A0A077Z1W7_TRITR Loading...

PHD finger protein

AlphaFold DB , UniProt , Accession A0A077Z1W7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,289 aa.

						>A0A077Z1W7_TRITR|A0A077Z1W7
MLRVGELNGRLESSSIIPAFLDGQRVVDSRKLVASNFCCGSNASTEDACASDGTSESRVADYSALETPDSDGSDDKGYCSSPILDPVSFDHCYVSCQRMPWTSDKGKGHVAPRIKTLGSFEQAAEVATKLKQKNGDDRSAVGSDNLSPSCENEGEISESVQAGETQNPAVDDKSASELHLNDGDGHDYFTSPVYSQEDSLAKGVMPTNFEYVKPIGSGSTINLSGGFQQLREAQASNSLTSGSGPLDKKGSFVYSSALAYGCPKLQGAVSPVRENEKTISNGFTKGSAYLQTSSALGRTPSVVSPPSTAPVLEQARVVPRHGRSNFDVDDSNQSVYERIRIALEKAEAQKQLMAAKTNVPSPSFDKAADEEKSASDKPVSADKKQRKDKGPGKEKAPRKFKKKDSLRSAEEDYVTRCLCGFGHNDDFMIQCDRCEVWQHCECLAIKPTNVPEKYLCEICEPRCLPFTSEEASHLQSVKLNASKHGVKTLQEKKKRCQSSQVSLPDKEGHKRRVRTEGNDESHQQCSAELWKLVKELYDSDELDSMTQKLRPSPPCKVLYVAPNITGLVVACTLAPDVPILECFGHAALAKECRTRVKGGIPRPHVFLVNNFKVGDTSSVKLCLRFMGEDDQWMQHVRRSCHPNSKKGLRFFLVSTTKIEKGEEVCVPFDYDFRKSSVQITCACTSIHETARDHDCPVELFNKELMASKARKKQSSKILDKHRPGKRKRNRAMPAIDWNSRRTASAKVDSGDSSRSDNEPKPRRVRKKHFELIQLQQSSYFEKSGEASEGSVGHPSSADYSKSSSREERKMQFIIERIQRMEDTVQKTRRKRSKKVSLDKDSTDHSLMPTDSSDREGGKSSAYVDGGHFVKAEAPPESALLMDVCSEGRVRRKRQSGESIENDSKEQSCQEQTIVPNEGEEDDRNEKVTSASPAIFSTDKDSQDSSSNVASSRNAIGVISLLASAAYLNNCDREAAAALNAPSDNVVAEKSKKVRKMSIEEYKRLKRCTFEPGKSEQLADSAAGDCRLDRSELPTLQVRPSFFPSCTDESLKSVGSIPSLKLFSLEEHAANGNEDTPLFSKEKGPNAEPEPGDELNINVNRGALADRLDVMRPLFGVQCKEEEAQNPPHEAQRAPQQNNFTAYGPGSYYPTPFGNGIGGQFGCFPAYNPSYAAATPCMLPFGFYSRVPPPPPPPPPPATLPPASIVGTTVPPVQHMHPAVVPAVVPPGYIGNLDYLVMFSGTAAAATTAVALAAADQAAGQKQAPTIGSVHRPPRRFGSENDEGASTSSL
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.7	Very low	32.6	Very low	229 Å²	229	161 Å²	161	100%	1.128	85%	0.846	S	S	*	*				0	139.5	0	-75.2	148.7	61.4	0	0	107.7
2	L	34.8	Very low	32.1	Very low	152 Å²	152	159.3 Å²	159.3	80%	0.796	83%	0.83	S	S	*	*			cis	-150.8	126	-13.3	-92.6	168.8	0	0	0	103.8
3	R	29.5	Very low	31.8	Very low	231 Å²	231	156.3 Å²	156.3	87%	0.872	83%	0.831	S	S	*	*			cis	54.6	123.6	44.8	-109.5	-167.4	-166.2	179	6	109.7
4	V	33.6	Very low	31.4	Very low	137 Å²	137	152.3 Å²	152.3	83%	0.83	82%	0.821	S	S	*	*			cis	-155.1	162.4	30.5	174.7	0	0	0	0	106.4
5	G	32.3	Very low	31.1	Very low	68 Å²	68	149.3 Å²	149.3	70%	0.701	82%	0.817	S	S	*	*			cis	157.9	179.3	-2	0	0	0	0	0	110.1
6	E	36.2	Very low	31	Very low	175 Å²	175	149.7 Å²	149.7	82%	0.818	82%	0.816	S	S	*	*			trans	-80.5	155.2	-177.2	-56.9	172.9	136.9	0	0	113
7	L	35.1	Very low	30.6	Very low	181 Å²	181	149.2 Å²	149.2	95%	0.948	81%	0.81	S	S	*	*			trans	-129	132.7	157.8	-86	175.3	0	0	0	110.9
8	N	30.6	Very low	30.8	Very low	148 Å²	148	148.1 Å²	148.1	79%	0.791	81%	0.812	S	S	*	*			trans	-104.5	158	-175.4	-78.5	-78.8	0	0	0	111.6
9	G	33.5	Very low	30.8	Very low	74 Å²	74	143.7 Å²	143.7	76%	0.763	80%	0.797	S	S	*	*			trans	154	98	176.5	0	0	0	0	0	110.2
10	R	27.9	Very low	30.8	Very low	215 Å²	215	145.8 Å²	145.8	81%	0.811	80%	0.798	S	S	*	*			cis	82.9	68.1	27.9	-154.2	-167.3	-169	-144.5	0.5	115.3
11	L	31.9	Very low	30.6	Very low	161 Å²	161	145.5 Å²	145.5	84%	0.843	80%	0.795	S	S	*	*			trans	-156	119.1	146.2	-95.2	127.1	0	0	0	104.7
12	E	27.3	Very low	30.4	Very low	140 Å²	140	142 Å²	142	65%	0.654	78%	0.781	S	S	*	*				70.5	120	55.3	-67.6	-166.4	-176	0	0	114.4
13	S	27.8	Very low	30.2	Very low	121 Å²	121	137.4 Å²	137.4	85%	0.846	77%	0.77	S	S	*	*			trans	65.8	155	175	88.1	0	0	0	0	114.6
14	S	26.7	Very low	30.3	Very low	100 Å²	100	135 Å²	135	70%	0.699	77%	0.768	S	S	*	*			cis	-148.8	-179.3	-8.1	52.7	0	0	0	0	109.7
15	S	26.1	Very low	29.8	Very low	107 Å²	107	139.4 Å²	139.4	75%	0.748	77%	0.77	S	S	*	*			trans	-57.2	134.3	166.9	51.4	0	0	0	0	112.9
16	I	29.3	Very low	29.9	Very low	156 Å²	156	142.9 Å²	142.9	80%	0.8	78%	0.777	S	S	*	*			trans	-152.5	138.5	146.4	-103.7	145.7	0	0	0	110
17	I	24.9	Very low	29.5	Very low	141 Å²	141	140.3 Å²	140.3	72%	0.723	77%	0.773	S	S	*	*			trans	-99.7	129.6	178.8	-69	161.6	0	0	0	108.4	A19	I17-A19 HydrophobicContact CG2-CB 3.44Å; I17-A19 VanDerWaalsContact CG2-CB 3.44Å
18	P	35	Very low	29.5	Very low	129 Å²	129	137.7 Å²	137.7	84%	0.838	76%	0.76	S	S	*	*			trans	-99.1	80.8	159.6	34.1	-28	0	0	0	110
19	A	29.8	Very low	29.4	Very low	65 Å²	65	135.1 Å²	135.1	54%	0.537	75%	0.754	S	S	.	*			trans	-120.1	85.4	170.1	0	0	0	0	0	108.5	I17	I17-A19 HydrophobicContact CG2-CB 3.44Å; I17-A19 VanDerWaalsContact CG2-CB 3.44Å
20	F	30.3	Very low	29.3	Very low	185 Å²	185	141.4 Å²	141.4	81%	0.811	76%	0.755	S	S	*	*			trans	-136.8	125	169.7	-85.6	-83.8	0	0	0	105.3
21	L	27.9	Very low	29.4	Very low	140 Å²	140	139.9 Å²	139.9	73%	0.733	75%	0.754	S	S	*	*				59.4	126.8	50.3	-52.1	172.4	0	0	0	110.2
22	D	27.9	Very low	29	Very low	157 Å²	157	139.6 Å²	139.6	84%	0.84	75%	0.753	S	S	*	*			cis	-156.8	179.6	2	-153.8	-39	0	0	0	107.5
23	G	30.5	Very low	29.1	Very low	54 Å²	54	139.5 Å²	139.5	56%	0.557	76%	0.761	S	S	*	*			trans	133.8	92.9	158.2	0	0	0	0	0	118.4
24	Q	30.9	Very low	29	Very low	181 Å²	181	137.5 Å²	137.5	85%	0.846	75%	0.752	S	S	*	*				52.8	108.3	127.5	-60.3	169.4	19.8	0	0	118.6
25	R	24.6	Very low	29.3	Very low	230 Å²	230	138 Å²	138	87%	0.868	76%	0.755	S	S	*	*				63.5	84.6	78.6	-69.9	-172	176.1	-148.8	3.8	116.5
26	V	33	Very low	29.5	Very low	140 Å²	140	139.2 Å²	139.2	85%	0.848	75%	0.753	S	S	*	*			trans	-148.1	112.7	137.7	-179.3	0	0	0	0	104.1
27	V	28.4	Very low	29.6	Very low	121 Å²	121	141.4 Å²	141.4	73%	0.733	76%	0.757	S	S	*	*			cis	62.9	78.8	43	-165.1	0	0	0	0	113.4
28	D	35	Very low	29.8	Very low	126 Å²	126	139.9 Å²	139.9	67%	0.674	76%	0.758	S	S	*	*				-146.8	151.8	126.3	-147.1	-13.2	0	0	0	112.2	R30	D28-R30 IonicContact OD1-NH2 3.57Å; D28-R30 IonicContact OD2-CZ 2.95Å; D28-R30 IonicContact OD2-NH2 2.64Å; D28-R30 PolarHBondContact OD2-NH2 3.27Å
29	S	28.7	Very low	29.6	Very low	94 Å²	94	139.5 Å²	139.5	66%	0.657	76%	0.757	S	S	*	*			trans	-104	146.2	178	-48.7	0	0	0	0	109.5
30	R	32.2	Very low	29.6	Very low	206 Å²	206	139.6 Å²	139.6	78%	0.777	77%	0.765	S	S	*	*			trans	-174.7	132.6	146.4	-103.6	145.5	-112.2	-144.8	7.2	112.9	D28	D28-R30 IonicContact OD1-NH2 3.57Å; D28-R30 IonicContact OD2-CZ 2.95Å; D28-R30 IonicContact OD2-NH2 2.64Å; D28-R30 PolarHBondContact OD2-NH2 3.27Å
31	K	28.7	Very low	29.6	Very low	183 Å²	183	136.1 Å²	136.1	80%	0.796	76%	0.763	S	S	*	*				43.2	132.1	129.7	-71.9	-173.9	177.1	-175.5	0	118.9
32	L	24.1	Very low	29.7	Very low	156 Å²	156	137.3 Å²	137.3	82%	0.817	77%	0.77	S	S	*	*				43.7	118.9	90.4	-75.3	157.2	0	0	0	111.4
33	V	28.4	Very low	29.7	Very low	138 Å²	138	134 Å²	134	84%	0.836	77%	0.765	S	S	*	*				-153.4	159.3	59.9	160.3	0	0	0	0	111.5
34	A	27.1	Very low	29.7	Very low	79 Å²	79	136.3 Å²	136.3	65%	0.653	77%	0.772	S	S	*	*			trans	-89	155	175.9	0	0	0	0	0	114.4
35	S	32.4	Very low	29.7	Very low	109 Å²	109	132.6 Å²	132.6	76%	0.762	76%	0.762	S	S	*	*			trans	-139.5	107.1	153.3	55.6	0	0	0	0	107.3
36	N	29.6	Very low	30	Very low	133 Å²	133	130 Å²	130	71%	0.711	76%	0.76	S	S	*	*				58.6	115.5	82.9	-58.8	-25.1	0	0	0	110.1
37	F	31	Very low	30	Very low	202 Å²	202	130.5 Å²	130.5	89%	0.886	76%	0.758	S	S	*	*				-139.6	146.3	53.7	-101.7	-100.5	0	0	0	116.1
38	C	29.7	Very low	30.1	Very low	110 Å²	110	128.7 Å²	128.7	74%	0.743	76%	0.755	S	S	*	*			trans	-80.2	176.3	151.9	-59.5	0	0	0	0	109.1
39	C	31.1	Very low	29.8	Very low	121 Å²	121	128.4 Å²	128.4	82%	0.818	76%	0.762	S	S	*	*			cis	-143.5	-178.2	30.2	-57.8	0	0	0	0	109.2
40	G	29.6	Very low	29.9	Very low	67 Å²	67	128.5 Å²	128.5	69%	0.691	77%	0.769	S	S	*	*			cis	82.8	138.4	27.1	0	0	0	0	0	111.7
41	S	30.7	Very low	29.9	Very low	112 Å²	112	123 Å²	123	78%	0.783	76%	0.761	S	S	*	*			cis	-160.4	163.3	6.6	-60.5	0	0	0	0	113.7
42	N	29.1	Very low	30.1	Very low	164 Å²	164	121.8 Å²	121.8	88%	0.877	76%	0.764	S	S	*	*			trans	-10.5	137.6	157.8	-44.7	-10.2	0	0	0	121
43	A	28.8	Very low	30.4	Very low	88 Å²	88	117.1 Å²	117.1	73%	0.727	75%	0.754	S	S	*	*			trans	177	135.8	140.7	0	0	0	0	0	107.1
44	S	30.4	Very low	30.5	Very low	102 Å²	102	117 Å²	117	71%	0.713	75%	0.753	S	S	*	*			cis	72.4	135.4	36.1	95.7	0	0	0	0	112.6
45	T	31.8	Very low	30.7	Very low	104 Å²	104	117.9 Å²	117.9	64%	0.638	76%	0.755	S	S	*	*			cis	-172.4	143.5	0.2	3.5	0	0	0	0	109.4
46	E	31	Very low	30.5	Very low	176 Å²	176	119.8 Å²	119.8	82%	0.822	75%	0.752	S	S	*	*			trans	56.6	164	156.6	11.2	-167.7	147.5	0	0	118.5
47	D	31.9	Very low	30.6	Very low	149 Å²	149	117.5 Å²	117.5	80%	0.797	75%	0.746	S	S	*	*			cis	-156.2	-173.8	-29.5	-150.1	-28.6	0	0	0	108.3
48	A	30	Very low	30.5	Very low	83 Å²	83	117.8 Å²	117.8	69%	0.686	74%	0.741	S	S	*	*			trans	71.9	159.6	158.7	0	0	0	0	0	118.4
49	C	30.1	Very low	30.5	Very low	121 Å²	121	118.2 Å²	118.2	82%	0.818	74%	0.74	S	S	*	*			cis	-168.1	169.1	-39.1	-107	0	0	0	0	108.6
50	A	30.2	Very low	30.5	Very low	96 Å²	96	116.5 Å²	116.5	79%	0.793	74%	0.735	S	S	*	*			trans	66.4	156.6	163.7	0	0	0	0	0	117.2
51	S	33.4	Very low	30.5	Very low	89 Å²	89	119.6 Å²	119.6	62%	0.622	74%	0.735	S	S	*	*			cis	-161.8	170.5	-26.2	53.5	0	0	0	0	109.6
52	D	31.6	Very low	30.7	Very low	158 Å²	158	124 Å²	124	85%	0.845	74%	0.736	S	S	*	*			trans	66.5	150.4	161.6	-48.6	-54.8	0	0	0	118.1
53	G	29.9	Very low	30.9	Very low	59 Å²	59	121.3 Å²	121.3	61%	0.608	73%	0.73	S	S	*	*			cis	168.9	169.3	-6.6	0	0	0	0	0	112.2
54	T	31.4	Very low	31	Very low	135 Å²	135	121.2 Å²	121.2	83%	0.828	73%	0.73	S	S	*	*			trans	61.6	121.1	170.3	48.4	0	0	0	0	117.5
55	S	30.4	Very low	31.1	Very low	97 Å²	97	123.4 Å²	123.4	68%	0.678	73%	0.733	S	S	*	*				74.3	143.6	83.2	102.2	0	0	0	0	113.1
56	E	29.8	Very low	31.2	Very low	150 Å²	150	126 Å²	126	70%	0.701	74%	0.737	S	S	*	*			cis	-143.1	159.2	8.8	-119.3	146.3	106.9	0	0	110.1
57	S	30.6	Very low	31.4	Very low	85 Å²	85	123.2 Å²	123.2	59%	0.594	73%	0.733	S	S	*	*				44	140.7	103.8	111.3	0	0	0	0	116.7
58	R	29.8	Very low	31.9	Very low	207 Å²	207	120.8 Å²	120.8	78%	0.781	73%	0.725	S	S	*	*			cis	-174.2	169.9	36.2	-132.3	-175.3	-179.2	108	-9.2	111.8
59	V	29.2	Very low	32.2	Very low	120 Å²	120	123.8 Å²	123.8	73%	0.727	73%	0.73	S	S	*	*			trans	62.1	108.9	149.2	168.4	0	0	0	0	117.3
60	A	30.3	Very low	32.6	Very low	84 Å²	84	122.7 Å²	122.7	69%	0.694	72%	0.723	S	S	*	*				80.6	163	74.3	0	0	0	0	0	113.6
61	D	30.2	Very low	33.1	Very low	132 Å²	132	126 Å²	126	71%	0.706	73%	0.728	S	S	*	*			cis	-160.3	-168.7	13.5	-144.5	-34.7	0	0	0	111.8
62	Y	34.3	Very low	33.3	Very low	204 Å²	204	125 Å²	125	80%	0.8	73%	0.731	S	S	*	*			trans	89.7	91.8	164	-62.8	-80.3	0	0	0	121.7
63	S	33.5	Very low	33.8	Very low	108 Å²	108	123.5 Å²	123.5	76%	0.755	73%	0.733	S	S	*	*				27.3	147.4	97.1	-51	0	0	0	0	120.3
64	A	30.6	Very low	34.1	Very low	87 Å²	87	128.3 Å²	128.3	72%	0.719	75%	0.745	S	S	*	*			cis	-152.4	-156.7	-4	0	0	0	0	0	108.3
65	L	33.6	Very low	34.5	Very low	147 Å²	147	129 Å²	129	77%	0.77	74%	0.743	S	S	*	*			cis	-147.1	149.1	21.5	-93.4	98.1	0	0	0	109.4
66	E	33.9	Very low	34.7	Very low	158 Å²	158	133.6 Å²	133.6	74%	0.738	75%	0.751	S	S	*	*				61.2	140.6	86.5	-55.5	-151	172.8	0	0	118.5
67	T	35.6	Very low	35	Very low	118 Å²	118	129.7 Å²	129.7	72%	0.724	75%	0.751	S	S	*	*			cis	-149.8	-139.9	-20	34.8	0	0	0	0	110.6
68	P	42	Very low	35.2	Very low	99 Å²	99	137.2 Å²	137.2	64%	0.643	77%	0.768	S	S	*	*				-132.1	-157.4	-114.1	43.5	-22.3	0	0	0	117.5
69	D	36.6	Very low	35.3	Very low	146 Å²	146	133.3 Å²	133.3	78%	0.781	77%	0.771	S	S	*	*			trans	81.4	145.3	162.4	-58.3	-25	0	0	0	120.2
70	S	38.8	Very low	35.3	Very low	97 Å²	97	133.3 Å²	133.3	68%	0.678	78%	0.777	S	S	*	*			cis	-166.9	154.6	-21.6	53.7	0	0	0	0	111.5
71	D	39	Very low	35.4	Very low	167 Å²	167	134.6 Å²	134.6	89%	0.893	78%	0.781	S	S	*	*			trans	42.8	148.9	156.5	-59.6	-11.3	0	0	0	123.1
72	G	37.8	Very low	35.4	Very low	67 Å²	67	134.2 Å²	134.2	69%	0.691	79%	0.785	S	S	*	*			cis	146.4	126.3	-4.7	0	0	0	0	0	113.6
73	S	41.7	Very low	35	Very low	126 Å²	126	131.8 Å²	131.8	88%	0.881	78%	0.784	S	S	*	*			trans	172.3	146	152.6	37.5	0	0	0	0	114.5
74	D	37.6	Very low	34.8	Very low	160 Å²	160	134.2 Å²	134.2	86%	0.856	79%	0.788	S	S	*	*			trans	-97.6	158.8	-167.8	-42.8	-99.4	0	0	0	116.8
75	D	39.9	Very low	34.6	Very low	149 Å²	149	136.5 Å²	136.5	80%	0.797	79%	0.788	S	S	*	*			trans	-147.7	160.7	134	-148	-10.5	0	0	0	112.6
76	K	33.6	Very low	34.7	Very low	194 Å²	194	134.5 Å²	134.5	84%	0.843	78%	0.784	S	S	*	*			trans	-91.1	115.7	-148.6	-69.9	144	-173.9	154.3	0	116
77	G	35.7	Very low	34.5	Very low	68 Å²	68	132.6 Å²	132.6	70%	0.701	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-103	148.8	163.8	0	0	0	0	0	113
78	Y	35.9	Very low	34.2	Very low	244 Å²	244	130.5 Å²	130.5	96%	0.957	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-76.6	132.6	173.1	-96.6	-112.4	0	0	0	110.7
79	C	30.8	Very low	33.7	Very low	125 Å²	125	136.5 Å²	136.5	85%	0.845	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-67.9	133.1	-176.4	-54.1	0	0	0	0	113.1
80	S	29.3	Very low	33.4	Very low	120 Å²	120	134 Å²	134	84%	0.839	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-80.1	134	153.8	-60.5	0	0	0	0	109
81	S	32.9	Very low	32.9	Very low	111 Å²	111	138 Å²	138	78%	0.776	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-83	153.6	165	-62.4	0	0	0	0	110.2
82	P	30.2	Very low	32.3	Very low	123 Å²	123	136 Å²	136	80%	0.799	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-73.2	172.1	-167.2	29.9	-36.8	0	0	0	114.1	L84	P82-L84 PolarHBondContact O-N 3.4Å
83	I	27.3	Very low	31.9	Very low	153 Å²	153	141.2 Å²	141.2	79%	0.785	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-67.6	123.6	176.7	-61.1	163.5	0	0	0	109.2
84	L	29.3	Very low	31.3	Very low	159 Å²	159	141.3 Å²	141.3	83%	0.832	78%	0.776	S	S	*	*			trans	-127.6	134.3	154.4	-74.5	172.8	0	0	0	105.8	P82 P86	P82-L84 PolarHBondContact O-N 3.4Å; L84-P86 WeakPolarHBondContact O-CD 3.19Å
85	D	25.9	Very low	30.9	Very low	136 Å²	136	137.9 Å²	137.9	73%	0.727	77%	0.765	S	S	*	*			trans	-66.3	124.9	-170.9	-68.8	-66.3	0	0	0	112.2	V87	D85-V87 PolarHBondContact O-N 3.47Å
86	P	34.4	Very low	30.5	Very low	104 Å²	104	136.1 Å²	136.1	68%	0.675	76%	0.763	S	S	*	*			trans	-75	82.3	156.4	33.4	-29.4	0	0	0	107.2	L84 S88	L84-P86 WeakPolarHBondContact O-CD 3.19Å; P86-S88 PolarHBondContact O-N 3.31Å
87	V	29.5	Very low	30.3	Very low	119 Å²	119	135.1 Å²	135.1	72%	0.721	76%	0.761	S	S	*	*			trans	-47.1	130.6	155.3	-178.7	0	0	0	0	106.4	D85	D85-V87 PolarHBondContact O-N 3.47Å
88	S	30.9	Very low	29.9	Very low	73 Å²	73	143.6 Å²	143.6	51%	0.51	77%	0.772	S	S	.	*			trans	-62.5	144.8	-178.5	49.1	0	0	0	0	109.7	P86 D90	P86-S88 PolarHBondContact O-N 3.31Å; S88-D90 WeakPolarHBondContact CB-OD2 3.34Å; S88-D90 PolarHBondContact O-N 3.1Å; S88-D90 PolarHBondContact OG-OD2 3.25Å
89	F	31.1	Very low	29.6	Very low	226 Å²	226	139.8 Å²	139.8	99%	0.991	77%	0.765	S	S	*	*	S	Bend	trans	-77.2	55.3	172.5	-95.8	-90.4	0	0	0	110.4
90	D	29.6	Very low	29.5	Very low	92 Å²	92	139.2 Å²	139.2	49%	0.492	76%	0.76	S	S	.	*			trans	-93.9	142.1	164.6	-62.4	-60.2	0	0	0	108	S88	S88-D90 WeakPolarHBondContact CB-OD2 3.34Å; S88-D90 PolarHBondContact O-N 3.1Å; S88-D90 PolarHBondContact OG-OD2 3.25Å
91	H	27.7	Very low	29.5	Very low	182 Å²	182	144.9 Å²	144.9	84%	0.843	76%	0.763	S	S	*	*	S	Bend	trans	59.2	70.9	177	-58.8	-82.8	0	0	0	118
92	C	27.2	Very low	29.5	Very low	125 Å²	125	145.4 Å²	145.4	85%	0.845	76%	0.761	S	S	*	*			trans	-170.7	93.3	134.6	-102.5	0	0	0	0	112.4
93	Y	29.3	Very low	29.7	Very low	177 Å²	177	144.6 Å²	144.6	69%	0.694	76%	0.759	S	S	*	*			trans	-162.1	60.5	156	-131	-81.2	0	0	0	114	H641	Y93-H641 AromaticContact CD1-NE2 3.88Å; Y93-H641 AromaticContact CE1-CE1 3.38Å; Y93-H641 WeakPolarHBondContact CE1-CE1 3.25Å; Y93-H641 AromaticContact CE1-NE2 3.56Å; Y93-H641 AromaticContact CZ-CE1 3.54Å
94	V	30.5	Very low	30.1	Very low	128 Å²	128	142.8 Å²	142.8	78%	0.776	75%	0.751	S	S	*	*			trans	-133.1	143	169.1	-179.2	0	0	0	0	109.2
95	S	29	Very low	30.3	Very low	88 Å²	88	143.6 Å²	143.6	62%	0.615	75%	0.748	S	S	*	*			trans	51.2	100.7	173.2	59.2	0	0	0	0	118.1
96	C	30.6	Very low	30.7	Very low	112 Å²	112	141 Å²	141	76%	0.757	75%	0.753	S	S	*	*				-141.8	140.5	129.3	-102.3	0	0	0	0	110.3
97	Q	30.2	Very low	30.7	Very low	173 Å²	173	146.3 Å²	146.3	81%	0.808	77%	0.765	S	S	*	*			trans	-88.2	168.7	-174.9	-64.2	173.6	0	0	0	111.3	M99	Q97-M99 PolarHBondContact O-N 3.38Å
98	R	27.2	Very low	30.8	Very low	246 Å²	246	144.2 Å²	144.2	93%	0.928	77%	0.768	S	S	*	*			trans	-57.1	123.6	177.1	-67.6	172	171.1	171.5	-4.3	111.4
99	M	28.7	Very low	30.9	Very low	164 Å²	164	149.6 Å²	149.6	81%	0.808	78%	0.784	S	S	*	*			trans	-133.8	111.3	158.8	-84.7	-67.3	-177.3	0	0	109.1	Q97	Q97-M99 PolarHBondContact O-N 3.38Å
100	P	29.4	Very low	31.1	Very low	113 Å²	113	145.8 Å²	145.8	73%	0.734	78%	0.779	S	S	*	*			trans	-85.4	124.7	179	32.5	-31	0	0	0	110.7
101	W	29.9	Very low	31.2	Very low	239 Å²	239	145.3 Å²	145.3	91%	0.905	79%	0.788	S	S	*	*			trans	-119.1	119.4	169.6	-89.4	68.3	0	0	0	111
102	T	31.8	Very low	31.5	Very low	121 Å²	121	142.8 Å²	142.8	74%	0.742	79%	0.788	S	S	*	*			trans	-108	153.9	175.3	55.4	0	0	0	0	109.5
103	S	34.8	Very low	31.8	Very low	107 Å²	107	148.4 Å²	148.4	75%	0.748	79%	0.792	S	S	*	*			trans	20.7	143.9	149.4	-60.1	0	0	0	0	120.6
104	D	35.3	Very low	31.9	Very low	114 Å²	114	147.4 Å²	147.4	61%	0.61	80%	0.797	S	S	*	*			cis	-169.3	169.7	29.8	-141.2	-28	0	0	0	114.8
105	K	34.1	Very low	32.1	Very low	177 Å²	177	150.4 Å²	150.4	77%	0.77	80%	0.799	S	S	*	*			trans	39.1	110	154.3	-72.8	139.6	-163.7	157	0	121.1
106	G	34.4	Very low	32.4	Very low	81 Å²	81	151 Å²	151	84%	0.835	80%	0.799	S	S	*	*			trans	-136	139	147.1	0	0	0	0	0	110.4
107	K	34.2	Very low	32.4	Very low	216 Å²	216	154 Å²	154	94%	0.939	81%	0.807	S	S	*	*			trans	-103	138.9	-170.5	-65.9	175	-176.9	170.4	0	113.3
108	G	31.4	Very low	32.6	Very low	75 Å²	75	149.5 Å²	149.5	77%	0.773	81%	0.806	S	S	*	*			trans	-159	129.7	165.4	0	0	0	0	0	111.8
109	H	33.1	Very low	33.2	Very low	186 Å²	186	142.8 Å²	142.8	86%	0.861	80%	0.797	S	S	*	*			trans	-79.6	158.2	172.6	-76.7	-90.7	0	0	0	109.6
110	V	34	Very low	33.3	Very low	145 Å²	145	144.4 Å²	144.4	88%	0.879	80%	0.8	S	S	*	*				-147.5	150	54.9	173.9	0	0	0	0	112
111	A	32	Very low	33.8	Very low	83 Å²	83	147 Å²	147	69%	0.686	80%	0.803	S	S	*	*			trans	-144.3	152.1	175.8	0	0	0	0	0	113
112	P	35.2	Very low	34.1	Very low	129 Å²	129	143.2 Å²	143.2	84%	0.838	80%	0.795	S	S	*	*			trans	-99.9	94.3	166.8	34.6	-28.8	0	0	0	113.1
113	R	32.6	Very low	34.4	Very low	243 Å²	243	141.4 Å²	141.4	92%	0.917	79%	0.792	S	S	*	*			trans	51.2	100.1	145.6	-68.5	178.9	164.7	143.4	-1.4	119.9
114	I	31.3	Very low	34.3	Very low	156 Å²	156	141.1 Å²	141.1	80%	0.8	80%	0.796	S	S	*	*			trans	-77.6	150.3	149.7	-67.9	169.5	0	0	0	110.1
115	K	35.6	Very low	34.5	Very low	191 Å²	191	143.5 Å²	143.5	83%	0.83	80%	0.804	S	S	*	*			trans	-128.5	109.7	151.4	-82.5	-165.7	174.7	-170.8	0	107.7
116	T	34	Very low	34.7	Very low	100 Å²	100	140.5 Å²	140.5	61%	0.613	80%	0.8	S	S	*	*				65	123	79.8	65.6	0	0	0	0	112.6
117	L	31.4	Very low	34.8	Very low	176 Å²	176	141.2 Å²	141.2	92%	0.921	80%	0.798	S	S	*	*			cis	-142.4	171.6	0.2	-72.4	107.7	0	0	0	110.6
118	G	34	Very low	34.9	Very low	77 Å²	77	135.7 Å²	135.7	79%	0.794	78%	0.783	S	S	*	*			trans	169.8	106.2	166.4	0	0	0	0	0	111.2
119	S	39.7	Very low	35.5	Very low	106 Å²	106	141 Å²	141	74%	0.741	79%	0.785	S	S	*	*			trans	-73.6	137.5	-173	37.9	0	0	0	0	113.3	E121	S119-E121 VanDerWaalsContact C-N 3.34Å; S119-E121 PolarHBondContact O-N 2.95Å
120	F	32.1	Very low	35.7	Very low	197 Å²	197	140.4 Å²	140.4	86%	0.864	79%	0.787	S	S	*	*	S	Bend	trans	-88.1	68.7	176.3	-172.3	-96.1	0	0	0	110
121	E	38.8	Very low	35.8	Very low	169 Å²	169	143 Å²	143	79%	0.79	79%	0.786	S	S	*	*			trans	-144.9	10.7	-171.3	-145	160.6	-152.6	0	0	115	S119	S119-E121 VanDerWaalsContact C-N 3.34Å; S119-E121 PolarHBondContact O-N 2.95Å
122	Q	36.6	Very low	36.1	Very low	159 Å²	159	148.4 Å²	148.4	74%	0.743	80%	0.797	S	S	*	*	S	Bend	trans	-124	6	175.2	-68.2	-176.3	-14.8	0	0	113.6	A124	Q122-A124 VanDerWaalsContact C-N 3.28Å; Q122-A124 PolarHBondContact O-N 3.41Å
123	A	37.1	Very low	36.4	Very low	82 Å²	82	151.2 Å²	151.2	68%	0.678	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-4.3	-174.5	0	0	0	0	0	114.9
124	A	33.5	Very low	36.6	Very low	102 Å²	102	147.4 Å²	147.4	84%	0.843	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	-11.6	-174.9	0	0	0	0	0	115	Q122	Q122-A124 VanDerWaalsContact C-N 3.28Å; Q122-A124 PolarHBondContact O-N 3.41Å
125	E	40.2	Very low	36.8	Very low	163 Å²	163	142.6 Å²	142.6	76%	0.762	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.7	-20.2	-168.6	-156.5	170.8	173.1	0	0	114.3
126	V	37.8	Very low	37.2	Very low	114 Å²	114	140.9 Å²	140.9	69%	0.691	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	6.6	-176.5	-164.9	0	0	0	0	112.8	T128	V126-T128 PolarHBondContact O-N 3.32Å
127	A	37.1	Very low	37.5	Very low	97 Å²	97	142.1 Å²	142.1	80%	0.802	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-0.4	171.6	0	0	0	0	0	113.3
128	T	36.6	Very low	37.8	Very low	100 Å²	100	144.1 Å²	144.1	61%	0.613	78%	0.781	S	S	*	*	S	Bend	trans	-124.1	144.3	169.6	73.2	0	0	0	0	110.3	V126	V126-T128 PolarHBondContact O-N 3.32Å
129	K	42.6	Very low	38	Very low	187 Å²	187	145 Å²	145	81%	0.813	78%	0.775	S	S	*	*	S	Bend	trans	71.6	145.8	-176.1	-51.9	168	-174.9	169.6	0	114.3
130	L	36.9	Very low	37.9	Very low	173 Å²	173	144.4 Å²	144.4	91%	0.906	78%	0.777	S	S	*	*			trans	60.6	108.7	-171	-56.4	169.7	0	0	0	112.9
131	K	36.8	Very low	38.2	Very low	198 Å²	198	141.8 Å²	141.8	86%	0.861	78%	0.777	S	S	*	*			cis	-148.6	81.7	39.1	-159	168.9	-173.3	174.5	0	113.5	K133	K131-K133 PolarHBondContact O-N 3.46Å
132	Q	39	Very low	38.1	Very low	198 Å²	198	136.6 Å²	136.6	93%	0.925	77%	0.768	S	S	*	*			trans	-69.4	109.8	151.8	-80.4	179.2	-30.8	0	0	108.9
133	K	40.2	Very low	38.3	Very low	187 Å²	187	133.9 Å²	133.9	81%	0.813	77%	0.767	S	S	*	*			trans	-176.3	107.2	133.1	-110.6	-173	175	-174.1	0	111.2	K131	K131-K133 PolarHBondContact O-N 3.46Å
134	N	37.2	Very low	38.5	Very low	163 Å²	163	136.5 Å²	136.5	87%	0.872	77%	0.77	S	S	*	*				-166.8	118.9	123.3	-84	-9.2	0	0	0	102.8
135	G	36.7	Very low	38.6	Very low	55 Å²	55	137.4 Å²	137.4	57%	0.567	76%	0.76	S	S	*	*			cis	97.4	71.2	38.9	0	0	0	0	0	106.2
136	D	42.3	Very low	38.5	Very low	155 Å²	155	137.3 Å²	137.3	83%	0.829	76%	0.764	S	S	*	*				84.2	101.2	74.3	-69.4	-35.3	0	0	0	111.8
137	D	40.9	Very low	38.1	Very low	127 Å²	127	137.1 Å²	137.1	68%	0.679	77%	0.768	S	S	*	*			trans	-160.7	116.9	143.5	-100.1	-37.8	0	0	0	105.8
138	R	37.8	Very low	38.2	Very low	218 Å²	218	137.8 Å²	137.8	82%	0.823	76%	0.764	S	S	*	*				78.6	140.8	83.7	-79.1	-161	176.7	120.4	-17.6	113.8
139	S	37.7	Very low	38	Very low	95 Å²	95	137.4 Å²	137.4	66%	0.664	77%	0.765	S	S	*	*			cis	-166	141.5	-2.9	-105.4	0	0	0	0	112.2
140	A	38.3	Very low	37.3	Very low	94 Å²	94	133.3 Å²	133.3	78%	0.777	76%	0.759	S	S	*	*			trans	60.6	173.2	151.9	0	0	0	0	0	117.3
141	V	38.7	Very low	37.2	Very low	142 Å²	142	132.3 Å²	132.3	86%	0.861	75%	0.75	S	S	*	*			cis	-138.3	144.3	5.9	-177.3	0	0	0	0	110.4
142	G	36.3	Very low	37	Very low	59 Å²	59	129.2 Å²	129.2	61%	0.608	74%	0.742	S	S	*	*			trans	83.1	140.7	151.8	0	0	0	0	0	117.7
143	S	41.3	Very low	36.7	Very low	103 Å²	103	128.3 Å²	128.3	72%	0.72	74%	0.738	S	S	*	*			cis	74.8	125.9	34.7	82.5	0	0	0	0	113.6
144	D	40	Very low	36.5	Very low	137 Å²	137	123.2 Å²	123.2	73%	0.733	74%	0.739	S	S	*	*			cis	-165.5	164.9	6	-118.6	0.5	0	0	0	113.2
145	N	37.3	Very low	36.4	Very low	120 Å²	120	124.7 Å²	124.7	64%	0.642	74%	0.74	S	S	*	*			trans	64.2	116.9	147.2	-68.6	-37	0	0	0	124
146	L	36.7	Very low	36.4	Very low	162 Å²	162	129.7 Å²	129.7	85%	0.848	75%	0.753	S	S	*	*				81.2	137.8	125.5	-61.7	172	0	0	0	122.7
147	S	30.1	Very low	36.1	Very low	109 Å²	109	126.8 Å²	126.8	76%	0.762	74%	0.744	S	S	*	*			trans	-82	-173.5	165.1	-30.6	0	0	0	0	111
148	P	39.7	Very low	35.9	Very low	112 Å²	112	128.6 Å²	128.6	73%	0.727	75%	0.749	S	S	*	*			cis	-140.5	-169.6	3.2	36.4	-12.8	0	0	0	116.2
149	S	32.3	Very low	35.7	Very low	91 Å²	91	122.9 Å²	122.9	64%	0.636	74%	0.742	S	S	*	*			trans	66.5	115.7	140.2	64.8	0	0	0	0	122.9
150	C	27.5	Very low	35.7	Very low	101 Å²	101	123.3 Å²	123.3	68%	0.682	74%	0.74	S	S	*	*				74.3	158.9	129.5	71.2	0	0	0	0	123.6
151	E	34.9	Very low	35.6	Very low	153 Å²	153	127.3 Å²	127.3	72%	0.715	74%	0.743	S	S	*	*			trans	83.1	103	160.2	-71.5	160.1	-117.8	0	0	121.2
152	N	32.7	Very low	35.4	Very low	132 Å²	132	125.3 Å²	125.3	71%	0.706	74%	0.741	S	S	*	*				79.7	129.7	117.4	-64.7	0.3	0	0	0	122.9
153	E	33	Very low	35.5	Very low	180 Å²	180	125.6 Å²	125.6	84%	0.841	74%	0.744	S	S	*	*			trans	50	128.6	134	-50.7	-50.5	93.9	0	0	121.6
154	G	36.2	Very low	35.3	Very low	80 Å²	80	129.6 Å²	129.6	83%	0.825	75%	0.752	S	S	*	*			trans	167.8	90.5	166.1	0	0	0	0	0	114.6
155	E	33.8	Very low	35.1	Very low	193 Å²	193	127.8 Å²	127.8	90%	0.902	75%	0.745	S	S	*	*			trans	-69.1	159.9	163.9	-60	179.7	108.9	0	0	111.4
156	I	36.3	Very low	35	Very low	161 Å²	161	130.1 Å²	130.1	83%	0.826	75%	0.752	S	S	*	*			trans	-179.5	127.6	141.3	-96.2	152.8	0	0	0	109.9
157	S	35.7	Very low	34.9	Very low	93 Å²	93	129.7 Å²	129.7	65%	0.65	75%	0.751	S	S	*	*			trans	29.3	152.8	139.1	-51.9	0	0	0	0	122.2
158	E	36.9	Very low	35.5	Very low	165 Å²	165	129.8 Å²	129.8	77%	0.771	75%	0.749	S	S	*	*			cis	-161.1	146.4	6.3	-119.2	157.7	149.2	0	0	107.7
159	S	35.4	Very low	35.3	Very low	98 Å²	98	128.8 Å²	128.8	69%	0.685	75%	0.75	S	S	*	*				57	152.5	103.6	95.4	0	0	0	0	117.1
160	V	36.1	Very low	35.5	Very low	104 Å²	104	130.4 Å²	130.4	63%	0.63	76%	0.756	S	S	*	*			cis	-164.8	146.3	24.6	85	0	0	0	0	112.5
161	Q	36.1	Very low	35.9	Very low	179 Å²	179	132.4 Å²	132.4	84%	0.836	76%	0.76	S	S	*	*			trans	52	164.3	150.1	-73.3	162.3	6.5	0	0	121.7
162	A	36.2	Very low	36	Very low	99 Å²	99	130.6 Å²	130.6	82%	0.818	76%	0.755	S	S	*	*			cis	-166.7	168.4	-20.9	0	0	0	0	0	107.8
163	G	36.9	Very low	36.2	Very low	65 Å²	65	132.1 Å²	132.1	67%	0.67	76%	0.756	S	S	*	*			cis	171.2	-173	-2.9	0	0	0	0	0	111.8
164	E	37.2	Very low	36.4	Very low	188 Å²	188	128.9 Å²	128.9	88%	0.879	75%	0.753	S	S	*	*			trans	70.6	143.9	158.1	-58.8	-166.2	118.8	0	0	119.3
165	T	35.4	Very low	36.3	Very low	98 Å²	98	129.4 Å²	129.4	60%	0.601	75%	0.75	S	S	*	*			cis	-159.4	150.5	-0.2	6.6	0	0	0	0	113.9
166	Q	36.6	Very low	36.4	Very low	169 Å²	169	125.7 Å²	125.7	79%	0.79	75%	0.745	S	S	*	*			trans	65.1	136	152.3	-62.9	158.1	29.5	0	0	120.2
167	N	34.4	Very low	36.1	Very low	153 Å²	153	126 Å²	126	82%	0.818	74%	0.743	S	S	*	*			cis	96	154.2	25.4	-82.2	-14.2	0	0	0	116
168	P	41.9	Very low	36	Very low	111 Å²	111	129.9 Å²	129.9	72%	0.721	76%	0.756	S	S	*	*			cis	-145.3	179.4	-27	39.9	-21.3	0	0	0	117.3
169	A	35	Very low	35.7	Very low	91 Å²	91	129.7 Å²	129.7	75%	0.752	75%	0.754	S	S	*	*			trans	68.7	161.9	154.2	0	0	0	0	0	119.2
170	V	36.6	Very low	35.5	Very low	126 Å²	126	132 Å²	132	76%	0.764	76%	0.758	S	S	*	*			cis	-144.7	164.6	17.2	-149.4	0	0	0	0	112.5
171	D	36.4	Very low	35.2	Very low	142 Å²	142	133.4 Å²	133.4	76%	0.759	76%	0.762	S	S	*	*			trans	-37.7	172.8	175.7	-33.3	-39.5	0	0	0	119
172	D	36.7	Very low	35.1	Very low	115 Å²	115	132.8 Å²	132.8	62%	0.615	76%	0.764	S	S	*	*			cis	-165.9	166.2	17.1	-151.4	-17.2	0	0	0	114.2
173	K	37.8	Very low	34.9	Very low	164 Å²	164	131.2 Å²	131.2	71%	0.713	76%	0.758	S	S	*	*			trans	55.1	127.2	152.5	-83.9	146.8	-162.2	148.6	0	125.8
174	S	36.5	Very low	34.9	Very low	113 Å²	113	136.6 Å²	136.6	79%	0.79	77%	0.772	S	S	*	*				107.1	127	124.1	72.9	0	0	0	0	122.7
175	A	35	Very low	34.9	Very low	91 Å²	91	130.7 Å²	130.7	75%	0.752	76%	0.761	S	S	*	*			trans	40.2	141.6	139.1	0	0	0	0	0	122.1
176	S	34.7	Very low	34.9	Very low	115 Å²	115	134.3 Å²	134.3	80%	0.804	77%	0.771	S	S	*	*			cis	-162.4	174.7	-5.8	-105.3	0	0	0	0	111.1
177	E	30.6	Very low	34.8	Very low	166 Å²	166	132.1 Å²	132.1	78%	0.776	76%	0.764	S	S	*	*			trans	-52.8	153.1	-177	-55.9	155.2	99.2	0	0	116.2
178	L	32.7	Very low	34.7	Very low	176 Å²	176	134.4 Å²	134.4	92%	0.921	76%	0.763	S	S	*	*				-157.6	130.5	113.4	-101.7	176.1	0	0	0	110.8
179	H	30.9	Very low	34.1	Very low	161 Å²	161	137.8 Å²	137.8	75%	0.745	77%	0.766	S	S	*	*			trans	-84.1	160.6	178.1	-82.9	-149.1	0	0	0	112.7
180	L	32.8	Very low	33.9	Very low	145 Å²	145	139.5 Å²	139.5	76%	0.759	77%	0.768	S	S	*	*				177.5	123.7	117.4	-94.2	163.3	0	0	0	113.2
181	N	29.5	Very low	33.4	Very low	135 Å²	135	138.6 Å²	138.6	72%	0.722	77%	0.767	S	S	*	*			trans	62	156.4	160.1	-42.5	-27.9	0	0	0	116.9
182	D	32.4	Very low	33.4	Very low	165 Å²	165	137.3 Å²	137.3	88%	0.882	77%	0.766	S	S	*	*			cis	-133.7	162.8	17	-72.8	-62.1	0	0	0	112.5
183	G	33.5	Very low	32.9	Very low	66 Å²	66	137.4 Å²	137.4	68%	0.68	77%	0.771	S	S	*	*			trans	175.8	153.8	171.7	0	0	0	0	0	114.4
184	D	36	Very low	32.5	Very low	179 Å²	179	139.8 Å²	139.8	96%	0.957	78%	0.777	S	S	*	*			trans	89	147.5	180	-63.1	-20.1	0	0	0	118.1
185	G	37.3	Very low	32.2	Very low	63 Å²	63	138 Å²	138	65%	0.649	76%	0.764	S	S	*	*			cis	162.1	125.8	-7.2	0	0	0	0	0	114.2
186	H	35	Very low	31.9	Very low	175 Å²	175	140.8 Å²	140.8	81%	0.81	76%	0.762	S	S	*	*			trans	44.6	121.3	157	-72.4	-76.4	0	0	0	123.7
187	D	34.1	Very low	31.8	Very low	123 Å²	123	142.5 Å²	142.5	66%	0.658	76%	0.757	S	S	*	*				55.9	139.9	121.1	-64.7	-43.3	0	0	0	125.7
188	Y	32.5	Very low	31.9	Very low	201 Å²	201	140.4 Å²	140.4	79%	0.788	75%	0.751	S	S	*	*			trans	26	122.1	140.6	-76.7	-91.8	0	0	0	122.7
189	F	29.4	Very low	31.9	Very low	181 Å²	181	136.1 Å²	136.1	79%	0.794	74%	0.736	S	S	*	*				56.2	137.8	125.8	-104.3	-97.9	0	0	0	122
190	T	30.8	Very low	32	Very low	127 Å²	127	134.5 Å²	134.5	78%	0.779	73%	0.732	S	S	*	*			trans	70.3	112.3	158.1	22.2	0	0	0	0	119.7
191	S	26.2	Very low	32.2	Very low	108 Å²	108	131.5 Å²	131.5	76%	0.755	73%	0.729	S	S	*	*			trans	-46	163.7	146.5	-43.3	0	0	0	0	112.2
192	P	36	Very low	32.5	Very low	114 Å²	114	134 Å²	134	74%	0.74	73%	0.733	S	S	*	*			cis	-157.6	-171.4	40.5	46.7	-25.3	0	0	0	119.6
193	V	27.5	Very low	32.5	Very low	117 Å²	117	129.4 Å²	129.4	71%	0.709	72%	0.724	S	S	*	*			trans	74.4	117.1	148.7	160.3	0	0	0	0	119.1
194	Y	28.3	Very low	32.5	Very low	215 Å²	215	133.1 Å²	133.1	84%	0.843	73%	0.733	S	S	*	*			trans	44.9	155.9	141.3	-71.6	-98.3	0	0	0	120.7
195	S	30.4	Very low	32.3	Very low	75 Å²	75	132.3 Å²	132.3	52%	0.524	73%	0.726	S	S	.	*			cis	-148	150.6	16.8	-124.3	0	0	0	0	108.9
196	Q	30.2	Very low	32.3	Very low	149 Å²	149	135.1 Å²	135.1	70%	0.696	73%	0.733	S	S	*	*				70.9	154.4	94.4	-153.8	-173	-23.9	0	0	112.7
197	E	31	Very low	32.1	Very low	151 Å²	151	131.6 Å²	131.6	71%	0.706	72%	0.724	S	S	*	*			cis	-112.1	-169.2	-1.4	-40.4	-121.4	49.3	0	0	108.5
198	D	33	Very low	32	Very low	122 Å²	122	132.7 Å²	132.7	65%	0.652	73%	0.729	S	S	*	*			cis	-153.1	-163.3	-9.6	-152.8	17	0	0	0	105.5
199	S	32.9	Very low	32	Very low	87 Å²	87	133.6 Å²	133.6	61%	0.608	74%	0.738	S	S	*	*			cis	-151.4	132.9	-1.9	60.1	0	0	0	0	112.2
200	L	34	Very low	32.1	Very low	126 Å²	126	132.9 Å²	132.9	66%	0.66	74%	0.737	S	S	*	*			trans	46.5	149.6	134.9	-70.9	139.7	0	0	0	120.4	K202	L200-K202 HydrophobicContact CD2-CD 4.28Å; L200-K202 VanDerWaalsContact CD2-CE 3.46Å
201	A	35.3	Very low	31.9	Very low	83 Å²	83	136.3 Å²	136.3	69%	0.686	74%	0.737	S	S	*	*			cis	-172.4	176.4	10.9	0	0	0	0	0	108.4
202	K	36.4	Very low	32.3	Very low	187 Å²	187	137.6 Å²	137.6	81%	0.813	74%	0.74	S	S	*	*			cis	-170.1	146.2	-23.1	-96.5	163.9	177.7	165.1	0	106.2	L200	L200-K202 HydrophobicContact CD2-CD 4.28Å; L200-K202 VanDerWaalsContact CD2-CE 3.46Å
203	G	32.8	Very low	32	Very low	68 Å²	68	139.6 Å²	139.6	70%	0.701	74%	0.737	S	S	*	*			trans	164.2	54.1	178.2	0	0	0	0	0	116.7
204	V	33.5	Very low	32.4	Very low	144 Å²	144	140.6 Å²	140.6	87%	0.873	75%	0.746	S	S	*	*				91.5	139.3	99.1	170.3	0	0	0	0	113.6
205	M	31.5	Very low	32.6	Very low	163 Å²	163	137.7 Å²	137.7	80%	0.803	74%	0.743	S	S	*	*			trans	-110.4	-177.9	-170.1	-64.5	-153.1	176.1	0	0	113.6
206	P	36.7	Very low	32.7	Very low	122 Å²	122	137.8 Å²	137.8	79%	0.792	76%	0.757	S	S	*	*				-139.2	123.6	91.9	34.9	-20.1	0	0	0	116.5
207	T	30.8	Very low	32.9	Very low	100 Å²	100	136.7 Å²	136.7	61%	0.613	77%	0.766	S	S	*	*			trans	26	146.4	134.3	57.6	0	0	0	0	123.3
208	N	32.3	Very low	32.9	Very low	146 Å²	146	133 Å²	133	78%	0.781	77%	0.768	S	S	*	*			trans	88.9	99.5	160.3	-54.7	-20.4	0	0	0	117.6
209	F	32.7	Very low	33	Very low	221 Å²	221	133.3 Å²	133.3	97%	0.969	78%	0.78	S	S	*	*				-160.6	163	112.8	-115.5	-77.8	0	0	0	110.9
210	E	32.7	Very low	32.9	Very low	166 Å²	166	135.1 Å²	135.1	78%	0.776	79%	0.787	S	S	*	*			trans	-120.8	141.3	-166.7	-169.5	-178	-170.2	0	0	111.9
211	Y	26.8	Very low	32.7	Very low	199 Å²	199	135.7 Å²	135.7	78%	0.78	79%	0.79	S	S	*	*			trans	60.9	130.8	165.4	-124.4	-97.3	0	0	0	119.5
212	V	32.8	Very low	32.6	Very low	135 Å²	135	137.6 Å²	137.6	82%	0.818	79%	0.788	S	S	*	*			trans	-179.6	150.1	131.8	141.9	0	0	0	0	110.6
213	K	30.7	Very low	32.2	Very low	155 Å²	155	135.9 Å²	135.9	67%	0.674	79%	0.787	S	S	*	*			trans	-77.3	149.6	176.7	-62	171.8	-179.3	173.4	0	111.5	I215	K213-I215 PolarHBondContact O-N 3.32Å; K213-I215 VanDerWaalsContact O-N 3.1Å
214	P	36.3	Very low	32.2	Very low	138 Å²	138	137.8 Å²	137.8	90%	0.896	79%	0.79	S	S	*	*			trans	-69.6	106.7	166.7	29.4	-32.9	0	0	0	110.5
215	I	32.5	Very low	32.1	Very low	154 Å²	154	135 Å²	135	79%	0.79	79%	0.791	S	S	*	*			trans	-116.3	121.9	162.2	-67.1	175.5	0	0	0	107.6	K213	K213-I215 PolarHBondContact O-N 3.32Å; K213-I215 VanDerWaalsContact O-N 3.1Å
216	G	31.5	Very low	32.2	Very low	78 Å²	78	130.9 Å²	130.9	80%	0.804	79%	0.79	S	S	*	*			trans	59.7	102	149.5	0	0	0	0	0	119.4
217	S	34.8	Very low	31.7	Very low	126 Å²	126	135.2 Å²	135.2	88%	0.881	80%	0.796	S	S	*	*			trans	-141.2	121.1	147.5	59.1	0	0	0	0	108.4
218	G	32	Very low	32	Very low	74 Å²	74	137.8 Å²	137.8	76%	0.763	80%	0.801	S	S	*	*			cis	113	78.5	1.1	0	0	0	0	0	111.5
219	S	33.4	Very low	32.1	Very low	128 Å²	128	137.8 Å²	137.8	90%	0.895	80%	0.797	S	S	*	*			trans	-103.8	111.6	175.5	-56.1	0	0	0	0	110.1
220	T	31.7	Very low	32.1	Very low	125 Å²	125	134.3 Å²	134.3	77%	0.767	79%	0.788	S	S	*	*			trans	-70.3	171.5	163.9	49.3	0	0	0	0	110.2
221	I	30.7	Very low	31.8	Very low	138 Å²	138	135.6 Å²	135.6	71%	0.708	79%	0.785	S	S	*	*			cis	-152.8	166.3	20.8	-3.4	178.3	0	0	0	105.8
222	N	32.2	Very low	32	Very low	122 Å²	122	133 Å²	133	65%	0.652	78%	0.78	S	S	*	*			cis	-169	156.1	42.4	-115.7	-33	0	0	0	111.3
223	L	29.2	Very low	32.1	Very low	151 Å²	151	130.8 Å²	130.8	79%	0.791	78%	0.776	S	S	*	*			trans	25.7	144	136.5	-58.3	174.3	0	0	0	121.4
224	S	31.5	Very low	32.1	Very low	109 Å²	109	132.4 Å²	132.4	76%	0.762	79%	0.786	S	S	*	*			cis	-173.8	151.1	1.4	47.1	0	0	0	0	113.7
225	G	30.9	Very low	32	Very low	86 Å²	86	130.3 Å²	130.3	89%	0.887	78%	0.78	S	S	*	*			trans	84.7	145	158.5	0	0	0	0	0	116.3
226	G	33.7	Very low	32.2	Very low	76 Å²	76	127.3 Å²	127.3	78%	0.784	77%	0.773	S	S	*	*			cis	-172.3	149.7	-8.2	0	0	0	0	0	111.6
227	F	26.4	Very low	32.3	Very low	212 Å²	212	130.6 Å²	130.6	93%	0.93	77%	0.772	S	S	*	*			trans	-145.6	122.2	179.1	-132.4	-79.5	0	0	0	109.2
228	Q	36.8	Very low	32.2	Very low	154 Å²	154	129 Å²	129	72%	0.72	76%	0.761	S	S	*	*			trans	-157.9	113.9	-164.7	-168	79	89.7	0	0	113.9
229	Q	34.1	Very low	32.3	Very low	147 Å²	147	132.7 Å²	132.7	69%	0.687	76%	0.763	S	S	*	*			trans	67	156.9	162.2	-61.6	165.3	40.6	0	0	116.2
230	L	32.9	Very low	32.3	Very low	148 Å²	148	132.6 Å²	132.6	78%	0.775	76%	0.756	S	S	*	*			cis	-110.5	164.4	-5.1	-74.7	84.4	0	0	0	109.4
231	R	27.9	Very low	32.4	Very low	192 Å²	192	132 Å²	132	73%	0.725	76%	0.758	S	S	*	*			cis	65.5	140.8	47.1	-94.5	-148.6	-86.8	-177.6	-0.6	113.6
232	E	30.9	Very low	32.7	Very low	145 Å²	145	129.1 Å²	129.1	68%	0.678	76%	0.762	S	S	*	*			cis	-157.9	178.7	10	-154.6	155.4	-142.4	0	0	111.6
233	A	33.9	Very low	32.9	Very low	89 Å²	89	129.3 Å²	129.3	74%	0.736	77%	0.773	S	S	*	*			trans	70.3	159.2	161.4	0	0	0	0	0	120.5
234	Q	31.5	Very low	33.3	Very low	188 Å²	188	125.5 Å²	125.5	88%	0.879	77%	0.77	S	S	*	*				-168.8	170.1	-51.3	-119.8	-178.7	21.3	0	0	110.5
235	A	34.5	Very low	34	Very low	94 Å²	94	125.8 Å²	125.8	78%	0.777	77%	0.769	S	S	*	*			trans	68.2	149.7	166	0	0	0	0	0	118
236	S	36.2	Very low	34.3	Very low	91 Å²	91	129 Å²	129	64%	0.636	77%	0.765	S	S	*	*			cis	-171.3	147.7	-18.3	54.2	0	0	0	0	111.9
237	N	32.6	Very low	34.7	Very low	148 Å²	148	130.4 Å²	130.4	79%	0.791	76%	0.755	S	S	*	*			trans	61.5	154.3	140.6	-64	-8.5	0	0	0	120.7
238	S	32.6	Very low	35.4	Very low	91 Å²	91	128.1 Å²	128.1	64%	0.636	74%	0.744	S	S	*	*			cis	-175.2	167.5	-19.2	-99.4	0	0	0	0	112.3
239	L	33.9	Very low	35.6	Very low	153 Å²	153	130.2 Å²	130.2	80%	0.801	75%	0.751	S	S	*	*			trans	85.4	143.6	142.7	-82.1	158.8	0	0	0	123.7
240	T	34.4	Very low	35.6	Very low	125 Å²	125	126.6 Å²	126.6	77%	0.767	75%	0.753	S	S	*	*			trans	62.9	162.1	156.5	58.5	0	0	0	0	122.7
241	S	33.9	Very low	35.8	Very low	114 Å²	114	125.4 Å²	125.4	80%	0.797	76%	0.757	S	S	*	*				175.2	135.4	-71.7	52.8	0	0	0	0	112
242	G	35.6	Very low	35.9	Very low	77 Å²	77	125.5 Å²	125.5	79%	0.794	76%	0.763	S	S	*	*			trans	-178.2	132.4	172	0	0	0	0	0	117.3
243	S	37.5	Very low	36	Very low	126 Å²	126	124.3 Å²	124.3	88%	0.881	77%	0.766	S	S	*	*			trans	-44.4	159	165	44.6	0	0	0	0	116.2
244	G	37	Very low	35.7	Very low	70 Å²	70	130.3 Å²	130.3	72%	0.722	77%	0.771	S	S	*	*			cis	107.4	166	19.8	0	0	0	0	0	111.8
245	P	47.4	Very low	35.6	Very low	116 Å²	116	125.8 Å²	125.8	75%	0.753	76%	0.76	S	S	*	*			cis	-138.3	-154.7	-18.5	32.7	-7.4	0	0	0	113.5
246	L	37.3	Very low	35.3	Very low	153 Å²	153	126.9 Å²	126.9	80%	0.801	76%	0.762	S	S	*	*			trans	79	144.2	158.2	-64.5	163.8	0	0	0	119.8
247	D	41	Very low	35.1	Very low	105 Å²	105	126.6 Å²	126.6	56%	0.561	77%	0.765	S	S	*	*			cis	-168.1	171.6	-13.9	-170.1	22.6	0	0	0	112.9
248	K	41.1	Very low	34.9	Very low	164 Å²	164	127.6 Å²	127.6	71%	0.713	77%	0.77	S	S	*	*			trans	81	106.6	166.2	-65.2	138.2	-168.9	174.2	0	117.2
249	K	40.7	Very low	34.8	Very low	199 Å²	199	127.1 Å²	127.1	87%	0.865	77%	0.771	S	S	*	*				79.6	123.8	74.2	-76.8	176.4	-177.6	-177.8	0	113.6
250	G	35.6	Very low	34.6	Very low	71 Å²	71	131.3 Å²	131.3	73%	0.732	78%	0.778	S	S	*	*			cis	157.8	168.5	-10.6	0	0	0	0	0	114.3
251	S	36.2	Very low	34.5	Very low	123 Å²	123	129.2 Å²	129.2	86%	0.86	78%	0.781	S	S	*	*			trans	71.5	157.6	163.6	-163.9	0	0	0	0	119.4
252	F	29.9	Very low	34.4	Very low	193 Å²	193	129.3 Å²	129.3	85%	0.846	78%	0.781	S	S	*	*				-168.9	-176.1	-50.6	-150	-101.9	0	0	0	108.7
253	V	33.6	Very low	34.6	Very low	121 Å²	121	131.1 Å²	131.1	73%	0.733	78%	0.778	S	S	*	*			trans	73.2	97.6	165.1	-146.9	0	0	0	0	119.9
254	Y	27.6	Very low	34.5	Very low	214 Å²	214	133.8 Å²	133.8	84%	0.839	77%	0.774	S	S	*	*			trans	0.9	163.6	130.7	-118	-107.5	0	0	0	123.9
255	S	29.1	Very low	34.5	Very low	93 Å²	93	137.5 Å²	137.5	65%	0.65	78%	0.776	S	S	*	*			trans	96.2	97.7	152.3	-60.8	0	0	0	0	121
256	S	28.3	Very low	33.9	Very low	117 Å²	117	140.1 Å²	140.1	82%	0.818	78%	0.779	S	S	*	*				76.2	149.6	124.6	-56.8	0	0	0	0	122.9
257	A	31.4	Very low	33.8	Very low	85 Å²	85	136.4 Å²	136.4	70%	0.702	78%	0.777	S	S	*	*			trans	72.1	115.4	157.1	0	0	0	0	0	120.9
258	L	29.2	Very low	33.5	Very low	170 Å²	170	135.9 Å²	135.9	89%	0.89	79%	0.787	S	S	*	*			trans	60.9	162.6	130.9	-65	171.9	0	0	0	122.1
259	A	31.3	Very low	33.2	Very low	80 Å²	80	135 Å²	135	66%	0.661	80%	0.795	S	S	*	*			trans	74.5	122.3	150.6	0	0	0	0	0	121.1
260	Y	29.2	Very low	32.8	Very low	242 Å²	242	130.5 Å²	130.5	95%	0.949	79%	0.789	S	S	*	*			trans	25.7	136.9	133	-58.5	-80.6	0	0	0	121.8
261	G	32	Very low	33.1	Very low	81 Å²	81	133.3 Å²	133.3	84%	0.835	80%	0.795	S	S	*	*			trans	160.1	137	148.9	0	0	0	0	0	116
262	C	32.2	Very low	33	Very low	116 Å²	116	133.6 Å²	133.6	78%	0.784	79%	0.791	S	S	*	*			trans	-145.3	138.2	173.3	-178.7	0	0	0	0	111.7
263	P	39.8	Very low	33.3	Very low	114 Å²	114	134.8 Å²	134.8	74%	0.74	79%	0.79	S	S	*	*			trans	-120.3	126	150.3	24.5	-7.3	0	0	0	110.7
264	K	35.4	Very low	33.4	Very low	182 Å²	182	135.4 Å²	135.4	79%	0.791	78%	0.784	S	S	*	*				66.4	126.6	74.4	-71	-178.4	177	176.9	0	114.7
265	L	36	Very low	33.8	Very low	148 Å²	148	131.7 Å²	131.7	78%	0.775	78%	0.779	S	S	*	*				177.4	178.3	107.2	-82	-179.2	0	0	0	111.2
266	Q	35.9	Very low	34.1	Very low	172 Å²	172	133.8 Å²	133.8	80%	0.804	78%	0.778	S	S	*	*			trans	-58.8	165.9	-162.6	-67.6	80.9	-1.5	0	0	116.7
267	G	33.9	Very low	34.7	Very low	75 Å²	75	135.8 Å²	135.8	77%	0.773	77%	0.772	S	S	*	*			cis	176.9	-162	7.6	0	0	0	0	0	110.5
268	A	35.5	Very low	34.8	Very low	93 Å²	93	137.6 Å²	137.6	77%	0.769	78%	0.775	S	S	*	*			cis	-171.5	144.4	-15.6	0	0	0	0	0	113.3
269	V	35.3	Very low	35.1	Very low	145 Å²	145	136.7 Å²	136.7	88%	0.879	77%	0.769	S	S	*	*			trans	74.8	151.7	149.3	179.9	0	0	0	0	122.5
270	S	31.3	Very low	35.3	Very low	106 Å²	106	137.1 Å²	137.1	74%	0.741	77%	0.767	S	S	*	*			trans	-124.9	-170.3	-168.5	-45.6	0	0	0	0	113.3
271	P	41.7	Very low	35.5	Very low	130 Å²	130	133.5 Å²	133.5	84%	0.844	77%	0.765	S	S	*	*				-149.7	-151.7	72.4	40.9	-18	0	0	0	115.7
272	V	34.2	Very low	35.7	Very low	128 Å²	128	133.2 Å²	133.2	78%	0.776	76%	0.762	S	S	*	*			trans	-151.7	154.1	-168.5	-179.2	0	0	0	0	112.5
273	R	36.5	Very low	35.6	Very low	219 Å²	219	137.7 Å²	137.7	83%	0.826	77%	0.768	S	S	*	*			trans	150.1	156.8	150.3	-87.3	-171.2	173.8	141	8.6	114.5
274	E	35.6	Very low	35.4	Very low	134 Å²	134	138.5 Å²	138.5	63%	0.626	77%	0.772	S	S	*	*			cis	-170.7	156.4	-33.5	-131.1	157.6	-146.2	0	0	112.6
275	N	36.6	Very low	35.4	Very low	135 Å²	135	140 Å²	140	72%	0.722	78%	0.778	S	S	*	*			trans	67.7	173.6	166	-57.4	-34.7	0	0	0	118.2
276	E	36	Very low	35.3	Very low	137 Å²	137	136.5 Å²	136.5	64%	0.64	78%	0.777	S	S	*	*			cis	-168	176.9	-41.1	-91.8	-154.1	123.9	0	0	106.9
277	K	39.6	Very low	35.1	Very low	159 Å²	159	134 Å²	134	69%	0.691	78%	0.779	S	S	*	*			cis	-166.7	174.3	-7	-111	169.6	175.6	128.2	0	105.3
278	T	34.7	Very low	35.2	Very low	123 Å²	123	134.7 Å²	134.7	76%	0.755	78%	0.777	S	S	*	*			cis	-171.4	167.1	-43.3	-74.5	0	0	0	0	108.6
279	I	35.2	Very low	35	Very low	151 Å²	151	140 Å²	140	77%	0.774	78%	0.779	S	S	*	*			trans	117.8	112.2	160.8	-60.1	-178.9	0	0	0	120.6
280	S	35.2	Very low	35	Very low	89 Å²	89	139.2 Å²	139.2	62%	0.622	77%	0.769	S	S	*	*			trans	66.5	123.5	142.7	83.6	0	0	0	0	128.9
281	N	33.8	Very low	35.2	Very low	167 Å²	167	141.2 Å²	141.2	89%	0.893	77%	0.767	S	S	*	*				65	135.6	126	-60.1	-12.2	0	0	0	124.6
282	G	35.3	Very low	34.9	Very low	75 Å²	75	140.6 Å²	140.6	77%	0.773	76%	0.76	S	S	*	*			trans	179.7	10.1	164	0	0	0	0	0	128.5
283	F	31.1	Very low	35.1	Very low	209 Å²	209	139.2 Å²	139.2	92%	0.917	76%	0.757	S	S	*	*			trans	63.5	161.8	154	-115.7	-92.6	0	0	0	124.8
284	T	35.8	Very low	35.1	Very low	132 Å²	132	134.5 Å²	134.5	81%	0.81	76%	0.757	S	S	*	*			trans	88.4	179	164.6	72.1	0	0	0	0	121.7
285	K	33.5	Very low	35	Very low	214 Å²	214	132 Å²	132	93%	0.93	76%	0.76	S	S	*	*			trans	-152	149.3	-149.9	-58.5	170.9	-178.6	168.5	0	114.9
286	G	33.7	Very low	35	Very low	73 Å²	73	134.3 Å²	134.3	75%	0.753	77%	0.771	S	S	*	*			trans	160.1	135.2	159.6	0	0	0	0	0	110.1
287	S	32.7	Very low	34.8	Very low	120 Å²	120	131.3 Å²	131.3	84%	0.839	78%	0.776	S	S	*	*			cis	103.8	132.7	18.8	-173.2	0	0	0	0	113.5
288	A	36	Very low	34.7	Very low	90 Å²	90	135.8 Å²	135.8	74%	0.744	79%	0.789	S	S	*	*			trans	71.1	152.6	168.4	0	0	0	0	0	117.3
289	Y	31.3	Very low	34.7	Very low	205 Å²	205	136.3 Å²	136.3	80%	0.804	79%	0.792	S	S	*	*			cis	-172.9	167.7	-24.4	-141.7	-152	0	0	0	110.2
290	L	35.4	Very low	34.8	Very low	127 Å²	127	135.1 Å²	135.1	67%	0.665	80%	0.795	S	S	*	*			trans	69.7	157.4	154.5	-62.4	174.3	0	0	0	119.7
291	Q	35.8	Very low	34.8	Very low	149 Å²	149	136.8 Å²	136.8	70%	0.696	81%	0.806	S	S	*	*			cis	-170.7	158.7	-34.2	-137.8	-174.6	3.1	0	0	112.4
292	T	34	Very low	34.6	Very low	116 Å²	116	134.8 Å²	134.8	71%	0.712	80%	0.8	S	S	*	*			trans	63.2	160.2	156.5	59.8	0	0	0	0	118.3
293	S	38.4	Very low	34.6	Very low	100 Å²	100	137.9 Å²	137.9	70%	0.699	80%	0.803	S	S	*	*			cis	-145.7	153.5	14.1	-50	0	0	0	0	114
294	S	38.2	Very low	34.8	Very low	119 Å²	119	133 Å²	133	83%	0.832	80%	0.795	S	S	*	*				29	150.6	126.8	-52.3	0	0	0	0	122.9
295	A	33.6	Very low	35.1	Very low	83 Å²	83	132.3 Å²	132.3	69%	0.686	79%	0.793	S	S	*	*			cis	-176	-173.8	-11.2	0	0	0	0	0	110.5
296	L	35.8	Very low	35.4	Very low	183 Å²	183	128.1 Å²	128.1	96%	0.958	79%	0.787	S	S	*	*			trans	79.9	149.3	171.4	-50.9	177.3	0	0	0	116.2
