A0A077ZD96_TRITR Loading...

MIZ:SP RING zinc finger

AlphaFold DB , UniProt , Accession A0A077ZD96, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 977 aa.

						>A0A077ZD96_TRITR|A0A077ZD96
MWTRNGSPHGAVSVFTTVYSNMPPNYSGNGPQLSYSTTALPGAQTATQPYNTGISNDLVNQVTTADRPNSSAVAPCYPGEVGPPNTNAAAPYGATDYSRPGNYHTGDPSSSEYASANGNPSGALNAAHVAAAAVATATATATAVAIDQTQFQPYPPQQQVPVYGSQQYSAAAAGQPPSFNLQGRMVQPNMVSRPQMPAAYMSNVRQQATLAAVGQGQSASMSRYAAVAQSQFVGGRQQVAQMVANQQSSQYAGPMSPVVGMTPNGTPMVHQQQPIDPAAAPLAPYPGSTVPSAPMMNGPYQKYQTSQMARNAPVYYASGGQVAMAGKGLCNNYMNATYSNQQSVPAGYQMPQSRQAHVPNQVSSSNPPYMAAPYQGSGGGGNVYADVKPMVQPNDDIEPRMSFPVKDGMILQPFRLEHNIPVSQITFFIMAEQFNLLCSDPDLDIQLKCFHADDRFMCNNWPHNASIQIVVNGTPVIVRQIDRPLYIKNLCQPNKNTLQVAVQQCCCSHLFMLSLISRPHVERVLSNLVRRKLLPVEMAIEKIKRSFMSNEVGAGQLSDVEHLSTTISLKCPFTMTKMSLPARCNDCRHIQCFDLKTFLMVNKDRLHWQCPICARPTTVENLEIDQYVWGILTNLAKCPDVSDVLIDSSASWKVHSAVALKQEMQYAACGTTKRFKSEPGVDPSWNQGTANHLRNAAGMQVPIERVSNVTTGPPMADSMKISPPPAKKHHYVNQVDQPSGIQCHPGAPIAQSPYQAVSTDCTPQQLLKYNPPTPVTPLPNPPSVGGGGGPRSVGNPPSVEGAYAIQCSTQSNLQLNVDGSAAGSAPYTPASVGSAGSQQGSHGINVASNEMCNSEFNDLSFDASDLLPSDGSASDNIGNLFTDSTMPDPGEFIQYFENSNFGDFGLSADSKAVVVDSQFAEAKTAYTKSDGGQNDSSIKVNHCDGSPNRKDSADASKVTLSSISSNEMDDIMSLLQN
					

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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	32.1	Very low	32.5	Very low	232 Å²	232	145.5 Å²	145.5	100%	1.143	83%	0.827	S	S	*	*				0	116.8	0	-62.7	157.2	-177.3	0	0	105.3
2	W	26.5	Very low	32.5	Very low	235 Å²	235	144.2 Å²	144.2	89%	0.89	82%	0.823	S	S	*	*				55.7	123.9	63.7	-69.1	59.6	0	0	0	111
3	T	33.2	Very low	32.3	Very low	113 Å²	113	140.4 Å²	140.4	69%	0.693	81%	0.811	S	S	*	*			cis	-171	151.9	1.4	18	0	0	0	0	108.3
4	R	33.5	Very low	32.4	Very low	222 Å²	222	138.4 Å²	138.4	84%	0.838	80%	0.802	S	S	*	*			trans	-179.3	153.9	140.6	-109.6	-173	119	147.8	5.4	115.3
5	N	37.4	Very low	32.4	Very low	134 Å²	134	140.6 Å²	140.6	72%	0.717	80%	0.799	S	S	*	*			trans	49.7	126.9	155.6	-48.9	-12.1	0	0	0	118
6	G	29.5	Very low	32.7	Very low	76 Å²	76	138.3 Å²	138.3	78%	0.784	79%	0.788	S	S	*	*			cis	130.4	109.9	8	0	0	0	0	0	110.2
7	S	34	Very low	32.8	Very low	120 Å²	120	134.7 Å²	134.7	84%	0.839	77%	0.77	S	S	*	*			trans	-126.7	134.4	-178.9	-60	0	0	0	0	111.5
8	P	32.6	Very low	32.9	Very low	103 Å²	103	130.2 Å²	130.2	67%	0.669	75%	0.745	S	S	*	*			trans	-85.9	-176	166.8	32.9	-28.5	0	0	0	112
9	H	36.7	Very low	32.9	Very low	182 Å²	182	132 Å²	132	84%	0.843	74%	0.74	S	S	*	*			trans	74	94.2	178.4	-51.1	-75.4	0	0	0	116.1
10	G	29.5	Very low	32.7	Very low	79 Å²	79	128.4 Å²	128.4	81%	0.814	72%	0.724	S	S	*	*			trans	-88.3	126	160.2	0	0	0	0	0	110.6
11	A	32.6	Very low	32.7	Very low	105 Å²	105	128.5 Å²	128.5	87%	0.868	72%	0.723	S	S	*	*			trans	-86.8	118.5	170.8	0	0	0	0	0	109.9	S13	A11-S13 PolarHBondContact O-N 3.12Å
12	V	32	Very low	32.9	Very low	129 Å²	129	124 Å²	124	78%	0.782	70%	0.7	S	S	*	*			trans	-83.2	105.5	175.4	179.8	0	0	0	0	108.8	V14	V12-V14 PolarHBondContact O-N 3.35Å; V12-V14 VanDerWaalsContact O-N 3.12Å
13	S	30	Very low	33.3	Very low	95 Å²	95	118.2 Å²	118.2	66%	0.664	69%	0.693	S	S	*	*			trans	-71.3	102.7	173.1	-174.9	0	0	0	0	110.1	A11 F15	A11-S13 PolarHBondContact O-N 3.12Å; S13-F15 PolarHBondContact O-N 3.2Å
14	V	34.3	Very low	33.3	Very low	113 Å²	113	118.6 Å²	118.6	69%	0.685	70%	0.698	S	S	*	*			trans	-76.2	91.5	174.3	-176.4	0	0	0	0	108.7	V12 T16	V12-V14 PolarHBondContact O-N 3.35Å; V12-V14 VanDerWaalsContact O-N 3.12Å; V14-T16 PolarHBondContact O-N 3.09Å
15	F	32.2	Very low	33.3	Very low	171 Å²	171	115.6 Å²	115.6	75%	0.75	70%	0.698	S	S	*	*			trans	-61.1	118	166.6	-99.7	-102.1	0	0	0	109.3	S13 T17	S13-F15 PolarHBondContact O-N 3.2Å; F15-T17 VanDerWaalsContact C-N 3.25Å; F15-T17 PolarHBondContact O-N 3.34Å
16	T	36.9	Very low	33	Very low	104 Å²	104	120.2 Å²	120.2	64%	0.638	71%	0.707	S	S	*	*			trans	-74.7	84.4	172	-158.1	0	0	0	0	109.5	V14 V18	V14-T16 PolarHBondContact O-N 3.09Å; T16-V18 PolarHBondContact O-N 3.19Å
17	T	35.4	Very low	33.2	Very low	77 Å²	77	121.7 Å²	121.7	47%	0.472	71%	0.706	S	S	.	*			trans	-92.5	78.2	172.1	-47.8	0	0	0	0	108	F15 Y19	F15-T17 VanDerWaalsContact C-N 3.25Å; F15-T17 PolarHBondContact O-N 3.34Å; T17-Y19 HydrophobicContact CG2-CD2 3.68Å; T17-Y19 HydrophobicContact CG2-CE2 3.81Å
18	V	34.6	Very low	33	Very low	54 Å²	54	119.2 Å²	119.2	33%	0.327	70%	0.699	S	S	.	*			trans	-59.1	137.1	164.7	-166.1	0	0	0	0	107.4	T16 E620	T16-V18 PolarHBondContact O-N 3.19Å; V18-E620 VanDerWaalsContact CB-OE1 3.25Å; V18-E620 WeakPolarHBondContact CB-OE1 3.32Å; V18-E620 WeakPolarHBondContact CG1-OE1 3.37Å
19	Y	31.4	Very low	33.1	Very low	164 Å²	164	121.9 Å²	121.9	64%	0.643	71%	0.707	S	S	*	*			trans	-134	106.7	-178.8	-120.1	-69.7	0	0	0	110.1	T17 N21	T17-Y19 HydrophobicContact CG2-CD2 3.68Å; T17-Y19 HydrophobicContact CG2-CE2 3.81Å; Y19-N21 PolarHBondContact O-N 2.96Å
20	S	29	Very low	32.9	Very low	60 Å²	60	116.2 Å²	116.2	42%	0.42	70%	0.698	S	S	.	*			trans	-72.8	70.3	171.6	-59.5	0	0	0	0	111.7	E620	S20-E620 WeakPolarHBondContact CB-OE2 3.41Å; S20-E620 VanDerWaalsContact OG-CD 3.25Å; S20-E620 PolarHBondContact OG-OE1 3.25Å; S20-E620 PolarHBondContact OG-OE2 2.99Å
21	N	33.3	Very low	33.1	Very low	130 Å²	130	118.5 Å²	118.5	70%	0.695	70%	0.699	S	S	*	*			trans	-143.3	118	172.2	-95	-35.4	0	0	0	111.8	Y19	Y19-N21 PolarHBondContact O-N 2.96Å
22	M	36.4	Very low	33	Very low	138 Å²	138	122.2 Å²	122.2	68%	0.68	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-70.4	144.8	169.1	-81.1	-179.8	160.2	0	0	110.8
23	P	34.3	Very low	33.1	Very low	114 Å²	114	124 Å²	124	74%	0.74	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-65.5	146.4	162.1	30.3	-33.8	0	0	0	110
24	P	33.5	Very low	32.9	Very low	121 Å²	121	124.1 Å²	124.1	79%	0.786	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-64.8	153.6	179.5	26.9	-34.5	0	0	0	112.5	Y26	P24-Y26 PolarHBondContact O-N 2.98Å
25	N	32.9	Very low	32.9	Very low	159 Å²	159	126.1 Å²	126.1	85%	0.85	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-47.4	122	-171.8	-74.8	-48	0	0	0	114.6	S27	N25-S27 PolarHBondContact O-N 3.18Å
26	Y	32.2	Very low	32.8	Very low	230 Å²	230	123.4 Å²	123.4	90%	0.902	70%	0.702	S	S	*	*			trans	-85	82.9	155.7	-114.2	-91.2	0	0	0	109.4	P24 G28	P24-Y26 PolarHBondContact O-N 2.98Å; Y26-G28 PolarHBondContact O-N 3.12Å
27	S	32.6	Very low	32.5	Very low	108 Å²	108	125.1 Å²	125.1	76%	0.755	71%	0.713	S	S	*	*			trans	-72.5	75.3	167.7	57.5	0	0	0	0	109.7	N25 N29	N25-S27 PolarHBondContact O-N 3.18Å; S27-N29 PolarHBondContact O-N 3.45Å
28	G	31.1	Very low	32.5	Very low	67 Å²	67	128.6 Å²	128.6	69%	0.691	73%	0.734	S	S	*	*			trans	-68.8	92.9	-176.4	0	0	0	0	0	112.5	Y26	Y26-G28 PolarHBondContact O-N 3.12Å
29	N	34.2	Very low	32.4	Very low	159 Å²	159	130.3 Å²	130.3	85%	0.85	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-60.7	156.6	163	-93.7	-35.1	0	0	0	111.1	S27	S27-N29 PolarHBondContact O-N 3.45Å
30	G	32.9	Very low	32.5	Very low	63 Å²	63	130.6 Å²	130.6	65%	0.649	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-58.9	166.1	-173.3	0	0	0	0	0	115.6
31	P	32.4	Very low	32.8	Very low	127 Å²	127	133.7 Å²	133.7	83%	0.825	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-71.5	144.8	-159	29.1	-36.7	0	0	0	113.7
32	Q	32.6	Very low	32.9	Very low	183 Å²	183	131.5 Å²	131.5	86%	0.855	79%	0.792	S	S	*	*			trans	-127	130.8	159.2	-82.5	-62.8	-14.7	0	0	110.5
33	L	32.6	Very low	32.7	Very low	166 Å²	166	129.5 Å²	129.5	87%	0.869	80%	0.797	S	S	*	*			trans	-79	139.4	175.1	-74.1	161.2	0	0	0	108.9
34	S	26.5	Very low	32.8	Very low	98 Å²	98	133.3 Å²	133.3	69%	0.685	81%	0.805	S	S	*	*			trans	-67.4	134.5	177	54.6	0	0	0	0	112.1
35	Y	33.2	Very low	32.6	Very low	155 Å²	155	134 Å²	134	61%	0.608	81%	0.807	S	S	*	*			trans	-160.4	135.1	134.7	-96.2	-62.9	0	0	0	113.3
36	S	32	Very low	32.6	Very low	114 Å²	114	131.6 Å²	131.6	80%	0.797	81%	0.809	S	S	*	*			trans	55.2	116.5	149.7	-57.2	0	0	0	0	121.6
37	T	29.9	Very low	32.6	Very low	141 Å²	141	126.6 Å²	126.6	87%	0.865	80%	0.803	S	S	*	*			trans	-69.8	141	169.9	16.5	0	0	0	0	115.2
38	T	34.5	Very low	32.5	Very low	149 Å²	149	129.4 Å²	129.4	91%	0.914	80%	0.804	S	S	*	*			trans	-144	152.4	135.9	-20.3	0	0	0	0	109.2
39	A	32.1	Very low	32.8	Very low	90 Å²	90	131 Å²	131	74%	0.744	80%	0.802	S	S	*	*			trans	-115.3	157.2	-168	0	0	0	0	0	113.8
40	L	34.8	Very low	32.6	Very low	171 Å²	171	133.6 Å²	133.6	90%	0.895	80%	0.802	S	S	*	*			trans	-170.5	142.8	136	-100.2	166.8	0	0	0	109.6
41	P	34.4	Very low	32.4	Very low	125 Å²	125	137.5 Å²	137.5	81%	0.812	81%	0.808	S	S	*	*			trans	-101.6	155.3	-175	38	-32.9	0	0	0	114
42	G	35.2	Very low	32.4	Very low	83 Å²	83	137.8 Å²	137.8	86%	0.856	81%	0.807	S	S	*	*			trans	-156.4	130.6	168	0	0	0	0	0	110.2
43	A	32.7	Very low	32.4	Very low	96 Å²	96	132.2 Å²	132.2	79%	0.793	80%	0.799	S	S	*	*			trans	-114.3	153.3	-172.8	0	0	0	0	0	112
44	Q	35.9	Very low	32.4	Very low	195 Å²	195	132.8 Å²	132.8	91%	0.911	80%	0.801	S	S	*	*				-170.2	165.5	121.6	-102.6	167	37	0	0	112.7
45	T	30.3	Very low	32.6	Very low	135 Å²	135	132.7 Å²	132.7	83%	0.828	80%	0.801	S	S	*	*			trans	-116.1	140.5	-164.8	49	0	0	0	0	112.6
46	A	33.6	Very low	32.7	Very low	108 Å²	108	133.1 Å²	133.1	89%	0.893	81%	0.814	S	S	*	*			trans	-155.1	114.6	158.3	0	0	0	0	0	112.6
47	T	31.6	Very low	32.8	Very low	125 Å²	125	134.5 Å²	134.5	77%	0.767	81%	0.812	S	S	*	*			trans	-94.3	147.9	-168.7	32.2	0	0	0	0	115.9
48	Q	31.2	Very low	33	Very low	167 Å²	167	135.9 Å²	135.9	78%	0.78	81%	0.813	S	S	*	*			trans	72.6	174.7	143.6	-58.3	-79.3	21.2	0	0	118.2
49	P	36.1	Very low	33	Very low	100 Å²	100	134 Å²	134	65%	0.649	80%	0.801	S	S	*	*				-138	179.6	-56.1	40	-24.9	0	0	0	116.6
50	Y	29.5	Very low	33.1	Very low	215 Å²	215	136.6 Å²	136.6	84%	0.843	80%	0.803	S	S	*	*			trans	0.7	146.1	150.7	-70.2	-95.6	0	0	0	120
51	N	30.1	Very low	33.1	Very low	144 Å²	144	138 Å²	138	77%	0.77	80%	0.804	S	S	*	*				-171.2	-170	59.8	-158.7	-5.5	0	0	0	113.8
52	T	32.2	Very low	32.9	Very low	133 Å²	133	137.9 Å²	137.9	82%	0.816	80%	0.801	S	S	*	*			trans	-101.2	170.2	-168.9	58.3	0	0	0	0	115.5
53	G	32.1	Very low	32.9	Very low	67 Å²	67	141 Å²	141	69%	0.691	80%	0.804	S	S	*	*			trans	-177.4	58.8	-179.8	0	0	0	0	0	122.7
54	I	33.7	Very low	32.8	Very low	177 Å²	177	142.8 Å²	142.8	91%	0.908	81%	0.805	S	S	*	*			trans	69.5	153	138.8	-59	165.3	0	0	0	120.9
55	S	30.6	Very low	32.8	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	80%	0.797	S	S	*	*			trans	-96.5	174.2	-167.4	-38.1	0	0	0	0	116.7
56	N	34.9	Very low	33	Very low	164 Å²	164	139.3 Å²	139.3	88%	0.877	80%	0.8	S	S	*	*				-169.8	155.2	126.2	-96.7	-18	0	0	0	113.5
57	D	33.1	Very low	32.8	Very low	142 Å²	142	144.8 Å²	144.8	76%	0.759	80%	0.798	S	S	*	*			trans	-92.3	160.5	-166.3	-56.8	-93.5	0	0	0	116.8
58	L	35.7	Very low	33.1	Very low	170 Å²	170	144.6 Å²	144.6	89%	0.89	80%	0.798	S	S	*	*			trans	-156.3	84.5	148	-145.3	76.6	0	0	0	116.4
59	V	34.2	Very low	33.1	Very low	110 Å²	110	143.1 Å²	143.1	67%	0.667	80%	0.796	S	S	*	*				46.5	123.4	127.5	-176.5	0	0	0	0	121.7
60	N	32.6	Very low	33.1	Very low	144 Å²	144	143 Å²	143	77%	0.77	80%	0.798	S	S	*	*			trans	67.8	117.7	152.3	-68.5	-12.4	0	0	0	122.8
61	Q	35.1	Very low	33.3	Very low	200 Å²	200	137.9 Å²	137.9	94%	0.935	79%	0.793	S	S	*	*				-155.8	160.9	110.6	-110.2	177.1	26.3	0	0	111.8
62	V	29.7	Very low	33.2	Very low	123 Å²	123	135.9 Å²	135.9	75%	0.745	80%	0.796	S	S	*	*			trans	-129.6	132.6	-168.9	173.6	0	0	0	0	111.5
63	T	36.5	Very low	33.3	Very low	149 Å²	149	136.2 Å²	136.2	91%	0.914	80%	0.798	S	S	*	*			trans	-155.7	157.4	154.8	13.4	0	0	0	0	111.1
64	T	30.9	Very low	33.3	Very low	134 Å²	134	137.2 Å²	137.2	82%	0.822	80%	0.8	S	S	*	*			trans	-117.1	142.4	-165.9	51.6	0	0	0	0	114.1
65	A	34.9	Very low	33.5	Very low	89 Å²	89	134.2 Å²	134.2	74%	0.736	79%	0.792	S	S	*	*			trans	-157.4	130	154	0	0	0	0	0	113.1
66	D	35.4	Very low	33.5	Very low	167 Å²	167	135.6 Å²	135.6	89%	0.893	80%	0.8	S	S	*	*			trans	56.1	143.2	149.3	-56.5	-32	0	0	0	125.7
67	R	28.5	Very low	33.4	Very low	224 Å²	224	138.9 Å²	138.9	85%	0.845	80%	0.802	S	S	*	*			trans	-117.2	166.8	174.6	-114.8	172.8	165.9	174.9	-5.5	107.2
68	P	37.9	Very low	33.6	Very low	120 Å²	120	138 Å²	138	78%	0.779	80%	0.804	S	S	*	*			cis	-127.1	164.2	43.6	10.3	16.7	0	0	0	113.5
69	N	32.4	Very low	33.6	Very low	137 Å²	137	132 Å²	132	73%	0.733	78%	0.784	S	S	*	*			cis	97.2	154.7	42	-160.8	33.3	0	0	0	113.8
70	S	34.5	Very low	33.6	Very low	98 Å²	98	135.6 Å²	135.6	69%	0.685	79%	0.793	S	S	*	*			trans	74.8	135.5	-172.8	-74.6	0	0	0	0	116.4
71	S	34	Very low	33.9	Very low	107 Å²	107	135.5 Å²	135.5	75%	0.748	80%	0.798	S	S	*	*			cis	-155	151.7	-9.4	-92.3	0	0	0	0	111.5
72	A	28.8	Very low	33.9	Very low	101 Å²	101	128.9 Å²	128.9	84%	0.835	78%	0.783	S	S	*	*			trans	-134.4	137.9	170.7	0	0	0	0	0	109.9
73	V	33.3	Very low	34.6	Very low	141 Å²	141	129.1 Å²	129.1	86%	0.855	79%	0.787	S	S	*	*			trans	-147.5	138.5	-179.9	-178.8	0	0	0	0	110.2
74	A	33.1	Very low	35	Very low	87 Å²	87	126.5 Å²	126.5	72%	0.719	77%	0.773	S	S	*	*			trans	-124.7	156.6	168.1	0	0	0	0	0	110
75	P	37.3	Very low	35.3	Very low	114 Å²	114	127 Å²	127	74%	0.74	77%	0.77	S	S	*	*				-141.3	147.5	129.7	19	3	0	0	0	112.6
76	C	30.1	Very low	35.5	Very low	127 Å²	127	127.8 Å²	127.8	86%	0.858	77%	0.766	S	S	*	*				92.2	131.2	52.6	-63.9	0	0	0	0	115.1
77	Y	32.8	Very low	35.6	Very low	233 Å²	233	127 Å²	127	91%	0.914	76%	0.762	S	S	*	*			trans	-93.9	160.2	165.7	-90.7	-95	0	0	0	110.8
78	P	38.4	Very low	36	Very low	122 Å²	122	121 Å²	121	79%	0.792	76%	0.761	S	S	*	*			trans	-121.2	161.5	173	39.8	-29.3	0	0	0	116.7
79	G	35.2	Very low	35.9	Very low	46 Å²	46	120.2 Å²	120.2	47%	0.474	76%	0.764	S	S	.	*			trans	-152.5	-165.9	167.7	0	0	0	0	0	109.2	A825	G79-A825 WeakPolarHBondContact O-CA 3.29Å
80	E	35.2	Very low	36.2	Very low	184 Å²	184	118.5 Å²	118.5	86%	0.86	77%	0.768	S	S	*	*			cis	-164.8	165.4	2.8	-167.1	171.7	-81.3	0	0	107.8
81	V	37.1	Very low	36.6	Very low	143 Å²	143	119.4 Å²	119.4	87%	0.867	77%	0.772	S	S	*	*			trans	-134.4	104.5	-179.4	-165.9	0	0	0	0	114.2
82	G	35.4	Very low	36.7	Very low	61 Å²	61	126 Å²	126	63%	0.629	78%	0.782	S	S	*	*			trans	-100.6	-122	160.9	0	0	0	0	0	110.2
83	P	45.2	Very low	37.2	Very low	127 Å²	127	124.4 Å²	124.4	83%	0.825	78%	0.776	S	S	*	*			cis	-118	-133.6	-10.1	33	-9.8	0	0	0	108
84	P	45.4	Very low	37.3	Very low	95 Å²	95	122.6 Å²	122.6	62%	0.617	78%	0.776	S	S	*	*			cis	-133	-160.3	-21.1	39.4	-19.1	0	0	0	113.9
85	N	37.4	Very low	37.5	Very low	143 Å²	143	125.3 Å²	125.3	77%	0.765	78%	0.783	S	S	*	*			trans	71.5	162.9	160.6	-66.6	-8.7	0	0	0	117.1
86	T	37.2	Very low	37.2	Very low	107 Å²	107	127.1 Å²	127.1	66%	0.656	79%	0.787	S	S	*	*			cis	-173.1	157.6	-22.3	37.9	0	0	0	0	105.3
87	N	37.8	Very low	37.6	Very low	150 Å²	150	132.5 Å²	132.5	80%	0.802	79%	0.791	S	S	*	*			cis	-169.5	161.8	-8.8	-100.8	5.7	0	0	0	105.6
88	A	37.6	Very low	37.7	Very low	99 Å²	99	126.8 Å²	126.8	82%	0.818	79%	0.785	S	S	*	*			cis	-154.8	-160.1	-8.2	0	0	0	0	0	107.7
89	A	36.1	Very low	37.4	Very low	102 Å²	102	132 Å²	132	84%	0.843	79%	0.789	S	S	*	*			trans	-147.6	161.5	-170.7	0	0	0	0	0	115.6
90	A	38.1	Very low	37.7	Very low	101 Å²	101	135.3 Å²	135.3	84%	0.835	80%	0.802	S	S	*	*			trans	-170.6	133.9	155.8	0	0	0	0	0	112.7
91	P	43.9	Very low	37.8	Very low	118 Å²	118	130.4 Å²	130.4	77%	0.766	80%	0.801	S	S	*	*			trans	-130.6	172.3	178.3	43	-31.1	0	0	0	116.3
92	Y	36.2	Very low	37.5	Very low	244 Å²	244	130.6 Å²	130.6	96%	0.957	80%	0.797	S	S	*	*			trans	-170.7	166.9	150.7	-93.4	-61.1	0	0	0	107.9
93	G	38.3	Very low	37.5	Very low	68 Å²	68	137.9 Å²	137.9	70%	0.701	81%	0.807	S	S	*	*			cis	-176.2	174.3	-0.6	0	0	0	0	0	109.7
94	A	34.9	Very low	37.1	Very low	103 Å²	103	139.6 Å²	139.6	85%	0.851	80%	0.804	S	S	*	*			trans	-153.3	157.6	-170	0	0	0	0	0	116.3
95	T	38.1	Very low	36.6	Very low	144 Å²	144	141.3 Å²	141.3	88%	0.883	81%	0.812	S	S	*	*			trans	-157.5	140.8	165.6	46.9	0	0	0	0	112.3
96	D	31.5	Very low	36.7	Very low	152 Å²	152	138 Å²	138	81%	0.813	81%	0.812	S	S	*	*			trans	-82.8	166	176.5	-74	-71.1	0	0	0	115.3
97	Y	38.7	Very low	36.8	Very low	240 Å²	240	140.4 Å²	140.4	94%	0.941	82%	0.821	S	S	*	*			trans	-166.5	174.1	134.5	-98.8	-59.9	0	0	0	112
98	S	34.5	Very low	37.2	Very low	114 Å²	114	137.9 Å²	137.9	80%	0.797	81%	0.813	S	S	*	*			trans	-112.3	163.8	-149.3	-47.2	0	0	0	0	118.9
99	R	32.2	Very low	37.2	Very low	232 Å²	232	138.9 Å²	138.9	88%	0.875	81%	0.814	S	S	*	*			trans	-46	176.7	163.4	-111.7	-171.2	149.5	-156	-1.3	115.4
100	P	41.7	Very low	37.2	Very low	114 Å²	114	138.7 Å²	138.7	74%	0.74	81%	0.806	S	S	*	*			cis	-134.6	178.4	-22.7	38.9	-22.3	0	0	0	114.6
101	G	35.9	Very low	37.2	Very low	81 Å²	81	137.8 Å²	137.8	84%	0.835	79%	0.794	S	S	*	*			trans	-174.4	148.9	164.9	0	0	0	0	0	114
102	N	31.8	Very low	36.7	Very low	147 Å²	147	139.8 Å²	139.8	79%	0.786	79%	0.793	S	S	*	*			trans	-159.6	125.5	-171.6	172.1	85.1	0	0	0	113.5
103	Y	34.4	Very low	36.7	Very low	214 Å²	214	138.3 Å²	138.3	84%	0.839	79%	0.787	S	S	*	*			trans	-162.4	142	161.5	-85.8	-61.3	0	0	0	114.5
104	H	37	Very low	36.5	Very low	164 Å²	164	139 Å²	139	76%	0.759	79%	0.787	S	S	*	*			trans	2.8	159.1	151.2	-64.1	-36.7	0	0	0	123.3
105	T	35.7	Very low	36.2	Very low	130 Å²	130	139.2 Å²	139.2	80%	0.798	78%	0.782	S	S	*	*			cis	-173.1	158.5	-8.4	27.3	0	0	0	0	110
106	G	40	Very low	36	Very low	74 Å²	74	137.2 Å²	137.2	76%	0.763	78%	0.78	S	S	*	*			trans	168.2	71.6	163.3	0	0	0	0	0	120.5
107	D	37.9	Very low	36	Very low	158 Å²	158	137.9 Å²	137.9	85%	0.845	78%	0.784	S	S	*	*				38.1	162.6	124.9	-121.2	37.9	0	0	0	124.3
108	P	47.3	Very low	35.6	Very low	96 Å²	96	130 Å²	130	62%	0.623	78%	0.775	S	S	*	*				-138.8	-157.4	-78.9	46.1	-29.6	0	0	0	115.5
109	S	36.2	Very low	35.4	Very low	120 Å²	120	131.9 Å²	131.9	84%	0.839	78%	0.776	S	S	*	*			trans	88	147.6	168.7	79.4	0	0	0	0	117.5
110	S	37	Very low	35.6	Very low	98 Å²	98	126.4 Å²	126.4	69%	0.685	77%	0.771	S	S	*	*			cis	-147.2	167.4	10.1	66.2	0	0	0	0	115.3
111	S	37.6	Very low	35.1	Very low	82 Å²	82	126.6 Å²	126.6	57%	0.573	78%	0.775	S	S	*	*			trans	55.2	106.3	152.5	55.1	0	0	0	0	119.9
112	E	33.3	Very low	34.8	Very low	160 Å²	160	126.2 Å²	126.2	75%	0.748	77%	0.771	S	S	*	*				87.7	138.2	77.6	-75.7	162.4	117.1	0	0	113.4
113	Y	36.5	Very low	34.6	Very low	213 Å²	213	123.8 Å²	123.8	84%	0.835	77%	0.771	S	S	*	*			cis	-137.4	173.6	33.8	-108.1	-84.9	0	0	0	115.9
114	A	34.4	Very low	34.5	Very low	83 Å²	83	121.6 Å²	121.6	69%	0.686	77%	0.773	S	S	*	*			trans	-49	149.6	-176.9	0	0	0	0	0	116.8
115	S	29.1	Very low	34.1	Very low	108 Å²	108	121.5 Å²	121.5	76%	0.755	78%	0.778	S	S	*	*			cis	82.1	108.3	26.8	-166	0	0	0	0	116.5
116	A	34.3	Very low	33.7	Very low	102 Å²	102	120.2 Å²	120.2	84%	0.843	78%	0.78	S	S	*	*			trans	-150.6	124.9	159.5	0	0	0	0	0	109.3
117	N	30.6	Very low	33.1	Very low	166 Å²	166	120.9 Å²	120.9	89%	0.888	78%	0.779	S	S	*	*			trans	-85.7	150.5	-173.1	-67.2	-50.3	0	0	0	113
118	G	30.2	Very low	32.7	Very low	74 Å²	74	122.4 Å²	122.4	76%	0.763	78%	0.781	S	S	*	*			trans	173.9	70.6	170.5	0	0	0	0	0	115.8	P120	G118-P120 WeakPolarHBondContact O-CD 3.34Å
119	N	29.4	Very low	31.9	Very low	153 Å²	153	125 Å²	125	82%	0.818	80%	0.795	S	S	*	*			trans	-100	120.6	171.8	-178.5	9.6	0	0	0	111.2
120	P	37.2	Very low	31.5	Very low	117 Å²	117	124.2 Å²	124.2	76%	0.76	80%	0.795	S	S	*	*			trans	-121.1	116.8	159.9	34.8	-21.5	0	0	0	112.1	G118	G118-P120 WeakPolarHBondContact O-CD 3.34Å
121	S	31	Very low	31.1	Very low	119 Å²	119	124.8 Å²	124.8	83%	0.832	81%	0.806	S	S	*	*			trans	-80.8	127.4	167.8	54.8	0	0	0	0	111.8
122	G	29	Very low	30.6	Very low	72 Å²	72	125.6 Å²	125.6	74%	0.742	82%	0.817	S	S	*	*			trans	131.1	127.4	159	0	0	0	0	0	116.2
123	A	28.4	Very low	30.5	Very low	97 Å²	97	122.6 Å²	122.6	80%	0.802	82%	0.82	S	S	*	*			trans	65.6	151.9	-179.5	0	0	0	0	0	114.5
124	L	32.2	Very low	30.1	Very low	168 Å²	168	119.1 Å²	119.1	88%	0.88	82%	0.82	S	S	*	*			cis	-127	164	17.4	-76.9	158.7	0	0	0	113.4
125	N	28.4	Very low	29.9	Very low	162 Å²	162	119.3 Å²	119.3	87%	0.866	82%	0.822	S	S	*	*			trans	-93.1	168	173	-72.7	-36.4	0	0	0	112.4
126	A	26.9	Very low	29.8	Very low	102 Å²	102	120.1 Å²	120.1	84%	0.843	82%	0.822	S	S	*	*			trans	86.8	155.1	160	0	0	0	0	0	119.2
127	A	27.4	Very low	29.7	Very low	88 Å²	88	119.6 Å²	119.6	73%	0.727	82%	0.818	S	S	*	*			trans	63.4	91.3	174.9	0	0	0	0	0	118.2
128	H	31	Very low	29.6	Very low	191 Å²	191	117.9 Å²	117.9	88%	0.884	81%	0.814	S	S	*	*				-171	96.1	104.7	-100.2	-69.9	0	0	0	111.8
129	V	29.3	Very low	29.6	Very low	151 Å²	151	118.9 Å²	118.9	92%	0.915	82%	0.815	S	S	*	*			trans	-142	104.4	169.6	177.1	0	0	0	0	108.3
130	A	27.9	Very low	29.8	Very low	103 Å²	103	117.6 Å²	117.6	85%	0.851	81%	0.813	S	S	*	*			trans	-167.1	100.8	169.4	0	0	0	0	0	111.4
131	A	28.5	Very low	29.5	Very low	110 Å²	110	116.8 Å²	116.8	91%	0.909	82%	0.816	S	S	*	*			trans	-160.5	64.1	168.9	0	0	0	0	0	110.5
132	A	28.3	Very low	29.7	Very low	98 Å²	98	117.1 Å²	117.1	81%	0.81	81%	0.813	S	S	*	*			trans	-119.1	146.2	179.1	0	0	0	0	0	111.3
133	A	30.7	Very low	29.9	Very low	97 Å²	97	118.3 Å²	118.3	80%	0.802	82%	0.816	S	S	*	*			trans	-53.4	133.1	-165.8	0	0	0	0	0	116.2
134	V	27.3	Very low	30.2	Very low	140 Å²	140	119.7 Å²	119.7	85%	0.848	81%	0.814	S	S	*	*			trans	-83.3	111.7	154.2	176.7	0	0	0	0	108.1
135	A	30.8	Very low	30.2	Very low	87 Å²	87	116.3 Å²	116.3	72%	0.719	81%	0.81	S	S	*	*			trans	-116.8	95	177.7	0	0	0	0	0	110.6	A137	A135-A137 PolarHBondContact O-N 2.99Å; A135-A137 VanDerWaalsContact O-N 3.14Å
136	T	27.3	Very low	30.7	Very low	125 Å²	125	116.1 Å²	116.1	77%	0.767	81%	0.808	S	S	*	*			trans	-75.6	100	178.2	-53.1	0	0	0	0	110.8
137	A	32	Very low	31	Very low	91 Å²	91	117.3 Å²	117.3	75%	0.752	80%	0.8	S	S	*	*			trans	-123.3	81	178.9	0	0	0	0	0	111.6	A135 A139	A135-A137 PolarHBondContact O-N 2.99Å; A135-A137 VanDerWaalsContact O-N 3.14Å; A137-A139 PolarHBondContact O-N 2.94Å
138	T	28	Very low	31.4	Very low	130 Å²	130	121 Å²	121	80%	0.798	80%	0.802	S	S	*	*			trans	-74.9	104.2	178.3	-46	0	0	0	0	111
139	A	31.7	Very low	31.5	Very low	95 Å²	95	116.7 Å²	116.7	79%	0.785	79%	0.789	S	S	*	*			trans	-119.2	105.6	175.6	0	0	0	0	0	110.9	A137 A141	A137-A139 PolarHBondContact O-N 2.94Å; A139-A141 PolarHBondContact O-N 2.86Å
140	T	32.4	Very low	31.5	Very low	126 Å²	126	116.8 Å²	116.8	77%	0.773	78%	0.78	S	S	*	*			trans	-76.1	112.9	-179.3	45.7	0	0	0	0	112.1	T142	T140-T142 PolarHBondContact O-N 3.06Å
141	A	31	Very low	31.8	Very low	100 Å²	100	121.1 Å²	121.1	83%	0.826	78%	0.78	S	S	*	*			trans	-80.6	99.5	173.5	0	0	0	0	0	111.8	A139 A143	A139-A141 PolarHBondContact O-N 2.86Å; A141-A143 PolarHBondContact O-N 3.38Å; A141-A143 VanDerWaalsContact O-N 3.14Å
142	T	34.6	Very low	31.9	Very low	126 Å²	126	124.4 Å²	124.4	77%	0.773	78%	0.776	S	S	*	*			trans	-79	87.1	169.8	48.5	0	0	0	0	111	T140 V144	T140-T142 PolarHBondContact O-N 3.06Å; T142-V144 PolarHBondContact O-N 3.16Å
143	A	33.5	Very low	32.1	Very low	98 Å²	98	124.3 Å²	124.3	81%	0.81	77%	0.768	S	S	*	*			trans	-73.8	111.7	169.3	0	0	0	0	0	110.3	A141 A145	A141-A143 PolarHBondContact O-N 3.38Å; A141-A143 VanDerWaalsContact O-N 3.14Å; A143-A145 PolarHBondContact O-N 3.42Å
144	V	35.6	Very low	32.4	Very low	126 Å²	126	130.6 Å²	130.6	76%	0.764	77%	0.772	S	S	*	*			trans	-89.7	95.7	171.7	-179.5	0	0	0	0	108.5	T142 I146	T142-V144 PolarHBondContact O-N 3.16Å; V144-I146 HydrophobicContact CG1-CD1 4.48Å; V144-I146 HydrophobicContact CG1-CG1 4.23Å
145	A	32.2	Very low	32.9	Very low	96 Å²	96	129.1 Å²	129.1	79%	0.793	77%	0.765	S	S	*	*			trans	-76.6	129.5	167.7	0	0	0	0	0	109.9	A143	A143-A145 PolarHBondContact O-N 3.42Å
146	I	39.3	Very low	33.1	Very low	158 Å²	158	129.6 Å²	129.6	81%	0.81	76%	0.761	S	S	*	*			trans	-120.9	102.7	164.1	-62.8	172.7	0	0	0	107.3	V144	V144-I146 HydrophobicContact CG1-CD1 4.48Å; V144-I146 HydrophobicContact CG1-CG1 4.23Å
147	D	32.2	Very low	33.5	Very low	127 Å²	127	129.7 Å²	129.7	68%	0.679	75%	0.753	S	S	*	*			trans	-88	130.2	161.2	168.7	39.9	0	0	0	108.9
148	Q	35.8	Very low	33.6	Very low	167 Å²	167	132.4 Å²	132.4	78%	0.78	75%	0.75	S	S	*	*				-168.1	100.9	129.1	-106.9	165.6	38.9	0	0	112.9
149	T	32.5	Very low	33.8	Very low	99 Å²	99	134.4 Å²	134.4	61%	0.607	75%	0.75	S	S	*	*			trans	51.4	147.1	131.5	65.8	0	0	0	0	122.8
150	Q	30.9	Very low	33.9	Very low	154 Å²	154	136.4 Å²	136.4	72%	0.72	75%	0.752	S	S	*	*			trans	74.1	118.7	173.2	-44.8	-68.9	-16.4	0	0	113.5
151	F	32.5	Very low	34	Very low	194 Å²	194	135.5 Å²	135.5	85%	0.851	75%	0.749	S	S	*	*			cis	-140.5	172.3	32.1	-99.3	-89.6	0	0	0	114.3
152	Q	32.3	Very low	34.1	Very low	178 Å²	178	137.1 Å²	137.1	83%	0.832	75%	0.748	S	S	*	*			trans	-95.4	161.2	-175.5	-85.4	-86.6	-57.9	0	0	114.5
153	P	32.6	Very low	33.9	Very low	97 Å²	97	142.5 Å²	142.5	63%	0.63	76%	0.756	S	S	*	*			trans	-99	159	-173.1	39	-34.6	0	0	0	114.3
154	Y	36.3	Very low	33.9	Very low	229 Å²	229	141.2 Å²	141.2	90%	0.898	75%	0.752	S	S	*	*			trans	-140.7	155.4	163.4	-98.8	-92.8	0	0	0	112.2
155	P	36.7	Very low	33.7	Very low	108 Å²	108	140.5 Å²	140.5	70%	0.701	75%	0.752	S	S	*	*			trans	-101.3	174.5	-164.8	40.1	-32.4	0	0	0	114
156	P	35.2	Very low	33.9	Very low	97 Å²	97	143.8 Å²	143.8	63%	0.63	75%	0.751	S	S	*	*			trans	-92.9	154.2	-172.4	36.3	-35.6	0	0	0	114.5
157	Q	37.3	Very low	33.6	Very low	127 Å²	127	143 Å²	143	59%	0.593	74%	0.744	S	S	*	*			trans	-175.8	122.9	137.9	-97.8	-71.1	-1.8	0	0	111.4
158	Q	32.9	Very low	33.8	Very low	149 Å²	149	147.1 Å²	147.1	70%	0.696	75%	0.752	S	S	*	*			trans	49	150.8	145.5	-86.6	-173.6	35.6	0	0	126.7
159	Q	31.8	Very low	33.6	Very low	171 Å²	171	144.3 Å²	144.3	80%	0.799	75%	0.751	S	S	*	*			trans	94.5	142.6	153	-76.4	167.1	49.6	0	0	121.2
160	V	33.4	Very low	33.7	Very low	137 Å²	137	144.1 Å²	144.1	83%	0.83	76%	0.759	S	S	*	*			trans	-99.5	178	-169	-107.7	0	0	0	0	110.1
161	P	36.4	Very low	33.9	Very low	108 Å²	108	141.7 Å²	141.7	70%	0.701	77%	0.766	S	S	*	*			cis	-143.1	178.4	24	42.5	-22	0	0	0	118.7
162	V	31.6	Very low	34	Very low	133 Å²	133	137.1 Å²	137.1	81%	0.806	76%	0.763	S	S	*	*			trans	15.7	124.4	146.1	-176.7	0	0	0	0	118.9
163	Y	31.8	Very low	34.1	Very low	240 Å²	240	133.9 Å²	133.9	94%	0.941	77%	0.767	S	S	*	*			trans	-76.6	116.6	162.4	-116	-97.8	0	0	0	111.6
164	G	31.9	Very low	34.2	Very low	70 Å²	70	133.2 Å²	133.2	72%	0.722	78%	0.778	S	S	*	*			trans	-114.2	147.4	162.1	0	0	0	0	0	109.9
165	S	32	Very low	34.3	Very low	111 Å²	111	131 Å²	131	78%	0.776	78%	0.776	S	S	*	*			trans	-110.9	157.3	-176.6	58	0	0	0	0	113.2
166	Q	36.2	Very low	34.5	Very low	165 Å²	165	131.2 Å²	131.2	77%	0.771	78%	0.777	S	S	*	*			trans	82.2	106.9	173.3	-52.8	-162.8	-5.5	0	0	118.7
167	Q	34.2	Very low	34.9	Very low	143 Å²	143	131.6 Å²	131.6	67%	0.668	78%	0.779	S	S	*	*				46.4	117.6	122.4	-60	168.4	-30.6	0	0	118.9
168	Y	34.5	Very low	34.6	Very low	212 Å²	212	130.7 Å²	130.7	83%	0.831	79%	0.787	S	S	*	*				-169.8	173.4	87.9	-103.4	-75.3	0	0	0	112.1
169	S	31.8	Very low	34.8	Very low	109 Å²	109	133.4 Å²	133.4	76%	0.762	80%	0.797	S	S	*	*			trans	-87.6	160	-155.6	-45.8	0	0	0	0	117.4
170	A	35.3	Very low	34.7	Very low	95 Å²	95	131.9 Å²	131.9	79%	0.785	80%	0.795	S	S	*	*				121.5	107.9	126.2	0	0	0	0	0	120.5
171	A	34.2	Very low	34.9	Very low	103 Å²	103	133 Å²	133	85%	0.851	80%	0.795	S	S	*	*				82.4	159.4	126.7	0	0	0	0	0	123.2
172	A	35.5	Very low	34.8	Very low	97 Å²	97	136 Å²	136	80%	0.802	80%	0.799	S	S	*	*			trans	82.7	77	161.4	0	0	0	0	0	121.1
173	A	33.6	Very low	34.8	Very low	111 Å²	111	133.1 Å²	133.1	92%	0.917	80%	0.797	S	S	*	*				47.2	124.5	126.6	0	0	0	0	0	122.6
174	G	35.2	Very low	34.9	Very low	83 Å²	83	133.2 Å²	133.2	86%	0.856	80%	0.796	S	S	*	*			trans	175.3	99.9	163	0	0	0	0	0	115.1
175	Q	38.1	Very low	34.8	Very low	183 Å²	183	138.7 Å²	138.7	86%	0.855	81%	0.805	S	S	*	*			trans	-139.7	157.4	166.2	-110.1	-163.7	13.2	0	0	107.4
176	P	42.6	Very low	35	Very low	112 Å²	112	139.9 Å²	139.9	73%	0.727	81%	0.807	S	S	*	*				-151	-147.8	57.4	46.7	-25.6	0	0	0	111.6
177	P	42	Very low	35	Very low	104 Å²	104	140.7 Å²	140.7	68%	0.675	81%	0.811	S	S	*	*			cis	-124.2	166.3	-22.4	36.5	-20.5	0	0	0	114.6
178	S	32.3	Very low	35.2	Very low	108 Å²	108	139.2 Å²	139.2	76%	0.755	81%	0.814	S	S	*	*			trans	-90.4	151	169.8	-51.2	0	0	0	0	112.3
179	F	35.6	Very low	35.3	Very low	206 Å²	206	135.8 Å²	135.8	90%	0.904	81%	0.81	S	S	*	*			trans	-122.8	124.6	155.5	-88.3	-80.4	0	0	0	110.3
180	N	30.8	Very low	35.3	Very low	140 Å²	140	138.4 Å²	138.4	75%	0.749	81%	0.812	S	S	*	*			trans	-150.5	140.4	168.6	-169.8	-16.6	0	0	0	106.3
181	L	38.3	Very low	35.4	Very low	159 Å²	159	140.4 Å²	140.4	83%	0.832	81%	0.814	S	S	*	*			trans	-135.8	115.7	-177.1	-145.8	79.9	0	0	0	111.4	G183	L181-G183 PolarHBondContact O-N 3.49Å
182	Q	33.5	Very low	35.6	Very low	171 Å²	171	141 Å²	141	80%	0.799	81%	0.812	S	S	*	*			trans	-56.5	117.5	176.1	-88.6	75.3	-7.7	0	0	112.4
183	G	30.9	Very low	35.8	Very low	74 Å²	74	145.4 Å²	145.4	76%	0.763	81%	0.808	S	S	*	*				63.6	138.7	98.1	0	0	0	0	0	120	L181	L181-G183 PolarHBondContact O-N 3.49Å
184	R	34.5	Very low	36	Very low	241 Å²	241	145.9 Å²	145.9	91%	0.909	80%	0.802	S	S	*	*			trans	-147.7	140.2	150.3	-138.3	180	-169.5	-141.1	1.2	111.2
185	M	29.5	Very low	36.1	Very low	186 Å²	186	148.2 Å²	148.2	92%	0.916	79%	0.79	S	S	*	*			trans	-92.1	138.7	172.9	-52.8	172.4	-167.8	0	0	109.7
186	V	37.5	Very low	36.4	Very low	136 Å²	136	147 Å²	147	82%	0.824	79%	0.787	S	S	*	*			trans	-141.6	146.2	161.2	-176.2	0	0	0	0	108.5
187	Q	34.5	Very low	36.1	Very low	181 Å²	181	147.9 Å²	147.9	85%	0.846	79%	0.792	S	S	*	*			trans	-83.6	164.8	-174.3	-94.4	-174.3	-11	0	0	114.2
188	P	38.6	Very low	35.8	Very low	113 Å²	113	147.6 Å²	147.6	73%	0.734	80%	0.799	S	S	*	*			trans	-85.8	156.6	-174	35.2	-36.7	0	0	0	113.7
189	N	36.2	Very low	36.1	Very low	140 Å²	140	147.1 Å²	147.1	75%	0.749	80%	0.802	S	S	*	*			trans	-158.4	134.6	148.4	-123.3	-5.8	0	0	0	115
190	M	32	Very low	36	Very low	163 Å²	163	146.8 Å²	146.8	80%	0.803	80%	0.796	S	S	*	*			trans	15.9	136.3	145.9	-56.1	171.6	-168.1	0	0	121.7
191	V	37.9	Very low	36.1	Very low	137 Å²	137	146.6 Å²	146.6	83%	0.83	79%	0.792	S	S	*	*				-149.5	134.7	121.7	161.5	0	0	0	0	110.5
192	S	39.1	Very low	35.7	Very low	116 Å²	116	143.3 Å²	143.3	81%	0.811	78%	0.782	S	S	*	*			trans	57.7	116	160.3	-63	0	0	0	0	124.1
193	R	38.6	Very low	35.7	Very low	189 Å²	189	141.8 Å²	141.8	71%	0.713	78%	0.78	S	S	*	*			trans	-81.7	-172.5	153	-129.9	-173.3	177	170.5	5.3	109.5
194	P	38.9	Very low	35.8	Very low	122 Å²	122	144.5 Å²	144.5	79%	0.792	78%	0.781	S	S	*	*			cis	-139.3	-171.5	36.6	39.5	-18.6	0	0	0	115.4
195	Q	37.2	Very low	35.6	Very low	131 Å²	131	142.6 Å²	142.6	61%	0.612	77%	0.774	S	S	*	*				-166.7	138.4	-52.3	173.9	162.8	-31.7	0	0	108.9
196	M	43.4	Very low	35.9	Very low	157 Å²	157	139.8 Å²	139.8	77%	0.773	76%	0.759	S	S	*	*			trans	-81.2	172.7	176.2	-51.8	-142.4	-64.4	0	0	112.9
197	P	38.1	Very low	35.8	Very low	131 Å²	131	141.1 Å²	141.1	85%	0.851	76%	0.756	S	S	*	*				-142.6	163.4	104.5	39.1	-27.1	0	0	0	115.3
198	A	33.7	Very low	35.7	Very low	98 Å²	98	136.6 Å²	136.6	81%	0.81	75%	0.749	S	S	*	*			trans	-120.3	144.9	164.9	0	0	0	0	0	110
199	A	39.5	Very low	35.5	Very low	99 Å²	99	136.8 Å²	136.8	82%	0.818	75%	0.748	S	S	*	*			trans	-148.8	119.5	177.4	0	0	0	0	0	106.7
200	Y	33.9	Very low	35.5	Very low	198 Å²	198	137.8 Å²	137.8	78%	0.776	75%	0.753	S	S	*	*				96	107.5	73.6	176.5	-92	0	0	0	112.3
201	M	32.3	Very low	35.6	Very low	136 Å²	136	134.6 Å²	134.6	67%	0.67	75%	0.753	S	S	*	*			trans	54.4	116.3	153.2	-69.8	-159.7	-177	0	0	123
202	S	30.6	Very low	35.5	Very low	90 Å²	90	132.1 Å²	132.1	63%	0.629	75%	0.747	S	S	*	*				88.6	146.8	116.9	77.6	0	0	0	0	121.5
203	N	33.5	Very low	35.4	Very low	140 Å²	140	133.7 Å²	133.7	75%	0.749	75%	0.751	S	S	*	*			trans	68.3	111.1	160.6	-53.4	-38.5	0	0	0	116.4
204	V	31.5	Very low	35.2	Very low	130 Å²	130	127.5 Å²	127.5	79%	0.788	75%	0.746	S	S	*	*				89.9	117.5	55.4	166.6	0	0	0	0	113
205	R	32.1	Very low	35.1	Very low	201 Å²	201	131.5 Å²	131.5	76%	0.758	75%	0.754	S	S	*	*			trans	98.1	112.9	145.9	-166	173.2	-176.1	142	9	121.3
206	Q	34.9	Very low	34.9	Very low	128 Å²	128	128.6 Å²	128.6	60%	0.598	76%	0.759	S	S	*	*			trans	63.9	158.7	144.4	-68.3	177.8	-44.8	0	0	118.5
207	Q	35	Very low	34.5	Very low	164 Å²	164	130.1 Å²	130.1	77%	0.766	77%	0.765	S	S	*	*			cis	-154	-175.9	-14.8	-122.3	161.4	-34.7	0	0	110.8
208	A	32.8	Very low	34.2	Very low	85 Å²	85	129.4 Å²	129.4	70%	0.702	76%	0.763	S	S	*	*			trans	-56	172.1	177.9	0	0	0	0	0	114.9
209	T	35.4	Very low	34.3	Very low	117 Å²	117	130 Å²	130	72%	0.718	77%	0.768	S	S	*	*				-167.3	146.3	52.1	49	0	0	0	0	116.7
210	L	34.4	Very low	33.8	Very low	161 Å²	161	130.7 Å²	130.7	84%	0.843	77%	0.766	S	S	*	*			trans	57.3	137	133.3	-63.6	168.2	0	0	0	124.8
211	A	35.1	Very low	33.8	Very low	96 Å²	96	129.1 Å²	129.1	79%	0.793	77%	0.768	S	S	*	*			trans	73.1	149.5	136.2	0	0	0	0	0	121.5
212	A	35.7	Very low	33.8	Very low	86 Å²	86	128.1 Å²	128.1	71%	0.711	78%	0.775	S	S	*	*			cis	-171.8	177.1	-17.9	0	0	0	0	0	111.4
213	V	36.6	Very low	33.9	Very low	148 Å²	148	132.8 Å²	132.8	90%	0.897	78%	0.778	S	S	*	*			trans	73.5	142.3	166.5	-165.9	0	0	0	0	115.9
214	G	33.8	Very low	34	Very low	59 Å²	59	135.8 Å²	135.8	61%	0.608	78%	0.781	S	S	*	*			cis	153.5	161.2	-8.3	0	0	0	0	0	113.4
215	Q	38.3	Very low	34	Very low	207 Å²	207	133.7 Å²	133.7	97%	0.967	78%	0.777	S	S	*	*			trans	71	150.6	-176.8	-48.8	179.7	0.9	0	0	115.8
216	G	31.5	Very low	34.1	Very low	70 Å²	70	128.9 Å²	128.9	72%	0.722	78%	0.78	S	S	*	*			cis	165.8	160	-10.4	0	0	0	0	0	114.5
217	Q	36.8	Very low	34.1	Very low	189 Å²	189	130 Å²	130	88%	0.883	80%	0.795	S	S	*	*			trans	75	95.4	162.3	-56.6	-174.2	10.6	0	0	121.6
218	S	30.9	Very low	34.3	Very low	116 Å²	116	126.4 Å²	126.4	81%	0.811	79%	0.794	S	S	*	*				12.4	132.9	125.9	58.3	0	0	0	0	122.4
219	A	36.6	Very low	34.4	Very low	111 Å²	111	131 Å²	131	92%	0.917	80%	0.801	S	S	*	*			trans	-157	159.2	139.4	0	0	0	0	0	111.2
220	S	29	Very low	34.5	Very low	112 Å²	112	130.3 Å²	130.3	78%	0.783	80%	0.801	S	S	*	*			trans	-120.4	147.8	-177.1	58.5	0	0	0	0	113.2
221	M	34	Very low	34.6	Very low	165 Å²	165	131.2 Å²	131.2	81%	0.813	80%	0.801	S	S	*	*			trans	173.9	140.4	132.3	-98.2	-160.1	-179.6	0	0	112.5
222	S	31.2	Very low	34.5	Very low	116 Å²	116	135.3 Å²	135.3	81%	0.811	80%	0.801	S	S	*	*			trans	-86.5	140.9	167.2	-42.4	0	0	0	0	110.9
223	R	33.6	Very low	34.4	Very low	187 Å²	187	137.3 Å²	137.3	71%	0.706	80%	0.804	S	S	*	*			trans	-170.2	128.6	162.7	-108.8	169.2	-141.4	-129.1	3.5	113
224	Y	34	Very low	34.1	Very low	204 Å²	204	134 Å²	134	80%	0.8	80%	0.8	S	S	*	*			trans	56.7	160.3	160.3	-52.8	-59.2	0	0	0	119.7
225	A	32.9	Very low	34.1	Very low	86 Å²	86	135.2 Å²	135.2	71%	0.711	81%	0.813	S	S	*	*			cis	159.2	133.5	-44.4	0	0	0	0	0	110.3
226	A	33.1	Very low	33.8	Very low	100 Å²	100	135.7 Å²	135.7	83%	0.826	81%	0.805	S	S	*	*			trans	62.2	107.1	151.6	0	0	0	0	0	122
227	V	35.6	Very low	33.9	Very low	150 Å²	150	139 Å²	139	91%	0.909	80%	0.802	S	S	*	*			trans	-151.6	136.1	151.9	177.4	0	0	0	0	106.1
228	A	38.5	Very low	33.7	Very low	90 Å²	90	137.8 Å²	137.8	74%	0.744	80%	0.796	S	S	*	*			cis	-130.5	-144.7	-6.4	0	0	0	0	0	110.5
229	Q	35.2	Very low	33.8	Very low	182 Å²	182	138.5 Å²	138.5	85%	0.85	80%	0.796	S	S	*	*			trans	-153.9	172.5	-171.4	-73.4	-173.4	-29.6	0	0	115.4
230	S	36.9	Very low	33.5	Very low	101 Å²	101	136.4 Å²	136.4	71%	0.706	78%	0.779	S	S	*	*			trans	77.8	155.7	162.9	82.6	0	0	0	0	116.7
231	Q	38	Very low	33.6	Very low	181 Å²	181	139.6 Å²	139.6	85%	0.846	78%	0.781	S	S	*	*			cis	-118.9	154.2	1.7	-69.3	177.8	28.4	0	0	110.1
232	F	32.1	Very low	33.6	Very low	182 Å²	182	140.5 Å²	140.5	80%	0.798	79%	0.785	S	S	*	*			cis	97.2	110.4	35.8	-98.5	-109	0	0	0	116.3
233	V	34.4	Very low	33.9	Very low	127 Å²	127	141.6 Å²	141.6	77%	0.77	79%	0.787	S	S	*	*			trans	68.8	104.8	147.6	-178.3	0	0	0	0	120.6
234	G	30	Very low	33.7	Very low	80 Å²	80	136.3 Å²	136.3	83%	0.825	78%	0.783	S	S	*	*				72.6	128	96.6	0	0	0	0	0	121.2
