Confident	92 Å²	92	98.8 Å²	98.8	43%	0.43	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.4	176.8	-155.4	163.5	111.4	0	0	109.5	L137 R138	E131-L137 WeakPolarHBondContact CA-O 3.36Å; E131-R138 HydrophobicContact CB-CG 4.11Å; E131-R138 HydrophobicContact CG-CG 4.01Å; E131-R138 IonicContact OE2-CZ 2.65Å; E131-R138 IonicContact OE2-NE 3.96Å; E131-R138 PolarHBondContact OE2-NE 2.92Å; E131-R138 IonicContact OE2-NH2 2.69Å; E131-R138 PolarHBondContact OE2-NH2 3.39Å
132	C	95.7	Very high	81.6	Confident	1 Å²	1	100.9 Å²	100.9	1%	0.007	52%	0.517	C	S	.	.			trans	-81.1	128	-179.4	173.6	0	0	0	0	110.8	L134 C135 L136 L137 F144 C155	C132-L134 PolarHBondContact O-N 3.42Å; C132-L134 VanDerWaalsContact O-N 3.15Å; C132-C135 VanDerWaalsContact CB-SG 3.55Å; C132-C135 VanDerWaalsContact SG-SG 3.67Å; C132-L136 VanDerWaalsContact O-CA 3.23Å; C132-L136 WeakPolarHBondContact O-CA 3.32Å; C132-L136 PolarHBondContact O-N 3.15Å; C132-L137 PolarHBondContact N-O 3.46Å; C132-F144 HydrophobicContact CB-CE1 3.99Å; C132-F144 HydrophobicContact CB-CZ 4.11Å; C132-C155 HydrophobicContact CB-CB 4.08Å; C132-C155 PolarHBondContact SG-N 3.19Å
133	P	94.1	Very high	83.6	Confident	65 Å²	65	98 Å²	98	42%	0.422	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-17.8	-177.5	26.3	-34.5	0	0	0	114.2	R153 E178	P133-R153 VanDerWaalsContact CD-O 3.24Å; P133-R153 WeakPolarHBondContact CD-O 3.15Å; P133-E178 HydrophobicContact CG-CG 4.41Å; P133-E178 WeakPolarHBondContact CG-OE1 3.5Å
134	L	95.1	Very high	85.5	Confident	78 Å²	78	93.1 Å²	93.1	41%	0.408	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-34.7	-176.9	-57.8	-180	0	0	0	114.5	C132 S154 C158 P177	C132-L134 PolarHBondContact O-N 3.42Å; C132-L134 VanDerWaalsContact O-N 3.15Å; L134-S154 VanDerWaalsContact CD1-OG 3.24Å; L134-S154 WeakPolarHBondContact CD1-OG 3.33Å; L134-S154 VanDerWaalsContact CG-OG 3.31Å; L134-S154 WeakPolarHBondContact CG-OG 3.19Å; L134-C158 HydrophobicContact CB-CB 4Å; L134-C158 HydrophobicContact CD1-CB 3.82Å; L134-P177 HydrophobicContact CD1-CB 4.15Å; L134-P177 HydrophobicContact CD1-CG 3.87Å; L134-P177 HydrophobicContact CD2-CB 4.11Å; L134-P177 HydrophobicContact CD2-CG 4.49Å
135	C	96	Very high	87.4	Confident	41 Å²	41	85.8 Å²	85.8	28%	0.277	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-7.3	179.6	62.4	0	0	0	0	114	C132 L137 C158	C132-C135 VanDerWaalsContact CB-SG 3.55Å; C132-C135 VanDerWaalsContact SG-SG 3.67Å; C135-L137 HydrophobicContact CB-CG 4.24Å; C135-L137 PolarHBondContact O-N 2.91Å; C135-C158 VanDerWaalsContact CB-SG 3.58Å; C135-C158 VanDerWaalsContact SG-SG 3.62Å
136	L	95.1	Very high	89.3	Confident	123 Å²	123	83 Å²	83	64%	0.644	42%	0.423	S	S	*	.			trans	58	16.2	-176.6	-48.2	179.7	0	0	0	114	C132	C132-L136 VanDerWaalsContact O-CA 3.23Å; C132-L136 WeakPolarHBondContact O-CA 3.32Å; C132-L136 PolarHBondContact O-N 3.15Å
137	L	95.1	Very high	91	Very high	104 Å²	104	75.1 Å²	75.1	55%	0.545	38%	0.382	S	S	.	.			trans	-90.9	149.6	175	-58.1	-177.7	0	0	0	111	E131 C132 C135	E131-L137 WeakPolarHBondContact CA-O 3.36Å; C132-L137 PolarHBondContact N-O 3.46Å; C135-L137 HydrophobicContact CB-CG 4.24Å; C135-L137 PolarHBondContact O-N 2.91Å
138	R	94.3	Very high	92.4	Very high	173 Å²	173	80 Å²	80	65%	0.653	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	128.1	176.5	-68	-177.2	-178.6	-178.5	0.3	111.1	F129 I130 E131	F129-R138 HydrophobicContact CB-CB 4.4Å; I130-R138 WeakPolarHBondContact O-CA 3.35Å; E131-R138 HydrophobicContact CB-CG 4.11Å; E131-R138 HydrophobicContact CG-CG 4.01Å; E131-R138 IonicContact OE2-CZ 2.65Å; E131-R138 IonicContact OE2-NE 3.96Å; E131-R138 PolarHBondContact OE2-NE 2.92Å; E131-R138 IonicContact OE2-NH2 2.69Å; E131-R138 PolarHBondContact OE2-NH2 3.39Å
139	H	94.4	Very high	93.3	Very high	24 Å²	24	78.4 Å²	78.4	11%	0.111	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	160.3	178.2	-54.4	-69.6	0	0	0	110.4	F129 I130 R143 F144 C155	F129-H139 CarbonylContact C-O 3.59Å; F129-H139 VanDerWaalsContact CA-O 3.3Å; F129-H139 WeakPolarHBondContact CA-O 3.49Å; I130-H139 PolarHBondContact N-O 3.04Å; I130-H139 PolarHBondContact O-N 3.39Å; H139-R143 HydrophobicContact CB-CB 3.77Å; H139-R143 HydrophobicContact CB-CG 4.19Å; H139-F144 HydrophobicContact CB-CE2 3.89Å; H139-F144 HydrophobicContact CB-CZ 4.39Å; H139-C155 PolarHBondContact NE2-SG 3.03Å
140	S	93.8	Very high	93.6	Very high	40 Å²	40	71.9 Å²	71.9	28%	0.28	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	155.8	170.9	68.9	0	0	0	0	110.6	D142 R143 F144	S140-D142 VanDerWaalsContact CB-OD2 3.25Å; S140-D142 WeakPolarHBondContact CB-OD2 3.3Å; S140-D142 PolarHBondContact O-N 3.31Å; S140-D142 VanDerWaalsContact O-N 3.08Å; S140-D142 PolarHBondContact OG-OD2 3.48Å; S140-R143 WeakPolarHBondContact O-CB 3.34Å; S140-R143 PolarHBondContact O-N 3.35Å; S140-F144 WeakPolarHBondContact O-CD2 3.4Å
141	K	90.1	Very high	93.5	Very high	94 Å²	94	78 Å²	78	41%	0.409	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-49.4	-35.2	176.8	-83.4	179.3	174.6	168.1	0	113.6	D128 I130 R143 F144	D128-K141 HydrophobicContact CB-CD 3.69Å; D128-K141 VanDerWaalsContact CB-CE 3.42Å; D128-K141 HydrophobicContact CB-CG 3.98Å; D128-K141 PolarHBondContact O-N 3.03Å; D128-K141 WeakPolarHBondContact OD2-CE 3.42Å; D128-K141 IonicContact OD2-NZ 3.33Å; D128-K141 PolarHBondContact OD2-NZ 3.01Å; I130-K141 HydrophobicContact CD1-CD 4.45Å; I130-K141 HydrophobicContact CD1-CG 3.69Å; I130-K141 HydrophobicContact CG1-CG 4.15Å; K141-R143 PolarHBondContact O-N 3.04Å; K141-F144 PolarHBondContact O-N 3.15Å; K141-F144 VanDerWaalsContact O-N 3.07Å
142	D	91.3	Very high	93.5	Very high	148 Å²	148	76.7 Å²	76.7	79%	0.791	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-68.5	-14.6	-176.8	-22.2	-81.6	0	0	0	113.3	S140 F144	S140-D142 VanDerWaalsContact CB-OD2 3.25Å; S140-D142 WeakPolarHBondContact CB-OD2 3.3Å; S140-D142 PolarHBondContact O-N 3.31Å; S140-D142 VanDerWaalsContact O-N 3.08Å; S140-D142 PolarHBondContact OG-OD2 3.48Å; D142-F144 VanDerWaalsContact C-N 3.3Å
143	R	93.1	Very high	93.3	Very high	103 Å²	103	81 Å²	81	39%	0.389	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-84.8	0.3	173.4	-71.5	-81.4	-79.2	-78.3	4.1	113.3	H139 S140 K141 C155 V156 D157	H139-R143 HydrophobicContact CB-CB 3.77Å; H139-R143 HydrophobicContact CB-CG 4.19Å; S140-R143 WeakPolarHBondContact O-CB 3.34Å; S140-R143 PolarHBondContact O-N 3.35Å; K141-R143 PolarHBondContact O-N 3.04Å; R143-C155 CarbonylContact O-C 3.54Å; R143-C155 WeakPolarHBondContact O-CA 3.37Å; R143-V156 PolarHBondContact O-N 3.26Å; R143-D157 IonicContact CZ-OD2 3.99Å; R143-D157 VanDerWaalsContact CZ-OD2 3.25Å; R143-D157 IonicContact NE-OD2 2.99Å; R143-D157 PolarHBondContact NE-OD2 3.04Å; R143-D157 IonicContact NH2-OD2 3.71Å; R143-D157 PolarHBondContact NH2-OD2 3.17Å
144	F	93.8	Very high	93.3	Very high	8 Å²	8	77.9 Å²	77.9	4%	0.035	38%	0.381	C	S	.	.	S	Bend	trans	-111.4	103.8	177.9	-64.8	-95.5	0	0	0	109.4	I130 C132 H139 S140 K141 D142 R153 C155	I130-F144 HydrophobicContact CB-CD2 4.38Å; I130-F144 HydrophobicContact CB-CE2 3.71Å; I130-F144 HydrophobicContact CB-CZ 3.88Å; I130-F144 HydrophobicContact CG2-CE1 4.16Å; I130-F144 HydrophobicContact CG2-CE2 4.09Å; I130-F144 HydrophobicContact CG2-CZ 3.78Å; I130-F144 WeakPolarHBondContact O-CZ 3.43Å; C132-F144 HydrophobicContact CB-CE1 3.99Å; C132-F144 HydrophobicContact CB-CZ 4.11Å; H139-F144 HydrophobicContact CB-CE2 3.89Å; H139-F144 HydrophobicContact CB-CZ 4.39Å; S140-F144 WeakPolarHBondContact O-CD2 3.4Å; K141-F144 PolarHBondContact O-N 3.15Å; K141-F144 VanDerWaalsContact O-N 3.07Å; D142-F144 VanDerWaalsContact C-N 3.3Å; F144-R153 HydrophobicContact CD1-CB 4.19Å; F144-R153 WeakPolarHBondContact CD1-O 3.38Å; F144-R153 WeakPolarHBondContact CE1-O 3.2Å; F144-C155 HydrophobicContact CD1-CB 4.33Å; F144-C155 HydrophobicContact CE1-CB 4.07Å; F144-C155 HydrophobicContact CZ-CB 4.27Å
145	P	92.7	Very high	93.3	Very high	32 Å²	32	74.2 Å²	74.2	21%	0.208	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-68.4	140.7	175.5	30.2	-33.4	0	0	0	109.8	L159 I191	P145-L159 HydrophobicContact CG-CD1 3.67Å; P145-I191 HydrophobicContact CB-CD1 4.33Å; P145-I191 HydrophobicContact CB-CG1 4.07Å; P145-I191 HydrophobicContact CG-CD1 3.99Å; P145-I191 HydrophobicContact CG-CG1 3.94Å
146	D	91.1	Very high	93.3	Very high	114 Å²	114	73.6 Å²	73.6	61%	0.61	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-75.2	131.4	169	-83.9	-59.3	0	0	0	109.8	R153	D146-R153 VanDerWaalsContact CG-NH2 3.32Å; D146-R153 IonicContact OD1-CZ 3.19Å; D146-R153 IonicContact OD1-NE 2.67Å; D146-R153 IonicContact OD1-NH2 2.84Å; D146-R153 PolarHBondContact OD1-NH2 2.67Å; D146-R153 IonicContact OD2-NH2 3.64Å; D146-R153 PolarHBondContact OD2-NH2 2.91Å
147	I	93.3	Very high	93.3	Very high	11 Å²	11	70.9 Å²	70.9	6%	0.056	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-97.4	134.3	-179.5	-54.6	172.7	0	0	0	108	T149 C150 L159 F183	I147-T149 VanDerWaalsContact C-N 3.31Å; I147-T149 PolarHBondContact O-N 3.41Å; I147-C150 VanDerWaalsContact O-O 3.04Å; I147-L159 HydrophobicContact CD1-CD1 4.47Å; I147-F183 HydrophobicContact CD1-CE1 3.74Å; I147-F183 HydrophobicContact CD1-CZ 3.99Å; I147-F183 HydrophobicContact CG1-CE1 3.99Å; I147-F183 HydrophobicContact CG2-CD1 3.97Å; I147-F183 HydrophobicContact CG2-CE1 3.85Å
148	M	91.4	Very high	93.4	Very high	135 Å²	135	67.3 Å²	67.3	67%	0.665	33%	0.326	S	S	*	.	S	Bend	trans	-71	-25.5	-175.6	-72	-170.3	73.4	0	0	113.6	N184 D187	M148-N184 PolarHBondContact SD-ND2 3.42Å; M148-D187 VanDerWaalsContact CG-OD1 3.27Å; M148-D187 WeakPolarHBondContact CG-OD1 3.39Å; M148-D187 PolarHBondContact N-OD2 2.84Å
149	T	92.9	Very high	93.4	Very high	57 Å²	57	59 Å²	59	35%	0.35	30%	0.295	S	S	.	.	S	Bend	trans	-101.2	-12.3	-171.6	55.9	0	0	0	0	114.8	I147 R182 N184	I147-T149 VanDerWaalsContact C-N 3.31Å; I147-T149 PolarHBondContact O-N 3.41Å; T149-R182 VanDerWaalsContact CB-O 3.26Å; T149-R182 WeakPolarHBondContact CB-O 3.24Å; T149-R182 VanDerWaalsContact CG2-O 3.3Å; T149-R182 WeakPolarHBondContact CG2-O 3.47Å; T149-R182 PolarHBondContact OG1-O 2.82Å; T149-N184 HydrophobicContact CG2-CB 4.42Å
150	C	94.3	Very high	93.5	Very high	14 Å²	14	60.5 Å²	60.5	10%	0.095	30%	0.3	C	S	.	.			trans	-157.4	164.9	176.3	66.4	0	0	0	0	112.1	I147 C176 E181	I147-C150 VanDerWaalsContact O-O 3.04Å; C150-C176 VanDerWaalsContact SG-SG 3.6Å; C150-E181 HydrophobicContact CB-CB 4.4Å
151	H	91.9	Very high	93.5	Very high	180 Å²	180	63.5 Å²	63.5	83%	0.833	31%	0.309	S	S	*	.			trans	-97.4	15.7	-177.7	-57.3	-35.8	0	0	0	114.2
152	H	93.7	Very high	93.7	Very high	65 Å²	65	61.6 Å²	61.6	30%	0.301	30%	0.3	S	S	.	.			trans	-72.7	149.6	177.7	-67.9	116.5	0	0	0	111.7	E178 C179	H152-E178 HydrophobicContact CB-CB 3.83Å; H152-E178 HydrophobicContact CB-CG 4.28Å; H152-E178 WeakPolarHBondContact CB-OE2 3.45Å; H152-E178 IonicContact CD2-OE2 2.69Å; H152-E178 PolarHBondContact CD2-OE2 3.04Å; H152-E178 IonicContact CG-OE2 2.72Å; H152-C179 VanDerWaalsContact CE1-CB 3.48Å; H152-C179 WeakPolarHBondContact CE1-CB 3.33Å; H152-C179 PolarHBondContact CE1-SG 3.17Å; H152-C179 PolarHBondContact ND1-SG 2.84Å
153	R	91.3	Very high	93.9	Very high	91 Å²	91	54.6 Å²	54.6	34%	0.343	26%	0.262	S	S	.	.			trans	-139.4	83.2	-164.4	-76.7	-174.6	168.9	-124.7	-4.3	112.3	P133 F144 D146 E178	P133-R153 VanDerWaalsContact CD-O 3.24Å; P133-R153 WeakPolarHBondContact CD-O 3.15Å; F144-R153 HydrophobicContact CD1-CB 4.19Å; F144-R153 WeakPolarHBondContact CD1-O 3.38Å; F144-R153 WeakPolarHBondContact CE1-O 3.2Å; D146-R153 VanDerWaalsContact CG-NH2 3.32Å; D146-R153 IonicContact OD1-CZ 3.19Å; D146-R153 IonicContact OD1-NE 2.67Å; D146-R153 IonicContact OD1-NH2 2.84Å; D146-R153 PolarHBondContact OD1-NH2 2.67Å; D146-R153 IonicContact OD2-NH2 3.64Å; D146-R153 PolarHBondContact OD2-NH2 2.91Å; R153-E178 PolarHBondContact N-OE1 3.14Å
154	S	95.3	Very high	93.9	Very high	1 Å²	1	54 Å²	54	1%	0.007	26%	0.26	C	S	.	.			trans	-96.6	150.7	167	-72.7	0	0	0	0	111.3	L134 L159 E178	L134-S154 VanDerWaalsContact CD1-OG 3.24Å; L134-S154 WeakPolarHBondContact CD1-OG 3.33Å; L134-S154 VanDerWaalsContact CG-OG 3.31Å; L134-S154 WeakPolarHBondContact CG-OG 3.19Å; S154-L159 WeakPolarHBondContact O-CD1 3.34Å; S154-E178 PolarHBondContact N-OE1 2.83Å; S154-E178 PolarHBondContact OG-OE1 3.05Å
155	C	95.4	Very high	93.8	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.007	28%	0.275	C	S	.	.			trans	-74.2	151.9	-179.5	73.2	0	0	0	0	112.1	C132 H139 R143 F144 D157 C158 L159	C132-C155 HydrophobicContact CB-CB 4.08Å; C132-C155 PolarHBondContact SG-N 3.19Å; H139-C155 PolarHBondContact NE2-SG 3.03Å; R143-C155 CarbonylContact O-C 3.54Å; R143-C155 WeakPolarHBondContact O-CA 3.37Å; F144-C155 HydrophobicContact CD1-CB 4.33Å; F144-C155 HydrophobicContact CE1-CB 4.07Å; F144-C155 HydrophobicContact CZ-CB 4.27Å; C155-D157 PolarHBondContact O-N 3.48Å; C155-D157 VanDerWaalsContact O-N 3.1Å; C155-C158 PolarHBondContact O-N 3.27Å; C155-C158 VanDerWaalsContact O-N 3.11Å; C155-C158 VanDerWaalsContact SG-SG 3.6Å; C155-L159 PolarHBondContact O-N 3.11Å
156	V	95.1	Very high	93.7	Very high	27 Å²	27	56.3 Å²	56.3	16%	0.164	27%	0.27	C	S	.	.	H	α-helix	trans	-54.5	-33.3	-173.6	66.7	0	0	0	0	113.1	R143 R160 I191	R143-V156 PolarHBondContact O-N 3.26Å; V156-R160 WeakPolarHBondContact O-CB 3.2Å; V156-R160 PolarHBondContact O-N 3.25Å; V156-I191 HydrophobicContact CG2-CG2 4.42Å
157	D	95.3	Very high	93.7	Very high	67 Å²	67	51 Å²	51	36%	0.358	24%	0.241	S	C	.	.	H	α-helix	trans	-74.3	-40.8	-177.8	-53	-62.7	0	0	0	111.7	R143 C155 R160 Q161	R143-D157 IonicContact CZ-OD2 3.99Å; R143-D157 VanDerWaalsContact CZ-OD2 3.25Å; R143-D157 IonicContact NE-OD2 2.99Å; R143-D157 PolarHBondContact NE-OD2 3.04Å; R143-D157 IonicContact NH2-OD2 3.71Å; R143-D157 PolarHBondContact NH2-OD2 3.17Å; C155-D157 PolarHBondContact O-N 3.48Å; C155-D157 VanDerWaalsContact O-N 3.1Å; D157-R160 IonicContact OD1-NH1 3.4Å; D157-Q161 WeakPolarHBondContact O-CB 3.16Å; D157-Q161 PolarHBondContact O-N 3.45Å
158	C	96.4	Very high	93.4	Very high	28 Å²	28	54.4 Å²	54.4	19%	0.189	27%	0.266	C	S	.	.	H	α-helix	trans	-68	-41.3	172.6	-67.3	0	0	0	0	111.7	L134 C135 C155 Q161 Y162	L134-C158 HydrophobicContact CB-CB 4Å; L134-C158 HydrophobicContact CD1-CB 3.82Å; C135-C158 VanDerWaalsContact CB-SG 3.58Å; C135-C158 VanDerWaalsContact SG-SG 3.62Å; C155-C158 PolarHBondContact O-N 3.27Å; C155-C158 VanDerWaalsContact O-N 3.11Å; C155-C158 VanDerWaalsContact SG-SG 3.6Å; C158-Q161 PolarHBondContact O-N 2.77Å; C158-Y162 WeakPolarHBondContact O-CB 3.49Å; C158-Y162 PolarHBondContact O-N 3.11Å
159	L	95.3	Very high	93.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66	-44.4	176.9	-70.8	176.3	0	0	0	111.8	P145 I147 S154 C155 Q161 Y162 L163 P177 F183 I191	P145-L159 HydrophobicContact CG-CD1 3.67Å; I147-L159 HydrophobicContact CD1-CD1 4.47Å; S154-L159 WeakPolarHBondContact O-CD1 3.34Å; C155-L159 PolarHBondContact O-N 3.11Å; L159-Q161 VanDerWaalsContact C-N 3.32Å; L159-Q161 PolarHBondContact O-N 3.07Å; L159-Y162 PolarHBondContact O-N 2.92Å; L159-L163 WeakPolarHBondContact O-CB 3.48Å; L159-L163 VanDerWaalsContact O-CG 3.31Å; L159-L163 WeakPolarHBondContact O-CG 3.45Å; L159-L163 PolarHBondContact O-N 3.08Å; L159-P177 HydrophobicContact CD2-CG 3.88Å; L159-F183 HydrophobicContact CD2-CZ 3.98Å; L159-I191 HydrophobicContact CB-CG2 3.75Å; L159-I191 HydrophobicContact CD1-CD1 4.34Å
160	R	95.3	Very high	92.5	Very high	55 Å²	55	50.9 Å²	50.9	21%	0.208	25%	0.247	C	C	.	.	H	α-helix	trans	-60	-41.6	174.1	-177.6	178.8	-67.9	116.1	-2.1	111.5	V156 D157 R164 I191 L192 S193	V156-R160 WeakPolarHBondContact O-CB 3.2Å; V156-R160 PolarHBondContact O-N 3.25Å; D157-R160 IonicContact OD1-NH1 3.4Å; R160-R164 WeakPolarHBondContact O-CB 3.44Å; R160-R164 WeakPolarHBondContact O-CG 3.45Å; R160-R164 PolarHBondContact O-N 2.92Å; R160-I191 HydrophobicContact CB-CG2 4.49Å; R160-I191 VanDerWaalsContact CZ-O 3.26Å; R160-I191 PolarHBondContact NE-O 3.29Å; R160-I191 PolarHBondContact NH2-O 3.37Å; R160-L192 WeakPolarHBondContact CD-O 3.33Å; R160-L192 PolarHBondContact NE-O 3.06Å; R160-S193 PolarHBondContact NH2-OG 2.87Å
161	Q	94.9	Very high	91.9	Very high	102 Å²	102	53 Å²	53	48%	0.477	25%	0.253	S	S	.	.	H	α-helix	trans	-68.2	-38.9	176.7	-172.8	60.1	18.6	0	0	112.4	D157 C158 L159 R164 I165	D157-Q161 WeakPolarHBondContact O-CB 3.16Å; D157-Q161 PolarHBondContact O-N 3.45Å; C158-Q161 PolarHBondContact O-N 2.77Å; L159-Q161 VanDerWaalsContact C-N 3.32Å; L159-Q161 PolarHBondContact O-N 3.07Å; Q161-R164 WeakPolarHBondContact O-CB 3.37Å; Q161-R164 PolarHBondContact O-N 2.65Å; Q161-I165 HydrophobicContact CG-CD1 4.13Å; Q161-I165 WeakPolarHBondContact O-CD1 3.18Å; Q161-I165 VanDerWaalsContact O-CG1 3.28Å; Q161-I165 WeakPolarHBondContact O-CG1 3.33Å; Q161-I165 PolarHBondContact O-N 3.49Å
162	Y	94.9	Very high	91.4	Very high	55 Å²	55	44.6 Å²	44.6	22%	0.216	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-50	174.3	172.9	-110.6	0	0	0	111.8	C158 L159 R164 I165 E166 I174 S175 F183	C158-Y162 WeakPolarHBondContact O-CB 3.49Å; C158-Y162 PolarHBondContact O-N 3.11Å; L159-Y162 PolarHBondContact O-N 2.92Å; Y162-R164 VanDerWaalsContact C-N 3.32Å; Y162-R164 PolarHBondContact O-N 3.27Å; Y162-I165 PolarHBondContact O-N 3.17Å; Y162-E166 HydrophobicContact CD2-CG 4.13Å; Y162-E166 HydrophobicContact CE1-CG 4.17Å; Y162-E166 HydrophobicContact CE2-CG 3.57Å; Y162-E166 WeakPolarHBondContact O-CG 3.27Å; Y162-E166 PolarHBondContact O-N 3.07Å; Y162-I174 HydrophobicContact CD1-CG2 4.47Å; Y162-I174 HydrophobicContact CE1-CG2 3.54Å; Y162-S175 VanDerWaalsContact CE1-O 3.25Å; Y162-S175 WeakPolarHBondContact CE1-O 3.31Å; Y162-S175 PolarHBondContact OH-O 3.23Å; Y162-F183 HydrophobicContact CD1-CE2 4.47Å; Y162-F183 HydrophobicContact CE1-CE2 4.15Å
163	L	94.1	Very high	90.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.2	-43.3	175.5	-68	176.6	0	0	0	111.6	L159 I165 E166 I167 I174 F183 I188 I191 L192	L159-L163 WeakPolarHBondContact O-CB 3.48Å; L159-L163 VanDerWaalsContact O-CG 3.31Å; L159-L163 WeakPolarHBondContact O-CG 3.45Å; L159-L163 PolarHBondContact O-N 3.08Å; L163-I165 PolarHBondContact O-N 3.48Å; L163-E166 PolarHBondContact O-N 3.45Å; L163-I167 HydrophobicContact CB-CD1 4.49Å; L163-I167 WeakPolarHBondContact O-CB 3.43Å; L163-I167 WeakPolarHBondContact O-CD1 3.31Å; L163-I167 WeakPolarHBondContact O-CG1 3.49Å; L163-I167 PolarHBondContact O-N 3.48Å; L163-I174 HydrophobicContact CD2-CD1 4.03Å; L163-I174 HydrophobicContact CD2-CG2 4.03Å; L163-F183 HydrophobicContact CD2-CD2 4.41Å; L163-I188 HydrophobicContact CD1-CG2 4.32Å; L163-I188 HydrophobicContact CD2-CG1 4.04Å; L163-I188 HydrophobicContact CD2-CG2 4.39Å; L163-I191 HydrophobicContact CD1-CB 3.9Å; L163-I191 HydrophobicContact CD1-CG2 3.74Å; L163-L192 HydrophobicContact CB-CD1 4.19Å; L163-L192 HydrophobicContact CD1-CB 4.37Å
164	R	93.2	Very high	90.9	Very high	91 Å²	91	40.4 Å²	40.4	34%	0.343	20%	0.2	S	C	.	.	H	α-helix	trans	-56.1	-48.2	175.1	-81.8	172.7	165.8	171.4	-4.1	112.5	R160 Q161 Y162 S168 L192 D194 L197	R160-R164 WeakPolarHBondContact O-CB 3.44Å; R160-R164 WeakPolarHBondContact O-CG 3.45Å; R160-R164 PolarHBondContact O-N 2.92Å; Q161-R164 WeakPolarHBondContact O-CB 3.37Å; Q161-R164 PolarHBondContact O-N 2.65Å; Y162-R164 VanDerWaalsContact C-N 3.32Å; Y162-R164 PolarHBondContact O-N 3.27Å; R164-S168 WeakPolarHBondContact O-CB 3.16Å; R164-S168 PolarHBondContact O-N 3.02Å; R164-S168 PolarHBondContact O-OG 3.08Å; R164-S168 VanDerWaalsContact O-OG 3.13Å; R164-L192 HydrophobicContact CG-CD1 3.84Å; R164-D194 IonicContact NE-OD2 3.46Å; R164-D194 IonicContact NH2-OD2 3.25Å; R164-D194 PolarHBondContact NH2-OD2 2.88Å; R164-D194 VanDerWaalsContact NH2-OD2 3.15Å; R164-L197 HydrophobicContact CG-CD1 3.64Å
165	I	91.6	Very high	90.8	Very high	67 Å²	67	42 Å²	42	34%	0.344	21%	0.211	S	C	.	.	H	α-helix	trans	-61.9	-54.9	179	-70	165.1	0	0	0	110	Q161 Y162 L163 I167 S168 E169	Q161-I165 HydrophobicContact CG-CD1 4.13Å; Q161-I165 WeakPolarHBondContact O-CD1 3.18Å; Q161-I165 VanDerWaalsContact O-CG1 3.28Å; Q161-I165 WeakPolarHBondContact O-CG1 3.33Å; Q161-I165 PolarHBondContact O-N 3.49Å; Y162-I165 PolarHBondContact O-N 3.17Å; L163-I165 PolarHBondContact O-N 3.48Å; I165-I167 PolarHBondContact O-N 3.11Å; I165-S168 PolarHBondContact O-N 3.01Å; I165-S168 PolarHBondContact O-OG 3.39Å; I165-E169 WeakPolarHBondContact CG2-OE1 3.09Å; I165-E169 PolarHBondContact O-N 2.69Å
166	E	90.7	Very high	90.7	Very high	22 Å²	22	42.2 Å²	42.2	10%	0.103	21%	0.213	C	C	.	.	H	α-helix	trans	-57.1	-47.4	-179	-68.3	-65.7	110.6	0	0	112.6	Y162 L163 E169 S170 R171 I174	Y162-E166 HydrophobicContact CD2-CG 4.13Å; Y162-E166 HydrophobicContact CE1-CG 4.17Å; Y162-E166 HydrophobicContact CE2-CG 3.57Å; Y162-E166 WeakPolarHBondContact O-CG 3.27Å; Y162-E166 PolarHBondContact O-N 3.07Å; L163-E166 PolarHBondContact O-N 3.45Å; E166-E169 CarbonylContact O-C 3.55Å; E166-E169 PolarHBondContact O-N 3.07Å; E166-S170 PolarHBondContact O-N 3.2Å; E166-R171 HydrophobicContact CB-CB 4.28Å; E166-R171 WeakPolarHBondContact O-CA 3.36Å; E166-R171 WeakPolarHBondContact O-CB 3.35Å; E166-R171 PolarHBondContact O-N 2.8Å; E166-R171 IonicContact OE1-CZ 2.85Å; E166-R171 IonicContact OE1-NE 3.77Å; E166-R171 PolarHBondContact OE1-NE 2.96Å; E166-R171 IonicContact OE1-NH2 2.73Å; E166-R171 PolarHBondContact OE1-NH2 2.93Å; E166-R171 WeakPolarHBondContact OE2-CB 3.37Å; E166-R171 WeakPolarHBondContact OE2-CD 2.99Å; E166-R171 IonicContact OE2-CZ 3.28Å; E166-R171 IonicContact OE2-NE 2.62Å; E166-R171 PolarHBondContact OE2-NE 3.39Å; E166-I174 HydrophobicContact CB-CD1 3.83Å; E166-I174 HydrophobicContact CB-CG1 3.98Å; E166-I174 HydrophobicContact CB-CG2 4.32Å; E166-I174 HydrophobicContact CG-CG2 4.09Å
167	I	90.9	Very high	90.6	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-63.1	-45.5	177.5	-65.5	167.6	0	0	0	110.7	L163 I165 E169 S170 I174 I188 L192 L197 K200 Y201 F204	L163-I167 HydrophobicContact CB-CD1 4.49Å; L163-I167 WeakPolarHBondContact O-CB 3.43Å; L163-I167 WeakPolarHBondContact O-CD1 3.31Å; L163-I167 WeakPolarHBondContact O-CG1 3.49Å; L163-I167 PolarHBondContact O-N 3.48Å; I165-I167 PolarHBondContact O-N 3.11Å; I167-E169 PolarHBondContact O-N 3.1Å; I167-S170 PolarHBondContact O-N 2.82Å; I167-I174 HydrophobicContact CG1-CD1 3.94Å; I167-I188 HydrophobicContact CD1-CG2 4.31Å; I167-L192 HydrophobicContact CD1-CD1 4.38Å; I167-L192 HydrophobicContact CD1-CD2 3.61Å; I167-L197 HydrophobicContact CG2-CB 4.49Å; I167-L197 HydrophobicContact CG2-CD2 4.34Å; I167-L197 WeakPolarHBondContact CG2-O 3.36Å; I167-K200 HydrophobicContact CG2-CB 4.35Å; I167-Y201 HydrophobicContact CD1-CD2 4.36Å; I167-Y201 HydrophobicContact CD1-CG 4.41Å; I167-Y201 HydrophobicContact CG1-CD2 3.95Å; I167-Y201 HydrophobicContact CG1-CG 4.38Å; I167-F204 WeakPolarHBondContact O-CE2 3.44Å
168	S	87.4	Confident	90.4	Very high	84 Å²	84	43.2 Å²	43.2	59%	0.587	22%	0.218	S	C	*	.	H	α-helix	trans	-63.6	-29	-179.8	73.1	0	0	0	0	113.3	R164 I165 S170	R164-S168 WeakPolarHBondContact O-CB 3.16Å; R164-S168 PolarHBondContact O-N 3.02Å; R164-S168 PolarHBondContact O-OG 3.08Å; R164-S168 VanDerWaalsContact O-OG 3.13Å; I165-S168 PolarHBondContact O-N 3.01Å; I165-S168 PolarHBondContact O-OG 3.39Å; S168-S170 VanDerWaalsContact C-N 3.3Å
169	E	84.9	Confident	90.2	Very high	96 Å²	96	43.7 Å²	43.7	45%	0.449	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	17.2	174.6	-64.7	-175.7	-111.5	0	0	113	I165 E166 I167 R171	I165-E169 WeakPolarHBondContact CG2-OE1 3.09Å; I165-E169 PolarHBondContact O-N 2.69Å; E166-E169 CarbonylContact O-C 3.55Å; E166-E169 PolarHBondContact O-N 3.07Å; I167-E169 PolarHBondContact O-N 3.1Å; E169-R171 VanDerWaalsContact C-N 3.27Å; E169-R171 VanDerWaalsContact CB-NH1 3.32Å; E169-R171 VanDerWaalsContact CD-NH1 3.26Å; E169-R171 PolarHBondContact O-N 3.42Å; E169-R171 IonicContact OE1-CZ 2.67Å; E169-R171 IonicContact OE1-NH1 2.65Å; E169-R171 IonicContact OE1-NH2 2.96Å; E169-R171 PolarHBondContact OE1-NH2 3.28Å; E169-R171 IonicContact OE2-CZ 2.68Å; E169-R171 IonicContact OE2-NH1 2.8Å; E169-R171 PolarHBondContact OE2-NH1 3.43Å; E169-R171 IonicContact OE2-NH2 3.45Å; E169-R171 PolarHBondContact OE2-NH2 3.13Å
170	S	80.9	Confident	89.9	Confident	22 Å²	22	49 Å²	49	15%	0.154	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	20.7	178.5	69.9	0	0	0	0	116.1	E166 I167 S168 V172	E166-S170 PolarHBondContact O-N 3.2Å; I167-S170 PolarHBondContact O-N 2.82Å; S168-S170 VanDerWaalsContact C-N 3.3Å; S170-V172 PolarHBondContact O-N 3.08Å
171	R	81.5	Confident	89.9	Confident	58 Å²	58	51.4 Å²	51.4	22%	0.219	27%	0.267	C	S	.	.			trans	-88	108.8	178.4	-64.5	-166	-74.7	-84.8	0.1	110.7	E166 E169 I174	E166-R171 HydrophobicContact CB-CB 4.28Å; E166-R171 WeakPolarHBondContact O-CA 3.36Å; E166-R171 WeakPolarHBondContact O-CB 3.35Å; E166-R171 PolarHBondContact O-N 2.8Å; E166-R171 IonicContact OE1-CZ 2.85Å; E166-R171 IonicContact OE1-NE 3.77Å; E166-R171 PolarHBondContact OE1-NE 2.96Å; E166-R171 IonicContact OE1-NH2 2.73Å; E166-R171 PolarHBondContact OE1-NH2 2.93Å; E166-R171 WeakPolarHBondContact OE2-CB 3.37Å; E166-R171 WeakPolarHBondContact OE2-CD 2.99Å; E166-R171 IonicContact OE2-CZ 3.28Å; E166-R171 IonicContact OE2-NE 2.62Å; E166-R171 PolarHBondContact OE2-NE 3.39Å; E169-R171 VanDerWaalsContact C-N 3.27Å; E169-R171 VanDerWaalsContact CB-NH1 3.32Å; E169-R171 VanDerWaalsContact CD-NH1 3.26Å; E169-R171 PolarHBondContact O-N 3.42Å; E169-R171 IonicContact OE1-CZ 2.67Å; E169-R171 IonicContact OE1-NH1 2.65Å; E169-R171 IonicContact OE1-NH2 2.96Å; E169-R171 PolarHBondContact OE1-NH2 3.28Å; E169-R171 IonicContact OE2-CZ 2.68Å; E169-R171 IonicContact OE2-NH1 2.8Å; E169-R171 PolarHBondContact OE2-NH1 3.43Å; E169-R171 IonicContact OE2-NH2 3.45Å; E169-R171 PolarHBondContact OE2-NH2 3.13Å; R171-I174 WeakPolarHBondContact O-CG1 3.1Å
172	V	80.4	Confident	89.8	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.018	27%	0.271	C	S	.	.			trans	-103.2	-22	-175.3	-67.2	0	0	0	0	115.9	S170 I174 Y201 F204 M205 R208	S170-V172 PolarHBondContact O-N 3.08Å; V172-I174 PolarHBondContact O-N 3.37Å; V172-Y201 HydrophobicContact CB-CD2 4.36Å; V172-Y201 HydrophobicContact CB-CE2 4.04Å; V172-Y201 HydrophobicContact CG1-CD2 4.01Å; V172-Y201 HydrophobicContact CG1-CE2 4.2Å; V172-Y201 WeakPolarHBondContact O-CE2 3.34Å; V172-Y201 PolarHBondContact O-OH 3.4Å; V172-F204 HydrophobicContact CG1-CB 3.3Å; V172-F204 HydrophobicContact CG1-CG 4.44Å; V172-M205 HydrophobicContact CB-CG 3.81Å; V172-M205 HydrophobicContact CG1-CG 4.08Å; V172-M205 HydrophobicContact CG2-CG 4.4Å; V172-R208 HydrophobicContact CG2-CB 4.18Å; V172-R208 VanDerWaalsContact CG2-CD 3.41Å; V172-R208 HydrophobicContact CG2-CG 4.46Å
173	N	84.8	Confident	89.7	Confident	66 Å²	66	51.6 Å²	51.6	35%	0.353	26%	0.263	S	S	.	.	S	Bend	trans	-83.9	62.6	170.7	-72.6	23.5	0	0	0	108.8	R208	N173-R208 PolarHBondContact ND2-NH2 3.29Å
174	I	90.7	Very high	89.6	Confident	2 Å²	2	54 Å²	54	1%	0.01	28%	0.276	C	S	.	.			trans	-74.3	129.3	-174.8	-50.4	177.8	0	0	0	109.4	Y162 L163 E166 I167 R171 V172 R182 F183 I188 Y201	Y162-I174 HydrophobicContact CD1-CG2 4.47Å; Y162-I174 HydrophobicContact CE1-CG2 3.54Å; L163-I174 HydrophobicContact CD2-CD1 4.03Å; L163-I174 HydrophobicContact CD2-CG2 4.03Å; E166-I174 HydrophobicContact CB-CD1 3.83Å; E166-I174 HydrophobicContact CB-CG1 3.98Å; E166-I174 HydrophobicContact CB-CG2 4.32Å; E166-I174 HydrophobicContact CG-CG2 4.09Å; I167-I174 HydrophobicContact CG1-CD1 3.94Å; R171-I174 WeakPolarHBondContact O-CG1 3.1Å; V172-I174 PolarHBondContact O-N 3.37Å; I174-R182 WeakPolarHBondContact O-CA 3.38Å; I174-F183 HydrophobicContact CG2-CD2 3.98Å; I174-F183 PolarHBondContact O-N 3.41Å; I174-I188 HydrophobicContact CD1-CD1 4.32Å; I174-Y201 HydrophobicContact CD1-CD2 4.15Å; I174-Y201 HydrophobicContact CD1-CE2 3.86Å; I174-Y201 HydrophobicContact CG1-CE2 4.26Å
175	S	92.8	Very high	89.5	Confident	34 Å²	34	52 Å²	52	24%	0.238	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-104.6	164.4	175.7	-72.5	0	0	0	0	111.7	Y162 T180 E181 F183	Y162-S175 VanDerWaalsContact CE1-O 3.25Å; Y162-S175 WeakPolarHBondContact CE1-O 3.31Å; Y162-S175 PolarHBondContact OH-O 3.23Å; S175-T180 PolarHBondContact OG-O 2.92Å; S175-E181 CarbonylContact C-O 3.53Å; S175-E181 WeakPolarHBondContact CA-O 3.36Å; S175-E181 WeakPolarHBondContact CB-O 3.38Å; S175-F183 WeakPolarHBondContact O-CD2 3.34Å; S175-F183 VanDerWaalsContact O-CE2 3.3Å; S175-F183 WeakPolarHBondContact O-CE2 3.49Å
176	C	93.8	Very high	89.5	Confident	7 Å²	7	53.9 Å²	53.9	5%	0.047	28%	0.282	C	S	.	.			trans	-54.8	139.9	168.1	-175.5	0	0	0	0	110.1	C150 E178 C179 E181	C150-C176 VanDerWaalsContact SG-SG 3.6Å; C176-E178 PolarHBondContact O-N 3.18Å; C176-E178 PolarHBondContact SG-N 2.97Å; C176-E178 VanDerWaalsContact SG-N 3.43Å; C176-C179 WeakPolarHBondContact CB-O 3.37Å; C176-C179 PolarHBondContact O-N 2.98Å; C176-E181 PolarHBondContact N-O 3.44Å
177	P	92.6	Very high	89.6	Confident	45 Å²	45	53.1 Å²	53.1	29%	0.292	28%	0.279	S	S	.	.	S	Bend	trans	-67	-15.7	173.8	27.8	-35.6	0	0	0	113.1	L134 L159	L134-P177 HydrophobicContact CD1-CB 4.15Å; L134-P177 HydrophobicContact CD1-CG 3.87Å; L134-P177 HydrophobicContact CD2-CB 4.11Å; L134-P177 HydrophobicContact CD2-CG 4.49Å; L159-P177 HydrophobicContact CD2-CG 3.88Å
178	E	91.2	Very high	89.8	Confident	70 Å²	70	53 Å²	53	33%	0.327	28%	0.279	S	S	.	.	S	Bend	trans	-103.4	-16.3	-179	-64.8	166.6	-120.4	0	0	113.1	P133 H152 R153 S154 C176	P133-E178 HydrophobicContact CG-CG 4.41Å; P133-E178 WeakPolarHBondContact CG-OE1 3.5Å; H152-E178 HydrophobicContact CB-CB 3.83Å; H152-E178 HydrophobicContact CB-CG 4.28Å; H152-E178 WeakPolarHBondContact CB-OE2 3.45Å; H152-E178 IonicContact CD2-OE2 2.69Å; H152-E178 PolarHBondContact CD2-OE2 3.04Å; H152-E178 IonicContact CG-OE2 2.72Å; R153-E178 PolarHBondContact N-OE1 3.14Å; S154-E178 PolarHBondContact N-OE1 2.83Å; S154-E178 PolarHBondContact OG-OE1 3.05Å; C176-E178 PolarHBondContact O-N 3.18Å; C176-E178 PolarHBondContact SG-N 2.97Å; C176-E178 VanDerWaalsContact SG-N 3.43Å
179	C	92.2	Very high	90	Very high	37 Å²	37	54.5 Å²	54.5	25%	0.25	27%	0.271	C	S	.	.	S	Bend	trans	-156.2	171.2	177.7	74.2	0	0	0	0	114.5	H152 C176 E181	H152-C179 VanDerWaalsContact CE1-CB 3.48Å; H152-C179 WeakPolarHBondContact CE1-CB 3.33Å; H152-C179 PolarHBondContact CE1-SG 3.17Å; H152-C179 PolarHBondContact ND1-SG 2.84Å; C176-C179 WeakPolarHBondContact CB-O 3.37Å; C176-C179 PolarHBondContact O-N 2.98Å; C179-E181 VanDerWaalsContact C-N 3.27Å; C179-E181 PolarHBondContact O-N 3.44Å
