A0A087Y888_POEFO Loading...

Zinc finger and BTB domain containing 10

AlphaFold DB , UniProt , Accession A0A087Y888, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 745 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.2	Very low	31.8	Very low	227 Å²	227	159.6 Å²	159.6	100%	1.118	83%	0.825	S	S	*	*				0	102.2	0	-60.8	166.7	81.5	0	0	105
2	S	31.7	Very low	31.3	Very low	123 Å²	123	162.1 Å²	162.1	86%	0.86	83%	0.826	S	S	*	*				67.1	109.7	97.6	-43.7	0	0	0	0	109.6
3	G	31.6	Very low	31.2	Very low	69 Å²	69	166.6 Å²	166.6	71%	0.711	83%	0.826	S	S	*	*				104.7	138.2	52.1	0	0	0	0	0	107
4	E	32.4	Very low	30.8	Very low	151 Å²	151	160.8 Å²	160.8	71%	0.706	83%	0.83	S	S	*	*			cis	-148.3	-162.5	16.9	-154.6	55.9	-146	0	0	111.4
5	R	39.3	Very low	30.4	Very low	213 Å²	213	155.9 Å²	155.9	80%	0.804	84%	0.835	S	S	*	*			trans	-107.9	-175.4	-155.3	-57.9	156	163.6	131.2	-13.7	114.9
6	N	28.5	Very low	30.3	Very low	144 Å²	144	151.4 Å²	151.4	77%	0.77	84%	0.836	S	S	*	*			trans	95.6	115.5	147.3	-136.5	34.1	0	0	0	115.6
7	R	36	Very low	30.1	Very low	224 Å²	224	150 Å²	150	85%	0.845	84%	0.84	S	S	*	*			cis	56.7	111.7	49	-77	-167.2	175.2	-170.8	0.2	115.5
8	R	31.1	Very low	30.2	Very low	236 Å²	236	147.5 Å²	147.5	89%	0.891	84%	0.841	S	S	*	*				167.1	152.8	112.8	-92.6	-176.8	-177.8	-106	3.1	111.8
9	S	29.7	Very low	30	Very low	108 Å²	108	143.4 Å²	143.4	76%	0.755	83%	0.834	S	S	*	*			trans	-99.8	155.6	167.7	26.6	0	0	0	0	111.1
10	L	29.6	Very low	30	Very low	178 Å²	178	144.2 Å²	144.2	93%	0.932	83%	0.834	S	S	*	*				-176	165	129.2	-100.8	166.5	0	0	0	113
11	A	29.3	Very low	29.9	Very low	83 Å²	83	144 Å²	144	69%	0.686	84%	0.836	S	S	*	*			trans	-98.3	169.5	-174.2	0	0	0	0	0	112.8
12	F	24.8	Very low	29.6	Very low	189 Å²	189	136.2 Å²	136.2	83%	0.829	81%	0.813	S	S	*	*				167.2	165.9	123	-122.8	-111.2	0	0	0	113.5
13	R	30.7	Very low	29.7	Very low	221 Å²	221	136.2 Å²	136.2	83%	0.834	81%	0.813	S	S	*	*			trans	-33.7	134.3	-179.1	-63.9	173.1	174.7	-152.5	-2.4	118.4
14	G	25	Very low	29.6	Very low	85 Å²	85	138.5 Å²	138.5	88%	0.876	82%	0.818	S	S	*	*				83.3	138	98.1	0	0	0	0	0	119.1
15	G	25.4	Very low	29.4	Very low	88 Å²	88	134.8 Å²	134.8	91%	0.907	82%	0.821	S	S	*	*			trans	172.7	122.1	172.4	0	0	0	0	0	110.6
16	G	28.1	Very low	29.1	Very low	83 Å²	83	132.6 Å²	132.6	86%	0.856	82%	0.823	S	S	*	*			trans	-124	150.7	168.7	0	0	0	0	0	109.3
17	S	28.1	Very low	29.1	Very low	128 Å²	128	129.3 Å²	129.3	90%	0.895	82%	0.823	S	S	*	*			trans	-145.7	149.1	173	53.1	0	0	0	0	109.5
18	A	31.6	Very low	28.8	Very low	105 Å²	105	122.6 Å²	122.6	87%	0.868	82%	0.824	S	S	*	*			trans	-133.1	160.2	-173.9	0	0	0	0	0	110.8
19	G	26.3	Very low	28.8	Very low	69 Å²	69	114.6 Å²	114.6	71%	0.711	82%	0.815	S	S	*	*			trans	-177.7	144.8	165.6	0	0	0	0	0	111.9
20	L	30	Very low	28.6	Very low	159 Å²	159	117 Å²	117	83%	0.832	82%	0.82	S	S	*	*			cis	-172	170.1	-27	-120.6	169.8	0	0	0	106.6
21	T	28.5	Very low	28.8	Very low	142 Å²	142	112.5 Å²	112.5	87%	0.871	80%	0.802	S	S	*	*			trans	72.3	133.1	-177.3	77.6	0	0	0	0	115.5
22	G	24.7	Very low	28.6	Very low	62 Å²	62	114.7 Å²	114.7	64%	0.639	80%	0.802	S	S	*	*			cis	-158.4	139.5	-13.9	0	0	0	0	0	109.2
23	S	33.6	Very low	28.7	Very low	123 Å²	123	110 Å²	110	86%	0.86	79%	0.793	S	S	*	*				57.7	119.4	95.7	-53.7	0	0	0	0	113.9
24	S	28.1	Very low	28.4	Very low	117 Å²	117	111.2 Å²	111.2	82%	0.818	80%	0.797	S	S	*	*			cis	-146.4	163.5	10.6	-63.9	0	0	0	0	109.7
25	G	28.9	Very low	28.3	Very low	73 Å²	73	115.8 Å²	115.8	75%	0.753	80%	0.796	S	S	*	*				79.8	130.7	59.8	0	0	0	0	0	110
26	I	32.2	Very low	28.6	Very low	167 Å²	167	115.9 Å²	115.9	86%	0.856	79%	0.789	S	S	*	*			cis	-144.3	164.7	19	-71.3	163.6	0	0	0	106.3
27	G	30.2	Very low	29	Very low	75 Å²	75	118 Å²	118	77%	0.773	79%	0.787	S	S	*	*			cis	114.6	149.6	18.7	0	0	0	0	0	110.4
28	G	29.7	Very low	28.9	Very low	83 Å²	83	116.4 Å²	116.4	86%	0.856	78%	0.781	S	S	*	*			cis	171	-176.5	0.8	0	0	0	0	0	112.5
29	G	29.4	Very low	28.5	Very low	69 Å²	69	117.8 Å²	117.8	71%	0.711	78%	0.783	S	S	*	*			trans	85.4	159.5	167.4	0	0	0	0	0	117.4
30	N	27.5	Very low	28.4	Very low	159 Å²	159	123.5 Å²	123.5	85%	0.85	79%	0.792	S	S	*	*			cis	-170.7	167.1	-3.8	-111	9.7	0	0	0	108.4
31	C	31.9	Very low	28.1	Very low	83 Å²	83	122.5 Å²	122.5	56%	0.561	79%	0.787	S	S	*	*			cis	-170.1	178.6	-19.9	53.2	0	0	0	0	109.7
32	N	25.8	Very low	28	Very low	129 Å²	129	126.5 Å²	126.5	69%	0.69	79%	0.786	S	S	*	*			trans	68.1	121.9	163.2	-49.2	-9.6	0	0	0	117.9
33	S	27.8	Very low	28	Very low	90 Å²	90	132.2 Å²	132.2	63%	0.629	80%	0.796	S	S	*	*			cis	69.3	141	3.3	-167.8	0	0	0	0	119.1
34	W	22.9	Very low	27.6	Very low	246 Å²	246	135.6 Å²	135.6	93%	0.932	80%	0.795	S	S	*	*			trans	-160.8	138.6	148.2	-89.4	-14.2	0	0	0	114.1
35	E	23.7	Very low	27.5	Very low	181 Å²	181	137.4 Å²	137.4	85%	0.846	80%	0.796	S	S	*	*			trans	-155.8	158.8	-175.7	-65.3	176.2	72.9	0	0	109.2
36	A	31.2	Very low	27.3	Very low	91 Å²	91	137.1 Å²	137.1	75%	0.752	79%	0.793	S	S	*	*			cis	-127.9	-73.7	-10.2	0	0	0	0	0	112.4
37	P	37.6	Very low	26.9	Very low	127 Å²	127	137.6 Å²	137.6	83%	0.825	80%	0.797	S	S	*	*			cis	-106	-175.4	-9.4	42.2	-32.4	0	0	0	113.6
38	A	24.9	Very low	26.8	Very low	94 Å²	94	143 Å²	143	78%	0.777	79%	0.794	S	S	*	*			trans	-122.9	166.4	173.9	0	0	0	0	0	112.5
39	C	22.9	Very low	27.4	Very low	134 Å²	134	144.7 Å²	144.7	91%	0.905	79%	0.79	S	S	*	*			trans	-124.6	157.6	171	-77	0	0	0	0	111.8
40	Q	25.8	Very low	27.3	Very low	190 Å²	190	145.2 Å²	145.2	89%	0.888	78%	0.777	S	S	*	*			trans	-129.2	160.2	-176.7	-64.2	-176.7	-10.1	0	0	112.6
41	D	23.1	Very low	27.4	Very low	138 Å²	138	144.8 Å²	144.8	74%	0.738	77%	0.77	S	S	*	*			trans	76.5	117.8	142.9	-156.5	16.6	0	0	0	120.8
42	R	25.5	Very low	27.3	Very low	226 Å²	226	148 Å²	148	85%	0.853	78%	0.777	S	S	*	*				-178.9	128.4	119.6	-98.6	171.2	-179.3	-160.8	-0.7	112.6
43	H	26.2	Very low	27.5	Very low	182 Å²	182	149.7 Å²	149.7	84%	0.843	78%	0.781	S	S	*	*			trans	-113.6	154.5	164.8	-93.5	-86.7	0	0	0	111
44	F	23.7	Very low	27.5	Very low	193 Å²	193	152 Å²	152	85%	0.846	79%	0.786	S	S	*	*			trans	-145	161	164.1	-108.4	-86.3	0	0	0	111.4
45	N	26.5	Very low	27.9	Very low	155 Å²	155	150 Å²	150	83%	0.829	78%	0.778	S	S	*	*			trans	-64.8	163	-174.7	-64.6	-23.6	0	0	0	114
46	G	25.1	Very low	28.2	Very low	68 Å²	68	148.1 Å²	148.1	70%	0.701	77%	0.774	S	S	*	*			cis	156.8	-154.5	-1.5	0	0	0	0	0	113
47	N	23.8	Very low	28.3	Very low	176 Å²	176	151.3 Å²	151.3	94%	0.941	78%	0.777	S	S	*	*			trans	86.3	134.2	172.8	-62.3	-4.4	0	0	0	120.3
48	R	27.7	Very low	27.8	Very low	188 Å²	188	148.6 Å²	148.6	71%	0.709	77%	0.772	S	S	*	*			trans	-128	151.1	167.6	-164.6	-172	176.4	-128.5	-8.2	106.1	D50	R48-D50 IonicContact CZ-OD1 2.86Å; R48-D50 IonicContact CZ-OD2 2.69Å; R48-D50 IonicContact NE-OD1 3.77Å; R48-D50 IonicContact NE-OD2 3.11Å; R48-D50 IonicContact NH1-OD1 3.53Å; R48-D50 PolarHBondContact NH1-OD1 2.67Å; R48-D50 IonicContact NH1-OD2 3.75Å; R48-D50 PolarHBondContact NH1-OD2 2.72Å; R48-D50 IonicContact NH2-OD1 3.81Å; R48-D50 PolarHBondContact NH2-OD1 2.78Å; R48-D50 IonicContact NH2-OD2 2.85Å
49	P	42.1	Very low	28.2	Very low	119 Å²	119	149.1 Å²	149.1	77%	0.773	78%	0.776	S	S	*	*				-127.8	158	98.4	5.3	17.8	0	0	0	110.6
50	D	28.8	Very low	28.5	Very low	81 Å²	81	152.9 Å²	152.9	43%	0.433	78%	0.778	S	S	.	*			cis	87.5	125.8	42.7	-78.3	-66.1	0	0	0	115.5	R48	R48-D50 IonicContact CZ-OD1 2.86Å; R48-D50 IonicContact CZ-OD2 2.69Å; R48-D50 IonicContact NE-OD1 3.77Å; R48-D50 IonicContact NE-OD2 3.11Å; R48-D50 IonicContact NH1-OD1 3.53Å; R48-D50 PolarHBondContact NH1-OD1 2.67Å; R48-D50 IonicContact NH1-OD2 3.75Å; R48-D50 PolarHBondContact NH1-OD2 2.72Å; R48-D50 IonicContact NH2-OD1 3.81Å; R48-D50 PolarHBondContact NH2-OD1 2.78Å; R48-D50 IonicContact NH2-OD2 2.85Å
51	Q	29.1	Very low	28.5	Very low	150 Å²	150	147.1 Å²	147.1	70%	0.701	77%	0.769	S	S	*	*			trans	66.8	155.6	154.7	-65.3	-178.7	-69.1	0	0	117.7
52	E	28.2	Very low	29.8	Very low	149 Å²	149	146.4 Å²	146.4	70%	0.696	77%	0.772	S	S	*	*			cis	-163.4	-173	-18	-118.2	159.3	-159.7	0	0	110.5
53	E	30.4	Very low	29.9	Very low	166 Å²	166	140.5 Å²	140.5	78%	0.776	77%	0.765	S	S	*	*			trans	65	109.3	154.8	-77.1	-175.4	168.7	0	0	123.3
54	D	28.7	Very low	30.2	Very low	137 Å²	137	140.6 Å²	140.6	73%	0.733	77%	0.766	S	S	*	*				75.8	159.6	107.2	-156.9	29.2	0	0	0	123.2
55	R	32	Very low	30.5	Very low	206 Å²	206	139.4 Å²	139.4	78%	0.777	76%	0.761	S	S	*	*			trans	87.3	94.5	163.2	-54	-173	-173.8	174	5.8	122.1
56	D	28.8	Very low	30.6	Very low	140 Å²	140	141.9 Å²	141.9	75%	0.749	76%	0.758	S	S	*	*				51.8	144.3	99.9	-151.8	16.1	0	0	0	123.1
57	L	32.8	Very low	31	Very low	159 Å²	159	144.3 Å²	144.3	83%	0.832	76%	0.759	S	S	*	*			trans	63	151.1	170.5	-49.7	-178.5	0	0	0	119.2
58	G	27.8	Very low	31.3	Very low	70 Å²	70	143.6 Å²	143.6	72%	0.722	75%	0.75	S	S	*	*			cis	171.9	133.2	-9	0	0	0	0	0	115.7
59	A	33.3	Very low	31.5	Very low	104 Å²	104	138.5 Å²	138.5	86%	0.86	76%	0.756	S	S	*	*			trans	40.3	132.3	151.9	0	0	0	0	0	124.1
60	K	28.9	Very low	30.8	Very low	214 Å²	214	138.2 Å²	138.2	93%	0.93	76%	0.764	S	S	*	*			trans	-140.6	132.9	134.8	-79.6	-166.8	178.2	178.3	0	111.5
61	G	26.6	Very low	30.7	Very low	69 Å²	69	138.2 Å²	138.2	71%	0.711	78%	0.783	S	S	*	*			trans	-103.2	-148.3	160.5	0	0	0	0	0	110.4
62	P	49.4	Very low	30.7	Very low	122 Å²	122	136.2 Å²	136.2	79%	0.792	79%	0.785	S	S	*	*			cis	-137.6	179.3	0.3	43.2	-27.5	0	0	0	115.2
63	S	28.7	Very low	30.7	Very low	103 Å²	103	135.6 Å²	135.6	72%	0.72	79%	0.791	S	S	*	*				172.7	130	128.6	-79.5	0	0	0	0	115.8
64	Q	32.7	Very low	30.7	Very low	183 Å²	183	132.3 Å²	132.3	86%	0.855	79%	0.787	S	S	*	*			trans	39.6	150	137.9	-59.5	-176.8	-4.4	0	0	123.3
65	K	29.7	Very low	30.5	Very low	169 Å²	169	132.8 Å²	132.8	74%	0.735	79%	0.789	S	S	*	*			cis	179.3	130.6	-17.6	175	-176.2	-178.8	-175.7	0	110.6
66	R	27.1	Very low	30.6	Very low	206 Å²	206	126.9 Å²	126.9	78%	0.777	78%	0.78	S	S	*	*			trans	62.6	131.3	170.4	-89.9	-177.4	179.2	178.7	-3	116
67	V	33.4	Very low	30.5	Very low	119 Å²	119	126.1 Å²	126.1	72%	0.721	78%	0.781	S	S	*	*			cis	68.2	135.3	19.6	-160.7	0	0	0	0	112.1
68	E	31.3	Very low	30.4	Very low	162 Å²	162	127 Å²	127	76%	0.757	78%	0.78	S	S	*	*			cis	-111.2	177	11.7	-57.4	63.6	-127.6	0	0	113.2
69	G	30.8	Very low	31.2	Very low	80 Å²	80	129 Å²	129	83%	0.825	78%	0.781	S	S	*	*			cis	144.6	95.3	-14.5	0	0	0	0	0	116.9
70	A	28	Very low	31.1	Very low	114 Å²	114	133 Å²	133	94%	0.942	78%	0.782	S	S	*	*			trans	-163.5	153.2	170.4	0	0	0	0	0	114.8
71	G	26.5	Very low	31.3	Very low	80 Å²	80	126.7 Å²	126.7	83%	0.825	77%	0.769	S	S	*	*			trans	113.4	82.7	156.7	0	0	0	0	0	120.4
72	S	29.6	Very low	31.8	Very low	108 Å²	108	131.9 Å²	131.9	76%	0.755	78%	0.775	S	S	*	*			trans	-5.4	132.8	161.6	-48.5	0	0	0	0	124.6
73	V	27.2	Very low	31.2	Very low	136 Å²	136	134.5 Å²	134.5	82%	0.824	78%	0.777	S	S	*	*			trans	54.6	151.5	130.5	-49.7	0	0	0	0	121.8
74	S	31.6	Very low	31.7	Very low	98 Å²	98	137.1 Å²	137.1	69%	0.685	78%	0.778	S	S	*	*			cis	-167.5	149.3	-19	-95.3	0	0	0	0	106.9
75	D	24.3	Very low	31.7	Very low	146 Å²	146	137 Å²	137	78%	0.781	78%	0.777	S	S	*	*				67.9	133.7	61.5	-144.3	42.5	0	0	0	112.3
76	S	33.2	Very low	32	Very low	82 Å²	82	136.3 Å²	136.3	57%	0.573	78%	0.782	S	S	*	*			cis	-167.4	165.8	-0.9	-136.7	0	0	0	0	113.1
77	T	27.5	Very low	33.1	Very low	125 Å²	125	131.5 Å²	131.5	77%	0.767	78%	0.777	S	S	*	*			trans	57.1	160.4	133.3	-52.3	0	0	0	0	123.2
78	E	29.9	Very low	33.2	Very low	176 Å²	176	135.1 Å²	135.1	82%	0.822	79%	0.786	S	S	*	*			trans	-71.5	-167.3	169.5	-53.7	178.8	118.5	0	0	111.7
79	P	45.8	Very low	33.1	Very low	113 Å²	113	131.2 Å²	131.2	73%	0.734	79%	0.789	S	S	*	*			cis	-148.2	-168.1	10.9	46.1	-23.3	0	0	0	118.7
80	E	31.4	Very low	33.2	Very low	188 Å²	188	131 Å²	131	88%	0.879	79%	0.787	S	S	*	*			trans	21	141.8	154.5	-66.9	-170.5	154.8	0	0	126.6
81	A	32.7	Very low	33.1	Very low	82 Å²	82	131.9 Å²	131.9	68%	0.678	79%	0.787	S	S	*	*			trans	84	98	136.1	0	0	0	0	0	124.7
82	E	37	Very low	33.2	Very low	178 Å²	178	134.3 Å²	134.3	83%	0.832	79%	0.789	S	S	*	*				65.9	138.4	120.4	-66.3	-179.9	-116.5	0	0	125.2
83	E	36.5	Very low	33.6	Very low	176 Å²	176	133.8 Å²	133.8	82%	0.822	79%	0.792	S	S	*	*			trans	63.4	143.1	164.9	-59.3	-171.3	167.5	0	0	119.9
84	E	38.9	Very low	34	Very low	159 Å²	159	132.3 Å²	132.3	74%	0.743	79%	0.794	S	S	*	*			cis	-163.1	166	-11.4	-110.5	-70.5	-156.9	0	0	111.8
85	E	34	Very low	33.8	Very low	180 Å²	180	131.1 Å²	131.1	84%	0.841	80%	0.796	S	S	*	*			trans	71.2	154.1	164	-69.6	-167.2	-174.6	0	0	123.7
86	D	35.2	Very low	34.2	Very low	155 Å²	155	132.3 Å²	132.3	83%	0.829	80%	0.803	S	S	*	*			trans	-87.5	-173.7	-161.8	-105.4	-53.1	0	0	0	115
87	P	51.4	Low	34.2	Very low	105 Å²	105	131.6 Å²	131.6	68%	0.682	81%	0.808	S	S	*	*			cis	-148.4	171.2	22.9	44.1	-23.2	0	0	0	121.2
88	E	33.7	Very low	34.7	Very low	194 Å²	194	132 Å²	132	91%	0.907	81%	0.806	S	S	*	*			trans	52.1	154.9	141.9	-71.1	-173.6	161.4	0	0	124.3
89	G	31	Very low	34.6	Very low	80 Å²	80	129.1 Å²	129.1	83%	0.825	80%	0.796	S	S	*	*			trans	-177.1	-97.9	168.8	0	0	0	0	0	120.4
90	G	32.1	Very low	33.8	Very low	76 Å²	76	132.3 Å²	132.3	78%	0.784	79%	0.793	S	S	*	*			trans	89	152.4	174.1	0	0	0	0	0	119.5
91	S	25.9	Very low	33.8	Very low	133 Å²	133	128.3 Å²	128.3	93%	0.93	79%	0.792	S	S	*	*			trans	-170.2	179.9	163.9	-88.7	0	0	0	0	113.4
92	C	29.3	Very low	33.6	Very low	130 Å²	130	127.8 Å²	127.8	88%	0.878	80%	0.795	S	S	*	*			trans	-120.9	-170.9	-147.4	57	0	0	0	0	118.6
93	A	37.3	Very low	33.4	Very low	98 Å²	98	124.5 Å²	124.5	81%	0.81	79%	0.792	S	S	*	*			trans	-101.8	-167.6	-167.6	0	0	0	0	0	114.3
94	A	35	Very low	33.1	Very low	105 Å²	105	121.9 Å²	121.9	87%	0.868	79%	0.788	S	S	*	*			cis	-164.4	-177.4	18.3	0	0	0	0	0	113.9
95	G	27.3	Very low	32.8	Very low	72 Å²	72	122.8 Å²	122.8	74%	0.742	79%	0.792	S	S	*	*			trans	165.2	143.7	165.3	0	0	0	0	0	117.2
96	D	33	Very low	32.6	Very low	172 Å²	172	117.4 Å²	117.4	92%	0.92	78%	0.784	S	S	*	*			trans	-122.7	-173.8	-166.2	-41.5	-91.7	0	0	0	113.3
97	G	34.2	Very low	32.5	Very low	66 Å²	66	117.2 Å²	117.2	68%	0.68	78%	0.784	S	S	*	*			cis	173.6	173.6	4.5	0	0	0	0	0	108.1
98	D	36.1	Very low	31.3	Very low	134 Å²	134	120.1 Å²	120.1	72%	0.717	79%	0.793	S	S	*	*			cis	-119.7	-112.1	-0.1	-74.2	-3.2	0	0	0	110.8	R100	D98-R100 IonicContact OD2-CZ 3.66Å; D98-R100 IonicContact OD2-NH1 3.18Å; D98-R100 IonicContact OD2-NH2 3.03Å; D98-R100 PolarHBondContact OD2-NH2 2.79Å
99	D	29.1	Very low	31	Very low	116 Å²	116	113.9 Å²	113.9	62%	0.62	78%	0.781	S	S	*	*			cis	-167.9	165.7	-9.7	-133.6	31.6	0	0	0	111.1
100	R	29.1	Very low	30.9	Very low	179 Å²	179	115.7 Å²	115.7	68%	0.675	78%	0.78	S	S	*	*			cis	-173.9	125.9	-36.4	167.4	178.7	-73	132	3.8	113.2	D98	D98-R100 IonicContact OD2-CZ 3.66Å; D98-R100 IonicContact OD2-NH1 3.18Å; D98-R100 IonicContact OD2-NH2 3.03Å; D98-R100 PolarHBondContact OD2-NH2 2.79Å
101	A	31.1	Very low	30.6	Very low	104 Å²	104	121.9 Å²	121.9	86%	0.86	78%	0.78	S	S	*	*			trans	64.6	155.4	162.5	0	0	0	0	0	120.7
102	G	28.2	Very low	30.8	Very low	71 Å²	71	122.9 Å²	122.9	73%	0.732	77%	0.77	S	S	*	*			cis	174.5	-173.2	3.7	0	0	0	0	0	110
103	S	32.3	Very low	30.7	Very low	110 Å²	110	120 Å²	120	77%	0.769	76%	0.762	S	S	*	*			cis	-172.3	-178	-11	-77	0	0	0	0	109.1
104	V	31.3	Very low	30.2	Very low	120 Å²	120	123.2 Å²	123.2	73%	0.727	77%	0.766	S	S	*	*			trans	75.2	122	162.4	173.1	0	0	0	0	117.1
105	E	32.9	Very low	29.8	Very low	179 Å²	179	122.7 Å²	122.7	84%	0.836	76%	0.756	S	S	*	*			cis	-157.2	-175.2	-4.4	-117.1	154.9	-134.7	0	0	107.8
106	G	29.4	Very low	29.7	Very low	66 Å²	66	130.6 Å²	130.6	68%	0.68	76%	0.763	S	S	*	*			cis	124.7	141.2	13	0	0	0	0	0	110.2
107	D	32.3	Very low	29.3	Very low	152 Å²	152	129.8 Å²	129.8	81%	0.813	77%	0.765	S	S	*	*			cis	-157.3	-135.5	-8.3	-162.8	-100.3	0	0	0	109.8
108	D	27.6	Very low	28.9	Very low	165 Å²	165	131.6 Å²	131.6	88%	0.882	77%	0.774	S	S	*	*			trans	68.6	117.3	-179.3	-94.5	-35.4	0	0	0	117.1
109	G	26.8	Very low	28.3	Very low	64 Å²	64	128.4 Å²	128.4	66%	0.66	77%	0.772	S	S	*	*			cis	-165.2	163.6	-1.3	0	0	0	0	0	112.9
110	C	29.7	Very low	28.1	Very low	118 Å²	118	130.8 Å²	130.8	80%	0.797	79%	0.785	S	S	*	*			trans	-127.1	165	-155.5	-63.9	0	0	0	0	116
111	R	24.9	Very low	28.1	Very low	205 Å²	205	125.4 Å²	125.4	77%	0.774	79%	0.785	S	S	*	*				-172.3	129.2	125.1	-108	-172.7	134.7	112.9	18.4	117.3
112	E	30.2	Very low	28.6	Very low	155 Å²	155	125.8 Å²	125.8	72%	0.724	78%	0.779	S	S	*	*				27.4	145.7	128.9	-60	163.5	-173.2	0	0	121.5
113	G	27.7	Very low	28.6	Very low	70 Å²	70	128 Å²	128	72%	0.722	78%	0.778	S	S	*	*			cis	164.4	160.1	-4.3	0	0	0	0	0	115.2
114	N	26.3	Very low	28.4	Very low	164 Å²	164	129.1 Å²	129.1	88%	0.877	78%	0.776	S	S	*	*			trans	57.1	104.8	158.2	-64.5	0.8	0	0	0	123.8
115	S	26.3	Very low	28.1	Very low	95 Å²	95	128.6 Å²	128.6	66%	0.664	77%	0.769	S	S	*	*				68.7	112.3	111	-159.2	0	0	0	0	124
116	W	24.9	Very low	27.9	Very low	238 Å²	238	125.6 Å²	125.6	90%	0.902	76%	0.763	S	S	*	*			trans	64.4	121.1	145.3	-66.3	36.7	0	0	0	121
117	T	25.3	Very low	27.9	Very low	154 Å²	154	128.7 Å²	128.7	95%	0.945	76%	0.76	S	S	*	*				175.3	-178.7	121.5	30.1	0	0	0	0	110.2
118	A	25.9	Very low	27.8	Very low	105 Å²	105	130.6 Å²	130.6	87%	0.868	76%	0.764	S	S	*	*			trans	-133.1	154.8	-168.5	0	0	0	0	0	114.3
119	G	24.1	Very low	27.8	Very low	66 Å²	66	125.9 Å²	125.9	68%	0.68	75%	0.754	S	S	*	*			trans	119.4	154.2	150.3	0	0	0	0	0	117.8
120	N	25	Very low	28.3	Very low	166 Å²	166	131.4 Å²	131.4	89%	0.888	76%	0.762	S	S	*	*			trans	79.9	124.7	163.2	-50.5	-37.1	0	0	0	119
121	G	28.9	Very low	28.4	Very low	67 Å²	67	132.4 Å²	132.4	69%	0.691	76%	0.755	S	S	*	*			trans	-80.6	-156.3	145.1	0	0	0	0	0	110.3
122	P	41.3	Very low	28.5	Very low	112 Å²	112	127.1 Å²	127.1	73%	0.727	75%	0.748	S	S	*	*			cis	-154.3	-167.4	49.9	43.3	-22.2	0	0	0	116
123	T	27.8	Very low	28.2	Very low	116 Å²	116	130.9 Å²	130.9	71%	0.712	76%	0.756	S	S	*	*			trans	62.2	148.8	154.9	55.6	0	0	0	0	119.8
124	N	27	Very low	28.1	Very low	135 Å²	135	130.8 Å²	130.8	72%	0.722	76%	0.755	S	S	*	*			cis	-160.8	-177.7	-18.1	-111.5	25.2	0	0	0	106.7
125	N	26.9	Very low	28	Very low	109 Å²	109	130.6 Å²	130.6	58%	0.583	76%	0.759	S	S	*	*			cis	-140.5	-144.6	9.2	-144.9	81.6	0	0	0	108.1	E127	N125-E127 PolarHBondContact ND2-OE1 3.47Å
126	T	27.4	Very low	27.9	Very low	115 Å²	115	130.1 Å²	130.1	71%	0.706	76%	0.762	S	S	*	*			trans	82.1	112.6	145.7	-54.1	0	0	0	0	119.7
127	E	29.9	Very low	28	Very low	132 Å²	132	129.1 Å²	129.1	62%	0.617	76%	0.763	S	S	*	*			cis	-152.6	-105.3	-17.7	-135.4	78.1	-95.4	0	0	110.6	N125	N125-E127 PolarHBondContact ND2-OE1 3.47Å
128	E	30.1	Very low	27.9	Very low	192 Å²	192	125.4 Å²	125.4	90%	0.897	76%	0.756	S	S	*	*			trans	-140.4	153.4	-164.1	-59.7	179.5	158.1	0	0	112.3
129	G	28.3	Very low	27.7	Very low	65 Å²	65	124 Å²	124	67%	0.67	75%	0.752	S	S	*	*			cis	-178.3	154.8	-6.7	0	0	0	0	0	114.4
130	Q	36.7	Very low	27.8	Very low	181 Å²	181	129.5 Å²	129.5	85%	0.846	76%	0.76	S	S	*	*			trans	52.9	152.5	133.5	-71.7	-168.3	-64.7	0	0	122.8
131	E	30.8	Very low	27.7	Very low	139 Å²	139	128.4 Å²	128.4	65%	0.65	76%	0.759	S	S	*	*			cis	-157.2	172.2	2	-102.1	-107.8	126	0	0	107.8
132	C	27.4	Very low	27.6	Very low	93 Å²	93	129 Å²	129	63%	0.628	77%	0.765	S	S	*	*			cis	177.2	-175.4	-28.8	-169.4	0	0	0	0	109.7
133	R	25.2	Very low	27	Very low	235 Å²	235	129.1 Å²	129.1	89%	0.887	77%	0.769	S	S	*	*			trans	70.6	145.5	174.3	-52.3	179.6	179.6	-133.5	-1.9	117.2
134	G	24.2	Very low	26.9	Very low	68 Å²	68	134.3 Å²	134.3	70%	0.701	78%	0.776	S	S	*	*			cis	162.8	144.9	-14.3	0	0	0	0	0	116
135	V	24.6	Very low	26.9	Very low	159 Å²	159	137.2 Å²	137.2	96%	0.964	78%	0.782	S	S	*	*			trans	70.7	160	161.7	-170.3	0	0	0	0	117.2
136	A	24.8	Very low	26.8	Very low	86 Å²	86	137.7 Å²	137.7	71%	0.711	79%	0.793	S	S	*	*			trans	-141	-176.9	-164.5	0	0	0	0	0	114.6
137	K	26.2	Very low	26.7	Very low	216 Å²	216	135.8 Å²	135.8	94%	0.939	80%	0.797	S	S	*	*			trans	85.7	148.2	-175.5	-56.4	-178.7	177.4	-176.4	0	115.1
138	G	22.9	Very low	26.5	Very low	77 Å²	77	135.9 Å²	135.9	79%	0.794	81%	0.806	S	S	*	*			cis	158	152.4	-10.2	0	0	0	0	0	114.3
139	G	23.1	Very low	26.3	Very low	76 Å²	76	136 Å²	136	78%	0.784	81%	0.807	S	S	*	*			trans	80.2	165	172.4	0	0	0	0	0	116.5
140	E	25	Very low	26.2	Very low	180 Å²	180	141.1 Å²	141.1	84%	0.841	82%	0.815	S	S	*	*			cis	-166.6	167.1	-19.2	-142.9	178.1	164	0	0	111.6
141	T	24	Very low	25.7	Very low	143 Å²	143	143.7 Å²	143.7	88%	0.877	82%	0.817	S	S	*	*			trans	73.6	150.4	169.6	77	0	0	0	0	120
142	G	25.5	Very low	25.6	Very low	79 Å²	79	141.9 Å²	141.9	81%	0.814	82%	0.817	S	S	*	*			trans	136.7	127.2	178.1	0	0	0	0	0	111.8
143	S	28.8	Very low	25.9	Very low	116 Å²	116	146.4 Å²	146.4	81%	0.811	83%	0.83	S	S	*	*			trans	-140.4	149.8	-167.1	-159.1	0	0	0	0	115.8
144	R	26	Very low	26.4	Very low	225 Å²	225	140.3 Å²	140.3	85%	0.849	82%	0.818	S	S	*	*			trans	87.6	112.9	162.9	-64	-177.6	170.2	-177.8	-3.7	120.6
145	K	27.7	Very low	26.8	Very low	196 Å²	196	143 Å²	143	85%	0.852	82%	0.816	S	S	*	*			trans	103.2	133.9	136.2	-76.1	-177.1	174.5	-172.3	0	121.1
146	S	23.3	Very low	27.1	Very low	118 Å²	118	142.4 Å²	142.4	83%	0.825	81%	0.807	S	S	*	*			trans	60	106.8	154	57.6	0	0	0	0	121
147	G	25.8	Very low	27.5	Very low	76 Å²	76	145.6 Å²	145.6	78%	0.784	81%	0.807	S	S	*	*				94.6	101.4	116.9	0	0	0	0	0	118.6
148	V	26.5	Very low	27.8	Very low	133 Å²	133	143.1 Å²	143.1	81%	0.806	80%	0.796	S	S	*	*			trans	168.9	122.1	130.9	152.5	0	0	0	0	106.9	M150	V148-M150 HydrophobicContact CG1-CG 4.36Å
149	E	24.7	Very low	28.5	Very low	194 Å²	194	144.9 Å²	144.9	91%	0.907	78%	0.784	S	S	*	*			trans	-103.2	126	179.2	-173.2	174.7	-164.3	0	0	109.5
150	M	27.6	Very low	29.1	Very low	173 Å²	173	144.9 Å²	144.9	85%	0.852	77%	0.771	S	S	*	*			trans	-117.1	132	-177.8	-94.8	-66.4	-155.2	0	0	112.7	V148	V148-M150 HydrophobicContact CG1-CG 4.36Å
151	R	26.2	Very low	29.8	Very low	236 Å²	236	145.8 Å²	145.8	89%	0.891	77%	0.767	S	S	*	*			trans	-67.4	136.5	-165.9	-170.9	-174.4	-163	126.7	-2.9	114.1
152	P	29.2	Very low	30.3	Very low	100 Å²	100	145.7 Å²	145.7	65%	0.649	76%	0.755	S	S	*	*			trans	-78.3	153.1	179.7	31.3	-35.6	0	0	0	114.5	T154	P152-T154 PolarHBondContact O-N 3.35Å; P152-T154 VanDerWaalsContact O-N 3.13Å
153	Q	33.1	Very low	31.2	Very low	189 Å²	189	145.5 Å²	145.5	88%	0.883	73%	0.733	S	S	*	*			trans	-87	52.2	-168.5	-62.6	173	-40.4	0	0	115	L155	Q153-L155 PolarHBondContact O-N 3.34Å
154	T	34.7	Very low	32.1	Very low	106 Å²	106	142.8 Å²	142.8	65%	0.65	72%	0.717	S	S	*	*			trans	-86.7	-3.3	-169.6	56.2	0	0	0	0	116.5	P152	P152-T154 PolarHBondContact O-N 3.35Å; P152-T154 VanDerWaalsContact O-N 3.13Å
155	L	32.3	Very low	33.1	Very low	124 Å²	124	135 Å²	135	65%	0.649	70%	0.697	S	S	*	*	S	Bend	trans	-84.7	-37.7	-172.5	-104.8	166	0	0	0	115	Q153 Q157 K158 H159	Q153-L155 PolarHBondContact O-N 3.34Å; L155-Q157 PolarHBondContact O-N 2.71Å; L155-K158 PolarHBondContact O-N 3.06Å; L155-H159 PolarHBondContact O-CD2 3.06Å
156	L	30.9	Very low	33.7	Very low	148 Å²	148	132.4 Å²	132.4	78%	0.775	68%	0.682	S	S	*	*	H	α-helix	trans	-64.8	-36.9	-172	-82	161.9	0	0	0	113.2	K158 H159	L156-K158 VanDerWaalsContact C-N 3.28Å; L156-K158 PolarHBondContact O-N 3.38Å; L156-H159 PolarHBondContact O-N 3.03Å
157	Q	33.2	Very low	34.9	Very low	152 Å²	152	129.5 Å²	129.5	71%	0.71	66%	0.657	S	S	*	*	H	α-helix	trans	-74.2	-14.6	-173.5	-150.7	178.7	43.5	0	0	114	L155 S160	L155-Q157 PolarHBondContact O-N 2.71Å; Q157-S160 PolarHBondContact O-OG 2.94Å