297	G	32.2	Very low	35.3	Very low	73 Å²	73	129.9 Å²	129.9	75%	0.753	79%	0.788	S	S	*	*			trans	-160.9	-179.2	-175.2	0	0	0	0	0	113.2
298	R	36.3	Very low	35.5	Very low	253 Å²	253	130.8 Å²	130.8	96%	0.955	79%	0.789	S	S	*	*			trans	-142.2	158.4	177.5	-73.4	-171.7	174.3	-168.9	-2.2	111.7
299	T	35.8	Very low	35.3	Very low	134 Å²	134	130.2 Å²	130.2	82%	0.822	78%	0.784	S	S	*	*			trans	-77.9	168.1	170.6	49.3	0	0	0	0	111.7
300	P	37.2	Very low	35.6	Very low	127 Å²	127	126.3 Å²	126.3	83%	0.825	78%	0.784	S	S	*	*				-133.5	172.7	120	38.3	-30.6	0	0	0	113.8
301	S	35.6	Very low	35.5	Very low	123 Å²	123	126 Å²	126	86%	0.86	79%	0.787	S	S	*	*			trans	-104.7	-178.1	-175.8	-162.2	0	0	0	0	113.2
302	V	29.5	Very low	35.3	Very low	125 Å²	125	126 Å²	126	76%	0.758	79%	0.791	S	S	*	*			trans	-86.1	130.9	178.2	176	0	0	0	0	111.8
303	V	35.2	Very low	35.2	Very low	141 Å²	141	128.5 Å²	128.5	86%	0.855	80%	0.795	S	S	*	*			trans	-150.1	148.2	148.3	-177.1	0	0	0	0	108.9
304	S	34.4	Very low	35	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	80%	0.803	S	S	*	*			trans	-95.1	158.5	178.8	-47.2	0	0	0	0	113.6
305	P	41.9	Very low	34.7	Very low	118 Å²	118	131.2 Å²	131.2	77%	0.766	80%	0.798	S	S	*	*			trans	-143.2	-177	142.1	42	-27.6	0	0	0	112.6
306	P	39.9	Very low	34.5	Very low	126 Å²	126	135.6 Å²	135.6	82%	0.818	80%	0.797	S	S	*	*				-129.1	-173.4	-64	39.9	-24.6	0	0	0	112.5
307	S	31.1	Very low	34.4	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	79%	0.79	S	S	*	*			trans	-100.1	153.1	174.2	179.7	0	0	0	0	112.3
308	T	37.9	Very low	34.4	Very low	139 Å²	139	135 Å²	135	85%	0.853	79%	0.786	S	S	*	*			trans	174.9	149.6	138.5	-71.9	0	0	0	0	110.5
309	A	31.4	Very low	34.3	Very low	78 Å²	78	128.5 Å²	128.5	65%	0.645	78%	0.776	S	S	*	*			trans	-104.9	167.2	177.6	0	0	0	0	0	112.4
310	P	38.8	Very low	34.1	Very low	123 Å²	123	133.6 Å²	133.6	80%	0.799	78%	0.781	S	S	*	*				-128.4	160.2	83.5	6.2	18.1	0	0	0	112.9
311	V	32.6	Very low	33.8	Very low	121 Å²	121	136.1 Å²	136.1	73%	0.733	78%	0.781	S	S	*	*			cis	89.4	124.4	48.8	178.2	0	0	0	0	114.2
312	L	32.5	Very low	33.6	Very low	148 Å²	148	134.1 Å²	134.1	78%	0.775	78%	0.78	S	S	*	*			trans	63.5	152.6	178.7	-97.1	58.6	0	0	0	116.2
313	E	31.8	Very low	33.8	Very low	169 Å²	169	139.4 Å²	139.4	79%	0.79	79%	0.787	S	S	*	*			cis	-140.2	-173.3	5.4	-155.5	155.7	149.1	0	0	112.8
314	Q	33.5	Very low	33.5	Very low	186 Å²	186	137.5 Å²	137.5	87%	0.869	78%	0.78	S	S	*	*			trans	-81.4	130.9	-167.6	-54.6	177.9	14.8	0	0	114.1
315	A	32.4	Very low	33.2	Very low	89 Å²	89	139.7 Å²	139.7	74%	0.736	78%	0.783	S	S	*	*			trans	-143.1	118	162.7	0	0	0	0	0	111.3	V317	A315-V317 PolarHBondContact O-N 3.04Å
316	R	28.4	Very low	32.9	Very low	175 Å²	175	143.6 Å²	143.6	66%	0.66	79%	0.788	S	S	*	*			trans	-74.5	106.6	173.7	-69.2	-178.4	176.8	116	-10.9	109.7	M1215 H1216	R316-M1215 PolarHBondContact NH2-SD 3.08Å; R316-H1216 PolarHBondContact NE-NE2 3.41Å; R316-H1216 PolarHBondContact NH2-CD2 3.41Å; R316-H1216 PolarHBondContact NH2-NE2 3.18Å
317	V	33.9	Very low	32.8	Very low	133 Å²	133	144.6 Å²	144.6	81%	0.806	79%	0.787	S	S	*	*			trans	-105.5	117	171.4	-177.1	0	0	0	0	109.8	A315	A315-V317 PolarHBondContact O-N 3.04Å
318	V	31.7	Very low	33	Very low	111 Å²	111	145.1 Å²	145.1	67%	0.673	79%	0.785	S	S	*	*			trans	-76.5	140	-174.9	-179.9	0	0	0	0	111	R320	V318-R320 PolarHBondContact O-N 3.5Å
319	P	35.6	Very low	33.3	Very low	116 Å²	116	144.8 Å²	144.8	75%	0.753	78%	0.778	S	S	*	*			trans	-61	101.8	166.5	-20.1	32.7	0	0	0	110.4	H321	P319-H321 PolarHBondContact O-N 3.42Å
320	R	30.8	Very low	34.2	Very low	241 Å²	241	145.3 Å²	145.3	91%	0.909	77%	0.77	S	S	*	*			trans	-61.9	130.1	-177.1	-79.5	-177.1	167.3	178.3	-4.2	111	V318 G322	V318-R320 PolarHBondContact O-N 3.5Å; R320-G322 PolarHBondContact O-N 2.79Å
321	H	31.1	Very low	35	Very low	180 Å²	180	142.6 Å²	142.6	83%	0.833	75%	0.754	S	S	*	*			trans	-64.3	125.8	169.6	-66.1	-0.2	0	0	0	110.7	P319	P319-H321 PolarHBondContact O-N 3.42Å
322	G	31.9	Very low	35.6	Very low	82 Å²	82	144.2 Å²	144.2	85%	0.845	76%	0.758	S	S	*	*			trans	-105.4	97.8	166.4	0	0	0	0	0	110.1	R320	R320-G322 PolarHBondContact O-N 2.79Å
323	R	32.9	Very low	37.1	Very low	236 Å²	236	139 Å²	139	89%	0.891	73%	0.73	S	S	*	*			trans	-80.5	140.2	174	-69.9	-178.6	172.4	-163.4	-2.2	110.8
324	S	29.8	Very low	39	Very low	101 Å²	101	134 Å²	134	71%	0.706	71%	0.713	S	S	*	*				-166.8	113.4	128.2	58.9	0	0	0	0	112
325	N	28.6	Very low	40.6	Very low	151 Å²	151	127 Å²	127	81%	0.807	68%	0.683	S	S	*	*			trans	53.2	82.8	148.4	-52.8	17.1	0	0	0	117.7
326	F	34.1	Very low	42	Very low	199 Å²	199	127.6 Å²	127.6	87%	0.873	67%	0.667	S	S	*	*			trans	-113.3	137.1	133.3	-91.6	-101.3	0	0	0	107	V328	F326-V328 PolarHBondContact O-N 3.49Å
327	D	37.9	Very low	44.1	Very low	148 Å²	148	122.5 Å²	122.5	79%	0.791	65%	0.651	S	S	*	*			trans	-76.7	116.2	179.9	-62	-63.4	0	0	0	110.2	D329	D327-D329 PolarHBondContact O-N 3.44Å; D327-D329 VanDerWaalsContact O-N 3.08Å
328	V	36.3	Very low	45.8	Very low	122 Å²	122	118.4 Å²	118.4	74%	0.739	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	56.7	-172.7	-167.6	0	0	0	0	110.7	F326	F326-V328 PolarHBondContact O-N 3.49Å
329	D	43.2	Very low	47.6	Very low	131 Å²	131	114.7 Å²	114.7	70%	0.701	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.1	-5	176.1	-84.5	-59.8	0	0	0	113.8	D327 S331 Q333	D327-D329 PolarHBondContact O-N 3.44Å; D327-D329 VanDerWaalsContact O-N 3.08Å; D329-S331 VanDerWaalsContact C-N 3.28Å; D329-S331 PolarHBondContact O-N 3.44Å; D329-Q333 PolarHBondContact O-NE2 3.2Å
330	D	50	Low	49.6	Very low	90 Å²	90	116.5 Å²	116.5	48%	0.481	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-75.2	-13.5	177	-108.1	27.3	0	0	0	113.7	N332 Q333	D330-N332 PolarHBondContact O-N 3.38Å; D330-Q333 PolarHBondContact OD1-NE2 2.95Å; D330-Q333 PolarHBondContact OD1-OE1 3.44Å
331	S	55.3	Low	52	Low	65 Å²	65	106.8 Å²	106.8	46%	0.455	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-92.1	13.8	-170	61.7	0	0	0	0	115.7	D329	D329-S331 VanDerWaalsContact C-N 3.28Å; D329-S331 PolarHBondContact O-N 3.44Å
332	N	45.3	Very low	54	Low	156 Å²	156	99.8 Å²	99.8	83%	0.834	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-130.1	7.3	167.2	-76.1	-60.5	0	0	0	112.2	D330	D330-N332 PolarHBondContact O-N 3.38Å
333	Q	64	Low	56.4	Low	39 Å²	39	100 Å²	100	18%	0.182	51%	0.509	C	S	.	.			trans	-80.9	122.5	-177.6	-69.6	174.1	23.8	0	0	111.2	D329 D330 E337 R338	D329-Q333 PolarHBondContact O-NE2 3.2Å; D330-Q333 PolarHBondContact OD1-NE2 2.95Å; D330-Q333 PolarHBondContact OD1-OE1 3.44Å; Q333-E337 HydrophobicContact CB-CB 4.36Å; Q333-R338 HydrophobicContact CB-CG 3.81Å; Q333-R338 PolarHBondContact O-NE 2.95Å; Q333-R338 PolarHBondContact O-NH1 2.64Å; Q333-R338 PolarHBondContact O-NH2 3.3Å
334	S	72.4	Confident	58.9	Low	62 Å²	62	94.6 Å²	94.6	43%	0.434	49%	0.494	S	S	.	.			trans	-56.8	159.2	171.9	77.1	0	0	0	0	111.9	Y336 E337 R338	S334-Y336 PolarHBondContact O-N 3.22Å; S334-E337 PolarHBondContact O-N 3.32Å; S334-E337 VanDerWaalsContact O-N 3.08Å; S334-E337 PolarHBondContact OG-N 2.86Å; S334-R338 PolarHBondContact O-N 3.06Å; S334-R338 VanDerWaalsContact O-N 3.1Å
335	V	67.1	Low	61.5	Low	39 Å²	39	96.2 Å²	96.2	24%	0.236	49%	0.489	C	S	.	.	H	α-helix	trans	-53.4	-38.6	175.5	179.4	0	0	0	0	111.2	R338 I339	V335-R338 PolarHBondContact O-N 3.31Å; V335-I339 HydrophobicContact CG1-CD1 3.81Å; V335-I339 HydrophobicContact CG1-CG1 4.47Å; V335-I339 WeakPolarHBondContact O-CD1 3.41Å; V335-I339 VanDerWaalsContact O-CG1 3.23Å; V335-I339 WeakPolarHBondContact O-CG1 3.42Å; V335-I339 PolarHBondContact O-N 3.45Å
336	Y	61	Low	64	Low	102 Å²	102	91 Å²	91	40%	0.4	47%	0.466	S	S	.	.	H	α-helix	trans	-62.1	-44.3	176.7	-62.1	-81.8	0	0	0	113.3	S334 I339 R340 L558	S334-Y336 PolarHBondContact O-N 3.22Å; Y336-I339 PolarHBondContact O-N 3.1Å; Y336-R340 PolarHBondContact O-N 2.9Å; Y336-L558 HydrophobicContact CE1-CD1 4.01Å
337	E	73.2	Confident	66.4	Low	69 Å²	69	87.3 Å²	87.3	32%	0.322	45%	0.452	S	S	.	.	H	α-helix	trans	-70	-37.1	-179.2	-156.2	61.4	-151.6	0	0	111	Q333 S334 I339 R340 I341	Q333-E337 HydrophobicContact CB-CB 4.36Å; S334-E337 PolarHBondContact O-N 3.32Å; S334-E337 VanDerWaalsContact O-N 3.08Å; S334-E337 PolarHBondContact OG-N 2.86Å; E337-I339 VanDerWaalsContact C-N 3.33Å; E337-I339 PolarHBondContact O-N 3.33Å; E337-R340 WeakPolarHBondContact O-CB 3.34Å; E337-R340 PolarHBondContact O-N 3.33Å; E337-R340 WeakPolarHBondContact OE1-CD 3.39Å; E337-R340 IonicContact OE1-CZ 3.86Å; E337-R340 IonicContact OE1-NE 3.92Å; E337-R340 IonicContact OE1-NH1 3.04Å; E337-R340 PolarHBondContact OE1-NH1 3.4Å; E337-R340 IonicContact OE2-NH1 3.7Å; E337-I341 HydrophobicContact CG-CD1 4.05Å; E337-I341 WeakPolarHBondContact O-CB 3.4Å; E337-I341 WeakPolarHBondContact O-CG1 3.38Å; E337-I341 PolarHBondContact O-N 2.87Å
338	R	70.2	Confident	68.6	Low	46 Å²	46	82.9 Å²	82.9	17%	0.174	44%	0.436	C	S	.	.	H	α-helix	trans	-64.3	-35.9	172.8	-68.3	-166.2	-80.4	-127.2	0.5	113	Q333 S334 V335 A342 E688 R691	Q333-R338 HydrophobicContact CB-CG 3.81Å; Q333-R338 PolarHBondContact O-NE 2.95Å; Q333-R338 PolarHBondContact O-NH1 2.64Å; Q333-R338 PolarHBondContact O-NH2 3.3Å; S334-R338 PolarHBondContact O-N 3.06Å; S334-R338 VanDerWaalsContact O-N 3.1Å; V335-R338 PolarHBondContact O-N 3.31Å; R338-A342 VanDerWaalsContact O-CB 3.22Å; R338-A342 WeakPolarHBondContact O-CB 3.39Å; R338-A342 PolarHBondContact O-N 3.39Å; R338-E688 IonicContact CZ-OE1 3.6Å; R338-E688 VanDerWaalsContact CZ-OE1 3.25Å; R338-E688 IonicContact NH1-OE1 2.7Å; R338-E688 PolarHBondContact NH1-OE1 3.27Å; R338-E688 IonicContact NH2-OE1 2.66Å; R338-E688 PolarHBondContact NH2-OE1 2.9Å; R338-R691 VanDerWaalsContact NH1-NH1 3.17Å
339	I	70	Confident	70.8	Confident	34 Å²	34	82.8 Å²	82.8	17%	0.174	43%	0.427	C	S	.	.	H	α-helix	trans	-65.7	-46.8	172.4	-69.4	161.2	0	0	0	110.3	V335 Y336 E337 I341 A342 L343 Y559	V335-I339 HydrophobicContact CG1-CD1 3.81Å; V335-I339 HydrophobicContact CG1-CG1 4.47Å; V335-I339 WeakPolarHBondContact O-CD1 3.41Å; V335-I339 VanDerWaalsContact O-CG1 3.23Å; V335-I339 WeakPolarHBondContact O-CG1 3.42Å; V335-I339 PolarHBondContact O-N 3.45Å; Y336-I339 PolarHBondContact O-N 3.1Å; E337-I339 VanDerWaalsContact C-N 3.33Å; E337-I339 PolarHBondContact O-N 3.33Å; I339-I341 PolarHBondContact O-N 3Å; I339-A342 PolarHBondContact O-N 3.11Å; I339-L343 HydrophobicContact CG2-CD1 4Å; I339-L343 HydrophobicContact CG2-CG 4.45Å; I339-L343 WeakPolarHBondContact O-CG 3.41Å; I339-L343 PolarHBondContact O-N 2.94Å; I339-Y559 WeakPolarHBondContact CD1-O 3.42Å; I339-Y559 VanDerWaalsContact CG1-O 3.32Å; I339-Y559 WeakPolarHBondContact CG1-O 3.45Å
340	R	77	Confident	72.8	Confident	153 Å²	153	84.3 Å²	84.3	58%	0.577	43%	0.427	S	S	*	.	H	α-helix	trans	-56.3	-52.7	177.5	-172.1	-166.1	-169.3	173.4	3	111.7	Y336 E337 A342 L343 E344	Y336-R340 PolarHBondContact O-N 2.9Å; E337-R340 WeakPolarHBondContact O-CB 3.34Å; E337-R340 PolarHBondContact O-N 3.33Å; E337-R340 WeakPolarHBondContact OE1-CD 3.39Å; E337-R340 IonicContact OE1-CZ 3.86Å; E337-R340 IonicContact OE1-NE 3.92Å; E337-R340 IonicContact OE1-NH1 3.04Å; E337-R340 PolarHBondContact OE1-NH1 3.4Å; E337-R340 IonicContact OE2-NH1 3.7Å; R340-A342 VanDerWaalsContact C-N 3.28Å; R340-A342 PolarHBondContact O-N 3.02Å; R340-L343 PolarHBondContact O-N 3.17Å; R340-L343 VanDerWaalsContact O-N 3.17Å; R340-E344 PolarHBondContact O-N 3.01Å
341	I	80.1	Confident	74.3	Confident	37 Å²	37	86.5 Å²	86.5	19%	0.19	44%	0.435	C	S	.	.	H	α-helix	trans	-62.4	-34	178.4	-70.6	165.3	0	0	0	111.4	E337 I339 K345	E337-I341 HydrophobicContact CG-CD1 4.05Å; E337-I341 WeakPolarHBondContact O-CB 3.4Å; E337-I341 WeakPolarHBondContact O-CG1 3.38Å; E337-I341 PolarHBondContact O-N 2.87Å; I339-I341 PolarHBondContact O-N 3Å; I341-K345 HydrophobicContact CG2-CD 3.81Å; I341-K345 VanDerWaalsContact CG2-CE 3.43Å; I341-K345 VanDerWaalsContact O-CB 3.28Å; I341-K345 WeakPolarHBondContact O-CB 3.41Å; I341-K345 WeakPolarHBondContact O-CD 3.38Å; I341-K345 WeakPolarHBondContact O-CG 3.28Å; I341-K345 PolarHBondContact O-N 3.24Å
342	A	74.1	Confident	75.7	Confident	34 Å²	34	88.2 Å²	88.2	28%	0.281	44%	0.438	S	S	.	.	H	α-helix	trans	-71.4	-35.7	175.5	0	0	0	0	0	113.2	R338 I339 R340 A346 P562	R338-A342 VanDerWaalsContact O-CB 3.22Å; R338-A342 WeakPolarHBondContact O-CB 3.39Å; R338-A342 PolarHBondContact O-N 3.39Å; I339-A342 PolarHBondContact O-N 3.11Å; R340-A342 VanDerWaalsContact C-N 3.28Å; R340-A342 PolarHBondContact O-N 3.02Å; A342-A346 WeakPolarHBondContact O-CB 3.43Å; A342-A346 PolarHBondContact O-N 2.94Å; A342-A346 VanDerWaalsContact O-N 3.11Å; A342-P562 HydrophobicContact CB-CG 4.32Å
343	L	82.6	Confident	77.4	Confident	85 Å²	85	86.7 Å²	86.7	45%	0.445	43%	0.428	S	S	.	.	H	α-helix	trans	-68	-49	173.6	-70.1	169.4	0	0	0	110.8	I339 R340 K345 A346 E347	I339-L343 HydrophobicContact CG2-CD1 4Å; I339-L343 HydrophobicContact CG2-CG 4.45Å; I339-L343 WeakPolarHBondContact O-CG 3.41Å; I339-L343 PolarHBondContact O-N 2.94Å; R340-L343 PolarHBondContact O-N 3.17Å; R340-L343 VanDerWaalsContact O-N 3.17Å; L343-K345 VanDerWaalsContact C-N 3.35Å; L343-K345 PolarHBondContact O-N 2.92Å; L343-A346 CarbonylContact O-C 3.59Å; L343-A346 WeakPolarHBondContact O-CA 3.45Å; L343-A346 WeakPolarHBondContact O-CB 3.4Å; L343-A346 PolarHBondContact O-N 3.34Å; L343-E347 PolarHBondContact O-N 3.19Å
344	E	84.1	Confident	78.2	Confident	124 Å²	124	87.2 Å²	87.2	58%	0.579	44%	0.439	S	S	*	.	H	α-helix	trans	-58.9	-43.7	177.8	-172.4	178.1	179.6	0	0	111.9	R340 A346 E347 A348	R340-E344 PolarHBondContact O-N 3.01Å; E344-A346 VanDerWaalsContact C-N 3.31Å; E344-A346 PolarHBondContact O-N 3.5Å; E344-E347 PolarHBondContact O-N 2.89Å; E344-A348 WeakPolarHBondContact O-CB 3.33Å; E344-A348 PolarHBondContact O-N 3.44Å
345	K	84.6	Confident	78.3	Confident	135 Å²	135	87.6 Å²	87.6	59%	0.587	45%	0.446	S	S	*	.	H	α-helix	trans	-63.2	-33.8	173.4	-74.9	168.8	-178.8	166.8	0	112.6	I341 L343 Q349	I341-K345 HydrophobicContact CG2-CD 3.81Å; I341-K345 VanDerWaalsContact CG2-CE 3.43Å; I341-K345 VanDerWaalsContact O-CB 3.28Å; I341-K345 WeakPolarHBondContact O-CB 3.41Å; I341-K345 WeakPolarHBondContact O-CD 3.38Å; I341-K345 WeakPolarHBondContact O-CG 3.28Å; I341-K345 PolarHBondContact O-N 3.24Å; L343-K345 VanDerWaalsContact C-N 3.35Å; L343-K345 PolarHBondContact O-N 2.92Å; K345-Q349 WeakPolarHBondContact O-CB 3.19Å; K345-Q349 PolarHBondContact O-N 3.1Å; K345-Q349 VanDerWaalsContact O-N 3.1Å
346	A	81.3	Confident	78.5	Confident	41 Å²	41	92.9 Å²	92.9	34%	0.339	47%	0.465	S	S	.	.	H	α-helix	trans	-73.2	-39	176	0	0	0	0	0	112.4	A342 L343 E344 Q349 K350	A342-A346 WeakPolarHBondContact O-CB 3.43Å; A342-A346 PolarHBondContact O-N 2.94Å; A342-A346 VanDerWaalsContact O-N 3.11Å; L343-A346 CarbonylContact O-C 3.59Å; L343-A346 WeakPolarHBondContact O-CA 3.45Å; L343-A346 WeakPolarHBondContact O-CB 3.4Å; L343-A346 PolarHBondContact O-N 3.34Å; E344-A346 VanDerWaalsContact C-N 3.31Å; E344-A346 PolarHBondContact O-N 3.5Å; A346-Q349 PolarHBondContact O-N 3.08Å; A346-K350 PolarHBondContact O-N 3.32Å
347	E	85.4	Confident	78.5	Confident	122 Å²	122	93.2 Å²	93.2	57%	0.57	48%	0.478	S	S	*	.	H	α-helix	trans	-66.6	-45.6	174.6	-71.4	-175.2	174.3	0	0	111.8	L343 E344 Q349 K350 Q351	L343-E347 PolarHBondContact O-N 3.19Å; E344-E347 PolarHBondContact O-N 2.89Å; E347-Q349 PolarHBondContact O-N 3.44Å; E347-K350 WeakPolarHBondContact O-CB 3.22Å; E347-K350 PolarHBondContact O-N 3.27Å; E347-Q351 WeakPolarHBondContact O-CG 3.37Å; E347-Q351 PolarHBondContact O-N 2.99Å
348	A	83.7	Confident	77.5	Confident	54 Å²	54	96.7 Å²	96.7	45%	0.446	50%	0.499	S	S	.	.	H	α-helix	trans	-57.7	-38.4	172.4	0	0	0	0	0	111.8	E344 L352	E344-A348 WeakPolarHBondContact O-CB 3.33Å; E344-A348 PolarHBondContact O-N 3.44Å; A348-L352 WeakPolarHBondContact O-CB 3.39Å; A348-L352 PolarHBondContact O-N 3.46Å
349	Q	82.6	Confident	76.2	Confident	120 Å²	120	100 Å²	100	56%	0.561	52%	0.524	S	S	*	.	H	α-helix	trans	-68.2	-38.1	174.4	-168.8	171.8	35.3	0	0	112.6	K345 A346 E347 L352 M353	K345-Q349 WeakPolarHBondContact O-CB 3.19Å; K345-Q349 PolarHBondContact O-N 3.1Å; K345-Q349 VanDerWaalsContact O-N 3.1Å; A346-Q349 PolarHBondContact O-N 3.08Å; E347-Q349 PolarHBondContact O-N 3.44Å; Q349-L352 PolarHBondContact O-N 3.03Å; Q349-M353 HydrophobicContact CG-CE 4.2Å; Q349-M353 WeakPolarHBondContact O-CG 3.33Å; Q349-M353 PolarHBondContact O-N 3.13Å
350	K	83.9	Confident	74.9	Confident	163 Å²	163	103.9 Å²	103.9	71%	0.709	55%	0.552	S	S	*	*	H	α-helix	trans	-63.2	-46.2	174.2	-172.7	-179.5	179.4	-177	0	111.1	A346 E347 M353 A354	A346-K350 PolarHBondContact O-N 3.32Å; E347-K350 WeakPolarHBondContact O-CB 3.22Å; E347-K350 PolarHBondContact O-N 3.27Å; K350-M353 PolarHBondContact O-N 2.94Å; K350-A354 PolarHBondContact O-N 2.88Å
351	Q	83.3	Confident	72.9	Confident	136 Å²	136	102.1 Å²	102.1	64%	0.636	56%	0.563	S	S	*	*	H	α-helix	trans	-60.7	-45.4	174.8	-68	178.4	17.8	0	0	111.7	E347 M353 A354 A355	E347-Q351 WeakPolarHBondContact O-CG 3.37Å; E347-Q351 PolarHBondContact O-N 2.99Å; Q351-M353 VanDerWaalsContact C-N 3.27Å; Q351-M353 PolarHBondContact O-N 3.18Å; Q351-A354 PolarHBondContact O-N 3.35Å; Q351-A355 WeakPolarHBondContact O-CB 3.28Å; Q351-A355 PolarHBondContact O-N 3.46Å
352	L	83.5	Confident	71.1	Confident	101 Å²	101	106 Å²	106	53%	0.529	59%	0.59	S	S	.	*	H	α-helix	trans	-64.6	-28.6	178.3	-171.7	68.1	0	0	0	113.2	A348 Q349 K356	A348-L352 WeakPolarHBondContact O-CB 3.39Å; A348-L352 PolarHBondContact O-N 3.46Å; Q349-L352 PolarHBondContact O-N 3.03Å; L352-K356 WeakPolarHBondContact O-CG 3.2Å
353	M	81.2	Confident	69.3	Low	124 Å²	124	108.7 Å²	108.7	61%	0.611	61%	0.607	S	S	*	*	H	α-helix	trans	-75.7	-44.3	172	-70.9	-166.2	-174.1	0	0	111.8	Q349 K350 Q351 A355 K356 T357	Q349-M353 HydrophobicContact CG-CE 4.2Å; Q349-M353 WeakPolarHBondContact O-CG 3.33Å; Q349-M353 PolarHBondContact O-N 3.13Å; K350-M353 PolarHBondContact O-N 2.94Å; Q351-M353 VanDerWaalsContact C-N 3.27Å; Q351-M353 PolarHBondContact O-N 3.18Å; M353-A355 VanDerWaalsContact C-N 3.33Å; M353-A355 PolarHBondContact O-N 2.81Å; M353-K356 PolarHBondContact O-N 2.62Å; M353-K356 VanDerWaalsContact O-N 3.08Å; M353-T357 PolarHBondContact O-N 3.16Å
354	A	80.7	Confident	67.2	Low	51 Å²	51	114.3 Å²	114.3	42%	0.421	63%	0.628	S	S	.	*	H	α-helix	trans	-61.3	-39.1	176.5	0	0	0	0	0	112.7	K350 Q351 K356 T357	K350-A354 PolarHBondContact O-N 2.88Å; Q351-A354 PolarHBondContact O-N 3.35Å; A354-K356 PolarHBondContact O-N 3.35Å; A354-T357 PolarHBondContact O-N 3.38Å; A354-T357 PolarHBondContact O-OG1 3.21Å
355	A	74.8	Confident	64.9	Low	69 Å²	69	114.8 Å²	114.8	57%	0.57	64%	0.635	S	S	*	*	H	α-helix	trans	-61.6	-30	174.5	0	0	0	0	0	112.9	Q351 M353	Q351-A355 WeakPolarHBondContact O-CB 3.28Å; Q351-A355 PolarHBondContact O-N 3.46Å; M353-A355 VanDerWaalsContact C-N 3.33Å; M353-A355 PolarHBondContact O-N 2.81Å
356	K	70.7	Confident	62.7	Low	150 Å²	150	118.4 Å²	118.4	65%	0.652	65%	0.651	S	S	*	*	H	α-helix	trans	-84.1	-9.7	179.2	-73.4	175.4	-178.6	175.2	0	114.2	L352 M353 A354	L352-K356 WeakPolarHBondContact O-CG 3.2Å; M353-K356 PolarHBondContact O-N 2.62Å; M353-K356 VanDerWaalsContact O-N 3.08Å; A354-K356 PolarHBondContact O-N 3.35Å
357	T	62.3	Low	60.6	Low	110 Å²	110	120.6 Å²	120.6	68%	0.675	67%	0.668	S	S	*	*	H	α-helix	trans	-93.8	-13.3	175.1	42.5	0	0	0	0	114.2	M353 A354 V359	M353-T357 PolarHBondContact O-N 3.16Å; A354-T357 PolarHBondContact O-N 3.38Å; A354-T357 PolarHBondContact O-OG1 3.21Å; T357-V359 PolarHBondContact O-N 3.08Å
358	N	51.2	Low	58.4	Low	141 Å²	141	118.6 Å²	118.6	75%	0.754	67%	0.673	S	S	*	*			trans	-95.5	51.5	-178.8	-85.7	-22.4	0	0	0	113.6
359	V	42.7	Very low	56.3	Low	116 Å²	116	123.1 Å²	123.1	70%	0.703	69%	0.69	S	S	*	*			trans	-105.9	111.8	170.3	-177.3	0	0	0	0	109.2	T357	T357-V359 PolarHBondContact O-N 3.08Å
360	P	42.8	Very low	54.3	Low	116 Å²	116	125.3 Å²	125.3	75%	0.753	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-75	135.4	179	29.9	-33.6	0	0	0	111.6
361	S	36	Very low	52.2	Low	116 Å²	116	124 Å²	124	81%	0.811	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-75.9	134	174.8	-57.5	0	0	0	0	111.3
362	P	41.7	Very low	50	Low	117 Å²	117	125 Å²	125	76%	0.76	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-73.7	138.6	170.9	30.5	-33.5	0	0	0	111.3
363	S	36.5	Very low	47.9	Very low	91 Å²	91	125 Å²	125	64%	0.636	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-87.3	155.6	169.6	56.2	0	0	0	0	111.6
364	F	38.9	Very low	45.8	Very low	204 Å²	204	123.8 Å²	123.8	90%	0.895	72%	0.717	S	S	*	*			trans	-139.2	102.5	164.4	-85.6	-73.7	0	0	0	109
365	D	35	Very low	43.9	Very low	134 Å²	134	125.9 Å²	125.9	72%	0.717	73%	0.728	S	S	*	*			trans	-91.6	138.2	177.8	-59.6	-79.1	0	0	0	111.5
366	K	38.3	Very low	42.2	Very low	211 Å²	211	129.6 Å²	129.6	92%	0.917	74%	0.739	S	S	*	*			trans	156.3	154	149.3	-90.1	161.1	-179.5	-179.6	0	110.5
367	A	38	Very low	40.5	Very low	86 Å²	86	131.7 Å²	131.7	71%	0.711	75%	0.747	S	S	*	*			cis	-177.1	169.9	-26.8	0	0	0	0	0	107
368	A	38.6	Very low	39.5	Very low	81 Å²	81	131.8 Å²	131.8	67%	0.669	75%	0.75	S	S	*	*			trans	70.6	120.1	174	0	0	0	0	0	115.7
369	D	39.1	Very low	38.9	Very low	148 Å²	148	130.9 Å²	130.9	79%	0.791	75%	0.749	S	S	*	*				89.4	140	61.2	-58.5	-23.9	0	0	0	110.4
370	E	40.9	Very low	38.9	Very low	166 Å²	166	130.6 Å²	130.6	78%	0.776	75%	0.752	S	S	*	*			cis	-158.4	162.1	-2.1	-127	-174.4	165.1	0	0	111.2
371	E	40	Very low	38.9	Very low	135 Å²	135	129.4 Å²	129.4	63%	0.631	75%	0.752	S	S	*	*			trans	61.4	148.8	142.6	-76.8	-84.1	74.4	0	0	126.2
372	K	38.1	Very low	39.5	Very low	159 Å²	159	129.3 Å²	129.3	69%	0.691	74%	0.743	S	S	*	*			trans	62.9	93.9	150.2	-74.9	-173.1	175.9	73.2	0	124.1
373	S	38.3	Very low	39.6	Very low	101 Å²	101	131.6 Å²	131.6	71%	0.706	74%	0.741	S	S	*	*				49.4	137.8	107.6	69.6	0	0	0	0	124.1
374	A	38	Very low	39.8	Very low	98 Å²	98	134.6 Å²	134.6	81%	0.81	74%	0.742	S	S	*	*			trans	68.9	151.7	154.6	0	0	0	0	0	118.1
375	S	39.8	Very low	40	Very low	95 Å²	95	131.5 Å²	131.5	66%	0.664	73%	0.731	S	S	*	*			cis	-157.8	176.9	-23.1	57.7	0	0	0	0	110.8
376	D	40.4	Very low	40.4	Very low	147 Å²	147	135.1 Å²	135.1	79%	0.786	73%	0.734	S	S	*	*			trans	72.6	174.1	158.4	-63.2	-61	0	0	0	121.5
377	K	33.8	Very low	40.6	Very low	193 Å²	193	133.8 Å²	133.8	84%	0.839	73%	0.729	S	S	*	*			trans	-135.2	-168	-167.8	-44	164.9	-175.3	157.2	0	107.1
378	P	41.3	Very low	40.9	Very low	112 Å²	112	136 Å²	136	73%	0.727	73%	0.728	S	S	*	*			cis	-126.3	-157.3	-19.5	38.9	-21	0	0	0	111.1
379	V	39.6	Very low	41.1	Very low	122 Å²	122	142.5 Å²	142.5	74%	0.739	74%	0.741	S	S	*	*			trans	148.9	136.8	136.8	163.7	0	0	0	0	113
380	S	42.6	Very low	41.2	Very low	110 Å²	110	138.8 Å²	138.8	77%	0.769	74%	0.739	S	S	*	*			trans	7.1	156.4	159.2	93.2	0	0	0	0	121.9
381	A	42.2	Very low	41.2	Very low	91 Å²	91	137.6 Å²	137.6	75%	0.752	75%	0.745	S	S	*	*			cis	-155.6	-157.2	8.8	0	0	0	0	0	108.1
382	D	47.5	Very low	41.2	Very low	114 Å²	114	134.5 Å²	134.5	61%	0.61	75%	0.75	S	S	*	*			cis	-159.4	176.2	-3.6	-165.4	3.4	0	0	0	108.8
383	K	45	Very low	41.4	Very low	165 Å²	165	137.4 Å²	137.4	72%	0.717	76%	0.762	S	S	*	*			trans	51.7	132.4	150.4	-83.1	164.6	-169.1	118.5	0	119.6
384	K	40	Very low	41.5	Very low	154 Å²	154	141 Å²	141	67%	0.67	77%	0.768	S	S	*	*			cis	-167.9	118.7	0.1	-162.2	174.9	-176.4	-179.7	0	112
385	Q	42.9	Very low	41.7	Very low	139 Å²	139	145.9 Å²	145.9	65%	0.65	77%	0.771	S	S	*	*			trans	62.1	152.7	142.5	-62.2	178	0.3	0	0	119.8
386	R	44.2	Very low	41.8	Very low	210 Å²	210	145.2 Å²	145.2	79%	0.792	77%	0.771	S	S	*	*			cis	-165.2	172.8	-6.5	-121	170.7	170.7	179.2	-5	111.4
387	K	41.6	Very low	41.6	Very low	184 Å²	184	144.2 Å²	144.2	80%	0.8	77%	0.773	S	S	*	*			trans	98	65.9	146.6	-141.6	170.5	-171.1	176.4	0	121.2
388	D	44.9	Very low	42.2	Very low	132 Å²	132	146.2 Å²	146.2	71%	0.706	78%	0.775	S	S	*	*				56.8	151.3	109.3	-48.8	-41.6	0	0	0	124
389	K	42.5	Very low	42.4	Very low	217 Å²	217	150.5 Å²	150.5	94%	0.943	78%	0.782	S	S	*	*			trans	72.9	131.4	168.8	-52.1	-169.2	179.4	-169.6	0	116.5
390	G	41.3	Very low	42.8	Very low	71 Å²	71	153.5 Å²	153.5	73%	0.732	79%	0.786	S	S	*	*			cis	179.9	148.7	-6.7	0	0	0	0	0	110.3
391	P	41.7	Very low	43.2	Very low	141 Å²	141	158.5 Å²	158.5	92%	0.916	79%	0.793	S	S	*	*			trans	-107.3	172.9	-165	40.7	-35.6	0	0	0	115
392	G	40.6	Very low	43.3	Very low	70 Å²	70	160.8 Å²	160.8	72%	0.722	79%	0.786	S	S	*	*			trans	137.6	104.8	150.3	0	0	0	0	0	117
393	K	40.8	Very low	43	Very low	220 Å²	220	165 Å²	165	96%	0.957	80%	0.799	S	S	*	*				-170.2	146	121.4	-102.8	163.1	-174.7	176.7	0	111.7
394	E	40.9	Very low	43	Very low	177 Å²	177	162.9 Å²	162.9	83%	0.827	80%	0.795	S	S	*	*			trans	-117.8	156.1	-166.3	-177.3	-163.8	145.5	0	0	110.6
395	K	42.3	Very low	43.1	Very low	200 Å²	200	160.7 Å²	160.7	87%	0.87	80%	0.8	S	S	*	*			trans	148.4	146.3	154.3	-84	158.5	-174.2	-173.6	0	109.9
396	A	41.8	Very low	43.3	Very low	81 Å²	81	161.9 Å²	161.9	67%	0.669	81%	0.81	S	S	*	*			cis	-163.7	147	-25.2	0	0	0	0	0	107.5
397	P	36.4	Very low	42.9	Very low	126 Å²	126	163.9 Å²	163.9	82%	0.818	82%	0.817	S	S	*	*			trans	-82.6	146.8	-176.2	33.1	-35	0	0	0	112.9
398	R	47	Very low	42.8	Very low	235 Å²	235	159.8 Å²	159.8	89%	0.887	81%	0.812	S	S	*	*			trans	-140.7	104.8	169.5	-74.6	-162.8	171.7	-159.3	-3.2	115.1
399	K	45	Very low	42.6	Very low	202 Å²	202	157.5 Å²	157.5	88%	0.878	81%	0.812	S	S	*	*			trans	63.1	114.7	139.3	-58.8	-165.4	174.1	-169.3	0	120.5
400	F	48.5	Very low	42.9	Very low	185 Å²	185	156.2 Å²	156.2	81%	0.811	81%	0.809	S	S	*	*			trans	-43.8	153	149.4	-103.5	-129.1	0	0	0	113.8	K402	F400-K402 HydrophobicContact CD1-CB 3.98Å; F400-K402 HydrophobicContact CE1-CB 4.25Å
401	K	50	Low	43.3	Very low	215 Å²	215	158.5 Å²	158.5	94%	0.935	80%	0.8	S	S	*	*			trans	-139.2	115.1	132.9	-127.5	-174.9	-177.7	-173.3	0	107.9
402	K	45.2	Very low	44.4	Very low	139 Å²	139	159.3 Å²	159.3	60%	0.604	80%	0.797	S	S	*	*			trans	-95.3	139.6	177.7	175.9	177.4	177	-179.5	0	108.5	F400 D404	F400-K402 HydrophobicContact CD1-CB 3.98Å; F400-K402 HydrophobicContact CE1-CB 4.25Å; K402-D404 WeakPolarHBondContact CE-OD2 3.29Å; K402-D404 HydrophobicContact CG-CB 4.33Å; K402-D404 WeakPolarHBondContact CG-OD2 3.48Å
403	K	41	Very low	46.3	Very low	203 Å²	203	162.4 Å²	162.4	88%	0.883	79%	0.788	S	S	*	*			trans	-136.8	40.9	166.5	-156	-168.7	173.8	-176.4	0	111.6	S405	K403-S405 PolarHBondContact O-N 3.3Å
404	D	43.5	Very low	48.6	Very low	119 Å²	119	156.5 Å²	156.5	64%	0.636	77%	0.77	S	S	*	*			trans	-86	87	169.7	-35.9	-44.5	0	0	0	108.3	K402	K402-D404 WeakPolarHBondContact CE-OD2 3.29Å; K402-D404 HydrophobicContact CG-CB 4.33Å; K402-D404 WeakPolarHBondContact CG-OD2 3.48Å
405	S	43.6	Very low	50.9	Low	109 Å²	109	149.5 Å²	149.5	76%	0.762	74%	0.74	S	S	*	*			trans	-154.2	52.1	171.3	-79.8	0	0	0	0	111.7	K403	K403-S405 PolarHBondContact O-N 3.3Å
406	L	47.4	Very low	53.3	Low	164 Å²	164	144 Å²	144	86%	0.859	71%	0.714	S	S	*	*			trans	-140.1	81.3	149.4	-151.2	82	0	0	0	108.3	S408	L406-S408 VanDerWaalsContact C-N 3.33Å; L406-S408 PolarHBondContact O-N 3.42Å
407	R	35.8	Very low	55.7	Low	251 Å²	251	140.7 Å²	140.7	95%	0.947	69%	0.685	S	S	*	*			trans	-82.9	77.9	175.7	-77	174	153.4	-172.4	-10.3	109.3
408	S	38.4	Very low	58.3	Low	99 Å²	99	136.2 Å²	136.2	69%	0.692	65%	0.654	S	S	*	*			trans	-72.3	157.2	147.7	-64.9	0	0	0	0	108.2	L406 E410	L406-S408 VanDerWaalsContact C-N 3.33Å; L406-S408 PolarHBondContact O-N 3.42Å; S408-E410 PolarHBondContact O-N 2.89Å
409	A	40.8	Very low	60.4	Low	84 Å²	84	125.1 Å²	125.1	69%	0.694	61%	0.613	S	S	*	*			trans	-60.4	127.8	-178.6	0	0	0	0	0	110.8	E411	A409-E411 VanDerWaalsContact C-N 3.28Å; A409-E411 HydrophobicContact CB-CG 4.42Å; A409-E411 PolarHBondContact O-N 2.86Å; A409-E411 VanDerWaalsContact O-N 3.16Å
410	E	49.5	Very low	62.6	Low	190 Å²	190	118.8 Å²	118.8	89%	0.888	60%	0.604	S	S	*	*			trans	-73.5	95.6	152.6	-70.5	-178.9	150	0	0	104.9	S408 D412	S408-E410 PolarHBondContact O-N 2.89Å; E410-D412 PolarHBondContact O-N 3Å
411	E	50.1	Low	64.5	Low	118 Å²	118	113 Å²	113	55%	0.551	58%	0.579	S	S	*	*			trans	-59.9	121.8	175.3	-70.6	166.9	-177.3	0	0	108.5	A409 Y413	A409-E411 VanDerWaalsContact C-N 3.28Å; A409-E411 HydrophobicContact CB-CG 4.42Å; A409-E411 PolarHBondContact O-N 2.86Å; A409-E411 VanDerWaalsContact O-N 3.16Å; E411-Y413 HydrophobicContact CB-CD1 4.19Å; E411-Y413 HydrophobicContact CB-CE1 3.6Å; E411-Y413 HydrophobicContact CB-CE2 4.2Å; E411-Y413 WeakPolarHBondContact O-CD2 3.46Å; E411-Y413 PolarHBondContact O-N 3.28Å; E411-Y413 WeakPolarHBondContact OE2-CE1 3.43Å; E411-Y413 VanDerWaalsContact OE2-CZ 3.24Å; E411-Y413 PolarHBondContact OE2-OH 3.06Å
412	D	63.1	Low	66.3	Low	159 Å²	159	105.8 Å²	105.8	85%	0.85	57%	0.566	S	S	*	*			trans	-73	70	-177.1	-88.9	-49.6	0	0	0	110.8	E410 V414	E410-D412 PolarHBondContact O-N 3Å; D412-V414 PolarHBondContact O-N 3.03Å; D412-V414 VanDerWaalsContact O-N 3.11Å
413	Y	80.8	Confident	68.4	Low	134 Å²	134	101 Å²	101	53%	0.525	55%	0.545	S	S	.	.			trans	-55.7	114.2	-175.8	-62	-56.8	0	0	0	112.4	E411 T415 W437	E411-Y413 HydrophobicContact CB-CD1 4.19Å; E411-Y413 HydrophobicContact CB-CE1 3.6Å; E411-Y413 HydrophobicContact CB-CE2 4.2Å; E411-Y413 WeakPolarHBondContact O-CD2 3.46Å; E411-Y413 PolarHBondContact O-N 3.28Å; E411-Y413 WeakPolarHBondContact OE2-CE1 3.43Å; E411-Y413 VanDerWaalsContact OE2-CZ 3.24Å; E411-Y413 PolarHBondContact OE2-OH 3.06Å; Y413-T415 PolarHBondContact O-N 2.95Å; Y413-W437 AromaticContact CD1-NE1 3.77Å; Y413-W437 AromaticContact CG-NE1 3.94Å
414	V	89	Confident	70.5	Confident	97 Å²	97	97.5 Å²	97.5	59%	0.588	54%	0.537	S	S	*	.			trans	-80.7	106.5	-173.3	-178	0	0	0	0	111.2	D412 V436 W437	D412-V414 PolarHBondContact O-N 3.03Å; D412-V414 VanDerWaalsContact O-N 3.11Å; V414-V436 HydrophobicContact CG1-CG2 4.46Å; V414-V436 VanDerWaalsContact O-CA 3.31Å; V414-V436 WeakPolarHBondContact O-CA 3.35Å; V414-W437 PolarHBondContact O-N 3.2Å
415	T	90.3	Very high	72.5	Confident	30 Å²	30	93.1 Å²	93.1	18%	0.184	51%	0.513	C	S	.	.	B	Isolated β-bridge	trans	-86.3	112.9	173.4	-58.2	0	0	0	0	111.6	Y413 M428 W437	Y413-T415 PolarHBondContact O-N 2.95Å; T415-M428 HydrophobicContact CG2-CE 3.72Å; T415-W437 WeakPolarHBondContact CA-O 3.23Å
416	R	91.7	Very high	74.5	Confident	85 Å²	85	96 Å²	96	32%	0.321	52%	0.52	S	S	.	.			trans	-137.1	91.7	175.3	-176.2	-153.1	78.8	-142.7	-1.5	110.4	V436 W437 Q438 C456 E457	R416-V436 HydrophobicContact CB-CG1 3.68Å; R416-V436 WeakPolarHBondContact O-CG1 3.42Å; R416-W437 PolarHBondContact N-O 3.48Å; R416-Q438 PolarHBondContact O-NE2 3.13Å; R416-C456 PolarHBondContact NH2-SG 3.3Å; R416-E457 IonicContact CZ-OE1 3.54Å; R416-E457 IonicContact NE-OE1 2.7Å; R416-E457 PolarHBondContact NE-OE1 3Å; R416-E457 IonicContact NH2-OE1 3.84Å; R416-E457 PolarHBondContact NH2-OE1 2.84Å
417	C	93.3	Very high	76.6	Confident	11 Å²	11	91.3 Å²	91.3	7%	0.074	49%	0.493	C	S	.	.			trans	-110	155.2	178.5	-167.5	0	0	0	0	112.3	C419 G420 Q438 H439 C442	C417-C419 PolarHBondContact O-N 3.47Å; C417-G420 PolarHBondContact O-N 3.09Å; C417-Q438 HydrophobicContact CB-CB 4.24Å; C417-H439 PolarHBondContact SG-N 3.33Å; C417-H439 VanDerWaalsContact SG-N 3.35Å; C417-C442 VanDerWaalsContact SG-CB 3.5Å
418	L	89.8	Confident	79.4	Confident	32 Å²	32	80.8 Å²	80.8	17%	0.168	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-30.2	178.3	-60.7	168.4	0	0	0	115	G420 C442 L443 E457 L464 S468 A471	L418-G420 VanDerWaalsContact C-N 3.27Å; L418-G420 PolarHBondContact O-N 2.92Å; L418-C442 WeakPolarHBondContact CD1-O 3.48Å; L418-L443 HydrophobicContact CD1-CD2 3.8Å; L418-L443 HydrophobicContact CG-CD2 4.47Å; L418-E457 HydrophobicContact CD2-CB 4.33Å; L418-E457 HydrophobicContact CD2-CG 3.8Å; L418-L464 HydrophobicContact CD1-CB 4.5Å; L418-L464 HydrophobicContact CD1-CD1 3.54Å; L418-L464 HydrophobicContact CD1-CD2 4.28Å; L418-L464 HydrophobicContact CD1-CG 4.32Å; L418-L464 HydrophobicContact CD2-CD1 3.64Å; L418-L464 HydrophobicContact CG-CD1 4.19Å; L418-S468 WeakPolarHBondContact O-CB 3.48Å; L418-S468 PolarHBondContact O-OG 2.59Å; L418-A471 HydrophobicContact CB-CB 4.18Å
419	C	92.7	Very high	82	Confident	2 Å²	2	76.9 Å²	76.9	1%	0.014	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-12.5	-179.1	66.7	0	0	0	0	114.5	C417 F421 H439 A471 S472 Q475	C417-C419 PolarHBondContact O-N 3.47Å; C419-F421 VanDerWaalsContact C-N 3.3Å; C419-F421 HydrophobicContact CB-CD2 4.02Å; C419-F421 WeakPolarHBondContact O-CD2 3.05Å; C419-F421 PolarHBondContact O-N 2.91Å; C419-F421 PolarHBondContact SG-N 3Å; C419-F421 VanDerWaalsContact SG-N 3.38Å; C419-H439 VanDerWaalsContact SG-CE1 3.57Å; C419-H439 PolarHBondContact SG-ND1 2.99Å; C419-A471 VanDerWaalsContact CB-C 3.48Å; C419-A471 HydrophobicContact CB-CB 3.95Å; C419-A471 VanDerWaalsContact CB-O 3.31Å; C419-A471 WeakPolarHBondContact CB-O 3.28Å; C419-S472 VanDerWaalsContact O-CB 3.31Å; C419-S472 WeakPolarHBondContact O-CB 3.39Å; C419-S472 PolarHBondContact O-OG 3.19Å; C419-Q475 HydrophobicContact CB-CB 4.21Å; C419-Q475 HydrophobicContact CB-CG 3.87Å
420	G	89.4	Confident	84.6	Confident	68 Å²	68	76 Å²	76	70%	0.701	41%	0.408	S	S	*	.			trans	77.2	0.9	-175.9	0	0	0	0	0	115.7	C417 L418	C417-G420 PolarHBondContact O-N 3.09Å; L418-G420 VanDerWaalsContact C-N 3.27Å; L418-G420 PolarHBondContact O-N 2.92Å
421	F	88.9	Confident	86.8	Confident	64 Å²	64	67 Å²	67	28%	0.281	37%	0.365	S	S	.	.			trans	-98.4	101	-177.6	-64.6	-78.2	0	0	0	113.1	C419 H423 H439 S472 Q475 L479	C419-F421 VanDerWaalsContact C-N 3.3Å; C419-F421 HydrophobicContact CB-CD2 4.02Å; C419-F421 WeakPolarHBondContact O-CD2 3.05Å; C419-F421 PolarHBondContact O-N 2.91Å; C419-F421 PolarHBondContact SG-N 3Å; C419-F421 VanDerWaalsContact SG-N 3.38Å; F421-H423 VanDerWaalsContact CB-ND1 3.33Å; F421-H423 WeakPolarHBondContact CB-ND1 3.43Å; F421-H423 PolarHBondContact O-N 3.37Å; F421-H423 PolarHBondContact O-ND1 3.16Å; F421-H439 PolarHBondContact O-CE1 2.64Å; F421-H439 VanDerWaalsContact O-CE1 3.3Å; F421-S472 WeakPolarHBondContact CE2-O 3.37Å; F421-S472 VanDerWaalsContact CE2-OG 3.3Å; F421-S472 WeakPolarHBondContact CE2-OG 3.48Å; F421-Q475 HydrophobicContact CD2-CB 3.57Å; F421-Q475 HydrophobicContact CD2-CG 4.49Å; F421-Q475 HydrophobicContact CE2-CB 3.89Å; F421-Q475 HydrophobicContact CG-CB 4.49Å; F421-L479 HydrophobicContact CD1-CD1 3.92Å; F421-L479 HydrophobicContact CE1-CD1 4.11Å; F421-L479 HydrophobicContact CG-CD1 4.26Å
422	G	88.5	Confident	88.9	Confident	64 Å²	64	66 Å²	66	66%	0.66	36%	0.364	S	S	*	.			trans	-67.7	77.9	164.4	0	0	0	0	0	112.1
423	H	88.6	Confident	90.3	Very high	37 Å²	37	67 Å²	67	17%	0.171	36%	0.356	C	S	.	.			trans	-147.1	154.2	174.4	79.3	-57.1	0	0	0	110.1	F421 D425 H439 Q475 L479	F421-H423 VanDerWaalsContact CB-ND1 3.33Å; F421-H423 WeakPolarHBondContact CB-ND1 3.43Å; F421-H423 PolarHBondContact O-N 3.37Å; F421-H423 PolarHBondContact O-ND1 3.16Å; H423-D425 IonicContact NE2-OD1 3.19Å; H423-H439 AromaticContact CE1-CE1 3.46Å; H423-H439 PolarHBondContact CE1-CE1 2.96Å; H423-H439 VanDerWaalsContact CE1-CE1 3.46Å; H423-H439 AromaticContact CE1-NE2 3.56Å; H423-H439 AromaticContact ND1-CE1 3.44Å; H423-H439 PolarHBondContact ND1-CE1 3.4Å; H423-H439 AromaticContact ND1-NE2 3.49Å; H423-H439 PolarHBondContact ND1-NE2 2.79Å; H423-H439 PolarHBondContact O-NE2 2.75Å; H423-Q475 PolarHBondContact CE1-OE1 2.88Å; H423-L479 VanDerWaalsContact CD2-CD2 3.48Å; H423-L479 WeakPolarHBondContact CD2-CD2 3.46Å; H423-L479 WeakPolarHBondContact NE2-CG 3.35Å
424	N	86.5	Confident	90.9	Very high	131 Å²	131	63 Å²	63	70%	0.701	35%	0.346	S	S	*	.			trans	-93	130.3	-175.9	-57.7	20.9	0	0	0	109.8	M428	N424-M428 VanDerWaalsContact CA-SD 3.55Å; N424-M428 HydrophobicContact CB-SD 4.04Å
425	D	85.3	Confident	91.1	Very high	26 Å²	26	65.1 Å²	65.1	14%	0.139	35%	0.35	C	S	.	.			trans	-100.6	164.9	170.1	-99.9	-24.4	0	0	0	110	H423 F427 M428 H439 Q475 K478	H423-D425 IonicContact NE2-OD1 3.19Å; D425-F427 PolarHBondContact O-N 3.16Å; D425-M428 HydrophobicContact CB-CG 4Å; D425-M428 HydrophobicContact CB-SD 4.49Å; D425-M428 PolarHBondContact N-SD 2.93Å; D425-H439 IonicContact OD2-CD2 2.62Å; D425-H439 IonicContact OD2-CG 2.68Å; D425-Q475 PolarHBondContact OD2-NE2 2.8Å; D425-Q475 PolarHBondContact OD2-OE1 2.94Å; D425-K478 WeakPolarHBondContact OD1-CD 3.41Å; D425-K478 WeakPolarHBondContact OD1-CE 3.31Å; D425-K478 IonicContact OD1-NZ 3.43Å; D425-K478 PolarHBondContact OD1-NZ 3.02Å; D425-K478 WeakPolarHBondContact OD2-CE 3.39Å; D425-K478 IonicContact OD2-NZ 2.71Å; D425-K478 PolarHBondContact OD2-NZ 2.96Å
426	D	85.4	Confident	91.2	Very high	171 Å²	171	64.2 Å²	64.2	91%	0.914	34%	0.344	S	S	*	.	S	Bend	trans	-67.3	-14.3	174.9	-51.3	-50.2	0	0	0	113.4
427	F	91.9	Very high	91.4	Very high	65 Å²	65	63.6 Å²	63.6	29%	0.285	34%	0.342	S	S	.	.	S	Bend	trans	-138.7	107.9	176.9	-171.6	-129.4	0	0	0	111	D425 C440 P447 V450	D425-F427 PolarHBondContact O-N 3.16Å; F427-C440 HydrophobicContact CD1-CB 3.36Å; F427-C440 HydrophobicContact CE1-CB 3.25Å; F427-C440 VanDerWaalsContact CE1-SG 3.52Å; F427-C440 HydrophobicContact CG-CB 4.2Å; F427-C440 HydrophobicContact CZ-CB 4.03Å; F427-P447 HydrophobicContact CD1-CG 4.04Å; F427-P447 HydrophobicContact CE1-CB 4.27Å; F427-P447 HydrophobicContact CE1-CG 3.63Å; F427-P447 HydrophobicContact CZ-CB 4.08Å; F427-P447 HydrophobicContact CZ-CG 3.93Å; F427-V450 HydrophobicContact CZ-CG2 3.87Å
428	M	93.4	Very high	91.4	Very high	29 Å²	29	63.1 Å²	63.1	14%	0.143	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	156.7	-177.1	-65	-174.9	74.2	0	0	110.5	T415 N424 D425 W437 Q438 C440	T415-M428 HydrophobicContact CG2-CE 3.72Å; N424-M428 VanDerWaalsContact CA-SD 3.55Å; N424-M428 HydrophobicContact CB-SD 4.04Å; D425-M428 HydrophobicContact CB-CG 4Å; D425-M428 HydrophobicContact CB-SD 4.49Å; D425-M428 PolarHBondContact N-SD 2.93Å; M428-W437 HydrophobicContact CB-CE3 3.86Å; M428-W437 HydrophobicContact CB-CZ3 4.23Å; M428-W437 HydrophobicContact CE-CB 3.94Å; M428-Q438 CarbonylContact C-O 3.57Å; M428-Q438 WeakPolarHBondContact CA-O 3.43Å; M428-Q438 VanDerWaalsContact CB-O 3.31Å; M428-Q438 WeakPolarHBondContact CB-O 3.49Å; M428-C440 VanDerWaalsContact CA-SG 3.58Å
429	I	94.3	Very high	91.6	Very high	18 Å²	18	61.6 Å²	61.6	9%	0.092	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	143.2	178.8	-164.7	163.3	0	0	0	109.7	Q438 L443 I445 V450 Y454	I429-Q438 HydrophobicContact CG2-CB 4.39Å; I429-Q438 PolarHBondContact N-O 2.96Å; I429-Q438 PolarHBondContact O-N 3.31Å; I429-L443 HydrophobicContact CG2-CD1 3.65Å; I429-I445 HydrophobicContact CD1-CD1 4.01Å; I429-I445 HydrophobicContact CG2-CD1 4.38Å; I429-V450 HydrophobicContact CD1-CG1 3.97Å; I429-Y454 HydrophobicContact CB-CD1 4.42Å; I429-Y454 HydrophobicContact CD1-CD1 3.96Å; I429-Y454 HydrophobicContact CD1-CD2 3.77Å; I429-Y454 HydrophobicContact CD1-CG 3.44Å; I429-Y454 VanDerWaalsContact CD1-CG 3.44Å; I429-Y454 HydrophobicContact CG1-CD1 3.79Å; I429-Y454 HydrophobicContact CG1-CG 3.78Å; I429-Y454 HydrophobicContact CG2-CD1 3.88Å; I429-Y454 HydrophobicContact CG2-CE1 3.78Å; I429-Y454 HydrophobicContact CG2-CG 4.37Å
430	Q	94.4	Very high	91.6	Very high	66 Å²	66	61.5 Å²	61.5	31%	0.308	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	143.5	176.4	-166.2	176.6	17.1	0	0	109.5	E435 V436 W437 Y454	Q430-E435 WeakPolarHBondContact CG-O 3.15Å; Q430-E435 PolarHBondContact NE2-O 3.46Å; Q430-V436 WeakPolarHBondContact CA-O 3.32Å; Q430-W437 HydrophobicContact CB-CD2 3.98Å; Q430-W437 HydrophobicContact CB-CE3 4.25Å; Q430-W437 HydrophobicContact CB-CH2 4.2Å; Q430-W437 HydrophobicContact CB-CZ2 3.91Å; Q430-W437 HydrophobicContact CB-CZ3 4.36Å; Q430-W437 VanDerWaalsContact CD-NE1 3.34Å; Q430-W437 HydrophobicContact CG-CD2 4.22Å; Q430-W437 HydrophobicContact CG-CG 4.36Å; Q430-W437 HydrophobicContact CG-CZ2 4.2Å; Q430-Y454 WeakPolarHBondContact O-CD1 3.48Å
431	C	95.2	Very high	91.7	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.316	C	S	.	.			trans	-86.7	121.1	175.6	174.3	0	0	0	0	112.4	R433 C434 E435 V436 Y454 C456	C431-R433 PolarHBondContact O-N 2.99Å; C431-C434 PolarHBondContact O-N 3.41Å; C431-C434 VanDerWaalsContact SG-SG 3.64Å; C431-E435 VanDerWaalsContact O-CA 3.31Å; C431-E435 WeakPolarHBondContact O-CA 3.39Å; C431-E435 PolarHBondContact O-N 2.82Å; C431-V436 PolarHBondContact N-O 2.83Å; C431-Y454 CarbonylContact C-O 3.59Å; C431-Y454 WeakPolarHBondContact CA-O 3.29Å; C431-Y454 HydrophobicContact CB-CD1 4.34Å; C431-Y454 HydrophobicContact CB-CE1 4.41Å; C431-C456 HydrophobicContact CB-CB 3.94Å; C431-C456 PolarHBondContact SG-N 3.5Å
432	D	94.4	Very high	91.9	Very high	97 Å²	97	59.3 Å²	59.3	52%	0.519	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-20.7	-176.7	-49.4	-22.1	0	0	0	114.8	K453 Y454	D432-K453 WeakPolarHBondContact OD2-CA 3.36Å; D432-K453 WeakPolarHBondContact OD2-CB 3.38Å; D432-Y454 PolarHBondContact N-O 2.78Å; D432-Y454 PolarHBondContact OD2-N 2.95Å
433	R	91.8	Very high	92	Very high	181 Å²	181	56.8 Å²	56.8	68%	0.683	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-18.8	-174.3	-177.3	175	-178.3	-158.5	2.4	114.5	C431 L455 C459	C431-R433 PolarHBondContact O-N 2.99Å; R433-L455 HydrophobicContact CB-CD2 3.56Å; R433-C459 HydrophobicContact CB-CB 4.17Å; R433-C459 HydrophobicContact CG-CB 4.38Å; R433-C459 PolarHBondContact NH1-O 3.18Å
434	C	94.2	Very high	92	Very high	49 Å²	49	57.2 Å²	57.2	33%	0.331	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.5	8.1	-179.1	70	0	0	0	0	114.4	C431 V436 C459	C431-C434 PolarHBondContact O-N 3.41Å; C431-C434 VanDerWaalsContact SG-SG 3.64Å; C434-V436 PolarHBondContact O-N 3.48Å; C434-C459 PolarHBondContact SG-SG 3.29Å
435	E	92.7	Very high	92.2	Very high	142 Å²	142	52 Å²	52	66%	0.664	26%	0.256	S	S	*	.			trans	58.5	6.6	174.2	-64.5	167.4	-162.6	0	0	115.4	Q430 C431	Q430-E435 WeakPolarHBondContact CG-O 3.15Å; Q430-E435 PolarHBondContact NE2-O 3.46Å; C431-E435 VanDerWaalsContact O-CA 3.31Å; C431-E435 WeakPolarHBondContact O-CA 3.39Å; C431-E435 PolarHBondContact O-N 2.82Å
436	V	93.3	Very high	92.3	Very high	10 Å²	10	55.4 Å²	55.4	6%	0.061	27%	0.269	C	S	.	.			trans	-67.7	132.3	178.1	164	0	0	0	0	111.2	V414 R416 Q430 C431 C434 Q438	V414-V436 HydrophobicContact CG1-CG2 4.46Å; V414-V436 VanDerWaalsContact O-CA 3.31Å; V414-V436 WeakPolarHBondContact O-CA 3.35Å; R416-V436 HydrophobicContact CB-CG1 3.68Å; R416-V436 WeakPolarHBondContact O-CG1 3.42Å; Q430-V436 WeakPolarHBondContact CA-O 3.32Å; C431-V436 PolarHBondContact N-O 2.83Å; C434-V436 PolarHBondContact O-N 3.48Å; V436-Q438 HydrophobicContact CG1-CG 3.94Å
437	W	94.9	Very high	92.5	Very high	73 Å²	73	52 Å²	52	28%	0.277	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	137.7	175.3	-74.6	81.5	0	0	0	112.4	Y413 V414 T415 R416 M428 Q430	Y413-W437 AromaticContact CD1-NE1 3.77Å; Y413-W437 AromaticContact CG-NE1 3.94Å; V414-W437 PolarHBondContact O-N 3.2Å; T415-W437 WeakPolarHBondContact CA-O 3.23Å; R416-W437 PolarHBondContact N-O 3.48Å; M428-W437 HydrophobicContact CB-CE3 3.86Å; M428-W437 HydrophobicContact CB-CZ3 4.23Å; M428-W437 HydrophobicContact CE-CB 3.94Å; Q430-W437 HydrophobicContact CB-CD2 3.98Å; Q430-W437 HydrophobicContact CB-CE3 4.25Å; Q430-W437 HydrophobicContact CB-CH2 4.2Å; Q430-W437 HydrophobicContact CB-CZ2 3.91Å; Q430-W437 HydrophobicContact CB-CZ3 4.36Å; Q430-W437 VanDerWaalsContact CD-NE1 3.34Å; Q430-W437 HydrophobicContact CG-CD2 4.22Å; Q430-W437 HydrophobicContact CG-CG 4.36Å; Q430-W437 HydrophobicContact CG-CZ2 4.2Å
438	Q	94.1	Very high	92.3	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	152	-174.6	-52.3	-161.3	-61.6	0	0	112	R416 C417 M428 I429 V436 L443 Y454 E457	R416-Q438 PolarHBondContact O-NE2 3.13Å; C417-Q438 HydrophobicContact CB-CB 4.24Å; M428-Q438 CarbonylContact C-O 3.57Å; M428-Q438 WeakPolarHBondContact CA-O 3.43Å; M428-Q438 VanDerWaalsContact CB-O 3.31Å; M428-Q438 WeakPolarHBondContact CB-O 3.49Å; I429-Q438 HydrophobicContact CG2-CB 4.39Å; I429-Q438 PolarHBondContact N-O 2.96Å; I429-Q438 PolarHBondContact O-N 3.31Å; V436-Q438 HydrophobicContact CG1-CG 3.94Å; Q438-L443 HydrophobicContact CB-CD1 3.76Å; Q438-Y454 PolarHBondContact OE1-OH 2.84Å; Q438-E457 PolarHBondContact NE2-OE1 3.15Å; Q438-E457 PolarHBondContact NE2-OE2 3.39Å; Q438-E457 PolarHBondContact OE1-OE2 3.29Å