180	T	90.2	Very high	90.4	Very high	113 Å²	113	55.1 Å²	55.1	69%	0.693	28%	0.277	S	S	*	.	S	Bend	trans	-68.7	-16.8	-177.1	45.9	0	0	0	0	115.4	S175	S175-T180 PolarHBondContact OG-O 2.92Å
181	E	93.4	Very high	91	Very high	104 Å²	104	54.4 Å²	54.4	49%	0.486	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-58.9	142.3	-177.7	-71	-55.6	149.8	0	0	112.5	C150 S175 C176 C179	C150-E181 HydrophobicContact CB-CB 4.4Å; S175-E181 CarbonylContact C-O 3.53Å; S175-E181 WeakPolarHBondContact CA-O 3.36Å; S175-E181 WeakPolarHBondContact CB-O 3.38Å; C176-E181 PolarHBondContact N-O 3.44Å; C179-E181 VanDerWaalsContact C-N 3.27Å; C179-E181 PolarHBondContact O-N 3.44Å
182	R	92.8	Very high	91.5	Very high	150 Å²	150	51.7 Å²	51.7	57%	0.566	26%	0.261	S	S	*	.	B	Isolated β-bridge	trans	-81.1	147.7	-179.5	-65.8	-175	-169.8	160.5	9.5	111.3	T149 I174	T149-R182 VanDerWaalsContact CB-O 3.26Å; T149-R182 WeakPolarHBondContact CB-O 3.24Å; T149-R182 VanDerWaalsContact CG2-O 3.3Å; T149-R182 WeakPolarHBondContact CG2-O 3.47Å; T149-R182 PolarHBondContact OG1-O 2.82Å; I174-R182 WeakPolarHBondContact O-CA 3.38Å
183	F	93.1	Very high	91.9	Very high	11 Å²	11	55.2 Å²	55.2	5%	0.048	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-68.6	144.3	166.4	-83.3	-82	0	0	0	110.9	I147 L159 Y162 L163 I174 S175 D187 I188 I191	I147-F183 HydrophobicContact CD1-CE1 3.74Å; I147-F183 HydrophobicContact CD1-CZ 3.99Å; I147-F183 HydrophobicContact CG1-CE1 3.99Å; I147-F183 HydrophobicContact CG2-CD1 3.97Å; I147-F183 HydrophobicContact CG2-CE1 3.85Å; L159-F183 HydrophobicContact CD2-CZ 3.98Å; Y162-F183 HydrophobicContact CD1-CE2 4.47Å; Y162-F183 HydrophobicContact CE1-CE2 4.15Å; L163-F183 HydrophobicContact CD2-CD2 4.41Å; I174-F183 HydrophobicContact CG2-CD2 3.98Å; I174-F183 PolarHBondContact O-N 3.41Å; S175-F183 WeakPolarHBondContact O-CD2 3.34Å; S175-F183 VanDerWaalsContact O-CE2 3.3Å; S175-F183 WeakPolarHBondContact O-CE2 3.49Å; F183-D187 HydrophobicContact CD1-CB 4.21Å; F183-I188 HydrophobicContact CB-CD1 3.86Å; F183-I188 HydrophobicContact CB-CG1 3.71Å; F183-I188 HydrophobicContact CG-CG1 4.37Å; F183-I191 HydrophobicContact CE1-CD1 4.18Å
184	N	92.6	Very high	92.2	Very high	50 Å²	50	54.2 Å²	54.2	27%	0.267	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-72.9	133.8	165.2	179.3	-6.3	0	0	0	108.9	M148 T149 H186 D187 I188	M148-N184 PolarHBondContact SD-ND2 3.42Å; T149-N184 HydrophobicContact CG2-CB 4.42Å; N184-H186 PolarHBondContact O-N 3.27Å; N184-H186 PolarHBondContact OD1-N 2.89Å; N184-D187 HydrophobicContact CB-CB 4.41Å; N184-D187 WeakPolarHBondContact O-CB 3.47Å; N184-D187 PolarHBondContact O-N 2.9Å; N184-I188 PolarHBondContact O-N 2.85Å; N184-I188 VanDerWaalsContact O-N 3.08Å
185	P	91.3	Very high	92.2	Very high	50 Å²	50	60 Å²	60	33%	0.325	31%	0.312	S	S	.	.	H	α-helix	trans	-51.8	-25.7	172.3	-30.7	37.4	0	0	0	114.9	R189 Y201 M205	P185-R189 PolarHBondContact O-N 2.91Å; P185-R189 VanDerWaalsContact O-N 3.14Å; P185-Y201 HydrophobicContact CB-CE1 4.28Å; P185-Y201 HydrophobicContact CG-CE1 4.46Å; P185-M205 HydrophobicContact CG-SD 4.45Å
186	H	91.6	Very high	92.2	Very high	106 Å²	106	62.5 Å²	62.5	49%	0.491	33%	0.325	S	S	.	.	H	α-helix	trans	-65	-51.1	171.2	-170.4	68.9	0	0	0	112.2	N184 I188 R189 L190	N184-H186 PolarHBondContact O-N 3.27Å; N184-H186 PolarHBondContact OD1-N 2.89Å; H186-I188 VanDerWaalsContact C-N 3.28Å; H186-I188 PolarHBondContact O-N 3.5Å; H186-R189 PolarHBondContact O-N 2.88Å; H186-L190 WeakPolarHBondContact O-CG 3.31Å; H186-L190 PolarHBondContact O-N 2.85Å
187	D	93.3	Very high	92.1	Very high	6 Å²	6	63.5 Å²	63.5	3%	0.032	33%	0.33	C	S	.	.	H	α-helix	trans	-59.3	-40.7	177.4	-53.5	0.5	0	0	0	110.8	M148 F183 N184 L190 I191	M148-D187 VanDerWaalsContact CG-OD1 3.27Å; M148-D187 WeakPolarHBondContact CG-OD1 3.39Å; M148-D187 PolarHBondContact N-OD2 2.84Å; F183-D187 HydrophobicContact CD1-CB 4.21Å; N184-D187 HydrophobicContact CB-CB 4.41Å; N184-D187 WeakPolarHBondContact O-CB 3.47Å; N184-D187 PolarHBondContact O-N 2.9Å; D187-L190 PolarHBondContact O-N 2.68Å; D187-I191 HydrophobicContact CB-CD1 4.37Å; D187-I191 WeakPolarHBondContact O-CB 3.49Å; D187-I191 WeakPolarHBondContact O-CD1 3.3Å; D187-I191 WeakPolarHBondContact O-CG1 3.16Å; D187-I191 PolarHBondContact O-N 2.9Å
188	I	93.3	Very high	92.1	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58	-52.5	175.6	-63.1	174.5	0	0	0	109.9	L163 I167 I174 F183 N184 H186 L190 I191 L192 M198 Y201	L163-I188 HydrophobicContact CD1-CG2 4.32Å; L163-I188 HydrophobicContact CD2-CG1 4.04Å; L163-I188 HydrophobicContact CD2-CG2 4.39Å; I167-I188 HydrophobicContact CD1-CG2 4.31Å; I174-I188 HydrophobicContact CD1-CD1 4.32Å; F183-I188 HydrophobicContact CB-CD1 3.86Å; F183-I188 HydrophobicContact CB-CG1 3.71Å; F183-I188 HydrophobicContact CG-CG1 4.37Å; N184-I188 PolarHBondContact O-N 2.85Å; N184-I188 VanDerWaalsContact O-N 3.08Å; H186-I188 VanDerWaalsContact C-N 3.28Å; H186-I188 PolarHBondContact O-N 3.5Å; I188-L190 VanDerWaalsContact C-N 3.35Å; I188-L190 PolarHBondContact O-N 2.73Å; I188-I191 PolarHBondContact O-N 3.07Å; I188-L192 WeakPolarHBondContact O-CB 3.46Å; I188-L192 PolarHBondContact O-N 2.97Å; I188-M198 HydrophobicContact CG2-SD 3.96Å; I188-Y201 HydrophobicContact CD1-CE1 3.91Å; I188-Y201 HydrophobicContact CD1-CE2 3.84Å; I188-Y201 VanDerWaalsContact CD1-CZ 3.4Å; I188-Y201 VanDerWaalsContact CD1-OH 3.28Å; I188-Y201 WeakPolarHBondContact CD1-OH 3.28Å; I188-Y201 HydrophobicContact CG2-CD1 4.49Å
189	R	93.4	Very high	92.1	Very high	114 Å²	114	64.6 Å²	64.6	43%	0.43	33%	0.332	S	S	.	.	H	α-helix	trans	-58.1	-45.8	179.9	-162.9	-175.8	-51.1	-86.4	-3.1	111.9	P185 H186 S193 M198 E202	P185-R189 PolarHBondContact O-N 2.91Å; P185-R189 VanDerWaalsContact O-N 3.14Å; H186-R189 PolarHBondContact O-N 2.88Å; R189-S193 PolarHBondContact O-N 2.62Å; R189-M198 HydrophobicContact CB-CE 4.1Å; R189-M198 HydrophobicContact CB-CG 4.48Å; R189-M198 HydrophobicContact CB-SD 4Å; R189-M198 HydrophobicContact CG-CG 4.11Å; R189-M198 HydrophobicContact CG-SD 4.29Å; R189-M198 VanDerWaalsContact NH1-CG 3.33Å; R189-E202 IonicContact CZ-OE1 2.99Å; R189-E202 IonicContact NH1-OE1 3.81Å; R189-E202 PolarHBondContact NH1-OE1 2.89Å; R189-E202 IonicContact NH2-OE1 3.15Å; R189-E202 PolarHBondContact NH2-OE1 2.86Å
190	L	92.6	Very high	92	Very high	110 Å²	110	67.2 Å²	67.2	58%	0.576	34%	0.338	S	S	*	.	H	α-helix	trans	-62.7	-52.4	179.9	-70	176.7	0	0	0	112.6	H186 D187 I188 S193	H186-L190 WeakPolarHBondContact O-CG 3.31Å; H186-L190 PolarHBondContact O-N 2.85Å; D187-L190 PolarHBondContact O-N 2.68Å; I188-L190 VanDerWaalsContact C-N 3.35Å; I188-L190 PolarHBondContact O-N 2.73Å; L190-S193 PolarHBondContact O-OG 2.99Å
191	I	93.7	Very high	92.1	Very high	7 Å²	7	62.1 Å²	62.1	4%	0.036	31%	0.307	C	S	.	.	H	α-helix	trans	-68.9	-41.6	-175.6	-65.3	167.8	0	0	0	111	P145 V156 L159 R160 L163 F183 D187 I188 S193	P145-I191 HydrophobicContact CB-CD1 4.33Å; P145-I191 HydrophobicContact CB-CG1 4.07Å; P145-I191 HydrophobicContact CG-CD1 3.99Å; P145-I191 HydrophobicContact CG-CG1 3.94Å; V156-I191 HydrophobicContact CG2-CG2 4.42Å; L159-I191 HydrophobicContact CB-CG2 3.75Å; L159-I191 HydrophobicContact CD1-CD1 4.34Å; R160-I191 HydrophobicContact CB-CG2 4.49Å; R160-I191 VanDerWaalsContact CZ-O 3.26Å; R160-I191 PolarHBondContact NE-O 3.29Å; R160-I191 PolarHBondContact NH2-O 3.37Å; L163-I191 HydrophobicContact CD1-CB 3.9Å; L163-I191 HydrophobicContact CD1-CG2 3.74Å; F183-I191 HydrophobicContact CE1-CD1 4.18Å; D187-I191 HydrophobicContact CB-CD1 4.37Å; D187-I191 WeakPolarHBondContact O-CB 3.49Å; D187-I191 WeakPolarHBondContact O-CD1 3.3Å; D187-I191 WeakPolarHBondContact O-CG1 3.16Å; D187-I191 PolarHBondContact O-N 2.9Å; I188-I191 PolarHBondContact O-N 3.07Å; I191-S193 PolarHBondContact O-OG 3.21Å
192	L	92.6	Very high	92	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-67.1	-48.4	-175.7	-175.2	64.4	0	0	0	111.2	R160 L163 R164 I167 I188 D194 L197 M198	R160-L192 WeakPolarHBondContact CD-O 3.33Å; R160-L192 PolarHBondContact NE-O 3.06Å; L163-L192 HydrophobicContact CB-CD1 4.19Å; L163-L192 HydrophobicContact CD1-CB 4.37Å; R164-L192 HydrophobicContact CG-CD1 3.84Å; I167-L192 HydrophobicContact CD1-CD1 4.38Å; I167-L192 HydrophobicContact CD1-CD2 3.61Å; I188-L192 WeakPolarHBondContact O-CB 3.46Å; I188-L192 PolarHBondContact O-N 2.97Å; L192-D194 VanDerWaalsContact C-N 3.28Å; L192-D194 HydrophobicContact CD1-CB 4.48Å; L192-D194 HydrophobicContact CG-CB 3.98Å; L192-D194 PolarHBondContact O-N 2.87Å; L192-L197 HydrophobicContact CD1-CB 4.48Å; L192-L197 HydrophobicContact CD1-CD1 4.14Å; L192-L197 HydrophobicContact CD2-CB 3.82Å; L192-L197 HydrophobicContact CG-CB 4.45Å; L192-M198 HydrophobicContact CD2-CB 4.48Å
193	S	87.3	Confident	91.7	Very high	77 Å²	77	58 Å²	58	54%	0.538	29%	0.294	S	S	.	.			trans	58.3	35.9	178.7	-29.6	0	0	0	0	113.5	R160 R189 L190 I191	R160-S193 PolarHBondContact NH2-OG 2.87Å; R189-S193 PolarHBondContact O-N 2.62Å; L190-S193 PolarHBondContact O-OG 2.99Å; I191-S193 PolarHBondContact O-OG 3.21Å
194	D	91.8	Very high	91.4	Very high	45 Å²	45	59.8 Å²	59.8	24%	0.241	30%	0.302	C	S	.	.			trans	-146.2	98.2	-171.6	-169.2	-39.7	0	0	0	109.1	R164 L192 V196 L197 M198	R164-D194 IonicContact NE-OD2 3.46Å; R164-D194 IonicContact NH2-OD2 3.25Å; R164-D194 PolarHBondContact NH2-OD2 2.88Å; R164-D194 VanDerWaalsContact NH2-OD2 3.15Å; L192-D194 VanDerWaalsContact C-N 3.28Å; L192-D194 HydrophobicContact CD1-CB 4.48Å; L192-D194 HydrophobicContact CG-CB 3.98Å; L192-D194 PolarHBondContact O-N 2.87Å; D194-V196 VanDerWaalsContact C-N 3.32Å; D194-V196 PolarHBondContact O-N 3.46Å; D194-L197 HydrophobicContact CB-CB 4.34Å; D194-L197 HydrophobicContact CB-CD1 4.33Å; D194-L197 PolarHBondContact O-N 3.25Å; D194-L197 PolarHBondContact OD1-N 2.81Å; D194-M198 PolarHBondContact O-N 3.05Å
195	D	90.9	Very high	91.2	Very high	124 Å²	124	60 Å²	60	66%	0.663	30%	0.302	S	S	*	.	H	α-helix	trans	-66.9	-31.4	-170.4	-61.9	-54.4	0	0	0	112.9	L197 M198 E199	D195-L197 VanDerWaalsContact C-N 3.34Å; D195-L197 PolarHBondContact O-N 2.85Å; D195-M198 PolarHBondContact O-N 3.38Å; D195-M198 VanDerWaalsContact O-N 3.17Å; D195-E199 WeakPolarHBondContact O-CB 3.28Å; D195-E199 PolarHBondContact O-N 2.99Å
196	V	92.3	Very high	91	Very high	86 Å²	86	62.8 Å²	62.8	52%	0.521	31%	0.313	S	S	.	.	H	α-helix	trans	-71.2	-30	179.8	-179.1	0	0	0	0	111.7	D194 K200	D194-V196 VanDerWaalsContact C-N 3.32Å; D194-V196 PolarHBondContact O-N 3.46Å; V196-K200 WeakPolarHBondContact O-CG 3.43Å
197	L	91	Very high	90.7	Very high	29 Å²	29	62 Å²	62	15%	0.152	31%	0.306	C	S	.	.	H	α-helix	trans	-80.1	-31.1	169.2	-71.8	176.7	0	0	0	112.2	R164 I167 L192 D194 D195 K200 Y201	R164-L197 HydrophobicContact CG-CD1 3.64Å; I167-L197 HydrophobicContact CG2-CB 4.49Å; I167-L197 HydrophobicContact CG2-CD2 4.34Å; I167-L197 WeakPolarHBondContact CG2-O 3.36Å; L192-L197 HydrophobicContact CD1-CB 4.48Å; L192-L197 HydrophobicContact CD1-CD1 4.14Å; L192-L197 HydrophobicContact CD2-CB 3.82Å; L192-L197 HydrophobicContact CG-CB 4.45Å; D194-L197 HydrophobicContact CB-CB 4.34Å; D194-L197 HydrophobicContact CB-CD1 4.33Å; D194-L197 PolarHBondContact O-N 3.25Å; D194-L197 PolarHBondContact OD1-N 2.81Å; D195-L197 VanDerWaalsContact C-N 3.34Å; D195-L197 PolarHBondContact O-N 2.85Å; L197-K200 HydrophobicContact CD2-CD 4.43Å; L197-K200 PolarHBondContact O-N 2.83Å; L197-Y201 PolarHBondContact O-N 2.99Å
198	M	92.7	Very high	90.1	Very high	4 Å²	4	64.2 Å²	64.2	2%	0.02	31%	0.314	C	S	.	.	H	α-helix	trans	-67.6	-41	175.2	-165.5	65.9	-164.9	0	0	112.1	I188 R189 L192 D194 D195 K200 Y201 E202	I188-M198 HydrophobicContact CG2-SD 3.96Å; R189-M198 HydrophobicContact CB-CE 4.1Å; R189-M198 HydrophobicContact CB-CG 4.48Å; R189-M198 HydrophobicContact CB-SD 4Å; R189-M198 HydrophobicContact CG-CG 4.11Å; R189-M198 HydrophobicContact CG-SD 4.29Å; R189-M198 VanDerWaalsContact NH1-CG 3.33Å; L192-M198 HydrophobicContact CD2-CB 4.48Å; D194-M198 PolarHBondContact O-N 3.05Å; D195-M198 PolarHBondContact O-N 3.38Å; D195-M198 VanDerWaalsContact O-N 3.17Å; M198-K200 VanDerWaalsContact C-N 3.33Å; M198-K200 PolarHBondContact O-N 2.93Å; M198-Y201 HydrophobicContact CE-CD1 3.66Å; M198-Y201 HydrophobicContact CE-CE1 4.07Å; M198-Y201 WeakPolarHBondContact O-CB 3.5Å; M198-Y201 PolarHBondContact O-N 3.44Å; M198-Y201 VanDerWaalsContact O-N 3.15Å; M198-Y201 HydrophobicContact SD-CD1 4.01Å; M198-E202 HydrophobicContact CE-CG 4.27Å; M198-E202 WeakPolarHBondContact O-CG 3.3Å; M198-E202 PolarHBondContact O-N 3.18Å
199	E	91.8	Very high	89.7	Confident	134 Å²	134	73.5 Å²	73.5	63%	0.626	35%	0.349	S	S	*	.	H	α-helix	trans	-56.8	-44.8	172.9	-176.5	-179.1	-155.3	0	0	111.4	D195 E202 E203	D195-E199 WeakPolarHBondContact O-CB 3.28Å; D195-E199 PolarHBondContact O-N 2.99Å; E199-E202 PolarHBondContact O-N 3.29Å; E199-E203 PolarHBondContact O-N 3.37Å
200	K	90.1	Very high	89.4	Confident	91 Å²	91	69.9 Å²	69.9	40%	0.396	34%	0.338	S	S	.	.	H	α-helix	trans	-64.7	-39.2	175.1	-70.9	170.2	-175.5	171.2	0	112.8	I167 V196 L197 M198 E202 E203 F204	I167-K200 HydrophobicContact CG2-CB 4.35Å; V196-K200 WeakPolarHBondContact O-CG 3.43Å; L197-K200 HydrophobicContact CD2-CD 4.43Å; L197-K200 PolarHBondContact O-N 2.83Å; M198-K200 VanDerWaalsContact C-N 3.33Å; M198-K200 PolarHBondContact O-N 2.93Å; K200-E202 VanDerWaalsContact C-N 3.33Å; K200-E203 PolarHBondContact O-N 3.32Å; K200-F204 HydrophobicContact CB-CE2 4.17Å; K200-F204 WeakPolarHBondContact O-CB 3.36Å; K200-F204 WeakPolarHBondContact O-CD2 3.36Å; K200-F204 WeakPolarHBondContact O-CG 3.16Å; K200-F204 PolarHBondContact O-N 3.33Å
201	Y	91.7	Very high	88.9	Confident	7 Å²	7	65.3 Å²	65.3	3%	0.027	32%	0.315	C	S	.	.	H	α-helix	trans	-61.5	-43.2	174.2	174.6	-102.9	0	0	0	111.2	I167 V172 I174 P185 I188 L197 M198 M205	I167-Y201 HydrophobicContact CD1-CD2 4.36Å; I167-Y201 HydrophobicContact CD1-CG 4.41Å; I167-Y201 HydrophobicContact CG1-CD2 3.95Å; I167-Y201 HydrophobicContact CG1-CG 4.38Å; V172-Y201 HydrophobicContact CB-CD2 4.36Å; V172-Y201 HydrophobicContact CB-CE2 4.04Å; V172-Y201 HydrophobicContact CG1-CD2 4.01Å; V172-Y201 HydrophobicContact CG1-CE2 4.2Å; V172-Y201 WeakPolarHBondContact O-CE2 3.34Å; V172-Y201 PolarHBondContact O-OH 3.4Å; I174-Y201 HydrophobicContact CD1-CD2 4.15Å; I174-Y201 HydrophobicContact CD1-CE2 3.86Å; I174-Y201 HydrophobicContact CG1-CE2 4.26Å; P185-Y201 HydrophobicContact CB-CE1 4.28Å; P185-Y201 HydrophobicContact CG-CE1 4.46Å; I188-Y201 HydrophobicContact CD1-CE1 3.91Å; I188-Y201 HydrophobicContact CD1-CE2 3.84Å; I188-Y201 VanDerWaalsContact CD1-CZ 3.4Å; I188-Y201 VanDerWaalsContact CD1-OH 3.28Å; I188-Y201 WeakPolarHBondContact CD1-OH 3.28Å; I188-Y201 HydrophobicContact CG2-CD1 4.49Å; L197-Y201 PolarHBondContact O-N 2.99Å; M198-Y201 HydrophobicContact CE-CD1 3.66Å; M198-Y201 HydrophobicContact CE-CE1 4.07Å; M198-Y201 WeakPolarHBondContact O-CB 3.5Å; M198-Y201 PolarHBondContact O-N 3.44Å; M198-Y201 VanDerWaalsContact O-N 3.15Å; M198-Y201 HydrophobicContact SD-CD1 4.01Å; Y201-M205 HydrophobicContact CD1-CG 4.47Å; Y201-M205 HydrophobicContact CD1-SD 4.09Å; Y201-M205 HydrophobicContact CE1-CG 4.07Å; Y201-M205 HydrophobicContact CE1-SD 3.31Å; Y201-M205 WeakPolarHBondContact CE1-SD 3.15Å; Y201-M205 HydrophobicContact CE2-CG 4.25Å; Y201-M205 HydrophobicContact CE2-SD 4.33Å; Y201-M205 WeakPolarHBondContact O-CB 3.41Å; Y201-M205 WeakPolarHBondContact O-CG 3.36Å; Y201-M205 PolarHBondContact O-N 3.29Å; Y201-M205 PolarHBondContact OH-SD 3Å; Y201-M205 VanDerWaalsContact OH-SD 3.4Å
202	E	91.4	Very high	88.2	Confident	80 Å²	80	67.7 Å²	67.7	37%	0.374	34%	0.335	S	S	.	.	H	α-helix	trans	-66.5	-43	175.9	-69.9	175.4	-159.7	0	0	112.1	R189 M198 E199 K200 M205 L206	R189-E202 IonicContact CZ-OE1 2.99Å; R189-E202 IonicContact NH1-OE1 3.81Å; R189-E202 PolarHBondContact NH1-OE1 2.89Å; R189-E202 IonicContact NH2-OE1 3.15Å; R189-E202 PolarHBondContact NH2-OE1 2.86Å; M198-E202 HydrophobicContact CE-CG 4.27Å; M198-E202 WeakPolarHBondContact O-CG 3.3Å; M198-E202 PolarHBondContact O-N 3.18Å; E199-E202 PolarHBondContact O-N 3.29Å; K200-E202 VanDerWaalsContact C-N 3.33Å; E202-M205 PolarHBondContact O-N 3.48Å; E202-L206 WeakPolarHBondContact O-CB 3.39Å; E202-L206 PolarHBondContact O-N 2.96Å
203	E	87.4	Confident	87.8	Confident	88 Å²	88	70.2 Å²	70.2	41%	0.411	35%	0.349	S	S	.	.	H	α-helix	trans	-58.3	-50.1	173.4	-167	-145.6	144.4	0	0	111	E199 K200 M205 L206 R207	E199-E203 PolarHBondContact O-N 3.37Å; K200-E203 PolarHBondContact O-N 3.32Å; E203-M205 VanDerWaalsContact C-N 3.33Å; E203-M205 PolarHBondContact O-N 3.27Å; E203-L206 PolarHBondContact O-N 3Å; E203-R207 WeakPolarHBondContact O-CB 3.21Å; E203-R207 PolarHBondContact O-N 3.42Å
204	F	86.9	Confident	87.5	Confident	48 Å²	48	71.2 Å²	71.2	21%	0.211	35%	0.353	C	S	.	.	H	α-helix	trans	-66.3	-33.6	179.1	-63.5	-32.9	0	0	0	112.2	I167 V172 K200 R208	I167-F204 WeakPolarHBondContact O-CE2 3.44Å; V172-F204 HydrophobicContact CG1-CB 3.3Å; V172-F204 HydrophobicContact CG1-CG 4.44Å; K200-F204 HydrophobicContact CB-CE2 4.17Å; K200-F204 WeakPolarHBondContact O-CB 3.36Å; K200-F204 WeakPolarHBondContact O-CD2 3.36Å; K200-F204 WeakPolarHBondContact O-CG 3.16Å; K200-F204 PolarHBondContact O-N 3.33Å; F204-R208 WeakPolarHBondContact O-CB 3.41Å; F204-R208 PolarHBondContact O-N 3.2Å
205	M	87.8	Confident	87.3	Confident	54 Å²	54	71.1 Å²	71.1	27%	0.266	35%	0.353	S	S	.	.	H	α-helix	trans	-65.2	-51.1	174	-86.2	-165.5	77	0	0	111.2	V172 P185 Y201 E202 E203 R207 R208 W209	V172-M205 HydrophobicContact CB-CG 3.81Å; V172-M205 HydrophobicContact CG1-CG 4.08Å; V172-M205 HydrophobicContact CG2-CG 4.4Å; P185-M205 HydrophobicContact CG-SD 4.45Å; Y201-M205 HydrophobicContact CD1-CG 4.47Å; Y201-M205 HydrophobicContact CD1-SD 4.09Å; Y201-M205 HydrophobicContact CE1-CG 4.07Å; Y201-M205 HydrophobicContact CE1-SD 3.31Å; Y201-M205 WeakPolarHBondContact CE1-SD 3.15Å; Y201-M205 HydrophobicContact CE2-CG 4.25Å; Y201-M205 HydrophobicContact CE2-SD 4.33Å; Y201-M205 WeakPolarHBondContact O-CB 3.41Å; Y201-M205 WeakPolarHBondContact O-CG 3.36Å; Y201-M205 PolarHBondContact O-N 3.29Å; Y201-M205 PolarHBondContact OH-SD 3Å; Y201-M205 VanDerWaalsContact OH-SD 3.4Å; E202-M205 PolarHBondContact O-N 3.48Å; E203-M205 VanDerWaalsContact C-N 3.33Å; E203-M205 PolarHBondContact O-N 3.27Å; M205-R207 VanDerWaalsContact C-N 3.31Å; M205-R207 PolarHBondContact O-N 2.87Å; M205-R208 PolarHBondContact O-N 3.44Å; M205-W209 PolarHBondContact O-N 3.1Å
206	L	87.2	Confident	87.2	Confident	108 Å²	108	65.3 Å²	65.3	57%	0.565	32%	0.322	S	S	*	.	H	α-helix	trans	-59.4	-44.6	177.5	177.7	61	0	0	0	110.4	E202 E203 R208 W209 L210	E202-L206 WeakPolarHBondContact O-CB 3.39Å; E202-L206 PolarHBondContact O-N 2.96Å; E203-L206 PolarHBondContact O-N 3Å; L206-R208 VanDerWaalsContact C-N 3.34Å; L206-R208 PolarHBondContact O-N 2.92Å; L206-W209 PolarHBondContact O-N 2.84Å; L206-L210 HydrophobicContact CD1-CD1 3.85Å; L206-L210 HydrophobicContact CD1-CG 4.01Å; L206-L210 HydrophobicContact CG-CD1 3.86Å; L206-L210 HydrophobicContact CG-CG 4.39Å; L206-L210 WeakPolarHBondContact O-CB 3.46Å; L206-L210 WeakPolarHBondContact O-CG 3.28Å; L206-L210 PolarHBondContact O-N 3.46Å
207	R	84.8	Confident	86.9	Confident	89 Å²	89	62.2 Å²	62.2	34%	0.336	30%	0.301	S	S	.	.	H	α-helix	trans	-58.8	-43.5	175.8	-174.7	166.6	-167.8	164.4	1.6	112	E203 M205 V211 W218	E203-R207 WeakPolarHBondContact O-CB 3.21Å; E203-R207 PolarHBondContact O-N 3.42Å; M205-R207 VanDerWaalsContact C-N 3.31Å; M205-R207 PolarHBondContact O-N 2.87Å; R207-V211 WeakPolarHBondContact O-CB 3.23Å; R207-V211 WeakPolarHBondContact O-CG2 3.45Å; R207-V211 PolarHBondContact O-N 2.98Å; R207-W218 HydrophobicContact CB-CH2 3.96Å; R207-W218 HydrophobicContact CB-CZ2 4.1Å; R207-W218 HydrophobicContact CG-CH2 3.69Å; R207-W218 HydrophobicContact CG-CZ2 3.72Å; R207-W218 HydrophobicContact CG-CZ3 4.31Å
208	R	82.1	Confident	86.8	Confident	53 Å²	53	63.3 Å²	63.3	20%	0.2	30%	0.303	C	S	.	.	H	α-helix	trans	-65.5	-41	177.4	-174.5	172.4	-174.9	136.9	-8	112.6	V172 N173 F204 M205 L206 A212	V172-R208 HydrophobicContact CG2-CB 4.18Å; V172-R208 VanDerWaalsContact CG2-CD 3.41Å; V172-R208 HydrophobicContact CG2-CG 4.46Å; N173-R208 PolarHBondContact ND2-NH2 3.29Å; F204-R208 WeakPolarHBondContact O-CB 3.41Å; F204-R208 PolarHBondContact O-N 3.2Å; M205-R208 PolarHBondContact O-N 3.44Å; L206-R208 VanDerWaalsContact C-N 3.34Å; L206-R208 PolarHBondContact O-N 2.92Å; R208-A212 PolarHBondContact O-N 3.2Å
209	W	84.6	Confident	86.7	Confident	195 Å²	195	63.7 Å²	63.7	74%	0.739	31%	0.306	S	S	*	.	H	α-helix	trans	-62.6	-54.2	173.9	-95.5	98.3	0	0	0	111.9	M205 L206 V211 A212 D213	M205-W209 PolarHBondContact O-N 3.1Å; L206-W209 PolarHBondContact O-N 2.84Å; W209-V211 PolarHBondContact O-N 2.78Å; W209-A212 WeakPolarHBondContact O-CB 3.45Å; W209-A212 PolarHBondContact O-N 2.86Å; W209-D213 PolarHBondContact O-N 2.77Å
210	L	87.1	Confident	86.6	Confident	38 Å²	38	59.3 Å²	59.3	20%	0.199	29%	0.289	C	S	.	.	H	α-helix	trans	-63.3	-22.5	179.4	-74	177.5	0	0	0	113.4	L206 A212 C216 W218 I229	L206-L210 HydrophobicContact CD1-CD1 3.85Å; L206-L210 HydrophobicContact CD1-CG 4.01Å; L206-L210 HydrophobicContact CG-CD1 3.86Å; L206-L210 HydrophobicContact CG-CG 4.39Å; L206-L210 WeakPolarHBondContact O-CB 3.46Å; L206-L210 WeakPolarHBondContact O-CG 3.28Å; L206-L210 PolarHBondContact O-N 3.46Å; L210-A212 VanDerWaalsContact C-N 3.35Å; L210-C216 WeakPolarHBondContact O-CB 3.27Å; L210-C216 PolarHBondContact O-SG 2.92Å; L210-W218 HydrophobicContact CB-CZ2 3.78Å; L210-W218 HydrophobicContact CD1-CH2 4.41Å; L210-W218 HydrophobicContact CD1-CZ2 4.08Å; L210-I229 HydrophobicContact CD2-CD1 4.16Å
211	V	81.5	Confident	86.5	Confident	14 Å²	14	56 Å²	56	9%	0.085	28%	0.278	C	S	.	.	H	α-helix	trans	-77.7	-18.4	171.8	167.1	0	0	0	0	112.9	R207 W209 W218 R303 C304 C324	R207-V211 WeakPolarHBondContact O-CB 3.23Å; R207-V211 WeakPolarHBondContact O-CG2 3.45Å; R207-V211 PolarHBondContact O-N 2.98Å; W209-V211 PolarHBondContact O-N 2.78Å; V211-W218 VanDerWaalsContact CG2-NE1 3.31Å; V211-R303 HydrophobicContact CG1-CG 3.77Å; V211-R303 WeakPolarHBondContact O-CD 3.37Å; V211-C304 HydrophobicContact CG1-CB 3.85Å; V211-C304 HydrophobicContact CG2-CB 4.49Å; V211-C324 HydrophobicContact CB-CB 4.27Å; V211-C324 HydrophobicContact CG1-CB 3.49Å; V211-C324 VanDerWaalsContact CG1-CB 3.49Å
212	A	79.8	Confident	86.1	Confident	57 Å²	57	61 Å²	61	47%	0.471	31%	0.312	S	S	.	.	H	α-helix	trans	-84.9	-19.2	173.8	0	0	0	0	0	113.4	R208 W209 L210	R208-A212 PolarHBondContact O-N 3.2Å; W209-A212 WeakPolarHBondContact O-CB 3.45Å; W209-A212 PolarHBondContact O-N 2.86Å; L210-A212 VanDerWaalsContact C-N 3.35Å
213	D	84.8	Confident	85.6	Confident	54 Å²	54	64.5 Å²	64.5	29%	0.289	33%	0.333	S	S	.	.			trans	-68.9	131	176.8	-177.1	-58.2	0	0	0	111.6	W209 D215 C216	W209-D213 PolarHBondContact O-N 2.77Å; D213-D215 WeakPolarHBondContact OD1-CA 3.26Å; D213-D215 PolarHBondContact OD1-N 3.14Å; D213-C216 HydrophobicContact CB-CB 3.71Å; D213-C216 PolarHBondContact OD1-N 2.79Å
214	P	81	Confident	85.6	Confident	97 Å²	97	61 Å²	61	63%	0.63	32%	0.318	S	S	*	.	S	Bend	trans	-77.3	-17	-175.9	32.6	-36.6	0	0	0	114.6	R217	P214-R217 PolarHBondContact O-NH1 3.35Å; P214-R217 PolarHBondContact O-NH2 2.8Å
215	D	85.8	Confident	85.4	Confident	44 Å²	44	60.2 Å²	60.2	24%	0.235	32%	0.324	C	S	.	.	S	Bend	trans	-105.5	-16.8	-178.2	-69.7	-13.1	0	0	0	112.1	D213 I229 A230 F231 Y252	D213-D215 WeakPolarHBondContact OD1-CA 3.26Å; D213-D215 PolarHBondContact OD1-N 3.14Å; D215-I229 HydrophobicContact CB-CG2 4.27Å; D215-A230 PolarHBondContact O-N 3.46Å; D215-A230 VanDerWaalsContact O-N 3.14Å; D215-F231 HydrophobicContact CB-CD1 4.32Å; D215-F231 WeakPolarHBondContact OD2-CD1 3.47Å; D215-Y252 PolarHBondContact OD1-OH 3.46Å
216	C	88.6	Confident	85.5	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.014	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	133.6	172.5	-179.8	0	0	0	0	113.8	L210 D213 V228 I229	L210-C216 WeakPolarHBondContact O-CB 3.27Å; L210-C216 PolarHBondContact O-SG 2.92Å; D213-C216 HydrophobicContact CB-CB 3.71Å; D213-C216 PolarHBondContact OD1-N 2.79Å; C216-V228 CarbonylContact C-O 3.55Å; C216-I229 HydrophobicContact CB-CG1 4.28Å
217	R	87.6	Confident	85.6	Confident	21 Å²	21	58.2 Å²	58.2	8%	0.079	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	116.8	179.8	-58.1	-68.2	175.8	-87.1	-11.1	110.7	P214 A227 V228 L239 F250 Y252	P214-R217 PolarHBondContact O-NH1 3.35Å; P214-R217 PolarHBondContact O-NH2 2.8Å; R217-A227 WeakPolarHBondContact O-CA 3.39Å; R217-V228 PolarHBondContact N-O 2.85Å; R217-V228 PolarHBondContact O-N 3.19Å; R217-L239 HydrophobicContact CB-CD1 3.77Å; R217-L239 HydrophobicContact CG-CD1 3.74Å; R217-F250 HydrophobicContact CB-CE2 3.74Å; R217-Y252 WeakPolarHBondContact CD-O 3.48Å; R217-Y252 HydrophobicContact CG-CD2 3.92Å; R217-Y252 HydrophobicContact CG-CE2 4.2Å; R217-Y252 PolarHBondContact NE-O 3.42Å; R217-Y252 VanDerWaalsContact NH2-CE2 3.27Å; R217-Y252 PolarHBondContact NH2-OH 3.46Å; R217-Y252 VanDerWaalsContact NH2-OH 3.16Å
218	W	88.6	Confident	85.8	Confident	52 Å²	52	55.5 Å²	55.5	20%	0.197	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	143	174.2	-68.9	81.1	0	0	0	111.3	R207 L210 V211 A227	R207-W218 HydrophobicContact CB-CH2 3.96Å; R207-W218 HydrophobicContact CB-CZ2 4.1Å; R207-W218 HydrophobicContact CG-CH2 3.69Å; R207-W218 HydrophobicContact CG-CZ2 3.72Å; R207-W218 HydrophobicContact CG-CZ3 4.31Å; L210-W218 HydrophobicContact CB-CZ2 3.78Å; L210-W218 HydrophobicContact CD1-CH2 4.41Å; L210-W218 HydrophobicContact CD1-CZ2 4.08Å; V211-W218 VanDerWaalsContact CG2-NE1 3.31Å; W218-A227 HydrophobicContact CD2-CB 4.01Å; W218-A227 HydrophobicContact CE3-CB 4.16Å; W218-A227 HydrophobicContact CG-CB 4.48Å; W218-A227 HydrophobicContact CH2-CB 4.37Å; W218-A227 HydrophobicContact CZ2-CB 4.21Å; W218-A227 HydrophobicContact CZ3-CB 4.34Å
219	C	90.4	Very high	86.1	Confident	11 Å²	11	56.6 Å²	56.6	7%	0.074	32%	0.315	C	S	.	.			trans	-62.8	133.4	170.6	-169.8	0	0	0	0	110.1	A221 C224 Y226 C241 F250	C219-A221 VanDerWaalsContact C-N 3.29Å; C219-C224 HydrophobicContact CB-CB 4.14Å; C219-Y226 WeakPolarHBondContact CB-O 3.23Å; C219-Y226 PolarHBondContact N-O 2.78Å; C219-C241 HydrophobicContact CB-CB 4.45Å; C219-F250 HydrophobicContact CB-CE1 4.42Å
220	P	88.7	Confident	86	Confident	42 Å²	42	47.6 Å²	47.6	27%	0.273	28%	0.282	S	S	.	.			trans	-86.5	5	177.5	35.8	-36.8	0	0	0	113.5	T248 F250 I257	P220-T248 HydrophobicContact CG-CG2 4.4Å; P220-F250 HydrophobicContact CG-CB 3.61Å; P220-F250 HydrophobicContact CG-CG 4.19Å; P220-I257 HydrophobicContact CG-CG1 4.19Å
221	A	87.9	Confident	85.6	Confident	21 Å²	21	53 Å²	53	17%	0.174	30%	0.304	C	S	.	.	S	Bend	trans	-68.9	145.5	174.6	0	0	0	0	0	110.8	C219 C224 T248	C219-A221 VanDerWaalsContact C-N 3.29Å; A221-C224 HydrophobicContact CB-CB 3.83Å; A221-C224 PolarHBondContact O-N 3.13Å; A221-T248 HydrophobicContact CB-CG2 4.11Å
222	P	83.6	Confident	84.8	Confident	113 Å²	113	55.7 Å²	55.7	73%	0.734	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	143	170.2	27.1	-34.7	0	0	0	110	C224	P222-C224 PolarHBondContact O-N 3.34Å
223	D	81.7	Confident	83.8	Confident	153 Å²	153	54.3 Å²	54.3	82%	0.818	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	4	174.8	-45.5	-46.4	0	0	0	116.3	G225	D223-G225 PolarHBondContact O-N 3.09Å
224	C	87.1	Confident	82.6	Confident	14 Å²	14	56 Å²	56	10%	0.095	34%	0.342	C	S	.	.			trans	-88.8	89.2	177.9	-170.5	0	0	0	0	111.9	C219 A221 P222 Y226 C246	C219-C224 HydrophobicContact CB-CB 4.14Å; A221-C224 HydrophobicContact CB-CB 3.83Å; A221-C224 PolarHBondContact O-N 3.13Å; P222-C224 PolarHBondContact O-N 3.34Å; C224-Y226 PolarHBondContact O-N 2.65Å; C224-C246 PolarHBondContact SG-SG 2.8Å
225	G	82.4	Confident	81.6	Confident	33 Å²	33	56.3 Å²	56.3	34%	0.34	35%	0.347	S	S	.	.			trans	-70	30.8	170.6	0	0	0	0	0	115.1	D223	D223-G225 PolarHBondContact O-N 3.09Å
226	Y	89.8	Confident	80.5	Confident	94 Å²	94	57.2 Å²	57.2	37%	0.369	36%	0.356	S	S	.	.			trans	-97.8	140.9	178.8	-161.3	-89.8	0	0	0	111.4	C219 C224 V228 R243	C219-Y226 WeakPolarHBondContact CB-O 3.23Å; C219-Y226 PolarHBondContact N-O 2.78Å; C224-Y226 PolarHBondContact O-N 2.65Å; Y226-V228 HydrophobicContact CD1-CG2 4.17Å; Y226-V228 HydrophobicContact CE1-CG2 3.98Å; Y226-R243 HydrophobicContact CD2-CB 3.82Å; Y226-R243 HydrophobicContact CE2-CB 4.5Å; Y226-R243 HydrophobicContact CG-CB 3.97Å
227	A	89.8	Confident	80.1	Confident	26 Å²	26	59.4 Å²	59.4	22%	0.215	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	147.1	175.9	0	0	0	0	0	111.1	R217 W218	R217-A227 WeakPolarHBondContact O-CA 3.39Å; W218-A227 HydrophobicContact CD2-CB 4.01Å; W218-A227 HydrophobicContact CE3-CB 4.16Å; W218-A227 HydrophobicContact CG-CB 4.48Å; W218-A227 HydrophobicContact CH2-CB 4.37Å; W218-A227 HydrophobicContact CZ2-CB 4.21Å; W218-A227 HydrophobicContact CZ3-CB 4.34Å
228	V	89.3	Confident	80.2	Confident	31 Å²	31	62.4 Å²	62.4	19%	0.188	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.3	176.4	177.7	0	0	0	0	107.9	C216 R217 Y226 L239 F250	C216-V228 CarbonylContact C-O 3.55Å; R217-V228 PolarHBondContact N-O 2.85Å; R217-V228 PolarHBondContact O-N 3.19Å; Y226-V228 HydrophobicContact CD1-CG2 4.17Å; Y226-V228 HydrophobicContact CE1-CG2 3.98Å; V228-L239 HydrophobicContact CG1-CD1 4.35Å; V228-L239 HydrophobicContact CG1-CD2 4.39Å; V228-F250 HydrophobicContact CB-CZ 4.25Å; V228-F250 HydrophobicContact CG2-CZ 3.91Å
229	I	89.1	Confident	80.3	Confident	76 Å²	76	60.8 Å²	60.8	39%	0.39	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	121.7	173.2	-52.8	176.9	0	0	0	107.5	L210 D215 C216 F231	L210-I229 HydrophobicContact CD2-CD1 4.16Å; D215-I229 HydrophobicContact CB-CG2 4.27Å; C216-I229 HydrophobicContact CB-CG1 4.28Å; I229-F231 HydrophobicContact CG2-CD1 4.41Å; I229-F231 HydrophobicContact CG2-CD2 4.37Å; I229-F231 HydrophobicContact CG2-CE1 3.81Å; I229-F231 HydrophobicContact CG2-CE2 3.77Å; I229-F231 HydrophobicContact CG2-CZ 3.46Å; I229-F231 VanDerWaalsContact CG2-CZ 3.46Å
230	A	82.8	Confident	80.4	Confident	7 Å²	7	63.6 Å²	63.6	6%	0.058	40%	0.396	C	S	.	.			trans	-125.8	78.2	-166.6	0	0	0	0	0	112	D215 C233 L239 Y252	D215-A230 PolarHBondContact O-N 3.46Å; D215-A230 VanDerWaalsContact O-N 3.14Å; A230-C233 HydrophobicContact CB-CB 4.32Å; A230-L239 HydrophobicContact CB-CD1 4.29Å; A230-L239 HydrophobicContact CB-CD2 3.9Å; A230-Y252 HydrophobicContact CB-CD2 3.99Å; A230-Y252 HydrophobicContact CB-CE2 3.85Å