158	K	33.5	Very low	36	Very low	165 Å²	165	133.6 Å²	133.6	72%	0.717	66%	0.655	S	S	*	*	H	α-helix	trans	-81.8	-27	173.9	-70.4	-171.7	176.8	-176.3	0	112.9	L155 L156	L155-K158 PolarHBondContact O-N 3.06Å; L156-K158 VanDerWaalsContact C-N 3.28Å; L156-K158 PolarHBondContact O-N 3.38Å
159	H	36.9	Very low	37	Very low	114 Å²	114	133.5 Å²	133.5	53%	0.528	65%	0.646	S	S	.	*	H	α-helix	trans	-75.1	-29.9	-177.2	-75.8	-64.7	0	0	0	114.1	L155 L156 F162 H163	L155-H159 PolarHBondContact O-CD2 3.06Å; L156-H159 PolarHBondContact O-N 3.03Å; H159-F162 PolarHBondContact O-N 2.97Å; H159-H163 PolarHBondContact O-N 2.83Å
160	S	36.5	Very low	38.1	Very low	75 Å²	75	127.8 Å²	127.8	52%	0.524	62%	0.619	S	S	.	*	H	α-helix	trans	-66.3	-43.9	178.3	54.7	0	0	0	0	112.5	Q157 F162 H163 A164	Q157-S160 PolarHBondContact O-OG 2.94Å; S160-F162 VanDerWaalsContact C-N 3.31Å; S160-F162 PolarHBondContact O-N 2.95Å; S160-H163 PolarHBondContact O-N 3.31Å; S160-A164 PolarHBondContact O-N 3.48Å
161	R	39.3	Very low	39.2	Very low	200 Å²	200	124.7 Å²	124.7	76%	0.755	61%	0.612	S	S	*	*	H	α-helix	trans	-62.7	-36.7	176.9	-68.7	-177.7	176.2	162.6	0.3	112.4	H163 A164	R161-H163 VanDerWaalsContact C-N 3.32Å; R161-H163 PolarHBondContact O-N 3.49Å; R161-A164 PolarHBondContact O-N 3.43Å
162	F	34.2	Very low	40.3	Very low	141 Å²	141	117.3 Å²	117.3	62%	0.618	58%	0.584	S	S	*	*	H	α-helix	trans	-68.7	-27.2	177.3	-161.5	-86.6	0	0	0	113.4	H159 S160 S165	H159-F162 PolarHBondContact O-N 2.97Å; S160-F162 VanDerWaalsContact C-N 3.31Å; S160-F162 PolarHBondContact O-N 2.95Å; F162-S165 PolarHBondContact O-OG 3.14Å
163	H	45.7	Very low	41.3	Very low	75 Å²	75	113.5 Å²	113.5	35%	0.347	56%	0.558	S	S	.	*	H	α-helix	trans	-75.4	-30.2	174.5	-98.3	-104.9	0	0	0	113.1	H159 S160 R161 L167	H159-H163 PolarHBondContact O-N 2.83Å; S160-H163 PolarHBondContact O-N 3.31Å; R161-H163 VanDerWaalsContact C-N 3.32Å; R161-H163 PolarHBondContact O-N 3.49Å; H163-L167 WeakPolarHBondContact O-CG 3.29Å; H163-L167 PolarHBondContact O-N 2.85Å
164	A	45.9	Very low	42.2	Very low	59 Å²	59	111.1 Å²	111.1	49%	0.488	55%	0.545	S	S	.	.	H	α-helix	trans	-70	-42.6	-175.1	0	0	0	0	0	112.9	S160 R161 L167	S160-A164 PolarHBondContact O-N 3.48Å; R161-A164 PolarHBondContact O-N 3.43Å; A164-L167 PolarHBondContact O-N 3.39Å
165	S	47.1	Very low	42.9	Very low	61 Å²	61	109.7 Å²	109.7	43%	0.427	53%	0.529	S	S	.	.	H	α-helix	trans	-66.1	-39.6	176.5	49	0	0	0	0	112.3	F162 L167 Q168	F162-S165 PolarHBondContact O-OG 3.14Å; S165-L167 PolarHBondContact O-N 3.39Å; S165-Q168 WeakPolarHBondContact O-CB 3.11Å; S165-Q168 PolarHBondContact O-N 2.9Å
166	W	42	Very low	43.8	Very low	142 Å²	142	105.9 Å²	105.9	54%	0.538	51%	0.512	S	S	.	.	H	α-helix	trans	-64.9	-25.1	178.2	-124.7	52.8	0	0	0	113.7
167	L	48.5	Very low	44.6	Very low	57 Å²	57	106.8 Å²	106.8	30%	0.298	51%	0.513	S	S	.	.	H	α-helix	trans	-79.3	-16.3	174.5	-72.3	166.2	0	0	0	113.2	H163 A164 S165 L173 M182	H163-L167 WeakPolarHBondContact O-CG 3.29Å; H163-L167 PolarHBondContact O-N 2.85Å; A164-L167 PolarHBondContact O-N 3.39Å; S165-L167 PolarHBondContact O-N 3.39Å; L167-L173 WeakPolarHBondContact CD2-O 3.49Å; L167-M182 HydrophobicContact CD2-CE 4.05Å
168	Q	48.8	Very low	44.9	Very low	161 Å²	161	108.6 Å²	108.6	75%	0.752	52%	0.521	S	S	*	.	H	α-helix	trans	-78.1	-30.1	172.6	-66.3	-178.2	-39	0	0	112	S165	S165-Q168 WeakPolarHBondContact O-CB 3.11Å; S165-Q168 PolarHBondContact O-N 2.9Å
169	E	47.4	Very low	45.8	Very low	131 Å²	131	104.9 Å²	104.9	61%	0.612	51%	0.512	S	S	*	.	H	α-helix	trans	-76.8	-24.1	176	-65.6	178.5	167	0	0	112.9
170	F	47.5	Very low	46.5	Very low	75 Å²	75	101.8 Å²	101.8	33%	0.329	51%	0.512	S	S	.	.			trans	-134.5	76.2	-175.9	-60	-78.9	0	0	0	113.3	W172 L173	F170-W172 HydrophobicContact CB-CZ2 4.36Å; F170-W172 AromaticContact CD1-CZ2 3.75Å; F170-W172 HydrophobicContact CD1-CZ2 3.75Å; F170-W172 HydrophobicContact CG-CZ2 4.42Å; F170-W172 PolarHBondContact O-N 3.01Å; F170-L173 HydrophobicContact CB-CB 4.41Å; F170-L173 PolarHBondContact O-N 3.36Å; F170-L173 VanDerWaalsContact O-N 3.1Å
171	P	50.2	Low	47	Very low	108 Å²	108	101.2 Å²	101.2	70%	0.701	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-17.3	-171.6	-25.9	35.6	0	0	0	116.5
172	W	50.3	Low	47.5	Very low	81 Å²	81	94.3 Å²	94.3	31%	0.307	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-4.9	179.9	50.2	-100.5	0	0	0	114	F170 C184 S185 H214	F170-W172 HydrophobicContact CB-CZ2 4.36Å; F170-W172 AromaticContact CD1-CZ2 3.75Å; F170-W172 HydrophobicContact CD1-CZ2 3.75Å; F170-W172 HydrophobicContact CG-CZ2 4.42Å; F170-W172 PolarHBondContact O-N 3.01Å; W172-C184 HydrophobicContact CE3-CB 4.05Å; W172-C184 HydrophobicContact CZ3-CB 4.18Å; W172-S185 PolarHBondContact O-N 2.99Å; W172-H214 AromaticContact CE2-CE1 3.97Å; W172-H214 AromaticContact CH2-CE1 3.63Å; W172-H214 AromaticContact CH2-ND1 3.86Å; W172-H214 AromaticContact CH2-NE2 3.83Å; W172-H214 AromaticContact CZ2-CE1 3.33Å; W172-H214 WeakPolarHBondContact CZ2-CE1 3.22Å; W172-H214 AromaticContact CZ2-NE2 3.34Å; W172-H214 VanDerWaalsContact CZ2-NE2 3.34Å; W172-H214 WeakPolarHBondContact CZ2-NE2 3.41Å
173	L	49.8	Very low	48.2	Very low	19 Å²	19	89.3 Å²	89.3	10%	0.099	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	132.5	178.6	-166.3	71	0	0	0	110	L167 F170 M182	L167-L173 WeakPolarHBondContact CD2-O 3.49Å; F170-L173 HydrophobicContact CB-CB 4.41Å; F170-L173 PolarHBondContact O-N 3.36Å; F170-L173 VanDerWaalsContact O-N 3.1Å; L173-M182 HydrophobicContact CD1-CB 4.37Å; L173-M182 HydrophobicContact CD2-CE 3.53Å; L173-M182 HydrophobicContact CG-CE 3.82Å
174	K	51.3	Low	48.6	Very low	140 Å²	140	86.2 Å²	86.2	61%	0.609	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	145.9	177.7	-66.2	-171.2	177	-175	0	111	M182 S183	K174-M182 CarbonylContact O-C 3.57Å; K174-M182 WeakPolarHBondContact O-CA 3.49Å; K174-S183 PolarHBondContact N-O 3.42Å; K174-S183 PolarHBondContact O-N 3.49Å
175	F	49.2	Very low	48.7	Very low	76 Å²	76	86 Å²	86	33%	0.333	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	121.1	174	177.3	-126.4	0	0	0	109.9	Q177 M182	F175-Q177 HydrophobicContact CD1-CG 3.91Å; F175-Q177 HydrophobicContact CE1-CG 3.82Å; F175-M182 HydrophobicContact CB-CE 4.03Å; F175-M182 HydrophobicContact CB-SD 3.72Å; F175-M182 HydrophobicContact CD2-SD 3.4Å; F175-M182 WeakPolarHBondContact CD2-SD 3.42Å; F175-M182 HydrophobicContact CE2-SD 4.31Å; F175-M182 HydrophobicContact CG-SD 3.88Å
176	C	51.9	Low	48.8	Very low	43 Å²	43	87.2 Å²	87.2	29%	0.291	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	109.4	173.5	177	0	0	0	0	109.4	E178 T179 G180 L181	C176-E178 VanDerWaalsContact C-N 3.28Å; C176-E178 PolarHBondContact O-N 2.79Å; C176-T179 WeakPolarHBondContact CB-OG1 3.49Å; C176-T179 PolarHBondContact O-N 3.27Å; C176-T179 PolarHBondContact SG-OG1 2.93Å; C176-G180 WeakPolarHBondContact O-CA 3.45Å; C176-G180 PolarHBondContact O-N 3.41Å; C176-L181 PolarHBondContact N-O 3.17Å
177	Q	47.8	Very low	49.3	Very low	168 Å²	168	82.3 Å²	82.3	79%	0.785	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-28.8	-176.9	-66.8	-176.1	0.8	0	0	113	F175	F175-Q177 HydrophobicContact CD1-CG 3.91Å; F175-Q177 HydrophobicContact CE1-CG 3.82Å
178	E	39.7	Very low	49.3	Very low	189 Å²	189	85.2 Å²	85.2	88%	0.883	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-31.7	-179.5	-59.9	174.2	153	0	0	113.1	C176	C176-E178 VanDerWaalsContact C-N 3.28Å; C176-E178 PolarHBondContact O-N 2.79Å
179	T	52.6	Low	49.1	Very low	87 Å²	87	83.1 Å²	83.1	53%	0.534	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-12.6	-178.2	60.7	0	0	0	0	113.8	C176 L181	C176-T179 WeakPolarHBondContact CB-OG1 3.49Å; C176-T179 PolarHBondContact O-N 3.27Å; C176-T179 PolarHBondContact SG-OG1 2.93Å; T179-L181 PolarHBondContact O-N 3.11Å
180	G	51.3	Low	49	Very low	50 Å²	50	80.8 Å²	80.8	52%	0.515	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	17.6	-175.2	0	0	0	0	0	114.2	C176	C176-G180 WeakPolarHBondContact O-CA 3.45Å; C176-G180 PolarHBondContact O-N 3.41Å
181	L	45.9	Very low	48.7	Very low	63 Å²	63	80.6 Å²	80.6	33%	0.33	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	145	-176.7	-63.5	175.1	0	0	0	112.4	C176 T179 V199	C176-L181 PolarHBondContact N-O 3.17Å; T179-L181 PolarHBondContact O-N 3.11Å; L181-V199 HydrophobicContact CD1-CG1 4.15Å
182	M	51.3	Low	48.6	Very low	55 Å²	55	80.4 Å²	80.4	27%	0.271	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	133.9	166	-52.7	-61.9	-62.3	0	0	109	L167 L173 K174 F175	L167-M182 HydrophobicContact CD2-CE 4.05Å; L173-M182 HydrophobicContact CD1-CB 4.37Å; L173-M182 HydrophobicContact CD2-CE 3.53Å; L173-M182 HydrophobicContact CG-CE 3.82Å; K174-M182 CarbonylContact O-C 3.57Å; K174-M182 WeakPolarHBondContact O-CA 3.49Å; F175-M182 HydrophobicContact CB-CE 4.03Å; F175-M182 HydrophobicContact CB-SD 3.72Å; F175-M182 HydrophobicContact CD2-SD 3.4Å; F175-M182 WeakPolarHBondContact CD2-SD 3.42Å; F175-M182 HydrophobicContact CE2-SD 4.31Å; F175-M182 HydrophobicContact CG-SD 3.88Å
183	S	48.6	Very low	48.5	Very low	36 Å²	36	85 Å²	85	25%	0.252	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	140.5	175.3	57.4	0	0	0	0	111.4	K174	K174-S183 PolarHBondContact N-O 3.42Å; K174-S183 PolarHBondContact O-N 3.49Å
184	C	52.8	Low	47.9	Very low	9 Å²	9	89.6 Å²	89.6	6%	0.061	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	145.9	165.6	173.9	0	0	0	0	109.5	W172 W186 C187 H188 H219	W172-C184 HydrophobicContact CE3-CB 4.05Å; W172-C184 HydrophobicContact CZ3-CB 4.18Å; C184-W186 PolarHBondContact O-N 3.26Å; C184-W186 PolarHBondContact SG-N 2.83Å; C184-C187 HydrophobicContact CB-CB 4.31Å; C184-C187 PolarHBondContact O-N 2.85Å; C184-H188 WeakPolarHBondContact O-CB 3.39Å; C184-H188 PolarHBondContact O-N 3.3Å; C184-H219 VanDerWaalsContact SG-CE1 3.57Å
185	S	48.7	Very low	47.5	Very low	56 Å²	56	88.9 Å²	88.9	39%	0.392	49%	0.491	S	S	.	.	H	α-helix	trans	-51.7	-34.6	174.3	52	0	0	0	0	114.2	W172 N189	W172-S185 PolarHBondContact O-N 2.99Å; S185-N189 PolarHBondContact O-ND2 2.95Å
186	W	49.3	Very low	46.7	Very low	86 Å²	86	90.5 Å²	90.5	33%	0.326	50%	0.503	S	S	.	.	H	α-helix	trans	-71.8	-52.6	175.8	-172.3	73.9	0	0	0	111.7	C184 H188 N189 I190 H213 H219	C184-W186 PolarHBondContact O-N 3.26Å; C184-W186 PolarHBondContact SG-N 2.83Å; W186-H188 PolarHBondContact O-N 2.93Å; W186-N189 PolarHBondContact O-N 3.36Å; W186-I190 HydrophobicContact CD2-CD1 3.85Å; W186-I190 HydrophobicContact CE3-CD1 3.81Å; W186-I190 HydrophobicContact CH2-CD1 3.73Å; W186-I190 HydrophobicContact CZ2-CD1 3.75Å; W186-I190 HydrophobicContact CZ3-CD1 3.75Å; W186-I190 PolarHBondContact O-N 2.88Å; W186-H213 AromaticContact CZ3-CE1 3.96Å; W186-H219 AromaticContact CE3-CD2 3.61Å; W186-H219 AromaticContact CE3-NE2 3.43Å; W186-H219 AromaticContact CZ3-CD2 3.86Å
187	C	51.8	Low	46	Very low	38 Å²	38	95 Å²	95	26%	0.257	52%	0.52	S	S	.	.	H	α-helix	trans	-57.7	-35.3	178.2	-56.1	0	0	0	0	112.7	C184 N189 I190 A191 H213	C184-C187 HydrophobicContact CB-CB 4.31Å; C184-C187 PolarHBondContact O-N 2.85Å; C187-N189 VanDerWaalsContact C-N 3.29Å; C187-N189 PolarHBondContact O-N 3.42Å; C187-I190 PolarHBondContact O-N 3.16Å; C187-I190 VanDerWaalsContact O-N 3.16Å; C187-A191 PolarHBondContact O-N 2.9Å; C187-H213 PolarHBondContact SG-CE1 2.97Å
188	H	48.8	Very low	45.7	Very low	118 Å²	118	93.4 Å²	93.4	55%	0.546	52%	0.516	S	S	.	.	H	α-helix	trans	-64.9	-30.9	178.2	-169.7	58.1	0	0	0	112.9	C184 W186	C184-H188 WeakPolarHBondContact O-CB 3.39Å; C184-H188 PolarHBondContact O-N 3.3Å; W186-H188 PolarHBondContact O-N 2.93Å
189	N	44.3	Very low	45.8	Very low	117 Å²	117	88.6 Å²	88.6	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-79.5	-13.8	174.5	-81.2	-71.6	0	0	0	114.1	S185 W186 C187 T192	S185-N189 PolarHBondContact O-ND2 2.95Å; W186-N189 PolarHBondContact O-N 3.36Å; C187-N189 VanDerWaalsContact C-N 3.29Å; C187-N189 PolarHBondContact O-N 3.42Å; N189-T192 PolarHBondContact O-OG1 3.24Å
190	I	45	Very low	45.1	Very low	82 Å²	82	92.7 Å²	92.7	42%	0.421	51%	0.51	S	S	.	.	H	α-helix	trans	-92.2	-38.9	176.1	-61.8	171.6	0	0	0	110.1	W186 C187 T192 K193 N194	W186-I190 HydrophobicContact CD2-CD1 3.85Å; W186-I190 HydrophobicContact CE3-CD1 3.81Å; W186-I190 HydrophobicContact CH2-CD1 3.73Å; W186-I190 HydrophobicContact CZ2-CD1 3.75Å; W186-I190 HydrophobicContact CZ3-CD1 3.75Å; W186-I190 PolarHBondContact O-N 2.88Å; C187-I190 PolarHBondContact O-N 3.16Å; C187-I190 VanDerWaalsContact O-N 3.16Å; I190-T192 PolarHBondContact O-N 3.26Å; I190-T192 VanDerWaalsContact O-N 3.13Å; I190-K193 PolarHBondContact O-N 2.8Å; I190-N194 PolarHBondContact O-N 2.88Å; I190-N194 VanDerWaalsContact O-N 3.14Å
191	A	42.9	Very low	44.1	Very low	71 Å²	71	91.5 Å²	91.5	59%	0.587	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-15.1	178	0	0	0	0	0	114.4	C187 K193	C187-A191 PolarHBondContact O-N 2.9Å; A191-K193 VanDerWaalsContact C-N 3.34Å
192	T	47	Very low	43.8	Very low	105 Å²	105	92.5 Å²	92.5	64%	0.644	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-4.8	171.5	52	0	0	0	0	113.7	N189 I190	N189-T192 PolarHBondContact O-OG1 3.24Å; I190-T192 PolarHBondContact O-N 3.26Å; I190-T192 VanDerWaalsContact O-N 3.13Å
193	K	47.5	Very low	43.2	Very low	178 Å²	178	99.5 Å²	99.5	77%	0.774	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.2	-25.9	180	-72.9	-170.3	174.2	-175.8	0	115.2	I190 A191	I190-K193 PolarHBondContact O-N 2.8Å; A191-K193 VanDerWaalsContact C-N 3.34Å
194	N	37.3	Very low	42.7	Very low	114 Å²	114	102.4 Å²	102.4	61%	0.61	55%	0.546	S	S	*	.			trans	-133.9	131.4	172.3	-86.6	-26.5	0	0	0	111.6	I190 D196	I190-N194 PolarHBondContact O-N 2.88Å; I190-N194 VanDerWaalsContact O-N 3.14Å; N194-D196 PolarHBondContact O-N 3.15Å
195	S	43	Very low	41.8	Very low	125 Å²	125	110.2 Å²	110.2	87%	0.874	58%	0.575	S	S	*	*			trans	-99.4	60	-174.9	61.1	0	0	0	0	112.7
196	D	33	Very low	41.6	Very low	111 Å²	111	110.5 Å²	110.5	59%	0.594	57%	0.569	S	S	*	*			trans	-77.9	144.2	-177.6	-91.7	-53.8	0	0	0	114.4	N194 L198	N194-D196 PolarHBondContact O-N 3.15Å; D196-L198 HydrophobicContact CB-CD1 4.42Å; D196-L198 PolarHBondContact O-N 2.86Å
197	E	38.1	Very low	41.2	Very low	136 Å²	136	114 Å²	114	64%	0.636	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-69.4	-2.3	-174.4	-68.8	-141.9	100	0	0	115.6	V199 K200	E197-V199 PolarHBondContact O-N 2.89Å; E197-K200 PolarHBondContact O-N 2.7Å; E197-K200 IonicContact OE1-NZ 3.53Å; E197-K200 PolarHBondContact OE1-NZ 3.2Å
198	L	40.6	Very low	40.8	Very low	136 Å²	136	115.4 Å²	115.4	71%	0.712	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-53.6	-17.9	-179	-75.2	163.8	0	0	0	114.5	D196 K200	D196-L198 HydrophobicContact CB-CD1 4.42Å; D196-L198 PolarHBondContact O-N 2.86Å; L198-K200 VanDerWaalsContact C-N 3.33Å; L198-K200 PolarHBondContact O-N 2.96Å
199	V	42	Very low	40.5	Very low	88 Å²	88	113 Å²	113	53%	0.533	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-70.3	-22.8	176.5	-172.6	0	0	0	0	113	L181 E197 G201 K206	L181-V199 HydrophobicContact CD1-CG1 4.15Å; E197-V199 PolarHBondContact O-N 2.89Å; V199-G201 VanDerWaalsContact C-N 3.27Å; V199-G201 PolarHBondContact O-N 3.26Å; V199-K206 WeakPolarHBondContact O-CE 3.28Å; V199-K206 PolarHBondContact O-NZ 3.2Å
200	K	37.7	Very low	40.6	Very low	172 Å²	172	111.3 Å²	111.3	75%	0.748	58%	0.578	S	S	*	*			trans	-85.2	39.5	-173.2	-65.7	177.9	-173.6	163.8	0	115	E197 L198	E197-K200 PolarHBondContact O-N 2.7Å; E197-K200 IonicContact OE1-NZ 3.53Å; E197-K200 PolarHBondContact OE1-NZ 3.2Å; L198-K200 VanDerWaalsContact C-N 3.33Å; L198-K200 PolarHBondContact O-N 2.96Å
201	G	30.8	Very low	40.6	Very low	25 Å²	25	113.4 Å²	113.4	26%	0.258	59%	0.59	S	S	.	*			trans	-95.6	145.5	171.1	0	0	0	0	0	114	V199 K206	V199-G201 VanDerWaalsContact C-N 3.27Å; V199-G201 PolarHBondContact O-N 3.26Å; G201-K206 WeakPolarHBondContact O-CD 3.38Å; G201-K206 WeakPolarHBondContact O-CE 3.44Å; G201-K206 PolarHBondContact O-NZ 3.47Å
202	S	38.5	Very low	40.4	Very low	84 Å²	84	119 Å²	119	59%	0.587	60%	0.596	S	S	*	*			trans	-69.1	160.4	176.8	77.2	0	0	0	0	112.8	N204 Y205 K206	S202-N204 PolarHBondContact O-N 2.99Å; S202-Y205 PolarHBondContact O-N 2.82Å; S202-K206 PolarHBondContact O-N 3.17Å
203	R	39.8	Very low	40.1	Very low	203 Å²	203	117.7 Å²	117.7	77%	0.766	58%	0.582	S	S	*	*	H	α-helix	trans	-54.2	-32.7	-168.2	-166.9	172.4	71.4	171.8	0.1	114.7
204	N	36.9	Very low	40	Very low	96 Å²	96	113.4 Å²	113.4	51%	0.513	57%	0.565	S	S	.	*	H	α-helix	trans	-85	-29	179	-68.8	-7.8	0	0	0	112.8	S202 R207	S202-N204 PolarHBondContact O-N 2.99Å; N204-R207 PolarHBondContact O-N 3.24Å
205	Y	34.4	Very low	40.4	Very low	174 Å²	174	113 Å²	113	68%	0.682	56%	0.562	S	S	*	*	H	α-helix	trans	-68.2	-37.5	177.5	-142.6	-105.3	0	0	0	111.4	S202 R207 A208 L209	S202-Y205 PolarHBondContact O-N 2.82Å; Y205-R207 VanDerWaalsContact C-N 3.32Å; Y205-R207 PolarHBondContact O-N 3.24Å; Y205-A208 PolarHBondContact O-N 2.94Å; Y205-L209 PolarHBondContact O-N 2.99Å; Y205-L209 VanDerWaalsContact O-N 3.14Å
206	K	44.8	Very low	40.8	Very low	61 Å²	61	109.5 Å²	109.5	27%	0.265	54%	0.538	S	S	.	.	H	α-helix	trans	-63	-29.7	178.6	-75.2	175.9	168.5	165.2	0	114.3	V199 G201 S202 L209 L210	V199-K206 WeakPolarHBondContact O-CE 3.28Å; V199-K206 PolarHBondContact O-NZ 3.2Å; G201-K206 WeakPolarHBondContact O-CD 3.38Å; G201-K206 WeakPolarHBondContact O-CE 3.44Å; G201-K206 PolarHBondContact O-NZ 3.47Å; S202-K206 PolarHBondContact O-N 3.17Å; K206-L209 PolarHBondContact O-N 2.9Å; K206-L210 WeakPolarHBondContact O-CG 3.27Å; K206-L210 PolarHBondContact O-N 2.83Å
207	R	41.7	Very low	41.4	Very low	159 Å²	159	108.6 Å²	108.6	60%	0.6	54%	0.54	S	S	*	.	H	α-helix	trans	-65.4	-46.8	177.4	-73.5	176.2	168.1	160.8	-8.3	112.1	N204 Y205 L209 L211	N204-R207 PolarHBondContact O-N 3.24Å; Y205-R207 VanDerWaalsContact C-N 3.32Å; Y205-R207 PolarHBondContact O-N 3.24Å; R207-L209 VanDerWaalsContact C-N 3.31Å; R207-L211 PolarHBondContact O-N 2.81Å
208	A	42.2	Very low	41.7	Very low	68 Å²	68	107.8 Å²	107.8	56%	0.562	54%	0.536	S	S	*	.	H	α-helix	trans	-66.9	-34.1	174.3	0	0	0	0	0	111.9	Y205 R212	Y205-A208 PolarHBondContact O-N 2.94Å; A208-R212 VanDerWaalsContact O-CB 3.31Å; A208-R212 WeakPolarHBondContact O-CB 3.47Å; A208-R212 PolarHBondContact O-N 3.36Å; A208-R212 VanDerWaalsContact O-N 3.07Å
209	L	43	Very low	41.9	Very low	68 Å²	68	102.2 Å²	102.2	36%	0.356	51%	0.506	S	S	.	.	H	α-helix	trans	-66.6	-42	177.5	-144.4	83.3	0	0	0	112.4	Y205 K206 R207 R212 H213	Y205-L209 PolarHBondContact O-N 2.99Å; Y205-L209 VanDerWaalsContact O-N 3.14Å; K206-L209 PolarHBondContact O-N 2.9Å; R207-L209 VanDerWaalsContact C-N 3.31Å; L209-R212 CarbonylContact O-C 3.58Å; L209-R212 PolarHBondContact O-N 3.3Å; L209-H213 VanDerWaalsContact O-CB 3.29Å; L209-H213 WeakPolarHBondContact O-CB 3.25Å; L209-H213 PolarHBondContact O-N 3.05Å
210	L	47.5	Very low	42.3	Very low	81 Å²	81	100.2 Å²	100.2	42%	0.424	50%	0.503	S	S	.	.	H	α-helix	trans	-63.5	-45.8	178.9	-80.3	163.5	0	0	0	112.5	K206 R212 H213 H214	K206-L210 WeakPolarHBondContact O-CG 3.27Å; K206-L210 PolarHBondContact O-N 2.83Å; L210-R212 VanDerWaalsContact C-N 3.34Å; L210-R212 PolarHBondContact O-N 2.88Å; L210-H213 PolarHBondContact O-N 3.35Å; L210-H214 PolarHBondContact O-N 3.38Å
211	L	43.1	Very low	42.8	Very low	127 Å²	127	101.1 Å²	101.1	67%	0.665	50%	0.502	S	S	*	.	H	α-helix	trans	-60.2	-42.7	172.1	-92.6	115.6	0	0	0	111.8	R207 H213 H214 L215	R207-L211 PolarHBondContact O-N 2.81Å; L211-H213 VanDerWaalsContact C-N 3.33Å; L211-H213 PolarHBondContact O-N 3.13Å; L211-H214 PolarHBondContact O-N 3.49Å; L211-L215 WeakPolarHBondContact O-CD1 3.44Å; L211-L215 VanDerWaalsContact O-CG 3.3Å; L211-L215 WeakPolarHBondContact O-CG 3.47Å; L211-L215 PolarHBondContact O-N 2.89Å
212	R	39.6	Very low	43.5	Very low	188 Å²	188	104.6 Å²	104.6	71%	0.709	52%	0.515	S	S	*	.	H	α-helix	trans	-66.3	-32.7	177.6	-179.8	176.6	-87.5	173	-9.4	112.9	A208 L209 L210 L215	A208-R212 VanDerWaalsContact O-CB 3.31Å; A208-R212 WeakPolarHBondContact O-CB 3.47Å; A208-R212 PolarHBondContact O-N 3.36Å; A208-R212 VanDerWaalsContact O-N 3.07Å; L209-R212 CarbonylContact O-C 3.58Å; L209-R212 PolarHBondContact O-N 3.3Å; L210-R212 VanDerWaalsContact C-N 3.34Å; L210-R212 PolarHBondContact O-N 2.88Å; R212-L215 PolarHBondContact O-N 2.95Å
213	H	40.2	Very low	43.6	Very low	78 Å²	78	102.5 Å²	102.5	36%	0.361	50%	0.497	S	S	.	.	H	α-helix	trans	-73.9	-38	178.5	-167.7	-77.6	0	0	0	111.9	W186 C187 L209 L210 L211 L215 S216 H219	W186-H213 AromaticContact CZ3-CE1 3.96Å; C187-H213 PolarHBondContact SG-CE1 2.97Å; L209-H213 VanDerWaalsContact O-CB 3.29Å; L209-H213 WeakPolarHBondContact O-CB 3.25Å; L209-H213 PolarHBondContact O-N 3.05Å; L210-H213 PolarHBondContact O-N 3.35Å; L211-H213 VanDerWaalsContact C-N 3.33Å; L211-H213 PolarHBondContact O-N 3.13Å; H213-L215 PolarHBondContact O-N 2.82Å; H213-S216 WeakPolarHBondContact O-CB 3.42Å; H213-S216 PolarHBondContact O-N 3.16Å; H213-S216 VanDerWaalsContact O-N 3.14Å; H213-H219 AromaticContact CE1-CD2 3.52Å; H213-H219 AromaticContact CE1-NE2 3.83Å; H213-H219 AromaticContact ND1-CD2 3.44Å; H213-H219 PolarHBondContact ND1-CD2 3.19Å; H213-H219 AromaticContact ND1-NE2 3.87Å
214	H	46.1	Very low	43.7	Very low	87 Å²	87	98 Å²	98	40%	0.403	49%	0.494	S	S	.	.	H	α-helix	trans	-71.3	-17.2	175.4	-154.4	44.6	0	0	0	112.9	W172 L210 L211	W172-H214 AromaticContact CE2-CE1 3.97Å; W172-H214 AromaticContact CH2-CE1 3.63Å; W172-H214 AromaticContact CH2-ND1 3.86Å; W172-H214 AromaticContact CH2-NE2 3.83Å; W172-H214 AromaticContact CZ2-CE1 3.33Å; W172-H214 WeakPolarHBondContact CZ2-CE1 3.22Å; W172-H214 AromaticContact CZ2-NE2 3.34Å; W172-H214 VanDerWaalsContact CZ2-NE2 3.34Å; W172-H214 WeakPolarHBondContact CZ2-NE2 3.41Å; L210-H214 PolarHBondContact O-N 3.38Å; L211-H214 PolarHBondContact O-N 3.49Å
215	L	46.3	Very low	44	Very low	107 Å²	107	99 Å²	99	56%	0.56	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	3.8	170.7	-68.7	165.7	0	0	0	113.8	L211 R212 H213 Y256	L211-L215 WeakPolarHBondContact O-CD1 3.44Å; L211-L215 VanDerWaalsContact O-CG 3.3Å; L211-L215 WeakPolarHBondContact O-CG 3.47Å; L211-L215 PolarHBondContact O-N 2.89Å; R212-L215 PolarHBondContact O-N 2.95Å; H213-L215 PolarHBondContact O-N 2.82Å; L215-Y256 WeakPolarHBondContact CD1-OH 3.32Å; L215-Y256 HydrophobicContact CD2-CE2 4.2Å
216	S	50.3	Low	44.7	Very low	51 Å²	51	97.9 Å²	97.9	36%	0.357	50%	0.503	S	S	.	.	S	Bend	trans	-73.3	135.3	170.7	-173.2	0	0	0	0	110.9	H213 E218 H219	H213-S216 WeakPolarHBondContact O-CB 3.42Å; H213-S216 PolarHBondContact O-N 3.16Å; H213-S216 VanDerWaalsContact O-N 3.14Å; S216-E218 PolarHBondContact O-N 3.12Å; S216-H219 PolarHBondContact O-N 3.28Å
217	S	45.4	Very low	44.7	Very low	91 Å²	91	102.4 Å²	102.4	64%	0.636	53%	0.525	S	S	*	.	H	α-helix	trans	-57.7	-33.8	-175.8	-172	0	0	0	0	113.1	H219 R221	S217-H219 VanDerWaalsContact C-N 3.29Å; S217-H219 PolarHBondContact O-N 2.99Å; S217-R221 WeakPolarHBondContact O-CG 3.48Å
218	E	44.3	Very low	44.5	Very low	119 Å²	119	103.5 Å²	103.5	56%	0.556	54%	0.537	S	S	*	.	H	α-helix	trans	-65	-32.4	178.8	-57.3	-178.4	140	0	0	112.9	S216 R221 N222	S216-E218 PolarHBondContact O-N 3.12Å; E218-R221 PolarHBondContact O-N 3.2Å; E218-N222 PolarHBondContact O-ND2 3.38Å