235	G	33.2	Very low	33.7	Very low	84 Å²	84	133.5 Å²	133.5	87%	0.866	78%	0.782	S	S	*	*			trans	-163.6	146.5	167.4	0	0	0	0	0	111.9
236	R	32	Very low	33.9	Very low	216 Å²	216	137.6 Å²	137.6	82%	0.815	79%	0.786	S	S	*	*			trans	-144	151.5	-171.4	-166.3	-163.5	-175.5	-164.5	6	109.9
237	Q	34.6	Very low	33.9	Very low	140 Å²	140	140.3 Å²	140.3	65%	0.654	78%	0.782	S	S	*	*			trans	65.7	160.7	176.9	-68.2	150.9	-67.6	0	0	112.9
238	Q	32.9	Very low	33.6	Very low	163 Å²	163	137.7 Å²	137.7	76%	0.762	77%	0.77	S	S	*	*			cis	-155.4	-177.2	-10.7	-117.2	165.9	-48.5	0	0	107
239	V	31.8	Very low	33.6	Very low	132 Å²	132	138.8 Å²	138.8	80%	0.8	77%	0.773	S	S	*	*			cis	-129.9	-101.5	13.6	63.9	0	0	0	0	113.8
240	A	30.9	Very low	33.4	Very low	67 Å²	67	138.1 Å²	138.1	55%	0.554	77%	0.769	S	S	*	*			trans	-162.6	166.6	-170.2	0	0	0	0	0	114
241	Q	29.8	Very low	33.3	Very low	178 Å²	178	143.6 Å²	143.6	83%	0.832	78%	0.776	S	S	*	*			trans	57	120.9	147.7	-72.1	164.2	-45.1	0	0	122.2
242	M	34.7	Very low	33.1	Very low	184 Å²	184	139.4 Å²	139.4	91%	0.906	77%	0.772	S	S	*	*			trans	172.4	146.4	133.2	-97.4	176.5	-70.1	0	0	108.7
243	V	36.9	Very low	33.2	Very low	140 Å²	140	134.3 Å²	134.3	85%	0.848	77%	0.771	S	S	*	*			cis	-153	169.3	-15.9	103.2	0	0	0	0	108.7
244	A	30.7	Very low	33.7	Very low	76 Å²	76	133.7 Å²	133.7	63%	0.628	77%	0.77	S	S	*	*			trans	-97.6	-178.9	-172.3	0	0	0	0	0	115.7
245	N	32.5	Very low	33.9	Very low	145 Å²	145	138.6 Å²	138.6	78%	0.775	77%	0.774	S	S	*	*			trans	79.9	144	-179.3	-48	-38.3	0	0	0	113.9
246	Q	37.3	Very low	34	Very low	171 Å²	171	139.9 Å²	139.9	80%	0.799	77%	0.77	S	S	*	*			cis	-138.1	144.1	23.5	-72.5	176.9	35.2	0	0	110
247	Q	34.4	Very low	34.6	Very low	158 Å²	158	134.6 Å²	134.6	74%	0.738	76%	0.763	S	S	*	*				58.7	143.7	75.1	-59.3	177	1.8	0	0	115.4
248	S	29.7	Very low	34.8	Very low	94 Å²	94	133.9 Å²	133.9	66%	0.657	77%	0.768	S	S	*	*			cis	-179.3	140.9	-26.6	51.7	0	0	0	0	111.5
249	S	36.5	Very low	34.9	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	77%	0.768	S	S	*	*			trans	-169.7	125.3	158.4	-75.9	0	0	0	0	107.4
250	Q	30.9	Very low	35.1	Very low	167 Å²	167	129 Å²	129	78%	0.78	76%	0.763	S	S	*	*				61.3	128.6	58.1	-57.1	-168.6	14.2	0	0	111.7
251	Y	35.1	Very low	35.5	Very low	216 Å²	216	133.9 Å²	133.9	85%	0.847	78%	0.776	S	S	*	*			cis	-117.2	152.7	24.2	-78.1	-116.1	0	0	0	111.6
252	A	35.1	Very low	36.3	Very low	93 Å²	93	132 Å²	132	77%	0.769	78%	0.778	S	S	*	*			cis	90.3	131.8	43.3	0	0	0	0	0	114.5
253	G	33.7	Very low	36.7	Very low	75 Å²	75	128.5 Å²	128.5	77%	0.773	77%	0.768	S	S	*	*			trans	-93.6	-132.5	-173.9	0	0	0	0	0	114.3
254	P	43.9	Very low	36.7	Very low	115 Å²	115	130 Å²	130	75%	0.747	77%	0.772	S	S	*	*			cis	-150.6	-163.4	15	46.2	-25.1	0	0	0	117.2
255	M	36.1	Very low	37.1	Very low	183 Å²	183	129.2 Å²	129.2	90%	0.901	77%	0.771	S	S	*	*			trans	82.3	114	150.8	-73.9	173.7	-172.9	0	0	123
256	S	33.7	Very low	37.7	Very low	111 Å²	111	129.2 Å²	129.2	78%	0.776	78%	0.776	S	S	*	*			trans	-83.2	-165.5	155.4	-146.4	0	0	0	0	109.5
257	P	45.1	Very low	37.8	Very low	105 Å²	105	126.8 Å²	126.8	68%	0.682	78%	0.776	S	S	*	*			cis	-145.1	-156.1	0	34.3	-7.7	0	0	0	115.5
258	V	38.3	Very low	37.9	Very low	124 Å²	124	128.1 Å²	128.1	75%	0.752	78%	0.784	S	S	*	*			trans	97.4	115.2	144.7	159.8	0	0	0	0	121.6
259	V	36.7	Very low	38.2	Very low	126 Å²	126	129.6 Å²	129.6	76%	0.764	79%	0.789	S	S	*	*			trans	32.6	137.5	136.3	-165.2	0	0	0	0	120.2
260	G	35.3	Very low	38.2	Very low	68 Å²	68	131.4 Å²	131.4	70%	0.701	78%	0.784	S	S	*	*			cis	153	-167	-1.9	0	0	0	0	0	113.7
261	M	39.4	Very low	38.3	Very low	168 Å²	168	130.2 Å²	130.2	83%	0.828	78%	0.779	S	S	*	*			trans	71.7	96.9	165	-64.3	-173	168.3	0	0	122.1
262	T	46.9	Very low	38.3	Very low	140 Å²	140	126.7 Å²	126.7	86%	0.859	77%	0.77	S	S	*	*			trans	73.4	153.4	131.1	54.3	0	0	0	0	122.9
263	P	42.1	Very low	38.4	Very low	110 Å²	110	130.1 Å²	130.1	71%	0.714	77%	0.77	S	S	*	*			trans	-123.3	165.4	-166.8	43	-29.6	0	0	0	116.4
264	N	37.9	Very low	38.7	Very low	171 Å²	171	131.6 Å²	131.6	91%	0.914	77%	0.766	S	S	*	*			trans	177.2	157.9	137.8	-100.4	-27.4	0	0	0	113.4
265	G	37.8	Very low	38.3	Very low	60 Å²	60	132.9 Å²	132.9	62%	0.619	77%	0.765	S	S	*	*			trans	109.8	78.6	140.9	0	0	0	0	0	121.7
266	T	45.2	Very low	38.1	Very low	144 Å²	144	131.1 Å²	131.1	88%	0.883	76%	0.759	S	S	*	*			trans	59.7	146.4	138	52.6	0	0	0	0	123.2
267	P	39.3	Very low	38.4	Very low	121 Å²	121	131.9 Å²	131.9	79%	0.786	76%	0.762	S	S	*	*			trans	-103.9	165.2	178.9	40.6	-35.5	0	0	0	115.3
268	M	37.8	Very low	37.9	Very low	185 Å²	185	131.5 Å²	131.5	91%	0.911	77%	0.768	S	S	*	*			trans	-151.5	171.1	163.3	-86.1	-132.1	75.4	0	0	113
269	V	35.2	Very low	37.8	Very low	125 Å²	125	130.7 Å²	130.7	76%	0.758	77%	0.774	S	S	*	*			trans	-131.3	130.8	-161.1	174.5	0	0	0	0	113.5
270	H	36.3	Very low	37.8	Very low	153 Å²	153	129.1 Å²	129.1	71%	0.708	77%	0.774	S	S	*	*			trans	-173.4	169.3	155.2	-116.3	55	0	0	0	112.3
271	Q	33.2	Very low	38	Very low	142 Å²	142	131.2 Å²	131.2	66%	0.664	78%	0.775	S	S	*	*				-169.3	-178.6	-55.3	-152.4	-166.2	48.1	0	0	108.6
272	Q	36	Very low	38	Very low	141 Å²	141	131 Å²	131	66%	0.659	78%	0.776	S	S	*	*			trans	77	124.2	165.1	-63.7	139.2	35.5	0	0	115.6
273	Q	36	Very low	37.6	Very low	165 Å²	165	128.4 Å²	128.4	77%	0.771	77%	0.769	S	S	*	*			cis	68.9	137.7	23.4	-67.6	-72.3	-16.7	0	0	114.1
274	P	39.7	Very low	37.6	Very low	106 Å²	106	128 Å²	128	69%	0.688	77%	0.767	S	S	*	*				-157.1	159.3	59.5	41.1	-19.1	0	0	0	122.1
275	I	35.6	Very low	37.6	Very low	143 Å²	143	130.5 Å²	130.5	73%	0.733	77%	0.765	S	S	*	*			trans	73	113.8	133.2	-68	168.2	0	0	0	123.3
276	D	32.2	Very low	37.8	Very low	145 Å²	145	134 Å²	134	78%	0.775	78%	0.777	S	S	*	*				26.3	164.2	116.2	-78.3	-56.7	0	0	0	123.4
277	P	40.4	Very low	37.4	Very low	127 Å²	127	130.4 Å²	130.4	83%	0.825	77%	0.768	S	S	*	*			cis	-144.8	-170.9	29.1	44	-22.6	0	0	0	119.3
278	A	34.6	Very low	37.4	Very low	98 Å²	98	129.5 Å²	129.5	81%	0.81	77%	0.765	S	S	*	*			trans	-99.9	169.1	-166.4	0	0	0	0	0	118.2
279	A	37.3	Very low	37.3	Very low	106 Å²	106	126.6 Å²	126.6	88%	0.876	76%	0.758	S	S	*	*			trans	-165	159.6	150	0	0	0	0	0	113.3
280	A	35.1	Very low	37.8	Very low	94 Å²	94	126.7 Å²	126.7	78%	0.777	76%	0.759	S	S	*	*			trans	-109.8	-171.7	173.5	0	0	0	0	0	110.4
281	P	41	Very low	37.9	Very low	111 Å²	111	125 Å²	125	72%	0.721	76%	0.761	S	S	*	*			cis	-154.5	177.5	33	45.5	-22.9	0	0	0	120.7
282	L	37.6	Very low	38.1	Very low	163 Å²	163	124 Å²	124	85%	0.853	77%	0.77	S	S	*	*			trans	61.7	117.5	143.1	-73.6	162.4	0	0	0	125.9
283	A	40.2	Very low	38.2	Very low	86 Å²	86	122 Å²	122	71%	0.711	78%	0.777	S	S	*	*				76.9	170.7	123.3	0	0	0	0	0	122.1
284	P	41.8	Very low	38.4	Very low	103 Å²	103	119.5 Å²	119.5	67%	0.669	78%	0.775	S	S	*	*				-144.7	163.9	-62.7	43.5	-27.9	0	0	0	118.6
285	Y	37.6	Very low	37.9	Very low	223 Å²	223	123.2 Å²	123.2	88%	0.875	79%	0.786	S	S	*	*			trans	59.3	170.6	159.6	-64.8	-60.6	0	0	0	119.6
286	P	41.3	Very low	38	Very low	133 Å²	133	126 Å²	126	86%	0.864	80%	0.798	S	S	*	*			cis	-117.1	-154.4	-11.1	44.1	-29	0	0	0	111.3
287	G	36.4	Very low	38	Very low	68 Å²	68	126.7 Å²	126.7	70%	0.701	80%	0.802	S	S	*	*			cis	164.1	164.3	-11.2	0	0	0	0	0	113.9
288	S	40	Very low	37.6	Very low	103 Å²	103	123.7 Å²	123.7	72%	0.72	79%	0.794	S	S	*	*			trans	70.1	130.2	175.2	-150.6	0	0	0	0	116.9
289	T	35.9	Very low	37.9	Very low	123 Å²	123	124.2 Å²	124.2	76%	0.755	79%	0.789	S	S	*	*			cis	69.9	144.7	35.2	77.1	0	0	0	0	113.7
290	V	44.6	Very low	37.6	Very low	128 Å²	128	129.3 Å²	129.3	78%	0.776	79%	0.787	S	S	*	*			cis	-146.8	-154.9	43.2	-141.4	0	0	0	0	113.9
291	P	40.3	Very low	37.6	Very low	117 Å²	117	130.8 Å²	130.8	76%	0.76	78%	0.778	S	S	*	*				-128.1	-170.3	-128.9	47.2	-28	0	0	0	118
292	S	35.6	Very low	37	Very low	121 Å²	121	133.2 Å²	133.2	85%	0.846	78%	0.777	S	S	*	*			trans	-72.9	158	170.4	-44.1	0	0	0	0	114.6
293	A	39.2	Very low	36.9	Very low	99 Å²	99	136.9 Å²	136.9	82%	0.818	78%	0.781	S	S	*	*			trans	-141.5	162.7	175.4	0	0	0	0	0	112.4
294	P	39.7	Very low	36.5	Very low	112 Å²	112	140.9 Å²	140.9	73%	0.727	79%	0.785	S	S	*	*			trans	-121.8	165.4	-152.6	42.3	-31.4	0	0	0	117.9
295	M	30.4	Very low	36.1	Very low	185 Å²	185	142.2 Å²	142.2	91%	0.911	79%	0.792	S	S	*	*			trans	34.2	119.1	141.9	-57.1	170.4	94.3	0	0	120.8
296	M	37.3	Very low	36.1	Very low	201 Å²	201	135.9 Å²	135.9	99%	0.99	78%	0.78	S	S	*	*			trans	-148.2	164.3	146.7	-159.3	162.1	-178.2	0	0	111.2
297	N	31.5	Very low	35.9	Very low	160 Å²	160	137.8 Å²	137.8	86%	0.856	78%	0.777	S	S	*	*			trans	-144.8	144.4	-159.5	-168.8	9.3	0	0	0	114.2
298	G	32.4	Very low	36	Very low	63 Å²	63	143 Å²	143	65%	0.649	79%	0.785	S	S	*	*			trans	78.9	-174.4	170.8	0	0	0	0	0	117.1
299	P	41.6	Very low	35.7	Very low	110 Å²	110	142.2 Å²	142.2	71%	0.714	79%	0.785	S	S	*	*			cis	-144.1	157.6	-31.7	37.1	-19.6	0	0	0	116.4
300	Y	30.8	Very low	35.8	Very low	212 Å²	212	147.4 Å²	147.4	83%	0.831	79%	0.791	S	S	*	*			trans	69.4	160.8	150	-76.5	-152.2	0	0	0	118
301	Q	34.3	Very low	35.5	Very low	125 Å²	125	148.8 Å²	148.8	58%	0.584	79%	0.794	S	S	*	*			cis	-156.6	163.8	-15	-100.8	-89.5	-36.7	0	0	111
302	K	29.1	Very low	35.2	Very low	162 Å²	162	147.5 Å²	147.5	70%	0.704	79%	0.793	S	S	*	*			trans	-1.1	148.2	163.7	-66.7	169.1	-171.8	169.3	0	122.6
303	Y	34.6	Very low	35.3	Very low	240 Å²	240	147.7 Å²	147.7	94%	0.941	79%	0.792	S	S	*	*				-139.2	165.8	121.8	-107.4	-84.2	0	0	0	111
304	Q	31.4	Very low	35	Very low	170 Å²	170	148.1 Å²	148.1	79%	0.794	78%	0.784	S	S	*	*			trans	-152.9	176.2	-170.4	-162.5	177.7	7.7	0	0	110.6
305	T	34.9	Very low	34.8	Very low	132 Å²	132	153.8 Å²	153.8	81%	0.81	79%	0.792	S	S	*	*			trans	94.3	142.3	172.9	-130.2	0	0	0	0	115
306	S	37.2	Very low	34.9	Very low	89 Å²	89	154.9 Å²	154.9	62%	0.622	79%	0.788	S	S	*	*			cis	-171.8	142.5	-14.5	35.1	0	0	0	0	116
307	Q	37.3	Very low	34.7	Very low	174 Å²	174	149.6 Å²	149.6	81%	0.813	78%	0.776	S	S	*	*			trans	79.2	157.9	132.4	-72.9	-71.8	2.5	0	0	124.4
308	M	37.6	Very low	34.7	Very low	176 Å²	176	147.5 Å²	147.5	87%	0.867	77%	0.774	S	S	*	*			trans	80.3	142.9	169.3	-50.4	-166.2	-171.7	0	0	119.3
309	A	35.2	Very low	34.6	Very low	87 Å²	87	148.4 Å²	148.4	72%	0.719	78%	0.783	S	S	*	*			cis	-177.1	133.7	-40.7	0	0	0	0	0	111.5
310	R	37	Very low	34.2	Very low	232 Å²	232	147 Å²	147	88%	0.875	79%	0.789	S	S	*	*			trans	162.3	120.2	131.7	-90.7	171.7	178.2	-171.1	-0.7	114.3
311	N	37.5	Very low	34.2	Very low	157 Å²	157	146.2 Å²	146.2	84%	0.84	79%	0.793	S	S	*	*			trans	31	151.2	135.7	-51.4	9.5	0	0	0	121.5
312	A	34.2	Very low	34.1	Very low	90 Å²	90	147 Å²	147	74%	0.744	81%	0.806	S	S	*	*			cis	173.6	172.1	-16.5	0	0	0	0	0	107.2
313	P	38.3	Very low	34.1	Very low	126 Å²	126	143.9 Å²	143.9	82%	0.818	81%	0.81	S	S	*	*			cis	-120.4	-169.9	-5.5	42	-27.3	0	0	0	113.5
314	V	32.5	Very low	33.9	Very low	108 Å²	108	141 Å²	141	66%	0.655	81%	0.808	S	S	*	*			trans	-132	153.4	-173.4	168.2	0	0	0	0	111	Y316	V314-Y316 HydrophobicContact CG1-CD2 4.37Å; V314-Y316 HydrophobicContact CG1-CE2 4.47Å
315	Y	34.8	Very low	33.8	Very low	230 Å²	230	137.9 Å²	137.9	90%	0.902	81%	0.811	S	S	*	*			trans	-124.7	148.7	148	-99.2	-85.3	0	0	0	111
316	Y	32.5	Very low	33.7	Very low	209 Å²	209	135.2 Å²	135.2	82%	0.82	81%	0.81	S	S	*	*			trans	-82.7	169.1	-167	-75	-104.4	0	0	0	112.2	V314	V314-Y316 HydrophobicContact CG1-CD2 4.37Å; V314-Y316 HydrophobicContact CG1-CE2 4.47Å
317	A	34.4	Very low	33.4	Very low	90 Å²	90	141.2 Å²	141.2	74%	0.744	82%	0.824	S	S	*	*			cis	-148	166	21.1	0	0	0	0	0	115.5
318	S	30.9	Very low	33.2	Very low	116 Å²	116	136.8 Å²	136.8	81%	0.811	83%	0.825	S	S	*	*			trans	-64.8	163.6	163.7	48.9	0	0	0	0	113
319	G	30.6	Very low	33.1	Very low	81 Å²	81	136.6 Å²	136.6	84%	0.835	83%	0.827	S	S	*	*			cis	132.3	149	3	0	0	0	0	0	112
320	G	33.4	Very low	32.9	Very low	81 Å²	81	137.6 Å²	137.6	84%	0.835	83%	0.828	S	S	*	*			trans	-174.9	129.8	178.4	0	0	0	0	0	112.4
321	Q	29.9	Very low	32.7	Very low	196 Å²	196	133.2 Å²	133.2	92%	0.916	82%	0.822	S	S	*	*			trans	-101.7	139.7	179.6	-67.6	179.7	-16.5	0	0	111.2
322	V	33.3	Very low	32.6	Very low	141 Å²	141	132.5 Å²	132.5	86%	0.855	82%	0.818	S	S	*	*			trans	-140.5	129.4	146.2	-166.4	0	0	0	0	107.8
323	A	28.2	Very low	32.4	Very low	97 Å²	97	139.2 Å²	139.2	80%	0.802	83%	0.825	S	S	*	*			trans	-102	132	168.8	0	0	0	0	0	109.2
324	M	31.4	Very low	32.2	Very low	180 Å²	180	142 Å²	142	89%	0.887	83%	0.83	S	S	*	*			trans	-144.4	132.6	169.8	-97.4	-63	-171.7	0	0	110.2
325	A	28.5	Very low	32.2	Very low	104 Å²	104	143.7 Å²	143.7	86%	0.86	84%	0.835	S	S	*	*			trans	-85.5	128.7	167.2	0	0	0	0	0	108.9
326	G	32.6	Very low	32	Very low	76 Å²	76	137.1 Å²	137.1	78%	0.784	83%	0.828	S	S	*	*			trans	-143.1	121.5	-179.2	0	0	0	0	0	111.7	G328	G326-G328 PolarHBondContact O-N 3.3Å
327	K	31.9	Very low	32	Very low	214 Å²	214	133.1 Å²	133.1	93%	0.93	83%	0.826	S	S	*	*			trans	-77.5	109.9	170.4	-67.7	179.7	177.4	-178.8	0	108.6
328	G	31.6	Very low	32	Very low	81 Å²	81	139.6 Å²	139.6	84%	0.835	83%	0.833	S	S	*	*			trans	-92.5	104.6	175.5	0	0	0	0	0	111.9	G326	G326-G328 PolarHBondContact O-N 3.3Å
329	L	36	Very low	32	Very low	173 Å²	173	140.1 Å²	140.1	91%	0.906	84%	0.836	S	S	*	*			trans	-85.9	119.9	163.7	-77.1	154.5	0	0	0	108.2	N331	L329-N331 PolarHBondContact O-N 3.07Å
330	C	31.1	Very low	32	Very low	108 Å²	108	141.8 Å²	141.8	73%	0.73	83%	0.826	S	S	*	*			trans	-84.7	109.5	170.8	47.1	0	0	0	0	110
331	N	33.8	Very low	32	Very low	140 Å²	140	146.9 Å²	146.9	75%	0.749	83%	0.828	S	S	*	*			trans	-152.3	134.6	167.6	-149.6	2.7	0	0	0	109.3	L329	L329-N331 PolarHBondContact O-N 3.07Å
332	N	34	Very low	32.2	Very low	141 Å²	141	145.1 Å²	145.1	75%	0.754	82%	0.82	S	S	*	*			trans	55.5	113.1	-177.7	-59.8	-9.8	0	0	0	117.1
333	Y	30.2	Very low	32.1	Very low	231 Å²	231	143 Å²	143	91%	0.906	81%	0.811	S	S	*	*			trans	-138.2	111.8	139	-103.9	-78	0	0	0	109.9
334	M	35.5	Very low	32.6	Very low	186 Å²	186	145.4 Å²	145.4	92%	0.916	82%	0.815	S	S	*	*			trans	-122.4	152.1	154.5	-120.4	-165.9	-179.6	0	0	107.3
335	N	32.5	Very low	32.7	Very low	143 Å²	143	142.1 Å²	142.1	77%	0.765	81%	0.808	S	S	*	*			trans	64.5	97.3	176.9	-141.4	-4.2	0	0	0	115.6
336	A	29.7	Very low	32.9	Very low	91 Å²	91	142.5 Å²	142.5	75%	0.752	81%	0.81	S	S	*	*			trans	-107.6	123	161.9	0	0	0	0	0	108.4
337	T	33.6	Very low	32.9	Very low	126 Å²	126	142.1 Å²	142.1	77%	0.773	81%	0.807	S	S	*	*			trans	-118.5	133.5	172.3	-37.9	0	0	0	0	108.7
338	Y	32.6	Very low	32.9	Very low	226 Å²	226	142.9 Å²	142.9	89%	0.886	81%	0.805	S	S	*	*			trans	-72.4	133.4	-170.3	-78.5	-108.9	0	0	0	112.8
339	S	31.4	Very low	33	Very low	126 Å²	126	147.6 Å²	147.6	88%	0.881	81%	0.806	S	S	*	*			trans	-150.2	138	137.4	-168.5	0	0	0	0	110
340	N	31.5	Very low	32.9	Very low	116 Å²	116	147.8 Å²	147.8	62%	0.62	80%	0.804	S	S	*	*			trans	-125	132.7	-173.1	175.2	17.6	0	0	0	109
341	Q	33.1	Very low	33.2	Very low	188 Å²	188	147.3 Å²	147.3	88%	0.879	80%	0.8	S	S	*	*			trans	-171	165.1	137.8	-108.1	164.4	68.3	0	0	114.6
342	Q	33.8	Very low	33.3	Very low	160 Å²	160	149.1 Å²	149.1	75%	0.748	80%	0.804	S	S	*	*			trans	-86.6	151.1	-162	-120.9	83.8	4.9	0	0	116.2
343	S	31.7	Very low	33.4	Very low	96 Å²	96	146.3 Å²	146.3	67%	0.671	80%	0.795	S	S	*	*			trans	-34.4	144.7	159.9	54.8	0	0	0	0	119.6
344	V	38.4	Very low	33.6	Very low	147 Å²	147	145.5 Å²	145.5	89%	0.891	79%	0.79	S	S	*	*				-148	135.8	127.7	-158.8	0	0	0	0	109.7
345	P	32.5	Very low	33.5	Very low	112 Å²	112	144.8 Å²	144.8	73%	0.727	79%	0.785	S	S	*	*			trans	-116.1	153.4	-178.9	39	-31.1	0	0	0	117.1
346	A	33.1	Very low	33.6	Very low	111 Å²	111	142.2 Å²	142.2	92%	0.917	78%	0.784	S	S	*	*			trans	67.6	125.5	156.7	0	0	0	0	0	120.7
347	G	32.4	Very low	33.8	Very low	69 Å²	69	146.3 Å²	146.3	71%	0.711	79%	0.787	S	S	*	*			trans	-176.9	35.5	-179.2	0	0	0	0	0	121.5
348	Y	33.3	Very low	34	Very low	229 Å²	229	146.5 Å²	146.5	90%	0.898	79%	0.787	S	S	*	*			trans	66.5	156.8	160.8	-74.1	-85.7	0	0	0	122.7
349	Q	33.3	Very low	34.2	Very low	181 Å²	181	140.7 Å²	140.7	85%	0.846	78%	0.778	S	S	*	*			trans	75	88.3	155.3	-75.1	168.7	-5.8	0	0	122.9
350	M	33	Very low	34.4	Very low	177 Å²	177	142.1 Å²	142.1	87%	0.872	78%	0.775	S	S	*	*				-8.5	166.3	123	-73	-74.2	-156.5	0	0	119.7
351	P	37.2	Very low	34.6	Very low	97 Å²	97	143.9 Å²	143.9	63%	0.63	78%	0.78	S	S	*	*			cis	-140.5	-160.7	-18	33	-8.9	0	0	0	114.5
352	Q	36.7	Very low	34.8	Very low	178 Å²	178	141.5 Å²	141.5	83%	0.832	78%	0.778	S	S	*	*			trans	80	148.1	160.4	-68.6	-177.8	26.1	0	0	118.9
353	S	35.8	Very low	34.8	Very low	82 Å²	82	138.5 Å²	138.5	57%	0.573	77%	0.774	S	S	*	*			cis	-167	167.6	-15.6	60.7	0	0	0	0	113.8
354	R	34.6	Very low	35.2	Very low	214 Å²	214	139.5 Å²	139.5	81%	0.808	78%	0.781	S	S	*	*			trans	70.1	163.8	160	-62.5	165.2	-165.6	-95.7	4.2	118.5
355	Q	32.5	Very low	35.4	Very low	171 Å²	171	138 Å²	138	80%	0.799	78%	0.778	S	S	*	*			cis	172.5	121	-48.9	-109.4	-179.3	-44	0	0	110.7
356	A	36.4	Very low	35.6	Very low	90 Å²	90	139.6 Å²	139.6	74%	0.744	78%	0.78	S	S	*	*			trans	-173.1	129.9	153.7	0	0	0	0	0	108.4
357	H	33	Very low	36.1	Very low	176 Å²	176	140.1 Å²	140.1	82%	0.815	77%	0.774	S	S	*	*				68.2	133.1	63.6	-82.9	-74.3	0	0	0	113.4
358	V	37	Very low	36.6	Very low	130 Å²	130	141.7 Å²	141.7	79%	0.788	77%	0.772	S	S	*	*			cis	-146.1	158.5	23.1	-179.1	0	0	0	0	111.6
359	P	37.1	Very low	36.8	Very low	105 Å²	105	140.6 Å²	140.6	68%	0.682	77%	0.767	S	S	*	*			trans	-116.5	172.5	-178.8	42.4	-33.2	0	0	0	117.1
360	N	36.6	Very low	37.2	Very low	156 Å²	156	138.6 Å²	138.6	83%	0.834	76%	0.76	S	S	*	*			trans	-160.2	141.5	153.3	-103.7	-12.9	0	0	0	108.5
361	Q	35.1	Very low	37.4	Very low	153 Å²	153	134.4 Å²	134.4	72%	0.715	75%	0.754	S	S	*	*			cis	91.3	108.9	30.5	-78.5	-74.6	0	0	0	116.1
362	V	37.3	Very low	37.4	Very low	137 Å²	137	134.2 Å²	134.2	83%	0.83	76%	0.76	S	S	*	*			trans	-149.2	174.5	165.3	-163.5	0	0	0	0	106.3
363	S	34.5	Very low	37.6	Very low	97 Å²	97	130.7 Å²	130.7	68%	0.678	75%	0.753	S	S	*	*			trans	-153.8	-176.8	-172	-74.1	0	0	0	0	114.7
364	S	40.3	Very low	37.6	Very low	117 Å²	117	136 Å²	136	82%	0.818	76%	0.762	S	S	*	*			trans	93	140.3	179.7	77.2	0	0	0	0	116.1
365	S	41.3	Very low	37.5	Very low	117 Å²	117	134.6 Å²	134.6	82%	0.818	76%	0.764	S	S	*	*			cis	-153.9	158.8	-8.1	36.2	0	0	0	0	114.2
366	N	37.3	Very low	37.5	Very low	144 Å²	144	130.5 Å²	130.5	77%	0.77	77%	0.768	S	S	*	*			trans	-73.6	175.6	-177.9	-111.1	0.4	0	0	0	113.8
367	P	43.7	Very low	37.5	Very low	122 Å²	122	132.7 Å²	132.7	79%	0.792	78%	0.778	S	S	*	*			cis	-142.6	171.6	38.2	41.3	-21.3	0	0	0	119.7
368	P	42.5	Very low	37.4	Very low	103 Å²	103	128 Å²	128	67%	0.669	78%	0.776	S	S	*	*			trans	-116.2	169.7	-177.1	42.5	-33.1	0	0	0	115.4
369	Y	38.1	Very low	37.2	Very low	205 Å²	205	125.7 Å²	125.7	80%	0.804	78%	0.78	S	S	*	*			trans	-149.5	159	152.6	-151.3	-105.5	0	0	0	114
370	M	40.8	Very low	36.8	Very low	139 Å²	139	124.8 Å²	124.8	69%	0.685	79%	0.789	S	S	*	*			trans	-41.6	149.1	-167.3	-61.8	179.1	-176.5	0	0	117.8
371	A	37.5	Very low	36.6	Very low	90 Å²	90	121.1 Å²	121.1	74%	0.744	79%	0.788	S	S	*	*			cis	110.1	89.6	19.4	0	0	0	0	0	115.6
372	A	36.2	Very low	36.7	Very low	93 Å²	93	120.3 Å²	120.3	77%	0.769	79%	0.789	S	S	*	*			trans	70.2	171	135.2	0	0	0	0	0	119.6
373	P	42.3	Very low	36.7	Very low	104 Å²	104	119.9 Å²	119.9	68%	0.675	79%	0.786	S	S	*	*			cis	-133.9	-171.5	-24.5	18	8.1	0	0	0	114.6
374	Y	34.8	Very low	36.7	Very low	194 Å²	194	125.3 Å²	125.3	76%	0.761	79%	0.793	S	S	*	*			trans	93.3	107.6	155	-76.5	-76.9	0	0	0	122.8
375	Q	32.4	Very low	36.6	Very low	183 Å²	183	123.5 Å²	123.5	86%	0.855	79%	0.785	S	S	*	*			trans	54.2	118.2	133.5	-76.4	175.4	-14.7	0	0	122.1
376	G	33.8	Very low	36.2	Very low	85 Å²	85	125.4 Å²	125.4	88%	0.876	79%	0.786	S	S	*	*			trans	-177	107.5	157.1	0	0	0	0	0	110.7
377	S	35	Very low	36.6	Very low	137 Å²	137	123.9 Å²	123.9	96%	0.958	78%	0.782	S	S	*	*			trans	-98.5	138.3	-178.6	-175.6	0	0	0	0	111.4
378	G	32.5	Very low	36.6	Very low	76 Å²	76	126 Å²	126	78%	0.784	78%	0.779	S	S	*	*			trans	177.8	89.6	175.8	0	0	0	0	0	117.3
379	G	31.3	Very low	36.5	Very low	83 Å²	83	126.2 Å²	126.2	86%	0.856	78%	0.78	S	S	*	*			trans	83	139.5	142	0	0	0	0	0	120.9
380	G	30	Very low	37.1	Very low	85 Å²	85	122.1 Å²	122.1	88%	0.876	77%	0.77	S	S	*	*			trans	87.4	46.3	136.5	0	0	0	0	0	120.3
381	G	32.9	Very low	37.3	Very low	79 Å²	79	120.9 Å²	120.9	81%	0.814	77%	0.77	S	S	*	*			trans	-87.1	111.4	164.8	0	0	0	0	0	112.1
382	N	37	Very low	38	Very low	137 Å²	137	118.6 Å²	118.6	73%	0.733	74%	0.743	S	S	*	*			trans	-77.7	138.7	-176.2	-162.3	13	0	0	0	112.5	Y384	N382-Y384 PolarHBondContact O-N 3.12Å
383	V	35.9	Very low	38.7	Very low	128 Å²	128	118.2 Å²	118.2	78%	0.776	73%	0.733	S	S	*	*			trans	-83.5	96.8	179.9	-179	0	0	0	0	109.7	A385	V383-A385 PolarHBondContact O-N 3.37Å
384	Y	34.8	Very low	39.2	Very low	211 Å²	211	116.5 Å²	116.5	83%	0.827	72%	0.718	S	S	*	*			trans	-70.2	107	165.5	-79.8	-89.2	0	0	0	109.6	N382	N382-Y384 PolarHBondContact O-N 3.12Å
385	A	38.7	Very low	40.2	Very low	78 Å²	78	108.9 Å²	108.9	65%	0.645	69%	0.691	S	S	*	*			trans	-73.3	125.1	165.7	0	0	0	0	0	109.1	V383 V387	V383-A385 PolarHBondContact O-N 3.37Å; A385-V387 PolarHBondContact O-N 3.32Å
386	D	32.7	Very low	41.4	Very low	158 Å²	158	104.4 Å²	104.4	85%	0.845	67%	0.673	S	S	*	*			trans	-75.8	85.3	-177.3	-173	14.1	0	0	0	111.2	K388	D386-K388 VanDerWaalsContact C-N 3.29Å; D386-K388 PolarHBondContact O-N 3.22Å
387	V	45.4	Very low	43.2	Very low	111 Å²	111	107.4 Å²	107.4	67%	0.673	67%	0.667	S	S	*	*			trans	-78.7	80.1	177.2	-174	0	0	0	0	109.4	A385	A385-V387 PolarHBondContact O-N 3.32Å
388	K	43.6	Very low	45.4	Very low	167 Å²	167	105.5 Å²	105.5	73%	0.726	64%	0.643	S	S	*	*			trans	-53.1	126.5	172.5	-174.6	175.8	-177.8	176.7	0	110.1	D386 M390	D386-K388 VanDerWaalsContact C-N 3.29Å; D386-K388 PolarHBondContact O-N 3.22Å; K388-M390 PolarHBondContact O-N 3.07Å
389	P	41.7	Very low	48	Very low	108 Å²	108	103.2 Å²	103.2	70%	0.701	62%	0.615	S	S	*	*			trans	-63.1	120.5	-174.5	23.6	-33.7	0	0	0	111.3	V391	P389-V391 PolarHBondContact O-N 3.38Å; P389-V391 VanDerWaalsContact O-N 3.16Å
390	M	49.2	Very low	50.9	Low	119 Å²	119	101.7 Å²	101.7	59%	0.586	58%	0.583	S	S	*	*			trans	-78.9	100.4	178.4	-74.2	-172.4	62.3	0	0	110.5	K388 Q392 T474 L490	K388-M390 PolarHBondContact O-N 3.07Å; M390-Q392 PolarHBondContact O-N 2.83Å; M390-T474 HydrophobicContact CB-CG2 4.44Å; M390-T474 HydrophobicContact CE-CG2 4.27Å; M390-T474 HydrophobicContact CG-CG2 4.4Å; M390-T474 HydrophobicContact SD-CG2 3.46Å; M390-T474 WeakPolarHBondContact SD-CG2 3.2Å; M390-L490 HydrophobicContact CE-CD2 3.61Å
391	V	44.9	Very low	53.8	Low	113 Å²	113	97.8 Å²	97.8	69%	0.685	54%	0.542	S	S	*	.			trans	-71.5	106.3	170.6	-179.2	0	0	0	0	108.1	P389	P389-V391 PolarHBondContact O-N 3.38Å; P389-V391 VanDerWaalsContact O-N 3.16Å
392	Q	53	Low	56.5	Low	41 Å²	41	95.2 Å²	95.2	19%	0.192	51%	0.512	C	S	.	.			trans	-54	141.1	162.3	-85.4	175.3	-42.4	0	0	109.3	M390 N394 Y486	M390-Q392 PolarHBondContact O-N 2.83Å; Q392-N394 PolarHBondContact O-N 2.91Å; Q392-Y486 PolarHBondContact NE2-O 2.86Å
393	P	50.2	Low	59.1	Low	85 Å²	85	90.4 Å²	90.4	55%	0.552	48%	0.484	S	S	*	.			trans	-49.8	132.3	176.1	-26.2	34.6	0	0	0	110.5	D395	P393-D395 PolarHBondContact O-N 2.79Å; P393-D395 VanDerWaalsContact O-N 3.15Å
394	N	53	Low	61.7	Low	68 Å²	68	88.9 Å²	88.9	36%	0.364	48%	0.477	S	S	.	.			trans	-79.9	104.5	-176.4	-144.7	70.7	0	0	0	108.6	Q392 D396 I397 R479	Q392-N394 PolarHBondContact O-N 2.91Å; N394-D396 PolarHBondContact ND2-OD2 2.8Å; N394-D396 PolarHBondContact O-N 2.87Å; N394-I397 HydrophobicContact CB-CD1 4.31Å; N394-I397 HydrophobicContact CB-CG1 4.36Å; N394-I397 PolarHBondContact O-N 3.03Å; N394-R479 PolarHBondContact OD1-NH1 3.31Å
395	D	56.3	Low	64.5	Low	35 Å²	35	81.1 Å²	81.1	19%	0.187	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	9.5	-177.6	-67.6	-53.4	0	0	0	115.3	P393 Y486 R518 K603	P393-D395 PolarHBondContact O-N 2.79Å; P393-D395 VanDerWaalsContact O-N 3.15Å; D395-Y486 VanDerWaalsContact OD2-CD2 3.3Å; D395-Y486 WeakPolarHBondContact OD2-CD2 3.3Å; D395-Y486 WeakPolarHBondContact OD2-CE2 3.49Å; D395-R518 VanDerWaalsContact CG-NH2 3.25Å; D395-R518 IonicContact OD1-CZ 3.11Å; D395-R518 IonicContact OD1-NH1 2.74Å; D395-R518 PolarHBondContact OD1-NH1 2.91Å; D395-R518 IonicContact OD1-NH2 2.62Å; D395-R518 PolarHBondContact OD1-NH2 2.81Å; D395-R518 IonicContact OD2-NH2 3.39Å; D395-K603 PolarHBondContact O-NZ 3.09Å
396	D	57.6	Low	66.9	Low	88 Å²	88	84 Å²	84	47%	0.471	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-9.5	177.1	-49.9	-54	0	0	0	112.4	N394 E398 R483 K603	N394-D396 PolarHBondContact ND2-OD2 2.8Å; N394-D396 PolarHBondContact O-N 2.87Å; D396-E398 VanDerWaalsContact C-N 3.34Å; D396-R483 IonicContact OD1-NH1 3.98Å; D396-R483 IonicContact OD1-NH2 3.63Å; D396-K603 IonicContact OD1-NZ 3.07Å; D396-K603 PolarHBondContact OD1-NZ 2.79Å
397	I	70.5	Confident	69.5	Low	149 Å²	149	83 Å²	83	76%	0.764	44%	0.444	S	S	*	.	S	Bend	trans	-66.6	-40.1	169.2	-66.5	173.1	0	0	0	109.9	N394	N394-I397 HydrophobicContact CB-CD1 4.31Å; N394-I397 HydrophobicContact CB-CG1 4.36Å; N394-I397 PolarHBondContact O-N 3.03Å
398	E	82.3	Confident	71.7	Confident	97 Å²	97	78.2 Å²	78.2	45%	0.453	42%	0.417	S	S	.	.	S	Bend	trans	-146.7	123.2	172.5	-151.4	-174.6	160.9	0	0	110.1	D396 R400 H520	D396-E398 VanDerWaalsContact C-N 3.34Å; E398-R400 PolarHBondContact O-N 2.84Å; E398-H520 VanDerWaalsContact CD-CE1 3.47Å; E398-H520 IonicContact OE1-CE1 3.02Å; E398-H520 PolarHBondContact OE1-CE1 2.86Å; E398-H520 IonicContact OE1-CG 3.17Å; E398-H520 IonicContact OE1-ND1 3.4Å; E398-H520 PolarHBondContact OE1-ND1 3.04Å; E398-H520 IonicContact OE2-CE1 3.77Å; E398-H520 PolarHBondContact OE2-CE1 2.86Å; E398-H520 IonicContact OE2-ND1 3.61Å; E398-H520 PolarHBondContact OE2-ND1 3.16Å; E398-H520 VanDerWaalsContact OE2-ND1 3.16Å
399	P	87.9	Confident	74	Confident	28 Å²	28	73.9 Å²	73.9	18%	0.182	40%	0.4	C	S	.	.			trans	-74.5	119.8	-170.9	29.9	-35.6	0	0	0	111.5	V521 M600 K603	P399-V521 HydrophobicContact CB-CB 4.48Å; P399-V521 HydrophobicContact CB-CG2 3.85Å; P399-V521 HydrophobicContact CG-CB 4.24Å; P399-V521 HydrophobicContact CG-CG2 4.14Å; P399-V521 WeakPolarHBondContact O-CG2 3.16Å; P399-V521 PolarHBondContact O-N 2.89Å; P399-M600 HydrophobicContact CB-CE 3.93Å; P399-M600 HydrophobicContact CB-SD 3.69Å; P399-M600 HydrophobicContact CG-CE 3.89Å; P399-M600 HydrophobicContact CG-SD 3.56Å; P399-M600 VanDerWaalsContact CG-SD 3.56Å; P399-K603 HydrophobicContact CB-CD 3.82Å
400	R	91.3	Very high	76.6	Confident	51 Å²	51	71 Å²	71	19%	0.192	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-107.4	152.6	173.2	-68	178.6	175.8	-85.7	-1.2	111.3	E398 D442 R518 P519 H520	E398-R400 PolarHBondContact O-N 2.84Å; R400-D442 IonicContact NH1-OD1 3.99Å; R400-D442 PolarHBondContact NH1-OD1 2.85Å; R400-R518 HydrophobicContact CB-CB 4.31Å; R400-R518 VanDerWaalsContact CD-O 3.32Å; R400-R518 WeakPolarHBondContact CD-O 3.36Å; R400-R518 WeakPolarHBondContact CG-O 3.26Å; R400-R518 PolarHBondContact NH1-O 3.24Å; R400-P519 WeakPolarHBondContact CA-O 3.36Å; R400-H520 VanDerWaalsContact CZ-NE2 3.3Å; R400-H520 PolarHBondContact NH1-CD2 3.35Å; R400-H520 PolarHBondContact NH1-NE2 3.32Å; R400-H520 PolarHBondContact NH2-CE1 3.21Å; R400-H520 PolarHBondContact NH2-NE2 2.79Å
401	M	90.6	Very high	78.8	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.01	36%	0.358	C	S	.	.			trans	-116.9	131.2	178.1	-50.5	-169.4	81	0	0	110	F403 R518 P519 V521 V524 L599 K603 W608	M401-F403 HydrophobicContact CB-CE2 3.73Å; M401-F403 HydrophobicContact CB-CZ 4.03Å; M401-R518 VanDerWaalsContact O-CA 3.31Å; M401-R518 WeakPolarHBondContact O-CA 3.45Å; M401-P519 PolarHBondContact N-O 2.86Å; M401-P519 WeakPolarHBondContact O-CD 3.46Å; M401-V521 HydrophobicContact CG-CB 4.43Å; M401-V521 HydrophobicContact CG-CG2 3.47Å; M401-V521 VanDerWaalsContact CG-CG2 3.47Å; M401-V521 HydrophobicContact SD-CB 4.46Å; M401-V521 HydrophobicContact SD-CG2 3.86Å; M401-V524 HydrophobicContact CB-CG2 4.42Å; M401-V524 HydrophobicContact CG-CG2 4.33Å; M401-V524 HydrophobicContact SD-CB 3.96Å; M401-V524 HydrophobicContact SD-CG1 3.97Å; M401-V524 HydrophobicContact SD-CG2 3.88Å; M401-L599 HydrophobicContact CE-CB 3.92Å; M401-L599 HydrophobicContact CE-CD2 3.9Å; M401-L599 HydrophobicContact CE-CG 4.47Å; M401-L599 WeakPolarHBondContact CE-O 3.45Å; M401-L599 HydrophobicContact SD-CB 4.05Å; M401-L599 HydrophobicContact SD-CD2 4.12Å; M401-L599 HydrophobicContact SD-CG 4.45Å; M401-K603 HydrophobicContact CG-CB 4.37Å; M401-W608 HydrophobicContact CE-CH2 3.41Å; M401-W608 VanDerWaalsContact CE-CH2 3.41Å; M401-W608 HydrophobicContact CE-CZ2 3.57Å
402	S	90.6	Very high	81.1	Confident	26 Å²	26	67.5 Å²	67.5	18%	0.182	35%	0.354	C	S	.	.			trans	-100.2	111.6	-170.1	-66.3	0	0	0	0	113.2	Y486 R518	S402-Y486 PolarHBondContact OG-OH 3.12Å; S402-R518 PolarHBondContact OG-NE 2.91Å
403	F	91	Very high	83	Confident	35 Å²	35	67.9 Å²	67.9	15%	0.154	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	136.8	178	-58.3	-80.4	0	0	0	111.8	M401 I516 S517 P519 V524 V619	M401-F403 HydrophobicContact CB-CE2 3.73Å; M401-F403 HydrophobicContact CB-CZ 4.03Å; F403-I516 CarbonylContact O-C 3.5Å; F403-I516 VanDerWaalsContact O-CA 3.25Å; F403-I516 WeakPolarHBondContact O-CA 3.28Å; F403-I516 VanDerWaalsContact O-CB 3.28Å; F403-I516 WeakPolarHBondContact O-CB 3.25Å; F403-S517 PolarHBondContact N-O 3.32Å; F403-S517 PolarHBondContact O-N 3.17Å; F403-P519 HydrophobicContact CD2-CG 3.85Å; F403-P519 HydrophobicContact CE2-CG 3.73Å; F403-V524 HydrophobicContact CE2-CG2 3.88Å; F403-V524 HydrophobicContact CZ-CG1 4.39Å; F403-V524 HydrophobicContact CZ-CG2 4.21Å; F403-V619 HydrophobicContact CE1-CB 4.27Å; F403-V619 HydrophobicContact CE1-CG2 3.71Å; F403-V619 HydrophobicContact CZ-CG2 3.94Å
404	P	90.8	Very high	85.1	Confident	96 Å²	96	65.7 Å²	65.7	62%	0.623	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	133.5	175.2	29	-33.9	0	0	0	111.2
405	V	92.4	Very high	87.1	Confident	48 Å²	48	68.6 Å²	68.6	29%	0.291	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	134.3	171.7	175.5	0	0	0	0	109.1	D407 G408 L443 L515	V405-D407 PolarHBondContact O-N 3.49Å; V405-G408 WeakPolarHBondContact O-CA 3.15Å; V405-G408 PolarHBondContact O-N 3.45Å; V405-L443 HydrophobicContact CG2-CD2 3.97Å; V405-L515 HydrophobicContact CB-CB 4.49Å; V405-L515 HydrophobicContact CB-CD2 4.2Å; V405-L515 HydrophobicContact CB-CG 4.17Å; V405-L515 HydrophobicContact CG1-CD2 4Å; V405-L515 HydrophobicContact CG2-CD2 4.4Å; V405-L515 HydrophobicContact CG2-CG 4.14Å; V405-L515 PolarHBondContact N-O 3.5Å
406	K	88.8	Confident	88.7	Confident	140 Å²	140	67.4 Å²	67.4	61%	0.609	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.6	134.4	176.2	-165.2	-154.3	172.8	-119.7	0	110.1	G408	K406-G408 PolarHBondContact O-N 3.27Å
407	D	87.6	Confident	90.3	Very high	135 Å²	135	69.8 Å²	69.8	72%	0.722	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	60.4	10.7	-177.1	-47.5	-45.2	0	0	0	114.3	V405 M409	V405-D407 PolarHBondContact O-N 3.49Å; D407-M409 VanDerWaalsContact C-N 3.25Å; D407-M409 PolarHBondContact O-N 3.38Å; D407-M409 VanDerWaalsContact O-N 3.11Å
408	G	91.5	Very high	91	Very high	11 Å²	11	68.7 Å²	68.7	11%	0.113	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	20.8	-176.7	0	0	0	0	0	116.3	V405 K406 I410 S514 L515	V405-G408 WeakPolarHBondContact O-CA 3.15Å; V405-G408 PolarHBondContact O-N 3.45Å; K406-G408 PolarHBondContact O-N 3.27Å; G408-I410 PolarHBondContact O-N 3.45Å; G408-S514 CarbonylContact O-C 3.59Å; G408-S514 VanDerWaalsContact O-CA 3.3Å; G408-S514 WeakPolarHBondContact O-CA 3.43Å; G408-L515 PolarHBondContact O-N 3.14Å
409	M	93.5	Very high	91	Very high	76 Å²	76	70.7 Å²	70.7	37%	0.374	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	107.7	-179.4	-72	-66.1	-67	0	0	111	D407 M512	D407-M409 VanDerWaalsContact C-N 3.25Å; D407-M409 PolarHBondContact O-N 3.38Å; D407-M409 VanDerWaalsContact O-N 3.11Å; M409-M512 HydrophobicContact CE-CE 4.31Å; M409-M512 HydrophobicContact CE-CG 3.84Å; M409-M512 HydrophobicContact CE-SD 4.15Å; M409-M512 HydrophobicContact SD-CG 4.43Å; M409-M512 HydrophobicContact SD-SD 4.24Å
410	I	94.9	Very high	91.1	Very high	47 Å²	47	72.6 Å²	72.6	24%	0.241	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-41.8	-178.3	-54.6	173.1	0	0	0	110.6	G408 F427 I445 L513 L515	G408-I410 PolarHBondContact O-N 3.45Å; I410-F427 HydrophobicContact CG2-CB 4.43Å; I410-F427 HydrophobicContact CG2-CD2 3.89Å; I410-I445 HydrophobicContact CD1-CD1 3.81Å; I410-I445 HydrophobicContact CD1-CG1 3.91Å; I410-I445 HydrophobicContact CD1-CG2 3.99Å; I410-L513 WeakPolarHBondContact CA-O 3.45Å; I410-L513 HydrophobicContact CB-CB 4.43Å; I410-L513 HydrophobicContact CB-CD2 4.16Å; I410-L513 HydrophobicContact CB-CG 4.21Å; I410-L513 WeakPolarHBondContact CB-O 3.36Å; I410-L513 HydrophobicContact CG2-CD2 3.83Å; I410-L513 HydrophobicContact CG2-CG 4.44Å; I410-L513 PolarHBondContact N-O 3.2Å; I410-L515 HydrophobicContact CD1-CB 4.46Å
411	L	95.5	Very high	91	Very high	29 Å²	29	74.2 Å²	74.2	15%	0.152	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	126.5	167.6	-63.9	171.9	0	0	0	109.2	F414 I425 F427 L513	L411-F414 HydrophobicContact CB-CD1 4.41Å; L411-F414 HydrophobicContact CB-CE1 4.35Å; L411-F414 HydrophobicContact CD1-CE1 3.92Å; L411-I425 HydrophobicContact CD1-CG2 3.82Å; L411-I425 HydrophobicContact CD2-CG2 4.22Å; L411-F427 HydrophobicContact CD1-CB 4.26Å; L411-F427 HydrophobicContact CD2-CB 4.04Å; L411-F427 HydrophobicContact CG-CB 4.19Å; L411-L513 HydrophobicContact CB-CB 3.78Å; L411-L513 HydrophobicContact CD1-CB 3.96Å; L411-L513 HydrophobicContact CD1-CD2 3.96Å; L411-L513 HydrophobicContact CG-CB 4.01Å; L411-L513 HydrophobicContact CG-CD2 4.2Å; L411-L513 PolarHBondContact N-O 3.38Å; L411-L513 PolarHBondContact O-N 3.29Å
412	Q	93.4	Very high	91.1	Very high	131 Å²	131	78 Å²	78	61%	0.612	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.5	155.2	169	-65.5	-61.2	-23.1	0	0	110.7	F414	Q412-F414 PolarHBondContact O-N 2.04Å; Q412-F414 VanDerWaalsContact O-N 3.14Å
413	P	94.2	Very high	91.3	Very high	48 Å²	48	77.4 Å²	77.4	31%	0.312	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	118.6	179.8	-28.1	37	0	0	0	112.6	F450 L510 F511 M512	P413-F450 HydrophobicContact CB-CZ 4.15Å; P413-F450 HydrophobicContact CG-CZ 4.37Å; P413-L510 HydrophobicContact CB-CB 4.28Å; P413-L510 HydrophobicContact CB-CD2 3.69Å; P413-F511 CarbonylContact C-O 3.48Å; P413-F511 WeakPolarHBondContact CA-O 3.39Å; P413-M512 HydrophobicContact CG-CE 3.76Å
414	F	93.9	Very high	91.5	Very high	39 Å²	39	81.3 Å²	81.3	17%	0.171	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.9	-178.9	67.8	-89.1	0	0	0	111.6	L411 Q412 L416 I425 L498 L510 F511	L411-F414 HydrophobicContact CB-CD1 4.41Å; L411-F414 HydrophobicContact CB-CE1 4.35Å; L411-F414 HydrophobicContact CD1-CE1 3.92Å; Q412-F414 PolarHBondContact O-N 2.04Å; Q412-F414 VanDerWaalsContact O-N 3.14Å; F414-L416 HydrophobicContact CD2-CD2 4.21Å; F414-L416 HydrophobicContact CE2-CD2 3.82Å; F414-I425 HydrophobicContact CD2-CD1 4.49Å; F414-I425 HydrophobicContact CD2-CG1 4.42Å; F414-I425 HydrophobicContact CE2-CD1 3.54Å; F414-I425 HydrophobicContact CE2-CG1 3.8Å; F414-I425 HydrophobicContact CZ-CD1 3.82Å; F414-I425 HydrophobicContact CZ-CG1 3.97Å; F414-L498 HydrophobicContact CZ-CD2 4.06Å; F414-L510 CarbonylContact O-C 3.55Å; F414-L510 VanDerWaalsContact O-CA 3.31Å; F414-L510 WeakPolarHBondContact O-CA 3.49Å; F414-F511 HydrophobicContact CD1-CB 4.18Å; F414-F511 WeakPolarHBondContact CD1-O 3.43Å; F414-F511 HydrophobicContact CD2-CB 4.23Å; F414-F511 HydrophobicContact CE1-CB 3.7Å; F414-F511 HydrophobicContact CE2-CB 3.75Å; F414-F511 HydrophobicContact CE2-CD2 4.39Å; F414-F511 HydrophobicContact CE2-CG 4.27Å; F414-F511 HydrophobicContact CG-CB 4.44Å; F414-F511 HydrophobicContact CZ-CB 3.46Å; F414-F511 VanDerWaalsContact CZ-CB 3.46Å; F414-F511 HydrophobicContact CZ-CG 4.31Å; F414-F511 PolarHBondContact N-O 2.98Å; F414-F511 PolarHBondContact O-N 2.78Å