231	F	77.5	Confident	80.6	Confident	152 Å²	152	61.9 Å²	61.9	67%	0.667	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	133.1	-178.9	-58.2	-68.3	0	0	0	112.5	D215 I229 C233	D215-F231 HydrophobicContact CB-CD1 4.32Å; D215-F231 WeakPolarHBondContact OD2-CD1 3.47Å; I229-F231 HydrophobicContact CG2-CD1 4.41Å; I229-F231 HydrophobicContact CG2-CD2 4.37Å; I229-F231 HydrophobicContact CG2-CE1 3.81Å; I229-F231 HydrophobicContact CG2-CE2 3.77Å; I229-F231 HydrophobicContact CG2-CZ 3.46Å; I229-F231 VanDerWaalsContact CG2-CZ 3.46Å; F231-C233 PolarHBondContact O-N 3.15Å; F231-C233 VanDerWaalsContact O-N 3.09Å; F231-C233 PolarHBondContact O-SG 3.41Å
232	G	64.7	Low	80.7	Confident	69 Å²	69	63.3 Å²	63.3	71%	0.711	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	4.5	170.2	0	0	0	0	0	116.4	A234	G232-A234 PolarHBondContact O-N 2.66Å
233	C	59.7	Low	81.1	Confident	28 Å²	28	63.1 Å²	63.1	19%	0.189	39%	0.386	C	S	.	.			trans	-71.3	38.8	-171.8	-67.4	0	0	0	0	116.2	A230 F231 S235 C236	A230-C233 HydrophobicContact CB-CB 4.32Å; F231-C233 PolarHBondContact O-N 3.15Å; F231-C233 VanDerWaalsContact O-N 3.09Å; F231-C233 PolarHBondContact O-SG 3.41Å; C233-S235 PolarHBondContact O-N 3.36Å; C233-C236 HydrophobicContact CB-CB 4.11Å; C233-C236 PolarHBondContact O-N 3.43Å; C233-C236 VanDerWaalsContact O-N 3.13Å
234	A	58.6	Low	81.5	Confident	89 Å²	89	64.8 Å²	64.8	74%	0.736	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.2	172.7	0	0	0	0	0	113.2	G232	G232-A234 PolarHBondContact O-N 2.66Å
235	S	60.4	Low	81.6	Confident	104 Å²	104	68.6 Å²	68.6	73%	0.727	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-11.5	176.7	45.1	0	0	0	0	114.4	C233 P237	C233-S235 PolarHBondContact O-N 3.36Å; S235-P237 VanDerWaalsContact O-CD 3.27Å; S235-P237 WeakPolarHBondContact O-CD 3.24Å
236	C	62.5	Low	82.1	Confident	63 Å²	63	68.5 Å²	68.5	43%	0.426	42%	0.424	S	S	.	.			trans	-119.8	79.1	-173.8	-64.5	0	0	0	0	110.7	C233 K238	C233-C236 HydrophobicContact CB-CB 4.11Å; C233-C236 PolarHBondContact O-N 3.43Å; C233-C236 VanDerWaalsContact O-N 3.13Å; C236-K238 PolarHBondContact O-N 2.94Å
237	P	80.1	Confident	82.2	Confident	48 Å²	48	66.2 Å²	66.2	31%	0.312	43%	0.429	S	S	.	.			trans	-73.1	-7.2	-175.9	31.2	-37.6	0	0	0	113.9	S235 C251 Y252 W258	S235-P237 VanDerWaalsContact O-CD 3.27Å; S235-P237 WeakPolarHBondContact O-CD 3.24Å; P237-C251 CarbonylContact O-C 3.55Å; P237-C251 VanDerWaalsContact O-CA 3.23Å; P237-C251 WeakPolarHBondContact O-CA 3.35Å; P237-C251 PolarHBondContact O-SG 3.28Å; P237-C251 VanDerWaalsContact O-SG 3.35Å; P237-Y252 PolarHBondContact O-N 3.21Å; P237-W258 HydrophobicContact CB-CH2 4.48Å; P237-W258 HydrophobicContact CB-CZ3 4.24Å; P237-W258 HydrophobicContact CG-CH2 4.13Å; P237-W258 HydrophobicContact CG-CZ3 4.36Å; P237-W258 WeakPolarHBondContact O-CZ3 3.31Å
238	K	89.9	Confident	82.3	Confident	84 Å²	84	66.7 Å²	66.7	37%	0.365	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	130.1	-179.2	-178.1	-175	177.1	-178.2	0	110	C236 E249 W258	C236-K238 PolarHBondContact O-N 2.94Å; K238-E249 WeakPolarHBondContact CE-OE1 3.14Å; K238-E249 WeakPolarHBondContact CE-OE2 3.37Å; K238-E249 IonicContact NZ-OE1 3.85Å; K238-E249 PolarHBondContact NZ-OE1 2.95Å; K238-E249 IonicContact NZ-OE2 2.73Å; K238-E249 PolarHBondContact NZ-OE2 3.47Å; K238-W258 HydrophobicContact CB-CD2 3.97Å; K238-W258 HydrophobicContact CB-CE3 3.78Å; K238-W258 HydrophobicContact CB-CH2 3.94Å; K238-W258 HydrophobicContact CB-CZ2 4.1Å; K238-W258 HydrophobicContact CB-CZ3 3.77Å; K238-W258 HydrophobicContact CD-CD2 4.1Å; K238-W258 HydrophobicContact CD-CG 4.27Å; K238-W258 HydrophobicContact CD-CZ2 4.34Å; K238-W258 HydrophobicContact CG-CD2 3.74Å; K238-W258 HydrophobicContact CG-CE3 4Å; K238-W258 HydrophobicContact CG-CG 4.06Å; K238-W258 HydrophobicContact CG-CZ2 4.45Å; K238-W258 HydrophobicContact CG-CZ3 4.46Å
239	L	90.6	Very high	82.5	Confident	18 Å²	18	68.9 Å²	68.9	9%	0.094	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	156.3	170.6	-60.9	179.2	0	0	0	109.9	R217 V228 A230 E249 F250 Y252	R217-L239 HydrophobicContact CB-CD1 3.77Å; R217-L239 HydrophobicContact CG-CD1 3.74Å; V228-L239 HydrophobicContact CG1-CD1 4.35Å; V228-L239 HydrophobicContact CG1-CD2 4.39Å; A230-L239 HydrophobicContact CB-CD1 4.29Å; A230-L239 HydrophobicContact CB-CD2 3.9Å; L239-E249 CarbonylContact O-C 3.54Å; L239-E249 VanDerWaalsContact O-CA 3.31Å; L239-E249 WeakPolarHBondContact O-CA 3.25Å; L239-F250 HydrophobicContact CB-CD2 3.99Å; L239-F250 HydrophobicContact CB-CE1 4.27Å; L239-F250 HydrophobicContact CB-CE2 3.71Å; L239-F250 HydrophobicContact CB-CG 4.39Å; L239-F250 HydrophobicContact CB-CZ 3.86Å; L239-F250 HydrophobicContact CD1-CD2 4.11Å; L239-F250 HydrophobicContact CD1-CE2 3.5Å; L239-F250 HydrophobicContact CD1-CZ 4.17Å; L239-F250 HydrophobicContact CG-CE2 4.25Å; L239-F250 PolarHBondContact N-O 3.49Å; L239-F250 PolarHBondContact O-N 2.8Å; L239-Y252 HydrophobicContact CD1-CD2 4.11Å
240	T	91.7	Very high	82.7	Confident	70 Å²	70	65.2 Å²	65.2	43%	0.429	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.8	173.8	-58.7	0	0	0	0	109.1	G242	T240-G242 PolarHBondContact O-N 3.19Å
241	C	93.1	Very high	83	Confident	6 Å²	6	65 Å²	65	4%	0.041	42%	0.417	C	S	.	.			trans	-71.4	123.8	178	-170.8	0	0	0	0	111.3	C219 R243 C246 T248 F250	C219-C241 HydrophobicContact CB-CB 4.45Å; C241-R243 VanDerWaalsContact C-N 3.29Å; C241-R243 PolarHBondContact O-N 2.72Å; C241-C246 HydrophobicContact CB-CB 4.44Å; C241-T248 WeakPolarHBondContact CB-O 3.46Å; C241-T248 PolarHBondContact N-O 2.67Å; C241-F250 HydrophobicContact CB-CE1 4.24Å
242	G	90.1	Very high	83.5	Confident	51 Å²	51	59 Å²	59	53%	0.526	39%	0.39	S	S	.	.			trans	-77	-6.8	177.2	0	0	0	0	0	115.2	T240 E244	T240-G242 PolarHBondContact O-N 3.19Å; G242-E244 PolarHBondContact O-N 2.88Å
243	R	91.5	Very high	84.5	Confident	109 Å²	109	60.9 Å²	60.9	41%	0.411	38%	0.381	S	S	.	.	S	Bend	trans	-67	125.5	174.9	-177.4	-173.6	-70.7	-118.2	-4.3	109.9	Y226 C241 C246	Y226-R243 HydrophobicContact CD2-CB 3.82Å; Y226-R243 HydrophobicContact CE2-CB 4.5Å; Y226-R243 HydrophobicContact CG-CB 3.97Å; C241-R243 VanDerWaalsContact C-N 3.29Å; C241-R243 PolarHBondContact O-N 2.72Å; R243-C246 HydrophobicContact CB-CB 3.94Å; R243-C246 HydrophobicContact CG-CB 4.25Å; R243-C246 WeakPolarHBondContact O-CB 3.33Å; R243-C246 PolarHBondContact O-N 3.31Å
244	E	91.1	Very high	85.6	Confident	188 Å²	188	61.1 Å²	61.1	88%	0.879	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	139.6	172.6	-59.5	-168.3	153.5	0	0	111.7	G242 C246	G242-E244 PolarHBondContact O-N 2.88Å; E244-C246 PolarHBondContact O-N 2.85Å
245	G	89.8	Confident	87	Confident	95 Å²	95	60.6 Å²	60.6	98%	0.979	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	-12.6	-176.3	0	0	0	0	0	116.2
246	C	93.1	Very high	88.3	Confident	30 Å²	30	58.6 Å²	58.6	20%	0.203	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-51.5	179.3	-177.6	0	0	0	0	112.9	C224 C241 R243 E244 T248	C224-C246 PolarHBondContact SG-SG 2.8Å; C241-C246 HydrophobicContact CB-CB 4.44Å; R243-C246 HydrophobicContact CB-CB 3.94Å; R243-C246 HydrophobicContact CG-CB 4.25Å; R243-C246 WeakPolarHBondContact O-CB 3.33Å; R243-C246 PolarHBondContact O-N 3.31Å; E244-C246 PolarHBondContact O-N 2.85Å; C246-T248 PolarHBondContact O-N 3.27Å; C246-T248 PolarHBondContact O-OG1 2.68Å; C246-T248 VanDerWaalsContact O-OG1 3.07Å
247	G	90	Very high	89.6	Confident	46 Å²	46	61 Å²	61	47%	0.474	35%	0.35	S	S	.	.			trans	54.2	6.2	175.2	0	0	0	0	0	117.3	E249	G247-E249 PolarHBondContact O-N 3.28Å
248	T	93.6	Very high	90.2	Very high	37 Å²	37	62 Å²	62	23%	0.227	35%	0.347	C	S	.	.			trans	-73.1	131.8	-163.6	-70.2	0	0	0	0	111.6	P220 A221 C241 C246 F250	P220-T248 HydrophobicContact CG-CG2 4.4Å; A221-T248 HydrophobicContact CB-CG2 4.11Å; C241-T248 WeakPolarHBondContact CB-O 3.46Å; C241-T248 PolarHBondContact N-O 2.67Å; C246-T248 PolarHBondContact O-N 3.27Å; C246-T248 PolarHBondContact O-OG1 2.68Å; C246-T248 VanDerWaalsContact O-OG1 3.07Å; T248-F250 WeakPolarHBondContact O-CD1 3.26Å
249	E	93.4	Very high	90.2	Very high	76 Å²	76	58.9 Å²	58.9	36%	0.355	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	135.3	-179.1	-49.3	-166.7	139.2	0	0	111.4	K238 L239 G247 W258	K238-E249 WeakPolarHBondContact CE-OE1 3.14Å; K238-E249 WeakPolarHBondContact CE-OE2 3.37Å; K238-E249 IonicContact NZ-OE1 3.85Å; K238-E249 PolarHBondContact NZ-OE1 2.95Å; K238-E249 IonicContact NZ-OE2 2.73Å; K238-E249 PolarHBondContact NZ-OE2 3.47Å; L239-E249 CarbonylContact O-C 3.54Å; L239-E249 VanDerWaalsContact O-CA 3.31Å; L239-E249 WeakPolarHBondContact O-CA 3.25Å; G247-E249 PolarHBondContact O-N 3.28Å; E249-W258 HydrophobicContact CB-CB 3.75Å; E249-W258 HydrophobicContact CB-CG 4.41Å; E249-W258 PolarHBondContact O-N 3.5Å
250	F	92.4	Very high	90	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	155.7	-176	56.8	-84.1	0	0	0	113.4	R217 C219 P220 V228 L239 C241 T248 Q256	R217-F250 HydrophobicContact CB-CE2 3.74Å; C219-F250 HydrophobicContact CB-CE1 4.42Å; P220-F250 HydrophobicContact CG-CB 3.61Å; P220-F250 HydrophobicContact CG-CG 4.19Å; V228-F250 HydrophobicContact CB-CZ 4.25Å; V228-F250 HydrophobicContact CG2-CZ 3.91Å; L239-F250 HydrophobicContact CB-CD2 3.99Å; L239-F250 HydrophobicContact CB-CE1 4.27Å; L239-F250 HydrophobicContact CB-CE2 3.71Å; L239-F250 HydrophobicContact CB-CG 4.39Å; L239-F250 HydrophobicContact CB-CZ 3.86Å; L239-F250 HydrophobicContact CD1-CD2 4.11Å; L239-F250 HydrophobicContact CD1-CE2 3.5Å; L239-F250 HydrophobicContact CD1-CZ 4.17Å; L239-F250 HydrophobicContact CG-CE2 4.25Å; L239-F250 PolarHBondContact N-O 3.49Å; L239-F250 PolarHBondContact O-N 2.8Å; C241-F250 HydrophobicContact CB-CE1 4.24Å; T248-F250 WeakPolarHBondContact O-CD1 3.26Å; F250-Q256 CarbonylContact C-O 3.58Å; F250-Q256 VanDerWaalsContact CA-O 3.23Å; F250-Q256 WeakPolarHBondContact CA-O 3.39Å; F250-Q256 VanDerWaalsContact CB-O 3.28Å; F250-Q256 WeakPolarHBondContact CB-O 3.38Å
251	C	89.9	Confident	89.8	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.014	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	129.6	-177.4	-178.8	0	0	0	0	112.3	P237 H253 K255 Q256 W258	P237-C251 CarbonylContact O-C 3.55Å; P237-C251 VanDerWaalsContact O-CA 3.23Å; P237-C251 WeakPolarHBondContact O-CA 3.35Å; P237-C251 PolarHBondContact O-SG 3.28Å; P237-C251 VanDerWaalsContact O-SG 3.35Å; C251-H253 VanDerWaalsContact C-N 3.29Å; C251-H253 PolarHBondContact O-N 3.01Å; C251-H253 PolarHBondContact SG-N 3.43Å; C251-K255 WeakPolarHBondContact O-CA 3.31Å; C251-K255 PolarHBondContact O-N 3.37Å; C251-Q256 PolarHBondContact N-O 3.45Å; C251-W258 HydrophobicContact CB-CE3 4.12Å; C251-W258 HydrophobicContact CB-CZ3 4.42Å
252	Y	87.8	Confident	89.5	Confident	25 Å²	25	69.9 Å²	69.9	10%	0.098	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-39.1	176.1	178.4	-108.4	0	0	0	113.1	D215 R217 A230 P237 L239	D215-Y252 PolarHBondContact OD1-OH 3.46Å; R217-Y252 WeakPolarHBondContact CD-O 3.48Å; R217-Y252 HydrophobicContact CG-CD2 3.92Å; R217-Y252 HydrophobicContact CG-CE2 4.2Å; R217-Y252 PolarHBondContact NE-O 3.42Å; R217-Y252 VanDerWaalsContact NH2-CE2 3.27Å; R217-Y252 PolarHBondContact NH2-OH 3.46Å; R217-Y252 VanDerWaalsContact NH2-OH 3.16Å; A230-Y252 HydrophobicContact CB-CD2 3.99Å; A230-Y252 HydrophobicContact CB-CE2 3.85Å; P237-Y252 PolarHBondContact O-N 3.21Å; L239-Y252 HydrophobicContact CD1-CD2 4.11Å
253	H	85.3	Confident	89.4	Confident	110 Å²	110	72.1 Å²	72.1	51%	0.509	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-47.1	-174.4	-60.6	-67.4	0	0	0	113.5	C251	C251-H253 VanDerWaalsContact C-N 3.29Å; C251-H253 PolarHBondContact O-N 3.01Å; C251-H253 PolarHBondContact SG-N 3.43Å
254	C	83.6	Confident	89.2	Confident	32 Å²	32	68.5 Å²	68.5	22%	0.216	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-8.1	-175.3	78.2	0	0	0	0	114.5	Q256 H259 C264	C254-Q256 WeakPolarHBondContact O-CG 3.3Å; C254-Q256 PolarHBondContact O-N 3.46Å; C254-H259 PolarHBondContact SG-NE2 2.8Å; C254-C264 HydrophobicContact CB-CB 3.94Å
255	K	86.8	Confident	88.9	Confident	78 Å²	78	63.6 Å²	63.6	34%	0.339	37%	0.366	S	S	.	.			trans	60	36.8	-179	-44.6	-170.1	-176.3	-174.5	0	114.1	C251	C251-K255 WeakPolarHBondContact O-CA 3.31Å; C251-K255 PolarHBondContact O-N 3.37Å
256	Q	87.6	Confident	88.6	Confident	62 Å²	62	60.8 Å²	60.8	29%	0.29	33%	0.333	S	S	.	.	S	Bend	trans	-139.7	168.7	-174.5	-59.7	-75.6	-77.8	0	0	111	F250 C251 C254 W258	F250-Q256 CarbonylContact C-O 3.58Å; F250-Q256 VanDerWaalsContact CA-O 3.23Å; F250-Q256 WeakPolarHBondContact CA-O 3.39Å; F250-Q256 VanDerWaalsContact CB-O 3.28Å; F250-Q256 WeakPolarHBondContact CB-O 3.38Å; C251-Q256 PolarHBondContact N-O 3.45Å; C254-Q256 WeakPolarHBondContact O-CG 3.3Å; C254-Q256 PolarHBondContact O-N 3.46Å; Q256-W258 PolarHBondContact O-N 2.79Å
257	I	90.3	Very high	88.3	Confident	114 Å²	114	59.4 Å²	59.4	59%	0.585	33%	0.325	S	S	*	.	B	Isolated β-bridge	trans	-45.3	136.5	-180	-57.7	173.5	0	0	0	111.2	P220 H259	P220-I257 HydrophobicContact CG-CG1 4.19Å; I257-H259 PolarHBondContact O-N 2.91Å
258	W	92.6	Very high	88	Confident	68 Å²	68	63.6 Å²	63.6	26%	0.258	33%	0.326	S	S	.	.			trans	-57.9	128.8	-173.9	175.2	-120.9	0	0	0	112	P237 K238 E249 C251 Q256 P260	P237-W258 HydrophobicContact CB-CH2 4.48Å; P237-W258 HydrophobicContact CB-CZ3 4.24Å; P237-W258 HydrophobicContact CG-CH2 4.13Å; P237-W258 HydrophobicContact CG-CZ3 4.36Å; P237-W258 WeakPolarHBondContact O-CZ3 3.31Å; K238-W258 HydrophobicContact CB-CD2 3.97Å; K238-W258 HydrophobicContact CB-CE3 3.78Å; K238-W258 HydrophobicContact CB-CH2 3.94Å; K238-W258 HydrophobicContact CB-CZ2 4.1Å; K238-W258 HydrophobicContact CB-CZ3 3.77Å; K238-W258 HydrophobicContact CD-CD2 4.1Å; K238-W258 HydrophobicContact CD-CG 4.27Å; K238-W258 HydrophobicContact CD-CZ2 4.34Å; K238-W258 HydrophobicContact CG-CD2 3.74Å; K238-W258 HydrophobicContact CG-CE3 4Å; K238-W258 HydrophobicContact CG-CG 4.06Å; K238-W258 HydrophobicContact CG-CZ2 4.45Å; K238-W258 HydrophobicContact CG-CZ3 4.46Å; E249-W258 HydrophobicContact CB-CB 3.75Å; E249-W258 HydrophobicContact CB-CG 4.41Å; E249-W258 PolarHBondContact O-N 3.5Å; C251-W258 HydrophobicContact CB-CE3 4.12Å; C251-W258 HydrophobicContact CB-CZ3 4.42Å; Q256-W258 PolarHBondContact O-N 2.79Å; W258-P260 WeakPolarHBondContact O-CD 3.38Å
259	H	89.1	Confident	87.4	Confident	19 Å²	19	67.3 Å²	67.3	9%	0.088	34%	0.341	C	S	.	.			trans	-120.2	84	-176	52.1	74.2	0	0	0	110.5	C254 I257 Q262 A267	C254-H259 PolarHBondContact SG-NE2 2.8Å; I257-H259 PolarHBondContact O-N 2.91Å; H259-Q262 HydrophobicContact CB-CB 4.36Å; H259-Q262 PolarHBondContact ND1-O 2.72Å; H259-Q262 VanDerWaalsContact ND1-O 3.07Å; H259-A267 HydrophobicContact CB-CB 3.69Å; H259-A267 VanDerWaalsContact CG-CB 3.43Å
260	P	88.1	Confident	86.9	Confident	72 Å²	72	68.7 Å²	68.7	47%	0.468	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	146.2	179.7	26.4	-34.4	0	0	0	110.9	W258 Q262	W258-P260 WeakPolarHBondContact O-CD 3.38Å; P260-Q262 PolarHBondContact O-N 2.81Å
261	N	87	Confident	86.3	Confident	180 Å²	180	72.6 Å²	72.6	96%	0.963	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	11	175.9	-50.6	-27.4	0	0	0	115.8
262	Q	86.8	Confident	85.6	Confident	74 Å²	74	74.6 Å²	74.6	35%	0.346	38%	0.378	S	S	.	.	S	Bend	trans	-120.8	146.5	177.3	-69.7	-158.3	50.3	0	0	112.5	H259 P260 A266 A267 E270	H259-Q262 HydrophobicContact CB-CB 4.36Å; H259-Q262 PolarHBondContact ND1-O 2.72Å; H259-Q262 VanDerWaalsContact ND1-O 3.07Å; P260-Q262 PolarHBondContact O-N 2.81Å; Q262-A266 HydrophobicContact CB-CB 4.5Å; Q262-A267 HydrophobicContact CB-CB 4.32Å; Q262-E270 PolarHBondContact NE2-OE2 3.16Å
263	T	87.6	Confident	84.8	Confident	97 Å²	97	78.8 Å²	78.8	60%	0.595	40%	0.399	S	S	*	.			trans	-72.5	155	167	68.4	0	0	0	0	110.8	D265 A266 A267	T263-D265 PolarHBondContact O-N 2.99Å; T263-D265 VanDerWaalsContact O-N 3.08Å; T263-A266 PolarHBondContact O-N 3.33Å; T263-A266 VanDerWaalsContact O-N 3.14Å; T263-A266 WeakPolarHBondContact OG1-CB 3.47Å; T263-A266 PolarHBondContact OG1-N 2.89Å; T263-A266 VanDerWaalsContact OG1-N 3.16Å; T263-A267 PolarHBondContact O-N 3.24Å
264	C	88.2	Confident	83.9	Confident	33 Å²	33	76.6 Å²	76.6	22%	0.223	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-24	175.3	-66.4	0	0	0	0	113.3	C254 R268	C254-C264 HydrophobicContact CB-CB 3.94Å; C264-R268 VanDerWaalsContact O-CB 3.27Å; C264-R268 WeakPolarHBondContact O-CB 3.49Å; C264-R268 PolarHBondContact O-N 3.07Å; C264-R268 PolarHBondContact O-NH1 3.48Å
265	D	84.1	Confident	82.8	Confident	85 Å²	85	80 Å²	80	46%	0.455	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-42.1	177	-74.4	-6.3	0	0	0	112.3	T263 R268 Q269	T263-D265 PolarHBondContact O-N 2.99Å; T263-D265 VanDerWaalsContact O-N 3.08Å; D265-R268 PolarHBondContact O-N 3.39Å; D265-R268 IonicContact OD1-CZ 3.68Å; D265-R268 IonicContact OD1-NH1 3.77Å; D265-R268 PolarHBondContact OD1-NH1 3.29Å; D265-R268 IonicContact OD1-NH2 3.41Å; D265-R268 PolarHBondContact OD1-NH2 3Å; D265-Q269 WeakPolarHBondContact O-CG 3.13Å; D265-Q269 PolarHBondContact O-N 2.78Å
266	A	84.3	Confident	81.4	Confident	36 Å²	36	84.8 Å²	84.8	30%	0.298	43%	0.428	S	S	.	.	H	α-helix	trans	-62	-51.3	173.9	0	0	0	0	0	110.8	Q262 T263 R268 Q269 E270	Q262-A266 HydrophobicContact CB-CB 4.5Å; T263-A266 PolarHBondContact O-N 3.33Å; T263-A266 VanDerWaalsContact O-N 3.14Å; T263-A266 WeakPolarHBondContact OG1-CB 3.47Å; T263-A266 PolarHBondContact OG1-N 2.89Å; T263-A266 VanDerWaalsContact OG1-N 3.16Å; A266-R268 PolarHBondContact O-N 2.78Å; A266-R268 VanDerWaalsContact O-N 3.14Å; A266-Q269 PolarHBondContact O-N 3.21Å; A266-E270 PolarHBondContact O-N 3.47Å
267	A	85.9	Confident	79.9	Confident	2 Å²	2	87.1 Å²	87.1	2%	0.017	44%	0.441	C	S	.	.	H	α-helix	trans	-64.9	-19.5	178.6	0	0	0	0	0	113.3	H259 Q262 T263 R271	H259-A267 HydrophobicContact CB-CB 3.69Å; H259-A267 VanDerWaalsContact CG-CB 3.43Å; Q262-A267 HydrophobicContact CB-CB 4.32Å; T263-A267 PolarHBondContact O-N 3.24Å; A267-R271 WeakPolarHBondContact O-CG 3.44Å; A267-R271 PolarHBondContact O-NE 3.26Å
268	R	83.9	Confident	78.1	Confident	133 Å²	133	90.7 Å²	90.7	50%	0.502	45%	0.447	S	S	.	.	H	α-helix	trans	-80.6	-40	170.1	-176.8	172.1	68.3	-100	4.3	111.8	C264 D265 A266 A272	C264-R268 VanDerWaalsContact O-CB 3.27Å; C264-R268 WeakPolarHBondContact O-CB 3.49Å; C264-R268 PolarHBondContact O-N 3.07Å; C264-R268 PolarHBondContact O-NH1 3.48Å; D265-R268 PolarHBondContact O-N 3.39Å; D265-R268 IonicContact OD1-CZ 3.68Å; D265-R268 IonicContact OD1-NH1 3.77Å; D265-R268 PolarHBondContact OD1-NH1 3.29Å; D265-R268 IonicContact OD1-NH2 3.41Å; D265-R268 PolarHBondContact OD1-NH2 3Å; A266-R268 PolarHBondContact O-N 2.78Å; A266-R268 VanDerWaalsContact O-N 3.14Å; R268-A272 WeakPolarHBondContact O-CB 3.48Å; R268-A272 PolarHBondContact O-N 3.4Å; R268-A272 VanDerWaalsContact O-N 3.08Å
269	Q	80.9	Confident	76.1	Confident	116 Å²	116	92 Å²	92	54%	0.542	46%	0.463	S	S	.	.	H	α-helix	trans	-66.1	-44.5	176.4	-71.6	175.6	50.2	0	0	111.9	D265 A266 R271 A272 Q273	D265-Q269 WeakPolarHBondContact O-CG 3.13Å; D265-Q269 PolarHBondContact O-N 2.78Å; A266-Q269 PolarHBondContact O-N 3.21Å; Q269-R271 VanDerWaalsContact C-N 3.34Å; Q269-R271 PolarHBondContact O-N 3.49Å; Q269-A272 PolarHBondContact O-N 3.06Å; Q269-Q273 WeakPolarHBondContact O-CG 3.23Å; Q269-Q273 PolarHBondContact O-N 2.83Å
270	E	83.7	Confident	74.3	Confident	105 Å²	105	96.4 Å²	96.4	49%	0.491	49%	0.486	S	S	.	.	H	α-helix	trans	-55.1	-48.2	176.7	-177.6	179.7	-164.3	0	0	111.6	Q262 A266 A272 Q273 S274	Q262-E270 PolarHBondContact NE2-OE2 3.16Å; A266-E270 PolarHBondContact O-N 3.47Å; E270-A272 PolarHBondContact O-N 3.27Å; E270-Q273 WeakPolarHBondContact O-CB 3.35Å; E270-Q273 PolarHBondContact O-N 3.01Å; E270-Q273 VanDerWaalsContact O-N 3.15Å; E270-S274 PolarHBondContact O-N 3.3Å
271	R	79.6	Confident	72.3	Confident	82 Å²	82	103.8 Å²	103.8	31%	0.309	51%	0.505	S	S	.	.	H	α-helix	trans	-70	-31.5	179	-68.3	-179.5	-67.8	141.7	-4.5	113.3	A267 Q269 Q273 S274 L275	A267-R271 WeakPolarHBondContact O-CG 3.44Å; A267-R271 PolarHBondContact O-NE 3.26Å; Q269-R271 VanDerWaalsContact C-N 3.34Å; Q269-R271 PolarHBondContact O-N 3.49Å; R271-Q273 VanDerWaalsContact C-N 3.32Å; R271-S274 PolarHBondContact O-OG 3.22Å; R271-L275 WeakPolarHBondContact O-CG 3.43Å; R271-L275 PolarHBondContact O-N 2.97Å; R271-L275 VanDerWaalsContact O-N 3.12Å
272	A	74.2	Confident	70.3	Confident	43 Å²	43	99 Å²	99	36%	0.355	49%	0.485	S	S	.	.	H	α-helix	trans	-67.4	-32.7	170.7	0	0	0	0	0	112.3	R268 Q269 E270 R276	R268-A272 WeakPolarHBondContact O-CB 3.48Å; R268-A272 PolarHBondContact O-N 3.4Å; R268-A272 VanDerWaalsContact O-N 3.08Å; Q269-A272 PolarHBondContact O-N 3.06Å; E270-A272 PolarHBondContact O-N 3.27Å; A272-R276 WeakPolarHBondContact O-CG 3.16Å; A272-R276 PolarHBondContact O-N 3.2Å
273	Q	71.8	Confident	68.3	Low	113 Å²	113	99.7 Å²	99.7	53%	0.528	50%	0.498	S	S	.	.	H	α-helix	trans	-72.7	-43.5	173.4	-67.8	174.3	31.4	0	0	111.7	Q269 E270 R271 L275 R276 L277	Q269-Q273 WeakPolarHBondContact O-CG 3.23Å; Q269-Q273 PolarHBondContact O-N 2.83Å; E270-Q273 WeakPolarHBondContact O-CB 3.35Å; E270-Q273 PolarHBondContact O-N 3.01Å; E270-Q273 VanDerWaalsContact O-N 3.15Å; R271-Q273 VanDerWaalsContact C-N 3.32Å; Q273-L275 VanDerWaalsContact C-N 3.35Å; Q273-L275 PolarHBondContact O-N 3.49Å; Q273-R276 PolarHBondContact O-N 2.89Å; Q273-L277 WeakPolarHBondContact O-CG 3.33Å; Q273-L277 PolarHBondContact O-N 2.84Å
274	S	65.2	Low	66.2	Low	65 Å²	65	100.8 Å²	100.8	46%	0.455	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-37.1	-179.8	73.2	0	0	0	0	112.7	E270 R271 L277 R278	E270-S274 PolarHBondContact O-N 3.3Å; R271-S274 PolarHBondContact O-OG 3.22Å; S274-L277 PolarHBondContact O-N 3.48Å; S274-R278 PolarHBondContact O-N 3.37Å
275	L	61.1	Low	64	Low	104 Å²	104	106 Å²	106	55%	0.545	53%	0.534	S	S	.	.	H	α-helix	trans	-61.6	-48.2	171.8	-72.7	170.7	0	0	0	112	R271 Q273 L277 R278 T279	R271-L275 WeakPolarHBondContact O-CG 3.43Å; R271-L275 PolarHBondContact O-N 2.97Å; R271-L275 VanDerWaalsContact O-N 3.12Å; Q273-L275 VanDerWaalsContact C-N 3.35Å; Q273-L275 PolarHBondContact O-N 3.49Å; L275-L277 VanDerWaalsContact C-N 3.34Å; L275-L277 PolarHBondContact O-N 3.19Å; L275-R278 WeakPolarHBondContact O-CB 3.32Å; L275-R278 PolarHBondContact O-N 3.32Å; L275-R278 VanDerWaalsContact O-N 3.11Å; L275-T279 PolarHBondContact O-N 3.38Å; L275-T279 PolarHBondContact O-OG1 2.97Å
276	R	58.2	Low	62	Low	178 Å²	178	107.9 Å²	107.9	67%	0.672	55%	0.554	S	S	*	*	H	α-helix	trans	-59.7	-42.7	176.2	-74.1	171.5	174.4	162.8	-2	112.4	A272 Q273 R278 T279 I280	A272-R276 WeakPolarHBondContact O-CG 3.16Å; A272-R276 PolarHBondContact O-N 3.2Å; Q273-R276 PolarHBondContact O-N 2.89Å; R276-R278 VanDerWaalsContact C-N 3.29Å; R276-R278 PolarHBondContact O-N 2.98Å; R276-T279 PolarHBondContact O-N 2.97Å; R276-I280 WeakPolarHBondContact O-CG1 3.36Å; R276-I280 PolarHBondContact O-N 3.25Å
277	L	54.6	Low	59.7	Low	110 Å²	110	116.2 Å²	116.2	58%	0.576	58%	0.579	S	S	*	*	H	α-helix	trans	-63.6	-34.7	175.7	-73.6	167.5	0	0	0	112.2	Q273 S274 L275 R281	Q273-L277 WeakPolarHBondContact O-CG 3.33Å; Q273-L277 PolarHBondContact O-N 2.84Å; S274-L277 PolarHBondContact O-N 3.48Å; L275-L277 VanDerWaalsContact C-N 3.34Å; L275-L277 PolarHBondContact O-N 3.19Å; L277-R281 PolarHBondContact O-N 2.05Å
278	R	52.7	Low	57.3	Low	189 Å²	189	119.9 Å²	119.9	71%	0.713	61%	0.605	S	S	*	*	H	α-helix	trans	-67.1	-46.6	174.1	-152	175.7	-165.3	176.2	4.2	111.2	S274 L275 R276 I280 R281 S282	S274-R278 PolarHBondContact O-N 3.37Å; L275-R278 WeakPolarHBondContact O-CB 3.32Å; L275-R278 PolarHBondContact O-N 3.32Å; L275-R278 VanDerWaalsContact O-N 3.11Å; R276-R278 VanDerWaalsContact C-N 3.29Å; R276-R278 PolarHBondContact O-N 2.98Å; R278-I280 VanDerWaalsContact C-N 3.32Å; R278-I280 PolarHBondContact O-N 2.95Å; R278-R281 PolarHBondContact O-N 3.17Å; R278-S282 PolarHBondContact O-N 3.38Å; R278-S282 PolarHBondContact O-OG 3.38Å
279	T	51	Low	55.1	Low	95 Å²	95	123.4 Å²	123.4	58%	0.583	63%	0.627	S	S	*	*	H	α-helix	trans	-56.2	-44.2	173.5	-52.5	0	0	0	0	112	L275 R276 S282	L275-T279 PolarHBondContact O-N 3.38Å; L275-T279 PolarHBondContact O-OG1 2.97Å; R276-T279 PolarHBondContact O-N 2.97Å; T279-S282 PolarHBondContact O-N 2.66Å
280	I	51	Low	53.1	Low	113 Å²	113	125.6 Å²	125.6	58%	0.579	64%	0.637	S	S	*	*	H	α-helix	trans	-64.2	-44.5	176.7	-68.2	166.1	0	0	0	111.1	R276 R278 S282 S283	R276-I280 WeakPolarHBondContact O-CG1 3.36Å; R276-I280 PolarHBondContact O-N 3.25Å; R278-I280 VanDerWaalsContact C-N 3.32Å; R278-I280 PolarHBondContact O-N 2.95Å; I280-S282 VanDerWaalsContact C-N 3.3Å; I280-S282 PolarHBondContact O-N 2.87Å; I280-S283 WeakPolarHBondContact O-CB 3.44Å; I280-S283 PolarHBondContact O-N 2.94Å; I280-S283 PolarHBondContact O-OG 2.85Å
281	R	47.3	Very low	51	Low	227 Å²	227	124.5 Å²	124.5	86%	0.857	64%	0.641	S	S	*	*	H	α-helix	trans	-68.5	-23	178.1	-107.6	-177	168.7	123.1	-2.6	114.6	L277 R278 S283	L277-R281 PolarHBondContact O-N 2.05Å; R278-R281 PolarHBondContact O-N 3.17Å; R281-S283 VanDerWaalsContact C-N 3.3Å
282	S	44	Very low	49.3	Very low	78 Å²	78	124.2 Å²	124.2	55%	0.545	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81	-2.9	175.1	-67.2	0	0	0	0	114.3	R278 T279 I280 S284	R278-S282 PolarHBondContact O-N 3.38Å; R278-S282 PolarHBondContact O-OG 3.38Å; T279-S282 PolarHBondContact O-N 2.66Å; I280-S282 VanDerWaalsContact C-N 3.3Å; I280-S282 PolarHBondContact O-N 2.87Å; S282-S284 PolarHBondContact O-N 3.11Å
283	S	45.1	Very low	47.8	Very low	89 Å²	89	124.1 Å²	124.1	62%	0.622	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	12.6	-175.8	65.7	0	0	0	0	115.8	I280 R281 I285	I280-S283 WeakPolarHBondContact O-CB 3.44Å; I280-S283 PolarHBondContact O-N 2.94Å; I280-S283 PolarHBondContact O-OG 2.85Å; R281-S283 VanDerWaalsContact C-N 3.3Å; S283-I285 PolarHBondContact O-N 2.97Å
284	S	43.2	Very low	46.6	Very low	120 Å²	120	122.8 Å²	122.8	84%	0.839	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-5.2	173.7	60	0	0	0	0	114	S282	S282-S284 PolarHBondContact O-N 3.11Å
285	I	42.8	Very low	45.9	Very low	143 Å²	143	123.3 Å²	123.3	73%	0.733	68%	0.68	S	S	*	*	S	Bend	trans	-103.5	117.7	170.3	-149.8	157.7	0	0	0	109.6	S283 Y287	S283-I285 PolarHBondContact O-N 2.97Å; I285-Y287 PolarHBondContact O-N 3.44Å
286	S	41	Very low	45.7	Very low	125 Å²	125	123 Å²	123	87%	0.874	68%	0.679	S	S	*	*			trans	-81.6	78.7	-167.8	56.1	0	0	0	0	112.1
287	Y	36.4	Very low	46.2	Very low	210 Å²	210	116.6 Å²	116.6	82%	0.824	66%	0.658	S	S	*	*			trans	-103.3	147.7	161.3	-150.9	-98	0	0	0	110.1	I285 Q289	I285-Y287 PolarHBondContact O-N 3.44Å; Y287-Q289 PolarHBondContact O-N 3.42Å
288	S	35.1	Very low	47.5	Very low	80 Å²	80	114.9 Å²	114.9	56%	0.559	65%	0.648	S	S	*	*			trans	-48.1	123.6	-163.6	52	0	0	0	0	115.4	E290	S288-E290 PolarHBondContact O-N 3.43Å
289	Q	38.4	Very low	49	Very low	207 Å²	207	107.9 Å²	107.9	97%	0.967	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	37.6	172	-162	175.4	96.7	0	0	112.7	Y287	Y287-Q289 PolarHBondContact O-N 3.42Å
290	E	38.5	Very low	50.7	Low	161 Å²	161	106.1 Å²	106.1	75%	0.752	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-15.4	178.9	-179.7	61.7	-144.2	0	0	111.6	S288	S288-E290 PolarHBondContact O-N 3.43Å
291	S	40	Very low	52.4	Low	82 Å²	82	100.9 Å²	100.9	57%	0.573	59%	0.586	S	S	*	*			trans	-150.9	111.8	-165.7	-72.1	0	0	0	0	114.3	A293	S291-A293 PolarHBondContact O-N 2.91Å
292	G	43	Very low	54.1	Low	77 Å²	77	92.7 Å²	92.7	79%	0.794	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-69.7	1.2	159.9	0	0	0	0	0	114.2	A294	G292-A294 PolarHBondContact O-N 3.33Å
293	A	42.9	Very low	55.8	Low	41 Å²	41	92.9 Å²	92.9	34%	0.339	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-67	-26.7	-170.6	0	0	0	0	0	115	S291 A295 D296 D297	S291-A293 PolarHBondContact O-N 2.91Å; A293-A295 PolarHBondContact O-N 3.23Å; A293-D296 PolarHBondContact O-N 3.39Å; A293-D297 PolarHBondContact O-N 2.74Å; A293-D297 VanDerWaalsContact O-N 3.11Å
294	A	47	Very low	57.3	Low	84 Å²	84	90.3 Å²	90.3	69%	0.694	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-60.2	-20.8	-174.2	0	0	0	0	0	114.5	G292	G292-A294 PolarHBondContact O-N 3.33Å
295	A	50.2	Low	59	Low	76 Å²	76	87 Å²	87	63%	0.628	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-97.3	-9.2	174.3	0	0	0	0	0	114	A293	A293-A295 PolarHBondContact O-N 3.23Å
296	D	56.7	Low	60.9	Low	98 Å²	98	81.3 Å²	81.3	52%	0.524	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-11.8	-178.6	-128.5	-28.5	0	0	0	112.4	A293 K299 W330	A293-D296 PolarHBondContact O-N 3.39Å; D296-K299 WeakPolarHBondContact O-CE 3.17Å; D296-K299 PolarHBondContact O-NZ 3.31Å; D296-K299 WeakPolarHBondContact OD1-CE 3.49Å; D296-K299 IonicContact OD1-NZ 2.68Å; D296-K299 PolarHBondContact OD1-NZ 3.17Å; D296-W330 WeakPolarHBondContact O-CZ2 3.41Å
297	D	69	Low	63	Low	43 Å²	43	82.7 Å²	82.7	23%	0.23	47%	0.474	C	S	.	.	S	Bend	trans	-85.1	-12.6	172.7	-76.4	-23.6	0	0	0	113.3	A293 I309 K310 N312 W330	A293-D297 PolarHBondContact O-N 2.74Å; A293-D297 VanDerWaalsContact O-N 3.11Å; D297-I309 WeakPolarHBondContact O-CA 3.39Å; D297-K310 PolarHBondContact O-N 3.14Å; D297-K310 VanDerWaalsContact O-N 3.07Å; D297-N312 PolarHBondContact OD2-ND2 3.08Å; D297-W330 WeakPolarHBondContact O-CH2 3.12Å
298	I	82.4	Confident	65.3	Low	75 Å²	75	72.7 Å²	72.7	39%	0.385	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	119.9	-179.5	-46.8	-173.2	0	0	0	111.4	Y307 I308 I309	I298-Y307 HydrophobicContact CG2-CD1 4.26Å; I298-I308 CarbonylContact C-O 3.6Å; I298-I308 WeakPolarHBondContact CA-O 3.45Å; I298-I309 HydrophobicContact CD1-CD1 4.06Å; I298-I309 HydrophobicContact CD1-CG1 4.32Å; I298-I309 HydrophobicContact CG1-CD1 4.25Å; I298-I309 HydrophobicContact CG1-CG1 4.02Å; I298-I309 HydrophobicContact CG1-CG2 4.44Å; I298-I309 HydrophobicContact CG2-CG1 4.3Å
299	K	84.4	Confident	67.6	Low	42 Å²	42	72.3 Å²	72.3	18%	0.183	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	148.5	-177	-55.2	-177.2	-171.2	-174.7	0	112.4	D296 I308 W330 M333	D296-K299 WeakPolarHBondContact O-CE 3.17Å; D296-K299 PolarHBondContact O-NZ 3.31Å; D296-K299 WeakPolarHBondContact OD1-CE 3.49Å; D296-K299 IonicContact OD1-NZ 2.68Å; D296-K299 PolarHBondContact OD1-NZ 3.17Å; K299-I308 PolarHBondContact N-O 3.31Å; K299-I308 WeakPolarHBondContact O-CB 3.15Å; K299-I308 PolarHBondContact O-N 3.4Å; K299-W330 HydrophobicContact CB-CE3 4.48Å; K299-W330 HydrophobicContact CB-CH2 3.71Å; K299-W330 HydrophobicContact CB-CZ2 4.42Å; K299-W330 HydrophobicContact CB-CZ3 3.73Å; K299-W330 HydrophobicContact CD-CD2 4.31Å; K299-W330 HydrophobicContact CD-CE3 4.43Å; K299-W330 HydrophobicContact CD-CH2 3.93Å; K299-W330 HydrophobicContact CD-CZ2 3.76Å; K299-W330 HydrophobicContact CD-CZ3 4.25Å; K299-W330 HydrophobicContact CG-CH2 3.61Å; K299-W330 HydrophobicContact CG-CZ2 3.86Å; K299-W330 HydrophobicContact CG-CZ3 4.08Å; K299-M333 HydrophobicContact CB-CE 3.39Å; K299-M333 HydrophobicContact CB-SD 4.15Å; K299-M333 HydrophobicContact CD-CE 3.52Å; K299-M333 HydrophobicContact CG-CE 4.02Å