219	H	45.9	Very low	43.9	Very low	19 Å²	19	107.1 Å²	107.1	9%	0.088	55%	0.552	C	S	.	*	H	α-helix	trans	-79.7	-31.8	-172.7	-139.9	-48.2	0	0	0	112.4	C184 W186 H213 S216 S217 R221	C184-H219 VanDerWaalsContact SG-CE1 3.57Å; W186-H219 AromaticContact CE3-CD2 3.61Å; W186-H219 AromaticContact CE3-NE2 3.43Å; W186-H219 AromaticContact CZ3-CD2 3.86Å; H213-H219 AromaticContact CE1-CD2 3.52Å; H213-H219 AromaticContact CE1-NE2 3.83Å; H213-H219 AromaticContact ND1-CD2 3.44Å; H213-H219 PolarHBondContact ND1-CD2 3.19Å; H213-H219 AromaticContact ND1-NE2 3.87Å; S216-H219 PolarHBondContact O-N 3.28Å; S217-H219 VanDerWaalsContact C-N 3.29Å; S217-H219 PolarHBondContact O-N 2.99Å; H219-R221 VanDerWaalsContact C-N 3.31Å
220	G	50.6	Low	43.4	Very low	46 Å²	46	110.3 Å²	110.3	47%	0.474	57%	0.574	S	S	.	*	H	α-helix	trans	-77.1	-12.7	174	0	0	0	0	0	114.4
221	R	47.6	Very low	42.7	Very low	192 Å²	192	117.3 Å²	117.3	73%	0.725	60%	0.595	S	S	*	*	H	α-helix	trans	-86.9	-17.6	176	-67.2	172	80.7	134.2	4	113.2	S217 E218 H219	S217-R221 WeakPolarHBondContact O-CG 3.48Å; E218-R221 PolarHBondContact O-N 3.2Å; H219-R221 VanDerWaalsContact C-N 3.31Å
222	N	44.5	Very low	42.2	Very low	98 Å²	98	117.1 Å²	117.1	52%	0.524	60%	0.601	S	S	.	*	S	Bend	trans	-108.3	27.5	177.6	-67	-71.9	0	0	0	112	E218 P224	E218-N222 PolarHBondContact O-ND2 3.38Å; N222-P224 WeakPolarHBondContact O-CD 3.39Å
223	D	42	Very low	41.9	Very low	40 Å²	40	113.2 Å²	113.2	21%	0.214	60%	0.603	C	S	.	*			trans	-76.3	111	171.9	-179.9	-5.6	0	0	0	109.3	T225 K226	D223-T225 VanDerWaalsContact CG-OG1 3.24Å; D223-T225 PolarHBondContact O-N 3.25Å; D223-T225 VanDerWaalsContact O-N 3.12Å; D223-T225 WeakPolarHBondContact OD1-CB 3.48Å; D223-T225 PolarHBondContact OD1-N 3.14Å; D223-T225 PolarHBondContact OD1-OG1 3.25Å; D223-T225 PolarHBondContact OD2-OG1 2.84Å; D223-K226 PolarHBondContact O-N 2.89Å; D223-K226 VanDerWaalsContact O-N 3.1Å; D223-K226 IonicContact OD2-NZ 3.93Å; D223-K226 PolarHBondContact OD2-NZ 2.69Å
224	P	41.1	Very low	41.3	Very low	109 Å²	109	117 Å²	117	71%	0.708	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-66.5	-14.5	-176.5	29.1	-35.5	0	0	0	112.7	N222 K226	N222-P224 WeakPolarHBondContact O-CD 3.39Å; P224-K226 PolarHBondContact O-N 2.89Å
225	T	44.2	Very low	40.6	Very low	117 Å²	117	119.9 Å²	119.9	72%	0.718	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-78.6	-0.3	175.6	68.7	0	0	0	0	113.6	D223	D223-T225 VanDerWaalsContact CG-OG1 3.24Å; D223-T225 PolarHBondContact O-N 3.25Å; D223-T225 VanDerWaalsContact O-N 3.12Å; D223-T225 WeakPolarHBondContact OD1-CB 3.48Å; D223-T225 PolarHBondContact OD1-N 3.14Å; D223-T225 PolarHBondContact OD1-OG1 3.25Å; D223-T225 PolarHBondContact OD2-OG1 2.84Å
226	K	49.1	Very low	39.6	Very low	149 Å²	149	121 Å²	121	65%	0.648	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-121.9	6.1	-177.3	-65	-170.9	179.8	103.1	0	114.9	D223 P224 E228	D223-K226 PolarHBondContact O-N 2.89Å; D223-K226 VanDerWaalsContact O-N 3.1Å; D223-K226 IonicContact OD2-NZ 3.93Å; D223-K226 PolarHBondContact OD2-NZ 2.69Å; P224-K226 PolarHBondContact O-N 2.89Å; K226-E228 VanDerWaalsContact C-N 3.34Å; K226-E228 PolarHBondContact O-N 2.96Å
227	Q	44.1	Very low	38.7	Very low	156 Å²	156	124.3 Å²	124.3	73%	0.729	68%	0.679	S	S	*	*	S	Bend	trans	-94.9	41.4	174.4	-73.1	-162.8	-10.1	0	0	113.3
228	E	37.1	Very low	38.2	Very low	183 Å²	183	125.8 Å²	125.8	86%	0.855	69%	0.686	S	S	*	*			trans	-147.8	87.9	169.2	-138.9	165.5	-135.6	0	0	112.5	K226	K226-E228 VanDerWaalsContact C-N 3.34Å; K226-E228 PolarHBondContact O-N 2.96Å
229	T	30.6	Very low	37.4	Very low	144 Å²	144	124.9 Å²	124.9	88%	0.883	69%	0.693	S	S	*	*			trans	-160.5	100.5	156.3	-7.6	0	0	0	0	109.2
230	V	31.6	Very low	36.7	Very low	135 Å²	135	129.1 Å²	129.1	82%	0.818	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-74.4	139.1	-179.8	172.6	0	0	0	0	110.1	P232	V230-P232 WeakPolarHBondContact O-CD 3.45Å
231	R	32.9	Very low	36	Very low	227 Å²	227	134.1 Å²	134.1	86%	0.857	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-70.8	139.3	169	-70.5	-178	175.5	-175.5	-2.5	110.8
232	P	31.8	Very low	34.9	Very low	124 Å²	124	131 Å²	131	81%	0.805	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-100.2	145.5	132.8	-12.2	29.9	0	0	0	110.3	V230	V230-P232 WeakPolarHBondContact O-CD 3.45Å
233	S	33.3	Very low	34.1	Very low	105 Å²	105	130.1 Å²	130.1	73%	0.734	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-83.1	148.5	159.9	-56.8	0	0	0	0	108.8
234	D	27.7	Very low	33.8	Very low	159 Å²	159	137.3 Å²	137.3	85%	0.85	78%	0.776	S	S	*	*			trans	-153.7	156.8	140.2	-124.3	-33.3	0	0	0	112.2
235	N	31.8	Very low	33.4	Very low	147 Å²	147	137.5 Å²	137.5	79%	0.786	77%	0.771	S	S	*	*			trans	-93.7	129.7	-171.1	-59.7	-67.7	0	0	0	112.2
236	T	25.3	Very low	32.7	Very low	130 Å²	130	137 Å²	137	80%	0.798	76%	0.764	S	S	*	*			trans	-161	123.2	146.9	-71.6	0	0	0	0	109.4
237	S	31.5	Very low	31.9	Very low	121 Å²	121	140.2 Å²	140.2	85%	0.846	77%	0.774	S	S	*	*			trans	-93.6	141	163.1	-58.6	0	0	0	0	109.4
238	P	34.6	Very low	31.3	Very low	121 Å²	121	141.7 Å²	141.7	79%	0.786	77%	0.772	S	S	*	*				-121.2	158.5	129.1	-3.8	24.5	0	0	0	112.2
239	S	28.7	Very low	31.2	Very low	101 Å²	101	137.2 Å²	137.2	71%	0.706	75%	0.754	S	S	*	*			trans	-91.3	-178.8	-174.3	57.7	0	0	0	0	114
240	T	30.3	Very low	31.5	Very low	108 Å²	108	138 Å²	138	66%	0.663	75%	0.746	S	S	*	*			trans	73.7	106.7	150.4	32	0	0	0	0	119.7
241	N	35.5	Very low	31.9	Very low	151 Å²	151	134.4 Å²	134.4	81%	0.807	73%	0.725	S	S	*	*			trans	72.5	87.9	133.8	-54.5	-3.1	0	0	0	119.7
242	C	24.3	Very low	32.6	Very low	127 Å²	127	126.5 Å²	126.5	86%	0.858	70%	0.7	S	S	*	*			trans	-121.9	146.7	149	-72.6	0	0	0	0	109.3
243	S	29	Very low	33.5	Very low	78 Å²	78	125.6 Å²	125.6	55%	0.545	69%	0.685	S	S	.	*			trans	-69.8	149.2	-173.7	-164.4	0	0	0	0	113.5	D245	S243-D245 PolarHBondContact O-N 3.25Å; S243-D245 PolarHBondContact OG-OD2 3.48Å
244	E	34.7	Very low	34.2	Very low	191 Å²	191	128.4 Å²	128.4	89%	0.893	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-69.9	-12.2	176.1	-140.8	164	124.5	0	0	113.1	D246	E244-D246 VanDerWaalsContact C-N 3.33Å; E244-D246 PolarHBondContact O-N 2.85Å
245	D	32.4	Very low	35.9	Very low	114 Å²	114	122.2 Å²	122.2	61%	0.61	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-64.8	-29.1	178.1	-64.8	-69.6	0	0	0	114.4	S243 Y247 R248	S243-D245 PolarHBondContact O-N 3.25Å; S243-D245 PolarHBondContact OG-OD2 3.48Å; D245-Y247 PolarHBondContact O-N 2.86Å; D245-Y247 VanDerWaalsContact O-N 3.17Å; D245-R248 PolarHBondContact O-N 3.35Å
246	D	29.3	Very low	37.4	Very low	107 Å²	107	121.5 Å²	121.5	57%	0.572	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-69.6	-17.5	-168.1	-111.2	-20.3	0	0	0	113.9	E244 R248	E244-D246 VanDerWaalsContact C-N 3.33Å; E244-D246 PolarHBondContact O-N 2.85Å; D246-R248 VanDerWaalsContact C-N 3.34Å
247	Y	33.3	Very low	39.4	Very low	216 Å²	216	116.3 Å²	116.3	85%	0.847	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-75.7	-17.5	177	-104.9	-80.5	0	0	0	114	D245	D245-Y247 PolarHBondContact O-N 2.86Å; D245-Y247 VanDerWaalsContact O-N 3.17Å
248	R	32.3	Very low	41.1	Very low	186 Å²	186	113.4 Å²	113.4	70%	0.702	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-89	-14.7	-176.3	-135	-166.8	-155.9	-162.5	14.9	114.4	D245 D246 D404	D245-R248 PolarHBondContact O-N 3.35Å; D246-R248 VanDerWaalsContact C-N 3.34Å; R248-D404 IonicContact NH1-OD1 2.66Å; R248-D404 IonicContact NH1-OD2 3.71Å; R248-D404 IonicContact NH2-OD2 2.9Å; R248-D404 PolarHBondContact NH2-OD2 3.47Å
249	N	34.2	Very low	43.1	Very low	89 Å²	89	113.5 Å²	113.5	48%	0.476	58%	0.578	S	S	.	*	S	Bend	trans	-106.9	-2.2	-168.4	-62.8	-51.6	0	0	0	115.1	Q393	N249-Q393 PolarHBondContact OD1-NE2 2.94Å
250	K	36.5	Very low	45.6	Very low	161 Å²	161	111.5 Å²	111.5	70%	0.7	56%	0.559	S	S	*	*	S	Bend	trans	-76.5	136.6	173.1	-76.7	173.3	-179.4	164.5	0	110.9
251	P	39.6	Very low	48.1	Very low	59 Å²	59	106.7 Å²	106.7	38%	0.383	53%	0.529	S	S	.	.			trans	-65.2	148.2	-178.4	28.7	-36.1	0	0	0	111.7	E253	P251-E253 HydrophobicContact CB-CG 4.12Å; P251-E253 WeakPolarHBondContact CB-OE1 3.44Å; P251-E253 HydrophobicContact CG-CG 4.26Å; P251-E253 WeakPolarHBondContact CG-OE1 3.48Å; P251-E253 PolarHBondContact O-N 3.29Å
252	N	49.6	Very low	50.2	Low	62 Å²	62	104 Å²	104	33%	0.332	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-78.8	32.8	-176.6	71.5	-20.7	0	0	0	113.6	N254 S255	N252-N254 PolarHBondContact O-N 3.4Å; N252-S255 WeakPolarHBondContact O-CB 3.38Å; N252-S255 PolarHBondContact O-N 3.13Å; N252-S255 PolarHBondContact O-OG 3.05Å
253	E	49.4	Very low	53	Low	104 Å²	104	101.6 Å²	101.6	49%	0.486	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-60.2	-33.7	-179.4	-73.7	158.1	-159.1	0	0	111.5	P251 S255 Y258	P251-E253 HydrophobicContact CB-CG 4.12Å; P251-E253 WeakPolarHBondContact CB-OE1 3.44Å; P251-E253 HydrophobicContact CG-CG 4.26Å; P251-E253 WeakPolarHBondContact CG-OE1 3.48Å; P251-E253 PolarHBondContact O-N 3.29Å; E253-S255 PolarHBondContact O-N 2.85Å; E253-Y258 HydrophobicContact CG-CE1 4.48Å
254	N	47.3	Very low	55.7	Low	164 Å²	164	99.8 Å²	99.8	88%	0.877	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-80.7	8.4	172.5	-68.3	-11.6	0	0	0	114.1	N252	N252-N254 PolarHBondContact O-N 3.4Å
255	S	64.2	Low	58	Low	30 Å²	30	91.7 Å²	91.7	21%	0.21	44%	0.435	C	S	.	.			trans	-78.1	127.5	176.8	72	0	0	0	0	111.1	N252 E253 C257 Y258 Q259	N252-S255 WeakPolarHBondContact O-CB 3.38Å; N252-S255 PolarHBondContact O-N 3.13Å; N252-S255 PolarHBondContact O-OG 3.05Å; E253-S255 PolarHBondContact O-N 2.85Å; S255-C257 PolarHBondContact O-N 2.97Å; S255-Y258 PolarHBondContact O-N 2.95Å; S255-Y258 WeakPolarHBondContact OG-CB 3.48Å; S255-Q259 PolarHBondContact O-N 3.16Å; S255-Q259 VanDerWaalsContact O-N 3.09Å
256	Y	64.5	Low	60.5	Low	131 Å²	131	91.3 Å²	91.3	51%	0.514	43%	0.428	S	S	.	.	H	α-helix	trans	-49.6	-32.8	178	176.9	-100.3	0	0	0	113.5	L215 L260	L215-Y256 WeakPolarHBondContact CD1-OH 3.32Å; L215-Y256 HydrophobicContact CD2-CE2 4.2Å; Y256-L260 HydrophobicContact CE1-CD2 4.46Å; Y256-L260 WeakPolarHBondContact O-CB 3.25Å; Y256-L260 PolarHBondContact O-N 3.02Å
257	C	66.2	Low	63.1	Low	22 Å²	22	88.4 Å²	88.4	15%	0.149	41%	0.411	C	S	.	.	H	α-helix	trans	-68.5	-38.4	176.7	-64.6	0	0	0	0	113.3	S255 L261 T413 L416	S255-C257 PolarHBondContact O-N 2.97Å; C257-L261 WeakPolarHBondContact O-CB 3.14Å; C257-L261 PolarHBondContact O-N 3.11Å; C257-L261 VanDerWaalsContact O-N 3.14Å; C257-T413 HydrophobicContact CB-CG2 3.84Å; C257-L416 HydrophobicContact CB-CD1 3.73Å
258	Y	68.3	Low	65.6	Low	59 Å²	59	79.3 Å²	79.3	23%	0.231	38%	0.375	C	S	.	.	H	α-helix	trans	-72.9	-45.6	177.7	-178	-105.3	0	0	0	110.7	E253 S255 L260 L261 Q262	E253-Y258 HydrophobicContact CG-CE1 4.48Å; S255-Y258 PolarHBondContact O-N 2.95Å; S255-Y258 WeakPolarHBondContact OG-CB 3.48Å; Y258-L260 VanDerWaalsContact C-N 3.32Å; Y258-L260 PolarHBondContact O-N 3.5Å; Y258-L261 PolarHBondContact O-N 2.87Å; Y258-L261 VanDerWaalsContact O-N 3.11Å; Y258-Q262 PolarHBondContact O-N 3.14Å
259	Q	75.3	Confident	68.1	Low	123 Å²	123	77.2 Å²	77.2	58%	0.575	37%	0.371	S	S	*	.	H	α-helix	trans	-59.6	-41.2	175.6	-164.9	178.9	28.1	0	0	112.1	S255 Q262 E263	S255-Q259 PolarHBondContact O-N 3.16Å; S255-Q259 VanDerWaalsContact O-N 3.09Å; Q259-Q262 PolarHBondContact O-N 3.06Å; Q259-E263 PolarHBondContact O-N 3.26Å
260	L	81.3	Confident	70.2	Confident	59 Å²	59	76.4 Å²	76.4	31%	0.309	37%	0.372	S	S	.	.	H	α-helix	trans	-63.6	-40.7	173.6	178	62.3	0	0	0	112.5	Y256 Y258 E263 L264 L416	Y256-L260 HydrophobicContact CE1-CD2 4.46Å; Y256-L260 WeakPolarHBondContact O-CB 3.25Å; Y256-L260 PolarHBondContact O-N 3.02Å; Y258-L260 VanDerWaalsContact C-N 3.32Å; Y258-L260 PolarHBondContact O-N 3.5Å; L260-E263 PolarHBondContact O-N 3.26Å; L260-L264 HydrophobicContact CD1-CD1 4.45Å; L260-L264 HydrophobicContact CG-CD1 4.3Å; L260-L264 WeakPolarHBondContact O-CG 3.5Å; L260-L264 PolarHBondContact O-N 3.23Å; L260-L416 HydrophobicContact CD2-CD1 4.22Å; L260-L416 HydrophobicContact CD2-CD2 4.01Å
261	L	82.6	Confident	72	Confident	8 Å²	8	69.7 Å²	69.7	4%	0.042	35%	0.349	C	S	.	.	H	α-helix	trans	-68.6	-40.1	179.1	-159.2	74.3	0	0	0	111.3	C257 Y258 E263 L264 D265 I291 Y335 F410	C257-L261 WeakPolarHBondContact O-CB 3.14Å; C257-L261 PolarHBondContact O-N 3.11Å; C257-L261 VanDerWaalsContact O-N 3.14Å; Y258-L261 PolarHBondContact O-N 2.87Å; Y258-L261 VanDerWaalsContact O-N 3.11Å; L261-E263 VanDerWaalsContact C-N 3.33Å; L261-E263 PolarHBondContact O-N 3.38Å; L261-L264 PolarHBondContact O-N 2.9Å; L261-D265 PolarHBondContact O-N 3.43Å; L261-I291 HydrophobicContact CD1-CD1 3.91Å; L261-Y335 WeakPolarHBondContact CD2-O 3.33Å; L261-Y335 WeakPolarHBondContact CG-O 3.46Å; L261-F410 HydrophobicContact CD2-CE1 4.25Å
262	Q	80.2	Confident	73.4	Confident	94 Å²	94	71.4 Å²	71.4	44%	0.439	35%	0.354	S	S	.	.	H	α-helix	trans	-62.3	-38.1	173.1	-168	-170.7	46	0	0	112.1	Y258 Q259 D265 K266	Y258-Q262 PolarHBondContact O-N 3.14Å; Q259-Q262 PolarHBondContact O-N 3.06Å; Q262-D265 WeakPolarHBondContact O-CB 3.41Å; Q262-D265 PolarHBondContact O-N 2.98Å; Q262-K266 PolarHBondContact O-N 2.94Å
263	E	82.9	Confident	74.4	Confident	77 Å²	77	74.2 Å²	74.2	36%	0.36	37%	0.368	S	S	.	.	H	α-helix	trans	-70.3	-37.9	175.8	-165.8	53.9	-128.5	0	0	112	Q259 L260 L261 D265 K266 Q267	Q259-E263 PolarHBondContact O-N 3.26Å; L260-E263 PolarHBondContact O-N 3.26Å; L261-E263 VanDerWaalsContact C-N 3.33Å; L261-E263 PolarHBondContact O-N 3.38Å; E263-D265 PolarHBondContact O-N 3.36Å; E263-K266 PolarHBondContact O-N 3.03Å; E263-K266 WeakPolarHBondContact OE2-CD 3.43Å; E263-K266 WeakPolarHBondContact OE2-CE 3.45Å; E263-K266 IonicContact OE2-NZ 3.89Å; E263-K266 PolarHBondContact OE2-NZ 3.45Å; E263-Q267 WeakPolarHBondContact O-CG 3.43Å; E263-Q267 PolarHBondContact O-N 3.14Å
264	L	84.8	Confident	75.9	Confident	39 Å²	39	70.1 Å²	70.1	20%	0.204	35%	0.351	C	S	.	.	H	α-helix	trans	-64.4	-28.3	170.2	-69.6	170.2	0	0	0	112.2	L260 L261 Q267 R268 H288 I291 Y335	L260-L264 HydrophobicContact CD1-CD1 4.45Å; L260-L264 HydrophobicContact CG-CD1 4.3Å; L260-L264 WeakPolarHBondContact O-CG 3.5Å; L260-L264 PolarHBondContact O-N 3.23Å; L261-L264 PolarHBondContact O-N 2.9Å; L264-Q267 PolarHBondContact O-N 2.89Å; L264-R268 WeakPolarHBondContact O-CB 3.26Å; L264-R268 PolarHBondContact O-N 3.3Å; L264-H288 VanDerWaalsContact C-CE1 3.44Å; L264-H288 PolarHBondContact O-CE1 3.46Å; L264-I291 HydrophobicContact CD1-CD1 4.08Å; L264-Y335 HydrophobicContact CB-CD1 4.4Å; L264-Y335 HydrophobicContact CB-CE1 4.23Å; L264-Y335 WeakPolarHBondContact O-CE1 3.08Å
265	D	84.5	Confident	77.5	Confident	22 Å²	22	65.9 Å²	65.9	12%	0.118	33%	0.328	C	S	.	.	H	α-helix	trans	-70.7	-41	172.1	-172.6	45	0	0	0	112.9	L261 Q262 E263 Q267 R268 K269 Y335	L261-D265 PolarHBondContact O-N 3.43Å; Q262-D265 WeakPolarHBondContact O-CB 3.41Å; Q262-D265 PolarHBondContact O-N 2.98Å; E263-D265 PolarHBondContact O-N 3.36Å; D265-Q267 VanDerWaalsContact C-N 3.28Å; D265-Q267 PolarHBondContact O-N 3.2Å; D265-R268 WeakPolarHBondContact O-CB 3.49Å; D265-R268 PolarHBondContact O-N 3.22Å; D265-R268 IonicContact OD1-CZ 2.68Å; D265-R268 IonicContact OD1-NE 2.67Å; D265-R268 PolarHBondContact OD1-NE 2.91Å; D265-R268 IonicContact OD1-NH2 2.74Å; D265-R268 PolarHBondContact OD1-NH2 2.96Å; D265-K269 WeakPolarHBondContact O-CB 3.21Å; D265-K269 WeakPolarHBondContact O-CG 3.42Å; D265-K269 PolarHBondContact O-N 2.81Å; D265-K269 WeakPolarHBondContact OD1-CE 3.17Å; D265-K269 IonicContact OD1-NZ 2.68Å; D265-K269 VanDerWaalsContact OD2-CE 3.27Å; D265-K269 WeakPolarHBondContact OD2-CE 3.44Å; D265-K269 IonicContact OD2-NZ 3.66Å; D265-K269 PolarHBondContact OD2-NZ 3.22Å; D265-Y335 HydrophobicContact CB-CD1 4.12Å
266	K	83.9	Confident	78.5	Confident	105 Å²	105	64.4 Å²	64.4	46%	0.457	32%	0.318	S	S	.	.	H	α-helix	trans	-60	-40.6	170.5	-62.8	178.1	-153.1	160.5	0	111.1	Q262 E263 K269 S270	Q262-K266 PolarHBondContact O-N 2.94Å; E263-K266 PolarHBondContact O-N 3.03Å; E263-K266 WeakPolarHBondContact OE2-CD 3.43Å; E263-K266 WeakPolarHBondContact OE2-CE 3.45Å; E263-K266 IonicContact OE2-NZ 3.89Å; E263-K266 PolarHBondContact OE2-NZ 3.45Å; K266-K269 PolarHBondContact O-N 3.07Å; K266-S270 WeakPolarHBondContact O-CB 3.33Å; K266-S270 PolarHBondContact O-N 3.02Å; K266-S270 PolarHBondContact O-OG 3.4Å
267	Q	83.9	Confident	79.6	Confident	46 Å²	46	59.8 Å²	59.8	22%	0.215	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-41.3	175.4	-69.2	171.2	31.2	0	0	111.9	E263 L264 D265 S270 G271 I272 H288	E263-Q267 WeakPolarHBondContact O-CG 3.43Å; E263-Q267 PolarHBondContact O-N 3.14Å; L264-Q267 PolarHBondContact O-N 2.89Å; D265-Q267 VanDerWaalsContact C-N 3.28Å; D265-Q267 PolarHBondContact O-N 3.2Å; Q267-S270 WeakPolarHBondContact CA-OG 3.43Å; Q267-S270 PolarHBondContact O-OG 3.36Å; Q267-G271 CarbonylContact O-C 3.57Å; Q267-G271 PolarHBondContact O-N 2.85Å; Q267-I272 PolarHBondContact O-N 3.24Å; Q267-H288 VanDerWaalsContact C-CE1 3.41Å; Q267-H288 WeakPolarHBondContact CB-CE1 3.09Å
268	R	86	Confident	80.7	Confident	25 Å²	25	58.8 Å²	58.8	9%	0.094	30%	0.295	C	S	.	.	H	α-helix	trans	-56.5	-51.8	171.6	178.8	-177.9	68.2	127.2	-4.7	111.4	L264 D265 G271 R286 H288 D332 Y335	L264-R268 WeakPolarHBondContact O-CB 3.26Å; L264-R268 PolarHBondContact O-N 3.3Å; D265-R268 WeakPolarHBondContact O-CB 3.49Å; D265-R268 PolarHBondContact O-N 3.22Å; D265-R268 IonicContact OD1-CZ 2.68Å; D265-R268 IonicContact OD1-NE 2.67Å; D265-R268 PolarHBondContact OD1-NE 2.91Å; D265-R268 IonicContact OD1-NH2 2.74Å; D265-R268 PolarHBondContact OD1-NH2 2.96Å; R268-G271 PolarHBondContact O-N 3.12Å; R268-R286 WeakPolarHBondContact CG-O 3.18Å; R268-H288 PolarHBondContact N-CE1 3.35Å; R268-D332 IonicContact CZ-OD1 2.69Å; R268-D332 IonicContact NH1-OD1 2.75Å; R268-D332 PolarHBondContact NH1-OD1 3.49Å; R268-D332 IonicContact NH2-OD1 2.71Å; R268-D332 PolarHBondContact NH2-OD1 3.28Å; R268-Y335 HydrophobicContact CB-CD1 4.28Å; R268-Y335 HydrophobicContact CB-CE1 3.86Å; R268-Y335 HydrophobicContact CG-CE1 4.41Å
269	K	85.4	Confident	81.6	Confident	142 Å²	142	57 Å²	57	62%	0.617	29%	0.291	S	S	*	.	H	α-helix	trans	-68.8	-34.8	-175.6	-73.7	168.4	173.7	166.9	0	113.4	D265 K266 G271	D265-K269 WeakPolarHBondContact O-CB 3.21Å; D265-K269 WeakPolarHBondContact O-CG 3.42Å; D265-K269 PolarHBondContact O-N 2.81Å; D265-K269 WeakPolarHBondContact OD1-CE 3.17Å; D265-K269 IonicContact OD1-NZ 2.68Å; D265-K269 VanDerWaalsContact OD2-CE 3.27Å; D265-K269 WeakPolarHBondContact OD2-CE 3.44Å; D265-K269 IonicContact OD2-NZ 3.66Å; D265-K269 PolarHBondContact OD2-NZ 3.22Å; K266-K269 PolarHBondContact O-N 3.07Å; K269-G271 VanDerWaalsContact C-N 3.26Å; K269-G271 PolarHBondContact O-N 3.07Å
270	S	78.1	Confident	82.3	Confident	72 Å²	72	51.2 Å²	51.2	50%	0.503	26%	0.263	S	S	.	.	H	α-helix	trans	-78.5	-6.5	170.5	54.8	0	0	0	0	113.7	K266 Q267 I272	K266-S270 WeakPolarHBondContact O-CB 3.33Å; K266-S270 PolarHBondContact O-N 3.02Å; K266-S270 PolarHBondContact O-OG 3.4Å; Q267-S270 WeakPolarHBondContact CA-OG 3.43Å; Q267-S270 PolarHBondContact O-OG 3.36Å; S270-I272 PolarHBondContact O-N 3.45Å; S270-I272 WeakPolarHBondContact OG-CD1 3.2Å; S270-I272 WeakPolarHBondContact OG-CG1 3.1Å
271	G	74.3	Confident	82.4	Confident	20 Å²	20	52.3 Å²	52.3	21%	0.206	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	15.6	-177.2	0	0	0	0	0	114.4	Q267 R268 K269	Q267-G271 CarbonylContact O-C 3.57Å; Q267-G271 PolarHBondContact O-N 2.85Å; R268-G271 PolarHBondContact O-N 3.12Å; K269-G271 VanDerWaalsContact C-N 3.26Å; K269-G271 PolarHBondContact O-N 3.07Å
272	I	68.4	Low	82.3	Confident	95 Å²	95	55 Å²	55	49%	0.487	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	137.7	-178.9	-66.1	176.2	0	0	0	109.6	Q267 S270 C274 H288	Q267-I272 PolarHBondContact O-N 3.24Å; S270-I272 PolarHBondContact O-N 3.45Å; S270-I272 WeakPolarHBondContact OG-CD1 3.2Å; S270-I272 WeakPolarHBondContact OG-CG1 3.1Å; I272-C274 PolarHBondContact O-N 3.1Å; I272-C274 PolarHBondContact O-SG 3.03Å; I272-H288 PolarHBondContact O-NE2 3.47Å
273	L	70.8	Confident	82.6	Confident	122 Å²	122	55.8 Å²	55.8	64%	0.639	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	14.6	179.4	-63.9	169.8	0	0	0	116	D275 H288	L273-D275 PolarHBondContact O-N 2.88Å; L273-D275 VanDerWaalsContact O-N 3.11Å; L273-H288 PolarHBondContact O-CD2 3.41Å; L273-H288 VanDerWaalsContact O-CD2 3.23Å; L273-H288 PolarHBondContact O-NE2 2.94Å
274	C	81.6	Confident	82.8	Confident	18 Å²	18	56.4 Å²	56.4	12%	0.122	32%	0.318	C	S	.	.			trans	-74.5	99.5	-178.6	-67.8	0	0	0	0	112.5	I272 V276 R286 A287 H288	I272-C274 PolarHBondContact O-N 3.1Å; I272-C274 PolarHBondContact O-SG 3.03Å; C274-V276 PolarHBondContact O-N 2.91Å; C274-R286 HydrophobicContact CB-CB 4Å; C274-A287 CarbonylContact C-O 3.59Å; C274-A287 WeakPolarHBondContact CA-O 3.5Å; C274-H288 PolarHBondContact N-NE2 3.09Å
275	D	80.7	Confident	83.1	Confident	74 Å²	74	55.8 Å²	55.8	40%	0.396	31%	0.313	S	S	.	.			trans	-69.5	-9	-178.8	-55.2	-57.2	0	0	0	115.3	L273 A287 K289 T315	L273-D275 PolarHBondContact O-N 2.88Å; L273-D275 VanDerWaalsContact O-N 3.11Å; D275-A287 PolarHBondContact N-O 2.84Å; D275-K289 HydrophobicContact CB-CD 3.74Å; D275-K289 HydrophobicContact CB-CG 4.02Å; D275-K289 VanDerWaalsContact O-CE 3.24Å; D275-K289 WeakPolarHBondContact O-CE 3.41Å; D275-K289 PolarHBondContact O-NZ 3.47Å; D275-T315 PolarHBondContact O-N 3.23Å; D275-T315 PolarHBondContact O-OG1 3.04Å
276	V	84.7	Confident	83.3	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	140	-169.4	49.8	0	0	0	0	112.1	C274 I278 A287 K289 L292 Y303 T315	C274-V276 PolarHBondContact O-N 2.91Å; V276-I278 HydrophobicContact CG2-CG1 4.02Å; V276-A287 HydrophobicContact CG1-CB 4.09Å; V276-A287 WeakPolarHBondContact CG1-O 3.49Å; V276-A287 PolarHBondContact N-O 2.88Å; V276-A287 PolarHBondContact O-N 3.05Å; V276-K289 HydrophobicContact CB-CG 4Å; V276-K289 HydrophobicContact CG1-CG 3.75Å; V276-L292 HydrophobicContact CG1-CD1 3.78Å; V276-L292 HydrophobicContact CG2-CD1 4.46Å; V276-Y303 HydrophobicContact CG2-CE1 4.43Å; V276-Y303 WeakPolarHBondContact CG2-OH 3.21Å; V276-T315 WeakPolarHBondContact CA-O 3.47Å; V276-T315 WeakPolarHBondContact CG2-O 3.09Å
277	N	87.2	Confident	83.5	Confident	34 Å²	34	56.3 Å²	56.3	18%	0.182	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	118.8	171.7	-63.2	-48.8	0	0	0	108.6	V284 T315 V316 T317	N277-V284 HydrophobicContact CB-CG1 3.94Å; N277-T315 PolarHBondContact N-O 2.86Å; N277-T315 VanDerWaalsContact N-O 3.07Å; N277-V316 CarbonylContact O-C 3.56Å; N277-V316 VanDerWaalsContact O-CA 3.31Å; N277-V316 WeakPolarHBondContact O-CA 3.24Å; N277-T317 PolarHBondContact O-N 3.33Å
278	I	89	Confident	83.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.3	180	-48.9	171.6	0	0	0	108.2	V276 V280 V284 F285 A287 L292 F299 T317 L319 F327	V276-I278 HydrophobicContact CG2-CG1 4.02Å; I278-V280 HydrophobicContact CG2-CG2 3.95Å; I278-V284 WeakPolarHBondContact O-CA 3.31Å; I278-F285 HydrophobicContact CB-CB 4.39Å; I278-F285 PolarHBondContact N-O 2.78Å; I278-F285 PolarHBondContact O-N 2.99Å; I278-A287 HydrophobicContact CD1-CB 4.34Å; I278-L292 HydrophobicContact CD1-CD1 3.77Å; I278-L292 HydrophobicContact CD1-CD2 3.98Å; I278-L292 HydrophobicContact CG1-CD1 4.49Å; I278-F299 HydrophobicContact CD1-CE1 4.37Å; I278-F299 HydrophobicContact CD1-CZ 3.92Å; I278-T317 CarbonylContact C-O 3.53Å; I278-T317 WeakPolarHBondContact CA-O 3.46Å; I278-L319 HydrophobicContact CG2-CB 4.15Å; I278-L319 HydrophobicContact CG2-CD2 4.03Å; I278-F327 HydrophobicContact CB-CZ 4.43Å; I278-F327 HydrophobicContact CD1-CE1 4.36Å; I278-F327 HydrophobicContact CD1-CZ 3.69Å; I278-F327 HydrophobicContact CG2-CE1 4.4Å; I278-F327 HydrophobicContact CG2-CZ 3.99Å