415	R	93.6	Very high	91.7	Very high	129 Å²	129	78.4 Å²	78.4	49%	0.487	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-91.6	158.2	168.3	-65.2	-179.5	-172.8	-97	5.3	109.5	C507 L510	R415-C507 PolarHBondContact NH1-O 3.43Å; R415-L510 HydrophobicContact CG-CD2 4.16Å; R415-L510 HydrophobicContact CG-CG 3.93Å
416	L	91.4	Very high	91.9	Very high	11 Å²	11	78.7 Å²	78.7	6%	0.058	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-83.4	149.2	163.5	-49.8	-168	0	0	0	109.7	F414 V500 V502 C506 F511	F414-L416 HydrophobicContact CD2-CD2 4.21Å; F414-L416 HydrophobicContact CE2-CD2 3.82Å; L416-V500 HydrophobicContact CD1-CB 4.11Å; L416-V500 HydrophobicContact CD1-CG1 3.65Å; L416-V500 HydrophobicContact CD2-CB 4.4Å; L416-V502 HydrophobicContact CD1-CG2 4.48Å; L416-C506 VanDerWaalsContact CD1-SG 3.54Å; L416-F511 HydrophobicContact CD1-CE2 4.14Å; L416-F511 HydrophobicContact CD1-CZ 4.41Å; L416-F511 HydrophobicContact CD2-CD2 3.99Å; L416-F511 HydrophobicContact CD2-CE2 4.02Å; L416-F511 HydrophobicContact CG-CD2 4.16Å; L416-F511 HydrophobicContact CG-CE2 3.72Å; L416-F511 HydrophobicContact CG-CZ 4.46Å
417	E	89.6	Confident	92.3	Very high	138 Å²	138	72.3 Å²	72.3	65%	0.645	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-71	136.1	176.6	-69.5	-177.2	-158.3	0	0	111.5	N419 I420	E417-N419 PolarHBondContact O-N 2.83Å; E417-I420 HydrophobicContact CB-CB 4.27Å; E417-I420 HydrophobicContact CB-CD1 3.84Å; E417-I420 HydrophobicContact CB-CG1 3.9Å; E417-I420 HydrophobicContact CG-CD1 4.37Å; E417-I420 PolarHBondContact O-N 2.87Å; E417-I420 VanDerWaalsContact O-N 3.12Å; E417-I420 VanDerWaalsContact OE2-CD1 3.3Å; E417-I420 WeakPolarHBondContact OE2-CD1 3.3Å
418	H	85.2	Confident	92.7	Very high	126 Å²	126	72.1 Å²	72.1	58%	0.583	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	129.6	175.8	-172.3	74	0	0	0	109.9	C505 C507	H418-C505 PolarHBondContact ND1-SG 2.82Å; H418-C507 PolarHBondContact ND1-SG 2.88Å
419	N	83.5	Confident	92.8	Very high	139 Å²	139	72 Å²	72	74%	0.743	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	6.8	-172.1	-49.5	-50.8	0	0	0	117.4	E417 P421	E417-N419 PolarHBondContact O-N 2.83Å; N419-P421 WeakPolarHBondContact O-CD 3.36Å
420	I	89.7	Confident	92.8	Very high	67 Å²	67	73.5 Å²	73.5	34%	0.344	37%	0.368	S	S	.	.			trans	-94	109.4	166.8	-63.9	-165.4	0	0	0	109.9	E417 V422	E417-I420 HydrophobicContact CB-CB 4.27Å; E417-I420 HydrophobicContact CB-CD1 3.84Å; E417-I420 HydrophobicContact CB-CG1 3.9Å; E417-I420 HydrophobicContact CG-CD1 4.37Å; E417-I420 PolarHBondContact O-N 2.87Å; E417-I420 VanDerWaalsContact O-N 3.12Å; E417-I420 VanDerWaalsContact OE2-CD1 3.3Å; E417-I420 WeakPolarHBondContact OE2-CD1 3.3Å; I420-V422 VanDerWaalsContact C-N 3.35Å; I420-V422 VanDerWaalsContact CG2-O 3.28Å; I420-V422 WeakPolarHBondContact CG2-O 3.39Å
421	P	89.2	Confident	92.7	Very high	85 Å²	85	72.7 Å²	72.7	55%	0.552	37%	0.368	S	S	*	.	S	Bend	trans	-77.6	-18.7	-177.9	31.6	-36.4	0	0	0	113.6	N419 A501 V502	N419-P421 WeakPolarHBondContact O-CD 3.36Å; P421-A501 CarbonylContact O-C 3.58Å; P421-A501 VanDerWaalsContact O-CA 3.26Å; P421-A501 WeakPolarHBondContact O-CA 3.28Å; P421-V502 PolarHBondContact O-N 3.32Å
422	V	93.3	Very high	92.6	Very high	81 Å²	81	78 Å²	78	49%	0.491	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	102.5	176.8	-174.1	0	0	0	0	108.9	I420 A501	I420-V422 VanDerWaalsContact C-N 3.35Å; I420-V422 VanDerWaalsContact CG2-O 3.28Å; I420-V422 WeakPolarHBondContact CG2-O 3.39Å; V422-A501 HydrophobicContact CB-CB 4.45Å; V422-A501 HydrophobicContact CG1-CB 4.32Å; V422-A501 HydrophobicContact CG2-CB 3.9Å
423	S	93.8	Very high	92.5	Very high	14 Å²	14	76.9 Å²	76.9	10%	0.098	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	130.4	174.3	-59.2	0	0	0	0	110.3	Q499 V500	S423-Q499 CarbonylContact O-C 3.6Å; S423-Q499 WeakPolarHBondContact O-CA 3.47Å; S423-V500 PolarHBondContact N-O 3.46Å; S423-V500 PolarHBondContact O-N 2.81Å
424	Q	95.4	Very high	92.5	Very high	118 Å²	118	75.6 Å²	75.6	55%	0.551	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	115.5	175.8	-176	179.5	-79	0	0	111.3	Q499	Q424-Q499 HydrophobicContact CB-CG 4.05Å; Q424-Q499 HydrophobicContact CG-CG 3.8Å
425	I	95.8	Very high	92.5	Very high	34 Å²	34	78.7 Å²	78.7	17%	0.174	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	136	177.6	-53.9	87.4	0	0	0	108.4	L411 F414 T497 L498	L411-I425 HydrophobicContact CD1-CG2 3.82Å; L411-I425 HydrophobicContact CD2-CG2 4.22Å; F414-I425 HydrophobicContact CD2-CD1 4.49Å; F414-I425 HydrophobicContact CD2-CG1 4.42Å; F414-I425 HydrophobicContact CE2-CD1 3.54Å; F414-I425 HydrophobicContact CE2-CG1 3.8Å; F414-I425 HydrophobicContact CZ-CD1 3.82Å; F414-I425 HydrophobicContact CZ-CG1 3.97Å; I425-T497 WeakPolarHBondContact O-CA 3.36Å; I425-L498 HydrophobicContact CB-CB 4.48Å; I425-L498 PolarHBondContact N-O 2.92Å; I425-L498 PolarHBondContact O-N 3Å
426	T	96.8	Very high	92.5	Very high	55 Å²	55	76.8 Å²	76.8	34%	0.337	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	132.2	170.3	-61.5	0	0	0	0	108.7	F428 K495 N496	T426-F428 HydrophobicContact CG2-CE2 3.81Å; T426-F428 HydrophobicContact CG2-CZ 3.94Å; T426-K495 HydrophobicContact CG2-CD 4.22Å; T426-K495 HydrophobicContact CG2-CG 3.81Å; T426-N496 WeakPolarHBondContact CA-O 3.44Å
427	F	96.4	Very high	92.6	Very high	5 Å²	5	76.5 Å²	76.5	2%	0.022	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	162.3	174.2	65.6	-81.4	0	0	0	110.4	I410 L411 I429 I487 N496 L498 L513	I410-F427 HydrophobicContact CG2-CB 4.43Å; I410-F427 HydrophobicContact CG2-CD2 3.89Å; L411-F427 HydrophobicContact CD1-CB 4.26Å; L411-F427 HydrophobicContact CD2-CB 4.04Å; L411-F427 HydrophobicContact CG-CB 4.19Å; F427-I429 HydrophobicContact CD2-CG1 4.36Å; F427-I429 HydrophobicContact CE2-CD1 4.05Å; F427-I429 HydrophobicContact CE2-CG1 4.34Å; F427-I487 HydrophobicContact CZ-CD1 4.4Å; F427-N496 HydrophobicContact CD1-CB 3.86Å; F427-N496 HydrophobicContact CD2-CB 3.79Å; F427-N496 HydrophobicContact CE1-CB 3.53Å; F427-N496 HydrophobicContact CE2-CB 3.47Å; F427-N496 VanDerWaalsContact CE2-CB 3.47Å; F427-N496 HydrophobicContact CG-CB 3.98Å; F427-N496 HydrophobicContact CZ-CB 3.34Å; F427-N496 PolarHBondContact N-O 2.92Å; F427-N496 PolarHBondContact O-N 2.84Å; F427-L498 HydrophobicContact CD1-CB 4.27Å; F427-L498 HydrophobicContact CE1-CB 3.95Å; F427-L513 HydrophobicContact CD1-CD2 4.14Å; F427-L513 HydrophobicContact CD2-CD2 3.67Å; F427-L513 HydrophobicContact CE1-CD2 4.12Å; F427-L513 HydrophobicContact CE2-CD2 3.63Å; F427-L513 HydrophobicContact CG-CD2 3.92Å; F427-L513 HydrophobicContact CZ-CD2 3.86Å
428	F	96.2	Very high	92.7	Very high	131 Å²	131	73 Å²	73	58%	0.575	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.3	138.3	-175.8	-65.4	-92.3	0	0	0	110.8	T426 N494 K495	T426-F428 HydrophobicContact CG2-CE2 3.81Å; T426-F428 HydrophobicContact CG2-CZ 3.94Å; F428-N494 VanDerWaalsContact CA-O 3.3Å; F428-N494 WeakPolarHBondContact CA-O 3.45Å; F428-K495 HydrophobicContact CD1-CB 4.12Å; F428-K495 HydrophobicContact CE1-CB 3.75Å; F428-K495 HydrophobicContact CE1-CG 3.95Å; F428-K495 HydrophobicContact CZ-CG 4.28Å
429	I	94.6	Very high	93.1	Very high	8 Å²	8	71.2 Å²	71.2	4%	0.041	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	118.4	171.2	-56.1	167	0	0	0	105.5	F427 Q433 F434 I445 C491 N494	F427-I429 HydrophobicContact CD2-CG1 4.36Å; F427-I429 HydrophobicContact CE2-CD1 4.05Å; F427-I429 HydrophobicContact CE2-CG1 4.34Å; I429-Q433 HydrophobicContact CG2-CB 3.82Å; I429-F434 HydrophobicContact CG2-CB 3.95Å; I429-I445 HydrophobicContact CD1-CD1 3.48Å; I429-I445 VanDerWaalsContact CD1-CD1 3.48Å; I429-I445 HydrophobicContact CG1-CD1 4.42Å; I429-C491 HydrophobicContact CD1-CB 3.78Å; I429-N494 PolarHBondContact N-O 2.92Å; I429-N494 WeakPolarHBondContact O-CA 3.24Å; I429-N494 PolarHBondContact O-N 2.78Å
430	M	93.2	Very high	93.5	Very high	109 Å²	109	67.1 Å²	67.1	54%	0.537	36%	0.362	S	S	.	.			trans	-61.9	153.9	-179.8	-61	-58.7	-166.7	0	0	110.9	E432 Q433 F434	M430-E432 PolarHBondContact O-N 3.15Å; M430-Q433 HydrophobicContact CB-CB 4.37Å; M430-Q433 HydrophobicContact CB-CG 4.08Å; M430-Q433 WeakPolarHBondContact O-CB 3.45Å; M430-Q433 PolarHBondContact O-N 2.95Å; M430-F434 PolarHBondContact O-N 3.37Å
431	A	93.1	Very high	93.7	Very high	29 Å²	29	68.2 Å²	68.2	24%	0.24	37%	0.374	C	S	.	.	H	α-helix	trans	-57.9	-37.4	-177.2	0	0	0	0	0	112.2	F434 N435	A431-F434 PolarHBondContact O-N 3.16Å; A431-N435 WeakPolarHBondContact O-CB 3.32Å; A431-N435 PolarHBondContact O-N 3.11Å; A431-N435 PolarHBondContact O-ND2 2.81Å
432	E	92.6	Very high	93.9	Very high	140 Å²	140	64.8 Å²	64.8	65%	0.654	35%	0.351	S	S	*	.	H	α-helix	trans	-66.2	-42.3	176.7	-58.6	68.6	-149.9	0	0	111.4	M430 N435 L436	M430-E432 PolarHBondContact O-N 3.15Å; E432-N435 PolarHBondContact O-N 3.16Å; E432-L436 WeakPolarHBondContact O-CB 3.42Å; E432-L436 PolarHBondContact O-N 2.81Å
433	Q	91.6	Very high	94	Very high	109 Å²	109	61.9 Å²	61.9	51%	0.509	33%	0.332	S	S	.	.	H	α-helix	trans	-67.3	-39.5	175.9	-66.5	171	-26.8	0	0	111.4	I429 M430 L436 L437	I429-Q433 HydrophobicContact CG2-CB 3.82Å; M430-Q433 HydrophobicContact CB-CB 4.37Å; M430-Q433 HydrophobicContact CB-CG 4.08Å; M430-Q433 WeakPolarHBondContact O-CB 3.45Å; M430-Q433 PolarHBondContact O-N 2.95Å; Q433-L436 PolarHBondContact O-N 2.78Å; Q433-L437 VanDerWaalsContact O-CB 3.24Å; Q433-L437 WeakPolarHBondContact O-CB 3.41Å; Q433-L437 PolarHBondContact O-N 3.38Å
434	F	94.3	Very high	94	Very high	20 Å²	20	62.1 Å²	62.1	9%	0.088	33%	0.332	C	S	.	.	H	α-helix	trans	-67.2	-40.3	176.4	-174.7	-95.7	0	0	0	111.6	I429 M430 A431 L437 C438 C491 P493	I429-F434 HydrophobicContact CG2-CB 3.95Å; M430-F434 PolarHBondContact O-N 3.37Å; A431-F434 PolarHBondContact O-N 3.16Å; F434-L437 HydrophobicContact CD2-CD2 4.48Å; F434-L437 PolarHBondContact O-N 2.89Å; F434-C438 VanDerWaalsContact CE1-SG 3.5Å; F434-C438 WeakPolarHBondContact O-CB 3.28Å; F434-C438 PolarHBondContact O-N 3.05Å; F434-C438 PolarHBondContact O-SG 3.09Å; F434-C491 HydrophobicContact CE2-CB 4.18Å; F434-C491 WeakPolarHBondContact CE2-O 3.04Å; F434-P493 HydrophobicContact CB-CB 4.09Å; F434-P493 HydrophobicContact CD1-CB 3.9Å; F434-P493 HydrophobicContact CD1-CG 4.17Å; F434-P493 HydrophobicContact CE1-CG 4.39Å; F434-P493 HydrophobicContact CG-CB 3.97Å
435	N	93.7	Very high	94	Very high	104 Å²	104	56.6 Å²	56.6	56%	0.556	31%	0.306	S	S	*	.	H	α-helix	trans	-63.1	-44.7	173.9	-70.2	-20.3	0	0	0	111.3	A431 E432 C438 S439	A431-N435 WeakPolarHBondContact O-CB 3.32Å; A431-N435 PolarHBondContact O-N 3.11Å; A431-N435 PolarHBondContact O-ND2 2.81Å; E432-N435 PolarHBondContact O-N 3.16Å; N435-C438 PolarHBondContact O-N 2.98Å; N435-S439 WeakPolarHBondContact O-CB 3.41Å; N435-S439 PolarHBondContact O-N 3.3Å; N435-S439 PolarHBondContact O-OG 3.46Å
436	L	92.8	Very high	94	Very high	90 Å²	90	55.2 Å²	55.2	47%	0.471	30%	0.299	S	S	.	.	H	α-helix	trans	-59.8	-50.7	174.7	-179.2	62.5	0	0	0	111.3	E432 Q433 C438 S439 D440 L443	E432-L436 WeakPolarHBondContact O-CB 3.42Å; E432-L436 PolarHBondContact O-N 2.81Å; Q433-L436 PolarHBondContact O-N 2.78Å; L436-C438 VanDerWaalsContact C-N 3.25Å; L436-C438 PolarHBondContact O-N 2.74Å; L436-S439 WeakPolarHBondContact CA-OG 3.48Å; L436-S439 PolarHBondContact O-N 3.27Å; L436-S439 PolarHBondContact O-OG 2.88Å; L436-D440 PolarHBondContact O-N 3.09Å; L436-D440 VanDerWaalsContact O-N 3.09Å; L436-L443 HydrophobicContact CG-CD1 4.12Å
437	L	93.1	Very high	93.9	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-54.6	-37.7	175.8	177	69.9	0	0	0	112.8	Q433 F434 L443 I445 K488 L515	Q433-L437 VanDerWaalsContact O-CB 3.24Å; Q433-L437 WeakPolarHBondContact O-CB 3.41Å; Q433-L437 PolarHBondContact O-N 3.38Å; F434-L437 HydrophobicContact CD2-CD2 4.48Å; F434-L437 PolarHBondContact O-N 2.89Å; L437-L443 HydrophobicContact CD1-CB 3.99Å; L437-I445 HydrophobicContact CD1-CG1 4.12Å; L437-I445 HydrophobicContact CD2-CD1 3.53Å; L437-I445 HydrophobicContact CD2-CG1 3.96Å; L437-K488 HydrophobicContact CD1-CB 4.48Å; L437-K488 HydrophobicContact CD1-CD 3.81Å; L437-K488 HydrophobicContact CD1-CG 4.16Å; L437-K488 HydrophobicContact CD2-CG 4.25Å; L437-K488 HydrophobicContact CG-CD 3.99Å; L437-K488 HydrophobicContact CG-CG 4.01Å; L437-K488 WeakPolarHBondContact O-CE 3.09Å; L437-K488 PolarHBondContact O-NZ 2.76Å; L437-L515 HydrophobicContact CD1-CD1 3.8Å
438	C	92.2	Very high	93.7	Very high	64 Å²	64	53.7 Å²	53.7	43%	0.432	29%	0.288	S	S	.	.	H	α-helix	trans	-77.1	-33.3	176.6	-67.9	0	0	0	0	113.1	F434 N435 L436	F434-C438 VanDerWaalsContact CE1-SG 3.5Å; F434-C438 WeakPolarHBondContact O-CB 3.28Å; F434-C438 PolarHBondContact O-N 3.05Å; F434-C438 PolarHBondContact O-SG 3.09Å; N435-C438 PolarHBondContact O-N 2.98Å; L436-C438 VanDerWaalsContact C-N 3.25Å; L436-C438 PolarHBondContact O-N 2.74Å
439	S	93	Very high	93.6	Very high	89 Å²	89	47.5 Å²	47.5	62%	0.622	26%	0.261	S	S	*	.	H	α-helix	trans	-74.1	-32.5	-177.6	67.4	0	0	0	0	114	N435 L436	N435-S439 WeakPolarHBondContact O-CB 3.41Å; N435-S439 PolarHBondContact O-N 3.3Å; N435-S439 PolarHBondContact O-OG 3.46Å; L436-S439 WeakPolarHBondContact CA-OG 3.48Å; L436-S439 PolarHBondContact O-N 3.27Å; L436-S439 PolarHBondContact O-OG 2.88Å
440	D	93.6	Very high	93.5	Very high	54 Å²	54	47.4 Å²	47.4	29%	0.289	26%	0.26	S	S	.	.			trans	-93.2	120.2	178.4	-171.3	-32.9	0	0	0	110.2	L436 D442 L443 K488	L436-D440 PolarHBondContact O-N 3.09Å; L436-D440 VanDerWaalsContact O-N 3.09Å; D440-D442 VanDerWaalsContact C-N 3.3Å; D440-D442 PolarHBondContact O-N 2.88Å; D440-D442 WeakPolarHBondContact OD1-CA 3.45Å; D440-D442 WeakPolarHBondContact OD1-CB 3.04Å; D440-D442 PolarHBondContact OD1-N 3.39Å; D440-L443 HydrophobicContact CB-CB 4.08Å; D440-L443 HydrophobicContact CB-CD1 3.87Å; D440-L443 HydrophobicContact CB-CG 3.81Å; D440-L443 PolarHBondContact OD1-N 3.19Å; D440-K488 PolarHBondContact O-NZ 3.2Å
441	P	92.1	Very high	93.5	Very high	90 Å²	90	45 Å²	45	58%	0.584	25%	0.247	S	C	*	.	S	Bend	trans	-72.4	-19.7	178.9	30.9	-35.9	0	0	0	113.8
442	D	93.9	Very high	93.4	Very high	13 Å²	13	45 Å²	45	7%	0.07	25%	0.247	C	C	.	.	S	Bend	trans	-87.4	-25.9	176.8	-72.1	-2.1	0	0	0	111.9	R400 D440 S517 R518 P519 H520 R523	R400-D442 IonicContact NH1-OD1 3.99Å; R400-D442 PolarHBondContact NH1-OD1 2.85Å; D440-D442 VanDerWaalsContact C-N 3.3Å; D440-D442 PolarHBondContact O-N 2.88Å; D440-D442 WeakPolarHBondContact OD1-CA 3.45Å; D440-D442 WeakPolarHBondContact OD1-CB 3.04Å; D440-D442 PolarHBondContact OD1-N 3.39Å; D442-S517 CarbonylContact O-C 3.57Å; D442-R518 WeakPolarHBondContact O-CA 3.41Å; D442-R518 WeakPolarHBondContact O-CB 3.5Å; D442-R518 PolarHBondContact O-N 3.18Å; D442-P519 VanDerWaalsContact OD2-CA 3.29Å; D442-P519 WeakPolarHBondContact OD2-CA 3.41Å; D442-P519 WeakPolarHBondContact OD2-CB 3.23Å; D442-H520 IonicContact OD1-CD2 2.71Å; D442-H520 IonicContact OD1-NE2 3.92Å; D442-R523 IonicContact OD1-NH1 2.89Å; D442-R523 PolarHBondContact OD1-NH1 3.06Å; D442-R523 VanDerWaalsContact OD1-NH1 3.07Å; D442-R523 IonicContact OD2-CZ 3.13Å; D442-R523 IonicContact OD2-NH1 2.62Å; D442-R523 PolarHBondContact OD2-NH1 3.02Å
443	L	95.1	Very high	93.4	Very high	19 Å²	19	44.5 Å²	44.5	10%	0.099	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	138.7	175.1	-70	-179.3	0	0	0	111.9	V405 L436 L437 D440 K488 L515 I516	V405-L443 HydrophobicContact CG2-CD2 3.97Å; L436-L443 HydrophobicContact CG-CD1 4.12Å; L437-L443 HydrophobicContact CD1-CB 3.99Å; D440-L443 HydrophobicContact CB-CB 4.08Å; D440-L443 HydrophobicContact CB-CD1 3.87Å; D440-L443 HydrophobicContact CB-CG 3.81Å; D440-L443 PolarHBondContact OD1-N 3.19Å; L443-K488 WeakPolarHBondContact O-CD 3.41Å; L443-K488 WeakPolarHBondContact O-CE 3.12Å; L443-K488 PolarHBondContact O-NZ 2.99Å; L443-L515 HydrophobicContact CD2-CD1 4.39Å; L443-L515 HydrophobicContact CD2-CG 4.47Å; L443-I516 WeakPolarHBondContact CA-O 3.38Å
444	D	95	Very high	93.2	Very high	19 Å²	19	41.3 Å²	41.3	10%	0.102	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	163.5	178.4	-156	-20.9	0	0	0	110.5	Y486 K488 I516 R518	D444-Y486 WeakPolarHBondContact OD2-CB 3.37Å; D444-K488 WeakPolarHBondContact OD1-CB 3.43Å; D444-K488 PolarHBondContact OD1-N 3.25Å; D444-I516 HydrophobicContact CB-CD1 4.34Å; D444-I516 HydrophobicContact CB-CG1 4.02Å; D444-I516 PolarHBondContact N-O 3.43Å; D444-I516 WeakPolarHBondContact O-CG1 3.32Å; D444-I516 PolarHBondContact O-N 2.79Å; D444-R518 HydrophobicContact CB-CG 3.84Å; D444-R518 WeakPolarHBondContact OD2-CD 3.42Å; D444-R518 IonicContact OD2-CZ 3.14Å; D444-R518 IonicContact OD2-NE 3.76Å; D444-R518 IonicContact OD2-NH1 3.21Å; D444-R518 PolarHBondContact OD2-NH1 3.25Å
445	I	95.4	Very high	92.7	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.3	174.6	-67.7	179.1	0	0	0	109	I410 I429 L437 I487 L513 L515	I410-I445 HydrophobicContact CD1-CD1 3.81Å; I410-I445 HydrophobicContact CD1-CG1 3.91Å; I410-I445 HydrophobicContact CD1-CG2 3.99Å; I429-I445 HydrophobicContact CD1-CD1 3.48Å; I429-I445 VanDerWaalsContact CD1-CD1 3.48Å; I429-I445 HydrophobicContact CG1-CD1 4.42Å; L437-I445 HydrophobicContact CD1-CG1 4.12Å; L437-I445 HydrophobicContact CD2-CD1 3.53Å; L437-I445 HydrophobicContact CD2-CG1 3.96Å; I445-I487 HydrophobicContact CB-CG1 4.08Å; I445-I487 HydrophobicContact CG2-CD1 4.09Å; I445-I487 HydrophobicContact CG2-CG1 3.63Å; I445-I487 PolarHBondContact O-N 3.16Å; I445-L513 HydrophobicContact CG2-CD1 3.64Å; I445-L513 HydrophobicContact CG2-CD2 4.46Å; I445-L513 HydrophobicContact CG2-CG 3.97Å; I445-L515 HydrophobicContact CG1-CD1 4.47Å
446	Q	94.8	Very high	92.1	Very high	5 Å²	5	50.8 Å²	50.8	2%	0.023	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	122	-177.9	-171.5	171.6	79.2	0	0	110.9	K448 P484 L485 Y486 L513 S514 I516	Q446-K448 HydrophobicContact CG-CD 4.43Å; Q446-K448 HydrophobicContact CG-CG 4.21Å; Q446-P484 HydrophobicContact CG-CB 3.7Å; Q446-P484 HydrophobicContact CG-CG 4.08Å; Q446-P484 VanDerWaalsContact NE2-CG 3.35Å; Q446-L485 WeakPolarHBondContact CA-O 3.42Å; Q446-Y486 HydrophobicContact CG-CE1 4.42Å; Q446-L513 WeakPolarHBondContact O-CA 3.31Å; Q446-S514 PolarHBondContact N-O 3.11Å; Q446-S514 PolarHBondContact O-N 2.98Å; Q446-I516 HydrophobicContact CB-CD1 3.76Å; Q446-I516 HydrophobicContact CB-CG1 3.98Å; Q446-I516 HydrophobicContact CB-CG2 3.8Å; Q446-I516 HydrophobicContact CG-CD1 4.29Å
447	L	95.5	Very high	91.7	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	121.3	165.2	177.9	67.7	0	0	0	108.9	W461 I469 L485 L498 M512 L513	L447-W461 HydrophobicContact CD2-CH2 4.01Å; L447-W461 HydrophobicContact CG-CH2 3.97Å; L447-I469 HydrophobicContact CD2-CG2 3.8Å; L447-L485 HydrophobicContact CB-CB 4.31Å; L447-L485 HydrophobicContact CD2-CD1 4.38Å; L447-L485 PolarHBondContact N-O 3.04Å; L447-L485 PolarHBondContact O-N 2.6Å; L447-L498 HydrophobicContact CD1-CD2 3.82Å; L447-L498 HydrophobicContact CD2-CD1 3.9Å; L447-L498 HydrophobicContact CD2-CD2 4.43Å; L447-M512 WeakPolarHBondContact CA-O 3.37Å; L447-L513 HydrophobicContact CB-CD1 3.82Å; L447-L513 HydrophobicContact CD1-CD1 4.01Å; L447-L513 HydrophobicContact CG-CD1 4.49Å
448	K	92.5	Very high	91.3	Very high	29 Å²	29	52.3 Å²	52.3	13%	0.126	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	150.6	178.2	-91.8	166.9	163.7	158.5	0	111.3	Q446 P484 F511 M512	Q446-K448 HydrophobicContact CG-CD 4.43Å; Q446-K448 HydrophobicContact CG-CG 4.21Å; K448-P484 HydrophobicContact CG-CB 3.78Å; K448-F511 VanDerWaalsContact O-CA 3.32Å; K448-F511 WeakPolarHBondContact O-CA 3.49Å; K448-M512 HydrophobicContact CB-CB 4.31Å; K448-M512 PolarHBondContact N-O 3.45Å; K448-M512 PolarHBondContact O-N 3.33Å
449	C	93.3	Very high	91.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.1	163.1	-168.9	0	0	0	0	108.4	N459 N460 W461 L510 F511	C449-N459 PolarHBondContact N-OD1 3.32Å; C449-N459 CarbonylContact O-C 3.49Å; C449-N459 VanDerWaalsContact O-CA 3.27Å; C449-N459 WeakPolarHBondContact O-CA 3.4Å; C449-N459 PolarHBondContact O-OD1 2.92Å; C449-N460 CarbonylContact C-O 3.5Å; C449-N460 PolarHBondContact O-N 2.86Å; C449-W461 HydrophobicContact CB-CD2 3.78Å; C449-W461 HydrophobicContact CB-CE3 3.44Å; C449-W461 VanDerWaalsContact CB-CE3 3.44Å; C449-W461 HydrophobicContact CB-CG 4.47Å; C449-W461 HydrophobicContact CB-CH2 4.1Å; C449-W461 HydrophobicContact CB-CZ2 4.38Å; C449-W461 HydrophobicContact CB-CZ3 3.64Å; C449-L510 CarbonylContact C-O 3.55Å; C449-L510 VanDerWaalsContact CA-O 3.31Å; C449-L510 WeakPolarHBondContact CA-O 3.46Å; C449-F511 HydrophobicContact CB-CD1 3.96Å; C449-F511 HydrophobicContact CB-CE1 3.89Å; C449-F511 WeakPolarHBondContact SG-CE1 3.36Å; C449-F511 VanDerWaalsContact SG-CZ 3.52Å
450	F	92.9	Very high	90.9	Very high	7 Å²	7	49 Å²	49	3%	0.031	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	157.4	178.1	60.1	-84.5	0	0	0	111.4	P413 M457 C458 H509 L510 M512	P413-F450 HydrophobicContact CB-CZ 4.15Å; P413-F450 HydrophobicContact CG-CZ 4.37Å; F450-M457 HydrophobicContact CD1-CB 4.35Å; F450-M457 HydrophobicContact CD2-CB 3.92Å; F450-M457 HydrophobicContact CD2-CG 3.95Å; F450-M457 HydrophobicContact CE1-CB 4.48Å; F450-M457 HydrophobicContact CE2-CB 4.05Å; F450-M457 HydrophobicContact CE2-CG 3.64Å; F450-M457 HydrophobicContact CE2-SD 4.07Å; F450-M457 HydrophobicContact CG-CB 4.08Å; F450-M457 HydrophobicContact CZ-CB 4.33Å; F450-M457 HydrophobicContact CZ-CG 4.01Å; F450-M457 HydrophobicContact CZ-SD 3.88Å; F450-C458 WeakPolarHBondContact CB-O 3.43Å; F450-H509 CarbonylContact O-C 3.51Å; F450-H509 WeakPolarHBondContact O-CA 3.27Å; F450-H509 WeakPolarHBondContact O-CB 3.3Å; F450-L510 HydrophobicContact CE1-CB 4.1Å; F450-L510 HydrophobicContact CE2-CB 4.1Å; F450-L510 HydrophobicContact CE2-CD1 4.05Å; F450-L510 HydrophobicContact CZ-CB 3.82Å; F450-L510 HydrophobicContact CZ-CD1 4.49Å; F450-L510 PolarHBondContact N-O 2.82Å; F450-L510 PolarHBondContact O-N 3.14Å; F450-M512 HydrophobicContact CE1-CB 4.16Å; F450-M512 HydrophobicContact CE1-CE 4.06Å; F450-M512 HydrophobicContact CZ-CE 4.34Å
451	H	92.8	Very high	90.8	Very high	57 Å²	57	46.6 Å²	46.6	26%	0.264	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	140.4	177.4	-161.3	-100.4	0	0	0	110.9	D453 D454 S508 H509	H451-D453 VanDerWaalsContact C-N 3.27Å; H451-D453 IonicContact CE1-OD2 2.68Å; H451-D453 PolarHBondContact CE1-OD2 2.98Å; H451-D453 IonicContact ND1-OD2 3.84Å; H451-D453 PolarHBondContact ND1-OD2 3.31Å; H451-D453 PolarHBondContact O-N 2.91Å; H451-D454 HydrophobicContact CB-CB 4.33Å; H451-D454 WeakPolarHBondContact O-CB 3.38Å; H451-D454 PolarHBondContact O-N 2.71Å; H451-S508 WeakPolarHBondContact NE2-CB 3.3Å; H451-H509 AromaticContact CD2-CE1 3.99Å; H451-H509 AromaticContact CD2-ND1 3.96Å; H451-H509 AromaticContact CD2-NE2 3.74Å
452	A	91.5	Very high	90.5	Very high	29 Å²	29	42.7 Å²	42.7	24%	0.24	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-31.1	-174.3	0	0	0	0	0	114.9	D454 S508 L510	A452-D454 VanDerWaalsContact C-N 3.27Å; A452-S508 WeakPolarHBondContact CB-O 3.2Å; A452-S508 PolarHBondContact N-O 3.39Å; A452-L510 VanDerWaalsContact CA-CD1 3.48Å; A452-L510 HydrophobicContact CB-CD1 3.47Å; A452-L510 VanDerWaalsContact CB-CD1 3.47Å
453	D	91.8	Very high	89.6	Confident	131 Å²	131	48.5 Å²	48.5	70%	0.701	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-3.5	179.1	-47.7	-46.8	0	0	0	112.4	H451 R455	H451-D453 VanDerWaalsContact C-N 3.27Å; H451-D453 IonicContact CE1-OD2 2.68Å; H451-D453 PolarHBondContact CE1-OD2 2.98Å; H451-D453 IonicContact ND1-OD2 3.84Å; H451-D453 PolarHBondContact ND1-OD2 3.31Å; H451-D453 PolarHBondContact O-N 2.91Å; D453-R455 PolarHBondContact O-N 2.89Å; D453-R455 VanDerWaalsContact O-N 3.16Å
454	D	88	Confident	88.3	Confident	41 Å²	41	53.4 Å²	53.4	22%	0.219	26%	0.262	C	S	.	.			trans	-79.7	97.7	175.2	-178.5	12.9	0	0	0	111.3	H451 A452 F456 M457 C458	H451-D454 HydrophobicContact CB-CB 4.33Å; H451-D454 WeakPolarHBondContact O-CB 3.38Å; H451-D454 PolarHBondContact O-N 2.71Å; A452-D454 VanDerWaalsContact C-N 3.27Å; D454-F456 PolarHBondContact O-N 2.84Å; D454-F456 VanDerWaalsContact O-N 3.09Å; D454-F456 WeakPolarHBondContact OD1-CB 3.13Å; D454-F456 PolarHBondContact OD1-N 3.14Å; D454-M457 PolarHBondContact O-N 2.99Å; D454-C458 WeakPolarHBondContact OD2-CA 3.15Å; D454-C458 VanDerWaalsContact OD2-CB 3.26Å; D454-C458 WeakPolarHBondContact OD2-CB 3.44Å; D454-C458 PolarHBondContact OD2-N 3.21Å
455	R	83.9	Confident	86.9	Confident	201 Å²	201	52.8 Å²	52.8	76%	0.758	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-18.2	174.9	-66.5	-175.8	-78.5	-168.8	-4.9	114.1	D453	D453-R455 PolarHBondContact O-N 2.89Å; D453-R455 VanDerWaalsContact O-N 3.16Å
456	F	80.5	Confident	86.2	Confident	122 Å²	122	55 Å²	55	54%	0.535	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-7	177.6	-57.5	-69.4	0	0	0	113.7	D454 C458 H607	D454-F456 PolarHBondContact O-N 2.84Å; D454-F456 VanDerWaalsContact O-N 3.09Å; D454-F456 WeakPolarHBondContact OD1-CB 3.13Å; D454-F456 PolarHBondContact OD1-N 3.14Å; F456-C458 PolarHBondContact O-N 2.81Å; F456-H607 AromaticContact CD1-ND1 3.93Å
457	M	84.5	Confident	86	Confident	80 Å²	80	56.1 Å²	56.1	39%	0.394	28%	0.281	S	S	.	.			trans	49.9	37.9	-175.1	-51.8	-175.1	-176.7	0	0	112.7	F450 D454 M512	F450-M457 HydrophobicContact CD1-CB 4.35Å; F450-M457 HydrophobicContact CD2-CB 3.92Å; F450-M457 HydrophobicContact CD2-CG 3.95Å; F450-M457 HydrophobicContact CE1-CB 4.48Å; F450-M457 HydrophobicContact CE2-CB 4.05Å; F450-M457 HydrophobicContact CE2-CG 3.64Å; F450-M457 HydrophobicContact CE2-SD 4.07Å; F450-M457 HydrophobicContact CG-CB 4.08Å; F450-M457 HydrophobicContact CZ-CB 4.33Å; F450-M457 HydrophobicContact CZ-CG 4.01Å; F450-M457 HydrophobicContact CZ-SD 3.88Å; D454-M457 PolarHBondContact O-N 2.99Å; M457-M512 HydrophobicContact SD-CE 3.97Å
458	C	84.2	Confident	85.8	Confident	46 Å²	46	61.7 Å²	61.7	31%	0.311	31%	0.307	S	S	.	.			trans	-64.4	138.3	175.6	-70.5	0	0	0	0	109.8	F450 D454 F456 N460	F450-C458 WeakPolarHBondContact CB-O 3.43Å; D454-C458 WeakPolarHBondContact OD2-CA 3.15Å; D454-C458 VanDerWaalsContact OD2-CB 3.26Å; D454-C458 WeakPolarHBondContact OD2-CB 3.44Å; D454-C458 PolarHBondContact OD2-N 3.21Å; F456-C458 PolarHBondContact O-N 2.81Å; C458-N460 PolarHBondContact O-N 2.71Å
459	N	88.9	Confident	85.9	Confident	14 Å²	14	60.4 Å²	60.4	8%	0.075	30%	0.302	C	S	.	.			trans	-66.7	124.1	-174.9	-172.1	101.2	0	0	0	110	C449 W461 I481 D482 R483 P484	C449-N459 PolarHBondContact N-OD1 3.32Å; C449-N459 CarbonylContact O-C 3.49Å; C449-N459 VanDerWaalsContact O-CA 3.27Å; C449-N459 WeakPolarHBondContact O-CA 3.4Å; C449-N459 PolarHBondContact O-OD1 2.92Å; N459-W461 PolarHBondContact ND2-NE1 2.87Å; N459-W461 VanDerWaalsContact ND2-NE1 3.11Å; N459-I481 PolarHBondContact ND2-O 3.23Å; N459-D482 WeakPolarHBondContact O-CA 3.4Å; N459-R483 PolarHBondContact ND2-O 2.98Å; N459-R483 VanDerWaalsContact ND2-O 3.16Å; N459-P484 WeakPolarHBondContact OD1-CA 3.49Å
460	N	89.4	Confident	86	Confident	70 Å²	70	61.8 Å²	61.8	37%	0.374	31%	0.31	S	S	.	.			trans	-142.3	102.9	-178.6	-167.5	-96.5	0	0	0	108.2	C449 C458 I481 H509	C449-N460 CarbonylContact C-O 3.5Å; C449-N460 PolarHBondContact O-N 2.86Å; C458-N460 PolarHBondContact O-N 2.71Å; N460-I481 WeakPolarHBondContact CA-O 3.32Å; N460-H509 PolarHBondContact O-CD2 3.11Å
461	W	90.3	Very high	86.2	Confident	3 Å²	3	61.4 Å²	61.4	1%	0.011	31%	0.308	C	S	.	.			trans	-81.3	138.1	172.2	-66.2	104	0	0	0	110.9	L447 C449 N459 H463 I467 I469 V478 I481 R483 L485 F511	L447-W461 HydrophobicContact CD2-CH2 4.01Å; L447-W461 HydrophobicContact CG-CH2 3.97Å; C449-W461 HydrophobicContact CB-CD2 3.78Å; C449-W461 HydrophobicContact CB-CE3 3.44Å; C449-W461 VanDerWaalsContact CB-CE3 3.44Å; C449-W461 HydrophobicContact CB-CG 4.47Å; C449-W461 HydrophobicContact CB-CH2 4.1Å; C449-W461 HydrophobicContact CB-CZ2 4.38Å; C449-W461 HydrophobicContact CB-CZ3 3.64Å; N459-W461 PolarHBondContact ND2-NE1 2.87Å; N459-W461 VanDerWaalsContact ND2-NE1 3.11Å; W461-H463 PolarHBondContact O-N 2.74Å; W461-I467 HydrophobicContact CE3-CD1 4.19Å; W461-I467 HydrophobicContact CZ3-CD1 4.31Å; W461-I469 HydrophobicContact CH2-CD1 4.41Å; W461-I469 HydrophobicContact CH2-CG1 4.37Å; W461-I469 HydrophobicContact CZ3-CD1 3.86Å; W461-I469 HydrophobicContact CZ3-CG1 4.05Å; W461-V478 HydrophobicContact CB-CG1 3.77Å; W461-V478 HydrophobicContact CD2-CG1 4.03Å; W461-V478 HydrophobicContact CD2-CG2 3.85Å; W461-V478 HydrophobicContact CE3-CG2 3.98Å; W461-V478 HydrophobicContact CG-CG1 3.5Å; W461-V478 HydrophobicContact CG-CG2 4.22Å; W461-V478 HydrophobicContact CZ3-CG2 4.36Å; W461-I481 VanDerWaalsContact CD1-O 3.31Å; W461-I481 PolarHBondContact N-O 3.46Å; W461-I481 WeakPolarHBondContact O-CG2 3.21Å; W461-R483 PolarHBondContact NE1-O 3.17Å; W461-L485 HydrophobicContact CH2-CD1 3.8Å; W461-L485 HydrophobicContact CH2-CG 4.2Å; W461-L485 HydrophobicContact CZ2-CB 4.19Å; W461-L485 HydrophobicContact CZ2-CD1 3.75Å; W461-L485 HydrophobicContact CZ2-CG 3.63Å; W461-F511 HydrophobicContact CE3-CE1 4.43Å; W461-F511 HydrophobicContact CZ3-CD1 4.26Å; W461-F511 AromaticContact CZ3-CE1 3.93Å; W461-F511 HydrophobicContact CZ3-CE1 3.93Å
462	P	86.1	Confident	86.4	Confident	8 Å²	8	60.4 Å²	60.4	5%	0.052	31%	0.305	C	S	.	.			trans	-73.2	85.5	-175.7	29.8	-36.7	0	0	0	111.9	N464 A465 I467 C506	P462-N464 VanDerWaalsContact C-N 3.32Å; P462-N464 PolarHBondContact O-N 2.75Å; P462-A465 HydrophobicContact CB-CB 4Å; P462-A465 HydrophobicContact CG-CB 4.33Å; P462-A465 PolarHBondContact O-N 2.95Å; P462-A465 VanDerWaalsContact O-N 3.07Å; P462-I467 HydrophobicContact CG-CB 4.32Å; P462-I467 HydrophobicContact CG-CD1 3.91Å; P462-I467 HydrophobicContact CG-CG2 4.37Å; P462-C506 HydrophobicContact CB-CB 4Å; P462-C506 HydrophobicContact CG-CB 3.82Å
463	H	74.5	Confident	86.5	Confident	136 Å²	136	61.8 Å²	61.8	63%	0.63	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-48.2	-47.9	-176.2	176.1	-99.4	0	0	0	113.6	W461 A465 I481	W461-H463 PolarHBondContact O-N 2.74Å; H463-A465 VanDerWaalsContact C-N 3.28Å; H463-A465 PolarHBondContact O-N 2.72Å; H463-I481 HydrophobicContact CB-CD1 4.03Å
464	N	67.7	Low	86.7	Confident	122 Å²	122	57.3 Å²	57.3	65%	0.652	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-74.5	-15.6	-174.2	-62.5	1.6	0	0	0	113.5	P462 S466 Q504	P462-N464 VanDerWaalsContact C-N 3.32Å; P462-N464 PolarHBondContact O-N 2.75Å; N464-S466 VanDerWaalsContact C-N 3.34Å; N464-S466 PolarHBondContact O-N 3.41Å; N464-Q504 PolarHBondContact O-NE2 3.2Å; N464-Q504 VanDerWaalsContact O-NE2 3.12Å; N464-Q504 PolarHBondContact O-OE1 2.85Å
465	A	66.1	Low	87	Confident	5 Å²	5	59.1 Å²	59.1	4%	0.041	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-87.4	0.9	-174.3	0	0	0	0	0	114.6	P462 H463 I467 Q503 Q504	P462-A465 HydrophobicContact CB-CB 4Å; P462-A465 HydrophobicContact CG-CB 4.33Å; P462-A465 PolarHBondContact O-N 2.95Å; P462-A465 VanDerWaalsContact O-N 3.07Å; H463-A465 VanDerWaalsContact C-N 3.28Å; H463-A465 PolarHBondContact O-N 2.72Å; A465-I467 PolarHBondContact O-N 3.22Å; A465-Q503 PolarHBondContact O-N 2.86Å; A465-Q504 HydrophobicContact CB-CB 4.06Å
466	S	81.5	Confident	87.4	Confident	50 Å²	50	50.1 Å²	50.1	35%	0.35	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	45	55.8	-175.4	75.3	0	0	0	0	112.8	N464 Q503	N464-S466 VanDerWaalsContact C-N 3.34Å; N464-S466 PolarHBondContact O-N 3.41Å; S466-Q503 WeakPolarHBondContact OG-CB 3.38Å; S466-Q503 WeakPolarHBondContact OG-CG 3.4Å; S466-Q503 PolarHBondContact OG-OE1 3.07Å
467	I	89.8	Confident	87.8	Confident	28 Å²	28	50 Å²	50	14%	0.144	28%	0.284	C	S	.	.			trans	-66.8	134.7	-174.2	-170.6	161.9	0	0	0	112.4	W461 P462 A465 I469 V478 V500 A501 V502 F511	W461-I467 HydrophobicContact CE3-CD1 4.19Å; W461-I467 HydrophobicContact CZ3-CD1 4.31Å; P462-I467 HydrophobicContact CG-CB 4.32Å; P462-I467 HydrophobicContact CG-CD1 3.91Å; P462-I467 HydrophobicContact CG-CG2 4.37Å; A465-I467 PolarHBondContact O-N 3.22Å; I467-I469 HydrophobicContact CD1-CD1 3.96Å; I467-I469 HydrophobicContact CG1-CD1 3.96Å; I467-I469 HydrophobicContact CG1-CG1 4.48Å; I467-V478 HydrophobicContact CG2-CG2 4.42Å; I467-V500 HydrophobicContact CD1-CG1 3.76Å; I467-V500 HydrophobicContact CG1-CG1 4.03Å; I467-A501 WeakPolarHBondContact CA-O 3.31Å; I467-V502 HydrophobicContact CB-CG1 4.08Å; I467-V502 HydrophobicContact CD1-CG1 4.1Å; I467-V502 HydrophobicContact CG1-CG1 3.84Å; I467-F511 HydrophobicContact CD1-CE1 3.65Å; I467-F511 HydrophobicContact CD1-CZ 3.74Å
468	Q	91.8	Very high	87.9	Confident	117 Å²	117	48 Å²	48	55%	0.547	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124.1	171.8	-60.3	-178.4	4.5	0	0	108.9	A501	Q468-A501 HydrophobicContact CB-CB 4.31Å; Q468-A501 PolarHBondContact N-O 3.06Å; Q468-A501 PolarHBondContact O-N 2.76Å
469	I	94.5	Very high	87.9	Confident	2 Å²	2	52 Å²	52	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.4	175.9	-57.6	-59.9	0	0	0	108	L447 W461 I467 V471 P475 V476 V478 L485 L498 V500	L447-I469 HydrophobicContact CD2-CG2 3.8Å; W461-I469 HydrophobicContact CH2-CD1 4.41Å; W461-I469 HydrophobicContact CH2-CG1 4.37Å; W461-I469 HydrophobicContact CZ3-CD1 3.86Å; W461-I469 HydrophobicContact CZ3-CG1 4.05Å; I467-I469 HydrophobicContact CD1-CD1 3.96Å; I467-I469 HydrophobicContact CG1-CD1 3.96Å; I467-I469 HydrophobicContact CG1-CG1 4.48Å; I469-V471 HydrophobicContact CG2-CG2 4.33Å; I469-P475 CarbonylContact O-C 3.58Å; I469-P475 WeakPolarHBondContact O-CA 3.46Å; I469-V476 HydrophobicContact CB-CB 4.19Å; I469-V476 HydrophobicContact CG2-CB 4.08Å; I469-V476 HydrophobicContact CG2-CG2 4.23Å; I469-V476 PolarHBondContact O-N 2.91Å; I469-V478 HydrophobicContact CG1-CG2 4.29Å; I469-L485 HydrophobicContact CB-CD1 4.25Å; I469-L485 HydrophobicContact CG1-CD1 4.03Å; I469-L485 HydrophobicContact CG2-CD1 4.18Å; I469-L498 HydrophobicContact CG2-CD1 3.95Å; I469-V500 HydrophobicContact CD1-CB 4.33Å; I469-V500 HydrophobicContact CD1-CG1 3.87Å; I469-V500 HydrophobicContact CD1-CG2 3.9Å
470	V	96.1	Very high	87.6	Confident	28 Å²	28	55.2 Å²	55.2	17%	0.17	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	123.6	175.9	175.1	0	0	0	0	108.8	G473 T474 P475 Q499	V470-G473 VanDerWaalsContact CG1-C 3.5Å; V470-T474 CarbonylContact C-O 3.54Å; V470-T474 VanDerWaalsContact CA-O 3.32Å; V470-T474 WeakPolarHBondContact CA-O 3.33Å; V470-P475 HydrophobicContact CG2-CB 4.29Å; V470-Q499 HydrophobicContact CB-CB 4.07Å; V470-Q499 PolarHBondContact N-O 2.7Å; V470-Q499 PolarHBondContact O-N 3.16Å
471	V	96.8	Very high	87.4	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.6	179.6	179.8	0	0	0	0	108.8	I469 G473 T474 V476 I487 L490 T497 L498	I469-V471 HydrophobicContact CG2-CG2 4.33Å; V471-G473 PolarHBondContact O-N 3.18Å; V471-T474 PolarHBondContact N-O 3.26Å; V471-T474 WeakPolarHBondContact O-CB 3.27Å; V471-T474 PolarHBondContact O-N 3.28Å; V471-V476 HydrophobicContact CB-CG2 4.4Å; V471-V476 HydrophobicContact CG2-CG2 3.99Å; V471-I487 HydrophobicContact CG1-CD1 4.19Å; V471-I487 HydrophobicContact CG2-CD1 4.02Å; V471-I487 HydrophobicContact CG2-CG2 4.35Å; V471-L490 HydrophobicContact CB-CB 4.07Å; V471-L490 HydrophobicContact CB-CD1 4.07Å; V471-L490 HydrophobicContact CG1-CB 3.76Å; V471-L490 HydrophobicContact CG2-CD1 4.41Å; V471-T497 WeakPolarHBondContact CA-O 3.48Å; V471-L498 HydrophobicContact CG2-CD1 4.09Å