300	P	86.4	Confident	69.7	Low	58 Å²	58	63.1 Å²	63.1	38%	0.377	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	139.7	-178.7	31.8	-34.6	0	0	0	113.2	A305 A306 Y307	P300-A305 VanDerWaalsContact CB-O 3.3Å; P300-A305 WeakPolarHBondContact CB-O 3.41Å; P300-A306 WeakPolarHBondContact CA-O 3.35Å; P300-Y307 HydrophobicContact CB-CD1 4.46Å
301	C	86.4	Confident	71.4	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.014	38%	0.376	C	S	.	.			trans	-59.1	134.9	169.5	155.4	0	0	0	0	110.5	R303 A305 A306 I308 C321 C326	C301-R303 PolarHBondContact O-N 3.19Å; C301-R303 VanDerWaalsContact O-N 3.17Å; C301-R303 PolarHBondContact SG-N 3.08Å; C301-A305 VanDerWaalsContact O-CA 3.31Å; C301-A305 WeakPolarHBondContact O-CA 3.33Å; C301-A305 PolarHBondContact O-N 3.15Å; C301-A306 PolarHBondContact N-O 2.89Å; C301-I308 HydrophobicContact CB-CD1 3.8Å; C301-C321 HydrophobicContact CB-CB 3.96Å; C301-C326 WeakPolarHBondContact CB-SG 3.35Å; C301-C326 WeakPolarHBondContact SG-CB 3.37Å; C301-C326 CovalentContact SG-SG 2.05Å; C301-C326 PolarHBondContact SG-SG 3.16Å
302	P	83.6	Confident	72.3	Confident	56 Å²	56	61.7 Å²	61.7	36%	0.364	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.3	-176.8	23.8	-34.2	0	0	0	114.7	F328 M333 E335	P302-F328 HydrophobicContact CG-CB 3.7Å; P302-F328 HydrophobicContact CG-CG 4.2Å; P302-M333 WeakPolarHBondContact CB-O 3.3Å; P302-E335 HydrophobicContact CG-CG 4.09Å
303	R	79.2	Confident	73.2	Confident	82 Å²	82	64 Å²	64	31%	0.309	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-47.7	-178.9	-162.1	174.8	-78.4	-144.2	-5.9	113.8	V211 C301 C326 E335	V211-R303 HydrophobicContact CG1-CG 3.77Å; V211-R303 WeakPolarHBondContact O-CD 3.37Å; C301-R303 PolarHBondContact O-N 3.19Å; C301-R303 VanDerWaalsContact O-N 3.17Å; C301-R303 PolarHBondContact SG-N 3.08Å; R303-C326 HydrophobicContact CB-CB 3.75Å; R303-E335 WeakPolarHBondContact CB-OE1 2.91Å; R303-E335 IonicContact CZ-OE1 3.92Å; R303-E335 IonicContact CZ-OE2 3.2Å; R303-E335 IonicContact NE-OE1 3.23Å; R303-E335 PolarHBondContact NE-OE1 3.22Å; R303-E335 IonicContact NE-OE2 2.65Å; R303-E335 IonicContact NH2-OE1 2.85Å; R303-E335 PolarHBondContact NH2-OE1 3.14Å; R303-E335 IonicContact NH2-OE2 2.78Å; R303-E335 PolarHBondContact NH2-OE2 3.49Å
304	C	76.6	Confident	74.2	Confident	35 Å²	35	63.4 Å²	63.4	24%	0.236	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-2.2	-168.1	70.4	0	0	0	0	115.1	V211 A306 C324	V211-C304 HydrophobicContact CG1-CB 3.85Å; V211-C304 HydrophobicContact CG2-CB 4.49Å; C304-A306 PolarHBondContact O-N 3.43Å; C304-A306 VanDerWaalsContact SG-CB 3.55Å; C304-C324 HydrophobicContact CB-CB 4.03Å; C304-C324 PolarHBondContact SG-SG 3.12Å
305	A	79	Confident	75.6	Confident	49 Å²	49	60.1 Å²	60.1	41%	0.405	34%	0.336	S	S	.	.			trans	59.9	1	-175.5	0	0	0	0	0	117.1	P300 C301 Y307	P300-A305 VanDerWaalsContact CB-O 3.3Å; P300-A305 WeakPolarHBondContact CB-O 3.41Å; C301-A305 VanDerWaalsContact O-CA 3.31Å; C301-A305 WeakPolarHBondContact O-CA 3.33Å; C301-A305 PolarHBondContact O-N 3.15Å; A305-Y307 PolarHBondContact O-N 2.73Å
306	A	81.6	Confident	77.3	Confident	24 Å²	24	56.7 Å²	56.7	20%	0.198	31%	0.307	C	S	.	.			trans	-58.3	131.1	176.5	0	0	0	0	0	111.3	P300 C301 C304 I308 V323	P300-A306 WeakPolarHBondContact CA-O 3.35Å; C301-A306 PolarHBondContact N-O 2.89Å; C304-A306 PolarHBondContact O-N 3.43Å; C304-A306 VanDerWaalsContact SG-CB 3.55Å; A306-I308 PolarHBondContact O-N 2.89Å; A306-V323 HydrophobicContact CB-CB 4.37Å; A306-V323 HydrophobicContact CB-CG2 3.96Å
307	Y	85.1	Confident	78.7	Confident	155 Å²	155	52 Å²	52	61%	0.608	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	127.1	179.8	-67.9	-73	0	0	0	111.4	I298 P300 A305 A597 G598	I298-Y307 HydrophobicContact CG2-CD1 4.26Å; P300-Y307 HydrophobicContact CB-CD1 4.46Å; A305-Y307 PolarHBondContact O-N 2.73Å; Y307-A597 WeakPolarHBondContact O-CA 3.22Å; Y307-G598 PolarHBondContact O-N 3.42Å
308	I	84.7	Confident	79.7	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	136	-179.1	-70.5	170.4	0	0	0	108.6	I298 K299 C301 A306 M319 C321 F328 W330 A595	I298-I308 CarbonylContact C-O 3.6Å; I298-I308 WeakPolarHBondContact CA-O 3.45Å; K299-I308 PolarHBondContact N-O 3.31Å; K299-I308 WeakPolarHBondContact O-CB 3.15Å; K299-I308 PolarHBondContact O-N 3.4Å; C301-I308 HydrophobicContact CB-CD1 3.8Å; A306-I308 PolarHBondContact O-N 2.89Å; I308-M319 HydrophobicContact CG2-CE 3.69Å; I308-C321 HydrophobicContact CD1-CB 3.79Å; I308-F328 HydrophobicContact CD1-CE1 3.52Å; I308-F328 HydrophobicContact CD1-CZ 3.42Å; I308-F328 VanDerWaalsContact CD1-CZ 3.42Å; I308-F328 HydrophobicContact CG2-CZ 4.34Å; I308-W330 HydrophobicContact CB-CZ3 4.4Å; I308-W330 HydrophobicContact CG2-CZ3 3.86Å; I308-A595 HydrophobicContact CB-CB 4.18Å; I308-A595 HydrophobicContact CD1-CB 3.71Å; I308-A595 HydrophobicContact CG1-CB 3.79Å; I308-A595 HydrophobicContact CG2-CB 3.38Å
309	I	84.8	Confident	80	Confident	71 Å²	71	47.9 Å²	47.9	36%	0.364	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	131.3	171.4	-47.4	-170.8	0	0	0	108.6	D297 I298 M596	D297-I309 WeakPolarHBondContact O-CA 3.39Å; I298-I309 HydrophobicContact CD1-CD1 4.06Å; I298-I309 HydrophobicContact CD1-CG1 4.32Å; I298-I309 HydrophobicContact CG1-CD1 4.25Å; I298-I309 HydrophobicContact CG1-CG1 4.02Å; I298-I309 HydrophobicContact CG1-CG2 4.44Å; I298-I309 HydrophobicContact CG2-CG1 4.3Å; I309-M596 PolarHBondContact N-O 2.93Å
310	K	81.8	Confident	80.1	Confident	14 Å²	14	47.1 Å²	47.1	6%	0.061	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-97.8	121.3	170.1	179.7	168.1	176.7	162.9	0	109.8	D297 N312 S315 C316 N317 M319 W330	D297-K310 PolarHBondContact O-N 3.14Å; D297-K310 VanDerWaalsContact O-N 3.07Å; K310-N312 PolarHBondContact O-N 3.31Å; K310-S315 WeakPolarHBondContact CE-OG 3.43Å; K310-S315 PolarHBondContact NZ-O 3.07Å; K310-C316 PolarHBondContact NZ-O 3.11Å; K310-N317 PolarHBondContact NZ-OD1 3.22Å; K310-M319 HydrophobicContact CB-CE 4.01Å; K310-M319 HydrophobicContact CB-SD 4.15Å; K310-M319 HydrophobicContact CD-SD 3.86Å; K310-M319 HydrophobicContact CG-CE 4.28Å; K310-M319 HydrophobicContact CG-SD 4.2Å; K310-W330 HydrophobicContact CB-CD2 3.95Å; K310-W330 HydrophobicContact CB-CE3 4.22Å; K310-W330 HydrophobicContact CB-CH2 3.79Å; K310-W330 HydrophobicContact CB-CZ2 3.49Å; K310-W330 VanDerWaalsContact CB-CZ2 3.49Å; K310-W330 HydrophobicContact CB-CZ3 4.16Å; K310-W330 HydrophobicContact CD-CB 4.44Å; K310-W330 HydrophobicContact CD-CD2 3.95Å; K310-W330 HydrophobicContact CD-CG 3.74Å
311	M	73.6	Confident	80.1	Confident	125 Å²	125	44.4 Å²	44.4	62%	0.616	24%	0.241	S	C	*	.	P	Polyproline II helix	trans	-63.7	128.5	167.3	-63	-176.2	-174	0	0	108.7	D313 M596	M311-D313 PolarHBondContact O-N 3.36Å; M311-D313 VanDerWaalsContact O-OD1 3.13Å; M311-M596 HydrophobicContact CE-CE 3.44Å; M311-M596 VanDerWaalsContact CE-CE 3.44Å; M311-M596 HydrophobicContact CE-CG 4.34Å; M311-M596 HydrophobicContact CE-SD 3.59Å; M311-M596 VanDerWaalsContact CE-SD 3.59Å
312	N	59	Low	79.8	Confident	89 Å²	89	45.3 Å²	45.3	48%	0.476	25%	0.248	S	C	.	.			trans	-98.9	33.6	-156	56.6	17.5	0	0	0	114	D297 K310 G314 K352	D297-N312 PolarHBondContact OD2-ND2 3.08Å; K310-N312 PolarHBondContact O-N 3.31Å; N312-G314 VanDerWaalsContact C-N 3.31Å; N312-G314 PolarHBondContact O-N 3Å; N312-K352 WeakPolarHBondContact O-CE 3.27Å; N312-K352 PolarHBondContact O-NZ 3.14Å
313	D	63.6	Low	79.6	Confident	125 Å²	125	44.3 Å²	44.3	67%	0.668	24%	0.241	S	C	*	.	S	Bend	trans	-65.1	-23.1	176.7	67.6	-26.2	0	0	0	114.8	M311 S315	M311-D313 PolarHBondContact O-N 3.36Å; M311-D313 VanDerWaalsContact O-OD1 3.13Å; D313-S315 WeakPolarHBondContact OD1-CB 3.5Å; D313-S315 PolarHBondContact OD1-N 3.12Å; D313-S315 PolarHBondContact OD1-OG 3.39Å; D313-S315 WeakPolarHBondContact OD2-CB 3.39Å
314	G	63.6	Low	79.5	Confident	29 Å²	29	40.9 Å²	40.9	30%	0.299	23%	0.229	S	C	.	.	S	Bend	trans	108.5	4.7	-172.4	0	0	0	0	0	114.7	N312	N312-G314 VanDerWaalsContact C-N 3.31Å; N312-G314 PolarHBondContact O-N 3Å
315	S	75.4	Confident	79.6	Confident	15 Å²	15	40 Å²	40	11%	0.105	23%	0.227	C	C	.	.			trans	-47.7	170.8	176.5	49.2	0	0	0	0	115.9	K310 D313	K310-S315 WeakPolarHBondContact CE-OG 3.43Å; K310-S315 PolarHBondContact NZ-O 3.07Å; D313-S315 WeakPolarHBondContact OD1-CB 3.5Å; D313-S315 PolarHBondContact OD1-N 3.12Å; D313-S315 PolarHBondContact OD1-OG 3.39Å; D313-S315 WeakPolarHBondContact OD2-CB 3.39Å
316	C	85.7	Confident	79.9	Confident	3 Å²	3	37.9 Å²	37.9	2%	0.02	21%	0.209	C	C	.	.			trans	-50.2	140.1	178	-171.8	0	0	0	0	112.9	K310 H318 F349 W350	K310-C316 PolarHBondContact NZ-O 3.11Å; C316-H318 WeakPolarHBondContact SG-CB 3.43Å; C316-H318 PolarHBondContact SG-N 2.67Å; C316-F349 CarbonylContact C-O 3.58Å; C316-F349 WeakPolarHBondContact CA-O 3.44Å; C316-F349 HydrophobicContact CB-CE1 4.17Å; C316-F349 WeakPolarHBondContact SG-CE1 3.31Å; C316-F349 WeakPolarHBondContact SG-CZ 3.34Å; C316-W350 HydrophobicContact CB-CE3 4.38Å; C316-W350 HydrophobicContact CB-CH2 4.4Å; C316-W350 HydrophobicContact CB-CZ3 3.99Å
317	N	87.5	Confident	80.3	Confident	1 Å²	1	41 Å²	41	1%	0.005	22%	0.219	C	C	.	.	S	Bend	trans	-90.5	-2.5	174.5	-68.4	-43.5	0	0	0	113.2	K310 M319 C329 W330 L331 Y341 T348 F349 G351	K310-N317 PolarHBondContact NZ-OD1 3.22Å; N317-M319 PolarHBondContact O-N 3.34Å; N317-C329 WeakPolarHBondContact O-CA 3.49Å; N317-W330 HydrophobicContact CB-CB 4.29Å; N317-W330 PolarHBondContact O-N 3.01Å; N317-L331 HydrophobicContact CB-CD1 4.46Å; N317-L331 HydrophobicContact CB-CG 4.23Å; N317-L331 WeakPolarHBondContact ND2-CD1 3.37Å; N317-Y341 PolarHBondContact O-OH 3.49Å; N317-T348 WeakPolarHBondContact CB-O 3.39Å; N317-T348 PolarHBondContact ND2-O 3.37Å; N317-F349 PolarHBondContact N-O 2.84Å; N317-G351 PolarHBondContact ND2-O 2.67Å
318	H	89.3	Confident	80.5	Confident	30 Å²	30	33.7 Å²	33.7	14%	0.139	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	111.9	163.4	-169.2	-66.6	0	0	0	107.4	C316 E327 I336 Y341 F349 S592 T593	C316-H318 WeakPolarHBondContact SG-CB 3.43Å; C316-H318 PolarHBondContact SG-N 2.67Å; H318-E327 IonicContact CE1-OE1 3.57Å; H318-E327 IonicContact CE1-OE2 2.59Å; H318-I336 HydrophobicContact CB-CD1 4.03Å; H318-I336 WeakPolarHBondContact CD2-CD1 3.11Å; H318-Y341 VanDerWaalsContact CA-OH 3.3Å; H318-Y341 WeakPolarHBondContact CA-OH 3.46Å; H318-Y341 PolarHBondContact N-OH 2.91Å; H318-F349 HydrophobicContact CB-CE2 4.46Å; H318-S592 VanDerWaalsContact ND1-CB 3.31Å; H318-S592 WeakPolarHBondContact ND1-CB 3.41Å; H318-S592 PolarHBondContact ND1-OG 2.94Å; H318-S592 PolarHBondContact O-OG 3.26Å; H318-T593 PolarHBondContact O-N 3.39Å
319	M	88.1	Confident	80.8	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136.4	-179.2	-66.9	-174.7	75.2	0	0	110.8	I308 K310 N317 E327 F328 W330 T593 A595	I308-M319 HydrophobicContact CG2-CE 3.69Å; K310-M319 HydrophobicContact CB-CE 4.01Å; K310-M319 HydrophobicContact CB-SD 4.15Å; K310-M319 HydrophobicContact CD-SD 3.86Å; K310-M319 HydrophobicContact CG-CE 4.28Å; K310-M319 HydrophobicContact CG-SD 4.2Å; N317-M319 PolarHBondContact O-N 3.34Å; M319-E327 WeakPolarHBondContact O-CA 3.48Å; M319-F328 HydrophobicContact CB-CD1 4.32Å; M319-F328 HydrophobicContact CB-CE1 3.7Å; M319-F328 HydrophobicContact CB-CE2 4.34Å; M319-F328 HydrophobicContact CB-CZ 3.71Å; M319-F328 PolarHBondContact N-O 3.28Å; M319-F328 WeakPolarHBondContact O-CD1 3.37Å; M319-F328 WeakPolarHBondContact O-CE1 3.41Å; M319-F328 PolarHBondContact O-N 2.59Å; M319-F328 HydrophobicContact SD-CZ 4.45Å; M319-W330 HydrophobicContact CE-CE3 4.24Å; M319-W330 HydrophobicContact CE-CZ3 4.49Å; M319-W330 HydrophobicContact CG-CB 4.45Å; M319-W330 HydrophobicContact SD-CB 3.81Å; M319-W330 HydrophobicContact SD-CD2 3.72Å; M319-W330 HydrophobicContact SD-CE3 3.37Å; M319-W330 HydrophobicContact SD-CG 3.93Å; M319-W330 HydrophobicContact SD-CZ3 4.17Å; M319-T593 WeakPolarHBondContact CA-O 3.3Å; M319-A595 HydrophobicContact CE-CB 4.07Å
320	T	88.2	Confident	80.9	Confident	25 Å²	25	31 Å²	31	15%	0.153	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	120	173.6	-47.7	0	0	0	0	108.6	A322 C326 E327 S592 A595	T320-A322 PolarHBondContact O-N 2.89Å; T320-C326 CarbonylContact C-O 3.53Å; T320-C326 WeakPolarHBondContact CA-O 3.44Å; T320-E327 HydrophobicContact CG2-CG 4.1Å; T320-E327 PolarHBondContact OG1-OE1 2.69Å; T320-S592 PolarHBondContact N-OG 2.98Å; T320-S592 WeakPolarHBondContact OG1-CB 3.38Å; T320-S592 PolarHBondContact OG1-OG 3.08Å; T320-A595 WeakPolarHBondContact O-CB 3.38Å; T320-A595 PolarHBondContact O-N 3.36Å
321	C	85.8	Confident	81	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.007	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	127.3	176.1	175.2	0	0	0	0	111	C301 I308 V323 C324 G325 C326 F328	C301-C321 HydrophobicContact CB-CB 3.96Å; I308-C321 HydrophobicContact CD1-CB 3.79Å; C321-V323 PolarHBondContact O-N 3.15Å; C321-C324 VanDerWaalsContact SG-SG 3.68Å; C321-G325 WeakPolarHBondContact O-CA 3.31Å; C321-G325 PolarHBondContact O-N 2.99Å; C321-C326 HydrophobicContact CB-CB 4.31Å; C321-C326 WeakPolarHBondContact CB-SG 3.28Å; C321-C326 PolarHBondContact N-O 2.69Å; C321-F328 HydrophobicContact CB-CE1 4.26Å
322	A	79.8	Confident	81.4	Confident	21 Å²	21	27.9 Å²	27.9	17%	0.174	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-50.4	177	0	0	0	0	0	112.7	T320 C324	T320-A322 PolarHBondContact O-N 2.89Å; A322-C324 PolarHBondContact O-N 2.86Å
323	V	78.6	Confident	82.7	Confident	35 Å²	35	25.9 Å²	25.9	21%	0.212	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-48	-170.7	-176.9	0	0	0	0	113	A306 C321 A597	A306-V323 HydrophobicContact CB-CB 4.37Å; A306-V323 HydrophobicContact CB-CG2 3.96Å; C321-V323 PolarHBondContact O-N 3.15Å; V323-A597 HydrophobicContact CG2-CB 3.89Å
324	C	77.3	Confident	83.7	Confident	10 Å²	10	25.9 Å²	25.9	7%	0.068	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118	-8.6	-174	66.2	0	0	0	0	114.8	V211 C304 C321 A322 C326	V211-C324 HydrophobicContact CB-CB 4.27Å; V211-C324 HydrophobicContact CG1-CB 3.49Å; V211-C324 VanDerWaalsContact CG1-CB 3.49Å; C304-C324 HydrophobicContact CB-CB 4.03Å; C304-C324 PolarHBondContact SG-SG 3.12Å; C321-C324 VanDerWaalsContact SG-SG 3.68Å; A322-C324 PolarHBondContact O-N 2.86Å; C324-C326 VanDerWaalsContact C-N 3.28Å; C324-C326 PolarHBondContact O-N 2.94Å; C324-C326 VanDerWaalsContact SG-CB 3.55Å; C324-C326 PolarHBondContact SG-N 2.72Å; C324-C326 VanDerWaalsContact SG-N 3.38Å
325	G	79.4	Confident	84.9	Confident	17 Å²	17	28.2 Å²	28.2	18%	0.175	15%	0.151	C	C	.	.			trans	71.5	15	-172.8	0	0	0	0	0	115.3	C321 E327	C321-G325 WeakPolarHBondContact O-CA 3.31Å; C321-G325 PolarHBondContact O-N 2.99Å; G325-E327 PolarHBondContact O-N 2.99Å
326	C	84.4	Confident	85.4	Confident	4 Å²	4	29.4 Å²	29.4	3%	0.027	16%	0.155	C	C	.	.			trans	-57.7	126.9	173.2	81.8	0	0	0	0	109.1	C301 R303 T320 C321 C324 F328	C301-C326 WeakPolarHBondContact CB-SG 3.35Å; C301-C326 WeakPolarHBondContact SG-CB 3.37Å; C301-C326 CovalentContact SG-SG 2.05Å; C301-C326 PolarHBondContact SG-SG 3.16Å; R303-C326 HydrophobicContact CB-CB 3.75Å; T320-C326 CarbonylContact C-O 3.53Å; T320-C326 WeakPolarHBondContact CA-O 3.44Å; C321-C326 HydrophobicContact CB-CB 4.31Å; C321-C326 WeakPolarHBondContact CB-SG 3.28Å; C321-C326 PolarHBondContact N-O 2.69Å; C324-C326 VanDerWaalsContact C-N 3.28Å; C324-C326 PolarHBondContact O-N 2.94Å; C324-C326 VanDerWaalsContact SG-CB 3.55Å; C324-C326 PolarHBondContact SG-N 2.72Å; C324-C326 VanDerWaalsContact SG-N 3.38Å; C326-F328 WeakPolarHBondContact O-CD1 3.37Å; C326-F328 WeakPolarHBondContact SG-CD1 3.5Å
327	E	90.3	Very high	85.2	Confident	91 Å²	91	32.6 Å²	32.6	43%	0.425	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	116.3	172.6	-54.2	-146.8	112.2	0	0	107.4	H318 M319 T320 G325 E335 I336	H318-E327 IonicContact CE1-OE1 3.57Å; H318-E327 IonicContact CE1-OE2 2.59Å; M319-E327 WeakPolarHBondContact O-CA 3.48Å; T320-E327 HydrophobicContact CG2-CG 4.1Å; T320-E327 PolarHBondContact OG1-OE1 2.69Å; G325-E327 PolarHBondContact O-N 2.99Å; E327-E335 CarbonylContact O-C 3.48Å; E327-E335 VanDerWaalsContact O-CA 3.28Å; E327-E335 WeakPolarHBondContact O-CA 3.26Å; E327-I336 PolarHBondContact O-N 2.85Å
328	F	90.2	Very high	84.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	153.6	-165.2	75	-77.8	0	0	0	112	P302 I308 M319 C321 C326 W330 M333 K334 I336	P302-F328 HydrophobicContact CG-CB 3.7Å; P302-F328 HydrophobicContact CG-CG 4.2Å; I308-F328 HydrophobicContact CD1-CE1 3.52Å; I308-F328 HydrophobicContact CD1-CZ 3.42Å; I308-F328 VanDerWaalsContact CD1-CZ 3.42Å; I308-F328 HydrophobicContact CG2-CZ 4.34Å; M319-F328 HydrophobicContact CB-CD1 4.32Å; M319-F328 HydrophobicContact CB-CE1 3.7Å; M319-F328 HydrophobicContact CB-CE2 4.34Å; M319-F328 HydrophobicContact CB-CZ 3.71Å; M319-F328 PolarHBondContact N-O 3.28Å; M319-F328 WeakPolarHBondContact O-CD1 3.37Å; M319-F328 WeakPolarHBondContact O-CE1 3.41Å; M319-F328 PolarHBondContact O-N 2.59Å; M319-F328 HydrophobicContact SD-CZ 4.45Å; C321-F328 HydrophobicContact CB-CE1 4.26Å; C326-F328 WeakPolarHBondContact O-CD1 3.37Å; C326-F328 WeakPolarHBondContact SG-CD1 3.5Å; F328-W330 HydrophobicContact CE2-CE3 4.15Å; F328-W330 HydrophobicContact CZ-CE3 4.48Å; F328-M333 HydrophobicContact CD2-CE 4.17Å; F328-M333 HydrophobicContact CD2-SD 3.76Å; F328-M333 HydrophobicContact CE2-CE 3.65Å; F328-M333 HydrophobicContact CE2-SD 3.67Å; F328-K334 VanDerWaalsContact CA-O 3.31Å; F328-K334 WeakPolarHBondContact CA-O 3.45Å; F328-K334 WeakPolarHBondContact CB-O 3.34Å; F328-I336 WeakPolarHBondContact O-CD1 3.08Å
329	C	89.8	Confident	83.9	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	117.6	-177.3	179.5	0	0	0	0	111.2	N317 L331 C332 M333 K334 I336 H340 C347	N317-C329 WeakPolarHBondContact O-CA 3.49Å; C329-L331 PolarHBondContact O-N 2.88Å; C329-L331 VanDerWaalsContact O-N 3.09Å; C329-C332 PolarHBondContact O-N 2.83Å; C329-M333 PolarHBondContact O-N 2.73Å; C329-K334 PolarHBondContact N-O 3.29Å; C329-I336 HydrophobicContact CB-CD1 4.24Å; C329-I336 HydrophobicContact CB-CG1 4.04Å; C329-H340 VanDerWaalsContact CB-CE1 3.44Å; C329-H340 WeakPolarHBondContact CB-CE1 3.01Å; C329-H340 WeakPolarHBondContact CB-NE2 3.11Å; C329-H340 PolarHBondContact SG-NE2 3.4Å; C329-C347 VanDerWaalsContact SG-CB 3.6Å
330	W	87.9	Confident	83.6	Confident	15 Å²	15	44 Å²	44	6%	0.057	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-32.3	-177.8	-175.7	-110.8	0	0	0	114	D296 D297 K299 I308 K310 N317 M319 F328 M333	D296-W330 WeakPolarHBondContact O-CZ2 3.41Å; D297-W330 WeakPolarHBondContact O-CH2 3.12Å; K299-W330 HydrophobicContact CB-CE3 4.48Å; K299-W330 HydrophobicContact CB-CH2 3.71Å; K299-W330 HydrophobicContact CB-CZ2 4.42Å; K299-W330 HydrophobicContact CB-CZ3 3.73Å; K299-W330 HydrophobicContact CD-CD2 4.31Å; K299-W330 HydrophobicContact CD-CE3 4.43Å; K299-W330 HydrophobicContact CD-CH2 3.93Å; K299-W330 HydrophobicContact CD-CZ2 3.76Å; K299-W330 HydrophobicContact CD-CZ3 4.25Å; K299-W330 HydrophobicContact CG-CH2 3.61Å; K299-W330 HydrophobicContact CG-CZ2 3.86Å; K299-W330 HydrophobicContact CG-CZ3 4.08Å; I308-W330 HydrophobicContact CB-CZ3 4.4Å; I308-W330 HydrophobicContact CG2-CZ3 3.86Å; K310-W330 HydrophobicContact CB-CD2 3.95Å; K310-W330 HydrophobicContact CB-CE3 4.22Å; K310-W330 HydrophobicContact CB-CH2 3.79Å; K310-W330 HydrophobicContact CB-CZ2 3.49Å; K310-W330 VanDerWaalsContact CB-CZ2 3.49Å; K310-W330 HydrophobicContact CB-CZ3 4.16Å; K310-W330 HydrophobicContact CD-CB 4.44Å; K310-W330 HydrophobicContact CD-CD2 3.95Å; K310-W330 HydrophobicContact CD-CG 3.74Å; N317-W330 HydrophobicContact CB-CB 4.29Å; N317-W330 PolarHBondContact O-N 3.01Å; M319-W330 HydrophobicContact CE-CE3 4.24Å; M319-W330 HydrophobicContact CE-CZ3 4.49Å; M319-W330 HydrophobicContact CG-CB 4.45Å; M319-W330 HydrophobicContact SD-CB 3.81Å; M319-W330 HydrophobicContact SD-CD2 3.72Å; M319-W330 HydrophobicContact SD-CE3 3.37Å; M319-W330 HydrophobicContact SD-CG 3.93Å; M319-W330 HydrophobicContact SD-CZ3 4.17Å; F328-W330 HydrophobicContact CE2-CE3 4.15Å; F328-W330 HydrophobicContact CZ-CE3 4.48Å; W330-M333 HydrophobicContact CD2-CE 4.08Å; W330-M333 HydrophobicContact CE3-CE 3.52Å; W330-M333 HydrophobicContact CZ3-CE 3.89Å; W330-M333 WeakPolarHBondContact O-CE 3.38Å
331	L	84.7	Confident	83.1	Confident	29 Å²	29	45.5 Å²	45.5	15%	0.152	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-21	-174.7	-61.2	177.6	0	0	0	114.1	N317 C329 C347 P354	N317-L331 HydrophobicContact CB-CD1 4.46Å; N317-L331 HydrophobicContact CB-CG 4.23Å; N317-L331 WeakPolarHBondContact ND2-CD1 3.37Å; C329-L331 PolarHBondContact O-N 2.88Å; C329-L331 VanDerWaalsContact O-N 3.09Å; L331-C347 HydrophobicContact CB-CB 4.12Å; L331-C347 HydrophobicContact CD1-CB 3.98Å; L331-P354 HydrophobicContact CD1-CB 4.43Å
332	C	81.9	Confident	82.3	Confident	44 Å²	44	51.1 Å²	51.1	30%	0.297	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.6	-2.8	-174.7	69.2	0	0	0	0	116.2	C329 K334 H340	C329-C332 PolarHBondContact O-N 2.83Å; C332-K334 VanDerWaalsContact C-N 3.32Å; C332-K334 PolarHBondContact O-N 2.84Å; C332-H340 PolarHBondContact SG-CE1 2.86Å
333	M	85.8	Confident	81.4	Confident	48 Å²	48	52.2 Å²	52.2	24%	0.236	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	49.2	-179.3	-65.7	-63.9	146.1	0	0	113.1	K299 P302 F328 C329 W330	K299-M333 HydrophobicContact CB-CE 3.39Å; K299-M333 HydrophobicContact CB-SD 4.15Å; K299-M333 HydrophobicContact CD-CE 3.52Å; K299-M333 HydrophobicContact CG-CE 4.02Å; P302-M333 WeakPolarHBondContact CB-O 3.3Å; F328-M333 HydrophobicContact CD2-CE 4.17Å; F328-M333 HydrophobicContact CD2-SD 3.76Å; F328-M333 HydrophobicContact CE2-CE 3.65Å; F328-M333 HydrophobicContact CE2-SD 3.67Å; C329-M333 PolarHBondContact O-N 2.73Å; W330-M333 HydrophobicContact CD2-CE 4.08Å; W330-M333 HydrophobicContact CE3-CE 3.52Å; W330-M333 HydrophobicContact CZ3-CE 3.89Å; W330-M333 WeakPolarHBondContact O-CE 3.38Å
334	K	84.8	Confident	80.4	Confident	125 Å²	125	51.7 Å²	51.7	54%	0.543	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	149.3	168.8	-64.1	-178.7	-178.2	-179.4	0	108.9	F328 C329 C332	F328-K334 VanDerWaalsContact CA-O 3.31Å; F328-K334 WeakPolarHBondContact CA-O 3.45Å; F328-K334 WeakPolarHBondContact CB-O 3.34Å; C329-K334 PolarHBondContact N-O 3.29Å; C332-K334 VanDerWaalsContact C-N 3.32Å; C332-K334 PolarHBondContact O-N 2.84Å
335	E	87.9	Confident	79.5	Confident	78 Å²	78	53 Å²	53	36%	0.364	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	148.8	171.6	-56.2	-166.8	163.7	0	0	110.2	P302 R303 E327 H340	P302-E335 HydrophobicContact CG-CG 4.09Å; R303-E335 WeakPolarHBondContact CB-OE1 2.91Å; R303-E335 IonicContact CZ-OE1 3.92Å; R303-E335 IonicContact CZ-OE2 3.2Å; R303-E335 IonicContact NE-OE1 3.23Å; R303-E335 PolarHBondContact NE-OE1 3.22Å; R303-E335 IonicContact NE-OE2 2.65Å; R303-E335 IonicContact NH2-OE1 2.85Å; R303-E335 PolarHBondContact NH2-OE1 3.14Å; R303-E335 IonicContact NH2-OE2 2.78Å; R303-E335 PolarHBondContact NH2-OE2 3.49Å; E327-E335 CarbonylContact O-C 3.48Å; E327-E335 VanDerWaalsContact O-CA 3.28Å; E327-E335 WeakPolarHBondContact O-CA 3.26Å; E335-H340 PolarHBondContact O-ND1 2.74Å
336	I	87.1	Confident	78.8	Confident	39 Å²	39	52.9 Å²	52.9	20%	0.2	28%	0.283	C	S	.	.			trans	-88.5	138.8	-178.7	-69.8	167.8	0	0	0	108.9	H318 E327 F328 C329 H340 Y341	H318-I336 HydrophobicContact CB-CD1 4.03Å; H318-I336 WeakPolarHBondContact CD2-CD1 3.11Å; E327-I336 PolarHBondContact O-N 2.85Å; F328-I336 WeakPolarHBondContact O-CD1 3.08Å; C329-I336 HydrophobicContact CB-CD1 4.24Å; C329-I336 HydrophobicContact CB-CG1 4.04Å; I336-H340 HydrophobicContact CG2-CB 4.14Å; I336-Y341 HydrophobicContact CD1-CE2 3.99Å; I336-Y341 VanDerWaalsContact CD1-OH 3.22Å; I336-Y341 WeakPolarHBondContact CD1-OH 3.44Å; I336-Y341 HydrophobicContact CG1-CE2 4.35Å; I336-Y341 HydrophobicContact CG2-CE2 4.24Å
337	S	80.7	Confident	78.6	Confident	70 Å²	70	53.2 Å²	53.2	49%	0.49	29%	0.285	S	S	.	.			trans	-125.9	165.2	164.3	60.6	0	0	0	0	107.9	L339 H340	S337-L339 PolarHBondContact O-N 2.95Å; S337-H340 WeakPolarHBondContact O-CB 3.37Å; S337-H340 PolarHBondContact O-N 3.17Å
338	D	75.9	Confident	78	Confident	168 Å²	168	50.5 Å²	50.5	90%	0.898	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-32.5	-176.2	-46.5	-8.9	0	0	0	113
339	L	73.7	Confident	77.6	Confident	92 Å²	92	53.9 Å²	53.9	48%	0.482	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-0	179.6	-152.3	73.4	0	0	0	114	S337 Y341 L342 S343	S337-L339 PolarHBondContact O-N 2.95Å; L339-Y341 PolarHBondContact O-N 3.01Å; L339-L342 HydrophobicContact CD1-CB 3.85Å; L339-L342 HydrophobicContact CD1-CD1 4.02Å; L339-L342 HydrophobicContact CG-CB 4.18Å; L339-L342 CarbonylContact O-C 3.42Å; L339-L342 PolarHBondContact O-N 3.49Å; L339-L342 VanDerWaalsContact O-N 3.15Å; L339-S343 WeakPolarHBondContact O-CB 3.22Å; L339-S343 PolarHBondContact O-N 3.23Å
340	H	82.2	Confident	77.1	Confident	12 Å²	12	61.7 Å²	61.7	6%	0.056	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-46.4	-169.2	-175	108.3	0	0	0	113.5	C329 C332 E335 I336 S337 S345	C329-H340 VanDerWaalsContact CB-CE1 3.44Å; C329-H340 WeakPolarHBondContact CB-CE1 3.01Å; C329-H340 WeakPolarHBondContact CB-NE2 3.11Å; C329-H340 PolarHBondContact SG-NE2 3.4Å; C332-H340 PolarHBondContact SG-CE1 2.86Å; E335-H340 PolarHBondContact O-ND1 2.74Å; I336-H340 HydrophobicContact CG2-CB 4.14Å; S337-H340 WeakPolarHBondContact O-CB 3.37Å; S337-H340 PolarHBondContact O-N 3.17Å; H340-S345 PolarHBondContact O-OG 2.8Å
341	Y	77.3	Confident	76.5	Confident	56 Å²	56	62.3 Å²	62.3	22%	0.22	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-16.8	-179.6	-62	-75.4	0	0	0	113.6	N317 H318 I336 L339 F349	N317-Y341 PolarHBondContact O-OH 3.49Å; H318-Y341 VanDerWaalsContact CA-OH 3.3Å; H318-Y341 WeakPolarHBondContact CA-OH 3.46Å; H318-Y341 PolarHBondContact N-OH 2.91Å; I336-Y341 HydrophobicContact CD1-CE2 3.99Å; I336-Y341 VanDerWaalsContact CD1-OH 3.22Å; I336-Y341 WeakPolarHBondContact CD1-OH 3.44Å; I336-Y341 HydrophobicContact CG1-CE2 4.35Å; I336-Y341 HydrophobicContact CG2-CE2 4.24Å; L339-Y341 PolarHBondContact O-N 3.01Å; Y341-F349 HydrophobicContact CD1-CB 4.35Å; Y341-F349 HydrophobicContact CD2-CD2 4.27Å; Y341-F349 HydrophobicContact CE2-CD2 4.22Å
342	L	69	Low	75.8	Confident	120 Å²	120	68 Å²	68	63%	0.628	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-24.6	174.1	-67	166	0	0	0	111.8	L339	L339-L342 HydrophobicContact CD1-CB 3.85Å; L339-L342 HydrophobicContact CD1-CD1 4.02Å; L339-L342 HydrophobicContact CG-CB 4.18Å; L339-L342 CarbonylContact O-C 3.42Å; L339-L342 PolarHBondContact O-N 3.49Å; L339-L342 VanDerWaalsContact O-N 3.15Å
343	S	60.7	Low	75.3	Confident	44 Å²	44	72.1 Å²	72.1	31%	0.308	37%	0.367	S	S	.	.	S	Bend	trans	-78.4	150.3	-179.9	-175.8	0	0	0	0	111.3	L339 S345	L339-S343 WeakPolarHBondContact O-CB 3.22Å; L339-S343 PolarHBondContact O-N 3.23Å; S343-S345 PolarHBondContact O-N 2.65Å
344	P	57.2	Low	74.6	Confident	23 Å²	23	72.7 Å²	72.7	15%	0.149	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	10.7	-174.7	-20.9	33.8	0	0	0	116.6	G346 W363 L454	P344-G346 PolarHBondContact O-N 2.94Å; P344-W363 HydrophobicContact CB-CZ3 4.21Å; P344-W363 HydrophobicContact CG-CZ3 4.14Å; P344-L454 HydrophobicContact CB-CD2 3.19Å; P344-L454 HydrophobicContact CG-CD2 3.55Å
345	S	59.6	Low	73.8	Confident	39 Å²	39	71.1 Å²	71.1	27%	0.273	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-33.7	-39.5	160.8	-43.3	0	0	0	0	112.2	H340 S343 C347 K360	H340-S345 PolarHBondContact O-OG 2.8Å; S343-S345 PolarHBondContact O-N 2.65Å; S345-C347 PolarHBondContact O-N 3.09Å; S345-K360 PolarHBondContact O-NZ 3.31Å
346	G	63.9	Low	73.1	Confident	13 Å²	13	69.9 Å²	69.9	13%	0.134	37%	0.365	C	S	.	.			trans	65.5	31.1	-179.8	0	0	0	0	0	112.1	P344 P354 W355	P344-G346 PolarHBondContact O-N 2.94Å; G346-P354 WeakPolarHBondContact O-CB 3.13Å; G346-W355 PolarHBondContact O-N 2.97Å
347	C	79.9	Confident	72.6	Confident	11 Å²	11	75.2 Å²	75.2	7%	0.074	38%	0.382	C	S	.	.			trans	-94.2	129.3	167.2	-63.9	0	0	0	0	107.4	C329 L331 S345	C329-C347 VanDerWaalsContact SG-CB 3.6Å; L331-C347 HydrophobicContact CB-CB 4.12Å; L331-C347 HydrophobicContact CD1-CB 3.98Å; S345-C347 PolarHBondContact O-N 3.09Å
348	T	78.8	Confident	72.5	Confident	35 Å²	35	75.9 Å²	75.9	22%	0.215	38%	0.377	C	S	.	.			trans	-87.5	150.7	175.9	37.1	0	0	0	0	111.6	N317 W350	N317-T348 WeakPolarHBondContact CB-O 3.39Å; N317-T348 PolarHBondContact ND2-O 3.37Å; T348-W350 VanDerWaalsContact C-N 3.26Å; T348-W350 WeakPolarHBondContact CB-O 3.36Å; T348-W350 PolarHBondContact O-N 2.96Å; T348-W350 PolarHBondContact OG1-O 3.17Å
349	F	81	Confident	72.7	Confident	71 Å²	71	74.2 Å²	74.2	31%	0.311	36%	0.361	S	S	.	.	S	Bend	trans	-61.7	-35.3	167.4	-165.5	-84.4	0	0	0	111.7	C316 N317 H318 Y341	C316-F349 CarbonylContact C-O 3.58Å; C316-F349 WeakPolarHBondContact CA-O 3.44Å; C316-F349 HydrophobicContact CB-CE1 4.17Å; C316-F349 WeakPolarHBondContact SG-CE1 3.31Å; C316-F349 WeakPolarHBondContact SG-CZ 3.34Å; N317-F349 PolarHBondContact N-O 2.84Å; H318-F349 HydrophobicContact CB-CE2 4.46Å; Y341-F349 HydrophobicContact CD1-CB 4.35Å; Y341-F349 HydrophobicContact CD2-CD2 4.27Å; Y341-F349 HydrophobicContact CE2-CD2 4.22Å
350	W	79.9	Confident	72.8	Confident	163 Å²	163	72.6 Å²	72.6	62%	0.617	35%	0.35	S	S	*	.	S	Bend	trans	-118.8	154.7	179.3	-57.5	108.7	0	0	0	112.9	C316 T348	C316-W350 HydrophobicContact CB-CE3 4.38Å; C316-W350 HydrophobicContact CB-CH2 4.4Å; C316-W350 HydrophobicContact CB-CZ3 3.99Å; T348-W350 VanDerWaalsContact C-N 3.26Å; T348-W350 WeakPolarHBondContact CB-O 3.36Å; T348-W350 PolarHBondContact O-N 2.96Å; T348-W350 PolarHBondContact OG1-O 3.17Å
351	G	75.3	Confident	72.7	Confident	28 Å²	28	76.6 Å²	76.6	29%	0.289	37%	0.371	S	S	.	.	S	Bend	trans	90.8	164.7	169	0	0	0	0	0	116.2	N317	N317-G351 PolarHBondContact ND2-O 2.67Å
352	K	70.2	Confident	72.9	Confident	149 Å²	149	79.8 Å²	79.8	65%	0.648	39%	0.391	S	S	*	.	S	Bend	trans	-86.5	-30.6	-160.5	-59.3	-171	175.5	-167.6	0	116.4	N312	N312-K352 WeakPolarHBondContact O-CE 3.27Å; N312-K352 PolarHBondContact O-NZ 3.14Å
353	K	70.1	Confident	73.4	Confident	130 Å²	130	79.4 Å²	79.4	57%	0.565	38%	0.381	S	S	*	.	S	Bend	trans	-110.1	145.5	178.1	-66.5	-175.8	-175.4	176.1	0	110.2	E477	K353-E477 IonicContact NZ-OE1 2.94Å; K353-E477 PolarHBondContact NZ-OE1 2.96Å; K353-E477 IonicContact NZ-OE2 3.78Å; K353-E477 PolarHBondContact NZ-OE2 3.47Å