279	V	88.6	Confident	83.7	Confident	23 Å²	23	56 Å²	56	14%	0.139	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	114.6	179.7	-174.5	0	0	0	0	109.2	Q283 V284 V316 T317 L319	V279-Q283 CarbonylContact C-O 3.45Å; V279-Q283 WeakPolarHBondContact CA-O 3.48Å; V279-V284 HydrophobicContact CG2-CG2 4.38Å; V279-V316 HydrophobicContact CG2-CG1 3.57Å; V279-T317 PolarHBondContact N-O 3.34Å; V279-L319 PolarHBondContact O-N 2.92Å
280	V	89.8	Confident	83.6	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	107.9	-177.9	-165.7	0	0	0	0	108.2	I278 G282 Q283 F285 L319 I321 V324 F327	I278-V280 HydrophobicContact CG2-CG2 3.95Å; V280-G282 PolarHBondContact O-N 3.3Å; V280-G282 VanDerWaalsContact O-N 3.09Å; V280-Q283 PolarHBondContact N-O 3.36Å; V280-Q283 PolarHBondContact O-N 3.18Å; V280-F285 HydrophobicContact CB-CD2 4.34Å; V280-F285 HydrophobicContact CB-CE2 4.06Å; V280-F285 HydrophobicContact CG2-CD2 3.86Å; V280-F285 HydrophobicContact CG2-CE2 4.02Å; V280-L319 HydrophobicContact CG2-CB 4.25Å; V280-L319 HydrophobicContact CG2-CD2 4.02Å; V280-I321 HydrophobicContact CG1-CB 4.07Å; V280-I321 HydrophobicContact CG1-CG2 4.29Å; V280-I321 WeakPolarHBondContact CG1-O 3.28Å; V280-V324 HydrophobicContact CG1-CG2 4.27Å; V280-F327 HydrophobicContact CG1-CB 4.33Å; V280-F327 HydrophobicContact CG2-CD1 3.72Å; V280-F327 HydrophobicContact CG2-CD2 4.4Å; V280-F327 HydrophobicContact CG2-CE1 4Å; V280-F327 HydrophobicContact CG2-CG 3.95Å; V280-F327 HydrophobicContact CG2-CZ 4.47Å
281	S	83.4	Confident	84	Confident	83 Å²	83	52.7 Å²	52.7	58%	0.58	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.6	46.8	-173.5	-67.5	0	0	0	0	114.3	I321	S281-I321 PolarHBondContact OG-O 2.85Å; S281-I321 VanDerWaalsContact OG-O 3.07Å
282	G	80.9	Confident	84.6	Confident	63 Å²	63	51.7 Å²	51.7	65%	0.649	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.5	-21.8	178.5	0	0	0	0	0	116	V280	V280-G282 PolarHBondContact O-N 3.3Å; V280-G282 VanDerWaalsContact O-N 3.09Å
283	Q	85.8	Confident	85.4	Confident	111 Å²	111	48.8 Å²	48.8	52%	0.519	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	141.1	175.1	-66.6	-166.7	10.5	0	0	111.8	V279 V280 F285 V324	V279-Q283 CarbonylContact C-O 3.45Å; V279-Q283 WeakPolarHBondContact CA-O 3.48Å; V280-Q283 PolarHBondContact N-O 3.36Å; V280-Q283 PolarHBondContact O-N 3.18Å; Q283-F285 HydrophobicContact CB-CE2 3.78Å; Q283-F285 HydrophobicContact CB-CZ 4.35Å; Q283-V324 HydrophobicContact CB-CG1 4.06Å; Q283-V324 HydrophobicContact CG-CG1 4.08Å
284	V	87.9	Confident	86	Confident	90 Å²	90	44.7 Å²	44.7	55%	0.545	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	108.4	-174.2	-172	0	0	0	0	111.3	N277 I278 V279	N277-V284 HydrophobicContact CB-CG1 3.94Å; I278-V284 WeakPolarHBondContact O-CA 3.31Å; V279-V284 HydrophobicContact CG2-CG2 4.38Å
285	F	89.9	Confident	86	Confident	26 Å²	26	44.6 Å²	44.6	11%	0.114	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120.2	178	-63.8	-93.9	0	0	0	110.9	I278 V280 Q283 V324 F327 L331	I278-F285 HydrophobicContact CB-CB 4.39Å; I278-F285 PolarHBondContact N-O 2.78Å; I278-F285 PolarHBondContact O-N 2.99Å; V280-F285 HydrophobicContact CB-CD2 4.34Å; V280-F285 HydrophobicContact CB-CE2 4.06Å; V280-F285 HydrophobicContact CG2-CD2 3.86Å; V280-F285 HydrophobicContact CG2-CE2 4.02Å; Q283-F285 HydrophobicContact CB-CE2 3.78Å; Q283-F285 HydrophobicContact CB-CZ 4.35Å; F285-V324 HydrophobicContact CE2-CG1 3.9Å; F285-V324 HydrophobicContact CZ-CG1 3.84Å; F285-F327 HydrophobicContact CB-CE1 4.04Å; F285-F327 HydrophobicContact CD1-CD1 4.27Å; F285-F327 HydrophobicContact CD1-CE1 4.27Å; F285-F327 AromaticContact CD2-CD1 3.9Å; F285-F327 HydrophobicContact CD2-CD1 3.9Å; F285-F327 AromaticContact CD2-CE1 3.96Å; F285-F327 HydrophobicContact CD2-CE1 3.96Å; F285-F327 HydrophobicContact CE1-CD1 4.37Å; F285-F327 HydrophobicContact CE2-CD1 4.01Å; F285-F327 HydrophobicContact CG-CD1 4.04Å; F285-F327 AromaticContact CG-CE1 3.82Å; F285-F327 HydrophobicContact CG-CE1 3.82Å; F285-F327 HydrophobicContact CZ-CD1 4.25Å; F285-L331 HydrophobicContact CB-CD2 3.89Å; F285-L331 HydrophobicContact CD1-CD2 3.87Å; F285-L331 HydrophobicContact CG-CD2 4.27Å
286	R	88.5	Confident	86.4	Confident	139 Å²	139	41.2 Å²	41.2	53%	0.525	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	140	173.7	-55	-166.1	-177.4	-179.5	5.1	110.2	R268 C274	R268-R286 WeakPolarHBondContact CG-O 3.18Å; C274-R286 HydrophobicContact CB-CB 4Å
287	A	89.3	Confident	86.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	174.2	-179.8	0	0	0	0	0	113.1	C274 D275 V276 I278 L292 L331	C274-A287 CarbonylContact C-O 3.59Å; C274-A287 WeakPolarHBondContact CA-O 3.5Å; D275-A287 PolarHBondContact N-O 2.84Å; V276-A287 HydrophobicContact CG1-CB 4.09Å; V276-A287 WeakPolarHBondContact CG1-O 3.49Å; V276-A287 PolarHBondContact N-O 2.88Å; V276-A287 PolarHBondContact O-N 3.05Å; I278-A287 HydrophobicContact CD1-CB 4.34Å; A287-L292 HydrophobicContact CB-CD1 3.99Å; A287-L292 HydrophobicContact CB-CD2 4.16Å; A287-L292 HydrophobicContact CB-CG 4.2Å; A287-L331 HydrophobicContact CB-CD1 4.24Å
288	H	87.3	Confident	86.5	Confident	12 Å²	12	48.9 Å²	48.9	6%	0.056	26%	0.264	C	S	.	.			trans	-105.3	125.5	173.5	-54.8	117.7	0	0	0	110	L264 Q267 R268 I272 L273 C274 N290 I291 L292 Y335	L264-H288 VanDerWaalsContact C-CE1 3.44Å; L264-H288 PolarHBondContact O-CE1 3.46Å; Q267-H288 VanDerWaalsContact C-CE1 3.41Å; Q267-H288 WeakPolarHBondContact CB-CE1 3.09Å; R268-H288 PolarHBondContact N-CE1 3.35Å; I272-H288 PolarHBondContact O-NE2 3.47Å; L273-H288 PolarHBondContact O-CD2 3.41Å; L273-H288 VanDerWaalsContact O-CD2 3.23Å; L273-H288 PolarHBondContact O-NE2 2.94Å; C274-H288 PolarHBondContact N-NE2 3.09Å; H288-N290 PolarHBondContact O-N 3.38Å; H288-N290 VanDerWaalsContact O-N 3.12Å; H288-I291 HydrophobicContact CB-CG1 4.25Å; H288-I291 PolarHBondContact O-N 3.36Å; H288-I291 VanDerWaalsContact O-N 3.08Å; H288-L292 PolarHBondContact O-N 3.32Å; H288-Y335 WeakPolarHBondContact CB-OH 3.37Å; H288-Y335 AromaticContact CE1-CE1 3.99Å; H288-Y335 PolarHBondContact N-OH 3.16Å; H288-Y335 AromaticContact ND1-CE1 3.47Å; H288-Y335 WeakPolarHBondContact ND1-CE1 3.06Å; H288-Y335 AromaticContact ND1-CZ 3.6Å; H288-Y335 PolarHBondContact ND1-OH 3.11Å
289	K	85.4	Confident	86.5	Confident	51 Å²	51	49 Å²	49	22%	0.222	27%	0.265	C	S	.	.	H	α-helix	trans	-52.5	-39.7	-179.8	-73.8	168.6	178	159.3	0	112.3	D275 V276 I291 L292 V293 T315	D275-K289 HydrophobicContact CB-CD 3.74Å; D275-K289 HydrophobicContact CB-CG 4.02Å; D275-K289 VanDerWaalsContact O-CE 3.24Å; D275-K289 WeakPolarHBondContact O-CE 3.41Å; D275-K289 PolarHBondContact O-NZ 3.47Å; V276-K289 HydrophobicContact CB-CG 4Å; V276-K289 HydrophobicContact CG1-CG 3.75Å; K289-I291 PolarHBondContact O-N 3.01Å; K289-L292 PolarHBondContact O-N 2.91Å; K289-V293 WeakPolarHBondContact O-CB 3.36Å; K289-V293 WeakPolarHBondContact O-CG2 3.43Å; K289-V293 PolarHBondContact O-N 3.22Å; K289-T315 WeakPolarHBondContact CE-OG1 3.36Å; K289-T315 PolarHBondContact NZ-OG1 3.28Å
290	N	83.9	Confident	86.2	Confident	126 Å²	126	53.6 Å²	53.6	67%	0.674	28%	0.283	S	S	*	.	H	α-helix	trans	-60.2	-40.1	-179.3	-63.3	-32.9	0	0	0	113.4	H288 A294	H288-N290 PolarHBondContact O-N 3.38Å; H288-N290 VanDerWaalsContact O-N 3.12Å; N290-A294 VanDerWaalsContact O-CB 3.26Å; N290-A294 WeakPolarHBondContact O-CB 3.49Å; N290-A294 PolarHBondContact O-N 3.47Å
291	I	86.6	Confident	86	Confident	19 Å²	19	57.1 Å²	57.1	10%	0.097	30%	0.304	C	S	.	.	H	α-helix	trans	-72.6	-45.2	179.7	-63.6	-58.5	0	0	0	110.5	L261 L264 H288 K289 V293 A294 G295 L334 Y335 W411	L261-I291 HydrophobicContact CD1-CD1 3.91Å; L264-I291 HydrophobicContact CD1-CD1 4.08Å; H288-I291 HydrophobicContact CB-CG1 4.25Å; H288-I291 PolarHBondContact O-N 3.36Å; H288-I291 VanDerWaalsContact O-N 3.08Å; K289-I291 PolarHBondContact O-N 3.01Å; I291-V293 PolarHBondContact O-N 3.04Å; I291-A294 PolarHBondContact O-N 2.92Å; I291-G295 PolarHBondContact O-N 3.1Å; I291-L334 HydrophobicContact CG2-CB 4.12Å; I291-Y335 HydrophobicContact CB-CE2 4.15Å; I291-Y335 HydrophobicContact CG1-CE1 4.2Å; I291-Y335 HydrophobicContact CG2-CD2 3.92Å; I291-Y335 HydrophobicContact CG2-CE1 4.48Å; I291-Y335 HydrophobicContact CG2-CE2 3.59Å; I291-W411 HydrophobicContact CG2-CH2 4.31Å
292	L	87.4	Confident	85.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.4	-47	177.2	-59.1	174.8	0	0	0	112.3	V276 I278 A287 H288 K289 A294 S296 F299 Y303 L331 L334	V276-L292 HydrophobicContact CG1-CD1 3.78Å; V276-L292 HydrophobicContact CG2-CD1 4.46Å; I278-L292 HydrophobicContact CD1-CD1 3.77Å; I278-L292 HydrophobicContact CD1-CD2 3.98Å; I278-L292 HydrophobicContact CG1-CD1 4.49Å; A287-L292 HydrophobicContact CB-CD1 3.99Å; A287-L292 HydrophobicContact CB-CD2 4.16Å; A287-L292 HydrophobicContact CB-CG 4.2Å; H288-L292 PolarHBondContact O-N 3.32Å; K289-L292 PolarHBondContact O-N 2.91Å; L292-A294 VanDerWaalsContact C-N 3.28Å; L292-A294 PolarHBondContact O-N 2.97Å; L292-S296 WeakPolarHBondContact O-CB 3.49Å; L292-S296 PolarHBondContact O-N 3.34Å; L292-F299 HydrophobicContact CB-CB 3.89Å; L292-F299 HydrophobicContact CB-CD2 3.78Å; L292-F299 HydrophobicContact CB-CG 3.9Å; L292-F299 HydrophobicContact CD2-CD2 4.01Å; L292-F299 HydrophobicContact CD2-CE2 3.92Å; L292-F299 HydrophobicContact CG-CD2 4.34Å; L292-Y303 HydrophobicContact CB-CE2 4.37Å; L292-Y303 HydrophobicContact CD1-CE2 3.96Å; L292-L331 HydrophobicContact CD2-CD1 3.95Å; L292-L334 HydrophobicContact CD2-CD1 4.17Å
293	V	85.1	Confident	85.9	Confident	34 Å²	34	54 Å²	54	21%	0.206	26%	0.264	C	S	.	.	H	α-helix	trans	-67	-28	179.4	168.8	0	0	0	0	112.5	K289 I291 K300 Y303	K289-V293 WeakPolarHBondContact O-CB 3.36Å; K289-V293 WeakPolarHBondContact O-CG2 3.43Å; K289-V293 PolarHBondContact O-N 3.22Å; I291-V293 PolarHBondContact O-N 3.04Å; V293-K300 HydrophobicContact CG1-CB 4.09Å; V293-K300 HydrophobicContact CG1-CG 4.06Å; V293-Y303 HydrophobicContact CG2-CD2 3.71Å; V293-Y303 HydrophobicContact CG2-CG 4.28Å
294	A	82.9	Confident	85.2	Confident	36 Å²	36	52.8 Å²	52.8	30%	0.298	27%	0.267	S	S	.	.	H	α-helix	trans	-79.7	-41.2	178.1	0	0	0	0	0	112.4	N290 I291 L292 W411 I415	N290-A294 VanDerWaalsContact O-CB 3.26Å; N290-A294 WeakPolarHBondContact O-CB 3.49Å; N290-A294 PolarHBondContact O-N 3.47Å; I291-A294 PolarHBondContact O-N 2.92Å; L292-A294 VanDerWaalsContact C-N 3.28Å; L292-A294 PolarHBondContact O-N 2.97Å; A294-W411 HydrophobicContact CB-CE3 3.84Å; A294-W411 HydrophobicContact CB-CH2 4.38Å; A294-W411 HydrophobicContact CB-CZ3 3.41Å; A294-W411 VanDerWaalsContact CB-CZ3 3.41Å; A294-I415 HydrophobicContact CB-CD1 3.89Å
295	G	82	Confident	83.8	Confident	16 Å²	16	55 Å²	55	17%	0.165	28%	0.275	C	S	.	.	H	α-helix	trans	-87.4	-22.3	-178.7	0	0	0	0	0	116.1	I291	I291-G295 PolarHBondContact O-N 3.1Å
296	S	88.4	Confident	82.2	Confident	3 Å²	3	58 Å²	58	2%	0.021	30%	0.295	C	S	.	.			trans	-126.5	131.9	-175.4	169.7	0	0	0	0	113.3	L292 Y298 F299 K300 L356	L292-S296 WeakPolarHBondContact O-CB 3.49Å; L292-S296 PolarHBondContact O-N 3.34Å; S296-Y298 VanDerWaalsContact C-N 3.35Å; S296-Y298 WeakPolarHBondContact OG-CB 3.29Å; S296-Y298 PolarHBondContact OG-N 3Å; S296-Y298 VanDerWaalsContact OG-N 3.16Å; S296-F299 PolarHBondContact OG-N 3.3Å; S296-K300 VanDerWaalsContact O-CB 3.29Å; S296-K300 WeakPolarHBondContact O-CB 3.43Å; S296-K300 PolarHBondContact O-N 2.86Å; S296-L356 PolarHBondContact OG-O 3.47Å
297	R	85.3	Confident	80.2	Confident	146 Å²	146	60.4 Å²	60.4	55%	0.551	31%	0.31	S	S	*	.	H	α-helix	trans	-71.7	-30.4	172.6	-59.7	179.4	-173.3	167.3	6.9	112	T301 Q357	R297-T301 WeakPolarHBondContact O-CB 3.32Å; R297-T301 PolarHBondContact O-N 3.38Å; R297-T301 PolarHBondContact O-OG1 3.34Å; R297-Q357 HydrophobicContact CB-CB 3.93Å
298	Y	89.7	Confident	78.3	Confident	49 Å²	49	65.3 Å²	65.3	19%	0.192	34%	0.344	C	S	.	.	H	α-helix	trans	-61.6	-57	172.8	175.4	-94.9	0	0	0	110.9	S296 K300 T301 L302 L319 Y355 L356	S296-Y298 VanDerWaalsContact C-N 3.35Å; S296-Y298 WeakPolarHBondContact OG-CB 3.29Å; S296-Y298 PolarHBondContact OG-N 3Å; S296-Y298 VanDerWaalsContact OG-N 3.16Å; Y298-K300 VanDerWaalsContact C-N 3.31Å; Y298-K300 PolarHBondContact O-N 3.45Å; Y298-T301 WeakPolarHBondContact O-CA 3.39Å; Y298-T301 WeakPolarHBondContact O-CB 3.3Å; Y298-T301 PolarHBondContact O-N 2.83Å; Y298-L302 HydrophobicContact CE1-CD1 3.89Å; Y298-L302 PolarHBondContact O-N 3.27Å; Y298-L319 HydrophobicContact CE1-CD1 4.1Å; Y298-Y355 HydrophobicContact CD1-CE1 4.49Å; Y298-Y355 HydrophobicContact CD2-CD1 4.47Å; Y298-Y355 HydrophobicContact CD2-CE1 4.09Å; Y298-Y355 HydrophobicContact CE1-CE1 4.06Å; Y298-Y355 HydrophobicContact CE2-CD1 4.42Å; Y298-Y355 AromaticContact CE2-CE1 3.62Å; Y298-Y355 HydrophobicContact CE2-CE1 3.62Å; Y298-Y355 AromaticContact CZ-CE1 3.61Å; Y298-L356 HydrophobicContact CD1-CD2 3.74Å; Y298-L356 HydrophobicContact CE1-CD2 4.37Å; Y298-L356 HydrophobicContact CG-CD2 4.3Å
299	F	87.3	Confident	76.1	Confident	3 Å²	3	72.8 Å²	72.8	1%	0.013	38%	0.379	C	S	.	.	H	α-helix	trans	-63.8	-34.8	179.1	-71.6	-51.4	0	0	0	112.8	I278 L292 S296 T301 L302 Y303 L319 F327 L356	I278-F299 HydrophobicContact CD1-CE1 4.37Å; I278-F299 HydrophobicContact CD1-CZ 3.92Å; L292-F299 HydrophobicContact CB-CB 3.89Å; L292-F299 HydrophobicContact CB-CD2 3.78Å; L292-F299 HydrophobicContact CB-CG 3.9Å; L292-F299 HydrophobicContact CD2-CD2 4.01Å; L292-F299 HydrophobicContact CD2-CE2 3.92Å; L292-F299 HydrophobicContact CG-CD2 4.34Å; S296-F299 PolarHBondContact OG-N 3.3Å; F299-T301 VanDerWaalsContact C-N 3.33Å; F299-T301 PolarHBondContact O-N 2.89Å; F299-L302 PolarHBondContact O-N 2.71Å; F299-Y303 HydrophobicContact CB-CD2 3.98Å; F299-Y303 HydrophobicContact CB-CE2 3.79Å; F299-Y303 HydrophobicContact CD1-CD2 4.46Å; F299-Y303 AromaticContact CD1-CE2 3.55Å; F299-Y303 HydrophobicContact CD1-CE2 3.55Å; F299-Y303 HydrophobicContact CE1-CE2 4.45Å; F299-Y303 AromaticContact CG-CE2 3.95Å; F299-Y303 HydrophobicContact CG-CE2 3.95Å; F299-Y303 WeakPolarHBondContact O-CD2 3.35Å; F299-Y303 PolarHBondContact O-N 3.47Å; F299-L319 HydrophobicContact CZ-CD2 4.48Å; F299-F327 HydrophobicContact CE2-CE2 4.43Å; F299-F327 HydrophobicContact CZ-CE2 4.2Å; F299-F327 HydrophobicContact CZ-CZ 4.44Å; F299-L356 HydrophobicContact CD2-CD2 4.22Å; F299-L356 HydrophobicContact CE1-CD2 4.45Å; F299-L356 HydrophobicContact CE2-CD1 4.29Å; F299-L356 HydrophobicContact CE2-CD2 3.58Å; F299-L356 HydrophobicContact CZ-CD2 3.71Å
300	K	83.4	Confident	74	Confident	119 Å²	119	73.9 Å²	73.9	52%	0.517	40%	0.397	S	S	.	.	H	α-helix	trans	-60.8	-39.6	170.3	-177.4	166.8	-176.1	171.1	0	113.1	V293 S296 Y298 C304	V293-K300 HydrophobicContact CG1-CB 4.09Å; V293-K300 HydrophobicContact CG1-CG 4.06Å; S296-K300 VanDerWaalsContact O-CB 3.29Å; S296-K300 WeakPolarHBondContact O-CB 3.43Å; S296-K300 PolarHBondContact O-N 2.86Å; Y298-K300 VanDerWaalsContact C-N 3.31Å; Y298-K300 PolarHBondContact O-N 3.45Å; K300-C304 WeakPolarHBondContact O-CB 3.17Å; K300-C304 PolarHBondContact O-N 2.94Å; K300-C304 PolarHBondContact O-SG 2.79Å; K300-C304 VanDerWaalsContact O-SG 3.35Å
301	T	84.6	Confident	72.5	Confident	73 Å²	73	75.2 Å²	75.2	45%	0.448	40%	0.399	S	S	.	.	H	α-helix	trans	-68.4	-44.1	177.1	-57.9	0	0	0	0	110.2	R297 Y298 F299 L305	R297-T301 WeakPolarHBondContact O-CB 3.32Å; R297-T301 PolarHBondContact O-N 3.38Å; R297-T301 PolarHBondContact O-OG1 3.34Å; Y298-T301 WeakPolarHBondContact O-CA 3.39Å; Y298-T301 WeakPolarHBondContact O-CB 3.3Å; Y298-T301 PolarHBondContact O-N 2.83Å; F299-T301 VanDerWaalsContact C-N 3.33Å; F299-T301 PolarHBondContact O-N 2.89Å; T301-L305 HydrophobicContact CG2-CD1 3.68Å; T301-L305 VanDerWaalsContact O-CB 3.28Å; T301-L305 WeakPolarHBondContact O-CB 3.23Å; T301-L305 VanDerWaalsContact O-CG 3.26Å; T301-L305 WeakPolarHBondContact O-CG 3.38Å; T301-L305 PolarHBondContact O-N 2.86Å
302	L	82.4	Confident	70.6	Confident	47 Å²	47	81.4 Å²	81.4	25%	0.246	43%	0.432	C	S	.	.	H	α-helix	trans	-63.6	-60.6	-179.5	-165.5	152.8	0	0	0	111.6	Y298 F299 C304 T306 T317	Y298-L302 HydrophobicContact CE1-CD1 3.89Å; Y298-L302 PolarHBondContact O-N 3.27Å; F299-L302 PolarHBondContact O-N 2.71Å; L302-C304 PolarHBondContact O-N 3.16Å; L302-T306 WeakPolarHBondContact O-CG2 3.5Å; L302-T306 PolarHBondContact O-N 2.96Å; L302-T306 PolarHBondContact O-OG1 2.91Å; L302-T317 HydrophobicContact CD2-CG2 4.04Å
303	Y	80.2	Confident	69.1	Low	34 Å²	34	88.5 Å²	88.5	13%	0.133	47%	0.466	C	S	.	.	H	α-helix	trans	-77.2	-15.8	-173.5	-58.1	-60.8	0	0	0	115.1	V276 L292 V293 F299 T306 T317	V276-Y303 HydrophobicContact CG2-CE1 4.43Å; V276-Y303 WeakPolarHBondContact CG2-OH 3.21Å; L292-Y303 HydrophobicContact CB-CE2 4.37Å; L292-Y303 HydrophobicContact CD1-CE2 3.96Å; V293-Y303 HydrophobicContact CG2-CD2 3.71Å; V293-Y303 HydrophobicContact CG2-CG 4.28Å; F299-Y303 HydrophobicContact CB-CD2 3.98Å; F299-Y303 HydrophobicContact CB-CE2 3.79Å; F299-Y303 HydrophobicContact CD1-CD2 4.46Å; F299-Y303 AromaticContact CD1-CE2 3.55Å; F299-Y303 HydrophobicContact CD1-CE2 3.55Å; F299-Y303 HydrophobicContact CE1-CE2 4.45Å; F299-Y303 AromaticContact CG-CE2 3.95Å; F299-Y303 HydrophobicContact CG-CE2 3.95Å; F299-Y303 WeakPolarHBondContact O-CD2 3.35Å; F299-Y303 PolarHBondContact O-N 3.47Å; Y303-T306 PolarHBondContact O-OG1 3.36Å; Y303-T317 HydrophobicContact CE1-CG2 3.7Å; Y303-T317 WeakPolarHBondContact OH-CG2 3.26Å; Y303-T317 PolarHBondContact OH-OG1 3.01Å
304	C	71.4	Confident	67.9	Low	85 Å²	85	89 Å²	89	57%	0.574	47%	0.473	S	S	*	.	H	α-helix	trans	-99.3	-10.2	177.5	-56.9	0	0	0	0	114.4	K300 L302	K300-C304 WeakPolarHBondContact O-CB 3.17Å; K300-C304 PolarHBondContact O-N 2.94Å; K300-C304 PolarHBondContact O-SG 2.79Å; K300-C304 VanDerWaalsContact O-SG 3.35Å; L302-C304 PolarHBondContact O-N 3.16Å
305	L	58.6	Low	67.4	Low	138 Å²	138	89.3 Å²	89.3	72%	0.723	47%	0.472	S	S	*	.	H	α-helix	trans	-98.5	-26.9	172.4	-66.9	177.7	0	0	0	112.9	T301 K307	T301-L305 HydrophobicContact CG2-CD1 3.68Å; T301-L305 VanDerWaalsContact O-CB 3.28Å; T301-L305 WeakPolarHBondContact O-CB 3.23Å; T301-L305 VanDerWaalsContact O-CG 3.26Å; T301-L305 WeakPolarHBondContact O-CG 3.38Å; T301-L305 PolarHBondContact O-N 2.86Å; L305-K307 PolarHBondContact O-N 3.34Å
306	T	56.7	Low	67.3	Low	88 Å²	88	92.4 Å²	92.4	54%	0.54	49%	0.487	S	S	.	.	S	Bend	trans	-62.1	118.7	168.6	48.1	0	0	0	0	110.3	L302 Y303	L302-T306 WeakPolarHBondContact O-CG2 3.5Å; L302-T306 PolarHBondContact O-N 2.96Å; L302-T306 PolarHBondContact O-OG1 2.91Å; Y303-T306 PolarHBondContact O-OG1 3.36Å
307	K	45.9	Very low	66.9	Low	190 Å²	190	93.2 Å²	93.2	83%	0.826	49%	0.492	S	S	*	.			trans	-60.6	150.8	165.1	-90.4	-177.5	174.1	179.4	0	110.1	L305 E309	L305-K307 PolarHBondContact O-N 3.34Å; K307-E309 PolarHBondContact O-N 3.19Å
308	S	50	Low	66.7	Low	103 Å²	103	92.3 Å²	92.3	72%	0.72	49%	0.494	S	S	*	.			trans	-68.1	93.4	177.4	-179.4	0	0	0	0	111.8
309	E	41.4	Very low	66.5	Low	169 Å²	169	90.2 Å²	90.2	79%	0.79	49%	0.486	S	S	*	.			trans	-118.5	153.5	160.3	-68.8	179.2	177.8	0	0	108.3	K307	K307-E309 PolarHBondContact O-N 3.19Å
310	A	41.5	Very low	66	Low	73 Å²	73	97 Å²	97	60%	0.603	52%	0.522	S	S	*	.	S	Bend	trans	56	69.8	-168.6	0	0	0	0	0	114.6
311	Q	52.3	Low	65.9	Low	155 Å²	155	91.9 Å²	91.9	72%	0.724	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	147.3	160.2	-155	166.7	-59.7	0	0	109.6	Q313	Q311-Q313 PolarHBondContact O-N 2.71Å
312	D	46.3	Very low	65.4	Low	148 Å²	148	92.8 Å²	92.8	79%	0.791	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	4.3	178.2	-59.9	-11.5	0	0	0	118.8
313	Q	54.9	Low	65.5	Low	150 Å²	150	91.4 Å²	91.4	70%	0.701	51%	0.51	S	S	*	.	S	Bend	trans	-108.6	136.5	169.6	-151.6	73	30.5	0	0	112	Q311 T315	Q311-Q313 PolarHBondContact O-N 2.71Å; Q313-T315 PolarHBondContact O-N 3.27Å
314	A	60.8	Low	65.8	Low	43 Å²	43	90.9 Å²	90.9	36%	0.355	51%	0.511	S	S	.	.			trans	-65	115.1	174.1	0	0	0	0	0	109.9	V316	A314-V316 PolarHBondContact O-N 3.15Å
315	T	72.9	Confident	66.5	Low	44 Å²	44	92.6 Å²	92.6	27%	0.27	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	123.2	-172.2	52.5	0	0	0	0	110	D275 V276 N277 K289 Q313	D275-T315 PolarHBondContact O-N 3.23Å; D275-T315 PolarHBondContact O-OG1 3.04Å; V276-T315 WeakPolarHBondContact CA-O 3.47Å; V276-T315 WeakPolarHBondContact CG2-O 3.09Å; N277-T315 PolarHBondContact N-O 2.86Å; N277-T315 VanDerWaalsContact N-O 3.07Å; K289-T315 WeakPolarHBondContact CE-OG1 3.36Å; K289-T315 PolarHBondContact NZ-OG1 3.28Å; Q313-T315 PolarHBondContact O-N 3.27Å
316	V	78.8	Confident	67.9	Low	81 Å²	81	86 Å²	86	49%	0.491	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	128.7	172.7	-173	0	0	0	0	108.8	N277 V279 A314	N277-V316 CarbonylContact O-C 3.56Å; N277-V316 VanDerWaalsContact O-CA 3.31Å; N277-V316 WeakPolarHBondContact O-CA 3.24Å; V279-V316 HydrophobicContact CG2-CG1 3.57Å; A314-V316 PolarHBondContact O-N 3.15Å
317	T	81	Confident	69.6	Low	20 Å²	20	81.9 Å²	81.9	12%	0.123	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	115.3	173.8	52.2	0	0	0	0	110.3	N277 I278 V279 L302 Y303	N277-T317 PolarHBondContact O-N 3.33Å; I278-T317 CarbonylContact C-O 3.53Å; I278-T317 WeakPolarHBondContact CA-O 3.46Å; V279-T317 PolarHBondContact N-O 3.34Å; L302-T317 HydrophobicContact CD2-CG2 4.04Å; Y303-T317 HydrophobicContact CE1-CG2 3.7Å; Y303-T317 WeakPolarHBondContact OH-CG2 3.26Å; Y303-T317 PolarHBondContact OH-OG1 3.01Å
318	H	81.8	Confident	71.8	Confident	127 Å²	127	74.2 Å²	74.2	59%	0.588	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	144.2	174.3	-64.4	-96.9	0	0	0	110.1
319	L	83.8	Confident	73.7	Confident	5 Å²	5	70.1 Å²	70.1	3%	0.026	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	105.5	-174.1	-175.7	61.9	0	0	0	108.7	I278 V279 V280 Y298 F299 I321 F327 Y355 L356	I278-L319 HydrophobicContact CG2-CB 4.15Å; I278-L319 HydrophobicContact CG2-CD2 4.03Å; V279-L319 PolarHBondContact O-N 2.92Å; V280-L319 HydrophobicContact CG2-CB 4.25Å; V280-L319 HydrophobicContact CG2-CD2 4.02Å; Y298-L319 HydrophobicContact CE1-CD1 4.1Å; F299-L319 HydrophobicContact CZ-CD2 4.48Å; L319-I321 HydrophobicContact CD1-CD1 3.85Å; L319-I321 HydrophobicContact CD1-CG1 4.21Å; L319-I321 HydrophobicContact CD2-CD1 3.88Å; L319-I321 HydrophobicContact CG-CB 4.35Å; L319-I321 HydrophobicContact CG-CD1 3.69Å; L319-I321 HydrophobicContact CG-CG1 3.9Å; L319-I321 PolarHBondContact O-N 3.43Å; L319-F327 HydrophobicContact CD2-CD2 3.67Å; L319-F327 HydrophobicContact CD2-CE2 3.5Å; L319-F327 VanDerWaalsContact CD2-CE2 3.5Å; L319-F327 HydrophobicContact CD2-CZ 4.26Å; L319-Y355 HydrophobicContact CD1-CD1 4.01Å; L319-Y355 HydrophobicContact CD1-CE1 3.33Å; L319-L356 HydrophobicContact CD2-CD2 4.49Å
320	D	77.7	Confident	76	Confident	144 Å²	144	62.1 Å²	62.1	77%	0.77	35%	0.354	S	S	*	.			trans	-76.6	67	-172.6	-56.4	-39.2	0	0	0	111.6
321	I	80.8	Confident	78.3	Confident	12 Å²	12	58.8 Å²	58.8	6%	0.062	33%	0.326	C	S	.	.			trans	-127.2	118.9	-176.5	-68.9	-175.3	0	0	0	109	V280 S281 L319 A323 V352 Y355	V280-I321 HydrophobicContact CG1-CB 4.07Å; V280-I321 HydrophobicContact CG1-CG2 4.29Å; V280-I321 WeakPolarHBondContact CG1-O 3.28Å; S281-I321 PolarHBondContact OG-O 2.85Å; S281-I321 VanDerWaalsContact OG-O 3.07Å; L319-I321 HydrophobicContact CD1-CD1 3.85Å; L319-I321 HydrophobicContact CD1-CG1 4.21Å; L319-I321 HydrophobicContact CD2-CD1 3.88Å; L319-I321 HydrophobicContact CG-CB 4.35Å; L319-I321 HydrophobicContact CG-CD1 3.69Å; L319-I321 HydrophobicContact CG-CG1 3.9Å; L319-I321 PolarHBondContact O-N 3.43Å; I321-A323 VanDerWaalsContact C-N 3.35Å; I321-A323 HydrophobicContact CG2-CB 4.17Å; I321-V352 HydrophobicContact CD1-CG1 3.94Å; I321-V352 HydrophobicContact CG2-CG1 4.48Å; I321-V352 HydrophobicContact CG2-CG2 3.63Å; I321-Y355 HydrophobicContact CD1-CD1 3.73Å; I321-Y355 HydrophobicContact CD1-CD2 4.11Å; I321-Y355 HydrophobicContact CD1-CE1 4.21Å; I321-Y355 HydrophobicContact CD1-CG 3.69Å; I321-Y355 HydrophobicContact CG1-CD1 4.44Å; I321-Y355 HydrophobicContact CG1-CD2 4.1Å; I321-Y355 HydrophobicContact CG1-CE2 4.26Å; I321-Y355 HydrophobicContact CG1-CG 4.2Å