472	N	96.1	Very high	87.2	Confident	36 Å²	36	59.9 Å²	59.9	19%	0.193	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	29.3	-177.6	-66.7	-33.2	0	0	0	114.5	L490 N496 T497	N472-L490 PolarHBondContact ND2-O 3.08Å; N472-N496 PolarHBondContact ND2-OD1 3.06Å; N472-N496 VanDerWaalsContact OD1-CA 3.28Å; N472-N496 WeakPolarHBondContact OD1-CA 3.31Å; N472-T497 PolarHBondContact N-O 2.96Å; N472-T497 PolarHBondContact OD1-N 2.69Å
473	G	94.3	Very high	87.2	Confident	58 Å²	58	61.2 Å²	61.2	60%	0.598	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.4	-6.8	-176.3	0	0	0	0	0	115.3	V470 V471	V470-G473 VanDerWaalsContact CG1-C 3.5Å; V471-G473 PolarHBondContact O-N 3.18Å
474	T	96.1	Very high	88	Confident	37 Å²	37	55.3 Å²	55.3	23%	0.227	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.4	176	-59.4	0	0	0	0	111	M390 V470 V471 L490	M390-T474 HydrophobicContact CB-CG2 4.44Å; M390-T474 HydrophobicContact CE-CG2 4.27Å; M390-T474 HydrophobicContact CG-CG2 4.4Å; M390-T474 HydrophobicContact SD-CG2 3.46Å; M390-T474 WeakPolarHBondContact SD-CG2 3.2Å; V470-T474 CarbonylContact C-O 3.54Å; V470-T474 VanDerWaalsContact CA-O 3.32Å; V470-T474 WeakPolarHBondContact CA-O 3.33Å; V471-T474 PolarHBondContact N-O 3.26Å; V471-T474 WeakPolarHBondContact O-CB 3.27Å; V471-T474 PolarHBondContact O-N 3.28Å; T474-L490 HydrophobicContact CG2-CD2 3.84Å
475	P	94.2	Very high	89.2	Confident	79 Å²	79	49.9 Å²	49.9	51%	0.513	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	141.2	174.7	29.6	-34.3	0	0	0	112.1	I469 V470	I469-P475 CarbonylContact O-C 3.58Å; I469-P475 WeakPolarHBondContact O-CA 3.46Å; V470-P475 HydrophobicContact CG2-CB 4.29Å
476	V	92.1	Very high	90.5	Very high	11 Å²	11	50.9 Å²	50.9	7%	0.067	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	123.7	-179.7	-165.5	0	0	0	0	109.1	I469 V471 L485 L490	I469-V476 HydrophobicContact CB-CB 4.19Å; I469-V476 HydrophobicContact CG2-CB 4.08Å; I469-V476 HydrophobicContact CG2-CG2 4.23Å; I469-V476 PolarHBondContact O-N 2.91Å; V471-V476 HydrophobicContact CB-CG2 4.4Å; V471-V476 HydrophobicContact CG2-CG2 3.99Å; V476-L485 HydrophobicContact CB-CD1 4.32Å; V476-L485 HydrophobicContact CG1-CD1 3.79Å; V476-L485 HydrophobicContact CG1-CD2 3.92Å; V476-L485 HydrophobicContact CG1-CG 4.33Å; V476-L490 HydrophobicContact CG2-CD1 3.37Å
477	I	88.4	Confident	91.2	Very high	119 Å²	119	48.6 Å²	48.6	61%	0.61	26%	0.259	S	S	*	.			trans	-89.7	115.1	-174.6	-58.2	174.6	0	0	0	109.4	R479	I477-R479 HydrophobicContact CG2-CG 4.12Å; I477-R479 PolarHBondContact O-N 2.92Å
478	V	87.6	Confident	91.4	Very high	38 Å²	38	48.6 Å²	48.6	23%	0.23	26%	0.258	C	S	.	.			trans	-68.6	99.2	165.9	177.7	0	0	0	0	108.3	W461 I467 I469 L485	W461-V478 HydrophobicContact CB-CG1 3.77Å; W461-V478 HydrophobicContact CD2-CG1 4.03Å; W461-V478 HydrophobicContact CD2-CG2 3.85Å; W461-V478 HydrophobicContact CE3-CG2 3.98Å; W461-V478 HydrophobicContact CG-CG1 3.5Å; W461-V478 HydrophobicContact CG-CG2 4.22Å; W461-V478 HydrophobicContact CZ3-CG2 4.36Å; I467-V478 HydrophobicContact CG2-CG2 4.42Å; I469-V478 HydrophobicContact CG1-CG2 4.29Å; V478-L485 HydrophobicContact CG2-CD1 3.96Å; V478-L485 HydrophobicContact CG2-CG 4.49Å
479	R	83	Confident	91.5	Very high	130 Å²	130	48.6 Å²	48.6	49%	0.491	26%	0.262	S	S	.	.			trans	-83.1	-29.9	178.7	-62.6	-174.9	-172	167.6	4.6	113.6	N394 I477	N394-R479 PolarHBondContact OD1-NH1 3.31Å; I477-R479 HydrophobicContact CG2-CG 4.12Å; I477-R479 PolarHBondContact O-N 2.92Å
480	Q	82.5	Confident	91.5	Very high	83 Å²	83	49.4 Å²	49.4	39%	0.388	27%	0.266	S	S	.	.			trans	-138.6	130.6	-170.9	-82.4	167.5	-25.6	0	0	108.6	D482 R483	Q480-D482 VanDerWaalsContact C-N 3.34Å; Q480-R483 HydrophobicContact CB-CB 4.01Å; Q480-R483 HydrophobicContact CB-CG 4.12Å
481	I	86.5	Confident	91.4	Very high	69 Å²	69	48.4 Å²	48.4	35%	0.354	26%	0.261	S	S	.	.	S	Bend	trans	-73.9	-32.5	-171.5	-64.1	162	0	0	0	111.1	N459 N460 W461 H463	N459-I481 PolarHBondContact ND2-O 3.23Å; N460-I481 WeakPolarHBondContact CA-O 3.32Å; W461-I481 VanDerWaalsContact CD1-O 3.31Å; W461-I481 PolarHBondContact N-O 3.46Å; W461-I481 WeakPolarHBondContact O-CG2 3.21Å; H463-I481 HydrophobicContact CB-CD1 4.03Å
482	D	85.3	Confident	91.3	Very high	101 Å²	101	53.5 Å²	53.5	54%	0.54	28%	0.284	S	S	.	.	S	Bend	trans	-86.5	-14.3	-177.7	60.7	-50.8	0	0	0	113.8	N459 Q480	N459-D482 WeakPolarHBondContact O-CA 3.4Å; Q480-D482 VanDerWaalsContact C-N 3.34Å
483	R	87	Confident	91.3	Very high	36 Å²	36	54.7 Å²	54.7	14%	0.136	29%	0.294	C	S	.	.	S	Bend	trans	-103.5	138.8	-179.9	-66.4	-153.9	-175.2	152.6	-17.9	113.1	D396 N459 W461 Q480 D604	D396-R483 IonicContact OD1-NH1 3.98Å; D396-R483 IonicContact OD1-NH2 3.63Å; N459-R483 PolarHBondContact ND2-O 2.98Å; N459-R483 VanDerWaalsContact ND2-O 3.16Å; W461-R483 PolarHBondContact NE1-O 3.17Å; Q480-R483 HydrophobicContact CB-CB 4.01Å; Q480-R483 HydrophobicContact CB-CG 4.12Å; R483-D604 HydrophobicContact CG-CB 4.39Å; R483-D604 IonicContact CZ-OD1 3.62Å; R483-D604 IonicContact CZ-OD2 2.99Å; R483-D604 VanDerWaalsContact CZ-OD2 3.27Å; R483-D604 IonicContact NE-OD1 3.57Å; R483-D604 PolarHBondContact NE-OD1 2.9Å; R483-D604 IonicContact NE-OD2 3.27Å; R483-D604 PolarHBondContact NE-OD2 3.44Å; R483-D604 VanDerWaalsContact NE-OD2 3.14Å; R483-D604 IonicContact NH2-OD1 3.65Å; R483-D604 IonicContact NH2-OD2 2.71Å; R483-D604 PolarHBondContact NH2-OD2 2.82Å
484	P	91.3	Very high	91.3	Very high	12 Å²	12	56 Å²	56	8%	0.078	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-72.2	165.1	172.8	33.8	-36.4	0	0	0	111.6	Q446 K448 N459 Y486	Q446-P484 HydrophobicContact CG-CB 3.7Å; Q446-P484 HydrophobicContact CG-CG 4.08Å; Q446-P484 VanDerWaalsContact NE2-CG 3.35Å; K448-P484 HydrophobicContact CG-CB 3.78Å; N459-P484 WeakPolarHBondContact OD1-CA 3.49Å; P484-Y486 HydrophobicContact CG-CE1 4.32Å
485	L	93.3	Very high	91.3	Very high	9 Å²	9	60.1 Å²	60.1	5%	0.047	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	136.6	175.1	-70	176.3	0	0	0	111.3	Q446 L447 W461 I469 V476 V478 I487	Q446-L485 WeakPolarHBondContact CA-O 3.42Å; L447-L485 HydrophobicContact CB-CB 4.31Å; L447-L485 HydrophobicContact CD2-CD1 4.38Å; L447-L485 PolarHBondContact N-O 3.04Å; L447-L485 PolarHBondContact O-N 2.6Å; W461-L485 HydrophobicContact CH2-CD1 3.8Å; W461-L485 HydrophobicContact CH2-CG 4.2Å; W461-L485 HydrophobicContact CZ2-CB 4.19Å; W461-L485 HydrophobicContact CZ2-CD1 3.75Å; W461-L485 HydrophobicContact CZ2-CG 3.63Å; I469-L485 HydrophobicContact CB-CD1 4.25Å; I469-L485 HydrophobicContact CG1-CD1 4.03Å; I469-L485 HydrophobicContact CG2-CD1 4.18Å; V476-L485 HydrophobicContact CB-CD1 4.32Å; V476-L485 HydrophobicContact CG1-CD1 3.79Å; V476-L485 HydrophobicContact CG1-CD2 3.92Å; V476-L485 HydrophobicContact CG1-CG 4.33Å; V478-L485 HydrophobicContact CG2-CD1 3.96Å; V478-L485 HydrophobicContact CG2-CG 4.49Å; L485-I487 HydrophobicContact CB-CG2 4.28Å
486	Y	93.3	Very high	91.5	Very high	26 Å²	26	56.4 Å²	56.4	10%	0.102	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	117.5	176.1	-58	-64	0	0	0	110.4	Q392 D395 S402 D444 Q446 P484 I516 R518	Q392-Y486 PolarHBondContact NE2-O 2.86Å; D395-Y486 VanDerWaalsContact OD2-CD2 3.3Å; D395-Y486 WeakPolarHBondContact OD2-CD2 3.3Å; D395-Y486 WeakPolarHBondContact OD2-CE2 3.49Å; S402-Y486 PolarHBondContact OG-OH 3.12Å; D444-Y486 WeakPolarHBondContact OD2-CB 3.37Å; Q446-Y486 HydrophobicContact CG-CE1 4.42Å; P484-Y486 HydrophobicContact CG-CE1 4.32Å; Y486-I516 HydrophobicContact CD1-CD1 3.93Å; Y486-I516 HydrophobicContact CE1-CD1 3.55Å; Y486-R518 VanDerWaalsContact CE2-CZ 3.49Å; Y486-R518 VanDerWaalsContact CE2-NH2 3.32Å
487	I	94.9	Very high	91.7	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	28%	0.284	C	S	.	.			trans	-123.6	7	-165.3	72.9	164.4	0	0	0	115.2	F427 I445 V471 L485 N489 L490 C491 L513	F427-I487 HydrophobicContact CZ-CD1 4.4Å; I445-I487 HydrophobicContact CB-CG1 4.08Å; I445-I487 HydrophobicContact CG2-CD1 4.09Å; I445-I487 HydrophobicContact CG2-CG1 3.63Å; I445-I487 PolarHBondContact O-N 3.16Å; V471-I487 HydrophobicContact CG1-CD1 4.19Å; V471-I487 HydrophobicContact CG2-CD1 4.02Å; V471-I487 HydrophobicContact CG2-CG2 4.35Å; L485-I487 HydrophobicContact CB-CG2 4.28Å; I487-N489 VanDerWaalsContact C-N 3.26Å; I487-N489 PolarHBondContact O-N 3.46Å; I487-N489 VanDerWaalsContact O-N 3.16Å; I487-L490 HydrophobicContact CB-CD1 4.32Å; I487-L490 HydrophobicContact CG2-CD1 4.4Å; I487-L490 WeakPolarHBondContact O-CB 3.47Å; I487-L490 PolarHBondContact O-N 3.46Å; I487-C491 PolarHBondContact O-N 2.89Å; I487-L513 HydrophobicContact CD1-CD1 3.72Å; I487-L513 HydrophobicContact CG1-CD1 4.37Å
488	K	93.9	Very high	92.1	Very high	28 Å²	28	51.6 Å²	51.6	12%	0.122	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-44.8	-48.5	177.1	162.4	171	159.9	168.8	0	113.3	L437 D440 L443 D444 L490 C491	L437-K488 HydrophobicContact CD1-CB 4.48Å; L437-K488 HydrophobicContact CD1-CD 3.81Å; L437-K488 HydrophobicContact CD1-CG 4.16Å; L437-K488 HydrophobicContact CD2-CG 4.25Å; L437-K488 HydrophobicContact CG-CD 3.99Å; L437-K488 HydrophobicContact CG-CG 4.01Å; L437-K488 WeakPolarHBondContact O-CE 3.09Å; L437-K488 PolarHBondContact O-NZ 2.76Å; D440-K488 PolarHBondContact O-NZ 3.2Å; L443-K488 WeakPolarHBondContact O-CD 3.41Å; L443-K488 WeakPolarHBondContact O-CE 3.12Å; L443-K488 PolarHBondContact O-NZ 2.99Å; D444-K488 WeakPolarHBondContact OD1-CB 3.43Å; D444-K488 PolarHBondContact OD1-N 3.25Å; K488-L490 PolarHBondContact O-N 3.37Å; K488-L490 VanDerWaalsContact O-N 3.11Å; K488-C491 PolarHBondContact O-N 3.39Å; K488-C491 VanDerWaalsContact O-N 3.16Å
489	N	93.4	Very high	92.5	Very high	117 Å²	117	52.6 Å²	52.6	63%	0.626	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-71.5	-2.6	-177.3	-60.9	-6.7	0	0	0	114.4	I487	I487-N489 VanDerWaalsContact C-N 3.26Å; I487-N489 PolarHBondContact O-N 3.46Å; I487-N489 VanDerWaalsContact O-N 3.16Å
490	L	94.9	Very high	93	Very high	19 Å²	19	46.4 Å²	46.4	10%	0.099	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-107.2	-14.6	176.6	-53.1	-179.3	0	0	0	112.1	M390 V471 N472 T474 V476 I487 K488	M390-L490 HydrophobicContact CE-CD2 3.61Å; V471-L490 HydrophobicContact CB-CB 4.07Å; V471-L490 HydrophobicContact CB-CD1 4.07Å; V471-L490 HydrophobicContact CG1-CB 3.76Å; V471-L490 HydrophobicContact CG2-CD1 4.41Å; N472-L490 PolarHBondContact ND2-O 3.08Å; T474-L490 HydrophobicContact CG2-CD2 3.84Å; V476-L490 HydrophobicContact CG2-CD1 3.37Å; I487-L490 HydrophobicContact CB-CD1 4.32Å; I487-L490 HydrophobicContact CG2-CD1 4.4Å; I487-L490 WeakPolarHBondContact O-CB 3.47Å; I487-L490 PolarHBondContact O-N 3.46Å; K488-L490 PolarHBondContact O-N 3.37Å; K488-L490 VanDerWaalsContact O-N 3.11Å
491	C	95.1	Very high	93.5	Very high	8 Å²	8	43.5 Å²	43.5	5%	0.054	22%	0.224	C	C	.	.			trans	-76.6	160.2	179.9	-70.6	0	0	0	0	112.3	I429 F434 I487 K488 N496	I429-C491 HydrophobicContact CD1-CB 3.78Å; F434-C491 HydrophobicContact CE2-CB 4.18Å; F434-C491 WeakPolarHBondContact CE2-O 3.04Å; I487-C491 PolarHBondContact O-N 2.89Å; K488-C491 PolarHBondContact O-N 3.39Å; K488-C491 VanDerWaalsContact O-N 3.16Å; C491-N496 VanDerWaalsContact CA-OD1 3.27Å; C491-N496 WeakPolarHBondContact CA-OD1 3.09Å
492	Q	94.5	Very high	93.8	Very high	106 Å²	106	41 Å²	41	50%	0.495	21%	0.211	S	C	.	.			trans	-132.6	157.2	178.5	-65.3	-179.2	25.1	0	0	109.6	N496	Q492-N496 PolarHBondContact N-OD1 3.31Å; Q492-N496 PolarHBondContact O-ND2 3.31Å; Q492-N496 PolarHBondContact O-OD1 2.86Å
493	P	95	Very high	93.8	Very high	61 Å²	61	43.7 Å²	43.7	40%	0.396	22%	0.221	S	C	.	.	S	Bend	trans	-66.6	141.5	173.6	27.9	-34	0	0	0	110.9	F434	F434-P493 HydrophobicContact CB-CB 4.09Å; F434-P493 HydrophobicContact CD1-CB 3.9Å; F434-P493 HydrophobicContact CD1-CG 4.17Å; F434-P493 HydrophobicContact CE1-CG 4.39Å; F434-P493 HydrophobicContact CG-CB 3.97Å
494	N	94.9	Very high	93.8	Very high	85 Å²	85	47.3 Å²	47.3	46%	0.455	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	67.7	-115.1	-172.3	-47.9	-77.5	0	0	0	113	F428 I429 N496	F428-N494 VanDerWaalsContact CA-O 3.3Å; F428-N494 WeakPolarHBondContact CA-O 3.45Å; I429-N494 PolarHBondContact N-O 2.92Å; I429-N494 WeakPolarHBondContact O-CA 3.24Å; I429-N494 PolarHBondContact O-N 2.78Å; N494-N496 PolarHBondContact O-ND2 2.91Å
495	K	96.4	Very high	93.6	Very high	125 Å²	125	50.1 Å²	50.1	54%	0.543	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	128	-167.2	-175.1	-179.9	175	177.2	0	112.1	T426 F428	T426-K495 HydrophobicContact CG2-CD 4.22Å; T426-K495 HydrophobicContact CG2-CG 3.81Å; F428-K495 HydrophobicContact CD1-CB 4.12Å; F428-K495 HydrophobicContact CE1-CB 3.75Å; F428-K495 HydrophobicContact CE1-CG 3.95Å; F428-K495 HydrophobicContact CZ-CG 4.28Å
496	N	97.6	Very high	93.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	153.2	173.6	-68.3	-94.5	0	0	0	110.9	T426 F427 N472 C491 Q492 N494	T426-N496 WeakPolarHBondContact CA-O 3.44Å; F427-N496 HydrophobicContact CD1-CB 3.86Å; F427-N496 HydrophobicContact CD2-CB 3.79Å; F427-N496 HydrophobicContact CE1-CB 3.53Å; F427-N496 HydrophobicContact CE2-CB 3.47Å; F427-N496 VanDerWaalsContact CE2-CB 3.47Å; F427-N496 HydrophobicContact CG-CB 3.98Å; F427-N496 HydrophobicContact CZ-CB 3.34Å; F427-N496 PolarHBondContact N-O 2.92Å; F427-N496 PolarHBondContact O-N 2.84Å; N472-N496 PolarHBondContact ND2-OD1 3.06Å; N472-N496 VanDerWaalsContact OD1-CA 3.28Å; N472-N496 WeakPolarHBondContact OD1-CA 3.31Å; C491-N496 VanDerWaalsContact CA-OD1 3.27Å; C491-N496 WeakPolarHBondContact CA-OD1 3.09Å; Q492-N496 PolarHBondContact N-OD1 3.31Å; Q492-N496 PolarHBondContact O-ND2 3.31Å; Q492-N496 PolarHBondContact O-OD1 2.86Å; N494-N496 PolarHBondContact O-ND2 2.91Å
497	T	97.4	Very high	93	Very high	30 Å²	30	49.8 Å²	49.8	18%	0.184	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	133.9	172	56.2	0	0	0	0	111.7	I425 V471 N472	I425-T497 WeakPolarHBondContact O-CA 3.36Å; V471-T497 WeakPolarHBondContact CA-O 3.48Å; N472-T497 PolarHBondContact N-O 2.96Å; N472-T497 PolarHBondContact OD1-N 2.69Å
498	L	97.2	Very high	92.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	117.8	168	170	62.6	0	0	0	107.5	F414 I425 F427 L447 I469 V471 V500	F414-L498 HydrophobicContact CZ-CD2 4.06Å; I425-L498 HydrophobicContact CB-CB 4.48Å; I425-L498 PolarHBondContact N-O 2.92Å; I425-L498 PolarHBondContact O-N 3Å; F427-L498 HydrophobicContact CD1-CB 4.27Å; F427-L498 HydrophobicContact CE1-CB 3.95Å; L447-L498 HydrophobicContact CD1-CD2 3.82Å; L447-L498 HydrophobicContact CD2-CD1 3.9Å; L447-L498 HydrophobicContact CD2-CD2 4.43Å; I469-L498 HydrophobicContact CG2-CD1 3.95Å; V471-L498 HydrophobicContact CG2-CD1 4.09Å; L498-V500 HydrophobicContact CD1-CG2 4.19Å; L498-V500 HydrophobicContact CD2-CG2 4.47Å; L498-V500 HydrophobicContact CG-CG2 4.11Å
499	Q	95.6	Very high	92.7	Very high	59 Å²	59	52 Å²	52	28%	0.276	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	133.1	169.6	-73.7	172.4	-14.2	0	0	108.7	S423 Q424 V470	S423-Q499 CarbonylContact O-C 3.6Å; S423-Q499 WeakPolarHBondContact O-CA 3.47Å; Q424-Q499 HydrophobicContact CB-CG 4.05Å; Q424-Q499 HydrophobicContact CG-CG 3.8Å; V470-Q499 HydrophobicContact CB-CB 4.07Å; V470-Q499 PolarHBondContact N-O 2.7Å; V470-Q499 PolarHBondContact O-N 3.16Å
500	V	94.1	Very high	92.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	113.8	174.1	-175.1	0	0	0	0	107.4	L416 S423 I467 I469 L498 F511	L416-V500 HydrophobicContact CD1-CB 4.11Å; L416-V500 HydrophobicContact CD1-CG1 3.65Å; L416-V500 HydrophobicContact CD2-CB 4.4Å; S423-V500 PolarHBondContact N-O 3.46Å; S423-V500 PolarHBondContact O-N 2.81Å; I467-V500 HydrophobicContact CD1-CG1 3.76Å; I467-V500 HydrophobicContact CG1-CG1 4.03Å; I469-V500 HydrophobicContact CD1-CB 4.33Å; I469-V500 HydrophobicContact CD1-CG1 3.87Å; I469-V500 HydrophobicContact CD1-CG2 3.9Å; L498-V500 HydrophobicContact CD1-CG2 4.19Å; L498-V500 HydrophobicContact CD2-CG2 4.47Å; L498-V500 HydrophobicContact CG-CG2 4.11Å; V500-F511 HydrophobicContact CG1-CE1 4.19Å; V500-F511 HydrophobicContact CG1-CZ 4.2Å
501	A	92.5	Very high	92.8	Very high	22 Å²	22	46.8 Å²	46.8	18%	0.182	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	139.2	176.9	0	0	0	0	0	110.7	P421 V422 I467 Q468	P421-A501 CarbonylContact O-C 3.58Å; P421-A501 VanDerWaalsContact O-CA 3.26Å; P421-A501 WeakPolarHBondContact O-CA 3.28Å; V422-A501 HydrophobicContact CB-CB 4.45Å; V422-A501 HydrophobicContact CG1-CB 4.32Å; V422-A501 HydrophobicContact CG2-CB 3.9Å; I467-A501 WeakPolarHBondContact CA-O 3.31Å; Q468-A501 HydrophobicContact CB-CB 4.31Å; Q468-A501 PolarHBondContact N-O 3.06Å; Q468-A501 PolarHBondContact O-N 2.76Å
502	V	91.3	Very high	92.7	Very high	16 Å²	16	47.6 Å²	47.6	10%	0.097	25%	0.251	C	S	.	.			trans	-142.1	145.7	-177.5	-68.9	0	0	0	0	110.8	L416 P421 I467 Q504	L416-V502 HydrophobicContact CD1-CG2 4.48Å; P421-V502 PolarHBondContact O-N 3.32Å; I467-V502 HydrophobicContact CB-CG1 4.08Å; I467-V502 HydrophobicContact CD1-CG1 4.1Å; I467-V502 HydrophobicContact CG1-CG1 3.84Å; V502-Q504 WeakPolarHBondContact CB-O 3.49Å; V502-Q504 WeakPolarHBondContact CG2-O 3.27Å
503	Q	86.3	Confident	92.8	Very high	157 Å²	157	42.5 Å²	42.5	73%	0.734	23%	0.228	S	C	*	.	S	Bend	trans	-90.3	-14.5	173.3	-65	-177.9	14.5	0	0	112.5	A465 S466	A465-Q503 PolarHBondContact O-N 2.86Å; S466-Q503 WeakPolarHBondContact OG-CB 3.38Å; S466-Q503 WeakPolarHBondContact OG-CG 3.4Å; S466-Q503 PolarHBondContact OG-OE1 3.07Å
504	Q	87	Confident	92.8	Very high	112 Å²	112	40 Å²	40	52%	0.523	21%	0.212	S	C	.	.	S	Bend	trans	-133.8	149.7	176.8	-51.2	179.8	6.5	0	0	109.7	N464 A465 V502 C506	N464-Q504 PolarHBondContact O-NE2 3.2Å; N464-Q504 VanDerWaalsContact O-NE2 3.12Å; N464-Q504 PolarHBondContact O-OE1 2.85Å; A465-Q504 HydrophobicContact CB-CB 4.06Å; V502-Q504 WeakPolarHBondContact CB-O 3.49Å; V502-Q504 WeakPolarHBondContact CG2-O 3.27Å; Q504-C506 PolarHBondContact O-N 2.87Å
505	C	86.1	Confident	92.8	Very high	71 Å²	71	38 Å²	38	48%	0.48	20%	0.201	S	C	.	.			trans	-59.6	111.7	177	156	0	0	0	0	111.2	H418 C507	H418-C505 PolarHBondContact ND1-SG 2.82Å; C505-C507 WeakPolarHBondContact CB-SG 3.26Å; C505-C507 PolarHBondContact O-N 2.78Å; C505-C507 WeakPolarHBondContact SG-CB 3.37Å; C505-C507 PolarHBondContact SG-N 3.47Å; C505-C507 VanDerWaalsContact SG-N 3.38Å; C505-C507 CovalentContact SG-SG 2.04Å; C505-C507 PolarHBondContact SG-SG 3.35Å
506	C	87.9	Confident	92.7	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.02	18%	0.175	C	C	.	.			trans	-91.5	28.3	167.9	68.8	0	0	0	0	111.9	L416 P462 Q504 S508 H509	L416-C506 VanDerWaalsContact CD1-SG 3.54Å; P462-C506 HydrophobicContact CB-CB 4Å; P462-C506 HydrophobicContact CG-CB 3.82Å; Q504-C506 PolarHBondContact O-N 2.87Å; C506-S508 PolarHBondContact O-N 2.89Å; C506-S508 VanDerWaalsContact O-N 3.09Å; C506-H509 WeakPolarHBondContact O-CB 3.44Å; C506-H509 PolarHBondContact O-CE1 3.09Å; C506-H509 VanDerWaalsContact O-CE1 3.27Å; C506-H509 PolarHBondContact O-N 3.3Å
507	C	86.4	Confident	92.5	Very high	25 Å²	25	33.2 Å²	33.2	17%	0.169	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-14.4	-168.1	-33.7	0	0	0	0	113.5	R415 H418 C505 H509	R415-C507 PolarHBondContact NH1-O 3.43Å; H418-C507 PolarHBondContact ND1-SG 2.88Å; C505-C507 WeakPolarHBondContact CB-SG 3.26Å; C505-C507 PolarHBondContact O-N 2.78Å; C505-C507 WeakPolarHBondContact SG-CB 3.37Å; C505-C507 PolarHBondContact SG-N 3.47Å; C505-C507 VanDerWaalsContact SG-N 3.38Å; C505-C507 CovalentContact SG-SG 2.04Å; C505-C507 PolarHBondContact SG-SG 3.35Å; C507-H509 VanDerWaalsContact C-N 3.28Å
508	S	90.3	Very high	92.4	Very high	46 Å²	46	32.4 Å²	32.4	32%	0.322	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-14.8	169	59.2	0	0	0	0	114	H451 A452 C506	H451-S508 WeakPolarHBondContact NE2-CB 3.3Å; A452-S508 WeakPolarHBondContact CB-O 3.2Å; A452-S508 PolarHBondContact N-O 3.39Å; C506-S508 PolarHBondContact O-N 2.89Å; C506-S508 VanDerWaalsContact O-N 3.09Å
509	H	93.2	Very high	92.2	Very high	30 Å²	30	33 Å²	33	14%	0.139	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	152.9	-178.6	-62.5	56.1	0	0	0	111.7	F450 H451 N460 C506 C507	F450-H509 CarbonylContact O-C 3.51Å; F450-H509 WeakPolarHBondContact O-CA 3.27Å; F450-H509 WeakPolarHBondContact O-CB 3.3Å; H451-H509 AromaticContact CD2-CE1 3.99Å; H451-H509 AromaticContact CD2-ND1 3.96Å; H451-H509 AromaticContact CD2-NE2 3.74Å; N460-H509 PolarHBondContact O-CD2 3.11Å; C506-H509 WeakPolarHBondContact O-CB 3.44Å; C506-H509 PolarHBondContact O-CE1 3.09Å; C506-H509 VanDerWaalsContact O-CE1 3.27Å; C506-H509 PolarHBondContact O-N 3.3Å; C507-H509 VanDerWaalsContact C-N 3.28Å
510	L	94.4	Very high	92.1	Very high	26 Å²	26	31.5 Å²	31.5	14%	0.136	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	152.4	165.6	-64.5	103.5	0	0	0	110.9	P413 F414 R415 C449 F450 A452	P413-L510 HydrophobicContact CB-CB 4.28Å; P413-L510 HydrophobicContact CB-CD2 3.69Å; F414-L510 CarbonylContact O-C 3.55Å; F414-L510 VanDerWaalsContact O-CA 3.31Å; F414-L510 WeakPolarHBondContact O-CA 3.49Å; R415-L510 HydrophobicContact CG-CD2 4.16Å; R415-L510 HydrophobicContact CG-CG 3.93Å; C449-L510 CarbonylContact C-O 3.55Å; C449-L510 VanDerWaalsContact CA-O 3.31Å; C449-L510 WeakPolarHBondContact CA-O 3.46Å; F450-L510 HydrophobicContact CE1-CB 4.1Å; F450-L510 HydrophobicContact CE2-CB 4.1Å; F450-L510 HydrophobicContact CE2-CD1 4.05Å; F450-L510 HydrophobicContact CZ-CB 3.82Å; F450-L510 HydrophobicContact CZ-CD1 4.49Å; F450-L510 PolarHBondContact N-O 2.82Å; F450-L510 PolarHBondContact O-N 3.14Å; A452-L510 VanDerWaalsContact CA-CD1 3.48Å; A452-L510 HydrophobicContact CB-CD1 3.47Å; A452-L510 VanDerWaalsContact CB-CD1 3.47Å
511	F	94.8	Very high	92.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	140	175.4	-62.7	-95.4	0	0	0	108.9	P413 F414 L416 K448 C449 W461 I467 V500	P413-F511 CarbonylContact C-O 3.48Å; P413-F511 WeakPolarHBondContact CA-O 3.39Å; F414-F511 HydrophobicContact CD1-CB 4.18Å; F414-F511 WeakPolarHBondContact CD1-O 3.43Å; F414-F511 HydrophobicContact CD2-CB 4.23Å; F414-F511 HydrophobicContact CE1-CB 3.7Å; F414-F511 HydrophobicContact CE2-CB 3.75Å; F414-F511 HydrophobicContact CE2-CD2 4.39Å; F414-F511 HydrophobicContact CE2-CG 4.27Å; F414-F511 HydrophobicContact CG-CB 4.44Å; F414-F511 HydrophobicContact CZ-CB 3.46Å; F414-F511 VanDerWaalsContact CZ-CB 3.46Å; F414-F511 HydrophobicContact CZ-CG 4.31Å; F414-F511 PolarHBondContact N-O 2.98Å; F414-F511 PolarHBondContact O-N 2.78Å; L416-F511 HydrophobicContact CD1-CE2 4.14Å; L416-F511 HydrophobicContact CD1-CZ 4.41Å; L416-F511 HydrophobicContact CD2-CD2 3.99Å; L416-F511 HydrophobicContact CD2-CE2 4.02Å; L416-F511 HydrophobicContact CG-CD2 4.16Å; L416-F511 HydrophobicContact CG-CE2 3.72Å; L416-F511 HydrophobicContact CG-CZ 4.46Å; K448-F511 VanDerWaalsContact O-CA 3.32Å; K448-F511 WeakPolarHBondContact O-CA 3.49Å; C449-F511 HydrophobicContact CB-CD1 3.96Å; C449-F511 HydrophobicContact CB-CE1 3.89Å; C449-F511 WeakPolarHBondContact SG-CE1 3.36Å; C449-F511 VanDerWaalsContact SG-CZ 3.52Å; W461-F511 HydrophobicContact CE3-CE1 4.43Å; W461-F511 HydrophobicContact CZ3-CD1 4.26Å; W461-F511 AromaticContact CZ3-CE1 3.93Å; W461-F511 HydrophobicContact CZ3-CE1 3.93Å; I467-F511 HydrophobicContact CD1-CE1 3.65Å; I467-F511 HydrophobicContact CD1-CZ 3.74Å; V500-F511 HydrophobicContact CG1-CE1 4.19Å; V500-F511 HydrophobicContact CG1-CZ 4.2Å
512	M	94.6	Very high	92.2	Very high	25 Å²	25	34 Å²	34	12%	0.123	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	139.3	-176.4	178.8	-162.7	-74.4	0	0	109.5	M409 P413 L447 K448 F450 M457	M409-M512 HydrophobicContact CE-CE 4.31Å; M409-M512 HydrophobicContact CE-CG 3.84Å; M409-M512 HydrophobicContact CE-SD 4.15Å; M409-M512 HydrophobicContact SD-CG 4.43Å; M409-M512 HydrophobicContact SD-SD 4.24Å; P413-M512 HydrophobicContact CG-CE 3.76Å; L447-M512 WeakPolarHBondContact CA-O 3.37Å; K448-M512 HydrophobicContact CB-CB 4.31Å; K448-M512 PolarHBondContact N-O 3.45Å; K448-M512 PolarHBondContact O-N 3.33Å; F450-M512 HydrophobicContact CE1-CB 4.16Å; F450-M512 HydrophobicContact CE1-CE 4.06Å; F450-M512 HydrophobicContact CZ-CE 4.34Å; M457-M512 HydrophobicContact SD-CE 3.97Å
513	L	96.1	Very high	92.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122.6	175.7	-166.9	72.7	0	0	0	110.4	I410 L411 F427 I445 Q446 L447 I487	I410-L513 WeakPolarHBondContact CA-O 3.45Å; I410-L513 HydrophobicContact CB-CB 4.43Å; I410-L513 HydrophobicContact CB-CD2 4.16Å; I410-L513 HydrophobicContact CB-CG 4.21Å; I410-L513 WeakPolarHBondContact CB-O 3.36Å; I410-L513 HydrophobicContact CG2-CD2 3.83Å; I410-L513 HydrophobicContact CG2-CG 4.44Å; I410-L513 PolarHBondContact N-O 3.2Å; L411-L513 HydrophobicContact CB-CB 3.78Å; L411-L513 HydrophobicContact CD1-CB 3.96Å; L411-L513 HydrophobicContact CD1-CD2 3.96Å; L411-L513 HydrophobicContact CG-CB 4.01Å; L411-L513 HydrophobicContact CG-CD2 4.2Å; L411-L513 PolarHBondContact N-O 3.38Å; L411-L513 PolarHBondContact O-N 3.29Å; F427-L513 HydrophobicContact CD1-CD2 4.14Å; F427-L513 HydrophobicContact CD2-CD2 3.67Å; F427-L513 HydrophobicContact CE1-CD2 4.12Å; F427-L513 HydrophobicContact CE2-CD2 3.63Å; F427-L513 HydrophobicContact CG-CD2 3.92Å; F427-L513 HydrophobicContact CZ-CD2 3.86Å; I445-L513 HydrophobicContact CG2-CD1 3.64Å; I445-L513 HydrophobicContact CG2-CD2 4.46Å; I445-L513 HydrophobicContact CG2-CG 3.97Å; Q446-L513 WeakPolarHBondContact O-CA 3.31Å; L447-L513 HydrophobicContact CB-CD1 3.82Å; L447-L513 HydrophobicContact CD1-CD1 4.01Å; L447-L513 HydrophobicContact CG-CD1 4.49Å; I487-L513 HydrophobicContact CD1-CD1 3.72Å; I487-L513 HydrophobicContact CG1-CD1 4.37Å
514	S	95	Very high	92.7	Very high	9 Å²	9	31.9 Å²	31.9	6%	0.063	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	152.9	-177	57	0	0	0	0	113.7	G408 Q446	G408-S514 CarbonylContact O-C 3.59Å; G408-S514 VanDerWaalsContact O-CA 3.3Å; G408-S514 WeakPolarHBondContact O-CA 3.43Å; Q446-S514 PolarHBondContact N-O 3.11Å; Q446-S514 PolarHBondContact O-N 2.98Å
515	L	95.3	Very high	93.1	Very high	42 Å²	42	27.5 Å²	27.5	22%	0.22	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	132.6	166.9	-177.6	70.2	0	0	0	109.1	V405 G408 I410 L437 L443 I445	V405-L515 HydrophobicContact CB-CB 4.49Å; V405-L515 HydrophobicContact CB-CD2 4.2Å; V405-L515 HydrophobicContact CB-CG 4.17Å; V405-L515 HydrophobicContact CG1-CD2 4Å; V405-L515 HydrophobicContact CG2-CD2 4.4Å; V405-L515 HydrophobicContact CG2-CG 4.14Å; V405-L515 PolarHBondContact N-O 3.5Å; G408-L515 PolarHBondContact O-N 3.14Å; I410-L515 HydrophobicContact CD1-CB 4.46Å; L437-L515 HydrophobicContact CD1-CD1 3.8Å; L443-L515 HydrophobicContact CD2-CD1 4.39Å; L443-L515 HydrophobicContact CD2-CG 4.47Å; I445-L515 HydrophobicContact CG1-CD1 4.47Å
516	I	94.1	Very high	93.5	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	158.4	179.7	60.2	161.7	0	0	0	110.9	F403 L443 D444 Q446 Y486 R518	F403-I516 CarbonylContact O-C 3.5Å; F403-I516 VanDerWaalsContact O-CA 3.25Å; F403-I516 WeakPolarHBondContact O-CA 3.28Å; F403-I516 VanDerWaalsContact O-CB 3.28Å; F403-I516 WeakPolarHBondContact O-CB 3.25Å; L443-I516 WeakPolarHBondContact CA-O 3.38Å; D444-I516 HydrophobicContact CB-CD1 4.34Å; D444-I516 HydrophobicContact CB-CG1 4.02Å; D444-I516 PolarHBondContact N-O 3.43Å; D444-I516 WeakPolarHBondContact O-CG1 3.32Å; D444-I516 PolarHBondContact O-N 2.79Å; Q446-I516 HydrophobicContact CB-CD1 3.76Å; Q446-I516 HydrophobicContact CB-CG1 3.98Å; Q446-I516 HydrophobicContact CB-CG2 3.8Å; Q446-I516 HydrophobicContact CG-CD1 4.29Å; Y486-I516 HydrophobicContact CD1-CD1 3.93Å; Y486-I516 HydrophobicContact CE1-CD1 3.55Å; I516-R518 HydrophobicContact CD1-CG 3.47Å; I516-R518 VanDerWaalsContact CD1-CG 3.47Å; I516-R518 HydrophobicContact CG1-CG 3.97Å
517	S	93.8	Very high	93.8	Very high	23 Å²	23	30.7 Å²	30.7	16%	0.161	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	133.3	166.8	-175	0	0	0	0	108.7	F403 D442 P519	F403-S517 PolarHBondContact N-O 3.32Å; F403-S517 PolarHBondContact O-N 3.17Å; D442-S517 CarbonylContact O-C 3.57Å; S517-P519 WeakPolarHBondContact O-CD 3.48Å
518	R	93.8	Very high	94.2	Very high	13 Å²	13	29.9 Å²	29.9	5%	0.049	16%	0.158	C	C	.	.			trans	-122.9	52.8	-173.4	-60.5	-168.5	72.2	-150.4	-8.2	112.8	D395 R400 M401 S402 D442 D444 Y486 I516	D395-R518 VanDerWaalsContact CG-NH2 3.25Å; D395-R518 IonicContact OD1-CZ 3.11Å; D395-R518 IonicContact OD1-NH1 2.74Å; D395-R518 PolarHBondContact OD1-NH1 2.91Å; D395-R518 IonicContact OD1-NH2 2.62Å; D395-R518 PolarHBondContact OD1-NH2 2.81Å; D395-R518 IonicContact OD2-NH2 3.39Å; R400-R518 HydrophobicContact CB-CB 4.31Å; R400-R518 VanDerWaalsContact CD-O 3.32Å; R400-R518 WeakPolarHBondContact CD-O 3.36Å; R400-R518 WeakPolarHBondContact CG-O 3.26Å; R400-R518 PolarHBondContact NH1-O 3.24Å; M401-R518 VanDerWaalsContact O-CA 3.31Å; M401-R518 WeakPolarHBondContact O-CA 3.45Å; S402-R518 PolarHBondContact OG-NE 2.91Å; D442-R518 WeakPolarHBondContact O-CA 3.41Å; D442-R518 WeakPolarHBondContact O-CB 3.5Å; D442-R518 PolarHBondContact O-N 3.18Å; D444-R518 HydrophobicContact CB-CG 3.84Å; D444-R518 WeakPolarHBondContact OD2-CD 3.42Å; D444-R518 IonicContact OD2-CZ 3.14Å; D444-R518 IonicContact OD2-NE 3.76Å; D444-R518 IonicContact OD2-NH1 3.21Å; D444-R518 PolarHBondContact OD2-NH1 3.25Å; Y486-R518 VanDerWaalsContact CE2-CZ 3.49Å; Y486-R518 VanDerWaalsContact CE2-NH2 3.32Å; I516-R518 HydrophobicContact CD1-CG 3.47Å; I516-R518 VanDerWaalsContact CD1-CG 3.47Å; I516-R518 HydrophobicContact CG1-CG 3.97Å
519	P	93.4	Very high	94.4	Very high	14 Å²	14	28.7 Å²	28.7	9%	0.091	15%	0.149	C	C	.	.			trans	-58.8	150.2	176.5	29.1	-37.6	0	0	0	111.7	R400 M401 F403 D442 S517 R523 V524	R400-P519 WeakPolarHBondContact CA-O 3.36Å; M401-P519 PolarHBondContact N-O 2.86Å; M401-P519 WeakPolarHBondContact O-CD 3.46Å; F403-P519 HydrophobicContact CD2-CG 3.85Å; F403-P519 HydrophobicContact CE2-CG 3.73Å; D442-P519 VanDerWaalsContact OD2-CA 3.29Å; D442-P519 WeakPolarHBondContact OD2-CA 3.41Å; D442-P519 WeakPolarHBondContact OD2-CB 3.23Å; S517-P519 WeakPolarHBondContact O-CD 3.48Å; P519-R523 HydrophobicContact CB-CB 4.42Å; P519-R523 HydrophobicContact CB-CG 4.37Å; P519-V524 HydrophobicContact CB-CG2 4.16Å; P519-V524 HydrophobicContact CG-CG2 3.75Å
520	H	94.4	Very high	94.4	Very high	27 Å²	27	36.1 Å²	36.1	13%	0.125	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-60.1	144.3	172.2	-56.9	-114.5	0	0	0	110.4	E398 R400 D442 E522 R523 V524	E398-H520 VanDerWaalsContact CD-CE1 3.47Å; E398-H520 IonicContact OE1-CE1 3.02Å; E398-H520 PolarHBondContact OE1-CE1 2.86Å; E398-H520 IonicContact OE1-CG 3.17Å; E398-H520 IonicContact OE1-ND1 3.4Å; E398-H520 PolarHBondContact OE1-ND1 3.04Å; E398-H520 IonicContact OE2-CE1 3.77Å; E398-H520 PolarHBondContact OE2-CE1 2.86Å; E398-H520 IonicContact OE2-ND1 3.61Å; E398-H520 PolarHBondContact OE2-ND1 3.16Å; E398-H520 VanDerWaalsContact OE2-ND1 3.16Å; R400-H520 VanDerWaalsContact CZ-NE2 3.3Å; R400-H520 PolarHBondContact NH1-CD2 3.35Å; R400-H520 PolarHBondContact NH1-NE2 3.32Å; R400-H520 PolarHBondContact NH2-CE1 3.21Å; R400-H520 PolarHBondContact NH2-NE2 2.79Å; D442-H520 IonicContact OD1-CD2 2.71Å; D442-H520 IonicContact OD1-NE2 3.92Å; H520-E522 PolarHBondContact O-N 3.02Å; H520-R523 HydrophobicContact CB-CB 4.29Å; H520-R523 WeakPolarHBondContact O-CA 3.38Å; H520-R523 WeakPolarHBondContact O-CB 3.33Å; H520-R523 PolarHBondContact O-N 3.22Å; H520-V524 PolarHBondContact O-N 3.44Å; H520-V524 VanDerWaalsContact O-N 3.12Å
521	V	93.9	Very high	94.4	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-53.7	-40.2	178.8	168.1	0	0	0	0	111.5	P399 M401 R523 V524 L525 L599 M600 K603	P399-V521 HydrophobicContact CB-CB 4.48Å; P399-V521 HydrophobicContact CB-CG2 3.85Å; P399-V521 HydrophobicContact CG-CB 4.24Å; P399-V521 HydrophobicContact CG-CG2 4.14Å; P399-V521 WeakPolarHBondContact O-CG2 3.16Å; P399-V521 PolarHBondContact O-N 2.89Å; M401-V521 HydrophobicContact CG-CB 4.43Å; M401-V521 HydrophobicContact CG-CG2 3.47Å; M401-V521 VanDerWaalsContact CG-CG2 3.47Å; M401-V521 HydrophobicContact SD-CB 4.46Å; M401-V521 HydrophobicContact SD-CG2 3.86Å; V521-R523 VanDerWaalsContact C-N 3.32Å; V521-R523 PolarHBondContact O-N 2.98Å; V521-V524 PolarHBondContact O-N 2.88Å; V521-L525 WeakPolarHBondContact O-CB 3.48Å; V521-L525 PolarHBondContact O-N 3.09Å; V521-L599 HydrophobicContact CG1-CB 3.9Å; V521-L599 HydrophobicContact CG1-CD1 4.28Å; V521-M600 HydrophobicContact CB-SD 4.24Å; V521-M600 HydrophobicContact CG1-CG 4.32Å; V521-M600 HydrophobicContact CG1-SD 4.02Å; V521-M600 HydrophobicContact CG2-SD 3.97Å; V521-K603 HydrophobicContact CG2-CB 4.42Å
522	E	94.2	Very high	94.4	Very high	74 Å²	74	46.2 Å²	46.2	35%	0.346	21%	0.214	S	C	.	.	H	α-helix	trans	-64.5	-34.6	177.9	-49.5	-62.7	175.5	0	0	112.5	H520 L525 S526 K596	H520-E522 PolarHBondContact O-N 3.02Å; E522-L525 PolarHBondContact O-N 3.07Å; E522-S526 VanDerWaalsContact O-CB 3.32Å; E522-S526 WeakPolarHBondContact O-CB 3.45Å; E522-S526 PolarHBondContact O-N 3.19Å; E522-K596 VanDerWaalsContact OE1-CE 3.22Å; E522-K596 WeakPolarHBondContact OE1-CE 3.47Å; E522-K596 IonicContact OE1-NZ 2.95Å; E522-K596 PolarHBondContact OE1-NZ 3.05Å; E522-K596 IonicContact OE2-NZ 3.82Å; E522-K596 PolarHBondContact OE2-NZ 3.2Å
523	R	94	Very high	94.5	Very high	116 Å²	116	48.5 Å²	48.5	44%	0.438	23%	0.226	S	C	.	.	H	α-helix	trans	-69.4	-34.4	175.8	-176	176.7	-68.8	165.8	1.3	111.5	D442 P519 H520 V521 N527	D442-R523 IonicContact OD1-NH1 2.89Å; D442-R523 PolarHBondContact OD1-NH1 3.06Å; D442-R523 VanDerWaalsContact OD1-NH1 3.07Å; D442-R523 IonicContact OD2-CZ 3.13Å; D442-R523 IonicContact OD2-NH1 2.62Å; D442-R523 PolarHBondContact OD2-NH1 3.02Å; P519-R523 HydrophobicContact CB-CB 4.42Å; P519-R523 HydrophobicContact CB-CG 4.37Å; H520-R523 HydrophobicContact CB-CB 4.29Å; H520-R523 WeakPolarHBondContact O-CA 3.38Å; H520-R523 WeakPolarHBondContact O-CB 3.33Å; H520-R523 PolarHBondContact O-N 3.22Å; V521-R523 VanDerWaalsContact C-N 3.32Å; V521-R523 PolarHBondContact O-N 2.98Å; R523-N527 PolarHBondContact O-N 2.92Å; R523-N527 PolarHBondContact O-ND2 3.24Å
524	V	94.3	Very high	94.5	Very high	12 Å²	12	49 Å²	49	7%	0.073	23%	0.229	C	C	.	.	H	α-helix	trans	-69.5	-47.7	171.5	-179.2	0	0	0	0	110.3	M401 F403 P519 H520 V521 S526 N527 L528 L599 V619	M401-V524 HydrophobicContact CB-CG2 4.42Å; M401-V524 HydrophobicContact CG-CG2 4.33Å; M401-V524 HydrophobicContact SD-CB 3.96Å; M401-V524 HydrophobicContact SD-CG1 3.97Å; M401-V524 HydrophobicContact SD-CG2 3.88Å; F403-V524 HydrophobicContact CE2-CG2 3.88Å; F403-V524 HydrophobicContact CZ-CG1 4.39Å; F403-V524 HydrophobicContact CZ-CG2 4.21Å; P519-V524 HydrophobicContact CB-CG2 4.16Å; P519-V524 HydrophobicContact CG-CG2 3.75Å; H520-V524 PolarHBondContact O-N 3.44Å; H520-V524 VanDerWaalsContact O-N 3.12Å; V521-V524 PolarHBondContact O-N 2.88Å; V524-S526 PolarHBondContact O-N 3.49Å; V524-N527 PolarHBondContact O-N 3.39Å; V524-N527 VanDerWaalsContact O-N 3.17Å; V524-L528 HydrophobicContact CG1-CD1 4.35Å; V524-L528 WeakPolarHBondContact O-CG 3.35Å; V524-L528 PolarHBondContact O-N 2.81Å; V524-L599 HydrophobicContact CG1-CD1 4.22Å; V524-L599 HydrophobicContact CG1-CD2 4.35Å; V524-V619 HydrophobicContact CG1-CG1 4.16Å
525	L	95.1	Very high	94.6	Very high	19 Å²	19	51.2 Å²	51.2	10%	0.099	24%	0.243	C	C	.	.	H	α-helix	trans	-57.2	-48.5	179	-174.5	65.6	0	0	0	112	V521 E522 N527 L528 V529 L580 L595 K596 L599	V521-L525 WeakPolarHBondContact O-CB 3.48Å; V521-L525 PolarHBondContact O-N 3.09Å; E522-L525 PolarHBondContact O-N 3.07Å; L525-N527 PolarHBondContact O-N 2.72Å; L525-L528 PolarHBondContact O-N 2.72Å; L525-L528 VanDerWaalsContact O-N 3.16Å; L525-V529 VanDerWaalsContact O-CG2 3.26Å; L525-V529 WeakPolarHBondContact O-CG2 3.49Å; L525-V529 PolarHBondContact O-N 3.4Å; L525-L580 HydrophobicContact CD1-CD2 3.91Å; L525-L595 HydrophobicContact CD1-CB 4.32Å; L525-L595 HydrophobicContact CD1-CD2 3.82Å; L525-L595 HydrophobicContact CD1-CG 3.76Å; L525-K596 HydrophobicContact CD1-CB 4.32Å; L525-K596 HydrophobicContact CD2-CB 3.98Å; L525-K596 HydrophobicContact CD2-CD 3.84Å; L525-K596 HydrophobicContact CD2-CG 3.97Å; L525-L599 HydrophobicContact CB-CD1 3.98Å; L525-L599 HydrophobicContact CD1-CD1 3.96Å