439	H	93.3	Very high	92	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	122.5	175.5	-49.3	123	0	0	0	110.7	C417 C419 F421 H423 D425 E441 C442 L443 Q475	C417-H439 PolarHBondContact SG-N 3.33Å; C417-H439 VanDerWaalsContact SG-N 3.35Å; C419-H439 VanDerWaalsContact SG-CE1 3.57Å; C419-H439 PolarHBondContact SG-ND1 2.99Å; F421-H439 PolarHBondContact O-CE1 2.64Å; F421-H439 VanDerWaalsContact O-CE1 3.3Å; H423-H439 AromaticContact CE1-CE1 3.46Å; H423-H439 PolarHBondContact CE1-CE1 2.96Å; H423-H439 VanDerWaalsContact CE1-CE1 3.46Å; H423-H439 AromaticContact CE1-NE2 3.56Å; H423-H439 AromaticContact ND1-CE1 3.44Å; H423-H439 PolarHBondContact ND1-CE1 3.4Å; H423-H439 AromaticContact ND1-NE2 3.49Å; H423-H439 PolarHBondContact ND1-NE2 2.79Å; H423-H439 PolarHBondContact O-NE2 2.75Å; D425-H439 IonicContact OD2-CD2 2.62Å; D425-H439 IonicContact OD2-CG 2.68Å; H439-E441 PolarHBondContact O-N 3.2Å; H439-C442 HydrophobicContact CB-CB 4.15Å; H439-C442 PolarHBondContact O-N 3.34Å; H439-L443 PolarHBondContact O-N 2.94Å; H439-Q475 PolarHBondContact ND1-NE2 3.3Å
440	C	92.9	Very high	91.8	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.007	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-57	-39.9	178.9	-55.8	0	0	0	0	112.1	F427 M428 C442 L443 A444 I445	F427-C440 HydrophobicContact CD1-CB 3.36Å; F427-C440 HydrophobicContact CE1-CB 3.25Å; F427-C440 VanDerWaalsContact CE1-SG 3.52Å; F427-C440 HydrophobicContact CG-CB 4.2Å; F427-C440 HydrophobicContact CZ-CB 4.03Å; M428-C440 VanDerWaalsContact CA-SG 3.58Å; C440-C442 VanDerWaalsContact C-N 3.29Å; C440-C442 PolarHBondContact O-N 3.45Å; C440-L443 CarbonylContact O-C 3.42Å; C440-L443 WeakPolarHBondContact O-CA 3.37Å; C440-L443 WeakPolarHBondContact O-CB 3.49Å; C440-L443 PolarHBondContact O-N 3.14Å; C440-A444 PolarHBondContact O-N 2.81Å; C440-A444 VanDerWaalsContact O-N 3.1Å; C440-I445 HydrophobicContact CB-CB 4.01Å; C440-I445 HydrophobicContact CB-CG2 4.23Å; C440-I445 WeakPolarHBondContact CB-O 3.37Å; C440-I445 PolarHBondContact O-N 3.46Å
441	E	91.6	Very high	91.5	Very high	86 Å²	86	61.4 Å²	61.4	40%	0.402	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-58.9	-36.4	177	-72.8	173.4	-158.4	0	0	113.1	H439 L443 A444 F466 K478	H439-E441 PolarHBondContact O-N 3.2Å; E441-L443 PolarHBondContact O-N 3.44Å; E441-A444 PolarHBondContact O-N 3.27Å; E441-F466 VanDerWaalsContact O-CE2 3.25Å; E441-F466 WeakPolarHBondContact O-CE2 3.44Å; E441-K478 IonicContact OE1-NZ 2.72Å; E441-K478 PolarHBondContact OE1-NZ 3.18Å; E441-K478 IonicContact OE2-NZ 3.49Å; E441-K478 PolarHBondContact OE2-NZ 2.63Å
442	C	92.7	Very high	91.2	Very high	0 Å²	0	71 Å²	71	0%	0	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-74.3	-16.7	177.9	-65.8	0	0	0	0	112.7	C417 L418 H439 C440 A471 Q475	C417-C442 VanDerWaalsContact SG-CB 3.5Å; L418-C442 WeakPolarHBondContact CD1-O 3.48Å; H439-C442 HydrophobicContact CB-CB 4.15Å; H439-C442 PolarHBondContact O-N 3.34Å; C440-C442 VanDerWaalsContact C-N 3.29Å; C440-C442 PolarHBondContact O-N 3.45Å; C442-A471 HydrophobicContact CB-CB 4.01Å; C442-Q475 VanDerWaalsContact SG-CG 3.51Å
443	L	91.4	Very high	91	Very high	11 Å²	11	74.5 Å²	74.5	6%	0.058	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-101	0.4	178.3	-62	163.3	0	0	0	112.2	L418 I429 Q438 H439 C440 E441 I445 Y454 L464	L418-L443 HydrophobicContact CD1-CD2 3.8Å; L418-L443 HydrophobicContact CG-CD2 4.47Å; I429-L443 HydrophobicContact CG2-CD1 3.65Å; Q438-L443 HydrophobicContact CB-CD1 3.76Å; H439-L443 PolarHBondContact O-N 2.94Å; C440-L443 CarbonylContact O-C 3.42Å; C440-L443 WeakPolarHBondContact O-CA 3.37Å; C440-L443 WeakPolarHBondContact O-CB 3.49Å; C440-L443 PolarHBondContact O-N 3.14Å; E441-L443 PolarHBondContact O-N 3.44Å; L443-I445 HydrophobicContact CB-CD1 3.99Å; L443-I445 HydrophobicContact CB-CG1 3.97Å; L443-I445 HydrophobicContact CD1-CD1 4.15Å; L443-I445 PolarHBondContact O-N 2.83Å; L443-Y454 HydrophobicContact CD1-CE1 4.25Å; L443-Y454 HydrophobicContact CD1-CE2 4.31Å; L443-Y454 WeakPolarHBondContact CD1-OH 3.32Å; L443-Y454 VanDerWaalsContact CD2-OH 3.23Å; L443-Y454 WeakPolarHBondContact CD2-OH 3.38Å; L443-L464 HydrophobicContact CD2-CD2 3.97Å
444	A	88.9	Confident	91.1	Very high	45 Å²	45	66.3 Å²	66.3	37%	0.372	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	19.6	-167.7	0	0	0	0	0	115.7	C440 E441 K446 P465 F466	C440-A444 PolarHBondContact O-N 2.81Å; C440-A444 VanDerWaalsContact O-N 3.1Å; E441-A444 PolarHBondContact O-N 3.27Å; A444-K446 PolarHBondContact O-N 2.96Å; A444-P465 HydrophobicContact CB-CG 3.43Å; A444-P465 VanDerWaalsContact CB-CG 3.43Å; A444-F466 HydrophobicContact CB-CD2 4.25Å; A444-F466 HydrophobicContact CB-CE2 3.77Å
445	I	90.8	Very high	91	Very high	22 Å²	22	66.2 Å²	66.2	11%	0.113	34%	0.343	C	S	.	.			trans	-74.9	111	175.1	-65.8	175.6	0	0	0	108.4	I429 C440 L443 V450 Y454	I429-I445 HydrophobicContact CD1-CD1 4.01Å; I429-I445 HydrophobicContact CG2-CD1 4.38Å; C440-I445 HydrophobicContact CB-CB 4.01Å; C440-I445 HydrophobicContact CB-CG2 4.23Å; C440-I445 WeakPolarHBondContact CB-O 3.37Å; C440-I445 PolarHBondContact O-N 3.46Å; L443-I445 HydrophobicContact CB-CD1 3.99Å; L443-I445 HydrophobicContact CB-CG1 3.97Å; L443-I445 HydrophobicContact CD1-CD1 4.15Å; L443-I445 PolarHBondContact O-N 2.83Å; I445-V450 HydrophobicContact CG2-CG2 4.02Å; I445-Y454 HydrophobicContact CD1-CD2 3.77Å; I445-Y454 HydrophobicContact CD1-CE2 3.49Å; I445-Y454 VanDerWaalsContact CD1-CE2 3.49Å
446	K	87.8	Confident	91.1	Very high	97 Å²	97	59.4 Å²	59.4	42%	0.422	31%	0.312	S	S	.	.			trans	-79.2	149.2	172.2	-65.4	177.9	178.5	176.5	0	109.3	A444 T448 N449 E628	A444-K446 PolarHBondContact O-N 2.96Å; K446-T448 PolarHBondContact O-N 2.95Å; K446-N449 CarbonylContact O-C 3.57Å; K446-N449 PolarHBondContact O-N 3.04Å; K446-E628 VanDerWaalsContact NZ-CD 3.34Å; K446-E628 IonicContact NZ-OE1 3.57Å; K446-E628 PolarHBondContact NZ-OE1 3.24Å; K446-E628 IonicContact NZ-OE2 2.64Å; K446-E628 PolarHBondContact NZ-OE2 3.16Å
447	P	88.1	Confident	90.9	Very high	100 Å²	100	60.4 Å²	60.4	65%	0.649	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-21.5	172.4	-25.6	33.8	0	0	0	114.9	F427	F427-P447 HydrophobicContact CD1-CG 4.04Å; F427-P447 HydrophobicContact CE1-CB 4.27Å; F427-P447 HydrophobicContact CE1-CG 3.63Å; F427-P447 HydrophobicContact CZ-CB 4.08Å; F427-P447 HydrophobicContact CZ-CG 3.93Å
448	T	88.2	Confident	90.7	Very high	128 Å²	128	62.4 Å²	62.4	79%	0.785	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-4.6	177.2	57.8	0	0	0	0	114.3	K446	K446-T448 PolarHBondContact O-N 2.95Å
449	N	87.2	Confident	90.7	Very high	121 Å²	121	63.1 Å²	63.1	65%	0.647	34%	0.335	S	S	*	.			trans	-145.8	63.8	-178.6	-171.3	14.1	0	0	0	109.6	K446	K446-N449 CarbonylContact O-C 3.57Å; K446-N449 PolarHBondContact O-N 3.04Å
450	V	89.7	Confident	90.5	Very high	71 Å²	71	67.4 Å²	67.4	43%	0.43	36%	0.355	S	S	.	.			trans	-94.5	121.5	170.7	-178.4	0	0	0	0	107.1	F427 I429 I445	F427-V450 HydrophobicContact CZ-CG2 3.87Å; I429-V450 HydrophobicContact CD1-CG1 3.97Å; I445-V450 HydrophobicContact CG2-CG2 4.02Å
451	P	88.4	Confident	90.3	Very high	56 Å²	56	72.8 Å²	72.8	36%	0.364	39%	0.391	S	S	.	.			trans	-72.8	147.7	178.9	31.6	-35.4	0	0	0	111	K453 Y454	P451-K453 WeakPolarHBondContact CB-O 3.01Å; P451-K453 PolarHBondContact O-N 3.47Å; P451-Y454 HydrophobicContact CG-CD2 4.18Å
452	E	88.5	Confident	89.9	Confident	200 Å²	200	72.8 Å²	72.8	94%	0.935	39%	0.387	S	S	*	.	S	Bend	trans	-61	-24.5	177.6	-63.7	-176.7	167.6	0	0	113.7
453	K	91	Very high	89.3	Confident	171 Å²	171	79.2 Å²	79.2	74%	0.743	43%	0.43	S	S	*	.	S	Bend	trans	-130.2	131.2	174	-65.7	-179.1	-177.4	175.5	0	108.8	D432 P451	D432-K453 WeakPolarHBondContact OD2-CA 3.36Å; D432-K453 WeakPolarHBondContact OD2-CB 3.38Å; P451-K453 WeakPolarHBondContact CB-O 3.01Å; P451-K453 PolarHBondContact O-N 3.47Å
454	Y	93.1	Very high	89.1	Confident	9 Å²	9	80.7 Å²	80.7	4%	0.035	44%	0.438	C	S	.	.			trans	-124.6	120.9	-177.4	-177.8	-101.7	0	0	0	113.2	I429 Q430 C431 D432 Q438 L443 I445 P451 C456 R462	I429-Y454 HydrophobicContact CB-CD1 4.42Å; I429-Y454 HydrophobicContact CD1-CD1 3.96Å; I429-Y454 HydrophobicContact CD1-CD2 3.77Å; I429-Y454 HydrophobicContact CD1-CG 3.44Å; I429-Y454 VanDerWaalsContact CD1-CG 3.44Å; I429-Y454 HydrophobicContact CG1-CD1 3.79Å; I429-Y454 HydrophobicContact CG1-CG 3.78Å; I429-Y454 HydrophobicContact CG2-CD1 3.88Å; I429-Y454 HydrophobicContact CG2-CE1 3.78Å; I429-Y454 HydrophobicContact CG2-CG 4.37Å; Q430-Y454 WeakPolarHBondContact O-CD1 3.48Å; C431-Y454 CarbonylContact C-O 3.59Å; C431-Y454 WeakPolarHBondContact CA-O 3.29Å; C431-Y454 HydrophobicContact CB-CD1 4.34Å; C431-Y454 HydrophobicContact CB-CE1 4.41Å; D432-Y454 PolarHBondContact N-O 2.78Å; D432-Y454 PolarHBondContact OD2-N 2.95Å; Q438-Y454 PolarHBondContact OE1-OH 2.84Å; L443-Y454 HydrophobicContact CD1-CE1 4.25Å; L443-Y454 HydrophobicContact CD1-CE2 4.31Å; L443-Y454 WeakPolarHBondContact CD1-OH 3.32Å; L443-Y454 VanDerWaalsContact CD2-OH 3.23Å; L443-Y454 WeakPolarHBondContact CD2-OH 3.38Å; I445-Y454 HydrophobicContact CD1-CD2 3.77Å; I445-Y454 HydrophobicContact CD1-CE2 3.49Å; I445-Y454 VanDerWaalsContact CD1-CE2 3.49Å; P451-Y454 HydrophobicContact CG-CD2 4.18Å; Y454-C456 HydrophobicContact CE1-CB 4.44Å; Y454-R462 PolarHBondContact OH-NH2 2.69Å
455	L	93.6	Very high	88.7	Confident	47 Å²	47	82.8 Å²	82.8	25%	0.246	45%	0.448	C	S	.	.			trans	-109	134.4	171.9	-59.9	-178.7	0	0	0	110.4	R433 C459 E460 R462	R433-L455 HydrophobicContact CB-CD2 3.56Å; L455-C459 HydrophobicContact CB-CB 4.13Å; L455-C459 HydrophobicContact CD2-CB 4.28Å; L455-E460 HydrophobicContact CB-CB 3.5Å; L455-E460 HydrophobicContact CD1-CB 3.84Å; L455-E460 HydrophobicContact CD1-CG 4.49Å; L455-E460 HydrophobicContact CG-CB 4.32Å; L455-R462 VanDerWaalsContact O-CZ 3.27Å; L455-R462 PolarHBondContact O-NH1 2.68Å; L455-R462 PolarHBondContact O-NH2 2.83Å
456	C	93.3	Very high	88.5	Confident	0 Å²	0	85 Å²	85	0%	0	46%	0.457	C	S	.	.			trans	-73.2	166.2	172.7	69.2	0	0	0	0	111.6	R416 C431 Y454 I458 C459 E460	R416-C456 PolarHBondContact NH2-SG 3.3Å; C431-C456 HydrophobicContact CB-CB 3.94Å; C431-C456 PolarHBondContact SG-N 3.5Å; Y454-C456 HydrophobicContact CE1-CB 4.44Å; C456-I458 PolarHBondContact O-N 2.91Å; C456-C459 PolarHBondContact O-N 2.88Å; C456-E460 PolarHBondContact O-N 2.85Å
457	E	89.2	Confident	88.5	Confident	31 Å²	31	84.1 Å²	84.1	15%	0.145	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-17.3	-178.5	70.3	-67.8	148.3	0	0	116.5	R416 L418 Q438 P461 L464	R416-E457 IonicContact CZ-OE1 3.54Å; R416-E457 IonicContact NE-OE1 2.7Å; R416-E457 PolarHBondContact NE-OE1 3Å; R416-E457 IonicContact NH2-OE1 3.84Å; R416-E457 PolarHBondContact NH2-OE1 2.84Å; L418-E457 HydrophobicContact CD2-CB 4.33Å; L418-E457 HydrophobicContact CD2-CG 3.8Å; Q438-E457 PolarHBondContact NE2-OE1 3.15Å; Q438-E457 PolarHBondContact NE2-OE2 3.39Å; Q438-E457 PolarHBondContact OE1-OE2 3.29Å; E457-P461 WeakPolarHBondContact O-CA 3.3Å; E457-L464 HydrophobicContact CB-CD1 3.69Å
458	I	91.3	Very high	88.6	Confident	114 Å²	114	83 Å²	83	59%	0.585	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-23	177.7	-78.2	157.9	0	0	0	111.7	C456	C456-I458 PolarHBondContact O-N 2.91Å
459	C	93.8	Very high	88.6	Confident	16 Å²	16	84.8 Å²	84.8	11%	0.108	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-29.6	173.8	-76.4	0	0	0	0	112.6	R433 C434 L455 C456	R433-C459 HydrophobicContact CB-CB 4.17Å; R433-C459 HydrophobicContact CG-CB 4.38Å; R433-C459 PolarHBondContact NH1-O 3.18Å; C434-C459 PolarHBondContact SG-SG 3.29Å; L455-C459 HydrophobicContact CB-CB 4.13Å; L455-C459 HydrophobicContact CD2-CB 4.28Å; C456-C459 PolarHBondContact O-N 2.88Å
460	E	90	Very high	88.8	Confident	89 Å²	89	83.6 Å²	83.6	42%	0.416	44%	0.444	S	S	.	.	S	Bend	trans	-142.3	97.1	174.4	-178.4	-174.4	-114.2	0	0	108.2	L455 C456 R462	L455-E460 HydrophobicContact CB-CB 3.5Å; L455-E460 HydrophobicContact CD1-CB 3.84Å; L455-E460 HydrophobicContact CD1-CG 4.49Å; L455-E460 HydrophobicContact CG-CB 4.32Å; C456-E460 PolarHBondContact O-N 2.85Å; E460-R462 PolarHBondContact O-N 3.04Å; E460-R462 IonicContact OE2-CZ 2.69Å; E460-R462 IonicContact OE2-NH1 2.67Å; E460-R462 PolarHBondContact OE2-NH1 3.23Å
461	P	87.4	Confident	88.9	Confident	115 Å²	115	80.2 Å²	80.2	75%	0.747	42%	0.424	S	S	*	.			trans	-65	117.8	177.3	-23.4	35.5	0	0	0	111.4	E457	E457-P461 WeakPolarHBondContact O-CA 3.3Å
462	R	83.8	Confident	89.1	Confident	85 Å²	85	79.4 Å²	79.4	32%	0.321	42%	0.419	S	S	.	.			trans	-142.7	153.6	177.8	61.9	177.6	177	-93.3	-17.4	111.6	Y454 L455 E460 L464	Y454-R462 PolarHBondContact OH-NH2 2.69Å; L455-R462 VanDerWaalsContact O-CZ 3.27Å; L455-R462 PolarHBondContact O-NH1 2.68Å; L455-R462 PolarHBondContact O-NH2 2.83Å; E460-R462 PolarHBondContact O-N 3.04Å; E460-R462 IonicContact OE2-CZ 2.69Å; E460-R462 IonicContact OE2-NH1 2.67Å; E460-R462 PolarHBondContact OE2-NH1 3.23Å; R462-L464 HydrophobicContact CG-CG 4.49Å; R462-L464 PolarHBondContact O-N 2.81Å; R462-L464 VanDerWaalsContact O-N 3.16Å
463	C	80.1	Confident	89.2	Confident	136 Å²	136	76.1 Å²	76.1	92%	0.919	40%	0.404	S	S	*	.			trans	-67.3	110.9	171.6	-65.5	0	0	0	0	109.9
464	L	86.2	Confident	89.2	Confident	42 Å²	42	71.7 Å²	71.7	22%	0.22	39%	0.388	C	S	.	.			trans	-88.9	142.5	178.9	-71.4	153.8	0	0	0	110.4	L418 L443 E457 R462 F466	L418-L464 HydrophobicContact CD1-CB 4.5Å; L418-L464 HydrophobicContact CD1-CD1 3.54Å; L418-L464 HydrophobicContact CD1-CD2 4.28Å; L418-L464 HydrophobicContact CD1-CG 4.32Å; L418-L464 HydrophobicContact CD2-CD1 3.64Å; L418-L464 HydrophobicContact CG-CD1 4.19Å; L443-L464 HydrophobicContact CD2-CD2 3.97Å; E457-L464 HydrophobicContact CB-CD1 3.69Å; R462-L464 HydrophobicContact CG-CG 4.49Å; R462-L464 PolarHBondContact O-N 2.81Å; R462-L464 VanDerWaalsContact O-N 3.16Å; L464-F466 PolarHBondContact O-N 2.77Å
465	P	81.3	Confident	89.1	Confident	89 Å²	89	71.2 Å²	71.2	58%	0.578	39%	0.386	S	S	*	.	S	Bend	trans	-75	-5.4	-175.7	30.5	-36.4	0	0	0	114.3	A444	A444-P465 HydrophobicContact CB-CG 3.43Å; A444-P465 VanDerWaalsContact CB-CG 3.43Å
466	F	86.5	Confident	88.9	Confident	67 Å²	67	71.2 Å²	71.2	29%	0.294	39%	0.39	S	S	.	.	S	Bend	trans	-123	134.5	172.4	-64	-57	0	0	0	110.4	E441 A444 L464 E470 L474	E441-F466 VanDerWaalsContact O-CE2 3.25Å; E441-F466 WeakPolarHBondContact O-CE2 3.44Å; A444-F466 HydrophobicContact CB-CD2 4.25Å; A444-F466 HydrophobicContact CB-CE2 3.77Å; L464-F466 PolarHBondContact O-N 2.77Å; F466-E470 HydrophobicContact CB-CB 4.49Å; F466-E470 HydrophobicContact CD1-CB 4.47Å; F466-L474 HydrophobicContact CD1-CD1 4.4Å; F466-L474 HydrophobicContact CE1-CD1 4.24Å; F466-L474 HydrophobicContact CE2-CD1 4.33Å; F466-L474 HydrophobicContact CZ-CD1 4.2Å
467	T	88.5	Confident	88.7	Confident	80 Å²	80	75.1 Å²	75.1	49%	0.491	41%	0.413	S	S	.	.			trans	-69.5	161	165.9	64.1	0	0	0	0	111.1	E469 E470 A471	T467-E469 PolarHBondContact O-N 2.92Å; T467-E470 VanDerWaalsContact CB-OE2 3.31Å; T467-E470 WeakPolarHBondContact CB-OE2 3.32Å; T467-E470 WeakPolarHBondContact CG2-OE2 3.36Å; T467-E470 PolarHBondContact N-OE2 3.09Å; T467-E470 PolarHBondContact O-N 2.76Å; T467-E470 VanDerWaalsContact OG1-CD 3.27Å; T467-E470 VanDerWaalsContact OG1-CG 3.32Å; T467-E470 WeakPolarHBondContact OG1-CG 3.49Å; T467-E470 PolarHBondContact OG1-N 2.83Å; T467-E470 PolarHBondContact OG1-OE2 2.7Å; T467-A471 WeakPolarHBondContact O-CB 3.5Å; T467-A471 PolarHBondContact O-N 2.77Å
468	S	88.7	Confident	88.6	Confident	76 Å²	76	76 Å²	76	53%	0.531	42%	0.417	S	S	.	.	H	α-helix	trans	-58.4	-35.6	175.2	-178.5	0	0	0	0	112.4	L418 S472	L418-S468 WeakPolarHBondContact O-CB 3.48Å; L418-S468 PolarHBondContact O-OG 2.59Å; S468-S472 VanDerWaalsContact O-CB 3.23Å; S468-S472 WeakPolarHBondContact O-CB 3.31Å; S468-S472 PolarHBondContact O-N 3.05Å
469	E	90	Very high	88.4	Confident	166 Å²	166	72.4 Å²	72.4	78%	0.776	40%	0.398	S	S	*	.	H	α-helix	trans	-66.1	-42.3	176.4	-64.7	-165.4	173.6	0	0	112.3	T467 S472 H473	T467-E469 PolarHBondContact O-N 2.92Å; E469-S472 PolarHBondContact O-N 3.36Å; E469-H473 WeakPolarHBondContact O-CB 3.43Å; E469-H473 PolarHBondContact O-N 3.38Å
470	E	90.3	Very high	88	Confident	96 Å²	96	75.2 Å²	75.2	45%	0.449	41%	0.413	S	S	.	.	H	α-helix	trans	-68.2	-46.2	177.3	-70.3	161.7	134	0	0	111.7	F466 T467 S472 H473 L474	F466-E470 HydrophobicContact CB-CB 4.49Å; F466-E470 HydrophobicContact CD1-CB 4.47Å; T467-E470 VanDerWaalsContact CB-OE2 3.31Å; T467-E470 WeakPolarHBondContact CB-OE2 3.32Å; T467-E470 WeakPolarHBondContact CG2-OE2 3.36Å; T467-E470 PolarHBondContact N-OE2 3.09Å; T467-E470 PolarHBondContact O-N 2.76Å; T467-E470 VanDerWaalsContact OG1-CD 3.27Å; T467-E470 VanDerWaalsContact OG1-CG 3.32Å; T467-E470 WeakPolarHBondContact OG1-CG 3.49Å; T467-E470 PolarHBondContact OG1-N 2.83Å; T467-E470 PolarHBondContact OG1-OE2 2.7Å; E470-S472 VanDerWaalsContact C-N 3.26Å; E470-S472 PolarHBondContact O-N 2.97Å; E470-H473 WeakPolarHBondContact O-CB 3.3Å; E470-H473 PolarHBondContact O-N 3.48Å; E470-L474 WeakPolarHBondContact O-CG 3.26Å; E470-L474 PolarHBondContact O-N 2.04Å
471	A	91.7	Very high	87.6	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-57.7	-40.4	173.6	0	0	0	0	0	111.4	L418 C419 C442 T467 Q475	L418-A471 HydrophobicContact CB-CB 4.18Å; C419-A471 VanDerWaalsContact CB-C 3.48Å; C419-A471 HydrophobicContact CB-CB 3.95Å; C419-A471 VanDerWaalsContact CB-O 3.31Å; C419-A471 WeakPolarHBondContact CB-O 3.28Å; C442-A471 HydrophobicContact CB-CB 4.01Å; T467-A471 WeakPolarHBondContact O-CB 3.5Å; T467-A471 PolarHBondContact O-N 2.77Å; A471-Q475 PolarHBondContact O-N 3.42Å; A471-Q475 VanDerWaalsContact O-N 3.17Å
472	S	92.6	Very high	87	Confident	38 Å²	38	72.2 Å²	72.2	27%	0.266	41%	0.408	S	S	.	.	H	α-helix	trans	-69.1	-36.2	174.7	-154.9	0	0	0	0	112.3	C419 F421 S468 E469 E470 S476	C419-S472 VanDerWaalsContact O-CB 3.31Å; C419-S472 WeakPolarHBondContact O-CB 3.39Å; C419-S472 PolarHBondContact O-OG 3.19Å; F421-S472 WeakPolarHBondContact CE2-O 3.37Å; F421-S472 VanDerWaalsContact CE2-OG 3.3Å; F421-S472 WeakPolarHBondContact CE2-OG 3.48Å; S468-S472 VanDerWaalsContact O-CB 3.23Å; S468-S472 WeakPolarHBondContact O-CB 3.31Å; S468-S472 PolarHBondContact O-N 3.05Å; E469-S472 PolarHBondContact O-N 3.36Å; E470-S472 VanDerWaalsContact C-N 3.26Å; E470-S472 PolarHBondContact O-N 2.97Å; S472-S476 WeakPolarHBondContact O-CB 3.33Å; S472-S476 PolarHBondContact O-N 2.97Å
473	H	90.9	Very high	86.5	Confident	132 Å²	132	72.8 Å²	72.8	61%	0.611	41%	0.413	S	S	*	.	H	α-helix	trans	-63.3	-50.6	174.5	-163.3	123.7	0	0	0	111.4	E469 E470 Q475 S476 V477	E469-H473 WeakPolarHBondContact O-CB 3.43Å; E469-H473 PolarHBondContact O-N 3.38Å; E470-H473 WeakPolarHBondContact O-CB 3.3Å; E470-H473 PolarHBondContact O-N 3.48Å; H473-Q475 PolarHBondContact O-N 3.09Å; H473-S476 PolarHBondContact O-N 3.36Å; H473-V477 WeakPolarHBondContact O-CG2 3.41Å; H473-V477 PolarHBondContact O-N 3.45Å
474	L	90.4	Very high	85.5	Confident	77 Å²	77	72 Å²	72	40%	0.403	40%	0.395	S	S	.	.	H	α-helix	trans	-52.9	-52.6	178.1	-71.2	169.7	0	0	0	110.7	F466 E470 V477 K478	F466-L474 HydrophobicContact CD1-CD1 4.4Å; F466-L474 HydrophobicContact CE1-CD1 4.24Å; F466-L474 HydrophobicContact CE2-CD1 4.33Å; F466-L474 HydrophobicContact CZ-CD1 4.2Å; E470-L474 WeakPolarHBondContact O-CG 3.26Å; E470-L474 PolarHBondContact O-N 2.04Å; L474-V477 PolarHBondContact O-N 3.34Å; L474-K478 PolarHBondContact O-N 2.9Å
475	Q	90.3	Very high	84.2	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-68.5	-36.6	-179.1	-72.8	-64.7	1	0	0	113.6	C419 F421 H423 D425 H439 C442 A471 H473 V477 K478 L479	C419-Q475 HydrophobicContact CB-CB 4.21Å; C419-Q475 HydrophobicContact CB-CG 3.87Å; F421-Q475 HydrophobicContact CD2-CB 3.57Å; F421-Q475 HydrophobicContact CD2-CG 4.49Å; F421-Q475 HydrophobicContact CE2-CB 3.89Å; F421-Q475 HydrophobicContact CG-CB 4.49Å; H423-Q475 PolarHBondContact CE1-OE1 2.88Å; D425-Q475 PolarHBondContact OD2-NE2 2.8Å; D425-Q475 PolarHBondContact OD2-OE1 2.94Å; H439-Q475 PolarHBondContact ND1-NE2 3.3Å; C442-Q475 VanDerWaalsContact SG-CG 3.51Å; A471-Q475 PolarHBondContact O-N 3.42Å; A471-Q475 VanDerWaalsContact O-N 3.17Å; H473-Q475 PolarHBondContact O-N 3.09Å; Q475-V477 VanDerWaalsContact C-N 3.31Å; Q475-V477 PolarHBondContact O-N 3.1Å; Q475-K478 PolarHBondContact O-N 3.33Å; Q475-L479 VanDerWaalsContact O-CB 3.27Å; Q475-L479 WeakPolarHBondContact O-CB 3.25Å; Q475-L479 WeakPolarHBondContact O-CG 3.49Å; Q475-L479 PolarHBondContact O-N 3.43Å
476	S	90.7	Very high	83.1	Confident	46 Å²	46	71.4 Å²	71.4	32%	0.322	40%	0.399	S	S	.	.	H	α-helix	trans	-60.4	-41.4	172.7	-174.7	0	0	0	0	111.6	S472 H473 N480	S472-S476 WeakPolarHBondContact O-CB 3.33Å; S472-S476 PolarHBondContact O-N 2.97Å; H473-S476 PolarHBondContact O-N 3.36Å; S476-N480 VanDerWaalsContact O-CB 3.26Å; S476-N480 WeakPolarHBondContact O-CB 3.33Å; S476-N480 PolarHBondContact O-N 2.85Å; S476-N480 PolarHBondContact O-ND2 2.85Å
477	V	88.9	Confident	81.8	Confident	83 Å²	83	73.7 Å²	73.7	50%	0.503	41%	0.409	S	S	.	.	H	α-helix	trans	-65.4	-47.6	175.8	170.2	0	0	0	0	111.3	H473 L474 Q475 N480 A481	H473-V477 WeakPolarHBondContact O-CG2 3.41Å; H473-V477 PolarHBondContact O-N 3.45Å; L474-V477 PolarHBondContact O-N 3.34Å; Q475-V477 VanDerWaalsContact C-N 3.31Å; Q475-V477 PolarHBondContact O-N 3.1Å; V477-N480 PolarHBondContact O-N 3.08Å; V477-N480 VanDerWaalsContact O-N 3.13Å; V477-A481 PolarHBondContact O-N 3.15Å
478	K	88.1	Confident	80.4	Confident	49 Å²	49	73.5 Å²	73.5	21%	0.213	41%	0.407	C	S	.	.	H	α-helix	trans	-56.2	-54.1	177.2	-165.4	176.4	-172.1	170.9	0	111.5	D425 E441 L474 Q475 N480 A481 S482	D425-K478 WeakPolarHBondContact OD1-CD 3.41Å; D425-K478 WeakPolarHBondContact OD1-CE 3.31Å; D425-K478 IonicContact OD1-NZ 3.43Å; D425-K478 PolarHBondContact OD1-NZ 3.02Å; D425-K478 WeakPolarHBondContact OD2-CE 3.39Å; D425-K478 IonicContact OD2-NZ 2.71Å; D425-K478 PolarHBondContact OD2-NZ 2.96Å; E441-K478 IonicContact OE1-NZ 2.72Å; E441-K478 PolarHBondContact OE1-NZ 3.18Å; E441-K478 IonicContact OE2-NZ 3.49Å; E441-K478 PolarHBondContact OE2-NZ 2.63Å; L474-K478 PolarHBondContact O-N 2.9Å; Q475-K478 PolarHBondContact O-N 3.33Å; K478-N480 VanDerWaalsContact C-N 3.27Å; K478-N480 PolarHBondContact O-N 2.86Å; K478-A481 WeakPolarHBondContact O-CB 3.35Å; K478-A481 PolarHBondContact O-N 3.33Å; K478-A481 VanDerWaalsContact O-N 3.15Å; K478-S482 PolarHBondContact O-N 2.86Å; K478-S482 VanDerWaalsContact O-N 3.1Å; K478-S482 PolarHBondContact O-OG 3.46Å
479	L	86.5	Confident	79	Confident	38 Å²	38	75.2 Å²	75.2	20%	0.199	41%	0.41	C	S	.	.	H	α-helix	trans	-56.6	-36.2	174.5	-81.4	171.4	0	0	0	113.3	F421 H423 Q475 K483	F421-L479 HydrophobicContact CD1-CD1 3.92Å; F421-L479 HydrophobicContact CE1-CD1 4.11Å; F421-L479 HydrophobicContact CG-CD1 4.26Å; H423-L479 VanDerWaalsContact CD2-CD2 3.48Å; H423-L479 WeakPolarHBondContact CD2-CD2 3.46Å; H423-L479 WeakPolarHBondContact NE2-CG 3.35Å; Q475-L479 VanDerWaalsContact O-CB 3.27Å; Q475-L479 WeakPolarHBondContact O-CB 3.25Å; Q475-L479 WeakPolarHBondContact O-CG 3.49Å; Q475-L479 PolarHBondContact O-N 3.43Å; L479-K483 WeakPolarHBondContact O-CB 3.19Å; L479-K483 VanDerWaalsContact O-CD 3.25Å; L479-K483 WeakPolarHBondContact O-CD 3.48Å; L479-K483 VanDerWaalsContact O-CE 3.26Å; L479-K483 WeakPolarHBondContact O-CE 3.38Å; L479-K483 WeakPolarHBondContact O-CG 3.2Å; L479-K483 PolarHBondContact O-N 2.81Å; L479-K483 VanDerWaalsContact O-N 3.07Å
480	N	85.4	Confident	77.7	Confident	76 Å²	76	72.1 Å²	72.1	41%	0.406	40%	0.395	S	S	.	.	H	α-helix	trans	-76.9	-30.3	179.9	-71.9	-31	0	0	0	113.1	S476 V477 K478 K483 H484	S476-N480 VanDerWaalsContact O-CB 3.26Å; S476-N480 WeakPolarHBondContact O-CB 3.33Å; S476-N480 PolarHBondContact O-N 2.85Å; S476-N480 PolarHBondContact O-ND2 2.85Å; V477-N480 PolarHBondContact O-N 3.08Å; V477-N480 VanDerWaalsContact O-N 3.13Å; K478-N480 VanDerWaalsContact C-N 3.27Å; K478-N480 PolarHBondContact O-N 2.86Å; N480-K483 PolarHBondContact OD1-NZ 3.39Å; N480-H484 PolarHBondContact O-N 3.1Å
481	A	81.6	Confident	76.2	Confident	65 Å²	65	74.2 Å²	74.2	54%	0.537	41%	0.405	S	S	.	.	H	α-helix	trans	-63.4	-51.1	168.7	0	0	0	0	0	111.1	V477 K478 K483 H484 G485	V477-A481 PolarHBondContact O-N 3.15Å; K478-A481 WeakPolarHBondContact O-CB 3.35Å; K478-A481 PolarHBondContact O-N 3.33Å; K478-A481 VanDerWaalsContact O-N 3.15Å; A481-K483 VanDerWaalsContact C-N 3.35Å; A481-K483 PolarHBondContact O-N 2.87Å; A481-H484 WeakPolarHBondContact O-CA 3.43Å; A481-H484 WeakPolarHBondContact O-CB 3.5Å; A481-H484 PolarHBondContact O-N 3.32Å; A481-G485 PolarHBondContact O-N 3.3Å; A481-G485 VanDerWaalsContact O-N 3.1Å
482	S	74.6	Confident	74.8	Confident	75 Å²	75	81 Å²	81	52%	0.524	44%	0.435	S	S	.	.	H	α-helix	trans	-59.6	-41.6	178.8	-57.8	0	0	0	0	112.4	K478 H484 G485 V486	K478-S482 PolarHBondContact O-N 2.86Å; K478-S482 VanDerWaalsContact O-N 3.1Å; K478-S482 PolarHBondContact O-OG 3.46Å; S482-H484 PolarHBondContact O-N 3.17Å; S482-G485 PolarHBondContact O-N 2.85Å; S482-V486 PolarHBondContact O-N 2.89Å; S482-V486 VanDerWaalsContact O-N 3.16Å
483	K	73.1	Confident	73.4	Confident	97 Å²	97	86 Å²	86	42%	0.422	45%	0.452	S	S	.	.	H	α-helix	trans	-60	-27.9	173	-72.1	162.5	-151.5	160.3	0	113.4	L479 N480 A481 K487	L479-K483 WeakPolarHBondContact O-CB 3.19Å; L479-K483 VanDerWaalsContact O-CD 3.25Å; L479-K483 WeakPolarHBondContact O-CD 3.48Å; L479-K483 VanDerWaalsContact O-CE 3.26Å; L479-K483 WeakPolarHBondContact O-CE 3.38Å; L479-K483 WeakPolarHBondContact O-CG 3.2Å; L479-K483 PolarHBondContact O-N 2.81Å; L479-K483 VanDerWaalsContact O-N 3.07Å; N480-K483 PolarHBondContact OD1-NZ 3.39Å; A481-K483 VanDerWaalsContact C-N 3.35Å; A481-K483 PolarHBondContact O-N 2.87Å; K483-K487 WeakPolarHBondContact O-CD 3.43Å; K483-K487 VanDerWaalsContact O-CG 3.26Å; K483-K487 WeakPolarHBondContact O-CG 3.47Å; K483-K487 PolarHBondContact O-N 3.03Å
484	H	60.1	Low	71.9	Confident	121 Å²	121	85.7 Å²	85.7	56%	0.56	45%	0.449	S	S	*	.	H	α-helix	trans	-81.5	-36.1	175.4	-99.4	-87.7	0	0	0	113.1	N480 A481 S482 K487 T488	N480-H484 PolarHBondContact O-N 3.1Å; A481-H484 WeakPolarHBondContact O-CA 3.43Å; A481-H484 WeakPolarHBondContact O-CB 3.5Å; A481-H484 PolarHBondContact O-N 3.32Å; S482-H484 PolarHBondContact O-N 3.17Å; H484-K487 PolarHBondContact O-N 2.91Å; H484-T488 PolarHBondContact O-N 3.24Å; H484-T488 VanDerWaalsContact O-N 3.08Å; H484-T488 PolarHBondContact O-OG1 3.48Å
485	G	57.1	Low	70.3	Confident	36 Å²	36	91.8 Å²	91.8	37%	0.371	47%	0.466	S	S	.	.	H	α-helix	trans	-56.9	-52.8	172	0	0	0	0	0	112	A481 S482 K487 T488 L489	A481-G485 PolarHBondContact O-N 3.3Å; A481-G485 VanDerWaalsContact O-N 3.1Å; S482-G485 PolarHBondContact O-N 2.85Å; G485-K487 PolarHBondContact O-N 3.14Å; G485-T488 PolarHBondContact O-N 3.35Å; G485-L489 PolarHBondContact O-N 3Å
486	V	59.5	Low	68.5	Low	81 Å²	81	95.5 Å²	95.5	49%	0.491	49%	0.491	S	S	.	.	H	α-helix	trans	-61.2	-41.3	-179.4	178.4	0	0	0	0	112.3	S482 L489 Q490	S482-V486 PolarHBondContact O-N 2.89Å; S482-V486 VanDerWaalsContact O-N 3.16Å; V486-L489 PolarHBondContact O-N 2.93Å; V486-Q490 HydrophobicContact CG1-CG 4.5Å; V486-Q490 WeakPolarHBondContact O-CG 3.17Å; V486-Q490 PolarHBondContact O-N 3.37Å
487	K	59.3	Low	66.8	Low	116 Å²	116	100.1 Å²	100.1	50%	0.504	51%	0.508	S	S	.	.	H	α-helix	trans	-61.8	-45.9	176	-74.9	170.8	-172	170.7	0	111.7	K483 H484 G485 L489 Q490 E491	K483-K487 WeakPolarHBondContact O-CD 3.43Å; K483-K487 VanDerWaalsContact O-CG 3.26Å; K483-K487 WeakPolarHBondContact O-CG 3.47Å; K483-K487 PolarHBondContact O-N 3.03Å; H484-K487 PolarHBondContact O-N 2.91Å; G485-K487 PolarHBondContact O-N 3.14Å; K487-L489 VanDerWaalsContact C-N 3.31Å; K487-L489 PolarHBondContact O-N 3.09Å; K487-Q490 PolarHBondContact O-N 2.64Å; K487-Q490 VanDerWaalsContact O-N 3.14Å; K487-E491 PolarHBondContact O-N 2.8Å
488	T	58.9	Low	65	Low	75 Å²	75	101.1 Å²	101.1	46%	0.46	52%	0.518	S	S	.	.	H	α-helix	trans	-63.4	-38.2	-179.5	-48.9	0	0	0	0	111.5	H484 G485 K492	H484-T488 PolarHBondContact O-N 3.24Å; H484-T488 VanDerWaalsContact O-N 3.08Å; H484-T488 PolarHBondContact O-OG1 3.48Å; G485-T488 PolarHBondContact O-N 3.35Å; T488-K492 PolarHBondContact O-N 3.04Å
489	L	59.8	Low	63.3	Low	113 Å²	113	102.9 Å²	102.9	59%	0.592	54%	0.537	S	S	*	.	H	α-helix	trans	-67.3	-39.7	172.6	-79.1	164.9	0	0	0	112.9	G485 V486 K487 K493	G485-L489 PolarHBondContact O-N 3Å; V486-L489 PolarHBondContact O-N 2.93Å; K487-L489 VanDerWaalsContact C-N 3.31Å; K487-L489 PolarHBondContact O-N 3.09Å; L489-K493 WeakPolarHBondContact O-CB 3.48Å; L489-K493 PolarHBondContact O-N 3.3Å
490	Q	62.6	Low	61.3	Low	100 Å²	100	108.8 Å²	108.8	47%	0.467	56%	0.563	S	S	.	*	H	α-helix	trans	-68.4	-36.5	175.3	-74.5	-170.3	20.3	0	0	112.8	V486 K487 K493 K494	V486-Q490 HydrophobicContact CG1-CG 4.5Å; V486-Q490 WeakPolarHBondContact O-CG 3.17Å; V486-Q490 PolarHBondContact O-N 3.37Å; K487-Q490 PolarHBondContact O-N 2.64Å; K487-Q490 VanDerWaalsContact O-N 3.14Å; Q490-K493 PolarHBondContact O-N 2.87Å; Q490-K494 WeakPolarHBondContact O-CB 3.15Å; Q490-K494 VanDerWaalsContact O-CG 3.29Å; Q490-K494 WeakPolarHBondContact O-CG 3.18Å; Q490-K494 PolarHBondContact O-N 2.93Å
491	E	58.5	Low	59.3	Low	140 Å²	140	111.9 Å²	111.9	65%	0.654	59%	0.585	S	S	*	*	H	α-helix	trans	-70.9	-40	175.5	-72.3	-175.2	154	0	0	111.8	K487 K494 R495	K487-E491 PolarHBondContact O-N 2.8Å; E491-K494 PolarHBondContact O-N 3.26Å; E491-R495 VanDerWaalsContact O-CB 3.29Å; E491-R495 WeakPolarHBondContact O-CB 3.47Å; E491-R495 PolarHBondContact O-N 3.22Å
492	K	62.7	Low	57.2	Low	143 Å²	143	113.4 Å²	113.4	62%	0.622	59%	0.591	S	S	*	*	H	α-helix	trans	-57.5	-50.8	167.8	-81.4	-173.4	174.1	-176.6	0	111.4	T488 K494 R495 C496	T488-K492 PolarHBondContact O-N 3.04Å; K492-K494 PolarHBondContact O-N 3.46Å; K492-R495 PolarHBondContact O-N 3.17Å; K492-C496 PolarHBondContact O-N 3.26Å; K492-C496 PolarHBondContact O-SG 2.81Å; K492-C496 VanDerWaalsContact O-SG 3.34Å
493	K	63.6	Low	55.5	Low	144 Å²	144	117.2 Å²	117.2	63%	0.626	61%	0.605	S	S	*	*	H	α-helix	trans	-58.9	-44.7	178.1	-82.3	-177.9	174.5	175.5	0	112.4	L489 Q490 C496 Q497	L489-K493 WeakPolarHBondContact O-CB 3.48Å; L489-K493 PolarHBondContact O-N 3.3Å; Q490-K493 PolarHBondContact O-N 2.87Å; K493-C496 PolarHBondContact O-N 3.1Å; K493-Q497 WeakPolarHBondContact O-CB 3.44Å; K493-Q497 VanDerWaalsContact O-CG 3.27Å; K493-Q497 WeakPolarHBondContact O-CG 3.13Å; K493-Q497 PolarHBondContact O-N 2.89Å
494	K	59.4	Low	53.6	Low	125 Å²	125	118.1 Å²	118.1	54%	0.543	62%	0.621	S	S	.	*	H	α-helix	trans	-64.9	-42	177.7	-75.2	167.3	-177.1	164.8	0	112.4	Q490 E491 K492 C496 Q497 S498	Q490-K494 WeakPolarHBondContact O-CB 3.15Å; Q490-K494 VanDerWaalsContact O-CG 3.29Å; Q490-K494 WeakPolarHBondContact O-CG 3.18Å; Q490-K494 PolarHBondContact O-N 2.93Å; E491-K494 PolarHBondContact O-N 3.26Å; K492-K494 PolarHBondContact O-N 3.46Å; K494-C496 VanDerWaalsContact C-N 3.31Å; K494-C496 PolarHBondContact O-N 3.41Å; K494-Q497 PolarHBondContact O-N 3.24Å; K494-S498 PolarHBondContact O-N 2.8Å; K494-S498 PolarHBondContact O-OG 3.21Å
495	R	55.5	Low	52.3	Low	205 Å²	205	119.6 Å²	119.6	77%	0.774	63%	0.633	S	S	*	*	H	α-helix	trans	-64.3	-33.1	177.2	-173	172.8	177.8	176.6	-2	112.7	E491 K492 S498 S499	E491-R495 VanDerWaalsContact O-CB 3.29Å; E491-R495 WeakPolarHBondContact O-CB 3.47Å; E491-R495 PolarHBondContact O-N 3.22Å; K492-R495 PolarHBondContact O-N 3.17Å; R495-S498 PolarHBondContact O-OG 2.84Å; R495-S499 PolarHBondContact O-OG 3.42Å; R495-S499 VanDerWaalsContact O-OG 3.13Å
496	C	52.6	Low	51.5	Low	78 Å²	78	127.8 Å²	127.8	53%	0.527	66%	0.658	S	S	.	*	H	α-helix	trans	-80.6	-28	174.1	-62.4	0	0	0	0	113.6	K492 K493 K494 S499	K492-C496 PolarHBondContact O-N 3.26Å; K492-C496 PolarHBondContact O-SG 2.81Å; K492-C496 VanDerWaalsContact O-SG 3.34Å; K493-C496 PolarHBondContact O-N 3.1Å; K494-C496 VanDerWaalsContact C-N 3.31Å; K494-C496 PolarHBondContact O-N 3.41Å; C496-S499 PolarHBondContact O-OG 3.06Å; C496-S499 VanDerWaalsContact O-OG 3.12Å
497	Q	54.8	Low	50.3	Low	142 Å²	142	133.2 Å²	133.2	66%	0.664	68%	0.678	S	S	*	*	H	α-helix	trans	-80.6	-28.7	177.6	-75.7	173.6	-17	0	0	112.9	K493 K494 S499	K493-Q497 WeakPolarHBondContact O-CB 3.44Å; K493-Q497 VanDerWaalsContact O-CG 3.27Å; K493-Q497 WeakPolarHBondContact O-CG 3.13Å; K493-Q497 PolarHBondContact O-N 2.89Å; K494-Q497 PolarHBondContact O-N 3.24Å; Q497-S499 PolarHBondContact O-N 2.9Å
498	S	52.2	Low	49.1	Very low	104 Å²	104	131 Å²	131	73%	0.727	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	6.6	174.5	67.3	0	0	0	0	114.3	K494 R495	K494-S498 PolarHBondContact O-N 2.8Å; K494-S498 PolarHBondContact O-OG 3.21Å; R495-S498 PolarHBondContact O-OG 2.84Å
499	S	51.5	Low	48.1	Very low	87 Å²	87	136.4 Å²	136.4	61%	0.608	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.8	16.8	-176	57.8	0	0	0	0	113.5	R495 C496 Q497	R495-S499 PolarHBondContact O-OG 3.42Å; R495-S499 VanDerWaalsContact O-OG 3.13Å; C496-S499 PolarHBondContact O-OG 3.06Å; C496-S499 VanDerWaalsContact O-OG 3.12Å; Q497-S499 PolarHBondContact O-N 2.9Å
500	Q	44.2	Very low	47.1	Very low	161 Å²	161	140.6 Å²	140.6	75%	0.752	72%	0.722	S	S	*	*			trans	-118.4	78.8	175.1	-73.2	-169.8	-21.9	0	0	111.4
501	V	42.9	Very low	45.8	Very low	142 Å²	142	147.5 Å²	147.5	86%	0.861	74%	0.743	S	S	*	*			trans	-134.2	128.8	159.7	-177.4	0	0	0	0	107.4
502	S	38	Very low	44.6	Very low	96 Å²	96	152.4 Å²	152.4	67%	0.671	76%	0.756	S	S	*	*			trans	-60.6	161.1	-177.5	48.1	0	0	0	0	113.4
503	L	38.4	Very low	43.5	Very low	155 Å²	155	151.6 Å²	151.6	81%	0.812	76%	0.763	S	S	*	*			cis	-164.9	-176.9	49.6	-74.4	163.2	0	0	0	109.4
504	P	33.9	Very low	42	Very low	116 Å²	116	153.6 Å²	153.6	75%	0.753	77%	0.767	S	S	*	*			cis	-122.5	-165.8	-41.8	36.9	-20.4	0	0	0	111
505	D	33.8	Very low	41.1	Very low	152 Å²	152	153.1 Å²	153.1	81%	0.813	77%	0.774	S	S	*	*			trans	-63.8	138.6	-177	-61.9	-76.8	0	0	0	116.3
506	K	40.4	Very low	40.3	Very low	208 Å²	208	149.8 Å²	149.8	90%	0.904	77%	0.767	S	S	*	*			trans	-141.9	134.5	138.9	-74.4	-159.3	174.6	-172.3	0	109.1
507	E	32.8	Very low	39.4	Very low	195 Å²	195	148.8 Å²	148.8	91%	0.911	77%	0.77	S	S	*	*			trans	-75.2	138.2	-176.1	-64.2	168	116.3	0	0	111.4
508	G	35.4	Very low	38.7	Very low	70 Å²	70	145.6 Å²	145.6	72%	0.722	76%	0.758	S	S	*	*			trans	-168.2	96.9	-178.3	0	0	0	0	0	111.4	K510	G508-K510 PolarHBondContact O-N 2.83Å
509	H	37.4	Very low	38.1	Very low	188 Å²	188	146.3 Å²	146.3	87%	0.87	75%	0.753	S	S	*	*			trans	-70.5	100.2	-175	-80.4	22.9	0	0	0	112.7
510	K	39.4	Very low	37.5	Very low	201 Å²	201	149 Å²	149	87%	0.874	76%	0.757	S	S	*	*			trans	-128.7	102.2	153.7	-77.6	-168.2	173.9	-178.8	0	110.4	G508 R512	G508-K510 PolarHBondContact O-N 2.83Å; K510-R512 PolarHBondContact O-N 2.83Å; K510-R512 VanDerWaalsContact O-N 3.11Å
511	R	34.1	Very low	37.2	Very low	245 Å²	245	144.1 Å²	144.1	93%	0.925	74%	0.74	S	S	*	*			trans	-61.5	107.8	177.3	-70.6	-178.5	176.1	-177.3	-0.7	110.1	V513	R511-V513 PolarHBondContact O-N 3.31Å
512	R	33.8	Very low	37.2	Very low	244 Å²	244	139.7 Å²	139.7	92%	0.921	71%	0.71	S	S	*	*			trans	-78.3	102.8	161.8	-90.7	-174.2	168.6	164.7	-0.9	109	K510 R514	K510-R512 PolarHBondContact O-N 2.83Å; K510-R512 VanDerWaalsContact O-N 3.11Å; R512-R514 PolarHBondContact O-N 2.93Å
513	V	39.7	Very low	37.9	Very low	126 Å²	126	141.4 Å²	141.4	76%	0.764	71%	0.707	S	S	*	*			trans	-58.6	131.3	168.6	177.8	0	0	0	0	108.9	R511	R511-V513 PolarHBondContact O-N 3.31Å
514	R	32.2	Very low	38.6	Very low	186 Å²	186	140 Å²	140	70%	0.702	70%	0.696	S	S	*	*			trans	-89.7	108.4	171	-65.4	171.6	92.4	115.6	4.9	107.8	R512 E516	R512-R514 PolarHBondContact O-N 2.93Å; R514-E516 HydrophobicContact CB-CB 4.41Å; R514-E516 HydrophobicContact CB-CG 4.04Å; R514-E516 WeakPolarHBondContact CD-OE2 3.26Å; R514-E516 IonicContact CZ-OE1 3.59Å; R514-E516 IonicContact CZ-OE2 2.69Å; R514-E516 IonicContact NE-OE1 2.76Å; R514-E516 PolarHBondContact NE-OE1 3.01Å; R514-E516 IonicContact NE-OE2 3.59Å; R514-E516 PolarHBondContact NE-OE2 2.82Å; R514-E516 IonicContact NH2-OE1 3.6Å; R514-E516 PolarHBondContact NH2-OE1 3.28Å; R514-E516 IonicContact NH2-OE2 3.25Å; R514-E516 PolarHBondContact O-N 2.92Å
515	T	40.6	Very low	39.4	Very low	114 Å²	114	136.9 Å²	136.9	70%	0.699	68%	0.677	S	S	*	*			trans	-78	66.1	168.8	-44.1	0	0	0	0	109.1	N518	T515-N518 HydrophobicContact CG2-CB 4.03Å
516	E	37.8	Very low	40.8	Very low	136 Å²	136	130.4 Å²	130.4	64%	0.636	64%	0.643	S	S	*	*			trans	-101.7	15.4	179.7	-75	173.3	174.1	0	0	111.9	R514	R514-E516 HydrophobicContact CB-CB 4.41Å; R514-E516 HydrophobicContact CB-CG 4.04Å; R514-E516 WeakPolarHBondContact CD-OE2 3.26Å; R514-E516 IonicContact CZ-OE1 3.59Å; R514-E516 IonicContact CZ-OE2 2.69Å; R514-E516 IonicContact NE-OE1 2.76Å; R514-E516 PolarHBondContact NE-OE1 3.01Å; R514-E516 IonicContact NE-OE2 3.59Å; R514-E516 PolarHBondContact NE-OE2 2.82Å; R514-E516 IonicContact NH2-OE1 3.6Å; R514-E516 PolarHBondContact NH2-OE1 3.28Å; R514-E516 IonicContact NH2-OE2 3.25Å; R514-E516 PolarHBondContact O-N 2.92Å
517	G	34.7	Very low	41.9	Very low	57 Å²	57	122.6 Å²	122.6	59%	0.588	62%	0.618	S	S	*	*	S	Bend	trans	-138.7	39.4	-177.2	0	0	0	0	0	114.4
518	N	39	Very low	43.4	Very low	74 Å²	74	117 Å²	117	40%	0.396	59%	0.592	S	S	.	*	S	Bend	trans	-131.4	7.5	178.5	-163.1	94.8	0	0	0	113.4	T515 S521 H522	T515-N518 HydrophobicContact CG2-CB 4.03Å; N518-S521 PolarHBondContact O-OG 2.96Å; N518-H522 PolarHBondContact ND2-CD2 2.77Å; N518-H522 PolarHBondContact ND2-CE1 3.44Å; N518-H522 PolarHBondContact ND2-NE2 2.99Å
519	D	40.3	Very low	44.9	Very low	120 Å²	120	115 Å²	115	64%	0.642	56%	0.564	S	S	*	*	S	Bend	trans	-88.8	-34.4	172.3	-73.2	-54.5	0	0	0	111.2	H522 Q523	D519-H522 PolarHBondContact O-N 3.15Å; D519-Q523 WeakPolarHBondContact O-CG 3.42Å; D519-Q523 PolarHBondContact O-N 3.27Å; D519-Q523 VanDerWaalsContact O-N 3.16Å
520	E	39	Very low	46.2	Very low	144 Å²	144	110.2 Å²	110.2	67%	0.673	54%	0.539	S	S	*	.	H	α-helix	trans	-67.4	-44.8	175.6	-66.2	168.8	117.1	0	0	112.1	H522 Q523 Q524	E520-H522 PolarHBondContact O-N 3.42Å; E520-Q523 PolarHBondContact O-N 3.02Å; E520-Q524 PolarHBondContact O-N 2.83Å
521	S	36.6	Very low	47.7	Very low	58 Å²	58	105.4 Å²	105.4	41%	0.406	52%	0.518	S	S	.	.	H	α-helix	trans	-61.2	-30.7	177.6	58.8	0	0	0	0	113.1	N518 C525	N518-S521 PolarHBondContact O-OG 2.96Å; S521-C525 WeakPolarHBondContact O-CB 3.46Å; S521-C525 PolarHBondContact O-N 3.26Å; S521-C525 VanDerWaalsContact O-N 3.11Å
522	H	44.9	Very low	49.2	Very low	48 Å²	48	97.8 Å²	97.8	22%	0.222	50%	0.495	C	S	.	.	H	α-helix	trans	-73.9	-38.4	172.5	-77.2	-162.3	0	0	0	112.4	N518 D519 E520 C525 S526 E591	N518-H522 PolarHBondContact ND2-CD2 2.77Å; N518-H522 PolarHBondContact ND2-CE1 3.44Å; N518-H522 PolarHBondContact ND2-NE2 2.99Å; D519-H522 PolarHBondContact O-N 3.15Å; E520-H522 PolarHBondContact O-N 3.42Å; H522-C525 PolarHBondContact O-N 2.86Å; H522-S526 PolarHBondContact O-N 2.99Å; H522-E591 HydrophobicContact CB-CG 4.23Å; H522-E591 IonicContact CG-OE1 2.79Å; H522-E591 IonicContact ND1-OE1 2.75Å
523	Q	50.9	Low	50.7	Low	133 Å²	133	87.1 Å²	87.1	62%	0.621	46%	0.457	S	S	*	.	H	α-helix	trans	-64.8	-42.4	175.4	-71	171.7	8.4	0	0	111.3	D519 E520 C525 S526 A527	D519-Q523 WeakPolarHBondContact O-CG 3.42Å; D519-Q523 PolarHBondContact O-N 3.27Å; D519-Q523 VanDerWaalsContact O-N 3.16Å; E520-Q523 PolarHBondContact O-N 3.02Å; Q523-C525 VanDerWaalsContact C-N 3.35Å; Q523-C525 PolarHBondContact O-N 2.8Å; Q523-S526 PolarHBondContact O-N 3.2Å; Q523-A527 PolarHBondContact O-N 3.29Å; Q523-A527 VanDerWaalsContact O-N 3.14Å
524	Q	53.7	Low	51.9	Low	124 Å²	124	85.8 Å²	85.8	58%	0.579	44%	0.441	S	S	*	.	H	α-helix	trans	-57.7	-46.9	171.1	-156.4	77	23.6	0	0	111.2	E520 S526 A527 E528	E520-Q524 PolarHBondContact O-N 2.83Å; Q524-S526 VanDerWaalsContact C-N 3.35Å; Q524-S526 PolarHBondContact O-N 2.98Å; Q524-A527 WeakPolarHBondContact O-CB 3.3Å; Q524-A527 PolarHBondContact O-N 2.69Å; Q524-E528 PolarHBondContact O-N 2.69Å
525	C	51.6	Low	53.4	Low	52 Å²	52	82.8 Å²	82.8	35%	0.351	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-38.6	179.4	-169.6	0	0	0	0	112.8	S521 H522 Q523 A527 L529	S521-C525 WeakPolarHBondContact O-CB 3.46Å; S521-C525 PolarHBondContact O-N 3.26Å; S521-C525 VanDerWaalsContact O-N 3.11Å; H522-C525 PolarHBondContact O-N 2.86Å; Q523-C525 VanDerWaalsContact C-N 3.35Å; Q523-C525 PolarHBondContact O-N 2.8Å; C525-A527 VanDerWaalsContact C-N 3.3Å; C525-A527 PolarHBondContact O-N 2.91Å; C525-L529 VanDerWaalsContact O-CB 3.32Å; C525-L529 WeakPolarHBondContact O-CB 3.49Å; C525-L529 WeakPolarHBondContact O-CD1 3.29Å; C525-L529 VanDerWaalsContact O-CG 3.26Å; C525-L529 WeakPolarHBondContact O-CG 3.47Å; C525-L529 PolarHBondContact O-N 3.34Å
526	S	61.5	Low	54.4	Low	15 Å²	15	82.7 Å²	82.7	11%	0.105	43%	0.429	C	S	.	.	H	α-helix	trans	-64.3	-33	173.2	-170.4	0	0	0	0	112.7	H522 Q523 Q524 W530 A587	H522-S526 PolarHBondContact O-N 2.99Å; Q523-S526 PolarHBondContact O-N 3.2Å; Q524-S526 VanDerWaalsContact C-N 3.35Å; Q524-S526 PolarHBondContact O-N 2.98Å; S526-W530 WeakPolarHBondContact O-CB 3.24Å; S526-W530 PolarHBondContact O-N 3.16Å; S526-W530 VanDerWaalsContact O-N 3.1Å; S526-A587 WeakPolarHBondContact OG-CB 3.43Å
527	A	65.5	Low	55.3	Low	45 Å²	45	80.9 Å²	80.9	37%	0.372	42%	0.417	S	S	.	.	H	α-helix	trans	-72.5	-46.5	177.4	0	0	0	0	0	111.8	Q523 Q524 C525 L529 W530 K531	Q523-A527 PolarHBondContact O-N 3.29Å; Q523-A527 VanDerWaalsContact O-N 3.14Å; Q524-A527 WeakPolarHBondContact O-CB 3.3Å; Q524-A527 PolarHBondContact O-N 2.69Å; C525-A527 VanDerWaalsContact C-N 3.3Å; C525-A527 PolarHBondContact O-N 2.91Å; A527-L529 PolarHBondContact O-N 2.95Å; A527-W530 PolarHBondContact O-N 3.23Å; A527-W530 VanDerWaalsContact O-N 3.16Å; A527-K531 PolarHBondContact O-N 2.91Å
528	E	63.7	Low	56.2	Low	76 Å²	76	83 Å²	83	36%	0.355	42%	0.416	S	S	.	.	H	α-helix	trans	-66.2	-36.2	176.7	-56.5	-49	129.7	0	0	112.1	Q524 W530 K531 L532	Q524-E528 PolarHBondContact O-N 2.69Å; E528-W530 VanDerWaalsContact C-N 3.32Å; E528-W530 PolarHBondContact O-N 3.2Å; E528-K531 PolarHBondContact O-N 2.84Å; E528-K531 IonicContact OE1-NZ 2.94Å; E528-K531 PolarHBondContact OE1-NZ 3.19Å; E528-K531 WeakPolarHBondContact OE2-CD 3.34Å; E528-K531 IonicContact OE2-NZ 3.86Å; E528-K531 PolarHBondContact OE2-NZ 3.19Å; E528-L532 WeakPolarHBondContact O-CG 3.36Å; E528-L532 PolarHBondContact O-N 3.23Å
529	L	66.8	Low	57.1	Low	29 Å²	29	81.7 Å²	81.7	15%	0.152	41%	0.412	C	S	.	.	H	α-helix	trans	-64.8	-35	171.6	-76.2	166.4	0	0	0	112.5	C525 A527 V533 L588 L621	C525-L529 VanDerWaalsContact O-CB 3.32Å; C525-L529 WeakPolarHBondContact O-CB 3.49Å; C525-L529 WeakPolarHBondContact O-CD1 3.29Å; C525-L529 VanDerWaalsContact O-CG 3.26Å; C525-L529 WeakPolarHBondContact O-CG 3.47Å; C525-L529 PolarHBondContact O-N 3.34Å; A527-L529 PolarHBondContact O-N 2.95Å; L529-V533 WeakPolarHBondContact O-CB 3.39Å; L529-V533 VanDerWaalsContact O-CG2 3.3Å; L529-V533 WeakPolarHBondContact O-CG2 3.3Å; L529-V533 PolarHBondContact O-N 2.84Å; L529-L588 HydrophobicContact CD1-CD1 4.32Å; L529-L588 HydrophobicContact CD1-CD2 3.43Å; L529-L588 VanDerWaalsContact CD1-CD2 3.43Å; L529-L588 HydrophobicContact CD1-CG 3.69Å; L529-L621 HydrophobicContact CD1-CD2 4.48Å
530	W	65	Low	57.7	Low	87 Å²	87	82.9 Å²	82.9	33%	0.33	42%	0.418	S	S	.	.	H	α-helix	trans	-70.7	-37.3	175	-177.4	-120.7	0	0	0	112.1	S526 A527 E528 V533 K534 H585 A586	S526-W530 WeakPolarHBondContact O-CB 3.24Å; S526-W530 PolarHBondContact O-N 3.16Å; S526-W530 VanDerWaalsContact O-N 3.1Å; A527-W530 PolarHBondContact O-N 3.23Å; A527-W530 VanDerWaalsContact O-N 3.16Å; E528-W530 VanDerWaalsContact C-N 3.32Å; E528-W530 PolarHBondContact O-N 3.2Å; W530-V533 HydrophobicContact CE3-CB 4.27Å; W530-V533 HydrophobicContact CE3-CG1 4.1Å; W530-V533 HydrophobicContact CZ3-CG1 3.88Å; W530-V533 PolarHBondContact O-N 2.85Å; W530-K534 PolarHBondContact O-N 3.16Å; W530-H585 AromaticContact CD1-CE1 3.96Å; W530-H585 AromaticContact CD1-ND1 3.81Å; W530-H585 AromaticContact CD2-ND1 3.45Å; W530-H585 AromaticContact CE2-ND1 3.57Å; W530-H585 AromaticContact CE3-ND1 3.98Å; W530-H585 AromaticContact CG-CE1 3.81Å; W530-H585 AromaticContact CG-ND1 3.63Å; W530-H585 AromaticContact NE1-ND1 3.76Å; W530-A586 HydrophobicContact CE3-CB 3.98Å; W530-A586 VanDerWaalsContact CE3-N 3.34Å; W530-A586 HydrophobicContact CZ3-CB 4.39Å