354	P	71.3	Confident	74.1	Confident	60 Å²	60	79.4 Å²	79.4	39%	0.39	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-63.4	167	164.4	30.7	-35.4	0	0	0	110.8	L331 G346 S356	L331-P354 HydrophobicContact CD1-CB 4.43Å; G346-P354 WeakPolarHBondContact O-CB 3.13Å; P354-S356 PolarHBondContact O-N 3.35Å
355	W	69.3	Low	75.3	Confident	93 Å²	93	82.8 Å²	82.8	35%	0.352	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-57.5	126.8	179.5	-83.5	36.8	0	0	0	111.7	G346 K359 K360 W363	G346-W355 PolarHBondContact O-N 2.97Å; W355-K359 HydrophobicContact CD2-CB 4.15Å; W355-K359 VanDerWaalsContact CE3-C 3.45Å; W355-K359 HydrophobicContact CE3-CB 3.56Å; W355-K359 HydrophobicContact CZ3-CB 4.02Å; W355-K359 VanDerWaalsContact CZ3-O 3.31Å; W355-K359 WeakPolarHBondContact CZ3-O 3.36Å; W355-K360 HydrophobicContact CB-CD 4.37Å; W355-K360 HydrophobicContact CB-CG 3.57Å; W355-K360 WeakPolarHBondContact O-CE 3.14Å; W355-W363 HydrophobicContact CE3-CB 4.43Å; W355-W363 HydrophobicContact CH2-CB 3.91Å; W355-W363 HydrophobicContact CH2-CG 4.1Å; W355-W363 HydrophobicContact CZ3-CB 3.42Å; W355-W363 VanDerWaalsContact CZ3-CB 3.42Å; W355-W363 HydrophobicContact CZ3-CG 4.01Å
356	S	72.4	Confident	76.5	Confident	52 Å²	52	83.1 Å²	83.1	36%	0.364	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-52.2	144.8	167.9	170.6	0	0	0	0	110.7	P354 K358 K359 K360	P354-S356 PolarHBondContact O-N 3.35Å; S356-K358 PolarHBondContact O-N 3.37Å; S356-K358 VanDerWaalsContact O-N 3.13Å; S356-K359 WeakPolarHBondContact O-CA 3.38Å; S356-K359 PolarHBondContact O-N 2.73Å; S356-K360 PolarHBondContact O-N 3.34Å
357	R	75.6	Confident	77.3	Confident	151 Å²	151	85.1 Å²	85.1	57%	0.57	41%	0.412	S	S	*	.	H	α-helix	trans	-50	-40.6	179.7	-166.9	-173.9	-65.8	145.2	-0.5	111.8	K359 K360 I361 E473	R357-K359 PolarHBondContact O-N 2.77Å; R357-K360 PolarHBondContact O-N 2.8Å; R357-I361 HydrophobicContact CG-CD1 4.05Å; R357-I361 WeakPolarHBondContact O-CG1 3.42Å; R357-I361 PolarHBondContact O-N 3.47Å; R357-E473 PolarHBondContact NH1-O 3.42Å
358	K	80.1	Confident	77.4	Confident	84 Å²	84	87.4 Å²	87.4	37%	0.365	42%	0.424	S	S	.	.	H	α-helix	trans	-57.1	-47.7	175	-65.3	168.2	176.8	165.9	0	112	S356 L362 D475 D476	S356-K358 PolarHBondContact O-N 3.37Å; S356-K358 VanDerWaalsContact O-N 3.13Å; K358-L362 WeakPolarHBondContact O-CB 3.36Å; K358-L362 PolarHBondContact O-N 2.98Å; K358-D475 PolarHBondContact NZ-O 3.14Å; K358-D476 IonicContact NZ-OD1 3.02Å; K358-D476 PolarHBondContact NZ-OD1 3.44Å
359	K	80	Confident	77.9	Confident	133 Å²	133	90.1 Å²	90.1	58%	0.578	44%	0.44	S	S	*	.	H	α-helix	trans	-68.4	-41.6	177.6	-64.6	-172.4	177.6	-178	0	111.9	W355 S356 R357 I361 L362 W363	W355-K359 HydrophobicContact CD2-CB 4.15Å; W355-K359 VanDerWaalsContact CE3-C 3.45Å; W355-K359 HydrophobicContact CE3-CB 3.56Å; W355-K359 HydrophobicContact CZ3-CB 4.02Å; W355-K359 VanDerWaalsContact CZ3-O 3.31Å; W355-K359 WeakPolarHBondContact CZ3-O 3.36Å; S356-K359 WeakPolarHBondContact O-CA 3.38Å; S356-K359 PolarHBondContact O-N 2.73Å; R357-K359 PolarHBondContact O-N 2.77Å; K359-I361 PolarHBondContact O-N 2.86Å; K359-L362 PolarHBondContact O-N 2.94Å; K359-W363 PolarHBondContact O-N 3.07Å
360	K	76	Confident	78.2	Confident	57 Å²	57	88.5 Å²	88.5	25%	0.248	44%	0.443	C	S	.	.	H	α-helix	trans	-58.4	-48.3	177.4	-63.8	-162.2	-166.8	-166.5	0	111	S345 W355 S356 R357 L362 W363 Q364	S345-K360 PolarHBondContact O-NZ 3.31Å; W355-K360 HydrophobicContact CB-CD 4.37Å; W355-K360 HydrophobicContact CB-CG 3.57Å; W355-K360 WeakPolarHBondContact O-CE 3.14Å; S356-K360 PolarHBondContact O-N 3.34Å; R357-K360 PolarHBondContact O-N 2.8Å; K360-L362 PolarHBondContact O-N 3.15Å; K360-W363 PolarHBondContact O-N 2.75Å; K360-Q364 WeakPolarHBondContact O-CB 3.09Å; K360-Q364 VanDerWaalsContact O-CD 3.23Å; K360-Q364 WeakPolarHBondContact O-CG 3.18Å; K360-Q364 PolarHBondContact O-N 3.28Å
361	I	78.6	Confident	78.5	Confident	96 Å²	96	81.9 Å²	81.9	49%	0.492	42%	0.423	S	S	.	.	H	α-helix	trans	-61.6	-43.5	176.9	-67.3	166.9	0	0	0	111	R357 K359 W363 Q364 L365	R357-I361 HydrophobicContact CG-CD1 4.05Å; R357-I361 WeakPolarHBondContact O-CG1 3.42Å; R357-I361 PolarHBondContact O-N 3.47Å; K359-I361 PolarHBondContact O-N 2.86Å; I361-W363 PolarHBondContact O-N 3.09Å; I361-Q364 PolarHBondContact O-N 2.86Å; I361-L365 VanDerWaalsContact O-CB 3.28Å; I361-L365 WeakPolarHBondContact O-CB 3.44Å; I361-L365 PolarHBondContact O-N 3.25Å
362	L	82.4	Confident	79	Confident	123 Å²	123	82.2 Å²	82.2	64%	0.644	42%	0.42	S	S	*	.	H	α-helix	trans	-61.5	-42.8	-179.8	-175.7	63.2	0	0	0	113	K358 K359 K360 G366	K358-L362 WeakPolarHBondContact O-CB 3.36Å; K358-L362 PolarHBondContact O-N 2.98Å; K359-L362 PolarHBondContact O-N 2.94Å; K360-L362 PolarHBondContact O-N 3.15Å; L362-G366 PolarHBondContact O-N 3.22Å
363	W	79	Confident	79.9	Confident	112 Å²	112	79.7 Å²	79.7	42%	0.424	42%	0.417	S	S	.	.	H	α-helix	trans	-76.6	-32.7	177.4	174.2	89.2	0	0	0	112.9	P344 W355 K359 K360 I361 G366 T367	P344-W363 HydrophobicContact CB-CZ3 4.21Å; P344-W363 HydrophobicContact CG-CZ3 4.14Å; W355-W363 HydrophobicContact CE3-CB 4.43Å; W355-W363 HydrophobicContact CH2-CB 3.91Å; W355-W363 HydrophobicContact CH2-CG 4.1Å; W355-W363 HydrophobicContact CZ3-CB 3.42Å; W355-W363 VanDerWaalsContact CZ3-CB 3.42Å; W355-W363 HydrophobicContact CZ3-CG 4.01Å; K359-W363 PolarHBondContact O-N 3.07Å; K360-W363 PolarHBondContact O-N 2.75Å; I361-W363 PolarHBondContact O-N 3.09Å; W363-G366 PolarHBondContact O-N 2.7Å; W363-T367 WeakPolarHBondContact O-CB 3.07Å; W363-T367 PolarHBondContact O-N 2.85Å; W363-T367 PolarHBondContact O-OG1 2.59Å
364	Q	75.1	Confident	80.8	Confident	44 Å²	44	75 Å²	75	21%	0.206	41%	0.405	C	S	.	.	H	α-helix	trans	-62.1	-46.1	170.3	-72.9	160.3	5.3	0	0	110.8	K360 I361 T367 L368 L454	K360-Q364 WeakPolarHBondContact O-CB 3.09Å; K360-Q364 VanDerWaalsContact O-CD 3.23Å; K360-Q364 WeakPolarHBondContact O-CG 3.18Å; K360-Q364 PolarHBondContact O-N 3.28Å; I361-Q364 PolarHBondContact O-N 2.86Å; Q364-T367 PolarHBondContact O-N 2.79Å; Q364-L368 VanDerWaalsContact O-CB 3.26Å; Q364-L368 WeakPolarHBondContact O-CB 3.44Å; Q364-L368 PolarHBondContact O-N 2.69Å; Q364-L454 HydrophobicContact CB-CD1 4.37Å; Q364-L454 HydrophobicContact CG-CD1 3.94Å; Q364-L454 HydrophobicContact CG-CD2 4.19Å; Q364-L454 VanDerWaalsContact NE2-CD2 3.33Å
365	L	82.7	Confident	81.6	Confident	94 Å²	94	74 Å²	74	49%	0.492	40%	0.396	S	S	.	.	H	α-helix	trans	-64.8	-44.2	175.5	-175.5	63.3	0	0	0	111.7	I361 T367 L368 V369	I361-L365 VanDerWaalsContact O-CB 3.28Å; I361-L365 WeakPolarHBondContact O-CB 3.44Å; I361-L365 PolarHBondContact O-N 3.25Å; L365-T367 VanDerWaalsContact C-N 3.29Å; L365-T367 PolarHBondContact O-N 3.41Å; L365-L368 PolarHBondContact O-N 2.7Å; L365-V369 HydrophobicContact CD1-CG2 4.09Å; L365-V369 HydrophobicContact CG-CG2 4.48Å; L365-V369 WeakPolarHBondContact O-CB 2.99Å; L365-V369 WeakPolarHBondContact O-CG2 3.21Å; L365-V369 PolarHBondContact O-N 3.23Å
366	G	85.3	Confident	82.5	Confident	46 Å²	46	72.6 Å²	72.6	47%	0.474	41%	0.405	S	S	.	.	H	α-helix	trans	-59.5	-37.1	174.2	0	0	0	0	0	113.1	L362 W363 G370	L362-G366 PolarHBondContact O-N 3.22Å; W363-G366 PolarHBondContact O-N 2.7Å; G366-G370 VanDerWaalsContact O-CA 3.32Å; G366-G370 WeakPolarHBondContact O-CA 3.47Å; G366-G370 PolarHBondContact O-N 3.17Å
367	T	81.2	Confident	83.5	Confident	56 Å²	56	75.3 Å²	75.3	34%	0.344	41%	0.414	S	S	.	.	H	α-helix	trans	-71.7	-43.2	174	-53.7	0	0	0	0	111.4	W363 Q364 L365 V369 G370 A371	W363-T367 WeakPolarHBondContact O-CB 3.07Å; W363-T367 PolarHBondContact O-N 2.85Å; W363-T367 PolarHBondContact O-OG1 2.59Å; Q364-T367 PolarHBondContact O-N 2.79Å; L365-T367 VanDerWaalsContact C-N 3.29Å; L365-T367 PolarHBondContact O-N 3.41Å; T367-V369 VanDerWaalsContact C-N 3.34Å; T367-V369 PolarHBondContact O-N 2.95Å; T367-G370 PolarHBondContact O-N 2.76Å; T367-A371 WeakPolarHBondContact O-CB 3.35Å; T367-A371 PolarHBondContact O-N 2.68Å
368	L	82.3	Confident	84.2	Confident	59 Å²	59	73.5 Å²	73.5	31%	0.309	42%	0.415	S	S	.	.	H	α-helix	trans	-65	-35.1	-179.6	-169.7	71	0	0	0	112.9	Q364 L365 P372 Y447	Q364-L368 VanDerWaalsContact O-CB 3.26Å; Q364-L368 WeakPolarHBondContact O-CB 3.44Å; Q364-L368 PolarHBondContact O-N 2.69Å; L365-L368 PolarHBondContact O-N 2.7Å; L368-P372 WeakPolarHBondContact O-CD 3.41Å; L368-P372 WeakPolarHBondContact O-CG 3.33Å; L368-Y447 HydrophobicContact CD1-CD1 3.57Å; L368-Y447 HydrophobicContact CD1-CE1 3.47Å; L368-Y447 VanDerWaalsContact CD1-CE1 3.47Å; L368-Y447 HydrophobicContact CD1-CG 4.48Å; L368-Y447 HydrophobicContact CG-CD1 4.5Å; L368-Y447 HydrophobicContact CG-CE1 3.96Å; L368-Y447 PolarHBondContact O-OH 3.27Å
369	V	87.5	Confident	84.7	Confident	92 Å²	92	70.5 Å²	70.5	56%	0.558	41%	0.406	S	S	*	.	H	α-helix	trans	-88.3	-36.2	177.2	176.5	0	0	0	0	111.5	L365 T367 P372	L365-V369 HydrophobicContact CD1-CG2 4.09Å; L365-V369 HydrophobicContact CG-CG2 4.48Å; L365-V369 WeakPolarHBondContact O-CB 2.99Å; L365-V369 WeakPolarHBondContact O-CG2 3.21Å; L365-V369 PolarHBondContact O-N 3.23Å; T367-V369 VanDerWaalsContact C-N 3.34Å; T367-V369 PolarHBondContact O-N 2.95Å; V369-P372 WeakPolarHBondContact O-CD 3.43Å
370	G	87.5	Confident	85.3	Confident	37 Å²	37	66.3 Å²	66.3	38%	0.381	40%	0.401	S	S	.	.	H	α-helix	trans	-75.5	-35.3	-178.7	0	0	0	0	0	114.2	G366 T367 V373 G374	G366-G370 VanDerWaalsContact O-CA 3.32Å; G366-G370 WeakPolarHBondContact O-CA 3.47Å; G366-G370 PolarHBondContact O-N 3.17Å; T367-G370 PolarHBondContact O-N 2.76Å; G370-V373 PolarHBondContact O-N 3.08Å; G370-G374 PolarHBondContact O-N 2.94Å
371	A	85.8	Confident	86.1	Confident	24 Å²	24	69.2 Å²	69.2	20%	0.198	42%	0.417	C	S	.	.	H	α-helix	trans	-63.1	-44.4	-178	0	0	0	0	0	113.8	T367 V373 G374 I375 V446	T367-A371 WeakPolarHBondContact O-CB 3.35Å; T367-A371 PolarHBondContact O-N 2.68Å; A371-V373 VanDerWaalsContact C-N 3.34Å; A371-V373 PolarHBondContact O-N 3.02Å; A371-G374 PolarHBondContact O-N 3.27Å; A371-I375 WeakPolarHBondContact O-CB 3.31Å; A371-I375 WeakPolarHBondContact O-CD1 3.13Å; A371-I375 WeakPolarHBondContact O-CG1 3.34Å; A371-I375 PolarHBondContact O-N 3.14Å; A371-V446 HydrophobicContact CB-CG1 3.92Å; A371-V446 HydrophobicContact CB-CG2 4.16Å
372	P	85.8	Confident	86.7	Confident	35 Å²	35	66.8 Å²	66.8	23%	0.227	41%	0.412	C	S	.	.	H	α-helix	trans	-58.8	-42.4	173	-22.9	31.2	0	0	0	113.2	L368 V369 I375 A376 Y447	L368-P372 WeakPolarHBondContact O-CD 3.41Å; L368-P372 WeakPolarHBondContact O-CG 3.33Å; V369-P372 WeakPolarHBondContact O-CD 3.43Å; P372-I375 PolarHBondContact O-N 2.98Å; P372-A376 VanDerWaalsContact O-CB 3.3Å; P372-A376 WeakPolarHBondContact O-CB 3.42Å; P372-A376 PolarHBondContact O-N 3.43Å; P372-Y447 HydrophobicContact CG-CE2 4.03Å; P372-Y447 WeakPolarHBondContact CG-OH 3.39Å
373	V	90.1	Very high	87.3	Confident	96 Å²	96	63.6 Å²	63.6	58%	0.582	40%	0.395	S	S	*	.	H	α-helix	trans	-65.9	-43.1	178.7	179	0	0	0	0	110.5	G370 A371 A376 L377	G370-V373 PolarHBondContact O-N 3.08Å; A371-V373 VanDerWaalsContact C-N 3.34Å; A371-V373 PolarHBondContact O-N 3.02Å; V373-A376 PolarHBondContact O-N 3.15Å; V373-L377 VanDerWaalsContact O-CB 3.31Å; V373-L377 WeakPolarHBondContact O-CB 3.37Å; V373-L377 PolarHBondContact O-N 3.11Å
374	G	89	Confident	88	Confident	30 Å²	30	61.2 Å²	61.2	31%	0.309	39%	0.394	S	S	.	.	H	α-helix	trans	-62.9	-45.5	174.3	0	0	0	0	0	112.9	G370 A371 L377 I378	G370-G374 PolarHBondContact O-N 2.94Å; A371-G374 PolarHBondContact O-N 3.27Å; G374-L377 PolarHBondContact O-N 3.22Å; G374-I378 WeakPolarHBondContact O-CB 3.31Å; G374-I378 WeakPolarHBondContact O-CD1 3.43Å; G374-I378 WeakPolarHBondContact O-CG1 3.22Å; G374-I378 PolarHBondContact O-N 2.76Å
375	I	88.1	Confident	88.9	Confident	39 Å²	39	62 Å²	62	20%	0.2	41%	0.408	C	S	.	.	H	α-helix	trans	-61.5	-44.7	176.3	-70	163.3	0	0	0	110.5	A371 P372 I378 A379 V439 M442 L443	A371-I375 WeakPolarHBondContact O-CB 3.31Å; A371-I375 WeakPolarHBondContact O-CD1 3.13Å; A371-I375 WeakPolarHBondContact O-CG1 3.34Å; A371-I375 PolarHBondContact O-N 3.14Å; P372-I375 PolarHBondContact O-N 2.98Å; I375-I378 PolarHBondContact O-N 3.48Å; I375-A379 VanDerWaalsContact O-CB 3.25Å; I375-A379 WeakPolarHBondContact O-CB 3.39Å; I375-A379 PolarHBondContact O-N 2.76Å; I375-V439 HydrophobicContact CG2-CG1 4.29Å; I375-V439 HydrophobicContact CG2-CG2 4.11Å; I375-M442 HydrophobicContact CD1-CB 4.07Å; I375-L443 HydrophobicContact CD1-CD2 4.41Å
376	A	88.7	Confident	89.4	Confident	65 Å²	65	61.2 Å²	61.2	54%	0.537	40%	0.403	S	S	.	.	H	α-helix	trans	-64	-42.5	177.8	0	0	0	0	0	112.4	P372 V373 G380	P372-A376 VanDerWaalsContact O-CB 3.3Å; P372-A376 WeakPolarHBondContact O-CB 3.42Å; P372-A376 PolarHBondContact O-N 3.43Å; V373-A376 PolarHBondContact O-N 3.15Å; A376-G380 PolarHBondContact O-N 3.45Å
377	L	92.9	Very high	89.9	Confident	108 Å²	108	62 Å²	62	57%	0.565	40%	0.396	S	S	*	.	H	α-helix	trans	-65.7	-45.7	177	-173.6	154.4	0	0	0	111.5	V373 G374 G380 I381	V373-L377 VanDerWaalsContact O-CB 3.31Å; V373-L377 WeakPolarHBondContact O-CB 3.37Å; V373-L377 PolarHBondContact O-N 3.11Å; G374-L377 PolarHBondContact O-N 3.22Å; L377-G380 PolarHBondContact O-N 3.44Å; L377-I381 HydrophobicContact CD2-CD1 3.74Å; L377-I381 WeakPolarHBondContact O-CG1 3.43Å; L377-I381 PolarHBondContact O-N 2.95Å; L377-I381 VanDerWaalsContact O-N 3.13Å
378	I	91.1	Very high	90.6	Very high	114 Å²	114	64.4 Å²	64.4	59%	0.585	41%	0.405	S	S	*	.	H	α-helix	trans	-62.9	-45	177.1	-69.5	165.3	0	0	0	110.5	G374 I375 G380 I381 A382	G374-I378 WeakPolarHBondContact O-CB 3.31Å; G374-I378 WeakPolarHBondContact O-CD1 3.43Å; G374-I378 WeakPolarHBondContact O-CG1 3.22Å; G374-I378 PolarHBondContact O-N 2.76Å; I375-I378 PolarHBondContact O-N 3.48Å; I378-G380 PolarHBondContact O-N 3.27Å; I378-I381 PolarHBondContact O-N 3.13Å; I378-A382 WeakPolarHBondContact O-CB 3.4Å; I378-A382 PolarHBondContact O-N 3.21Å
379	A	89.2	Confident	91.2	Very high	20 Å²	20	63.1 Å²	63.1	17%	0.165	41%	0.406	C	S	.	.	H	α-helix	trans	-62.1	-42.8	175.7	0	0	0	0	0	111.8	I375 I381 A382 I383	I375-A379 VanDerWaalsContact O-CB 3.25Å; I375-A379 WeakPolarHBondContact O-CB 3.39Å; I375-A379 PolarHBondContact O-N 2.76Å; A379-I381 PolarHBondContact O-N 3.5Å; A379-A382 PolarHBondContact O-N 2.95Å; A379-I383 HydrophobicContact CB-CD1 4.3Å; A379-I383 WeakPolarHBondContact O-CB 3.36Å; A379-I383 WeakPolarHBondContact O-CD1 3.22Å; A379-I383 WeakPolarHBondContact O-CG1 3.07Å; A379-I383 PolarHBondContact O-N 3.01Å
380	G	92.2	Very high	91.6	Very high	46 Å²	46	60.5 Å²	60.5	47%	0.474	39%	0.388	S	S	.	.	H	α-helix	trans	-60.6	-29.1	177.6	0	0	0	0	0	114.3	A376 L377 I378 P384	A376-G380 PolarHBondContact O-N 3.45Å; L377-G380 PolarHBondContact O-N 3.44Å; I378-G380 PolarHBondContact O-N 3.27Å; G380-P384 WeakPolarHBondContact O-CD 3.46Å; G380-P384 WeakPolarHBondContact O-CG 3.32Å
381	I	93.9	Very high	91.9	Very high	117 Å²	117	59.4 Å²	59.4	60%	0.6	37%	0.374	S	S	*	.	H	α-helix	trans	-87.5	-42.4	174	-62.8	171.8	0	0	0	111.3	L377 I378 A379 P384 A385	L377-I381 HydrophobicContact CD2-CD1 3.74Å; L377-I381 WeakPolarHBondContact O-CG1 3.43Å; L377-I381 PolarHBondContact O-N 2.95Å; L377-I381 VanDerWaalsContact O-N 3.13Å; I378-I381 PolarHBondContact O-N 3.13Å; A379-I381 PolarHBondContact O-N 3.5Å; I381-P384 WeakPolarHBondContact O-CD 3.34Å; I381-A385 WeakPolarHBondContact O-CB 3.26Å; I381-A385 PolarHBondContact O-N 3.32Å
382	A	91.5	Very high	92.4	Very high	45 Å²	45	60.4 Å²	60.4	37%	0.372	38%	0.378	S	S	.	.	H	α-helix	trans	-68.4	-36	-175.5	0	0	0	0	0	113.2	I378 A379 A385 M386	I378-A382 WeakPolarHBondContact O-CB 3.4Å; I378-A382 PolarHBondContact O-N 3.21Å; A379-A382 PolarHBondContact O-N 2.95Å; A382-A385 PolarHBondContact O-N 3.49Å; A382-M386 WeakPolarHBondContact O-CB 3.28Å; A382-M386 VanDerWaalsContact O-CG 3.26Å; A382-M386 WeakPolarHBondContact O-CG 3.45Å; A382-M386 PolarHBondContact O-N 3.13Å
383	I	94	Very high	92.9	Very high	56 Å²	56	63.9 Å²	63.9	29%	0.287	39%	0.387	S	S	.	.	H	α-helix	trans	-64.1	-54	-178.3	-67.5	162	0	0	0	111.3	A379 A385 M386 I387 V435	A379-I383 HydrophobicContact CB-CD1 4.3Å; A379-I383 WeakPolarHBondContact O-CB 3.36Å; A379-I383 WeakPolarHBondContact O-CD1 3.22Å; A379-I383 WeakPolarHBondContact O-CG1 3.07Å; A379-I383 PolarHBondContact O-N 3.01Å; I383-A385 VanDerWaalsContact C-N 3.33Å; I383-A385 PolarHBondContact O-N 2.9Å; I383-M386 PolarHBondContact O-N 3.39Å; I383-I387 HydrophobicContact CG2-CD1 3.63Å; I383-I387 HydrophobicContact CG2-CG1 4.46Å; I383-I387 WeakPolarHBondContact O-CB 3.02Å; I383-I387 VanDerWaalsContact O-CG1 3.29Å; I383-I387 WeakPolarHBondContact O-CG1 3.48Å; I383-I387 PolarHBondContact O-N 3.18Å; I383-V435 HydrophobicContact CD1-CG2 3.71Å; I383-V435 HydrophobicContact CG1-CG2 3.69Å
384	P	94.1	Very high	93.1	Very high	63 Å²	63	61 Å²	61	41%	0.409	37%	0.37	S	S	.	.	H	α-helix	trans	-59	-41.9	173.3	-24.5	34.4	0	0	0	113.1	G380 I381 M386 I387 I388	G380-P384 WeakPolarHBondContact O-CD 3.46Å; G380-P384 WeakPolarHBondContact O-CG 3.32Å; I381-P384 WeakPolarHBondContact O-CD 3.34Å; P384-M386 VanDerWaalsContact C-N 3.31Å; P384-M386 PolarHBondContact O-N 3.49Å; P384-I387 PolarHBondContact O-N 2.67Å; P384-I388 WeakPolarHBondContact O-CB 3.27Å; P384-I388 WeakPolarHBondContact O-CG1 3.15Å; P384-I388 PolarHBondContact O-N 3.22Å
385	A	94.9	Very high	93.4	Very high	60 Å²	60	60.1 Å²	60.1	50%	0.496	36%	0.36	S	S	.	.	H	α-helix	trans	-61.4	-37.7	179.5	0	0	0	0	0	112.5	I381 A382 I383 G389	I381-A385 WeakPolarHBondContact O-CB 3.26Å; I381-A385 PolarHBondContact O-N 3.32Å; A382-A385 PolarHBondContact O-N 3.49Å; I383-A385 VanDerWaalsContact C-N 3.33Å; I383-A385 PolarHBondContact O-N 2.9Å; A385-G389 WeakPolarHBondContact O-CA 3.39Å; A385-G389 PolarHBondContact O-N 3.02Å
386	M	92.8	Very high	93.6	Very high	78 Å²	78	61.8 Å²	61.8	38%	0.384	36%	0.364	S	S	.	.	H	α-helix	trans	-75.5	-42.7	175.1	-72.4	-73.9	-86.6	0	0	112.3	A382 I383 P384 I388 I390	A382-M386 WeakPolarHBondContact O-CB 3.28Å; A382-M386 VanDerWaalsContact O-CG 3.26Å; A382-M386 WeakPolarHBondContact O-CG 3.45Å; A382-M386 PolarHBondContact O-N 3.13Å; I383-M386 PolarHBondContact O-N 3.39Å; P384-M386 VanDerWaalsContact C-N 3.31Å; P384-M386 PolarHBondContact O-N 3.49Å; M386-I388 PolarHBondContact O-N 3.29Å; M386-I390 HydrophobicContact CB-CD1 4.3Å; M386-I390 HydrophobicContact CE-CD1 3.85Å; M386-I390 WeakPolarHBondContact O-CB 3.31Å; M386-I390 WeakPolarHBondContact O-CG1 3.42Å; M386-I390 PolarHBondContact O-N 3.32Å; M386-I390 HydrophobicContact SD-CD1 4.13Å; M386-I390 HydrophobicContact SD-CG1 4.45Å
387	I	95	Very high	93.9	Very high	63 Å²	63	61.6 Å²	61.6	32%	0.323	35%	0.351	S	S	.	.	H	α-helix	trans	-61.5	-43.3	-179.1	-72.6	170.5	0	0	0	111.4	I383 P384 P391 S427 A431	I383-I387 HydrophobicContact CG2-CD1 3.63Å; I383-I387 HydrophobicContact CG2-CG1 4.46Å; I383-I387 WeakPolarHBondContact O-CB 3.02Å; I383-I387 VanDerWaalsContact O-CG1 3.29Å; I383-I387 WeakPolarHBondContact O-CG1 3.48Å; I383-I387 PolarHBondContact O-N 3.18Å; P384-I387 PolarHBondContact O-N 2.67Å; I387-P391 WeakPolarHBondContact O-CD 3.49Å; I387-P391 WeakPolarHBondContact O-CG 3.25Å; I387-S427 PolarHBondContact O-OG 2.9Å; I387-A431 HydrophobicContact CG1-CB 4.22Å
388	I	95.3	Very high	93.8	Very high	106 Å²	106	58.2 Å²	58.2	54%	0.544	33%	0.333	S	S	.	.	H	α-helix	trans	-83.9	-42.9	178.5	-59.6	169.9	0	0	0	110.9	P384 M386 I390 P391 V392	P384-I388 WeakPolarHBondContact O-CB 3.27Å; P384-I388 WeakPolarHBondContact O-CG1 3.15Å; P384-I388 PolarHBondContact O-N 3.22Å; M386-I388 PolarHBondContact O-N 3.29Å; I388-I390 PolarHBondContact O-N 3.04Å; I388-P391 WeakPolarHBondContact O-CD 3.27Å; I388-V392 HydrophobicContact CG2-CG2 4.35Å; I388-V392 WeakPolarHBondContact O-CB 3.42Å; I388-V392 VanDerWaalsContact O-CG2 3.23Å; I388-V392 WeakPolarHBondContact O-CG2 3.43Å; I388-V392 PolarHBondContact O-N 3.06Å
389	G	95.6	Very high	93.7	Very high	31 Å²	31	55.7 Å²	55.7	32%	0.32	32%	0.319	S	S	.	.	H	α-helix	trans	-69	-32.5	-173.7	0	0	0	0	0	114.2	A385 Y393	A385-G389 WeakPolarHBondContact O-CA 3.39Å; A385-G389 PolarHBondContact O-N 3.02Å; G389-Y393 WeakPolarHBondContact O-CB 3.41Å; G389-Y393 PolarHBondContact O-N 2.69Å
390	I	95.2	Very high	93.9	Very high	38 Å²	38	57.8 Å²	57.8	20%	0.195	33%	0.328	C	S	.	.	H	α-helix	trans	-68.7	-50.1	178.7	-70.8	164.6	0	0	0	112	M386 I388 V392 Y393 V394	M386-I390 HydrophobicContact CB-CD1 4.3Å; M386-I390 HydrophobicContact CE-CD1 3.85Å; M386-I390 WeakPolarHBondContact O-CB 3.31Å; M386-I390 WeakPolarHBondContact O-CG1 3.42Å; M386-I390 PolarHBondContact O-N 3.32Å; M386-I390 HydrophobicContact SD-CD1 4.13Å; M386-I390 HydrophobicContact SD-CG1 4.45Å; I388-I390 PolarHBondContact O-N 3.04Å; I390-V392 VanDerWaalsContact C-N 3.32Å; I390-V392 PolarHBondContact O-N 3.41Å; I390-Y393 CarbonylContact O-C 3.43Å; I390-Y393 WeakPolarHBondContact O-CA 3.37Å; I390-Y393 PolarHBondContact O-N 3.37Å; I390-Y393 VanDerWaalsContact O-N 3.09Å; I390-V394 WeakPolarHBondContact O-CG2 3.45Å; I390-V394 PolarHBondContact O-N 2.98Å
391	P	95.6	Very high	93.6	Very high	14 Å²	14	60.1 Å²	60.1	9%	0.091	32%	0.322	C	S	.	.	H	α-helix	trans	-62.7	-38.5	176.4	-24.7	34.7	0	0	0	113.7	I387 I388 V394 G395 V420 S423 V424	I387-P391 WeakPolarHBondContact O-CD 3.49Å; I387-P391 WeakPolarHBondContact O-CG 3.25Å; I388-P391 WeakPolarHBondContact O-CD 3.27Å; P391-V394 PolarHBondContact O-N 3.06Å; P391-G395 PolarHBondContact O-N 3.34Å; P391-V420 HydrophobicContact CB-CG1 4.5Å; P391-S423 VanDerWaalsContact CA-OG 3.23Å; P391-S423 WeakPolarHBondContact CA-OG 3.41Å; P391-S423 WeakPolarHBondContact CB-OG 3.39Å; P391-V424 HydrophobicContact CB-CG2 3.71Å; P391-V424 HydrophobicContact CG-CB 4.42Å; P391-V424 HydrophobicContact CG-CG2 3.71Å
392	V	95.4	Very high	93.3	Very high	45 Å²	45	57.6 Å²	57.6	27%	0.273	31%	0.305	S	S	.	.	H	α-helix	trans	-55.5	-53	168.3	167	0	0	0	0	109.8	I388 I390 V394 G395 E730 F731	I388-V392 HydrophobicContact CG2-CG2 4.35Å; I388-V392 WeakPolarHBondContact O-CB 3.42Å; I388-V392 VanDerWaalsContact O-CG2 3.23Å; I388-V392 WeakPolarHBondContact O-CG2 3.43Å; I388-V392 PolarHBondContact O-N 3.06Å; I390-V392 VanDerWaalsContact C-N 3.32Å; I390-V392 PolarHBondContact O-N 3.41Å; V392-V394 VanDerWaalsContact C-N 3.28Å; V392-V394 PolarHBondContact O-N 3.38Å; V392-G395 PolarHBondContact O-N 3.38Å; V392-E730 HydrophobicContact CG1-CG 4.03Å; V392-E730 WeakPolarHBondContact CG1-OE2 3.36Å; V392-F731 WeakPolarHBondContact O-CE2 3.3Å; V392-F731 WeakPolarHBondContact O-CZ 3.48Å
393	Y	95.9	Very high	92.7	Very high	107 Å²	107	61.1 Å²	61.1	42%	0.42	31%	0.314	S	S	.	.	H	α-helix	trans	-66.2	-14.9	179.1	-178.6	-96	0	0	0	115.4	G389 I390 K397 F731 S732	G389-Y393 WeakPolarHBondContact O-CB 3.41Å; G389-Y393 PolarHBondContact O-N 2.69Å; I390-Y393 CarbonylContact O-C 3.43Å; I390-Y393 WeakPolarHBondContact O-CA 3.37Å; I390-Y393 PolarHBondContact O-N 3.37Å; I390-Y393 VanDerWaalsContact O-N 3.09Å; Y393-K397 HydrophobicContact CE1-CD 4.15Å; Y393-K397 PolarHBondContact OH-NZ 2.57Å; Y393-F731 HydrophobicContact CD2-CE1 4.45Å; Y393-F731 HydrophobicContact CD2-CZ 4.43Å; Y393-F731 WeakPolarHBondContact O-CE1 3.39Å; Y393-F731 WeakPolarHBondContact O-CZ 3.16Å; Y393-S732 WeakPolarHBondContact CE2-OG 3.28Å; Y393-S732 VanDerWaalsContact CZ-OG 3.23Å; Y393-S732 PolarHBondContact OH-OG 3.02Å; Y393-S732 VanDerWaalsContact OH-OG 3.06Å
394	V	95.3	Very high	91.9	Very high	37 Å²	37	62.4 Å²	62.4	22%	0.224	34%	0.341	C	S	.	.	H	α-helix	trans	-89	-44.1	170	172.1	0	0	0	0	111.3	I390 P391 V392 R396 K397 I398	I390-V394 WeakPolarHBondContact O-CG2 3.45Å; I390-V394 PolarHBondContact O-N 2.98Å; P391-V394 PolarHBondContact O-N 3.06Å; V392-V394 VanDerWaalsContact C-N 3.28Å; V392-V394 PolarHBondContact O-N 3.38Å; V394-R396 PolarHBondContact O-N 2.89Å; V394-K397 VanDerWaalsContact O-CB 3.27Å; V394-K397 WeakPolarHBondContact O-CB 3.45Å; V394-K397 PolarHBondContact O-N 3.2Å; V394-I398 HydrophobicContact CG1-CD1 3.72Å; V394-I398 HydrophobicContact CG1-CG1 4.44Å; V394-I398 PolarHBondContact O-N 2.73Å
395	G	93.8	Very high	91.3	Very high	10 Å²	10	65.2 Å²	65.2	10%	0.103	35%	0.347	C	S	.	.	H	α-helix	trans	-55.6	-57.9	-171.9	0	0	0	0	0	114.5	P391 V392 K397 I398 H399	P391-G395 PolarHBondContact O-N 3.34Å; V392-G395 PolarHBondContact O-N 3.38Å; G395-K397 PolarHBondContact O-N 3.3Å; G395-I398 PolarHBondContact O-N 2.85Å; G395-H399 PolarHBondContact O-N 3.45Å
396	R	93.6	Very high	90.6	Very high	74 Å²	74	71.1 Å²	71.1	28%	0.279	37%	0.37	S	S	.	.	H	α-helix	trans	-73.5	-6.7	179.6	-163.4	-165.3	-53	-156.1	-1	112.5	V394 H399 N400 S729 E730 F731	V394-R396 PolarHBondContact O-N 2.89Å; R396-H399 HydrophobicContact CB-CB 4.45Å; R396-H399 HydrophobicContact CG-CB 4.28Å; R396-H399 PolarHBondContact O-N 3.07Å; R396-N400 WeakPolarHBondContact CG-OD1 3.42Å; R396-N400 WeakPolarHBondContact O-CB 3.23Å; R396-N400 VanDerWaalsContact O-CG 3.27Å; R396-N400 PolarHBondContact O-N 3.04Å; R396-N400 PolarHBondContact O-OD1 2.87Å; R396-N400 VanDerWaalsContact O-OD1 3.08Å; R396-S729 PolarHBondContact NH1-O 2.98Å; R396-S729 VanDerWaalsContact NH1-O 3.16Å; R396-E730 IonicContact CZ-OE1 3.43Å; R396-E730 IonicContact NE-OE1 2.72Å; R396-E730 PolarHBondContact NE-OE1 3.4Å; R396-E730 VanDerWaalsContact NH2-CB 3.3Å; R396-E730 IonicContact NH2-OE1 2.88Å; R396-E730 PolarHBondContact NH2-OE1 3.18Å; R396-E730 IonicContact NH2-OE2 3.31Å; R396-E730 PolarHBondContact NH2-OE2 2.8Å; R396-F731 HydrophobicContact CB-CD1 3.75Å; R396-F731 HydrophobicContact CB-CD2 3.58Å; R396-F731 HydrophobicContact CB-CE1 3.78Å; R396-F731 HydrophobicContact CB-CE2 3.42Å; R396-F731 VanDerWaalsContact CB-CE2 3.42Å; R396-F731 HydrophobicContact CB-CG 3.73Å; R396-F731 HydrophobicContact CB-CZ 3.47Å; R396-F731 VanDerWaalsContact CB-CZ 3.47Å; R396-F731 HydrophobicContact CG-CD1 4.25Å; R396-F731 HydrophobicContact CG-CD2 4.09Å; R396-F731 HydrophobicContact CG-CE2 4.41Å; R396-F731 HydrophobicContact CG-CG 3.99Å
397	K	93.9	Very high	90.1	Very high	61 Å²	61	69.4 Å²	69.4	27%	0.265	36%	0.364	S	S	.	.	H	α-helix	trans	-74.7	-49.4	177.5	-144.2	166	177.8	170	0	107.5	Y393 V394 G395 H399 R401 F731 C733	Y393-K397 HydrophobicContact CE1-CD 4.15Å; Y393-K397 PolarHBondContact OH-NZ 2.57Å; V394-K397 VanDerWaalsContact O-CB 3.27Å; V394-K397 WeakPolarHBondContact O-CB 3.45Å; V394-K397 PolarHBondContact O-N 3.2Å; G395-K397 PolarHBondContact O-N 3.3Å; K397-H399 VanDerWaalsContact C-N 3.31Å; K397-R401 VanDerWaalsContact O-CB 3.25Å; K397-R401 WeakPolarHBondContact O-CB 3.01Å; K397-R401 WeakPolarHBondContact O-CG 3.03Å; K397-R401 PolarHBondContact O-N 3.24Å; K397-F731 HydrophobicContact CB-CD1 4.25Å; K397-F731 HydrophobicContact CB-CE1 3.59Å; K397-F731 HydrophobicContact CG-CE1 4.18Å; K397-C733 WeakPolarHBondContact CE-SG 3.33Å; K397-C733 HydrophobicContact CG-CB 4.15Å
398	I	91.8	Very high	89.7	Confident	37 Å²	37	70.2 Å²	70.2	19%	0.19	38%	0.375	C	S	.	.	H	α-helix	trans	-64.1	-40.8	174.2	-57.1	174.1	0	0	0	108.8	V394 G395 R401 Y402 A415 I416	V394-I398 HydrophobicContact CG1-CD1 3.72Å; V394-I398 HydrophobicContact CG1-CG1 4.44Å; V394-I398 PolarHBondContact O-N 2.73Å; G395-I398 PolarHBondContact O-N 2.85Å; I398-R401 PolarHBondContact O-N 3.47Å; I398-Y402 HydrophobicContact CG2-CD2 3.74Å; I398-Y402 HydrophobicContact CG2-CE2 3.65Å; I398-Y402 WeakPolarHBondContact O-CD2 3.2Å; I398-Y402 PolarHBondContact O-N 3.01Å; I398-A415 HydrophobicContact CG2-CB 4.06Å; I398-I416 HydrophobicContact CB-CG1 4.13Å; I398-I416 HydrophobicContact CG2-CB 4.41Å; I398-I416 HydrophobicContact CG2-CG1 3.68Å
399	H	89.4	Confident	89.2	Confident	61 Å²	61	73.1 Å²	73.1	28%	0.282	38%	0.384	S	S	.	.	H	α-helix	trans	-54	-63.3	172	-169.9	-87	0	0	0	112.5	G395 R396 K397 R401 Y402 E403 I416	G395-H399 PolarHBondContact O-N 3.45Å; R396-H399 HydrophobicContact CB-CB 4.45Å; R396-H399 HydrophobicContact CG-CB 4.28Å; R396-H399 PolarHBondContact O-N 3.07Å; K397-H399 VanDerWaalsContact C-N 3.31Å; H399-R401 PolarHBondContact O-N 3.04Å; H399-R401 VanDerWaalsContact O-N 3.17Å; H399-Y402 CarbonylContact O-C 3.39Å; H399-Y402 WeakPolarHBondContact O-CA 3.05Å; H399-Y402 PolarHBondContact O-N 3.3Å; H399-E403 IonicContact CE1-OE1 2.9Å; H399-E403 IonicContact CE1-OE2 3.37Å; H399-E403 PolarHBondContact CE1-OE2 2.85Å; H399-E403 IonicContact ND1-OE2 2.79Å; H399-E403 PolarHBondContact ND1-OE2 3.22Å; H399-E403 PolarHBondContact O-N 3.41Å; H399-I416 HydrophobicContact CB-CD1 4.24Å
400	N	91.7	Very high	88.8	Confident	65 Å²	65	79.6 Å²	79.6	35%	0.348	41%	0.405	S	S	.	.	H	α-helix	trans	-61.1	-30.5	-175.7	-65.1	17.6	0	0	0	111.8	R396 Y402 E403	R396-N400 WeakPolarHBondContact CG-OD1 3.42Å; R396-N400 WeakPolarHBondContact O-CB 3.23Å; R396-N400 VanDerWaalsContact O-CG 3.27Å; R396-N400 PolarHBondContact O-N 3.04Å; R396-N400 PolarHBondContact O-OD1 2.87Å; R396-N400 VanDerWaalsContact O-OD1 3.08Å; N400-Y402 VanDerWaalsContact C-N 3.27Å; N400-Y402 PolarHBondContact O-N 3.45Å; N400-E403 PolarHBondContact O-N 3.06Å
401	R	87.6	Confident	88.4	Confident	95 Å²	95	84.2 Å²	84.2	36%	0.358	42%	0.424	S	S	.	.	H	α-helix	trans	-74.7	-12.2	176.2	-68.4	-81.8	-81.1	-164.9	-2.2	114.4	K397 I398 H399 K405 S734 D735	K397-R401 VanDerWaalsContact O-CB 3.25Å; K397-R401 WeakPolarHBondContact O-CB 3.01Å; K397-R401 WeakPolarHBondContact O-CG 3.03Å; K397-R401 PolarHBondContact O-N 3.24Å; I398-R401 PolarHBondContact O-N 3.47Å; H399-R401 PolarHBondContact O-N 3.04Å; H399-R401 VanDerWaalsContact O-N 3.17Å; R401-K405 PolarHBondContact O-NZ 2.89Å; R401-S734 PolarHBondContact NH1-OG 3.25Å; R401-D735 IonicContact CZ-OD1 3.94Å; R401-D735 IonicContact CZ-OD2 2.9Å; R401-D735 VanDerWaalsContact NH1-CG 3.27Å; R401-D735 IonicContact NH1-OD1 3.19Å; R401-D735 PolarHBondContact NH1-OD1 3.48Å; R401-D735 IonicContact NH1-OD2 3.4Å; R401-D735 PolarHBondContact NH1-OD2 3.36Å; R401-D735 IonicContact NH2-OD1 3.22Å; R401-D735 PolarHBondContact NH2-OD1 3.15Å; R401-D735 IonicContact NH2-OD2 3.29Å
402	Y	85.9	Confident	88	Confident	63 Å²	63	87.3 Å²	87.3	25%	0.247	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	7.6	170.9	-72.2	-62.9	0	0	0	113.2	I398 H399 N400 G404 V407 R412 A415	I398-Y402 HydrophobicContact CG2-CD2 3.74Å; I398-Y402 HydrophobicContact CG2-CE2 3.65Å; I398-Y402 WeakPolarHBondContact O-CD2 3.2Å; I398-Y402 PolarHBondContact O-N 3.01Å; H399-Y402 CarbonylContact O-C 3.39Å; H399-Y402 WeakPolarHBondContact O-CA 3.05Å; H399-Y402 PolarHBondContact O-N 3.3Å; N400-Y402 VanDerWaalsContact C-N 3.27Å; N400-Y402 PolarHBondContact O-N 3.45Å; Y402-G404 PolarHBondContact O-N 3.49Å; Y402-V407 HydrophobicContact CD1-CB 4.36Å; Y402-V407 HydrophobicContact CD1-CG2 3.91Å; Y402-V407 HydrophobicContact CE1-CG1 4.46Å; Y402-V407 HydrophobicContact CE1-CG2 4.18Å; Y402-R412 HydrophobicContact CD2-CG 4.23Å; Y402-R412 HydrophobicContact CG-CG 4.08Å; Y402-A415 HydrophobicContact CD2-CB 4.42Å; Y402-A415 HydrophobicContact CE2-CB 3.56Å