526	S	94.6	Very high	94.6	Very high	76 Å²	76	50.7 Å²	50.7	53%	0.531	24%	0.242	S	C	.	.	H	α-helix	trans	-59.3	-42	175.5	177.1	0	0	0	0	112.4	E522 V524 L528 V529 R530	E522-S526 VanDerWaalsContact O-CB 3.32Å; E522-S526 WeakPolarHBondContact O-CB 3.45Å; E522-S526 PolarHBondContact O-N 3.19Å; V524-S526 PolarHBondContact O-N 3.49Å; S526-L528 VanDerWaalsContact C-N 3.34Å; S526-L528 PolarHBondContact O-N 3.25Å; S526-V529 PolarHBondContact O-N 2.99Å; S526-R530 WeakPolarHBondContact O-CB 3.46Å; S526-R530 PolarHBondContact O-N 3.07Å
527	N	94.1	Very high	94.7	Very high	65 Å²	65	56.5 Å²	56.5	35%	0.348	27%	0.269	S	S	.	.	H	α-helix	trans	-67.3	-32.1	175.9	-88	-81.8	0	0	0	113.1	R523 V524 L525 R531	R523-N527 PolarHBondContact O-N 2.92Å; R523-N527 PolarHBondContact O-ND2 3.24Å; V524-N527 PolarHBondContact O-N 3.39Å; V524-N527 VanDerWaalsContact O-N 3.17Å; L525-N527 PolarHBondContact O-N 2.72Å; N527-R531 VanDerWaalsContact O-CB 3.29Å; N527-R531 WeakPolarHBondContact O-CB 3.45Å; N527-R531 VanDerWaalsContact O-CG 3.28Å; N527-R531 WeakPolarHBondContact O-CG 3.38Å; N527-R531 PolarHBondContact O-N 2.95Å; N527-R531 PolarHBondContact OD1-NE 2.85Å; N527-R531 PolarHBondContact OD1-NH2 2.94Å
528	L	95.7	Very high	94.8	Very high	9 Å²	9	59 Å²	59	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-69.2	-49.5	172.6	-69	174.9	0	0	0	111	V524 L525 S526 R530 R531 K532 L595 L599 V619 L622	V524-L528 HydrophobicContact CG1-CD1 4.35Å; V524-L528 WeakPolarHBondContact O-CG 3.35Å; V524-L528 PolarHBondContact O-N 2.81Å; L525-L528 PolarHBondContact O-N 2.72Å; L525-L528 VanDerWaalsContact O-N 3.16Å; S526-L528 VanDerWaalsContact C-N 3.34Å; S526-L528 PolarHBondContact O-N 3.25Å; L528-R530 PolarHBondContact O-N 2.82Å; L528-R531 PolarHBondContact O-N 3.19Å; L528-R531 VanDerWaalsContact O-N 3.09Å; L528-K532 HydrophobicContact CD2-CB 4.26Å; L528-K532 HydrophobicContact CD2-CG 3.77Å; L528-K532 WeakPolarHBondContact O-CA 3.34Å; L528-K532 WeakPolarHBondContact O-CB 3.44Å; L528-K532 PolarHBondContact O-N 3.06Å; L528-L595 HydrophobicContact CB-CD2 4.14Å; L528-L595 HydrophobicContact CD1-CD1 4.07Å; L528-L595 HydrophobicContact CD1-CD2 4.04Å; L528-L595 HydrophobicContact CD1-CG 4.44Å; L528-L599 HydrophobicContact CD1-CD1 4.16Å; L528-L599 HydrophobicContact CD1-CD2 4.12Å; L528-V619 HydrophobicContact CD1-CG1 4.33Å; L528-V619 HydrophobicContact CD2-CG1 3.9Å; L528-V619 HydrophobicContact CG-CG1 4.41Å; L528-L622 HydrophobicContact CD1-CD1 4.25Å
529	V	94	Very high	94.9	Very high	20 Å²	20	58.3 Å²	58.3	12%	0.121	28%	0.276	C	S	.	.	H	α-helix	trans	-50.2	-45.6	174.3	171.1	0	0	0	0	111.1	L525 S526 R531 L580 I624 F896	L525-V529 VanDerWaalsContact O-CG2 3.26Å; L525-V529 WeakPolarHBondContact O-CG2 3.49Å; L525-V529 PolarHBondContact O-N 3.4Å; S526-V529 PolarHBondContact O-N 2.99Å; V529-R531 PolarHBondContact O-N 3.11Å; V529-L580 HydrophobicContact CG2-CD2 3.72Å; V529-I624 HydrophobicContact CB-CD1 4.3Å; V529-I624 HydrophobicContact CG2-CD1 3.92Å; V529-F896 HydrophobicContact CB-CZ 4.49Å; V529-F896 HydrophobicContact CG1-CD1 4.47Å; V529-F896 HydrophobicContact CG1-CD2 4Å; V529-F896 HydrophobicContact CG1-CE1 3.96Å; V529-F896 HydrophobicContact CG1-CE2 3.43Å; V529-F896 VanDerWaalsContact CG1-CE2 3.43Å; V529-F896 HydrophobicContact CG1-CG 4.5Å; V529-F896 HydrophobicContact CG1-CZ 3.41Å; V529-F896 VanDerWaalsContact CG1-CZ 3.41Å; V529-F896 HydrophobicContact CG2-CE1 4.24Å; V529-F896 HydrophobicContact CG2-CZ 4.23Å
530	R	93.5	Very high	95	Very high	187 Å²	187	59.1 Å²	59.1	71%	0.706	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-2.3	-176.6	-142.9	-160.8	79.2	170.4	5.9	115.8	S526 L528	S526-R530 WeakPolarHBondContact O-CB 3.46Å; S526-R530 PolarHBondContact O-N 3.07Å; L528-R530 PolarHBondContact O-N 2.82Å
531	R	93.7	Very high	95	Very high	159 Å²	159	61.9 Å²	61.9	60%	0.6	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.2	-10.2	-173.1	-57.1	-174.3	-164.2	-144	9.7	116	N527 L528 V529	N527-R531 VanDerWaalsContact O-CB 3.29Å; N527-R531 WeakPolarHBondContact O-CB 3.45Å; N527-R531 VanDerWaalsContact O-CG 3.28Å; N527-R531 WeakPolarHBondContact O-CG 3.38Å; N527-R531 PolarHBondContact O-N 2.95Å; N527-R531 PolarHBondContact OD1-NE 2.85Å; N527-R531 PolarHBondContact OD1-NH2 2.94Å; L528-R531 PolarHBondContact O-N 3.19Å; L528-R531 VanDerWaalsContact O-N 3.09Å; V529-R531 PolarHBondContact O-N 3.11Å
532	K	95.4	Very high	95.1	Very high	79 Å²	79	63.3 Å²	63.3	34%	0.343	30%	0.298	S	S	.	.			trans	-135.1	39.3	-168.8	-65	-68.4	-177.4	167.8	0	112.3	L528 E620 L622 E623 I624	L528-K532 HydrophobicContact CD2-CB 4.26Å; L528-K532 HydrophobicContact CD2-CG 3.77Å; L528-K532 WeakPolarHBondContact O-CA 3.34Å; L528-K532 WeakPolarHBondContact O-CB 3.44Å; L528-K532 PolarHBondContact O-N 3.06Å; K532-E620 WeakPolarHBondContact CE-O 3.33Å; K532-E620 PolarHBondContact NZ-O 3.17Å; K532-L622 WeakPolarHBondContact CB-O 3.3Å; K532-E623 CarbonylContact O-C 3.6Å; K532-E623 WeakPolarHBondContact O-CA 3.5Å; K532-I624 PolarHBondContact O-N 2.89Å
533	L	95.6	Very high	95.1	Very high	72 Å²	72	59.8 Å²	59.8	38%	0.377	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	131	165.9	-66.9	164.5	0	0	0	109.2	P535 I624 Q626 W629	L533-P535 WeakPolarHBondContact O-CD 3.35Å; L533-I624 HydrophobicContact CD2-CB 4.15Å; L533-I624 HydrophobicContact CD2-CG2 3.96Å; L533-Q626 HydrophobicContact CD2-CG 4.24Å; L533-W629 HydrophobicContact CD2-CE3 4.49Å; L533-W629 HydrophobicContact CD2-CZ3 3.95Å
534	L	96.4	Very high	95	Very high	11 Å²	11	58.6 Å²	58.6	6%	0.058	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	115.5	165.2	176.1	70.1	0	0	0	107.9	M538 A539 K542 E623 I624 D625 Q626	L534-M538 HydrophobicContact CD1-CB 3.53Å; L534-M538 HydrophobicContact CG-CB 4.29Å; L534-A539 HydrophobicContact CD2-CB 3.85Å; L534-A539 HydrophobicContact CG-CB 4.22Å; L534-K542 HydrophobicContact CD2-CD 4.17Å; L534-E623 HydrophobicContact CB-CB 4.2Å; L534-E623 HydrophobicContact CB-CG 4.26Å; L534-E623 HydrophobicContact CD2-CG 4.45Å; L534-I624 WeakPolarHBondContact CB-O 3.4Å; L534-I624 PolarHBondContact N-O 3.4Å; L534-D625 WeakPolarHBondContact CD2-OD2 3.44Å; L534-Q626 WeakPolarHBondContact O-CB 3.4Å; L534-Q626 WeakPolarHBondContact O-CG 3.22Å; L534-Q626 PolarHBondContact O-N 2.94Å
535	P	96.5	Very high	94.9	Very high	55 Å²	55	63.7 Å²	63.7	36%	0.357	30%	0.298	S	S	.	.			trans	-58.2	150.2	178.1	-26.1	35.9	0	0	0	112.8	L533 E537 M538 A539	L533-P535 WeakPolarHBondContact O-CD 3.35Å; P535-E537 PolarHBondContact O-N 3.17Å; P535-M538 HydrophobicContact CB-CG 4.32Å; P535-M538 HydrophobicContact CG-CG 4.36Å; P535-M538 PolarHBondContact O-N 2.62Å; P535-M538 VanDerWaalsContact O-N 3.09Å; P535-A539 PolarHBondContact O-N 2.74Å
536	V	96.2	Very high	94.6	Very high	32 Å²	32	63.8 Å²	63.8	19%	0.194	30%	0.3	C	S	.	.	H	α-helix	trans	-55.5	-38.9	-178.7	179.7	0	0	0	0	111.8	A539 I540 Q626 Y627	V536-A539 WeakPolarHBondContact O-CB 3.48Å; V536-A539 PolarHBondContact O-N 3.2Å; V536-I540 HydrophobicContact CG1-CD1 3.85Å; V536-I540 HydrophobicContact CG1-CG1 4.45Å; V536-I540 WeakPolarHBondContact O-CB 3.42Å; V536-I540 VanDerWaalsContact O-CG1 3.26Å; V536-I540 WeakPolarHBondContact O-CG1 3.29Å; V536-I540 PolarHBondContact O-N 2.83Å; V536-Q626 HydrophobicContact CG2-CB 3.65Å; V536-Y627 HydrophobicContact CG1-CD2 4.35Å
537	E	96.3	Very high	94.3	Very high	122 Å²	122	61.4 Å²	61.4	57%	0.57	28%	0.28	S	S	*	.	H	α-helix	trans	-63.5	-45.9	178.5	-61.4	66.7	-146.1	0	0	111.2	P535 A539 I540 E541	P535-E537 PolarHBondContact O-N 3.17Å; E537-A539 VanDerWaalsContact C-N 3.35Å; E537-I540 PolarHBondContact O-N 3.21Å; E537-E541 PolarHBondContact O-N 3.41Å
538	M	95.5	Very high	93.7	Very high	75 Å²	75	64.4 Å²	64.4	37%	0.369	29%	0.293	S	S	.	.	H	α-helix	trans	-69	-34.2	178.1	-64.6	-72	98.9	0	0	111.6	L534 P535 E541 K542	L534-M538 HydrophobicContact CD1-CB 3.53Å; L534-M538 HydrophobicContact CG-CB 4.29Å; P535-M538 HydrophobicContact CB-CG 4.32Å; P535-M538 HydrophobicContact CG-CG 4.36Å; P535-M538 PolarHBondContact O-N 2.62Å; P535-M538 VanDerWaalsContact O-N 3.09Å; M538-E541 VanDerWaalsContact CE-CD 3.47Å; M538-E541 HydrophobicContact CE-CG 4.43Å; M538-E541 WeakPolarHBondContact CE-OE1 3.21Å; M538-E541 PolarHBondContact O-N 2.95Å; M538-K542 WeakPolarHBondContact O-CG 3.38Å; M538-K542 PolarHBondContact O-N 3.45Å
539	A	96.4	Very high	92.2	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.3	-46	171.3	0	0	0	0	0	111.6	L534 P535 V536 E537 E541 K542 I543 D625	L534-A539 HydrophobicContact CD2-CB 3.85Å; L534-A539 HydrophobicContact CG-CB 4.22Å; P535-A539 PolarHBondContact O-N 2.74Å; V536-A539 WeakPolarHBondContact O-CB 3.48Å; V536-A539 PolarHBondContact O-N 3.2Å; E537-A539 VanDerWaalsContact C-N 3.35Å; A539-E541 VanDerWaalsContact C-N 3.31Å; A539-E541 PolarHBondContact O-N 3.12Å; A539-K542 PolarHBondContact O-N 2.97Å; A539-K542 VanDerWaalsContact O-N 3.15Å; A539-I543 VanDerWaalsContact O-CG1 3.29Å; A539-I543 WeakPolarHBondContact O-CG1 3.43Å; A539-I543 PolarHBondContact O-N 3.48Å; A539-D625 WeakPolarHBondContact CB-OD2 3.49Å
540	I	96.3	Very high	90.4	Very high	30 Å²	30	72 Å²	72	15%	0.154	34%	0.339	C	S	.	.	H	α-helix	trans	-59.1	-40.6	174.8	-73.6	168	0	0	0	111.2	V536 E537 I543 K544 Y627 A650	V536-I540 HydrophobicContact CG1-CD1 3.85Å; V536-I540 HydrophobicContact CG1-CG1 4.45Å; V536-I540 WeakPolarHBondContact O-CB 3.42Å; V536-I540 VanDerWaalsContact O-CG1 3.26Å; V536-I540 WeakPolarHBondContact O-CG1 3.29Å; V536-I540 PolarHBondContact O-N 2.83Å; E537-I540 PolarHBondContact O-N 3.21Å; I540-I543 WeakPolarHBondContact O-CB 3.48Å; I540-I543 PolarHBondContact O-N 3.18Å; I540-K544 HydrophobicContact CG2-CD 3.95Å; I540-K544 WeakPolarHBondContact O-CB 3.46Å; I540-K544 WeakPolarHBondContact O-CG 3.48Å; I540-K544 PolarHBondContact O-N 2.9Å; I540-Y627 HydrophobicContact CD1-CD2 4.36Å; I540-Y627 HydrophobicContact CG1-CD2 3.84Å; I540-Y627 HydrophobicContact CG1-CE2 4.08Å; I540-A650 HydrophobicContact CB-CB 4.22Å; I540-A650 HydrophobicContact CG1-CB 3.91Å; I540-A650 HydrophobicContact CG2-CB 3.9Å
541	E	94.4	Very high	88.3	Confident	86 Å²	86	70.8 Å²	70.8	40%	0.402	34%	0.341	S	S	.	.	H	α-helix	trans	-66.4	-39.6	173.8	-73.8	-174.7	-167.3	0	0	113.5	E537 M538 A539 I543 K544 R545	E537-E541 PolarHBondContact O-N 3.41Å; M538-E541 VanDerWaalsContact CE-CD 3.47Å; M538-E541 HydrophobicContact CE-CG 4.43Å; M538-E541 WeakPolarHBondContact CE-OE1 3.21Å; M538-E541 PolarHBondContact O-N 2.95Å; A539-E541 VanDerWaalsContact C-N 3.31Å; A539-E541 PolarHBondContact O-N 3.12Å; E541-I543 VanDerWaalsContact C-N 3.31Å; E541-K544 PolarHBondContact O-N 3.42Å; E541-R545 WeakPolarHBondContact O-CB 3.28Å; E541-R545 VanDerWaalsContact O-CG 3.29Å; E541-R545 WeakPolarHBondContact O-CG 3.4Å; E541-R545 PolarHBondContact O-N 2.68Å; E541-R545 PolarHBondContact O-NE 3.07Å; E541-R545 VanDerWaalsContact O-NE 3.15Å; E541-R545 IonicContact OE2-CZ 3.75Å; E541-R545 IonicContact OE2-NH2 2.86Å; E541-R545 PolarHBondContact OE2-NH2 3.31Å
542	K	94.1	Very high	85.9	Confident	30 Å²	30	70 Å²	70	13%	0.13	35%	0.353	C	S	.	.	H	α-helix	trans	-65	-37.7	175.1	-71.9	-173	-170.4	-164.8	0	110.9	L534 M538 A539 S546 N585 E623	L534-K542 HydrophobicContact CD2-CD 4.17Å; M538-K542 WeakPolarHBondContact O-CG 3.38Å; M538-K542 PolarHBondContact O-N 3.45Å; A539-K542 PolarHBondContact O-N 2.97Å; A539-K542 VanDerWaalsContact O-N 3.15Å; K542-S546 PolarHBondContact O-N 3.47Å; K542-N585 PolarHBondContact NZ-O 3.34Å; K542-N585 PolarHBondContact NZ-OD1 3.31Å; K542-E623 IonicContact NZ-OE1 2.74Å; K542-E623 PolarHBondContact NZ-OE1 3.31Å; K542-E623 IonicContact NZ-OE2 3.76Å; K542-E623 PolarHBondContact NZ-OE2 3.24Å
543	I	94.2	Very high	83.2	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-60.1	-55.9	172	-70.2	163.6	0	0	0	110.4	A539 I540 E541 R545 S546 F547 I590 Y627 I646 A650	A539-I543 VanDerWaalsContact O-CG1 3.29Å; A539-I543 WeakPolarHBondContact O-CG1 3.43Å; A539-I543 PolarHBondContact O-N 3.48Å; I540-I543 WeakPolarHBondContact O-CB 3.48Å; I540-I543 PolarHBondContact O-N 3.18Å; E541-I543 VanDerWaalsContact C-N 3.31Å; I543-R545 VanDerWaalsContact C-N 3.33Å; I543-R545 PolarHBondContact O-N 3.3Å; I543-S546 WeakPolarHBondContact O-CB 3.35Å; I543-S546 PolarHBondContact O-N 3.42Å; I543-S546 PolarHBondContact O-OG 3.28Å; I543-F547 HydrophobicContact CG2-CD2 4.26Å; I543-F547 HydrophobicContact CG2-CE2 3.79Å; I543-F547 VanDerWaalsContact O-CD2 3.3Å; I543-F547 WeakPolarHBondContact O-CD2 3.39Å; I543-F547 PolarHBondContact O-N 2.99Å; I543-I590 HydrophobicContact CD1-CG2 4.27Å; I543-I590 HydrophobicContact CG1-CD1 4.45Å; I543-I590 HydrophobicContact CG1-CG1 4.09Å; I543-I590 HydrophobicContact CG1-CG2 3.87Å; I543-I590 HydrophobicContact CG2-CD1 4Å; I543-I590 HydrophobicContact CG2-CG1 4.46Å; I543-Y627 HydrophobicContact CD1-CD1 3.54Å; I543-Y627 HydrophobicContact CD1-CD2 4.28Å; I543-Y627 HydrophobicContact CD1-CE1 3.45Å; I543-Y627 VanDerWaalsContact CD1-CE1 3.45Å; I543-Y627 HydrophobicContact CD1-CE2 4.19Å; I543-Y627 HydrophobicContact CD1-CG 3.98Å; I543-I646 HydrophobicContact CG2-CG2 3.96Å; I543-A650 HydrophobicContact CB-CB 4.21Å; I543-A650 HydrophobicContact CD1-CB 4.24Å; I543-A650 HydrophobicContact CG2-CB 3.73Å
544	K	93.1	Very high	80.6	Confident	91 Å²	91	70.2 Å²	70.2	40%	0.396	39%	0.386	S	S	.	.	H	α-helix	trans	-55	-46.6	178.7	-75.5	169.8	178.6	175.4	0	112.2	I540 E541 S546 F547 M548 S648 S649	I540-K544 HydrophobicContact CG2-CD 3.95Å; I540-K544 WeakPolarHBondContact O-CB 3.46Å; I540-K544 WeakPolarHBondContact O-CG 3.48Å; I540-K544 PolarHBondContact O-N 2.9Å; E541-K544 PolarHBondContact O-N 3.42Å; K544-S546 VanDerWaalsContact C-N 3.28Å; K544-S546 PolarHBondContact O-N 2.9Å; K544-F547 PolarHBondContact O-N 3.37Å; K544-M548 WeakPolarHBondContact O-CG 3.33Å; K544-M548 PolarHBondContact O-N 3.31Å; K544-S648 WeakPolarHBondContact CG-O 3.16Å; K544-S649 WeakPolarHBondContact CE-O 3.1Å; K544-S649 PolarHBondContact NZ-O 2.87Å
545	R	91.2	Very high	77.8	Confident	120 Å²	120	74.5 Å²	74.5	45%	0.453	43%	0.433	S	S	.	.	H	α-helix	trans	-61.1	-31.6	175.2	-76.1	178.3	-94.2	169.5	-16.9	113.6	E541 I543 S549	E541-R545 WeakPolarHBondContact O-CB 3.28Å; E541-R545 VanDerWaalsContact O-CG 3.29Å; E541-R545 WeakPolarHBondContact O-CG 3.4Å; E541-R545 PolarHBondContact O-N 2.68Å; E541-R545 PolarHBondContact O-NE 3.07Å; E541-R545 VanDerWaalsContact O-NE 3.15Å; E541-R545 IonicContact OE2-CZ 3.75Å; E541-R545 IonicContact OE2-NH2 2.86Å; E541-R545 PolarHBondContact OE2-NH2 3.31Å; I543-R545 VanDerWaalsContact C-N 3.33Å; I543-R545 PolarHBondContact O-N 3.3Å; R545-S549 WeakPolarHBondContact O-CB 3.33Å; R545-S549 PolarHBondContact O-N 2.9Å; R545-S549 PolarHBondContact O-OG 2.8Å
546	S	89.1	Confident	75.4	Confident	20 Å²	20	80.2 Å²	80.2	14%	0.14	45%	0.454	C	S	.	.	H	α-helix	trans	-69.3	-33.4	178.6	73.9	0	0	0	0	113.2	K542 I543 K544 R588 I590	K542-S546 PolarHBondContact O-N 3.47Å; I543-S546 WeakPolarHBondContact O-CB 3.35Å; I543-S546 PolarHBondContact O-N 3.42Å; I543-S546 PolarHBondContact O-OG 3.28Å; K544-S546 VanDerWaalsContact C-N 3.28Å; K544-S546 PolarHBondContact O-N 2.9Å; S546-R588 VanDerWaalsContact CB-O 3.32Å; S546-R588 WeakPolarHBondContact CB-O 3.17Å; S546-I590 WeakPolarHBondContact OG-CG1 3.28Å
547	F	88.8	Confident	72.7	Confident	27 Å²	27	87.2 Å²	87.2	12%	0.118	49%	0.49	C	S	.	.	H	α-helix	trans	-69.7	-48.7	173.1	-71.1	-79.3	0	0	0	111.7	I543 K544 S549 H562 T565 I590 D647	I543-F547 HydrophobicContact CG2-CD2 4.26Å; I543-F547 HydrophobicContact CG2-CE2 3.79Å; I543-F547 VanDerWaalsContact O-CD2 3.3Å; I543-F547 WeakPolarHBondContact O-CD2 3.39Å; I543-F547 PolarHBondContact O-N 2.99Å; K544-F547 PolarHBondContact O-N 3.37Å; F547-S549 PolarHBondContact O-N 3.13Å; F547-S549 VanDerWaalsContact O-N 3.16Å; F547-H562 WeakPolarHBondContact CD1-O 3.35Å; F547-H562 WeakPolarHBondContact CE1-O 3.26Å; F547-T565 WeakPolarHBondContact CE1-OG1 3.44Å; F547-I590 HydrophobicContact CE2-CD1 3.82Å; F547-I590 HydrophobicContact CZ-CD1 4.05Å; F547-D647 VanDerWaalsContact CE2-O 3.32Å; F547-D647 WeakPolarHBondContact CE2-O 3.29Å
548	M	81.8	Confident	70.2	Confident	127 Å²	127	85.7 Å²	85.7	63%	0.626	49%	0.493	S	S	*	.	H	α-helix	trans	-61.5	-23.8	179.7	-60.3	170.8	73.7	0	0	114	K544 N550	K544-M548 WeakPolarHBondContact O-CG 3.33Å; K544-M548 PolarHBondContact O-N 3.31Å; M548-N550 VanDerWaalsContact C-N 3.28Å; M548-N550 PolarHBondContact O-N 2.82Å
549	S	63.9	Low	67.9	Low	62 Å²	62	90.6 Å²	90.6	43%	0.434	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-9.1	-171.1	-68.1	0	0	0	0	114.9	R545 F547	R545-S549 WeakPolarHBondContact O-CB 3.33Å; R545-S549 PolarHBondContact O-N 2.9Å; R545-S549 PolarHBondContact O-OG 2.8Å; F547-S549 PolarHBondContact O-N 3.13Å; F547-S549 VanDerWaalsContact O-N 3.16Å
550	N	55.8	Low	65.9	Low	128 Å²	128	95.5 Å²	95.5	68%	0.684	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-10.9	-177.9	-82.6	1.1	0	0	0	114.2	M548 V552	M548-N550 VanDerWaalsContact C-N 3.28Å; M548-N550 PolarHBondContact O-N 2.82Å; N550-V552 VanDerWaalsContact C-N 3.31Å; N550-V552 PolarHBondContact O-N 3.43Å
551	E	49	Very low	64.2	Low	161 Å²	161	101.7 Å²	101.7	75%	0.752	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-1.6	-168.1	-65.2	170.2	-148.3	0	0	114.6
552	V	44.8	Very low	62.8	Low	142 Å²	142	102.7 Å²	102.7	86%	0.861	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.5	32.2	-167.8	-154.2	0	0	0	0	112.9	N550	N550-V552 VanDerWaalsContact C-N 3.31Å; N550-V552 PolarHBondContact O-N 3.43Å
553	G	38.7	Very low	62.4	Low	60 Å²	60	106.1 Å²	106.1	62%	0.619	60%	0.602	S	S	*	*	S	Bend	trans	-151.5	125.6	-179	0	0	0	0	0	114.3
554	A	40.3	Very low	62.2	Low	96 Å²	96	108.1 Å²	108.1	79%	0.793	62%	0.616	S	S	*	*			trans	64.7	114.1	-177.3	0	0	0	0	0	115.6	Q556	A554-Q556 VanDerWaalsContact C-N 3.33Å; A554-Q556 PolarHBondContact O-N 3.49Å
555	G	37.3	Very low	62.1	Low	100 Å²	100	105.8 Å²	105.8	100%	1.031	61%	0.61	S	S	*	*			trans	-76.7	76.6	177	0	0	0	0	0	112.6
556	Q	45.5	Very low	62.3	Low	175 Å²	175	103 Å²	103	82%	0.818	61%	0.606	S	S	*	*			trans	-128.1	132.9	173.2	-160.1	165.3	21.7	0	0	110.3	A554 S558	A554-Q556 VanDerWaalsContact C-N 3.33Å; A554-Q556 PolarHBondContact O-N 3.49Å; Q556-S558 PolarHBondContact O-N 2.97Å
557	L	39.5	Very low	62.6	Low	179 Å²	179	102.3 Å²	102.3	94%	0.937	60%	0.601	S	S	*	*			trans	-70.3	110	-170.4	-68.5	161.3	0	0	0	111.9
558	S	44.1	Very low	63	Low	91 Å²	91	102.4 Å²	102.4	64%	0.636	61%	0.605	S	S	*	*			trans	-150.2	102.3	162.1	60.7	0	0	0	0	110.9	Q556 V560	Q556-S558 PolarHBondContact O-N 2.97Å; S558-V560 PolarHBondContact O-N 3.15Å
559	D	47.4	Very low	63.7	Low	177 Å²	177	96.3 Å²	96.3	95%	0.947	58%	0.575	S	S	*	*			trans	-71.7	61.2	168	-68.6	-46.1	0	0	0	110.3
560	V	54.6	Low	65.3	Low	104 Å²	104	97.3 Å²	97.3	63%	0.63	57%	0.571	S	S	*	*			trans	-114.9	79.2	176.6	-176	0	0	0	0	107	S558 H562	S558-V560 PolarHBondContact O-N 3.15Å; V560-H562 PolarHBondContact O-N 2.94Å
561	E	60.2	Low	67.3	Low	159 Å²	159	91.2 Å²	91.2	74%	0.743	54%	0.539	S	S	*	.			trans	-50.6	113.5	163.8	-67.2	-173.6	141.1	0	0	107.7	L563	E561-L563 HydrophobicContact CB-CD2 4Å; E561-L563 HydrophobicContact CB-CG 3.98Å; E561-L563 PolarHBondContact O-N 3.48Å
562	H	66.2	Low	69.5	Low	108 Å²	108	85.7 Å²	85.7	50%	0.5	52%	0.517	S	S	.	.			trans	-81.2	60.3	-176.2	-148.1	88.6	0	0	0	110	F547 V560 S564	F547-H562 WeakPolarHBondContact CD1-O 3.35Å; F547-H562 WeakPolarHBondContact CE1-O 3.26Å; V560-H562 PolarHBondContact O-N 2.94Å; H562-S564 PolarHBondContact O-N 2.64Å
563	L	84.3	Confident	71.9	Confident	102 Å²	102	82.7 Å²	82.7	53%	0.534	49%	0.492	S	S	.	.			trans	-54	-23.2	-171.5	-64.3	175.9	0	0	0	113.1	E561 D647 S648	E561-L563 HydrophobicContact CB-CD2 4Å; E561-L563 HydrophobicContact CB-CG 3.98Å; E561-L563 PolarHBondContact O-N 3.48Å; L563-D647 CarbonylContact O-C 3.53Å; L563-D647 WeakPolarHBondContact O-CA 3.38Å; L563-D647 VanDerWaalsContact O-CB 3.23Å; L563-D647 WeakPolarHBondContact O-CB 3.22Å; L563-S648 PolarHBondContact O-N 3.43Å
564	S	90.3	Very high	74.6	Confident	41 Å²	41	82.7 Å²	82.7	29%	0.287	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	140.2	176.8	64.6	0	0	0	0	114.7	H562 L645 I646	H562-S564 PolarHBondContact O-N 2.64Å; S564-L645 WeakPolarHBondContact OG-CD2 3.16Å; S564-I646 CarbonylContact C-O 3.6Å; S564-I646 WeakPolarHBondContact CA-O 3.44Å; S564-I646 WeakPolarHBondContact CB-O 3.46Å
565	T	92.3	Very high	77.2	Confident	42 Å²	42	84.2 Å²	84.2	26%	0.258	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	141.3	175.7	-58.9	0	0	0	0	110.1	F547 I567 I646	F547-T565 WeakPolarHBondContact CE1-OG1 3.44Å; T565-I567 HydrophobicContact CG2-CG2 4.42Å; T565-I646 PolarHBondContact N-O 2.85Å; T565-I646 PolarHBondContact O-N 3.43Å
566	T	94.9	Very high	79.9	Confident	63 Å²	63	83.4 Å²	83.4	39%	0.387	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	130.2	167	-57	0	0	0	0	109.7	D643 V644 L645 H655	T566-D643 HydrophobicContact CG2-CB 4.1Å; T566-V644 CarbonylContact C-O 3.53Å; T566-V644 WeakPolarHBondContact CA-O 3.34Å; T566-L645 VanDerWaalsContact OG1-CD1 3.28Å; T566-L645 WeakPolarHBondContact OG1-CD1 3.45Å; T566-H655 HydrophobicContact CG2-CB 4.24Å; T566-H655 PolarHBondContact OG1-ND1 3.21Å
567	I	95.6	Very high	82.3	Confident	5 Å²	5	78 Å²	78	3%	0.026	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	155.3	170.5	69.4	158.1	0	0	0	110.8	T565 I590 V628 D643 V644 I646	T565-I567 HydrophobicContact CG2-CG2 4.42Å; I567-I590 HydrophobicContact CD1-CG2 4.29Å; I567-I590 HydrophobicContact CG2-CB 3.99Å; I567-I590 HydrophobicContact CG2-CG2 4Å; I567-V628 HydrophobicContact CD1-CG2 4.21Å; I567-D643 WeakPolarHBondContact O-CA 3.49Å; I567-V644 HydrophobicContact CD1-CG2 4.07Å; I567-V644 HydrophobicContact CG1-CG2 3.54Å; I567-V644 PolarHBondContact N-O 3.44Å; I567-V644 PolarHBondContact O-N 2.87Å; I567-I646 HydrophobicContact CD1-CD1 3.47Å; I567-I646 VanDerWaalsContact CD1-CD1 3.47Å; I567-I646 HydrophobicContact CG1-CD1 3.69Å; I567-I646 HydrophobicContact CG1-CG1 4.47Å; I567-I646 HydrophobicContact CG2-CD1 4.33Å
568	S	96.7	Very high	85	Confident	28 Å²	28	70 Å²	70	20%	0.196	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	138.7	172.6	-156.5	0	0	0	0	111.8	K570 M578 Q591 S642 D643	S568-K570 PolarHBondContact OG-N 3.28Å; S568-M578 WeakPolarHBondContact O-CE 3.32Å; S568-Q591 PolarHBondContact O-NE2 3.26Å; S568-Q591 PolarHBondContact O-OE1 2.82Å; S568-S642 PolarHBondContact OG-O 2.9Å; S568-D643 VanDerWaalsContact CA-OD1 3.23Å; S568-D643 WeakPolarHBondContact CA-OD1 3.47Å; S568-D643 WeakPolarHBondContact CB-OD1 3.43Å; S568-D643 PolarHBondContact OG-OD1 3.1Å
569	L	97.1	Very high	87.5	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	38%	0.375	C	S	.	.	S	Bend	trans	-81.7	-2.4	169.6	-57.9	-175.8	0	0	0	112	K577 M578 I631 L632 L635 V641 S642 V644	L569-K577 HydrophobicContact CB-CG 4.49Å; L569-K577 WeakPolarHBondContact O-CA 3.28Å; L569-M578 WeakPolarHBondContact O-CE 3.3Å; L569-M578 PolarHBondContact O-N 2.87Å; L569-I631 HydrophobicContact CD1-CG2 4.26Å; L569-I631 HydrophobicContact CD2-CG2 3.85Å; L569-L632 HydrophobicContact CB-CD2 3.83Å; L569-L632 HydrophobicContact CD1-CD2 4.34Å; L569-L632 HydrophobicContact CD2-CD2 4.19Å; L569-L632 HydrophobicContact CG-CD2 4.34Å; L569-L635 HydrophobicContact CD1-CD1 3.65Å; L569-V641 HydrophobicContact CD1-CG1 4.3Å; L569-S642 WeakPolarHBondContact CB-O 3.38Å; L569-S642 PolarHBondContact N-O 3.37Å; L569-V644 HydrophobicContact CD1-CG1 4.01Å; L569-V644 HydrophobicContact CD2-CG1 4.47Å; L569-V644 HydrophobicContact CD2-CG2 4.02Å; L569-V644 HydrophobicContact CG-CG1 4.34Å
570	K	96.9	Very high	89.8	Confident	83 Å²	83	61.5 Å²	61.5	36%	0.361	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-86.4	145	175.4	-70.8	167.1	169.5	159.7	0	112.1	S568 M575 T576 S642	S568-K570 PolarHBondContact OG-N 3.28Å; K570-M575 WeakPolarHBondContact CD-O 3.1Å; K570-M575 WeakPolarHBondContact CG-O 3.42Å; K570-T576 CarbonylContact C-O 3.55Å; K570-T576 WeakPolarHBondContact CA-O 3.47Å; K570-S642 VanDerWaalsContact CE-CB 3.49Å; K570-S642 VanDerWaalsContact NZ-CB 3.34Å
571	C	97.1	Very high	91.9	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.303	C	S	.	.			trans	-75.8	134	173	177.1	0	0	0	0	110.5	F573 T574 M575 T576 M578 D594	C571-F573 PolarHBondContact O-N 3.4Å; C571-F573 VanDerWaalsContact O-N 3.13Å; C571-T574 WeakPolarHBondContact CB-OG1 3.33Å; C571-M575 WeakPolarHBondContact O-CA 3.36Å; C571-M575 PolarHBondContact O-N 3.3Å; C571-T576 PolarHBondContact N-O 3.2Å; C571-M578 HydrophobicContact CB-CG 3.91Å; C571-D594 HydrophobicContact CB-CB 3.78Å; C571-D594 VanDerWaalsContact SG-CB 3.57Å; C571-D594 PolarHBondContact SG-N 3.46Å
572	P	96.6	Very high	93.7	Very high	45 Å²	45	49 Å²	49	29%	0.292	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-13.3	-179.5	28.5	-37.5	0	0	0	114.5	M575 F593 P611 I612	P572-M575 WeakPolarHBondContact O-CE 3.47Å; P572-F593 HydrophobicContact CG-CB 3.93Å; P572-P611 HydrophobicContact CG-CB 4.03Å; P572-P611 HydrophobicContact CG-CG 3.98Å; P572-I612 HydrophobicContact CB-CD1 4.39Å; P572-I612 HydrophobicContact CG-CD1 3.96Å
573	F	94.2	Very high	95.1	Very high	79 Å²	79	43.9 Å²	43.9	35%	0.346	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-44.2	178.6	-62.8	-74	0	0	0	113.4	C571 T597 F598 V601 P611	C571-F573 PolarHBondContact O-N 3.4Å; C571-F573 VanDerWaalsContact O-N 3.13Å; F573-T597 HydrophobicContact CB-CG2 3.62Å; F573-T597 HydrophobicContact CD2-CG2 4.19Å; F573-T597 HydrophobicContact CG-CG2 4.18Å; F573-F598 HydrophobicContact CE2-CB 4.38Å; F573-F598 AromaticContact CE2-CD2 3.76Å; F573-F598 HydrophobicContact CE2-CD2 3.76Å; F573-F598 AromaticContact CZ-CD2 3.88Å; F573-F598 HydrophobicContact CZ-CD2 3.88Å; F573-F598 HydrophobicContact CZ-CE2 4.44Å; F573-V601 HydrophobicContact CD1-CG1 4.37Å; F573-V601 HydrophobicContact CD1-CG2 4.17Å; F573-V601 HydrophobicContact CE1-CG1 3.99Å; F573-V601 HydrophobicContact CG-CG2 4.4Å; F573-P611 HydrophobicContact CE1-CB 4.36Å; F573-P611 HydrophobicContact CE2-CB 3.88Å; F573-P611 HydrophobicContact CE2-CG 3.74Å; F573-P611 HydrophobicContact CZ-CB 3.62Å; F573-P611 HydrophobicContact CZ-CG 3.92Å
574	T	95.4	Very high	95.7	Very high	59 Å²	59	39 Å²	39	36%	0.362	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-17.9	-177.5	58.5	0	0	0	0	113.7	C571 T576 T597	C571-T574 WeakPolarHBondContact CB-OG1 3.33Å; T574-T576 WeakPolarHBondContact CB-OG1 3.23Å; T574-T576 PolarHBondContact O-N 2.89Å; T574-T576 VanDerWaalsContact O-N 3.07Å; T574-T576 PolarHBondContact OG1-N 2.98Å; T574-T576 PolarHBondContact OG1-OG1 3.17Å; T574-T597 HydrophobicContact CG2-CG2 3.78Å
575	M	95.3	Very high	95.9	Very high	129 Å²	129	41.8 Å²	41.8	64%	0.635	23%	0.23	S	C	*	.			trans	57.7	9.3	-166.2	-53.6	-59.9	173.3	0	0	114.8	K570 C571 P572	K570-M575 WeakPolarHBondContact CD-O 3.1Å; K570-M575 WeakPolarHBondContact CG-O 3.42Å; C571-M575 WeakPolarHBondContact O-CA 3.36Å; C571-M575 PolarHBondContact O-N 3.3Å; P572-M575 WeakPolarHBondContact O-CE 3.47Å
576	T	94.6	Very high	95.9	Very high	83 Å²	83	42.8 Å²	42.8	51%	0.509	23%	0.234	S	C	.	.	S	Bend	trans	-89.7	159.3	172.1	66	0	0	0	0	110.8	K570 C571 T574 M578	K570-T576 CarbonylContact C-O 3.55Å; K570-T576 WeakPolarHBondContact CA-O 3.47Å; C571-T576 PolarHBondContact N-O 3.2Å; T574-T576 WeakPolarHBondContact CB-OG1 3.23Å; T574-T576 PolarHBondContact O-N 2.89Å; T574-T576 VanDerWaalsContact O-N 3.07Å; T574-T576 PolarHBondContact OG1-N 2.98Å; T574-T576 PolarHBondContact OG1-OG1 3.17Å; T576-M578 PolarHBondContact O-N 2.89Å
577	K	95.2	Very high	95.9	Very high	61 Å²	61	40.2 Å²	40.2	27%	0.265	22%	0.218	S	C	.	.	B	Isolated β-bridge	trans	-54.1	135.1	170.8	-164.6	164.3	-176.8	168.8	0	109.7	L569 L632 L635 C638	L569-K577 HydrophobicContact CB-CG 4.49Å; L569-K577 WeakPolarHBondContact O-CA 3.28Å; K577-L632 HydrophobicContact CD-CD2 4.38Å; K577-L632 HydrophobicContact CG-CD2 3.72Å; K577-L635 PolarHBondContact NZ-O 2.63Å; K577-C638 PolarHBondContact NZ-O 2.84Å; K577-C638 VanDerWaalsContact NZ-O 3.15Å
578	M	96.9	Very high	95.7	Very high	10 Å²	10	48.4 Å²	48.4	5%	0.049	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-64.1	142.3	179.9	-70.2	178.9	-83.8	0	0	110.7	S568 L569 C571 T576 P581 C592 F593 D594 V628 L632	S568-M578 WeakPolarHBondContact O-CE 3.32Å; L569-M578 WeakPolarHBondContact O-CE 3.3Å; L569-M578 PolarHBondContact O-N 2.87Å; C571-M578 HydrophobicContact CB-CG 3.91Å; T576-M578 PolarHBondContact O-N 2.89Å; M578-P581 HydrophobicContact SD-CB 4.05Å; M578-C592 HydrophobicContact CE-CB 4.1Å; M578-C592 VanDerWaalsContact SD-C 3.54Å; M578-C592 HydrophobicContact SD-CB 3.78Å; M578-F593 VanDerWaalsContact SD-C 3.5Å; M578-D594 HydrophobicContact CB-CB 4.41Å; M578-D594 HydrophobicContact CG-CB 4.16Å; M578-V628 HydrophobicContact CE-CG1 4.29Å; M578-L632 HydrophobicContact CB-CD1 3.87Å
579	S	95.5	Very high	95.6	Very high	77 Å²	77	48.5 Å²	48.5	54%	0.538	25%	0.246	S	C	.	.	S	Bend	trans	-93.4	-42.5	173.6	69	0	0	0	0	111.7	D594	S579-D594 WeakPolarHBondContact CB-OD1 3.29Å; S579-D594 PolarHBondContact N-OD1 3.45Å; S579-D594 PolarHBondContact OG-OD1 2.96Å
580	L	96.6	Very high	95.5	Very high	13 Å²	13	49 Å²	49	7%	0.068	25%	0.248	C	C	.	.	S	Bend	trans	-136.2	96.6	178.9	-172.4	65.7	0	0	0	108.6	L525 V529 A582 D594 L595 I624 W629	L525-L580 HydrophobicContact CD1-CD2 3.91Å; V529-L580 HydrophobicContact CG2-CD2 3.72Å; L580-A582 PolarHBondContact O-N 3.12Å; L580-D594 PolarHBondContact N-OD1 3.47Å; L580-L595 HydrophobicContact CB-CB 4.48Å; L580-L595 HydrophobicContact CD2-CB 4.19Å; L580-L595 HydrophobicContact CD2-CD2 3.93Å; L580-L595 HydrophobicContact CG-CB 4.34Å; L580-L595 PolarHBondContact O-N 3.37Å; L580-I624 HydrophobicContact CD1-CD1 4.38Å; L580-I624 HydrophobicContact CD1-CG1 4.5Å; L580-I624 HydrophobicContact CD1-CG2 3.69Å; L580-I624 HydrophobicContact CD2-CD1 4Å; L580-I624 HydrophobicContact CD2-CG1 4.37Å; L580-I624 HydrophobicContact CG-CD1 4.33Å; L580-I624 HydrophobicContact CG-CG1 4.28Å; L580-I624 HydrophobicContact CG-CG2 4.19Å; L580-W629 HydrophobicContact CD1-CD2 4.36Å; L580-W629 HydrophobicContact CD1-CE3 4.39Å; L580-W629 HydrophobicContact CD1-CH2 4.3Å; L580-W629 HydrophobicContact CD1-CZ2 4.23Å; L580-W629 HydrophobicContact CD1-CZ3 4.37Å
581	P	98	Very high	95.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	127.6	-173.6	31.3	-35.6	0	0	0	110.8	M578 C592 I624 D625 V628 W629 L632	M578-P581 HydrophobicContact SD-CB 4.05Å; P581-C592 HydrophobicContact CB-CB 3.82Å; P581-I624 WeakPolarHBondContact O-CA 3.33Å; P581-D625 PolarHBondContact O-N 2.91Å; P581-V628 HydrophobicContact CB-CB 4.19Å; P581-V628 HydrophobicContact CB-CG1 3.77Å; P581-V628 HydrophobicContact CG-CB 4.23Å; P581-V628 HydrophobicContact CG-CG1 4.09Å; P581-W629 HydrophobicContact CG-CB 3.66Å; P581-W629 HydrophobicContact CG-CG 4.3Å; P581-L632 HydrophobicContact CB-CD1 4.02Å; P581-L632 HydrophobicContact CG-CD1 3.7Å
582	A	98	Very high	95.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	163.1	175.6	0	0	0	0	0	112.3	L580 C592 F593 L595 E623	L580-A582 PolarHBondContact O-N 3.12Å; A582-C592 WeakPolarHBondContact O-CA 3.25Å; A582-C592 WeakPolarHBondContact O-CB 3.15Å; A582-F593 HydrophobicContact CB-CD2 4.43Å; A582-F593 HydrophobicContact CB-CE2 4Å; A582-F593 HydrophobicContact CB-CZ 4.49Å; A582-F593 PolarHBondContact N-O 2.76Å; A582-F593 PolarHBondContact O-N 3.06Å; A582-L595 HydrophobicContact CB-CB 3.78Å; A582-L595 HydrophobicContact CB-CD1 3.98Å; A582-L595 HydrophobicContact CB-CD2 4.42Å; A582-L595 HydrophobicContact CB-CG 4.27Å; A582-E623 CarbonylContact C-O 3.59Å; A582-E623 WeakPolarHBondContact CA-O 3.34Å; A582-E623 VanDerWaalsContact CB-O 3.25Å; A582-E623 WeakPolarHBondContact CB-O 3.37Å
583	R	96.4	Very high	95.6	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.008	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	-175.7	167.1	59.2	175.7	71	126.3	8.3	108.9	C587 I590 C592 E623 D625	R583-C587 HydrophobicContact CB-CB 4.31Å; R583-I590 PolarHBondContact NH2-O 2.87Å; R583-C592 PolarHBondContact NH2-SG 2.92Å; R583-E623 HydrophobicContact CG-CG 3.8Å; R583-E623 WeakPolarHBondContact CG-OE1 3.25Å; R583-E623 PolarHBondContact N-O 3.04Å; R583-E623 PolarHBondContact O-N 3.02Å; R583-D625 IonicContact CZ-OD2 3.72Å; R583-D625 IonicContact NE-OD2 2.7Å; R583-D625 IonicContact NH1-OD2 2.71Å; R583-D625 PolarHBondContact NH1-OD2 3.23Å; R583-D625 IonicContact NH2-OD1 3.72Å; R583-D625 IonicContact NH2-OD2 2.86Å; R583-D625 PolarHBondContact NH2-OD2 3.31Å; R583-D625 VanDerWaalsContact NH2-OD2 3.13Å
584	C	96.1	Very high	95.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	150.3	169.2	-43.7	0	0	0	0	109.6	D586 C587 T617 N621	C584-D586 PolarHBondContact O-N 3Å; C584-D586 VanDerWaalsContact O-N 3.11Å; C584-C587 VanDerWaalsContact CB-SG 3.53Å; C584-C587 PolarHBondContact N-SG 3Å; C584-C587 WeakPolarHBondContact O-CB 3.42Å; C584-C587 PolarHBondContact O-N 3.44Å; C584-C587 PolarHBondContact O-SG 3.21Å; C584-T617 PolarHBondContact SG-OG1 3.36Å; C584-N621 CarbonylContact C-O 3.3Å; C584-N621 VanDerWaalsContact CA-O 3.25Å; C584-N621 WeakPolarHBondContact CA-O 3.5Å
585	N	94	Very high	95.9	Very high	98 Å²	98	38.5 Å²	38.5	52%	0.524	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-34.4	-175.4	-174	19.8	0	0	0	113.5	K542 N621 E623	K542-N585 PolarHBondContact NZ-O 3.34Å; K542-N585 PolarHBondContact NZ-OD1 3.31Å; N585-N621 PolarHBondContact N-O 2.83Å; N585-E623 WeakPolarHBondContact CA-OE2 3.42Å; N585-E623 PolarHBondContact OD1-OE2 3.21Å
586	D	92.6	Very high	95.9	Very high	63 Å²	63	34.9 Å²	34.9	34%	0.337	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	3.8	-179.7	78.6	-56.2	0	0	0	114.5	C584 R588 R615	C584-D586 PolarHBondContact O-N 3Å; C584-D586 VanDerWaalsContact O-N 3.11Å; D586-R588 PolarHBondContact O-N 2.91Å; D586-R615 PolarHBondContact O-NH1 3.37Å; D586-R615 VanDerWaalsContact OD2-CD 3.28Å; D586-R615 WeakPolarHBondContact OD2-CD 3.38Å; D586-R615 IonicContact OD2-CZ 3.12Å; D586-R615 IonicContact OD2-NE 3.46Å; D586-R615 IonicContact OD2-NH1 3.16Å; D586-R615 PolarHBondContact OD2-NH1 2.91Å
587	C	94.7	Very high	95.9	Very high	9 Å²	9	32.3 Å²	32.3	6%	0.061	16%	0.159	C	C	.	.			trans	-63.8	128.5	178.4	-72.7	0	0	0	0	111.6	R583 C584 H589	R583-C587 HydrophobicContact CB-CB 4.31Å; C584-C587 VanDerWaalsContact CB-SG 3.53Å; C584-C587 PolarHBondContact N-SG 3Å; C584-C587 WeakPolarHBondContact O-CB 3.42Å; C584-C587 PolarHBondContact O-N 3.44Å; C584-C587 PolarHBondContact O-SG 3.21Å; C587-H589 WeakPolarHBondContact CB-NE2 3.26Å; C587-H589 VanDerWaalsContact SG-CE1 3.54Å; C587-H589 PolarHBondContact SG-NE2 3.45Å
588	R	92.2	Very high	96	Very high	177 Å²	177	29.4 Å²	29.4	67%	0.668	15%	0.146	S	C	*	.			trans	-93	7.4	174	-63.1	-170.6	179	-174.2	-1	114	S546 D586	S546-R588 VanDerWaalsContact CB-O 3.32Å; S546-R588 WeakPolarHBondContact CB-O 3.17Å; D586-R588 PolarHBondContact O-N 2.91Å
589	H	94.5	Very high	95.9	Very high	31 Å²	31	28.9 Å²	28.9	14%	0.144	14%	0.144	C	C	.	.			trans	-112.9	148.3	-178.1	54	78.1	0	0	0	111.8	C587 Q591 C610 I612 C613	C587-H589 WeakPolarHBondContact CB-NE2 3.26Å; C587-H589 VanDerWaalsContact SG-CE1 3.54Å; C587-H589 PolarHBondContact SG-NE2 3.45Å; H589-Q591 PolarHBondContact CE1-O 3.4Å; H589-Q591 PolarHBondContact ND1-O 2.62Å; H589-C610 PolarHBondContact NE2-SG 3.09Å; H589-I612 HydrophobicContact CB-CG2 4.13Å; H589-C613 VanDerWaalsContact CD2-SG 3.51Å; H589-C613 PolarHBondContact NE2-SG 2.9Å