531	K	69.5	Low	58.4	Low	100 Å²	100	79.5 Å²	79.5	44%	0.435	40%	0.402	S	S	.	.	H	α-helix	trans	-59.3	-51	169.6	-67.3	177.6	-167	164.8	0	111.4	A527 E528 V533 K534 E535	A527-K531 PolarHBondContact O-N 2.91Å; E528-K531 PolarHBondContact O-N 2.84Å; E528-K531 IonicContact OE1-NZ 2.94Å; E528-K531 PolarHBondContact OE1-NZ 3.19Å; E528-K531 WeakPolarHBondContact OE2-CD 3.34Å; E528-K531 IonicContact OE2-NZ 3.86Å; E528-K531 PolarHBondContact OE2-NZ 3.19Å; K531-V533 VanDerWaalsContact C-N 3.29Å; K531-V533 PolarHBondContact O-N 3.4Å; K531-K534 CarbonylContact O-C 3.44Å; K531-K534 WeakPolarHBondContact O-CA 3.43Å; K531-K534 WeakPolarHBondContact O-CB 3.36Å; K531-K534 PolarHBondContact O-N 3.31Å; K531-E535 WeakPolarHBondContact O-CG 3.26Å; K531-E535 PolarHBondContact O-N 2.76Å
532	L	67.1	Low	59.1	Low	86 Å²	86	77.4 Å²	77.4	45%	0.45	39%	0.386	S	S	.	.	H	α-helix	trans	-59.4	-37.8	178.5	-73.2	166.2	0	0	0	112.6	E528 K534 E535 L536	E528-L532 WeakPolarHBondContact O-CG 3.36Å; E528-L532 PolarHBondContact O-N 3.23Å; L532-K534 VanDerWaalsContact C-N 3.29Å; L532-K534 PolarHBondContact O-N 2.63Å; L532-E535 PolarHBondContact O-N 2.78Å; L532-L536 VanDerWaalsContact O-CG 3.29Å; L532-L536 WeakPolarHBondContact O-CG 3.46Å; L532-L536 PolarHBondContact O-N 2.7Å; L532-L536 VanDerWaalsContact O-N 3.1Å
533	V	64.1	Low	59.3	Low	19 Å²	19	79.6 Å²	79.6	12%	0.115	40%	0.4	C	S	.	.	H	α-helix	trans	-68.1	-28.4	173.4	168.9	0	0	0	0	112	L529 W530 K531 Y537 A586	L529-V533 WeakPolarHBondContact O-CB 3.39Å; L529-V533 VanDerWaalsContact O-CG2 3.3Å; L529-V533 WeakPolarHBondContact O-CG2 3.3Å; L529-V533 PolarHBondContact O-N 2.84Å; W530-V533 HydrophobicContact CE3-CB 4.27Å; W530-V533 HydrophobicContact CE3-CG1 4.1Å; W530-V533 HydrophobicContact CZ3-CG1 3.88Å; W530-V533 PolarHBondContact O-N 2.85Å; K531-V533 VanDerWaalsContact C-N 3.29Å; K531-V533 PolarHBondContact O-N 3.4Å; V533-Y537 PolarHBondContact O-N 2.83Å; V533-A586 HydrophobicContact CG2-CB 4.18Å
534	K	66	Low	59.3	Low	99 Å²	99	76.2 Å²	76.2	43%	0.43	39%	0.391	S	S	.	.	H	α-helix	trans	-81.1	-33.6	172.7	-164.3	-174.9	-175.6	-71.9	0	113.3	W530 K531 L532 L536 Y537 D538	W530-K534 PolarHBondContact O-N 3.16Å; K531-K534 CarbonylContact O-C 3.44Å; K531-K534 WeakPolarHBondContact O-CA 3.43Å; K531-K534 WeakPolarHBondContact O-CB 3.36Å; K531-K534 PolarHBondContact O-N 3.31Å; L532-K534 VanDerWaalsContact C-N 3.29Å; L532-K534 PolarHBondContact O-N 2.63Å; K534-L536 PolarHBondContact O-N 2.85Å; K534-Y537 CarbonylContact O-C 3.54Å; K534-Y537 WeakPolarHBondContact O-CA 3.36Å; K534-Y537 WeakPolarHBondContact O-CB 3.48Å; K534-Y537 PolarHBondContact O-N 2.67Å; K534-D538 IonicContact NZ-OD1 2.59Å; K534-D538 PolarHBondContact NZ-OD1 3.48Å; K534-D538 IonicContact NZ-OD2 3.17Å; K534-D538 PolarHBondContact NZ-OD2 3.42Å; K534-D538 PolarHBondContact O-N 3.37Å
535	E	64	Low	59.1	Low	122 Å²	122	72.2 Å²	72.2	57%	0.57	37%	0.373	S	S	*	.	H	α-helix	trans	-66.7	-27.6	172.5	-71.1	165.3	-170.3	0	0	111.4	K531 L532 Y537	K531-E535 WeakPolarHBondContact O-CG 3.26Å; K531-E535 PolarHBondContact O-N 2.76Å; L532-E535 PolarHBondContact O-N 2.78Å; E535-Y537 VanDerWaalsContact C-N 3.29Å
536	L	60.3	Low	59.1	Low	112 Å²	112	72.2 Å²	72.2	59%	0.586	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-10	167	-69	169.7	0	0	0	114.1	L532 K534	L532-L536 VanDerWaalsContact O-CG 3.29Å; L532-L536 WeakPolarHBondContact O-CG 3.46Å; L532-L536 PolarHBondContact O-N 2.7Å; L532-L536 VanDerWaalsContact O-N 3.1Å; K534-L536 PolarHBondContact O-N 2.85Å
537	Y	56.2	Low	58.4	Low	98 Å²	98	78.6 Å²	78.6	38%	0.384	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-48.1	178.6	-164	-52.7	0	0	0	109.8	V533 K534 E535 S539 L542 F583	V533-Y537 PolarHBondContact O-N 2.83Å; K534-Y537 CarbonylContact O-C 3.54Å; K534-Y537 WeakPolarHBondContact O-CA 3.36Å; K534-Y537 WeakPolarHBondContact O-CB 3.48Å; K534-Y537 PolarHBondContact O-N 2.67Å; E535-Y537 VanDerWaalsContact C-N 3.29Å; Y537-S539 PolarHBondContact O-N 2.79Å; Y537-L542 HydrophobicContact CD1-CD2 4.5Å; Y537-L542 HydrophobicContact CG-CD2 4.5Å; Y537-F583 HydrophobicContact CD1-CZ 4.24Å; Y537-F583 AromaticContact CD2-CD1 3.7Å; Y537-F583 HydrophobicContact CD2-CD1 3.7Å; Y537-F583 AromaticContact CD2-CE1 3.36Å; Y537-F583 HydrophobicContact CD2-CE1 3.36Å; Y537-F583 HydrophobicContact CD2-CE2 4.46Å; Y537-F583 HydrophobicContact CD2-CG 4.37Å; Y537-F583 AromaticContact CD2-CZ 3.77Å; Y537-F583 HydrophobicContact CD2-CZ 3.77Å; Y537-F583 HydrophobicContact CE1-CE1 4.44Å; Y537-F583 HydrophobicContact CE1-CE2 4.11Å; Y537-F583 AromaticContact CE1-CZ 3.85Å; Y537-F583 HydrophobicContact CE1-CZ 3.85Å; Y537-F583 HydrophobicContact CE2-CB 4.39Å; Y537-F583 AromaticContact CE2-CD1 3.35Å; Y537-F583 HydrophobicContact CE2-CD1 3.35Å; Y537-F583 AromaticContact CE2-CD2 3.71Å; Y537-F583 HydrophobicContact CE2-CD2 3.71Å; Y537-F583 AromaticContact CE2-CE1 3.25Å; Y537-F583 HydrophobicContact CE2-CE1 3.25Å; Y537-F583 AromaticContact CE2-CE2 3.61Å; Y537-F583 HydrophobicContact CE2-CE2 3.61Å; Y537-F583 AromaticContact CE2-CG 3.57Å; Y537-F583 HydrophobicContact CE2-CG 3.57Å; Y537-F583 AromaticContact CE2-CZ 3.36Å; Y537-F583 HydrophobicContact CE2-CZ 3.36Å; Y537-F583 HydrophobicContact CG-CE1 4.05Å; Y537-F583 HydrophobicContact CG-CZ 4.2Å; Y537-F583 AromaticContact CZ-CD2 3.77Å; Y537-F583 AromaticContact CZ-CE1 3.83Å; Y537-F583 AromaticContact CZ-CE2 3.38Å; Y537-F583 AromaticContact CZ-CZ 3.39Å; Y537-F583 WeakPolarHBondContact OH-CD2 3.1Å; Y537-F583 VanDerWaalsContact OH-CE2 3.23Å; Y537-F583 WeakPolarHBondContact OH-CE2 3.46Å
538	D	55.4	Low	57.8	Low	103 Å²	103	83.4 Å²	83.4	55%	0.551	41%	0.412	S	S	*	.	S	Bend	trans	-74.5	35.5	-178.9	-56.4	-29.5	0	0	0	112.7	K534	K534-D538 IonicContact NZ-OD1 2.59Å; K534-D538 PolarHBondContact NZ-OD1 3.48Å; K534-D538 IonicContact NZ-OD2 3.17Å; K534-D538 PolarHBondContact NZ-OD2 3.42Å; K534-D538 PolarHBondContact O-N 3.37Å
539	S	57.5	Low	57.3	Low	45 Å²	45	81.7 Å²	81.7	32%	0.315	41%	0.405	S	S	.	.			trans	-110.5	129.5	-179.2	-176.3	0	0	0	0	111	Y537 E541 L542	Y537-S539 PolarHBondContact O-N 2.79Å; S539-E541 PolarHBondContact O-N 3.37Å; S539-L542 WeakPolarHBondContact O-CB 3.22Å; S539-L542 PolarHBondContact O-N 3.08Å
540	D	53.5	Low	56.6	Low	146 Å²	146	88.6 Å²	88.6	78%	0.781	43%	0.429	S	S	*	.	H	α-helix	trans	-56.2	-26.7	-174.1	-55.1	-71.5	0	0	0	114.3	L542 S544	D540-L542 VanDerWaalsContact C-N 3.32Å; D540-L542 PolarHBondContact O-N 3.26Å; D540-S544 WeakPolarHBondContact O-CB 3.46Å; D540-S544 PolarHBondContact O-N 3.04Å; D540-S544 VanDerWaalsContact O-N 3.16Å
541	E	52.6	Low	56	Low	72 Å²	72	91.4 Å²	91.4	34%	0.336	46%	0.459	S	S	.	.	H	α-helix	trans	-63	-36.1	173.3	-75.8	-166.4	170.1	0	0	112.8	S539 M545 R649 L960	S539-E541 PolarHBondContact O-N 3.37Å; E541-M545 PolarHBondContact O-N 3.5Å; E541-R649 IonicContact OE2-CZ 3.13Å; E541-R649 IonicContact OE2-NH1 2.78Å; E541-R649 PolarHBondContact OE2-NH1 3.44Å; E541-R649 IonicContact OE2-NH2 2.67Å; E541-R649 PolarHBondContact OE2-NH2 3.41Å; E541-L960 WeakPolarHBondContact OE2-CD2 3.19Å
542	L	51.9	Low	55.6	Low	14 Å²	14	90.3 Å²	90.3	7%	0.073	46%	0.464	C	S	.	.	H	α-helix	trans	-74.4	-48.1	-177.4	-167.6	64.6	0	0	0	110	Y537 S539 D540 S544 M545 T546 E581 F583 F651	Y537-L542 HydrophobicContact CD1-CD2 4.5Å; Y537-L542 HydrophobicContact CG-CD2 4.5Å; S539-L542 WeakPolarHBondContact O-CB 3.22Å; S539-L542 PolarHBondContact O-N 3.08Å; D540-L542 VanDerWaalsContact C-N 3.32Å; D540-L542 PolarHBondContact O-N 3.26Å; L542-S544 PolarHBondContact O-N 3.14Å; L542-M545 HydrophobicContact CD1-CE 4.05Å; L542-M545 CarbonylContact O-C 3.55Å; L542-M545 WeakPolarHBondContact O-CA 3.46Å; L542-M545 WeakPolarHBondContact O-CB 3.39Å; L542-M545 PolarHBondContact O-N 3.36Å; L542-T546 PolarHBondContact O-N 2.84Å; L542-T546 PolarHBondContact O-OG1 3.17Å; L542-E581 WeakPolarHBondContact CD1-OE2 3.39Å; L542-F583 HydrophobicContact CD2-CE1 4.33Å; L542-F583 HydrophobicContact CD2-CZ 4.1Å; L542-F651 HydrophobicContact CD1-CE2 3.79Å; L542-F651 HydrophobicContact CD1-CZ 3.83Å
543	D	49.5	Very low	55.8	Low	94 Å²	94	88 Å²	88	50%	0.503	45%	0.453	S	S	.	.	H	α-helix	trans	-55.8	-37	175.4	-117.5	17	0	0	0	111.8	M545 T546 Q547	D543-M545 PolarHBondContact O-N 3.25Å; D543-T546 PolarHBondContact O-N 3.4Å; D543-Q547 VanDerWaalsContact O-CB 3.27Å; D543-Q547 WeakPolarHBondContact O-CB 3.23Å; D543-Q547 WeakPolarHBondContact O-CG 3.47Å; D543-Q547 PolarHBondContact O-N 3.06Å
544	S	50.5	Low	56.7	Low	63 Å²	63	88.1 Å²	88.1	44%	0.441	46%	0.455	S	S	.	.	H	α-helix	trans	-63.9	-34.1	173	-172.4	0	0	0	0	113.5	D540 L542 K548	D540-S544 WeakPolarHBondContact O-CB 3.46Å; D540-S544 PolarHBondContact O-N 3.04Å; D540-S544 VanDerWaalsContact O-N 3.16Å; L542-S544 PolarHBondContact O-N 3.14Å; S544-K548 WeakPolarHBondContact O-CG 3.47Å; S544-K548 PolarHBondContact O-N 3.05Å
545	M	49.2	Very low	57.8	Low	40 Å²	40	83.6 Å²	83.6	20%	0.197	44%	0.436	C	S	.	.	H	α-helix	trans	-78.6	-39.8	172.8	-72.1	-174.2	-71.7	0	0	112.5	E541 L542 D543 Q547 K548 L549 L967	E541-M545 PolarHBondContact O-N 3.5Å; L542-M545 HydrophobicContact CD1-CE 4.05Å; L542-M545 CarbonylContact O-C 3.55Å; L542-M545 WeakPolarHBondContact O-CA 3.46Å; L542-M545 WeakPolarHBondContact O-CB 3.39Å; L542-M545 PolarHBondContact O-N 3.36Å; D543-M545 PolarHBondContact O-N 3.25Å; M545-Q547 VanDerWaalsContact C-N 3.27Å; M545-Q547 PolarHBondContact O-N 3.4Å; M545-K548 WeakPolarHBondContact O-CA 3.48Å; M545-K548 WeakPolarHBondContact O-CB 3.26Å; M545-K548 PolarHBondContact O-N 3.17Å; M545-L549 PolarHBondContact O-N 3.35Å; M545-L967 HydrophobicContact SD-CD2 4.36Å
546	T	52.1	Low	59.1	Low	51 Å²	51	83.9 Å²	83.9	31%	0.313	44%	0.435	S	S	.	.	H	α-helix	trans	-69.2	-26.3	178.3	-52	0	0	0	0	111.5	L542 D543 E581	L542-T546 PolarHBondContact O-N 2.84Å; L542-T546 PolarHBondContact O-OG1 3.17Å; D543-T546 PolarHBondContact O-N 3.4Å; T546-E581 WeakPolarHBondContact CG2-OE1 3.3Å; T546-E581 PolarHBondContact OG1-OE1 2.87Å; T546-E581 PolarHBondContact OG1-OE2 2.94Å
547	Q	46.5	Very low	60.6	Low	150 Å²	150	80.9 Å²	80.9	70%	0.701	42%	0.421	S	S	*	.	H	α-helix	trans	-77.5	-23.5	167.1	-71.2	172.5	46.3	0	0	114.2	D543 M545	D543-Q547 VanDerWaalsContact O-CB 3.27Å; D543-Q547 WeakPolarHBondContact O-CB 3.23Å; D543-Q547 WeakPolarHBondContact O-CG 3.47Å; D543-Q547 PolarHBondContact O-N 3.06Å; M545-Q547 VanDerWaalsContact C-N 3.27Å; M545-Q547 PolarHBondContact O-N 3.4Å
548	K	52.1	Low	62.2	Low	145 Å²	145	78.9 Å²	78.9	63%	0.63	42%	0.417	S	S	*	.	H	α-helix	trans	-74.9	-28.3	169.1	-77.2	175.3	178.5	-173.7	0	111.7	S544 M545	S544-K548 WeakPolarHBondContact O-CG 3.47Å; S544-K548 PolarHBondContact O-N 3.05Å; M545-K548 WeakPolarHBondContact O-CA 3.48Å; M545-K548 WeakPolarHBondContact O-CB 3.26Å; M545-K548 PolarHBondContact O-N 3.17Å
549	L	54.6	Low	63.9	Low	41 Å²	41	80.2 Å²	80.2	22%	0.215	42%	0.415	C	S	.	.	S	Bend	trans	-68	148.5	167.1	-67.4	174.7	0	0	0	110.2	M545 P578 F651	M545-L549 PolarHBondContact O-N 3.35Å; L549-P578 HydrophobicContact CD2-CB 4.11Å; L549-P578 HydrophobicContact CD2-CG 3.91Å; L549-F651 HydrophobicContact CD1-CD1 4.25Å; L549-F651 HydrophobicContact CD1-CE1 3.69Å
550	R	50.2	Low	65.4	Low	173 Å²	173	79 Å²	79	65%	0.653	41%	0.406	S	S	*	.			trans	-63.5	145.4	177.3	-75.7	-177.3	-179.6	155.3	1.8	110	S552	R550-S552 VanDerWaalsContact CB-O 3.26Å; R550-S552 WeakPolarHBondContact CB-O 3.48Å; R550-S552 CarbonylContact O-C 3.57Å; R550-S552 PolarHBondContact O-N 3.12Å
551	P	52.3	Low	66.9	Low	147 Å²	147	73.9 Å²	73.9	96%	0.955	38%	0.383	S	S	*	.	S	Bend	trans	-65.9	2.9	177.6	28.1	-36.6	0	0	0	114.5
552	S	62.1	Low	68.3	Low	77 Å²	77	73.6 Å²	73.6	54%	0.538	39%	0.388	S	S	.	.	S	Bend	trans	-134.6	138.2	154.6	48	0	0	0	0	107.8	R550	R550-S552 VanDerWaalsContact CB-O 3.26Å; R550-S552 WeakPolarHBondContact CB-O 3.48Å; R550-S552 CarbonylContact O-C 3.57Å; R550-S552 PolarHBondContact O-N 3.12Å
553	P	71.5	Confident	69.9	Low	36 Å²	36	80.3 Å²	80.3	23%	0.234	42%	0.424	C	S	.	.			trans	-59.9	150.9	177.1	25.8	-33.9	0	0	0	109.9	C555 L580 W632	P553-C555 PolarHBondContact O-N 3.15Å; P553-L580 HydrophobicContact CB-CD1 4.14Å; P553-L580 HydrophobicContact CG-CD1 4.46Å; P553-W632 HydrophobicContact CG-CD2 3.97Å; P553-W632 HydrophobicContact CG-CE3 4.28Å; P553-W632 HydrophobicContact CG-CH2 4.03Å; P553-W632 HydrophobicContact CG-CZ2 3.72Å; P553-W632 HydrophobicContact CG-CZ3 4.29Å
554	P	82.7	Confident	71.8	Confident	22 Å²	22	79 Å²	79	14%	0.143	42%	0.416	C	S	.	.	S	Bend	trans	-70.3	25.7	-178.9	31.1	-37.4	0	0	0	113.8	V569 A570 L573 I579	P554-V569 WeakPolarHBondContact O-CG1 3.45Å; P554-A570 WeakPolarHBondContact O-CB 3.34Å; P554-A570 PolarHBondContact O-N 3.32Å; P554-L573 HydrophobicContact CB-CD2 4.34Å; P554-L573 HydrophobicContact CG-CD1 4.29Å; P554-L573 HydrophobicContact CG-CD2 4.36Å; P554-I579 WeakPolarHBondContact CD-O 3.37Å
555	C	89.5	Confident	73.7	Confident	5 Å²	5	78.1 Å²	78.1	3%	0.034	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	163.2	-170.2	-59.8	0	0	0	0	112.4	P553 L567 V568 I579 W632	P553-C555 PolarHBondContact O-N 3.15Å; C555-L567 HydrophobicContact CB-CD1 3.53Å; C555-L567 HydrophobicContact CB-CD2 4.34Å; C555-L567 HydrophobicContact CB-CG 3.88Å; C555-V568 CarbonylContact C-O 3.54Å; C555-V568 VanDerWaalsContact CA-O 3.25Å; C555-V568 WeakPolarHBondContact CA-O 3.38Å; C555-I579 WeakPolarHBondContact SG-CG2 3.29Å; C555-W632 HydrophobicContact CB-CZ3 4.45Å; C555-W632 WeakPolarHBondContact O-CZ3 3.42Å
556	K	90.7	Very high	75.7	Confident	128 Å²	128	76.2 Å²	76.2	56%	0.557	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.1	143.1	171.4	-66.5	-171.2	178.1	-170.4	0	109	L558 V568 A570	K556-L558 HydrophobicContact CB-CG 4.35Å; K556-V568 PolarHBondContact N-O 3.24Å; K556-V568 PolarHBondContact O-N 3.11Å; K556-A570 HydrophobicContact CG-CB 4.39Å
557	V	92.1	Very high	77.7	Confident	48 Å²	48	73.8 Å²	73.8	29%	0.291	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	123.8	168.9	178.7	0	0	0	0	108.2	T565 W632 H635	V557-T565 HydrophobicContact CG1-CG2 4.2Å; V557-W632 HydrophobicContact CG2-CE3 4.2Å; V557-W632 HydrophobicContact CG2-CZ3 4.41Å; V557-H635 HydrophobicContact CG1-CB 4.35Å; V557-H635 VanDerWaalsContact CG1-CD2 3.47Å; V557-H635 WeakPolarHBondContact CG1-CD2 3.07Å; V557-H635 HydrophobicContact CG2-CB 4.16Å
558	L	90.8	Very high	79.9	Confident	56 Å²	56	66.9 Å²	66.9	29%	0.293	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	158.2	-179.7	-66.9	178.1	0	0	0	110.9	Y336 K556 V560 T565 G566 V568	Y336-L558 HydrophobicContact CE1-CD1 4.01Å; K556-L558 HydrophobicContact CB-CG 4.35Å; L558-V560 PolarHBondContact O-N 3.05Å; L558-T565 CarbonylContact O-C 3.59Å; L558-T565 VanDerWaalsContact O-CA 3.3Å; L558-T565 WeakPolarHBondContact O-CA 3.43Å; L558-G566 PolarHBondContact N-O 3.44Å; L558-G566 PolarHBondContact O-N 3.13Å; L558-V568 HydrophobicContact CB-CB 4.38Å; L558-V568 HydrophobicContact CB-CG2 4.09Å; L558-V568 HydrophobicContact CD1-CB 4.01Å; L558-V568 HydrophobicContact CD1-CG1 3.92Å; L558-V568 HydrophobicContact CD1-CG2 4.42Å; L558-V568 HydrophobicContact CG-CB 4.41Å
559	Y	90.4	Very high	81.8	Confident	132 Å²	132	60 Å²	60	52%	0.518	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	109.2	170.7	-75.9	-79	0	0	0	110.2	I339 I564 T565	I339-Y559 WeakPolarHBondContact CD1-O 3.42Å; I339-Y559 VanDerWaalsContact CG1-O 3.32Å; I339-Y559 WeakPolarHBondContact CG1-O 3.45Å; Y559-I564 CarbonylContact C-O 3.53Å; Y559-I564 WeakPolarHBondContact CA-O 3.17Å; Y559-T565 HydrophobicContact CD1-CG2 3.8Å; Y559-T565 HydrophobicContact CD2-CG2 4.45Å; Y559-T565 HydrophobicContact CE1-CG2 3.64Å; Y559-T565 HydrophobicContact CE2-CG2 4.31Å; Y559-T565 HydrophobicContact CG-CG2 4.21Å
560	V	88.5	Confident	83.6	Confident	20 Å²	20	59.7 Å²	59.7	12%	0.121	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-15.1	178.5	-64.9	0	0	0	0	112.7	L558 I564 V568 E663	L558-V560 PolarHBondContact O-N 3.05Å; V560-I564 HydrophobicContact CG2-CG2 4.1Å; V560-I564 WeakPolarHBondContact CG2-O 3.38Å; V560-I564 PolarHBondContact N-O 3.06Å; V560-V568 HydrophobicContact CG1-CG2 3.65Å; V560-E663 HydrophobicContact CG1-CB 4.27Å; V560-E663 HydrophobicContact CG1-CG 4.1Å
561	A	84.5	Confident	85.4	Confident	37 Å²	37	53.3 Å²	53.3	31%	0.306	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	167	166.2	0	0	0	0	0	109.6	N563 I564	A561-N563 PolarHBondContact O-N 2.71Å; A561-N563 VanDerWaalsContact O-N 3.15Å; A561-I564 HydrophobicContact CB-CB 4.17Å; A561-I564 HydrophobicContact CB-CD1 4.26Å; A561-I564 HydrophobicContact CB-CG1 4.45Å; A561-I564 PolarHBondContact N-O 3.4Å; A561-I564 PolarHBondContact O-N 3.14Å; A561-I564 VanDerWaalsContact O-O 3.12Å
562	P	83.7	Confident	87.3	Confident	67 Å²	67	49.9 Å²	49.9	44%	0.435	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	120.7	179.2	-27.9	36.4	0	0	0	112.6	A342 I564	A342-P562 HydrophobicContact CB-CG 4.32Å; P562-I564 VanDerWaalsContact C-N 3.25Å; P562-I564 PolarHBondContact O-N 2.79Å
563	N	84.6	Confident	88.7	Confident	155 Å²	155	47.1 Å²	47.1	83%	0.829	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	21.9	-173.9	-42.5	-78.1	0	0	0	115.2	A561	A561-N563 PolarHBondContact O-N 2.71Å; A561-N563 VanDerWaalsContact O-N 3.15Å
564	I	88.6	Confident	89.7	Confident	67 Å²	67	47.9 Å²	47.9	34%	0.344	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	110.7	175.4	-54.1	-178	0	0	0	109.5	Y559 V560 A561 P562	Y559-I564 CarbonylContact C-O 3.53Å; Y559-I564 WeakPolarHBondContact CA-O 3.17Å; V560-I564 HydrophobicContact CG2-CG2 4.1Å; V560-I564 WeakPolarHBondContact CG2-O 3.38Å; V560-I564 PolarHBondContact N-O 3.06Å; A561-I564 HydrophobicContact CB-CB 4.17Å; A561-I564 HydrophobicContact CB-CD1 4.26Å; A561-I564 HydrophobicContact CB-CG1 4.45Å; A561-I564 PolarHBondContact N-O 3.4Å; A561-I564 PolarHBondContact O-N 3.14Å; A561-I564 VanDerWaalsContact O-O 3.12Å; P562-I564 VanDerWaalsContact C-N 3.25Å; P562-I564 PolarHBondContact O-N 2.79Å
565	T	92.1	Very high	90.1	Very high	44 Å²	44	50 Å²	50	27%	0.27	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	150.2	169.3	43.8	0	0	0	0	111.5	V557 L558 Y559 H635	V557-T565 HydrophobicContact CG1-CG2 4.2Å; L558-T565 CarbonylContact O-C 3.59Å; L558-T565 VanDerWaalsContact O-CA 3.3Å; L558-T565 WeakPolarHBondContact O-CA 3.43Å; Y559-T565 HydrophobicContact CD1-CG2 3.8Å; Y559-T565 HydrophobicContact CD2-CG2 4.45Å; Y559-T565 HydrophobicContact CE1-CG2 3.64Å; Y559-T565 HydrophobicContact CE2-CG2 4.31Å; Y559-T565 HydrophobicContact CG-CG2 4.21Å; T565-H635 PolarHBondContact OG1-CD2 3.12Å; T565-H635 VanDerWaalsContact OG1-CD2 3.24Å
566	G	91.5	Very high	90	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	159.1	175.6	0	0	0	0	0	111	L558 H635	L558-G566 PolarHBondContact N-O 3.44Å; L558-G566 PolarHBondContact O-N 3.13Å; G566-H635 WeakPolarHBondContact CA-O 3.33Å
567	L	93	Very high	89.9	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	117.6	173.8	-173.1	69	0	0	0	109.3	C555 L580 W632 H635 V636 E663 V664	C555-L567 HydrophobicContact CB-CD1 3.53Å; C555-L567 HydrophobicContact CB-CD2 4.34Å; C555-L567 HydrophobicContact CB-CG 3.88Å; L567-L580 HydrophobicContact CD2-CD2 3.83Å; L567-W632 HydrophobicContact CD1-CE3 3.66Å; L567-W632 HydrophobicContact CD1-CZ3 4.29Å; L567-H635 HydrophobicContact CB-CB 4.45Å; L567-H635 PolarHBondContact N-O 3.47Å; L567-V636 HydrophobicContact CB-CG2 4.04Å; L567-V636 HydrophobicContact CD2-CG2 3.55Å; L567-V636 HydrophobicContact CG-CG2 4.42Å; L567-E663 CarbonylContact O-C 3.56Å; L567-E663 WeakPolarHBondContact O-CA 3.41Å; L567-E663 WeakPolarHBondContact O-CG 3.46Å; L567-V664 HydrophobicContact CB-CB 4.39Å; L567-V664 HydrophobicContact CD2-CB 4.14Å; L567-V664 HydrophobicContact CD2-CG1 4.44Å; L567-V664 HydrophobicContact CD2-CG2 4.32Å; L567-V664 HydrophobicContact CG-CB 4.34Å; L567-V664 HydrophobicContact CG-CG2 4.34Å; L567-V664 PolarHBondContact O-N 2.86Å
568	V	93.1	Very high	89.6	Confident	4 Å²	4	51 Å²	51	2%	0.024	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	139	-174	172.9	0	0	0	0	111	C555 K556 L558 V560 G661 E662 E663	C555-V568 CarbonylContact C-O 3.54Å; C555-V568 VanDerWaalsContact CA-O 3.25Å; C555-V568 WeakPolarHBondContact CA-O 3.38Å; K556-V568 PolarHBondContact N-O 3.24Å; K556-V568 PolarHBondContact O-N 3.11Å; L558-V568 HydrophobicContact CB-CB 4.38Å; L558-V568 HydrophobicContact CB-CG2 4.09Å; L558-V568 HydrophobicContact CD1-CB 4.01Å; L558-V568 HydrophobicContact CD1-CG1 3.92Å; L558-V568 HydrophobicContact CD1-CG2 4.42Å; L558-V568 HydrophobicContact CG-CB 4.41Å; V560-V568 HydrophobicContact CG1-CG2 3.65Å; V568-G661 VanDerWaalsContact CG1-C 3.44Å; V568-G661 WeakPolarHBondContact CG1-O 3.05Å; V568-E662 WeakPolarHBondContact CA-O 3.33Å; V568-E662 WeakPolarHBondContact CG1-O 3.5Å; V568-E663 HydrophobicContact CG2-CB 4.37Å
569	V	92.5	Very high	89.5	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	133	-175.2	-156.6	0	0	0	0	112.3	P554 C571 L573 I658 G661 E662 V664	P554-V569 WeakPolarHBondContact O-CG1 3.45Å; V569-C571 WeakPolarHBondContact CG1-O 3.31Å; V569-L573 HydrophobicContact CG1-CD1 3.58Å; V569-L573 HydrophobicContact CG1-CG 3.8Å; V569-L573 HydrophobicContact CG2-CD1 4.47Å; V569-I658 HydrophobicContact CB-CG2 4.44Å; V569-I658 HydrophobicContact CG2-CB 4.32Å; V569-I658 HydrophobicContact CG2-CG2 3.56Å; V569-G661 PolarHBondContact O-N 3.09Å; V569-E662 PolarHBondContact N-O 3.3Å; V569-V664 HydrophobicContact CG2-CG2 3.35Å
570	A	90.5	Very high	89.3	Confident	36 Å²	36	43.1 Å²	43.1	30%	0.298	27%	0.267	S	S	.	.	S	Bend	trans	-84.2	-16.8	-176.4	0	0	0	0	0	114.2	P554 K556 K660	P554-A570 WeakPolarHBondContact O-CB 3.34Å; P554-A570 PolarHBondContact O-N 3.32Å; K556-A570 HydrophobicContact CG-CB 4.39Å; A570-K660 WeakPolarHBondContact O-CD 3.25Å; A570-K660 WeakPolarHBondContact O-CE 3.41Å; A570-K660 WeakPolarHBondContact O-CG 3.37Å
571	C	89.7	Confident	88.8	Confident	39 Å²	39	43.1 Å²	43.1	26%	0.264	27%	0.266	S	S	.	.	S	Bend	trans	-143.7	157.7	174.4	56.3	0	0	0	0	109.8	V569 L573	V569-C571 WeakPolarHBondContact CG1-O 3.31Å; C571-L573 PolarHBondContact O-N 3.2Å
572	T	92.3	Very high	88.3	Confident	75 Å²	75	41.5 Å²	41.5	46%	0.46	25%	0.252	S	S	.	.			trans	-64.5	135	175.2	-57.7	0	0	0	0	110.5	K657 I658 K660	T572-K657 HydrophobicContact CG2-CG 4.15Å; T572-I658 CarbonylContact C-O 3.6Å; T572-I658 VanDerWaalsContact CA-O 3.29Å; T572-I658 WeakPolarHBondContact CA-O 3.47Å; T572-I658 WeakPolarHBondContact CG2-O 3.33Å; T572-K660 PolarHBondContact OG1-N 3.43Å
573	L	91.4	Very high	87.6	Confident	18 Å²	18	40.6 Å²	40.6	9%	0.094	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-113.1	144.4	175	-62.2	174.1	0	0	0	110.2	P554 V569 C571 V577 I579 K657 I658	P554-L573 HydrophobicContact CB-CD2 4.34Å; P554-L573 HydrophobicContact CG-CD1 4.29Å; P554-L573 HydrophobicContact CG-CD2 4.36Å; V569-L573 HydrophobicContact CG1-CD1 3.58Å; V569-L573 HydrophobicContact CG1-CG 3.8Å; V569-L573 HydrophobicContact CG2-CD1 4.47Å; C571-L573 PolarHBondContact O-N 3.2Å; L573-V577 HydrophobicContact CD2-CG1 4.17Å; L573-I579 HydrophobicContact CD1-CG1 4.1Å; L573-I579 HydrophobicContact CD1-CG2 4.37Å; L573-K657 CarbonylContact O-C 3.52Å; L573-K657 WeakPolarHBondContact O-CA 3.18Å; L573-K657 WeakPolarHBondContact O-CG 3.36Å; L573-I658 PolarHBondContact N-O 3.25Å; L573-I658 PolarHBondContact O-N 3.16Å
574	A	91.1	Very high	87	Confident	53 Å²	53	33.4 Å²	33.4	44%	0.438	20%	0.204	S	C	.	.			trans	-74.7	168	168.2	0	0	0	0	0	111	V577 S654	A574-V577 HydrophobicContact CB-CG2 3.89Å; A574-V577 WeakPolarHBondContact O-CG2 3.18Å; A574-S654 WeakPolarHBondContact O-CB 3.4Å; A574-S654 PolarHBondContact O-OG 3.21Å
575	P	91.2	Very high	86.5	Confident	67 Å²	67	33.2 Å²	33.2	44%	0.435	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	156.4	165.1	-17.2	29.5	0	0	0	112.4	V577	P575-V577 PolarHBondContact O-N 2.77Å; P575-V577 VanDerWaalsContact O-N 3.08Å
576	D	88.2	Confident	85.9	Confident	98 Å²	98	31.2 Å²	31.2	52%	0.524	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	21.6	176.4	-64.4	-74.1	0	0	0	115.9	K645 V653 S654	D576-K645 VanDerWaalsContact OD1-CE 3.31Å; D576-K645 WeakPolarHBondContact OD1-CE 3.3Å; D576-K645 IonicContact OD1-NZ 3.4Å; D576-K645 PolarHBondContact OD1-NZ 2.86Å; D576-V653 HydrophobicContact CB-CG1 4.42Å; D576-S654 VanDerWaalsContact CA-O 3.3Å; D576-S654 WeakPolarHBondContact CA-O 3.46Å; D576-S654 PolarHBondContact N-O 3.08Å; D576-S654 PolarHBondContact N-OG 2.86Å
577	V	88	Confident	85.3	Confident	47 Å²	47	31.2 Å²	31.2	29%	0.285	19%	0.189	S	C	.	.			trans	-86.7	132	172.4	178	0	0	0	0	110.2	L573 A574 P575 I579 V653 S654	L573-V577 HydrophobicContact CD2-CG1 4.17Å; A574-V577 HydrophobicContact CB-CG2 3.89Å; A574-V577 WeakPolarHBondContact O-CG2 3.18Å; P575-V577 PolarHBondContact O-N 2.77Å; P575-V577 VanDerWaalsContact O-N 3.08Å; V577-I579 PolarHBondContact O-N 3.41Å; V577-V653 WeakPolarHBondContact O-CA 3.47Å; V577-S654 PolarHBondContact N-OG 3.48Å; V577-S654 PolarHBondContact O-N 2.77Å; V577-S654 PolarHBondContact O-OG 2.82Å
578	P	86.7	Confident	84.6	Confident	56 Å²	56	32.2 Å²	32.2	36%	0.364	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	128.1	171.7	28.2	-34.4	0	0	0	111.2	L549	L549-P578 HydrophobicContact CD2-CB 4.11Å; L549-P578 HydrophobicContact CD2-CG 3.91Å
579	I	88	Confident	83.8	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-47.4	-173.2	-50.7	-179.2	0	0	0	111.2	P554 C555 L573 V577 L652 I658 V664	P554-I579 WeakPolarHBondContact CD-O 3.37Å; C555-I579 WeakPolarHBondContact SG-CG2 3.29Å; L573-I579 HydrophobicContact CD1-CG1 4.1Å; L573-I579 HydrophobicContact CD1-CG2 4.37Å; V577-I579 PolarHBondContact O-N 3.41Å; I579-L652 HydrophobicContact CD1-CG 4.46Å; I579-L652 PolarHBondContact N-O 3.33Å; I579-I658 HydrophobicContact CD1-CD1 3.73Å; I579-V664 HydrophobicContact CD1-CG1 3.83Å; I579-V664 HydrophobicContact CG2-CG1 4.41Å; I579-V664 HydrophobicContact CG2-CG2 4.27Å
580	L	85.6	Confident	82.8	Confident	20 Å²	20	39.4 Å²	39.4	11%	0.105	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	149.7	-168.5	179.9	63.3	0	0	0	109.8	P553 L567 W632 M633 L652	P553-L580 HydrophobicContact CB-CD1 4.14Å; P553-L580 HydrophobicContact CG-CD1 4.46Å; L567-L580 HydrophobicContact CD2-CD2 3.83Å; L580-W632 HydrophobicContact CD1-CB 3.99Å; L580-W632 HydrophobicContact CD1-CG 4.28Å; L580-W632 HydrophobicContact CD2-CB 3.55Å; L580-W632 HydrophobicContact CG-CB 4.42Å; L580-M633 HydrophobicContact CD2-CG 3.89Å; L580-M633 HydrophobicContact CD2-SD 3.63Å; L580-M633 HydrophobicContact CG-CG 4.44Å; L580-M633 HydrophobicContact CG-SD 4.22Å; L580-L652 HydrophobicContact CB-CB 4.35Å; L580-L652 HydrophobicContact CB-CD2 4.45Å; L580-L652 WeakPolarHBondContact O-CB 3.31Å; L580-L652 PolarHBondContact O-N 3.29Å
581	E	78.6	Confident	81.9	Confident	20 Å²	20	39.9 Å²	39.9	9%	0.093	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	126.2	178.3	-154.3	156.8	10.1	0	0	110.4	L542 T546 F583 F651	L542-E581 WeakPolarHBondContact CD1-OE2 3.39Å; T546-E581 WeakPolarHBondContact CG2-OE1 3.3Å; T546-E581 PolarHBondContact OG1-OE1 2.87Å; T546-E581 PolarHBondContact OG1-OE2 2.94Å; E581-F583 HydrophobicContact CB-CD2 4.13Å; E581-F583 HydrophobicContact CB-CE2 3.99Å; E581-F583 HydrophobicContact CB-CZ 4.47Å; E581-F583 HydrophobicContact CG-CD1 4.28Å; E581-F583 HydrophobicContact CG-CD2 3.89Å; E581-F583 HydrophobicContact CG-CE1 3.86Å; E581-F583 HydrophobicContact CG-CE2 3.44Å; E581-F583 VanDerWaalsContact CG-CE2 3.44Å; E581-F583 HydrophobicContact CG-CG 4.3Å; E581-F583 HydrophobicContact CG-CZ 3.45Å; E581-F583 VanDerWaalsContact CG-CZ 3.45Å; E581-F583 PolarHBondContact O-N 3.02Å; E581-F583 WeakPolarHBondContact OE1-CE2 3.23Å; E581-F583 WeakPolarHBondContact OE2-CZ 3.28Å; E581-F651 HydrophobicContact CB-CD1 4.13Å; E581-F651 HydrophobicContact CB-CE1 3.87Å; E581-F651 VanDerWaalsContact CD-CZ 3.44Å; E581-F651 HydrophobicContact CG-CD1 3.94Å; E581-F651 HydrophobicContact CG-CE1 3.46Å; E581-F651 VanDerWaalsContact CG-CE1 3.46Å; E581-F651 HydrophobicContact CG-CZ 3.88Å; E581-F651 WeakPolarHBondContact OE2-CE1 3.43Å; E581-F651 WeakPolarHBondContact OE2-CZ 3.35Å
582	C	73.5	Confident	80.8	Confident	4 Å²	4	38.1 Å²	38.1	3%	0.027	22%	0.216	C	C	.	.			trans	-87	51	-173.1	-54.8	0	0	0	0	112.9	F625 M633 F650	C582-F625 HydrophobicContact CB-CE1 4.26Å; C582-F625 HydrophobicContact CB-CZ 4.19Å; C582-F625 WeakPolarHBondContact O-CE1 3.17Å; C582-M633 HydrophobicContact CB-CE 3.75Å; C582-M633 HydrophobicContact CB-SD 4.23Å; C582-M633 WeakPolarHBondContact SG-CE 3.24Å; C582-F650 WeakPolarHBondContact CA-O 3.47Å; C582-F650 WeakPolarHBondContact CB-O 3.31Å; C582-F650 PolarHBondContact N-O 3.34Å; C582-F650 PolarHBondContact SG-O 3.47Å
583	F	68.4	Low	79.4	Confident	48 Å²	48	43.6 Å²	43.6	21%	0.211	23%	0.228	C	C	.	.			trans	-69.2	136.1	173.7	-62.7	-46.3	0	0	0	112.4	Y537 L542 E581 F625	Y537-F583 HydrophobicContact CD1-CZ 4.24Å; Y537-F583 AromaticContact CD2-CD1 3.7Å; Y537-F583 HydrophobicContact CD2-CD1 3.7Å; Y537-F583 AromaticContact CD2-CE1 3.36Å; Y537-F583 HydrophobicContact CD2-CE1 3.36Å; Y537-F583 HydrophobicContact CD2-CE2 4.46Å; Y537-F583 HydrophobicContact CD2-CG 4.37Å; Y537-F583 AromaticContact CD2-CZ 3.77Å; Y537-F583 HydrophobicContact CD2-CZ 3.77Å; Y537-F583 HydrophobicContact CE1-CE1 4.44Å; Y537-F583 HydrophobicContact CE1-CE2 4.11Å; Y537-F583 AromaticContact CE1-CZ 3.85Å; Y537-F583 HydrophobicContact CE1-CZ 3.85Å; Y537-F583 HydrophobicContact CE2-CB 4.39Å; Y537-F583 AromaticContact CE2-CD1 3.35Å; Y537-F583 HydrophobicContact CE2-CD1 3.35Å; Y537-F583 AromaticContact CE2-CD2 3.71Å; Y537-F583 HydrophobicContact CE2-CD2 3.71Å; Y537-F583 AromaticContact CE2-CE1 3.25Å; Y537-F583 HydrophobicContact CE2-CE1 3.25Å; Y537-F583 AromaticContact CE2-CE2 3.61Å; Y537-F583 HydrophobicContact CE2-CE2 3.61Å; Y537-F583 AromaticContact CE2-CG 3.57Å; Y537-F583 HydrophobicContact CE2-CG 3.57Å; Y537-F583 AromaticContact CE2-CZ 3.36Å; Y537-F583 HydrophobicContact CE2-CZ 3.36Å; Y537-F583 HydrophobicContact CG-CE1 4.05Å; Y537-F583 HydrophobicContact CG-CZ 4.2Å; Y537-F583 AromaticContact CZ-CD2 3.77Å; Y537-F583 AromaticContact CZ-CE1 3.83Å; Y537-F583 AromaticContact CZ-CE2 3.38Å; Y537-F583 AromaticContact CZ-CZ 3.39Å; Y537-F583 WeakPolarHBondContact OH-CD2 3.1Å; Y537-F583 VanDerWaalsContact OH-CE2 3.23Å; Y537-F583 WeakPolarHBondContact OH-CE2 3.46Å; L542-F583 HydrophobicContact CD2-CE1 4.33Å; L542-F583 HydrophobicContact CD2-CZ 4.1Å; E581-F583 HydrophobicContact CB-CD2 4.13Å; E581-F583 HydrophobicContact CB-CE2 3.99Å; E581-F583 HydrophobicContact CB-CZ 4.47Å; E581-F583 HydrophobicContact CG-CD1 4.28Å; E581-F583 HydrophobicContact CG-CD2 3.89Å; E581-F583 HydrophobicContact CG-CE1 3.86Å; E581-F583 HydrophobicContact CG-CE2 3.44Å; E581-F583 VanDerWaalsContact CG-CE2 3.44Å; E581-F583 HydrophobicContact CG-CG 4.3Å; E581-F583 HydrophobicContact CG-CZ 3.45Å; E581-F583 VanDerWaalsContact CG-CZ 3.45Å; E581-F583 PolarHBondContact O-N 3.02Å; E581-F583 WeakPolarHBondContact OE1-CE2 3.23Å; E581-F583 WeakPolarHBondContact OE2-CZ 3.28Å; F583-F625 WeakPolarHBondContact O-CD1 3.45Å; F583-F625 WeakPolarHBondContact O-CE1 3.27Å
584	G	73.5	Confident	77.9	Confident	4 Å²	4	48 Å²	48	4%	0.041	26%	0.256	C	S	.	.			trans	177.1	147.2	176.8	0	0	0	0	0	110.7	A586 R624	G584-A586 PolarHBondContact O-N 3.32Å; G584-A586 VanDerWaalsContact O-N 3.15Å; G584-R624 CarbonylContact C-O 3.57Å
585	H	78.4	Confident	76.6	Confident	63 Å²	63	49 Å²	49	29%	0.292	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59	116.8	-167.6	179.2	73.3	0	0	0	113.2	W530 R624	W530-H585 AromaticContact CD1-CE1 3.96Å; W530-H585 AromaticContact CD1-ND1 3.81Å; W530-H585 AromaticContact CD2-ND1 3.45Å; W530-H585 AromaticContact CE2-ND1 3.57Å; W530-H585 AromaticContact CE3-ND1 3.98Å; W530-H585 AromaticContact CG-CE1 3.81Å; W530-H585 AromaticContact CG-ND1 3.63Å; W530-H585 AromaticContact NE1-ND1 3.76Å; H585-R624 PolarHBondContact N-O 3.5Å; H585-R624 VanDerWaalsContact O-CB 3.26Å; H585-R624 WeakPolarHBondContact O-CB 3.49Å; H585-R624 PolarHBondContact O-N 2.64Å
586	A	78.2	Confident	75.4	Confident	1 Å²	1	48 Å²	48	1%	0.008	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	137.6	-176.4	0	0	0	0	0	112.6	W530 V533 G584 L623	W530-A586 HydrophobicContact CE3-CB 3.98Å; W530-A586 VanDerWaalsContact CE3-N 3.34Å; W530-A586 HydrophobicContact CZ3-CB 4.39Å; V533-A586 HydrophobicContact CG2-CB 4.18Å; G584-A586 PolarHBondContact O-N 3.32Å; G584-A586 VanDerWaalsContact O-N 3.15Å; A586-L623 HydrophobicContact CB-CD2 3.89Å
587	A	78.8	Confident	74.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	165.1	172.1	0	0	0	0	0	110.2	S526 L621 C622	S526-A587 WeakPolarHBondContact OG-CB 3.43Å; A587-L621 CarbonylContact O-C 3.37Å; A587-L621 WeakPolarHBondContact O-CA 3.46Å; A587-C622 PolarHBondContact N-O 3.42Å; A587-C622 PolarHBondContact O-N 3.41Å
588	L	78.4	Confident	73	Confident	22 Å²	22	50.3 Å²	50.3	12%	0.115	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	149.4	173.4	-58.4	173.5	0	0	0	110.9	L529 K590 E591 C592 V619 L621	L529-L588 HydrophobicContact CD1-CD1 4.32Å; L529-L588 HydrophobicContact CD1-CD2 3.43Å; L529-L588 VanDerWaalsContact CD1-CD2 3.43Å; L529-L588 HydrophobicContact CD1-CG 3.69Å; L588-K590 HydrophobicContact CB-CB 4.33Å; L588-K590 PolarHBondContact O-N 2.88Å; L588-E591 WeakPolarHBondContact CA-OE2 3.42Å; L588-E591 WeakPolarHBondContact CB-OE1 3.23Å; L588-E591 VanDerWaalsContact CB-OE2 3.27Å; L588-E591 WeakPolarHBondContact CB-OE2 3.47Å; L588-E591 PolarHBondContact N-OE2 2.6Å; L588-E591 PolarHBondContact O-N 3.41Å; L588-C592 PolarHBondContact O-N 2.84Å; L588-V619 HydrophobicContact CD2-CG1 3.39Å; L588-L621 HydrophobicContact CD2-CD2 4.04Å
589	A	76.3	Confident	71.9	Confident	33 Å²	33	49.3 Å²	49.3	27%	0.273	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-12.8	169.1	0	0	0	0	0	113.3	K620	A589-K620 HydrophobicContact CB-CB 3.85Å; A589-K620 VanDerWaalsContact CB-O 3.29Å; A589-K620 WeakPolarHBondContact CB-O 3.43Å; A589-K620 PolarHBondContact N-O 2.74Å
590	K	71.8	Confident	71.3	Confident	122 Å²	122	50.6 Å²	50.6	53%	0.53	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-48.3	172	-68.3	177.8	-177.3	171.9	0	111.7	L588 R593	L588-K590 HydrophobicContact CB-CB 4.33Å; L588-K590 PolarHBondContact O-N 2.88Å; K590-R593 VanDerWaalsContact O-CD 3.28Å; K590-R593 WeakPolarHBondContact O-CD 3.49Å; K590-R593 VanDerWaalsContact O-CG 3.23Å; K590-R593 WeakPolarHBondContact O-CG 3.31Å
591	E	71.5	Confident	70.9	Confident	45 Å²	45	50.1 Å²	50.1	21%	0.21	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-65.2	-40.6	173.5	-63.6	86	-105.1	0	0	111.9	H522 L588 R593	H522-E591 HydrophobicContact CB-CG 4.23Å; H522-E591 IonicContact CG-OE1 2.79Å; H522-E591 IonicContact ND1-OE1 2.75Å; L588-E591 WeakPolarHBondContact CA-OE2 3.42Å; L588-E591 WeakPolarHBondContact CB-OE1 3.23Å; L588-E591 VanDerWaalsContact CB-OE2 3.27Å; L588-E591 WeakPolarHBondContact CB-OE2 3.47Å; L588-E591 PolarHBondContact N-OE2 2.6Å; L588-E591 PolarHBondContact O-N 3.41Å; E591-R593 PolarHBondContact O-N 3.34Å
592	C	67.8	Low	70.8	Confident	2 Å²	2	55 Å²	55	1%	0.014	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-73.5	9.8	-174.4	-72.7	0	0	0	0	115.2	L588 T594 R595 V596 C622	L588-C592 PolarHBondContact O-N 2.84Å; C592-T594 PolarHBondContact O-N 3.18Å; C592-T594 VanDerWaalsContact O-N 3.14Å; C592-R595 WeakPolarHBondContact O-CA 3.38Å; C592-R595 WeakPolarHBondContact O-CB 3.43Å; C592-R595 PolarHBondContact O-N 2.86Å; C592-V596 PolarHBondContact O-N 3.15Å; C592-C622 HydrophobicContact CB-CB 3.91Å; C592-C622 VanDerWaalsContact CB-SG 3.55Å
593	R	62.8	Low	70.9	Confident	191 Å²	191	59.3 Å²	59.3	72%	0.721	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-56	-26.7	175.5	-76.4	173.9	174.2	-176.8	-3.6	114.4	K590 E591 R595	K590-R593 VanDerWaalsContact O-CD 3.28Å; K590-R593 WeakPolarHBondContact O-CD 3.49Å; K590-R593 VanDerWaalsContact O-CG 3.23Å; K590-R593 WeakPolarHBondContact O-CG 3.31Å; E591-R593 PolarHBondContact O-N 3.34Å; R593-R595 VanDerWaalsContact C-N 3.28Å
594	T	60	Low	71.5	Confident	110 Å²	110	60 Å²	60	68%	0.675	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-75.9	-15.1	173.8	57.4	0	0	0	0	113.7	C592	C592-T594 PolarHBondContact O-N 3.18Å; C592-T594 VanDerWaalsContact O-N 3.14Å
595	R	63.5	Low	72	Confident	74 Å²	74	60 Å²	60	28%	0.279	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-28.5	-177.6	-57.1	-175.4	-178.4	-113.9	-1.8	112.1	C592 R593 K597 R602	C592-R595 WeakPolarHBondContact O-CA 3.38Å; C592-R595 WeakPolarHBondContact O-CB 3.43Å; C592-R595 PolarHBondContact O-N 2.86Å; R593-R595 VanDerWaalsContact C-N 3.28Å; R595-K597 PolarHBondContact O-N 3.23Å; R595-R602 WeakPolarHBondContact O-CG 3.4Å
596	V	64.9	Low	72.3	Confident	45 Å²	45	57 Å²	57	27%	0.273	29%	0.294	S	S	.	.			trans	-83.9	97.7	174.7	-177	0	0	0	0	110.8	C592 G598 I600	C592-V596 PolarHBondContact O-N 3.15Å; V596-G598 PolarHBondContact O-N 3.49Å; V596-I600 CarbonylContact C-O 3.49Å; V596-I600 VanDerWaalsContact CA-O 3.3Å; V596-I600 WeakPolarHBondContact CA-O 3.38Å
597	K	64	Low	72.5	Confident	148 Å²	148	58.3 Å²	58.3	64%	0.643	30%	0.301	S	S	*	.	B	Isolated β-bridge	trans	-90.1	107.4	179.9	-80.2	-175.5	176	176.5	0	110.9	R595 G599 I600	R595-K597 PolarHBondContact O-N 3.23Å; K597-G599 VanDerWaalsContact C-N 3.35Å; K597-G599 PolarHBondContact O-N 2.89Å; K597-I600 PolarHBondContact N-O 2.8Å; K597-I600 PolarHBondContact O-N 3.21Å
598	G	61.7	Low	72.5	Confident	46 Å²	46	59.7 Å²	59.7	47%	0.474	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	36.2	173.6	0	0	0	0	0	113.8	V596	V596-G598 PolarHBondContact O-N 3.49Å
599	G	65.2	Low	72.3	Confident	36 Å²	36	61.8 Å²	61.8	37%	0.371	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-21.6	-177.7	0	0	0	0	0	114.8	K597	K597-G599 VanDerWaalsContact C-N 3.35Å; K597-G599 PolarHBondContact O-N 2.89Å
600	I	74.2	Confident	72	Confident	29 Å²	29	64.7 Å²	64.7	15%	0.149	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-90.9	126.4	-179.5	-45.2	171.1	0	0	0	110.4	V596 K597 Y670 S675 V677 I679	V596-I600 CarbonylContact C-O 3.49Å; V596-I600 VanDerWaalsContact CA-O 3.3Å; V596-I600 WeakPolarHBondContact CA-O 3.38Å; K597-I600 PolarHBondContact N-O 2.8Å; K597-I600 PolarHBondContact O-N 3.21Å; I600-Y670 HydrophobicContact CB-CE2 4.15Å; I600-Y670 HydrophobicContact CG1-CE2 4.11Å; I600-Y670 HydrophobicContact CG2-CE1 4.45Å; I600-Y670 HydrophobicContact CG2-CE2 3.69Å; I600-S675 WeakPolarHBondContact CD1-OG 2.96Å; I600-V677 HydrophobicContact CD1-CB 4.12Å; I600-I679 HydrophobicContact CD1-CD1 4.15Å; I600-I679 HydrophobicContact CD1-CG1 3.72Å; I600-I679 HydrophobicContact CG1-CD1 4.15Å; I600-I679 HydrophobicContact CG1-CG1 4.22Å
601	P	77.9	Confident	71.9	Confident	9 Å²	9	60.8 Å²	60.8	6%	0.058	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-55.9	159.2	159.8	-22	34.1	0	0	0	112.1	V605 L607 Y670	P601-V605 HydrophobicContact CB-CB 4.23Å; P601-V605 HydrophobicContact CB-CG1 4.32Å; P601-V605 WeakPolarHBondContact CB-O 3.32Å; P601-L607 HydrophobicContact CG-CD1 4Å; P601-L607 HydrophobicContact CG-CD2 4.27Å; P601-L607 HydrophobicContact CG-CG 3.86Å; P601-Y670 VanDerWaalsContact CD-CG 3.47Å; P601-Y670 HydrophobicContact CG-CD1 3.76Å; P601-Y670 HydrophobicContact CG-CE1 4.28Å; P601-Y670 HydrophobicContact CG-CG 4.21Å
602	R	77.1	Confident	71.6	Confident	123 Å²	123	65.8 Å²	65.8	46%	0.464	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-71	161.1	166.2	-74.1	-173.7	-163.5	-161.9	9.8	110.2	R595 V605	R595-R602 WeakPolarHBondContact O-CG 3.4Å; R602-V605 HydrophobicContact CB-CG2 4.19Å; R602-V605 PolarHBondContact O-N 3.33Å; R602-V605 VanDerWaalsContact O-N 3.14Å
603	P	73.7	Confident	71.2	Confident	94 Å²	94	69.3 Å²	69.3	61%	0.61	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.5	144.2	153.8	-27.6	36.4	0	0	0	111	V605	P603-V605 PolarHBondContact O-N 3.02Å; P603-V605 VanDerWaalsContact O-N 3.09Å
604	H	81	Confident	71.2	Confident	62 Å²	62	62.2 Å²	62.2	29%	0.287	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.4	14.7	-179.5	-14	-68.5	0	0	0	115.2	F625 Q634	H604-F625 HydrophobicContact CB-CB 4.1Å; H604-F625 WeakPolarHBondContact CB-O 3.49Å; H604-F625 WeakPolarHBondContact O-CD2 3.44Å; H604-F625 PolarHBondContact O-N 3.24Å; H604-Q634 HydrophobicContact CB-CB 4.43Å; H604-Q634 HydrophobicContact CB-CG 4.19Å; H604-Q634 PolarHBondContact CE1-O 2.9Å; H604-Q634 WeakPolarHBondContact ND1-CA 3.18Å; H604-Q634 WeakPolarHBondContact ND1-CB 3.46Å; H604-Q634 PolarHBondContact ND1-O 2.95Å
605	V	85.2	Confident	71.1	Confident	4 Å²	4	64.8 Å²	64.8	2%	0.024	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	122.4	165.1	-178.7	0	0	0	0	108.7	P601 R602 P603 C622 L623 R638	P601-V605 HydrophobicContact CB-CB 4.23Å; P601-V605 HydrophobicContact CB-CG1 4.32Å; P601-V605 WeakPolarHBondContact CB-O 3.32Å; R602-V605 HydrophobicContact CB-CG2 4.19Å; R602-V605 PolarHBondContact O-N 3.33Å; R602-V605 VanDerWaalsContact O-N 3.14Å; P603-V605 PolarHBondContact O-N 3.02Å; P603-V605 VanDerWaalsContact O-N 3.09Å; V605-C622 HydrophobicContact CG1-CB 4.31Å; V605-L623 WeakPolarHBondContact CA-O 3.42Å; V605-R638 PolarHBondContact O-NH2 2.9Å
606	F	84.8	Confident	70.9	Confident	1 Å²	1	64.7 Å²	64.7	0%	0.004	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	142	176.6	-67.8	-118	0	0	0	110	C622 L623 F625 M633 V636 R638 V666 D669	F606-C622 CarbonylContact O-C 3.54Å; F606-C622 WeakPolarHBondContact O-CA 3.27Å; F606-L623 PolarHBondContact N-O 2.95Å; F606-L623 PolarHBondContact O-N 3.25Å; F606-F625 HydrophobicContact CB-CE2 3.95Å; F606-F625 AromaticContact CD2-CD2 3.35Å; F606-F625 HydrophobicContact CD2-CD2 3.35Å; F606-F625 AromaticContact CD2-CE2 3.18Å; F606-F625 HydrophobicContact CD2-CE2 3.18Å; F606-F625 HydrophobicContact CD2-CG 4.46Å; F606-F625 HydrophobicContact CD2-CZ 4.18Å; F606-F625 AromaticContact CE2-CD2 3.67Å; F606-F625 HydrophobicContact CE2-CD2 3.67Å; F606-F625 AromaticContact CE2-CE2 3.75Å; F606-F625 HydrophobicContact CE2-CE2 3.75Å; F606-F625 HydrophobicContact CE2-CG 4.41Å; F606-F625 HydrophobicContact CG-CD2 4.35Å; F606-F625 AromaticContact CG-CE2 3.77Å; F606-F625 HydrophobicContact CG-CE2 3.77Å; F606-M633 HydrophobicContact CE1-CE 4.15Å; F606-M633 HydrophobicContact CE2-CE 4.16Å; F606-M633 HydrophobicContact CZ-CE 3.77Å; F606-V636 HydrophobicContact CE1-CG1 4.46Å; F606-V636 HydrophobicContact CZ-CB 4.14Å; F606-V636 HydrophobicContact CZ-CG1 4.25Å; F606-R638 VanDerWaalsContact CD2-NH2 3.29Å; F606-R638 VanDerWaalsContact CE2-NH1 3.31Å; F606-V666 HydrophobicContact CE1-CG1 4.45Å; F606-V666 HydrophobicContact CE1-CG2 3.95Å; F606-D669 WeakPolarHBondContact CA-OD2 3.25Å; F606-D669 WeakPolarHBondContact CB-OD2 3.45Å
607	L	82	Confident	70.9	Confident	29 Å²	29	67.6 Å²	67.6	15%	0.152	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	137.5	172.2	-55.1	-175.1	0	0	0	109.5	P601 C622 K646 D669	P601-L607 HydrophobicContact CG-CD1 4Å; P601-L607 HydrophobicContact CG-CD2 4.27Å; P601-L607 HydrophobicContact CG-CG 3.86Å; L607-C622 WeakPolarHBondContact CD2-SG 3.48Å; L607-K646 PolarHBondContact O-NZ 3Å; L607-D669 HydrophobicContact CB-CB 4.26Å; L607-D669 PolarHBondContact N-OD2 2.83Å
608	V	79.3	Confident	71.3	Confident	28 Å²	28	63.8 Å²	63.8	17%	0.17	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	104.8	163.6	179.5	0	0	0	0	106.1	F611 K620 L621 L623	V608-F611 HydrophobicContact CG1-CB 4.26Å; V608-F611 HydrophobicContact CG1-CD2 4.49Å; V608-K620 WeakPolarHBondContact O-CA 3.21Å; V608-L621 HydrophobicContact CB-CB 4.31Å; V608-L621 PolarHBondContact N-O 2.88Å; V608-L621 PolarHBondContact O-N 3.42Å; V608-L623 HydrophobicContact CG2-CD1 3.75Å; V608-L623 HydrophobicContact CG2-CG 3.99Å