322	A	73.6	Confident	80.1	Confident	93 Å²	93	54.5 Å²	54.5	77%	0.769	31%	0.308	S	S	*	.	S	Bend	trans	-72.5	-25.8	177	0	0	0	0	0	113.6	V324	A322-V324 VanDerWaalsContact C-N 3.34Å; A322-V324 PolarHBondContact O-N 2.97Å
323	A	85	Confident	82.1	Confident	17 Å²	17	47.7 Å²	47.7	14%	0.14	27%	0.271	C	S	.	.			trans	-82.3	71.5	-178.7	0	0	0	0	0	112.1	I321 Q325 G326 F327 E348 V352	I321-A323 VanDerWaalsContact C-N 3.35Å; I321-A323 HydrophobicContact CG2-CB 4.17Å; A323-Q325 VanDerWaalsContact C-N 3.33Å; A323-Q325 PolarHBondContact O-N 2.9Å; A323-G326 PolarHBondContact O-N 3.09Å; A323-F327 PolarHBondContact O-N 2.88Å; A323-F327 VanDerWaalsContact O-N 3.07Å; A323-E348 HydrophobicContact CB-CB 4Å; A323-E348 HydrophobicContact CB-CG 3.86Å; A323-V352 HydrophobicContact CB-CG2 3.68Å
324	V	86.4	Confident	83.6	Confident	23 Å²	23	40.6 Å²	40.6	14%	0.139	24%	0.239	C	C	.	.	H	α-helix	trans	-62.3	-39.8	-177.9	-171.7	0	0	0	0	111.8	V280 Q283 F285 A322 F327 S328	V280-V324 HydrophobicContact CG1-CG2 4.27Å; Q283-V324 HydrophobicContact CB-CG1 4.06Å; Q283-V324 HydrophobicContact CG-CG1 4.08Å; F285-V324 HydrophobicContact CE2-CG1 3.9Å; F285-V324 HydrophobicContact CZ-CG1 3.84Å; A322-V324 VanDerWaalsContact C-N 3.34Å; A322-V324 PolarHBondContact O-N 2.97Å; V324-F327 WeakPolarHBondContact O-CB 3.4Å; V324-F327 PolarHBondContact O-N 3.15Å; V324-S328 PolarHBondContact O-N 2.9Å
325	Q	86.8	Confident	84.9	Confident	121 Å²	121	38.7 Å²	38.7	57%	0.565	22%	0.222	S	C	*	.	H	α-helix	trans	-68.2	-43.6	178.9	-170.3	63.1	14.7	0	0	111.4	A323 F327 S328 V329	A323-Q325 VanDerWaalsContact C-N 3.33Å; A323-Q325 PolarHBondContact O-N 2.9Å; Q325-F327 PolarHBondContact O-N 3.02Å; Q325-S328 WeakPolarHBondContact O-CB 3.38Å; Q325-S328 PolarHBondContact O-N 2.96Å; Q325-S328 VanDerWaalsContact O-N 3.15Å; Q325-V329 PolarHBondContact O-N 3.09Å; Q325-V329 VanDerWaalsContact O-N 3.09Å
326	G	88.6	Confident	85.3	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-55.1	-35.6	169.5	0	0	0	0	0	114.2	A323 I330 E348	A323-G326 PolarHBondContact O-N 3.09Å; G326-I330 WeakPolarHBondContact O-CG1 3.5Å; G326-I330 PolarHBondContact O-N 3.35Å; G326-E348 PolarHBondContact N-OE2 3.47Å
327	F	92	Very high	85.4	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.009	20%	0.197	C	C	.	.	H	α-helix	trans	-69.9	-43.2	173.5	-175.9	-93.6	0	0	0	112.8	I278 V280 F285 F299 L319 A323 V324 Q325 V329 I330 L331 V352 L356	I278-F327 HydrophobicContact CB-CZ 4.43Å; I278-F327 HydrophobicContact CD1-CE1 4.36Å; I278-F327 HydrophobicContact CD1-CZ 3.69Å; I278-F327 HydrophobicContact CG2-CE1 4.4Å; I278-F327 HydrophobicContact CG2-CZ 3.99Å; V280-F327 HydrophobicContact CG1-CB 4.33Å; V280-F327 HydrophobicContact CG2-CD1 3.72Å; V280-F327 HydrophobicContact CG2-CD2 4.4Å; V280-F327 HydrophobicContact CG2-CE1 4Å; V280-F327 HydrophobicContact CG2-CG 3.95Å; V280-F327 HydrophobicContact CG2-CZ 4.47Å; F285-F327 HydrophobicContact CB-CE1 4.04Å; F285-F327 HydrophobicContact CD1-CD1 4.27Å; F285-F327 HydrophobicContact CD1-CE1 4.27Å; F285-F327 AromaticContact CD2-CD1 3.9Å; F285-F327 HydrophobicContact CD2-CD1 3.9Å; F285-F327 AromaticContact CD2-CE1 3.96Å; F285-F327 HydrophobicContact CD2-CE1 3.96Å; F285-F327 HydrophobicContact CE1-CD1 4.37Å; F285-F327 HydrophobicContact CE2-CD1 4.01Å; F285-F327 HydrophobicContact CG-CD1 4.04Å; F285-F327 AromaticContact CG-CE1 3.82Å; F285-F327 HydrophobicContact CG-CE1 3.82Å; F285-F327 HydrophobicContact CZ-CD1 4.25Å; F299-F327 HydrophobicContact CE2-CE2 4.43Å; F299-F327 HydrophobicContact CZ-CE2 4.2Å; F299-F327 HydrophobicContact CZ-CZ 4.44Å; L319-F327 HydrophobicContact CD2-CD2 3.67Å; L319-F327 HydrophobicContact CD2-CE2 3.5Å; L319-F327 VanDerWaalsContact CD2-CE2 3.5Å; L319-F327 HydrophobicContact CD2-CZ 4.26Å; A323-F327 PolarHBondContact O-N 2.88Å; A323-F327 VanDerWaalsContact O-N 3.07Å; V324-F327 WeakPolarHBondContact O-CB 3.4Å; V324-F327 PolarHBondContact O-N 3.15Å; Q325-F327 PolarHBondContact O-N 3.02Å; F327-V329 VanDerWaalsContact C-N 3.35Å; F327-V329 PolarHBondContact O-N 3.31Å; F327-I330 PolarHBondContact O-N 2.82Å; F327-I330 VanDerWaalsContact O-N 3.15Å; F327-L331 HydrophobicContact CE1-CB 4.35Å; F327-L331 HydrophobicContact CE1-CD2 4.32Å; F327-L331 PolarHBondContact O-N 3.22Å; F327-V352 HydrophobicContact CB-CG1 4.11Å; F327-V352 HydrophobicContact CD2-CG1 3.95Å; F327-L356 HydrophobicContact CD2-CD1 4.1Å; F327-L356 HydrophobicContact CE2-CD1 3.95Å
328	S	90.8	Very high	85.3	Confident	29 Å²	29	35.4 Å²	35.4	20%	0.203	20%	0.202	C	C	.	.	H	α-helix	trans	-56.7	-47.4	177.4	-164.9	0	0	0	0	111.8	V324 Q325 I330 L331 D332	V324-S328 PolarHBondContact O-N 2.9Å; Q325-S328 WeakPolarHBondContact O-CB 3.38Å; Q325-S328 PolarHBondContact O-N 2.96Å; Q325-S328 VanDerWaalsContact O-N 3.15Å; S328-I330 VanDerWaalsContact C-N 3.31Å; S328-I330 PolarHBondContact O-N 3.25Å; S328-L331 PolarHBondContact O-N 2.93Å; S328-L331 VanDerWaalsContact O-N 3.14Å; S328-D332 PolarHBondContact O-N 3.26Å
329	V	89.9	Confident	85.5	Confident	17 Å²	17	29.4 Å²	29.4	10%	0.103	17%	0.174	C	C	.	.	H	α-helix	trans	-60.6	-37.2	176.8	174.5	0	0	0	0	112.4	Q325 F327 F333 L339 V349	Q325-V329 PolarHBondContact O-N 3.09Å; Q325-V329 VanDerWaalsContact O-N 3.09Å; F327-V329 VanDerWaalsContact C-N 3.35Å; F327-V329 PolarHBondContact O-N 3.31Å; V329-F333 WeakPolarHBondContact O-CB 3.42Å; V329-F333 PolarHBondContact O-N 2.91Å; V329-L339 HydrophobicContact CG1-CD1 4.33Å; V329-V349 HydrophobicContact CB-CG2 3.99Å; V329-V349 HydrophobicContact CG1-CG2 3.85Å
330	I	90.9	Very high	85.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-71.2	-38.6	176.1	-71.3	169.9	0	0	0	111.5	G326 F327 S328 D332 F333 L334 V349 V352 A353 L356 M358	G326-I330 WeakPolarHBondContact O-CG1 3.5Å; G326-I330 PolarHBondContact O-N 3.35Å; F327-I330 PolarHBondContact O-N 2.82Å; F327-I330 VanDerWaalsContact O-N 3.15Å; S328-I330 VanDerWaalsContact C-N 3.31Å; S328-I330 PolarHBondContact O-N 3.25Å; I330-D332 VanDerWaalsContact C-N 3.34Å; I330-F333 PolarHBondContact O-N 3.32Å; I330-L334 HydrophobicContact CG2-CD1 4.42Å; I330-L334 WeakPolarHBondContact O-CG 3.49Å; I330-L334 PolarHBondContact O-N 2.91Å; I330-V349 HydrophobicContact CD1-CG1 4.3Å; I330-V349 HydrophobicContact CG1-CG1 4.04Å; I330-V352 HydrophobicContact CD1-CB 3.68Å; I330-V352 HydrophobicContact CD1-CG1 3.66Å; I330-A353 HydrophobicContact CD1-CB 3.81Å; I330-A353 VanDerWaalsContact CD1-N 3.35Å; I330-L356 HydrophobicContact CG2-CD1 4Å; I330-M358 HydrophobicContact CG2-CE 4.13Å; I330-M358 HydrophobicContact CG2-SD 3.62Å
331	L	90.4	Very high	85.9	Confident	3 Å²	3	26.2 Å²	26.2	2%	0.016	16%	0.157	C	C	.	.	H	α-helix	trans	-65.6	-39.7	176.5	-167.9	68.2	0	0	0	111.1	F285 A287 L292 F327 S328 L334 Y335	F285-L331 HydrophobicContact CB-CD2 3.89Å; F285-L331 HydrophobicContact CD1-CD2 3.87Å; F285-L331 HydrophobicContact CG-CD2 4.27Å; A287-L331 HydrophobicContact CB-CD1 4.24Å; L292-L331 HydrophobicContact CD2-CD1 3.95Å; F327-L331 HydrophobicContact CE1-CB 4.35Å; F327-L331 HydrophobicContact CE1-CD2 4.32Å; F327-L331 PolarHBondContact O-N 3.22Å; S328-L331 PolarHBondContact O-N 2.93Å; S328-L331 VanDerWaalsContact O-N 3.14Å; L331-L334 PolarHBondContact O-N 3.13Å; L331-Y335 HydrophobicContact CD1-CD2 4.45Å; L331-Y335 HydrophobicContact CD1-CE2 4.14Å; L331-Y335 WeakPolarHBondContact O-CD2 3.48Å; L331-Y335 PolarHBondContact O-N 3.04Å
332	D	88.4	Confident	86	Confident	66 Å²	66	27.1 Å²	27.1	35%	0.353	16%	0.163	S	C	.	.	H	α-helix	trans	-66.4	-39	173.7	-76.5	2.6	0	0	0	112.2	R268 S328 I330 L334 Y335 S336	R268-D332 IonicContact CZ-OD1 2.69Å; R268-D332 IonicContact NH1-OD1 2.75Å; R268-D332 PolarHBondContact NH1-OD1 3.49Å; R268-D332 IonicContact NH2-OD1 2.71Å; R268-D332 PolarHBondContact NH2-OD1 3.28Å; S328-D332 PolarHBondContact O-N 3.26Å; I330-D332 VanDerWaalsContact C-N 3.34Å; D332-L334 VanDerWaalsContact C-N 3.34Å; D332-L334 PolarHBondContact O-N 2.81Å; D332-Y335 PolarHBondContact O-N 2.94Å; D332-S336 WeakPolarHBondContact O-CB 3.44Å; D332-S336 PolarHBondContact O-N 2.8Å; D332-S336 PolarHBondContact O-OG 3.28Å
333	F	89.1	Confident	86.3	Confident	4 Å²	4	26.9 Å²	26.9	2%	0.018	16%	0.155	C	C	.	.	H	α-helix	trans	-60.1	-40.6	171	164.4	-109.2	0	0	0	112.5	V329 I330 Y335 S336 G337 N338 L339 M358 V361 Y389 F410	V329-F333 WeakPolarHBondContact O-CB 3.42Å; V329-F333 PolarHBondContact O-N 2.91Å; I330-F333 PolarHBondContact O-N 3.32Å; F333-Y335 PolarHBondContact O-N 3.46Å; F333-S336 PolarHBondContact O-N 2.89Å; F333-G337 WeakPolarHBondContact CE2-O 3.02Å; F333-G337 WeakPolarHBondContact O-CA 3.35Å; F333-G337 PolarHBondContact O-N 3.3Å; F333-N338 WeakPolarHBondContact CA-O 3.42Å; F333-L339 HydrophobicContact CB-CB 4.47Å; F333-L339 HydrophobicContact CB-CD1 3.83Å; F333-L339 HydrophobicContact CD1-CD1 4.38Å; F333-L339 HydrophobicContact CD2-CB 3.77Å; F333-L339 HydrophobicContact CD2-CD1 4.32Å; F333-L339 HydrophobicContact CE2-CB 4.32Å; F333-L339 HydrophobicContact CG-CB 4.22Å; F333-L339 HydrophobicContact CG-CD1 3.9Å; F333-M358 HydrophobicContact CD1-CE 4.04Å; F333-M358 HydrophobicContact CE1-CE 3.82Å; F333-V361 HydrophobicContact CD1-CG2 4Å; F333-V361 HydrophobicContact CE1-CG2 3.4Å; F333-V361 HydrophobicContact CZ-CG2 3.95Å; F333-Y389 HydrophobicContact CD2-CD2 4.28Å; F333-Y389 HydrophobicContact CD2-CE2 4.35Å; F333-Y389 AromaticContact CE2-CD2 3.44Å; F333-Y389 HydrophobicContact CE2-CD2 3.44Å; F333-Y389 VanDerWaalsContact CE2-CD2 3.44Å; F333-Y389 AromaticContact CE2-CE2 3.61Å; F333-Y389 HydrophobicContact CE2-CE2 3.61Å; F333-Y389 AromaticContact CE2-CG 3.96Å; F333-Y389 HydrophobicContact CE2-CG 3.96Å; F333-Y389 HydrophobicContact CZ-CD2 4.14Å; F333-Y389 HydrophobicContact CZ-CE2 4.06Å; F333-Y389 HydrophobicContact CZ-CG 4.4Å; F333-F410 HydrophobicContact CE2-CE2 4.15Å; F333-F410 HydrophobicContact CZ-CE2 4.17Å
334	L	86.9	Confident	86.2	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-63.4	-22.5	178.1	-75.1	174.7	0	0	0	113.7	I291 L292 I330 L331 D332 M358 W411	I291-L334 HydrophobicContact CG2-CB 4.12Å; L292-L334 HydrophobicContact CD2-CD1 4.17Å; I330-L334 HydrophobicContact CG2-CD1 4.42Å; I330-L334 WeakPolarHBondContact O-CG 3.49Å; I330-L334 PolarHBondContact O-N 2.91Å; L331-L334 PolarHBondContact O-N 3.13Å; D332-L334 VanDerWaalsContact C-N 3.34Å; D332-L334 PolarHBondContact O-N 2.81Å; L334-M358 HydrophobicContact CD2-CE 3.62Å; L334-M358 HydrophobicContact CG-CE 4.19Å; L334-W411 HydrophobicContact CD2-CH2 4.27Å; L334-W411 HydrophobicContact CD2-CZ2 3.62Å
335	Y	86.9	Confident	86.3	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-110.4	-7.9	-177.2	-81.9	-97.6	0	0	0	114.4	L261 L264 D265 R268 H288 I291 L331 D332 F333	L261-Y335 WeakPolarHBondContact CD2-O 3.33Å; L261-Y335 WeakPolarHBondContact CG-O 3.46Å; L264-Y335 HydrophobicContact CB-CD1 4.4Å; L264-Y335 HydrophobicContact CB-CE1 4.23Å; L264-Y335 WeakPolarHBondContact O-CE1 3.08Å; D265-Y335 HydrophobicContact CB-CD1 4.12Å; R268-Y335 HydrophobicContact CB-CD1 4.28Å; R268-Y335 HydrophobicContact CB-CE1 3.86Å; R268-Y335 HydrophobicContact CG-CE1 4.41Å; H288-Y335 WeakPolarHBondContact CB-OH 3.37Å; H288-Y335 AromaticContact CE1-CE1 3.99Å; H288-Y335 PolarHBondContact N-OH 3.16Å; H288-Y335 AromaticContact ND1-CE1 3.47Å; H288-Y335 WeakPolarHBondContact ND1-CE1 3.06Å; H288-Y335 AromaticContact ND1-CZ 3.6Å; H288-Y335 PolarHBondContact ND1-OH 3.11Å; I291-Y335 HydrophobicContact CB-CE2 4.15Å; I291-Y335 HydrophobicContact CG1-CE1 4.2Å; I291-Y335 HydrophobicContact CG2-CD2 3.92Å; I291-Y335 HydrophobicContact CG2-CE1 4.48Å; I291-Y335 HydrophobicContact CG2-CE2 3.59Å; L331-Y335 HydrophobicContact CD1-CD2 4.45Å; L331-Y335 HydrophobicContact CD1-CE2 4.14Å; L331-Y335 WeakPolarHBondContact O-CD2 3.48Å; L331-Y335 PolarHBondContact O-N 3.04Å; D332-Y335 PolarHBondContact O-N 2.94Å; F333-Y335 PolarHBondContact O-N 3.46Å
336	S	82.5	Confident	86.3	Confident	33 Å²	33	27.8 Å²	27.8	23%	0.231	16%	0.156	C	C	.	.	H	α-helix	trans	-121.8	-22.1	177.4	63.9	0	0	0	0	114.4	D332 F333 N338	D332-S336 WeakPolarHBondContact O-CB 3.44Å; D332-S336 PolarHBondContact O-N 2.8Å; D332-S336 PolarHBondContact O-OG 3.28Å; F333-S336 PolarHBondContact O-N 2.89Å; S336-N338 PolarHBondContact O-N 3.41Å; S336-N338 PolarHBondContact OG-N 3.23Å; S336-N338 VanDerWaalsContact OG-N 3.15Å; S336-N338 PolarHBondContact OG-O 3.35Å
337	G	79.5	Confident	86.2	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	73.5	-1.3	-167.7	0	0	0	0	0	114.8	F333 Y389 F410	F333-G337 WeakPolarHBondContact CE2-O 3.02Å; F333-G337 WeakPolarHBondContact O-CA 3.35Å; F333-G337 PolarHBondContact O-N 3.3Å; G337-Y389 PolarHBondContact O-N 3.3Å; G337-F410 VanDerWaalsContact CA-CZ 3.41Å
338	N	79.8	Confident	86.1	Confident	44 Å²	44	36.2 Å²	36.2	24%	0.235	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.9	-176.9	-63.1	-28.2	0	0	0	110	F333 S336 V386 D388 N390	F333-N338 WeakPolarHBondContact CA-O 3.42Å; S336-N338 PolarHBondContact O-N 3.41Å; S336-N338 PolarHBondContact OG-N 3.23Å; S336-N338 VanDerWaalsContact OG-N 3.15Å; S336-N338 PolarHBondContact OG-O 3.35Å; N338-V386 HydrophobicContact CB-CG1 4.35Å; N338-D388 PolarHBondContact OD1-OD1 2.8Å; N338-N390 PolarHBondContact OD1-ND2 3.08Å
339	L	85.7	Confident	86.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	105.2	-178.7	-175.7	74.4	0	0	0	109.7	V329 F333 L341 V349 V361 V387 Y389	V329-L339 HydrophobicContact CG1-CD1 4.33Å; F333-L339 HydrophobicContact CB-CB 4.47Å; F333-L339 HydrophobicContact CB-CD1 3.83Å; F333-L339 HydrophobicContact CD1-CD1 4.38Å; F333-L339 HydrophobicContact CD2-CB 3.77Å; F333-L339 HydrophobicContact CD2-CD1 4.32Å; F333-L339 HydrophobicContact CE2-CB 4.32Å; F333-L339 HydrophobicContact CG-CB 4.22Å; F333-L339 HydrophobicContact CG-CD1 3.9Å; L339-L341 HydrophobicContact CD2-CD1 4.1Å; L339-L341 HydrophobicContact CD2-CD2 4.05Å; L339-L341 HydrophobicContact CD2-CG 4.06Å; L339-L341 HydrophobicContact CG-CD2 4.02Å; L339-L341 HydrophobicContact CG-CG 4.09Å; L339-L341 PolarHBondContact O-N 2.96Å; L339-V349 HydrophobicContact CD1-CG1 4.05Å; L339-V361 HydrophobicContact CD1-CG1 4.17Å; L339-V361 HydrophobicContact CD2-CG1 3.87Å; L339-V387 HydrophobicContact CB-CB 4.3Å; L339-V387 PolarHBondContact N-O 3.04Å; L339-V387 PolarHBondContact O-N 3.42Å; L339-Y389 HydrophobicContact CB-CD2 4.34Å; L339-Y389 HydrophobicContact CB-CE2 3.72Å; L339-Y389 HydrophobicContact CD2-CE2 3.96Å
340	L	82.3	Confident	86.2	Confident	83 Å²	83	36.1 Å²	36.1	44%	0.435	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	103.4	177.5	179.9	65.2	0	0	0	110.6	N345 V386	L340-N345 PolarHBondContact O-ND2 3.02Å; L340-V386 HydrophobicContact CD1-CG2 3.87Å
341	L	86.9	Confident	86.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	136.4	173.9	-62.6	-178	0	0	0	110.8	L339 N345 V349 F368 V385 V387	L339-L341 HydrophobicContact CD2-CD1 4.1Å; L339-L341 HydrophobicContact CD2-CD2 4.05Å; L339-L341 HydrophobicContact CD2-CG 4.06Å; L339-L341 HydrophobicContact CG-CD2 4.02Å; L339-L341 HydrophobicContact CG-CG 4.09Å; L339-L341 PolarHBondContact O-N 2.96Å; L341-N345 WeakPolarHBondContact CA-OD1 3.39Å; L341-V349 HydrophobicContact CD2-CB 4.13Å; L341-V349 HydrophobicContact CD2-CG1 3.85Å; L341-V349 HydrophobicContact CD2-CG2 4.44Å; L341-F368 HydrophobicContact CB-CD1 4.04Å; L341-F368 HydrophobicContact CB-CD2 4.43Å; L341-F368 HydrophobicContact CB-CE1 4.18Å; L341-F368 HydrophobicContact CB-CG 4.17Å; L341-F368 HydrophobicContact CB-CZ 4.44Å; L341-F368 HydrophobicContact CD1-CB 3.81Å; L341-F368 HydrophobicContact CD1-CD1 4.24Å; L341-F368 HydrophobicContact CD1-CG 4.01Å; L341-V385 PolarHBondContact N-O 3.19Å; L341-V385 PolarHBondContact O-N 3.4Å; L341-V387 HydrophobicContact CD1-CG2 4.05Å; L341-V387 HydrophobicContact CG-CG2 4.46Å
342	T	84.8	Confident	86.3	Confident	31 Å²	31	39.7 Å²	39.7	19%	0.19	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	160.7	170.8	70.4	0	0	0	0	109	Q344 N345 A346 F368	T342-Q344 PolarHBondContact O-N 3.3Å; T342-N345 PolarHBondContact N-OD1 2.97Å; T342-N345 PolarHBondContact O-N 3.48Å; T342-N345 PolarHBondContact O-OD1 3.24Å; T342-N345 PolarHBondContact OG1-N 3.49Å; T342-N345 VanDerWaalsContact OG1-N 3.1Å; T342-A346 VanDerWaalsContact O-CB 3.29Å; T342-A346 WeakPolarHBondContact O-CB 3.42Å; T342-A346 PolarHBondContact O-N 3.39Å; T342-F368 WeakPolarHBondContact O-CE1 3.31Å
343	S	79.9	Confident	86.5	Confident	87 Å²	87	36.5 Å²	36.5	61%	0.608	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-41.5	174.3	50.1	0	0	0	0	112.2
344	Q	82.9	Confident	86.7	Confident	160 Å²	160	39.9 Å²	39.9	75%	0.748	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-41.6	179.9	-167.4	64.6	23.1	0	0	113.6	T342	T342-Q344 PolarHBondContact O-N 3.3Å
345	N	86.6	Confident	86.9	Confident	19 Å²	19	44 Å²	44	10%	0.102	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-17.8	-172.3	85.5	4.2	0	0	0	114.3	L340 L341 T342 I347 E348 V349	L340-N345 PolarHBondContact O-ND2 3.02Å; L341-N345 WeakPolarHBondContact CA-OD1 3.39Å; T342-N345 PolarHBondContact N-OD1 2.97Å; T342-N345 PolarHBondContact O-N 3.48Å; T342-N345 PolarHBondContact O-OD1 3.24Å; T342-N345 PolarHBondContact OG1-N 3.49Å; T342-N345 VanDerWaalsContact OG1-N 3.1Å; N345-I347 VanDerWaalsContact C-N 3.28Å; N345-I347 PolarHBondContact O-N 3.33Å; N345-E348 WeakPolarHBondContact O-CB 3.49Å; N345-E348 PolarHBondContact O-N 2.94Å; N345-E348 VanDerWaalsContact O-N 3.13Å; N345-V349 HydrophobicContact CB-CG2 4.46Å; N345-V349 WeakPolarHBondContact O-CG2 3.47Å; N345-V349 PolarHBondContact O-N 3.46Å
346	A	86.9	Confident	87.1	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-63.7	-30.4	-167.1	0	0	0	0	0	114	T342 M350 F368 I369	T342-A346 VanDerWaalsContact O-CB 3.29Å; T342-A346 WeakPolarHBondContact O-CB 3.42Å; T342-A346 PolarHBondContact O-N 3.39Å; A346-M350 WeakPolarHBondContact O-CB 3.42Å; A346-M350 PolarHBondContact O-N 3.17Å; A346-F368 HydrophobicContact CB-CD1 3.61Å; A346-F368 HydrophobicContact CB-CE1 3.68Å; A346-I369 HydrophobicContact CB-CD1 4.29Å; A346-I369 HydrophobicContact CB-CG1 4.07Å
347	I	87.4	Confident	87.5	Confident	110 Å²	110	46.6 Å²	46.6	56%	0.564	25%	0.247	S	C	*	.	H	α-helix	trans	-72.5	-43.7	176.4	-58.5	177.7	0	0	0	110.7	N345 M350 T351 I369	N345-I347 VanDerWaalsContact C-N 3.28Å; N345-I347 PolarHBondContact O-N 3.33Å; I347-M350 PolarHBondContact O-N 2.9Å; I347-T351 WeakPolarHBondContact O-CG2 3.49Å; I347-T351 PolarHBondContact O-N 3.21Å; I347-T351 PolarHBondContact O-OG1 3.45Å; I347-I369 HydrophobicContact CG1-CD1 4.4Å
348	E	90.2	Very high	87.9	Confident	70 Å²	70	47 Å²	47	33%	0.327	25%	0.25	S	C	.	.	H	α-helix	trans	-59.1	-54.9	173.5	-76.3	-170.7	-143.7	0	0	111	A323 G326 N345 M350 T351 V352	A323-E348 HydrophobicContact CB-CB 4Å; A323-E348 HydrophobicContact CB-CG 3.86Å; G326-E348 PolarHBondContact N-OE2 3.47Å; N345-E348 WeakPolarHBondContact O-CB 3.49Å; N345-E348 PolarHBondContact O-N 2.94Å; N345-E348 VanDerWaalsContact O-N 3.13Å; E348-M350 PolarHBondContact O-N 3.29Å; E348-T351 PolarHBondContact O-N 2.86Å; E348-T351 PolarHBondContact O-OG1 2.97Å; E348-V352 WeakPolarHBondContact O-CG2 3.13Å; E348-V352 PolarHBondContact O-N 3.38Å
349	V	90.9	Very high	88.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-57.6	-38.4	179.4	177.4	0	0	0	0	110.8	V329 I330 L339 L341 N345 A353 V361	V329-V349 HydrophobicContact CB-CG2 3.99Å; V329-V349 HydrophobicContact CG1-CG2 3.85Å; I330-V349 HydrophobicContact CD1-CG1 4.3Å; I330-V349 HydrophobicContact CG1-CG1 4.04Å; L339-V349 HydrophobicContact CD1-CG1 4.05Å; L341-V349 HydrophobicContact CD2-CB 4.13Å; L341-V349 HydrophobicContact CD2-CG1 3.85Å; L341-V349 HydrophobicContact CD2-CG2 4.44Å; N345-V349 HydrophobicContact CB-CG2 4.46Å; N345-V349 WeakPolarHBondContact O-CG2 3.47Å; N345-V349 PolarHBondContact O-N 3.46Å; V349-A353 WeakPolarHBondContact O-CB 3.29Å; V349-A353 PolarHBondContact O-N 3.34Å; V349-V361 HydrophobicContact CG1-CG1 4.33Å
350	M	91.1	Very high	88.3	Confident	44 Å²	44	52.9 Å²	52.9	22%	0.217	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-42.9	175.2	-174.2	173.7	56.6	0	0	113.2	A346 I347 E348 S354 V362 C365 R366 I369	A346-M350 WeakPolarHBondContact O-CB 3.42Å; A346-M350 PolarHBondContact O-N 3.17Å; I347-M350 PolarHBondContact O-N 2.9Å; E348-M350 PolarHBondContact O-N 3.29Å; M350-S354 VanDerWaalsContact O-CB 3.32Å; M350-S354 WeakPolarHBondContact O-CB 3.26Å; M350-S354 PolarHBondContact O-N 2.93Å; M350-V362 HydrophobicContact CG-CG1 3.84Å; M350-C365 HydrophobicContact CB-CB 3.77Å; M350-C365 HydrophobicContact CG-CB 4.08Å; M350-C365 HydrophobicContact SD-CB 4.43Å; M350-R366 HydrophobicContact SD-CG 3.55Å; M350-R366 VanDerWaalsContact SD-CG 3.55Å; M350-I369 HydrophobicContact CE-CD1 3.68Å; M350-I369 HydrophobicContact SD-CD1 3.95Å
351	T	91.3	Very high	88.6	Confident	76 Å²	76	49 Å²	49	47%	0.466	26%	0.26	S	S	.	.	H	α-helix	trans	-68.4	-44.6	179.5	55.1	0	0	0	0	111.6	I347 E348 S354 Y355	I347-T351 WeakPolarHBondContact O-CG2 3.49Å; I347-T351 PolarHBondContact O-N 3.21Å; I347-T351 PolarHBondContact O-OG1 3.45Å; E348-T351 PolarHBondContact O-N 2.86Å; E348-T351 PolarHBondContact O-OG1 2.97Å; T351-S354 WeakPolarHBondContact O-CB 3.43Å; T351-S354 PolarHBondContact O-N 3.15Å; T351-Y355 PolarHBondContact O-N 3.16Å
352	V	92.5	Very high	88.7	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-66.3	-41.4	177.3	-175.4	0	0	0	0	111.4	I321 A323 F327 I330 E348 S354 Y355 L356	I321-V352 HydrophobicContact CD1-CG1 3.94Å; I321-V352 HydrophobicContact CG2-CG1 4.48Å; I321-V352 HydrophobicContact CG2-CG2 3.63Å; A323-V352 HydrophobicContact CB-CG2 3.68Å; F327-V352 HydrophobicContact CB-CG1 4.11Å; F327-V352 HydrophobicContact CD2-CG1 3.95Å; I330-V352 HydrophobicContact CD1-CB 3.68Å; I330-V352 HydrophobicContact CD1-CG1 3.66Å; E348-V352 WeakPolarHBondContact O-CG2 3.13Å; E348-V352 PolarHBondContact O-N 3.38Å; V352-S354 VanDerWaalsContact C-N 3.26Å; V352-S354 PolarHBondContact O-N 3.12Å; V352-Y355 PolarHBondContact O-N 3.33Å; V352-L356 HydrophobicContact CG1-CD1 3.9Å; V352-L356 HydrophobicContact CG1-CG 4.34Å; V352-L356 WeakPolarHBondContact O-CB 3.13Å; V352-L356 WeakPolarHBondContact O-CG 3.47Å; V352-L356 PolarHBondContact O-N 2.92Å
353	A	91.9	Very high	88.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.9	-30.7	174.6	0	0	0	0	0	112.6	I330 V349 Q357 M358 V361 V362	I330-A353 HydrophobicContact CD1-CB 3.81Å; I330-A353 VanDerWaalsContact CD1-N 3.35Å; V349-A353 WeakPolarHBondContact O-CB 3.29Å; V349-A353 PolarHBondContact O-N 3.34Å; A353-Q357 PolarHBondContact O-N 2.89Å; A353-Q357 VanDerWaalsContact O-N 3.14Å; A353-M358 HydrophobicContact CB-CB 4.32Å; A353-M358 PolarHBondContact O-N 2.81Å; A353-V361 HydrophobicContact CB-CB 3.93Å; A353-V361 HydrophobicContact CB-CG1 3.53Å; A353-V362 VanDerWaalsContact C-CG2 3.42Å; A353-V362 HydrophobicContact CB-CG2 3.63Å