403	E	79.9	Confident	87.7	Confident	120 Å²	120	89.6 Å²	89.6	56%	0.561	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	98.1	175.3	-169.3	154.5	-151.6	0	0	108.2	H399 N400	H399-E403 IonicContact CE1-OE1 2.9Å; H399-E403 IonicContact CE1-OE2 3.37Å; H399-E403 PolarHBondContact CE1-OE2 2.85Å; H399-E403 IonicContact ND1-OE2 2.79Å; H399-E403 PolarHBondContact ND1-OE2 3.22Å; H399-E403 PolarHBondContact O-N 3.41Å; N400-E403 PolarHBondContact O-N 3.06Å
404	G	77	Confident	87.5	Confident	82 Å²	82	90.7 Å²	90.7	85%	0.845	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.1	16.2	-172.8	0	0	0	0	0	115.9	Y402	Y402-G404 PolarHBondContact O-N 3.49Å
405	K	81.8	Confident	87.3	Confident	123 Å²	123	90.3 Å²	90.3	54%	0.535	46%	0.458	S	S	.	.	S	Bend	trans	-121.9	140.4	168.2	-68	173.7	-178.2	157.5	0	110.2	R401 V407	R401-K405 PolarHBondContact O-NZ 2.89Å; K405-V407 HydrophobicContact CB-CG2 3.81Å; K405-V407 PolarHBondContact O-N 3.45Å
406	D	79.6	Confident	87.2	Confident	183 Å²	183	91.6 Å²	91.6	98%	0.979	46%	0.462	S	S	*	.			trans	-74.4	56.3	-178.5	-60.2	-53.8	0	0	0	113.3
407	V	82.2	Confident	87.2	Confident	43 Å²	43	90.5 Å²	90.5	26%	0.261	47%	0.468	S	S	.	.			trans	-97.9	135.2	-177.8	-170.8	0	0	0	0	109.7	Y402 K405 K409 K411	Y402-V407 HydrophobicContact CD1-CB 4.36Å; Y402-V407 HydrophobicContact CD1-CG2 3.91Å; Y402-V407 HydrophobicContact CE1-CG1 4.46Å; Y402-V407 HydrophobicContact CE1-CG2 4.18Å; K405-V407 HydrophobicContact CB-CG2 3.81Å; K405-V407 PolarHBondContact O-N 3.45Å; V407-K409 PolarHBondContact O-N 3.38Å; V407-K411 HydrophobicContact CG1-CB 3.87Å; V407-K411 HydrophobicContact CG1-CD 3.9Å; V407-K411 HydrophobicContact CG1-CG 3.83Å
408	S	86.4	Confident	87.3	Confident	79 Å²	79	89.6 Å²	89.6	55%	0.552	48%	0.476	S	S	*	.			trans	-57.2	140.4	179.7	67	0	0	0	0	112	H410 K411 R412	S408-H410 PolarHBondContact O-N 2.83Å; S408-H410 VanDerWaalsContact O-N 3.14Å; S408-K411 PolarHBondContact O-N 3.35Å; S408-K411 WeakPolarHBondContact OG-CB 3.2Å; S408-R412 PolarHBondContact O-N 3.33Å; S408-R412 VanDerWaalsContact O-N 3.08Å
409	K	84.4	Confident	87.4	Confident	168 Å²	168	88.5 Å²	88.5	73%	0.73	48%	0.475	S	S	*	.	H	α-helix	trans	-51.8	-41.9	-174.5	-64.5	-179.6	-179.2	178.5	0	112.4	V407 R412 N413	V407-K409 PolarHBondContact O-N 3.38Å; K409-R412 PolarHBondContact O-N 2.78Å; K409-N413 WeakPolarHBondContact O-CB 3.35Å; K409-N413 PolarHBondContact O-N 3.02Å; K409-N413 PolarHBondContact O-OD1 3.43Å
410	H	87.6	Confident	87.7	Confident	167 Å²	167	87.9 Å²	87.9	77%	0.773	48%	0.475	S	S	*	.	H	α-helix	trans	-62.8	-43	175.5	-76.3	-71.1	0	0	0	113.5	S408 N413 L414	S408-H410 PolarHBondContact O-N 2.83Å; S408-H410 VanDerWaalsContact O-N 3.14Å; H410-N413 PolarHBondContact O-N 3.17Å; H410-L414 VanDerWaalsContact O-CB 3.22Å; H410-L414 WeakPolarHBondContact O-CB 3.46Å; H410-L414 PolarHBondContact O-N 2.89Å
411	K	87.3	Confident	87.9	Confident	134 Å²	134	89 Å²	89	58%	0.583	48%	0.484	S	S	*	.	H	α-helix	trans	-68.4	-36.8	-179.8	-178.3	170.9	178.5	178.3	0	111.9	V407 S408 A415	V407-K411 HydrophobicContact CG1-CB 3.87Å; V407-K411 HydrophobicContact CG1-CD 3.9Å; V407-K411 HydrophobicContact CG1-CG 3.83Å; S408-K411 PolarHBondContact O-N 3.35Å; S408-K411 WeakPolarHBondContact OG-CB 3.2Å; K411-A415 WeakPolarHBondContact O-CB 3.2Å; K411-A415 PolarHBondContact O-N 3.21Å; K411-A415 VanDerWaalsContact O-N 3.14Å
412	R	87.8	Confident	88.2	Confident	79 Å²	79	89.7 Å²	89.7	30%	0.298	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-50.1	171.6	-176.1	173	74.3	-176.3	9.6	111.7	Y402 S408 K409 L414 A415 I416	Y402-R412 HydrophobicContact CD2-CG 4.23Å; Y402-R412 HydrophobicContact CG-CG 4.08Å; S408-R412 PolarHBondContact O-N 3.33Å; S408-R412 VanDerWaalsContact O-N 3.08Å; K409-R412 PolarHBondContact O-N 2.78Å; R412-L414 VanDerWaalsContact C-N 3.34Å; R412-L414 PolarHBondContact O-N 2.85Å; R412-A415 PolarHBondContact O-N 2.92Å; R412-I416 HydrophobicContact CG-CD1 3.95Å; R412-I416 WeakPolarHBondContact O-CG1 3.2Å; R412-I416 PolarHBondContact O-N 3.21Å
413	N	88.8	Confident	88.7	Confident	93 Å²	93	87.1 Å²	87.1	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-39.1	-178.2	-69	12.8	0	0	0	111.8	K409 H410 I416 A417	K409-N413 WeakPolarHBondContact O-CB 3.35Å; K409-N413 PolarHBondContact O-N 3.02Å; K409-N413 PolarHBondContact O-OD1 3.43Å; H410-N413 PolarHBondContact O-N 3.17Å; N413-I416 PolarHBondContact O-N 2.9Å; N413-A417 VanDerWaalsContact O-CB 3.29Å; N413-A417 WeakPolarHBondContact O-CB 3.45Å; N413-A417 PolarHBondContact O-N 3.41Å
414	L	92.1	Very high	89.5	Confident	131 Å²	131	85.2 Å²	85.2	69%	0.686	48%	0.482	S	S	*	.	H	α-helix	trans	-62.9	-41.2	174.9	-177.3	64.5	0	0	0	112	H410 R412 G418	H410-L414 VanDerWaalsContact O-CB 3.22Å; H410-L414 WeakPolarHBondContact O-CB 3.46Å; H410-L414 PolarHBondContact O-N 2.89Å; R412-L414 VanDerWaalsContact C-N 3.34Å; R412-L414 PolarHBondContact O-N 2.85Å; L414-G418 PolarHBondContact O-N 3.01Å
415	A	91.1	Very high	90.4	Very high	29 Å²	29	86.7 Å²	86.7	24%	0.24	47%	0.47	C	S	.	.	H	α-helix	trans	-66.9	-41.2	177.3	0	0	0	0	0	112.4	I398 Y402 K411 R412 G419	I398-A415 HydrophobicContact CG2-CB 4.06Å; Y402-A415 HydrophobicContact CD2-CB 4.42Å; Y402-A415 HydrophobicContact CE2-CB 3.56Å; K411-A415 WeakPolarHBondContact O-CB 3.2Å; K411-A415 PolarHBondContact O-N 3.21Å; K411-A415 VanDerWaalsContact O-N 3.14Å; R412-A415 PolarHBondContact O-N 2.92Å; A415-G419 PolarHBondContact O-N 2.94Å
416	I	92.3	Very high	91	Very high	36 Å²	36	84 Å²	84	19%	0.185	46%	0.463	C	S	.	.	H	α-helix	trans	-65.2	-50.1	175.8	-64.2	168	0	0	0	110	I398 H399 R412 N413 G419 V420	I398-I416 HydrophobicContact CB-CG1 4.13Å; I398-I416 HydrophobicContact CG2-CB 4.41Å; I398-I416 HydrophobicContact CG2-CG1 3.68Å; H399-I416 HydrophobicContact CB-CD1 4.24Å; R412-I416 HydrophobicContact CG-CD1 3.95Å; R412-I416 WeakPolarHBondContact O-CG1 3.2Å; R412-I416 PolarHBondContact O-N 3.21Å; N413-I416 PolarHBondContact O-N 2.9Å; I416-G419 PolarHBondContact O-N 2.88Å; I416-V420 HydrophobicContact CG2-CG2 4.44Å; I416-V420 WeakPolarHBondContact O-CG2 3.45Å; I416-V420 PolarHBondContact O-N 2.86Å
417	A	93.5	Very high	91.8	Very high	51 Å²	51	75.4 Å²	75.4	42%	0.421	42%	0.417	S	S	.	.	H	α-helix	trans	-59.9	-50.5	179.9	0	0	0	0	0	111.9	N413 G419 V420 T421	N413-A417 VanDerWaalsContact O-CB 3.29Å; N413-A417 WeakPolarHBondContact O-CB 3.45Å; N413-A417 PolarHBondContact O-N 3.41Å; A417-G419 VanDerWaalsContact C-N 3.34Å; A417-G419 PolarHBondContact O-N 3.46Å; A417-V420 PolarHBondContact O-N 2.83Å; A417-T421 WeakPolarHBondContact O-CB 3.38Å; A417-T421 PolarHBondContact O-N 3.16Å; A417-T421 PolarHBondContact O-OG1 3.28Å; A417-T421 VanDerWaalsContact O-OG1 3.1Å
418	G	94.6	Very high	92.4	Very high	42 Å²	42	76.1 Å²	76.1	43%	0.433	42%	0.423	S	S	.	.	H	α-helix	trans	-61.2	-39.6	178.8	0	0	0	0	0	113.1	L414 L422	L414-G418 PolarHBondContact O-N 3.01Å; G418-L422 VanDerWaalsContact O-CB 3.3Å; G418-L422 WeakPolarHBondContact O-CB 3.32Å; G418-L422 PolarHBondContact O-N 3.36Å
419	G	94.6	Very high	92.9	Very high	15 Å²	15	76.6 Å²	76.6	16%	0.155	42%	0.422	C	S	.	.	H	α-helix	trans	-65.1	-44.9	175	0	0	0	0	0	113	A415 I416 A417 S423	A415-G419 PolarHBondContact O-N 2.94Å; I416-G419 PolarHBondContact O-N 2.88Å; A417-G419 VanDerWaalsContact C-N 3.34Å; A417-G419 PolarHBondContact O-N 3.46Å; G419-S423 WeakPolarHBondContact O-CB 3.09Å; G419-S423 PolarHBondContact O-N 3.3Å; G419-S423 PolarHBondContact O-OG 2.93Å; G419-S423 VanDerWaalsContact O-OG 3.08Å
420	V	95.9	Very high	93.3	Very high	47 Å²	47	71.3 Å²	71.3	29%	0.285	40%	0.404	S	S	.	.	H	α-helix	trans	-63.2	-51.2	175.9	173.5	0	0	0	0	110.5	P391 I416 A417 L422 S423 V424	P391-V420 HydrophobicContact CB-CG1 4.5Å; I416-V420 HydrophobicContact CG2-CG2 4.44Å; I416-V420 WeakPolarHBondContact O-CG2 3.45Å; I416-V420 PolarHBondContact O-N 2.86Å; A417-V420 PolarHBondContact O-N 2.83Å; V420-L422 VanDerWaalsContact C-N 3.34Å; V420-L422 PolarHBondContact O-N 3.37Å; V420-S423 WeakPolarHBondContact CA-OG 3.38Å; V420-S423 PolarHBondContact O-N 2.99Å; V420-S423 VanDerWaalsContact O-N 3.07Å; V420-S423 PolarHBondContact O-OG 2.9Å; V420-V424 HydrophobicContact CG1-CG2 4.36Å; V420-V424 WeakPolarHBondContact O-CG2 3.49Å; V420-V424 PolarHBondContact O-N 3.49Å
421	T	94.7	Very high	93.6	Very high	88 Å²	88	63.6 Å²	63.6	54%	0.54	37%	0.369	S	S	.	.	H	α-helix	trans	-57.4	-43.7	178.6	-59.8	0	0	0	0	112.3	A417 V424 I425	A417-T421 WeakPolarHBondContact O-CB 3.38Å; A417-T421 PolarHBondContact O-N 3.16Å; A417-T421 PolarHBondContact O-OG1 3.28Å; A417-T421 VanDerWaalsContact O-OG1 3.1Å; T421-V424 PolarHBondContact O-N 3.5Å; T421-I425 HydrophobicContact CG2-CD1 4.46Å; T421-I425 WeakPolarHBondContact O-CG1 3.16Å; T421-I425 PolarHBondContact O-N 3.22Å
422	L	95.8	Very high	93.9	Very high	111 Å²	111	60.3 Å²	60.3	58%	0.581	37%	0.367	S	S	*	.	H	α-helix	trans	-61.8	-44.7	175.1	-179.6	60.9	0	0	0	111.5	G418 V420 V424 I425 V426	G418-L422 VanDerWaalsContact O-CB 3.3Å; G418-L422 WeakPolarHBondContact O-CB 3.32Å; G418-L422 PolarHBondContact O-N 3.36Å; V420-L422 VanDerWaalsContact C-N 3.34Å; V420-L422 PolarHBondContact O-N 3.37Å; L422-V424 VanDerWaalsContact C-N 3.34Å; L422-V424 PolarHBondContact O-N 2.85Å; L422-I425 PolarHBondContact O-N 3.02Å; L422-I425 VanDerWaalsContact O-N 3.15Å; L422-V426 HydrophobicContact CD1-CG2 4.24Å; L422-V426 HydrophobicContact CG-CG2 4.45Å; L422-V426 WeakPolarHBondContact O-CG2 3.46Å; L422-V426 PolarHBondContact O-N 3.08Å
423	S	96.1	Very high	94.2	Very high	9 Å²	9	60.4 Å²	60.4	6%	0.063	38%	0.376	C	S	.	.	H	α-helix	trans	-67.4	-29.1	180	64.3	0	0	0	0	114.3	P391 G419 V420 I425 V426 S427	P391-S423 VanDerWaalsContact CA-OG 3.23Å; P391-S423 WeakPolarHBondContact CA-OG 3.41Å; P391-S423 WeakPolarHBondContact CB-OG 3.39Å; G419-S423 WeakPolarHBondContact O-CB 3.09Å; G419-S423 PolarHBondContact O-N 3.3Å; G419-S423 PolarHBondContact O-OG 2.93Å; G419-S423 VanDerWaalsContact O-OG 3.08Å; V420-S423 WeakPolarHBondContact CA-OG 3.38Å; V420-S423 PolarHBondContact O-N 2.99Å; V420-S423 VanDerWaalsContact O-N 3.07Å; V420-S423 PolarHBondContact O-OG 2.9Å; S423-I425 VanDerWaalsContact C-N 3.3Å; S423-V426 PolarHBondContact O-N 2.94Å; S423-S427 WeakPolarHBondContact O-CB 3.34Å; S423-S427 PolarHBondContact O-N 2.83Å; S423-S427 PolarHBondContact O-OG 2.88Å
424	V	96.6	Very high	94.4	Very high	79 Å²	79	59.7 Å²	59.7	48%	0.479	38%	0.375	S	S	.	.	H	α-helix	trans	-67.6	-30.3	172.2	171.6	0	0	0	0	111.7	P391 V420 T421 L422 P428	P391-V424 HydrophobicContact CB-CG2 3.71Å; P391-V424 HydrophobicContact CG-CB 4.42Å; P391-V424 HydrophobicContact CG-CG2 3.71Å; V420-V424 HydrophobicContact CG1-CG2 4.36Å; V420-V424 WeakPolarHBondContact O-CG2 3.49Å; V420-V424 PolarHBondContact O-N 3.49Å; T421-V424 PolarHBondContact O-N 3.5Å; L422-V424 VanDerWaalsContact C-N 3.34Å; L422-V424 PolarHBondContact O-N 2.85Å; V424-P428 WeakPolarHBondContact O-CD 3.26Å
425	I	95.1	Very high	94.4	Very high	114 Å²	114	55.7 Å²	55.7	59%	0.585	36%	0.356	S	S	*	.	H	α-helix	trans	-79.4	-34.2	175.3	-62.7	165.5	0	0	0	110.8	T421 L422 S423	T421-I425 HydrophobicContact CG2-CD1 4.46Å; T421-I425 WeakPolarHBondContact O-CG1 3.16Å; T421-I425 PolarHBondContact O-N 3.22Å; L422-I425 PolarHBondContact O-N 3.02Å; L422-I425 VanDerWaalsContact O-N 3.15Å; S423-I425 VanDerWaalsContact C-N 3.3Å
426	V	95.7	Very high	94.4	Very high	67 Å²	67	56.6 Å²	56.6	41%	0.406	37%	0.368	S	S	.	.	H	α-helix	trans	-82.8	-34.8	-177.4	173.3	0	0	0	0	113.1	L422 S423 V429 V430	L422-V426 HydrophobicContact CD1-CG2 4.24Å; L422-V426 HydrophobicContact CG-CG2 4.45Å; L422-V426 WeakPolarHBondContact O-CG2 3.46Å; L422-V426 PolarHBondContact O-N 3.08Å; S423-V426 PolarHBondContact O-N 2.94Å; V426-V429 PolarHBondContact O-N 3.31Å; V426-V429 VanDerWaalsContact O-N 3.16Å; V426-V430 HydrophobicContact CG1-CG2 3.81Å; V426-V430 WeakPolarHBondContact O-CG2 3.45Å; V426-V430 PolarHBondContact O-N 3.44Å
427	S	96.3	Very high	94.5	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.007	39%	0.385	C	S	.	.	H	α-helix	trans	-61.2	-37.8	-174.8	72.3	0	0	0	0	114.7	I387 S423 V430 A431	I387-S427 PolarHBondContact O-OG 2.9Å; S423-S427 WeakPolarHBondContact O-CB 3.34Å; S423-S427 PolarHBondContact O-N 2.83Å; S423-S427 PolarHBondContact O-OG 2.88Å; S427-V430 PolarHBondContact O-N 3.37Å; S427-A431 WeakPolarHBondContact O-CB 3.05Å; S427-A431 PolarHBondContact O-N 2.89Å
428	P	95	Very high	94.3	Very high	58 Å²	58	58.8 Å²	58.8	38%	0.377	38%	0.379	S	S	.	.	H	α-helix	trans	-69.2	-33.5	175.5	-18.5	33.8	0	0	0	112.5	V424 A431 A432	V424-P428 WeakPolarHBondContact O-CD 3.26Å; P428-A431 PolarHBondContact O-N 3.49Å; P428-A432 VanDerWaalsContact O-CB 3.28Å; P428-A432 WeakPolarHBondContact O-CB 3.34Å; P428-A432 PolarHBondContact O-N 3.29Å
429	V	95.1	Very high	94.1	Very high	90 Å²	90	58.7 Å²	58.7	55%	0.545	37%	0.37	S	S	.	.	H	α-helix	trans	-68.4	-44.3	177.2	-177.6	0	0	0	0	110.5	V426 A432 V433	V426-V429 PolarHBondContact O-N 3.31Å; V426-V429 VanDerWaalsContact O-N 3.16Å; V429-A432 PolarHBondContact O-N 3.33Å; V429-V433 WeakPolarHBondContact O-CB 3.37Å; V429-V433 WeakPolarHBondContact O-CG2 3.25Å; V429-V433 PolarHBondContact O-N 2.85Å
430	V	94.3	Very high	93.9	Very high	57 Å²	57	61.4 Å²	61.4	35%	0.345	39%	0.385	S	S	.	.	H	α-helix	trans	-63.3	-43.5	175.5	174.7	0	0	0	0	110.6	V426 S427 V433 T434	V426-V430 HydrophobicContact CG1-CG2 3.81Å; V426-V430 WeakPolarHBondContact O-CG2 3.45Å; V426-V430 PolarHBondContact O-N 3.44Å; S427-V430 PolarHBondContact O-N 3.37Å; V430-V433 PolarHBondContact O-N 3.43Å; V430-T434 HydrophobicContact CG1-CG2 4.44Å; V430-T434 WeakPolarHBondContact O-CB 3.44Å; V430-T434 WeakPolarHBondContact O-CG2 3.38Å; V430-T434 PolarHBondContact O-N 3.29Å; V430-T434 PolarHBondContact O-OG1 2.83Å
431	A	93.6	Very high	93.7	Very high	5 Å²	5	64.1 Å²	64.1	4%	0.041	40%	0.397	C	S	.	.	H	α-helix	trans	-60.7	-46.6	175	0	0	0	0	0	111.9	I387 S427 P428 V433 T434 V435	I387-A431 HydrophobicContact CG1-CB 4.22Å; S427-A431 WeakPolarHBondContact O-CB 3.05Å; S427-A431 PolarHBondContact O-N 2.89Å; P428-A431 PolarHBondContact O-N 3.49Å; A431-V433 PolarHBondContact O-N 3.06Å; A431-T434 WeakPolarHBondContact CA-OG1 3.17Å; A431-T434 PolarHBondContact O-N 3.44Å; A431-T434 PolarHBondContact O-OG1 3.5Å; A431-T434 VanDerWaalsContact O-OG1 3.04Å; A431-V435 WeakPolarHBondContact O-CB 3.46Å; A431-V435 VanDerWaalsContact O-CG2 3.22Å; A431-V435 WeakPolarHBondContact O-CG2 3.22Å; A431-V435 PolarHBondContact O-N 3.01Å
432	A	93.2	Very high	93.2	Very high	65 Å²	65	65 Å²	65	54%	0.537	40%	0.396	S	S	.	.	H	α-helix	trans	-62.5	-42.5	178.2	0	0	0	0	0	113.1	P428 V429 G436	P428-A432 VanDerWaalsContact O-CB 3.28Å; P428-A432 WeakPolarHBondContact O-CB 3.34Å; P428-A432 PolarHBondContact O-N 3.29Å; V429-A432 PolarHBondContact O-N 3.33Å; A432-G436 WeakPolarHBondContact O-CA 3.47Å; A432-G436 PolarHBondContact O-N 3.23Å
433	V	94.9	Very high	92.8	Very high	80 Å²	80	62.5 Å²	62.5	49%	0.485	38%	0.383	S	S	.	.	H	α-helix	trans	-68.5	-44.8	178.5	170.3	0	0	0	0	111.6	V429 V430 A431 V435 G436 I437	V429-V433 WeakPolarHBondContact O-CB 3.37Å; V429-V433 WeakPolarHBondContact O-CG2 3.25Å; V429-V433 PolarHBondContact O-N 2.85Å; V430-V433 PolarHBondContact O-N 3.43Å; A431-V433 PolarHBondContact O-N 3.06Å; V433-V435 PolarHBondContact O-N 3.25Å; V433-G436 PolarHBondContact O-N 3.05Å; V433-I437 HydrophobicContact CG1-CD1 3.78Å; V433-I437 WeakPolarHBondContact O-CB 3.36Å; V433-I437 WeakPolarHBondContact O-CG1 3.37Å; V433-I437 PolarHBondContact O-N 2.87Å
434	T	91	Very high	92.4	Very high	78 Å²	78	65 Å²	65	48%	0.479	40%	0.404	S	S	.	.	H	α-helix	trans	-64.4	-40.1	179.5	47.2	0	0	0	0	112.6	V430 A431 G438	V430-T434 HydrophobicContact CG1-CG2 4.44Å; V430-T434 WeakPolarHBondContact O-CB 3.44Å; V430-T434 WeakPolarHBondContact O-CG2 3.38Å; V430-T434 PolarHBondContact O-N 3.29Å; V430-T434 PolarHBondContact O-OG1 2.83Å; A431-T434 WeakPolarHBondContact CA-OG1 3.17Å; A431-T434 PolarHBondContact O-N 3.44Å; A431-T434 PolarHBondContact O-OG1 3.5Å; A431-T434 VanDerWaalsContact O-OG1 3.04Å; T434-G438 WeakPolarHBondContact O-CA 3.49Å; T434-G438 PolarHBondContact O-N 3.09Å
435	V	92.2	Very high	91.9	Very high	47 Å²	47	66.8 Å²	66.8	29%	0.285	40%	0.403	S	S	.	.	H	α-helix	trans	-70.5	-47.7	173.5	174.3	0	0	0	0	111.2	I383 A431 V433 I437 G438 V439	I383-V435 HydrophobicContact CD1-CG2 3.71Å; I383-V435 HydrophobicContact CG1-CG2 3.69Å; A431-V435 WeakPolarHBondContact O-CB 3.46Å; A431-V435 VanDerWaalsContact O-CG2 3.22Å; A431-V435 WeakPolarHBondContact O-CG2 3.22Å; A431-V435 PolarHBondContact O-N 3.01Å; V433-V435 PolarHBondContact O-N 3.25Å; V435-I437 VanDerWaalsContact C-N 3.26Å; V435-I437 PolarHBondContact O-N 3.27Å; V435-G438 PolarHBondContact O-N 2.8Å; V435-V439 HydrophobicContact CG1-CG2 3.93Å; V435-V439 WeakPolarHBondContact O-CB 3.45Å; V435-V439 WeakPolarHBondContact O-CG2 3.45Å; V435-V439 PolarHBondContact O-N 3.48Å
436	G	91.8	Very high	91.4	Very high	49 Å²	49	62.5 Å²	62.5	51%	0.505	38%	0.382	S	S	.	.	H	α-helix	trans	-64.7	-24.7	-176.5	0	0	0	0	0	114.6	A432 V433 P440	A432-G436 WeakPolarHBondContact O-CA 3.47Å; A432-G436 PolarHBondContact O-N 3.23Å; V433-G436 PolarHBondContact O-N 3.05Å; G436-P440 VanDerWaalsContact O-CD 3.3Å; G436-P440 WeakPolarHBondContact O-CD 3.49Å; G436-P440 VanDerWaalsContact O-CG 3.3Å; G436-P440 WeakPolarHBondContact O-CG 3.4Å
437	I	94.1	Very high	90.9	Very high	102 Å²	102	64.7 Å²	64.7	52%	0.523	38%	0.384	S	S	.	.	H	α-helix	trans	-95.8	-45.4	172.4	-62.5	174.4	0	0	0	110.9	V433 V435 I441	V433-I437 HydrophobicContact CG1-CD1 3.78Å; V433-I437 WeakPolarHBondContact O-CB 3.36Å; V433-I437 WeakPolarHBondContact O-CG1 3.37Å; V433-I437 PolarHBondContact O-N 2.87Å; V435-I437 VanDerWaalsContact C-N 3.26Å; V435-I437 PolarHBondContact O-N 3.27Å; I437-I441 HydrophobicContact CG2-CD1 3.73Å; I437-I441 VanDerWaalsContact O-CG1 3.32Å; I437-I441 WeakPolarHBondContact O-CG1 3.3Å; I437-I441 PolarHBondContact O-N 3.3Å
438	G	90	Very high	90.3	Very high	30 Å²	30	65.9 Å²	65.9	31%	0.309	40%	0.397	S	S	.	.	H	α-helix	trans	-68.7	-40.9	-173.2	0	0	0	0	0	114.3	T434 V435 I441 M442	T434-G438 WeakPolarHBondContact O-CA 3.49Å; T434-G438 PolarHBondContact O-N 3.09Å; V435-G438 PolarHBondContact O-N 2.8Å; G438-I441 PolarHBondContact O-N 3.43Å; G438-M442 WeakPolarHBondContact O-CB 3.14Å; G438-M442 WeakPolarHBondContact O-CG 3.23Å; G438-M442 PolarHBondContact O-N 3.05Å
439	V	90	Very high	89.6	Confident	40 Å²	40	66.3 Å²	66.3	24%	0.242	40%	0.398	C	S	.	.	H	α-helix	trans	-67.7	-47.9	-178.2	174.2	0	0	0	0	111.7	I375 V435 I441 M442 L443	I375-V439 HydrophobicContact CG2-CG1 4.29Å; I375-V439 HydrophobicContact CG2-CG2 4.11Å; V435-V439 HydrophobicContact CG1-CG2 3.93Å; V435-V439 WeakPolarHBondContact O-CB 3.45Å; V435-V439 WeakPolarHBondContact O-CG2 3.45Å; V435-V439 PolarHBondContact O-N 3.48Å; V439-I441 VanDerWaalsContact C-N 3.33Å; V439-I441 PolarHBondContact O-N 3Å; V439-M442 PolarHBondContact O-N 2.98Å; V439-L443 HydrophobicContact CG1-CD1 3.63Å; V439-L443 HydrophobicContact CG1-CG 4.1Å; V439-L443 WeakPolarHBondContact O-CB 3.34Å; V439-L443 VanDerWaalsContact O-CG 3.27Å; V439-L443 WeakPolarHBondContact O-CG 3.5Å; V439-L443 PolarHBondContact O-N 2.89Å
440	P	90.5	Very high	88.7	Confident	72 Å²	72	64.1 Å²	64.1	47%	0.468	39%	0.385	S	S	.	.	H	α-helix	trans	-59.4	-38.1	174.5	-28.5	38.3	0	0	0	114.1	G436 A444	G436-P440 VanDerWaalsContact O-CD 3.3Å; G436-P440 WeakPolarHBondContact O-CD 3.49Å; G436-P440 VanDerWaalsContact O-CG 3.3Å; G436-P440 WeakPolarHBondContact O-CG 3.4Å; P440-A444 VanDerWaalsContact O-CB 3.23Å; P440-A444 WeakPolarHBondContact O-CB 3.3Å; P440-A444 PolarHBondContact O-N 2.96Å
441	I	91.4	Very high	87.8	Confident	104 Å²	104	63.5 Å²	63.5	53%	0.533	38%	0.382	S	S	.	.	H	α-helix	trans	-65	-46	176.6	-68.7	172.3	0	0	0	110.9	I437 G438 V439 A444 Y445	I437-I441 HydrophobicContact CG2-CD1 3.73Å; I437-I441 VanDerWaalsContact O-CG1 3.32Å; I437-I441 WeakPolarHBondContact O-CG1 3.3Å; I437-I441 PolarHBondContact O-N 3.3Å; G438-I441 PolarHBondContact O-N 3.43Å; V439-I441 VanDerWaalsContact C-N 3.33Å; V439-I441 PolarHBondContact O-N 3Å; I441-A444 PolarHBondContact O-N 3.4Å; I441-Y445 PolarHBondContact O-N 3.14Å
442	M	85.3	Confident	87	Confident	106 Å²	106	68.5 Å²	68.5	52%	0.522	41%	0.406	S	S	.	.	H	α-helix	trans	-66.2	-40.6	178.4	-73.2	-67.1	151.8	0	0	112.3	I375 G438 V439 Y445 V446	I375-M442 HydrophobicContact CD1-CB 4.07Å; G438-M442 WeakPolarHBondContact O-CB 3.14Å; G438-M442 WeakPolarHBondContact O-CG 3.23Å; G438-M442 PolarHBondContact O-N 3.05Å; V439-M442 PolarHBondContact O-N 2.98Å; M442-Y445 PolarHBondContact O-N 3.02Å; M442-V446 WeakPolarHBondContact O-CB 3.49Å; M442-V446 VanDerWaalsContact O-CG2 3.31Å; M442-V446 WeakPolarHBondContact O-CG2 3.39Å; M442-V446 PolarHBondContact O-N 3.49Å
443	L	86.3	Confident	85.6	Confident	59 Å²	59	67.5 Å²	67.5	31%	0.309	40%	0.395	S	S	.	.	H	α-helix	trans	-65	-42.6	174.2	-67.8	173.1	0	0	0	111.5	I375 V439 Y445 V446 Y447	I375-L443 HydrophobicContact CD1-CD2 4.41Å; V439-L443 HydrophobicContact CG1-CD1 3.63Å; V439-L443 HydrophobicContact CG1-CG 4.1Å; V439-L443 WeakPolarHBondContact O-CB 3.34Å; V439-L443 VanDerWaalsContact O-CG 3.27Å; V439-L443 WeakPolarHBondContact O-CG 3.5Å; V439-L443 PolarHBondContact O-N 2.89Å; L443-Y445 VanDerWaalsContact C-N 3.29Å; L443-Y445 PolarHBondContact O-N 3.5Å; L443-V446 PolarHBondContact O-N 3.49Å; L443-Y447 HydrophobicContact CB-CD2 4.41Å; L443-Y447 HydrophobicContact CD2-CD2 4.18Å; L443-Y447 HydrophobicContact CD2-CE2 3.86Å; L443-Y447 WeakPolarHBondContact O-CB 3.4Å; L443-Y447 WeakPolarHBondContact O-CD2 3.32Å; L443-Y447 PolarHBondContact O-N 3.48Å
444	A	88.6	Confident	84.2	Confident	61 Å²	61	65.3 Å²	65.3	50%	0.504	38%	0.381	S	S	.	.	H	α-helix	trans	-63.2	-33.9	175.8	0	0	0	0	0	112.6	P440 I441 G448 V449	P440-A444 VanDerWaalsContact O-CB 3.23Å; P440-A444 WeakPolarHBondContact O-CB 3.3Å; P440-A444 PolarHBondContact O-N 2.96Å; I441-A444 PolarHBondContact O-N 3.4Å; A444-G448 VanDerWaalsContact O-CA 3.22Å; A444-G448 WeakPolarHBondContact O-CA 3.47Å; A444-G448 PolarHBondContact O-N 3.45Å; A444-V449 PolarHBondContact O-N 2.71Å
445	Y	86	Confident	83	Confident	118 Å²	118	65.8 Å²	65.8	46%	0.463	39%	0.386	S	S	.	.	I	π-helix	trans	-68.4	-50.4	172.2	-173.5	-93.7	0	0	0	111.9	I441 M442 L443 V449 V450	I441-Y445 PolarHBondContact O-N 3.14Å; M442-Y445 PolarHBondContact O-N 3.02Å; L443-Y445 VanDerWaalsContact C-N 3.29Å; L443-Y445 PolarHBondContact O-N 3.5Å; Y445-V449 HydrophobicContact CD2-CB 3.85Å; Y445-V449 HydrophobicContact CD2-CG1 4.09Å; Y445-V449 HydrophobicContact CD2-CG2 3.9Å; Y445-V449 HydrophobicContact CE2-CB 4.1Å; Y445-V449 HydrophobicContact CE2-CG1 3.82Å; Y445-V449 HydrophobicContact CE2-CG2 4.44Å; Y445-V449 HydrophobicContact CG-CB 4.34Å; Y445-V449 WeakPolarHBondContact O-CB 3.42Å; Y445-V449 PolarHBondContact O-N 3.04Å; Y445-V450 HydrophobicContact CE1-CG2 4.3Å; Y445-V450 PolarHBondContact O-N 2.94Å
446	V	84.5	Confident	81.6	Confident	23 Å²	23	73.7 Å²	73.7	14%	0.139	41%	0.411	C	S	.	.	I	π-helix	trans	-65.6	-39.2	-178.2	168.9	0	0	0	0	112.9	A371 M442 L443 P451	A371-V446 HydrophobicContact CB-CG1 3.92Å; A371-V446 HydrophobicContact CB-CG2 4.16Å; M442-V446 WeakPolarHBondContact O-CB 3.49Å; M442-V446 VanDerWaalsContact O-CG2 3.31Å; M442-V446 WeakPolarHBondContact O-CG2 3.39Å; M442-V446 PolarHBondContact O-N 3.49Å; L443-V446 PolarHBondContact O-N 3.49Å; V446-P451 WeakPolarHBondContact O-CD 3.23Å
447	Y	84.6	Confident	79.9	Confident	114 Å²	114	74.5 Å²	74.5	45%	0.447	41%	0.409	S	S	.	.	I	π-helix	trans	-98	-23.7	-176.8	-74.2	-77.4	0	0	0	114.5	L368 P372 L443 P451	L368-Y447 HydrophobicContact CD1-CD1 3.57Å; L368-Y447 HydrophobicContact CD1-CE1 3.47Å; L368-Y447 VanDerWaalsContact CD1-CE1 3.47Å; L368-Y447 HydrophobicContact CD1-CG 4.48Å; L368-Y447 HydrophobicContact CG-CD1 4.5Å; L368-Y447 HydrophobicContact CG-CE1 3.96Å; L368-Y447 PolarHBondContact O-OH 3.27Å; P372-Y447 HydrophobicContact CG-CE2 4.03Å; P372-Y447 WeakPolarHBondContact CG-OH 3.39Å; L443-Y447 HydrophobicContact CB-CD2 4.41Å; L443-Y447 HydrophobicContact CD2-CD2 4.18Å; L443-Y447 HydrophobicContact CD2-CE2 3.86Å; L443-Y447 WeakPolarHBondContact O-CB 3.4Å; L443-Y447 WeakPolarHBondContact O-CD2 3.32Å; L443-Y447 PolarHBondContact O-N 3.48Å; Y447-P451 WeakPolarHBondContact O-CD 3.4Å; Y447-P451 VanDerWaalsContact O-CG 3.31Å; Y447-P451 WeakPolarHBondContact O-CG 3.46Å
448	G	83.3	Confident	77.9	Confident	26 Å²	26	72 Å²	72	27%	0.268	41%	0.409	S	S	.	.	I	π-helix	trans	-97	-67.6	175.8	0	0	0	0	0	112	A444 V450 I452	A444-G448 VanDerWaalsContact O-CA 3.22Å; A444-G448 WeakPolarHBondContact O-CA 3.47Å; A444-G448 PolarHBondContact O-N 3.45Å; G448-V450 PolarHBondContact O-N 3.36Å; G448-I452 WeakPolarHBondContact O-CB 3.01Å; G448-I452 WeakPolarHBondContact O-CD1 3.31Å; G448-I452 WeakPolarHBondContact O-CG1 3.08Å; G448-I452 PolarHBondContact O-N 3.16Å
449	V	81.5	Confident	76	Confident	66 Å²	66	74 Å²	74	40%	0.4	43%	0.43	S	S	.	.	I	π-helix	trans	-64.3	-40.9	-170.5	-178.3	0	0	0	0	112.1	A444 Y445 S453	A444-V449 PolarHBondContact O-N 2.71Å; Y445-V449 HydrophobicContact CD2-CB 3.85Å; Y445-V449 HydrophobicContact CD2-CG1 4.09Å; Y445-V449 HydrophobicContact CD2-CG2 3.9Å; Y445-V449 HydrophobicContact CE2-CB 4.1Å; Y445-V449 HydrophobicContact CE2-CG1 3.82Å; Y445-V449 HydrophobicContact CE2-CG2 4.44Å; Y445-V449 HydrophobicContact CG-CB 4.34Å; Y445-V449 WeakPolarHBondContact O-CB 3.42Å; Y445-V449 PolarHBondContact O-N 3.04Å; V449-S453 WeakPolarHBondContact O-CB 3.48Å; V449-S453 PolarHBondContact O-N 3Å; V449-S453 PolarHBondContact O-OG 2.79Å
450	V	76.2	Confident	73.8	Confident	45 Å²	45	76.5 Å²	76.5	27%	0.273	45%	0.448	S	S	.	.	H	α-helix	trans	-65	-58.2	179	178	0	0	0	0	111.3	Y445 G448 I452 S453 L454	Y445-V450 HydrophobicContact CE1-CG2 4.3Å; Y445-V450 PolarHBondContact O-N 2.94Å; G448-V450 PolarHBondContact O-N 3.36Å; V450-I452 PolarHBondContact O-N 3.41Å; V450-S453 CarbonylContact O-C 3.59Å; V450-S453 WeakPolarHBondContact O-CA 3.14Å; V450-S453 WeakPolarHBondContact O-CB 3.36Å; V450-S453 PolarHBondContact O-N 2.84Å; V450-L454 WeakPolarHBondContact O-CG 3.35Å; V450-L454 PolarHBondContact O-N 3.28Å
451	P	74.3	Confident	71.6	Confident	43 Å²	43	76.4 Å²	76.4	28%	0.279	46%	0.459	S	S	.	.	H	α-helix	trans	-59.1	-38.4	178.5	-28.8	39.3	0	0	0	114.8	V446 Y447 S453 L454 C455	V446-P451 WeakPolarHBondContact O-CD 3.23Å; Y447-P451 WeakPolarHBondContact O-CD 3.4Å; Y447-P451 VanDerWaalsContact O-CG 3.31Å; Y447-P451 WeakPolarHBondContact O-CG 3.46Å; P451-S453 VanDerWaalsContact C-N 3.3Å; P451-S453 PolarHBondContact O-N 3.37Å; P451-L454 WeakPolarHBondContact O-CB 3.46Å; P451-L454 PolarHBondContact O-N 3.27Å; P451-L454 VanDerWaalsContact O-N 3.15Å; P451-C455 PolarHBondContact O-N 3.28Å; P451-C455 PolarHBondContact O-SG 2.87Å; P451-C455 VanDerWaalsContact O-SG 3.4Å
452	I	76.6	Confident	69.2	Low	110 Å²	110	75.9 Å²	75.9	56%	0.564	46%	0.461	S	S	*	.	H	α-helix	trans	-64.5	-37.3	175.5	-67.2	169	0	0	0	110.8	G448 V450 L454 R456	G448-I452 WeakPolarHBondContact O-CB 3.01Å; G448-I452 WeakPolarHBondContact O-CD1 3.31Å; G448-I452 WeakPolarHBondContact O-CG1 3.08Å; G448-I452 PolarHBondContact O-N 3.16Å; V450-I452 PolarHBondContact O-N 3.41Å; I452-L454 VanDerWaalsContact C-N 3.35Å; I452-R456 WeakPolarHBondContact O-CB 3.45Å; I452-R456 PolarHBondContact O-N 3.13Å
453	S	65.5	Low	67	Low	44 Å²	44	76.5 Å²	76.5	31%	0.308	48%	0.475	S	S	.	.	H	α-helix	trans	-69.2	-30.9	174.2	-58.9	0	0	0	0	112.6	V449 V450 P451 S457	V449-S453 WeakPolarHBondContact O-CB 3.48Å; V449-S453 PolarHBondContact O-N 3Å; V449-S453 PolarHBondContact O-OG 2.79Å; V450-S453 CarbonylContact O-C 3.59Å; V450-S453 WeakPolarHBondContact O-CA 3.14Å; V450-S453 WeakPolarHBondContact O-CB 3.36Å; V450-S453 PolarHBondContact O-N 2.84Å; P451-S453 VanDerWaalsContact C-N 3.3Å; P451-S453 PolarHBondContact O-N 3.37Å; S453-S457 WeakPolarHBondContact O-CB 3.29Å; S453-S457 PolarHBondContact O-N 3.3Å; S453-S457 PolarHBondContact O-OG 3.44Å
454	L	64.3	Low	64.8	Low	35 Å²	35	78.2 Å²	78.2	18%	0.183	50%	0.498	C	S	.	.	H	α-helix	trans	-63	-57.2	170.7	-60.3	-175.6	0	0	0	110.7	P344 Q364 V450 P451 I452 R456 S457	P344-L454 HydrophobicContact CB-CD2 3.19Å; P344-L454 HydrophobicContact CG-CD2 3.55Å; Q364-L454 HydrophobicContact CB-CD1 4.37Å; Q364-L454 HydrophobicContact CG-CD1 3.94Å; Q364-L454 HydrophobicContact CG-CD2 4.19Å; Q364-L454 VanDerWaalsContact NE2-CD2 3.33Å; V450-L454 WeakPolarHBondContact O-CG 3.35Å; V450-L454 PolarHBondContact O-N 3.28Å; P451-L454 WeakPolarHBondContact O-CB 3.46Å; P451-L454 PolarHBondContact O-N 3.27Å; P451-L454 VanDerWaalsContact O-N 3.15Å; I452-L454 VanDerWaalsContact C-N 3.35Å; L454-R456 PolarHBondContact O-N 3.49Å; L454-R456 VanDerWaalsContact O-N 3.08Å; L454-S457 PolarHBondContact O-N 2.93Å; L454-S457 VanDerWaalsContact O-N 3.09Å; L454-S457 PolarHBondContact O-OG 3.16Å
455	C	65.3	Low	62.6	Low	87 Å²	87	77.9 Å²	77.9	59%	0.588	50%	0.501	S	S	*	.	H	α-helix	trans	-56.8	-28.9	-177.9	-66.7	0	0	0	0	113.3	P451	P451-C455 PolarHBondContact O-N 3.28Å; P451-C455 PolarHBondContact O-SG 2.87Å; P451-C455 VanDerWaalsContact O-SG 3.4Å
456	R	64.8	Low	60.6	Low	213 Å²	213	80.2 Å²	80.2	80%	0.804	52%	0.521	S	S	*	.	H	α-helix	trans	-93.9	-17	179.8	-168.3	162.6	62.3	121.1	-2.5	115	I452 L454	I452-R456 WeakPolarHBondContact O-CB 3.45Å; I452-R456 PolarHBondContact O-N 3.13Å; L454-R456 PolarHBondContact O-N 3.49Å; L454-R456 VanDerWaalsContact O-N 3.08Å
457	S	54.7	Low	58.8	Low	67 Å²	67	83.2 Å²	83.2	47%	0.469	56%	0.557	S	S	.	*	H	α-helix	trans	-94.5	-20.9	-174.3	57.2	0	0	0	0	114.9	S453 L454	S453-S457 WeakPolarHBondContact O-CB 3.29Å; S453-S457 PolarHBondContact O-N 3.3Å; S453-S457 PolarHBondContact O-OG 3.44Å; L454-S457 PolarHBondContact O-N 2.93Å; L454-S457 VanDerWaalsContact O-N 3.09Å; L454-S457 PolarHBondContact O-OG 3.16Å
458	G	52	Low	56.9	Low	50 Å²	50	87 Å²	87	52%	0.515	58%	0.576	S	S	.	*	S	Bend	trans	-163.9	119.3	171.1	0	0	0	0	0	110.2	C460	G458-C460 PolarHBondContact O-N 3.27Å
459	G	50.7	Low	54.8	Low	72 Å²	72	89.1 Å²	89.1	74%	0.742	60%	0.597	S	S	*	*			trans	-55.4	125.5	-170.9	0	0	0	0	0	113	G461	G459-G461 PolarHBondContact O-N 3.44Å
460	C	42.8	Very low	52.5	Low	92 Å²	92	91.3 Å²	91.3	62%	0.622	61%	0.61	S	S	*	*			trans	-54.3	123.8	163.9	-65	0	0	0	0	108.1	G458 V462	G458-C460 PolarHBondContact O-N 3.27Å; C460-V462 HydrophobicContact CB-CG2 4.33Å; C460-V462 PolarHBondContact O-N 2.83Å