609	N	74.8	Confident	71.7	Confident	67 Å²	67	63.4 Å²	63.4	36%	0.358	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	156.1	169.1	-63.8	-76.7	0	0	0	108.6	F611 K620	N609-F611 VanDerWaalsContact C-N 3.3Å; N609-F611 PolarHBondContact O-N 2.99Å; N609-K620 VanDerWaalsContact OD1-CD 3.3Å; N609-K620 WeakPolarHBondContact OD1-CD 3.49Å; N609-K620 VanDerWaalsContact OD1-CE 3.3Å; N609-K620 WeakPolarHBondContact OD1-CE 3.44Å; N609-K620 PolarHBondContact OD1-NZ 3.05Å
610	N	69.7	Low	72.3	Confident	93 Å²	93	67 Å²	67	50%	0.497	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	64	26.5	169.2	-52.3	-4.8	0	0	0	115.4	K612 V619	N610-K612 PolarHBondContact O-N 2.96Å; N610-V619 PolarHBondContact N-O 3.38Å
611	F	69.2	Low	72.5	Confident	41 Å²	41	65.8 Å²	65.8	18%	0.18	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	112.2	170.3	-168.8	-101.5	0	0	0	109.2	V608 N609 V613 V619 L621 F650	V608-F611 HydrophobicContact CG1-CB 4.26Å; V608-F611 HydrophobicContact CG1-CD2 4.49Å; N609-F611 VanDerWaalsContact C-N 3.3Å; N609-F611 PolarHBondContact O-N 2.99Å; F611-V613 HydrophobicContact CD1-CG2 3.93Å; F611-V613 HydrophobicContact CE1-CG2 3.43Å; F611-V613 VanDerWaalsContact CE1-CG2 3.43Å; F611-V613 HydrophobicContact CZ-CG2 4.32Å; F611-V619 PolarHBondContact N-O 2.86Å; F611-V619 WeakPolarHBondContact O-CB 3.49Å; F611-V619 PolarHBondContact O-N 2.68Å; F611-L621 HydrophobicContact CB-CD1 4.07Å; F611-L621 HydrophobicContact CB-CG 4.17Å; F611-L621 HydrophobicContact CD1-CD1 3.56Å; F611-L621 HydrophobicContact CD1-CG 4.21Å; F611-L621 HydrophobicContact CD2-CD1 4.03Å; F611-L621 HydrophobicContact CE1-CD1 3.9Å; F611-L621 HydrophobicContact CE2-CD1 4.36Å; F611-L621 HydrophobicContact CG-CD1 3.62Å; F611-L621 HydrophobicContact CG-CG 4.23Å; F611-L621 HydrophobicContact CZ-CD1 4.29Å; F611-F650 HydrophobicContact CE2-CE2 4.5Å; F611-F650 AromaticContact CE2-CZ 3.8Å; F611-F650 HydrophobicContact CE2-CZ 3.8Å; F611-F650 HydrophobicContact CZ-CZ 4.35Å
612	K	64.8	Low	72.7	Confident	149 Å²	149	65.3 Å²	65.3	65%	0.648	36%	0.36	S	S	*	.			trans	-104.6	137.5	174.5	-66.5	-175.1	179.3	-176.7	0	109.2	N610	N610-K612 PolarHBondContact O-N 2.96Å
613	V	60.3	Low	73	Confident	77 Å²	77	59.7 Å²	59.7	47%	0.467	34%	0.339	S	S	.	.	S	Bend	trans	-113.8	98	169.5	-177.5	0	0	0	0	106.5	F611 T616	F611-V613 HydrophobicContact CD1-CG2 3.93Å; F611-V613 HydrophobicContact CE1-CG2 3.43Å; F611-V613 VanDerWaalsContact CE1-CG2 3.43Å; F611-V613 HydrophobicContact CZ-CG2 4.32Å; V613-T616 PolarHBondContact N-OG1 3.45Å; V613-T616 WeakPolarHBondContact O-CB 3.44Å; V613-T616 VanDerWaalsContact O-CG2 3.31Å; V613-T616 WeakPolarHBondContact O-CG2 3.46Å; V613-T616 PolarHBondContact O-N 2.75Å; V613-T616 PolarHBondContact O-OG1 2.87Å
614	G	62.8	Low	73.4	Confident	41 Å²	41	57.4 Å²	57.4	42%	0.423	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	-140.7	-164.1	0	0	0	0	0	111.8	T616	G614-T616 PolarHBondContact O-N 3.32Å; G614-T616 VanDerWaalsContact O-N 3.09Å
615	D	57.9	Low	73.6	Confident	164 Å²	164	54.5 Å²	54.5	88%	0.877	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	8.9	-177.2	-53	-59.8	0	0	0	114.8
616	T	58.4	Low	73.1	Confident	72 Å²	72	59.9 Å²	59.9	44%	0.442	33%	0.331	S	S	.	.	S	Bend	trans	-66.9	147.9	-178.8	54.1	0	0	0	0	113	V613 G614 S618	V613-T616 PolarHBondContact N-OG1 3.45Å; V613-T616 WeakPolarHBondContact O-CB 3.44Å; V613-T616 VanDerWaalsContact O-CG2 3.31Å; V613-T616 WeakPolarHBondContact O-CG2 3.46Å; V613-T616 PolarHBondContact O-N 2.75Å; V613-T616 PolarHBondContact O-OG1 2.87Å; G614-T616 PolarHBondContact O-N 3.32Å; G614-T616 VanDerWaalsContact O-N 3.09Å; T616-S618 PolarHBondContact O-N 2.99Å
617	S	65.9	Low	72.5	Confident	106 Å²	106	61.2 Å²	61.2	74%	0.741	35%	0.345	S	S	*	.			trans	-57.5	124.9	176	62	0	0	0	0	111.3	V619	S617-V619 WeakPolarHBondContact O-CG2 3.4Å; S617-V619 PolarHBondContact O-N 2.73Å; S617-V619 VanDerWaalsContact O-N 3.1Å
618	S	71.6	Confident	72	Confident	69 Å²	69	66.7 Å²	66.7	48%	0.483	37%	0.37	S	S	.	.			trans	-38.4	109.8	-178.2	46.4	0	0	0	0	115.1	T616	T616-S618 PolarHBondContact O-N 2.99Å
619	V	70.5	Confident	71.6	Confident	38 Å²	38	72.3 Å²	72.3	23%	0.23	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	147.3	179.1	-174.4	0	0	0	0	110.1	L588 N610 F611 S617 L621	L588-V619 HydrophobicContact CD2-CG1 3.39Å; N610-V619 PolarHBondContact N-O 3.38Å; F611-V619 PolarHBondContact N-O 2.86Å; F611-V619 WeakPolarHBondContact O-CB 3.49Å; F611-V619 PolarHBondContact O-N 2.68Å; S617-V619 WeakPolarHBondContact O-CG2 3.4Å; S617-V619 PolarHBondContact O-N 2.73Å; S617-V619 VanDerWaalsContact O-N 3.1Å; V619-L621 HydrophobicContact CG1-CD2 3.83Å; V619-L621 HydrophobicContact CG1-CG 4.4Å
620	K	77	Confident	71.7	Confident	112 Å²	112	70.2 Å²	70.2	49%	0.487	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	108.3	170.2	-62.6	-167.9	176	-144.1	0	109.3	A589 V608 N609	A589-K620 HydrophobicContact CB-CB 3.85Å; A589-K620 VanDerWaalsContact CB-O 3.29Å; A589-K620 WeakPolarHBondContact CB-O 3.43Å; A589-K620 PolarHBondContact N-O 2.74Å; V608-K620 WeakPolarHBondContact O-CA 3.21Å; N609-K620 VanDerWaalsContact OD1-CD 3.3Å; N609-K620 WeakPolarHBondContact OD1-CD 3.49Å; N609-K620 VanDerWaalsContact OD1-CE 3.3Å; N609-K620 WeakPolarHBondContact OD1-CE 3.44Å; N609-K620 PolarHBondContact OD1-NZ 3.05Å
621	L	78.8	Confident	72.2	Confident	2 Å²	2	71 Å²	71	1%	0.01	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	155.4	176.9	-58.9	-179.1	0	0	0	111.2	L529 A587 L588 V608 F611 V619	L529-L621 HydrophobicContact CD1-CD2 4.48Å; A587-L621 CarbonylContact O-C 3.37Å; A587-L621 WeakPolarHBondContact O-CA 3.46Å; L588-L621 HydrophobicContact CD2-CD2 4.04Å; V608-L621 HydrophobicContact CB-CB 4.31Å; V608-L621 PolarHBondContact N-O 2.88Å; V608-L621 PolarHBondContact O-N 3.42Å; F611-L621 HydrophobicContact CB-CD1 4.07Å; F611-L621 HydrophobicContact CB-CG 4.17Å; F611-L621 HydrophobicContact CD1-CD1 3.56Å; F611-L621 HydrophobicContact CD1-CG 4.21Å; F611-L621 HydrophobicContact CD2-CD1 4.03Å; F611-L621 HydrophobicContact CE1-CD1 3.9Å; F611-L621 HydrophobicContact CE2-CD1 4.36Å; F611-L621 HydrophobicContact CG-CD1 3.62Å; F611-L621 HydrophobicContact CG-CG 4.23Å; F611-L621 HydrophobicContact CZ-CD1 4.29Å; V619-L621 HydrophobicContact CG1-CD2 3.83Å; V619-L621 HydrophobicContact CG1-CG 4.4Å
622	C	81.8	Confident	73	Confident	0 Å²	0	73 Å²	73	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	113.4	164.6	-71.2	0	0	0	0	107.9	A587 C592 V605 F606 L607	A587-C622 PolarHBondContact N-O 3.42Å; A587-C622 PolarHBondContact O-N 3.41Å; C592-C622 HydrophobicContact CB-CB 3.91Å; C592-C622 VanDerWaalsContact CB-SG 3.55Å; V605-C622 HydrophobicContact CG1-CB 4.31Å; F606-C622 CarbonylContact O-C 3.54Å; F606-C622 WeakPolarHBondContact O-CA 3.27Å; L607-C622 WeakPolarHBondContact CD2-SG 3.48Å
623	L	82.8	Confident	74.1	Confident	4 Å²	4	66.1 Å²	66.1	2%	0.021	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	133.7	167.7	-58.8	178.9	0	0	0	108.4	A586 V605 F606 V608 F625 F650	A586-L623 HydrophobicContact CB-CD2 3.89Å; V605-L623 WeakPolarHBondContact CA-O 3.42Å; F606-L623 PolarHBondContact N-O 2.95Å; F606-L623 PolarHBondContact O-N 3.25Å; V608-L623 HydrophobicContact CG2-CD1 3.75Å; V608-L623 HydrophobicContact CG2-CG 3.99Å; L623-F625 HydrophobicContact CB-CE2 3.55Å; L623-F625 HydrophobicContact CB-CZ 3.81Å; L623-F625 HydrophobicContact CD1-CZ 4.21Å; L623-F650 HydrophobicContact CD1-CD1 3.86Å; L623-F650 HydrophobicContact CD1-CE1 4Å; L623-F650 HydrophobicContact CD2-CE1 4.17Å
624	R	83.7	Confident	75.3	Confident	47 Å²	47	65 Å²	65	18%	0.177	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	106.3	-172.2	-175.5	-164.1	-53.9	154.6	12.5	110.3	G584 H585 M626	G584-R624 CarbonylContact C-O 3.57Å; H585-R624 PolarHBondContact N-O 3.5Å; H585-R624 VanDerWaalsContact O-CB 3.26Å; H585-R624 WeakPolarHBondContact O-CB 3.49Å; H585-R624 PolarHBondContact O-N 2.64Å; R624-M626 HydrophobicContact CG-CG 3.6Å; R624-M626 PolarHBondContact O-N 3.48Å
625	F	84.6	Confident	76.6	Confident	1 Å²	1	64.9 Å²	64.9	0%	0.004	34%	0.343	C	S	.	.			trans	-91	100.8	-176.8	-57	-91.4	0	0	0	107.9	C582 F583 H604 F606 L623 D630 M633 Q634	C582-F625 HydrophobicContact CB-CE1 4.26Å; C582-F625 HydrophobicContact CB-CZ 4.19Å; C582-F625 WeakPolarHBondContact O-CE1 3.17Å; F583-F625 WeakPolarHBondContact O-CD1 3.45Å; F583-F625 WeakPolarHBondContact O-CE1 3.27Å; H604-F625 HydrophobicContact CB-CB 4.1Å; H604-F625 WeakPolarHBondContact CB-O 3.49Å; H604-F625 WeakPolarHBondContact O-CD2 3.44Å; H604-F625 PolarHBondContact O-N 3.24Å; F606-F625 HydrophobicContact CB-CE2 3.95Å; F606-F625 AromaticContact CD2-CD2 3.35Å; F606-F625 HydrophobicContact CD2-CD2 3.35Å; F606-F625 AromaticContact CD2-CE2 3.18Å; F606-F625 HydrophobicContact CD2-CE2 3.18Å; F606-F625 HydrophobicContact CD2-CG 4.46Å; F606-F625 HydrophobicContact CD2-CZ 4.18Å; F606-F625 AromaticContact CE2-CD2 3.67Å; F606-F625 HydrophobicContact CE2-CD2 3.67Å; F606-F625 AromaticContact CE2-CE2 3.75Å; F606-F625 HydrophobicContact CE2-CE2 3.75Å; F606-F625 HydrophobicContact CE2-CG 4.41Å; F606-F625 HydrophobicContact CG-CD2 4.35Å; F606-F625 AromaticContact CG-CE2 3.77Å; F606-F625 HydrophobicContact CG-CE2 3.77Å; L623-F625 HydrophobicContact CB-CE2 3.55Å; L623-F625 HydrophobicContact CB-CZ 3.81Å; L623-F625 HydrophobicContact CD1-CZ 4.21Å; F625-D630 VanDerWaalsContact CA-OD2 3.27Å; F625-D630 WeakPolarHBondContact CA-OD2 3.26Å; F625-D630 HydrophobicContact CB-CB 3.98Å; F625-D630 HydrophobicContact CD1-CB 4.29Å; F625-M633 HydrophobicContact CB-CB 4.29Å; F625-M633 HydrophobicContact CD1-CB 3.18Å; F625-M633 HydrophobicContact CD1-CE 4.38Å; F625-M633 HydrophobicContact CD1-CG 3.76Å; F625-M633 HydrophobicContact CE1-CB 3.59Å; F625-M633 HydrophobicContact CE1-CE 3.72Å; F625-M633 HydrophobicContact CE1-CG 3.65Å; F625-M633 HydrophobicContact CE2-CE 4.43Å; F625-M633 HydrophobicContact CG-CB 3.82Å; F625-M633 HydrophobicContact CZ-CE 3.77Å; F625-Q634 HydrophobicContact CB-CG 4.16Å
626	M	74.8	Confident	78.2	Confident	117 Å²	117	57.2 Å²	57.2	58%	0.576	30%	0.302	S	S	*	.			trans	-146.9	-12.4	-172.5	-68.7	-74.1	-34.7	0	0	113.3	R624 D630	R624-M626 HydrophobicContact CG-CG 3.6Å; R624-M626 PolarHBondContact O-N 3.48Å; M626-D630 PolarHBondContact N-OD2 3.07Å
627	G	72.7	Confident	79.8	Confident	29 Å²	29	56 Å²	56	30%	0.299	29%	0.289	S	S	.	.	S	Bend	trans	-72.3	170.5	171.1	0	0	0	0	0	112.3	D630 Q634	G627-D630 PolarHBondContact N-OD2 2.72Å; G627-D630 PolarHBondContact O-N 3.05Å; G627-Q634 PolarHBondContact O-NE2 3.45Å
628	E	71.6	Confident	81	Confident	144 Å²	144	52.3 Å²	52.3	67%	0.673	26%	0.259	S	S	*	.	S	Bend	trans	-75.1	-33.2	175.3	-62.9	-176.5	148.1	0	0	110.1	K446 D630 Q631	K446-E628 VanDerWaalsContact NZ-CD 3.34Å; K446-E628 IonicContact NZ-OE1 3.57Å; K446-E628 PolarHBondContact NZ-OE1 3.24Å; K446-E628 IonicContact NZ-OE2 2.64Å; K446-E628 PolarHBondContact NZ-OE2 3.16Å; E628-D630 VanDerWaalsContact C-N 3.32Å; E628-D630 PolarHBondContact O-N 3.19Å; E628-Q631 WeakPolarHBondContact O-CB 3.26Å; E628-Q631 PolarHBondContact O-N 3.07Å
629	D	69.2	Low	81.9	Confident	146 Å²	146	49.1 Å²	49.1	78%	0.781	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-37.9	170.6	-39.5	-75.2	0	0	0	112	Q631	D629-Q631 PolarHBondContact O-N 2.89Å; D629-Q631 VanDerWaalsContact O-N 3.12Å
630	D	77.2	Confident	82.8	Confident	22 Å²	22	48.8 Å²	48.8	12%	0.118	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-5.7	179.7	-54.8	-19.3	0	0	0	113.5	F625 M626 G627 E628 W632 M633 Q634	F625-D630 VanDerWaalsContact CA-OD2 3.27Å; F625-D630 WeakPolarHBondContact CA-OD2 3.26Å; F625-D630 HydrophobicContact CB-CB 3.98Å; F625-D630 HydrophobicContact CD1-CB 4.29Å; M626-D630 PolarHBondContact N-OD2 3.07Å; G627-D630 PolarHBondContact N-OD2 2.72Å; G627-D630 PolarHBondContact O-N 3.05Å; E628-D630 VanDerWaalsContact C-N 3.32Å; E628-D630 PolarHBondContact O-N 3.19Å; D630-W632 PolarHBondContact O-N 3.34Å; D630-M633 PolarHBondContact O-N 3.17Å; D630-Q634 PolarHBondContact O-N 3.35Å
631	Q	80.3	Confident	83.3	Confident	111 Å²	111	46 Å²	46	52%	0.519	22%	0.224	S	C	.	.	H	α-helix	trans	-53.1	-36.7	-165.9	-177.3	-178.3	77.9	0	0	113.6	E628 D629 Q634 H635	E628-Q631 WeakPolarHBondContact O-CB 3.26Å; E628-Q631 PolarHBondContact O-N 3.07Å; D629-Q631 PolarHBondContact O-N 2.89Å; D629-Q631 VanDerWaalsContact O-N 3.12Å; Q631-Q634 WeakPolarHBondContact O-CB 3.38Å; Q631-Q634 PolarHBondContact O-N 2.89Å; Q631-H635 PolarHBondContact O-ND1 3.45Å
632	W	86.5	Confident	84	Confident	82 Å²	82	48 Å²	48	31%	0.311	24%	0.238	S	C	.	.	H	α-helix	trans	-60.9	-47	176.3	-60.6	100.6	0	0	0	112.5	P553 C555 V557 L567 L580 D630 Q634 H635	P553-W632 HydrophobicContact CG-CD2 3.97Å; P553-W632 HydrophobicContact CG-CE3 4.28Å; P553-W632 HydrophobicContact CG-CH2 4.03Å; P553-W632 HydrophobicContact CG-CZ2 3.72Å; P553-W632 HydrophobicContact CG-CZ3 4.29Å; C555-W632 HydrophobicContact CB-CZ3 4.45Å; C555-W632 WeakPolarHBondContact O-CZ3 3.42Å; V557-W632 HydrophobicContact CG2-CE3 4.2Å; V557-W632 HydrophobicContact CG2-CZ3 4.41Å; L567-W632 HydrophobicContact CD1-CE3 3.66Å; L567-W632 HydrophobicContact CD1-CZ3 4.29Å; L580-W632 HydrophobicContact CD1-CB 3.99Å; L580-W632 HydrophobicContact CD1-CG 4.28Å; L580-W632 HydrophobicContact CD2-CB 3.55Å; L580-W632 HydrophobicContact CG-CB 4.42Å; D630-W632 PolarHBondContact O-N 3.34Å; W632-Q634 VanDerWaalsContact C-N 3.29Å; W632-Q634 PolarHBondContact O-N 3.1Å; W632-H635 PolarHBondContact O-N 3.37Å; W632-H635 VanDerWaalsContact O-N 3.17Å
633	M	87.1	Confident	84.4	Confident	5 Å²	5	48.3 Å²	48.3	3%	0.025	24%	0.239	C	C	.	.	H	α-helix	trans	-71	-22.9	-179.4	-75.8	-62.6	-61.7	0	0	113.3	L580 C582 F606 F625 D630 H635 V636	L580-M633 HydrophobicContact CD2-CG 3.89Å; L580-M633 HydrophobicContact CD2-SD 3.63Å; L580-M633 HydrophobicContact CG-CG 4.44Å; L580-M633 HydrophobicContact CG-SD 4.22Å; C582-M633 HydrophobicContact CB-CE 3.75Å; C582-M633 HydrophobicContact CB-SD 4.23Å; C582-M633 WeakPolarHBondContact SG-CE 3.24Å; F606-M633 HydrophobicContact CE1-CE 4.15Å; F606-M633 HydrophobicContact CE2-CE 4.16Å; F606-M633 HydrophobicContact CZ-CE 3.77Å; F625-M633 HydrophobicContact CB-CB 4.29Å; F625-M633 HydrophobicContact CD1-CB 3.18Å; F625-M633 HydrophobicContact CD1-CE 4.38Å; F625-M633 HydrophobicContact CD1-CG 3.76Å; F625-M633 HydrophobicContact CE1-CB 3.59Å; F625-M633 HydrophobicContact CE1-CE 3.72Å; F625-M633 HydrophobicContact CE1-CG 3.65Å; F625-M633 HydrophobicContact CE2-CE 4.43Å; F625-M633 HydrophobicContact CG-CB 3.82Å; F625-M633 HydrophobicContact CZ-CE 3.77Å; D630-M633 PolarHBondContact O-N 3.17Å; M633-H635 PolarHBondContact O-N 2.96Å; M633-V636 PolarHBondContact O-N 3.17Å; M633-V636 HydrophobicContact SD-CG2 4.11Å
634	Q	87.1	Confident	84.8	Confident	52 Å²	52	48.1 Å²	48.1	24%	0.243	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-26.8	171.8	-61.7	-172.8	36.3	0	0	112	H604 F625 G627 D630 Q631 W632	H604-Q634 HydrophobicContact CB-CB 4.43Å; H604-Q634 HydrophobicContact CB-CG 4.19Å; H604-Q634 PolarHBondContact CE1-O 2.9Å; H604-Q634 WeakPolarHBondContact ND1-CA 3.18Å; H604-Q634 WeakPolarHBondContact ND1-CB 3.46Å; H604-Q634 PolarHBondContact ND1-O 2.95Å; F625-Q634 HydrophobicContact CB-CG 4.16Å; G627-Q634 PolarHBondContact O-NE2 3.45Å; D630-Q634 PolarHBondContact O-N 3.35Å; Q631-Q634 WeakPolarHBondContact O-CB 3.38Å; Q631-Q634 PolarHBondContact O-N 2.89Å; W632-Q634 VanDerWaalsContact C-N 3.29Å; W632-Q634 PolarHBondContact O-N 3.1Å
635	H	89.7	Confident	85	Confident	39 Å²	39	48.8 Å²	48.8	18%	0.181	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-1.9	-176.4	-66	97.1	0	0	0	114.9	V557 T565 G566 L567 Q631 W632 M633 R637	V557-H635 HydrophobicContact CG1-CB 4.35Å; V557-H635 VanDerWaalsContact CG1-CD2 3.47Å; V557-H635 WeakPolarHBondContact CG1-CD2 3.07Å; V557-H635 HydrophobicContact CG2-CB 4.16Å; T565-H635 PolarHBondContact OG1-CD2 3.12Å; T565-H635 VanDerWaalsContact OG1-CD2 3.24Å; G566-H635 WeakPolarHBondContact CA-O 3.33Å; L567-H635 HydrophobicContact CB-CB 4.45Å; L567-H635 PolarHBondContact N-O 3.47Å; Q631-H635 PolarHBondContact O-ND1 3.45Å; W632-H635 PolarHBondContact O-N 3.37Å; W632-H635 VanDerWaalsContact O-N 3.17Å; M633-H635 PolarHBondContact O-N 2.96Å; H635-R637 PolarHBondContact O-N 3.26Å
636	V	91	Very high	84.8	Confident	3 Å²	3	52 Å²	52	2%	0.018	26%	0.256	C	S	.	.			trans	-81.8	110.2	-176.9	176.1	0	0	0	0	111.4	L567 F606 M633 R638 L652 V666	L567-V636 HydrophobicContact CB-CG2 4.04Å; L567-V636 HydrophobicContact CD2-CG2 3.55Å; L567-V636 HydrophobicContact CG-CG2 4.42Å; F606-V636 HydrophobicContact CE1-CG1 4.46Å; F606-V636 HydrophobicContact CZ-CB 4.14Å; F606-V636 HydrophobicContact CZ-CG1 4.25Å; M633-V636 PolarHBondContact O-N 3.17Å; M633-V636 HydrophobicContact SD-CG2 4.11Å; V636-R638 PolarHBondContact O-NH1 3.07Å; V636-R638 VanDerWaalsContact O-NH1 3.14Å; V636-L652 HydrophobicContact CG2-CD2 4.36Å; V636-V666 HydrophobicContact CG1-CB 4.43Å; V636-V666 HydrophobicContact CG1-CG1 3.66Å; V636-V666 HydrophobicContact CG1-CG2 4.06Å
637	R	91.6	Very high	84.3	Confident	46 Å²	46	47.7 Å²	47.7	17%	0.174	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	161.2	-177.3	-58.6	-160.3	-57.8	143.8	6	112.6	H635 E663 C665 V666 A682 S685	H635-R637 PolarHBondContact O-N 3.26Å; R637-E663 WeakPolarHBondContact CG-OE1 3.36Å; R637-E663 IonicContact CZ-OE1 2.62Å; R637-E663 IonicContact CZ-OE2 3.69Å; R637-E663 IonicContact NE-OE1 2.74Å; R637-E663 PolarHBondContact NE-OE1 3.43Å; R637-E663 IonicContact NE-OE2 3.62Å; R637-E663 IonicContact NH2-OE1 2.83Å; R637-E663 PolarHBondContact NH2-OE1 3.37Å; R637-E663 IonicContact NH2-OE2 2.64Å; R637-E663 PolarHBondContact NH2-OE2 2.99Å; R637-C665 WeakPolarHBondContact O-CA 3.49Å; R637-V666 WeakPolarHBondContact O-CG2 3.27Å; R637-V666 PolarHBondContact O-N 3.33Å; R637-A682 HydrophobicContact CB-CB 4.12Å; R637-S685 PolarHBondContact NH2-OG 3.3Å
638	R	91.3	Very high	83.4	Confident	29 Å²	29	53.3 Å²	53.3	11%	0.109	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	138.7	179.9	-77.8	61.6	169	165.6	0	110.8	V605 F606 V636 V666 F668 D669 A682	V605-R638 PolarHBondContact O-NH2 2.9Å; F606-R638 VanDerWaalsContact CD2-NH2 3.29Å; F606-R638 VanDerWaalsContact CE2-NH1 3.31Å; V636-R638 PolarHBondContact O-NH1 3.07Å; V636-R638 VanDerWaalsContact O-NH1 3.14Å; R638-V666 CarbonylContact C-O 3.56Å; R638-V666 WeakPolarHBondContact CA-O 3.47Å; R638-V666 HydrophobicContact CG-CG2 4.02Å; R638-F668 HydrophobicContact CB-CD1 3.69Å; R638-F668 HydrophobicContact CB-CD2 4.23Å; R638-F668 HydrophobicContact CB-CE1 3.47Å; R638-F668 VanDerWaalsContact CB-CE1 3.47Å; R638-F668 HydrophobicContact CB-CE2 4.05Å; R638-F668 HydrophobicContact CB-CG 4.06Å; R638-F668 HydrophobicContact CB-CZ 3.67Å; R638-F668 HydrophobicContact CG-CD1 3.98Å; R638-F668 HydrophobicContact CG-CE1 4.19Å; R638-F668 HydrophobicContact CG-CG 4.39Å; R638-D669 IonicContact NE-OD1 3.7Å; R638-D669 IonicContact NH2-OD1 2.76Å; R638-D669 IonicContact NH2-OD2 3.43Å; R638-A682 WeakPolarHBondContact O-CB 3.39Å; R638-A682 PolarHBondContact O-N 3.27Å
639	S	91.6	Very high	82.8	Confident	2 Å²	2	50 Å²	50	1%	0.014	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	149.8	180	-174.2	0	0	0	0	112.2	H641 V666 F668 C683 I686	S639-H641 PolarHBondContact OG-N 3.16Å; S639-H641 PolarHBondContact OG-O 2.88Å; S639-V666 PolarHBondContact N-O 3.33Å; S639-F668 VanDerWaalsContact C-CE2 3.44Å; S639-F668 VanDerWaalsContact O-CD2 3.31Å; S639-F668 WeakPolarHBondContact O-CD2 3.15Å; S639-C683 PolarHBondContact OG-SG 2.84Å; S639-I686 WeakPolarHBondContact OG-CD1 3.4Å
640	C	89.5	Confident	82.9	Confident	32 Å²	32	45.2 Å²	45.2	22%	0.216	22%	0.218	C	C	.	.	S	Bend	trans	-73.3	-18.8	164.8	73.7	0	0	0	0	112.4	C681 C683 H693 C695 P696 V697	C640-C681 PolarHBondContact N-SG 2.9Å; C640-C683 WeakPolarHBondContact CA-SG 3.35Å; C640-C683 WeakPolarHBondContact CB-SG 3.4Å; C640-C683 PolarHBondContact N-SG 3.3Å; C640-C683 WeakPolarHBondContact SG-CB 3.05Å; C640-C683 CovalentContact SG-SG 2.04Å; C640-C683 PolarHBondContact SG-SG 3.09Å; C640-H693 PolarHBondContact SG-CE1 3.14Å; C640-C695 PolarHBondContact SG-SG 3.32Å; C640-P696 HydrophobicContact CB-CG 4.34Å; C640-V697 HydrophobicContact CB-CG2 4.37Å
641	H	87.8	Confident	83.1	Confident	53 Å²	53	45 Å²	45	25%	0.245	22%	0.216	C	C	.	.	S	Bend	trans	-136.3	79.2	-176.9	-138.1	91.7	0	0	0	106.8	Y93 S639 C683 I686 H693	Y93-H641 AromaticContact CD1-NE2 3.88Å; Y93-H641 AromaticContact CE1-CE1 3.38Å; Y93-H641 WeakPolarHBondContact CE1-CE1 3.25Å; Y93-H641 AromaticContact CE1-NE2 3.56Å; Y93-H641 AromaticContact CZ-CE1 3.54Å; S639-H641 PolarHBondContact OG-N 3.16Å; S639-H641 PolarHBondContact OG-O 2.88Å; H641-C683 PolarHBondContact N-SG 3.38Å; H641-I686 WeakPolarHBondContact O-CD1 2.98Å; H641-H693 AromaticContact ND1-CD2 3.88Å; H641-H693 AromaticContact ND1-NE2 3.87Å
642	P	91.5	Very high	83.5	Confident	44 Å²	44	39.7 Å²	39.7	29%	0.286	19%	0.191	S	C	.	.			trans	-85.4	135.4	-171.3	33.7	-34.9	0	0	0	112.2	T655 C665 V666 P667	P642-T655 PolarHBondContact O-OG1 3.43Å; P642-C665 WeakPolarHBondContact CB-O 3.33Å; P642-V666 VanDerWaalsContact CB-C 3.48Å; P642-P667 HydrophobicContact CG-CB 4.09Å
643	N	91.7	Very high	83.6	Confident	6 Å²	6	36.8 Å²	36.8	3%	0.032	18%	0.182	C	C	.	.	S	Bend	trans	-94.3	1.3	173.5	62.3	-0.9	0	0	0	113	S654 T655 T656 I658 E663 C665	N643-S654 WeakPolarHBondContact O-CA 3.49Å; N643-T655 VanDerWaalsContact CA-OG1 3.26Å; N643-T655 WeakPolarHBondContact CA-OG1 3.06Å; N643-T655 PolarHBondContact O-N 2.95Å; N643-T655 PolarHBondContact O-OG1 3.34Å; N643-T656 WeakPolarHBondContact CB-OG1 3.38Å; N643-I658 HydrophobicContact CB-CD1 4.22Å; N643-I658 HydrophobicContact CB-CG1 4.12Å; N643-I658 WeakPolarHBondContact O-CD1 3.45Å; N643-E663 PolarHBondContact ND2-O 3.34Å; N643-E663 PolarHBondContact OD1-O 3.49Å; N643-C665 PolarHBondContact N-O 3.28Å; N643-C665 PolarHBondContact OD1-N 2.72Å; N643-C665 PolarHBondContact OD1-O 3.02Å
644	S	91.4	Very high	83.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	150.1	171.1	56.6	0	0	0	0	113.2	V653 T655 V664 C665 P667	S644-V653 CarbonylContact C-O 3.58Å; S644-V653 WeakPolarHBondContact CA-O 3.34Å; S644-V653 WeakPolarHBondContact CB-O 3.06Å; S644-T655 PolarHBondContact N-OG1 2.91Å; S644-V664 WeakPolarHBondContact OG-CG1 3.45Å; S644-C665 PolarHBondContact N-O 3.14Å; S644-C665 VanDerWaalsContact N-O 3.15Å; S644-C665 PolarHBondContact OG-O 3.23Å; S644-P667 WeakPolarHBondContact O-CD 3.48Å
645	K	88	Confident	84	Confident	61 Å²	61	36 Å²	36	27%	0.265	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	155.7	175.9	62.1	-176.1	168.1	-168.5	0	109.8	D576 G647 V653 T655	D576-K645 VanDerWaalsContact OD1-CE 3.31Å; D576-K645 WeakPolarHBondContact OD1-CE 3.3Å; D576-K645 IonicContact OD1-NZ 3.4Å; D576-K645 PolarHBondContact OD1-NZ 2.86Å; K645-G647 PolarHBondContact O-N 3.18Å; K645-V653 HydrophobicContact CG-CB 4.37Å; K645-V653 PolarHBondContact N-O 2.8Å; K645-V653 PolarHBondContact O-N 2.82Å; K645-T655 HydrophobicContact CB-CG2 3.66Å; K645-T655 HydrophobicContact CD-CG2 3.78Å; K645-T655 HydrophobicContact CG-CG2 3.63Å
646	K	79.8	Confident	84.1	Confident	69 Å²	69	36.7 Å²	36.7	30%	0.3	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	117.5	162	-61.1	173.4	-167.6	154.9	0	106.8	L607 F651 D669	L607-K646 PolarHBondContact O-NZ 3Å; K646-F651 CarbonylContact C-O 3.56Å; K646-D669 IonicContact NZ-OD2 3.88Å; K646-D669 PolarHBondContact NZ-OD2 3.04Å
647	G	64.9	Low	84.1	Confident	26 Å²	26	42 Å²	42	27%	0.268	21%	0.211	S	C	.	.			trans	-78.2	-173.9	170.8	0	0	0	0	0	112.3	K645 F651	K645-G647 PolarHBondContact O-N 3.18Å; G647-F651 PolarHBondContact N-O 3.27Å
648	L	53.5	Low	84.1	Confident	147 Å²	147	39.8 Å²	39.8	77%	0.77	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-66.2	160.6	165.6	-63.3	171	0	0	0	110.1	F650	L648-F650 VanDerWaalsContact C-N 3.26Å; L648-F650 PolarHBondContact O-N 3.43Å
649	R	57.6	Low	84.1	Confident	76 Å²	76	42.2 Å²	42.2	29%	0.287	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	51.8	37.8	-176.7	-60	-173.2	177.1	-156.2	1.5	114.6	E541 F651 S963	E541-R649 IonicContact OE2-CZ 3.13Å; E541-R649 IonicContact OE2-NH1 2.78Å; E541-R649 PolarHBondContact OE2-NH1 3.44Å; E541-R649 IonicContact OE2-NH2 2.67Å; E541-R649 PolarHBondContact OE2-NH2 3.41Å; R649-F651 HydrophobicContact CB-CD2 4.24Å; R649-F651 HydrophobicContact CB-CE2 4.32Å; R649-F651 VanDerWaalsContact O-CD2 3.27Å; R649-F651 WeakPolarHBondContact O-CD2 3.31Å; R649-F651 PolarHBondContact O-N 3.29Å; R649-F651 VanDerWaalsContact O-N 3.08Å; R649-S963 PolarHBondContact NH2-OG 3.17Å
650	F	71.7	Confident	84	Confident	44 Å²	44	48.6 Å²	48.6	19%	0.193	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	61.2	10	174.5	-56.3	-77.2	0	0	0	117.2	C582 F611 L623 L648	C582-F650 WeakPolarHBondContact CA-O 3.47Å; C582-F650 WeakPolarHBondContact CB-O 3.31Å; C582-F650 PolarHBondContact N-O 3.34Å; C582-F650 PolarHBondContact SG-O 3.47Å; F611-F650 HydrophobicContact CE2-CE2 4.5Å; F611-F650 AromaticContact CE2-CZ 3.8Å; F611-F650 HydrophobicContact CE2-CZ 3.8Å; F611-F650 HydrophobicContact CZ-CZ 4.35Å; L623-F650 HydrophobicContact CD1-CD1 3.86Å; L623-F650 HydrophobicContact CD1-CE1 4Å; L623-F650 HydrophobicContact CD2-CE1 4.17Å; L648-F650 VanDerWaalsContact C-N 3.26Å; L648-F650 PolarHBondContact O-N 3.43Å
651	F	81.3	Confident	84	Confident	18 Å²	18	47.1 Å²	47.1	8%	0.079	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	146	174.2	-70.8	-80.6	0	0	0	112.8	L542 L549 E581 K646 G647 R649 V653	L542-F651 HydrophobicContact CD1-CE2 3.79Å; L542-F651 HydrophobicContact CD1-CZ 3.83Å; L549-F651 HydrophobicContact CD1-CD1 4.25Å; L549-F651 HydrophobicContact CD1-CE1 3.69Å; E581-F651 HydrophobicContact CB-CD1 4.13Å; E581-F651 HydrophobicContact CB-CE1 3.87Å; E581-F651 VanDerWaalsContact CD-CZ 3.44Å; E581-F651 HydrophobicContact CG-CD1 3.94Å; E581-F651 HydrophobicContact CG-CE1 3.46Å; E581-F651 VanDerWaalsContact CG-CE1 3.46Å; E581-F651 HydrophobicContact CG-CZ 3.88Å; E581-F651 WeakPolarHBondContact OE2-CE1 3.43Å; E581-F651 WeakPolarHBondContact OE2-CZ 3.35Å; K646-F651 CarbonylContact C-O 3.56Å; G647-F651 PolarHBondContact N-O 3.27Å; R649-F651 HydrophobicContact CB-CD2 4.24Å; R649-F651 HydrophobicContact CB-CE2 4.32Å; R649-F651 VanDerWaalsContact O-CD2 3.27Å; R649-F651 WeakPolarHBondContact O-CD2 3.31Å; R649-F651 PolarHBondContact O-N 3.29Å; R649-F651 VanDerWaalsContact O-N 3.08Å; F651-V653 HydrophobicContact CB-CG2 4.14Å
652	L	88.2	Confident	84.1	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	123.5	162.8	-170.4	63.8	0	0	0	107.9	I579 L580 V636 V664 V666	I579-L652 HydrophobicContact CD1-CG 4.46Å; I579-L652 PolarHBondContact N-O 3.33Å; L580-L652 HydrophobicContact CB-CB 4.35Å; L580-L652 HydrophobicContact CB-CD2 4.45Å; L580-L652 WeakPolarHBondContact O-CB 3.31Å; L580-L652 PolarHBondContact O-N 3.29Å; V636-L652 HydrophobicContact CG2-CD2 4.36Å; L652-V664 HydrophobicContact CD2-CG1 3.63Å; L652-V664 HydrophobicContact CG-CG1 4.41Å; L652-V666 HydrophobicContact CD1-CG1 3.54Å
653	V	89.4	Confident	84.1	Confident	20 Å²	20	43.6 Å²	43.6	12%	0.121	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138.2	-172.2	179.2	0	0	0	0	109.2	D576 V577 S644 K645 F651	D576-V653 HydrophobicContact CB-CG1 4.42Å; V577-V653 WeakPolarHBondContact O-CA 3.47Å; S644-V653 CarbonylContact C-O 3.58Å; S644-V653 WeakPolarHBondContact CA-O 3.34Å; S644-V653 WeakPolarHBondContact CB-O 3.06Å; K645-V653 HydrophobicContact CG-CB 4.37Å; K645-V653 PolarHBondContact N-O 2.8Å; K645-V653 PolarHBondContact O-N 2.82Å; F651-V653 HydrophobicContact CB-CG2 4.14Å
654	S	92.2	Very high	84.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	137	175.9	51.5	0	0	0	0	111.5	A574 D576 V577 N643	A574-S654 WeakPolarHBondContact O-CB 3.4Å; A574-S654 PolarHBondContact O-OG 3.21Å; D576-S654 VanDerWaalsContact CA-O 3.3Å; D576-S654 WeakPolarHBondContact CA-O 3.46Å; D576-S654 PolarHBondContact N-O 3.08Å; D576-S654 PolarHBondContact N-OG 2.86Å; V577-S654 PolarHBondContact N-OG 3.48Å; V577-S654 PolarHBondContact O-N 2.77Å; V577-S654 PolarHBondContact O-OG 2.82Å; N643-S654 WeakPolarHBondContact O-CA 3.49Å
655	T	90.6	Very high	84.2	Confident	42 Å²	42	43.3 Å²	43.3	26%	0.258	21%	0.212	S	C	.	.	S	Bend	trans	-94.7	-16.1	173.2	48	0	0	0	0	112.7	P642 N643 S644 K645	P642-T655 PolarHBondContact O-OG1 3.43Å; N643-T655 VanDerWaalsContact CA-OG1 3.26Å; N643-T655 WeakPolarHBondContact CA-OG1 3.06Å; N643-T655 PolarHBondContact O-N 2.95Å; N643-T655 PolarHBondContact O-OG1 3.34Å; S644-T655 PolarHBondContact N-OG1 2.91Å; K645-T655 HydrophobicContact CB-CG2 3.66Å; K645-T655 HydrophobicContact CD-CG2 3.78Å; K645-T655 HydrophobicContact CG-CG2 3.63Å
656	T	90.7	Very high	84.4	Confident	52 Å²	52	40.5 Å²	40.5	32%	0.319	20%	0.2	S	C	.	.	S	Bend	trans	-146.2	168.1	-174.3	52.2	0	0	0	0	108.6	N643 I658	N643-T656 WeakPolarHBondContact CB-OG1 3.38Å; T656-I658 PolarHBondContact O-N 2.62Å
657	K	91.7	Very high	84.9	Confident	115 Å²	115	40.1 Å²	40.1	50%	0.5	20%	0.204	S	C	.	.			trans	-57.8	129.4	163.9	-175.4	-163.7	-179.3	-164	0	108	T572 L573 E659	T572-K657 HydrophobicContact CG2-CG 4.15Å; L573-K657 CarbonylContact O-C 3.52Å; L573-K657 WeakPolarHBondContact O-CA 3.18Å; L573-K657 WeakPolarHBondContact O-CG 3.36Å; K657-E659 VanDerWaalsContact CE-OE1 3.29Å; K657-E659 WeakPolarHBondContact CE-OE1 3.15Å; K657-E659 IonicContact NZ-OE1 3.99Å; K657-E659 PolarHBondContact NZ-OE1 2.71Å
658	I	91.9	Very high	86.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-113.7	124.9	175.2	-46.3	-178.4	0	0	0	107.6	V569 T572 L573 I579 N643 T656 E662	V569-I658 HydrophobicContact CB-CG2 4.44Å; V569-I658 HydrophobicContact CG2-CB 4.32Å; V569-I658 HydrophobicContact CG2-CG2 3.56Å; T572-I658 CarbonylContact C-O 3.6Å; T572-I658 VanDerWaalsContact CA-O 3.29Å; T572-I658 WeakPolarHBondContact CA-O 3.47Å; T572-I658 WeakPolarHBondContact CG2-O 3.33Å; L573-I658 PolarHBondContact N-O 3.25Å; L573-I658 PolarHBondContact O-N 3.16Å; I579-I658 HydrophobicContact CD1-CD1 3.73Å; N643-I658 HydrophobicContact CB-CD1 4.22Å; N643-I658 HydrophobicContact CB-CG1 4.12Å; N643-I658 WeakPolarHBondContact O-CD1 3.45Å; T656-I658 PolarHBondContact O-N 2.62Å; I658-E662 HydrophobicContact CG2-CB 3.82Å
659	E	90.5	Very high	87.7	Confident	80 Å²	80	34.6 Å²	34.6	37%	0.374	17%	0.168	S	C	.	.			trans	-87	155.8	-177	-54	-145.6	150.2	0	0	112.9	K657 G661 E662	K657-E659 VanDerWaalsContact CE-OE1 3.29Å; K657-E659 WeakPolarHBondContact CE-OE1 3.15Å; K657-E659 IonicContact NZ-OE1 3.99Å; K657-E659 PolarHBondContact NZ-OE1 2.71Å; E659-G661 PolarHBondContact O-N 3.16Å; E659-E662 HydrophobicContact CB-CG 4.02Å; E659-E662 PolarHBondContact N-OE2 2.94Å; E659-E662 WeakPolarHBondContact O-CB 3.5Å; E659-E662 WeakPolarHBondContact O-CG 3.27Å; E659-E662 PolarHBondContact O-N 2.98Å
660	K	90.8	Very high	88.9	Confident	135 Å²	135	32.7 Å²	32.7	59%	0.587	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	120.4	177.8	176.3	178.2	177.5	-171.5	0	110.6	A570 T572	A570-K660 WeakPolarHBondContact O-CD 3.25Å; A570-K660 WeakPolarHBondContact O-CE 3.41Å; A570-K660 WeakPolarHBondContact O-CG 3.37Å; T572-K660 PolarHBondContact OG1-N 3.43Å
661	G	88.2	Confident	89.6	Confident	2 Å²	2	33.8 Å²	33.8	2%	0.021	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.1	-1.6	-176.3	0	0	0	0	0	114.7	V568 V569 E659	V568-G661 VanDerWaalsContact CG1-C 3.44Å; V568-G661 WeakPolarHBondContact CG1-O 3.05Å; V569-G661 PolarHBondContact O-N 3.09Å; E659-G661 PolarHBondContact O-N 3.16Å
662	E	90.5	Very high	89.8	Confident	20 Å²	20	34.4 Å²	34.4	9%	0.093	17%	0.171	C	C	.	.			trans	-83.5	152.3	171	-61.9	-164.1	124.2	0	0	113	V568 V569 I658 E659 H687	V568-E662 WeakPolarHBondContact CA-O 3.33Å; V568-E662 WeakPolarHBondContact CG1-O 3.5Å; V569-E662 PolarHBondContact N-O 3.3Å; I658-E662 HydrophobicContact CG2-CB 3.82Å; E659-E662 HydrophobicContact CB-CG 4.02Å; E659-E662 PolarHBondContact N-OE2 2.94Å; E659-E662 WeakPolarHBondContact O-CB 3.5Å; E659-E662 WeakPolarHBondContact O-CG 3.27Å; E659-E662 PolarHBondContact O-N 2.98Å; E662-H687 WeakPolarHBondContact OE1-CA 3.4Å; E662-H687 WeakPolarHBondContact OE1-CB 3.46Å; E662-H687 IonicContact OE1-CD2 3.96Å; E662-H687 PolarHBondContact OE1-CD2 3.01Å; E662-H687 IonicContact OE1-CG 3.2Å; E662-H687 PolarHBondContact OE1-N 3.44Å
663	E	92.4	Very high	89.7	Confident	2 Å²	2	43 Å²	43	1%	0.009	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-85.4	130	179.5	-169.6	-173.7	178.7	0	0	112.5	V560 L567 V568 R637 N643 C665 S685	V560-E663 HydrophobicContact CG1-CB 4.27Å; V560-E663 HydrophobicContact CG1-CG 4.1Å; L567-E663 CarbonylContact O-C 3.56Å; L567-E663 WeakPolarHBondContact O-CA 3.41Å; L567-E663 WeakPolarHBondContact O-CG 3.46Å; V568-E663 HydrophobicContact CG2-CB 4.37Å; R637-E663 WeakPolarHBondContact CG-OE1 3.36Å; R637-E663 IonicContact CZ-OE1 2.62Å; R637-E663 IonicContact CZ-OE2 3.69Å; R637-E663 IonicContact NE-OE1 2.74Å; R637-E663 PolarHBondContact NE-OE1 3.43Å; R637-E663 IonicContact NE-OE2 3.62Å; R637-E663 IonicContact NH2-OE1 2.83Å; R637-E663 PolarHBondContact NH2-OE1 3.37Å; R637-E663 IonicContact NH2-OE2 2.64Å; R637-E663 PolarHBondContact NH2-OE2 2.99Å; N643-E663 PolarHBondContact ND2-O 3.34Å; N643-E663 PolarHBondContact OD1-O 3.49Å; E663-C665 PolarHBondContact O-N 3.5Å; E663-S685 WeakPolarHBondContact OE2-CB 3.23Å; E663-S685 PolarHBondContact OE2-OG 3.24Å
664	V	92.3	Very high	89.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.231	C	C	.	.			trans	-74.5	112.4	172.9	-172.8	0	0	0	0	109.8	L567 V569 I579 S644 L652	L567-V664 HydrophobicContact CB-CB 4.39Å; L567-V664 HydrophobicContact CD2-CB 4.14Å; L567-V664 HydrophobicContact CD2-CG1 4.44Å; L567-V664 HydrophobicContact CD2-CG2 4.32Å; L567-V664 HydrophobicContact CG-CB 4.34Å; L567-V664 HydrophobicContact CG-CG2 4.34Å; L567-V664 PolarHBondContact O-N 2.86Å; V569-V664 HydrophobicContact CG2-CG2 3.35Å; I579-V664 HydrophobicContact CD1-CG1 3.83Å; I579-V664 HydrophobicContact CG2-CG1 4.41Å; I579-V664 HydrophobicContact CG2-CG2 4.27Å; S644-V664 WeakPolarHBondContact OG-CG1 3.45Å; L652-V664 HydrophobicContact CD2-CG1 3.63Å; L652-V664 HydrophobicContact CG-CG1 4.41Å
665	C	92.6	Very high	89.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134.9	-175	-62.7	0	0	0	0	112.6	R637 P642 N643 S644 E663 A682 I686	R637-C665 WeakPolarHBondContact O-CA 3.49Å; P642-C665 WeakPolarHBondContact CB-O 3.33Å; N643-C665 PolarHBondContact N-O 3.28Å; N643-C665 PolarHBondContact OD1-N 2.72Å; N643-C665 PolarHBondContact OD1-O 3.02Å; S644-C665 PolarHBondContact N-O 3.14Å; S644-C665 VanDerWaalsContact N-O 3.15Å; S644-C665 PolarHBondContact OG-O 3.23Å; E663-C665 PolarHBondContact O-N 3.5Å; C665-A682 HydrophobicContact CB-CB 4.4Å; C665-A682 VanDerWaalsContact SG-CB 3.51Å; C665-I686 HydrophobicContact CB-CD1 3.65Å; C665-I686 HydrophobicContact CB-CG1 4.38Å
666	V	91.8	Very high	88.7	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	158.4	179	-69.1	0	0	0	0	113.1	F606 V636 R637 R638 S639 P642 L652	F606-V666 HydrophobicContact CE1-CG1 4.45Å; F606-V666 HydrophobicContact CE1-CG2 3.95Å; V636-V666 HydrophobicContact CG1-CB 4.43Å; V636-V666 HydrophobicContact CG1-CG1 3.66Å; V636-V666 HydrophobicContact CG1-CG2 4.06Å; R637-V666 WeakPolarHBondContact O-CG2 3.27Å; R637-V666 PolarHBondContact O-N 3.33Å; R638-V666 CarbonylContact C-O 3.56Å; R638-V666 WeakPolarHBondContact CA-O 3.47Å; R638-V666 HydrophobicContact CG-CG2 4.02Å; S639-V666 PolarHBondContact N-O 3.33Å; P642-V666 VanDerWaalsContact CB-C 3.48Å; L652-V666 HydrophobicContact CD1-CG1 3.54Å
667	P	90.5	Very high	88.4	Confident	61 Å²	61	53 Å²	53	40%	0.396	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	159	165.1	24.5	-34.9	0	0	0	112.5	P642 S644 D669	P642-P667 HydrophobicContact CG-CB 4.09Å; S644-P667 WeakPolarHBondContact O-CD 3.48Å; P667-D669 PolarHBondContact O-N 2.94Å
668	F	89.9	Confident	88.3	Confident	36 Å²	36	52.3 Å²	52.3	16%	0.158	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-69.5	117.4	169.4	-76.5	-87.4	0	0	0	110.9	R638 S639 Y670 I679 C681 V697	R638-F668 HydrophobicContact CB-CD1 3.69Å; R638-F668 HydrophobicContact CB-CD2 4.23Å; R638-F668 HydrophobicContact CB-CE1 3.47Å; R638-F668 VanDerWaalsContact CB-CE1 3.47Å; R638-F668 HydrophobicContact CB-CE2 4.05Å; R638-F668 HydrophobicContact CB-CG 4.06Å; R638-F668 HydrophobicContact CB-CZ 3.67Å; R638-F668 HydrophobicContact CG-CD1 3.98Å; R638-F668 HydrophobicContact CG-CE1 4.19Å; R638-F668 HydrophobicContact CG-CG 4.39Å; S639-F668 VanDerWaalsContact C-CE2 3.44Å; S639-F668 VanDerWaalsContact O-CD2 3.31Å; S639-F668 WeakPolarHBondContact O-CD2 3.15Å; F668-Y670 AromaticContact CD1-CE1 3.91Å; F668-Y670 HydrophobicContact CD1-CE1 3.91Å; F668-Y670 HydrophobicContact CD1-CE2 4.32Å; F668-Y670 AromaticContact CD1-CZ 3.71Å; F668-Y670 PolarHBondContact O-N 2.91Å; F668-I679 HydrophobicContact CD1-CG2 4.4Å; F668-I679 HydrophobicContact CE1-CG2 3.46Å; F668-I679 VanDerWaalsContact CE1-CG2 3.46Å; F668-I679 HydrophobicContact CZ-CG2 3.95Å; F668-C681 HydrophobicContact CZ-CB 4.23Å; F668-V697 HydrophobicContact CD2-CG2 4.36Å; F668-V697 HydrophobicContact CE2-CG2 3.75Å; F668-V697 HydrophobicContact CZ-CG1 4.38Å; F668-V697 HydrophobicContact CZ-CG2 4.07Å
669	D	86.3	Confident	88.1	Confident	20 Å²	20	52.6 Å²	52.6	11%	0.107	26%	0.255	C	S	.	.	S	Bend	trans	-83.3	11.3	178.9	48.9	-8.3	0	0	0	114.1	F606 L607 R638 K646 P667	F606-D669 WeakPolarHBondContact CA-OD2 3.25Å; F606-D669 WeakPolarHBondContact CB-OD2 3.45Å; L607-D669 HydrophobicContact CB-CB 4.26Å; L607-D669 PolarHBondContact N-OD2 2.83Å; R638-D669 IonicContact NE-OD1 3.7Å; R638-D669 IonicContact NH2-OD1 2.76Å; R638-D669 IonicContact NH2-OD2 3.43Å; K646-D669 IonicContact NZ-OD2 3.88Å; K646-D669 PolarHBondContact NZ-OD2 3.04Å; P667-D669 PolarHBondContact O-N 2.94Å
670	Y	84.3	Confident	88	Confident	37 Å²	37	54.5 Å²	54.5	15%	0.145	27%	0.272	C	S	.	.	S	Bend	trans	-148.9	150.2	178.8	59.6	-81.3	0	0	0	110.9	I600 P601 F668 F672 I679	I600-Y670 HydrophobicContact CB-CE2 4.15Å; I600-Y670 HydrophobicContact CG1-CE2 4.11Å; I600-Y670 HydrophobicContact CG2-CE1 4.45Å; I600-Y670 HydrophobicContact CG2-CE2 3.69Å; P601-Y670 VanDerWaalsContact CD-CG 3.47Å; P601-Y670 HydrophobicContact CG-CD1 3.76Å; P601-Y670 HydrophobicContact CG-CE1 4.28Å; P601-Y670 HydrophobicContact CG-CG 4.21Å; F668-Y670 AromaticContact CD1-CE1 3.91Å; F668-Y670 HydrophobicContact CD1-CE1 3.91Å; F668-Y670 HydrophobicContact CD1-CE2 4.32Å; F668-Y670 AromaticContact CD1-CZ 3.71Å; F668-Y670 PolarHBondContact O-N 2.91Å; Y670-F672 PolarHBondContact O-N 3.01Å; Y670-F672 VanDerWaalsContact O-N 3.09Å; Y670-I679 HydrophobicContact CE2-CD1 3.92Å
671	D	85.3	Confident	88.1	Confident	66 Å²	66	49 Å²	49	35%	0.353	25%	0.251	S	S	.	.			trans	-72	104.3	176.5	178.2	4	0	0	0	111.1	R673 K674	D671-R673 PolarHBondContact O-N 2.79Å; D671-R673 VanDerWaalsContact OD1-CB 3.25Å; D671-R673 WeakPolarHBondContact OD1-CB 2.93Å; D671-R673 PolarHBondContact OD1-N 3.31Å; D671-K674 HydrophobicContact CB-CD 4.29Å; D671-K674 HydrophobicContact CB-CG 4.42Å; D671-K674 PolarHBondContact O-N 2.98Å; D671-K674 WeakPolarHBondContact OD2-CG 3.44Å; D671-K674 IonicContact OD2-NZ 3.73Å; D671-K674 PolarHBondContact OD2-NZ 3.45Å
672	F	86	Confident	88.2	Confident	32 Å²	32	49 Å²	49	14%	0.14	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-60.7	-28.9	179.1	62.8	-94.2	0	0	0	113.3	Y670 K674 S675 I679 P696 V697 F700	Y670-F672 PolarHBondContact O-N 3.01Å; Y670-F672 VanDerWaalsContact O-N 3.09Å; F672-K674 PolarHBondContact O-N 3.27Å; F672-S675 WeakPolarHBondContact O-CB 3.46Å; F672-S675 PolarHBondContact O-N 3.5Å; F672-S675 VanDerWaalsContact O-N 3.11Å; F672-I679 HydrophobicContact CB-CD1 3.47Å; F672-I679 VanDerWaalsContact CB-CD1 3.47Å; F672-P696 HydrophobicContact CZ-CB 4.1Å; F672-P696 HydrophobicContact CZ-CG 4.32Å; F672-V697 HydrophobicContact CD1-CG2 4.12Å; F672-V697 HydrophobicContact CD2-CG2 4.17Å; F672-V697 HydrophobicContact CE1-CG2 4.12Å; F672-V697 HydrophobicContact CE2-CG2 4.16Å; F672-V697 HydrophobicContact CG-CG2 4.15Å; F672-V697 HydrophobicContact CZ-CG2 4.14Å; F672-F700 HydrophobicContact CD2-CB 4.15Å; F672-F700 HydrophobicContact CD2-CD1 4.19Å; F672-F700 HydrophobicContact CD2-CG 4.13Å; F672-F700 HydrophobicContact CE2-CB 4.12Å; F672-F700 VanDerWaalsContact O-CE1 3.24Å; F672-F700 WeakPolarHBondContact O-CE1 3.33Å; F672-F700 VanDerWaalsContact O-CZ 3.26Å; F672-F700 WeakPolarHBondContact O-CZ 3.13Å
673	R	85.9	Confident	87.9	Confident	179 Å²	179	48.2 Å²	48.2	68%	0.675	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-66.9	-22.4	-177.9	-58	177.5	174	175.3	-2	112.7	D671 S675 F700	D671-R673 PolarHBondContact O-N 2.79Å; D671-R673 VanDerWaalsContact OD1-CB 3.25Å; D671-R673 WeakPolarHBondContact OD1-CB 2.93Å; D671-R673 PolarHBondContact OD1-N 3.31Å; R673-S675 VanDerWaalsContact C-N 3.25Å; R673-S675 PolarHBondContact O-N 2.81Å; R673-F700 WeakPolarHBondContact O-CE2 3.31Å
674	K	83.7	Confident	86.9	Confident	160 Å²	160	51.9 Å²	51.9	70%	0.696	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-79.6	-2.4	176.4	-69.3	-179.9	174.8	82.5	0	113.6	D671 F672	D671-K674 HydrophobicContact CB-CD 4.29Å; D671-K674 HydrophobicContact CB-CG 4.42Å; D671-K674 PolarHBondContact O-N 2.98Å; D671-K674 WeakPolarHBondContact OD2-CG 3.44Å; D671-K674 IonicContact OD2-NZ 3.73Å; D671-K674 PolarHBondContact OD2-NZ 3.45Å; F672-K674 PolarHBondContact O-N 3.27Å
675	S	84.4	Confident	85.8	Confident	12 Å²	12	52.8 Å²	52.8	8%	0.084	28%	0.276	C	S	.	.			trans	-74.3	151.6	-176.8	179.9	0	0	0	0	114.4	I600 F672 R673 V677	I600-S675 WeakPolarHBondContact CD1-OG 2.96Å; F672-S675 WeakPolarHBondContact O-CB 3.46Å; F672-S675 PolarHBondContact O-N 3.5Å; F672-S675 VanDerWaalsContact O-N 3.11Å; R673-S675 VanDerWaalsContact C-N 3.25Å; R673-S675 PolarHBondContact O-N 2.81Å; S675-V677 PolarHBondContact OG-N 3.34Å; S675-V677 PolarHBondContact OG-O 2.85Å
676	S	82.8	Confident	84.6	Confident	73 Å²	73	53.5 Å²	53.5	51%	0.51	28%	0.28	S	S	.	.	S	Bend	trans	-102.5	-4.1	167.5	57.7	0	0	0	0	113.8	K708	S676-K708 WeakPolarHBondContact O-CE 3.26Å; S676-K708 PolarHBondContact O-NZ 2.89Å
677	V	85.2	Confident	83.3	Confident	80 Å²	80	57.5 Å²	57.5	49%	0.485	30%	0.298	S	S	.	.	S	Bend	trans	-121.2	154	-175.4	-171	0	0	0	0	109.3	I600 S675 L704	I600-V677 HydrophobicContact CD1-CB 4.12Å; S675-V677 PolarHBondContact OG-N 3.34Å; S675-V677 PolarHBondContact OG-O 2.85Å; V677-L704 WeakPolarHBondContact O-CD2 3.27Å
678	Q	88.3	Confident	81.7	Confident	100 Å²	100	57.9 Å²	57.9	47%	0.467	29%	0.294	S	S	.	.			trans	-65	146.2	172.8	-68.5	174.5	-68.2	0	0	110.1	N701 L704 M705	Q678-N701 WeakPolarHBondContact CA-OD1 3.45Å; Q678-N701 WeakPolarHBondContact CB-OD1 3.05Å; Q678-N701 HydrophobicContact CG-CB 4.4Å; Q678-L704 HydrophobicContact CG-CD2 3.92Å; Q678-M705 HydrophobicContact CG-CG 4.49Å
679	I	88.4	Confident	80.1	Confident	6 Å²	6	61.1 Å²	61.1	3%	0.031	32%	0.317	C	S	.	.			trans	-116.2	128.9	-179.1	-70.7	165.5	0	0	0	109	I600 F668 Y670 F672 V697 F700 N701	I600-I679 HydrophobicContact CD1-CD1 4.15Å; I600-I679 HydrophobicContact CD1-CG1 3.72Å; I600-I679 HydrophobicContact CG1-CD1 4.15Å; I600-I679 HydrophobicContact CG1-CG1 4.22Å; F668-I679 HydrophobicContact CD1-CG2 4.4Å; F668-I679 HydrophobicContact CE1-CG2 3.46Å; F668-I679 VanDerWaalsContact CE1-CG2 3.46Å; F668-I679 HydrophobicContact CZ-CG2 3.95Å; Y670-I679 HydrophobicContact CE2-CD1 3.92Å; F672-I679 HydrophobicContact CB-CD1 3.47Å; F672-I679 VanDerWaalsContact CB-CD1 3.47Å; I679-V697 HydrophobicContact CB-CG1 3.91Å; I679-V697 HydrophobicContact CG2-CG1 3.75Å; I679-F700 HydrophobicContact CD1-CE1 4.47Å; I679-N701 PolarHBondContact N-OD1 3.25Å; I679-N701 PolarHBondContact O-ND2 2.95Å
680	T	89.2	Confident	78.8	Confident	120 Å²	120	60.3 Å²	60.3	74%	0.736	31%	0.313	S	S	*	.			trans	-77.6	136	174.5	48.2	0	0	0	0	110.5
681	C	91.1	Very high	77.7	Confident	21 Å²	21	64.3 Å²	64.3	14%	0.142	33%	0.328	C	S	.	.			trans	-126	140.4	-179.1	-169.6	0	0	0	0	109.7	C640 F668 C683 V697	C640-C681 PolarHBondContact N-SG 2.9Å; F668-C681 HydrophobicContact CZ-CB 4.23Å; C681-C683 VanDerWaalsContact C-N 3.34Å; C681-C683 PolarHBondContact SG-SG 3.46Å; C681-V697 HydrophobicContact CB-CB 4.06Å; C681-V697 HydrophobicContact CB-CG1 4.07Å; C681-V697 HydrophobicContact CB-CG2 4.49Å