354	S	93.1	Very high	89.3	Confident	75 Å²	75	50 Å²	50	52%	0.524	25%	0.254	S	S	.	.	H	α-helix	trans	-68.6	-47.5	173.9	-166.4	0	0	0	0	111.2	M350 T351 V352 L356 Q357	M350-S354 VanDerWaalsContact O-CB 3.32Å; M350-S354 WeakPolarHBondContact O-CB 3.26Å; M350-S354 PolarHBondContact O-N 2.93Å; T351-S354 WeakPolarHBondContact O-CB 3.43Å; T351-S354 PolarHBondContact O-N 3.15Å; V352-S354 VanDerWaalsContact C-N 3.26Å; V352-S354 PolarHBondContact O-N 3.12Å; S354-L356 PolarHBondContact O-N 3.14Å; S354-Q357 PolarHBondContact O-N 3.34Å
355	Y	92.2	Very high	89.6	Confident	88 Å²	88	42.4 Å²	42.4	35%	0.345	22%	0.218	S	C	.	.	H	α-helix	trans	-57	-48.3	173.8	-173.2	-71	0	0	0	111.4	Y298 L319 I321 T351 V352 Q357	Y298-Y355 HydrophobicContact CD1-CE1 4.49Å; Y298-Y355 HydrophobicContact CD2-CD1 4.47Å; Y298-Y355 HydrophobicContact CD2-CE1 4.09Å; Y298-Y355 HydrophobicContact CE1-CE1 4.06Å; Y298-Y355 HydrophobicContact CE2-CD1 4.42Å; Y298-Y355 AromaticContact CE2-CE1 3.62Å; Y298-Y355 HydrophobicContact CE2-CE1 3.62Å; Y298-Y355 AromaticContact CZ-CE1 3.61Å; L319-Y355 HydrophobicContact CD1-CD1 4.01Å; L319-Y355 HydrophobicContact CD1-CE1 3.33Å; I321-Y355 HydrophobicContact CD1-CD1 3.73Å; I321-Y355 HydrophobicContact CD1-CD2 4.11Å; I321-Y355 HydrophobicContact CD1-CE1 4.21Å; I321-Y355 HydrophobicContact CD1-CG 3.69Å; I321-Y355 HydrophobicContact CG1-CD1 4.44Å; I321-Y355 HydrophobicContact CG1-CD2 4.1Å; I321-Y355 HydrophobicContact CG1-CE2 4.26Å; I321-Y355 HydrophobicContact CG1-CG 4.2Å; T351-Y355 PolarHBondContact O-N 3.16Å; V352-Y355 PolarHBondContact O-N 3.33Å; Y355-Q357 PolarHBondContact O-N 2.96Å; Y355-Q357 VanDerWaalsContact O-N 3.14Å
356	L	90.9	Very high	89.6	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	3.2	178.9	-64.1	176.8	0	0	0	113.9	S296 Y298 F299 L319 F327 I330 V352 S354 M358	S296-L356 PolarHBondContact OG-O 3.47Å; Y298-L356 HydrophobicContact CD1-CD2 3.74Å; Y298-L356 HydrophobicContact CE1-CD2 4.37Å; Y298-L356 HydrophobicContact CG-CD2 4.3Å; F299-L356 HydrophobicContact CD2-CD2 4.22Å; F299-L356 HydrophobicContact CE1-CD2 4.45Å; F299-L356 HydrophobicContact CE2-CD1 4.29Å; F299-L356 HydrophobicContact CE2-CD2 3.58Å; F299-L356 HydrophobicContact CZ-CD2 3.71Å; L319-L356 HydrophobicContact CD2-CD2 4.49Å; F327-L356 HydrophobicContact CD2-CD1 4.1Å; F327-L356 HydrophobicContact CE2-CD1 3.95Å; I330-L356 HydrophobicContact CG2-CD1 4Å; V352-L356 HydrophobicContact CG1-CD1 3.9Å; V352-L356 HydrophobicContact CG1-CG 4.34Å; V352-L356 WeakPolarHBondContact O-CB 3.13Å; V352-L356 WeakPolarHBondContact O-CG 3.47Å; V352-L356 PolarHBondContact O-N 2.92Å; S354-L356 PolarHBondContact O-N 3.14Å; L356-M358 VanDerWaalsContact C-N 3.26Å; L356-M358 HydrophobicContact CB-CG 4.02Å; L356-M358 HydrophobicContact CB-SD 4.07Å; L356-M358 HydrophobicContact CD1-SD 4.34Å; L356-M358 PolarHBondContact O-N 2.82Å
357	Q	90.5	Very high	89.5	Confident	89 Å²	89	49.2 Å²	49.2	42%	0.416	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	30.4	177.1	-55.5	177.8	11.1	0	0	114.3	R297 A353 S354 Y355 T359	R297-Q357 HydrophobicContact CB-CB 3.93Å; A353-Q357 PolarHBondContact O-N 2.89Å; A353-Q357 VanDerWaalsContact O-N 3.14Å; S354-Q357 PolarHBondContact O-N 3.34Å; Y355-Q357 PolarHBondContact O-N 2.96Å; Y355-Q357 VanDerWaalsContact O-N 3.14Å; Q357-T359 PolarHBondContact O-N 2.9Å; Q357-T359 VanDerWaalsContact O-N 3.13Å
358	M	88.4	Confident	89.5	Confident	10 Å²	10	45.1 Å²	45.1	5%	0.049	23%	0.23	C	C	.	.			trans	-87.7	69.6	-177.4	-63.5	-179.7	70.7	0	0	110.7	I330 F333 L334 A353 L356 E360 V361 V362	I330-M358 HydrophobicContact CG2-CE 4.13Å; I330-M358 HydrophobicContact CG2-SD 3.62Å; F333-M358 HydrophobicContact CD1-CE 4.04Å; F333-M358 HydrophobicContact CE1-CE 3.82Å; L334-M358 HydrophobicContact CD2-CE 3.62Å; L334-M358 HydrophobicContact CG-CE 4.19Å; A353-M358 HydrophobicContact CB-CB 4.32Å; A353-M358 PolarHBondContact O-N 2.81Å; L356-M358 VanDerWaalsContact C-N 3.26Å; L356-M358 HydrophobicContact CB-CG 4.02Å; L356-M358 HydrophobicContact CB-SD 4.07Å; L356-M358 HydrophobicContact CD1-SD 4.34Å; L356-M358 PolarHBondContact O-N 2.82Å; M358-E360 PolarHBondContact O-N 3.12Å; M358-V361 HydrophobicContact CB-CB 4.17Å; M358-V361 HydrophobicContact CB-CG2 4.21Å; M358-V361 HydrophobicContact CE-CG2 4.03Å; M358-V361 WeakPolarHBondContact O-CB 3.21Å; M358-V361 PolarHBondContact O-N 3.17Å; M358-V362 PolarHBondContact O-N 3.15Å; M358-V362 VanDerWaalsContact O-N 3.16Å
359	T	86.8	Confident	89.3	Confident	58 Å²	58	43.9 Å²	43.9	36%	0.356	23%	0.225	S	C	.	.	H	α-helix	trans	-53.7	-34	-166.3	51.3	0	0	0	0	115.5	Q357 Q363	Q357-T359 PolarHBondContact O-N 2.9Å; Q357-T359 VanDerWaalsContact O-N 3.13Å; T359-Q363 VanDerWaalsContact O-CG 3.31Å; T359-Q363 WeakPolarHBondContact O-CG 3.39Å; T359-Q363 PolarHBondContact O-N 3.18Å
360	E	86.1	Confident	89.1	Confident	108 Å²	108	50.7 Å²	50.7	51%	0.505	25%	0.254	S	S	.	.	H	α-helix	trans	-70.4	-39.4	178.3	-68.8	165.8	-155.6	0	0	112	M358 Q363 S364	M358-E360 PolarHBondContact O-N 3.12Å; E360-Q363 WeakPolarHBondContact O-CB 3.33Å; E360-Q363 PolarHBondContact O-N 3.1Å; E360-S364 PolarHBondContact O-N 3.34Å; E360-S364 PolarHBondContact O-OG 2.86Å
361	V	88.8	Confident	88.5	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-64.5	-47.5	174.5	176.8	0	0	0	0	110.1	F333 L339 V349 A353 M358 Q363 S364 C365	F333-V361 HydrophobicContact CD1-CG2 4Å; F333-V361 HydrophobicContact CE1-CG2 3.4Å; F333-V361 HydrophobicContact CZ-CG2 3.95Å; L339-V361 HydrophobicContact CD1-CG1 4.17Å; L339-V361 HydrophobicContact CD2-CG1 3.87Å; V349-V361 HydrophobicContact CG1-CG1 4.33Å; A353-V361 HydrophobicContact CB-CB 3.93Å; A353-V361 HydrophobicContact CB-CG1 3.53Å; M358-V361 HydrophobicContact CB-CB 4.17Å; M358-V361 HydrophobicContact CB-CG2 4.21Å; M358-V361 HydrophobicContact CE-CG2 4.03Å; M358-V361 WeakPolarHBondContact O-CB 3.21Å; M358-V361 PolarHBondContact O-N 3.17Å; V361-Q363 PolarHBondContact O-N 3.36Å; V361-S364 PolarHBondContact O-N 3.06Å; V361-S364 VanDerWaalsContact O-N 3.11Å; V361-C365 PolarHBondContact O-N 3.24Å; V361-C365 PolarHBondContact O-SG 3.49Å
362	V	90.1	Very high	87.8	Confident	9 Å²	9	50.8 Å²	50.8	6%	0.055	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-29.4	176.7	-165.8	0	0	0	0	111.7	M350 A353 M358 R366	M350-V362 HydrophobicContact CG-CG1 3.84Å; A353-V362 VanDerWaalsContact C-CG2 3.42Å; A353-V362 HydrophobicContact CB-CG2 3.63Å; M358-V362 PolarHBondContact O-N 3.15Å; M358-V362 VanDerWaalsContact O-N 3.16Å; V362-R366 VanDerWaalsContact CG1-CZ 3.5Å; V362-R366 WeakPolarHBondContact O-CB 3.39Å; V362-R366 WeakPolarHBondContact O-CG 3.48Å; V362-R366 PolarHBondContact O-N 2.93Å; V362-R366 PolarHBondContact O-NE 2.9Å
363	Q	87.5	Confident	86.8	Confident	119 Å²	119	56.1 Å²	56.1	56%	0.556	29%	0.285	S	S	*	.	H	α-helix	trans	-70.3	-46.1	171.7	-78.4	172.2	-11.9	0	0	111.8	T359 E360 V361 C365 R366 A367	T359-Q363 VanDerWaalsContact O-CG 3.31Å; T359-Q363 WeakPolarHBondContact O-CG 3.39Å; T359-Q363 PolarHBondContact O-N 3.18Å; E360-Q363 WeakPolarHBondContact O-CB 3.33Å; E360-Q363 PolarHBondContact O-N 3.1Å; V361-Q363 PolarHBondContact O-N 3.36Å; Q363-C365 PolarHBondContact O-N 2.79Å; Q363-R366 PolarHBondContact O-N 3.47Å; Q363-A367 PolarHBondContact O-N 3.16Å
364	S	88.4	Confident	85.5	Confident	10 Å²	10	60.9 Å²	60.9	7%	0.07	31%	0.311	C	S	.	.	H	α-helix	trans	-62	-41.2	175.2	-64.7	0	0	0	0	112.8	E360 V361 R366 A367 F368 Y389 R392	E360-S364 PolarHBondContact O-N 3.34Å; E360-S364 PolarHBondContact O-OG 2.86Å; V361-S364 PolarHBondContact O-N 3.06Å; V361-S364 VanDerWaalsContact O-N 3.11Å; S364-R366 PolarHBondContact O-N 3.26Å; S364-A367 PolarHBondContact O-N 3.14Å; S364-F368 WeakPolarHBondContact O-CB 3.48Å; S364-F368 PolarHBondContact O-N 2.69Å; S364-Y389 WeakPolarHBondContact CB-OH 3.5Å; S364-Y389 PolarHBondContact OG-OH 3.31Å; S364-R392 PolarHBondContact OG-NH2 3.15Å
365	C	89	Confident	83.8	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.7	-40.7	175.1	-60	0	0	0	0	111.9	M350 V361 Q363 F368 I369	M350-C365 HydrophobicContact CB-CB 3.77Å; M350-C365 HydrophobicContact CG-CB 4.08Å; M350-C365 HydrophobicContact SD-CB 4.43Å; V361-C365 PolarHBondContact O-N 3.24Å; V361-C365 PolarHBondContact O-SG 3.49Å; Q363-C365 PolarHBondContact O-N 2.79Å; C365-F368 PolarHBondContact O-N 3.14Å; C365-I369 WeakPolarHBondContact O-CB 3.42Å; C365-I369 WeakPolarHBondContact O-CD1 3.48Å; C365-I369 VanDerWaalsContact O-CG1 3.25Å; C365-I369 WeakPolarHBondContact O-CG1 3.36Å; C365-I369 PolarHBondContact O-N 3.4Å
366	R	87.8	Confident	81.9	Confident	121 Å²	121	60.8 Å²	60.8	46%	0.457	32%	0.318	S	S	.	.	H	α-helix	trans	-68.5	-31	175	-77.9	178.3	-69	-146.5	-1.8	113.5	M350 V362 Q363 S364 K370	M350-R366 HydrophobicContact SD-CG 3.55Å; M350-R366 VanDerWaalsContact SD-CG 3.55Å; V362-R366 VanDerWaalsContact CG1-CZ 3.5Å; V362-R366 WeakPolarHBondContact O-CB 3.39Å; V362-R366 WeakPolarHBondContact O-CG 3.48Å; V362-R366 PolarHBondContact O-N 2.93Å; V362-R366 PolarHBondContact O-NE 2.9Å; Q363-R366 PolarHBondContact O-N 3.47Å; S364-R366 PolarHBondContact O-N 3.26Å; R366-K370 WeakPolarHBondContact O-CB 3.28Å; R366-K370 VanDerWaalsContact O-CG 3.27Å; R366-K370 WeakPolarHBondContact O-CG 3.33Å; R366-K370 PolarHBondContact O-N 3.25Å
367	A	85.4	Confident	80.1	Confident	42 Å²	42	67.5 Å²	67.5	35%	0.347	35%	0.353	S	S	.	.	H	α-helix	trans	-66	-55.6	170.5	0	0	0	0	0	109.8	Q363 S364 I369 K370 D371	Q363-A367 PolarHBondContact O-N 3.16Å; S364-A367 PolarHBondContact O-N 3.14Å; A367-I369 VanDerWaalsContact C-N 3.32Å; A367-I369 PolarHBondContact O-N 3.24Å; A367-K370 CarbonylContact O-C 3.45Å; A367-K370 WeakPolarHBondContact O-CA 3.2Å; A367-K370 WeakPolarHBondContact O-CB 3.46Å; A367-K370 PolarHBondContact O-N 3.36Å; A367-D371 VanDerWaalsContact O-CG 3.27Å; A367-D371 PolarHBondContact O-N 2.92Å
368	F	87.1	Confident	78.1	Confident	25 Å²	25	71.1 Å²	71.1	11%	0.11	37%	0.367	C	S	.	.	H	α-helix	trans	-53.2	-44	177.9	175.5	-101.8	0	0	0	113.3	L341 T342 A346 S364 C365 D371 A372 V385	L341-F368 HydrophobicContact CB-CD1 4.04Å; L341-F368 HydrophobicContact CB-CD2 4.43Å; L341-F368 HydrophobicContact CB-CE1 4.18Å; L341-F368 HydrophobicContact CB-CG 4.17Å; L341-F368 HydrophobicContact CB-CZ 4.44Å; L341-F368 HydrophobicContact CD1-CB 3.81Å; L341-F368 HydrophobicContact CD1-CD1 4.24Å; L341-F368 HydrophobicContact CD1-CG 4.01Å; T342-F368 WeakPolarHBondContact O-CE1 3.31Å; A346-F368 HydrophobicContact CB-CD1 3.61Å; A346-F368 HydrophobicContact CB-CE1 3.68Å; S364-F368 WeakPolarHBondContact O-CB 3.48Å; S364-F368 PolarHBondContact O-N 2.69Å; C365-F368 PolarHBondContact O-N 3.14Å; F368-D371 PolarHBondContact O-N 2.79Å; F368-A372 VanDerWaalsContact O-CB 3.26Å; F368-A372 WeakPolarHBondContact O-CB 3.35Å; F368-A372 PolarHBondContact O-N 3.23Å; F368-V385 HydrophobicContact CD2-CB 4.03Å; F368-V385 HydrophobicContact CD2-CG1 4.48Å; F368-V385 HydrophobicContact CD2-CG2 4.2Å; F368-V385 HydrophobicContact CE2-CB 3.72Å; F368-V385 HydrophobicContact CE2-CG2 3.66Å
369	I	86.4	Confident	76.1	Confident	44 Å²	44	79.8 Å²	79.8	23%	0.226	41%	0.407	C	S	.	.	H	α-helix	trans	-65.4	-41.1	176.7	-68.4	164	0	0	0	111.5	A346 I347 M350 C365 A367 L373	A346-I369 HydrophobicContact CB-CD1 4.29Å; A346-I369 HydrophobicContact CB-CG1 4.07Å; I347-I369 HydrophobicContact CG1-CD1 4.4Å; M350-I369 HydrophobicContact CE-CD1 3.68Å; M350-I369 HydrophobicContact SD-CD1 3.95Å; C365-I369 WeakPolarHBondContact O-CB 3.42Å; C365-I369 WeakPolarHBondContact O-CD1 3.48Å; C365-I369 VanDerWaalsContact O-CG1 3.25Å; C365-I369 WeakPolarHBondContact O-CG1 3.36Å; C365-I369 PolarHBondContact O-N 3.4Å; A367-I369 VanDerWaalsContact C-N 3.32Å; A367-I369 PolarHBondContact O-N 3.24Å; I369-L373 HydrophobicContact CG2-CD1 3.99Å; I369-L373 WeakPolarHBondContact O-CB 3.29Å; I369-L373 VanDerWaalsContact O-CG 3.22Å; I369-L373 WeakPolarHBondContact O-CG 3.32Å; I369-L373 PolarHBondContact O-N 3.02Å
370	K	85	Confident	74.3	Confident	143 Å²	143	86 Å²	86	62%	0.622	43%	0.432	S	S	*	.	H	α-helix	trans	-64.9	-40.9	174.9	-77.8	179.7	174.9	-163.3	0	112	R366 A367 L373 N374	R366-K370 WeakPolarHBondContact O-CB 3.28Å; R366-K370 VanDerWaalsContact O-CG 3.27Å; R366-K370 WeakPolarHBondContact O-CG 3.33Å; R366-K370 PolarHBondContact O-N 3.25Å; A367-K370 CarbonylContact O-C 3.45Å; A367-K370 WeakPolarHBondContact O-CA 3.2Å; A367-K370 WeakPolarHBondContact O-CB 3.46Å; A367-K370 PolarHBondContact O-N 3.36Å; K370-L373 PolarHBondContact O-N 3.09Å; K370-N374 WeakPolarHBondContact O-CB 3.16Å; K370-N374 PolarHBondContact O-N 3.2Å; K370-N374 PolarHBondContact O-ND2 3.48Å; K370-N374 VanDerWaalsContact O-ND2 3.11Å
371	D	79.8	Confident	72.3	Confident	86 Å²	86	83.9 Å²	83.9	46%	0.46	43%	0.433	S	S	.	.	H	α-helix	trans	-69.9	-42.9	-179.6	-63.3	-31.6	0	0	0	110.4	A367 F368 L373 N374 I375	A367-D371 VanDerWaalsContact O-CG 3.27Å; A367-D371 PolarHBondContact O-N 2.92Å; F368-D371 PolarHBondContact O-N 2.79Å; D371-L373 VanDerWaalsContact C-N 3.35Å; D371-L373 PolarHBondContact O-N 3Å; D371-N374 CarbonylContact O-C 3.59Å; D371-N374 PolarHBondContact O-N 3.19Å; D371-N374 VanDerWaalsContact O-N 3.17Å; D371-I375 WeakPolarHBondContact O-CB 3.43Å; D371-I375 WeakPolarHBondContact O-CD1 3.4Å; D371-I375 WeakPolarHBondContact O-CG1 3.31Å; D371-I375 PolarHBondContact O-N 2.85Å
372	A	76.3	Confident	70.4	Confident	35 Å²	35	87.4 Å²	87.4	29%	0.289	46%	0.456	S	S	.	.	H	α-helix	trans	-60.2	-40	172	0	0	0	0	0	112.7	F368 I375 S376	F368-A372 VanDerWaalsContact O-CB 3.26Å; F368-A372 WeakPolarHBondContact O-CB 3.35Å; F368-A372 PolarHBondContact O-N 3.23Å; A372-I375 PolarHBondContact O-N 2.75Å; A372-S376 WeakPolarHBondContact O-CB 3.44Å; A372-S376 PolarHBondContact O-N 3.42Å
373	L	71.2	Confident	68.6	Low	113 Å²	113	93.8 Å²	93.8	59%	0.592	49%	0.49	S	S	*	.	H	α-helix	trans	-68.2	-35.2	174.3	-72	168.7	0	0	0	112.6	I369 K370 D371 S376	I369-L373 HydrophobicContact CG2-CD1 3.99Å; I369-L373 WeakPolarHBondContact O-CB 3.29Å; I369-L373 VanDerWaalsContact O-CG 3.22Å; I369-L373 WeakPolarHBondContact O-CG 3.32Å; I369-L373 PolarHBondContact O-N 3.02Å; K370-L373 PolarHBondContact O-N 3.09Å; D371-L373 VanDerWaalsContact C-N 3.35Å; D371-L373 PolarHBondContact O-N 3Å; L373-S376 PolarHBondContact O-N 3.29Å
374	N	65.4	Low	66.9	Low	101 Å²	101	91.3 Å²	91.3	54%	0.54	49%	0.486	S	S	.	.	H	α-helix	trans	-69.8	-36	172.5	-77	-41.7	0	0	0	112.4	K370 D371 I377	K370-N374 WeakPolarHBondContact O-CB 3.16Å; K370-N374 PolarHBondContact O-N 3.2Å; K370-N374 PolarHBondContact O-ND2 3.48Å; K370-N374 VanDerWaalsContact O-ND2 3.11Å; D371-N374 CarbonylContact O-C 3.59Å; D371-N374 PolarHBondContact O-N 3.19Å; D371-N374 VanDerWaalsContact O-N 3.17Å; N374-I377 WeakPolarHBondContact O-CB 3.49Å; N374-I377 PolarHBondContact O-N 2.95Å
375	I	56.8	Low	65.6	Low	59 Å²	59	93.2 Å²	93.2	30%	0.303	50%	0.497	S	S	.	.	H	α-helix	trans	-75.9	-26.3	176.3	-62.3	160.5	0	0	0	110.6	D371 A372 I377 K378 E380 A381	D371-I375 WeakPolarHBondContact O-CB 3.43Å; D371-I375 WeakPolarHBondContact O-CD1 3.4Å; D371-I375 WeakPolarHBondContact O-CG1 3.31Å; D371-I375 PolarHBondContact O-N 2.85Å; A372-I375 PolarHBondContact O-N 2.75Å; I375-I377 PolarHBondContact O-N 3.19Å; I375-K378 CarbonylContact O-C 3.15Å; I375-K378 PolarHBondContact O-N 2.93Å; I375-E380 WeakPolarHBondContact CG2-O 3.31Å; I375-A381 HydrophobicContact CG2-CB 3.74Å
376	S	51.8	Low	64.1	Low	101 Å²	101	97.5 Å²	97.5	71%	0.706	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-8.7	167.6	-168.5	0	0	0	0	113.9	A372 L373	A372-S376 WeakPolarHBondContact O-CB 3.44Å; A372-S376 PolarHBondContact O-N 3.42Å; L373-S376 PolarHBondContact O-N 3.29Å
377	I	54.1	Low	62.7	Low	142 Å²	142	92.8 Å²	92.8	73%	0.728	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-11.9	173.1	-56.9	169.8	0	0	0	111.5	N374 I375	N374-I377 WeakPolarHBondContact O-CB 3.49Å; N374-I377 PolarHBondContact O-N 2.95Å; I375-I377 PolarHBondContact O-N 3.19Å
378	K	48	Very low	61.1	Low	164 Å²	164	92 Å²	92	71%	0.713	50%	0.497	S	S	*	.	S	Bend	trans	-131.7	100.5	178.9	-69.5	-169.4	175.2	-167.6	0	109.9	I375	I375-K378 CarbonylContact O-C 3.15Å; I375-K378 PolarHBondContact O-N 2.93Å
379	Q	47	Very low	59.5	Low	192 Å²	192	91.8 Å²	91.8	90%	0.897	50%	0.496	S	S	*	.	S	Bend	trans	-36.5	142.2	-173.2	-67.5	170	-22.4	0	0	114.6
380	E	48.8	Very low	57.6	Low	188 Å²	188	91.6 Å²	91.6	88%	0.879	50%	0.495	S	S	*	.			trans	78.2	98.7	-175.6	-55.1	-177.9	177.3	0	0	114.9	I375	I375-E380 WeakPolarHBondContact CG2-O 3.31Å
381	A	44.2	Very low	55.9	Low	64 Å²	64	90.3 Å²	90.3	53%	0.529	49%	0.49	S	S	.	.			trans	-104.2	141.2	171.1	0	0	0	0	0	110.6	I375	I375-A381 HydrophobicContact CG2-CB 3.74Å
382	P	49.4	Very low	53.9	Low	77 Å²	77	91.5 Å²	91.5	50%	0.5	49%	0.488	S	S	.	.			trans	-75.4	126.5	173.9	29.9	-33.2	0	0	0	111.1	S384 V385	P382-S384 PolarHBondContact O-N 3.15Å; P382-S384 VanDerWaalsContact O-N 3.12Å; P382-V385 HydrophobicContact CB-CG2 4.46Å; P382-V385 HydrophobicContact CG-CG2 3.87Å
383	D	52.3	Low	51.8	Low	144 Å²	144	96.6 Å²	96.6	77%	0.77	51%	0.506	S	S	*	.	S	Bend	trans	-61.7	-21.7	-176.2	-66.5	-54.4	0	0	0	114.5
384	S	50.9	Low	49.8	Very low	67 Å²	67	96.6 Å²	96.6	47%	0.469	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	147.7	171.7	65.7	0	0	0	0	111.9	P382	P382-S384 PolarHBondContact O-N 3.15Å; P382-S384 VanDerWaalsContact O-N 3.12Å
385	V	61.3	Low	48	Very low	49 Å²	49	98.7 Å²	98.7	30%	0.297	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	111	174	174.8	0	0	0	0	109	L341 F368 P382 V387	L341-V385 PolarHBondContact N-O 3.19Å; L341-V385 PolarHBondContact O-N 3.4Å; F368-V385 HydrophobicContact CD2-CB 4.03Å; F368-V385 HydrophobicContact CD2-CG1 4.48Å; F368-V385 HydrophobicContact CD2-CG2 4.2Å; F368-V385 HydrophobicContact CE2-CB 3.72Å; F368-V385 HydrophobicContact CE2-CG2 3.66Å; P382-V385 HydrophobicContact CB-CG2 4.46Å; P382-V385 HydrophobicContact CG-CG2 3.87Å; V385-V387 HydrophobicContact CG1-CG2 4.14Å; V385-V387 PolarHBondContact O-N 3.24Å
386	V	57.7	Low	46.5	Very low	90 Å²	90	99.8 Å²	99.8	55%	0.545	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	106.7	169.3	-174.9	0	0	0	0	108.3	N338 L340 D388	N338-V386 HydrophobicContact CB-CG1 4.35Å; L340-V386 HydrophobicContact CD1-CG2 3.87Å; V386-D388 PolarHBondContact O-N 3.15Å; V386-D388 VanDerWaalsContact O-N 3.12Å
387	V	57.9	Low	45.5	Very low	22 Å²	22	104.5 Å²	104.5	13%	0.133	55%	0.552	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.9	86.7	170	-174.5	0	0	0	0	107.9	L339 L341 V385 Y389	L339-V387 HydrophobicContact CB-CB 4.3Å; L339-V387 PolarHBondContact N-O 3.04Å; L339-V387 PolarHBondContact O-N 3.42Å; L341-V387 HydrophobicContact CD1-CG2 4.05Å; L341-V387 HydrophobicContact CG-CG2 4.46Å; V385-V387 HydrophobicContact CG1-CG2 4.14Å; V385-V387 PolarHBondContact O-N 3.24Å; V387-Y389 HydrophobicContact CB-CE2 4.26Å; V387-Y389 HydrophobicContact CG1-CD2 4.03Å; V387-Y389 HydrophobicContact CG1-CE2 3.66Å; V387-Y389 VanDerWaalsContact O-CD2 3.26Å; V387-Y389 WeakPolarHBondContact O-CD2 3.19Å; V387-Y389 PolarHBondContact O-N 3.39Å
388	D	51.5	Low	44.4	Very low	26 Å²	26	107.1 Å²	107.1	14%	0.139	56%	0.562	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.2	112.2	169.9	-178	-20.1	0	0	0	109.1	N338 V386 N390 K391	N338-D388 PolarHBondContact OD1-OD1 2.8Å; V386-D388 PolarHBondContact O-N 3.15Å; V386-D388 VanDerWaalsContact O-N 3.12Å; D388-N390 VanDerWaalsContact C-N 3.28Å; D388-N390 PolarHBondContact O-N 3.03Å; D388-N390 WeakPolarHBondContact OD1-CA 3.33Å; D388-N390 WeakPolarHBondContact OD1-CB 3.5Å; D388-N390 PolarHBondContact OD1-N 3.4Å; D388-N390 PolarHBondContact OD1-ND2 3.12Å; D388-K391 HydrophobicContact CB-CB 4.24Å; D388-K391 PolarHBondContact O-N 3.48Å; D388-K391 PolarHBondContact OD1-N 3.22Å; D388-K391 VanDerWaalsContact OD1-N 3.15Å; D388-K391 VanDerWaalsContact OD2-CD 3.28Å; D388-K391 WeakPolarHBondContact OD2-CD 3.33Å; D388-K391 WeakPolarHBondContact OD2-CE 3.26Å; D388-K391 VanDerWaalsContact OD2-CG 3.26Å; D388-K391 WeakPolarHBondContact OD2-CG 3.45Å; D388-K391 IonicContact OD2-NZ 3.18Å; D388-K391 PolarHBondContact OD2-NZ 2.79Å
389	Y	54	Low	43.8	Very low	20 Å²	20	102.5 Å²	102.5	8%	0.078	56%	0.56	C	S	.	*	S	Bend	trans	-79	-11.3	179.7	-77.6	-109.9	0	0	0	113.1	F333 G337 L339 S364 V387	F333-Y389 HydrophobicContact CD2-CD2 4.28Å; F333-Y389 HydrophobicContact CD2-CE2 4.35Å; F333-Y389 AromaticContact CE2-CD2 3.44Å; F333-Y389 HydrophobicContact CE2-CD2 3.44Å; F333-Y389 VanDerWaalsContact CE2-CD2 3.44Å; F333-Y389 AromaticContact CE2-CE2 3.61Å; F333-Y389 HydrophobicContact CE2-CE2 3.61Å; F333-Y389 AromaticContact CE2-CG 3.96Å; F333-Y389 HydrophobicContact CE2-CG 3.96Å; F333-Y389 HydrophobicContact CZ-CD2 4.14Å; F333-Y389 HydrophobicContact CZ-CE2 4.06Å; F333-Y389 HydrophobicContact CZ-CG 4.4Å; G337-Y389 PolarHBondContact O-N 3.3Å; L339-Y389 HydrophobicContact CB-CD2 4.34Å; L339-Y389 HydrophobicContact CB-CE2 3.72Å; L339-Y389 HydrophobicContact CD2-CE2 3.96Å; S364-Y389 WeakPolarHBondContact CB-OH 3.5Å; S364-Y389 PolarHBondContact OG-OH 3.31Å; V387-Y389 HydrophobicContact CB-CE2 4.26Å; V387-Y389 HydrophobicContact CG1-CD2 4.03Å; V387-Y389 HydrophobicContact CG1-CE2 3.66Å; V387-Y389 VanDerWaalsContact O-CD2 3.26Å; V387-Y389 WeakPolarHBondContact O-CD2 3.19Å; V387-Y389 PolarHBondContact O-N 3.39Å
390	N	46.1	Very low	42.9	Very low	40 Å²	40	102.8 Å²	102.8	21%	0.214	56%	0.562	C	S	.	*	S	Bend	trans	-79.8	-29.4	173.3	-46.2	-80.3	0	0	0	111	N338 D388	N338-N390 PolarHBondContact OD1-ND2 3.08Å; D388-N390 VanDerWaalsContact C-N 3.28Å; D388-N390 PolarHBondContact O-N 3.03Å; D388-N390 WeakPolarHBondContact OD1-CA 3.33Å; D388-N390 WeakPolarHBondContact OD1-CB 3.5Å; D388-N390 PolarHBondContact OD1-N 3.4Å; D388-N390 PolarHBondContact OD1-ND2 3.12Å
391	K	48.4	Very low	42.1	Very low	117 Å²	117	105.9 Å²	105.9	51%	0.509	57%	0.565	S	S	.	*			trans	-99.5	25.1	-178.6	-65	-173.1	-173.1	99.3	0	115.3	D388 Q393	D388-K391 HydrophobicContact CB-CB 4.24Å; D388-K391 PolarHBondContact O-N 3.48Å; D388-K391 PolarHBondContact OD1-N 3.22Å; D388-K391 VanDerWaalsContact OD1-N 3.15Å; D388-K391 VanDerWaalsContact OD2-CD 3.28Å; D388-K391 WeakPolarHBondContact OD2-CD 3.33Å; D388-K391 WeakPolarHBondContact OD2-CE 3.26Å; D388-K391 VanDerWaalsContact OD2-CG 3.26Å; D388-K391 WeakPolarHBondContact OD2-CG 3.45Å; D388-K391 IonicContact OD2-NZ 3.18Å; D388-K391 PolarHBondContact OD2-NZ 2.79Å; K391-Q393 PolarHBondContact O-N 3.39Å
392	R	39.5	Very low	41.3	Very low	111 Å²	111	106.4 Å²	106.4	42%	0.419	58%	0.576	S	S	.	*			trans	-73.7	62.4	173.9	-82.1	-166.8	173.8	-82	9.1	113.4	S364	S364-R392 PolarHBondContact OG-NH2 3.15Å
393	Q	31.5	Very low	40.4	Very low	142 Å²	142	110.7 Å²	110.7	66%	0.664	60%	0.595	S	S	*	*			trans	-71.2	140.8	152.2	-156.2	165.6	20	0	0	107.4	N249 K391 V395	N249-Q393 PolarHBondContact OD1-NE2 2.94Å; K391-Q393 PolarHBondContact O-N 3.39Å; Q393-V395 PolarHBondContact O-N 3.47Å
394	T	28.4	Very low	39.4	Very low	113 Å²	113	108.9 Å²	108.9	69%	0.693	59%	0.585	S	S	*	*			trans	-70.8	123.2	178.5	46.3	0	0	0	0	109.8	A396	T394-A396 VanDerWaalsContact C-N 3.33Å; T394-A396 PolarHBondContact O-N 2.9Å
395	V	28.2	Very low	38.6	Very low	145 Å²	145	115.2 Å²	115.2	88%	0.879	60%	0.598	S	S	*	*			trans	-62.4	99.1	166.6	-179.8	0	0	0	0	107.7	Q393 K397	Q393-V395 PolarHBondContact O-N 3.47Å; V395-K397 PolarHBondContact O-N 3.02Å
396	A	25.7	Very low	36.9	Very low	82 Å²	82	121.7 Å²	121.7	68%	0.678	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-68.5	122.2	173.1	0	0	0	0	0	108	T394 E398	T394-A396 VanDerWaalsContact C-N 3.33Å; T394-A396 PolarHBondContact O-N 2.9Å; A396-E398 PolarHBondContact O-N 3.19Å