590	I	95.2	Very high	95.7	Very high	9 Å²	9	29.1 Å²	29.1	5%	0.046	14%	0.137	C	C	.	.	S	Bend	trans	-75.9	-33.3	176.3	-50.5	171.4	0	0	0	111.3	I543 S546 F547 I567 R583 C592 I646	I543-I590 HydrophobicContact CD1-CG2 4.27Å; I543-I590 HydrophobicContact CG1-CD1 4.45Å; I543-I590 HydrophobicContact CG1-CG1 4.09Å; I543-I590 HydrophobicContact CG1-CG2 3.87Å; I543-I590 HydrophobicContact CG2-CD1 4Å; I543-I590 HydrophobicContact CG2-CG1 4.46Å; S546-I590 WeakPolarHBondContact OG-CG1 3.28Å; F547-I590 HydrophobicContact CE2-CD1 3.82Å; F547-I590 HydrophobicContact CZ-CD1 4.05Å; I567-I590 HydrophobicContact CD1-CG2 4.29Å; I567-I590 HydrophobicContact CG2-CB 3.99Å; I567-I590 HydrophobicContact CG2-CG2 4Å; R583-I590 PolarHBondContact NH2-O 2.87Å; I590-C592 PolarHBondContact O-N 3.2Å; I590-I646 HydrophobicContact CG2-CD1 3.68Å
591	Q	96.9	Very high	95.4	Very high	36 Å²	36	31 Å²	31	17%	0.168	15%	0.149	C	C	.	.			trans	-57.2	132.5	-178.4	-178.3	60.2	55.8	0	0	111.9	S568 H589 I612	S568-Q591 PolarHBondContact O-NE2 3.26Å; S568-Q591 PolarHBondContact O-OE1 2.82Å; H589-Q591 PolarHBondContact CE1-O 3.4Å; H589-Q591 PolarHBondContact ND1-O 2.62Å; Q591-I612 HydrophobicContact CB-CG1 4.42Å; Q591-I612 HydrophobicContact CB-CG2 4.1Å; Q591-I612 HydrophobicContact CG-CD1 3.65Å; Q591-I612 HydrophobicContact CG-CG1 4.04Å; Q591-I612 HydrophobicContact CG-CG2 4.3Å
592	C	97.9	Very high	95.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.15	C	C	.	.			trans	-105	172.4	176.1	-72.6	0	0	0	0	112	M578 P581 A582 R583 I590 V628	M578-C592 HydrophobicContact CE-CB 4.1Å; M578-C592 VanDerWaalsContact SD-C 3.54Å; M578-C592 HydrophobicContact SD-CB 3.78Å; P581-C592 HydrophobicContact CB-CB 3.82Å; A582-C592 WeakPolarHBondContact O-CA 3.25Å; A582-C592 WeakPolarHBondContact O-CB 3.15Å; R583-C592 PolarHBondContact NH2-SG 2.92Å; I590-C592 PolarHBondContact O-N 3.2Å; C592-V628 HydrophobicContact CB-CG1 4.39Å
593	F	98.1	Very high	94.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	161.4	168.3	53.2	-97.9	0	0	0	110.3	P572 M578 A582 L595 F598 P611 L622	P572-F593 HydrophobicContact CG-CB 3.93Å; M578-F593 VanDerWaalsContact SD-C 3.5Å; A582-F593 HydrophobicContact CB-CD2 4.43Å; A582-F593 HydrophobicContact CB-CE2 4Å; A582-F593 HydrophobicContact CB-CZ 4.49Å; A582-F593 PolarHBondContact N-O 2.76Å; A582-F593 PolarHBondContact O-N 3.06Å; F593-L595 PolarHBondContact O-N 2.88Å; F593-F598 HydrophobicContact CD2-CB 3.67Å; F593-F598 HydrophobicContact CD2-CD2 4.19Å; F593-F598 AromaticContact CD2-CG 3.9Å; F593-F598 HydrophobicContact CD2-CG 3.9Å; F593-F598 HydrophobicContact CE2-CB 3.7Å; F593-F598 AromaticContact CE2-CD1 3.76Å; F593-F598 HydrophobicContact CE2-CD1 3.76Å; F593-F598 AromaticContact CE2-CD2 3.98Å; F593-F598 HydrophobicContact CE2-CD2 3.98Å; F593-F598 HydrophobicContact CE2-CE1 4.38Å; F593-F598 AromaticContact CE2-CG 3.53Å; F593-F598 HydrophobicContact CE2-CG 3.53Å; F593-F598 HydrophobicContact CZ-CD1 4.31Å; F593-F598 HydrophobicContact CZ-CD2 4.44Å; F593-F598 HydrophobicContact CZ-CE1 4.5Å; F593-F598 HydrophobicContact CZ-CG 4.28Å; F593-P611 HydrophobicContact CB-CG 3.84Å; F593-P611 HydrophobicContact CD1-CG 3.46Å; F593-P611 VanDerWaalsContact CD1-CG 3.46Å; F593-P611 HydrophobicContact CE1-CG 4.14Å; F593-P611 HydrophobicContact CG-CG 3.73Å; F593-L622 HydrophobicContact CE2-CD2 4.37Å; F593-L622 HydrophobicContact CZ-CD2 3.96Å
594	D	97.8	Very high	93.4	Very high	8 Å²	8	34 Å²	34	4%	0.043	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	123.2	176.4	-179.4	87.9	0	0	0	111.1	C571 M578 S579 L580 K596 T597 F598	C571-D594 HydrophobicContact CB-CB 3.78Å; C571-D594 VanDerWaalsContact SG-CB 3.57Å; C571-D594 PolarHBondContact SG-N 3.46Å; M578-D594 HydrophobicContact CB-CB 4.41Å; M578-D594 HydrophobicContact CG-CB 4.16Å; S579-D594 WeakPolarHBondContact CB-OD1 3.29Å; S579-D594 PolarHBondContact N-OD1 3.45Å; S579-D594 PolarHBondContact OG-OD1 2.96Å; L580-D594 PolarHBondContact N-OD1 3.47Å; D594-K596 PolarHBondContact OD2-N 3.39Å; D594-T597 PolarHBondContact O-N 2.82Å; D594-T597 WeakPolarHBondContact OD2-CB 3.46Å; D594-T597 PolarHBondContact OD2-N 2.61Å; D594-T597 PolarHBondContact OD2-OG1 3.37Å; D594-F598 WeakPolarHBondContact O-CB 3.28Å; D594-F598 PolarHBondContact O-N 3.15Å
595	L	97.3	Very high	92.5	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-64.5	-45.3	-173.5	-178.5	55.5	0	0	0	112.8	L525 L528 L580 A582 F593 T597 F598 L599 L622 I624	L525-L595 HydrophobicContact CD1-CB 4.32Å; L525-L595 HydrophobicContact CD1-CD2 3.82Å; L525-L595 HydrophobicContact CD1-CG 3.76Å; L528-L595 HydrophobicContact CB-CD2 4.14Å; L528-L595 HydrophobicContact CD1-CD1 4.07Å; L528-L595 HydrophobicContact CD1-CD2 4.04Å; L528-L595 HydrophobicContact CD1-CG 4.44Å; L580-L595 HydrophobicContact CB-CB 4.48Å; L580-L595 HydrophobicContact CD2-CB 4.19Å; L580-L595 HydrophobicContact CD2-CD2 3.93Å; L580-L595 HydrophobicContact CG-CB 4.34Å; L580-L595 PolarHBondContact O-N 3.37Å; A582-L595 HydrophobicContact CB-CB 3.78Å; A582-L595 HydrophobicContact CB-CD1 3.98Å; A582-L595 HydrophobicContact CB-CD2 4.42Å; A582-L595 HydrophobicContact CB-CG 4.27Å; F593-L595 PolarHBondContact O-N 2.88Å; L595-T597 VanDerWaalsContact C-N 3.31Å; L595-T597 PolarHBondContact O-N 3.47Å; L595-F598 PolarHBondContact O-N 2.82Å; L595-F598 VanDerWaalsContact O-N 3.15Å; L595-L599 HydrophobicContact CD1-CG 4.28Å; L595-L599 WeakPolarHBondContact O-CG 3.27Å; L595-L599 PolarHBondContact O-N 3.36Å; L595-L622 HydrophobicContact CD1-CD1 3.74Å; L595-I624 HydrophobicContact CD2-CD1 3.77Å; L595-I624 HydrophobicContact CD2-CG1 3.6Å
596	K	95.4	Very high	91.5	Very high	54 Å²	54	39.6 Å²	39.6	24%	0.235	18%	0.183	C	C	.	.	H	α-helix	trans	-62.1	-43.8	-178.3	-178.4	166.1	-176.6	145.7	0	110.5	E522 L525 D594 L599 M600	E522-K596 VanDerWaalsContact OE1-CE 3.22Å; E522-K596 WeakPolarHBondContact OE1-CE 3.47Å; E522-K596 IonicContact OE1-NZ 2.95Å; E522-K596 PolarHBondContact OE1-NZ 3.05Å; E522-K596 IonicContact OE2-NZ 3.82Å; E522-K596 PolarHBondContact OE2-NZ 3.2Å; L525-K596 HydrophobicContact CD1-CB 4.32Å; L525-K596 HydrophobicContact CD2-CB 3.98Å; L525-K596 HydrophobicContact CD2-CD 3.84Å; L525-K596 HydrophobicContact CD2-CG 3.97Å; D594-K596 PolarHBondContact OD2-N 3.39Å; K596-L599 PolarHBondContact O-N 3.07Å; K596-M600 WeakPolarHBondContact O-CG 3.28Å; K596-M600 PolarHBondContact O-N 3.37Å
597	T	95.5	Very high	90.9	Very high	28 Å²	28	39.6 Å²	39.6	17%	0.172	18%	0.181	C	C	.	.	H	α-helix	trans	-60.7	-44.7	173.6	-51.4	0	0	0	0	111.7	F573 T574 D594 L595 L599 M600 V601	F573-T597 HydrophobicContact CB-CG2 3.62Å; F573-T597 HydrophobicContact CD2-CG2 4.19Å; F573-T597 HydrophobicContact CG-CG2 4.18Å; T574-T597 HydrophobicContact CG2-CG2 3.78Å; D594-T597 PolarHBondContact O-N 2.82Å; D594-T597 WeakPolarHBondContact OD2-CB 3.46Å; D594-T597 PolarHBondContact OD2-N 2.61Å; D594-T597 PolarHBondContact OD2-OG1 3.37Å; L595-T597 VanDerWaalsContact C-N 3.31Å; L595-T597 PolarHBondContact O-N 3.47Å; T597-L599 PolarHBondContact O-N 3.41Å; T597-M600 PolarHBondContact O-N 3.3Å; T597-V601 HydrophobicContact CG2-CG2 4.37Å; T597-V601 WeakPolarHBondContact O-CG2 3.38Å; T597-V601 PolarHBondContact O-N 3.38Å
598	F	96	Very high	90.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.1	-41.4	179.4	-176.8	-105	0	0	0	112.7	F573 F593 D594 L595 N602 W608 Q609 T617 L622	F573-F598 HydrophobicContact CE2-CB 4.38Å; F573-F598 AromaticContact CE2-CD2 3.76Å; F573-F598 HydrophobicContact CE2-CD2 3.76Å; F573-F598 AromaticContact CZ-CD2 3.88Å; F573-F598 HydrophobicContact CZ-CD2 3.88Å; F573-F598 HydrophobicContact CZ-CE2 4.44Å; F593-F598 HydrophobicContact CD2-CB 3.67Å; F593-F598 HydrophobicContact CD2-CD2 4.19Å; F593-F598 AromaticContact CD2-CG 3.9Å; F593-F598 HydrophobicContact CD2-CG 3.9Å; F593-F598 HydrophobicContact CE2-CB 3.7Å; F593-F598 AromaticContact CE2-CD1 3.76Å; F593-F598 HydrophobicContact CE2-CD1 3.76Å; F593-F598 AromaticContact CE2-CD2 3.98Å; F593-F598 HydrophobicContact CE2-CD2 3.98Å; F593-F598 HydrophobicContact CE2-CE1 4.38Å; F593-F598 AromaticContact CE2-CG 3.53Å; F593-F598 HydrophobicContact CE2-CG 3.53Å; F593-F598 HydrophobicContact CZ-CD1 4.31Å; F593-F598 HydrophobicContact CZ-CD2 4.44Å; F593-F598 HydrophobicContact CZ-CE1 4.5Å; F593-F598 HydrophobicContact CZ-CG 4.28Å; D594-F598 WeakPolarHBondContact O-CB 3.28Å; D594-F598 PolarHBondContact O-N 3.15Å; L595-F598 PolarHBondContact O-N 2.82Å; L595-F598 VanDerWaalsContact O-N 3.15Å; F598-N602 WeakPolarHBondContact CD2-ND2 3.33Å; F598-N602 VanDerWaalsContact CE2-ND2 3.26Å; F598-N602 WeakPolarHBondContact CE2-ND2 3.15Å; F598-N602 PolarHBondContact O-N 2.99Å; F598-N602 PolarHBondContact O-ND2 3.41Å; F598-W608 HydrophobicContact CD1-CE3 4.49Å; F598-W608 HydrophobicContact CD1-CZ3 4.44Å; F598-W608 AromaticContact CE1-CE3 3.61Å; F598-W608 HydrophobicContact CE1-CE3 3.61Å; F598-W608 AromaticContact CE1-CZ3 3.95Å; F598-W608 HydrophobicContact CE1-CZ3 3.95Å; F598-W608 HydrophobicContact CZ-CE3 4.14Å; F598-Q609 WeakPolarHBondContact CE2-O 3.38Å; F598-T617 HydrophobicContact CE1-CG2 4.42Å; F598-T617 HydrophobicContact CZ-CG2 3.99Å; F598-L622 HydrophobicContact CD1-CD1 3.93Å; F598-L622 HydrophobicContact CD1-CD2 4.16Å; F598-L622 HydrophobicContact CE1-CD1 3.92Å; F598-L622 HydrophobicContact CE1-CD2 3.79Å; F598-L622 HydrophobicContact CE1-CG 4.43Å
599	L	95.1	Very high	90.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.6	-43.9	173.4	-64.3	179.4	0	0	0	111.4	M401 V521 V524 L525 L528 L595 K596 T597 N602 K603 W608 L622	M401-L599 HydrophobicContact CE-CB 3.92Å; M401-L599 HydrophobicContact CE-CD2 3.9Å; M401-L599 HydrophobicContact CE-CG 4.47Å; M401-L599 WeakPolarHBondContact CE-O 3.45Å; M401-L599 HydrophobicContact SD-CB 4.05Å; M401-L599 HydrophobicContact SD-CD2 4.12Å; M401-L599 HydrophobicContact SD-CG 4.45Å; V521-L599 HydrophobicContact CG1-CB 3.9Å; V521-L599 HydrophobicContact CG1-CD1 4.28Å; V524-L599 HydrophobicContact CG1-CD1 4.22Å; V524-L599 HydrophobicContact CG1-CD2 4.35Å; L525-L599 HydrophobicContact CB-CD1 3.98Å; L525-L599 HydrophobicContact CD1-CD1 3.96Å; L528-L599 HydrophobicContact CD1-CD1 4.16Å; L528-L599 HydrophobicContact CD1-CD2 4.12Å; L595-L599 HydrophobicContact CD1-CG 4.28Å; L595-L599 WeakPolarHBondContact O-CG 3.27Å; L595-L599 PolarHBondContact O-N 3.36Å; K596-L599 PolarHBondContact O-N 3.07Å; T597-L599 PolarHBondContact O-N 3.41Å; L599-N602 CarbonylContact O-C 3.58Å; L599-N602 PolarHBondContact O-N 2.91Å; L599-K603 PolarHBondContact O-N 2.79Å; L599-W608 HydrophobicContact CD2-CH2 3.88Å; L599-W608 HydrophobicContact CD2-CZ3 4Å; L599-L622 HydrophobicContact CD2-CD1 4.2Å
600	M	92.2	Very high	90.8	Very high	82 Å²	82	34.7 Å²	34.7	40%	0.404	16%	0.164	S	C	.	.	H	α-helix	trans	-61.9	-43.9	178.6	-74.4	-64.7	-67.5	0	0	112.9	P399 V521 K596 T597 N602 K603	P399-M600 HydrophobicContact CB-CE 3.93Å; P399-M600 HydrophobicContact CB-SD 3.69Å; P399-M600 HydrophobicContact CG-CE 3.89Å; P399-M600 HydrophobicContact CG-SD 3.56Å; P399-M600 VanDerWaalsContact CG-SD 3.56Å; V521-M600 HydrophobicContact CB-SD 4.24Å; V521-M600 HydrophobicContact CG1-CG 4.32Å; V521-M600 HydrophobicContact CG1-SD 4.02Å; V521-M600 HydrophobicContact CG2-SD 3.97Å; K596-M600 WeakPolarHBondContact O-CG 3.28Å; K596-M600 PolarHBondContact O-N 3.37Å; T597-M600 PolarHBondContact O-N 3.3Å; M600-N602 VanDerWaalsContact C-N 3.25Å; M600-N602 PolarHBondContact O-N 3.38Å; M600-K603 PolarHBondContact O-N 3.22Å
601	V	90	Very high	90.8	Very high	51 Å²	51	36.5 Å²	36.5	31%	0.309	18%	0.176	S	C	.	.	H	α-helix	trans	-66.6	-27	178.1	170.6	0	0	0	0	112.4	F573 T597 R605	F573-V601 HydrophobicContact CD1-CG1 4.37Å; F573-V601 HydrophobicContact CD1-CG2 4.17Å; F573-V601 HydrophobicContact CE1-CG1 3.99Å; F573-V601 HydrophobicContact CG-CG2 4.4Å; T597-V601 HydrophobicContact CG2-CG2 4.37Å; T597-V601 WeakPolarHBondContact O-CG2 3.38Å; T597-V601 PolarHBondContact O-N 3.38Å; V601-R605 PolarHBondContact O-NE 3.46Å
602	N	90.4	Very high	90.8	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-105.9	7.9	-179	-62.7	-80.2	0	0	0	114.3	F598 L599 M600 D604 R605 W608	F598-N602 WeakPolarHBondContact CD2-ND2 3.33Å; F598-N602 VanDerWaalsContact CE2-ND2 3.26Å; F598-N602 WeakPolarHBondContact CE2-ND2 3.15Å; F598-N602 PolarHBondContact O-N 2.99Å; F598-N602 PolarHBondContact O-ND2 3.41Å; L599-N602 CarbonylContact O-C 3.58Å; L599-N602 PolarHBondContact O-N 2.91Å; M600-N602 VanDerWaalsContact C-N 3.25Å; M600-N602 PolarHBondContact O-N 3.38Å; N602-D604 PolarHBondContact O-N 3.16Å; N602-D604 VanDerWaalsContact O-N 3.08Å; N602-R605 HydrophobicContact CB-CB 4.32Å; N602-R605 PolarHBondContact O-N 3.44Å; N602-R605 WeakPolarHBondContact OD1-CD 3.25Å; N602-W608 HydrophobicContact CB-CD2 3.76Å; N602-W608 HydrophobicContact CB-CE3 4.3Å; N602-W608 HydrophobicContact CB-CG 4.07Å; N602-W608 HydrophobicContact CB-CH2 4.38Å; N602-W608 HydrophobicContact CB-CZ2 3.88Å
603	K	86.1	Confident	90.7	Very high	21 Å²	21	39.9 Å²	39.9	9%	0.091	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-35.6	-174.9	82.9	170.9	-171.2	171.5	0	113.7	D395 D396 P399 M401 V521 L599 M600	D395-K603 PolarHBondContact O-NZ 3.09Å; D396-K603 IonicContact OD1-NZ 3.07Å; D396-K603 PolarHBondContact OD1-NZ 2.79Å; P399-K603 HydrophobicContact CB-CD 3.82Å; M401-K603 HydrophobicContact CG-CB 4.37Å; V521-K603 HydrophobicContact CG2-CB 4.42Å; L599-K603 PolarHBondContact O-N 2.79Å; M600-K603 PolarHBondContact O-N 3.22Å
604	D	74	Confident	90.5	Very high	40 Å²	40	42.8 Å²	42.8	21%	0.214	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-7	-178.7	-51.2	-65.7	0	0	0	113.5	R483 N602	R483-D604 HydrophobicContact CG-CB 4.39Å; R483-D604 IonicContact CZ-OD1 3.62Å; R483-D604 IonicContact CZ-OD2 2.99Å; R483-D604 VanDerWaalsContact CZ-OD2 3.27Å; R483-D604 IonicContact NE-OD1 3.57Å; R483-D604 PolarHBondContact NE-OD1 2.9Å; R483-D604 IonicContact NE-OD2 3.27Å; R483-D604 PolarHBondContact NE-OD2 3.44Å; R483-D604 VanDerWaalsContact NE-OD2 3.14Å; R483-D604 IonicContact NH2-OD1 3.65Å; R483-D604 IonicContact NH2-OD2 2.71Å; R483-D604 PolarHBondContact NH2-OD2 2.82Å; N602-D604 PolarHBondContact O-N 3.16Å; N602-D604 VanDerWaalsContact O-N 3.08Å
605	R	77.4	Confident	90.3	Very high	141 Å²	141	46.7 Å²	46.7	53%	0.532	24%	0.237	S	C	.	.			trans	-88	139.3	-172.1	-65.9	-177.5	177.3	-174.2	-1	111	V601 N602 W608	V601-R605 PolarHBondContact O-NE 3.46Å; N602-R605 HydrophobicContact CB-CB 4.32Å; N602-R605 PolarHBondContact O-N 3.44Å; N602-R605 WeakPolarHBondContact OD1-CD 3.25Å; R605-W608 PolarHBondContact O-NE1 3.37Å
606	L	71.7	Confident	90.1	Very high	75 Å²	75	50.7 Å²	50.7	39%	0.393	26%	0.262	S	S	.	.	S	Bend	trans	-93.2	-29	176.2	-56.5	179.5	0	0	0	113
607	H	81	Confident	89.9	Confident	63 Å²	63	48.6 Å²	48.6	29%	0.292	25%	0.254	S	S	.	.	S	Bend	trans	-109.3	119.1	174.8	-171.3	83.1	0	0	0	109.5	F456 Q609	F456-H607 AromaticContact CD1-ND1 3.93Å; H607-Q609 PolarHBondContact CD2-NE2 3.2Å; H607-Q609 PolarHBondContact NE2-NE2 3.14Å
608	W	89.7	Confident	89.8	Confident	23 Å²	23	49.3 Å²	49.3	9%	0.087	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	141.8	-177.1	-63.5	21.1	0	0	0	109.3	M401 F598 L599 N602 R605 P616 T617 V619 L622	M401-W608 HydrophobicContact CE-CH2 3.41Å; M401-W608 VanDerWaalsContact CE-CH2 3.41Å; M401-W608 HydrophobicContact CE-CZ2 3.57Å; F598-W608 HydrophobicContact CD1-CE3 4.49Å; F598-W608 HydrophobicContact CD1-CZ3 4.44Å; F598-W608 AromaticContact CE1-CE3 3.61Å; F598-W608 HydrophobicContact CE1-CE3 3.61Å; F598-W608 AromaticContact CE1-CZ3 3.95Å; F598-W608 HydrophobicContact CE1-CZ3 3.95Å; F598-W608 HydrophobicContact CZ-CE3 4.14Å; L599-W608 HydrophobicContact CD2-CH2 3.88Å; L599-W608 HydrophobicContact CD2-CZ3 4Å; N602-W608 HydrophobicContact CB-CD2 3.76Å; N602-W608 HydrophobicContact CB-CE3 4.3Å; N602-W608 HydrophobicContact CB-CG 4.07Å; N602-W608 HydrophobicContact CB-CH2 4.38Å; N602-W608 HydrophobicContact CB-CZ2 3.88Å; R605-W608 PolarHBondContact O-NE1 3.37Å; W608-P616 CarbonylContact O-C 3.6Å; W608-P616 WeakPolarHBondContact O-CA 3.5Å; W608-T617 HydrophobicContact CB-CG2 3.91Å; W608-T617 PolarHBondContact O-N 3.31Å; W608-V619 HydrophobicContact CE3-CG2 4.34Å; W608-V619 HydrophobicContact CH2-CG2 3.16Å; W608-V619 HydrophobicContact CZ2-CG2 4.01Å; W608-V619 HydrophobicContact CZ3-CB 4.47Å; W608-V619 HydrophobicContact CZ3-CG2 3.36Å; W608-L622 HydrophobicContact CZ3-CD1 4.09Å
609	Q	93.4	Very high	89.6	Confident	90 Å²	90	50.5 Å²	50.5	42%	0.421	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	145.2	177.8	-68.7	176.7	-0.9	0	0	110.6	F598 H607 A614 R615	F598-Q609 WeakPolarHBondContact CE2-O 3.38Å; H607-Q609 PolarHBondContact CD2-NE2 3.2Å; H607-Q609 PolarHBondContact NE2-NE2 3.14Å; Q609-A614 WeakPolarHBondContact CG-O 3.4Å; Q609-R615 CarbonylContact C-O 3.45Å; Q609-R615 VanDerWaalsContact CA-O 3.28Å; Q609-R615 WeakPolarHBondContact CA-O 3.32Å
610	C	96	Very high	89.4	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.007	28%	0.279	C	S	.	.			trans	-63.1	126.4	171.9	177	0	0	0	0	110	H589 I612 C613 A614 R615	H589-C610 PolarHBondContact NE2-SG 3.09Å; C610-I612 PolarHBondContact O-N 3.34Å; C610-I612 VanDerWaalsContact O-N 3.09Å; C610-C613 PolarHBondContact O-N 3.29Å; C610-A614 VanDerWaalsContact O-CA 3.3Å; C610-A614 WeakPolarHBondContact O-CA 3.34Å; C610-A614 PolarHBondContact O-N 3.23Å; C610-R615 PolarHBondContact N-O 3.25Å
611	P	95.4	Very high	89.5	Confident	47 Å²	47	52.6 Å²	52.6	31%	0.305	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-12.6	-176.8	28.6	-37.6	0	0	0	114.5	P572 F573 F593	P572-P611 HydrophobicContact CG-CB 4.03Å; P572-P611 HydrophobicContact CG-CG 3.98Å; F573-P611 HydrophobicContact CE1-CB 4.36Å; F573-P611 HydrophobicContact CE2-CB 3.88Å; F573-P611 HydrophobicContact CE2-CG 3.74Å; F573-P611 HydrophobicContact CZ-CB 3.62Å; F573-P611 HydrophobicContact CZ-CG 3.92Å; F593-P611 HydrophobicContact CB-CG 3.84Å; F593-P611 HydrophobicContact CD1-CG 3.46Å; F593-P611 VanDerWaalsContact CD1-CG 3.46Å; F593-P611 HydrophobicContact CE1-CG 4.14Å; F593-P611 HydrophobicContact CG-CG 3.73Å
612	I	96.4	Very high	89.8	Confident	61 Å²	61	50.3 Å²	50.3	31%	0.313	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-36.1	-177.2	-49.5	-53.8	0	0	0	112.1	P572 H589 Q591 C610	P572-I612 HydrophobicContact CB-CD1 4.39Å; P572-I612 HydrophobicContact CG-CD1 3.96Å; H589-I612 HydrophobicContact CB-CG2 4.13Å; Q591-I612 HydrophobicContact CB-CG1 4.42Å; Q591-I612 HydrophobicContact CB-CG2 4.1Å; Q591-I612 HydrophobicContact CG-CD1 3.65Å; Q591-I612 HydrophobicContact CG-CG1 4.04Å; Q591-I612 HydrophobicContact CG-CG2 4.3Å; C610-I612 PolarHBondContact O-N 3.34Å; C610-I612 VanDerWaalsContact O-N 3.09Å
613	C	95.8	Very high	90.1	Very high	46 Å²	46	50.9 Å²	50.9	31%	0.311	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.8	9.6	-174.3	63.4	0	0	0	0	115.1	H589 C610 R615	H589-C613 VanDerWaalsContact CD2-SG 3.51Å; H589-C613 PolarHBondContact NE2-SG 2.9Å; C610-C613 PolarHBondContact O-N 3.29Å; C613-R615 HydrophobicContact CB-CG 4.38Å; C613-R615 PolarHBondContact O-N 3.4Å; C613-R615 VanDerWaalsContact SG-CD 3.57Å
614	A	94.1	Very high	90.7	Very high	62 Å²	62	50 Å²	50	51%	0.512	26%	0.261	S	S	.	.			trans	56.1	7.7	179.2	0	0	0	0	0	116.4	Q609 C610	Q609-A614 WeakPolarHBondContact CG-O 3.4Å; C610-A614 VanDerWaalsContact O-CA 3.3Å; C610-A614 WeakPolarHBondContact O-CA 3.34Å; C610-A614 PolarHBondContact O-N 3.23Å
615	R	93.3	Very high	91.8	Very high	90 Å²	90	48 Å²	48	34%	0.34	25%	0.251	S	S	.	.			trans	-64.8	131	179.7	-70	179.1	164.1	-120.3	-7.9	111.2	D586 Q609 C610 C613	D586-R615 PolarHBondContact O-NH1 3.37Å; D586-R615 VanDerWaalsContact OD2-CD 3.28Å; D586-R615 WeakPolarHBondContact OD2-CD 3.38Å; D586-R615 IonicContact OD2-CZ 3.12Å; D586-R615 IonicContact OD2-NE 3.46Å; D586-R615 IonicContact OD2-NH1 3.16Å; D586-R615 PolarHBondContact OD2-NH1 2.91Å; Q609-R615 CarbonylContact C-O 3.45Å; Q609-R615 VanDerWaalsContact CA-O 3.28Å; Q609-R615 WeakPolarHBondContact CA-O 3.32Å; C610-R615 PolarHBondContact N-O 3.25Å; C613-R615 HydrophobicContact CB-CG 4.38Å; C613-R615 PolarHBondContact O-N 3.4Å; C613-R615 VanDerWaalsContact SG-CD 3.57Å
616	P	92.3	Very high	92.7	Very high	85 Å²	85	44 Å²	44	55%	0.552	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-56.6	139.5	172.6	-26.1	35.6	0	0	0	112	W608	W608-P616 CarbonylContact O-C 3.6Å; W608-P616 WeakPolarHBondContact O-CA 3.5Å
617	T	92.7	Very high	94	Very high	10 Å²	10	40.9 Å²	40.9	6%	0.061	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	172.6	-176.6	-166.3	0	0	0	0	111.7	C584 F598 W608	C584-T617 PolarHBondContact SG-OG1 3.36Å; F598-T617 HydrophobicContact CE1-CG2 4.42Å; F598-T617 HydrophobicContact CZ-CG2 3.99Å; W608-T617 HydrophobicContact CB-CG2 3.91Å; W608-T617 PolarHBondContact O-N 3.31Å
618	T	91.8	Very high	94.7	Very high	43 Å²	43	37.9 Å²	37.9	26%	0.264	21%	0.207	S	C	.	.			trans	-138.5	168	174.5	68.7	0	0	0	0	109.1	E620 N621	T618-E620 PolarHBondContact O-N 3.17Å; T618-E620 PolarHBondContact OG1-N 2.99Å; T618-N621 PolarHBondContact O-N 2.89Å
619	V	92.9	Very high	95.1	Very high	26 Å²	26	38.1 Å²	38.1	16%	0.158	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-53.7	-35.6	173	172.4	0	0	0	0	112.1	F403 V524 L528 W608 N621 L622	F403-V619 HydrophobicContact CE1-CB 4.27Å; F403-V619 HydrophobicContact CE1-CG2 3.71Å; F403-V619 HydrophobicContact CZ-CG2 3.94Å; V524-V619 HydrophobicContact CG1-CG1 4.16Å; L528-V619 HydrophobicContact CD1-CG1 4.33Å; L528-V619 HydrophobicContact CD2-CG1 3.9Å; L528-V619 HydrophobicContact CG-CG1 4.41Å; W608-V619 HydrophobicContact CE3-CG2 4.34Å; W608-V619 HydrophobicContact CH2-CG2 3.16Å; W608-V619 HydrophobicContact CZ2-CG2 4.01Å; W608-V619 HydrophobicContact CZ3-CB 4.47Å; W608-V619 HydrophobicContact CZ3-CG2 3.36Å; V619-N621 VanDerWaalsContact C-N 3.28Å; V619-N621 PolarHBondContact O-N 3.38Å; V619-L622 PolarHBondContact O-N 3.03Å
620	E	90.9	Very high	95.2	Very high	59 Å²	59	35 Å²	35	28%	0.276	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-66.7	-28.8	-180	-65.8	157.4	-166.1	0	0	112.7	V18 S20 K532 T618	V18-E620 VanDerWaalsContact CB-OE1 3.25Å; V18-E620 WeakPolarHBondContact CB-OE1 3.32Å; V18-E620 WeakPolarHBondContact CG1-OE1 3.37Å; S20-E620 WeakPolarHBondContact CB-OE2 3.41Å; S20-E620 VanDerWaalsContact OG-CD 3.25Å; S20-E620 PolarHBondContact OG-OE1 3.25Å; S20-E620 PolarHBondContact OG-OE2 2.99Å; K532-E620 WeakPolarHBondContact CE-O 3.33Å; K532-E620 PolarHBondContact NZ-O 3.17Å; T618-E620 PolarHBondContact O-N 3.17Å; T618-E620 PolarHBondContact OG1-N 2.99Å
621	N	94.1	Very high	95.3	Very high	67 Å²	67	35.1 Å²	35.1	36%	0.358	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-89.1	-4.9	-178.6	-74.3	-6.7	0	0	0	113.6	C584 N585 T618 V619	C584-N621 CarbonylContact C-O 3.3Å; C584-N621 VanDerWaalsContact CA-O 3.25Å; C584-N621 WeakPolarHBondContact CA-O 3.5Å; N585-N621 PolarHBondContact N-O 2.83Å; T618-N621 PolarHBondContact O-N 2.89Å; V619-N621 VanDerWaalsContact C-N 3.28Å; V619-N621 PolarHBondContact O-N 3.38Å
622	L	96.4	Very high	95.3	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.016	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	141.1	176.4	-63.8	178.7	0	0	0	111.7	L528 K532 F593 L595 F598 L599 W608 V619	L528-L622 HydrophobicContact CD1-CD1 4.25Å; K532-L622 WeakPolarHBondContact CB-O 3.3Å; F593-L622 HydrophobicContact CE2-CD2 4.37Å; F593-L622 HydrophobicContact CZ-CD2 3.96Å; L595-L622 HydrophobicContact CD1-CD1 3.74Å; F598-L622 HydrophobicContact CD1-CD1 3.93Å; F598-L622 HydrophobicContact CD1-CD2 4.16Å; F598-L622 HydrophobicContact CE1-CD1 3.92Å; F598-L622 HydrophobicContact CE1-CD2 3.79Å; F598-L622 HydrophobicContact CE1-CG 4.43Å; L599-L622 HydrophobicContact CD2-CD1 4.2Å; W608-L622 HydrophobicContact CZ3-CD1 4.09Å; V619-L622 PolarHBondContact O-N 3.03Å
623	E	97	Very high	95.3	Very high	16 Å²	16	34.6 Å²	34.6	8%	0.075	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	141.2	175.9	65.8	-173	-170.2	0	0	110.4	K532 L534 K542 A582 R583 N585	K532-E623 CarbonylContact O-C 3.6Å; K532-E623 WeakPolarHBondContact O-CA 3.5Å; L534-E623 HydrophobicContact CB-CB 4.2Å; L534-E623 HydrophobicContact CB-CG 4.26Å; L534-E623 HydrophobicContact CD2-CG 4.45Å; K542-E623 IonicContact NZ-OE1 2.74Å; K542-E623 PolarHBondContact NZ-OE1 3.31Å; K542-E623 IonicContact NZ-OE2 3.76Å; K542-E623 PolarHBondContact NZ-OE2 3.24Å; A582-E623 CarbonylContact C-O 3.59Å; A582-E623 WeakPolarHBondContact CA-O 3.34Å; A582-E623 VanDerWaalsContact CB-O 3.25Å; A582-E623 WeakPolarHBondContact CB-O 3.37Å; R583-E623 HydrophobicContact CG-CG 3.8Å; R583-E623 WeakPolarHBondContact CG-OE1 3.25Å; R583-E623 PolarHBondContact N-O 3.04Å; R583-E623 PolarHBondContact O-N 3.02Å; N585-E623 WeakPolarHBondContact CA-OE2 3.42Å; N585-E623 PolarHBondContact OD1-OE2 3.21Å
624	I	97.9	Very high	95.2	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	119.7	177.3	-66.1	158.3	0	0	0	107.7	V529 K532 L533 L534 L580 P581 L595 Q626 W629	V529-I624 HydrophobicContact CB-CD1 4.3Å; V529-I624 HydrophobicContact CG2-CD1 3.92Å; K532-I624 PolarHBondContact O-N 2.89Å; L533-I624 HydrophobicContact CD2-CB 4.15Å; L533-I624 HydrophobicContact CD2-CG2 3.96Å; L534-I624 WeakPolarHBondContact CB-O 3.4Å; L534-I624 PolarHBondContact N-O 3.4Å; L580-I624 HydrophobicContact CD1-CD1 4.38Å; L580-I624 HydrophobicContact CD1-CG1 4.5Å; L580-I624 HydrophobicContact CD1-CG2 3.69Å; L580-I624 HydrophobicContact CD2-CD1 4Å; L580-I624 HydrophobicContact CD2-CG1 4.37Å; L580-I624 HydrophobicContact CG-CD1 4.33Å; L580-I624 HydrophobicContact CG-CG1 4.28Å; L580-I624 HydrophobicContact CG-CG2 4.19Å; P581-I624 WeakPolarHBondContact O-CA 3.33Å; L595-I624 HydrophobicContact CD2-CD1 3.77Å; L595-I624 HydrophobicContact CD2-CG1 3.6Å; I624-Q626 PolarHBondContact O-N 3Å; I624-W629 HydrophobicContact CG2-CE3 4.06Å; I624-W629 HydrophobicContact CG2-CZ3 4.4Å
625	D	97.9	Very high	95.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	106.6	-173	-176.1	-87.4	0	0	0	111.4	L534 A539 P581 R583 Y627 V628 W629	L534-D625 WeakPolarHBondContact CD2-OD2 3.44Å; A539-D625 WeakPolarHBondContact CB-OD2 3.49Å; P581-D625 PolarHBondContact O-N 2.91Å; R583-D625 IonicContact CZ-OD2 3.72Å; R583-D625 IonicContact NE-OD2 2.7Å; R583-D625 IonicContact NH1-OD2 2.71Å; R583-D625 PolarHBondContact NH1-OD2 3.23Å; R583-D625 IonicContact NH2-OD1 3.72Å; R583-D625 IonicContact NH2-OD2 2.86Å; R583-D625 PolarHBondContact NH2-OD2 3.31Å; R583-D625 VanDerWaalsContact NH2-OD2 3.13Å; D625-Y627 PolarHBondContact O-N 2.91Å; D625-Y627 WeakPolarHBondContact OD1-CB 3.43Å; D625-Y627 PolarHBondContact OD1-N 3.42Å; D625-V628 WeakPolarHBondContact OD1-CB 3.5Å; D625-V628 VanDerWaalsContact OD1-CG2 3.32Å; D625-V628 WeakPolarHBondContact OD1-CG2 3.4Å; D625-V628 PolarHBondContact OD1-N 3.34Å; D625-W629 VanDerWaalsContact O-CB 3.3Å; D625-W629 WeakPolarHBondContact O-CB 3.37Å; D625-W629 PolarHBondContact O-N 3.26Å
626	Q	96.6	Very high	95	Very high	55 Å²	55	34.1 Å²	34.1	26%	0.257	20%	0.202	S	C	.	.	H	α-helix	trans	-65	-26.3	-178.8	-72.5	-175.2	-22.1	0	0	113.5	L533 L534 V536 I624 G630	L533-Q626 HydrophobicContact CD2-CG 4.24Å; L534-Q626 WeakPolarHBondContact O-CB 3.4Å; L534-Q626 WeakPolarHBondContact O-CG 3.22Å; L534-Q626 PolarHBondContact O-N 2.94Å; V536-Q626 HydrophobicContact CG2-CB 3.65Å; I624-Q626 PolarHBondContact O-N 3Å; Q626-G630 PolarHBondContact O-N 2.86Å
627	Y	97.8	Very high	94.8	Very high	10 Å²	10	39.5 Å²	39.5	4%	0.039	22%	0.216	C	C	.	.	H	α-helix	trans	-70.4	-52.6	-179	172	-84.1	0	0	0	111.4	V536 I540 I543 D625 W629 G630 I631 I646 A650	V536-Y627 HydrophobicContact CG1-CD2 4.35Å; I540-Y627 HydrophobicContact CD1-CD2 4.36Å; I540-Y627 HydrophobicContact CG1-CD2 3.84Å; I540-Y627 HydrophobicContact CG1-CE2 4.08Å; I543-Y627 HydrophobicContact CD1-CD1 3.54Å; I543-Y627 HydrophobicContact CD1-CD2 4.28Å; I543-Y627 HydrophobicContact CD1-CE1 3.45Å; I543-Y627 VanDerWaalsContact CD1-CE1 3.45Å; I543-Y627 HydrophobicContact CD1-CE2 4.19Å; I543-Y627 HydrophobicContact CD1-CG 3.98Å; D625-Y627 PolarHBondContact O-N 2.91Å; D625-Y627 WeakPolarHBondContact OD1-CB 3.43Å; D625-Y627 PolarHBondContact OD1-N 3.42Å; Y627-W629 VanDerWaalsContact C-N 3.28Å; Y627-W629 PolarHBondContact O-N 3.23Å; Y627-G630 PolarHBondContact O-N 2.82Å; Y627-I631 HydrophobicContact CD1-CD1 3.99Å; Y627-I631 HydrophobicContact CE1-CD1 3.42Å; Y627-I631 VanDerWaalsContact CE1-CD1 3.42Å; Y627-I631 HydrophobicContact CE1-CG1 4.46Å; Y627-I631 WeakPolarHBondContact O-CG1 3.28Å; Y627-I631 PolarHBondContact O-N 2.95Å; Y627-I646 HydrophobicContact CE1-CD1 3.89Å; Y627-I646 HydrophobicContact CE1-CG1 4.47Å; Y627-A650 HydrophobicContact CE2-CB 4.25Å; Y627-A650 VanDerWaalsContact CE2-O 3.29Å; Y627-A650 WeakPolarHBondContact CE2-O 3.44Å; Y627-A650 PolarHBondContact OH-O 3.42Å
628	V	97.3	Very high	94.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-66	-33.1	174.5	177.3	0	0	0	0	110.3	I567 M578 P581 C592 D625 I631 L632	I567-V628 HydrophobicContact CD1-CG2 4.21Å; M578-V628 HydrophobicContact CE-CG1 4.29Å; P581-V628 HydrophobicContact CB-CB 4.19Å; P581-V628 HydrophobicContact CB-CG1 3.77Å; P581-V628 HydrophobicContact CG-CB 4.23Å; P581-V628 HydrophobicContact CG-CG1 4.09Å; C592-V628 HydrophobicContact CB-CG1 4.39Å; D625-V628 WeakPolarHBondContact OD1-CB 3.5Å; D625-V628 VanDerWaalsContact OD1-CG2 3.32Å; D625-V628 WeakPolarHBondContact OD1-CG2 3.4Å; D625-V628 PolarHBondContact OD1-N 3.34Å; V628-I631 PolarHBondContact O-N 2.81Å; V628-L632 HydrophobicContact CG1-CD1 4.3Å; V628-L632 VanDerWaalsContact O-CG 3.32Å; V628-L632 WeakPolarHBondContact O-CG 3.21Å; V628-L632 PolarHBondContact O-N 2.97Å
629	W	97.1	Very high	94.3	Very high	28 Å²	28	44.1 Å²	44.1	11%	0.106	25%	0.248	C	C	.	.	H	α-helix	trans	-65	-42.8	172.9	-165.8	9.6	0	0	0	111.6	L533 L580 P581 I624 D625 Y627 I631 L632 T633 F892 F896	L533-W629 HydrophobicContact CD2-CE3 4.49Å; L533-W629 HydrophobicContact CD2-CZ3 3.95Å; L580-W629 HydrophobicContact CD1-CD2 4.36Å; L580-W629 HydrophobicContact CD1-CE3 4.39Å; L580-W629 HydrophobicContact CD1-CH2 4.3Å; L580-W629 HydrophobicContact CD1-CZ2 4.23Å; L580-W629 HydrophobicContact CD1-CZ3 4.37Å; P581-W629 HydrophobicContact CG-CB 3.66Å; P581-W629 HydrophobicContact CG-CG 4.3Å; I624-W629 HydrophobicContact CG2-CE3 4.06Å; I624-W629 HydrophobicContact CG2-CZ3 4.4Å; D625-W629 VanDerWaalsContact O-CB 3.3Å; D625-W629 WeakPolarHBondContact O-CB 3.37Å; D625-W629 PolarHBondContact O-N 3.26Å; Y627-W629 VanDerWaalsContact C-N 3.28Å; Y627-W629 PolarHBondContact O-N 3.23Å; W629-I631 VanDerWaalsContact C-N 3.34Å; W629-I631 PolarHBondContact O-N 3.11Å; W629-L632 PolarHBondContact O-N 2.85Å; W629-T633 WeakPolarHBondContact O-CB 3.32Å; W629-T633 PolarHBondContact O-N 2.69Å; W629-T633 PolarHBondContact O-OG1 2.92Å; W629-T633 VanDerWaalsContact O-OG1 3.1Å; W629-F892 HydrophobicContact CE3-CE1 4.3Å; W629-F892 AromaticContact CH2-CD1 3.88Å; W629-F892 HydrophobicContact CH2-CD1 3.88Å; W629-F892 AromaticContact CH2-CE1 3.61Å; W629-F892 HydrophobicContact CH2-CE1 3.61Å; W629-F892 HydrophobicContact CZ2-CE1 4.07Å; W629-F892 HydrophobicContact CZ3-CD1 4.19Å; W629-F892 AromaticContact CZ3-CE1 3.75Å; W629-F892 HydrophobicContact CZ3-CE1 3.75Å; W629-F896 AromaticContact CH2-CE2 3.84Å; W629-F896 HydrophobicContact CH2-CE2 3.84Å; W629-F896 AromaticContact CH2-CZ 3.58Å; W629-F896 HydrophobicContact CH2-CZ 3.58Å; W629-F896 HydrophobicContact CZ2-CE2 4.47Å; W629-F896 AromaticContact CZ2-CZ 3.98Å; W629-F896 HydrophobicContact CZ2-CZ 3.98Å
630	G	96.3	Very high	94.1	Very high	26 Å²	26	49.9 Å²	49.9	27%	0.268	28%	0.278	S	S	.	.	H	α-helix	trans	-57.7	-42.8	171.2	0	0	0	0	0	112.7	Q626 Y627 T633 N634	Q626-G630 PolarHBondContact O-N 2.86Å; Y627-G630 PolarHBondContact O-N 2.82Å; G630-T633 PolarHBondContact O-N 3.19Å; G630-N634 VanDerWaalsContact O-CB 3.29Å; G630-N634 WeakPolarHBondContact O-CB 3.39Å; G630-N634 PolarHBondContact O-N 3.46Å; G630-N634 PolarHBondContact O-ND2 3.48Å; G630-N634 VanDerWaalsContact O-ND2 3.14Å
631	I	96.8	Very high	94.2	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-61.1	-46.5	173.7	-66.3	175.5	0	0	0	111.4	L569 Y627 V628 W629 T633 N634 L635 V644 I646 W652	L569-I631 HydrophobicContact CD1-CG2 4.26Å; L569-I631 HydrophobicContact CD2-CG2 3.85Å; Y627-I631 HydrophobicContact CD1-CD1 3.99Å; Y627-I631 HydrophobicContact CE1-CD1 3.42Å; Y627-I631 VanDerWaalsContact CE1-CD1 3.42Å; Y627-I631 HydrophobicContact CE1-CG1 4.46Å; Y627-I631 WeakPolarHBondContact O-CG1 3.28Å; Y627-I631 PolarHBondContact O-N 2.95Å; V628-I631 PolarHBondContact O-N 2.81Å; W629-I631 VanDerWaalsContact C-N 3.34Å; W629-I631 PolarHBondContact O-N 3.11Å; I631-T633 PolarHBondContact O-N 3.08Å; I631-N634 PolarHBondContact O-N 3.33Å; I631-L635 HydrophobicContact CG2-CD1 3.79Å; I631-L635 WeakPolarHBondContact O-CB 3.35Å; I631-L635 WeakPolarHBondContact O-CG 3.42Å; I631-L635 PolarHBondContact O-N 2.95Å; I631-V644 HydrophobicContact CG2-CG1 4.07Å; I631-V644 HydrophobicContact CG2-CG2 4.3Å; I631-I646 HydrophobicContact CD1-CD1 4.44Å; I631-W652 HydrophobicContact CD1-CB 4.08Å; I631-W652 HydrophobicContact CD1-CD2 4Å; I631-W652 HydrophobicContact CD1-CG 3.7Å; I631-W652 HydrophobicContact CG1-CD2 3.83Å; I631-W652 HydrophobicContact CG1-CE3 4.44Å; I631-W652 HydrophobicContact CG1-CG 3.97Å; I631-W652 HydrophobicContact CG1-CZ2 4.31Å; I631-W652 HydrophobicContact CG2-CD2 4.44Å; I631-W652 HydrophobicContact CG2-CE3 4.22Å; I631-W652 HydrophobicContact CG2-CZ3 4.3Å
632	L	96.4	Very high	94.1	Very high	12 Å²	12	46.6 Å²	46.6	6%	0.063	27%	0.265	C	S	.	.	H	α-helix	trans	-60.7	-43.8	178.4	-72.9	165.5	0	0	0	112	L569 K577 M578 P581 V628 W629 L635 A636	L569-L632 HydrophobicContact CB-CD2 3.83Å; L569-L632 HydrophobicContact CD1-CD2 4.34Å; L569-L632 HydrophobicContact CD2-CD2 4.19Å; L569-L632 HydrophobicContact CG-CD2 4.34Å; K577-L632 HydrophobicContact CD-CD2 4.38Å; K577-L632 HydrophobicContact CG-CD2 3.72Å; M578-L632 HydrophobicContact CB-CD1 3.87Å; P581-L632 HydrophobicContact CB-CD1 4.02Å; P581-L632 HydrophobicContact CG-CD1 3.7Å; V628-L632 HydrophobicContact CG1-CD1 4.3Å; V628-L632 VanDerWaalsContact O-CG 3.32Å; V628-L632 WeakPolarHBondContact O-CG 3.21Å; V628-L632 PolarHBondContact O-N 2.97Å; W629-L632 PolarHBondContact O-N 2.85Å; L632-L635 CarbonylContact O-C 3.52Å; L632-L635 VanDerWaalsContact O-C 3.3Å; L632-L635 PolarHBondContact O-N 2.96Å; L632-A636 PolarHBondContact O-N 3.01Å
633	T	95.3	Very high	94.1	Very high	85 Å²	85	48.6 Å²	48.6	52%	0.521	28%	0.276	S	S	.	.	H	α-helix	trans	-66.8	-46	178.2	-62.1	0	0	0	0	111.8	W629 G630 I631 L635 A636	W629-T633 WeakPolarHBondContact O-CB 3.32Å; W629-T633 PolarHBondContact O-N 2.69Å; W629-T633 PolarHBondContact O-OG1 2.92Å; W629-T633 VanDerWaalsContact O-OG1 3.1Å; G630-T633 PolarHBondContact O-N 3.19Å; I631-T633 PolarHBondContact O-N 3.08Å; T633-L635 PolarHBondContact O-N 3.44Å; T633-A636 WeakPolarHBondContact O-CB 3.23Å; T633-A636 PolarHBondContact O-N 3.31Å
634	N	94.1	Very high	94.1	Very high	109 Å²	109	47.8 Å²	47.8	58%	0.583	27%	0.273	S	S	*	.	H	α-helix	trans	-60.1	-35.4	175	-73.6	-27.5	0	0	0	111.9	G630 I631 W652	G630-N634 VanDerWaalsContact O-CB 3.29Å; G630-N634 WeakPolarHBondContact O-CB 3.39Å; G630-N634 PolarHBondContact O-N 3.46Å; G630-N634 PolarHBondContact O-ND2 3.48Å; G630-N634 VanDerWaalsContact O-ND2 3.14Å; I631-N634 PolarHBondContact O-N 3.33Å; N634-W652 HydrophobicContact CB-CH2 4.25Å; N634-W652 HydrophobicContact CB-CZ2 4.23Å