461	G	45.2	Very low	50.7	Low	69 Å²	69	98.3 Å²	98.3	71%	0.711	63%	0.632	S	S	*	*			trans	-70.7	33.2	-174.4	0	0	0	0	0	115	G459 S463	G459-G461 PolarHBondContact O-N 3.44Å; G461-S463 VanDerWaalsContact C-N 3.3Å; G461-S463 PolarHBondContact O-N 2.97Å; G461-S463 VanDerWaalsContact O-N 3.14Å
462	V	40.1	Very low	49.2	Very low	94 Å²	94	102 Å²	102	57%	0.57	65%	0.648	S	S	*	*			trans	-85.6	74.6	177.5	-171	0	0	0	0	108.1	C460 A464	C460-V462 HydrophobicContact CB-CG2 4.33Å; C460-V462 PolarHBondContact O-N 2.83Å; V462-A464 PolarHBondContact O-N 2.98Å; V462-A464 VanDerWaalsContact O-N 3.11Å
463	S	40.8	Very low	47.5	Very low	118 Å²	118	102.2 Å²	102.2	83%	0.825	65%	0.647	S	S	*	*			trans	-61.3	112.7	160.1	-70.4	0	0	0	0	107.9	G461 G465	G461-S463 VanDerWaalsContact C-N 3.3Å; G461-S463 PolarHBondContact O-N 2.97Å; G461-S463 VanDerWaalsContact O-N 3.14Å; S463-G465 PolarHBondContact O-N 3.32Å
464	A	40.2	Very low	46.3	Very low	96 Å²	96	106.4 Å²	106.4	79%	0.793	66%	0.659	S	S	*	*			trans	-71.4	71.7	174.3	0	0	0	0	0	110.5	V462	V462-A464 PolarHBondContact O-N 2.98Å; V462-A464 VanDerWaalsContact O-N 3.11Å
465	G	42	Very low	45.3	Very low	54 Å²	54	110.3 Å²	110.3	56%	0.557	68%	0.68	S	S	*	*			trans	-69.5	130.2	168.6	0	0	0	0	0	110	S463 G467	S463-G465 PolarHBondContact O-N 3.32Å; G465-G467 PolarHBondContact O-N 2.95Å
466	N	43.6	Very low	44.4	Very low	167 Å²	167	111.7 Å²	111.7	89%	0.893	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	120.7	-173.7	-81.4	8.1	0	0	0	113.4	K468	N466-K468 PolarHBondContact O-N 3.38Å
467	G	47.5	Very low	43.6	Very low	85 Å²	85	108.2 Å²	108.2	88%	0.876	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.3	7.9	154.6	0	0	0	0	0	118	G465	G465-G467 PolarHBondContact O-N 2.95Å
468	K	43.2	Very low	42.9	Very low	195 Å²	195	111.4 Å²	111.4	85%	0.848	69%	0.687	S	S	*	*	S	Bend	trans	-129.4	143.2	170.7	-69.9	-173.2	177.4	179.8	0	111	N466	N466-K468 PolarHBondContact O-N 3.38Å
469	G	40.1	Very low	42.2	Very low	70 Å²	70	117.1 Å²	117.1	72%	0.722	71%	0.706	S	S	*	*			trans	-63.6	166	-160	0	0	0	0	0	116.2	R471	G469-R471 PolarHBondContact O-N 3.31Å
470	V	33.8	Very low	41.6	Very low	112 Å²	112	120.4 Å²	120.4	68%	0.679	71%	0.705	S	S	*	*			trans	-64.7	91.8	-178.3	-177.7	0	0	0	0	110.8	I472	V470-I472 HydrophobicContact CG1-CG1 4.21Å; V470-I472 PolarHBondContact O-N 2.89Å
471	R	37.4	Very low	41.1	Very low	192 Å²	192	123.2 Å²	123.2	73%	0.725	71%	0.713	S	S	*	*			trans	-74.7	99	163.7	47.9	174.5	-104.3	-115.4	6.9	109.4	G469 E473	G469-R471 PolarHBondContact O-N 3.31Å; R471-E473 IonicContact CZ-OE2 2.57Å; R471-E473 IonicContact NE-OE2 3.15Å; R471-E473 PolarHBondContact NE-OE2 2.94Å; R471-E473 IonicContact NH2-OE1 2.69Å; R471-E473 IonicContact NH2-OE2 3.63Å; R471-E473 PolarHBondContact NH2-OE2 2.88Å; R471-E473 PolarHBondContact O-N 3.42Å
472	I	41.8	Very low	40.5	Very low	119 Å²	119	126.1 Å²	126.1	61%	0.61	72%	0.717	S	S	*	*			trans	-68.1	108.9	161.2	-58.6	177.4	0	0	0	105.9	V470 F474	V470-I472 HydrophobicContact CG1-CG1 4.21Å; V470-I472 PolarHBondContact O-N 2.89Å; I472-F474 HydrophobicContact CB-CD2 4.41Å; I472-F474 HydrophobicContact CB-CE2 4.07Å; I472-F474 HydrophobicContact CG2-CD2 4.01Å; I472-F474 HydrophobicContact CG2-CE2 3.72Å; I472-F474 WeakPolarHBondContact O-CD2 3.2Å; I472-F474 PolarHBondContact O-N 2.89Å
473	E	41.1	Very low	40.2	Very low	116 Å²	116	125 Å²	125	54%	0.542	73%	0.725	S	S	.	*			trans	-73.3	113.4	175.3	-149.8	130.4	124.4	0	0	108.9	R357 R471 D475	R357-E473 PolarHBondContact NH1-O 3.42Å; R471-E473 IonicContact CZ-OE2 2.57Å; R471-E473 IonicContact NE-OE2 3.15Å; R471-E473 PolarHBondContact NE-OE2 2.94Å; R471-E473 IonicContact NH2-OE1 2.69Å; R471-E473 IonicContact NH2-OE2 3.63Å; R471-E473 PolarHBondContact NH2-OE2 2.88Å; R471-E473 PolarHBondContact O-N 3.42Å; E473-D475 PolarHBondContact O-N 2.92Å
474	F	40.8	Very low	39.5	Very low	131 Å²	131	123 Å²	123	58%	0.575	72%	0.723	S	S	*	*			trans	-82	106.9	175.8	-85	-110.7	0	0	0	108.8	I472 D476	I472-F474 HydrophobicContact CB-CD2 4.41Å; I472-F474 HydrophobicContact CB-CE2 4.07Å; I472-F474 HydrophobicContact CG2-CD2 4.01Å; I472-F474 HydrophobicContact CG2-CE2 3.72Å; I472-F474 WeakPolarHBondContact O-CD2 3.2Å; I472-F474 PolarHBondContact O-N 2.89Å; F474-D476 PolarHBondContact O-N 3.08Å
475	D	43.7	Very low	39	Very low	117 Å²	117	125 Å²	125	63%	0.626	73%	0.726	S	S	*	*			trans	-73	101.5	170.3	-166.8	39.3	0	0	0	108.2	K358 E473	K358-D475 PolarHBondContact NZ-O 3.14Å; E473-D475 PolarHBondContact O-N 2.92Å
476	D	46.5	Very low	38.4	Very low	116 Å²	116	130.4 Å²	130.4	62%	0.62	74%	0.742	S	S	*	*			trans	-109.1	84.9	-172.3	-76	-25.6	0	0	0	110.9	K358 F474 N478	K358-D476 IonicContact NZ-OD1 3.02Å; K358-D476 PolarHBondContact NZ-OD1 3.44Å; F474-D476 PolarHBondContact O-N 3.08Å; D476-N478 PolarHBondContact O-N 2.87Å; D476-N478 VanDerWaalsContact O-N 3.13Å
477	E	48.5	Very low	37.7	Very low	141 Å²	141	128.9 Å²	128.9	66%	0.659	74%	0.738	S	S	*	*			trans	-71.1	100.9	170.7	-63.3	-166.1	147.9	0	0	110.5	K353	K353-E477 IonicContact NZ-OE1 2.94Å; K353-E477 PolarHBondContact NZ-OE1 2.96Å; K353-E477 IonicContact NZ-OE2 3.78Å; K353-E477 PolarHBondContact NZ-OE2 3.47Å
478	N	40.2	Very low	36.8	Very low	134 Å²	134	128.6 Å²	128.6	72%	0.717	73%	0.728	S	S	*	*			trans	-142.1	66.1	164.5	-169.5	93.8	0	0	0	111.1	D476	D476-N478 PolarHBondContact O-N 2.87Å; D476-N478 VanDerWaalsContact O-N 3.13Å
479	D	35.7	Very low	36.1	Very low	170 Å²	170	125.6 Å²	125.6	91%	0.909	73%	0.725	S	S	*	*			trans	-98.3	105.9	164.3	-81.1	-54.7	0	0	0	109.8
480	I	39.5	Very low	35.7	Very low	141 Å²	141	128.7 Å²	128.7	72%	0.723	73%	0.725	S	S	*	*			trans	-114	115.5	160	-67.5	179.7	0	0	0	106.7	V482	I480-V482 PolarHBondContact O-N 3.4Å
481	N	31.3	Very low	35.5	Very low	150 Å²	150	129.2 Å²	129.2	80%	0.802	73%	0.729	S	S	*	*			trans	-69	114.4	-176.2	178.3	10.2	0	0	0	111.8	G483	N481-G483 PolarHBondContact OD1-N 2.97Å
482	V	33.6	Very low	35.1	Very low	131 Å²	131	125.8 Å²	125.8	79%	0.794	73%	0.73	S	S	*	*			trans	-132.2	103.2	157.2	-179	0	0	0	0	108.2	I480	I480-V482 PolarHBondContact O-N 3.4Å
483	G	32.2	Very low	34.7	Very low	70 Å²	70	125.3 Å²	125.3	72%	0.722	74%	0.737	S	S	*	*			trans	-70.3	135.2	176.4	0	0	0	0	0	112.5	N481	N481-G483 PolarHBondContact OD1-N 2.97Å
484	G	26.5	Very low	34.2	Very low	77 Å²	77	126.3 Å²	126.3	79%	0.794	75%	0.751	S	S	*	*			trans	-176.7	72.5	-179.1	0	0	0	0	0	113.8	N486	G484-N486 PolarHBondContact O-N 3.03Å
485	T	29.6	Very low	33.8	Very low	138 Å²	138	124 Å²	124	85%	0.847	76%	0.755	S	S	*	*			trans	-70.4	115.8	173.1	49.9	0	0	0	0	111.2
486	N	29.8	Very low	33	Very low	167 Å²	167	127.3 Å²	127.3	89%	0.893	77%	0.767	S	S	*	*			trans	-155.9	140.6	149.5	-101.3	-33.2	0	0	0	111	G484	G484-N486 PolarHBondContact O-N 3.03Å
487	T	28.8	Very low	32.2	Very low	134 Å²	134	125.3 Å²	125.3	82%	0.822	77%	0.767	S	S	*	*			trans	-87.2	143.5	177.4	50.9	0	0	0	0	111.7
488	A	28.4	Very low	31.1	Very low	80 Å²	80	129.4 Å²	129.4	66%	0.661	78%	0.776	S	S	*	*				142.3	129.7	125.3	0	0	0	0	0	114.5
489	V	29.8	Very low	30.6	Very low	131 Å²	131	131.1 Å²	131.1	79%	0.794	78%	0.78	S	S	*	*			trans	52.3	154.7	134.5	-46.4	0	0	0	0	120.4
490	D	30.3	Very low	30.2	Very low	135 Å²	135	129.5 Å²	129.5	72%	0.722	77%	0.771	S	S	*	*			cis	-161.3	177.1	4.9	-139.6	-26.2	0	0	0	113.5
491	T	29.5	Very low	30.1	Very low	123 Å²	123	128.1 Å²	128.1	76%	0.755	77%	0.771	S	S	*	*			trans	79.1	147	165.9	74.5	0	0	0	0	117.9
492	T	30	Very low	29.9	Very low	121 Å²	121	124.7 Å²	124.7	74%	0.742	76%	0.759	S	S	*	*			cis	-131.9	149.9	20.7	51.8	0	0	0	0	116.5
493	S	32.4	Very low	29.8	Very low	108 Å²	108	126 Å²	126	76%	0.755	76%	0.76	S	S	*	*			trans	-11.3	154.9	157.9	58.4	0	0	0	0	120.4
494	V	31.7	Very low	29.7	Very low	138 Å²	138	125.5 Å²	125.5	84%	0.836	76%	0.755	S	S	*	*			cis	-145.6	169.8	47.9	176.7	0	0	0	0	112.9
495	A	32.1	Very low	29.8	Very low	81 Å²	81	131.3 Å²	131.3	67%	0.669	76%	0.761	S	S	*	*			trans	-69.4	179.8	179.8	0	0	0	0	0	114.3
496	E	26.8	Very low	29.8	Very low	187 Å²	187	128 Å²	128	87%	0.874	75%	0.754	S	S	*	*			cis	-161.6	166.7	26.8	-152	173	130.2	0	0	115.4
497	A	29.1	Very low	29.8	Very low	74 Å²	74	125.3 Å²	125.3	61%	0.612	75%	0.748	S	S	*	*			trans	73.8	88.8	149.8	0	0	0	0	0	124.3
498	R	26.3	Very low	30	Very low	228 Å²	228	125.9 Å²	125.9	86%	0.86	75%	0.751	S	S	*	*				80.4	149.5	123.7	-62.9	-170.8	-175.3	-149.4	2	123.8
499	H	29.5	Very low	30	Very low	170 Å²	170	125.8 Å²	125.8	79%	0.787	76%	0.758	S	S	*	*			trans	78.2	95.6	159.7	-81.1	-68.2	0	0	0	122
500	N	27.7	Very low	30	Very low	136 Å²	136	123 Å²	123	73%	0.727	76%	0.756	S	S	*	*			trans	-72.1	157.4	138.8	-118.5	-5.9	0	0	0	109.4
501	P	36.1	Very low	30.1	Very low	112 Å²	112	124.3 Å²	124.3	73%	0.727	76%	0.762	S	S	*	*				-122.4	157.6	66.1	12.4	10.2	0	0	0	113.2
502	S	27.2	Very low	30.2	Very low	77 Å²	77	124.9 Å²	124.9	54%	0.538	77%	0.766	S	S	.	*			cis	89.6	135.4	31.2	92.2	0	0	0	0	116
503	I	32.4	Very low	30.2	Very low	160 Å²	160	122.4 Å²	122.4	82%	0.821	76%	0.764	S	S	*	*			trans	72.1	136.7	172	-54.6	170.6	0	0	0	113.3
504	G	28.8	Very low	30	Very low	59 Å²	59	122.8 Å²	122.8	61%	0.608	77%	0.767	S	S	*	*			cis	154.3	168.5	-4.7	0	0	0	0	0	111.5
505	E	29.8	Very low	29.9	Very low	199 Å²	199	124.7 Å²	124.7	93%	0.93	77%	0.771	S	S	*	*			trans	60.1	171.2	176.4	-60.9	160	-136.6	0	0	112.4
506	G	29.1	Very low	29.7	Very low	67 Å²	67	126.3 Å²	126.3	69%	0.691	78%	0.778	S	S	*	*			cis	-170.5	129.1	-11.9	0	0	0	0	0	108.8
507	S	30.4	Very low	30	Very low	112 Å²	112	122.2 Å²	122.2	78%	0.783	78%	0.776	S	S	*	*			trans	31.9	145.3	138.1	-150.1	0	0	0	0	122.1
508	V	32.8	Very low	30.2	Very low	146 Å²	146	124.8 Å²	124.8	89%	0.885	79%	0.789	S	S	*	*			trans	60.6	152.1	175.9	-49.4	0	0	0	0	115.8
509	G	29.3	Very low	30.2	Very low	78 Å²	78	117.1 Å²	117.1	80%	0.804	78%	0.782	S	S	*	*			cis	153.3	136.6	-11	0	0	0	0	0	112
510	G	28.8	Very low	30.4	Very low	73 Å²	73	114.3 Å²	114.3	75%	0.753	78%	0.781	S	S	*	*			trans	106.6	108.2	165.2	0	0	0	0	0	118.4
511	L	31.6	Very low	30.6	Very low	161 Å²	161	116.4 Å²	116.4	84%	0.843	79%	0.786	S	S	*	*				56.4	120.7	125.3	-62	169.2	0	0	0	123
512	T	31.8	Very low	30.4	Very low	136 Å²	136	118.3 Å²	118.3	83%	0.834	79%	0.787	S	S	*	*			trans	75.1	147.4	132.8	59	0	0	0	0	122.6
513	G	29.7	Very low	30.4	Very low	68 Å²	68	119.6 Å²	119.6	70%	0.701	79%	0.788	S	S	*	*			trans	86.5	115.4	172.8	0	0	0	0	0	113.4
514	S	30	Very low	30.5	Very low	117 Å²	117	122 Å²	122	82%	0.818	79%	0.786	S	S	*	*			cis	69.7	89.8	23.9	-47.6	0	0	0	0	115.6
515	L	28.7	Very low	30.5	Very low	177 Å²	177	127.3 Å²	127.3	93%	0.927	80%	0.799	S	S	*	*				175.4	179.3	119.1	-88.5	169.4	0	0	0	111.3
516	S	28.7	Very low	30.5	Very low	116 Å²	116	121 Å²	121	81%	0.811	79%	0.788	S	S	*	*			trans	-123	-178.5	-154	-49.5	0	0	0	0	115.8
517	A	33.2	Very low	30.5	Very low	101 Å²	101	122.7 Å²	122.7	84%	0.835	80%	0.795	S	S	*	*			trans	96.7	151	166.3	0	0	0	0	0	117.9
518	S	31.7	Very low	30.6	Very low	127 Å²	127	124.9 Å²	124.9	89%	0.888	80%	0.796	S	S	*	*			cis	-172.3	154.7	-25.1	-173.7	0	0	0	0	112.4
519	G	27.9	Very low	30.4	Very low	68 Å²	68	127.5 Å²	127.5	70%	0.701	79%	0.79	S	S	*	*			trans	87.7	163.1	160.6	0	0	0	0	0	119
520	S	32.2	Very low	30.3	Very low	110 Å²	110	128.6 Å²	128.6	77%	0.769	78%	0.778	S	S	*	*			cis	-179.2	150.6	-17.3	49.9	0	0	0	0	113.9
521	H	31.7	Very low	30.3	Very low	180 Å²	180	130.8 Å²	130.8	83%	0.833	77%	0.772	S	S	*	*			trans	69.5	158.1	163.2	-92	-134.4	0	0	0	118.5
522	M	31.9	Very low	30.1	Very low	152 Å²	152	130.2 Å²	130.2	75%	0.749	77%	0.769	S	S	*	*			cis	-128.9	-174	-4.4	-64.3	-165.8	62.4	0	0	110.1
523	D	28.9	Very low	29.9	Very low	105 Å²	105	128 Å²	128	56%	0.561	76%	0.759	S	S	*	*			cis	72.9	135.3	24.6	-114.2	35.2	0	0	0	116.2
524	R	33.5	Very low	29.8	Very low	209 Å²	209	132.2 Å²	132.2	79%	0.789	76%	0.761	S	S	*	*			cis	-169.1	-179.2	-1.8	-146.3	-175.6	-165.9	129.4	-8.3	114.6
525	I	28.6	Very low	29.7	Very low	172 Å²	172	132.6 Å²	132.6	88%	0.882	76%	0.758	S	S	*	*			trans	113.2	130.9	160.5	-60.7	159.3	0	0	0	114.2
526	G	29.2	Very low	29.7	Very low	67 Å²	67	128.2 Å²	128.2	69%	0.691	75%	0.747	S	S	*	*			cis	167.8	142.1	-13	0	0	0	0	0	116.2
527	A	29	Very low	29.5	Very low	102 Å²	102	128.5 Å²	128.5	84%	0.843	75%	0.75	S	S	*	*			trans	68	156.8	168.8	0	0	0	0	0	117.8
528	I	33.2	Very low	29.5	Very low	157 Å²	157	130 Å²	130	81%	0.805	75%	0.749	S	S	*	*			cis	-134.6	151.8	13.4	-70.5	173.7	0	0	0	111.7
529	R	29.3	Very low	29.3	Very low	201 Å²	201	133 Å²	133	76%	0.758	75%	0.751	S	S	*	*			trans	-10.3	154.4	151.7	-60.9	-170	70.9	173.1	-3.7	118.1
530	D	26.5	Very low	29.2	Very low	101 Å²	101	134 Å²	134	54%	0.54	75%	0.752	S	S	.	*			cis	-165.1	161.7	5	-118.4	37.8	0	0	0	105
531	N	28.6	Very low	29	Very low	119 Å²	119	137.2 Å²	137.2	64%	0.636	76%	0.76	S	S	*	*			cis	-165.4	-175.4	-11.1	-138.6	-34.5	0	0	0	104.7
532	L	28.5	Very low	28.7	Very low	150 Å²	150	133.7 Å²	133.7	79%	0.785	76%	0.762	S	S	*	*			cis	-164	140.8	0.6	174.2	67.4	0	0	0	104.5
533	S	28	Very low	28.3	Very low	88 Å²	88	130.1 Å²	130.1	62%	0.615	76%	0.764	S	S	*	*			cis	-136.5	-159.5	1.7	63.5	0	0	0	0	110.6
534	E	27.6	Very low	28.2	Very low	157 Å²	157	130 Å²	130	73%	0.734	78%	0.778	S	S	*	*			trans	-72.6	152.2	176.4	-65.9	91.2	158.1	0	0	114.3
535	T	27.2	Very low	27.9	Very low	125 Å²	125	125.7 Å²	125.7	77%	0.767	78%	0.78	S	S	*	*			cis	93.2	117.7	22.9	-61.9	0	0	0	0	115.3
536	A	28	Very low	27.9	Very low	85 Å²	85	125.6 Å²	125.6	70%	0.702	78%	0.779	S	S	*	*			trans	29.7	140.3	152.9	0	0	0	0	0	121.9
537	S	25.6	Very low	28.1	Very low	123 Å²	123	129.3 Å²	129.3	86%	0.86	79%	0.788	S	S	*	*				-167.5	154	107.4	-84	0	0	0	0	113.8
538	T	32.1	Very low	28	Very low	133 Å²	133	128.1 Å²	128.1	82%	0.816	79%	0.787	S	S	*	*			trans	-90.8	134.8	166.4	50.3	0	0	0	0	110.6
539	M	27	Very low	27.8	Very low	190 Å²	190	126.5 Å²	126.5	94%	0.936	79%	0.789	S	S	*	*			trans	-178.4	169.3	132	-102.9	-179.5	76.2	0	0	111.7
540	A	27.3	Very low	27.8	Very low	88 Å²	88	125.3 Å²	125.3	73%	0.727	80%	0.797	S	S	*	*			trans	-95.2	159.7	-174.3	0	0	0	0	0	113.4
541	L	27.4	Very low	27.8	Very low	177 Å²	177	126.3 Å²	126.3	93%	0.927	81%	0.812	S	S	*	*			trans	-130.4	140.3	147.6	-81.2	177.2	0	0	0	109
542	A	25.8	Very low	27.7	Very low	107 Å²	107	124.5 Å²	124.5	88%	0.884	82%	0.821	S	S	*	*			trans	-95.1	146.9	173.4	0	0	0	0	0	110.2
543	G	24.3	Very low	27.7	Very low	76 Å²	76	123.4 Å²	123.4	78%	0.784	83%	0.826	S	S	*	*			trans	-146.6	113.5	-179.8	0	0	0	0	0	112
544	A	25.4	Very low	27.7	Very low	103 Å²	103	123.7 Å²	123.7	85%	0.851	83%	0.834	S	S	*	*			trans	11.3	135.9	167	0	0	0	0	0	121.7
545	S	28.2	Very low	27.6	Very low	118 Å²	118	124.9 Å²	124.9	83%	0.825	84%	0.842	S	S	*	*			trans	-57.2	149.1	163.4	-37.8	0	0	0	0	113.8
546	I	28.4	Very low	27.6	Very low	170 Å²	170	125.4 Å²	125.4	87%	0.872	84%	0.844	S	S	*	*			trans	-142	153.5	144.6	39.2	173	0	0	0	110.8
547	T	32.6	Very low	27.5	Very low	145 Å²	145	127.9 Å²	127.9	89%	0.89	85%	0.846	S	S	*	*			trans	-78.5	157.8	177.9	44.4	0	0	0	0	112
548	G	27.6	Very low	27.5	Very low	78 Å²	78	127.7 Å²	127.7	80%	0.804	84%	0.843	S	S	*	*			trans	-174.9	60.7	-177.2	0	0	0	0	0	115.2
549	S	28.5	Very low	27.3	Very low	122 Å²	122	130.7 Å²	130.7	85%	0.853	85%	0.845	S	S	*	*			trans	-74.7	127.9	171.1	-57.3	0	0	0	0	111
550	L	28.8	Very low	27.3	Very low	176 Å²	176	129.1 Å²	129.1	92%	0.921	84%	0.84	S	S	*	*			trans	-135.3	118.6	160.9	-77.8	179.1	0	0	0	110.8
551	S	28.2	Very low	27.2	Very low	123 Å²	123	134.8 Å²	134.8	86%	0.86	84%	0.843	S	S	*	*			trans	-77.6	145.7	170	-55.7	0	0	0	0	110.5
552	G	26.2	Very low	27.2	Very low	81 Å²	81	134.3 Å²	134.3	84%	0.835	84%	0.84	S	S	*	*			trans	-136.9	85.1	177	0	0	0	0	0	111.5
553	S	27.6	Very low	27.3	Very low	126 Å²	126	135.8 Å²	135.8	88%	0.881	83%	0.829	S	S	*	*			trans	-76.5	136.2	175.9	-55.9	0	0	0	0	111
554	A	27.7	Very low	27.3	Very low	95 Å²	95	138.7 Å²	138.7	79%	0.785	83%	0.831	S	S	*	*			trans	-137.3	121.4	171.6	0	0	0	0	0	110.4
555	M	26.3	Very low	27.4	Very low	182 Å²	182	142.4 Å²	142.4	90%	0.897	83%	0.831	S	S	*	*			trans	-76.2	152.8	170.9	-58.1	176.2	-174	0	0	110
556	V	25.9	Very low	27.4	Very low	135 Å²	135	141.6 Å²	141.6	82%	0.818	83%	0.832	S	S	*	*			trans	-127.8	112.6	166.3	179.4	0	0	0	0	108.4
557	N	26.6	Very low	27.2	Very low	138 Å²	138	139.8 Å²	139.8	74%	0.738	82%	0.824	S	S	*	*			trans	-73.7	141.8	175.8	-85.8	-15.4	0	0	0	111.3
558	C	26	Very low	27	Very low	118 Å²	118	138.7 Å²	138.7	80%	0.797	82%	0.816	S	S	*	*			trans	-82.2	142.5	170.7	-47.1	0	0	0	0	110.6
559	F	27.7	Very low	26.9	Very low	196 Å²	196	142.2 Å²	142.2	86%	0.86	81%	0.812	S	S	*	*			trans	-143.7	150.7	162.6	-95.5	-74.2	0	0	0	111.3
560	N	27.3	Very low	26.8	Very low	157 Å²	157	144.2 Å²	144.2	84%	0.84	81%	0.805	S	S	*	*			trans	-83.7	147.8	-164.8	-64.3	-26.3	0	0	0	113.7
561	R	25.3	Very low	26.7	Very low	208 Å²	208	141.1 Å²	141.1	79%	0.785	79%	0.786	S	S	*	*			trans	-71.3	137.8	163.6	171.7	172.4	165.9	171.6	-9.5	109.4	E563	R561-E563 IonicContact CZ-OE1 3.19Å; R561-E563 VanDerWaalsContact CZ-OE1 3.23Å; R561-E563 IonicContact NE-OE1 3.52Å; R561-E563 PolarHBondContact NE-OE1 3.23Å; R561-E563 IonicContact NH2-OE1 3.56Å; R561-E563 PolarHBondContact NH2-OE1 3.49Å
562	L	26.6	Very low	26.6	Very low	166 Å²	166	144 Å²	144	87%	0.869	78%	0.778	S	S	*	*			trans	-124.9	146.1	168.2	-148	110.5	0	0	0	108.4
563	E	27.2	Very low	26.5	Very low	138 Å²	138	149.6 Å²	149.6	65%	0.645	78%	0.776	S	S	*	*			trans	-134.8	138.1	-163.3	-166.3	157.3	-84.4	0	0	110.3	R561	R561-E563 IonicContact CZ-OE1 3.19Å; R561-E563 VanDerWaalsContact CZ-OE1 3.23Å; R561-E563 IonicContact NE-OE1 3.52Å; R561-E563 PolarHBondContact NE-OE1 3.23Å; R561-E563 IonicContact NH2-OE1 3.56Å; R561-E563 PolarHBondContact NH2-OE1 3.49Å
564	V	24.8	Very low	26.4	Very low	137 Å²	137	148 Å²	148	83%	0.83	76%	0.764	S	S	*	*			trans	-139.8	126.7	179.1	-177.6	0	0	0	0	109.5
565	Q	28.1	Very low	26.2	Very low	182 Å²	182	151 Å²	151	85%	0.85	77%	0.766	S	S	*	*			trans	-101.3	148.9	-177.9	-175.5	178.7	6.6	0	0	110.7
566	A	27.6	Very low	26.2	Very low	101 Å²	101	148 Å²	148	84%	0.835	76%	0.763	S	S	*	*			trans	-142.7	138.1	166.4	0	0	0	0	0	110.2
567	D	24.8	Very low	26.2	Very low	131 Å²	131	144.7 Å²	144.7	70%	0.701	76%	0.757	S	S	*	*			trans	-119.8	164	180	176.3	34	0	0	0	109.7
568	V	28	Very low	26.1	Very low	122 Å²	122	147.3 Å²	147.3	74%	0.739	77%	0.765	S	S	*	*			trans	160.5	109.4	140.5	159	0	0	0	0	110.9
569	Q	25.1	Very low	26.1	Very low	153 Å²	153	147 Å²	147	72%	0.715	76%	0.763	S	S	*	*			trans	10.9	145.9	137	-51.3	178.7	-3.1	0	0	118.3
570	K	26.3	Very low	26.5	Very low	163 Å²	163	141.7 Å²	141.7	71%	0.709	76%	0.764	S	S	*	*				-176.4	154.1	61	-168	168.4	-178.9	166.9	0	114.9
571	E	27.8	Very low	26.5	Very low	111 Å²	111	140.2 Å²	140.2	52%	0.519	76%	0.761	S	S	.	*			trans	-14.6	165.8	164.8	-39	169.3	78.4	0	0	121.7
572	R	26	Very low	26.7	Very low	184 Å²	184	137.3 Å²	137.3	69%	0.694	77%	0.766	S	S	*	*			cis	-156.7	146.2	30.5	-86.6	-161.9	170.2	145.7	15.5	115.4
573	Y	24.1	Very low	26.6	Very low	199 Å²	199	134.7 Å²	134.7	78%	0.78	76%	0.762	S	S	*	*			trans	51.2	149.8	135.4	-70.3	-119.2	0	0	0	120.2
574	S	24.2	Very low	26.7	Very low	91 Å²	91	136.6 Å²	136.6	64%	0.636	78%	0.775	S	S	*	*			cis	177.6	171.7	-7.9	-92.5	0	0	0	0	107.6
575	L	25.3	Very low	26.8	Very low	158 Å²	158	133.6 Å²	133.6	83%	0.827	77%	0.773	S	S	*	*			cis	-162.5	171.5	-2.2	-123	171.7	0	0	0	109.7
576	S	25	Very low	26.9	Very low	119 Å²	119	131.3 Å²	131.3	83%	0.832	77%	0.771	S	S	*	*			trans	72.3	129.7	161.3	-153.1	0	0	0	0	118.5
577	G	26.5	Very low	27.2	Very low	67 Å²	67	132.9 Å²	132.9	69%	0.691	77%	0.77	S	S	*	*			cis	-176.1	159.6	-3.9	0	0	0	0	0	116
578	E	25	Very low	27.4	Very low	193 Å²	193	130.6 Å²	130.6	90%	0.902	76%	0.764	S	S	*	*			trans	60.6	86.5	150.4	-148.4	163.7	152.9	0	0	121.1
579	S	25.9	Very low	27.7	Very low	110 Å²	110	131.9 Å²	131.9	77%	0.769	77%	0.767	S	S	*	*				179.8	146.1	116.3	-81.1	0	0	0	0	113.7	T581	S579-T581 PolarHBondContact O-N 2.9Å
580	G	35.3	Very low	28.5	Very low	85 Å²	85	130.5 Å²	130.5	88%	0.876	77%	0.765	S	S	*	*			trans	-36.7	117.3	-168.4	0	0	0	0	0	118.9
581	T	27.9	Very low	29.1	Very low	126 Å²	126	125.9 Å²	125.9	77%	0.773	76%	0.757	S	S	*	*			trans	-135	144.4	165.8	48.3	0	0	0	0	111	S579	S579-T581 PolarHBondContact O-N 2.9Å
582	V	29	Very low	30.3	Very low	147 Å²	147	121.7 Å²	121.7	89%	0.891	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-83.1	122.9	178.8	-167.3	0	0	0	0	108.7
583	S	24.6	Very low	31.8	Very low	112 Å²	112	115 Å²	115	78%	0.783	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-85.4	124.7	-174.7	-68.7	0	0	0	0	112.3
584	L	30.4	Very low	33.5	Very low	177 Å²	177	113.2 Å²	113.2	93%	0.927	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-74.7	125.8	167.4	-79.9	139.7	0	0	0	110.2
585	G	26	Very low	35	Very low	75 Å²	75	109.2 Å²	109.2	77%	0.773	69%	0.688	S	S	*	*			trans	-113.3	137.2	164.2	0	0	0	0	0	109.6
586	T	30.6	Very low	36.4	Very low	133 Å²	133	107 Å²	107	82%	0.816	68%	0.675	S	S	*	*			trans	-92.1	155.4	-170.3	49.6	0	0	0	0	113.9
587	V	33.7	Very low	37.4	Very low	134 Å²	134	103 Å²	103	81%	0.812	65%	0.649	S	S	*	*			trans	72	83.1	173.4	-164.3	0	0	0	0	114.6
588	S	29.9	Very low	38	Very low	83 Å²	83	102.4 Å²	102.4	58%	0.58	64%	0.643	S	S	*	*			trans	-144.2	118.5	148.7	177.8	0	0	0	0	107.9	N590	S588-N590 PolarHBondContact O-N 2.9Å; S588-N590 VanDerWaalsContact O-N 3.14Å
589	D	34.1	Very low	38.5	Very low	149 Å²	149	98.2 Å²	98.2	80%	0.797	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	6.9	-178.5	-62.2	-30.5	0	0	0	112.6
590	N	41.7	Very low	38.9	Very low	125 Å²	125	100.1 Å²	100.1	67%	0.668	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	20.7	-174.8	-63.1	107.9	0	0	0	114.4	S588 S592	S588-N590 PolarHBondContact O-N 2.9Å; S588-N590 VanDerWaalsContact O-N 3.14Å; N590-S592 PolarHBondContact O-N 3.42Å
591	A	38	Very low	38.6	Very low	66 Å²	66	103.1 Å²	103.1	55%	0.545	63%	0.63	S	S	.	*			trans	-72.1	36.6	176.5	0	0	0	0	0	114.3
592	S	52.7	Low	38.6	Very low	22 Å²	22	104.2 Å²	104.2	15%	0.154	63%	0.631	C	S	.	*			trans	-93.6	132.1	178.9	-174.2	0	0	0	0	111.1	H318 T320 N590 K594	H318-S592 VanDerWaalsContact ND1-CB 3.31Å; H318-S592 WeakPolarHBondContact ND1-CB 3.41Å; H318-S592 PolarHBondContact ND1-OG 2.94Å; H318-S592 PolarHBondContact O-OG 3.26Å; T320-S592 PolarHBondContact N-OG 2.98Å; T320-S592 WeakPolarHBondContact OG1-CB 3.38Å; T320-S592 PolarHBondContact OG1-OG 3.08Å; N590-S592 PolarHBondContact O-N 3.42Å; S592-K594 PolarHBondContact O-N 2.85Å; S592-K594 VanDerWaalsContact O-N 3.12Å
593	T	58	Low	38.5	Very low	43 Å²	43	101.8 Å²	101.8	26%	0.264	62%	0.62	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.9	102.3	173.1	-60.3	0	0	0	0	108.9	H318 M319 A595	H318-T593 PolarHBondContact O-N 3.39Å; M319-T593 WeakPolarHBondContact CA-O 3.3Å; T593-A595 PolarHBondContact O-N 3.1Å
594	K	60.4	Low	38.6	Very low	162 Å²	162	106.1 Å²	106.1	70%	0.704	62%	0.621	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-59.2	127.3	176.7	-73.4	-174.8	178.9	178	0	110.4	S592	S592-K594 PolarHBondContact O-N 2.85Å; S592-K594 VanDerWaalsContact O-N 3.12Å
595	A	55.3	Low	38.5	Very low	7 Å²	7	104.3 Å²	104.3	6%	0.058	61%	0.611	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.6	129.5	179	0	0	0	0	0	111.9	I308 M319 T320 T593	I308-A595 HydrophobicContact CB-CB 4.18Å; I308-A595 HydrophobicContact CD1-CB 3.71Å; I308-A595 HydrophobicContact CG1-CB 3.79Å; I308-A595 HydrophobicContact CG2-CB 3.38Å; M319-A595 HydrophobicContact CE-CB 4.07Å; T320-A595 WeakPolarHBondContact O-CB 3.38Å; T320-A595 PolarHBondContact O-N 3.36Å; T593-A595 PolarHBondContact O-N 3.1Å
596	M	53.7	Low	38.6	Very low	113 Å²	113	105.7 Å²	105.7	56%	0.557	61%	0.606	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.8	124.5	158.4	-60.4	-157.1	-43.5	0	0	108.9	I309 M311	I309-M596 PolarHBondContact N-O 2.93Å; M311-M596 HydrophobicContact CE-CE 3.44Å; M311-M596 VanDerWaalsContact CE-CE 3.44Å; M311-M596 HydrophobicContact CE-CG 4.34Å; M311-M596 HydrophobicContact CE-SD 3.59Å; M311-M596 VanDerWaalsContact CE-SD 3.59Å
597	A	46.5	Very low	38.5	Very low	35 Å²	35	106.3 Å²	106.3	29%	0.289	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.2	142.3	166.1	0	0	0	0	0	109.1	Y307 V323 S599	Y307-A597 WeakPolarHBondContact O-CA 3.22Å; V323-A597 HydrophobicContact CG2-CB 3.89Å; A597-S599 PolarHBondContact O-N 3.4Å
598	G	39	Very low	38.3	Very low	54 Å²	54	106.6 Å²	106.6	56%	0.557	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-68.3	117.3	177	0	0	0	0	0	111.5	Y307	Y307-G598 PolarHBondContact O-N 3.42Å
599	S	35.6	Very low	38.1	Very low	104 Å²	104	112.1 Å²	112.1	73%	0.727	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-74.2	127.7	170.2	-176.1	0	0	0	0	110.1	A597	A597-S599 PolarHBondContact O-N 3.4Å
600	I	34.1	Very low	37.8	Very low	150 Å²	150	113.5 Å²	113.5	77%	0.769	62%	0.616	S	S	*	*			trans	-89.9	102.6	171.7	-52.7	176.1	0	0	0	106.6	N602	I600-N602 PolarHBondContact O-N 2.68Å
601	L	29.8	Very low	37.1	Very low	149 Å²	149	111.3 Å²	111.3	78%	0.78	62%	0.623	S	S	*	*			trans	-67.5	122.4	172.8	-91.9	92.4	0	0	0	109.9	S603	L601-S603 PolarHBondContact O-N 3.34Å
602	N	28.1	Very low	36.5	Very low	148 Å²	148	115.9 Å²	115.9	79%	0.791	64%	0.638	S	S	*	*			trans	-73.7	91.4	171.2	-173	17.8	0	0	0	109.8	I600 Y604	I600-N602 PolarHBondContact O-N 2.68Å; N602-Y604 PolarHBondContact O-N 3.07Å
603	S	26.7	Very low	35.2	Very low	96 Å²	96	119.2 Å²	119.2	67%	0.671	66%	0.661	S	S	*	*			trans	-74.6	91.9	-179.2	57.4	0	0	0	0	111.3	L601 I605	L601-S603 PolarHBondContact O-N 3.34Å; S603-I605 PolarHBondContact O-N 3.44Å
604	Y	26.3	Very low	33.8	Very low	203 Å²	203	124.7 Å²	124.7	80%	0.796	69%	0.686	S	S	*	*			trans	-67.6	121.8	176.2	-155.3	-95.6	0	0	0	110.6	N602 P606	N602-Y604 PolarHBondContact O-N 3.07Å; Y604-P606 HydrophobicContact CD1-CG 4.23Å
605	I	28.3	Very low	32	Very low	140 Å²	140	126.4 Å²	126.4	72%	0.718	70%	0.696	S	S	*	*			trans	-114.4	105.6	177.8	-58.6	174.9	0	0	0	109	S603	S603-I605 PolarHBondContact O-N 3.44Å
606	P	27.2	Very low	30.6	Very low	104 Å²	104	131.6 Å²	131.6	68%	0.675	73%	0.727	S	S	*	*			trans	-79.3	136.2	163.2	-4.6	23.1	0	0	0	109.8	Y604	Y604-P606 HydrophobicContact CD1-CG 4.23Å
607	L	30.2	Very low	29.1	Very low	146 Å²	146	135.2 Å²	135.2	76%	0.764	74%	0.743	S	S	*	*			trans	-91.4	133.6	170.3	-82	164.5	0	0	0	111.3
608	D	28.3	Very low	28.1	Very low	140 Å²	140	139 Å²	139	75%	0.749	76%	0.762	S	S	*	*			trans	48.5	115.6	147.9	-51.4	-25.9	0	0	0	120.9
609	K	25.9	Very low	27.4	Very low	198 Å²	198	143.6 Å²	143.6	86%	0.861	77%	0.774	S	S	*	*			trans	-151.4	141.4	132.1	-150.1	164.4	-171.6	170.3	0	111.5
610	E	27.8	Very low	27	Very low	179 Å²	179	145.7 Å²	145.7	84%	0.836	78%	0.775	S	S	*	*			trans	-75.7	142.2	-164.6	-62.3	88.9	155.9	0	0	114.8
611	G	26.6	Very low	26.6	Very low	79 Å²	79	144.6 Å²	144.6	81%	0.814	77%	0.767	S	S	*	*			trans	-156.1	142.5	171.4	0	0	0	0	0	110.2
612	N	25.8	Very low	26.4	Very low	161 Å²	161	143.4 Å²	143.4	86%	0.861	77%	0.771	S	S	*	*			trans	-112.2	132.2	-159.6	-169.6	21.2	0	0	0	114.4
613	S	24.7	Very low	26.3	Very low	92 Å²	92	143.4 Å²	143.4	64%	0.643	76%	0.764	S	S	*	*			trans	48.3	115.9	154.1	-165.5	0	0	0	0	120.6
614	M	28.9	Very low	26.9	Very low	159 Å²	159	144.5 Å²	144.5	78%	0.783	77%	0.768	S	S	*	*				177.2	125.8	106.7	-96.9	176.9	59.8	0	0	111.3	V616	M614-V616 HydrophobicContact CE-CG2 4.42Å
615	E	24	Very low	26.8	Very low	197 Å²	197	139.1 Å²	139.1	92%	0.921	76%	0.761	S	S	*	*			trans	-93.4	133.5	168.6	-67.6	-174.6	135.2	0	0	110.8
616	V	24.9	Very low	26.6	Very low	116 Å²	116	141.1 Å²	141.1	70%	0.703	76%	0.764	S	S	*	*			trans	-136.6	109.2	167.7	176.8	0	0	0	0	108.2	M614 V618	M614-V616 HydrophobicContact CE-CG2 4.42Å; V616-V618 HydrophobicContact CG1-CG2 4.24Å
617	Q	23.1	Very low	26.3	Very low	189 Å²	189	144.2 Å²	144.2	88%	0.883	77%	0.767	S	S	*	*			trans	-96	121.6	175.7	-173.4	-179.7	22.1	0	0	109.9
618	V	25.2	Very low	26.1	Very low	114 Å²	114	146 Å²	146	69%	0.691	76%	0.764	S	S	*	*			trans	-138.6	127.1	167.4	-178.7	0	0	0	0	108.4	V616 I620	V616-V618 HydrophobicContact CG1-CG2 4.24Å; V618-I620 HydrophobicContact CG1-CD1 3.99Å; V618-I620 HydrophobicContact CG1-CG1 3.98Å
619	D	23.4	Very low	26	Very low	152 Å²	152	146.4 Å²	146.4	81%	0.813	76%	0.761	S	S	*	*			trans	-122.9	121.9	178	-176.4	15.9	0	0	0	108.1
620	I	27.8	Very low	25.9	Very low	147 Å²	147	144.4 Å²	144.4	75%	0.754	76%	0.76	S	S	*	*			trans	-138.9	118.8	-177.4	-67.7	-176.1	0	0	0	111.4	V618	V618-I620 HydrophobicContact CG1-CD1 3.99Å; V618-I620 HydrophobicContact CG1-CG1 3.98Å
621	E	25.3	Very low	26	Very low	128 Å²	128	141.7 Å²	141.7	60%	0.598	76%	0.76	S	S	*	*			trans	-77.5	155.9	174.5	-162.7	-150.3	116.7	0	0	112.6	K623	E621-K623 VanDerWaalsContact OE1-CB 3.26Å; E621-K623 WeakPolarHBondContact OE1-CB 3.29Å; E621-K623 WeakPolarHBondContact OE1-CD 3.48Å; E621-K623 WeakPolarHBondContact OE1-CG 3.34Å; E621-K623 PolarHBondContact OE1-N 3.49Å; E621-K623 IonicContact OE1-NZ 3.15Å; E621-K623 PolarHBondContact OE1-NZ 2.86Å; E621-K623 IonicContact OE2-NZ 3.62Å; E621-K623 PolarHBondContact OE2-NZ 3.37Å
622	S	25.3	Very low	26	Very low	123 Å²	123	141 Å²	141	86%	0.86	75%	0.754	S	S	*	*			trans	-133.4	90.8	160.5	56.8	0	0	0	0	114.4
623	K	27.4	Very low	26.2	Very low	149 Å²	149	138.6 Å²	138.6	65%	0.648	75%	0.749	S	S	*	*			trans	-57.7	171.3	154.8	-114.4	174.7	-147.2	78.6	0	111.2	E621	E621-K623 VanDerWaalsContact OE1-CB 3.26Å; E621-K623 WeakPolarHBondContact OE1-CB 3.29Å; E621-K623 WeakPolarHBondContact OE1-CD 3.48Å; E621-K623 WeakPolarHBondContact OE1-CG 3.34Å; E621-K623 PolarHBondContact OE1-N 3.49Å; E621-K623 IonicContact OE1-NZ 3.15Å; E621-K623 PolarHBondContact OE1-NZ 2.86Å; E621-K623 IonicContact OE2-NZ 3.62Å; E621-K623 PolarHBondContact OE2-NZ 3.37Å
624	P	38.1	Very low	26.5	Very low	118 Å²	118	139.7 Å²	139.7	77%	0.766	76%	0.757	S	S	*	*				-144.3	177.2	50.1	45.3	-26	0	0	0	114.8
625	S	24	Very low	26.6	Very low	91 Å²	91	137.1 Å²	137.1	64%	0.636	76%	0.755	S	S	*	*			cis	-156.1	-173.7	25.4	47.1	0	0	0	0	109.2
626	K	24.1	Very low	26.9	Very low	181 Å²	181	133.6 Å²	133.6	79%	0.787	75%	0.746	S	S	*	*			cis	-152.4	166.2	20.7	-57.5	172.7	-178.3	175.5	0	111.6
627	F	22.1	Very low	27.1	Very low	169 Å²	169	135.4 Å²	135.4	74%	0.741	75%	0.752	S	S	*	*			trans	18.8	137.7	138.4	-77.7	-123.5	0	0	0	120
628	R	25	Very low	27.5	Very low	183 Å²	183	133.8 Å²	133.8	69%	0.691	75%	0.75	S	S	*	*			cis	-168.1	146.3	-0.5	-131	-168.2	172.4	152.8	2.2	111.9
629	H	26.6	Very low	27.6	Very low	149 Å²	149	132 Å²	132	69%	0.69	76%	0.755	S	S	*	*			trans	35.6	136.2	158.1	-50.1	-49.4	0	0	0	121
630	N	24.1	Very low	27.9	Very low	157 Å²	157	130.6 Å²	130.6	84%	0.84	76%	0.756	S	S	*	*				-162.3	174.2	69.7	-121.4	-0.8	0	0	0	115.4
631	S	29.8	Very low	27.9	Very low	121 Å²	121	128.4 Å²	128.4	85%	0.846	76%	0.761	S	S	*	*			trans	-88.8	167.3	-157.5	-39.9	0	0	0	0	119.6