682	A	90.4	Very high	76.8	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.351	C	S	.	.	S	Bend	trans	-86.3	6.1	-178.9	0	0	0	0	0	114.9	R637 R638 C665 T684 S685	R637-A682 HydrophobicContact CB-CB 4.12Å; R638-A682 WeakPolarHBondContact O-CB 3.39Å; R638-A682 PolarHBondContact O-N 3.27Å; C665-A682 HydrophobicContact CB-CB 4.4Å; C665-A682 VanDerWaalsContact SG-CB 3.51Å; A682-T684 PolarHBondContact O-N 3.44Å; A682-S685 PolarHBondContact O-N 3.28Å; A682-S685 VanDerWaalsContact O-N 3.16Å; A682-S685 PolarHBondContact O-OG 3.35Å; A682-S685 VanDerWaalsContact O-OG 3.05Å
683	C	84.5	Confident	76.3	Confident	5 Å²	5	69.9 Å²	69.9	3%	0.034	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-5.8	-179	-64.5	0	0	0	0	115.2	S639 C640 H641 C681	S639-C683 PolarHBondContact OG-SG 2.84Å; C640-C683 WeakPolarHBondContact CA-SG 3.35Å; C640-C683 WeakPolarHBondContact CB-SG 3.4Å; C640-C683 PolarHBondContact N-SG 3.3Å; C640-C683 WeakPolarHBondContact SG-CB 3.05Å; C640-C683 CovalentContact SG-SG 2.04Å; C640-C683 PolarHBondContact SG-SG 3.09Å; H641-C683 PolarHBondContact N-SG 3.38Å; C681-C683 VanDerWaalsContact C-N 3.34Å; C681-C683 PolarHBondContact SG-SG 3.46Å
684	T	71.8	Confident	76.1	Confident	79 Å²	79	67.2 Å²	67.2	49%	0.485	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-16.9	177.4	47.6	0	0	0	0	114.6	A682 R691	A682-T684 PolarHBondContact O-N 3.44Å; T684-R691 PolarHBondContact O-NE 3.42Å
685	S	68.9	Low	76.4	Confident	19 Å²	19	60.2 Å²	60.2	13%	0.133	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-15.8	-177.5	46.8	0	0	0	0	114.4	R637 E663 A682	R637-S685 PolarHBondContact NH2-OG 3.3Å; E663-S685 WeakPolarHBondContact OE2-CB 3.23Å; E663-S685 PolarHBondContact OE2-OG 3.24Å; A682-S685 PolarHBondContact O-N 3.28Å; A682-S685 VanDerWaalsContact O-N 3.16Å; A682-S685 PolarHBondContact O-OG 3.35Å; A682-S685 VanDerWaalsContact O-OG 3.05Å
686	I	68.1	Low	76.6	Confident	15 Å²	15	61.9 Å²	61.9	8%	0.077	34%	0.338	C	S	.	.	S	Bend	trans	-72.3	163.9	166.5	-58.7	166.6	0	0	0	109	S639 H641 C665 A690	S639-I686 WeakPolarHBondContact OG-CD1 3.4Å; H641-I686 WeakPolarHBondContact O-CD1 2.98Å; C665-I686 HydrophobicContact CB-CD1 3.65Å; C665-I686 HydrophobicContact CB-CG1 4.38Å; I686-A690 HydrophobicContact CB-CB 4.39Å; I686-A690 HydrophobicContact CG2-CB 4.4Å
687	H	63.9	Low	77	Confident	87 Å²	87	58.4 Å²	58.4	40%	0.403	31%	0.314	S	S	.	.			trans	-28.6	149	179.7	-161.7	-107.5	0	0	0	116.4	E662 T689 A690	E662-H687 WeakPolarHBondContact OE1-CA 3.4Å; E662-H687 WeakPolarHBondContact OE1-CB 3.46Å; E662-H687 IonicContact OE1-CD2 3.96Å; E662-H687 PolarHBondContact OE1-CD2 3.01Å; E662-H687 IonicContact OE1-CG 3.2Å; E662-H687 PolarHBondContact OE1-N 3.44Å; H687-T689 PolarHBondContact ND1-OG1 3.05Å; H687-T689 PolarHBondContact O-N 3.35Å; H687-A690 VanDerWaalsContact O-CB 3.28Å; H687-A690 WeakPolarHBondContact O-CB 3.42Å; H687-A690 PolarHBondContact O-N 3.39Å
688	E	57.5	Low	77.1	Confident	69 Å²	69	58.2 Å²	58.2	32%	0.322	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-56.9	-32	-172.4	-48.7	-156.7	147.3	0	0	113.8	R338 A690 R691	R338-E688 IonicContact CZ-OE1 3.6Å; R338-E688 VanDerWaalsContact CZ-OE1 3.25Å; R338-E688 IonicContact NH1-OE1 2.7Å; R338-E688 PolarHBondContact NH1-OE1 3.27Å; R338-E688 IonicContact NH2-OE1 2.66Å; R338-E688 PolarHBondContact NH2-OE1 2.9Å; E688-A690 PolarHBondContact O-N 3.26Å; E688-A690 VanDerWaalsContact O-N 3.13Å; E688-R691 WeakPolarHBondContact O-CB 3.44Å; E688-R691 PolarHBondContact O-N 3.03Å
689	T	55.7	Low	77.2	Confident	103 Å²	103	57.3 Å²	57.3	63%	0.632	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-59.5	-19.4	173.2	51	0	0	0	0	114.5	H687	H687-T689 PolarHBondContact ND1-OG1 3.05Å; H687-T689 PolarHBondContact O-N 3.35Å
690	A	59.7	Low	77.4	Confident	4 Å²	4	58.1 Å²	58.1	3%	0.033	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-83.6	-15	173.9	0	0	0	0	0	113.4	I686 H687 E688	I686-A690 HydrophobicContact CB-CB 4.39Å; I686-A690 HydrophobicContact CG2-CB 4.4Å; H687-A690 VanDerWaalsContact O-CB 3.28Å; H687-A690 WeakPolarHBondContact O-CB 3.42Å; H687-A690 PolarHBondContact O-N 3.39Å; E688-A690 PolarHBondContact O-N 3.26Å; E688-A690 VanDerWaalsContact O-N 3.13Å
691	R	60.4	Low	77.5	Confident	121 Å²	121	53.5 Å²	53.5	46%	0.457	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-33.1	179.2	-63.8	-178.7	168.4	175.3	-1.5	112.9	R338 T684 E688 H693	R338-R691 VanDerWaalsContact NH1-NH1 3.17Å; T684-R691 PolarHBondContact O-NE 3.42Å; E688-R691 WeakPolarHBondContact O-CB 3.44Å; E688-R691 PolarHBondContact O-N 3.03Å; R691-H693 PolarHBondContact O-N 3.42Å
692	D	66.3	Low	77.5	Confident	155 Å²	155	58 Å²	58	83%	0.829	30%	0.297	S	S	*	.	S	Bend	trans	-80.2	-4.6	176.2	-66.2	-23.1	0	0	0	113
693	H	75.3	Confident	77.6	Confident	59 Å²	59	64 Å²	64	27%	0.273	33%	0.325	S	S	.	.	S	Bend	trans	-88.1	129.2	-179.5	155.7	-77.7	0	0	0	112	C640 H641 R691 C695	C640-H693 PolarHBondContact SG-CE1 3.14Å; H641-H693 AromaticContact ND1-CD2 3.88Å; H641-H693 AromaticContact ND1-NE2 3.87Å; R691-H693 PolarHBondContact O-N 3.42Å; H693-C695 PolarHBondContact O-N 3.43Å
694	D	82.8	Confident	77.8	Confident	124 Å²	124	64.9 Å²	64.9	66%	0.663	33%	0.329	S	S	*	.			trans	-62.9	86.7	178	-108.9	-41.4	0	0	0	112.4	P696 L699	D694-P696 VanDerWaalsContact O-CD 3.24Å; D694-P696 WeakPolarHBondContact O-CD 3.3Å; D694-P696 VanDerWaalsContact O-N 3.08Å; D694-L699 HydrophobicContact CB-CD1 4.45Å
695	C	88.5	Confident	78.7	Confident	12 Å²	12	65.6 Å²	65.6	8%	0.081	33%	0.328	C	S	.	.			trans	-60.8	113.1	-173.2	-175.7	0	0	0	0	112	C640 H693 V697 E698 L699	C640-C695 PolarHBondContact SG-SG 3.32Å; H693-C695 PolarHBondContact O-N 3.43Å; C695-V697 PolarHBondContact O-N 2.75Å; C695-E698 HydrophobicContact CB-CB 4Å; C695-E698 HydrophobicContact CB-CG 3.93Å; C695-E698 WeakPolarHBondContact O-CA 3.45Å; C695-E698 WeakPolarHBondContact O-CB 3.49Å; C695-E698 PolarHBondContact O-N 2.93Å; C695-L699 PolarHBondContact O-N 3.23Å
696	P	89.7	Confident	79.7	Confident	47 Å²	47	66.9 Å²	66.9	31%	0.305	34%	0.34	S	S	.	.	H	α-helix	trans	-68.6	-23.9	-174.3	27.9	-35.7	0	0	0	112.5	C640 F672 D694 F700	C640-P696 HydrophobicContact CB-CG 4.34Å; F672-P696 HydrophobicContact CZ-CB 4.1Å; F672-P696 HydrophobicContact CZ-CG 4.32Å; D694-P696 VanDerWaalsContact O-CD 3.24Å; D694-P696 WeakPolarHBondContact O-CD 3.3Å; D694-P696 VanDerWaalsContact O-N 3.08Å; P696-F700 WeakPolarHBondContact O-CB 3.44Å; P696-F700 PolarHBondContact O-N 3.13Å
697	V	90.4	Very high	80.7	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-72	-36.2	172.9	-173.5	0	0	0	0	110.8	C640 F668 F672 I679 C681 C695 N701	C640-V697 HydrophobicContact CB-CG2 4.37Å; F668-V697 HydrophobicContact CD2-CG2 4.36Å; F668-V697 HydrophobicContact CE2-CG2 3.75Å; F668-V697 HydrophobicContact CZ-CG1 4.38Å; F668-V697 HydrophobicContact CZ-CG2 4.07Å; F672-V697 HydrophobicContact CD1-CG2 4.12Å; F672-V697 HydrophobicContact CD2-CG2 4.17Å; F672-V697 HydrophobicContact CE1-CG2 4.12Å; F672-V697 HydrophobicContact CE2-CG2 4.16Å; F672-V697 HydrophobicContact CG-CG2 4.15Å; F672-V697 HydrophobicContact CZ-CG2 4.14Å; I679-V697 HydrophobicContact CB-CG1 3.91Å; I679-V697 HydrophobicContact CG2-CG1 3.75Å; C681-V697 HydrophobicContact CB-CB 4.06Å; C681-V697 HydrophobicContact CB-CG1 4.07Å; C681-V697 HydrophobicContact CB-CG2 4.49Å; C695-V697 PolarHBondContact O-N 2.75Å; V697-N701 WeakPolarHBondContact O-CB 3.23Å; V697-N701 PolarHBondContact O-N 2.98Å; V697-N701 PolarHBondContact O-ND2 3.23Å
698	E	88.8	Confident	81.8	Confident	76 Å²	76	68.7 Å²	68.7	36%	0.355	35%	0.352	S	S	.	.	H	α-helix	trans	-69.9	-42.6	171.5	-74.3	-155.2	175.4	0	0	112.7	C695 F700 N701 K702	C695-E698 HydrophobicContact CB-CB 4Å; C695-E698 HydrophobicContact CB-CG 3.93Å; C695-E698 WeakPolarHBondContact O-CA 3.45Å; C695-E698 WeakPolarHBondContact O-CB 3.49Å; C695-E698 PolarHBondContact O-N 2.93Å; E698-F700 VanDerWaalsContact C-N 3.28Å; E698-F700 PolarHBondContact O-N 3.24Å; E698-N701 CarbonylContact O-C 3.58Å; E698-N701 WeakPolarHBondContact O-CB 3.43Å; E698-N701 PolarHBondContact O-N 2.88Å; E698-N701 VanDerWaalsContact O-N 3.09Å; E698-K702 WeakPolarHBondContact O-CB 3.17Å; E698-K702 WeakPolarHBondContact O-CD 3.47Å; E698-K702 WeakPolarHBondContact O-CG 3.28Å; E698-K702 PolarHBondContact O-N 2.66Å; E698-K702 WeakPolarHBondContact OE2-CE 3.41Å; E698-K702 IonicContact OE2-NZ 3.25Å; E698-K702 PolarHBondContact OE2-NZ 3.02Å
699	L	90.2	Very high	83.2	Confident	82 Å²	82	67.8 Å²	67.8	43%	0.429	36%	0.357	S	S	.	.	H	α-helix	trans	-57.6	-44.9	175.6	-65.7	175.7	0	0	0	110.4	D694 C695 K702 E703	D694-L699 HydrophobicContact CB-CD1 4.45Å; C695-L699 PolarHBondContact O-N 3.23Å; L699-K702 HydrophobicContact CD2-CD 4.46Å; L699-K702 WeakPolarHBondContact O-CB 3.29Å; L699-K702 PolarHBondContact O-N 2.81Å; L699-E703 PolarHBondContact O-N 2.73Å
700	F	91.8	Very high	84.6	Confident	23 Å²	23	71.8 Å²	71.8	10%	0.101	36%	0.36	C	S	.	.	H	α-helix	trans	-59.7	-44.3	171	173.8	-102.6	0	0	0	112.9	F672 R673 I679 P696 E698 K702 E703 L704	F672-F700 HydrophobicContact CD2-CB 4.15Å; F672-F700 HydrophobicContact CD2-CD1 4.19Å; F672-F700 HydrophobicContact CD2-CG 4.13Å; F672-F700 HydrophobicContact CE2-CB 4.12Å; F672-F700 VanDerWaalsContact O-CE1 3.24Å; F672-F700 WeakPolarHBondContact O-CE1 3.33Å; F672-F700 VanDerWaalsContact O-CZ 3.26Å; F672-F700 WeakPolarHBondContact O-CZ 3.13Å; R673-F700 WeakPolarHBondContact O-CE2 3.31Å; I679-F700 HydrophobicContact CD1-CE1 4.47Å; P696-F700 WeakPolarHBondContact O-CB 3.44Å; P696-F700 PolarHBondContact O-N 3.13Å; E698-F700 VanDerWaalsContact C-N 3.28Å; E698-F700 PolarHBondContact O-N 3.24Å; F700-K702 VanDerWaalsContact C-N 3.32Å; F700-K702 PolarHBondContact O-N 3.33Å; F700-E703 PolarHBondContact O-N 3.46Å; F700-L704 HydrophobicContact CZ-CD1 4.15Å; F700-L704 VanDerWaalsContact O-CB 3.26Å; F700-L704 WeakPolarHBondContact O-CB 3.46Å; F700-L704 PolarHBondContact O-N 2.95Å
701	N	91.9	Very high	85.6	Confident	23 Å²	23	79.3 Å²	79.3	12%	0.123	39%	0.392	C	S	.	.	H	α-helix	trans	-61.5	-39	175.8	-74.7	-30.6	0	0	0	112.6	Q678 I679 V697 E698 M705	Q678-N701 WeakPolarHBondContact CA-OD1 3.45Å; Q678-N701 WeakPolarHBondContact CB-OD1 3.05Å; Q678-N701 HydrophobicContact CG-CB 4.4Å; I679-N701 PolarHBondContact N-OD1 3.25Å; I679-N701 PolarHBondContact O-ND2 2.95Å; V697-N701 WeakPolarHBondContact O-CB 3.23Å; V697-N701 PolarHBondContact O-N 2.98Å; V697-N701 PolarHBondContact O-ND2 3.23Å; E698-N701 CarbonylContact O-C 3.58Å; E698-N701 WeakPolarHBondContact O-CB 3.43Å; E698-N701 PolarHBondContact O-N 2.88Å; E698-N701 VanDerWaalsContact O-N 3.09Å; N701-M705 VanDerWaalsContact O-CG 3.29Å; N701-M705 WeakPolarHBondContact O-CG 3.43Å; N701-M705 PolarHBondContact O-N 3.45Å; N701-M705 VanDerWaalsContact O-N 3.17Å
702	K	91.4	Very high	86.4	Confident	115 Å²	115	80.7 Å²	80.7	50%	0.5	40%	0.402	S	S	.	.	H	α-helix	trans	-65.2	-45.5	176.7	-69	157.4	-170.9	165.5	0	109.8	E698 L699 F700 M705 A706	E698-K702 WeakPolarHBondContact O-CB 3.17Å; E698-K702 WeakPolarHBondContact O-CD 3.47Å; E698-K702 WeakPolarHBondContact O-CG 3.28Å; E698-K702 PolarHBondContact O-N 2.66Å; E698-K702 WeakPolarHBondContact OE2-CE 3.41Å; E698-K702 IonicContact OE2-NZ 3.25Å; E698-K702 PolarHBondContact OE2-NZ 3.02Å; L699-K702 HydrophobicContact CD2-CD 4.46Å; L699-K702 WeakPolarHBondContact O-CB 3.29Å; L699-K702 PolarHBondContact O-N 2.81Å; F700-K702 VanDerWaalsContact C-N 3.32Å; F700-K702 PolarHBondContact O-N 3.33Å; K702-M705 PolarHBondContact O-N 3.5Å; K702-A706 PolarHBondContact O-N 3.01Å
703	E	91.2	Very high	86.6	Confident	126 Å²	126	79.5 Å²	79.5	59%	0.589	39%	0.391	S	S	*	.	H	α-helix	trans	-64.2	-46.1	175.2	-167.4	-166.8	169.7	0	0	112.9	L699 F700 M705 A706 S707	L699-E703 PolarHBondContact O-N 2.73Å; F700-E703 PolarHBondContact O-N 3.46Å; E703-M705 PolarHBondContact O-N 2.89Å; E703-A706 WeakPolarHBondContact O-CB 3.44Å; E703-A706 PolarHBondContact O-N 3.15Å; E703-A706 VanDerWaalsContact O-N 3.1Å; E703-S707 WeakPolarHBondContact O-CB 3.33Å; E703-S707 PolarHBondContact O-N 3.03Å
704	L	90.2	Very high	86.2	Confident	23 Å²	23	80.3 Å²	80.3	12%	0.12	40%	0.403	C	S	.	.	H	α-helix	trans	-56	-39.2	177.9	-171.6	82.5	0	0	0	111.3	V677 Q678 F700 K708	V677-L704 WeakPolarHBondContact O-CD2 3.27Å; Q678-L704 HydrophobicContact CG-CD2 3.92Å; F700-L704 HydrophobicContact CZ-CD1 4.15Å; F700-L704 VanDerWaalsContact O-CB 3.26Å; F700-L704 WeakPolarHBondContact O-CB 3.46Å; F700-L704 PolarHBondContact O-N 2.95Å; L704-K708 VanDerWaalsContact CD2-NZ 3.31Å; L704-K708 HydrophobicContact CG-CD 4.41Å; L704-K708 WeakPolarHBondContact O-CB 3.48Å; L704-K708 WeakPolarHBondContact O-CD 3.42Å; L704-K708 VanDerWaalsContact O-CG 3.27Å; L704-K708 WeakPolarHBondContact O-CG 3.44Å; L704-K708 PolarHBondContact O-N 2.86Å
705	M	89.2	Confident	85.4	Confident	95 Å²	95	77.1 Å²	77.1	47%	0.468	39%	0.391	S	S	.	.	H	α-helix	trans	-72.6	-41.7	176.3	-71.4	-67.4	-93.7	0	0	112.4	Q678 N701 K702 E703 S707 K708 A709	Q678-M705 HydrophobicContact CG-CG 4.49Å; N701-M705 VanDerWaalsContact O-CG 3.29Å; N701-M705 WeakPolarHBondContact O-CG 3.43Å; N701-M705 PolarHBondContact O-N 3.45Å; N701-M705 VanDerWaalsContact O-N 3.17Å; K702-M705 PolarHBondContact O-N 3.5Å; E703-M705 PolarHBondContact O-N 2.89Å; M705-S707 VanDerWaalsContact C-N 3.34Å; M705-S707 PolarHBondContact O-N 3.23Å; M705-K708 PolarHBondContact O-N 2.89Å; M705-K708 HydrophobicContact SD-CD 4.49Å; M705-A709 WeakPolarHBondContact O-CB 3.3Å; M705-A709 PolarHBondContact O-N 3.03Å
706	A	91.4	Very high	84.2	Confident	46 Å²	46	83.6 Å²	83.6	38%	0.38	42%	0.418	S	S	.	.	H	α-helix	trans	-59.8	-43	173	0	0	0	0	0	111.9	K702 E703 A709 R710	K702-A706 PolarHBondContact O-N 3.01Å; E703-A706 WeakPolarHBondContact O-CB 3.44Å; E703-A706 PolarHBondContact O-N 3.15Å; E703-A706 VanDerWaalsContact O-N 3.1Å; A706-A709 WeakPolarHBondContact O-CB 3.14Å; A706-A709 PolarHBondContact O-N 2.93Å; A706-R710 WeakPolarHBondContact O-CG 3.26Å; A706-R710 PolarHBondContact O-N 3.42Å
707	S	88	Confident	83.1	Confident	48 Å²	48	87 Å²	87	34%	0.336	43%	0.432	S	S	.	.	H	α-helix	trans	-63	-40.6	175.1	-81.9	0	0	0	0	112.9	E703 M705 K711	E703-S707 WeakPolarHBondContact O-CB 3.33Å; E703-S707 PolarHBondContact O-N 3.03Å; M705-S707 VanDerWaalsContact C-N 3.34Å; M705-S707 PolarHBondContact O-N 3.23Å; S707-K711 WeakPolarHBondContact O-CG 3.1Å; S707-K711 PolarHBondContact O-N 2.73Å; S707-K711 VanDerWaalsContact O-N 3.13Å
708	K	88	Confident	81.6	Confident	91 Å²	91	93.4 Å²	93.4	40%	0.396	47%	0.466	S	S	.	.	H	α-helix	trans	-66.1	-37	173.1	-75.1	166	-178.3	172.3	0	111.9	S676 L704 M705 K712	S676-K708 WeakPolarHBondContact O-CE 3.26Å; S676-K708 PolarHBondContact O-NZ 2.89Å; L704-K708 VanDerWaalsContact CD2-NZ 3.31Å; L704-K708 HydrophobicContact CG-CD 4.41Å; L704-K708 WeakPolarHBondContact O-CB 3.48Å; L704-K708 WeakPolarHBondContact O-CD 3.42Å; L704-K708 VanDerWaalsContact O-CG 3.27Å; L704-K708 WeakPolarHBondContact O-CG 3.44Å; L704-K708 PolarHBondContact O-N 2.86Å; M705-K708 PolarHBondContact O-N 2.89Å; M705-K708 HydrophobicContact SD-CD 4.49Å; K708-K712 WeakPolarHBondContact O-CB 3.37Å; K708-K712 PolarHBondContact O-N 3.17Å; K708-K712 VanDerWaalsContact O-N 3.15Å
709	A	86.8	Confident	80.2	Confident	51 Å²	51	95.5 Å²	95.5	42%	0.421	48%	0.479	S	S	.	.	H	α-helix	trans	-65.7	-47.6	175.2	0	0	0	0	0	112.4	M705 A706 K711 K712 Q713	M705-A709 WeakPolarHBondContact O-CB 3.3Å; M705-A709 PolarHBondContact O-N 3.03Å; A706-A709 WeakPolarHBondContact O-CB 3.14Å; A706-A709 PolarHBondContact O-N 2.93Å; A709-K711 PolarHBondContact O-N 3.29Å; A709-K712 PolarHBondContact O-N 2.79Å; A709-K712 VanDerWaalsContact O-N 3.12Å; A709-Q713 PolarHBondContact O-N 3.39Å
710	R	84.6	Confident	78.7	Confident	186 Å²	186	100.6 Å²	100.6	70%	0.702	50%	0.498	S	S	*	.	H	α-helix	trans	-57.9	-45.9	176.3	-70.4	177.9	-172.3	-129	6.2	111.7	A706 K712 Q713 S714	A706-R710 WeakPolarHBondContact O-CG 3.26Å; A706-R710 PolarHBondContact O-N 3.42Å; R710-K712 VanDerWaalsContact C-N 3.3Å; R710-K712 PolarHBondContact O-N 3.21Å; R710-Q713 PolarHBondContact O-N 2.81Å; R710-Q713 VanDerWaalsContact O-N 3.14Å; R710-S714 PolarHBondContact O-N 3.14Å
711	K	81.1	Confident	76.8	Confident	163 Å²	163	106.2 Å²	106.2	71%	0.709	52%	0.524	S	S	*	.	H	α-helix	trans	-60.1	-36.9	175.7	-72.5	175.4	-179.5	177.2	0	112.6	S707 A709 S715	S707-K711 WeakPolarHBondContact O-CG 3.1Å; S707-K711 PolarHBondContact O-N 2.73Å; S707-K711 VanDerWaalsContact O-N 3.13Å; A709-K711 PolarHBondContact O-N 3.29Å; K711-S715 PolarHBondContact O-N 3.34Å
712	K	76.2	Confident	74.5	Confident	150 Å²	150	113.1 Å²	113.1	65%	0.652	55%	0.548	S	S	*	.	H	α-helix	trans	-75	-18.8	177	-167.8	175.1	-177	178.6	0	114.2	K708 A709 R710 S715	K708-K712 WeakPolarHBondContact O-CB 3.37Å; K708-K712 PolarHBondContact O-N 3.17Å; K708-K712 VanDerWaalsContact O-N 3.15Å; A709-K712 PolarHBondContact O-N 2.79Å; A709-K712 VanDerWaalsContact O-N 3.12Å; R710-K712 VanDerWaalsContact C-N 3.3Å; R710-K712 PolarHBondContact O-N 3.21Å; K712-S715 PolarHBondContact O-OG 3.05Å
713	Q	70.7	Confident	72.4	Confident	129 Å²	129	113.1 Å²	113.1	60%	0.603	56%	0.56	S	S	*	*	H	α-helix	trans	-81.2	-45.6	169.5	-72	174.9	-19.4	0	0	111.1	A709 R710 S715 K716 I717	A709-Q713 PolarHBondContact O-N 3.39Å; R710-Q713 PolarHBondContact O-N 2.81Å; R710-Q713 VanDerWaalsContact O-N 3.14Å; Q713-S715 PolarHBondContact O-N 3.05Å; Q713-K716 WeakPolarHBondContact O-CB 3.36Å; Q713-K716 PolarHBondContact O-N 3.44Å; Q713-K716 VanDerWaalsContact O-N 3.16Å; Q713-I717 PolarHBondContact O-N 2.91Å
714	S	67.4	Low	70.1	Confident	76 Å²	76	110.5 Å²	110.5	53%	0.531	57%	0.567	S	S	.	*	H	α-helix	trans	-57.3	-45.1	179.4	180	0	0	0	0	113	R710 K716 I717 L718	R710-S714 PolarHBondContact O-N 3.14Å; S714-K716 VanDerWaalsContact C-N 3.32Å; S714-K716 PolarHBondContact O-N 3.05Å; S714-I717 PolarHBondContact O-N 2.66Å; S714-I717 VanDerWaalsContact O-N 3.08Å; S714-L718 PolarHBondContact O-N 2.88Å
715	S	66.6	Low	68	Low	58 Å²	58	118.1 Å²	118.1	41%	0.406	60%	0.599	S	S	.	*	H	α-helix	trans	-61.4	-36.8	177.5	58.2	0	0	0	0	113.5	K711 K712 Q713 I717 L718 D719	K711-S715 PolarHBondContact O-N 3.34Å; K712-S715 PolarHBondContact O-OG 3.05Å; Q713-S715 PolarHBondContact O-N 3.05Å; S715-I717 VanDerWaalsContact C-N 3.29Å; S715-I717 PolarHBondContact O-N 2.7Å; S715-L718 PolarHBondContact O-N 2.85Å; S715-D719 PolarHBondContact O-N 3.24Å
716	K	62	Low	65.8	Low	148 Å²	148	125.1 Å²	125.1	64%	0.643	62%	0.62	S	S	*	*	H	α-helix	trans	-67	-26.9	175.4	-74.6	-174.6	172.5	-168.4	0	113.7	Q713 S714	Q713-K716 WeakPolarHBondContact O-CB 3.36Å; Q713-K716 PolarHBondContact O-N 3.44Å; Q713-K716 VanDerWaalsContact O-N 3.16Å; S714-K716 VanDerWaalsContact C-N 3.32Å; S714-K716 PolarHBondContact O-N 3.05Å
717	I	67.4	Low	63.5	Low	117 Å²	117	132.3 Å²	132.3	60%	0.6	64%	0.643	S	S	*	*	H	α-helix	trans	-76	-43.8	174.6	-64.6	167.3	0	0	0	109.2	Q713 S714 S715 K720	Q713-I717 PolarHBondContact O-N 2.91Å; S714-I717 PolarHBondContact O-N 2.66Å; S714-I717 VanDerWaalsContact O-N 3.08Å; S715-I717 VanDerWaalsContact C-N 3.29Å; S715-I717 PolarHBondContact O-N 2.7Å; I717-K720 PolarHBondContact O-N 2.93Å
718	L	58.8	Low	61.4	Low	136 Å²	136	141.7 Å²	141.7	71%	0.712	67%	0.671	S	S	*	*	H	α-helix	trans	-67	-42.8	-178.5	-152.5	76.2	0	0	0	113.1	S714 S715 K720 H721	S714-L718 PolarHBondContact O-N 2.88Å; S715-L718 PolarHBondContact O-N 2.85Å; L718-K720 VanDerWaalsContact C-N 3.26Å; L718-K720 PolarHBondContact O-N 3.11Å; L718-H721 PolarHBondContact O-N 2.93Å
719	D	59.3	Low	59.1	Low	119 Å²	119	144.1 Å²	144.1	64%	0.636	69%	0.688	S	S	*	*	H	α-helix	trans	-65.3	-27.2	178.2	-90	-38.9	0	0	0	112.9	S715 H721 R722	S715-D719 PolarHBondContact O-N 3.24Å; D719-H721 VanDerWaalsContact C-N 3.26Å; D719-H721 PolarHBondContact O-N 3.16Å; D719-R722 PolarHBondContact O-N 3.26Å
720	K	58.5	Low	57.1	Low	189 Å²	189	153.5 Å²	153.5	82%	0.822	71%	0.713	S	S	*	*	H	α-helix	trans	-68.8	-20.8	175.3	-91.7	-169.1	170.4	-169.8	0	114	I717 L718	I717-K720 PolarHBondContact O-N 2.93Å; L718-K720 VanDerWaalsContact C-N 3.26Å; L718-K720 PolarHBondContact O-N 3.11Å
721	H	51.9	Low	54.9	Low	141 Å²	141	149.3 Å²	149.3	65%	0.653	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	12.1	179.6	-87.3	-92.7	0	0	0	114.3	L718 D719 P723	L718-H721 PolarHBondContact O-N 2.93Å; D719-H721 VanDerWaalsContact C-N 3.26Å; D719-H721 PolarHBondContact O-N 3.16Å; H721-P723 WeakPolarHBondContact O-CD 3.3Å
722	R	43.6	Very low	52.8	Low	168 Å²	168	149.3 Å²	149.3	63%	0.634	72%	0.722	S	S	*	*			trans	-98.9	96.2	179.4	-162.5	176.7	-156.5	162.4	12.5	112.6	D719	D719-R722 PolarHBondContact O-N 3.26Å
723	P	47.4	Very low	51	Low	116 Å²	116	148 Å²	148	75%	0.753	73%	0.729	S	S	*	*			trans	-61.3	146.2	175	25.8	-34.6	0	0	0	111.8	H721 K725	H721-P723 WeakPolarHBondContact O-CD 3.3Å; P723-K725 PolarHBondContact O-N 2.99Å
724	G	43.4	Very low	49.2	Very low	70 Å²	70	146 Å²	146	72%	0.722	74%	0.735	S	S	*	*			trans	-61.5	132.3	-166.5	0	0	0	0	0	114.9	R726	G724-R726 PolarHBondContact O-N 2.78Å
725	K	46.3	Very low	48	Very low	183 Å²	183	150.6 Å²	150.6	80%	0.796	75%	0.751	S	S	*	*			trans	-65.4	92.7	174.9	-70.6	-173.3	177.1	-175	0	111.7	P723	P723-K725 PolarHBondContact O-N 2.99Å
726	R	42.9	Very low	46.7	Very low	242 Å²	242	154.2 Å²	154.2	91%	0.913	77%	0.766	S	S	*	*			trans	-67.9	128.5	164.6	-85.5	-176.7	153.6	177.6	-7.1	110.2	G724 R728	G724-R726 PolarHBondContact O-N 2.78Å; R726-R728 PolarHBondContact O-N 2.98Å
727	K	43.4	Very low	45.3	Very low	197 Å²	197	158.9 Å²	158.9	86%	0.857	78%	0.78	S	S	*	*			trans	-60.1	130.8	170.4	-72.3	177.4	174.6	176.5	0	110.3
728	R	43.8	Very low	43.9	Very low	245 Å²	245	160 Å²	160	93%	0.925	79%	0.787	S	S	*	*			trans	-133.6	141.7	148.7	-81.8	-175.4	65	158.9	-3.1	108.2	R726	R726-R728 PolarHBondContact O-N 2.98Å
729	N	39.6	Very low	43	Very low	142 Å²	142	158.3 Å²	158.3	76%	0.759	79%	0.787	S	S	*	*			trans	-103	170.2	-173.7	-60.7	-16.8	0	0	0	111.4
730	R	43.4	Very low	42.1	Very low	249 Å²	249	163.5 Å²	163.5	94%	0.94	80%	0.797	S	S	*	*			trans	85.7	139.6	162.8	-70.9	-176.9	162.1	158.9	-4.9	119.4
731	A	39.7	Very low	41.1	Very low	98 Å²	98	165.8 Å²	165.8	81%	0.81	80%	0.801	S	S	*	*			trans	71.1	112.2	153.9	0	0	0	0	0	119.5
732	M	35.8	Very low	40.5	Very low	163 Å²	163	165.7 Å²	165.7	80%	0.803	81%	0.81	S	S	*	*			trans	-86.1	170.2	148.2	-57.5	-117.4	72.4	0	0	108.5
733	P	39.9	Very low	40.3	Very low	123 Å²	123	162 Å²	162	80%	0.799	82%	0.816	S	S	*	*				-119.1	174.5	70.3	1.7	20.7	0	0	0	113.8
734	A	32.9	Very low	40	Very low	87 Å²	87	161.9 Å²	161.9	72%	0.719	82%	0.818	S	S	*	*			trans	-92.2	146.3	170.9	0	0	0	0	0	111.3
735	I	41.5	Very low	39.9	Very low	171 Å²	171	162.9 Å²	162.9	88%	0.877	82%	0.819	S	S	*	*			trans	-133.1	146	163.2	-67.7	-176.2	0	0	0	107.7
736	D	39.6	Very low	39.6	Very low	135 Å²	135	163.4 Å²	163.4	72%	0.722	82%	0.822	S	S	*	*			trans	-65.1	154.1	-171.6	-173.8	22.2	0	0	0	114.6
737	W	31.8	Very low	39.5	Very low	246 Å²	246	157.7 Å²	157.7	93%	0.932	81%	0.813	S	S	*	*			trans	-122.8	71.4	171.8	-171.2	-76.5	0	0	0	109.5
738	N	37.4	Very low	39.2	Very low	139 Å²	139	154.5 Å²	154.5	74%	0.743	81%	0.806	S	S	*	*			trans	-154.8	60.3	160.2	-138.5	10.7	0	0	0	114.1
739	S	40.5	Very low	38.9	Very low	101 Å²	101	148.2 Å²	148.2	71%	0.706	80%	0.799	S	S	*	*			trans	-162.2	82.9	172.8	-84.5	0	0	0	0	114.8
740	R	40.9	Very low	38.9	Very low	228 Å²	228	145.4 Å²	145.4	86%	0.86	80%	0.804	S	S	*	*			trans	158.7	110.2	140.4	-93	166.8	-92.5	-139	-7.7	114.1
741	R	36.7	Very low	38.6	Very low	238 Å²	238	140.7 Å²	140.7	90%	0.898	80%	0.797	S	S	*	*				-169.6	107.2	107.3	-113.2	165.1	-76.3	-152.4	-1.3	113.3
742	T	39	Very low	38.5	Very low	139 Å²	139	140.5 Å²	140.5	85%	0.853	79%	0.79	S	S	*	*			trans	-134.3	160.8	153.3	46	0	0	0	0	106.9
743	A	40.9	Very low	38.5	Very low	91 Å²	91	137.7 Å²	137.7	75%	0.752	79%	0.786	S	S	*	*			trans	68.8	144.3	-170.9	0	0	0	0	0	114.5
744	S	40.5	Very low	38.5	Very low	112 Å²	112	143.3 Å²	143.3	78%	0.783	79%	0.792	S	S	*	*			cis	-147.7	157.6	12.2	-60.3	0	0	0	0	113.4
745	A	41.1	Very low	38.6	Very low	92 Å²	92	143.5 Å²	143.5	76%	0.76	79%	0.788	S	S	*	*			trans	65.1	140.2	161.2	0	0	0	0	0	117.3
746	K	40.3	Very low	38.4	Very low	194 Å²	194	141.6 Å²	141.6	84%	0.843	78%	0.779	S	S	*	*			cis	62.4	134.5	48.6	-74.2	-171.7	171.8	-174.9	0	112.4
747	V	39.9	Very low	38.3	Very low	122 Å²	122	143 Å²	143	74%	0.739	79%	0.787	S	S	*	*			cis	-143.6	161.4	24.5	-124.5	0	0	0	0	113.2
748	D	38.3	Very low	38.2	Very low	130 Å²	130	137.1 Å²	137.1	70%	0.695	77%	0.77	S	S	*	*			trans	23.6	128.1	153.6	-80.1	-83.2	0	0	0	125.6
749	S	37.9	Very low	38.2	Very low	112 Å²	112	136 Å²	136	78%	0.783	77%	0.77	S	S	*	*				47.9	124	113	-45.1	0	0	0	0	121.2
750	G	38.3	Very low	38	Very low	84 Å²	84	137.8 Å²	137.8	87%	0.866	77%	0.765	S	S	*	*			trans	179.4	122.7	167.4	0	0	0	0	0	113.7
751	D	37.7	Very low	37.7	Very low	150 Å²	150	133.4 Å²	133.4	80%	0.802	77%	0.766	S	S	*	*			trans	-87.8	157.8	-168	-161.4	0.6	0	0	0	114.8
752	S	36.7	Very low	37.7	Very low	93 Å²	93	131 Å²	131	65%	0.65	76%	0.757	S	S	*	*			trans	29.2	121.9	151.5	-69.7	0	0	0	0	122.2
753	S	36.6	Very low	37.7	Very low	104 Å²	104	134.3 Å²	134.3	73%	0.727	75%	0.754	S	S	*	*				128.6	154.6	114	76.5	0	0	0	0	118.1
754	R	39.2	Very low	37.6	Very low	242 Å²	242	135.1 Å²	135.1	91%	0.913	75%	0.749	S	S	*	*			trans	74.6	162.1	162.7	-74.4	177.6	167.7	143.1	-1.2	118.6
755	S	35.7	Very low	37.6	Very low	91 Å²	91	140.5 Å²	140.5	64%	0.636	75%	0.752	S	S	*	*			trans	-103.4	-174.9	-148.7	46.9	0	0	0	0	113.5
756	D	37.4	Very low	37.6	Very low	131 Å²	131	145.1 Å²	145.1	70%	0.701	76%	0.755	S	S	*	*			trans	68.6	86	157.4	-48.1	-51.1	0	0	0	117.2
757	N	38.3	Very low	37.5	Very low	163 Å²	163	145.5 Å²	145.5	87%	0.872	76%	0.757	S	S	*	*				-178.1	159.9	99.8	-98.6	-80.1	0	0	0	113.1
758	E	29.8	Very low	37.3	Very low	124 Å²	124	146.4 Å²	146.4	58%	0.579	75%	0.753	S	S	*	*			trans	-102.5	125.7	-175.7	-177	-105.2	109.2	0	0	113.5	K760	E758-K760 VanDerWaalsContact OE1-CD 3.24Å; E758-K760 WeakPolarHBondContact OE1-CD 3.43Å; E758-K760 WeakPolarHBondContact OE1-CE 3.48Å; E758-K760 VanDerWaalsContact OE1-CG 3.23Å; E758-K760 WeakPolarHBondContact OE1-CG 3.3Å; E758-K760 PolarHBondContact OE1-N 2.75Å; E758-K760 IonicContact OE1-NZ 3.33Å; E758-K760 PolarHBondContact OE1-NZ 3.28Å; E758-K760 IonicContact OE2-NZ 3.64Å; E758-K760 PolarHBondContact OE2-NZ 3.22Å
759	P	37.4	Very low	37	Very low	114 Å²	114	149.3 Å²	149.3	74%	0.74	76%	0.76	S	S	*	*			trans	-127.5	108	160.1	33.9	-19.4	0	0	0	114
760	K	35.4	Very low	36.9	Very low	139 Å²	139	151.6 Å²	151.6	60%	0.604	76%	0.758	S	S	*	*			trans	-37.1	131.4	171.9	-55.6	101.6	179.5	97.4	0	115.8	E758	E758-K760 VanDerWaalsContact OE1-CD 3.24Å; E758-K760 WeakPolarHBondContact OE1-CD 3.43Å; E758-K760 WeakPolarHBondContact OE1-CE 3.48Å; E758-K760 VanDerWaalsContact OE1-CG 3.23Å; E758-K760 WeakPolarHBondContact OE1-CG 3.3Å; E758-K760 PolarHBondContact OE1-N 2.75Å; E758-K760 IonicContact OE1-NZ 3.33Å; E758-K760 PolarHBondContact OE1-NZ 3.28Å; E758-K760 IonicContact OE2-NZ 3.64Å; E758-K760 PolarHBondContact OE2-NZ 3.22Å
761	P	35.1	Very low	36.9	Very low	136 Å²	136	153.5 Å²	153.5	88%	0.883	75%	0.748	S	S	*	*			trans	-73.9	125	158	30.6	-32	0	0	0	110.3
762	R	37	Very low	36.9	Very low	187 Å²	187	153 Å²	153	71%	0.706	74%	0.743	S	S	*	*			trans	-138.3	116.9	-171.4	-129.1	-172.3	179.9	-170.3	3.2	115.1
763	R	37.5	Very low	37	Very low	209 Å²	209	157 Å²	157	79%	0.789	75%	0.752	S	S	*	*			trans	72.5	155.5	166.2	-49.5	161.7	173.2	179.9	-5.3	112.3
764	V	38.9	Very low	37.1	Very low	108 Å²	108	160 Å²	160	66%	0.655	76%	0.759	S	S	*	*			cis	-160.7	139.3	35.9	167.7	0	0	0	0	106.3
765	R	40.2	Very low	37.1	Very low	225 Å²	225	156.5 Å²	156.5	85%	0.849	75%	0.753	S	S	*	*			cis	-147.3	141	-4.7	-85.4	146.1	-173.8	141.7	-2.4	104.8
766	K	41.3	Very low	37.3	Very low	189 Å²	189	160.9 Å²	160.9	82%	0.822	76%	0.763	S	S	*	*				80	129.6	62.7	-164	165.6	-172	168.7	0	115.4
767	K	39.4	Very low	37.2	Very low	203 Å²	203	159.8 Å²	159.8	88%	0.883	77%	0.766	S	S	*	*			trans	84.8	126.5	-169.9	-59.2	178.7	-179.7	-178.8	0	113.6
768	H	34.4	Very low	36.9	Very low	140 Å²	140	157.4 Å²	157.4	65%	0.648	76%	0.762	S	S	*	*			cis	-156.7	103.5	-2.8	174.6	-73.1	0	0	0	110.6
769	F	32.8	Very low	37.1	Very low	192 Å²	192	161 Å²	161	84%	0.842	77%	0.772	S	S	*	*			trans	-119.8	18.4	173.8	-155.6	-98.4	0	0	0	112	L771	F769-L771 PolarHBondContact O-N 3.21Å
770	E	36.3	Very low	36.9	Very low	159 Å²	159	163.2 Å²	163.2	74%	0.743	77%	0.77	S	S	*	*			trans	-101.3	56.4	-178.5	-68.7	173	113.8	0	0	111
771	L	37.9	Very low	36.9	Very low	125 Å²	125	163 Å²	163	65%	0.654	77%	0.771	S	S	*	*	S	Bend	trans	-169.1	111.1	163.2	-129.7	87.1	0	0	0	105.8	F769	F769-L771 PolarHBondContact O-N 3.21Å
772	I	38.4	Very low	36.9	Very low	138 Å²	138	164.5 Å²	164.5	71%	0.708	76%	0.764	S	S	*	*	S	Bend	cis	-134.5	112.8	12.7	-64.1	158.3	0	0	0	108.8
773	Q	38.1	Very low	36.7	Very low	178 Å²	178	160.8 Å²	160.8	83%	0.832	77%	0.766	S	S	*	*	S	Bend	trans	-140.1	16.1	168.7	-150.3	174.2	10.2	0	0	112.9
774	L	39.8	Very low	36.4	Very low	167 Å²	167	153.9 Å²	153.9	87%	0.874	76%	0.76	S	S	*	*			trans	-117.8	71.6	176.6	-74.7	171.5	0	0	0	110.2
775	Q	38.9	Very low	36	Very low	168 Å²	168	158 Å²	158	79%	0.785	77%	0.773	S	S	*	*	S	Bend	trans	-149.7	48.9	163.2	-155.3	175.1	7	0	0	112.4
776	Q	39.9	Very low	35.6	Very low	183 Å²	183	152 Å²	152	86%	0.855	77%	0.77	S	S	*	*	S	Bend	trans	-165.1	153.4	158.6	-106.5	141.3	98.5	0	0	110.5
777	S	33.9	Very low	35.4	Very low	109 Å²	109	147.4 Å²	147.4	76%	0.762	76%	0.762	S	S	*	*			trans	62.1	65.1	173.4	60.1	0	0	0	0	120
778	S	31.7	Very low	35	Very low	113 Å²	113	146.9 Å²	146.9	79%	0.79	76%	0.763	S	S	*	*			trans	-165.6	124.9	133.8	14.9	0	0	0	0	106.2
779	Y	35.5	Very low	35	Very low	199 Å²	199	143.2 Å²	143.2	78%	0.78	76%	0.763	S	S	*	*			cis	58.1	116.9	19	-68.6	-67.2	0	0	0	112.4
780	F	33.6	Very low	35.2	Very low	161 Å²	161	139.7 Å²	139.7	71%	0.706	76%	0.762	S	S	*	*			cis	-148.3	153.9	23.5	-141.6	-100.7	0	0	0	112.5
781	E	34.1	Very low	35.3	Very low	133 Å²	133	139.1 Å²	139.1	62%	0.621	77%	0.769	S	S	*	*			trans	61.4	159.2	165.3	-86	171.5	-138	0	0	119.7
782	K	36.2	Very low	35.1	Very low	169 Å²	169	136.6 Å²	136.6	74%	0.735	77%	0.774	S	S	*	*			cis	-139.4	175.6	8.3	-140.6	173.4	-175	93.8	0	112.8
783	S	32.1	Very low	34.9	Very low	109 Å²	109	139 Å²	139	76%	0.762	78%	0.781	S	S	*	*			trans	-46.5	156.4	172.7	49	0	0	0	0	115.5
784	G	30.7	Very low	34.8	Very low	64 Å²	64	136.3 Å²	136.3	66%	0.66	78%	0.779	S	S	*	*			cis	161.4	-176.8	1.1	0	0	0	0	0	111.4
785	E	30.6	Very low	34.6	Very low	195 Å²	195	133.3 Å²	133.3	91%	0.911	77%	0.773	S	S	*	*			trans	66.7	125.4	163.8	-64.1	166.8	171.7	0	0	116.1
786	A	33.2	Very low	34.2	Very low	97 Å²	97	131.3 Å²	131.3	80%	0.802	78%	0.777	S	S	*	*				68.3	134.4	103.3	0	0	0	0	0	114.5
787	S	35.2	Very low	33.9	Very low	94 Å²	94	126.7 Å²	126.7	66%	0.657	77%	0.77	S	S	*	*			cis	-167.4	155.8	1.1	44.6	0	0	0	0	111.4
788	E	32.4	Very low	34.1	Very low	192 Å²	192	127.7 Å²	127.7	90%	0.897	77%	0.767	S	S	*	*			trans	64	167.2	149.9	-70.1	163.8	-146.6	0	0	121
789	G	33.9	Very low	34	Very low	63 Å²	63	133 Å²	133	65%	0.649	77%	0.771	S	S	*	*			trans	78.1	96.8	175.5	0	0	0	0	0	115.7
790	S	36.8	Very low	33.8	Very low	118 Å²	118	129.1 Å²	129.1	83%	0.825	77%	0.773	S	S	*	*				63	136.1	63.4	86.7	0	0	0	0	115
791	V	38.4	Very low	34.5	Very low	147 Å²	147	129.1 Å²	129.1	89%	0.891	77%	0.773	S	S	*	*			cis	-160.9	149.1	-11.4	124.2	0	0	0	0	106.6
792	G	33.2	Very low	34.8	Very low	72 Å²	72	128.6 Å²	128.6	74%	0.742	78%	0.784	S	S	*	*			trans	-178.6	105.2	176	0	0	0	0	0	116.5
793	H	34.8	Very low	35.7	Very low	188 Å²	188	121.2 Å²	121.2	87%	0.87	75%	0.753	S	S	*	*			trans	-81	172.3	165.1	-91.8	-92.8	0	0	0	110.8
794	P	35.5	Very low	37.7	Very low	121 Å²	121	118.6 Å²	118.6	79%	0.786	74%	0.735	S	S	*	*			cis	-112.3	-166.3	13.3	45.4	-34.8	0	0	0	112.2
795	S	36.6	Very low	39.9	Very low	105 Å²	105	124.9 Å²	124.9	73%	0.734	74%	0.739	S	S	*	*			cis	-149.9	170.4	13.6	58.8	0	0	0	0	113.2	A797	S795-A797 PolarHBondContact O-N 2.98Å; S795-A797 VanDerWaalsContact O-N 3.16Å
796	S	29.9	Very low	42.1	Very low	126 Å²	126	120.2 Å²	120.2	88%	0.881	72%	0.717	S	S	*	*			trans	-75.2	97.5	-171.3	56	0	0	0	0	115.6
797	A	34.2	Very low	44.2	Very low	86 Å²	86	119.8 Å²	119.8	71%	0.711	70%	0.698	S	S	*	*			trans	-149.1	164.7	153.8	0	0	0	0	0	109.4	S795	S795-A797 PolarHBondContact O-N 2.98Å; S795-A797 VanDerWaalsContact O-N 3.16Å
798	D	38	Very low	46.4	Very low	129 Å²	129	122.6 Å²	122.6	69%	0.69	70%	0.695	S	S	*	*			trans	56.7	69.2	175.9	-81.3	-54.6	0	0	0	117.2	K801	D798-K801 IonicContact OD1-NZ 3.46Å; D798-K801 PolarHBondContact OD1-NZ 2.8Å
799	Y	29.4	Very low	48.9	Very low	226 Å²	226	118.6 Å²	118.6	89%	0.886	67%	0.674	S	S	*	*			trans	-137.8	75	152.9	-157.2	-91.3	0	0	0	113.4
800	S	32.1	Very low	51.3	Low	116 Å²	116	121.4 Å²	121.4	81%	0.811	67%	0.672	S	S	*	*			trans	-167	74.3	167.5	-81.7	0	0	0	0	110.5
801	K	47.6	Very low	53.7	Low	162 Å²	162	120.8 Å²	120.8	70%	0.704	66%	0.656	S	S	*	*			trans	-141.7	16.1	-174.9	-110.1	164	-158.9	152.7	0	117.2	D798 S803	D798-K801 IonicContact OD1-NZ 3.46Å; D798-K801 PolarHBondContact OD1-NZ 2.8Å; K801-S803 PolarHBondContact O-N 3.07Å; K801-S803 VanDerWaalsContact O-N 3.13Å
802	S	40.6	Very low	56	Low	122 Å²	122	120.5 Å²	120.5	85%	0.853	64%	0.643	S	S	*	*			trans	-81.6	38.8	160.7	61.9	0	0	0	0	111.8	S804	S802-S804 PolarHBondContact O-N 2.84Å
803	S	55.2	Low	58.6	Low	13 Å²	13	121.6 Å²	121.6	9%	0.091	63%	0.631	C	S	.	*			trans	-66.6	132.1	-171.1	141.6	0	0	0	0	111.4	K801 E807 R808	K801-S803 PolarHBondContact O-N 3.07Å; K801-S803 VanDerWaalsContact O-N 3.13Å; S803-E807 WeakPolarHBondContact CA-OE2 3.33Å; S803-E807 VanDerWaalsContact CB-OE2 3.28Å; S803-E807 WeakPolarHBondContact CB-OE2 3.31Å; S803-E807 PolarHBondContact OG-OE2 2.78Å; S803-R808 PolarHBondContact O-NE 2.85Å; S803-R808 PolarHBondContact O-NH2 3.02Å; S803-R808 WeakPolarHBondContact OG-CG 3.49Å
804	S	74.4	Confident	61.2	Low	55 Å²	55	116.8 Å²	116.8	39%	0.385	61%	0.611	S	S	.	*			trans	-70	168.6	-170.7	85.9	0	0	0	0	112.9	S802 E806 E807 R808	S802-S804 PolarHBondContact O-N 2.84Å; S804-E806 PolarHBondContact O-N 3.49Å; S804-E806 PolarHBondContact OG-N 3.19Å; S804-E807 PolarHBondContact N-OE2 2.74Å; S804-E807 PolarHBondContact O-N 2.74Å; S804-E807 WeakPolarHBondContact OG-CB 3.47Å; S804-E807 PolarHBondContact OG-N 3.25Å; S804-R808 WeakPolarHBondContact O-CG 3.24Å; S804-R808 PolarHBondContact O-N 2.93Å
805	R	75.8	Confident	63.8	Low	196 Å²	196	115 Å²	115	74%	0.74	59%	0.592	S	S	*	*	H	α-helix	trans	-61.1	-37.8	175.8	-177.2	-176.1	-173.3	-173.9	1.4	110.8	K809	R805-K809 WeakPolarHBondContact O-CG 3.23Å; R805-K809 PolarHBondContact O-N 3.37Å; R805-K809 VanDerWaalsContact O-N 3.16Å
806	E	76.3	Confident	66.3	Low	97 Å²	97	117.1 Å²	117.1	45%	0.453	58%	0.584	S	S	.	*	H	α-helix	trans	-71.7	-40.3	178.3	-75.2	47.5	-110	0	0	110.9	S804 R808 K809 M810	S804-E806 PolarHBondContact O-N 3.49Å; S804-E806 PolarHBondContact OG-N 3.19Å; E806-R808 VanDerWaalsContact C-N 3.35Å; E806-R808 PolarHBondContact O-N 2.79Å; E806-K809 CarbonylContact O-C 3.58Å; E806-K809 WeakPolarHBondContact O-CA 3.38Å; E806-K809 VanDerWaalsContact O-CB 3.31Å; E806-K809 WeakPolarHBondContact O-CB 3.35Å; E806-K809 PolarHBondContact O-N 3.34Å; E806-K809 VanDerWaalsContact O-N 3.09Å; E806-K809 WeakPolarHBondContact OE1-CE 3.31Å; E806-K809 IonicContact OE1-NZ 3.25Å; E806-K809 PolarHBondContact OE1-NZ 3.23Å; E806-M810 WeakPolarHBondContact O-CG 3.43Å; E806-M810 PolarHBondContact O-N 2.89Å
807	E	78.2	Confident	69.3	Low	87 Å²	87	114.7 Å²	114.7	41%	0.407	56%	0.56	S	S	.	*	H	α-helix	trans	-66.9	-35.5	177	-163.4	179.4	178.7	0	0	111.9	S803 S804 M810 Q811	S803-E807 WeakPolarHBondContact CA-OE2 3.33Å; S803-E807 VanDerWaalsContact CB-OE2 3.28Å; S803-E807 WeakPolarHBondContact CB-OE2 3.31Å; S803-E807 PolarHBondContact OG-OE2 2.78Å; S804-E807 PolarHBondContact N-OE2 2.74Å; S804-E807 PolarHBondContact O-N 2.74Å; S804-E807 WeakPolarHBondContact OG-CB 3.47Å; S804-E807 PolarHBondContact OG-N 3.25Å; E807-M810 PolarHBondContact O-N 2.95Å; E807-Q811 WeakPolarHBondContact O-CB 3.42Å; E807-Q811 WeakPolarHBondContact O-CG 3.49Å; E807-Q811 PolarHBondContact O-N 3.37Å
808	R	81.4	Confident	72	Confident	154 Å²	154	115.9 Å²	115.9	58%	0.581	55%	0.551	S	S	*	*	H	α-helix	trans	-69.2	-30.5	170.3	-65.3	177.3	-152.1	-169.2	4.7	112.8	S803 S804 E806 F812	S803-R808 PolarHBondContact O-NE 2.85Å; S803-R808 PolarHBondContact O-NH2 3.02Å; S803-R808 WeakPolarHBondContact OG-CG 3.49Å; S804-R808 WeakPolarHBondContact O-CG 3.24Å; S804-R808 PolarHBondContact O-N 2.93Å; E806-R808 VanDerWaalsContact C-N 3.35Å; E806-R808 PolarHBondContact O-N 2.79Å; R808-F812 WeakPolarHBondContact O-CB 3.12Å; R808-F812 PolarHBondContact O-N 3.15Å
809	K	84.6	Confident	74.5	Confident	108 Å²	108	115.2 Å²	115.2	47%	0.47	54%	0.539	S	S	.	.	H	α-helix	trans	-65.8	-46.6	168.3	-64.8	167.2	-171.4	166.5	0	109.8	R805 E806 F812 I813	R805-K809 WeakPolarHBondContact O-CG 3.23Å; R805-K809 PolarHBondContact O-N 3.37Å; R805-K809 VanDerWaalsContact O-N 3.16Å; E806-K809 CarbonylContact O-C 3.58Å; E806-K809 WeakPolarHBondContact O-CA 3.38Å; E806-K809 VanDerWaalsContact O-CB 3.31Å; E806-K809 WeakPolarHBondContact O-CB 3.35Å; E806-K809 PolarHBondContact O-N 3.34Å; E806-K809 VanDerWaalsContact O-N 3.09Å; E806-K809 WeakPolarHBondContact OE1-CE 3.31Å; E806-K809 IonicContact OE1-NZ 3.25Å; E806-K809 PolarHBondContact OE1-NZ 3.23Å; K809-F812 PolarHBondContact O-N 3.48Å; K809-I813 VanDerWaalsContact O-CG1 3.31Å; K809-I813 WeakPolarHBondContact O-CG1 3.37Å; K809-I813 PolarHBondContact O-N 3.31Å
810	M	85	Confident	77.2	Confident	121 Å²	121	108.9 Å²	108.9	60%	0.596	52%	0.519	S	S	*	.	H	α-helix	trans	-61.8	-47.7	178.6	-69	-129.3	-66.1	0	0	112.3	E806 E807 F812 I813 I814	E806-M810 WeakPolarHBondContact O-CG 3.43Å; E806-M810 PolarHBondContact O-N 2.89Å; E807-M810 PolarHBondContact O-N 2.95Å; M810-F812 VanDerWaalsContact C-N 3.27Å; M810-F812 PolarHBondContact O-N 3.35Å; M810-I813 CarbonylContact O-C 3.45Å; M810-I813 WeakPolarHBondContact O-CA 3.28Å; M810-I813 WeakPolarHBondContact O-CB 3.24Å; M810-I813 PolarHBondContact O-N 3.07Å; M810-I814 WeakPolarHBondContact O-CG1 3.31Å; M810-I814 PolarHBondContact O-N 2.85Å
811	Q	86.9	Confident	80.1	Confident	106 Å²	106	108.8 Å²	108.8	50%	0.495	51%	0.505	S	S	.	.	H	α-helix	trans	-58.1	-39.9	175	-73.1	176	7.1	0	0	111.7	E807 I813 I814 E815	E807-Q811 WeakPolarHBondContact O-CB 3.42Å; E807-Q811 WeakPolarHBondContact O-CG 3.49Å; E807-Q811 PolarHBondContact O-N 3.37Å; Q811-I813 VanDerWaalsContact C-N 3.33Å; Q811-I813 PolarHBondContact O-N 3.1Å; Q811-I814 PolarHBondContact O-N 3.14Å; Q811-E815 WeakPolarHBondContact O-CB 3.37Å; Q811-E815 PolarHBondContact O-N 3Å
812	F	85.5	Confident	82.2	Confident	140 Å²	140	104.4 Å²	104.4	61%	0.614	49%	0.49	S	S	*	.	H	α-helix	trans	-67.7	-30.2	174.4	-173.6	-98	0	0	0	113.2	R808 K809 M810 R816	R808-F812 WeakPolarHBondContact O-CB 3.12Å; R808-F812 PolarHBondContact O-N 3.15Å; K809-F812 PolarHBondContact O-N 3.48Å; M810-F812 VanDerWaalsContact C-N 3.27Å; M810-F812 PolarHBondContact O-N 3.35Å; F812-R816 WeakPolarHBondContact O-CB 3.39Å; F812-R816 PolarHBondContact O-N 2.93Å; F812-R816 VanDerWaalsContact O-N 3.1Å
813	I	88.1	Confident	84.3	Confident	96 Å²	96	102.5 Å²	102.5	49%	0.492	47%	0.473	S	S	.	.	H	α-helix	trans	-73.8	-45.3	173.8	-68.8	162	0	0	0	110.8	K809 M810 Q811 R816 I817	K809-I813 VanDerWaalsContact O-CG1 3.31Å; K809-I813 WeakPolarHBondContact O-CG1 3.37Å; K809-I813 PolarHBondContact O-N 3.31Å; M810-I813 CarbonylContact O-C 3.45Å; M810-I813 WeakPolarHBondContact O-CA 3.28Å; M810-I813 WeakPolarHBondContact O-CB 3.24Å; M810-I813 PolarHBondContact O-N 3.07Å; Q811-I813 VanDerWaalsContact C-N 3.33Å; Q811-I813 PolarHBondContact O-N 3.1Å; I813-R816 CarbonylContact O-C 3.52Å; I813-R816 WeakPolarHBondContact O-CA 3.25Å; I813-R816 VanDerWaalsContact O-CB 3.3Å; I813-R816 WeakPolarHBondContact O-CB 3.42Å; I813-R816 PolarHBondContact O-N 3.1Å; I813-I817 HydrophobicContact CG2-CD1 3.89Å; I813-I817 WeakPolarHBondContact O-CG1 3.48Å; I813-I817 PolarHBondContact O-N 3.5Å
814	I	90.5	Very high	85.9	Confident	87 Å²	87	106.2 Å²	106.2	45%	0.446	50%	0.495	S	S	.	.	H	α-helix	trans	-60.8	-48.1	176.1	-65.9	163.4	0	0	0	110.1	M810 Q811 R816 I817 Q818	M810-I814 WeakPolarHBondContact O-CG1 3.31Å; M810-I814 PolarHBondContact O-N 2.85Å; Q811-I814 PolarHBondContact O-N 3.14Å; I814-R816 PolarHBondContact O-N 2.98Å; I814-I817 PolarHBondContact O-N 3.19Å; I814-I817 VanDerWaalsContact O-N 3.16Å; I814-Q818 HydrophobicContact CG2-CG 4.34Å; I814-Q818 WeakPolarHBondContact O-CB 3.48Å; I814-Q818 WeakPolarHBondContact O-CG 3.11Å; I814-Q818 PolarHBondContact O-N 3.41Å
815	E	90.6	Very high	86.4	Confident	84 Å²	84	108.6 Å²	108.6	39%	0.393	50%	0.5	S	S	.	.	H	α-helix	trans	-67.3	-15.9	175.8	-157.6	-148.4	-164.3	0	0	112.7	Q811 R819	Q811-E815 WeakPolarHBondContact O-CB 3.37Å; Q811-E815 PolarHBondContact O-N 3Å; E815-R819 VanDerWaalsContact O-CG 3.25Å; E815-R819 WeakPolarHBondContact O-CG 3.22Å; E815-R819 PolarHBondContact O-NH1 2.88Å; E815-R819 IonicContact OE1-CZ 2.78Å; E815-R819 IonicContact OE1-NH1 2.64Å; E815-R819 IonicContact OE1-NH2 2.74Å; E815-R819 PolarHBondContact OE1-NH2 3.37Å; E815-R819 IonicContact OE2-CZ 3.23Å; E815-R819 IonicContact OE2-NH1 2.7Å; E815-R819 PolarHBondContact OE2-NH1 3.05Å; E815-R819 IonicContact OE2-NH2 2.69Å; E815-R819 PolarHBondContact OE2-NH2 3.01Å
816	R	88.7	Confident	86.9	Confident	148 Å²	148	104.3 Å²	104.3	56%	0.558	49%	0.487	S	S	*	.	H	α-helix	trans	-82.9	-42.1	171.3	-179.9	65.9	174.7	160.1	4.4	111.3	F812 I813 I814 M820	F812-R816 WeakPolarHBondContact O-CB 3.39Å; F812-R816 PolarHBondContact O-N 2.93Å; F812-R816 VanDerWaalsContact O-N 3.1Å; I813-R816 CarbonylContact O-C 3.52Å; I813-R816 WeakPolarHBondContact O-CA 3.25Å; I813-R816 VanDerWaalsContact O-CB 3.3Å; I813-R816 WeakPolarHBondContact O-CB 3.42Å; I813-R816 PolarHBondContact O-N 3.1Å; I814-R816 PolarHBondContact O-N 2.98Å; R816-M820 WeakPolarHBondContact O-CG 3.26Å; R816-M820 PolarHBondContact O-N 2.88Å
817	I	92	Very high	87.2	Confident	76 Å²	76	103.8 Å²	103.8	39%	0.39	49%	0.49	S	S	.	.	H	α-helix	trans	-65.4	-53.4	176.1	-67.8	165.3	0	0	0	110	I813 I814 R819 M820 E821	I813-I817 HydrophobicContact CG2-CD1 3.89Å; I813-I817 WeakPolarHBondContact O-CG1 3.48Å; I813-I817 PolarHBondContact O-N 3.5Å; I814-I817 PolarHBondContact O-N 3.19Å; I814-I817 VanDerWaalsContact O-N 3.16Å; I817-R819 VanDerWaalsContact C-N 3.26Å; I817-R819 PolarHBondContact O-N 2.87Å; I817-M820 WeakPolarHBondContact O-CA 3.25Å; I817-M820 WeakPolarHBondContact O-CB 3.49Å; I817-M820 PolarHBondContact O-N 2.9Å; I817-E821 HydrophobicContact CG2-CG 4.23Å; I817-E821 WeakPolarHBondContact O-CG 3.11Å; I817-E821 PolarHBondContact O-N 3.49Å
818	Q	91.1	Very high	87.5	Confident	111 Å²	111	108.6 Å²	108.6	52%	0.519	50%	0.504	S	S	.	.	H	α-helix	trans	-54.2	-40.6	177.7	-72.8	177	-13.5	0	0	112.4	I814 M820 E821 D822	I814-Q818 HydrophobicContact CG2-CG 4.34Å; I814-Q818 WeakPolarHBondContact O-CB 3.48Å; I814-Q818 WeakPolarHBondContact O-CG 3.11Å; I814-Q818 PolarHBondContact O-N 3.41Å; Q818-M820 PolarHBondContact O-N 2.64Å; Q818-E821 WeakPolarHBondContact CA-OE2 3.44Å; Q818-E821 PolarHBondContact O-N 2.87Å; Q818-D822 WeakPolarHBondContact O-CB 3.46Å; Q818-D822 PolarHBondContact O-N 3.03Å
819	R	90.3	Very high	87.5	Confident	115 Å²	115	109.2 Å²	109.2	43%	0.434	51%	0.507	S	S	.	.	H	α-helix	trans	-66	-33.7	174.1	-78.7	-173.4	-164.1	102.4	-12.4	113.4	E815 I817 T823	E815-R819 VanDerWaalsContact O-CG 3.25Å; E815-R819 WeakPolarHBondContact O-CG 3.22Å; E815-R819 PolarHBondContact O-NH1 2.88Å; E815-R819 IonicContact OE1-CZ 2.78Å; E815-R819 IonicContact OE1-NH1 2.64Å; E815-R819 IonicContact OE1-NH2 2.74Å; E815-R819 PolarHBondContact OE1-NH2 3.37Å; E815-R819 IonicContact OE2-CZ 3.23Å; E815-R819 IonicContact OE2-NH1 2.7Å; E815-R819 PolarHBondContact OE2-NH1 3.05Å; E815-R819 IonicContact OE2-NH2 2.69Å; E815-R819 PolarHBondContact OE2-NH2 3.01Å; I817-R819 VanDerWaalsContact C-N 3.26Å; I817-R819 PolarHBondContact O-N 2.87Å; R819-T823 PolarHBondContact O-N 2.77Å; R819-T823 PolarHBondContact O-OG1 2.9Å