635	L	93.6	Very high	94	Very high	11 Å²	11	49.3 Å²	49.3	6%	0.058	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	16.4	176.7	-62.2	172.8	0	0	0	113.5	L569 K577 I631 L632 T633 K637 C638 V641 V644 W652 V654	L569-L635 HydrophobicContact CD1-CD1 3.65Å; K577-L635 PolarHBondContact NZ-O 2.63Å; I631-L635 HydrophobicContact CG2-CD1 3.79Å; I631-L635 WeakPolarHBondContact O-CB 3.35Å; I631-L635 WeakPolarHBondContact O-CG 3.42Å; I631-L635 PolarHBondContact O-N 2.95Å; L632-L635 CarbonylContact O-C 3.52Å; L632-L635 VanDerWaalsContact O-C 3.3Å; L632-L635 PolarHBondContact O-N 2.96Å; T633-L635 PolarHBondContact O-N 3.44Å; L635-K637 VanDerWaalsContact C-N 3.25Å; L635-K637 PolarHBondContact O-N 3.31Å; L635-C638 HydrophobicContact CD2-CB 4.3Å; L635-C638 CarbonylContact O-C 3.5Å; L635-C638 PolarHBondContact O-N 2.94Å; L635-V641 HydrophobicContact CD1-CB 4.48Å; L635-V641 HydrophobicContact CD1-CG1 3.86Å; L635-V644 HydrophobicContact CD1-CG1 3.74Å; L635-W652 HydrophobicContact CD1-CH2 4.34Å; L635-W652 HydrophobicContact CD1-CZ3 3.86Å; L635-W652 HydrophobicContact CD2-CH2 4.29Å; L635-W652 HydrophobicContact CD2-CZ3 4.19Å; L635-W652 HydrophobicContact CG-CH2 4.11Å; L635-W652 HydrophobicContact CG-CZ3 4.09Å; L635-V654 HydrophobicContact CD1-CG2 4.47Å; L635-V654 HydrophobicContact CD2-CG2 3.79Å
636	A	90.1	Very high	93.9	Very high	68 Å²	68	49.3 Å²	49.3	56%	0.562	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-34.3	177.1	0	0	0	0	0	111.8	L632 T633 C638	L632-A636 PolarHBondContact O-N 3.01Å; T633-A636 WeakPolarHBondContact O-CB 3.23Å; T633-A636 PolarHBondContact O-N 3.31Å; A636-C638 PolarHBondContact O-N 3.37Å
637	K	86.9	Confident	93.7	Very high	199 Å²	199	49 Å²	49	87%	0.865	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-7.6	175.3	-62.9	175.7	-177.7	172.8	0	113.8	L635 P639	L635-K637 VanDerWaalsContact C-N 3.25Å; L635-K637 PolarHBondContact O-N 3.31Å; K637-P639 WeakPolarHBondContact O-CD 3.19Å
638	C	88.5	Confident	93.5	Very high	56 Å²	56	51.2 Å²	51.2	38%	0.378	30%	0.297	S	S	.	.			trans	-122.3	76.8	-176.5	-59.9	0	0	0	0	109.7	K577 L635 A636 D640 V641	K577-C638 PolarHBondContact NZ-O 2.84Å; K577-C638 VanDerWaalsContact NZ-O 3.15Å; L635-C638 HydrophobicContact CD2-CB 4.3Å; L635-C638 CarbonylContact O-C 3.5Å; L635-C638 PolarHBondContact O-N 2.94Å; A636-C638 PolarHBondContact O-N 3.37Å; C638-D640 VanDerWaalsContact C-N 3.28Å; C638-D640 PolarHBondContact O-N 2.8Å; C638-V641 HydrophobicContact CB-CG2 3.9Å; C638-V641 PolarHBondContact O-N 2.98Å
639	P	85.5	Confident	93.2	Very high	94 Å²	94	54 Å²	54	61%	0.61	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-31.3	-175	26.8	-34.8	0	0	0	112.9	K637 V641	K637-P639 WeakPolarHBondContact O-CD 3.19Å; P639-V641 PolarHBondContact O-N 3.3Å
640	D	90.2	Very high	93.1	Very high	147 Å²	147	53 Å²	53	79%	0.786	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-18.6	-177.4	-48.6	-62.9	0	0	0	113.6	C638 S642	C638-D640 VanDerWaalsContact C-N 3.28Å; C638-D640 PolarHBondContact O-N 2.8Å; D640-S642 PolarHBondContact O-N 3.06Å
641	V	92	Very high	93	Very high	23 Å²	23	53.9 Å²	53.9	14%	0.139	32%	0.317	C	S	.	.			trans	-74.3	103	177.2	-179	0	0	0	0	109.2	L569 L635 C638 P639 D643 V644 V654	L569-V641 HydrophobicContact CD1-CG1 4.3Å; L635-V641 HydrophobicContact CD1-CB 4.48Å; L635-V641 HydrophobicContact CD1-CG1 3.86Å; C638-V641 HydrophobicContact CB-CG2 3.9Å; C638-V641 PolarHBondContact O-N 2.98Å; P639-V641 PolarHBondContact O-N 3.3Å; V641-D643 WeakPolarHBondContact CG1-O 3.47Å; V641-V644 HydrophobicContact CG1-CG1 4.31Å; V641-V654 HydrophobicContact CB-CG1 4.45Å; V641-V654 HydrophobicContact CG1-CG1 3.85Å; V641-V654 HydrophobicContact CG1-CG2 4.23Å; V641-V654 HydrophobicContact CG2-CG1 3.7Å; V641-V654 HydrophobicContact CG2-CG2 4.24Å
642	S	93.2	Very high	92.9	Very high	33 Å²	33	55.9 Å²	55.9	23%	0.231	32%	0.324	C	S	.	.			trans	-90.3	-25.8	174.9	27.3	0	0	0	0	113.6	S568 L569 K570 D640	S568-S642 PolarHBondContact OG-O 2.9Å; L569-S642 WeakPolarHBondContact CB-O 3.38Å; L569-S642 PolarHBondContact N-O 3.37Å; K570-S642 VanDerWaalsContact CE-CB 3.49Å; K570-S642 VanDerWaalsContact NZ-CB 3.34Å; D640-S642 PolarHBondContact O-N 3.06Å
643	D	95.3	Very high	92.8	Very high	45 Å²	45	61.1 Å²	61.1	24%	0.241	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	149.8	-169.3	-49.3	-71	0	0	0	111.6	T566 I567 S568 V641 H655	T566-D643 HydrophobicContact CG2-CB 4.1Å; I567-D643 WeakPolarHBondContact O-CA 3.49Å; S568-D643 VanDerWaalsContact CA-OD1 3.23Å; S568-D643 WeakPolarHBondContact CA-OD1 3.47Å; S568-D643 WeakPolarHBondContact CB-OD1 3.43Å; S568-D643 PolarHBondContact OG-OD1 3.1Å; V641-D643 WeakPolarHBondContact CG1-O 3.47Å; D643-H655 HydrophobicContact CB-CB 4.14Å; D643-H655 WeakPolarHBondContact O-CB 3.32Å; D643-H655 PolarHBondContact O-N 2.89Å; D643-H655 VanDerWaalsContact O-N 3.08Å
644	V	96.5	Very high	92.8	Very high	0 Å²	0	60 Å²	60	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146.7	178.6	-64.5	0	0	0	0	110.8	T566 I567 L569 I631 L635 V641 I646 W652 K653	T566-V644 CarbonylContact C-O 3.53Å; T566-V644 WeakPolarHBondContact CA-O 3.34Å; I567-V644 HydrophobicContact CD1-CG2 4.07Å; I567-V644 HydrophobicContact CG1-CG2 3.54Å; I567-V644 PolarHBondContact N-O 3.44Å; I567-V644 PolarHBondContact O-N 2.87Å; L569-V644 HydrophobicContact CD1-CG1 4.01Å; L569-V644 HydrophobicContact CD2-CG1 4.47Å; L569-V644 HydrophobicContact CD2-CG2 4.02Å; L569-V644 HydrophobicContact CG-CG1 4.34Å; I631-V644 HydrophobicContact CG2-CG1 4.07Å; I631-V644 HydrophobicContact CG2-CG2 4.3Å; L635-V644 HydrophobicContact CD1-CG1 3.74Å; V641-V644 HydrophobicContact CG1-CG1 4.31Å; V644-I646 HydrophobicContact CG2-CG1 4.39Å; V644-W652 HydrophobicContact CG1-CE3 4.24Å; V644-K653 CarbonylContact C-O 3.44Å; V644-K653 WeakPolarHBondContact CA-O 3.39Å
645	L	95.9	Very high	92.5	Very high	33 Å²	33	58.6 Å²	58.6	17%	0.173	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.5	171.4	-168.1	88.4	0	0	0	108.8	S564 T566 W652 K653	S564-L645 WeakPolarHBondContact OG-CD2 3.16Å; T566-L645 VanDerWaalsContact OG1-CD1 3.28Å; T566-L645 WeakPolarHBondContact OG1-CD1 3.45Å; L645-W652 CarbonylContact O-C 3.53Å; L645-W652 VanDerWaalsContact O-CA 3.23Å; L645-W652 WeakPolarHBondContact O-CA 3.39Å; L645-K653 HydrophobicContact CB-CG 4.11Å; L645-K653 HydrophobicContact CD2-CD 4.44Å; L645-K653 HydrophobicContact CD2-CG 4.34Å; L645-K653 PolarHBondContact N-O 3.43Å; L645-K653 PolarHBondContact O-N 2.91Å
646	I	95.7	Very high	91.4	Very high	0 Å²	0	62 Å²	62	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	133.1	175.1	-63.3	167.4	0	0	0	108	I543 S564 T565 I567 I590 Y627 I631 V644 S651 W652	I543-I646 HydrophobicContact CG2-CG2 3.96Å; S564-I646 CarbonylContact C-O 3.6Å; S564-I646 WeakPolarHBondContact CA-O 3.44Å; S564-I646 WeakPolarHBondContact CB-O 3.46Å; T565-I646 PolarHBondContact N-O 2.85Å; T565-I646 PolarHBondContact O-N 3.43Å; I567-I646 HydrophobicContact CD1-CD1 3.47Å; I567-I646 VanDerWaalsContact CD1-CD1 3.47Å; I567-I646 HydrophobicContact CG1-CD1 3.69Å; I567-I646 HydrophobicContact CG1-CG1 4.47Å; I567-I646 HydrophobicContact CG2-CD1 4.33Å; I590-I646 HydrophobicContact CG2-CD1 3.68Å; Y627-I646 HydrophobicContact CE1-CD1 3.89Å; Y627-I646 HydrophobicContact CE1-CG1 4.47Å; I631-I646 HydrophobicContact CD1-CD1 4.44Å; V644-I646 HydrophobicContact CG2-CG1 4.39Å; I646-S651 CarbonylContact C-O 3.54Å; I646-S651 WeakPolarHBondContact CA-O 3.49Å; I646-W652 HydrophobicContact CG1-CB 3.96Å
647	D	93.6	Very high	89.7	Confident	48 Å²	48	62 Å²	62	26%	0.257	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	172.8	176.9	68.1	36.4	0	0	0	114	F547 L563 S649 A650 S651	F547-D647 VanDerWaalsContact CE2-O 3.32Å; F547-D647 WeakPolarHBondContact CE2-O 3.29Å; L563-D647 CarbonylContact O-C 3.53Å; L563-D647 WeakPolarHBondContact O-CA 3.38Å; L563-D647 VanDerWaalsContact O-CB 3.23Å; L563-D647 WeakPolarHBondContact O-CB 3.22Å; D647-S649 PolarHBondContact O-N 3.13Å; D647-S649 WeakPolarHBondContact OD1-CA 3.42Å; D647-S649 VanDerWaalsContact OD1-CB 3.28Å; D647-S649 WeakPolarHBondContact OD1-CB 3.45Å; D647-S649 PolarHBondContact OD1-N 3.28Å; D647-S649 PolarHBondContact OD1-OG 3.28Å; D647-A650 WeakPolarHBondContact O-CA 3.07Å; D647-A650 PolarHBondContact O-N 3.3Å; D647-A650 PolarHBondContact OD1-N 3.08Å; D647-S651 PolarHBondContact N-O 3.36Å; D647-S651 PolarHBondContact OD1-N 3.43Å; D647-S651 WeakPolarHBondContact OD2-CB 3.17Å
648	S	92.5	Very high	87.9	Confident	56 Å²	56	58.6 Å²	58.6	39%	0.392	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.7	179.4	61.5	0	0	0	0	114.3	K544 L563 A650	K544-S648 WeakPolarHBondContact CG-O 3.16Å; L563-S648 PolarHBondContact O-N 3.43Å; S648-A650 VanDerWaalsContact C-N 3.27Å
649	S	92.4	Very high	85.4	Confident	58 Å²	58	58 Å²	58	41%	0.406	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-11.3	170.2	82	0	0	0	0	113.1	K544 D647 S651	K544-S649 WeakPolarHBondContact CE-O 3.1Å; K544-S649 PolarHBondContact NZ-O 2.87Å; D647-S649 PolarHBondContact O-N 3.13Å; D647-S649 WeakPolarHBondContact OD1-CA 3.42Å; D647-S649 VanDerWaalsContact OD1-CB 3.28Å; D647-S649 WeakPolarHBondContact OD1-CB 3.45Å; D647-S649 PolarHBondContact OD1-N 3.28Å; D647-S649 PolarHBondContact OD1-OG 3.28Å; S649-S651 VanDerWaalsContact C-N 3.34Å; S649-S651 WeakPolarHBondContact OG-CB 3.36Å; S649-S651 PolarHBondContact OG-N 3.31Å; S649-S651 PolarHBondContact OG-OG 3.21Å
650	A	93.6	Very high	83.3	Confident	9 Å²	9	60.3 Å²	60.3	7%	0.074	36%	0.355	C	S	.	.	S	Bend	trans	68	23.8	-162.8	0	0	0	0	0	114.5	I540 I543 Y627 D647 S648	I540-A650 HydrophobicContact CB-CB 4.22Å; I540-A650 HydrophobicContact CG1-CB 3.91Å; I540-A650 HydrophobicContact CG2-CB 3.9Å; I543-A650 HydrophobicContact CB-CB 4.21Å; I543-A650 HydrophobicContact CD1-CB 4.24Å; I543-A650 HydrophobicContact CG2-CB 3.73Å; Y627-A650 HydrophobicContact CE2-CB 4.25Å; Y627-A650 VanDerWaalsContact CE2-O 3.29Å; Y627-A650 WeakPolarHBondContact CE2-O 3.44Å; Y627-A650 PolarHBondContact OH-O 3.42Å; D647-A650 WeakPolarHBondContact O-CA 3.07Å; D647-A650 PolarHBondContact O-N 3.3Å; D647-A650 PolarHBondContact OD1-N 3.08Å; S648-A650 VanDerWaalsContact C-N 3.27Å
651	S	94.9	Very high	80.9	Confident	43 Å²	43	61.9 Å²	61.9	30%	0.301	36%	0.355	S	S	.	.			trans	-79.5	150.9	163.3	-56.7	0	0	0	0	109.4	I646 D647 S649	I646-S651 CarbonylContact C-O 3.54Å; I646-S651 WeakPolarHBondContact CA-O 3.49Å; D647-S651 PolarHBondContact N-O 3.36Å; D647-S651 PolarHBondContact OD1-N 3.43Å; D647-S651 WeakPolarHBondContact OD2-CB 3.17Å; S649-S651 VanDerWaalsContact C-N 3.34Å; S649-S651 WeakPolarHBondContact OG-CB 3.36Å; S649-S651 PolarHBondContact OG-N 3.31Å; S649-S651 PolarHBondContact OG-OG 3.21Å
652	W	95.2	Very high	78.4	Confident	44 Å²	44	67.2 Å²	67.2	17%	0.167	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	155.4	-175.4	67.6	-87.7	0	0	0	112.8	I631 N634 L635 V644 L645 I646	I631-W652 HydrophobicContact CD1-CB 4.08Å; I631-W652 HydrophobicContact CD1-CD2 4Å; I631-W652 HydrophobicContact CD1-CG 3.7Å; I631-W652 HydrophobicContact CG1-CD2 3.83Å; I631-W652 HydrophobicContact CG1-CE3 4.44Å; I631-W652 HydrophobicContact CG1-CG 3.97Å; I631-W652 HydrophobicContact CG1-CZ2 4.31Å; I631-W652 HydrophobicContact CG2-CD2 4.44Å; I631-W652 HydrophobicContact CG2-CE3 4.22Å; I631-W652 HydrophobicContact CG2-CZ3 4.3Å; N634-W652 HydrophobicContact CB-CH2 4.25Å; N634-W652 HydrophobicContact CB-CZ2 4.23Å; L635-W652 HydrophobicContact CD1-CH2 4.34Å; L635-W652 HydrophobicContact CD1-CZ3 3.86Å; L635-W652 HydrophobicContact CD2-CH2 4.29Å; L635-W652 HydrophobicContact CD2-CZ3 4.19Å; L635-W652 HydrophobicContact CG-CH2 4.11Å; L635-W652 HydrophobicContact CG-CZ3 4.09Å; V644-W652 HydrophobicContact CG1-CE3 4.24Å; L645-W652 CarbonylContact O-C 3.53Å; L645-W652 VanDerWaalsContact O-CA 3.23Å; L645-W652 WeakPolarHBondContact O-CA 3.39Å; I646-W652 HydrophobicContact CG1-CB 3.96Å
653	K	94.3	Very high	75.9	Confident	123 Å²	123	73.4 Å²	73.4	54%	0.535	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	154.8	171.4	60.8	-176.6	172.9	-174.8	0	111.7	V644 L645 H655	V644-K653 CarbonylContact C-O 3.44Å; V644-K653 WeakPolarHBondContact CA-O 3.39Å; L645-K653 HydrophobicContact CB-CG 4.11Å; L645-K653 HydrophobicContact CD2-CD 4.44Å; L645-K653 HydrophobicContact CD2-CG 4.34Å; L645-K653 PolarHBondContact N-O 3.43Å; L645-K653 PolarHBondContact O-N 2.91Å; K653-H655 PolarHBondContact O-N 3.41Å
654	V	94.5	Very high	73.2	Confident	62 Å²	62	79.2 Å²	79.2	38%	0.376	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	130.7	174.9	173	0	0	0	0	110.5	L635 V641 S656	L635-V654 HydrophobicContact CD1-CG2 4.47Å; L635-V654 HydrophobicContact CD2-CG2 3.79Å; V641-V654 HydrophobicContact CB-CG1 4.45Å; V641-V654 HydrophobicContact CG1-CG1 3.85Å; V641-V654 HydrophobicContact CG1-CG2 4.23Å; V641-V654 HydrophobicContact CG2-CG1 3.7Å; V641-V654 HydrophobicContact CG2-CG2 4.24Å; V654-S656 PolarHBondContact O-N 2.84Å
655	H	88	Confident	70.4	Confident	79 Å²	79	86.9 Å²	86.9	37%	0.366	47%	0.467	S	S	.	.			trans	-82.9	95.9	175.8	-173.2	102.4	0	0	0	109.6	T566 D643 K653 A657	T566-H655 HydrophobicContact CG2-CB 4.24Å; T566-H655 PolarHBondContact OG1-ND1 3.21Å; D643-H655 HydrophobicContact CB-CB 4.14Å; D643-H655 WeakPolarHBondContact O-CB 3.32Å; D643-H655 PolarHBondContact O-N 2.89Å; D643-H655 VanDerWaalsContact O-N 3.08Å; K653-H655 PolarHBondContact O-N 3.41Å; H655-A657 VanDerWaalsContact C-N 3.28Å; H655-A657 PolarHBondContact O-N 2.86Å
656	S	71	Confident	67.9	Low	81 Å²	81	95.7 Å²	95.7	57%	0.566	50%	0.5	S	S	*	.			trans	-78.9	64.8	-175.5	51.1	0	0	0	0	113.7	V654 V658 A659	V654-S656 PolarHBondContact O-N 2.84Å; S656-V658 PolarHBondContact O-N 2.84Å; S656-A659 PolarHBondContact O-N 3.42Å
657	A	54.3	Low	64.9	Low	69 Å²	69	100.2 Å²	100.2	57%	0.57	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-14.3	175.6	0	0	0	0	0	114.7	H655	H655-A657 VanDerWaalsContact C-N 3.28Å; H655-A657 PolarHBondContact O-N 2.86Å
658	V	47.9	Very low	62.2	Low	127 Å²	127	102.5 Å²	102.5	77%	0.77	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-26	176.5	-173.2	0	0	0	0	112.6	S656	S656-V658 PolarHBondContact O-N 2.84Å
659	A	37.1	Very low	59.3	Low	45 Å²	45	106.2 Å²	106.2	37%	0.372	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-73.4	-49.2	-172.3	0	0	0	0	0	113.7	S656 K661 Q662	S656-A659 PolarHBondContact O-N 3.42Å; A659-K661 PolarHBondContact O-N 2.88Å; A659-Q662 PolarHBondContact O-N 3.13Å
660	L	42.1	Very low	56.7	Low	142 Å²	142	106.3 Å²	106.3	74%	0.743	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-73.7	2.6	-168.5	-73.7	171.2	0	0	0	115.5
661	K	39.5	Very low	54.1	Low	179 Å²	179	111.9 Å²	111.9	78%	0.778	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-96.7	-9.3	168.1	-78.2	-172.6	175.1	179.8	0	114.2	A659	A659-K661 PolarHBondContact O-N 2.88Å
662	Q	38.5	Very low	51.5	Low	136 Å²	136	115.4 Å²	115.4	64%	0.636	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	-28.6	-173.8	-154.5	164.5	19	0	0	114.1	A659	A659-Q662 PolarHBondContact O-N 3.13Å
663	E	41.7	Very low	48.9	Very low	162 Å²	162	122.8 Å²	122.8	76%	0.757	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-74.8	-21.6	178.1	-69.8	-173.5	120.6	0	0	113.9	Q665	E663-Q665 VanDerWaalsContact C-N 3.3Å; E663-Q665 PolarHBondContact O-N 2.62Å
664	M	38.2	Very low	46.2	Very low	168 Å²	168	127.8 Å²	127.8	83%	0.828	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-85.2	6.8	-179.3	-157.1	115.6	69.4	0	0	114.3
665	Q	38.1	Very low	43.6	Very low	161 Å²	161	134.5 Å²	134.5	75%	0.752	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-112.2	3.1	-173.4	-110.5	178.9	-1.8	0	0	115.8	E663	E663-Q665 VanDerWaalsContact C-N 3.3Å; E663-Q665 PolarHBondContact O-N 2.62Å
666	Y	42.1	Very low	41.2	Very low	217 Å²	217	138.4 Å²	138.4	85%	0.851	74%	0.74	S	S	*	*	S	Bend	trans	-110.4	40.3	178.5	-83.9	-83.8	0	0	0	113.6
667	A	33.1	Very low	39.8	Very low	95 Å²	95	139.1 Å²	139.1	79%	0.785	75%	0.745	S	S	*	*			trans	-144.6	42.9	-173.3	0	0	0	0	0	115.8
668	A	36.5	Very low	39.1	Very low	97 Å²	97	142.9 Å²	142.9	80%	0.802	75%	0.751	S	S	*	*			trans	-150.5	133.2	171	0	0	0	0	0	114.5
669	C	32.7	Very low	38.6	Very low	133 Å²	133	143 Å²	143	90%	0.899	76%	0.755	S	S	*	*			trans	34.6	125.7	153.1	-144.2	0	0	0	0	120.5
670	G	36.6	Very low	38.8	Very low	61 Å²	61	144.4 Å²	144.4	63%	0.629	77%	0.773	S	S	*	*			cis	160.6	174.7	-1.6	0	0	0	0	0	112.9
671	T	40.1	Very low	39	Very low	125 Å²	125	144.4 Å²	144.4	77%	0.767	78%	0.779	S	S	*	*			trans	39.8	119.6	150.4	51	0	0	0	0	119.4
672	T	40	Very low	39.2	Very low	117 Å²	117	143 Å²	143	72%	0.718	78%	0.78	S	S	*	*			cis	-176.6	171.2	40.6	31.4	0	0	0	0	112.2
673	K	40.6	Very low	39.5	Very low	200 Å²	200	142.4 Å²	142.4	87%	0.87	79%	0.787	S	S	*	*			trans	81.4	138.1	168.2	-50.5	174.5	-171.6	172.1	0	115.6
674	R	37.4	Very low	39.3	Very low	227 Å²	227	139.9 Å²	139.9	86%	0.857	79%	0.788	S	S	*	*			cis	168.7	100.4	-37.8	167.4	-169.5	-169.5	-176.2	5.3	107.4
675	F	39.4	Very low	39.1	Very low	204 Å²	204	142.8 Å²	142.8	90%	0.895	79%	0.79	S	S	*	*			trans	173.4	121.9	160.6	-88.2	-64.6	0	0	0	104.2
676	K	39.1	Very low	39.1	Very low	160 Å²	160	140.4 Å²	140.4	70%	0.696	78%	0.782	S	S	*	*			cis	66.4	122	34.6	-164.3	163.6	-168.5	166.7	0	112.1	E678	K676-E678 WeakPolarHBondContact CE-OE2 3.41Å; K676-E678 IonicContact NZ-OE2 3.41Å; K676-E678 PolarHBondContact NZ-OE2 2.86Å
677	S	40.5	Very low	38.9	Very low	97 Å²	97	138.3 Å²	138.3	68%	0.678	78%	0.78	S	S	*	*			cis	-156.8	161.7	14.6	35.1	0	0	0	0	110.7
678	E	41	Very low	38.9	Very low	147 Å²	147	137.3 Å²	137.3	69%	0.687	78%	0.779	S	S	*	*			cis	-159.7	172.9	-11.8	-122.4	88.1	-87.7	0	0	106.7	K676	K676-E678 WeakPolarHBondContact CE-OE2 3.41Å; K676-E678 IonicContact NZ-OE2 3.41Å; K676-E678 PolarHBondContact NZ-OE2 2.86Å
679	P	37.4	Very low	38.8	Very low	131 Å²	131	139.4 Å²	139.4	85%	0.851	78%	0.782	S	S	*	*			trans	-101.5	167.2	-164.4	39.1	-37.4	0	0	0	118
680	G	39.4	Very low	38.8	Very low	73 Å²	73	137.8 Å²	137.8	75%	0.753	78%	0.778	S	S	*	*			trans	173.9	154.2	162.4	0	0	0	0	0	117.7
681	V	47.1	Very low	38.8	Very low	143 Å²	143	142.7 Å²	142.7	87%	0.867	79%	0.79	S	S	*	*			trans	80.2	99.4	170.7	-167.7	0	0	0	0	118.6
682	D	43.3	Very low	38.6	Very low	150 Å²	150	145.6 Å²	145.6	80%	0.802	80%	0.795	S	S	*	*			trans	-93.6	-174.7	158.4	-58	-65.4	0	0	0	110.8
683	P	45.6	Very low	38.5	Very low	122 Å²	122	148.3 Å²	148.3	79%	0.792	80%	0.804	S	S	*	*				-131.5	163.8	-64.3	38.2	-24.2	0	0	0	113.1
684	S	37.1	Very low	38.2	Very low	110 Å²	110	150.2 Å²	150.2	77%	0.769	81%	0.805	S	S	*	*			trans	-160.8	148	160.3	-164.8	0	0	0	0	113.7
685	W	34.1	Very low	38	Very low	229 Å²	229	147.8 Å²	147.8	87%	0.867	81%	0.809	S	S	*	*			trans	-31	153.4	170	-49.9	80	0	0	0	116.3
686	N	37.7	Very low	37.9	Very low	111 Å²	111	143.3 Å²	143.3	59%	0.594	81%	0.81	S	S	*	*			cis	-160.5	165.6	25.4	-158	12.3	0	0	0	113.3
687	Q	38.6	Very low	37.9	Very low	172 Å²	172	140.7 Å²	140.7	80%	0.804	82%	0.819	S	S	*	*			trans	19.9	134	155.9	-72.6	160	11.2	0	0	121.4
688	G	32.6	Very low	37.5	Very low	74 Å²	74	139.5 Å²	139.5	76%	0.763	82%	0.821	S	S	*	*			trans	-171.6	-44.2	164.6	0	0	0	0	0	121
689	T	34.3	Very low	37.4	Very low	142 Å²	142	140.2 Å²	140.2	87%	0.871	83%	0.826	S	S	*	*			trans	-150.6	132.3	-163.6	50.1	0	0	0	0	115.6
690	A	34.1	Very low	37.4	Very low	99 Å²	99	141.9 Å²	141.9	82%	0.818	82%	0.823	S	S	*	*			trans	159.7	101.5	133.6	0	0	0	0	0	110.5
691	N	34.5	Very low	37.4	Very low	164 Å²	164	142.9 Å²	142.9	88%	0.877	81%	0.814	S	S	*	*			trans	-146.1	70.5	173.8	-125.8	-5.2	0	0	0	112.2
692	H	37.9	Very low	36.9	Very low	186 Å²	186	141.4 Å²	141.4	86%	0.861	81%	0.807	S	S	*	*	S	Bend	trans	-155	152.3	161.4	-96.3	-78	0	0	0	108.3
693	L	37.9	Very low	36.7	Very low	173 Å²	173	139.2 Å²	139.2	91%	0.906	80%	0.795	S	S	*	*	S	Bend	trans	69.9	49.9	170.4	-58.8	162.7	0	0	0	117.8
694	R	33.2	Very low	36.4	Very low	240 Å²	240	140.7 Å²	140.7	91%	0.906	79%	0.791	S	S	*	*			trans	-152.3	105.4	150.7	-105.8	-179.5	-171.3	-173.9	2	111.2
695	N	33	Very low	36.1	Very low	176 Å²	176	144.9 Å²	144.9	94%	0.941	79%	0.79	S	S	*	*			trans	-175.1	89.6	155.4	-102.7	-10.5	0	0	0	110.5
696	A	38.5	Very low	36	Very low	110 Å²	110	141 Å²	141	91%	0.909	79%	0.791	S	S	*	*	S	Bend	trans	-150.8	4.2	173.1	0	0	0	0	0	113.5
697	A	37.8	Very low	35.8	Very low	106 Å²	106	141.1 Å²	141.1	88%	0.876	80%	0.801	S	S	*	*	S	Bend	trans	-144.2	87.1	-175.9	0	0	0	0	0	108.9
698	G	33.4	Very low	35.4	Very low	71 Å²	71	140.2 Å²	140.2	73%	0.732	80%	0.802	S	S	*	*			trans	169.1	25.2	-172.4	0	0	0	0	0	116.3	Q700	G698-Q700 PolarHBondContact O-N 3.47Å
699	M	37.3	Very low	35.4	Very low	162 Å²	162	143.6 Å²	143.6	80%	0.798	81%	0.807	S	S	*	*			trans	-89.6	83.4	169.5	-83	-179.2	148.1	0	0	109.8
700	Q	37.5	Very low	35.2	Very low	167 Å²	167	142.9 Å²	142.9	78%	0.78	80%	0.803	S	S	*	*			trans	-95.9	125.1	155.8	-71.2	176.8	-78.8	0	0	107.2	G698	G698-Q700 PolarHBondContact O-N 3.47Å
701	V	39.2	Very low	35.2	Very low	94 Å²	94	145 Å²	145	57%	0.57	81%	0.806	S	S	*	*			trans	-127.2	101.3	178.1	-173.8	0	0	0	0	108.3
702	P	36.9	Very low	35.2	Very low	111 Å²	111	140.4 Å²	140.4	72%	0.721	80%	0.797	S	S	*	*			trans	-65.2	142.9	168.6	-16.6	31.2	0	0	0	110.1
703	I	39.1	Very low	35	Very low	105 Å²	105	137.6 Å²	137.6	54%	0.538	80%	0.795	S	S	.	*			trans	-119.5	99.6	178.9	-57.1	176.9	0	0	0	109
704	E	38.7	Very low	35.1	Very low	152 Å²	152	135.3 Å²	135.3	71%	0.71	79%	0.791	S	S	*	*			trans	-139.5	121.8	164.6	-70.7	-147.3	114.2	0	0	112.2
705	R	32.7	Very low	35.3	Very low	198 Å²	198	133 Å²	133	75%	0.747	79%	0.792	S	S	*	*			trans	17.7	139.4	152.7	-44.6	179.1	-156.7	76.9	11.7	120.8
706	V	31.6	Very low	35.4	Very low	148 Å²	148	129.6 Å²	129.6	90%	0.897	79%	0.789	S	S	*	*				-178	169.2	118.9	145.7	0	0	0	0	111
707	S	33.3	Very low	35.2	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	79%	0.787	S	S	*	*			trans	-112.5	165.1	-157.2	-44.6	0	0	0	0	117
708	N	29.9	Very low	35.1	Very low	153 Å²	153	131.9 Å²	131.9	82%	0.818	78%	0.779	S	S	*	*			trans	-52.2	148.2	179.7	-51.8	-5.4	0	0	0	117.6
709	V	33.5	Very low	35.4	Very low	145 Å²	145	137.8 Å²	137.8	88%	0.879	79%	0.789	S	S	*	*			trans	-148.7	145	130.7	173.4	0	0	0	0	109.9
710	T	29.6	Very low	35.1	Very low	126 Å²	126	139.2 Å²	139.2	77%	0.773	79%	0.791	S	S	*	*			trans	-95.9	144.8	-175.1	-44.5	0	0	0	0	114
711	T	33.7	Very low	35.2	Very low	145 Å²	145	139.7 Å²	139.7	89%	0.89	80%	0.797	S	S	*	*			trans	-155.8	159.7	148.7	-16	0	0	0	0	112.5
712	G	34	Very low	35.1	Very low	66 Å²	66	140.3 Å²	140.3	68%	0.68	81%	0.806	S	S	*	*			trans	-89.9	179	-166.3	0	0	0	0	0	117.5
713	P	34.2	Very low	35.5	Very low	127 Å²	127	140.7 Å²	140.7	83%	0.825	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-94.7	148.2	-162.7	35.7	-36.1	0	0	0	115.7
714	P	40.2	Very low	36.2	Very low	126 Å²	126	141.5 Å²	141.5	82%	0.818	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-87.1	164.9	161.2	35.8	-32.5	0	0	0	112.3
715	M	37.9	Very low	36.4	Very low	191 Å²	191	140.3 Å²	140.3	94%	0.941	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-86.3	169.8	-174.1	-66.4	-176.7	175.5	0	0	114.1
716	A	33.6	Very low	36.6	Very low	104 Å²	104	135.7 Å²	135.7	86%	0.86	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-66.2	152.8	178.1	0	0	0	0	0	113.7
717	D	36	Very low	37.2	Very low	164 Å²	164	138.7 Å²	138.7	88%	0.877	83%	0.831	S	S	*	*			trans	-139.5	160.8	151.2	-150.1	-18.4	0	0	0	110.1
718	S	34.4	Very low	37.2	Very low	100 Å²	100	142.7 Å²	142.7	70%	0.699	83%	0.834	S	S	*	*			trans	-125.9	123	-154.2	-172.1	0	0	0	0	113.8
719	M	39.9	Very low	37.6	Very low	195 Å²	195	143.4 Å²	143.4	96%	0.961	83%	0.832	S	S	*	*			trans	-132.7	129.2	169.7	-65.5	-163.1	-178.9	0	0	112.1
720	K	31.5	Very low	37.8	Very low	193 Å²	193	144.6 Å²	144.6	84%	0.839	83%	0.828	S	S	*	*			trans	-89.7	146.7	-178	-58.7	172.7	-179.9	175	0	111.6
721	I	39.1	Very low	38	Very low	176 Å²	176	147.8 Å²	147.8	90%	0.903	83%	0.827	S	S	*	*			trans	-149.3	150.7	146.5	-92.8	127.3	0	0	0	108.7
722	S	38.2	Very low	38.1	Very low	108 Å²	108	145.6 Å²	145.6	76%	0.755	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-93.2	158.1	-162.4	-53.9	0	0	0	0	115.2
723	P	44.6	Very low	38.1	Very low	118 Å²	118	148.1 Å²	148.1	77%	0.766	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-83.1	158.2	176	34.3	-36.4	0	0	0	114.1
724	P	53.7	Low	38.2	Very low	123 Å²	123	149.4 Å²	149.4	80%	0.799	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-86	157.3	178.4	34.7	-35.5	0	0	0	114.2
725	P	42.4	Very low	37.8	Very low	126 Å²	126	149.8 Å²	149.8	82%	0.818	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-96	157.1	-172.4	37.2	-36.4	0	0	0	115.5
726	A	37.4	Very low	37.8	Very low	102 Å²	102	148.1 Å²	148.1	84%	0.843	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-84.9	161	174.4	0	0	0	0	0	113.9
727	K	43.9	Very low	37.9	Very low	210 Å²	210	151.6 Å²	151.6	91%	0.913	80%	0.799	S	S	*	*			trans	-119.6	148.7	170.9	-70.9	-176	177	179.7	0	111.3
728	K	33.1	Very low	38.1	Very low	199 Å²	199	149.2 Å²	149.2	87%	0.865	79%	0.793	S	S	*	*			trans	-120.6	147.6	-179.4	-69.2	-178.2	176.5	-179.4	0	112
729	H	39.2	Very low	38.2	Very low	168 Å²	168	150.6 Å²	150.6	78%	0.778	80%	0.803	S	S	*	*			trans	-146.4	121.7	154.7	-79.9	-69.4	0	0	0	105.9
730	H	37.8	Very low	37.7	Very low	170 Å²	170	144.8 Å²	144.8	79%	0.787	79%	0.792	S	S	*	*				72.7	132.9	89.2	-75.3	0.8	0	0	0	113.1
731	Y	33	Very low	37.9	Very low	193 Å²	193	143.9 Å²	143.9	76%	0.757	80%	0.795	S	S	*	*			cis	-169.3	130	4.6	178.4	-109.5	0	0	0	112.3
732	V	35.9	Very low	37.3	Very low	99 Å²	99	144 Å²	144	60%	0.6	79%	0.791	S	S	*	*			trans	69.6	151.6	147.2	159.2	0	0	0	0	118
733	N	35.2	Very low	37.1	Very low	118 Å²	118	144.5 Å²	144.5	63%	0.631	79%	0.794	S	S	*	*			cis	-141.8	177.1	24	-149.8	0.8	0	0	0	116.8
734	Q	36.3	Very low	36.7	Very low	154 Å²	154	147.2 Å²	147.2	72%	0.72	80%	0.796	S	S	*	*			trans	-23.5	142	170.2	-68.6	142.1	-15.9	0	0	117.8
735	V	30.8	Very low	35.9	Very low	135 Å²	135	147.4 Å²	147.4	82%	0.818	80%	0.797	S	S	*	*			cis	75.8	108.1	39.3	-178.8	0	0	0	0	114.7
736	D	38.4	Very low	35.4	Very low	155 Å²	155	145.3 Å²	145.3	83%	0.829	80%	0.799	S	S	*	*			trans	-161.4	179.1	133.7	-130.6	-38	0	0	0	114
737	Q	35.6	Very low	35.4	Very low	178 Å²	178	145.1 Å²	145.1	83%	0.832	80%	0.797	S	S	*	*			trans	-91.2	167.3	-157	-83.3	-170.5	33.1	0	0	118.9
738	P	40	Very low	35.2	Very low	113 Å²	113	140.6 Å²	140.6	73%	0.734	79%	0.789	S	S	*	*			trans	-95.5	159.9	-171.5	37.9	-36.8	0	0	0	115.6
739	S	35.7	Very low	35.2	Very low	130 Å²	130	139.1 Å²	139.1	91%	0.909	79%	0.789	S	S	*	*			trans	-158.6	142.2	155.3	-79.1	0	0	0	0	109.3
740	G	29.9	Very low	34.8	Very low	72 Å²	72	135.1 Å²	135.1	74%	0.742	79%	0.785	S	S	*	*			trans	-105.9	173.8	-179.6	0	0	0	0	0	113.3
741	I	35.1	Very low	34.8	Very low	175 Å²	175	136.4 Å²	136.4	90%	0.897	79%	0.791	S	S	*	*			trans	-158.3	143.6	159	-103.3	150.6	0	0	0	108.2
742	Q	28.2	Very low	34.8	Very low	177 Å²	177	132.4 Å²	132.4	83%	0.827	79%	0.792	S	S	*	*			trans	-89.8	149.3	174.3	-58.8	162.2	-68.1	0	0	110.1
743	C	32.3	Very low	35.1	Very low	120 Å²	120	132.1 Å²	132.1	81%	0.811	79%	0.792	S	S	*	*				-177.1	125.8	128.9	-98	0	0	0	0	114.1
744	H	36.8	Very low	35.2	Very low	175 Å²	175	135.7 Å²	135.7	81%	0.81	80%	0.798	S	S	*	*			trans	16.1	150.9	147	-64.4	-73.8	0	0	0	123.9
745	P	36.5	Very low	35.2	Very low	127 Å²	127	136.7 Å²	136.7	83%	0.825	80%	0.802	S	S	*	*			trans	-89.2	159.3	-168.8	37.1	-37.7	0	0	0	114.8
746	G	33.2	Very low	35.4	Very low	82 Å²	82	134.3 Å²	134.3	85%	0.845	80%	0.797	S	S	*	*			trans	-153.8	141.3	166.9	0	0	0	0	0	111.6
747	A	35.5	Very low	35.2	Very low	98 Å²	98	133 Å²	133	81%	0.81	79%	0.794	S	S	*	*			trans	-139	173	174.3	0	0	0	0	0	108.4
748	P	41.4	Very low	35.1	Very low	115 Å²	115	129.2 Å²	129.2	75%	0.747	79%	0.787	S	S	*	*			cis	-118.9	-168.8	-16.1	40.2	-26.3	0	0	0	110.9
749	I	33.3	Very low	35	Very low	167 Å²	167	130.8 Å²	130.8	86%	0.856	80%	0.795	S	S	*	*			trans	178.6	153.5	132.8	-93.6	156.8	0	0	0	109.4
750	A	30.7	Very low	34.8	Very low	84 Å²	84	132.1 Å²	132.1	69%	0.694	79%	0.792	S	S	*	*			trans	-94.8	160.3	-169.8	0	0	0	0	0	114.5
751	Q	36	Very low	34.9	Very low	197 Å²	197	134.7 Å²	134.7	92%	0.921	80%	0.797	S	S	*	*			trans	-157.3	144.5	141.4	-109.8	155.9	47.9	0	0	112.3
752	S	34.6	Very low	34.7	Very low	110 Å²	110	132.3 Å²	132.3	77%	0.769	79%	0.791	S	S	*	*			trans	-131.6	163.2	173.5	-162.4	0	0	0	0	106.5
753	P	42.3	Very low	35	Very low	92 Å²	92	129.6 Å²	129.6	60%	0.597	79%	0.789	S	S	*	*				-157.2	-154.3	82.9	43.1	-21.3	0	0	0	115
754	Y	36.8	Very low	35.1	Very low	194 Å²	194	132.4 Å²	132.4	76%	0.761	79%	0.79	S	S	*	*			trans	91.7	95.7	178.6	-57.5	-68.3	0	0	0	114.4
755	Q	36.5	Very low	35	Very low	174 Å²	174	132.5 Å²	132.5	81%	0.813	79%	0.791	S	S	*	*				67.1	135.2	65	-64.2	-179.3	-22.4	0	0	113.2
756	A	34.3	Very low	34.8	Very low	85 Å²	85	133.2 Å²	133.2	70%	0.702	79%	0.787	S	S	*	*			cis	-152.9	169.7	-13.4	0	0	0	0	0	106.4
757	V	35.4	Very low	34.7	Very low	128 Å²	128	136.5 Å²	136.5	78%	0.776	78%	0.784	S	S	*	*				-172.5	118.7	60.2	164.3	0	0	0	0	104.2
758	S	32.7	Very low	34.5	Very low	98 Å²	98	140.9 Å²	140.9	69%	0.685	79%	0.785	S	S	*	*				68.9	96.4	72.4	-56.3	0	0	0	0	116.2
759	T	37.9	Very low	34.2	Very low	147 Å²	147	145.3 Å²	145.3	90%	0.902	79%	0.789	S	S	*	*				-165.5	119.1	126.5	32.2	0	0	0	0	110
760	D	32.2	Very low	34.3	Very low	158 Å²	158	143.6 Å²	143.6	85%	0.845	78%	0.781	S	S	*	*			trans	-83.4	159	174	-54.8	-93.8	0	0	0	112.5
761	C	32	Very low	35.2	Very low	125 Å²	125	145 Å²	145	85%	0.845	78%	0.783	S	S	*	*			trans	-154.7	118.5	136.8	-153.6	0	0	0	0	111.6
762	T	29.9	Very low	35.7	Very low	125 Å²	125	141.6 Å²	141.6	77%	0.767	78%	0.778	S	S	*	*			trans	-120.8	156.1	158.1	60.9	0	0	0	0	108.2
763	P	34	Very low	36	Very low	121 Å²	121	141.9 Å²	141.9	79%	0.786	78%	0.775	S	S	*	*			trans	-137.1	118.6	132.9	31.3	-17.3	0	0	0	112.2
764	Q	34.1	Very low	36.2	Very low	178 Å²	178	143.7 Å²	143.7	83%	0.832	79%	0.787	S	S	*	*			trans	-74.5	124	151.8	-64.6	175.3	-5.9	0	0	108.3
765	Q	35.7	Very low	36.3	Very low	178 Å²	178	140.5 Å²	140.5	83%	0.832	79%	0.788	S	S	*	*			trans	-173.8	150.7	140.5	-107.8	168.3	83.5	0	0	113.3
766	L	31.4	Very low	36.6	Very low	141 Å²	141	138 Å²	138	74%	0.738	78%	0.784	S	S	*	*			trans	40.5	100	161.5	-81	70.3	0	0	0	118.1
767	L	33	Very low	37.1	Very low	152 Å²	152	139.8 Å²	139.8	80%	0.796	79%	0.788	S	S	*	*				-165.6	148.1	92.5	-103	157.2	0	0	0	112.3	Y769	L767-Y769 HydrophobicContact CB-CD2 4.5Å
768	K	31	Very low	37.3	Very low	190 Å²	190	140.2 Å²	140.2	83%	0.826	79%	0.786	S	S	*	*			trans	-106.6	88.9	-170.3	-178.1	-178.4	177.8	178.5	0	110.4
769	Y	34.4	Very low	38.3	Very low	208 Å²	208	141.4 Å²	141.4	82%	0.816	79%	0.791	S	S	*	*			trans	-97.6	106.4	174.6	-90.5	-87.7	0	0	0	111.8	L767	L767-Y769 HydrophobicContact CB-CD2 4.5Å
770	N	35.5	Very low	38.3	Very low	131 Å²	131	140.8 Å²	140.8	70%	0.701	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-68.9	149	158.4	-95.5	12.9	0	0	0	109.3
771	P	50	Low	39.2	Very low	112 Å²	112	138.4 Å²	138.4	73%	0.727	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-62.9	139.5	161.4	29.2	-33.7	0	0	0	109.5	T773	P771-T773 PolarHBondContact O-N 2.71Å
772	P	45.6	Very low	40.2	Very low	126 Å²	126	138.8 Å²	138.8	82%	0.818	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-69.6	123.6	178	27.9	-33.3	0	0	0	110.5
773	T	41.8	Very low	40.7	Very low	116 Å²	116	137.9 Å²	137.9	71%	0.712	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-66.2	130.7	167.4	45.5	0	0	0	0	109.8	P771 V775	P771-T773 PolarHBondContact O-N 2.71Å; T773-V775 PolarHBondContact O-N 2.8Å; T773-V775 VanDerWaalsContact O-N 3.09Å
774	P	45.4	Very low	41	Very low	130 Å²	130	138.9 Å²	138.9	84%	0.844	78%	0.779	S	S	*	*			trans	-67.5	110.6	175.7	27.4	-33.2	0	0	0	109.8
775	V	39.4	Very low	41.1	Very low	128 Å²	128	134.1 Å²	134.1	78%	0.776	78%	0.778	S	S	*	*			trans	-82	119.6	176.6	-176.3	0	0	0	0	108.9	T773 P777	T773-V775 PolarHBondContact O-N 2.8Å; T773-V775 VanDerWaalsContact O-N 3.09Å; V775-P777 WeakPolarHBondContact O-CD 3.3Å
776	T	42.1	Very low	41.1	Very low	121 Å²	121	129.8 Å²	129.8	74%	0.742	78%	0.78	S	S	*	*			trans	-68	122.1	175.6	22.8	0	0	0	0	111.5	L778	T776-L778 PolarHBondContact O-N 3.43Å
777	P	44.6	Very low	41.4	Very low	122 Å²	122	126.9 Å²	126.9	79%	0.792	79%	0.785	S	S	*	*			trans	-74.2	115.6	166.3	-9.1	26.3	0	0	0	108.9	V775 P779	V775-P777 WeakPolarHBondContact O-CD 3.3Å; P777-P779 WeakPolarHBondContact O-CD 3.49Å
778	L	41.3	Very low	41.7	Very low	137 Å²	137	123.8 Å²	123.8	72%	0.717	79%	0.789	S	S	*	*			trans	-86.4	118.2	174.8	-142.6	80.4	0	0	0	109.6	T776 N780	T776-L778 PolarHBondContact O-N 3.43Å; L778-N780 PolarHBondContact O-N 3Å; L778-N780 VanDerWaalsContact O-N 3.12Å
779	P	52	Low	42.2	Very low	124 Å²	124	118.3 Å²	118.3	81%	0.805	79%	0.787	S	S	*	*			trans	-82.7	87.8	177.4	32.6	-33.2	0	0	0	110.8	P777	P777-P779 WeakPolarHBondContact O-CD 3.49Å
780	N	39.9	Very low	42.8	Very low	133 Å²	133	113.6 Å²	113.6	71%	0.711	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-84.1	136.3	169.7	-81.1	-5.8	0	0	0	111	L778	L778-N780 PolarHBondContact O-N 3Å; L778-N780 VanDerWaalsContact O-N 3.12Å
781	P	49.7	Very low	43.1	Very low	108 Å²	108	118.8 Å²	118.8	70%	0.701	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-86.6	148.2	-175.3	33.9	-35.5	0	0	0	113.3
782	P	53	Low	42.7	Very low	134 Å²	134	119 Å²	119	87%	0.87	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.6	137.1	162.6	32.1	-32.2	0	0	0	110.3
783	S	39.8	Very low	42.4	Very low	105 Å²	105	119.9 Å²	119.9	73%	0.734	80%	0.799	S	S	*	*			trans	-126.6	123.5	-174	-170.1	0	0	0	0	112.8
784	V	40.7	Very low	42.2	Very low	143 Å²	143	117.9 Å²	117.9	87%	0.867	80%	0.801	S	S	*	*			trans	62.9	125.1	152.4	176.1	0	0	0	0	120
785	G	36.5	Very low	41.9	Very low	78 Å²	78	119.2 Å²	119.2	80%	0.804	80%	0.801	S	S	*	*			trans	113.2	125.1	147.4	0	0	0	0	0	115.9
786	G	36.6	Very low	42.1	Very low	86 Å²	86	118.2 Å²	118.2	89%	0.887	80%	0.797	S	S	*	*			cis	159.8	149.8	-10.6	0	0	0	0	0	113
787	G	37.3	Very low	42.3	Very low	81 Å²	81	117.5 Å²	117.5	84%	0.835	79%	0.794	S	S	*	*			trans	151.8	102.9	167.7	0	0	0	0	0	117.1
788	G	38.6	Very low	41.9	Very low	86 Å²	86	117.1 Å²	117.1	89%	0.887	79%	0.794	S	S	*	*			trans	71.5	137.9	170	0	0	0	0	0	116.1
789	G	41.8	Very low	41.8	Very low	76 Å²	76	117.6 Å²	117.6	78%	0.784	80%	0.803	S	S	*	*			cis	112.1	144.6	-2.2	0	0	0	0	0	113.3
790	P	47.1	Very low	40.9	Very low	109 Å²	109	121 Å²	121	71%	0.708	81%	0.808	S	S	*	*			cis	-136.2	169.3	-2.8	43.5	-27.6	0	0	0	116.2
791	R	41.7	Very low	40.6	Very low	240 Å²	240	117.1 Å²	117.1	91%	0.906	80%	0.799	S	S	*	*			trans	58.5	123.7	157.8	-61.3	160.3	-174.5	-163.4	1	117.5
792	S	41.6	Very low	39.9	Very low	116 Å²	116	116.8 Å²	116.8	81%	0.811	81%	0.806	S	S	*	*				-175	154.1	66.8	-171.9	0	0	0	0	114
793	V	38.8	Very low	38.9	Very low	145 Å²	145	120.1 Å²	120.1	88%	0.879	80%	0.803	S	S	*	*			trans	-38.6	139.5	173.9	-169.4	0	0	0	0	117
794	G	37.6	Very low	38.5	Very low	73 Å²	73	120.2 Å²	120.2	75%	0.753	81%	0.81	S	S	*	*			trans	172.9	120.8	161.8	0	0	0	0	0	115.3
795	N	39.2	Very low	38.2	Very low	159 Å²	159	120.9 Å²	120.9	85%	0.85	81%	0.807	S	S	*	*			trans	-159.9	162.2	179	-143.4	21.1	0	0	0	107.3
796	P	45.2	Very low	37.9	Very low	106 Å²	106	126.6 Å²	126.6	69%	0.688	81%	0.813	S	S	*	*			cis	-122.5	-122.6	-24.8	24.2	1.3	0	0	0	111.7
797	P	45.3	Very low	37.6	Very low	107 Å²	107	127.8 Å²	127.8	70%	0.695	81%	0.806	S	S	*	*				-125.9	-179.1	-95.3	39.5	-23.7	0	0	0	117.5
798	S	35.6	Very low	37.1	Very low	113 Å²	113	129.7 Å²	129.7	79%	0.79	81%	0.807	S	S	*	*			trans	64.5	113.5	149.5	-61.9	0	0	0	0	121.8
799	V	39.8	Very low	36.9	Very low	148 Å²	148	131.4 Å²	131.4	90%	0.897	80%	0.8	S	S	*	*			trans	-144.6	144	145.2	-169.9	0	0	0	0	108.6
800	E	32.7	Very low	36.3	Very low	194 Å²	194	136.7 Å²	136.7	91%	0.907	80%	0.804	S	S	*	*			trans	-82.4	151.6	173.5	-64.5	171.5	108.2	0	0	112.2