397	K	31.2	Very low	35.8	Very low	199 Å²	199	121.5 Å²	121.5	87%	0.865	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-67	125.3	150.4	-79.5	-172.6	175.1	-179.7	0	106.4	V395 G399	V395-K397 PolarHBondContact O-N 3.02Å; K397-G399 PolarHBondContact O-N 2.87Å
398	E	30	Very low	34.8	Very low	198 Å²	198	124.6 Å²	124.6	93%	0.925	65%	0.646	S	S	*	*	S	Bend	trans	-53.8	132.5	180	-169.3	168.6	-153.5	0	0	110.6	A396	A396-E398 PolarHBondContact O-N 3.19Å
399	G	35.7	Very low	34.5	Very low	66 Å²	66	129.1 Å²	129.1	68%	0.68	67%	0.67	S	S	*	*	S	Bend	trans	133.6	8	169.9	0	0	0	0	0	120.2	K397	K397-G399 PolarHBondContact O-N 2.87Å
400	Q	27.9	Very low	34.3	Very low	199 Å²	199	129 Å²	129	93%	0.93	67%	0.67	S	S	*	*			trans	-160.4	140.2	163.2	-111.5	146.6	0.5	0	0	114
401	R	31.5	Very low	34.5	Very low	253 Å²	253	128.9 Å²	128.9	96%	0.955	67%	0.667	S	S	*	*			trans	-94.9	153.9	178.1	-54.9	-176.2	-157.8	-128.9	3.1	111
402	G	27.9	Very low	34.4	Very low	74 Å²	74	123.7 Å²	123.7	76%	0.763	65%	0.645	S	S	*	*			trans	100.1	83.9	159	0	0	0	0	0	117
403	L	30.3	Very low	34.7	Very low	168 Å²	168	119.6 Å²	119.6	88%	0.88	63%	0.633	S	S	*	*				-176.3	144	100.4	-145.7	73.7	0	0	0	110	R405	L403-R405 PolarHBondContact O-N 3.39Å
404	D	31.5	Very low	35.2	Very low	105 Å²	105	114.5 Å²	114.5	56%	0.561	61%	0.612	S	S	*	*			trans	-72.7	86.6	-169.9	-153.7	-5.1	0	0	0	112.7	R248 K406	R248-D404 IonicContact NH1-OD1 2.66Å; R248-D404 IonicContact NH1-OD2 3.71Å; R248-D404 IonicContact NH2-OD2 2.9Å; R248-D404 PolarHBondContact NH2-OD2 3.47Å; D404-K406 PolarHBondContact O-N 2.84Å
405	R	33.5	Very low	36.1	Very low	200 Å²	200	112.4 Å²	112.4	76%	0.755	60%	0.596	S	S	*	*			trans	-73.6	91.9	171.6	-87.5	-169.4	165.2	-161	-3.4	110.3	L403	L403-R405 PolarHBondContact O-N 3.39Å
406	K	27.7	Very low	36.8	Very low	186 Å²	186	108 Å²	108	81%	0.809	57%	0.567	S	S	*	*			trans	-45.5	129	173.9	-68.1	178.5	178.7	175.3	0	111.4	D404	D404-K406 PolarHBondContact O-N 2.84Å
407	P	33.4	Very low	37.5	Very low	86 Å²	86	106.5 Å²	106.5	56%	0.558	55%	0.552	S	S	*	*			trans	-63.2	149.5	-178	25.5	-34.1	0	0	0	111.7	N409	P407-N409 PolarHBondContact O-N 2.66Å
408	S	37.9	Very low	37.7	Very low	87 Å²	87	102.9 Å²	102.9	61%	0.608	54%	0.536	S	S	*	.			trans	-70.6	93.1	177.9	54.5	0	0	0	0	110.4	F410	S408-F410 PolarHBondContact O-N 2.71Å; S408-F410 VanDerWaalsContact O-N 3.11Å
409	N	43.5	Very low	38	Very low	121 Å²	121	99 Å²	99	65%	0.647	52%	0.521	S	S	*	.			trans	-46.3	116.5	179.4	-75.7	-39.6	0	0	0	112.2	P407	P407-N409 PolarHBondContact O-N 2.66Å
410	F	51.5	Low	38	Very low	18 Å²	18	99.2 Å²	99.2	8%	0.079	51%	0.512	C	S	.	.			trans	-47.4	137.9	176.9	-178.3	-120.6	0	0	0	111.5	L261 F333 G337 S408 A412 T413 S414	L261-F410 HydrophobicContact CD2-CE1 4.25Å; F333-F410 HydrophobicContact CE2-CE2 4.15Å; F333-F410 HydrophobicContact CZ-CE2 4.17Å; G337-F410 VanDerWaalsContact CA-CZ 3.41Å; S408-F410 PolarHBondContact O-N 2.71Å; S408-F410 VanDerWaalsContact O-N 3.11Å; F410-A412 HydrophobicContact CD1-CB 3.76Å; F410-A412 HydrophobicContact CE1-CB 3.48Å; F410-A412 VanDerWaalsContact CE1-CB 3.48Å; F410-A412 HydrophobicContact CZ-CB 4.35Å; F410-A412 PolarHBondContact O-N 2.9Å; F410-A412 VanDerWaalsContact O-N 3.15Å; F410-T413 HydrophobicContact CD1-CG2 4.44Å; F410-T413 PolarHBondContact O-N 3.07Å; F410-T413 PolarHBondContact O-OG1 3.23Å; F410-S414 WeakPolarHBondContact O-CB 3.26Å; F410-S414 PolarHBondContact O-N 3.03Å
411	W	49.9	Very low	38.4	Very low	37 Å²	37	95.1 Å²	95.1	14%	0.14	50%	0.496	C	S	.	.	H	α-helix	trans	-60.3	-34.3	-168.1	60.3	-96.2	0	0	0	112.7	I291 A294 L334 S414 I415	I291-W411 HydrophobicContact CG2-CH2 4.31Å; A294-W411 HydrophobicContact CB-CE3 3.84Å; A294-W411 HydrophobicContact CB-CH2 4.38Å; A294-W411 HydrophobicContact CB-CZ3 3.41Å; A294-W411 VanDerWaalsContact CB-CZ3 3.41Å; L334-W411 HydrophobicContact CD2-CH2 4.27Å; L334-W411 HydrophobicContact CD2-CZ2 3.62Å; W411-S414 PolarHBondContact O-N 3.17Å; W411-I415 HydrophobicContact CE3-CD1 4.3Å; W411-I415 WeakPolarHBondContact O-CB 3.36Å; W411-I415 VanDerWaalsContact O-CG1 3.31Å; W411-I415 WeakPolarHBondContact O-CG1 2.92Å; W411-I415 PolarHBondContact O-N 2.74Å
412	A	45.6	Very low	38.5	Very low	7 Å²	7	91.3 Å²	91.3	6%	0.058	49%	0.486	C	S	.	.	H	α-helix	trans	-68	-48.1	178.1	0	0	0	0	0	112.1	F410 S414 I415 L416	F410-A412 HydrophobicContact CD1-CB 3.76Å; F410-A412 HydrophobicContact CE1-CB 3.48Å; F410-A412 VanDerWaalsContact CE1-CB 3.48Å; F410-A412 HydrophobicContact CZ-CB 4.35Å; F410-A412 PolarHBondContact O-N 2.9Å; F410-A412 VanDerWaalsContact O-N 3.15Å; A412-S414 VanDerWaalsContact C-N 3.3Å; A412-S414 PolarHBondContact O-N 2.68Å; A412-I415 PolarHBondContact O-N 2.85Å; A412-L416 WeakPolarHBondContact O-CB 3.24Å; A412-L416 WeakPolarHBondContact O-CG 3.28Å; A412-L416 PolarHBondContact O-N 2.85Å
413	T	45.2	Very low	38.7	Very low	26 Å²	26	90.7 Å²	90.7	16%	0.16	47%	0.474	C	S	.	.	H	α-helix	trans	-62.9	-40.3	175.8	61.2	0	0	0	0	110.4	C257 F410 I415 L416 S417	C257-T413 HydrophobicContact CB-CG2 3.84Å; F410-T413 HydrophobicContact CD1-CG2 4.44Å; F410-T413 PolarHBondContact O-N 3.07Å; F410-T413 PolarHBondContact O-OG1 3.23Å; T413-I415 VanDerWaalsContact C-N 3.28Å; T413-I415 PolarHBondContact O-N 3.27Å; T413-L416 PolarHBondContact O-N 3.01Å; T413-S417 VanDerWaalsContact O-CB 3.31Å; T413-S417 WeakPolarHBondContact O-CB 3.38Å; T413-S417 PolarHBondContact O-N 2.93Å; T413-S417 PolarHBondContact O-OG 3.44Å; T413-S417 VanDerWaalsContact O-OG 3.06Å
414	S	42.9	Very low	39	Very low	34 Å²	34	86.3 Å²	86.3	24%	0.238	46%	0.457	C	S	.	.	H	α-helix	trans	-65.3	-26.2	177.4	-154.3	0	0	0	0	114	F410 W411 A412 K418	F410-S414 WeakPolarHBondContact O-CB 3.26Å; F410-S414 PolarHBondContact O-N 3.03Å; W411-S414 PolarHBondContact O-N 3.17Å; A412-S414 VanDerWaalsContact C-N 3.3Å; A412-S414 PolarHBondContact O-N 2.68Å; S414-K418 WeakPolarHBondContact O-CD 3.48Å; S414-K418 WeakPolarHBondContact O-CG 3.48Å; S414-K418 PolarHBondContact O-NZ 3.35Å; S414-K418 PolarHBondContact OG-NZ 2.82Å
415	I	46.2	Very low	39	Very low	70 Å²	70	84.4 Å²	84.4	36%	0.359	46%	0.462	S	S	.	.	H	α-helix	trans	-85.6	-44.6	175.3	-72.4	170.6	0	0	0	110.6	A294 W411 A412 T413 K418 L419	A294-I415 HydrophobicContact CB-CD1 3.89Å; W411-I415 HydrophobicContact CE3-CD1 4.3Å; W411-I415 WeakPolarHBondContact O-CB 3.36Å; W411-I415 VanDerWaalsContact O-CG1 3.31Å; W411-I415 WeakPolarHBondContact O-CG1 2.92Å; W411-I415 PolarHBondContact O-N 2.74Å; A412-I415 PolarHBondContact O-N 2.85Å; T413-I415 VanDerWaalsContact C-N 3.28Å; T413-I415 PolarHBondContact O-N 3.27Å; I415-K418 PolarHBondContact O-N 2.82Å; I415-K418 VanDerWaalsContact O-N 3.16Å; I415-L419 HydrophobicContact CG2-CD1 4.29Å; I415-L419 WeakPolarHBondContact O-CG 3.41Å; I415-L419 PolarHBondContact O-N 3.26Å; I415-L419 VanDerWaalsContact O-N 3.1Å
416	L	43.2	Very low	39.1	Very low	51 Å²	51	81.9 Å²	81.9	27%	0.267	46%	0.464	S	S	.	.	H	α-helix	trans	-62.7	-43.3	177.7	-68.3	168.9	0	0	0	111.7	C257 L260 A412 T413 K418 L419 S420	C257-L416 HydrophobicContact CB-CD1 3.73Å; L260-L416 HydrophobicContact CD2-CD1 4.22Å; L260-L416 HydrophobicContact CD2-CD2 4.01Å; A412-L416 WeakPolarHBondContact O-CB 3.24Å; A412-L416 WeakPolarHBondContact O-CG 3.28Å; A412-L416 PolarHBondContact O-N 2.85Å; T413-L416 PolarHBondContact O-N 3.01Å; L416-K418 VanDerWaalsContact C-N 3.31Å; L416-K418 PolarHBondContact O-N 2.95Å; L416-L419 WeakPolarHBondContact O-CA 3.4Å; L416-L419 WeakPolarHBondContact O-CB 3.14Å; L416-L419 PolarHBondContact O-N 3.4Å; L416-S420 PolarHBondContact O-N 3.49Å
417	S	41.8	Very low	39.6	Very low	51 Å²	51	81.2 Å²	81.2	36%	0.357	46%	0.464	S	S	.	.	H	α-helix	trans	-65.4	-29.8	174	-60.3	0	0	0	0	113.3	T413 L419 S420 I421	T413-S417 VanDerWaalsContact O-CB 3.31Å; T413-S417 WeakPolarHBondContact O-CB 3.38Å; T413-S417 PolarHBondContact O-N 2.93Å; T413-S417 PolarHBondContact O-OG 3.44Å; T413-S417 VanDerWaalsContact O-OG 3.06Å; S417-L419 VanDerWaalsContact C-N 3.28Å; S417-L419 PolarHBondContact O-N 2.7Å; S417-S420 WeakPolarHBondContact CA-OG 3.35Å; S417-S420 PolarHBondContact O-N 2.8Å; S417-S420 PolarHBondContact O-OG 3.06Å; S417-S420 VanDerWaalsContact O-OG 3.1Å; S417-I421 WeakPolarHBondContact O-CB 3.32Å; S417-I421 WeakPolarHBondContact O-CD1 3.47Å; S417-I421 WeakPolarHBondContact O-CG1 3.38Å; S417-I421 PolarHBondContact O-N 2.94Å
418	K	35.2	Very low	39.8	Very low	123 Å²	123	81 Å²	81	54%	0.535	48%	0.477	S	S	.	.	H	α-helix	trans	-72.3	-23.1	172.3	-74.8	177	-165.9	99.3	0	112.6	S414 I415 L416 K422	S414-K418 WeakPolarHBondContact O-CD 3.48Å; S414-K418 WeakPolarHBondContact O-CG 3.48Å; S414-K418 PolarHBondContact O-NZ 3.35Å; S414-K418 PolarHBondContact OG-NZ 2.82Å; I415-K418 PolarHBondContact O-N 2.82Å; I415-K418 VanDerWaalsContact O-N 3.16Å; L416-K418 VanDerWaalsContact C-N 3.31Å; L416-K418 PolarHBondContact O-N 2.95Å; K418-K422 WeakPolarHBondContact O-CB 3.37Å
419	L	36.1	Very low	39.5	Very low	117 Å²	117	86.4 Å²	86.4	61%	0.613	49%	0.489	S	S	*	.	H	α-helix	trans	-81.1	-33.2	173.2	-67.7	167	0	0	0	111.9	I415 L416 S417	I415-L419 HydrophobicContact CG2-CD1 4.29Å; I415-L419 WeakPolarHBondContact O-CG 3.41Å; I415-L419 PolarHBondContact O-N 3.26Å; I415-L419 VanDerWaalsContact O-N 3.1Å; L416-L419 WeakPolarHBondContact O-CA 3.4Å; L416-L419 WeakPolarHBondContact O-CB 3.14Å; L416-L419 PolarHBondContact O-N 3.4Å; S417-L419 VanDerWaalsContact C-N 3.28Å; S417-L419 PolarHBondContact O-N 2.7Å
420	S	34.3	Very low	38.6	Very low	70 Å²	70	88.8 Å²	88.8	49%	0.49	50%	0.502	S	S	.	.	H	α-helix	trans	-76	-43.5	174.3	63.7	0	0	0	0	113.2	L416 S417 K422 A423 S424	L416-S420 PolarHBondContact O-N 3.49Å; S417-S420 WeakPolarHBondContact CA-OG 3.35Å; S417-S420 PolarHBondContact O-N 2.8Å; S417-S420 PolarHBondContact O-OG 3.06Å; S417-S420 VanDerWaalsContact O-OG 3.1Å; S420-K422 PolarHBondContact O-N 3.1Å; S420-A423 WeakPolarHBondContact O-CA 3.44Å; S420-A423 WeakPolarHBondContact O-CB 3.44Å; S420-A423 PolarHBondContact O-N 3.38Å; S420-S424 PolarHBondContact O-N 3.16Å
421	I	37.3	Very low	37.6	Very low	113 Å²	113	92.6 Å²	92.6	58%	0.579	54%	0.537	S	S	*	.	H	α-helix	trans	-60.2	-30.2	175.2	-67.7	164.9	0	0	0	111.3	S417 A423 S424 G425	S417-I421 WeakPolarHBondContact O-CB 3.32Å; S417-I421 WeakPolarHBondContact O-CD1 3.47Å; S417-I421 WeakPolarHBondContact O-CG1 3.38Å; S417-I421 PolarHBondContact O-N 2.94Å; I421-A423 VanDerWaalsContact C-N 3.26Å; I421-A423 PolarHBondContact O-N 3.04Å; I421-S424 PolarHBondContact O-OG 2.98Å; I421-G425 PolarHBondContact O-N 3.1Å; I421-G425 VanDerWaalsContact O-N 3.08Å
422	K	32.8	Very low	36.5	Very low	173 Å²	173	98.6 Å²	98.6	75%	0.752	57%	0.57	S	S	*	*	H	α-helix	trans	-80.7	-2.2	175.3	-164.2	157.7	-175.4	173.8	0	114.1	K418 S420	K418-K422 WeakPolarHBondContact O-CB 3.37Å; S420-K422 PolarHBondContact O-N 3.1Å
423	A	33.5	Very low	35.7	Very low	62 Å²	62	106.8 Å²	106.8	51%	0.512	61%	0.607	S	S	.	*	H	α-helix	trans	-92.6	-41.3	165.6	0	0	0	0	0	111.5	S420 I421	S420-A423 WeakPolarHBondContact O-CA 3.44Å; S420-A423 WeakPolarHBondContact O-CB 3.44Å; S420-A423 PolarHBondContact O-N 3.38Å; I421-A423 VanDerWaalsContact C-N 3.26Å; I421-A423 PolarHBondContact O-N 3.04Å
424	S	36.6	Very low	34.8	Very low	75 Å²	75	114.8 Å²	114.8	52%	0.524	64%	0.643	S	S	.	*	H	α-helix	trans	-71.4	-35.1	178.2	56.7	0	0	0	0	113.4	S420 I421 N426 Q427	S420-S424 PolarHBondContact O-N 3.16Å; I421-S424 PolarHBondContact O-OG 2.98Å; S424-N426 PolarHBondContact O-N 3.46Å; S424-Q427 PolarHBondContact O-N 3.06Å; S424-Q427 VanDerWaalsContact O-N 3.09Å
425	G	30.1	Very low	33.9	Very low	65 Å²	65	121 Å²	121	67%	0.67	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	8.9	179	0	0	0	0	0	116.7	I421	I421-G425 PolarHBondContact O-N 3.1Å; I421-G425 VanDerWaalsContact O-N 3.08Å
426	N	36.6	Very low	32.9	Very low	147 Å²	147	125.6 Å²	125.6	79%	0.786	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	3.2	176.4	-107.4	71.7	0	0	0	113.2	S424	S424-N426 PolarHBondContact O-N 3.46Å
427	Q	38.4	Very low	32.3	Very low	173 Å²	173	128.5 Å²	128.5	81%	0.808	72%	0.718	S	S	*	*	S	Bend	trans	-115.5	115	167.7	-72.9	177.8	-27.1	0	0	107.9	S424	S424-Q427 PolarHBondContact O-N 3.06Å; S424-Q427 VanDerWaalsContact O-N 3.09Å
428	G	37.4	Very low	31.5	Very low	80 Å²	80	133.5 Å²	133.5	83%	0.825	74%	0.741	S	S	*	*	S	Bend	trans	141.1	35.9	-176.5	0	0	0	0	0	115.6
429	K	31.8	Very low	31	Very low	201 Å²	201	131.5 Å²	131.5	87%	0.874	76%	0.755	S	S	*	*			trans	-164.4	67.5	161.4	-122.3	179.3	-173.1	-171.3	0	113.4
430	D	24.4	Very low	30.4	Very low	171 Å²	171	137.3 Å²	137.3	91%	0.914	77%	0.769	S	S	*	*			trans	-142	139.8	144.1	-80.2	-52	0	0	0	105.7
431	A	30.9	Very low	29.8	Very low	99 Å²	99	139.4 Å²	139.4	82%	0.818	78%	0.779	S	S	*	*			trans	-100.4	146	-179.2	0	0	0	0	0	109.6
432	I	27	Very low	29.2	Very low	162 Å²	162	143.9 Å²	143.9	83%	0.831	79%	0.794	S	S	*	*			trans	-130	135.5	165.5	-62.9	-178.3	0	0	0	106.3
433	E	27.3	Very low	28.7	Very low	179 Å²	179	143.6 Å²	143.6	84%	0.836	80%	0.795	S	S	*	*			trans	-76.7	146	178.2	-64.1	143.6	138.8	0	0	109.8
434	E	26.3	Very low	28.3	Very low	195 Å²	195	148.8 Å²	148.8	91%	0.911	81%	0.809	S	S	*	*			trans	-111.4	121.4	166.7	-68.6	-165.5	153.4	0	0	108.7
435	D	25.8	Very low	27.7	Very low	165 Å²	165	151.6 Å²	151.6	88%	0.882	82%	0.823	S	S	*	*			trans	-76	126.7	178.5	-80.1	-55.6	0	0	0	111.4
436	D	25.1	Very low	27.3	Very low	165 Å²	165	153.1 Å²	153.1	88%	0.882	82%	0.824	S	S	*	*			trans	-91	122	-178.2	-138.8	-22.8	0	0	0	111.2
437	V	29.2	Very low	26.6	Very low	112 Å²	112	152.3 Å²	152.3	68%	0.679	82%	0.819	S	S	*	*			trans	-142.8	119.3	177.3	177.8	0	0	0	0	112.3
438	N	25.6	Very low	26.1	Very low	157 Å²	157	150.7 Å²	150.7	84%	0.84	82%	0.815	S	S	*	*			trans	59	105.4	171.8	-59.8	-30.8	0	0	0	115.9
439	G	23.8	Very low	25.4	Very low	81 Å²	81	155.7 Å²	155.7	84%	0.835	82%	0.817	S	S	*	*			cis	97.5	132.2	15.9	0	0	0	0	0	113
440	R	23.9	Very low	25	Very low	238 Å²	238	151.7 Å²	151.7	90%	0.898	81%	0.809	S	S	*	*			trans	-176.5	108.6	149.7	-170	164.4	-170.4	171.1	3.3	114.8
441	V	22.4	Very low	25	Very low	114 Å²	114	149.7 Å²	149.7	69%	0.691	80%	0.803	S	S	*	*			trans	44.3	118.2	142.7	-176.5	0	0	0	0	120.4
442	K	24.7	Very low	24.7	Very low	208 Å²	208	149.7 Å²	149.7	90%	0.904	80%	0.803	S	S	*	*				-150.4	129.3	124.6	-115.1	-175.8	-179.2	-173.2	0	111.7
443	E	23	Very low	24.6	Very low	166 Å²	166	147.2 Å²	147.2	78%	0.776	81%	0.807	S	S	*	*			trans	-80.6	170.4	165.2	-53.1	150.6	114.6	0	0	108.6
444	E	24.2	Very low	24.4	Very low	171 Å²	171	141.6 Å²	141.6	80%	0.799	80%	0.797	S	S	*	*			cis	-133.6	165.1	5.1	-63.4	170.9	115.1	0	0	107.9
445	T	23.3	Very low	24.4	Very low	135 Å²	135	138.7 Å²	138.7	83%	0.828	79%	0.792	S	S	*	*				-174.4	173.8	69.5	35.3	0	0	0	0	110.9
446	S	22.5	Very low	24.4	Very low	97 Å²	97	139.8 Å²	139.8	68%	0.678	79%	0.792	S	S	*	*			trans	-83.1	177.8	-175.8	58.3	0	0	0	0	113.6
447	D	22.7	Very low	24.4	Very low	130 Å²	130	134.8 Å²	134.8	70%	0.695	78%	0.779	S	S	*	*			cis	-141.1	141.9	34.5	-66.4	-46.5	0	0	0	111.3
448	I	26.3	Very low	24.2	Very low	139 Å²	139	136 Å²	136	71%	0.713	79%	0.791	S	S	*	*				58.4	116.7	82.5	-52.6	162.1	0	0	0	111.3
449	E	23.1	Very low	24.1	Very low	185 Å²	185	132.7 Å²	132.7	86%	0.864	79%	0.786	S	S	*	*			cis	-146.1	-171.7	48	-75	-167.3	146.5	0	0	113
450	V	23.1	Very low	24	Very low	116 Å²	116	136.5 Å²	136.5	70%	0.703	79%	0.786	S	S	*	*				-167.4	162.4	-62.3	140.1	0	0	0	0	108.9
451	T	24.6	Very low	24.1	Very low	129 Å²	129	131.4 Å²	131.4	79%	0.791	78%	0.781	S	S	*	*			trans	90.2	121.6	-176.2	69.7	0	0	0	0	115.4
452	A	24.7	Very low	24.1	Very low	100 Å²	100	131.9 Å²	131.9	83%	0.826	78%	0.784	S	S	*	*			cis	77.1	132.9	26.3	0	0	0	0	0	114.5
453	A	24.9	Very low	24.7	Very low	110 Å²	110	128.2 Å²	128.2	91%	0.909	78%	0.782	S	S	*	*			cis	-144.5	-175.4	-0.2	0	0	0	0	0	109
454	G	24.4	Very low	24.7	Very low	61 Å²	61	124.1 Å²	124.1	63%	0.629	78%	0.784	S	S	*	*			cis	-164.8	165.3	3.7	0	0	0	0	0	109
455	V	25.6	Very low	24.8	Very low	133 Å²	133	120.4 Å²	120.4	81%	0.806	78%	0.783	S	S	*	*				60.5	120.8	80.1	-177.6	0	0	0	0	110.9
456	E	26.3	Very low	24.8	Very low	189 Å²	189	120.3 Å²	120.3	88%	0.883	79%	0.787	S	S	*	*			cis	-152.3	174.4	19.2	-124.9	147.5	-141.4	0	0	108.6
457	G	25.1	Very low	24.8	Very low	60 Å²	60	119.3 Å²	119.3	62%	0.619	79%	0.792	S	S	*	*			cis	147.8	128.7	-5.5	0	0	0	0	0	113.1
458	C	23.5	Very low	24.8	Very low	138 Å²	138	119.9 Å²	119.9	93%	0.932	80%	0.796	S	S	*	*			trans	61.6	159.2	153.6	-67.4	0	0	0	0	121
459	A	23.3	Very low	24.5	Very low	87 Å²	87	123.8 Å²	123.8	72%	0.719	80%	0.802	S	S	*	*			cis	-166	155.4	-23.9	0	0	0	0	0	112.1
460	L	22.6	Very low	24.6	Very low	160 Å²	160	121.5 Å²	121.5	84%	0.838	80%	0.801	S	S	*	*			trans	40.1	132.9	142	-144.4	78.4	0	0	0	122.4
461	V	25	Very low	24.7	Very low	131 Å²	131	124 Å²	124	79%	0.794	80%	0.804	S	S	*	*				180	140.9	116.2	150.2	0	0	0	0	111.7
462	T	22.9	Very low	24.6	Very low	124 Å²	124	126.8 Å²	126.8	76%	0.761	81%	0.808	S	S	*	*			trans	-143.5	176.2	174.2	42.7	0	0	0	0	108.4
463	P	38.7	Very low	24.6	Very low	131 Å²	131	128.1 Å²	128.1	85%	0.851	80%	0.801	S	S	*	*			cis	-125	-178.4	-13.6	33.9	-15.2	0	0	0	113.4
464	G	22.8	Very low	24.5	Very low	80 Å²	80	131.2 Å²	131.2	83%	0.825	80%	0.797	S	S	*	*			trans	-169.8	148.5	168.5	0	0	0	0	0	111
465	A	24.6	Very low	24.4	Very low	94 Å²	94	133.1 Å²	133.1	78%	0.777	80%	0.796	S	S	*	*			trans	-131.8	155.3	-164.4	0	0	0	0	0	114.8
466	S	23.3	Very low	24.3	Very low	132 Å²	132	131.5 Å²	131.5	92%	0.923	79%	0.791	S	S	*	*			trans	67	130.7	161.7	66.9	0	0	0	0	119.3
467	G	23.8	Very low	24.4	Very low	76 Å²	76	127.1 Å²	127.1	78%	0.784	78%	0.781	S	S	*	*			trans	166.2	137.8	168.7	0	0	0	0	0	111.1
468	N	21.6	Very low	24.3	Very low	143 Å²	143	130.9 Å²	130.9	77%	0.765	79%	0.787	S	S	*	*			trans	-136.4	127.7	-166.5	-134.8	15.5	0	0	0	112
469	W	21.5	Very low	24.5	Very low	221 Å²	221	129.2 Å²	129.2	84%	0.837	78%	0.777	S	S	*	*			trans	68.7	141.6	165.2	-58.5	35.2	0	0	0	114.9
470	T	24	Very low	24.7	Very low	137 Å²	137	130.1 Å²	130.1	84%	0.84	78%	0.784	S	S	*	*				-161	-174.5	58.1	36.5	0	0	0	0	113.2
471	H	25.7	Very low	25	Very low	167 Å²	167	131.1 Å²	131.1	77%	0.773	79%	0.785	S	S	*	*			trans	-64.9	153.1	-176.3	-92.3	-124.2	0	0	0	117
472	H	23.1	Very low	25	Very low	188 Å²	188	131.8 Å²	131.8	87%	0.87	79%	0.789	S	S	*	*			trans	-177.2	124.4	130	-87.9	-73.6	0	0	0	105.3
473	N	24.4	Very low	25.2	Very low	129 Å²	129	132.7 Å²	132.7	69%	0.69	79%	0.789	S	S	*	*			cis	73.4	94.9	33.1	-166.5	92.8	0	0	0	115.6
474	E	22.4	Very low	24.4	Very low	174 Å²	174	133.9 Å²	133.9	81%	0.813	79%	0.789	S	S	*	*			trans	-161.5	179.8	140.9	-85	-113.4	90.8	0	0	108.2
475	T	22.2	Very low	24.5	Very low	102 Å²	102	137 Å²	137	63%	0.626	78%	0.784	S	S	*	*			cis	-179.8	170.1	-47.3	-71.3	0	0	0	0	106.6
476	S	23.2	Very low	24.5	Very low	99 Å²	99	142.7 Å²	142.7	69%	0.692	79%	0.785	S	S	*	*			trans	78.9	119.4	171.9	-160.1	0	0	0	0	115
477	S	29.2	Very low	24.6	Very low	97 Å²	97	140.6 Å²	140.6	68%	0.678	78%	0.776	S	S	*	*			cis	75.4	140.2	49.7	-55.1	0	0	0	0	112.8
478	D	23.3	Very low	24.8	Very low	138 Å²	138	140.8 Å²	140.8	74%	0.738	77%	0.77	S	S	*	*			cis	-135.6	151.4	8	-93.8	-57.8	0	0	0	109.8
479	S	28	Very low	25	Very low	103 Å²	103	141.7 Å²	141.7	72%	0.72	78%	0.775	S	S	*	*			cis	84	120.8	49.9	102.2	0	0	0	0	115.6
480	A	26.6	Very low	25.2	Very low	106 Å²	106	134.1 Å²	134.1	88%	0.876	77%	0.766	S	S	*	*			trans	-167.9	134.5	167.1	0	0	0	0	0	109.7
481	E	28.4	Very low	25.3	Very low	182 Å²	182	136.7 Å²	136.7	85%	0.85	77%	0.768	S	S	*	*			trans	-110.1	159.9	-177.9	-56.2	178.6	113.6	0	0	112.2
482	T	25.4	Very low	25.3	Very low	145 Å²	145	134.8 Å²	134.8	89%	0.89	77%	0.768	S	S	*	*			trans	-173.3	169.5	132.6	16.2	0	0	0	0	112.2
483	N	27	Very low	25.4	Very low	142 Å²	142	134.3 Å²	134.3	76%	0.759	77%	0.767	S	S	*	*			trans	-111.9	-175.3	-163.7	-80.9	-64.1	0	0	0	114.7
484	D	23	Very low	25.3	Very low	156 Å²	156	133.4 Å²	133.4	83%	0.834	77%	0.765	S	S	*	*			trans	95.7	166.5	151.3	-59.2	-37	0	0	0	120.1
485	M	23.6	Very low	25.2	Very low	146 Å²	146	133.7 Å²	133.7	72%	0.719	76%	0.764	S	S	*	*				-164.8	136.6	-71.4	-137.3	-147.8	-172.3	0	0	110.3
486	R	25.6	Very low	25.2	Very low	213 Å²	213	135.8 Å²	135.8	80%	0.804	78%	0.776	S	S	*	*			trans	73.6	136.9	137	-143.1	-170.3	-173.9	140.4	-0.7	122.4
487	A	24.8	Very low	25.1	Very low	88 Å²	88	142.1 Å²	142.1	73%	0.727	79%	0.785	S	S	*	*			trans	71.5	155	142.9	0	0	0	0	0	121.2
488	A	27.1	Very low	25	Very low	80 Å²	80	142.6 Å²	142.6	66%	0.661	78%	0.781	S	S	*	*			cis	-171.6	173.1	-22.1	0	0	0	0	0	112
489	N	26	Very low	25	Very low	162 Å²	162	144.3 Å²	144.3	87%	0.866	78%	0.784	S	S	*	*			trans	75.1	142.8	162.6	-61.1	-19.3	0	0	0	119.2
490	G	25.6	Very low	26.4	Very low	63 Å²	63	144.6 Å²	144.6	65%	0.649	78%	0.784	S	S	*	*			cis	160.2	170	-13.6	0	0	0	0	0	116.4
491	Q	27.3	Very low	26.5	Very low	190 Å²	190	146.7 Å²	146.7	89%	0.888	79%	0.785	S	S	*	*			trans	70.6	151.2	166.8	-44.6	-176.9	-2.1	0	0	115.4
492	T	24.5	Very low	26.5	Very low	127 Å²	127	142.9 Å²	142.9	78%	0.779	79%	0.785	S	S	*	*			cis	-135.1	154.9	4.6	47.7	0	0	0	0	114.6
493	Q	26.3	Very low	26.5	Very low	179 Å²	179	139.9 Å²	139.9	84%	0.836	78%	0.782	S	S	*	*			trans	-28.1	165.9	147.9	-72.5	-171.9	-6.3	0	0	118.5
494	V	21.8	Very low	26.5	Very low	110 Å²	110	136.2 Å²	136.2	67%	0.667	78%	0.778	S	S	*	*			cis	-163.6	157.3	5.3	121.2	0	0	0	0	112.5
495	F	21.1	Very low	26.7	Very low	179 Å²	179	135.8 Å²	135.8	79%	0.785	78%	0.781	S	S	*	*			trans	-1.9	148.3	164.5	-66	-114.3	0	0	0	123.2
496	V	22.6	Very low	26.9	Very low	146 Å²	146	133.4 Å²	133.4	89%	0.885	79%	0.785	S	S	*	*				-177.5	171.9	106.1	152.1	0	0	0	0	111.3
497	W	20.5	Very low	26.9	Very low	232 Å²	232	128.3 Å²	128.3	88%	0.879	79%	0.788	S	S	*	*			trans	-113.5	168.1	-165.7	-122.2	25.5	0	0	0	114.6
498	N	25.9	Very low	26.9	Very low	108 Å²	108	128.5 Å²	128.5	58%	0.578	79%	0.79	S	S	*	*			trans	75	122.5	151.6	-83.1	34.9	0	0	0	124.9
499	E	24.8	Very low	27.8	Very low	174 Å²	174	130.4 Å²	130.4	81%	0.813	80%	0.796	S	S	*	*				74.7	157.9	128	-70.9	-158.5	122.8	0	0	124
500	P	57.3	Low	27.9	Very low	109 Å²	109	127.4 Å²	127.4	71%	0.708	79%	0.793	S	S	*	*			trans	-110.7	-178.2	-170.6	43.3	-34.3	0	0	0	113.9
501	V	27.2	Very low	27.9	Very low	150 Å²	150	128.2 Å²	128.2	91%	0.909	79%	0.794	S	S	*	*			trans	-168.1	162.9	143.2	130.5	0	0	0	0	112.2
502	A	28.9	Very low	28	Very low	102 Å²	102	126.1 Å²	126.1	84%	0.843	79%	0.787	S	S	*	*			trans	-96	178.9	-169.8	0	0	0	0	0	116
503	G	26.3	Very low	28	Very low	81 Å²	81	128.2 Å²	128.2	84%	0.835	79%	0.785	S	S	*	*			trans	160.7	136.6	152.1	0	0	0	0	0	119
504	G	27.3	Very low	28.1	Very low	65 Å²	65	128.9 Å²	128.9	67%	0.67	78%	0.78	S	S	*	*			trans	93.1	124.1	162.3	0	0	0	0	0	116.3
505	T	27	Very low	28.4	Very low	147 Å²	147	130.6 Å²	130.6	90%	0.902	78%	0.781	S	S	*	*			cis	75.9	139.9	49.5	69.7	0	0	0	0	114.1
506	A	27.2	Very low	28.7	Very low	96 Å²	96	126.5 Å²	126.5	79%	0.793	78%	0.78	S	S	*	*			cis	-162.1	-176.5	9.3	0	0	0	0	0	114
507	A	25.3	Very low	28.9	Very low	106 Å²	106	125 Å²	125	88%	0.876	77%	0.771	S	S	*	*			trans	90.7	153.2	151	0	0	0	0	0	122.2
508	A	26	Very low	29.1	Very low	93 Å²	93	121.1 Å²	121.1	77%	0.769	77%	0.768	S	S	*	*			trans	-129.4	-161.3	173.7	0	0	0	0	0	107.8
509	P	45.3	Very low	29.2	Very low	120 Å²	120	120 Å²	120	78%	0.779	77%	0.773	S	S	*	*			cis	-150	179.7	25.9	45.4	-24.3	0	0	0	119.5
510	A	28.1	Very low	29.5	Very low	99 Å²	99	116.6 Å²	116.6	82%	0.818	78%	0.775	S	S	*	*			trans	69.1	165.3	152.3	0	0	0	0	0	118.8