820	M	86.5	Confident	87.2	Confident	93 Å²	93	111.7 Å²	111.7	46%	0.458	52%	0.517	S	S	.	.	H	α-helix	trans	-69.8	-49.7	174.9	-69.9	-169.7	-55.6	0	0	110.5	R816 I817 Q818 D822 T823 V824	R816-M820 WeakPolarHBondContact O-CG 3.26Å; R816-M820 PolarHBondContact O-N 2.88Å; I817-M820 WeakPolarHBondContact O-CA 3.25Å; I817-M820 WeakPolarHBondContact O-CB 3.49Å; I817-M820 PolarHBondContact O-N 2.9Å; Q818-M820 PolarHBondContact O-N 2.64Å; M820-D822 VanDerWaalsContact C-N 3.31Å; M820-D822 PolarHBondContact O-N 3.1Å; M820-T823 WeakPolarHBondContact CA-OG1 3.49Å; M820-T823 CarbonylContact O-C 3.57Å; M820-T823 WeakPolarHBondContact O-CA 3.39Å; M820-T823 PolarHBondContact O-N 3.3Å; M820-T823 PolarHBondContact O-OG1 3.1Å; M820-V824 WeakPolarHBondContact O-CG2 3.48Å; M820-V824 PolarHBondContact O-N 3.37Å
821	E	92.6	Very high	86.6	Confident	114 Å²	114	115.7 Å²	115.7	53%	0.533	53%	0.526	S	S	.	.	H	α-helix	trans	-54.6	-46.5	174.8	-66	170.4	152.1	0	0	111.7	I817 Q818 T823 V824 Q825	I817-E821 HydrophobicContact CG2-CG 4.23Å; I817-E821 WeakPolarHBondContact O-CG 3.11Å; I817-E821 PolarHBondContact O-N 3.49Å; Q818-E821 WeakPolarHBondContact CA-OE2 3.44Å; Q818-E821 PolarHBondContact O-N 2.87Å; E821-T823 VanDerWaalsContact C-N 3.34Å; E821-T823 PolarHBondContact O-N 3.46Å; E821-V824 CarbonylContact O-C 3.37Å; E821-V824 WeakPolarHBondContact O-CA 3.26Å; E821-V824 PolarHBondContact O-N 2.76Å; E821-Q825 PolarHBondContact O-N 3.36Å
822	D	91	Very high	86	Confident	70 Å²	70	114 Å²	114	37%	0.374	53%	0.525	S	S	.	.	H	α-helix	trans	-62.9	-36.5	176.8	-179.2	40.3	0	0	0	111.8	Q818 M820 K826	Q818-D822 WeakPolarHBondContact O-CB 3.46Å; Q818-D822 PolarHBondContact O-N 3.03Å; M820-D822 VanDerWaalsContact C-N 3.31Å; M820-D822 PolarHBondContact O-N 3.1Å; D822-K826 VanDerWaalsContact O-CB 3.29Å; D822-K826 WeakPolarHBondContact O-CB 3.39Å; D822-K826 VanDerWaalsContact O-CD 3.28Å; D822-K826 WeakPolarHBondContact O-CD 3.47Å; D822-K826 WeakPolarHBondContact O-CG 3.35Å; D822-K826 PolarHBondContact O-N 2.81Å; D822-K826 WeakPolarHBondContact OD1-CE 3.29Å; D822-K826 IonicContact OD1-NZ 3.94Å; D822-K826 PolarHBondContact OD1-NZ 3.26Å; D822-K826 IonicContact OD2-NZ 2.87Å; D822-K826 PolarHBondContact OD2-NZ 3.04Å
823	T	86.2	Confident	85.3	Confident	81 Å²	81	114.6 Å²	114.6	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-69.3	-35.2	168.5	51.8	0	0	0	0	113.9	R819 M820 E821 K826 T827	R819-T823 PolarHBondContact O-N 2.77Å; R819-T823 PolarHBondContact O-OG1 2.9Å; M820-T823 WeakPolarHBondContact CA-OG1 3.49Å; M820-T823 CarbonylContact O-C 3.57Å; M820-T823 WeakPolarHBondContact O-CA 3.39Å; M820-T823 PolarHBondContact O-N 3.3Å; M820-T823 PolarHBondContact O-OG1 3.1Å; E821-T823 VanDerWaalsContact C-N 3.34Å; E821-T823 PolarHBondContact O-N 3.46Å; T823-K826 PolarHBondContact O-N 3.29Å; T823-T827 PolarHBondContact O-N 3.4Å; T823-T827 PolarHBondContact O-OG1 3.45Å
824	V	88	Confident	84.3	Confident	91 Å²	91	116 Å²	116	55%	0.552	53%	0.531	S	S	*	.	H	α-helix	trans	-70.8	-40.1	176.7	172.4	0	0	0	0	111.3	M820 E821 K826 T827 R828	M820-V824 WeakPolarHBondContact O-CG2 3.48Å; M820-V824 PolarHBondContact O-N 3.37Å; E821-V824 CarbonylContact O-C 3.37Å; E821-V824 WeakPolarHBondContact O-CA 3.26Å; E821-V824 PolarHBondContact O-N 2.76Å; V824-K826 VanDerWaalsContact C-N 3.33Å; V824-K826 PolarHBondContact O-N 3.3Å; V824-T827 WeakPolarHBondContact CA-OG1 3.45Å; V824-T827 PolarHBondContact O-N 3.29Å; V824-T827 PolarHBondContact O-OG1 2.9Å; V824-R828 VanDerWaalsContact O-CB 3.31Å; V824-R828 WeakPolarHBondContact O-CB 3.3Å; V824-R828 PolarHBondContact O-N 3.09Å
825	Q	86.2	Confident	82.9	Confident	105 Å²	105	116.4 Å²	116.4	49%	0.491	54%	0.537	S	S	.	.	H	α-helix	trans	-63.3	-39	169	-92.3	-160.7	17.7	0	0	111.3	E821 R828 R829	E821-Q825 PolarHBondContact O-N 3.36Å; Q825-R828 PolarHBondContact O-N 3.47Å; Q825-R829 VanDerWaalsContact O-CB 3.24Å; Q825-R829 WeakPolarHBondContact O-CB 3.29Å; Q825-R829 VanDerWaalsContact O-CG 3.28Å; Q825-R829 WeakPolarHBondContact O-CG 3.23Å; Q825-R829 PolarHBondContact O-N 3.43Å
826	K	86.3	Confident	81.2	Confident	107 Å²	107	115 Å²	115	47%	0.465	54%	0.536	S	S	.	.	H	α-helix	trans	-68.3	-31.5	176.2	-76.1	163	-176.3	160.2	0	112.9	D822 T823 V824 K830	D822-K826 VanDerWaalsContact O-CB 3.29Å; D822-K826 WeakPolarHBondContact O-CB 3.39Å; D822-K826 VanDerWaalsContact O-CD 3.28Å; D822-K826 WeakPolarHBondContact O-CD 3.47Å; D822-K826 WeakPolarHBondContact O-CG 3.35Å; D822-K826 PolarHBondContact O-N 2.81Å; D822-K826 WeakPolarHBondContact OD1-CE 3.29Å; D822-K826 IonicContact OD1-NZ 3.94Å; D822-K826 PolarHBondContact OD1-NZ 3.26Å; D822-K826 IonicContact OD2-NZ 2.87Å; D822-K826 PolarHBondContact OD2-NZ 3.04Å; T823-K826 PolarHBondContact O-N 3.29Å; V824-K826 VanDerWaalsContact C-N 3.33Å; V824-K826 PolarHBondContact O-N 3.3Å; K826-K830 WeakPolarHBondContact O-CB 3.34Å; K826-K830 VanDerWaalsContact O-CG 3.25Å; K826-K830 WeakPolarHBondContact O-CG 3.44Å; K826-K830 PolarHBondContact O-N 2.93Å
827	T	82.1	Confident	79.7	Confident	85 Å²	85	114.3 Å²	114.3	52%	0.521	54%	0.543	S	S	.	.	H	α-helix	trans	-78.7	-38.6	171.3	53.8	0	0	0	0	112.4	T823 V824 K830 R831	T823-T827 PolarHBondContact O-N 3.4Å; T823-T827 PolarHBondContact O-OG1 3.45Å; V824-T827 WeakPolarHBondContact CA-OG1 3.45Å; V824-T827 PolarHBondContact O-N 3.29Å; V824-T827 PolarHBondContact O-OG1 2.9Å; T827-K830 PolarHBondContact O-N 2.99Å; T827-R831 PolarHBondContact O-N 3.33Å
828	R	83.8	Confident	77.9	Confident	189 Å²	189	115 Å²	115	71%	0.713	55%	0.548	S	S	*	.	H	α-helix	trans	-59.1	-51.6	171.9	-173	173.5	177.2	176.6	-1.6	110.9	V824 Q825 K830 R831 S832	V824-R828 VanDerWaalsContact O-CB 3.31Å; V824-R828 WeakPolarHBondContact O-CB 3.3Å; V824-R828 PolarHBondContact O-N 3.09Å; Q825-R828 PolarHBondContact O-N 3.47Å; R828-K830 VanDerWaalsContact C-N 3.27Å; R828-K830 PolarHBondContact O-N 3.08Å; R828-R831 WeakPolarHBondContact O-CB 3.49Å; R828-R831 PolarHBondContact O-N 3.23Å; R828-R831 VanDerWaalsContact O-N 3.07Å; R828-S832 PolarHBondContact O-N 3.34Å; R828-S832 PolarHBondContact O-OG 3.16Å
829	R	81.8	Confident	76	Confident	167 Å²	167	117.7 Å²	117.7	63%	0.63	56%	0.558	S	S	*	*	H	α-helix	trans	-59	-33.6	174.7	-73.4	176.4	175.6	177.5	0.8	112.9	Q825 K833	Q825-R829 VanDerWaalsContact O-CB 3.24Å; Q825-R829 WeakPolarHBondContact O-CB 3.29Å; Q825-R829 VanDerWaalsContact O-CG 3.28Å; Q825-R829 WeakPolarHBondContact O-CG 3.23Å; Q825-R829 PolarHBondContact O-N 3.43Å; R829-K833 WeakPolarHBondContact O-CB 3.49Å; R829-K833 WeakPolarHBondContact O-CG 3.45Å; R829-K833 PolarHBondContact O-N 2.78Å
830	K	78.3	Confident	74	Confident	160 Å²	160	119 Å²	119	70%	0.696	57%	0.573	S	S	*	*	H	α-helix	trans	-71.6	-38.8	172.6	-80.6	176.1	177.7	-177.3	0	113.1	K826 T827 R828 K834	K826-K830 WeakPolarHBondContact O-CB 3.34Å; K826-K830 VanDerWaalsContact O-CG 3.25Å; K826-K830 WeakPolarHBondContact O-CG 3.44Å; K826-K830 PolarHBondContact O-N 2.93Å; T827-K830 PolarHBondContact O-N 2.99Å; R828-K830 VanDerWaalsContact C-N 3.27Å; R828-K830 PolarHBondContact O-N 3.08Å; K830-K834 PolarHBondContact O-N 3.47Å; K830-K834 VanDerWaalsContact O-N 3.08Å
831	R	72.6	Confident	71.8	Confident	204 Å²	204	119.3 Å²	119.3	77%	0.77	59%	0.585	S	S	*	*	H	α-helix	trans	-62.3	-51.7	171.5	-92.4	-178	157.8	178.8	-9.2	110.4	T827 R828 K833 K834 V835	T827-R831 PolarHBondContact O-N 3.33Å; R828-R831 WeakPolarHBondContact O-CB 3.49Å; R828-R831 PolarHBondContact O-N 3.23Å; R828-R831 VanDerWaalsContact O-N 3.07Å; R831-K833 VanDerWaalsContact C-N 3.32Å; R831-K833 PolarHBondContact O-N 3.21Å; R831-K834 PolarHBondContact O-N 3.08Å; R831-V835 WeakPolarHBondContact O-CG2 3.27Å; R831-V835 PolarHBondContact O-N 3.14Å
832	S	73.3	Confident	69.3	Low	70 Å²	70	120.4 Å²	120.4	49%	0.49	60%	0.599	S	S	.	*	H	α-helix	trans	-56.4	-42.6	176.5	-56.6	0	0	0	0	112.6	R828 K834 V835 S836	R828-S832 PolarHBondContact O-N 3.34Å; R828-S832 PolarHBondContact O-OG 3.16Å; S832-K834 VanDerWaalsContact C-N 3.32Å; S832-K834 PolarHBondContact O-N 2.85Å; S832-V835 PolarHBondContact O-N 3.24Å; S832-S836 PolarHBondContact O-N 3.4Å; S832-S836 PolarHBondContact O-OG 3.47Å
833	K	72.3	Confident	66.8	Low	154 Å²	154	124.3 Å²	124.3	67%	0.67	62%	0.62	S	S	*	*	H	α-helix	trans	-70.8	-19.5	175.4	-77.4	-160	173.2	-154.9	0	114.9	R829 R831 S836 L837	R829-K833 WeakPolarHBondContact O-CB 3.49Å; R829-K833 WeakPolarHBondContact O-CG 3.45Å; R829-K833 PolarHBondContact O-N 2.78Å; R831-K833 VanDerWaalsContact C-N 3.32Å; R831-K833 PolarHBondContact O-N 3.21Å; K833-S836 PolarHBondContact O-OG 3.39Å; K833-L837 WeakPolarHBondContact O-CD1 3.39Å; K833-L837 WeakPolarHBondContact O-CG 3.44Å; K833-L837 PolarHBondContact O-N 2.93Å
834	K	66.4	Low	64.7	Low	126 Å²	126	128.9 Å²	128.9	55%	0.548	64%	0.635	S	S	.	*	H	α-helix	trans	-77.4	-49.2	167.9	-159.3	-165.7	175.6	-80.4	0	109.7	K830 R831 S832 S836 L837 D838	K830-K834 PolarHBondContact O-N 3.47Å; K830-K834 VanDerWaalsContact O-N 3.08Å; R831-K834 PolarHBondContact O-N 3.08Å; S832-K834 VanDerWaalsContact C-N 3.32Å; S832-K834 PolarHBondContact O-N 2.85Å; K834-S836 PolarHBondContact O-N 2.86Å; K834-L837 CarbonylContact O-C 3.57Å; K834-L837 PolarHBondContact O-N 3.42Å; K834-D838 WeakPolarHBondContact CG-OD2 3.28Å; K834-D838 VanDerWaalsContact NZ-CG 3.34Å; K834-D838 IonicContact NZ-OD1 2.79Å; K834-D838 PolarHBondContact NZ-OD1 3.21Å; K834-D838 IonicContact NZ-OD2 2.82Å; K834-D838 PolarHBondContact NZ-OD2 3.18Å; K834-D838 VanDerWaalsContact O-CG 3.29Å; K834-D838 PolarHBondContact O-N 2.76Å
835	V	60.9	Low	62.4	Low	94 Å²	94	129.4 Å²	129.4	57%	0.57	64%	0.643	S	S	*	*	H	α-helix	trans	-59.1	-31.8	178.8	175.1	0	0	0	0	112.6	R831 S832 K839	R831-V835 WeakPolarHBondContact O-CG2 3.27Å; R831-V835 PolarHBondContact O-N 3.14Å; S832-V835 PolarHBondContact O-N 3.24Å; V835-K839 PolarHBondContact O-N 2.8Å
836	S	55.3	Low	60.2	Low	55 Å²	55	132 Å²	132	39%	0.385	66%	0.66	S	S	.	*	H	α-helix	trans	-73.4	-41.9	171.6	67.9	0	0	0	0	112.9	S832 K833 K834 D838 K839 D840	S832-S836 PolarHBondContact O-N 3.4Å; S832-S836 PolarHBondContact O-OG 3.47Å; K833-S836 PolarHBondContact O-OG 3.39Å; K834-S836 PolarHBondContact O-N 2.86Å; S836-D838 PolarHBondContact O-N 3.02Å; S836-K839 PolarHBondContact O-N 3.07Å; S836-D840 PolarHBondContact O-N 3.14Å
837	L	55.8	Low	57.9	Low	133 Å²	133	135 Å²	135	70%	0.696	68%	0.677	S	S	*	*	H	α-helix	trans	-66.6	-25.7	175.9	-82.8	168.9	0	0	0	113.2	K833 K834 K839	K833-L837 WeakPolarHBondContact O-CD1 3.39Å; K833-L837 WeakPolarHBondContact O-CG 3.44Å; K833-L837 PolarHBondContact O-N 2.93Å; K834-L837 CarbonylContact O-C 3.57Å; K834-L837 PolarHBondContact O-N 3.42Å; L837-K839 VanDerWaalsContact C-N 3.29Å
838	D	54.2	Low	55.8	Low	92 Å²	92	136.1 Å²	136.1	49%	0.492	69%	0.686	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.5	3.9	172.5	-57.3	-43.3	0	0	0	112.3	K834 S836	K834-D838 WeakPolarHBondContact CG-OD2 3.28Å; K834-D838 VanDerWaalsContact NZ-CG 3.34Å; K834-D838 IonicContact NZ-OD1 2.79Å; K834-D838 PolarHBondContact NZ-OD1 3.21Å; K834-D838 IonicContact NZ-OD2 2.82Å; K834-D838 PolarHBondContact NZ-OD2 3.18Å; K834-D838 VanDerWaalsContact O-CG 3.29Å; K834-D838 PolarHBondContact O-N 2.76Å; S836-D838 PolarHBondContact O-N 3.02Å
839	K	51.5	Low	53.8	Low	167 Å²	167	133.6 Å²	133.6	73%	0.726	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	-23.7	179	-114.3	-172.3	176.1	-169	0	115.6	V835 S836 L837 S841	V835-K839 PolarHBondContact O-N 2.8Å; S836-K839 PolarHBondContact O-N 3.07Å; L837-K839 VanDerWaalsContact C-N 3.29Å; K839-S841 PolarHBondContact O-N 3.44Å
840	D	48	Very low	51.6	Low	142 Å²	142	132.7 Å²	132.7	76%	0.759	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	35.8	179.2	-63.8	-27.5	0	0	0	113.4	S836	S836-D840 PolarHBondContact O-N 3.14Å
841	S	42.1	Very low	49.7	Very low	100 Å²	100	130.3 Å²	130.3	70%	0.699	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.5	19.6	-175.5	81.3	0	0	0	0	116.7	K839	K839-S841 PolarHBondContact O-N 3.44Å
842	T	38.4	Very low	48.2	Very low	137 Å²	137	125.2 Å²	125.2	84%	0.84	70%	0.698	S	S	*	*			trans	-145.2	92.4	167	-50.4	0	0	0	0	109.8
843	D	39.3	Very low	46.5	Very low	152 Å²	152	128.8 Å²	128.8	81%	0.813	71%	0.712	S	S	*	*			trans	-150	116.9	169.3	-163.9	-1.5	0	0	0	110.3
844	H	42.3	Very low	44.9	Very low	177 Å²	177	133 Å²	133	82%	0.819	72%	0.724	S	S	*	*			trans	174.1	115.4	163.5	-103	-61.8	0	0	0	110
845	S	39.2	Very low	43.4	Very low	102 Å²	102	136.1 Å²	136.1	71%	0.713	74%	0.74	S	S	*	*			trans	65.5	132.6	155.4	-62.3	0	0	0	0	118.2
846	L	40.1	Very low	42.1	Very low	160 Å²	160	135.8 Å²	135.8	84%	0.838	76%	0.755	S	S	*	*			cis	-148.9	-175.8	8.1	-107.5	158.9	0	0	0	111.3
847	M	39.1	Very low	41.1	Very low	170 Å²	170	136.4 Å²	136.4	84%	0.837	77%	0.771	S	S	*	*			trans	-86	164.7	-162.5	-71.7	-79.1	96.7	0	0	116.7
848	P	38.1	Very low	40.1	Very low	108 Å²	108	139.8 Å²	139.8	70%	0.701	78%	0.78	S	S	*	*			trans	-110.9	166.4	-172.4	42	-33.9	0	0	0	115.8
849	T	40.4	Very low	39.2	Very low	135 Å²	135	141 Å²	141	83%	0.828	80%	0.796	S	S	*	*			trans	-158.9	156.8	156.8	51.4	0	0	0	0	107.9
850	D	35.4	Very low	38.3	Very low	148 Å²	148	138.4 Å²	138.4	79%	0.791	80%	0.799	S	S	*	*			cis	167.8	153.5	-31.7	-136.7	-31	0	0	0	104.8
851	S	39.1	Very low	37.6	Very low	111 Å²	111	136.1 Å²	136.1	78%	0.776	80%	0.8	S	S	*	*			trans	60.8	152.6	175.9	70.1	0	0	0	0	118.5
852	S	40.7	Very low	37	Very low	96 Å²	96	140.4 Å²	140.4	67%	0.671	80%	0.802	S	S	*	*			cis	-166.7	149.1	-19.1	48.4	0	0	0	0	111.3
853	D	37.6	Very low	37	Very low	146 Å²	146	139.6 Å²	139.6	78%	0.781	80%	0.796	S	S	*	*			trans	25.1	127.1	147.8	-39.7	-34.1	0	0	0	121.9
854	R	38.7	Very low	36.7	Very low	243 Å²	243	138.8 Å²	138.8	92%	0.917	79%	0.792	S	S	*	*				-175.9	171.3	103.7	-103.5	179.4	172.6	174.8	-1.1	115.6
855	E	34.5	Very low	36.4	Very low	191 Å²	191	133.8 Å²	133.8	89%	0.893	79%	0.788	S	S	*	*			trans	-98.7	160.6	-166.5	-52.5	167.8	105.2	0	0	114.8
856	G	35	Very low	36.1	Very low	86 Å²	86	132 Å²	132	89%	0.887	79%	0.786	S	S	*	*			trans	90.9	147.2	155.2	0	0	0	0	0	117.1
857	G	34.2	Very low	35.9	Very low	69 Å²	69	133.4 Å²	133.4	71%	0.711	79%	0.788	S	S	*	*			cis	163	153.3	-11.6	0	0	0	0	0	115
858	K	33.7	Very low	35.4	Very low	203 Å²	203	134 Å²	134	88%	0.883	79%	0.786	S	S	*	*			trans	69.4	147.9	165.6	-61.7	-179.7	176.7	178.2	0	119.8
859	S	36.6	Very low	35.3	Very low	118 Å²	118	134.9 Å²	134.9	83%	0.825	79%	0.79	S	S	*	*			trans	67.1	154.4	149.8	50.3	0	0	0	0	120.1
860	S	31	Very low	34.8	Very low	113 Å²	113	136 Å²	136	79%	0.79	78%	0.783	S	S	*	*			cis	-174.9	163.8	-27.3	-168.2	0	0	0	0	108.9
861	A	35.3	Very low	34.7	Very low	94 Å²	94	133.5 Å²	133.5	78%	0.777	78%	0.782	S	S	*	*			trans	65.3	167.3	161	0	0	0	0	0	117.5
862	Y	29.2	Very low	34.4	Very low	189 Å²	189	135.3 Å²	135.3	74%	0.741	78%	0.779	S	S	*	*			cis	-173.6	-178.4	-34.5	-178.3	-111.8	0	0	0	107.1
863	V	38.2	Very low	34.1	Very low	120 Å²	120	135 Å²	135	73%	0.727	78%	0.782	S	S	*	*			trans	76.2	121.3	176	-166	0	0	0	0	113.9
864	D	32.5	Very low	34	Very low	136 Å²	136	133.9 Å²	133.9	73%	0.727	78%	0.783	S	S	*	*			cis	108.7	143.8	10.8	-164.7	27.4	0	0	0	115.3
865	G	36.7	Very low	34.1	Very low	71 Å²	71	127.7 Å²	127.7	73%	0.732	77%	0.774	S	S	*	*			trans	89.8	135.9	178	0	0	0	0	0	116.4
866	G	31.9	Very low	34.1	Very low	66 Å²	66	127.4 Å²	127.4	68%	0.68	77%	0.772	S	S	*	*			cis	158.1	152.7	-12.1	0	0	0	0	0	114.8
867	H	36	Very low	33.9	Very low	189 Å²	189	128.1 Å²	128.1	88%	0.875	76%	0.764	S	S	*	*			trans	70.1	156.1	162.5	-64.2	-90	0	0	0	120.2
868	F	29.4	Very low	33.7	Very low	181 Å²	181	128.8 Å²	128.8	79%	0.794	76%	0.762	S	S	*	*			cis	-171.9	-172.4	-27.5	-173.2	-121.4	0	0	0	110.1
869	V	35.1	Very low	33.6	Very low	128 Å²	128	126.7 Å²	126.7	78%	0.776	76%	0.76	S	S	*	*			trans	91.7	155.2	174	-170.2	0	0	0	0	115.2
870	K	29.8	Very low	33.4	Very low	159 Å²	159	128.5 Å²	128.5	69%	0.691	76%	0.76	S	S	*	*			trans	-160.2	137.1	-160.2	175	-137.9	169.5	-170.8	0	113.6	E872	K870-E872 WeakPolarHBondContact CE-OE1 3.39Å; K870-E872 IonicContact NZ-OE1 3.32Å; K870-E872 PolarHBondContact NZ-OE1 3.1Å
871	A	34.2	Very low	33.2	Very low	94 Å²	94	130.8 Å²	130.8	78%	0.777	76%	0.76	S	S	*	*			trans	-146.9	117.6	154.4	0	0	0	0	0	107.5
872	E	32.4	Very low	33.1	Very low	150 Å²	150	133.5 Å²	133.5	70%	0.701	76%	0.762	S	S	*	*				73.2	128.7	78	-66.9	-62.4	162.9	0	0	114.3	K870	K870-E872 WeakPolarHBondContact CE-OE1 3.39Å; K870-E872 IonicContact NZ-OE1 3.32Å; K870-E872 PolarHBondContact NZ-OE1 3.1Å
873	A	34.1	Very low	33.1	Very low	88 Å²	88	129.8 Å²	129.8	73%	0.727	76%	0.758	S	S	*	*			trans	-109.8	-175.5	-169.3	0	0	0	0	0	112.7
874	P	36	Very low	32.8	Very low	124 Å²	124	130.1 Å²	130.1	81%	0.805	77%	0.765	S	S	*	*				-148.8	-138.9	83.7	44.6	-22.4	0	0	0	113.6
875	P	40.4	Very low	32.7	Very low	112 Å²	112	128.4 Å²	128.4	73%	0.727	76%	0.763	S	S	*	*			trans	-127.3	-159.6	-132.7	37.4	-12	0	0	0	115.7
876	E	33.7	Very low	32.3	Very low	185 Å²	185	131.8 Å²	131.8	86%	0.864	76%	0.76	S	S	*	*			trans	71.2	158.5	-178.4	-57.6	-169	161.3	0	0	115.4
877	S	30.8	Very low	32.4	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	76%	0.76	S	S	*	*			cis	-164.2	-178.8	-36.8	65.6	0	0	0	0	108.5
878	A	31.5	Very low	32.1	Very low	82 Å²	82	132.6 Å²	132.6	68%	0.678	76%	0.755	S	S	*	*			trans	72.5	125.1	159.2	0	0	0	0	0	122.1
879	L	30.6	Very low	32.3	Very low	159 Å²	159	130.6 Å²	130.6	83%	0.832	76%	0.758	S	S	*	*			trans	64.4	108.2	139.5	-58.1	168.1	0	0	0	122.1
880	L	32.6	Very low	32.3	Very low	157 Å²	157	135.7 Å²	135.7	82%	0.822	76%	0.763	S	S	*	*				-178	138.5	98.4	-106.9	96.9	0	0	0	107
881	M	28	Very low	32.6	Very low	160 Å²	160	140.2 Å²	140.2	79%	0.788	78%	0.776	S	S	*	*				58.7	87.9	55.5	-79.7	-76.5	175.9	0	0	113.6
882	D	31.8	Very low	32.8	Very low	152 Å²	152	145.9 Å²	145.9	81%	0.813	78%	0.783	S	S	*	*			trans	-118.7	122.3	168.6	-156	-13.4	0	0	0	111.2
883	V	29.1	Very low	32.8	Very low	110 Å²	110	150 Å²	150	67%	0.667	79%	0.792	S	S	*	*			trans	-114.2	87.3	-170.8	179.3	0	0	0	0	109.2	S885	V883-S885 VanDerWaalsContact C-N 3.29Å; V883-S885 PolarHBondContact O-N 3.4Å
884	C	31.9	Very low	32.9	Very low	128 Å²	128	154.6 Å²	154.6	87%	0.865	80%	0.799	S	S	*	*			trans	-77	73.7	177.9	-88.3	0	0	0	0	113.3
885	S	30	Very low	32.9	Very low	99 Å²	99	154.1 Å²	154.1	69%	0.692	80%	0.798	S	S	*	*			trans	-91	100.1	167.5	-78.7	0	0	0	0	112	V883	V883-S885 VanDerWaalsContact C-N 3.29Å; V883-S885 PolarHBondContact O-N 3.4Å
886	E	29.6	Very low	32.6	Very low	143 Å²	143	151.6 Å²	151.6	67%	0.668	79%	0.792	S	S	*	*			trans	-164.9	138.2	144.9	-103	-131.1	-138.8	0	0	113	R888	E886-R888 IonicContact OE1-CZ 3.59Å; E886-R888 IonicContact OE1-NE 2.73Å; E886-R888 IonicContact OE1-NH2 2.72Å; E886-R888 PolarHBondContact OE1-NH2 3.31Å; E886-R888 VanDerWaalsContact OE2-CG 3.31Å; E886-R888 WeakPolarHBondContact OE2-CG 3.45Å; E886-R888 IonicContact OE2-CZ 3.41Å; E886-R888 IonicContact OE2-NE 2.66Å; E886-R888 PolarHBondContact OE2-NE 3.34Å; E886-R888 IonicContact OE2-NH2 3.29Å; E886-R888 PolarHBondContact OE2-NH2 2.95Å
887	G	33	Very low	32.8	Very low	67 Å²	67	151.6 Å²	151.6	69%	0.691	79%	0.792	S	S	*	*			trans	-155.7	46	-169.7	0	0	0	0	0	115	V889	G887-V889 PolarHBondContact O-N 2.94Å
888	R	30.7	Very low	32.9	Very low	204 Å²	204	151.5 Å²	151.5	77%	0.77	79%	0.791	S	S	*	*			trans	-48.9	119.6	-170.7	-69.8	174.1	-156.2	-174.9	4.5	115.1	E886	E886-R888 IonicContact OE1-CZ 3.59Å; E886-R888 IonicContact OE1-NE 2.73Å; E886-R888 IonicContact OE1-NH2 2.72Å; E886-R888 PolarHBondContact OE1-NH2 3.31Å; E886-R888 VanDerWaalsContact OE2-CG 3.31Å; E886-R888 WeakPolarHBondContact OE2-CG 3.45Å; E886-R888 IonicContact OE2-CZ 3.41Å; E886-R888 IonicContact OE2-NE 2.66Å; E886-R888 PolarHBondContact OE2-NE 3.34Å; E886-R888 IonicContact OE2-NH2 3.29Å; E886-R888 PolarHBondContact OE2-NH2 2.95Å
889	V	34.1	Very low	33.3	Very low	140 Å²	140	154.4 Å²	154.4	85%	0.848	79%	0.794	S	S	*	*			trans	-107.9	82.7	168	-172.9	0	0	0	0	112	G887	G887-V889 PolarHBondContact O-N 2.94Å
890	R	33.8	Very low	33.6	Very low	235 Å²	235	154.1 Å²	154.1	89%	0.887	79%	0.789	S	S	*	*			trans	24.9	110.2	150.6	-71.5	179.4	159.5	121.1	-2.9	118.6
891	R	37.4	Very low	33.7	Very low	254 Å²	254	153.3 Å²	153.3	96%	0.958	79%	0.785	S	S	*	*			trans	-92.6	178.8	148.5	-74.5	-171.5	-178.5	173.1	4.4	111.7
892	K	38.1	Very low	34.1	Very low	213 Å²	213	152 Å²	152	93%	0.926	78%	0.782	S	S	*	*			trans	-79.7	162.8	-154.4	-154	173.2	179.7	-175.2	0	114
893	R	31.2	Very low	34.4	Very low	235 Å²	235	149.5 Å²	149.5	89%	0.887	78%	0.776	S	S	*	*			trans	-77.1	143	-178.2	-66.8	171.3	166.1	174.9	-7.7	114.5
894	Q	37.6	Very low	34.8	Very low	186 Å²	186	153.2 Å²	153.2	87%	0.869	78%	0.783	S	S	*	*			trans	-173.8	150.4	149.9	-97.1	154.5	-28.6	0	0	105.1
895	S	35.7	Very low	34.8	Very low	114 Å²	114	154 Å²	154	80%	0.797	77%	0.774	S	S	*	*			cis	163.6	128.4	-28.1	42.5	0	0	0	0	105.9
896	G	34.5	Very low	35.1	Very low	58 Å²	58	157.9 Å²	157.9	60%	0.598	78%	0.781	S	S	*	*			trans	121	113.9	-169.9	0	0	0	0	0	110.1
897	E	36.6	Very low	35.5	Very low	185 Å²	185	156.4 Å²	156.4	86%	0.864	79%	0.787	S	S	*	*				73.1	95.4	87.4	-71.8	168.2	120.5	0	0	111.5
898	S	34.1	Very low	35.4	Very low	100 Å²	100	158.6 Å²	158.6	70%	0.699	79%	0.79	S	S	*	*				61.3	115.6	80.1	68.3	0	0	0	0	113.1
899	I	38.3	Very low	35.5	Very low	144 Å²	144	157 Å²	157	74%	0.738	79%	0.792	S	S	*	*				-161	139.8	82.2	-85	151.3	0	0	0	111.8
900	E	37	Very low	35.6	Very low	153 Å²	153	157.5 Å²	157.5	72%	0.715	78%	0.784	S	S	*	*			trans	28.8	124.7	138.8	-48.4	-175.2	140.9	0	0	121.6
901	N	35.5	Very low	35.6	Very low	139 Å²	139	155 Å²	155	74%	0.743	78%	0.783	S	S	*	*				82.1	152	102.6	-59.3	-2.7	0	0	0	113.4
902	D	37.2	Very low	35.2	Very low	134 Å²	134	148.9 Å²	148.9	72%	0.717	77%	0.774	S	S	*	*			cis	-150.9	138.2	12.8	-109.7	-56	0	0	0	108.6
903	S	37.7	Very low	35	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	77%	0.772	S	S	*	*				86.8	143.8	90.3	-67.7	0	0	0	0	118.3
904	K	36.9	Very low	35.1	Very low	187 Å²	187	141.4 Å²	141.4	81%	0.813	76%	0.764	S	S	*	*			trans	72.7	163.1	173.1	-70.2	-162.2	166.8	-171	0	119.3
905	E	33.1	Very low	35.3	Very low	144 Å²	144	137.5 Å²	137.5	67%	0.673	76%	0.755	S	S	*	*			cis	173.2	158.7	-42.5	-108.6	-177.5	142.4	0	0	108.4
906	Q	35.4	Very low	35.2	Very low	181 Å²	181	137.7 Å²	137.7	85%	0.846	75%	0.747	S	S	*	*			trans	66.5	156.2	164.6	-74.9	174.3	-4.6	0	0	117.7
907	S	36.9	Very low	35.1	Very low	113 Å²	113	143.2 Å²	143.2	79%	0.79	76%	0.757	S	S	*	*			cis	-155.4	-178.8	-20.1	-163.6	0	0	0	0	110.4
908	C	30.9	Very low	34.8	Very low	112 Å²	112	137.7 Å²	137.7	76%	0.757	75%	0.749	S	S	*	*			trans	-77.8	-175.9	-168.3	-53.4	0	0	0	0	117.2
909	Q	34.5	Very low	34.9	Very low	172 Å²	172	141.7 Å²	141.7	80%	0.804	76%	0.757	S	S	*	*			trans	86.2	150.8	161.5	-63.6	-168.3	-71.4	0	0	118.6
910	E	35.2	Very low	34.8	Very low	149 Å²	149	143.5 Å²	143.5	70%	0.696	76%	0.763	S	S	*	*			cis	-171.6	163.9	-26.4	-170	168	141.6	0	0	109.1
911	Q	34.6	Very low	34.8	Very low	182 Å²	182	143.1 Å²	143.1	85%	0.85	77%	0.765	S	S	*	*			trans	127.9	147.6	151.9	-68.1	-177.1	-3.3	0	0	115.9
912	T	28.2	Very low	34.7	Very low	126 Å²	126	142 Å²	142	77%	0.773	76%	0.759	S	S	*	*			trans	-140.6	131.5	-166.6	-55.1	0	0	0	0	110.1	V914	T912-V914 HydrophobicContact CG2-CG2 4.32Å
913	I	33.2	Very low	34.7	Very low	172 Å²	172	145.1 Å²	145.1	88%	0.882	76%	0.761	S	S	*	*			trans	-140.5	133.3	168.1	-55.8	-178.3	0	0	0	110.4
914	V	35.1	Very low	34.5	Very low	120 Å²	120	146.6 Å²	146.6	73%	0.727	76%	0.761	S	S	*	*			trans	-161.2	172.5	174	-114.4	0	0	0	0	105.3	T912	T912-V914 HydrophobicContact CG2-CG2 4.32Å
915	P	41	Very low	34.2	Very low	104 Å²	104	144.8 Å²	144.8	68%	0.675	76%	0.756	S	S	*	*			cis	-135.3	-146.7	5	25.8	2.6	0	0	0	112.7
916	N	33.5	Very low	34	Very low	117 Å²	117	146.2 Å²	146.2	63%	0.626	76%	0.759	S	S	*	*			trans	76.6	152.9	162.5	-72.9	59	0	0	0	118.2
917	E	31.5	Very low	33.9	Very low	175 Å²	175	142.9 Å²	142.9	82%	0.818	75%	0.751	S	S	*	*			cis	178.3	151.4	-32.8	-113.9	167.4	-140.6	0	0	106.9
918	G	31.6	Very low	33.4	Very low	68 Å²	68	143 Å²	143	70%	0.701	75%	0.747	S	S	*	*			trans	125.6	145.4	161.1	0	0	0	0	0	118.5
919	E	36.9	Very low	33.3	Very low	184 Å²	184	143 Å²	143	86%	0.86	75%	0.749	S	S	*	*			trans	52	123.2	153.6	-63.9	163.6	132.9	0	0	118.9
920	E	34.3	Very low	33.1	Very low	183 Å²	183	139.6 Å²	139.6	86%	0.855	75%	0.75	S	S	*	*			cis	91.6	163	49.5	-72	-161.8	158.2	0	0	114.7
921	D	37.7	Very low	33	Very low	145 Å²	145	137.9 Å²	137.9	78%	0.775	76%	0.755	S	S	*	*			trans	69.6	92	177.4	-82.9	-5.6	0	0	0	122.8
922	D	34.5	Very low	33.1	Very low	115 Å²	115	135 Å²	135	62%	0.615	75%	0.751	S	S	*	*				71.7	153.5	105.2	-141.5	0.8	0	0	0	123.8
923	R	36.9	Very low	33.2	Very low	200 Å²	200	133 Å²	133	76%	0.755	75%	0.748	S	S	*	*			trans	70.3	102.6	156.5	-80.8	162.1	-132.5	174.7	18.3	123.2
924	N	32.9	Very low	33.1	Very low	130 Å²	130	131.1 Å²	131.1	70%	0.695	74%	0.738	S	S	*	*				95.3	100.5	103	-163.1	80	0	0	0	121.7
925	E	30.5	Very low	33	Very low	149 Å²	149	134.3 Å²	134.3	70%	0.696	74%	0.743	S	S	*	*			trans	61.4	151.3	135.6	-76.3	-151.2	131	0	0	124.6
926	K	29.8	Very low	32.5	Very low	173 Å²	173	134.1 Å²	134.1	75%	0.752	74%	0.744	S	S	*	*			trans	88.1	119.6	145	-86.1	-172.4	177.2	173.8	0	122.4
927	V	31.7	Very low	32.7	Very low	111 Å²	111	134.6 Å²	134.6	67%	0.673	75%	0.751	S	S	*	*				96.6	86	124.9	171.4	0	0	0	0	119.7
928	T	27.5	Very low	32.8	Very low	116 Å²	116	131.6 Å²	131.6	71%	0.712	74%	0.741	S	S	*	*				60.2	124.8	127.3	67.1	0	0	0	0	123.4
929	S	27.8	Very low	33.1	Very low	113 Å²	113	135.3 Å²	135.3	79%	0.79	74%	0.737	S	S	*	*				89.2	151.8	120.9	72.6	0	0	0	0	123.1
930	A	31	Very low	33	Very low	99 Å²	99	133.1 Å²	133.1	82%	0.818	73%	0.732	S	S	*	*			trans	87.5	126.8	157.7	0	0	0	0	0	119.6
931	S	33.9	Very low	33	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	73%	0.732	S	S	*	*			trans	-82.3	176.3	173.9	-39.9	0	0	0	0	112.2
932	P	35.3	Very low	32.8	Very low	121 Å²	121	131.5 Å²	131.5	79%	0.786	73%	0.733	S	S	*	*				-150.1	146.4	103.4	39.6	-23.7	0	0	0	117.6
933	A	31.6	Very low	32.6	Very low	84 Å²	84	132 Å²	132	69%	0.694	74%	0.735	S	S	*	*				65.8	159.1	121.4	0	0	0	0	0	124.5
934	I	30.1	Very low	32.3	Very low	132 Å²	132	127.7 Å²	127.7	68%	0.677	74%	0.736	S	S	*	*			cis	-163.2	168.7	-21.4	-95.8	161.2	0	0	0	107
935	F	32.5	Very low	32	Very low	188 Å²	188	127.2 Å²	127.2	83%	0.825	74%	0.743	S	S	*	*			trans	98.6	106.7	170.8	-63.5	-69.7	0	0	0	115.1
936	S	32.1	Very low	32	Very low	100 Å²	100	125.1 Å²	125.1	70%	0.699	75%	0.745	S	S	*	*			cis	80.7	142.4	35.8	-44	0	0	0	0	113.5
937	T	35.8	Very low	31.9	Very low	127 Å²	127	124.4 Å²	124.4	78%	0.779	75%	0.749	S	S	*	*			cis	-131.5	-167.5	8.4	56.2	0	0	0	0	110.5
938	D	34.9	Very low	31.9	Very low	112 Å²	112	126.4 Å²	126.4	60%	0.599	76%	0.762	S	S	*	*			cis	-158.7	156.4	2.6	-143.1	10.6	0	0	0	113.4
939	K	37.3	Very low	31.9	Very low	146 Å²	146	125.4 Å²	125.4	64%	0.635	77%	0.765	S	S	*	*			trans	49.9	107	149.3	-70.8	175.7	-173.7	67	0	125.5
940	D	34.9	Very low	32	Very low	138 Å²	138	126.2 Å²	126.2	74%	0.738	77%	0.77	S	S	*	*				59.5	112.9	110.8	-47.8	-12.7	0	0	0	122.1
941	S	35.4	Very low	32	Very low	122 Å²	122	126.2 Å²	126.2	85%	0.853	76%	0.764	S	S	*	*				-173.5	137	91.5	-87.3	0	0	0	0	114.4
942	Q	32.8	Very low	31.9	Very low	171 Å²	171	132.1 Å²	132.1	80%	0.799	77%	0.769	S	S	*	*			trans	-51.1	164.3	174.8	-71.8	173	-89.9	0	0	117
943	D	30.2	Very low	32	Very low	125 Å²	125	133.7 Å²	133.7	67%	0.668	77%	0.771	S	S	*	*			cis	-158.8	178.1	1.3	-131.5	-42.8	0	0	0	115.5
944	S	31.3	Very low	32	Very low	110 Å²	110	133.1 Å²	133.1	77%	0.769	77%	0.766	S	S	*	*			trans	76.5	92.1	152.9	72.1	0	0	0	0	118.8
945	S	26.3	Very low	32.3	Very low	120 Å²	120	131.3 Å²	131.3	84%	0.839	76%	0.757	S	S	*	*			trans	-134.9	135.1	149.5	66.4	0	0	0	0	109.2
946	S	30.2	Very low	32.5	Very low	106 Å²	106	124.7 Å²	124.7	74%	0.741	74%	0.742	S	S	*	*			trans	-143.9	131.7	179.8	53.3	0	0	0	0	114.7
947	N	27.9	Very low	32.6	Very low	157 Å²	157	123.8 Å²	123.8	84%	0.84	73%	0.732	S	S	*	*			trans	53.2	99.7	143.6	-54.4	-12.7	0	0	0	119.7
948	V	30.5	Very low	32.5	Very low	154 Å²	154	123.8 Å²	123.8	93%	0.933	73%	0.726	S	S	*	*			trans	-131.2	100.8	145.7	-178.2	0	0	0	0	109.6
949	A	28.1	Very low	32.6	Very low	95 Å²	95	122.4 Å²	122.4	79%	0.785	73%	0.725	S	S	*	*			trans	-148	150.9	169.6	0	0	0	0	0	110.1
950	S	29.6	Very low	32.6	Very low	129 Å²	129	119 Å²	119	90%	0.902	71%	0.713	S	S	*	*			trans	66.5	98.1	174.3	-153.8	0	0	0	0	118.5
951	S	31.6	Very low	32.7	Very low	99 Å²	99	117.9 Å²	117.9	69%	0.692	71%	0.707	S	S	*	*			trans	-166.1	26.3	159.6	57.6	0	0	0	0	114.3
952	R	32.6	Very low	32.7	Very low	238 Å²	238	115.1 Å²	115.1	90%	0.898	69%	0.691	S	S	*	*			trans	-82.8	-20.5	-160.7	-84.8	-175.9	169.6	145.1	0.5	118
953	N	36.8	Very low	33	Very low	155 Å²	155	108.5 Å²	108.5	83%	0.829	66%	0.663	S	S	*	*	S	Bend	trans	-108.2	-4.3	-162	-66.7	20.3	0	0	0	116.1
954	A	31.8	Very low	33.4	Very low	72 Å²	72	104 Å²	104	60%	0.595	64%	0.643	S	S	*	*	S	Bend	trans	-89.2	-25.9	-174.2	0	0	0	0	0	114.9	G956	A954-G956 PolarHBondContact O-N 3.16Å
955	I	36.3	Very low	33.6	Very low	94 Å²	94	101.4 Å²	101.4	48%	0.482	63%	0.629	S	S	.	*	H	α-helix	trans	-78.5	-26.6	-161.4	-61.3	172.2	0	0	0	113.1	V957	I955-V957 VanDerWaalsContact C-N 3.33Å; I955-V957 PolarHBondContact O-N 2.96Å
956	G	36	Very low	34.1	Very low	48 Å²	48	103 Å²	103	50%	0.495	62%	0.618	S	S	.	*	H	α-helix	trans	-63.7	-35.2	179.3	0	0	0	0	0	113.8	A954 I958 S959 L960	A954-G956 PolarHBondContact O-N 3.16Å; G956-I958 VanDerWaalsContact C-N 3.34Å; G956-I958 PolarHBondContact O-N 3.48Å; G956-S959 PolarHBondContact O-N 3.49Å; G956-L960 PolarHBondContact O-N 3.4Å; G956-L960 VanDerWaalsContact O-N 3.14Å
957	V	33.6	Very low	34.5	Very low	82 Å²	82	101 Å²	101	50%	0.497	60%	0.598	S	S	.	*	H	α-helix	trans	-64.4	-36.7	-174.9	-174.2	0	0	0	0	112	I955 S959 L960 L961	I955-V957 VanDerWaalsContact C-N 3.33Å; I955-V957 PolarHBondContact O-N 2.96Å; V957-S959 PolarHBondContact O-N 2.96Å; V957-L960 PolarHBondContact O-N 3.49Å; V957-L961 HydrophobicContact CG1-CD1 4.07Å; V957-L961 HydrophobicContact CG1-CG 4.39Å; V957-L961 WeakPolarHBondContact O-CG 3.32Å; V957-L961 PolarHBondContact O-N 2.86Å
958	I	35.4	Very low	35.2	Very low	127 Å²	127	98.3 Å²	98.3	65%	0.651	58%	0.584	S	S	*	*	H	α-helix	trans	-69.1	-35.8	-178.1	-57.8	176.7	0	0	0	111	G956 A962	G956-I958 VanDerWaalsContact C-N 3.34Å; G956-I958 PolarHBondContact O-N 3.48Å; I958-A962 PolarHBondContact O-N 3.01Å
959	S	37	Very low	36	Very low	83 Å²	83	95.2 Å²	95.2	58%	0.58	56%	0.562	S	S	*	*	H	α-helix	trans	-73.9	-33.2	176.2	-166.4	0	0	0	0	112.6	G956 V957 S963	G956-S959 PolarHBondContact O-N 3.49Å; V957-S959 PolarHBondContact O-N 2.96Å; S959-S963 PolarHBondContact O-N 2.66Å; S959-S963 PolarHBondContact O-OG 2.59Å
960	L	37.6	Very low	36.5	Very low	74 Å²	74	93.1 Å²	93.1	39%	0.387	54%	0.541	S	S	.	.	H	α-helix	trans	-63.5	-48.9	169.3	-77.1	163.6	0	0	0	111.3	E541 G956 V957 A962 S963 A964	E541-L960 WeakPolarHBondContact OE2-CD2 3.19Å; G956-L960 PolarHBondContact O-N 3.4Å; G956-L960 VanDerWaalsContact O-N 3.14Å; V957-L960 PolarHBondContact O-N 3.49Å; L960-A962 PolarHBondContact O-N 3Å; L960-S963 CarbonylContact O-C 3.57Å; L960-S963 WeakPolarHBondContact O-CA 3.41Å; L960-S963 VanDerWaalsContact O-CB 3.3Å; L960-S963 WeakPolarHBondContact O-CB 3.48Å; L960-S963 PolarHBondContact O-N 3.47Å; L960-A964 WeakPolarHBondContact O-CB 3.26Å; L960-A964 PolarHBondContact O-N 3.36Å
961	L	36.1	Very low	37.2	Very low	115 Å²	115	91 Å²	91	60%	0.602	52%	0.52	S	S	*	.	H	α-helix	trans	-60.9	-40.8	178.2	-72	169.9	0	0	0	112.9	V957 S963 A964 A965	V957-L961 HydrophobicContact CG1-CD1 4.07Å; V957-L961 HydrophobicContact CG1-CG 4.39Å; V957-L961 WeakPolarHBondContact O-CG 3.32Å; V957-L961 PolarHBondContact O-N 2.86Å; L961-S963 VanDerWaalsContact C-N 3.33Å; L961-S963 PolarHBondContact O-N 3.46Å; L961-A964 PolarHBondContact O-N 2.89Å; L961-A965 WeakPolarHBondContact O-CB 3.47Å; L961-A965 PolarHBondContact O-N 3.48Å
962	A	35.1	Very low	37.9	Very low	64 Å²	64	95.2 Å²	95.2	53%	0.529	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-37	173.2	0	0	0	0	0	112.4	I958 L960 Y966	I958-A962 PolarHBondContact O-N 3.01Å; L960-A962 PolarHBondContact O-N 3Å; A962-Y966 PolarHBondContact O-N 2.92Å
963	S	39.1	Very low	38.4	Very low	31 Å²	31	90.7 Å²	90.7	22%	0.217	51%	0.509	C	S	.	.	H	α-helix	trans	-65.7	-45.8	173.3	-56	0	0	0	0	111.5	R649 S959 L960 L961 A965 Y966 L967	R649-S963 PolarHBondContact NH2-OG 3.17Å; S959-S963 PolarHBondContact O-N 2.66Å; S959-S963 PolarHBondContact O-OG 2.59Å; L960-S963 CarbonylContact O-C 3.57Å; L960-S963 WeakPolarHBondContact O-CA 3.41Å; L960-S963 VanDerWaalsContact O-CB 3.3Å; L960-S963 WeakPolarHBondContact O-CB 3.48Å; L960-S963 PolarHBondContact O-N 3.47Å; L961-S963 VanDerWaalsContact C-N 3.33Å; L961-S963 PolarHBondContact O-N 3.46Å; S963-A965 VanDerWaalsContact C-N 3.32Å; S963-A965 PolarHBondContact O-N 2.61Å; S963-Y966 PolarHBondContact O-N 2.67Å; S963-Y966 VanDerWaalsContact O-N 3.16Å; S963-L967 WeakPolarHBondContact O-CB 3.31Å; S963-L967 WeakPolarHBondContact O-CG 3.44Å; S963-L967 PolarHBondContact O-N 2.98Å
964	A	38.5	Very low	38.7	Very low	30 Å²	30	85.5 Å²	85.5	25%	0.248	49%	0.488	C	S	.	.	H	α-helix	trans	-63.9	-35.9	179.4	0	0	0	0	0	111.8	L960 L961 N968	L960-A964 WeakPolarHBondContact O-CB 3.26Å; L960-A964 PolarHBondContact O-N 3.36Å; L961-A964 PolarHBondContact O-N 2.89Å; A964-N968 WeakPolarHBondContact O-CB 3.34Å; A964-N968 PolarHBondContact O-N 3.03Å; A964-N968 PolarHBondContact O-ND2 3.24Å
965	A	35.4	Very low	39.4	Very low	56 Å²	56	84.1 Å²	84.1	46%	0.463	48%	0.477	S	S	.	.	H	α-helix	trans	-64.3	-42	172.3	0	0	0	0	0	112.1	L961 S963 N968 N969	L961-A965 WeakPolarHBondContact O-CB 3.47Å; L961-A965 PolarHBondContact O-N 3.48Å; S963-A965 VanDerWaalsContact C-N 3.32Å; S963-A965 PolarHBondContact O-N 2.61Å; A965-N968 PolarHBondContact O-N 3.27Å; A965-N969 PolarHBondContact O-N 3.47Å; A965-N969 VanDerWaalsContact O-N 3.15Å
966	Y	38.2	Very low	39.7	Very low	155 Å²	155	83 Å²	83	61%	0.608	48%	0.482	S	S	*	.	H	α-helix	trans	-68.2	-41.2	177	-164.5	-96	0	0	0	112.3	A962 S963 N969 C970	A962-Y966 PolarHBondContact O-N 2.92Å; S963-Y966 PolarHBondContact O-N 2.67Å; S963-Y966 VanDerWaalsContact O-N 3.16Å; Y966-N969 PolarHBondContact O-N 3.11Å; Y966-C970 PolarHBondContact O-N 2.92Å; Y966-C970 PolarHBondContact O-SG 2.79Å
967	L	38.2	Very low	40.1	Very low	62 Å²	62	84.5 Å²	84.5	33%	0.325	49%	0.49	S	S	.	.	H	α-helix	trans	-64.4	-41.6	174.6	-72	169.8	0	0	0	111.8	M545 S963 N969 C970 D971	M545-L967 HydrophobicContact SD-CD2 4.36Å; S963-L967 WeakPolarHBondContact O-CB 3.31Å; S963-L967 WeakPolarHBondContact O-CG 3.44Å; S963-L967 PolarHBondContact O-N 2.98Å; L967-N969 VanDerWaalsContact C-N 3.26Å; L967-N969 PolarHBondContact O-N 2.9Å; L967-C970 PolarHBondContact O-N 3.16Å; L967-D971 WeakPolarHBondContact O-CB 3.45Å; L967-D971 PolarHBondContact O-N 2.99Å
968	N	42.8	Very low	40.5	Very low	102 Å²	102	87.5 Å²	87.5	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-61.4	-32.9	173.3	-86.2	-71.2	0	0	0	112.7	A964 A965 R972	A964-N968 WeakPolarHBondContact O-CB 3.34Å; A964-N968 PolarHBondContact O-N 3.03Å; A964-N968 PolarHBondContact O-ND2 3.24Å; A965-N968 PolarHBondContact O-N 3.27Å; N968-R972 VanDerWaalsContact O-CB 3.28Å; N968-R972 WeakPolarHBondContact O-CB 3.2Å; N968-R972 VanDerWaalsContact O-CG 3.23Å; N968-R972 WeakPolarHBondContact O-CG 3.45Å; N968-R972 PolarHBondContact O-N 3.47Å
969	N	45.6	Very low	40.6	Very low	89 Å²	89	87.8 Å²	87.8	48%	0.476	51%	0.505	S	S	.	.	H	α-helix	trans	-71.1	-43.9	172.8	-76.1	-7.1	0	0	0	111.6	A965 Y966 L967 R972 E973	A965-N969 PolarHBondContact O-N 3.47Å; A965-N969 VanDerWaalsContact O-N 3.15Å; Y966-N969 PolarHBondContact O-N 3.11Å; L967-N969 VanDerWaalsContact C-N 3.26Å; L967-N969 PolarHBondContact O-N 2.9Å; N969-R972 PolarHBondContact O-N 3.01Å; N969-E973 WeakPolarHBondContact O-CG 3.18Å; N969-E973 PolarHBondContact O-N 3.48Å
970	C	39.8	Very low	40.7	Very low	50 Å²	50	87.7 Å²	87.7	34%	0.338	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-43.4	176.2	-62.5	0	0	0	0	112.2	Y966 L967 R972 E973 A974	Y966-C970 PolarHBondContact O-N 2.92Å; Y966-C970 PolarHBondContact O-SG 2.79Å; L967-C970 PolarHBondContact O-N 3.16Å; C970-R972 VanDerWaalsContact C-N 3.33Å; C970-E973 PolarHBondContact O-N 2.75Å; C970-A974 VanDerWaalsContact O-CB 3.29Å; C970-A974 WeakPolarHBondContact O-CB 3.41Å; C970-A974 PolarHBondContact O-N 2.93Å
971	D	44.1	Very low	40.7	Very low	86 Å²	86	90 Å²	90	46%	0.46	53%	0.528	S	S	.	.	H	α-helix	trans	-68.1	-30.9	175.3	-82.5	-25.1	0	0	0	111.3	L967 A975	L967-D971 WeakPolarHBondContact O-CB 3.45Å; L967-D971 PolarHBondContact O-N 2.99Å; D971-A975 WeakPolarHBondContact O-CB 3.45Å; D971-A975 PolarHBondContact O-N 3.31Å
972	R	45.8	Very low	40.8	Very low	186 Å²	186	89.2 Å²	89.2	70%	0.702	53%	0.532	S	S	*	.	H	α-helix	trans	-69.4	-40.2	170.5	-82.8	-177.7	69.3	178	1.5	113.1	N968 N969 C970 A976	N968-R972 VanDerWaalsContact O-CB 3.28Å; N968-R972 WeakPolarHBondContact O-CB 3.2Å; N968-R972 VanDerWaalsContact O-CG 3.23Å; N968-R972 WeakPolarHBondContact O-CG 3.45Å; N968-R972 PolarHBondContact O-N 3.47Å; N969-R972 PolarHBondContact O-N 3.01Å; C970-R972 VanDerWaalsContact C-N 3.33Å; R972-A976 WeakPolarHBondContact O-CB 3.29Å; R972-A976 PolarHBondContact O-N 3.16Å
973	E	43.9	Very low	40.9	Very low	143 Å²	143	92.7 Å²	92.7	67%	0.668	54%	0.542	S	S	*	.	H	α-helix	trans	-70.3	-40.5	177	-73.2	176.5	176.2	0	0	111.2	N969 C970 A976 A977	N969-E973 WeakPolarHBondContact O-CG 3.18Å; N969-E973 PolarHBondContact O-N 3.48Å; C970-E973 PolarHBondContact O-N 2.75Å; E973-A976 PolarHBondContact O-N 3.46Å; E973-A977 PolarHBondContact O-N 3.42Å
974	A	43.6	Very low	40.8	Very low	47 Å²	47	97.4 Å²	97.4	39%	0.388	57%	0.565	S	S	.	*	H	α-helix	trans	-64.3	-42	171.6	0	0	0	0	0	112.1	C970 A977 L978	C970-A974 VanDerWaalsContact O-CB 3.29Å; C970-A974 WeakPolarHBondContact O-CB 3.41Å; C970-A974 PolarHBondContact O-N 2.93Å; A974-A977 PolarHBondContact O-N 3.3Å; A974-L978 WeakPolarHBondContact O-CB 3.38Å; A974-L978 VanDerWaalsContact O-CG 3.3Å; A974-L978 WeakPolarHBondContact O-CG 3.46Å; A974-L978 PolarHBondContact O-N 3.43Å
975	A	45.2	Very low	40.7	Very low	43 Å²	43	102.1 Å²	102.1	36%	0.355	59%	0.59	S	S	.	*	H	α-helix	trans	-65.2	-36.7	173.5	0	0	0	0	0	112.1	D971 L978 N979	D971-A975 WeakPolarHBondContact O-CB 3.45Å; D971-A975 PolarHBondContact O-N 3.31Å; A975-L978 PolarHBondContact O-N 2.93Å; A975-N979 PolarHBondContact O-N 3.44Å; A975-N979 PolarHBondContact O-ND2 2.94Å
976	A	42.7	Very low	40.7	Very low	70 Å²	70	106 Å²	106	58%	0.579	61%	0.608	S	S	*	*	H	α-helix	trans	-63.8	-43	174.1	0	0	0	0	0	111.2	R972 E973 L978 N979	R972-A976 WeakPolarHBondContact O-CB 3.29Å; R972-A976 PolarHBondContact O-N 3.16Å; E973-A976 PolarHBondContact O-N 3.46Å; A976-L978 VanDerWaalsContact C-N 3.29Å; A976-L978 PolarHBondContact O-N 3.36Å; A976-N979 PolarHBondContact O-N 3.25Å
977	A	44.7	Very low	40.3	Very low	80 Å²	80	103 Å²	103	66%	0.661	62%	0.615	S	S	*	*	H	α-helix	trans	-65.8	-27.8	175.5	0	0	0	0	0	113.8	E973 A974	E973-A977 PolarHBondContact O-N 3.42Å; A974-A977 PolarHBondContact O-N 3.3Å
978	L	42.1	Very low	40	Very low	145 Å²	145	107.6 Å²	107.6	76%	0.759	64%	0.635	S	S	*	*	H	α-helix	trans	-86.2	-9.8	178.2	-73.8	168.6	0	0	0	114.5	A974 A975 A976	A974-L978 WeakPolarHBondContact O-CB 3.38Å; A974-L978 VanDerWaalsContact O-CG 3.3Å; A974-L978 WeakPolarHBondContact O-CG 3.46Å; A974-L978 PolarHBondContact O-N 3.43Å; A975-L978 PolarHBondContact O-N 2.93Å; A976-L978 VanDerWaalsContact C-N 3.29Å; A976-L978 PolarHBondContact O-N 3.36Å
979	N	37.7	Very low	39.8	Very low	133 Å²	133	111.1 Å²	111.1	71%	0.711	65%	0.646	S	S	*	*			trans	-99.2	19.6	-177.9	-81.9	-65.3	0	0	0	114.1	A975 A976	A975-N979 PolarHBondContact O-N 3.44Å; A975-N979 PolarHBondContact O-ND2 2.94Å; A976-N979 PolarHBondContact O-N 3.25Å
980	A	38	Very low	39.2	Very low	81 Å²	81	112.4 Å²	112.4	67%	0.669	66%	0.661	S	S	*	*			trans	-88.4	120	173.6	0	0	0	0	0	111.9
981	P	38.6	Very low	38.8	Very low	121 Å²	121	119.8 Å²	119.8	79%	0.786	69%	0.688	S	S	*	*			trans	-86.4	158.4	176.2	35.2	-35.1	0	0	0	112.3
982	S	37.6	Very low	38.3	Very low	99 Å²	99	125.1 Å²	125.1	69%	0.692	71%	0.707	S	S	*	*			cis	-160.7	176.4	-14.7	57.6	0	0	0	0	110.5
983	D	37.7	Very low	37.5	Very low	137 Å²	137	122.8 Å²	122.8	73%	0.733	71%	0.713	S	S	*	*			trans	117.3	129.2	153.8	-67.5	8.7	0	0	0	116.5
984	N	37.5	Very low	37	Very low	131 Å²	131	127 Å²	127	70%	0.701	72%	0.723	S	S	*	*			cis	-163.3	162.5	-22.2	-144.7	-41.5	0	0	0	109.8
985	V	35	Very low	36.4	Very low	128 Å²	128	134.8 Å²	134.8	78%	0.776	75%	0.748	S	S	*	*			trans	64.2	128.4	167.5	-178.7	0	0	0	0	116.5
986	V	35	Very low	36.2	Very low	137 Å²	137	137.1 Å²	137.1	83%	0.83	75%	0.753	S	S	*	*			cis	-148.4	164.7	-6.1	109.9	0	0	0	0	109.1
987	A	30.1	Very low	36.5	Very low	93 Å²	93	136.3 Å²	136.3	77%	0.769	74%	0.742	S	S	*	*			trans	-128.9	-175.9	-173.1	0	0	0	0	0	114.8
988	E	33.3	Very low	36.7	Very low	158 Å²	158	138.2 Å²	138.2	74%	0.738	74%	0.74	S	S	*	*			trans	94	101.6	157.7	-138.1	-154.1	-169.1	0	0	119.4
989	K	38.9	Very low	37.4	Very low	177 Å²	177	136.2 Å²	136.2	77%	0.77	73%	0.727	S	S	*	*				-178.7	138.8	101	-93.5	160.6	-159	175.6	0	113.2
990	S	31.1	Very low	38.5	Very low	115 Å²	115	134.4 Å²	134.4	80%	0.804	72%	0.715	S	S	*	*			trans	-133	169.4	-179.2	-66.7	0	0	0	0	111.4
991	K	31.8	Very low	38.7	Very low	205 Å²	205	136.6 Å²	136.6	89%	0.891	71%	0.706	S	S	*	*			trans	78	96.7	172.1	-50.7	174.4	-178.2	176.5	0	117.1
992	K	33.3	Very low	39.7	Very low	198 Å²	198	136.1 Å²	136.1	86%	0.861	69%	0.692	S	S	*	*				-157.5	134.7	115.6	-126.7	162.2	-174	165.3	0	113.1
993	V	29.6	Very low	40.4	Very low	137 Å²	137	140.4 Å²	140.4	83%	0.83	69%	0.693	S	S	*	*			trans	-74.9	134.9	167.6	174.2	0	0	0	0	108.9
994	R	34.5	Very low	40.8	Very low	231 Å²	231	139.4 Å²	139.4	87%	0.872	69%	0.687	S	S	*	*			trans	-156.6	140.6	153.3	-109.2	159	-167.2	-168	-1.1	109.9	M996	R994-M996 PolarHBondContact O-N 3.13Å
995	K	30.8	Very low	41.3	Very low	211 Å²	211	140.6 Å²	140.6	92%	0.917	69%	0.686	S	S	*	*			trans	-65.5	129.6	170.1	-63.8	176.7	179.4	179.3	0	107.4
996	M	40.2	Very low	41.7	Very low	93 Å²	93	144.3 Å²	144.3	46%	0.458	69%	0.686	S	S	.	*			trans	-114.6	128.6	172.7	-168.3	167.1	73.3	0	0	107.4	R994 E1000 Y1001 L1004	R994-M996 PolarHBondContact O-N 3.13Å; M996-E1000 HydrophobicContact CG-CB 3.4Å; M996-E1000 HydrophobicContact CG-CG 4.36Å; M996-E1000 HydrophobicContact SD-CB 4.22Å; M996-Y1001 HydrophobicContact CE-CD2 3.93Å; M996-L1004 HydrophobicContact CE-CD2 4.1Å; M996-L1004 HydrophobicContact SD-CD2 4.08Å
997	S	48.3	Very low	41.6	Very low	52 Å²	52	142 Å²	142	36%	0.364	67%	0.674	S	S	.	*			trans	-67.9	161.4	-176.9	60.9	0	0	0	0	112.2	E999 E1000 Y1001	S997-E999 PolarHBondContact O-N 3.42Å; S997-E1000 VanDerWaalsContact CB-OE2 3.3Å; S997-E1000 WeakPolarHBondContact CB-OE2 3.45Å; S997-E1000 PolarHBondContact N-OE2 3.18Å; S997-E1000 PolarHBondContact O-N 3.04Å; S997-E1000 VanDerWaalsContact O-N 3.14Å; S997-E1000 WeakPolarHBondContact OG-CB 3.29Å; S997-E1000 VanDerWaalsContact OG-CG 3.23Å; S997-E1000 WeakPolarHBondContact OG-CG 3.4Å; S997-E1000 PolarHBondContact OG-N 3.3Å; S997-E1000 VanDerWaalsContact OG-N 3.09Å; S997-E1000 PolarHBondContact OG-OE2 3.29Å; S997-Y1001 PolarHBondContact O-N 3.27Å
998	I	48.6	Very low	41.8	Very low	120 Å²	120	143.7 Å²	143.7	62%	0.615	68%	0.676	S	S	*	*	H	α-helix	trans	-60.4	-37.9	175.5	-67.9	174.5	0	0	0	110.1	Y1001 K1002	I998-Y1001 PolarHBondContact O-N 3.24Å; I998-K1002 HydrophobicContact CG2-CD 4.21Å; I998-K1002 WeakPolarHBondContact O-CB 3.38Å; I998-K1002 VanDerWaalsContact O-CG 3.26Å; I998-K1002 WeakPolarHBondContact O-CG 3.37Å; I998-K1002 PolarHBondContact O-N 3.12Å
999	E	58.1	Low	41.8	Very low	103 Å²	103	144.8 Å²	144.8	48%	0.481	68%	0.678	S	S	.	*	H	α-helix	trans	-65.3	-39.5	172.9	-85.9	46.3	-113.7	0	0	113.2	S997 K1002 R1003	S997-E999 PolarHBondContact O-N 3.42Å; E999-K1002 PolarHBondContact O-N 3.34Å; E999-K1002 WeakPolarHBondContact OE1-CD 3.36Å; E999-K1002 IonicContact OE1-NZ 2.68Å; E999-K1002 PolarHBondContact OE1-NZ 2.82Å; E999-R1003 WeakPolarHBondContact O-CB 3.27Å; E999-R1003 WeakPolarHBondContact O-CG 3.08Å; E999-R1003 PolarHBondContact O-N 2.94Å