801	G	34.7	Very low	35.6	Very low	52 Å²	52	136.8 Å²	136.8	54%	0.536	81%	0.808	S	S	.	*			trans	-173.9	122.9	173.9	0	0	0	0	0	112.4	Y803	G801-Y803 WeakPolarHBondContact O-CE2 3.32Å
802	A	33.3	Very low	35	Very low	102 Å²	102	132 Å²	132	84%	0.843	80%	0.8	S	S	*	*			trans	-94.6	134.2	-174.3	0	0	0	0	0	112.6
803	Y	33.4	Very low	34.7	Very low	204 Å²	204	133.9 Å²	133.9	80%	0.8	80%	0.8	S	S	*	*			trans	-137.3	125.9	170.9	-43.6	-76	0	0	0	109.2	G801	G801-Y803 WeakPolarHBondContact O-CE2 3.32Å
804	A	31.5	Very low	34.1	Very low	107 Å²	107	134.6 Å²	134.6	88%	0.884	79%	0.794	S	S	*	*			trans	-85.3	134.8	171.1	0	0	0	0	0	109.8
805	I	34	Very low	33.9	Very low	157 Å²	157	139 Å²	139	81%	0.805	80%	0.8	S	S	*	*			trans	-129.7	121.2	168.6	-64.5	-177.3	0	0	0	108.2
806	Q	29.1	Very low	33.4	Very low	197 Å²	197	137.6 Å²	137.6	92%	0.921	79%	0.792	S	S	*	*			trans	-75.2	136.3	166.9	-60.6	171.4	-73	0	0	108.8
807	C	30.5	Very low	32.9	Very low	111 Å²	111	139.2 Å²	139.2	75%	0.75	80%	0.8	S	S	*	*			trans	-146.6	107.6	160.2	-156.1	0	0	0	0	110.6
808	S	28.5	Very low	32.3	Very low	121 Å²	121	141 Å²	141	85%	0.846	80%	0.804	S	S	*	*			trans	-95.5	113.1	172.1	52.1	0	0	0	0	109.7
809	T	34.3	Very low	32.2	Very low	123 Å²	123	139.4 Å²	139.4	76%	0.755	81%	0.805	S	S	*	*			trans	-125.6	118.4	170.4	44.9	0	0	0	0	110.5
810	Q	27.6	Very low	31.9	Very low	186 Å²	186	138.4 Å²	138.4	87%	0.869	80%	0.804	S	S	*	*			trans	-74.7	137.1	167	-65.1	170.8	-20.2	0	0	109
811	S	34.1	Very low	32.1	Very low	111 Å²	111	133.9 Å²	133.9	78%	0.776	80%	0.8	S	S	*	*			trans	-117.5	80.5	169.3	41.8	0	0	0	0	110.3	L813	S811-L813 PolarHBondContact O-N 2.71Å
812	N	28.3	Very low	32.1	Very low	140 Å²	140	136.6 Å²	136.6	75%	0.749	82%	0.817	S	S	*	*			trans	-64.7	125.9	163.5	-105.2	-46.6	0	0	0	109.1
813	L	34.5	Very low	32.1	Very low	156 Å²	156	134.7 Å²	134.7	82%	0.817	81%	0.807	S	S	*	*			trans	-125.5	85	169.1	-88.5	167.4	0	0	0	109.2	S811	S811-L813 PolarHBondContact O-N 2.71Å
814	Q	27	Very low	32.2	Very low	159 Å²	159	130.7 Å²	130.7	74%	0.743	81%	0.81	S	S	*	*			trans	-71.2	133.9	163.2	-69.9	173.7	-98.1	0	0	109.1
815	L	34.3	Very low	32.6	Very low	166 Å²	166	128.7 Å²	128.7	87%	0.869	79%	0.793	S	S	*	*			trans	-123.5	116.3	160.7	-72	174.9	0	0	0	108
816	N	28	Very low	33	Very low	130 Å²	130	125.2 Å²	125.2	70%	0.695	78%	0.781	S	S	*	*			trans	-69.1	155.5	164.9	-72.5	9.6	0	0	0	109.5
817	V	35.6	Very low	33.3	Very low	140 Å²	140	126 Å²	126	85%	0.848	78%	0.776	S	S	*	*				-168.7	145.7	108.5	145.6	0	0	0	0	109.4
818	D	31.7	Very low	33.9	Very low	145 Å²	145	126.6 Å²	126.6	78%	0.775	78%	0.777	S	S	*	*			trans	-76	161.6	-165.2	-46	-93.9	0	0	0	114.7
819	G	32.7	Very low	34.5	Very low	79 Å²	79	125.9 Å²	125.9	81%	0.814	77%	0.769	S	S	*	*			trans	167.8	67.6	174.3	0	0	0	0	0	116.4
820	S	33.7	Very low	34.5	Very low	127 Å²	127	124.6 Å²	124.6	89%	0.888	77%	0.772	S	S	*	*			trans	-94.1	148	-178.4	-48	0	0	0	0	114.6
821	A	37.7	Very low	34.9	Very low	98 Å²	98	120.8 Å²	120.8	81%	0.81	77%	0.765	S	S	*	*			trans	-172.4	136.1	135.2	0	0	0	0	0	114.1
822	A	34.6	Very low	35	Very low	109 Å²	109	122.3 Å²	122.3	90%	0.901	77%	0.77	S	S	*	*			trans	12.4	148.2	157.4	0	0	0	0	0	122.7
823	G	32.8	Very low	35.3	Very low	62 Å²	62	118.7 Å²	118.7	64%	0.639	77%	0.766	S	S	*	*			cis	-172.6	150.9	0.5	0	0	0	0	0	111.2
824	S	36.5	Very low	35.4	Very low	121 Å²	121	117 Å²	117	85%	0.846	77%	0.767	S	S	*	*				61.2	101.5	100.6	-53	0	0	0	0	113.6
825	A	39.6	Very low	35.8	Very low	64 Å²	64	114.7 Å²	114.7	53%	0.529	77%	0.774	S	S	.	*				64	165.9	55.1	0	0	0	0	0	113.7	G79	G79-A825 WeakPolarHBondContact O-CA 3.29Å
826	P	42.9	Very low	35.8	Very low	85 Å²	85	110.8 Å²	110.8	55%	0.552	77%	0.774	S	S	*	*			cis	-135.2	-171	-20.6	29.3	-6.1	0	0	0	113.7
827	Y	34.7	Very low	36.2	Very low	212 Å²	212	109.9 Å²	109.9	83%	0.831	78%	0.778	S	S	*	*				160.4	138.5	116.5	-87.3	-61.5	0	0	0	117.2
828	T	42.8	Very low	36.2	Very low	124 Å²	124	112.4 Å²	112.4	76%	0.761	78%	0.781	S	S	*	*			trans	-107.1	-147	156.7	58.5	0	0	0	0	107.5
829	P	41	Very low	36.4	Very low	106 Å²	106	115.1 Å²	115.1	69%	0.688	79%	0.789	S	S	*	*			cis	-128.8	-173.6	-34.9	39.8	-23.8	0	0	0	112.5
830	A	35.2	Very low	36.3	Very low	97 Å²	97	114.9 Å²	114.9	80%	0.802	79%	0.786	S	S	*	*			trans	178.8	134.5	138	0	0	0	0	0	109.8
831	S	35.4	Very low	36.2	Very low	105 Å²	105	114.4 Å²	114.4	73%	0.734	78%	0.783	S	S	*	*			cis	93.4	86.9	9.7	-45.2	0	0	0	0	117.7
832	V	35.3	Very low	35.9	Very low	144 Å²	144	118.1 Å²	118.1	87%	0.873	78%	0.783	S	S	*	*			trans	-141.5	149.1	142	-76.4	0	0	0	0	106.6
833	G	35.1	Very low	35.6	Very low	64 Å²	64	117 Å²	117	66%	0.66	78%	0.782	S	S	*	*			cis	108.4	126.2	20.1	0	0	0	0	0	108.9
834	S	36.8	Very low	35.5	Very low	121 Å²	121	120.4 Å²	120.4	85%	0.846	78%	0.784	S	S	*	*			cis	-157.5	154	12.5	-67.4	0	0	0	0	113.4
835	A	36.5	Very low	35	Very low	109 Å²	109	122.4 Å²	122.4	90%	0.901	79%	0.785	S	S	*	*			trans	54.2	134.6	133.3	0	0	0	0	0	122.3
836	G	32.9	Very low	34.5	Very low	84 Å²	84	124.7 Å²	124.7	87%	0.866	79%	0.793	S	S	*	*			trans	-178.2	61.8	174.4	0	0	0	0	0	111.4
837	S	36.8	Very low	33.7	Very low	111 Å²	111	124.7 Å²	124.7	78%	0.776	80%	0.8	S	S	*	*			trans	-85.6	128.8	-168.4	56	0	0	0	0	114.4
838	Q	36.5	Very low	33.7	Very low	194 Å²	194	118.8 Å²	118.8	91%	0.907	79%	0.789	S	S	*	*			trans	-134.4	149.7	140.7	-73.8	-158.4	-4.4	0	0	110.2
839	Q	34.9	Very low	33.2	Very low	202 Å²	202	119.4 Å²	119.4	94%	0.944	79%	0.788	S	S	*	*			trans	-96.1	121.3	-171.4	-66.9	164.9	-51.4	0	0	110.6
840	G	31	Very low	32.6	Very low	74 Å²	74	122 Å²	122	76%	0.763	79%	0.791	S	S	*	*			trans	-121.5	97	168.9	0	0	0	0	0	109.7	H842	G840-H842 PolarHBondContact O-N 3.21Å
841	S	31.8	Very low	32.3	Very low	117 Å²	117	126.5 Å²	126.5	82%	0.818	80%	0.798	S	S	*	*			trans	-86.4	97.7	-170.7	55.5	0	0	0	0	112.9
842	H	31.4	Very low	32	Very low	176 Å²	176	127.2 Å²	127.2	82%	0.815	80%	0.802	S	S	*	*			trans	-116.4	95.8	160	-76.9	-71.8	0	0	0	110.4	G840 I844	G840-H842 PolarHBondContact O-N 3.21Å; H842-I844 PolarHBondContact O-N 3.19Å
843	G	27.5	Very low	31.6	Very low	84 Å²	84	128.4 Å²	128.4	87%	0.866	80%	0.803	S	S	*	*			trans	-76.5	100.3	166.1	0	0	0	0	0	109.6
844	I	30.5	Very low	31.4	Very low	135 Å²	135	130 Å²	130	69%	0.692	80%	0.804	S	S	*	*			trans	-93.1	108.9	170.2	-55.4	-177.9	0	0	0	108.2	H842 V846	H842-I844 PolarHBondContact O-N 3.19Å; I844-V846 VanDerWaalsContact C-N 3.32Å; I844-V846 HydrophobicContact CB-CG2 4.35Å; I844-V846 HydrophobicContact CG2-CG2 3.67Å; I844-V846 PolarHBondContact O-N 3.33Å
845	N	25.6	Very low	31.1	Very low	163 Å²	163	133 Å²	133	87%	0.872	81%	0.805	S	S	*	*			trans	-65.4	95	159.1	-97.3	-21.1	0	0	0	107.9	A847	N845-A847 PolarHBondContact O-N 2.84Å
846	V	30.2	Very low	30.8	Very low	112 Å²	112	136.9 Å²	136.9	68%	0.679	80%	0.801	S	S	*	*			trans	-78	72	169.5	-172.5	0	0	0	0	108.8	I844 S848	I844-V846 VanDerWaalsContact C-N 3.32Å; I844-V846 HydrophobicContact CB-CG2 4.35Å; I844-V846 HydrophobicContact CG2-CG2 3.67Å; I844-V846 PolarHBondContact O-N 3.33Å; V846-S848 VanDerWaalsContact C-N 3.25Å; V846-S848 PolarHBondContact O-N 3.14Å
847	A	26.4	Very low	30.5	Very low	85 Å²	85	140.4 Å²	140.4	70%	0.702	80%	0.801	S	S	*	*			trans	-75.7	86.7	151.6	0	0	0	0	0	107.2	N845	N845-A847 PolarHBondContact O-N 2.84Å
848	S	34.2	Very low	30.2	Very low	87 Å²	87	142.1 Å²	142.1	61%	0.608	80%	0.801	S	S	*	*			trans	-97.4	97.9	161.9	54.8	0	0	0	0	107	V846	V846-S848 VanDerWaalsContact C-N 3.25Å; V846-S848 PolarHBondContact O-N 3.14Å
849	N	31.6	Very low	30	Very low	138 Å²	138	140.5 Å²	140.5	74%	0.738	80%	0.798	S	S	*	*				46.6	101.6	85.2	-69.2	10.1	0	0	0	109.1
850	E	29.4	Very low	29.7	Very low	161 Å²	161	136.1 Å²	136.1	75%	0.752	79%	0.789	S	S	*	*				47.4	135.9	55.4	-56.8	-139.1	122.6	0	0	113
851	M	28.6	Very low	29.7	Very low	190 Å²	190	142.4 Å²	142.4	94%	0.936	80%	0.796	S	S	*	*			trans	67.5	92.4	-176.7	-55.6	174.9	62.3	0	0	116.4
852	C	28.4	Very low	29.6	Very low	121 Å²	121	143.3 Å²	143.3	82%	0.818	79%	0.792	S	S	*	*			trans	-135.5	36.8	145.5	-165.6	0	0	0	0	111.3
853	N	27.8	Very low	29.6	Very low	168 Å²	168	139.9 Å²	139.9	90%	0.898	79%	0.794	S	S	*	*			trans	-109.1	77.8	165.9	-83.2	0.2	0	0	0	108
854	S	30.7	Very low	29.8	Very low	97 Å²	97	140.6 Å²	140.6	68%	0.678	79%	0.785	S	S	*	*			trans	-113.5	93.2	176.2	56.7	0	0	0	0	110.2
855	E	29.7	Very low	30	Very low	186 Å²	186	141 Å²	141	87%	0.869	79%	0.789	S	S	*	*			trans	37.1	103.6	143.2	-59.9	174	133.5	0	0	117.9
856	F	30.7	Very low	30.3	Very low	189 Å²	189	140.4 Å²	140.4	83%	0.829	79%	0.785	S	S	*	*			trans	-137.7	58.9	154.2	-149.5	-89.1	0	0	0	111.7
857	N	27.8	Very low	30.4	Very low	159 Å²	159	143.4 Å²	143.4	85%	0.85	80%	0.796	S	S	*	*			trans	-115.9	86.8	166.5	-102.3	-1.3	0	0	0	107.9
858	D	29.7	Very low	30.8	Very low	147 Å²	147	145.6 Å²	145.6	79%	0.786	80%	0.803	S	S	*	*			trans	172.5	103.7	147.9	-97.3	-19.1	0	0	0	110.1
859	L	32	Very low	30.8	Very low	160 Å²	160	147 Å²	147	84%	0.838	81%	0.813	S	S	*	*			trans	-167.4	88.4	145.2	-87.9	-156.8	0	0	0	108.6
860	S	28.1	Very low	30.8	Very low	110 Å²	110	148.3 Å²	148.3	77%	0.769	82%	0.82	S	S	*	*			trans	-75.1	129.3	161.9	56.5	0	0	0	0	109.6
861	F	31.7	Very low	31.1	Very low	206 Å²	206	144.5 Å²	144.5	90%	0.904	82%	0.824	S	S	*	*			trans	-142.4	147.4	162.4	-120.2	-82.8	0	0	0	112.5
862	D	28.8	Very low	31.2	Very low	136 Å²	136	141.4 Å²	141.4	73%	0.727	82%	0.821	S	S	*	*			trans	-76.1	138.9	-170.8	-141	-54.5	0	0	0	111.9	S864	D862-S864 PolarHBondContact OD1-OG 3.14Å
863	A	32.6	Very low	31.6	Very low	104 Å²	104	140.6 Å²	140.6	86%	0.86	82%	0.823	S	S	*	*			trans	-110.7	47.8	-175.7	0	0	0	0	0	111.4
864	S	31.3	Very low	31.9	Very low	98 Å²	98	137.3 Å²	137.3	69%	0.685	81%	0.813	S	S	*	*			trans	-112.3	47.9	-174.1	-61.1	0	0	0	0	112.5	D862	D862-S864 PolarHBondContact OD1-OG 3.14Å
865	D	34.1	Very low	32.2	Very low	143 Å²	143	138.3 Å²	138.3	77%	0.765	81%	0.811	S	S	*	*			trans	-153.4	140.8	169.1	-125.6	-21.7	0	0	0	116.7
866	L	33.5	Very low	32.4	Very low	152 Å²	152	135.8 Å²	135.8	80%	0.796	80%	0.804	S	S	*	*			trans	60	107	160.1	-50.5	-176.1	0	0	0	122.2
867	L	31	Very low	32.5	Very low	174 Å²	174	134.3 Å²	134.3	91%	0.911	80%	0.803	S	S	*	*			trans	-83.1	151.6	152.4	-62.2	166.5	0	0	0	111.2
868	P	35.2	Very low	32.6	Very low	131 Å²	131	129.6 Å²	129.6	85%	0.851	79%	0.792	S	S	*	*			trans	-109.5	162.5	156.8	24.2	-7.3	0	0	0	113.3
869	S	34.7	Very low	32.6	Very low	117 Å²	117	130.3 Å²	130.3	82%	0.818	80%	0.796	S	S	*	*			trans	-114.2	157.9	-173.6	-179.9	0	0	0	0	112.8
870	D	31.9	Very low	32.5	Very low	165 Å²	165	129.7 Å²	129.7	88%	0.882	79%	0.792	S	S	*	*			trans	-64.8	157.9	-178.6	-54.7	-75.7	0	0	0	115.8
871	G	34.8	Very low	32.7	Very low	81 Å²	81	133.8 Å²	133.8	84%	0.835	80%	0.796	S	S	*	*			trans	-169.4	124.9	166.6	0	0	0	0	0	111.9
872	S	31.7	Very low	32.6	Very low	126 Å²	126	130.6 Å²	130.6	88%	0.881	79%	0.794	S	S	*	*			trans	-114.5	153.9	-165.9	55.7	0	0	0	0	115.2
873	A	35.9	Very low	32.7	Very low	104 Å²	104	131.7 Å²	131.7	86%	0.86	80%	0.8	S	S	*	*			trans	-157.3	151.1	158.3	0	0	0	0	0	111.3
874	S	33.5	Very low	32.9	Very low	98 Å²	98	132.1 Å²	132.1	69%	0.685	80%	0.797	S	S	*	*			trans	-95.9	172.5	178.2	43.9	0	0	0	0	111.2
875	D	36.8	Very low	33.3	Very low	119 Å²	119	134.3 Å²	134.3	64%	0.636	81%	0.806	S	S	*	*				-176.1	144.1	58.8	-101.2	-73.2	0	0	0	113.1
876	N	33.7	Very low	33.6	Very low	133 Å²	133	135.4 Å²	135.4	71%	0.711	81%	0.809	S	S	*	*			trans	46.7	148.9	136.3	-74.8	-54.8	0	0	0	122.6
877	I	34.4	Very low	33.7	Very low	157 Å²	157	131.2 Å²	131.2	81%	0.805	79%	0.791	S	S	*	*			cis	-156.8	144.6	14.3	-116.8	152.2	0	0	0	112.1
878	G	29.9	Very low	33.9	Very low	60 Å²	60	128.1 Å²	128.1	62%	0.619	78%	0.775	S	S	*	*				82.7	96.4	126	0	0	0	0	0	124.6
879	N	30	Very low	34.1	Very low	163 Å²	163	126.8 Å²	126.8	87%	0.872	77%	0.766	S	S	*	*				56.2	116.7	129.5	-60.3	6.4	0	0	0	123
880	L	28.9	Very low	34.4	Very low	146 Å²	146	122.9 Å²	122.9	76%	0.764	75%	0.745	S	S	*	*			trans	-158.5	145.4	134.1	-113.1	154.5	0	0	0	111.4
881	F	32.8	Very low	34.9	Very low	196 Å²	196	120.3 Å²	120.3	86%	0.86	73%	0.727	S	S	*	*			trans	73.3	124.3	175.6	-53.6	-67.8	0	0	0	119.7
882	T	30	Very low	35.2	Very low	139 Å²	139	120.4 Å²	120.4	85%	0.853	71%	0.705	S	S	*	*			trans	-129.5	122.7	168.4	49.3	0	0	0	0	108.7
883	D	30.3	Very low	36	Very low	160 Å²	160	118.9 Å²	118.9	86%	0.856	69%	0.686	S	S	*	*			trans	-170.3	165.8	142.7	-135.8	-41.7	0	0	0	112.1
884	S	37.2	Very low	36.1	Very low	112 Å²	112	118.6 Å²	118.6	78%	0.783	67%	0.667	S	S	*	*			trans	63.9	85.8	169.6	-58.5	0	0	0	0	117.8
885	T	38.3	Very low	36.4	Very low	145 Å²	145	121.8 Å²	121.8	89%	0.89	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-81.3	135.6	170.5	44.5	0	0	0	0	113.7
886	M	41.3	Very low	36.7	Very low	166 Å²	166	120.1 Å²	120.1	82%	0.818	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-74.8	155	158.5	-105.9	-168.5	163.1	0	0	111
887	P	35.4	Very low	37.1	Very low	64 Å²	64	120.3 Å²	120.3	42%	0.416	65%	0.649	S	S	.	*	P	Polyproline II helix	trans	-71.5	153.4	177	31.5	-36	0	0	0	112.4	E891	P887-E891 HydrophobicContact CB-CB 4.06Å; P887-E891 WeakPolarHBondContact CB-OE2 3.29Å
888	D	35.7	Very low	37.2	Very low	109 Å²	109	118.9 Å²	118.9	58%	0.583	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-59.4	143.4	176.6	-169.8	-51.6	0	0	0	110.7	G890 E891 F892	D888-G890 PolarHBondContact O-N 3.2Å; D888-G890 PolarHBondContact OD1-N 2.77Å; D888-E891 PolarHBondContact O-N 2.99Å; D888-F892 PolarHBondContact O-N 2.93Å
889	P	39.7	Very low	37.6	Very low	103 Å²	103	118.4 Å²	118.4	67%	0.669	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.3	-20	168.3	19.6	-32.3	0	0	0	114.7	F892	P889-F892 WeakPolarHBondContact O-CB 3.41Å
890	G	39.5	Very low	37.6	Very low	35 Å²	35	118.2 Å²	118.2	36%	0.361	63%	0.629	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.8	-41.8	167.3	0	0	0	0	0	114.6	D888 F892 I893 Q894	D888-G890 PolarHBondContact O-N 3.2Å; D888-G890 PolarHBondContact OD1-N 2.77Å; G890-F892 VanDerWaalsContact C-N 3.27Å; G890-F892 PolarHBondContact O-N 3.32Å; G890-I893 WeakPolarHBondContact O-CB 3.29Å; G890-I893 PolarHBondContact O-N 3.3Å; G890-I893 VanDerWaalsContact O-N 3.08Å; G890-Q894 PolarHBondContact O-N 3.16Å
891	E	42.9	Very low	38	Very low	111 Å²	111	118.4 Å²	118.4	52%	0.519	62%	0.624	S	S	.	*	H	α-helix	trans	-69	-27.5	174.1	-72.8	-169.5	166.6	0	0	111.8	P887 D888 I893 Q894 Y895	P887-E891 HydrophobicContact CB-CB 4.06Å; P887-E891 WeakPolarHBondContact CB-OE2 3.29Å; D888-E891 PolarHBondContact O-N 2.99Å; E891-I893 PolarHBondContact O-N 3.19Å; E891-Q894 WeakPolarHBondContact O-CB 3.45Å; E891-Q894 PolarHBondContact O-N 2.81Å; E891-Q894 VanDerWaalsContact O-N 3.13Å; E891-Y895 PolarHBondContact O-N 3.39Å
892	F	41.7	Very low	37.9	Very low	83 Å²	83	112.1 Å²	112.1	36%	0.364	62%	0.615	S	S	.	*	H	α-helix	trans	-61.1	-26.6	169.8	-111.4	-82.2	0	0	0	113.1	W629 D888 P889 G890 F896	W629-F892 HydrophobicContact CE3-CE1 4.3Å; W629-F892 AromaticContact CH2-CD1 3.88Å; W629-F892 HydrophobicContact CH2-CD1 3.88Å; W629-F892 AromaticContact CH2-CE1 3.61Å; W629-F892 HydrophobicContact CH2-CE1 3.61Å; W629-F892 HydrophobicContact CZ2-CE1 4.07Å; W629-F892 HydrophobicContact CZ3-CD1 4.19Å; W629-F892 AromaticContact CZ3-CE1 3.75Å; W629-F892 HydrophobicContact CZ3-CE1 3.75Å; D888-F892 PolarHBondContact O-N 2.93Å; P889-F892 WeakPolarHBondContact O-CB 3.41Å; G890-F892 VanDerWaalsContact C-N 3.27Å; G890-F892 PolarHBondContact O-N 3.32Å; F892-F896 VanDerWaalsContact O-CD2 3.27Å; F892-F896 WeakPolarHBondContact O-CD2 3.02Å
893	I	47.4	Very low	37.9	Very low	93 Å²	93	112.5 Å²	112.5	48%	0.477	61%	0.611	S	S	.	*	H	α-helix	trans	-77.1	-43.5	172.3	-61.2	172.4	0	0	0	109.8	G890 E891 Y895 F896 E897	G890-I893 WeakPolarHBondContact O-CB 3.29Å; G890-I893 PolarHBondContact O-N 3.3Å; G890-I893 VanDerWaalsContact O-N 3.08Å; E891-I893 PolarHBondContact O-N 3.19Å; I893-Y895 PolarHBondContact O-N 3.28Å; I893-Y895 VanDerWaalsContact O-N 3.17Å; I893-F896 WeakPolarHBondContact O-CB 3.26Å; I893-F896 PolarHBondContact O-N 2.69Å; I893-E897 PolarHBondContact O-N 3.02Å
894	Q	38.8	Very low	38	Very low	99 Å²	99	114.3 Å²	114.3	46%	0.463	61%	0.612	S	S	.	*	H	α-helix	trans	-59.3	-26.9	175.4	-69.1	-170.6	-19	0	0	113.2	G890 E891 F896 E897 N898	G890-Q894 PolarHBondContact O-N 3.16Å; E891-Q894 WeakPolarHBondContact O-CB 3.45Å; E891-Q894 PolarHBondContact O-N 2.81Å; E891-Q894 VanDerWaalsContact O-N 3.13Å; Q894-F896 VanDerWaalsContact C-N 3.25Å; Q894-F896 PolarHBondContact O-N 3.33Å; Q894-E897 PolarHBondContact O-N 2.97Å; Q894-N898 VanDerWaalsContact O-CB 3.28Å; Q894-N898 WeakPolarHBondContact O-CB 3.23Å; Q894-N898 VanDerWaalsContact O-CG 3.32Å; Q894-N898 PolarHBondContact O-N 3.19Å; Q894-N898 PolarHBondContact O-ND2 2.92Å; Q894-N898 VanDerWaalsContact O-ND2 3.17Å
895	Y	39.4	Very low	37.4	Very low	164 Å²	164	112.2 Å²	112.2	64%	0.643	61%	0.608	S	S	*	*	H	α-helix	trans	-63.8	-30.3	172.9	-156.2	-89.1	0	0	0	112.7	E891 I893 S899	E891-Y895 PolarHBondContact O-N 3.39Å; I893-Y895 PolarHBondContact O-N 3.28Å; I893-Y895 VanDerWaalsContact O-N 3.17Å; Y895-S899 VanDerWaalsContact O-CB 3.28Å; Y895-S899 WeakPolarHBondContact O-CB 3.19Å; Y895-S899 PolarHBondContact O-N 2.89Å; Y895-S899 PolarHBondContact O-OG 2.88Å
896	F	43.5	Very low	37.2	Very low	85 Å²	85	113.3 Å²	113.3	37%	0.373	61%	0.608	S	S	.	*	H	α-helix	trans	-79.5	-31.4	172.8	-69	-78.6	0	0	0	112.8	V529 W629 F892 I893 Q894	V529-F896 HydrophobicContact CB-CZ 4.49Å; V529-F896 HydrophobicContact CG1-CD1 4.47Å; V529-F896 HydrophobicContact CG1-CD2 4Å; V529-F896 HydrophobicContact CG1-CE1 3.96Å; V529-F896 HydrophobicContact CG1-CE2 3.43Å; V529-F896 VanDerWaalsContact CG1-CE2 3.43Å; V529-F896 HydrophobicContact CG1-CG 4.5Å; V529-F896 HydrophobicContact CG1-CZ 3.41Å; V529-F896 VanDerWaalsContact CG1-CZ 3.41Å; V529-F896 HydrophobicContact CG2-CE1 4.24Å; V529-F896 HydrophobicContact CG2-CZ 4.23Å; W629-F896 AromaticContact CH2-CE2 3.84Å; W629-F896 HydrophobicContact CH2-CE2 3.84Å; W629-F896 AromaticContact CH2-CZ 3.58Å; W629-F896 HydrophobicContact CH2-CZ 3.58Å; W629-F896 HydrophobicContact CZ2-CE2 4.47Å; W629-F896 AromaticContact CZ2-CZ 3.98Å; W629-F896 HydrophobicContact CZ2-CZ 3.98Å; F892-F896 VanDerWaalsContact O-CD2 3.27Å; F892-F896 WeakPolarHBondContact O-CD2 3.02Å; I893-F896 WeakPolarHBondContact O-CB 3.26Å; I893-F896 PolarHBondContact O-N 2.69Å; Q894-F896 VanDerWaalsContact C-N 3.25Å; Q894-F896 PolarHBondContact O-N 3.33Å
897	E	41.4	Very low	36.8	Very low	136 Å²	136	110.8 Å²	110.8	64%	0.636	61%	0.606	S	S	*	*	H	α-helix	trans	-72.5	-39.2	176.3	-62.7	172.9	153.2	0	0	111.5	I893 Q894	I893-E897 PolarHBondContact O-N 3.02Å; Q894-E897 PolarHBondContact O-N 2.97Å
898	N	38.1	Very low	36.6	Very low	127 Å²	127	112.3 Å²	112.3	68%	0.679	62%	0.624	S	S	*	*	S	Bend	trans	-81.7	-8.1	179	-67.8	-36.3	0	0	0	114	Q894 N900	Q894-N898 VanDerWaalsContact O-CB 3.28Å; Q894-N898 WeakPolarHBondContact O-CB 3.23Å; Q894-N898 VanDerWaalsContact O-CG 3.32Å; Q894-N898 PolarHBondContact O-N 3.19Å; Q894-N898 PolarHBondContact O-ND2 2.92Å; Q894-N898 VanDerWaalsContact O-ND2 3.17Å; N898-N900 PolarHBondContact O-N 2.65Å
899	S	36.7	Very low	36.6	Very low	51 Å²	51	114.2 Å²	114.2	36%	0.357	63%	0.634	S	S	.	*	S	Bend	trans	-80.8	37.6	-179	-74.6	0	0	0	0	114.3	Y895 F901	Y895-S899 VanDerWaalsContact O-CB 3.28Å; Y895-S899 WeakPolarHBondContact O-CB 3.19Å; Y895-S899 PolarHBondContact O-N 2.89Å; Y895-S899 PolarHBondContact O-OG 2.88Å; S899-F901 VanDerWaalsContact C-N 3.34Å; S899-F901 WeakPolarHBondContact O-CD2 3.45Å; S899-F901 PolarHBondContact O-N 2.91Å
900	N	31.2	Very low	36.3	Very low	158 Å²	158	114.5 Å²	114.5	85%	0.845	64%	0.639	S	S	*	*			trans	41.3	49.3	164.8	-158	12.8	0	0	0	116	N898	N898-N900 PolarHBondContact O-N 2.65Å
901	F	37.4	Very low	36.1	Very low	150 Å²	150	122.7 Å²	122.7	66%	0.658	66%	0.664	S	S	*	*			trans	-86.9	134.8	163.4	-87	-92.5	0	0	0	109.1	S899	S899-F901 VanDerWaalsContact C-N 3.34Å; S899-F901 WeakPolarHBondContact O-CD2 3.45Å; S899-F901 PolarHBondContact O-N 2.91Å
902	G	31	Very low	35.6	Very low	65 Å²	65	121.9 Å²	121.9	67%	0.67	68%	0.677	S	S	*	*			trans	-62	144.2	-167.8	0	0	0	0	0	115	F904	G902-F904 PolarHBondContact O-N 3.45Å
903	D	28.8	Very low	35.2	Very low	146 Å²	146	124 Å²	124	78%	0.781	70%	0.697	S	S	*	*			trans	-37.2	117.8	176.7	172	28.3	0	0	0	114.6	G905	D903-G905 PolarHBondContact OD1-N 3.34Å
904	F	32.1	Very low	34.4	Very low	198 Å²	198	125.5 Å²	125.5	87%	0.868	71%	0.71	S	S	*	*			trans	-146.4	81.4	156.2	-86	-72.2	0	0	0	109.9	G902 L906	G902-F904 PolarHBondContact O-N 3.45Å; F904-L906 PolarHBondContact O-N 3.4Å
905	G	25.8	Very low	34.1	Very low	68 Å²	68	126.8 Å²	126.8	70%	0.701	72%	0.724	S	S	*	*			trans	-57.2	130.7	176.8	0	0	0	0	0	114.3	D903	D903-G905 PolarHBondContact OD1-N 3.34Å
906	L	33.7	Very low	33.7	Very low	169 Å²	169	125.6 Å²	125.6	89%	0.885	73%	0.729	S	S	*	*			trans	-130.5	131	164.4	-73.8	176.9	0	0	0	109.5	F904	F904-L906 PolarHBondContact O-N 3.4Å
907	S	31.6	Very low	33.4	Very low	113 Å²	113	126.6 Å²	126.6	79%	0.79	75%	0.746	S	S	*	*			trans	-60.5	134.3	-172.4	-170.8	0	0	0	0	113.1	D909	S907-D909 PolarHBondContact O-N 2.89Å
908	A	31.4	Very low	33	Very low	95 Å²	95	127.9 Å²	127.9	79%	0.785	75%	0.752	S	S	*	*			trans	-92.2	92.7	179.1	0	0	0	0	0	111.7	S910	A908-S910 PolarHBondContact O-N 2.93Å
909	D	36	Very low	32.8	Very low	149 Å²	149	131.5 Å²	131.5	80%	0.797	76%	0.762	S	S	*	*			trans	-75.2	91.6	175.7	-94.6	-47.6	0	0	0	113	S907	S907-D909 PolarHBondContact O-N 2.89Å
910	S	33.8	Very low	32.6	Very low	110 Å²	110	132.7 Å²	132.7	77%	0.769	78%	0.775	S	S	*	*			trans	33.7	98.7	138.9	-60.8	0	0	0	0	118.5	A908	A908-S910 PolarHBondContact O-N 2.93Å
911	K	35.8	Very low	32.7	Very low	206 Å²	206	133.9 Å²	133.9	90%	0.896	78%	0.776	S	S	*	*			trans	-94.4	103.9	152.6	-82.9	-170.2	174.7	-176.6	0	110.6	V913	K911-V913 PolarHBondContact O-N 3.15Å
912	A	32.1	Very low	32.6	Very low	95 Å²	95	130.7 Å²	130.7	79%	0.785	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-68.4	124.3	170.5	0	0	0	0	0	110.9
913	V	32.5	Very low	32.9	Very low	128 Å²	128	136.2 Å²	136.2	78%	0.776	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-90.5	119.4	167.9	179.6	0	0	0	0	107.9	K911 V915	K911-V913 PolarHBondContact O-N 3.15Å; V913-V915 HydrophobicContact CG1-CG2 4.19Å
914	V	30.4	Very low	33.2	Very low	123 Å²	123	135.6 Å²	135.6	75%	0.745	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-86.5	116.3	175.2	179.2	0	0	0	0	109
915	V	33.9	Very low	33.3	Very low	126 Å²	126	130.4 Å²	130.4	76%	0.764	78%	0.778	S	S	*	*			trans	-121.5	108.7	163.6	-176.7	0	0	0	0	107.3	V913	V913-V915 HydrophobicContact CG1-CG2 4.19Å
916	D	30.4	Very low	33.7	Very low	140 Å²	140	138.1 Å²	138.1	75%	0.749	79%	0.788	S	S	*	*			trans	-95	114.4	-174	-148.9	-26.3	0	0	0	109.7
917	S	37	Very low	33.7	Very low	105 Å²	105	135.3 Å²	135.3	73%	0.734	78%	0.778	S	S	*	*			trans	-164.5	88.1	170.5	-82.3	0	0	0	0	112.7
918	Q	32.7	Very low	33.9	Very low	163 Å²	163	139.3 Å²	139.3	76%	0.762	78%	0.781	S	S	*	*			trans	29.6	118.7	138.2	-52.5	176	18.5	0	0	118.7
919	F	34	Very low	34	Very low	203 Å²	203	138.9 Å²	138.9	89%	0.89	77%	0.772	S	S	*	*				-166.5	171.7	101.4	-117.1	-93.9	0	0	0	112
920	A	33.6	Very low	33.9	Very low	76 Å²	76	139.6 Å²	139.6	63%	0.628	78%	0.776	S	S	*	*			trans	-84.6	157.8	-153.9	0	0	0	0	0	118.2
921	E	32.6	Very low	33.9	Very low	183 Å²	183	138.4 Å²	138.4	86%	0.855	78%	0.781	S	S	*	*			trans	16.5	144.2	142.3	-52.2	-175.3	103	0	0	119.8
922	A	34.9	Very low	33.9	Very low	83 Å²	83	132.3 Å²	132.3	69%	0.686	78%	0.776	S	S	*	*				-171.2	145.8	51	0	0	0	0	0	117.5
923	K	36.9	Very low	34	Very low	182 Å²	182	136.1 Å²	136.1	79%	0.791	78%	0.778	S	S	*	*			trans	67.5	128.3	134.6	-73.7	175.6	179.5	172.1	0	124.5
924	T	36.3	Very low	34.2	Very low	132 Å²	132	136 Å²	136	81%	0.81	77%	0.773	S	S	*	*			trans	62.4	126.1	144.6	48.9	0	0	0	0	119.5
925	A	34.3	Very low	34.4	Very low	89 Å²	89	137 Å²	137	74%	0.736	77%	0.774	S	S	*	*			cis	102.7	129	22.9	0	0	0	0	0	114.8
926	Y	34.1	Very low	34.7	Very low	231 Å²	231	136.9 Å²	136.9	91%	0.906	78%	0.779	S	S	*	*			trans	-167.6	-178.7	138.2	-113.4	-76.4	0	0	0	110.9
927	T	34.2	Very low	34.7	Very low	110 Å²	110	135.7 Å²	135.7	68%	0.675	78%	0.781	S	S	*	*			trans	-142.2	158.6	-155.4	60	0	0	0	0	115.7
928	K	34.1	Very low	34.6	Very low	197 Å²	197	138.8 Å²	138.8	86%	0.857	79%	0.788	S	S	*	*			trans	69.4	159.3	155.7	-78.6	-177.3	177	-172.1	0	117.6
929	S	34	Very low	34.5	Very low	86 Å²	86	140.4 Å²	140.4	60%	0.601	79%	0.792	S	S	*	*			cis	-168.1	161.1	-10.1	43	0	0	0	0	112.8
930	D	34.1	Very low	34.5	Very low	163 Å²	163	137 Å²	137	87%	0.872	79%	0.788	S	S	*	*			trans	61.9	137.3	150.6	-55	-27.4	0	0	0	124
931	G	34.3	Very low	34.6	Very low	85 Å²	85	140.4 Å²	140.4	88%	0.876	80%	0.796	S	S	*	*			trans	134.7	124.9	139.3	0	0	0	0	0	119.6
932	G	35.2	Very low	34.5	Very low	78 Å²	78	139.9 Å²	139.9	80%	0.804	79%	0.793	S	S	*	*			trans	118.1	69.4	140.2	0	0	0	0	0	122.8
933	Q	35.3	Very low	34.5	Very low	175 Å²	175	141.9 Å²	141.9	82%	0.818	80%	0.801	S	S	*	*				28.5	122.9	127.6	-95.5	-172.3	-67.5	0	0	123.4
934	N	36.4	Very low	34.2	Very low	126 Å²	126	141 Å²	141	67%	0.674	80%	0.804	S	S	*	*				154.4	138.8	103.3	-84.5	-18.7	0	0	0	117.7
935	D	35	Very low	34	Very low	144 Å²	144	138.5 Å²	138.5	77%	0.77	81%	0.805	S	S	*	*			trans	12.9	134.3	151.1	-56	-29.6	0	0	0	123.8
936	S	38.6	Very low	34	Very low	123 Å²	123	139.7 Å²	139.7	86%	0.86	81%	0.808	S	S	*	*				-178.4	169.7	93	44.8	0	0	0	0	113.6
937	S	32	Very low	34.3	Very low	115 Å²	115	133.9 Å²	133.9	80%	0.804	80%	0.799	S	S	*	*			trans	-111.8	159.9	-166	-62.3	0	0	0	0	114.6
938	I	33.5	Very low	34.4	Very low	170 Å²	170	134.5 Å²	134.5	87%	0.872	80%	0.798	S	S	*	*			trans	-164.5	151	135.2	-101.6	150.9	0	0	0	110.8
939	K	30.9	Very low	34.3	Very low	197 Å²	197	135.6 Å²	135.6	86%	0.857	80%	0.797	S	S	*	*			trans	-130.8	144.9	176.4	-60.6	175.8	178.5	178.9	0	110.3
940	V	35.1	Very low	34.4	Very low	133 Å²	133	139.9 Å²	139.9	81%	0.806	81%	0.805	S	S	*	*			trans	-145.2	113	151.2	-167.8	0	0	0	0	112.7
941	N	34.3	Very low	34.4	Very low	147 Å²	147	138.2 Å²	138.2	79%	0.786	80%	0.795	S	S	*	*			trans	7.6	141.1	154.3	-50.3	-14.6	0	0	0	123.7
942	H	31.4	Very low	34.5	Very low	171 Å²	171	140.4 Å²	140.4	79%	0.792	80%	0.798	S	S	*	*			trans	-73.6	162.7	153.5	-108.9	-90.9	0	0	0	112.8
943	C	33.8	Very low	34.6	Very low	126 Å²	126	140.4 Å²	140.4	85%	0.851	79%	0.79	S	S	*	*			trans	-141.5	136.1	156.7	-74.2	0	0	0	0	109.6
944	D	30.6	Very low	34.5	Very low	162 Å²	162	139.7 Å²	139.7	87%	0.866	79%	0.792	S	S	*	*			trans	-101.8	156.2	178.6	-86.5	-58.7	0	0	0	112.9
945	G	33.4	Very low	34.5	Very low	80 Å²	80	138.3 Å²	138.3	83%	0.825	80%	0.797	S	S	*	*			trans	-174.5	93.9	174.4	0	0	0	0	0	115.2
946	S	33.6	Very low	34.5	Very low	114 Å²	114	137.9 Å²	137.9	80%	0.797	81%	0.806	S	S	*	*			trans	-101.3	156.4	168.2	-166	0	0	0	0	110.2
947	P	40.4	Very low	34.4	Very low	109 Å²	109	140.8 Å²	140.8	71%	0.708	80%	0.803	S	S	*	*				-157.6	152.9	100.4	39	-19.6	0	0	0	119.4
948	N	35.8	Very low	34.6	Very low	123 Å²	123	141.9 Å²	141.9	66%	0.658	80%	0.804	S	S	*	*			trans	57.5	114.4	139.9	-76.7	-52.2	0	0	0	124.8
949	R	33	Very low	34.7	Very low	220 Å²	220	139.4 Å²	139.4	83%	0.83	80%	0.797	S	S	*	*				52.5	121.6	120.4	-60.8	175	178.2	-173.5	-2.1	121.2
950	K	36.2	Very low	35.1	Very low	177 Å²	177	138.2 Å²	138.2	77%	0.77	80%	0.8	S	S	*	*				-172.8	142.2	93.4	-108.7	-171.6	164.6	-104.9	0	115.6
951	D	34.4	Very low	35.5	Very low	127 Å²	127	137.1 Å²	137.1	68%	0.679	80%	0.798	S	S	*	*			trans	22.2	115.7	144.3	-35.5	-23.2	0	0	0	121.2
952	S	36.4	Very low	36	Very low	132 Å²	132	135.7 Å²	135.7	92%	0.923	80%	0.799	S	S	*	*				-175.4	-179.8	112	-156.4	0	0	0	0	111.5
953	A	35.9	Very low	37.2	Very low	77 Å²	77	133.1 Å²	133.1	64%	0.636	79%	0.79	S	S	*	*			trans	-111.3	175.9	-163	0	0	0	0	0	116.6
954	D	33.3	Very low	38.8	Very low	161 Å²	161	130 Å²	130	86%	0.861	77%	0.769	S	S	*	*			trans	63.1	102.2	160.3	-59.2	-29.7	0	0	0	120.8
955	A	36.9	Very low	40.2	Very low	96 Å²	96	126.7 Å²	126.7	79%	0.793	76%	0.759	S	S	*	*				177.3	78.7	129.8	0	0	0	0	0	113.1	K957	A955-K957 PolarHBondContact O-N 3.18Å
956	S	34.6	Very low	41.6	Very low	135 Å²	135	128.6 Å²	128.6	94%	0.944	75%	0.751	S	S	*	*			trans	-75.8	78.7	176.1	-62.9	0	0	0	0	112.9
957	K	36.9	Very low	43.3	Very low	185 Å²	185	128 Å²	128	80%	0.804	74%	0.735	S	S	*	*			trans	-119.8	84.2	173.5	-165.7	178.5	-175.1	-178.2	0	110.5	A955 T959	A955-K957 PolarHBondContact O-N 3.18Å; K957-T959 PolarHBondContact O-N 2.64Å; K957-T959 VanDerWaalsContact O-N 3.09Å
958	V	35.7	Very low	44.5	Very low	137 Å²	137	128.4 Å²	128.4	83%	0.83	73%	0.729	S	S	*	*			trans	-71.5	102.8	-177.3	-178.4	0	0	0	0	110.6
959	T	36.8	Very low	46.2	Very low	118 Å²	118	128 Å²	128	72%	0.724	73%	0.727	S	S	*	*			trans	-89.6	114.2	162.9	48.5	0	0	0	0	109.1	K957 S961	K957-T959 PolarHBondContact O-N 2.64Å; K957-T959 VanDerWaalsContact O-N 3.09Å; T959-S961 PolarHBondContact O-N 3.15Å
960	L	38.5	Very low	48.1	Very low	173 Å²	173	122.8 Å²	122.8	91%	0.906	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-67.4	117.5	170.1	-84	160.6	0	0	0	109.9
961	S	43.9	Very low	49.7	Very low	110 Å²	110	118.7 Å²	118.7	77%	0.769	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-78.5	139.4	167.5	48.8	0	0	0	0	110.4	T959	T959-S961 PolarHBondContact O-N 3.15Å
962	S	44.4	Very low	51.4	Low	116 Å²	116	117.8 Å²	117.8	81%	0.811	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-64.8	132.6	-179.9	51.4	0	0	0	0	113
963	I	56	Low	53.1	Low	117 Å²	117	114.7 Å²	114.7	60%	0.6	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-59.4	143.6	164.9	-63.3	172.5	0	0	0	109.2	E967	I963-E967 HydrophobicContact CG2-CB 3.67Å; I963-E967 HydrophobicContact CG2-CG 4.5Å
964	S	68.7	Low	54.8	Low	60 Å²	60	117.6 Å²	117.6	42%	0.42	68%	0.676	S	S	.	*	P	Polyproline II helix	trans	-82.1	154.7	179.5	74.3	0	0	0	0	112.3	N966 E967 M968	S964-N966 PolarHBondContact O-N 3.41Å; S964-E967 WeakPolarHBondContact CA-OE2 3.28Å; S964-E967 VanDerWaalsContact CB-OE2 3.27Å; S964-E967 WeakPolarHBondContact CB-OE2 3.38Å; S964-E967 PolarHBondContact N-OE2 3.33Å; S964-E967 PolarHBondContact O-N 3.31Å; S964-E967 VanDerWaalsContact O-N 3.17Å; S964-E967 PolarHBondContact OG-OE2 2.9Å; S964-M968 PolarHBondContact O-N 2.74Å
965	S	59.4	Low	56.2	Low	93 Å²	93	116.3 Å²	116.3	65%	0.65	67%	0.669	S	S	*	*	H	α-helix	trans	-56.8	-36.9	-176.1	-55.1	0	0	0	0	113.5	E967 M968 D969	S965-E967 VanDerWaalsContact C-N 3.34Å; S965-E967 PolarHBondContact O-N 2.88Å; S965-M968 WeakPolarHBondContact O-CB 3.39Å; S965-M968 PolarHBondContact O-N 3.33Å; S965-M968 VanDerWaalsContact O-N 3.14Å; S965-D969 PolarHBondContact O-N 3.01Å
966	N	61.8	Low	57.5	Low	121 Å²	121	119.6 Å²	119.6	65%	0.647	67%	0.668	S	S	*	*	H	α-helix	trans	-64.8	-37.8	-178.5	-57.8	12.5	0	0	0	112.1	S964 M968 D969 D970	S964-N966 PolarHBondContact O-N 3.41Å; N966-M968 PolarHBondContact O-N 3.09Å; N966-D969 PolarHBondContact O-N 3.46Å; N966-D970 PolarHBondContact O-N 2.95Å
967	E	70.7	Confident	58.5	Low	100 Å²	100	122.4 Å²	122.4	47%	0.467	67%	0.672	S	S	.	*	H	α-helix	trans	-67.6	-26.7	177.8	-66.2	163	114	0	0	111.5	I963 S964 S965 I971	I963-E967 HydrophobicContact CG2-CB 3.67Å; I963-E967 HydrophobicContact CG2-CG 4.5Å; S964-E967 WeakPolarHBondContact CA-OE2 3.28Å; S964-E967 VanDerWaalsContact CB-OE2 3.27Å; S964-E967 WeakPolarHBondContact CB-OE2 3.38Å; S964-E967 PolarHBondContact N-OE2 3.33Å; S964-E967 PolarHBondContact O-N 3.31Å; S964-E967 VanDerWaalsContact O-N 3.17Å; S964-E967 PolarHBondContact OG-OE2 2.9Å; S965-E967 VanDerWaalsContact C-N 3.34Å; S965-E967 PolarHBondContact O-N 2.88Å; E967-I971 WeakPolarHBondContact O-CD1 3.19Å; E967-I971 VanDerWaalsContact O-CG1 3.23Å; E967-I971 WeakPolarHBondContact O-CG1 3.02Å; E967-I971 PolarHBondContact O-N 3.41Å
968	M	65.3	Low	59.6	Low	118 Å²	118	119.3 Å²	119.3	58%	0.581	67%	0.666	S	S	*	*	H	α-helix	trans	-75.5	-37.4	175.8	-169	166.4	-73.3	0	0	112.1	S964 S965 N966 I971 M972	S964-M968 PolarHBondContact O-N 2.74Å; S965-M968 WeakPolarHBondContact O-CB 3.39Å; S965-M968 PolarHBondContact O-N 3.33Å; S965-M968 VanDerWaalsContact O-N 3.14Å; N966-M968 PolarHBondContact O-N 3.09Å; M968-I971 PolarHBondContact O-N 2.8Å; M968-M972 WeakPolarHBondContact O-CB 3.45Å; M968-M972 WeakPolarHBondContact O-CG 3.37Å; M968-M972 PolarHBondContact O-N 3.22Å
969	D	71.7	Confident	60.8	Low	114 Å²	114	118.4 Å²	118.4	61%	0.61	66%	0.657	S	S	*	*	H	α-helix	trans	-66.7	-40.2	175.1	-72.5	-34.1	0	0	0	111.9	S965 N966 M972 S973	S965-D969 PolarHBondContact O-N 3.01Å; N966-D969 PolarHBondContact O-N 3.46Å; D969-M972 PolarHBondContact O-N 2.92Å; D969-S973 WeakPolarHBondContact O-CB 3.47Å; D969-S973 PolarHBondContact O-N 2.99Å
970	D	71.9	Confident	62.2	Low	111 Å²	111	118.4 Å²	118.4	59%	0.594	65%	0.653	S	S	*	*	H	α-helix	trans	-63	-41.4	174.5	-80.3	-26.1	0	0	0	112	N966 S973 L974	N966-D970 PolarHBondContact O-N 2.95Å; D970-S973 PolarHBondContact O-N 3.2Å; D970-L974 WeakPolarHBondContact O-CG 3.49Å; D970-L974 PolarHBondContact O-N 2.81Å
971	I	70.3	Confident	63.6	Low	91 Å²	91	115.2 Å²	115.2	47%	0.467	64%	0.638	S	S	.	*	H	α-helix	trans	-64.7	-41.9	175	-70	167	0	0	0	111.2	E967 M968 S973 L974 L975	E967-I971 WeakPolarHBondContact O-CD1 3.19Å; E967-I971 VanDerWaalsContact O-CG1 3.23Å; E967-I971 WeakPolarHBondContact O-CG1 3.02Å; E967-I971 PolarHBondContact O-N 3.41Å; M968-I971 PolarHBondContact O-N 2.8Å; I971-S973 VanDerWaalsContact C-N 3.33Å; I971-S973 PolarHBondContact O-N 3.01Å; I971-L974 PolarHBondContact O-N 2.98Å; I971-L975 HydrophobicContact CG2-CD1 4.11Å; I971-L975 WeakPolarHBondContact O-CG 3.4Å; I971-L975 PolarHBondContact O-N 3.32Å
972	M	70.6	Confident	64.8	Low	109 Å²	109	115.5 Å²	115.5	54%	0.537	63%	0.63	S	S	.	*	H	α-helix	trans	-65	-36.7	176.4	-71.7	-75.7	-76.9	0	0	112	M968 D969 L975 Q976	M968-M972 WeakPolarHBondContact O-CB 3.45Å; M968-M972 WeakPolarHBondContact O-CG 3.37Å; M968-M972 PolarHBondContact O-N 3.22Å; D969-M972 PolarHBondContact O-N 2.92Å; M972-L975 PolarHBondContact O-N 3.32Å; M972-Q976 PolarHBondContact O-N 2.55Å
973	S	72.8	Confident	66.2	Low	67 Å²	67	115.5 Å²	115.5	47%	0.469	62%	0.618	S	S	.	*	H	α-helix	trans	-67.1	-36.1	175.2	-166.1	0	0	0	0	112.6	D969 D970 I971 L975 Q976 N977	D969-S973 WeakPolarHBondContact O-CB 3.47Å; D969-S973 PolarHBondContact O-N 2.99Å; D970-S973 PolarHBondContact O-N 3.2Å; I971-S973 VanDerWaalsContact C-N 3.33Å; I971-S973 PolarHBondContact O-N 3.01Å; S973-L975 VanDerWaalsContact C-N 3.3Å; S973-L975 PolarHBondContact O-N 2.86Å; S973-Q976 PolarHBondContact O-N 2.85Å; S973-N977 PolarHBondContact O-ND2 3.41Å
974	L	69.7	Low	66.9	Low	137 Å²	137	115.4 Å²	115.4	72%	0.717	62%	0.619	S	S	*	*	H	α-helix	trans	-73.1	-17.3	175	-77.1	166.5	0	0	0	114.2	D970 I971	D970-L974 WeakPolarHBondContact O-CG 3.49Å; D970-L974 PolarHBondContact O-N 2.81Å; I971-L974 PolarHBondContact O-N 2.98Å
975	L	63.3	Low	66.7	Low	134 Å²	134	119.6 Å²	119.6	70%	0.702	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	0.1	175.6	-69.2	170.5	0	0	0	113.7	I971 M972 S973	I971-L975 HydrophobicContact CG2-CD1 4.11Å; I971-L975 WeakPolarHBondContact O-CG 3.4Å; I971-L975 PolarHBondContact O-N 3.32Å; M972-L975 PolarHBondContact O-N 3.32Å; S973-L975 VanDerWaalsContact C-N 3.3Å; S973-L975 PolarHBondContact O-N 2.86Å
976	Q	64.5	Low	67.4	Low	166 Å²	166	121.8 Å²	121.8	78%	0.776	63%	0.634	S	S	*	*			trans	-108	7.5	176.3	-74.4	-170.5	-19.9	0	0	114.2	M972 S973	M972-Q976 PolarHBondContact O-N 2.55Å; S973-Q976 PolarHBondContact O-N 2.85Å
977	N	55.8	Low	67.9	Low	194 Å²	194	121.9 Å²	121.9	100%	1.037	63%	0.632	S	S	*	*			trans	-119.7	0	175.5	-69.8	-86.5	0	0	0	111.3	S973	S973-N977 PolarHBondContact O-ND2 3.41Å

Retrieved 977 of 977 residues in 728.7 ms (Link to these results)

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