632	G	25.5	Very low	28.1	Very low	66 Å²	66	128.6 Å²	128.6	68%	0.68	77%	0.771	S	S	*	*			trans	151	91.9	155.2	0	0	0	0	0	115
633	S	30.2	Very low	28.3	Very low	109 Å²	109	133.5 Å²	133.5	76%	0.762	77%	0.77	S	S	*	*				64.3	103.1	91.5	66.6	0	0	0	0	115.1
634	S	32.6	Very low	28.5	Very low	116 Å²	116	130.5 Å²	130.5	81%	0.811	77%	0.768	S	S	*	*				89.2	127.4	54.9	69.2	0	0	0	0	115
635	S	29.2	Very low	28	Very low	104 Å²	104	134 Å²	134	73%	0.727	77%	0.774	S	S	*	*			trans	-170.3	107.8	158.9	-168	0	0	0	0	114.7
636	V	31.9	Very low	28.2	Very low	123 Å²	123	134.5 Å²	134.5	75%	0.745	78%	0.783	S	S	*	*			trans	51.6	163.6	142.7	-42	0	0	0	0	120.8
637	D	28.8	Very low	28.4	Very low	154 Å²	154	129.9 Å²	129.9	82%	0.824	79%	0.787	S	S	*	*			cis	-145.4	169.7	9.7	-128.4	-38.4	0	0	0	112.8
638	D	30.3	Very low	28.6	Very low	155 Å²	155	125.8 Å²	125.8	83%	0.829	79%	0.792	S	S	*	*			trans	-97.4	166.1	-171.8	-126.9	-49.8	0	0	0	114.5
639	G	28.2	Very low	28.7	Very low	78 Å²	78	122.8 Å²	122.8	80%	0.804	80%	0.8	S	S	*	*			trans	174.2	84.4	175.9	0	0	0	0	0	118.2
640	S	29.2	Very low	28.8	Very low	121 Å²	121	120.9 Å²	120.9	85%	0.846	80%	0.803	S	S	*	*			trans	-87.9	143.8	-179	-75.7	0	0	0	0	116
641	A	29.3	Very low	29.1	Very low	102 Å²	102	119 Å²	119	84%	0.843	80%	0.802	S	S	*	*			trans	-154.7	130.9	150.4	0	0	0	0	0	112.7
642	T	29.4	Very low	28.9	Very low	131 Å²	131	117 Å²	117	80%	0.804	80%	0.8	S	S	*	*			trans	-92.3	167.1	167.4	59.7	0	0	0	0	109.1
643	R	29.3	Very low	29.2	Very low	226 Å²	226	121.9 Å²	121.9	85%	0.853	81%	0.81	S	S	*	*			cis	-179.9	157.9	49.8	-151.2	178.8	-164.1	171.7	4.5	112.3
644	S	29.9	Very low	29.8	Very low	87 Å²	87	122.3 Å²	122.3	61%	0.608	81%	0.81	S	S	*	*			trans	57.8	104	147.6	52.7	0	0	0	0	122.9
645	H	28.1	Very low	29.8	Very low	192 Å²	192	125.5 Å²	125.5	89%	0.889	81%	0.813	S	S	*	*				66.4	128.3	118.5	-78.1	-70.7	0	0	0	124.9
646	A	29.1	Very low	29.7	Very low	100 Å²	100	124.2 Å²	124.2	83%	0.826	82%	0.816	S	S	*	*				97.6	118.1	128	0	0	0	0	0	121.6
647	G	26.7	Very low	29.6	Very low	84 Å²	84	127.2 Å²	127.2	87%	0.866	82%	0.819	S	S	*	*				114.7	139.1	129.1	0	0	0	0	0	118.4
648	G	26.3	Very low	29.5	Very low	83 Å²	83	125.2 Å²	125.2	86%	0.856	82%	0.816	S	S	*	*			trans	100	95.5	148.3	0	0	0	0	0	118
649	S	28.2	Very low	29.3	Very low	121 Å²	121	123.7 Å²	123.7	85%	0.846	82%	0.818	S	S	*	*			trans	-68.5	145.5	164.5	-41.4	0	0	0	0	112.2
650	S	28.8	Very low	29.4	Very low	108 Å²	108	124.5 Å²	124.5	76%	0.755	82%	0.817	S	S	*	*				167.8	138.3	118.9	58.8	0	0	0	0	115.4
651	S	29.9	Very low	29.5	Very low	118 Å²	118	125.1 Å²	125.1	83%	0.825	82%	0.816	S	S	*	*			trans	35.6	127	145.9	60.6	0	0	0	0	122.5
652	G	25.8	Very low	29.5	Very low	78 Å²	78	127.5 Å²	127.5	80%	0.804	81%	0.808	S	S	*	*			trans	179	100.2	158.7	0	0	0	0	0	116.2
653	L	31.6	Very low	29.3	Very low	169 Å²	169	131.4 Å²	131.4	89%	0.885	81%	0.808	S	S	*	*			trans	-97.7	160.7	151.9	-122	80	0	0	0	107.5
654	P	43.9	Very low	29.3	Very low	119 Å²	119	125.6 Å²	125.6	77%	0.773	80%	0.802	S	S	*	*				-149.3	-153.6	57.3	42.5	-20.3	0	0	0	115.5
655	E	30.9	Very low	29.4	Very low	183 Å²	183	131.2 Å²	131.2	86%	0.855	82%	0.815	S	S	*	*			trans	-69.6	163.5	-170.2	-54.2	166.3	83	0	0	116.8
656	G	28.2	Very low	29.2	Very low	77 Å²	77	130.9 Å²	130.9	79%	0.794	81%	0.814	S	S	*	*			trans	-164.7	145.1	165.9	0	0	0	0	0	112.9
657	K	29.2	Very low	29.3	Very low	186 Å²	186	130 Å²	130	81%	0.809	81%	0.807	S	S	*	*			trans	-117.2	146.3	-171.4	-71.7	177	179.5	168.3	0	114.3
658	S	26.6	Very low	29.5	Very low	111 Å²	111	132.7 Å²	132.7	78%	0.776	81%	0.807	S	S	*	*			trans	77.5	158.1	137.2	74.4	0	0	0	0	122.6
659	S	27.6	Very low	29.6	Very low	124 Å²	124	133.8 Å²	133.8	87%	0.867	81%	0.808	S	S	*	*			trans	108.2	136.1	148	81.5	0	0	0	0	119
660	A	29.6	Very low	29.6	Very low	95 Å²	95	131.1 Å²	131.1	79%	0.785	80%	0.8	S	S	*	*			trans	-101.4	164.2	-156.3	0	0	0	0	0	115
661	T	31.4	Very low	29.6	Very low	134 Å²	134	135.8 Å²	135.8	82%	0.822	81%	0.806	S	S	*	*			trans	-164	137.7	142.4	23.5	0	0	0	0	107.2
662	K	29.9	Very low	29.5	Very low	152 Å²	152	139.3 Å²	139.3	66%	0.661	81%	0.807	S	S	*	*			cis	93.6	100.2	32.4	-174.2	-159.4	177.5	-170	0	113.2
663	W	24.9	Very low	29.5	Very low	212 Å²	212	140.6 Å²	140.6	80%	0.803	80%	0.803	S	S	*	*				-170.5	169.7	117.2	-128.5	-83.1	0	0	0	113.2
664	S	28.2	Very low	29.4	Very low	105 Å²	105	141.8 Å²	141.8	73%	0.734	80%	0.801	S	S	*	*			trans	-138.6	138.3	-173.8	-53.4	0	0	0	0	114
665	K	32.3	Very low	28.5	Very low	204 Å²	204	141.6 Å²	141.6	89%	0.887	80%	0.803	S	S	*	*			trans	36	120.2	132.1	-173.2	-175.9	-177.8	179.3	0	121.7
666	E	24.1	Very low	28.3	Very low	185 Å²	185	136.8 Å²	136.8	86%	0.864	80%	0.802	S	S	*	*			trans	-151.2	143.4	143.8	-97.2	177.9	162.2	0	0	107.4
667	A	31.4	Very low	28.5	Very low	83 Å²	83	142.9 Å²	142.9	69%	0.686	81%	0.807	S	S	*	*				77	140.3	61.1	0	0	0	0	0	113
668	T	30.7	Very low	28.4	Very low	140 Å²	140	142 Å²	142	86%	0.859	81%	0.81	S	S	*	*			cis	-163.1	175.9	7.9	-16.5	0	0	0	0	113.1
669	A	28.5	Very low	28.6	Very low	105 Å²	105	147.5 Å²	147.5	87%	0.868	81%	0.814	S	S	*	*			trans	86.4	156.4	151.1	0	0	0	0	0	122
670	G	27.4	Very low	28.6	Very low	66 Å²	66	150.6 Å²	150.6	68%	0.68	81%	0.812	S	S	*	*			trans	-171	-175.9	179.9	0	0	0	0	0	112.5
671	K	29	Very low	28.6	Very low	206 Å²	206	155.1 Å²	155.1	90%	0.896	81%	0.814	S	S	*	*			trans	-166.6	128	177	-107	150.5	-173.2	173.6	0	117.7
672	K	27.9	Very low	28.4	Very low	192 Å²	192	151.8 Å²	151.8	84%	0.835	81%	0.806	S	S	*	*			trans	36.6	117.8	138.5	-61.5	-170.8	176.3	-174	0	124.3
673	S	27.1	Very low	28.2	Very low	104 Å²	104	151.6 Å²	151.6	73%	0.727	81%	0.812	S	S	*	*				60.2	127.9	127.4	70.4	0	0	0	0	124.4
674	K	28.6	Very low	28.6	Very low	194 Å²	194	148.8 Å²	148.8	84%	0.843	81%	0.81	S	S	*	*				179	151.1	108.6	-109.6	-177	177.9	178.6	0	116.1
675	S	24.9	Very low	28.7	Very low	115 Å²	115	152.2 Å²	152.2	80%	0.804	81%	0.811	S	S	*	*			trans	9	138.4	153.4	59.1	0	0	0	0	123.6
676	G	27.6	Very low	28.5	Very low	82 Å²	82	150.2 Å²	150.2	85%	0.845	81%	0.809	S	S	*	*			trans	-167	140.7	156.4	0	0	0	0	0	113.6
677	K	32.2	Very low	28.7	Very low	205 Å²	205	146.9 Å²	146.9	89%	0.891	80%	0.797	S	S	*	*			trans	-152.6	108.8	-177.6	177.9	-179.5	179.6	175.6	0	112.6
678	L	27.4	Very low	28.8	Very low	169 Å²	169	150.1 Å²	150.1	89%	0.885	80%	0.798	S	S	*	*			trans	-169.5	156.6	175.1	-136.9	60.2	0	0	0	110
679	R	29	Very low	28.7	Very low	225 Å²	225	149.5 Å²	149.5	85%	0.849	79%	0.794	S	S	*	*			cis	-176	174.1	-38.1	-165.7	175.8	-175.1	-155.4	3.9	107.5
680	K	29.4	Very low	29	Very low	190 Å²	190	152.7 Å²	152.7	83%	0.826	78%	0.784	S	S	*	*			trans	80.9	125.7	164.8	-126	166.9	177.3	-174.5	0	113.1
681	K	28.2	Very low	29.3	Very low	190 Å²	190	156.1 Å²	156.1	83%	0.826	78%	0.782	S	S	*	*			cis	73.9	125.1	46.7	-175.4	-170.5	-178.3	-178.5	0	111.8
682	G	26.9	Very low	29.3	Very low	63 Å²	63	153.2 Å²	153.2	65%	0.649	78%	0.776	S	S	*	*			cis	161.5	-175.7	-0.2	0	0	0	0	0	111.9
683	N	27.6	Very low	29.6	Very low	148 Å²	148	151.5 Å²	151.5	79%	0.791	77%	0.773	S	S	*	*			trans	77.2	168	173.1	-61.5	23	0	0	0	118.8
684	M	32.7	Very low	29.9	Very low	153 Å²	153	152.5 Å²	152.5	75%	0.754	77%	0.77	S	S	*	*				-178.2	156.4	-51.5	-142.9	159.3	67.5	0	0	112.2
685	K	29	Very low	30.2	Very low	178 Å²	178	146.7 Å²	146.7	77%	0.774	76%	0.759	S	S	*	*			trans	69.7	165.3	168.6	-84.4	-169.2	172.6	-167.1	0	116
686	I	29.9	Very low	30.6	Very low	162 Å²	162	148.7 Å²	148.7	83%	0.831	76%	0.755	S	S	*	*			cis	-135.8	174.9	36.1	-62.3	161.1	0	0	0	113
687	N	27.6	Very low	30.7	Very low	114 Å²	114	150.2 Å²	150.2	61%	0.61	74%	0.743	S	S	*	*			trans	-108.2	160.5	-168.9	-97.9	39	0	0	0	115.8
688	E	32.3	Very low	30.5	Very low	152 Å²	152	147 Å²	147	71%	0.71	74%	0.735	S	S	*	*			trans	56.9	125.4	140.3	-68.3	170	100.4	0	0	124.5
689	T	30.1	Very low	30.7	Very low	127 Å²	127	144.8 Å²	144.8	78%	0.779	72%	0.72	S	S	*	*				-169.8	133.1	114.1	32.4	0	0	0	0	107.2
690	R	34.1	Very low	30.7	Very low	172 Å²	172	140.4 Å²	140.4	65%	0.649	71%	0.709	S	S	*	*				64.9	124.9	65	-66.1	170.4	49.5	65.3	9.2	111.8
691	E	34.3	Very low	30.6	Very low	137 Å²	137	138.7 Å²	138.7	64%	0.64	70%	0.704	S	S	*	*			cis	-134.6	-159.3	3.1	-100.8	139.1	149.2	0	0	109.9
692	D	28.1	Very low	30.5	Very low	146 Å²	146	133.9 Å²	133.9	78%	0.781	70%	0.695	S	S	*	*			cis	-158.2	-162	20.4	-148.5	-42	0	0	0	111.6
693	M	34.9	Very low	30.4	Very low	155 Å²	155	136.2 Å²	136.2	76%	0.764	70%	0.696	S	S	*	*			trans	-107.6	-178	-168.5	-43.3	-166.4	-51	0	0	115
694	D	34	Very low	30.3	Very low	125 Å²	125	136.2 Å²	136.2	67%	0.668	70%	0.697	S	S	*	*			cis	-159.5	166.6	9	-153.6	-5.5	0	0	0	114.2
695	A	33.8	Very low	30	Very low	73 Å²	73	133.5 Å²	133.5	60%	0.603	69%	0.693	S	S	*	*			trans	62.4	144.7	144.8	0	0	0	0	0	123.6
696	Q	32.5	Very low	30	Very low	156 Å²	156	130.1 Å²	130.1	73%	0.729	69%	0.691	S	S	*	*			cis	-165.7	143	-12.9	-110.5	-177.9	18.5	0	0	112.4
697	L	31.4	Very low	29.9	Very low	115 Å²	115	130.4 Å²	130.4	60%	0.602	69%	0.689	S	S	*	*			trans	53.4	156.6	136.4	-64	172.7	0	0	0	122.7	E699	L697-E699 WeakPolarHBondContact CD2-OE2 3.41Å
698	L	28.2	Very low	29.9	Very low	137 Å²	137	133.7 Å²	133.7	72%	0.717	70%	0.698	S	S	*	*			cis	-118.5	154.8	-5.9	-85.3	100.3	0	0	0	109.4
699	E	31.5	Very low	29.6	Very low	123 Å²	123	135.3 Å²	135.3	58%	0.575	71%	0.706	S	S	*	*				65.1	143.7	57.7	-86.4	-174.5	97.7	0	0	114.2	L697	L697-E699 WeakPolarHBondContact CD2-OE2 3.41Å
700	Q	29	Very low	29.6	Very low	132 Å²	132	133.4 Å²	133.4	62%	0.617	70%	0.703	S	S	*	*			cis	-156.8	153.4	26.1	-136.9	160.6	40.6	0	0	114
701	Q	26.3	Very low	29.8	Very low	155 Å²	155	131.3 Å²	131.3	72%	0.724	71%	0.711	S	S	*	*			trans	36.3	152.4	135.3	-71.5	174.2	16.1	0	0	123.1
702	S	26.5	Very low	29.3	Very low	89 Å²	89	130.6 Å²	130.6	62%	0.622	72%	0.722	S	S	*	*			cis	-172.5	157.6	-5.6	48.2	0	0	0	0	114.9
703	T	25.4	Very low	29.3	Very low	111 Å²	111	131.6 Å²	131.6	68%	0.681	73%	0.726	S	S	*	*			trans	63.1	127.8	143.1	50.4	0	0	0	0	123.9
704	N	25.1	Very low	28.8	Very low	149 Å²	149	129.4 Å²	129.4	80%	0.797	73%	0.726	S	S	*	*			trans	69.8	147	137.8	-63	-9.6	0	0	0	120.2
705	S	26.1	Very low	28.5	Very low	96 Å²	96	130.5 Å²	130.5	67%	0.671	73%	0.732	S	S	*	*			cis	-174.3	163.3	-17.7	49.5	0	0	0	0	110.2
706	S	28.9	Very low	28	Very low	106 Å²	106	132.5 Å²	132.5	74%	0.741	74%	0.742	S	S	*	*			trans	69.2	148.7	174	77.7	0	0	0	0	116.1
707	E	27.7	Very low	28.2	Very low	168 Å²	168	133.4 Å²	133.4	79%	0.785	75%	0.748	S	S	*	*			cis	-154.2	-166.5	-17.8	-120.2	176.4	112.1	0	0	110.5
708	F	27.9	Very low	28.3	Very low	183 Å²	183	133.8 Å²	133.8	80%	0.803	76%	0.757	S	S	*	*			trans	-53	162.5	179.3	-62.6	-95.3	0	0	0	114.4
709	E	25.6	Very low	28.4	Very low	186 Å²	186	132.2 Å²	132.2	87%	0.869	76%	0.758	S	S	*	*			cis	-150.8	-147.2	21.6	-149.3	174.7	-177.2	0	0	114.1
710	A	30.5	Very low	28.3	Very low	87 Å²	87	132.8 Å²	132.8	72%	0.719	77%	0.769	S	S	*	*			trans	-85.1	165.8	-159.2	0	0	0	0	0	116.4
711	P	37.3	Very low	28.3	Very low	128 Å²	128	130.9 Å²	130.9	83%	0.831	78%	0.776	S	S	*	*			trans	-94.9	163.6	-160.8	37.5	-36.9	0	0	0	116.2
712	S	24.5	Very low	28.4	Very low	122 Å²	122	130.5 Å²	130.5	85%	0.853	78%	0.779	S	S	*	*			trans	-144.9	178.6	167.6	60.1	0	0	0	0	112.4
713	L	28.1	Very low	28.4	Very low	167 Å²	167	130.5 Å²	130.5	87%	0.874	78%	0.779	S	S	*	*			trans	-82	170.9	-151.7	-63.4	163.4	0	0	0	117
714	S	25.1	Very low	28.7	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	79%	0.787	S	S	*	*			trans	107.1	128.9	141.5	72.3	0	0	0	0	121.4
715	D	26.5	Very low	28.8	Very low	149 Å²	149	132.3 Å²	132.3	80%	0.797	79%	0.787	S	S	*	*			trans	4	133.4	154.8	-51.9	-61.5	0	0	0	122.1
716	S	25	Very low	29	Very low	115 Å²	115	132.4 Å²	132.4	80%	0.804	79%	0.788	S	S	*	*				178.1	149.3	106.6	-77.2	0	0	0	0	113.9
717	M	36.2	Very low	28.8	Very low	175 Å²	175	132.6 Å²	132.6	86%	0.862	78%	0.777	S	S	*	*			trans	-86.5	165.5	165.5	-74.2	-88.1	94.7	0	0	111.4
718	P	33	Very low	28.6	Very low	122 Å²	122	132.2 Å²	132.2	79%	0.792	77%	0.773	S	S	*	*				-139.3	168.3	122.8	38.2	-27.2	0	0	0	115.8
719	S	30	Very low	28.5	Very low	105 Å²	105	126.9 Å²	126.9	73%	0.734	76%	0.758	S	S	*	*			trans	-85.3	-168.6	171.8	-147.2	0	0	0	0	110.4
720	V	30	Very low	28.6	Very low	134 Å²	134	121.2 Å²	121.2	81%	0.812	73%	0.732	S	S	*	*			cis	-166.7	168.4	36.6	-135.7	0	0	0	0	112.8
721	A	29.2	Very low	28.3	Very low	92 Å²	92	119.7 Å²	119.7	76%	0.76	71%	0.709	S	S	*	*			trans	73.7	132.4	155.9	0	0	0	0	0	118.4
722	D	27	Very low	28	Very low	148 Å²	148	115.7 Å²	115.7	79%	0.791	68%	0.684	S	S	*	*			cis	-150.7	-169.4	2	-152.5	-141.9	0	0	0	109.3
723	S	26.8	Very low	28.3	Very low	88 Å²	88	112.6 Å²	112.6	62%	0.615	66%	0.662	S	S	*	*			cis	-159.9	-156.4	12.9	-157.5	0	0	0	0	112.6
724	H	31.9	Very low	28.6	Very low	183 Å²	183	108.2 Å²	108.2	85%	0.847	65%	0.645	S	S	*	*			trans	-130.7	173.5	178.7	-65.7	-0.4	0	0	0	111.6
725	S	27.4	Very low	28.7	Very low	116 Å²	116	108.7 Å²	108.7	81%	0.811	64%	0.639	S	S	*	*			cis	-144.2	-158.5	10.6	56.6	0	0	0	0	109.1
726	S	29.6	Very low	29.1	Very low	97 Å²	97	108.4 Å²	108.4	68%	0.678	64%	0.637	S	S	*	*			cis	-152.4	169	14.3	58.4	0	0	0	0	109.4
727	H	25.8	Very low	29.5	Very low	111 Å²	111	111.2 Å²	111.2	51%	0.514	64%	0.637	S	S	.	*				46.2	131.4	67.7	-93	-93.8	0	0	0	115
728	F	23.5	Very low	29.4	Very low	160 Å²	160	106.2 Å²	106.2	70%	0.702	62%	0.619	S	S	*	*			cis	-134.7	158.4	8.2	-66.4	-97.3	0	0	0	109.4
729	S	25.9	Very low	29.5	Very low	71 Å²	71	107.1 Å²	107.1	50%	0.497	62%	0.615	S	S	.	*			cis	86.9	148.7	22.5	81.4	0	0	0	0	115.8	R396	R396-S729 PolarHBondContact NH1-O 2.98Å; R396-S729 VanDerWaalsContact NH1-O 3.16Å
730	E	27.7	Very low	29.4	Very low	67 Å²	67	110.2 Å²	110.2	31%	0.313	62%	0.615	S	S	.	*			cis	165.1	168.7	49.3	-139.1	166.5	66.5	0	0	111.3	V392 R396	V392-E730 HydrophobicContact CG1-CG 4.03Å; V392-E730 WeakPolarHBondContact CG1-OE2 3.36Å; R396-E730 IonicContact CZ-OE1 3.43Å; R396-E730 IonicContact NE-OE1 2.72Å; R396-E730 PolarHBondContact NE-OE1 3.4Å; R396-E730 VanDerWaalsContact NH2-CB 3.3Å; R396-E730 IonicContact NH2-OE1 2.88Å; R396-E730 PolarHBondContact NH2-OE1 3.18Å; R396-E730 IonicContact NH2-OE2 3.31Å; R396-E730 PolarHBondContact NH2-OE2 2.8Å
731	F	24.6	Very low	29.4	Very low	55 Å²	55	110 Å²	110	24%	0.241	61%	0.614	C	S	.	*			trans	79.3	163.8	160.2	-81.7	-109.9	0	0	0	123.7	V392 Y393 R396 K397	V392-F731 WeakPolarHBondContact O-CE2 3.3Å; V392-F731 WeakPolarHBondContact O-CZ 3.48Å; Y393-F731 HydrophobicContact CD2-CE1 4.45Å; Y393-F731 HydrophobicContact CD2-CZ 4.43Å; Y393-F731 WeakPolarHBondContact O-CE1 3.39Å; Y393-F731 WeakPolarHBondContact O-CZ 3.16Å; R396-F731 HydrophobicContact CB-CD1 3.75Å; R396-F731 HydrophobicContact CB-CD2 3.58Å; R396-F731 HydrophobicContact CB-CE1 3.78Å; R396-F731 HydrophobicContact CB-CE2 3.42Å; R396-F731 VanDerWaalsContact CB-CE2 3.42Å; R396-F731 HydrophobicContact CB-CG 3.73Å; R396-F731 HydrophobicContact CB-CZ 3.47Å; R396-F731 VanDerWaalsContact CB-CZ 3.47Å; R396-F731 HydrophobicContact CG-CD1 4.25Å; R396-F731 HydrophobicContact CG-CD2 4.09Å; R396-F731 HydrophobicContact CG-CE2 4.41Å; R396-F731 HydrophobicContact CG-CG 3.99Å; K397-F731 HydrophobicContact CB-CD1 4.25Å; K397-F731 HydrophobicContact CB-CE1 3.59Å; K397-F731 HydrophobicContact CG-CE1 4.18Å
732	S	30	Very low	29.4	Very low	44 Å²	44	110.4 Å²	110.4	31%	0.308	61%	0.611	S	S	.	*			cis	171.2	172.6	-37.8	-165.8	0	0	0	0	113.4	Y393	Y393-S732 WeakPolarHBondContact CE2-OG 3.28Å; Y393-S732 VanDerWaalsContact CZ-OG 3.23Å; Y393-S732 PolarHBondContact OH-OG 3.02Å; Y393-S732 VanDerWaalsContact OH-OG 3.06Å
733	C	31.2	Very low	29.3	Very low	56 Å²	56	109.1 Å²	109.1	38%	0.378	61%	0.613	S	S	.	*			trans	82.1	151.3	162.1	-132.4	0	0	0	0	116.6	K397	K397-C733 WeakPolarHBondContact CE-SG 3.33Å; K397-C733 HydrophobicContact CG-CB 4.15Å
734	S	33.7	Very low	29.5	Very low	76 Å²	76	110 Å²	110	53%	0.531	62%	0.619	S	S	.	*			cis	-132.4	-155.4	10.7	-50.3	0	0	0	0	111.3	R401	R401-S734 PolarHBondContact NH1-OG 3.25Å
735	D	28.9	Very low	29.3	Very low	118 Å²	118	111.3 Å²	111.3	63%	0.631	63%	0.625	S	S	*	*			cis	-155.2	-179.7	-4.2	-136.2	-36.1	0	0	0	112.1	R401	R401-D735 IonicContact CZ-OD1 3.94Å; R401-D735 IonicContact CZ-OD2 2.9Å; R401-D735 VanDerWaalsContact NH1-CG 3.27Å; R401-D735 IonicContact NH1-OD1 3.19Å; R401-D735 PolarHBondContact NH1-OD1 3.48Å; R401-D735 IonicContact NH1-OD2 3.4Å; R401-D735 PolarHBondContact NH1-OD2 3.36Å; R401-D735 IonicContact NH2-OD1 3.22Å; R401-D735 PolarHBondContact NH2-OD1 3.15Å; R401-D735 IonicContact NH2-OD2 3.29Å
736	L	33.7	Very low	29.2	Very low	144 Å²	144	109.4 Å²	109.4	75%	0.754	62%	0.624	S	S	*	*			trans	-166.2	154.6	-178.8	170.6	147	0	0	0	113.8
737	E	33.6	Very low	29.1	Very low	173 Å²	173	110.6 Å²	110.6	81%	0.808	63%	0.632	S	S	*	*			trans	-151.4	167.5	168.5	-84	-143.1	75.6	0	0	113
738	S	34.6	Very low	29.2	Very low	70 Å²	70	110 Å²	110	49%	0.49	64%	0.641	S	S	.	*			cis	-175.7	166.2	-37.3	75.4	0	0	0	0	108.4
739	M	35.6	Very low	29.5	Very low	142 Å²	142	108.8 Å²	108.8	70%	0.7	64%	0.642	S	S	*	*			cis	-170.7	165.8	-28	-97.4	178	-160.5	0	0	109.2
740	K	27.9	Very low	29.5	Very low	170 Å²	170	115.9 Å²	115.9	74%	0.739	66%	0.659	S	S	*	*			trans	71.2	146	177.3	-13.9	103.4	-138.8	141.6	0	117
741	T	29.7	Very low	29.6	Very low	128 Å²	128	121.2 Å²	121.2	79%	0.785	68%	0.683	S	S	*	*			cis	81.4	141	5	76.6	0	0	0	0	120.4
742	S	28.5	Very low	29.6	Very low	101 Å²	101	123.7 Å²	123.7	71%	0.706	70%	0.703	S	S	*	*			cis	-175.2	148.2	-17.4	-88	0	0	0	0	113.6
743	C	25.7	Very low	29.5	Very low	121 Å²	121	131.9 Å²	131.9	82%	0.818	73%	0.728	S	S	*	*			trans	63.4	177.4	154.1	-61.6	0	0	0	0	121.6
744	S	30.1	Very low	29.3	Very low	108 Å²	108	138.6 Å²	138.6	76%	0.755	75%	0.75	S	S	*	*				-178.4	138.3	-61.9	-84.1	0	0	0	0	113.3
745	H	28.6	Very low	29.1	Very low	210 Å²	210	139 Å²	139	97%	0.972	76%	0.759	S	S	*	*			trans	-170.8	151.8	164.5	-118.9	-83.1	0	0	0	111.9
746	G	25.1	Very low	29.3	Very low	76 Å²	76	139.8 Å²	139.8	78%	0.784	77%	0.768	S	S	*	*			trans	128	158.4	170.2	0	0	0	0	0	115.7
747	S	27.8	Very low	29	Very low	122 Å²	122	139.3 Å²	139.3	85%	0.853	77%	0.771	S	S	*	*			trans	-154.6	158.1	-173.8	-169.1	0	0	0	0	114.3
748	S	26.9	Very low	28.9	Very low	99 Å²	99	137.7 Å²	137.7	69%	0.692	77%	0.767	S	S	*	*			trans	70.7	130.1	170.6	-161.4	0	0	0	0	116.1
749	D	29.1	Very low	28.6	Very low	134 Å²	134	142.3 Å²	142.3	72%	0.717	79%	0.785	S	S	*	*			cis	-158.4	-179.6	-8.8	-122.2	-60.9	0	0	0	113.5
750	Y	27.1	Very low	28.5	Very low	219 Å²	219	142.7 Å²	142.7	86%	0.859	79%	0.789	S	S	*	*			trans	93.1	140.9	170.4	-69.6	-82	0	0	0	120.3
751	H	28.5	Very low	29.1	Very low	179 Å²	179	139.9 Å²	139.9	83%	0.829	79%	0.788	S	S	*	*			trans	66.3	85	178.6	-106.3	-68.5	0	0	0	120.5
752	T	26.1	Very low	28.9	Very low	108 Å²	108	141.8 Å²	141.8	66%	0.663	79%	0.788	S	S	*	*			trans	-43.5	162	145.2	38.7	0	0	0	0	115.3
753	R	27.7	Very low	29	Very low	216 Å²	216	142.5 Å²	142.5	82%	0.815	79%	0.788	S	S	*	*			cis	-168.3	145.9	-25.7	-111.5	-176.8	-173.9	174.2	2	106.2
754	F	26.4	Very low	29	Very low	196 Å²	196	145.8 Å²	145.8	86%	0.86	79%	0.792	S	S	*	*				34.3	145.4	95.9	-65.8	-96.1	0	0	0	117.1
755	A	29.6	Very low	29.1	Very low	86 Å²	86	147.5 Å²	147.5	71%	0.711	79%	0.792	S	S	*	*			cis	-173.8	177.5	-18	0	0	0	0	0	110.1
756	T	33.7	Very low	28.9	Very low	133 Å²	133	144.6 Å²	144.6	82%	0.816	78%	0.784	S	S	*	*			trans	-46.8	139	176.1	-41.6	0	0	0	0	116.7
757	V	27.5	Very low	29	Very low	134 Å²	134	150.5 Å²	150.5	81%	0.812	78%	0.783	S	S	*	*				173.3	150.8	124.6	153.7	0	0	0	0	110.7
758	N	31.6	Very low	28.9	Very low	139 Å²	139	152 Å²	152	74%	0.743	78%	0.78	S	S	*	*			trans	-73.6	152.7	-171.5	-56.2	-13.6	0	0	0	115.1
759	I	27.1	Very low	28.9	Very low	167 Å²	167	154.3 Å²	154.3	86%	0.856	78%	0.78	S	S	*	*				178.1	154.8	112.7	-91	162.1	0	0	0	110.9
760	L	33.9	Very low	28.7	Very low	151 Å²	151	154.2 Å²	154.2	79%	0.791	78%	0.779	S	S	*	*			trans	-84.9	148.8	-178.9	-150.3	77.7	0	0	0	112.1
761	P	41.7	Very low	28.6	Very low	111 Å²	111	149.1 Å²	149.1	72%	0.721	78%	0.776	S	S	*	*				-142.1	147.7	99.8	28.7	-8.7	0	0	0	112.6
762	E	24.6	Very low	29.4	Very low	168 Å²	168	144.9 Å²	144.9	79%	0.785	76%	0.764	S	S	*	*				94.1	119.6	68.9	-160.5	175.9	175.9	0	0	114.4
763	V	30.6	Very low	29.4	Very low	116 Å²	116	147.9 Å²	147.9	70%	0.703	77%	0.77	S	S	*	*			trans	45.1	116.5	158.3	178.7	0	0	0	0	120.6
764	E	26.4	Very low	29.3	Very low	190 Å²	190	145.7 Å²	145.7	89%	0.888	77%	0.769	S	S	*	*				-149.4	153.1	117.4	-153.2	162.6	-172	0	0	110.2
765	N	32.5	Very low	29.2	Very low	144 Å²	144	142.6 Å²	142.6	77%	0.77	77%	0.77	S	S	*	*			trans	-128	139.6	178.3	-70.5	-92.3	0	0	0	109.6
766	D	24.3	Very low	29	Very low	148 Å²	148	143.2 Å²	143.2	79%	0.791	77%	0.77	S	S	*	*			trans	-154.4	166.3	144.1	-138.8	-16.7	0	0	0	114.8
767	R	26.3	Very low	28.7	Very low	201 Å²	201	144.2 Å²	144.2	76%	0.758	77%	0.769	S	S	*	*			trans	-64.9	157	-163.1	-55.5	131.7	76.4	173.1	4.7	116.4
768	L	26.6	Very low	28.6	Very low	153 Å²	153	142.6 Å²	142.6	80%	0.801	76%	0.763	S	S	*	*				-173.1	-174.4	102.8	-98.2	166.6	0	0	0	113.3
769	E	26.2	Very low	28.3	Very low	147 Å²	147	142.8 Å²	142.8	69%	0.687	77%	0.769	S	S	*	*			trans	-114.3	158.7	-150.7	-65.1	171.3	60.7	0	0	116.8
770	N	25.5	Very low	28.2	Very low	132 Å²	132	140.3 Å²	140.3	71%	0.706	76%	0.761	S	S	*	*			trans	50.5	111.5	137.3	-68.6	-36	0	0	0	122.9
771	S	23.9	Very low	27.8	Very low	112 Å²	112	139.2 Å²	139.2	78%	0.783	76%	0.761	S	S	*	*				72.2	-173.7	126.1	-126.2	0	0	0	0	118.3
772	P	46.4	Very low	26.9	Very low	90 Å²	90	142.5 Å²	142.5	58%	0.584	77%	0.767	S	S	*	*				-127.1	-175.6	-68.4	28.3	-8.4	0	0	0	115.2
773	H	25.6	Very low	26.9	Very low	171 Å²	171	140.6 Å²	140.6	79%	0.792	77%	0.767	S	S	*	*			trans	77.1	164.1	168.6	-48.5	-60.6	0	0	0	115.8
774	Q	25.9	Very low	26.7	Very low	171 Å²	171	139.9 Å²	139.9	80%	0.799	77%	0.773	S	S	*	*			cis	-156	145.1	9.6	-154	167.9	47.7	0	0	112.1
775	C	24.5	Very low	26.7	Very low	130 Å²	130	136.2 Å²	136.2	88%	0.878	77%	0.768	S	S	*	*			trans	171.3	167.7	132.4	-99	0	0	0	0	112.7
776	S	24.2	Very low	26.2	Very low	100 Å²	100	135.2 Å²	135.2	70%	0.699	77%	0.771	S	S	*	*			trans	-136.2	-165.9	-162.5	56.2	0	0	0	0	113.1
777	I	28.1	Very low	26.3	Very low	154 Å²	154	133 Å²	133	79%	0.79	77%	0.767	S	S	*	*			trans	82.9	105.9	-176	-49.5	162.2	0	0	0	111.6
778	S	25.3	Very low	26.2	Very low	99 Å²	99	132.3 Å²	132.3	69%	0.692	77%	0.773	S	S	*	*			cis	86.7	148.1	12.5	-37.1	0	0	0	0	117.5
779	V	25.3	Very low	26.4	Very low	143 Å²	143	131.2 Å²	131.2	87%	0.867	77%	0.772	S	S	*	*			trans	76.6	130.8	176.1	-177.6	0	0	0	0	115.3
780	V	25	Very low	26.9	Very low	115 Å²	115	130.3 Å²	130.3	70%	0.697	78%	0.779	S	S	*	*			cis	-163	156.3	-25.8	72.5	0	0	0	0	109.6
781	T	24.2	Very low	27	Very low	128 Å²	128	132.1 Å²	132.1	79%	0.785	78%	0.783	S	S	*	*			trans	-91.1	136.4	165.1	-53.1	0	0	0	0	110.2
782	Q	24	Very low	27.3	Very low	180 Å²	180	133.2 Å²	133.2	84%	0.841	78%	0.779	S	S	*	*			trans	-110	154	171.3	-87.1	-170.1	-13.4	0	0	113
783	T	24	Very low	26.5	Very low	129 Å²	129	134.7 Å²	134.7	79%	0.791	78%	0.782	S	S	*	*			trans	-137.2	149.6	-174.9	43.3	0	0	0	0	112.2
784	A	27.5	Very low	26.7	Very low	101 Å²	101	133.5 Å²	133.5	84%	0.835	78%	0.777	S	S	*	*			trans	63.3	112.7	154.5	0	0	0	0	0	121.7
785	S	24.9	Very low	26.8	Very low	113 Å²	113	132.8 Å²	132.8	79%	0.79	78%	0.777	S	S	*	*			trans	-145.3	131.7	131.4	50.1	0	0	0	0	106.5
786	C	22.5	Very low	27	Very low	122 Å²	122	130.1 Å²	130.1	82%	0.824	76%	0.764	S	S	*	*				82.2	137.3	52.1	-75.5	0	0	0	0	115.2
787	S	25.9	Very low	27.2	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	77%	0.773	S	S	*	*			trans	84.1	102.4	165.6	-60.5	0	0	0	0	121
788	E	24.2	Very low	27.2	Very low	187 Å²	187	135.6 Å²	135.6	87%	0.874	78%	0.775	S	S	*	*				71.5	154.2	123.8	-66.3	178.9	122.1	0	0	123
789	V	32	Very low	27.4	Very low	130 Å²	130	138.5 Å²	138.5	79%	0.788	78%	0.778	S	S	*	*			trans	-110.4	143.6	-177.7	172.9	0	0	0	0	109.2
790	P	36.4	Very low	27.5	Very low	128 Å²	128	135.6 Å²	135.6	83%	0.831	76%	0.764	S	S	*	*			trans	-116.7	158.6	139.1	-6.1	26.6	0	0	0	113.8
791	Q	28.1	Very low	27.6	Very low	170 Å²	170	138.7 Å²	138.7	79%	0.794	77%	0.768	S	S	*	*			trans	-111.8	-170.6	-176.6	-167.9	-176.1	5.6	0	0	109.7
792	L	29.7	Very low	27.8	Very low	134 Å²	134	140.6 Å²	140.6	70%	0.702	77%	0.773	S	S	*	*			trans	80.3	149.5	174.8	-68.2	69.1	0	0	0	114.4
793	N	28.2	Very low	27.9	Very low	121 Å²	121	135.4 Å²	135.4	65%	0.647	77%	0.768	S	S	*	*			cis	-168.8	170.2	-6.1	-109.7	6.4	0	0	0	109.8
794	H	29.9	Very low	28.1	Very low	146 Å²	146	137.7 Å²	137.7	68%	0.676	77%	0.774	S	S	*	*			cis	-170.7	178.5	-25.4	-133.9	64.1	0	0	0	107.7
795	I	28.2	Very low	28.1	Very low	157 Å²	157	141.9 Å²	141.9	81%	0.805	77%	0.773	S	S	*	*			trans	71.2	145.9	152.7	-74.8	156.4	0	0	0	118.8
796	A	28.7	Very low	28.4	Very low	73 Å²	73	142 Å²	142	60%	0.603	77%	0.774	S	S	*	*			cis	-168.8	156.5	-29.2	0	0	0	0	0	112.5
797	E	30	Very low	28.8	Very low	189 Å²	189	143.1 Å²	143.1	88%	0.883	77%	0.772	S	S	*	*			trans	68	161.8	141.1	-78.2	-179.6	151.8	0	0	125.5
798	E	27.7	Very low	29	Very low	180 Å²	180	144 Å²	144	84%	0.841	77%	0.773	S	S	*	*			trans	67.5	159.5	174.3	-63.8	-137.1	134.6	0	0	121.4
799	H	29.9	Very low	29.2	Very low	160 Å²	160	141.2 Å²	141.2	74%	0.741	76%	0.763	S	S	*	*				-162.5	171.3	-57.4	-148.8	-101.4	0	0	0	110.9
800	S	25.9	Very low	29.1	Very low	82 Å²	82	141.4 Å²	141.4	57%	0.573	76%	0.759	S	S	*	*			trans	72.3	114.8	153.6	-64.6	0	0	0	0	122.5
801	K	28.4	Very low	28.8	Very low	181 Å²	181	146.1 Å²	146.1	79%	0.787	76%	0.762	S	S	*	*				47.6	119.6	124	-56.9	171.3	-177.4	172.3	0	120.1
802	N	27.4	Very low	28.9	Very low	168 Å²	168	147.3 Å²	147.3	90%	0.898	77%	0.765	S	S	*	*				-173.8	162	100.5	-93.9	-26	0	0	0	111.6
803	G	25.9	Very low	28.9	Very low	71 Å²	71	143.8 Å²	143.8	73%	0.732	76%	0.762	S	S	*	*			trans	-141.1	154	170.8	0	0	0	0	0	111.3
804	I	28.8	Very low	29	Very low	177 Å²	177	144.9 Å²	144.9	91%	0.908	77%	0.767	S	S	*	*			trans	-146.9	153.7	176.5	-97.5	156.4	0	0	0	108.6
805	K	28.4	Very low	29	Very low	188 Å²	188	142.9 Å²	142.9	82%	0.817	77%	0.765	S	S	*	*			trans	-116.7	148.8	-177.4	-69.8	-177	176.2	-176.2	0	113
806	S	30.2	Very low	29.2	Very low	116 Å²	116	142.5 Å²	142.5	81%	0.811	76%	0.764	S	S	*	*			trans	-166.5	107.2	147.7	50.1	0	0	0	0	107.4
807	N	30.1	Very low	29.3	Very low	146 Å²	146	146.6 Å²	146.6	78%	0.781	77%	0.768	S	S	*	*			cis	81	148.7	26.7	-152	40.2	0	0	0	114.4
808	V	30.3	Very low	29.3	Very low	121 Å²	121	144 Å²	144	73%	0.733	76%	0.756	S	S	*	*			trans	89	124.7	-154.6	175	0	0	0	0	111.1
809	D	28.2	Very low	29.5	Very low	127 Å²	127	140.6 Å²	140.6	68%	0.679	75%	0.748	S	S	*	*			cis	-148.7	136.1	-13	-100.8	-14.2	0	0	0	108
810	L	31.6	Very low	29.5	Very low	134 Å²	134	140 Å²	140	70%	0.702	75%	0.75	S	S	*	*				62	107.4	87.6	-94.6	170.7	0	0	0	116.8
811	Y	28.5	Very low	29.8	Very low	228 Å²	228	142.6 Å²	142.6	89%	0.894	76%	0.758	S	S	*	*				-163.9	178.2	114.4	-119	-87.6	0	0	0	111.7
812	F	31.5	Very low	29.9	Very low	194 Å²	194	141.6 Å²	141.6	85%	0.851	76%	0.761	S	S	*	*			trans	-135.5	155.8	-156.7	-126.2	-92.9	0	0	0	113.8
813	G	29.8	Very low	30.1	Very low	61 Å²	61	142 Å²	142	63%	0.629	76%	0.757	S	S	*	*			trans	94.4	152.5	160.8	0	0	0	0	0	117.5
814	D	29.7	Very low	30.3	Very low	144 Å²	144	142.9 Å²	142.9	77%	0.77	75%	0.752	S	S	*	*			cis	-160.6	152.7	-10.8	-129.1	-15.4	0	0	0	115.9
815	T	30.6	Very low	30.2	Very low	103 Å²	103	142.4 Å²	142.4	63%	0.632	75%	0.746	S	S	*	*			trans	46	127.1	154.5	58.2	0	0	0	0	124.5
816	L	31.1	Very low	30.3	Very low	150 Å²	150	142.2 Å²	142.2	79%	0.785	75%	0.748	S	S	*	*			trans	53	124.1	131.3	-76.6	136	0	0	0	119.5
817	K	30.8	Very low	30.2	Very low	158 Å²	158	141.8 Å²	141.8	69%	0.687	74%	0.74	S	S	*	*				-170.8	173.8	62.4	-117.7	172.4	-171.4	-69	0	110
818	E	30.5	Very low	30.2	Very low	135 Å²	135	143.4 Å²	143.4	63%	0.631	75%	0.745	S	S	*	*			cis	-141.1	-127.3	0.1	-171.5	78.2	-77.1	0	0	108.2
819	T	32.6	Very low	30.1	Very low	108 Å²	108	144.7 Å²	144.7	66%	0.663	74%	0.743	S	S	*	*			trans	-151.8	148.4	-177.8	50.9	0	0	0	0	112.1
820	N	30	Very low	30.2	Very low	148 Å²	148	146.8 Å²	146.8	79%	0.791	75%	0.754	S	S	*	*				180	162.4	114.5	-102.2	-61.1	0	0	0	115
821	N	31.5	Very low	30	Very low	136 Å²	136	148.1 Å²	148.1	73%	0.727	75%	0.754	S	S	*	*			trans	-96.8	157.9	-178.3	-55.7	-60.8	0	0	0	112.4
822	N	29.6	Very low	30	Very low	160 Å²	160	143.8 Å²	143.8	86%	0.856	75%	0.751	S	S	*	*				-178.1	158.9	109	-92.9	-26.4	0	0	0	116.8
823	H	32.9	Very low	29.9	Very low	177 Å²	177	138.1 Å²	138.1	82%	0.819	74%	0.74	S	S	*	*			trans	-37.5	166.9	161	-88.8	8.6	0	0	0	118.2
824	S	28.7	Very low	30.1	Very low	90 Å²	90	142.4 Å²	142.4	63%	0.629	75%	0.747	S	S	*	*			cis	-175	157.5	-0.6	43.8	0	0	0	0	114.1
825	H	28.1	Very low	30.1	Very low	166 Å²	166	143.5 Å²	143.5	77%	0.769	75%	0.747	S	S	*	*			trans	47.9	115.2	143.6	-81.2	-99.5	0	0	0	123
826	Q	29.8	Very low	30.1	Very low	185 Å²	185	142.9 Å²	142.9	86%	0.864	74%	0.743	S	S	*	*				-179.3	124.5	121.3	-96.9	-178.3	-15.9	0	0	107.1
827	T	29	Very low	30.2	Very low	106 Å²	106	144.4 Å²	144.4	65%	0.65	75%	0.747	S	S	*	*			cis	105.5	128.4	25.2	58.8	0	0	0	0	114.3
828	M	28.6	Very low	30.5	Very low	181 Å²	181	148.4 Å²	148.4	89%	0.892	77%	0.773	S	S	*	*			trans	72.7	126.5	177.4	-62.1	178	166.3	0	0	115.9
829	E	29.4	Very low	30.5	Very low	147 Å²	147	149.1 Å²	149.1	69%	0.687	78%	0.78	S	S	*	*			cis	88.3	106.9	35.1	-78.7	-149.9	106	0	0	116.5	K831	E829-K831 IonicContact OE1-NZ 2.85Å
830	L	28.8	Very low	30.3	Very low	172 Å²	172	151.3 Å²	151.3	90%	0.901	79%	0.786	S	S	*	*			trans	177	122.4	138.7	-118.5	72.8	0	0	0	106.1
831	K	28.3	Very low	30.4	Very low	161 Å²	161	151.4 Å²	151.4	70%	0.7	79%	0.786	S	S	*	*			cis	91.9	121.7	13.2	-139	-169.5	-172.4	166.4	0	115.6	E829	E829-K831 IonicContact OE1-NZ 2.85Å
832	V	29.3	Very low	30.3	Very low	137 Å²	137	152.4 Å²	152.4	83%	0.83	79%	0.79	S	S	*	*			trans	73.1	140.8	166.1	-170.9	0	0	0	0	115.2
833	A	28.8	Very low	30.3	Very low	76 Å²	76	151.9 Å²	151.9	63%	0.628	79%	0.785	S	S	*	*			cis	-152.3	152.5	-11	0	0	0	0	0	108.5
834	I	34	Very low	30.2	Very low	151 Å²	151	150.2 Å²	150.2	77%	0.774	78%	0.783	S	S	*	*				41.1	111.7	86.9	-50	176	0	0	0	115.6
835	Q	29.1	Very low	30.3	Very low	167 Å²	167	154.5 Å²	154.5	78%	0.78	79%	0.794	S	S	*	*			trans	-158	-177.5	133.4	-154.4	48.4	63.5	0	0	109.6
836	T	32	Very low	30.4	Very low	89 Å²	89	153.6 Å²	153.6	55%	0.546	80%	0.796	S	S	.	*			trans	-126.1	171.7	-150	48	0	0	0	0	114.9
837	E	32.1	Very low	30.5	Very low	183 Å²	183	151 Å²	151	86%	0.855	79%	0.79	S	S	*	*			trans	69.7	137.1	169.3	-62.6	164	168.3	0	0	114.1
838	I	36.5	Very low	30.6	Very low	242 Å²	242	155.1 Å²	155.1	100%	1.241	80%	0.803	S	S	*	*			cis	-125.4	0	32.3	-69.6	164.2	0	0	0	112

Retrieved 838 of 838 residues in 232.9 ms (Link to these results)

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