1000	E	59.7	Low	41.4	Very low	96 Å²	96	144.6 Å²	144.6	45%	0.449	68%	0.68	S	S	.	*	H	α-helix	trans	-67.1	-38.8	173	-76.1	163.7	118.3	0	0	111.9	M996 S997 K1002 R1003 L1004	M996-E1000 HydrophobicContact CG-CB 3.4Å; M996-E1000 HydrophobicContact CG-CG 4.36Å; M996-E1000 HydrophobicContact SD-CB 4.22Å; S997-E1000 VanDerWaalsContact CB-OE2 3.3Å; S997-E1000 WeakPolarHBondContact CB-OE2 3.45Å; S997-E1000 PolarHBondContact N-OE2 3.18Å; S997-E1000 PolarHBondContact O-N 3.04Å; S997-E1000 VanDerWaalsContact O-N 3.14Å; S997-E1000 WeakPolarHBondContact OG-CB 3.29Å; S997-E1000 VanDerWaalsContact OG-CG 3.23Å; S997-E1000 WeakPolarHBondContact OG-CG 3.4Å; S997-E1000 PolarHBondContact OG-N 3.3Å; S997-E1000 VanDerWaalsContact OG-N 3.09Å; S997-E1000 PolarHBondContact OG-OE2 3.29Å; E1000-K1002 PolarHBondContact O-N 3.46Å; E1000-R1003 CarbonylContact O-C 3.46Å; E1000-R1003 PolarHBondContact O-N 2.76Å; E1000-R1003 VanDerWaalsContact O-N 3.14Å; E1000-L1004 WeakPolarHBondContact O-CB 3.34Å; E1000-L1004 PolarHBondContact O-N 3.26Å
1001	Y	43.7	Very low	41.6	Very low	127 Å²	127	144.3 Å²	144.3	50%	0.498	68%	0.675	S	S	.	*	H	α-helix	trans	-64.1	-39.4	173.4	-173.5	-96.4	0	0	0	111.9	M996 S997 I998 R1003 L1004 K1005	M996-Y1001 HydrophobicContact CE-CD2 3.93Å; S997-Y1001 PolarHBondContact O-N 3.27Å; I998-Y1001 PolarHBondContact O-N 3.24Å; Y1001-R1003 VanDerWaalsContact C-N 3.29Å; Y1001-R1003 PolarHBondContact O-N 2.92Å; Y1001-L1004 PolarHBondContact O-N 2.89Å; Y1001-K1005 HydrophobicContact CE1-CD 3.8Å; Y1001-K1005 PolarHBondContact O-N 2.69Å; Y1001-K1005 VanDerWaalsContact OH-CE 3.26Å; Y1001-K1005 WeakPolarHBondContact OH-CE 3.49Å; Y1001-K1005 PolarHBondContact OH-NZ 3.29Å; Y1001-K1005 VanDerWaalsContact OH-NZ 3.16Å
1002	K	58.9	Low	41.7	Very low	110 Å²	110	137.4 Å²	137.4	48%	0.478	66%	0.662	S	S	.	*	H	α-helix	trans	-65.9	-26.1	171.9	-71.9	167.2	-176.9	169.8	0	113.4	I998 E999 E1000	I998-K1002 HydrophobicContact CG2-CD 4.21Å; I998-K1002 WeakPolarHBondContact O-CB 3.38Å; I998-K1002 VanDerWaalsContact O-CG 3.26Å; I998-K1002 WeakPolarHBondContact O-CG 3.37Å; I998-K1002 PolarHBondContact O-N 3.12Å; E999-K1002 PolarHBondContact O-N 3.34Å; E999-K1002 WeakPolarHBondContact OE1-CD 3.36Å; E999-K1002 IonicContact OE1-NZ 2.68Å; E999-K1002 PolarHBondContact OE1-NZ 2.82Å; E1000-K1002 PolarHBondContact O-N 3.46Å
1003	R	53.2	Low	41.7	Very low	190 Å²	190	137.4 Å²	137.4	72%	0.717	66%	0.663	S	S	*	*	H	α-helix	trans	-82.6	-42.2	173.6	-74.5	175.4	178.9	-162.1	-0.8	112	E999 E1000 Y1001 K1005 R1006	E999-R1003 WeakPolarHBondContact O-CB 3.27Å; E999-R1003 WeakPolarHBondContact O-CG 3.08Å; E999-R1003 PolarHBondContact O-N 2.94Å; E1000-R1003 CarbonylContact O-C 3.46Å; E1000-R1003 PolarHBondContact O-N 2.76Å; E1000-R1003 VanDerWaalsContact O-N 3.14Å; Y1001-R1003 VanDerWaalsContact C-N 3.29Å; Y1001-R1003 PolarHBondContact O-N 2.92Å; R1003-K1005 VanDerWaalsContact C-N 3.34Å; R1003-K1005 PolarHBondContact O-N 3.45Å; R1003-R1006 WeakPolarHBondContact O-CB 3.31Å; R1003-R1006 PolarHBondContact O-N 2.72Å
1004	L	45.8	Very low	41.9	Very low	115 Å²	115	135.4 Å²	135.4	60%	0.602	65%	0.654	S	S	*	*	H	α-helix	trans	-65.3	-35.7	177.8	-124.4	73.9	0	0	0	112.1	M996 E1000 Y1001 R1006	M996-L1004 HydrophobicContact CE-CD2 4.1Å; M996-L1004 HydrophobicContact SD-CD2 4.08Å; E1000-L1004 WeakPolarHBondContact O-CB 3.34Å; E1000-L1004 PolarHBondContact O-N 3.26Å; Y1001-L1004 PolarHBondContact O-N 2.89Å; L1004-R1006 PolarHBondContact O-N 3.11Å
1005	K	47.3	Very low	41.9	Very low	156 Å²	156	131.6 Å²	131.6	68%	0.678	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-1.5	171.5	-96.1	-173.2	168.5	176.9	0	115.1	Y1001 R1003	Y1001-K1005 HydrophobicContact CE1-CD 3.8Å; Y1001-K1005 PolarHBondContact O-N 2.69Å; Y1001-K1005 VanDerWaalsContact OH-CE 3.26Å; Y1001-K1005 WeakPolarHBondContact OH-CE 3.49Å; Y1001-K1005 PolarHBondContact OH-NZ 3.29Å; Y1001-K1005 VanDerWaalsContact OH-NZ 3.16Å; R1003-K1005 VanDerWaalsContact C-N 3.34Å; R1003-K1005 PolarHBondContact O-N 3.45Å
1006	R	44.4	Very low	41.9	Very low	207 Å²	207	128.7 Å²	128.7	78%	0.781	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-2.8	-179.2	-156.2	172.8	-65.8	-158.7	-5.3	113.2	R1003 L1004	R1003-R1006 WeakPolarHBondContact O-CB 3.31Å; R1003-R1006 PolarHBondContact O-N 2.72Å; L1004-R1006 PolarHBondContact O-N 3.11Å
1007	C	32.5	Very low	41.6	Very low	87 Å²	87	131 Å²	131	59%	0.588	65%	0.65	S	S	*	*	S	Bend	trans	-137	150.9	177.9	-63.1	0	0	0	0	109.8
1008	T	33.1	Very low	40.8	Very low	130 Å²	130	132.7 Å²	132.7	80%	0.798	67%	0.666	S	S	*	*			trans	66.9	135.3	172.8	68.6	0	0	0	0	118.3
1009	F	33.4	Very low	40.1	Very low	181 Å²	181	133.7 Å²	133.7	79%	0.794	67%	0.673	S	S	*	*			cis	-165.5	143	-23.9	-146.9	-103.9	0	0	0	108.4
1010	E	31.4	Very low	38.9	Very low	173 Å²	173	133.6 Å²	133.6	81%	0.808	68%	0.684	S	S	*	*	S	Bend	trans	-105.6	152.2	163.8	-87.9	-69.7	126.8	0	0	109.8
1011	P	34.8	Very low	37.6	Very low	108 Å²	108	133.4 Å²	133.4	70%	0.701	70%	0.699	S	S	*	*			trans	-100.2	130.6	-142.9	35.4	-36	0	0	0	117.6
1012	G	33.8	Very low	37.1	Very low	60 Å²	60	132.4 Å²	132.4	62%	0.619	72%	0.717	S	S	*	*				74.5	108.4	114.4	0	0	0	0	0	121
1013	K	34.3	Very low	35.9	Very low	199 Å²	199	130.7 Å²	130.7	87%	0.865	73%	0.73	S	S	*	*			trans	-179.4	115.2	132.3	-95.5	156.2	-176.8	-178.3	0	107.7
1014	S	33.3	Very low	34.9	Very low	94 Å²	94	128.9 Å²	128.9	66%	0.657	74%	0.735	S	S	*	*				58.4	125.8	83.3	72.2	0	0	0	0	112.7
1015	E	33.9	Very low	34.1	Very low	151 Å²	151	127.8 Å²	127.8	71%	0.706	74%	0.736	S	S	*	*			cis	-165.2	162.6	17.9	-130.6	-177.9	119.5	0	0	112.5
1016	Q	32.5	Very low	33.3	Very low	151 Å²	151	131.3 Å²	131.3	71%	0.706	75%	0.745	S	S	*	*			trans	55.5	148.3	156.7	-62.1	-174.4	33.9	0	0	118.7
1017	L	33.1	Very low	32.8	Very low	142 Å²	142	129.4 Å²	129.4	74%	0.743	75%	0.749	S	S	*	*			cis	-179	140.3	-12.9	-109.9	168.2	0	0	0	104.9
1018	A	30.8	Very low	32.6	Very low	86 Å²	86	130.2 Å²	130.2	71%	0.711	75%	0.748	S	S	*	*			trans	65.4	153.4	146.7	0	0	0	0	0	118.8
1019	D	33.4	Very low	32.6	Very low	142 Å²	142	134 Å²	134	76%	0.759	75%	0.747	S	S	*	*			cis	-153.3	167.8	28.1	-146.6	-45.8	0	0	0	113.2
1020	S	33	Very low	32.4	Very low	100 Å²	100	129.1 Å²	129.1	70%	0.699	74%	0.736	S	S	*	*			trans	31.9	151.8	152.5	25.8	0	0	0	0	123.7
1021	A	33.3	Very low	32.6	Very low	92 Å²	92	129.5 Å²	129.5	76%	0.76	74%	0.738	S	S	*	*			cis	-173.4	167.5	-12.9	0	0	0	0	0	112.7
1022	A	32.7	Very low	32.4	Very low	107 Å²	107	131.5 Å²	131.5	88%	0.884	74%	0.742	S	S	*	*			trans	72.5	155.3	149.7	0	0	0	0	0	121.8
1023	G	34.7	Very low	32.6	Very low	74 Å²	74	134.3 Å²	134.3	76%	0.763	75%	0.749	S	S	*	*			trans	89	87.9	175.5	0	0	0	0	0	114.1
1024	D	32.3	Very low	32.4	Very low	151 Å²	151	129.8 Å²	129.8	81%	0.807	74%	0.738	S	S	*	*			cis	87.6	138.2	35.3	-164.3	30.5	0	0	0	115.8
1025	C	28.1	Very low	32.5	Very low	93 Å²	93	133 Å²	133	63%	0.628	75%	0.747	S	S	*	*			trans	54.5	119.4	175.2	-75.7	0	0	0	0	118.7
1026	R	30.1	Very low	32.5	Very low	229 Å²	229	133.3 Å²	133.3	86%	0.864	75%	0.749	S	S	*	*				84.9	155.8	61.2	-83.4	-171.9	168.6	-154	-0	114.4
1027	L	33.3	Very low	32.7	Very low	167 Å²	167	131.9 Å²	131.9	87%	0.874	75%	0.75	S	S	*	*			trans	90.3	152	172.2	-53.1	172	0	0	0	116.6
1028	D	30.1	Very low	32.8	Very low	105 Å²	105	136.2 Å²	136.2	56%	0.561	76%	0.757	S	S	*	*			cis	-170.1	150.7	-38.6	-166.8	22.7	0	0	0	109.1
1029	R	31.7	Very low	33.3	Very low	208 Å²	208	137.5 Å²	137.5	79%	0.785	76%	0.758	S	S	*	*			trans	56.9	171.6	158.1	-82.4	176.6	168.9	100.9	-7.8	118.4
1030	S	30.3	Very low	33.5	Very low	80 Å²	80	135.9 Å²	135.9	56%	0.559	76%	0.758	S	S	*	*			cis	-160.8	174.8	-27.4	49	0	0	0	0	112.1
1031	E	34.6	Very low	33.5	Very low	180 Å²	180	139 Å²	139	84%	0.841	76%	0.759	S	S	*	*			trans	89.7	126.9	148.5	-80.9	140.8	-111.7	0	0	123.8
1032	L	31.7	Very low	33.3	Very low	150 Å²	150	143.1 Å²	143.1	79%	0.785	76%	0.76	S	S	*	*			trans	-90	160.6	171	-94	155.5	0	0	0	109.9
1033	P	36.3	Very low	33.4	Very low	119 Å²	119	143.3 Å²	143.3	77%	0.773	75%	0.752	S	S	*	*				-145.7	143.5	79.9	25.8	-2.4	0	0	0	115.5
1034	T	31	Very low	33.1	Very low	104 Å²	104	144.8 Å²	144.8	64%	0.638	75%	0.751	S	S	*	*				72.1	111.7	72.3	-51.8	0	0	0	0	116.1
1035	L	34.5	Very low	32.7	Very low	162 Å²	162	143.2 Å²	143.2	85%	0.848	75%	0.75	S	S	*	*			trans	-178.3	160.7	141.7	-93.4	-176.8	0	0	0	109.4
1036	Q	34	Very low	32.7	Very low	157 Å²	157	144.7 Å²	144.7	73%	0.734	76%	0.757	S	S	*	*				-156.1	172	-68.7	-146.3	-170.1	49.2	0	0	110.8
1037	V	37	Very low	32.5	Very low	121 Å²	121	140.7 Å²	140.7	73%	0.733	75%	0.752	S	S	*	*			trans	76.9	130.6	165.7	-172.8	0	0	0	0	118
1038	R	36.7	Very low	32.2	Very low	234 Å²	234	140.8 Å²	140.8	88%	0.883	75%	0.748	S	S	*	*			cis	-154.8	164.8	-27.4	-107.9	-153.1	167.1	149.7	-1.6	110.3
1039	P	40.1	Very low	32.1	Very low	112 Å²	112	139.9 Å²	139.9	73%	0.727	75%	0.75	S	S	*	*			trans	-123.8	177	-159.1	44.4	-34.1	0	0	0	116.7
1040	S	37	Very low	31.9	Very low	109 Å²	109	136.2 Å²	136.2	76%	0.762	75%	0.745	S	S	*	*			trans	-170.9	135.3	156.8	-178.1	0	0	0	0	111.6
1041	F	33.2	Very low	31.9	Very low	165 Å²	165	141 Å²	141	72%	0.724	76%	0.756	S	S	*	*			cis	-153.2	123.4	-15.9	-128.5	-101.3	0	0	0	110
1042	F	30.5	Very low	31.7	Very low	179 Å²	179	137 Å²	137	79%	0.785	75%	0.749	S	S	*	*			trans	58.9	132.7	148.8	-77.9	-108.8	0	0	0	125.5
1043	P	33.7	Very low	31.7	Very low	110 Å²	110	136.8 Å²	136.8	71%	0.714	75%	0.753	S	S	*	*			trans	-123.2	174.1	147.6	40.3	-29.5	0	0	0	114.2
1044	S	28.1	Very low	31.4	Very low	106 Å²	106	134.3 Å²	134.3	74%	0.741	75%	0.749	S	S	*	*			trans	83.2	135.1	155.2	76.5	0	0	0	0	122.8
1045	C	25.7	Very low	31.7	Very low	118 Å²	118	135.1 Å²	135.1	80%	0.797	76%	0.759	S	S	*	*			trans	77.4	161.2	143.8	-69.4	0	0	0	0	123.9
1046	T	27.6	Very low	31.7	Very low	124 Å²	124	134.7 Å²	134.7	76%	0.761	76%	0.756	S	S	*	*			trans	69.8	111.8	166.6	52.7	0	0	0	0	121.7
1047	D	25.7	Very low	31.6	Very low	144 Å²	144	132.8 Å²	132.8	77%	0.77	76%	0.757	S	S	*	*				75.8	136.3	125.2	-74.3	-46.3	0	0	0	126
1048	E	27	Very low	31.4	Very low	170 Å²	170	131.3 Å²	131.3	79%	0.794	75%	0.752	S	S	*	*			trans	63	141	140.2	-69.7	-123.6	102.4	0	0	124.2
1049	S	28.6	Very low	30.9	Very low	85 Å²	85	127.8 Å²	127.8	59%	0.594	75%	0.75	S	S	*	*			trans	83.6	93.8	142	-81.5	0	0	0	0	122.4
1050	L	27.3	Very low	30.4	Very low	131 Å²	131	132.3 Å²	132.3	69%	0.686	76%	0.758	S	S	*	*				87.2	126.4	117	-70.7	169.3	0	0	0	121.2
1051	K	29.9	Very low	29.9	Very low	180 Å²	180	133.4 Å²	133.4	78%	0.783	76%	0.755	S	S	*	*			trans	80.1	140.4	151.1	-61.8	150.8	-172.4	170.2	0	117.1
1052	S	30.5	Very low	29.5	Very low	98 Å²	98	134.2 Å²	134.2	69%	0.685	76%	0.758	S	S	*	*			cis	-173.4	156.1	-9.9	48.3	0	0	0	0	112.6
1053	V	31.8	Very low	29.2	Very low	145 Å²	145	130.5 Å²	130.5	88%	0.879	76%	0.755	S	S	*	*			trans	69.3	140.5	170.2	-163	0	0	0	0	113.5
1054	G	30.6	Very low	28.9	Very low	66 Å²	66	132.1 Å²	132.1	68%	0.68	76%	0.756	S	S	*	*			cis	149.5	144.3	0.6	0	0	0	0	0	108.1
1055	S	36.4	Very low	28.8	Very low	122 Å²	122	135 Å²	135	85%	0.853	76%	0.758	S	S	*	*			cis	-149.3	166.9	16.2	-67	0	0	0	0	112.3
1056	I	33.5	Very low	28.9	Very low	152 Å²	152	137.4 Å²	137.4	78%	0.779	76%	0.758	S	S	*	*			trans	-101	159.7	170.6	-27.4	178.1	0	0	0	109.3
1057	P	33.2	Very low	28.9	Very low	117 Å²	117	139.3 Å²	139.3	76%	0.76	76%	0.758	S	S	*	*				-131.2	128.6	106.6	7.8	13.8	0	0	0	112.5
1058	S	31.8	Very low	29.1	Very low	90 Å²	90	137.1 Å²	137.1	63%	0.629	76%	0.76	S	S	*	*				72.9	100.1	85	-58.6	0	0	0	0	112.6
1059	L	26.9	Very low	29.3	Very low	160 Å²	160	133 Å²	133	84%	0.838	75%	0.754	S	S	*	*				59.9	119.3	78.6	-68.6	175.4	0	0	0	114.6
1060	K	29.5	Very low	29.4	Very low	207 Å²	207	136.7 Å²	136.7	90%	0.9	77%	0.768	S	S	*	*			trans	-148.9	140.3	132.5	-111.6	171.3	-173.5	179.4	0	111.2
1061	L	26.7	Very low	29.5	Very low	133 Å²	133	134 Å²	134	70%	0.696	77%	0.772	S	S	*	*			trans	-90.6	-169.6	171.6	-118.5	74	0	0	0	109.7
1062	F	24.4	Very low	29.7	Very low	182 Å²	182	132.2 Å²	132.2	80%	0.798	77%	0.771	S	S	*	*			trans	78.3	147.9	164.9	-50.7	-75.1	0	0	0	115.5
1063	S	24.1	Very low	29.9	Very low	101 Å²	101	134.5 Å²	134.5	71%	0.706	77%	0.77	S	S	*	*			cis	-164	-168.8	-19.9	-114.1	0	0	0	0	110
1064	L	27.6	Very low	30.2	Very low	144 Å²	144	134.4 Å²	134.4	75%	0.754	77%	0.765	S	S	*	*			trans	-65.1	-171.5	163.3	-80.8	78.5	0	0	0	113
1065	E	26.1	Very low	30.4	Very low	167 Å²	167	136.9 Å²	136.9	78%	0.78	77%	0.767	S	S	*	*			trans	96.1	153.7	167.6	-79.8	63.9	-111.8	0	0	118.5
1066	E	27.4	Very low	30.4	Very low	168 Å²	168	136.2 Å²	136.2	79%	0.785	76%	0.76	S	S	*	*			trans	-99.3	-173.8	-162.6	-60.6	-180	81	0	0	113.7
1067	H	28.9	Very low	30.2	Very low	164 Å²	164	134.8 Å²	134.8	76%	0.759	75%	0.753	S	S	*	*			trans	85	94	163.4	-53.1	-65.1	0	0	0	119.7
1068	A	28.3	Very low	30.2	Very low	98 Å²	98	137.6 Å²	137.6	81%	0.81	75%	0.754	S	S	*	*				62.6	151.1	108.1	0	0	0	0	0	123.2
1069	A	31.4	Very low	30.1	Very low	83 Å²	83	137.6 Å²	137.6	69%	0.686	75%	0.754	S	S	*	*			trans	84.6	121.3	158.9	0	0	0	0	0	119.5
1070	N	30.5	Very low	30.4	Very low	163 Å²	163	138 Å²	138	87%	0.872	75%	0.749	S	S	*	*			trans	56.9	129.5	146.6	-48.3	-14.3	0	0	0	117.6
1071	G	30.9	Very low	30.5	Very low	75 Å²	75	134.2 Å²	134.2	77%	0.773	73%	0.734	S	S	*	*			cis	100.4	148	47.2	0	0	0	0	0	108.7
1072	N	33.1	Very low	30.8	Very low	142 Å²	142	136.6 Å²	136.6	76%	0.759	74%	0.739	S	S	*	*			cis	-157.2	-150.6	-1.9	-161.3	56	0	0	0	107.5
1073	E	34.7	Very low	31.1	Very low	146 Å²	146	131.3 Å²	131.3	68%	0.682	74%	0.736	S	S	*	*			trans	69.5	140	167.4	-31	-61.2	64.6	0	0	116.7
1074	D	37.4	Very low	31.9	Very low	143 Å²	143	132.1 Å²	132.1	77%	0.765	74%	0.739	S	S	*	*			cis	-150.5	167.3	-3.7	-141.3	-21.5	0	0	0	114.8
1075	T	36.1	Very low	31.8	Very low	117 Å²	117	132.6 Å²	132.6	72%	0.718	74%	0.742	S	S	*	*			trans	-110.5	171	-175.3	-28.5	0	0	0	0	111.1
1076	P	34.9	Very low	31.8	Very low	109 Å²	109	128.9 Å²	128.9	71%	0.708	74%	0.74	S	S	*	*				-150.9	176.7	102.9	35.3	-17.3	0	0	0	113.5
1077	L	30	Very low	31.9	Very low	121 Å²	121	129.5 Å²	129.5	63%	0.634	74%	0.742	S	S	*	*			cis	-169	161.4	-26.2	-94.1	166	0	0	0	103.6
1078	F	33	Very low	32.1	Very low	176 Å²	176	127 Å²	127	77%	0.772	74%	0.741	S	S	*	*			cis	-141.8	139.3	24.1	-76.4	-91.4	0	0	0	108.4
1079	S	29.9	Very low	32.4	Very low	91 Å²	91	129.7 Å²	129.7	64%	0.636	74%	0.737	S	S	*	*				67.9	142.4	79.5	-41	0	0	0	0	114.2
1080	K	34.6	Very low	32.6	Very low	168 Å²	168	131.2 Å²	131.2	73%	0.73	74%	0.74	S	S	*	*			cis	-161	121.3	29.9	-160.5	171.3	-176.2	177.7	0	116.2
1081	E	30.4	Very low	32.6	Very low	127 Å²	127	126.4 Å²	126.4	59%	0.593	73%	0.729	S	S	*	*			trans	60.3	142.3	139	-63.4	170.4	-145.8	0	0	126
1082	K	32.6	Very low	32.9	Very low	184 Å²	184	130.8 Å²	130.8	80%	0.8	74%	0.735	S	S	*	*			trans	84.5	122.9	140.5	-78.6	157.4	-177.2	155.9	0	122.1
1083	G	31.3	Very low	32.6	Very low	71 Å²	71	132.4 Å²	132.4	73%	0.732	74%	0.737	S	S	*	*			trans	-94.1	-145.3	152	0	0	0	0	0	111.2
1084	P	41.8	Very low	32.3	Very low	117 Å²	117	132.2 Å²	132.2	76%	0.76	74%	0.74	S	S	*	*			cis	-131.9	-160.6	10.9	44.3	-27.3	0	0	0	114.4
1085	N	25	Very low	31.7	Very low	155 Å²	155	131.4 Å²	131.4	83%	0.829	74%	0.736	S	S	*	*			trans	79	141	163.6	-71	-10	0	0	0	121
1086	A	25	Very low	31.3	Very low	88 Å²	88	132.6 Å²	132.6	73%	0.727	74%	0.737	S	S	*	*			trans	62.7	108.9	148.4	0	0	0	0	0	121.5
1087	E	31.2	Very low	30.9	Very low	181 Å²	181	134.2 Å²	134.2	85%	0.846	74%	0.739	S	S	*	*			trans	55	158.6	130.6	-77.8	-178.7	-163	0	0	121.6
1088	P	32.6	Very low	31	Very low	113 Å²	113	134.7 Å²	134.7	73%	0.734	75%	0.747	S	S	*	*			cis	-131	162.2	14.1	41.5	-25.2	0	0	0	118.2
1089	E	34.8	Very low	30.6	Very low	154 Å²	154	133.3 Å²	133.3	72%	0.72	75%	0.748	S	S	*	*				-12.2	172.9	124.8	-68.7	-61.7	147.7	0	0	119.3
1090	P	35.9	Very low	30.5	Very low	114 Å²	114	140.6 Å²	140.6	74%	0.74	76%	0.761	S	S	*	*			cis	-134.9	-175.9	-12	26.8	-3.7	0	0	0	114.7
1091	G	29.4	Very low	30.1	Very low	63 Å²	63	136.3 Å²	136.3	65%	0.649	77%	0.765	S	S	*	*			trans	106.8	134.3	142.9	0	0	0	0	0	116.9
1092	D	37.2	Very low	29.9	Very low	167 Å²	167	135 Å²	135	89%	0.893	78%	0.776	S	S	*	*			cis	-137.4	151.2	-5.5	-85.8	-38	0	0	0	111.1
1093	E	27	Very low	29.7	Very low	175 Å²	175	134.2 Å²	134.2	82%	0.818	78%	0.779	S	S	*	*			trans	-74.3	164	178.4	-53.2	178.3	110	0	0	112.2
1094	L	27.8	Very low	29.6	Very low	142 Å²	142	135.9 Å²	135.9	74%	0.743	79%	0.787	S	S	*	*				179.4	133.2	105.9	-92.1	165.1	0	0	0	113.5
1095	N	25.8	Very low	29	Very low	126 Å²	126	137 Å²	137	67%	0.674	79%	0.786	S	S	*	*			trans	49.5	94.4	150.2	-66.2	-22.7	0	0	0	120.2
1096	I	26.6	Very low	29.2	Very low	142 Å²	142	140.6 Å²	140.6	73%	0.728	79%	0.788	S	S	*	*				33.5	108.5	97.3	-52.6	164.7	0	0	0	114.8
1097	N	27.8	Very low	29.4	Very low	144 Å²	144	144.6 Å²	144.6	77%	0.77	80%	0.796	S	S	*	*				-154.8	130.3	118	-120.8	-40.1	0	0	0	113.1
1098	V	31.5	Very low	29.2	Very low	131 Å²	131	143.2 Å²	143.2	79%	0.794	80%	0.795	S	S	*	*			trans	-80.4	117.5	163.6	173.7	0	0	0	0	106.9
1099	N	25.8	Very low	29	Very low	147 Å²	147	144.3 Å²	144.3	79%	0.786	80%	0.799	S	S	*	*			trans	-147.1	149.4	162.1	-107	-45.5	0	0	0	113.3
1100	R	26.8	Very low	28.8	Very low	243 Å²	243	145.7 Å²	145.7	92%	0.917	81%	0.807	S	S	*	*			trans	-89.4	145.1	-174.3	-71.4	169.8	164.3	150.1	-8.7	111.3
1101	G	25.4	Very low	28.5	Very low	78 Å²	78	151.2 Å²	151.2	80%	0.804	81%	0.814	S	S	*	*			trans	99.3	115.7	149.3	0	0	0	0	0	116.3
1102	A	26.3	Very low	28.7	Very low	100 Å²	100	153.5 Å²	153.5	83%	0.826	82%	0.817	S	S	*	*	S	Bend	trans	-167.1	50.2	156.9	0	0	0	0	0	112.6
1103	L	29.8	Very low	28.2	Very low	167 Å²	167	153.3 Å²	153.3	87%	0.874	82%	0.815	S	S	*	*			trans	-170.2	41.5	152.7	-108.8	170	0	0	0	113	D1105	L1103-D1105 PolarHBondContact O-N 3.3Å
1104	A	28.1	Very low	28.5	Very low	107 Å²	107	151.5 Å²	151.5	88%	0.884	80%	0.804	S	S	*	*			trans	-84.1	91.1	159	0	0	0	0	0	107.4
1105	D	29.2	Very low	28.6	Very low	139 Å²	139	148.6 Å²	148.6	74%	0.743	81%	0.809	S	S	*	*			trans	-158.4	150.3	167.9	-137.7	-27.2	0	0	0	111.4	L1103	L1103-D1105 PolarHBondContact O-N 3.3Å
1106	R	29.1	Very low	28.9	Very low	232 Å²	232	148.8 Å²	148.8	88%	0.875	81%	0.814	S	S	*	*	S	Bend	trans	68.5	26.1	177.5	-43.7	-169.5	71.3	147.9	6.6	118.9
1107	L	28.7	Very low	29	Very low	172 Å²	172	150.9 Å²	150.9	90%	0.901	82%	0.821	S	S	*	*			trans	-121.8	46.2	165.2	-88.3	177.6	0	0	0	113.4
1108	D	26.9	Very low	29.1	Very low	152 Å²	152	150.3 Å²	150.3	81%	0.813	83%	0.827	S	S	*	*			trans	-140.5	86.2	173.1	-111.6	-41.8	0	0	0	112.9
1109	V	29.8	Very low	29.1	Very low	135 Å²	135	152.3 Å²	152.3	82%	0.818	83%	0.825	S	S	*	*	S	Bend	trans	-145.1	111.1	165	177.7	0	0	0	0	109.6
1110	M	30	Very low	29.3	Very low	183 Å²	183	154.8 Å²	154.8	90%	0.901	83%	0.832	S	S	*	*			trans	73.1	72.1	170	-58.6	-160.7	-48.8	0	0	119.9
1111	R	29.2	Very low	29.7	Very low	231 Å²	231	151.4 Å²	151.4	87%	0.872	83%	0.826	S	S	*	*			trans	-149.1	141.6	131.3	-163.1	179.5	-65	177.9	1.9	107.1
1112	P	33.2	Very low	29.9	Very low	110 Å²	110	155.8 Å²	155.8	71%	0.714	83%	0.826	S	S	*	*			cis	-116	160.8	9.2	39.8	-28.5	0	0	0	115.5
1113	L	26.9	Very low	30.2	Very low	163 Å²	163	155.7 Å²	155.7	85%	0.853	83%	0.825	S	S	*	*			trans	-129.7	155.9	149.4	-78.7	174.3	0	0	0	107.8
1114	F	34.3	Very low	30.4	Very low	137 Å²	137	155.1 Å²	155.1	60%	0.601	82%	0.818	S	S	*	*			trans	76	58.8	-167.4	-54.1	-66.7	0	0	0	116.2
1115	G	28.6	Very low	30.4	Very low	81 Å²	81	157.3 Å²	157.3	84%	0.835	81%	0.814	S	S	*	*			trans	-77.6	117.2	141	0	0	0	0	0	109.3
1116	V	32.8	Very low	31	Very low	130 Å²	130	156 Å²	156	79%	0.788	81%	0.814	S	S	*	*			trans	-130.9	125.7	164.1	178.2	0	0	0	0	106.7
1117	Q	29.3	Very low	31.6	Very low	187 Å²	187	151.1 Å²	151.1	87%	0.874	81%	0.812	S	S	*	*			trans	-75.1	137.5	-168.4	-63.1	160.4	-51.6	0	0	111.9
1118	C	29	Very low	31.7	Very low	131 Å²	131	150.7 Å²	150.7	89%	0.885	81%	0.805	S	S	*	*			trans	-123.8	138.4	144.1	-78.3	0	0	0	0	106.6
1119	K	32.3	Very low	31.8	Very low	173 Å²	173	151.2 Å²	151.2	75%	0.752	80%	0.802	S	S	*	*			trans	-85.7	135.8	-174.2	-65.3	178.9	171.7	-170.2	0	110.7
1120	E	28.7	Very low	31.8	Very low	200 Å²	200	148.5 Å²	148.5	94%	0.935	80%	0.795	S	S	*	*			trans	-99.9	128.6	149.8	-65	178.6	137.2	0	0	106.5
1121	E	35.2	Very low	31.8	Very low	171 Å²	171	147.1 Å²	147.1	80%	0.799	79%	0.786	S	S	*	*			trans	-113.7	126.7	168.7	-83.4	-174.1	94.6	0	0	108.6
1122	E	30.7	Very low	31.9	Very low	171 Å²	171	146.9 Å²	146.9	80%	0.799	79%	0.785	S	S	*	*			trans	-117.8	110.6	-172	-174.1	-168.2	168.4	0	0	110.3
1123	A	33.4	Very low	31.8	Very low	97 Å²	97	146 Å²	146	80%	0.802	79%	0.787	S	S	*	*			trans	-152	96.8	169.6	0	0	0	0	0	109
1124	Q	32.1	Very low	32.3	Very low	155 Å²	155	143.6 Å²	143.6	72%	0.724	78%	0.781	S	S	*	*				83.8	93.5	71.7	-72.1	-176.9	11.1	0	0	115.4
1125	N	30	Very low	32.5	Very low	153 Å²	153	144.9 Å²	144.9	82%	0.818	79%	0.789	S	S	*	*			trans	62.8	140.2	146.4	-68.3	-51.8	0	0	0	122.3
1126	P	41.6	Very low	32.7	Very low	112 Å²	112	148.6 Å²	148.6	73%	0.727	79%	0.785	S	S	*	*			trans	-99.1	168	176.1	40.2	-35.9	0	0	0	113.5
1127	P	40.2	Very low	32.8	Very low	129 Å²	129	148.4 Å²	148.4	84%	0.838	78%	0.779	S	S	*	*			trans	-108.1	152.2	152.8	35.9	-28	0	0	0	113.4
1128	H	31	Very low	33.2	Very low	163 Å²	163	145 Å²	145	76%	0.755	77%	0.767	S	S	*	*			trans	-72.7	160.4	-170	-154.5	-126.8	0	0	0	115.5
1129	E	29.6	Very low	33.5	Very low	163 Å²	163	147.6 Å²	147.6	76%	0.762	76%	0.763	S	S	*	*			trans	96.9	155.2	134.4	-133.7	162.9	162.4	0	0	123.6
1130	A	29.8	Very low	33.6	Very low	79 Å²	79	145 Å²	145	65%	0.653	76%	0.762	S	S	*	*			trans	83.5	78.6	151.6	0	0	0	0	0	122.7
1131	Q	29.3	Very low	33.7	Very low	153 Å²	153	139.1 Å²	139.1	72%	0.715	75%	0.748	S	S	*	*				70.6	145.3	118.8	-72.2	-173.5	23.4	0	0	124
1132	R	31.5	Very low	33.7	Very low	227 Å²	227	142.1 Å²	142.1	86%	0.857	75%	0.754	S	S	*	*			trans	89.1	122.8	153.3	-69.8	150.3	-166.1	-114.2	3.6	119.8
1133	A	30.5	Very low	33.7	Very low	91 Å²	91	137 Å²	137	75%	0.752	75%	0.747	S	S	*	*			trans	-96.2	-168.2	159.6	0	0	0	0	0	108.7
1134	P	39.3	Very low	34.2	Very low	112 Å²	112	139.1 Å²	139.1	73%	0.727	75%	0.753	S	S	*	*			cis	-138.3	-142.5	4.4	42.2	-20	0	0	0	113.4
1135	Q	37.1	Very low	34.2	Very low	165 Å²	165	135.7 Å²	135.7	77%	0.771	76%	0.759	S	S	*	*			trans	86.8	111.8	176.8	-58.6	-177.2	-3.8	0	0	114.4
1136	Q	34.1	Very low	34.3	Very low	159 Å²	159	133.3 Å²	133.3	74%	0.743	75%	0.754	S	S	*	*				81.4	104.9	64.3	-80.3	-175.7	-25.9	0	0	113.8
1137	N	35	Very low	33.9	Very low	125 Å²	125	138.7 Å²	138.7	67%	0.668	76%	0.762	S	S	*	*				174.1	124	99.6	-91.1	-34.9	0	0	0	116.4
1138	N	37.2	Very low	33.6	Very low	117 Å²	117	142.3 Å²	142.3	63%	0.626	76%	0.76	S	S	*	*				85.2	139.6	125.5	-63	-17.4	0	0	0	125.8
1139	F	35.5	Very low	33.9	Very low	184 Å²	184	140.4 Å²	140.4	81%	0.807	76%	0.762	S	S	*	*			trans	65.9	134.7	158.4	-59.8	-62.2	0	0	0	120.6
1140	T	33.9	Very low	34.1	Very low	118 Å²	118	138.2 Å²	138.2	72%	0.724	76%	0.76	S	S	*	*			cis	-162.2	162.1	-28.8	-119.7	0	0	0	0	111.3
1141	A	31.5	Very low	34.7	Very low	78 Å²	78	138.9 Å²	138.9	65%	0.645	76%	0.757	S	S	*	*			trans	-73.4	170.5	-177.6	0	0	0	0	0	115.6
1142	Y	34.6	Very low	34.9	Very low	233 Å²	233	141.4 Å²	141.4	91%	0.914	77%	0.766	S	S	*	*				-164.5	167.2	109.9	-106.5	-73.6	0	0	0	112.5
1143	G	30.1	Very low	35.1	Very low	65 Å²	65	134.1 Å²	134.1	67%	0.67	76%	0.762	S	S	*	*			trans	-110.5	-166.6	-167.4	0	0	0	0	0	116.6
1144	P	44.3	Very low	35.3	Very low	141 Å²	141	138 Å²	138	92%	0.916	77%	0.771	S	S	*	*			trans	-90.9	166.7	-161.8	36.2	-38	0	0	0	116.1
1145	G	32.7	Very low	35.2	Very low	82 Å²	82	136.1 Å²	136.1	85%	0.845	77%	0.771	S	S	*	*			trans	-159.6	160.3	174	0	0	0	0	0	113.5
1146	S	32	Very low	35.1	Very low	104 Å²	104	136.8 Å²	136.8	73%	0.727	78%	0.778	S	S	*	*			trans	-101.9	164.9	-172.1	52.5	0	0	0	0	114.3
1147	Y	33.4	Very low	35.1	Very low	225 Å²	225	133.1 Å²	133.1	88%	0.882	78%	0.783	S	S	*	*				174.1	159.6	122.3	-108.6	-88.4	0	0	0	113.6
1148	Y	33.2	Very low	35.1	Very low	205 Å²	205	131 Å²	131	80%	0.804	79%	0.791	S	S	*	*			trans	-109	156.7	170.2	-111.3	-77.4	0	0	0	109.4
1149	P	38.2	Very low	35.1	Very low	123 Å²	123	132.9 Å²	132.9	80%	0.799	80%	0.796	S	S	*	*				-156.4	-176.1	95.5	41.2	-21.2	0	0	0	117.1
1150	T	33	Very low	35	Very low	116 Å²	116	133 Å²	133	71%	0.712	80%	0.797	S	S	*	*			trans	-103.4	-156.7	169.8	55.1	0	0	0	0	109.7
1151	P	43.2	Very low	35	Very low	93 Å²	93	130.7 Å²	130.7	60%	0.604	80%	0.796	S	S	*	*			cis	-145.5	-171.5	-2	27.6	1.1	0	0	0	118.4
1152	F	33.4	Very low	35	Very low	206 Å²	206	133 Å²	133	90%	0.904	81%	0.806	S	S	*	*			trans	78.8	140.8	155.2	-65.2	-61.4	0	0	0	124.5
1153	G	35.3	Very low	34.8	Very low	75 Å²	75	131.6 Å²	131.6	77%	0.773	81%	0.805	S	S	*	*			trans	159.8	118.9	161	0	0	0	0	0	116.4
1154	N	35.3	Very low	35.3	Very low	173 Å²	173	133.9 Å²	133.9	93%	0.925	81%	0.808	S	S	*	*			trans	-98.2	165.8	-173.6	-62.9	-21.4	0	0	0	115.1
1155	G	35.4	Very low	34.8	Very low	72 Å²	72	131.3 Å²	131.3	74%	0.742	80%	0.799	S	S	*	*			trans	-177.1	31.4	174.6	0	0	0	0	0	127.1
1156	I	35.1	Very low	35	Very low	178 Å²	178	138.7 Å²	138.7	91%	0.913	80%	0.803	S	S	*	*			trans	51.7	127.7	146.1	-53.8	171.4	0	0	0	123.7
1157	G	35.1	Very low	35.1	Very low	82 Å²	82	141 Å²	141	85%	0.845	81%	0.807	S	S	*	*			trans	87	150.1	150	0	0	0	0	0	118.5
1158	G	34.2	Very low	35.9	Very low	81 Å²	81	135.4 Å²	135.4	84%	0.835	80%	0.799	S	S	*	*			cis	160.5	168.6	-1.9	0	0	0	0	0	109.8
1159	Q	36.9	Very low	36	Very low	156 Å²	156	130.6 Å²	130.6	73%	0.729	80%	0.795	S	S	*	*			cis	-171.3	160.2	-15.9	-173.3	170.9	-37.6	0	0	110.2
1160	F	33.8	Very low	36	Very low	187 Å²	187	135.5 Å²	135.5	82%	0.82	80%	0.799	S	S	*	*			trans	70.2	150.9	179.1	-50.2	-79.5	0	0	0	116.4
1161	G	33.9	Very low	36.2	Very low	70 Å²	70	133.8 Å²	133.8	72%	0.722	80%	0.797	S	S	*	*			cis	173.4	171.1	-1.6	0	0	0	0	0	109.1
1162	C	32.4	Very low	35.9	Very low	126 Å²	126	134.3 Å²	134.3	85%	0.851	81%	0.809	S	S	*	*			cis	-162.4	-164.8	-3.9	-86.8	0	0	0	0	110.8
1163	F	29.5	Very low	36.1	Very low	203 Å²	203	129.3 Å²	129.3	89%	0.89	81%	0.806	S	S	*	*			trans	-132.8	-163.9	-174.7	-96.3	-94.3	0	0	0	110.5
1164	P	42	Very low	36	Very low	113 Å²	113	132.3 Å²	132.3	73%	0.734	81%	0.809	S	S	*	*			cis	-140.1	167.9	-10.5	24.2	1.9	0	0	0	119.6
1165	A	33.6	Very low	36.2	Very low	88 Å²	88	130.1 Å²	130.1	73%	0.727	80%	0.804	S	S	*	*			trans	32.3	148.4	136.4	0	0	0	0	0	127.1
1166	Y	35.9	Very low	36.1	Very low	236 Å²	236	131.8 Å²	131.8	93%	0.925	80%	0.803	S	S	*	*				-164.6	176.1	112.4	-122.7	-97.1	0	0	0	114.5
1167	N	35	Very low	36.2	Very low	153 Å²	153	131.7 Å²	131.7	82%	0.818	80%	0.801	S	S	*	*			trans	-129.1	175.7	-160.7	-117.7	0.3	0	0	0	116
1168	P	49.1	Very low	36.2	Very low	108 Å²	108	135.3 Å²	135.3	70%	0.701	80%	0.8	S	S	*	*			trans	-116.8	-169.5	-157.5	45.5	-39.8	0	0	0	117.2
1169	S	35.9	Very low	36.5	Very low	103 Å²	103	136 Å²	136	72%	0.72	79%	0.79	S	S	*	*			trans	-165.2	138.1	165.4	-85.5	0	0	0	0	117.8
1170	Y	38.7	Very low	36.5	Very low	227 Å²	227	138.4 Å²	138.4	89%	0.89	80%	0.798	S	S	*	*			trans	45.8	160.7	141.1	-70.7	-106.5	0	0	0	123.7
1171	A	37.5	Very low	36.5	Very low	80 Å²	80	132.8 Å²	132.8	66%	0.661	79%	0.794	S	S	*	*			cis	-174.6	148.5	-34.5	0	0	0	0	0	113.6
1172	A	36	Very low	36.7	Very low	103 Å²	103	139.5 Å²	139.5	85%	0.851	80%	0.803	S	S	*	*			trans	49.8	143.4	143.6	0	0	0	0	0	125.5
1173	A	37.3	Very low	37	Very low	102 Å²	102	144.3 Å²	144.3	84%	0.843	81%	0.805	S	S	*	*			trans	130.4	148.7	133.2	0	0	0	0	0	118.7
1174	T	34.1	Very low	37.6	Very low	138 Å²	138	140.1 Å²	140.1	85%	0.847	80%	0.801	S	S	*	*			trans	-104.9	168.4	-173.5	23.6	0	0	0	0	111.4
1175	P	39.5	Very low	37.7	Very low	126 Å²	126	146.2 Å²	146.2	82%	0.818	81%	0.81	S	S	*	*				-153.5	-153.2	59.1	44.2	-19.9	0	0	0	117.2
1176	C	32.7	Very low	38.3	Very low	107 Å²	107	148.7 Å²	148.7	72%	0.723	82%	0.815	S	S	*	*			trans	-94.6	156	-158.6	53.4	0	0	0	0	116.4
1177	M	38	Very low	39.7	Very low	177 Å²	177	142.4 Å²	142.4	87%	0.872	80%	0.803	S	S	*	*				-171.3	169.2	128.7	-100.7	-57	165.7	0	0	112.3
1178	L	34.6	Very low	41.3	Very low	157 Å²	157	140.6 Å²	140.6	82%	0.822	80%	0.8	S	S	*	*			trans	-92.8	-172.2	177.2	-60.8	167.9	0	0	0	110.7
1179	P	41.3	Very low	42.1	Very low	96 Å²	96	141 Å²	141	62%	0.623	80%	0.802	S	S	*	*			cis	-131.2	-164.4	-14.7	16.2	11.2	0	0	0	113.5
1180	F	36.3	Very low	43.9	Very low	206 Å²	206	141.6 Å²	141.6	90%	0.904	80%	0.804	S	S	*	*			trans	77.5	140.7	168.5	-59.2	-75.2	0	0	0	116.3
1181	G	34.4	Very low	45.6	Very low	70 Å²	70	136.4 Å²	136.4	72%	0.722	80%	0.798	S	S	*	*			trans	-129.7	163.6	-169.3	0	0	0	0	0	113.4
1182	F	37.7	Very low	47	Very low	211 Å²	211	138.1 Å²	138.1	93%	0.925	80%	0.802	S	S	*	*			trans	-134.6	156.7	163	-98.2	-84.3	0	0	0	110	S1184	F1182-S1184 PolarHBondContact O-N 3.07Å
1183	Y	37.5	Very low	48.6	Very low	226 Å²	226	138.8 Å²	138.8	89%	0.886	80%	0.798	S	S	*	*			trans	-66.7	126.8	-179	-74.7	-110.7	0	0	0	111.3
1184	S	42.9	Very low	50.2	Low	116 Å²	116	139.5 Å²	139.5	81%	0.811	79%	0.794	S	S	*	*			trans	-157.2	125.9	152.6	-91.3	0	0	0	0	114.9	F1182	F1182-S1184 PolarHBondContact O-N 3.07Å
1185	R	44.2	Very low	51.7	Low	241 Å²	241	138.6 Å²	138.6	91%	0.909	79%	0.79	S	S	*	*			trans	14.2	111	152.6	-57.9	180	-178.1	-171.5	-0.1	118
1186	V	45.3	Very low	52.8	Low	139 Å²	139	138.6 Å²	138.6	84%	0.842	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-64.2	134	156.7	-177.8	0	0	0	0	109
1187	P	66.1	Low	53.5	Low	104 Å²	104	138.2 Å²	138.2	68%	0.675	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-70.5	152.6	175.5	29.6	-35.2	0	0	0	112
1188	P	69	Low	53.8	Low	116 Å²	116	136.6 Å²	136.6	75%	0.753	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-68.8	148.8	173	30.6	-34.7	0	0	0	111.2
1189	P	65.2	Low	54.4	Low	115 Å²	115	136.5 Å²	136.5	75%	0.747	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-67.4	153.1	172.6	30.1	-35.1	0	0	0	111.4
1190	P	73.2	Confident	54.5	Low	117 Å²	117	137.3 Å²	137.3	76%	0.76	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-66.8	151.8	177.2	28.7	-35.2	0	0	0	112.1
1191	P	74.3	Confident	54.7	Low	117 Å²	117	133.7 Å²	133.7	76%	0.76	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-72.2	151.5	177	31	-35.3	0	0	0	112.1
1192	P	67.9	Low	55.1	Low	116 Å²	116	135.4 Å²	135.4	75%	0.753	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-69.7	153.1	175	30.3	-35.4	0	0	0	112.1
1193	P	69.8	Low	55	Low	118 Å²	118	130.7 Å²	130.7	77%	0.766	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-68.7	150.7	178.7	29	-35.3	0	0	0	112.5
1194	P	70.8	Confident	54.9	Low	117 Å²	117	127.5 Å²	127.5	76%	0.76	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-73.1	152.9	179.9	30.9	-35.7	0	0	0	112.6
1195	P	64.3	Low	54.6	Low	118 Å²	118	128.3 Å²	128.3	77%	0.766	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-68.7	150	173.7	29.9	-35.2	0	0	0	111.8
1196	P	62.9	Low	54.1	Low	126 Å²	126	119.7 Å²	119.7	82%	0.818	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-66	139.6	179.6	27.4	-34.6	0	0	0	112.1
1197	A	48.3	Very low	53.5	Low	100 Å²	100	119.3 Å²	119.3	83%	0.826	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-73.6	136.6	-173.1	0	0	0	0	0	113.3
1198	T	44.1	Very low	52	Low	142 Å²	142	120.8 Å²	120.8	87%	0.871	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-78	133.3	173.4	-39.7	0	0	0	0	110.9
1199	L	46.4	Very low	50.4	Low	156 Å²	156	121.7 Å²	121.7	82%	0.817	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-71.3	151.9	177.3	-72.8	170.8	0	0	0	112.4
1200	P	44.5	Very low	49	Very low	112 Å²	112	121.9 Å²	121.9	73%	0.727	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-76.4	153.9	-172.5	31.2	-36.6	0	0	0	113.6
1201	P	40.7	Very low	47.2	Very low	130 Å²	130	121.8 Å²	121.8	84%	0.844	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-79.9	134.5	178.2	32.2	-34.1	0	0	0	112.3
1202	A	41.3	Very low	45.1	Very low	106 Å²	106	122 Å²	122	88%	0.876	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-78.8	141.5	167.7	0	0	0	0	0	111.1
1203	S	35.7	Very low	43.3	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	79%	0.792	S	S	*	*			trans	-107.3	140.9	173.3	-178.6	0	0	0	0	110
1204	I	36	Very low	41.4	Very low	159 Å²	159	128.2 Å²	128.2	82%	0.815	80%	0.797	S	S	*	*			trans	-167.3	145.1	143.2	-102.7	151.2	0	0	0	111.4
1205	V	36.8	Very low	39.3	Very low	133 Å²	133	129.5 Å²	129.5	81%	0.806	80%	0.795	S	S	*	*			trans	-14.1	140.3	163.4	-168.8	0	0	0	0	117.3
1206	G	32.9	Very low	37.7	Very low	61 Å²	61	129.8 Å²	129.8	63%	0.629	79%	0.786	S	S	*	*			cis	127.4	107.1	-5.1	0	0	0	0	0	114.7
1207	T	34.2	Very low	36.2	Very low	130 Å²	130	129.4 Å²	129.4	80%	0.798	78%	0.783	S	S	*	*			trans	-148.3	122.6	174.7	16.4	0	0	0	0	113.8
1208	T	33.5	Very low	35.4	Very low	136 Å²	136	129.1 Å²	129.1	83%	0.834	78%	0.781	S	S	*	*			trans	41.2	115.4	147.4	55	0	0	0	0	121.4
1209	V	35.8	Very low	34.8	Very low	135 Å²	135	129 Å²	129	82%	0.818	78%	0.779	S	S	*	*			trans	-105	150.7	164.6	176	0	0	0	0	110
1210	P	36	Very low	34.3	Very low	119 Å²	119	127.5 Å²	127.5	77%	0.773	78%	0.776	S	S	*	*			trans	-123.3	151.2	134.9	0.1	21.2	0	0	0	113.5
1211	P	34.2	Very low	33.9	Very low	115 Å²	115	127.8 Å²	127.8	75%	0.747	78%	0.778	S	S	*	*			trans	-100.9	-156.1	-176.9	41.7	-36.9	0	0	0	113
1212	V	30.3	Very low	33.4	Very low	121 Å²	121	125.6 Å²	125.6	73%	0.733	77%	0.771	S	S	*	*			trans	105.1	135.7	171.5	178.3	0	0	0	0	113.9
1213	Q	31.1	Very low	33	Very low	177 Å²	177	127.4 Å²	127.4	83%	0.827	77%	0.771	S	S	*	*			cis	-165.3	170	-26.3	-108.1	165.1	9.2	0	0	107.9
1214	H	29.4	Very low	32.9	Very low	187 Å²	187	127.9 Å²	127.9	87%	0.866	77%	0.769	S	S	*	*			trans	-70.7	150.1	169.7	-75.8	-86.9	0	0	0	113.3
1215	M	27.7	Very low	33	Very low	144 Å²	144	125.9 Å²	125.9	71%	0.709	77%	0.766	S	S	*	*			trans	164.9	156.6	147	-83.7	-97	-175.3	0	0	108.5	R316	R316-M1215 PolarHBondContact NH2-SD 3.08Å
1216	H	30.5	Very low	33.2	Very low	125 Å²	125	125.8 Å²	125.8	58%	0.579	77%	0.768	S	S	*	*			cis	-162.5	141.9	-29.8	-149.2	-93.1	0	0	0	108	R316	R316-H1216 PolarHBondContact NE-NE2 3.41Å; R316-H1216 PolarHBondContact NH2-CD2 3.41Å; R316-H1216 PolarHBondContact NH2-NE2 3.18Å
1217	P	29.8	Very low	33.3	Very low	118 Å²	118	125.9 Å²	125.9	77%	0.766	77%	0.77	S	S	*	*			trans	-102.1	121.7	-175.5	35.3	-31	0	0	0	115.4
1218	A	31.9	Very low	33.1	Very low	94 Å²	94	131 Å²	131	78%	0.777	78%	0.776	S	S	*	*			trans	-167.5	166.8	162.6	0	0	0	0	0	107.9
1219	V	32.7	Very low	33.2	Very low	138 Å²	138	132.6 Å²	132.6	84%	0.836	78%	0.777	S	S	*	*			cis	-141	165.1	15.4	177.9	0	0	0	0	109.2
1220	V	35.2	Very low	33.1	Very low	125 Å²	125	129.1 Å²	129.1	76%	0.758	77%	0.769	S	S	*	*			trans	-117.5	146.1	177.9	177.2	0	0	0	0	111.7
1221	P	36.3	Very low	33	Very low	119 Å²	119	131 Å²	131	77%	0.773	77%	0.772	S	S	*	*			trans	-127.4	143.3	133.3	35.2	-25.8	0	0	0	111.2
1222	A	30.9	Very low	33	Very low	84 Å²	84	133.3 Å²	133.3	69%	0.694	78%	0.778	S	S	*	*			cis	111.2	156.1	20.3	0	0	0	0	0	112.5
1223	V	31.6	Very low	33.3	Very low	143 Å²	143	134.2 Å²	134.2	87%	0.867	78%	0.779	S	S	*	*			trans	84	138.7	179.1	-176.4	0	0	0	0	115.5
1224	V	34.5	Very low	33.1	Very low	123 Å²	123	136 Å²	136	75%	0.745	78%	0.779	S	S	*	*			cis	-158.1	148	-27.3	135.8	0	0	0	0	108.1
1225	P	38.4	Very low	33.1	Very low	117 Å²	117	134.7 Å²	134.7	76%	0.76	78%	0.778	S	S	*	*			trans	-127.2	152.3	172.7	40	-28.3	0	0	0	116.8
1226	P	40.9	Very low	33.3	Very low	130 Å²	130	133.7 Å²	133.7	84%	0.844	78%	0.779	S	S	*	*			trans	-112.5	164.5	155.9	38.2	-29.1	0	0	0	112.5
1227	G	33.7	Very low	33.3	Very low	64 Å²	64	134.9 Å²	134.9	66%	0.66	79%	0.787	S	S	*	*			cis	156	105.5	-14.3	0	0	0	0	0	115.3
1228	Y	31.1	Very low	33.3	Very low	238 Å²	238	138 Å²	138	93%	0.933	79%	0.789	S	S	*	*			trans	59.2	163.1	169.4	-71.5	-100.2	0	0	0	116.1
1229	I	35.3	Very low	33.2	Very low	168 Å²	168	138.9 Å²	138.9	86%	0.862	79%	0.79	S	S	*	*			cis	-140.3	158.7	17.6	-61.7	166.7	0	0	0	106.7
1230	G	34	Very low	33.3	Very low	62 Å²	62	135.4 Å²	135.4	64%	0.639	78%	0.781	S	S	*	*			cis	178.8	178.9	1.1	0	0	0	0	0	110.6
1231	N	33.7	Very low	33.2	Very low	158 Å²	158	136.1 Å²	136.1	85%	0.845	79%	0.786	S	S	*	*			trans	-93.1	161.6	-169.2	-51.1	-60.8	0	0	0	115.1
1232	L	35.1	Very low	33	Very low	164 Å²	164	135.6 Å²	135.6	86%	0.859	79%	0.792	S	S	*	*			trans	168.4	151.5	134.5	-108.9	74.8	0	0	0	108.7
1233	D	35.1	Very low	33.1	Very low	141 Å²	141	136.7 Å²	136.7	75%	0.754	80%	0.801	S	S	*	*			cis	-158.7	175.1	-40.2	-136.1	-43.5	0	0	0	111.2
1234	Y	28	Very low	33.2	Very low	215 Å²	215	134.5 Å²	134.5	84%	0.843	80%	0.798	S	S	*	*			trans	-88.7	136.6	175.6	-94.8	-110.8	0	0	0	113.4
1235	L	29.2	Very low	33.1	Very low	159 Å²	159	133.4 Å²	133.4	83%	0.832	80%	0.801	S	S	*	*				178	-179.2	123.1	-125.9	69.4	0	0	0	114.9
1236	V	32.2	Very low	32.9	Very low	122 Å²	122	133.4 Å²	133.4	74%	0.739	80%	0.799	S	S	*	*			trans	72.7	117.8	171.4	-164.8	0	0	0	0	114.9
1237	M	29.8	Very low	32.6	Very low	151 Å²	151	133.2 Å²	133.2	74%	0.744	80%	0.796	S	S	*	*			cis	82.4	99.1	14.1	-67.2	-83.5	-77.9	0	0	118.3
1238	F	30.2	Very low	32.6	Very low	183 Å²	183	134.4 Å²	134.4	80%	0.803	80%	0.8	S	S	*	*			trans	67.9	152.7	171.1	-68.4	-96.6	0	0	0	115
1239	S	30.1	Very low	32.5	Very low	113 Å²	113	129.6 Å²	129.6	79%	0.79	80%	0.795	S	S	*	*			cis	-164.3	158.8	-2.7	39.6	0	0	0	0	112.3
1240	G	33.5	Very low	32.5	Very low	64 Å²	64	125.8 Å²	125.8	66%	0.66	79%	0.789	S	S	*	*			trans	92	179	160.2	0	0	0	0	0	117
1241	T	33.5	Very low	32.3	Very low	141 Å²	141	130.6 Å²	130.6	87%	0.865	80%	0.799	S	S	*	*				-173.6	116.5	-84.7	31.8	0	0	0	0	111.1
1242	A	32.4	Very low	32.3	Very low	108 Å²	108	127.8 Å²	127.8	89%	0.893	80%	0.798	S	S	*	*			trans	60.5	121.6	148.4	0	0	0	0	0	122.8
1243	A	33.8	Very low	32.3	Very low	106 Å²	106	124.5 Å²	124.5	88%	0.876	79%	0.794	S	S	*	*			trans	-150.6	163.5	143.2	0	0	0	0	0	108.7
1244	A	32.2	Very low	32.3	Very low	98 Å²	98	122.4 Å²	122.4	81%	0.81	80%	0.796	S	S	*	*			trans	-159.1	167.4	-174.6	0	0	0	0	0	114.4
1245	A	32.8	Very low	32.6	Very low	99 Å²	99	118.4 Å²	118.4	82%	0.818	79%	0.789	S	S	*	*			trans	73.4	158.8	-179.5	0	0	0	0	0	114.3
1246	T	34.7	Very low	32.9	Very low	117 Å²	117	118.8 Å²	118.8	72%	0.718	79%	0.787	S	S	*	*			cis	-146	153.7	22.9	46.3	0	0	0	0	114.6
1247	T	33.9	Very low	33	Very low	127 Å²	127	117.5 Å²	117.5	78%	0.779	79%	0.789	S	S	*	*			trans	57.7	137.5	152.4	48	0	0	0	0	120
1248	A	33.3	Very low	33	Very low	89 Å²	89	115.5 Å²	115.5	74%	0.736	80%	0.797	S	S	*	*			cis	75.9	141.1	40.5	0	0	0	0	0	113.5
1249	V	28.8	Very low	33.1	Very low	136 Å²	136	110.1 Å²	110.1	82%	0.824	79%	0.792	S	S	*	*			cis	-161.3	167.1	1.2	104	0	0	0	0	111.2
1250	A	36.5	Very low	33.2	Very low	89 Å²	89	112.5 Å²	112.5	74%	0.736	79%	0.791	S	S	*	*			trans	130.9	126.1	163	0	0	0	0	0	111.3
1251	L	29.2	Very low	33.2	Very low	162 Å²	162	116.9 Å²	116.9	85%	0.848	79%	0.792	S	S	*	*			cis	86	93.5	14	-65.2	175.8	0	0	0	119.6
1252	A	33	Very low	33.2	Very low	100 Å²	100	119 Å²	119	83%	0.826	79%	0.792	S	S	*	*				74.8	119.3	118.9	0	0	0	0	0	123.4
1253	A	36.1	Very low	33.5	Very low	95 Å²	95	118.1 Å²	118.1	79%	0.785	79%	0.785	S	S	*	*			trans	-153.3	142.6	138.2	0	0	0	0	0	106.8
1254	A	34.6	Very low	33.7	Very low	96 Å²	96	118.2 Å²	118.2	79%	0.793	78%	0.777	S	S	*	*			cis	79.1	131.6	33.4	0	0	0	0	0	113.7
1255	D	35.6	Very low	33.7	Very low	131 Å²	131	119.1 Å²	119.1	70%	0.701	77%	0.772	S	S	*	*			cis	-166.6	165.4	-13.4	-166.8	17	0	0	0	111.6
1256	Q	33.9	Very low	33.7	Very low	168 Å²	168	122.4 Å²	122.4	79%	0.785	77%	0.774	S	S	*	*			trans	64.8	166.5	150	-95.1	178.2	84.6	0	0	124.1
1257	A	34.1	Very low	33.5	Very low	94 Å²	94	120.1 Å²	120.1	78%	0.777	77%	0.774	S	S	*	*			trans	62.1	114.7	173.2	0	0	0	0	0	117.7
1258	A	31.2	Very low	33.5	Very low	110 Å²	110	119.4 Å²	119.4	91%	0.909	77%	0.774	S	S	*	*			cis	95.3	117.5	21.7	0	0	0	0	0	116.6
1259	G	31.7	Very low	33.5	Very low	69 Å²	69	120.4 Å²	120.4	71%	0.711	77%	0.771	S	S	*	*			trans	120.7	108	146.8	0	0	0	0	0	119.6
1260	Q	33.1	Very low	33.8	Very low	164 Å²	164	120.9 Å²	120.9	77%	0.766	76%	0.764	S	S	*	*			trans	65.5	153.9	145.1	-57.1	-166.5	39.3	0	0	118
1261	K	33.8	Very low	33.6	Very low	155 Å²	155	126.6 Å²	126.6	67%	0.674	77%	0.767	S	S	*	*			cis	-161.3	171.8	-11.2	-122.6	177.1	-169.9	152.9	0	110.5
1262	Q	32.9	Very low	34.3	Very low	185 Å²	185	124.1 Å²	124.1	86%	0.864	76%	0.761	S	S	*	*			trans	74.3	151.8	156.4	-74.2	164.2	-9.4	0	0	119.1
1263	A	37.7	Very low	34.8	Very low	91 Å²	91	124.3 Å²	124.3	75%	0.752	75%	0.753	S	S	*	*			trans	-110.3	-165.8	178.1	0	0	0	0	0	108.8
1264	P	38.5	Very low	34.6	Very low	107 Å²	107	129.7 Å²	129.7	70%	0.695	75%	0.753	S	S	*	*				-155.4	152.3	51.6	43.7	-21.7	0	0	0	119.9
1265	T	32.7	Very low	34.6	Very low	118 Å²	118	133.8 Å²	133.8	72%	0.724	75%	0.748	S	S	*	*			trans	52.4	154.8	136.2	63.4	0	0	0	0	125
1266	I	31.4	Very low	34.6	Very low	167 Å²	167	135.8 Å²	135.8	86%	0.856	75%	0.751	S	S	*	*			trans	73.8	133.4	168.1	-41.7	-177.7	0	0	0	112.6
1267	G	30.7	Very low	34.6	Very low	70 Å²	70	130.7 Å²	130.7	72%	0.722	74%	0.743	S	S	*	*			cis	119.5	147.7	17.5	0	0	0	0	0	109.3
1268	S	35.5	Very low	34.7	Very low	111 Å²	111	131.7 Å²	131.7	78%	0.776	74%	0.744	S	S	*	*			cis	-169.4	-178.1	1.1	-171.9	0	0	0	0	110.8
1269	V	33.3	Very low	35	Very low	110 Å²	110	134.6 Å²	134.6	67%	0.667	74%	0.739	S	S	*	*			trans	68.2	140.2	159.1	-107.1	0	0	0	0	125.1
1270	H	33.9	Very low	35.2	Very low	147 Å²	147	137.6 Å²	137.6	68%	0.681	74%	0.739	S	S	*	*			trans	78.1	145.6	143.2	-74.6	-18.5	0	0	0	122.1
1271	R	33	Very low	35.4	Very low	208 Å²	208	136.7 Å²	136.7	79%	0.785	74%	0.74	S	S	*	*			cis	-168.8	135.9	-26.9	-150.2	179.5	-170.2	161.2	0.4	111.9
1272	P	43.3	Very low	35.5	Very low	111 Å²	111	138.3 Å²	138.3	72%	0.721	75%	0.749	S	S	*	*			trans	-97.2	164.3	165.2	38.1	-34.8	0	0	0	112.4
1273	P	42.8	Very low	35.6	Very low	103 Å²	103	133 Å²	133	67%	0.669	75%	0.745	S	S	*	*				-167.5	-173.4	95.4	45.1	-23.9	0	0	0	119.2
1274	R	33.6	Very low	35.5	Very low	209 Å²	209	132.9 Å²	132.9	79%	0.789	74%	0.743	S	S	*	*			trans	82	150.1	155.9	-64.8	163.6	-165.9	-122.4	-5.9	118.6
1275	R	34.9	Very low	35.2	Very low	182 Å²	182	132.7 Å²	132.7	69%	0.687	75%	0.745	S	S	*	*			cis	-161.7	-164.4	-8.5	-119.9	179.4	175.9	-168.8	-1.5	108.9
1276	F	33.6	Very low	35.2	Very low	173 Å²	173	132.8 Å²	132.8	76%	0.759	75%	0.746	S	S	*	*			cis	-166.7	154.6	13.1	-129.1	-47.6	0	0	0	110.8
1277	G	35.1	Very low	35.2	Very low	61 Å²	61	129.6 Å²	129.6	63%	0.629	74%	0.738	S	S	*	*			trans	79.2	141.6	162.9	0	0	0	0	0	117.5
1278	S	35.5	Very low	35.2	Very low	114 Å²	114	131.6 Å²	131.6	80%	0.797	74%	0.741	S	S	*	*			cis	95.8	146.4	20	81.4	0	0	0	0	115.2
1279	E	37.6	Very low	35.2	Very low	171 Å²	171	138 Å²	138	80%	0.799	77%	0.765	S	S	*	*			cis	-128.8	-111.7	17.3	-70.2	179.5	64	0	0	116.7
1280	N	35.4	Very low	35.3	Very low	133 Å²	133	139.5 Å²	139.5	71%	0.711	77%	0.77	S	S	*	*			trans	-132.2	-169.2	-152.9	-50	-55.1	0	0	0	117.6
1281	D	38.5	Very low	35.4	Very low	145 Å²	145	139.1 Å²	139.1	78%	0.775	78%	0.775	S	S	*	*			trans	87.1	110.5	159.2	-59.6	-20	0	0	0	117.7
1282	E	36.4	Very low	35.5	Very low	188 Å²	188	135.2 Å²	135.2	88%	0.879	77%	0.774	S	S	*	*				86.3	120.2	71.2	-82.2	-78	121.2	0	0	112.7
1283	G	35	Very low	35	Very low	75 Å²	75	136.6 Å²	136.6	77%	0.773	78%	0.778	S	S	*	*			trans	-177.5	27.2	-168.3	0	0	0	0	0	121.1
1284	A	35	Very low	34.5	Very low	87 Å²	87	138.8 Å²	138.8	72%	0.719	78%	0.784	S	S	*	*			trans	31.5	115	157.4	0	0	0	0	0	122.5
1285	S	32.4	Very low	34.6	Very low	104 Å²	104	134.1 Å²	134.1	73%	0.727	78%	0.784	S	S	*	*				88.6	153.5	119.5	77.4	0	0	0	0	124
1286	T	32.6	Very low	34.6	Very low	120 Å²	120	130.6 Å²	130.6	74%	0.736	79%	0.791	S	S	*	*			trans	71.3	86.5	154.6	44.1	0	0	0	0	122.1
1287	S	31.1	Very low	34.7	Very low	99 Å²	99	127.4 Å²	127.4	69%	0.692	79%	0.794	S	S	*	*				69.2	136.3	111.7	66.9	0	0	0	0	122.9
1288	S	31	Very low	34.6	Very low	113 Å²	113	132.9 Å²	132.9	79%	0.79	81%	0.807	S	S	*	*			trans	69.4	143.2	170.7	72.4	0	0	0	0	115.7
1289	L	34.9	Very low	34.5	Very low	246 Å²	246	134.6 Å²	134.6	100%	1.288	81%	0.808	S	S	*	*			cis	-106	0	7.6	-81.6	157.9	0	0	0	113.6

Retrieved 1,289 of 1,289 residues in 1403.7 ms (Link to these results)

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