511	A	25.8	Very low	28.2	Very low	79 Å²	79	116.2 Å²	116.2	65%	0.653	78%	0.782	S	S	*	*			cis	-162.5	152.3	3.9	0	0	0	0	0	115.9
512	I	27.9	Very low	28.2	Very low	146 Å²	146	112.7 Å²	112.7	75%	0.749	78%	0.775	S	S	*	*			trans	85.2	130.6	132.4	-74.3	167.2	0	0	0	124.5
513	K	26.5	Very low	28.2	Very low	172 Å²	172	114.3 Å²	114.3	75%	0.748	78%	0.781	S	S	*	*			trans	73.2	130.2	158.3	-81.1	164.9	-174.5	179.9	0	119.6
514	R	27.9	Very low	28.3	Very low	193 Å²	193	113.6 Å²	113.6	73%	0.728	77%	0.773	S	S	*	*				90.3	148.6	58.4	-73.6	-160.4	-158.2	-177.3	-3.8	112.3
515	E	26.7	Very low	28.4	Very low	146 Å²	146	122 Å²	122	68%	0.682	78%	0.784	S	S	*	*			cis	-160.9	144.3	11.1	-131.1	151.6	170.8	0	0	112.7
516	A	27.4	Very low	28.6	Very low	93 Å²	93	126.3 Å²	126.3	77%	0.769	78%	0.784	S	S	*	*			trans	50.6	175.9	150.3	0	0	0	0	0	121.2
517	T	26.9	Very low	28.7	Very low	113 Å²	113	131.9 Å²	131.9	69%	0.693	79%	0.79	S	S	*	*			cis	-149	152.2	5.1	39.4	0	0	0	0	111.9
518	D	26.3	Very low	29	Very low	151 Å²	151	136.4 Å²	136.4	81%	0.807	79%	0.79	S	S	*	*			trans	55.6	157.9	140.1	-60.4	-17.8	0	0	0	123.6
519	A	28.2	Very low	29.2	Very low	84 Å²	84	140.6 Å²	140.6	69%	0.694	79%	0.794	S	S	*	*			cis	-169.9	153.4	-27.8	0	0	0	0	0	111.9
520	A	29.4	Very low	28.3	Very low	103 Å²	103	141.1 Å²	141.1	85%	0.851	80%	0.795	S	S	*	*			trans	56	164.3	153.3	0	0	0	0	0	121.5
521	A	29.8	Very low	28.3	Very low	102 Å²	102	141.9 Å²	141.9	84%	0.843	79%	0.79	S	S	*	*			cis	-168.5	149.6	-39.2	0	0	0	0	0	111.6
522	G	27.8	Very low	28.3	Very low	75 Å²	75	145 Å²	145	77%	0.773	80%	0.8	S	S	*	*			trans	101.8	125.2	143.7	0	0	0	0	0	121.6
523	S	29.2	Very low	28.4	Very low	137 Å²	137	148.5 Å²	148.5	96%	0.958	81%	0.805	S	S	*	*			trans	65.2	144.5	154.8	-150.5	0	0	0	0	119.7
524	G	27.7	Very low	28.3	Very low	65 Å²	65	151.6 Å²	151.6	67%	0.67	81%	0.811	S	S	*	*			cis	172.1	148.1	-10.7	0	0	0	0	0	115.8
525	R	30.2	Very low	28.1	Very low	242 Å²	242	152.1 Å²	152.1	91%	0.913	82%	0.819	S	S	*	*			trans	76.6	88.2	154.2	-148.3	176.8	-158.6	-179.1	5.1	122.1
526	R	30.9	Very low	28	Very low	238 Å²	238	150.2 Å²	150.2	90%	0.898	82%	0.818	S	S	*	*			trans	47.1	109	136.9	-65.2	-176.2	176.4	176.5	-1.4	121.2
527	K	29.1	Very low	27.9	Very low	212 Å²	212	156.2 Å²	156.2	92%	0.922	82%	0.822	S	S	*	*				-153.3	130.7	111.1	-109.7	-179.8	-179.2	179.5	0	108.4
528	K	31.6	Very low	27.8	Very low	201 Å²	201	156.8 Å²	156.8	87%	0.874	82%	0.821	S	S	*	*			trans	-107.2	107.7	178.8	-76	-168	174.9	-171.5	0	110.5
529	Q	30.7	Very low	27.6	Very low	182 Å²	182	159.3 Å²	159.3	85%	0.85	83%	0.825	S	S	*	*			trans	-78.7	128.3	145.7	-76.8	169.4	-59.8	0	0	106.9	T531	Q529-T531 PolarHBondContact O-N 3.2Å
530	T	27.1	Very low	27.7	Very low	131 Å²	131	161.8 Å²	161.8	80%	0.804	82%	0.822	S	S	*	*			trans	-96.6	79	177.8	-47.2	0	0	0	0	109
531	T	27	Very low	27.7	Very low	114 Å²	114	162.7 Å²	162.7	70%	0.699	82%	0.819	S	S	*	*			trans	-69.3	138.9	174.3	40.4	0	0	0	0	111	Q529 R533	Q529-T531 PolarHBondContact O-N 3.2Å; T531-R533 PolarHBondContact O-N 3.17Å
532	T	26.8	Very low	27.7	Very low	144 Å²	144	163.3 Å²	163.3	88%	0.883	81%	0.805	S	S	*	*			trans	-76.5	110.3	179.8	35.9	0	0	0	0	110.7
533	R	28.7	Very low	27.9	Very low	221 Å²	221	165.7 Å²	165.7	83%	0.834	81%	0.807	S	S	*	*			trans	-122.9	107.1	171.2	-86.9	-168.4	160.8	-165.6	-6.7	113.3	T531 F535	T531-R533 PolarHBondContact O-N 3.17Å; R533-F535 PolarHBondContact O-N 3.17Å
534	R	24.8	Very low	27.9	Very low	236 Å²	236	167.2 Å²	167.2	89%	0.891	80%	0.799	S	S	*	*			trans	-11.7	109.7	145.9	-173	178	-171.4	163.4	-1.3	113.6
535	F	23.3	Very low	27.9	Very low	205 Å²	205	173.8 Å²	173.8	90%	0.899	81%	0.812	S	S	*	*			trans	-80.3	126.1	166.6	-78.6	-88.6	0	0	0	110.1	R533	R533-F535 PolarHBondContact O-N 3.17Å
536	V	25.1	Very low	27.7	Very low	106 Å²	106	165.4 Å²	165.4	64%	0.642	80%	0.801	S	S	*	*			trans	-116.9	137.5	158.8	173.9	0	0	0	0	105.8	N538	V536-N538 PolarHBondContact O-N 2.85Å
537	Y	25	Very low	27.2	Very low	218 Å²	218	163.7 Å²	163.7	86%	0.855	80%	0.8	S	S	*	*			trans	-74.4	121.8	172.7	-89.4	-96.5	0	0	0	109.4
538	N	25.3	Very low	26.9	Very low	126 Å²	126	159.5 Å²	159.5	67%	0.674	79%	0.788	S	S	*	*			trans	-117.4	120.5	161.7	-99.8	45.6	0	0	0	108.9	V536	V536-N538 PolarHBondContact O-N 2.85Å
539	F	23.1	Very low	26.8	Very low	203 Å²	203	159.1 Å²	159.1	89%	0.89	79%	0.789	S	S	*	*			trans	-130.8	129.6	149.3	-87.9	-77.3	0	0	0	106.9
540	Q	29.2	Very low	26.5	Very low	136 Å²	136	154.1 Å²	154.1	64%	0.636	79%	0.787	S	S	*	*			trans	-139.4	150.3	173.3	-136	174.1	-17.9	0	0	104.3	E542	Q540-E542 PolarHBondContact NE2-OE1 3.4Å
541	P	29.8	Very low	26.6	Very low	122 Å²	122	155.9 Å²	155.9	79%	0.792	79%	0.788	S	S	*	*				-143.5	160.2	79.6	38.7	-22.8	0	0	0	116.7
542	E	28.4	Very low	26.5	Very low	115 Å²	115	160.5 Å²	160.5	54%	0.537	80%	0.799	S	S	.	*			trans	-30	162	145.5	-64	-41.3	128.5	0	0	116.4	Q540	Q540-E542 PolarHBondContact NE2-OE1 3.4Å
543	P	33.5	Very low	26.5	Very low	126 Å²	126	159.5 Å²	159.5	82%	0.818	79%	0.786	S	S	*	*			cis	-142.8	171	37.5	42.4	-23.2	0	0	0	120.9
544	E	29.1	Very low	26.3	Very low	169 Å²	169	157.4 Å²	157.4	79%	0.79	79%	0.786	S	S	*	*			trans	-79	144.7	176.4	-49.5	176.9	127.3	0	0	114.3
545	E	26.4	Very low	26.9	Very low	202 Å²	202	151.7 Å²	151.7	94%	0.944	78%	0.78	S	S	*	*			trans	-146.9	126.1	143.6	-67.7	-172.6	166.4	0	0	106.6
546	G	26.1	Very low	27.1	Very low	67 Å²	67	147.7 Å²	147.7	69%	0.691	78%	0.777	S	S	*	*			cis	166.3	145.4	-12.1	0	0	0	0	0	111
547	F	21.4	Very low	27.1	Very low	201 Å²	201	147.5 Å²	147.5	88%	0.882	79%	0.787	S	S	*	*			trans	64.9	147.8	174.5	-95.6	-123.4	0	0	0	116.7
548	D	23.6	Very low	27.1	Very low	124 Å²	124	142.7 Å²	142.7	66%	0.663	79%	0.785	S	S	*	*			cis	-152.2	-179.3	-4.2	-154.3	-5	0	0	0	111
549	E	27.7	Very low	27.2	Very low	193 Å²	193	147.1 Å²	147.1	90%	0.902	79%	0.794	S	S	*	*			trans	-61.8	152.2	-173.2	-61.4	-171.9	124	0	0	117.1
550	G	25.5	Very low	27.5	Very low	77 Å²	77	142.7 Å²	142.7	79%	0.794	79%	0.786	S	S	*	*			trans	-175.7	101	169.8	0	0	0	0	0	115
551	M	29.6	Very low	28	Very low	168 Å²	168	146.4 Å²	146.4	83%	0.828	79%	0.794	S	S	*	*			trans	-67	146	174.7	-67.5	164	51.2	0	0	113.1
552	F	25.3	Very low	27.9	Very low	212 Å²	212	148.3 Å²	148.3	93%	0.93	79%	0.792	S	S	*	*			trans	-159.2	164.4	132.2	-124	-84.5	0	0	0	112.4
553	I	25.5	Very low	28	Very low	122 Å²	122	148 Å²	148	63%	0.626	79%	0.794	S	S	*	*			trans	-129.4	136.6	-161.7	-78	174.7	0	0	0	112.8
554	Q	24.4	Very low	27.9	Very low	177 Å²	177	150.6 Å²	150.6	83%	0.827	79%	0.793	S	S	*	*			trans	64.3	175	160.9	-83.9	-176.4	16.1	0	0	118.8
555	P	37.2	Very low	28.1	Very low	116 Å²	116	146.8 Å²	146.8	75%	0.753	79%	0.785	S	S	*	*			cis	-126.2	175.9	-5.2	15.3	10	0	0	0	116.3
556	S	28	Very low	28.4	Very low	122 Å²	122	140.5 Å²	140.5	85%	0.853	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-68.2	155	172.5	-45.6	0	0	0	0	114.3
557	A	24.9	Very low	28.7	Very low	102 Å²	102	142.6 Å²	142.6	84%	0.843	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-99.5	126.6	165.5	0	0	0	0	0	111.4
558	S	25.5	Very low	29.5	Very low	116 Å²	116	136.8 Å²	136.8	81%	0.811	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-92.6	154	178.1	48.7	0	0	0	0	112.8
559	Y	26.5	Very low	30.1	Very low	219 Å²	219	137.8 Å²	137.8	86%	0.859	74%	0.743	S	S	*	*			trans	-110.1	152.9	163.9	-98.5	-98.6	0	0	0	110.9
560	P	30.3	Very low	30.8	Very low	111 Å²	111	132.5 Å²	132.5	72%	0.721	72%	0.721	S	S	*	*			trans	-69.1	151.6	-169	-20.8	34.3	0	0	0	114.5
561	R	38.8	Very low	31.7	Very low	214 Å²	214	131.4 Å²	131.4	81%	0.808	70%	0.704	S	S	*	*			trans	-101.9	108.3	166.9	-179.7	-167.5	-161	-110.3	14.3	107.4	D563	R561-D563 IonicContact NH1-OD1 3.23Å
562	E	29.2	Very low	32.3	Very low	162 Å²	162	130.7 Å²	130.7	76%	0.757	70%	0.699	S	S	*	*			trans	-109.6	154	165.6	-64.2	-163.8	171.9	0	0	109.8	F564	E562-F564 PolarHBondContact O-N 2.91Å
563	D	29.8	Very low	33.1	Very low	108 Å²	108	124.8 Å²	124.8	58%	0.578	68%	0.677	S	S	*	*			trans	-83.2	125	-146.2	-68.8	-62.1	0	0	0	115.6	R561 S565	R561-D563 IonicContact NH1-OD1 3.23Å; D563-S565 PolarHBondContact O-N 3.14Å
564	F	31.9	Very low	34.1	Very low	180 Å²	180	120.6 Å²	120.6	79%	0.789	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	41	174.8	-76.4	-91.1	0	0	0	113.2	E562 L567	E562-F564 PolarHBondContact O-N 2.91Å; F564-L567 HydrophobicContact CD1-CD1 4.36Å
565	S	33.3	Very low	34.9	Very low	89 Å²	89	116.4 Å²	116.4	62%	0.622	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	-18.7	-179.7	-62.2	0	0	0	0	113.7	D563 S568	D563-S565 PolarHBondContact O-N 3.14Å; S565-S568 PolarHBondContact O-OG 2.88Å
566	S	31.3	Very low	35	Very low	71 Å²	71	117 Å²	117	50%	0.497	64%	0.636	S	S	.	*	S	Bend	trans	-93.3	-0.7	178.3	56.1	0	0	0	0	114.3	N570	S566-N570 PolarHBondContact O-ND2 3.48Å
567	L	32.7	Very low	35.7	Very low	111 Å²	111	115.3 Å²	115.3	58%	0.581	62%	0.617	S	S	*	*	S	Bend	trans	-100.3	-7.7	-177.9	-66.2	-179.7	0	0	0	114.5	F564	F564-L567 HydrophobicContact CD1-CD1 4.36Å
568	S	38.9	Very low	36.3	Very low	78 Å²	78	113.8 Å²	113.8	55%	0.545	59%	0.592	S	S	.	*	S	Bend	trans	-76.5	-47.5	173.7	44.3	0	0	0	0	112.1	S565 N570 A571	S565-S568 PolarHBondContact O-OG 2.88Å; S568-N570 PolarHBondContact O-N 2.86Å; S568-A571 WeakPolarHBondContact O-CB 3.4Å; S568-A571 PolarHBondContact O-N 2.9Å
569	E	35.8	Very low	36.9	Very low	145 Å²	145	115.5 Å²	115.5	68%	0.678	58%	0.582	S	S	*	*	H	α-helix	trans	-58.4	-34.7	176.5	-61	178.5	131.4	0	0	111.7	A571 E572 L573	E569-A571 PolarHBondContact O-N 3.28Å; E569-E572 PolarHBondContact O-N 2.72Å; E569-E572 VanDerWaalsContact O-N 3.12Å; E569-L573 PolarHBondContact O-N 2.92Å
570	N	41.8	Very low	37.2	Very low	82 Å²	82	107.6 Å²	107.6	44%	0.439	56%	0.559	S	S	.	*	H	α-helix	trans	-63.3	-16.9	174.1	-83.8	-68.6	0	0	0	113.9	S566 S568 A574	S566-N570 PolarHBondContact O-ND2 3.48Å; S568-N570 PolarHBondContact O-N 2.86Å; N570-A574 WeakPolarHBondContact O-CB 3.36Å; N570-A574 PolarHBondContact O-N 3.29Å
571	A	45.8	Very low	37.9	Very low	54 Å²	54	107 Å²	107	45%	0.446	55%	0.548	S	S	.	.	H	α-helix	trans	-72.4	-36.6	172.9	0	0	0	0	0	112	S568 E569 N575	S568-A571 WeakPolarHBondContact O-CB 3.4Å; S568-A571 PolarHBondContact O-N 2.9Å; E569-A571 PolarHBondContact O-N 3.28Å; A571-N575 PolarHBondContact O-N 3.45Å; A571-N575 VanDerWaalsContact O-N 3.15Å; A571-N575 PolarHBondContact O-ND2 3.47Å
572	E	41.7	Very low	37.8	Very low	154 Å²	154	100.9 Å²	100.9	72%	0.72	53%	0.53	S	S	*	.	H	α-helix	trans	-75.4	-44.2	176.8	-62.2	-170.1	149.2	0	0	110.1	E569 A574 N575 Q576	E569-E572 PolarHBondContact O-N 2.72Å; E569-E572 VanDerWaalsContact O-N 3.12Å; E572-A574 VanDerWaalsContact C-N 3.32Å; E572-A574 PolarHBondContact O-N 3.11Å; E572-N575 PolarHBondContact O-N 2.31Å; E572-N575 VanDerWaalsContact O-N 3.1Å; E572-Q576 PolarHBondContact O-N 3.45Å
573	L	42.5	Very low	38.1	Very low	88 Å²	88	98.5 Å²	98.5	46%	0.461	52%	0.519	S	S	.	.	H	α-helix	trans	-58.7	-41	173.2	-152.7	80	0	0	0	112.2	E569 N575 Q576 I577	E569-L573 PolarHBondContact O-N 2.92Å; L573-N575 PolarHBondContact O-N 2.91Å; L573-Q576 PolarHBondContact O-N 3.11Å; L573-I577 HydrophobicContact CD2-CD1 4.42Å; L573-I577 HydrophobicContact CG-CD1 4.28Å; L573-I577 WeakPolarHBondContact O-CB 3.4Å; L573-I577 VanDerWaalsContact O-CG1 3.28Å; L573-I577 WeakPolarHBondContact O-CG1 3.33Å; L573-I577 PolarHBondContact O-N 3.39Å
574	A	45	Very low	38.4	Very low	34 Å²	34	98.6 Å²	98.6	28%	0.281	52%	0.519	S	S	.	.	H	α-helix	trans	-68	-31.8	176.2	0	0	0	0	0	113.3	N570 E572 Q578	N570-A574 WeakPolarHBondContact O-CB 3.36Å; N570-A574 PolarHBondContact O-N 3.29Å; E572-A574 VanDerWaalsContact C-N 3.32Å; E572-A574 PolarHBondContact O-N 3.11Å; A574-Q578 VanDerWaalsContact O-CB 3.31Å; A574-Q578 WeakPolarHBondContact O-CB 3.42Å; A574-Q578 PolarHBondContact O-N 3.46Å; A574-Q578 VanDerWaalsContact O-N 3.15Å
575	N	42.2	Very low	38.9	Very low	88 Å²	88	93.6 Å²	93.6	47%	0.471	50%	0.5	S	S	.	.	H	α-helix	trans	-69.6	-43.3	169.8	-81.6	-72.3	0	0	0	110.8	A571 E572 L573 Q578 Y579	A571-N575 PolarHBondContact O-N 3.45Å; A571-N575 VanDerWaalsContact O-N 3.15Å; A571-N575 PolarHBondContact O-ND2 3.47Å; E572-N575 PolarHBondContact O-N 2.31Å; E572-N575 VanDerWaalsContact O-N 3.1Å; L573-N575 PolarHBondContact O-N 2.91Å; N575-Q578 CarbonylContact O-C 3.57Å; N575-Q578 WeakPolarHBondContact O-CA 3.45Å; N575-Q578 WeakPolarHBondContact O-CB 3.43Å; N575-Q578 PolarHBondContact O-N 3.06Å; N575-Y579 WeakPolarHBondContact O-CD2 3.49Å; N575-Y579 PolarHBondContact O-N 3.24Å
576	Q	39.5	Very low	39.2	Very low	128 Å²	128	96.3 Å²	96.3	60%	0.598	50%	0.503	S	S	*	.	H	α-helix	trans	-62.1	-45.7	179.5	-157.7	167.1	34.7	0	0	111.8	E572 L573 Q578 Y579 S580	E572-Q576 PolarHBondContact O-N 3.45Å; L573-Q576 PolarHBondContact O-N 3.11Å; Q576-Q578 VanDerWaalsContact C-N 3.27Å; Q576-Q578 PolarHBondContact O-N 3.26Å; Q576-Y579 CarbonylContact O-C 3.54Å; Q576-Y579 WeakPolarHBondContact O-CA 3.39Å; Q576-Y579 WeakPolarHBondContact O-CB 3.36Å; Q576-Y579 PolarHBondContact O-N 3.23Å; Q576-S580 PolarHBondContact O-N 2.67Å; Q576-S580 PolarHBondContact O-OG 3.48Å
577	I	41.6	Very low	39.4	Very low	87 Å²	87	99.9 Å²	99.9	45%	0.446	51%	0.512	S	S	.	.	H	α-helix	trans	-59.6	-37.2	171.5	-68.5	163.7	0	0	0	111.5	L573 Y579 S580 I581	L573-I577 HydrophobicContact CD2-CD1 4.42Å; L573-I577 HydrophobicContact CG-CD1 4.28Å; L573-I577 WeakPolarHBondContact O-CB 3.4Å; L573-I577 VanDerWaalsContact O-CG1 3.28Å; L573-I577 WeakPolarHBondContact O-CG1 3.33Å; L573-I577 PolarHBondContact O-N 3.39Å; I577-Y579 VanDerWaalsContact C-N 3.3Å; I577-Y579 PolarHBondContact O-N 2.43Å; I577-S580 PolarHBondContact O-N 2.95Å; I577-I581 HydrophobicContact CG2-CD1 3.67Å; I577-I581 HydrophobicContact CG2-CG1 4.34Å; I577-I581 WeakPolarHBondContact O-CB 3.31Å; I577-I581 WeakPolarHBondContact O-CG1 3.45Å; I577-I581 PolarHBondContact O-N 2.88Å
578	Q	38.1	Very low	39.6	Very low	70 Å²	70	98.3 Å²	98.3	33%	0.327	52%	0.523	S	S	.	.	H	α-helix	trans	-70.4	-24.8	175.7	-167.3	172.3	-112.2	0	0	112.6	A574 N575 Q576 M582	A574-Q578 VanDerWaalsContact O-CB 3.31Å; A574-Q578 WeakPolarHBondContact O-CB 3.42Å; A574-Q578 PolarHBondContact O-N 3.46Å; A574-Q578 VanDerWaalsContact O-N 3.15Å; N575-Q578 CarbonylContact O-C 3.57Å; N575-Q578 WeakPolarHBondContact O-CA 3.45Å; N575-Q578 WeakPolarHBondContact O-CB 3.43Å; N575-Q578 PolarHBondContact O-N 3.06Å; Q576-Q578 VanDerWaalsContact C-N 3.27Å; Q576-Q578 PolarHBondContact O-N 3.26Å; Q578-M582 WeakPolarHBondContact O-CE 3.47Å; Q578-M582 WeakPolarHBondContact O-CG 3.33Å
579	Y	37.4	Very low	39.2	Very low	153 Å²	153	101.8 Å²	101.8	60%	0.6	53%	0.531	S	S	*	.	H	α-helix	trans	-77.2	-45.7	167.6	-84.8	-82.1	0	0	0	112.1	N575 Q576 I577 I581 M582 Q583	N575-Y579 WeakPolarHBondContact O-CD2 3.49Å; N575-Y579 PolarHBondContact O-N 3.24Å; Q576-Y579 CarbonylContact O-C 3.54Å; Q576-Y579 WeakPolarHBondContact O-CA 3.39Å; Q576-Y579 WeakPolarHBondContact O-CB 3.36Å; Q576-Y579 PolarHBondContact O-N 3.23Å; I577-Y579 VanDerWaalsContact C-N 3.3Å; I577-Y579 PolarHBondContact O-N 2.43Å; Y579-I581 PolarHBondContact O-N 3.01Å; Y579-M582 HydrophobicContact CD1-CE 3.96Å; Y579-M582 HydrophobicContact CE1-CE 4.17Å; Y579-M582 HydrophobicContact CG-CE 4.33Å; Y579-M582 CarbonylContact O-C 3.59Å; Y579-M582 WeakPolarHBondContact O-CA 3.34Å; Y579-M582 WeakPolarHBondContact O-CB 3.32Å; Y579-M582 PolarHBondContact O-N 2.92Å; Y579-Q583 PolarHBondContact O-N 3.37Å
580	S	34	Very low	39	Very low	53 Å²	53	100 Å²	100	37%	0.371	53%	0.534	S	S	.	.	H	α-helix	trans	-56.5	-49.3	175.5	-57.7	0	0	0	0	111.8	Q576 I577 M582 Q583 D584	Q576-S580 PolarHBondContact O-N 2.67Å; Q576-S580 PolarHBondContact O-OG 3.48Å; I577-S580 PolarHBondContact O-N 2.95Å; S580-M582 PolarHBondContact O-N 3.05Å; S580-Q583 CarbonylContact O-C 3.59Å; S580-Q583 WeakPolarHBondContact O-CA 3.41Å; S580-Q583 WeakPolarHBondContact O-CB 3.18Å; S580-Q583 PolarHBondContact O-N 3.35Å; S580-D584 PolarHBondContact O-N 3.04Å; S580-D584 VanDerWaalsContact O-OD2 3.14Å
581	I	43.8	Very low	38.6	Very low	98 Å²	98	106 Å²	106	50%	0.503	55%	0.55	S	S	.	*	H	α-helix	trans	-65.4	-15.2	176.5	-64.5	171	0	0	0	112.5	I577 Y579	I577-I581 HydrophobicContact CG2-CD1 3.67Å; I577-I581 HydrophobicContact CG2-CG1 4.34Å; I577-I581 WeakPolarHBondContact O-CB 3.31Å; I577-I581 WeakPolarHBondContact O-CG1 3.45Å; I577-I581 PolarHBondContact O-N 2.88Å; Y579-I581 PolarHBondContact O-N 3.01Å
582	M	36.8	Very low	37.8	Very low	85 Å²	85	111.9 Å²	111.9	42%	0.419	57%	0.569	S	S	.	*	H	α-helix	trans	-83.8	-32.2	166.4	-74	-167.1	-66.1	0	0	113.2	Q578 Y579 S580	Q578-M582 WeakPolarHBondContact O-CE 3.47Å; Q578-M582 WeakPolarHBondContact O-CG 3.33Å; Y579-M582 HydrophobicContact CD1-CE 3.96Å; Y579-M582 HydrophobicContact CE1-CE 4.17Å; Y579-M582 HydrophobicContact CG-CE 4.33Å; Y579-M582 CarbonylContact O-C 3.59Å; Y579-M582 WeakPolarHBondContact O-CA 3.34Å; Y579-M582 WeakPolarHBondContact O-CB 3.32Å; Y579-M582 PolarHBondContact O-N 2.92Å; S580-M582 PolarHBondContact O-N 3.05Å
583	Q	37.1	Very low	37.5	Very low	112 Å²	112	113 Å²	113	52%	0.523	58%	0.579	S	S	.	*	H	α-helix	trans	-81.7	-39.5	-177.6	-163.1	162.5	0.5	0	0	112.9	Y579 S580 L585 Q586 Q587	Y579-Q583 PolarHBondContact O-N 3.37Å; S580-Q583 CarbonylContact O-C 3.59Å; S580-Q583 WeakPolarHBondContact O-CA 3.41Å; S580-Q583 WeakPolarHBondContact O-CB 3.18Å; S580-Q583 PolarHBondContact O-N 3.35Å; Q583-L585 PolarHBondContact O-N 3.23Å; Q583-Q586 CarbonylContact O-C 3.59Å; Q583-Q586 VanDerWaalsContact O-CA 3.3Å; Q583-Q586 WeakPolarHBondContact O-CA 3.46Å; Q583-Q586 WeakPolarHBondContact O-CB 3.18Å; Q583-Q586 PolarHBondContact O-N 2.88Å; Q583-Q587 PolarHBondContact O-N 3.2Å
584	D	35.3	Very low	36.9	Very low	110 Å²	110	112 Å²	112	59%	0.588	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-25.7	173.7	-54.5	-31.9	0	0	0	111.8	S580 Q586	S580-D584 PolarHBondContact O-N 3.04Å; S580-D584 VanDerWaalsContact O-OD2 3.14Å; D584-Q586 PolarHBondContact O-N 2.91Å
585	L	42.4	Very low	36.5	Very low	75 Å²	75	120.1 Å²	120.1	39%	0.393	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.6	11.8	171	-97.4	156.8	0	0	0	113.3	Q583 R616	Q583-L585 PolarHBondContact O-N 3.23Å; L585-R616 PolarHBondContact O-NH2 3.4Å
586	Q	38.9	Very low	36.2	Very low	147 Å²	147	120.1 Å²	120.1	69%	0.687	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.8	-14	-178.5	-142.5	90.4	7	0	0	112.5	Q583 D584	Q583-Q586 CarbonylContact O-C 3.59Å; Q583-Q586 VanDerWaalsContact O-CA 3.3Å; Q583-Q586 WeakPolarHBondContact O-CA 3.46Å; Q583-Q586 WeakPolarHBondContact O-CB 3.18Å; Q583-Q586 PolarHBondContact O-N 2.88Å; D584-Q586 PolarHBondContact O-N 2.91Å
587	Q	36.3	Very low	36.1	Very low	145 Å²	145	119.6 Å²	119.6	68%	0.678	65%	0.646	S	S	*	*	S	Bend	trans	-130.1	123.5	179.3	-68.7	-179.3	-18.2	0	0	110.1	Q583	Q583-Q587 PolarHBondContact O-N 3.2Å
588	G	35.7	Very low	36	Very low	78 Å²	78	124.9 Å²	124.9	80%	0.804	67%	0.668	S	S	*	*	S	Bend	trans	111.2	56.3	174.3	0	0	0	0	0	116.5
589	E	32.4	Very low	36.5	Very low	152 Å²	152	129.7 Å²	129.7	71%	0.71	70%	0.695	S	S	*	*			trans	-167.6	116.1	140.4	-115	174.2	-149.5	0	0	109.7	W591	E589-W591 PolarHBondContact OE2-NE1 3.42Å
590	S	31.1	Very low	36.6	Very low	107 Å²	107	126.2 Å²	126.2	75%	0.748	70%	0.698	S	S	*	*			trans	-79.4	123.1	169.3	-174.7	0	0	0	0	108.8
591	W	32.5	Very low	37.2	Very low	207 Å²	207	131.6 Å²	131.6	78%	0.784	72%	0.722	S	S	*	*			trans	-114.1	100.7	166.3	-71.4	91.4	0	0	0	107.2	E589	E589-W591 PolarHBondContact OE2-NE1 3.42Å
592	E	30.6	Very low	37.6	Very low	179 Å²	179	133 Å²	133	84%	0.836	73%	0.73	S	S	*	*			trans	-62	153.7	-177.1	-61.3	-174.1	134.5	0	0	111.8	G594	E592-G594 PolarHBondContact O-N 3.5Å
593	N	33.4	Very low	38.7	Very low	176 Å²	176	136.4 Å²	136.4	94%	0.941	74%	0.743	S	S	*	*			trans	-69	98.2	-175.1	-66.4	-53.5	0	0	0	111.7
594	G	30.7	Very low	40.5	Very low	68 Å²	68	133.9 Å²	133.9	70%	0.701	73%	0.733	S	S	*	*			trans	-107.5	110.5	167.1	0	0	0	0	0	111.4	E592 A596	E592-G594 PolarHBondContact O-N 3.5Å; G594-A596 PolarHBondContact O-N 3.25Å; G594-A596 VanDerWaalsContact O-N 3.07Å
595	E	37.2	Very low	42.5	Very low	205 Å²	205	136 Å²	136	96%	0.958	74%	0.736	S	S	*	*			trans	-71.5	98.1	-178.6	-62.2	-174.1	138.6	0	0	112.1
596	A	35.5	Very low	44.2	Very low	87 Å²	87	132.9 Å²	132.9	72%	0.719	72%	0.721	S	S	*	*			trans	-149.9	117.1	173	0	0	0	0	0	115	G594	G594-A596 PolarHBondContact O-N 3.25Å; G594-A596 VanDerWaalsContact O-N 3.07Å
597	S	36.6	Very low	45.8	Very low	118 Å²	118	130.9 Å²	130.9	83%	0.825	72%	0.721	S	S	*	*			trans	51	91.9	142	-59.1	0	0	0	0	119.4	L599	S597-L599 PolarHBondContact O-N 3.29Å
598	H	41	Very low	47.4	Very low	197 Å²	197	130.1 Å²	130.1	91%	0.912	72%	0.717	S	S	*	*	S	Bend	trans	-61	75.6	169	179.5	-78	0	0	0	113.7
599	L	47.9	Very low	49.4	Very low	171 Å²	171	128.8 Å²	128.8	90%	0.895	70%	0.695	S	S	*	*			trans	-158.1	46.4	171.5	-119.9	178	0	0	0	116.6	S597	S597-L599 PolarHBondContact O-N 3.29Å
600	A	39	Very low	51.5	Low	81 Å²	81	129.6 Å²	129.6	67%	0.669	70%	0.704	S	S	*	*			trans	-124	118.3	172.7	0	0	0	0	0	113.1	N602	A600-N602 PolarHBondContact O-N 2.88Å; A600-N602 VanDerWaalsContact O-N 3.17Å
601	L	46.4	Very low	53.7	Low	165 Å²	165	129 Å²	129	86%	0.864	69%	0.686	S	S	*	*			trans	-78.7	95.8	169.7	-79.9	172.7	0	0	0	109.9	K603	L601-K603 PolarHBondContact O-N 2.77Å
602	N	54	Low	55.9	Low	127 Å²	127	123.2 Å²	123.2	68%	0.679	67%	0.67	S	S	*	*			trans	-60.2	89.1	-178.6	-75.7	-10.6	0	0	0	113	A600 L604	A600-N602 PolarHBondContact O-N 2.88Å; A600-N602 VanDerWaalsContact O-N 3.17Å; N602-L604 PolarHBondContact O-N 3.08Å
603	K	59.6	Low	58.3	Low	157 Å²	157	114.8 Å²	114.8	68%	0.683	63%	0.63	S	S	*	*			trans	-75.9	92.3	172.2	-77.2	177.9	-176.8	174.6	0	109.7	L601 K605 I612	L601-K603 PolarHBondContact O-N 2.77Å; K603-K605 PolarHBondContact O-N 2.89Å; K603-K605 VanDerWaalsContact O-N 3.13Å; K603-I612 HydrophobicContact CB-CG2 3.66Å; K603-I612 HydrophobicContact CD-CG2 4.5Å; K603-I612 HydrophobicContact CG-CG2 4.12Å
604	L	75.1	Confident	60.3	Low	60 Å²	60	115.2 Å²	115.2	31%	0.314	62%	0.624	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.8	102.6	-176.7	-60.6	174	0	0	0	110.4	N602 A613 R616 L619	N602-L604 PolarHBondContact O-N 3.08Å; L604-A613 HydrophobicContact CB-CB 4.39Å; L604-A613 PolarHBondContact N-O 3.2Å; L604-A613 VanDerWaalsContact N-O 3.09Å; L604-A613 WeakPolarHBondContact O-CB 3.48Å; L604-A613 PolarHBondContact O-N 3.44Å; L604-R616 HydrophobicContact CD1-CB 3.93Å; L604-R616 HydrophobicContact CD1-CG 4.47Å; L604-R616 VanDerWaalsContact CD1-N 3.35Å; L604-L619 HydrophobicContact CB-CD2 3.97Å
605	K	75.8	Confident	62.5	Low	153 Å²	153	116.6 Å²	116.6	67%	0.665	61%	0.612	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-74.2	154.2	176.4	-59.3	-178.1	-177.7	176.1	0	111.1	K603 Y611 I612 L619	K603-K605 PolarHBondContact O-N 2.89Å; K603-K605 VanDerWaalsContact O-N 3.13Å; K605-Y611 CarbonylContact C-O 3.23Å; K605-Y611 WeakPolarHBondContact CA-O 3.27Å; K605-I612 HydrophobicContact CG-CG1 4.32Å; K605-L619 VanDerWaalsContact O-CD2 3.29Å; K605-L619 WeakPolarHBondContact O-CD2 3.41Å
606	C	78	Confident	64.2	Low	11 Å²	11	113.2 Å²	113.2	7%	0.074	59%	0.591	C	S	.	*			trans	-84.3	137.7	165.5	-175.1	0	0	0	0	110.5	H608 C609 Y611 L619 H622	C606-H608 VanDerWaalsContact C-N 3.3Å; C606-H608 PolarHBondContact SG-N 3.2Å; C606-C609 WeakPolarHBondContact CB-O 3.37Å; C606-Y611 PolarHBondContact N-O 2.84Å; C606-L619 HydrophobicContact CB-CD1 3.85Å; C606-H622 PolarHBondContact SG-CD2 3.24Å; C606-H622 PolarHBondContact SG-NE2 2.95Å; C606-H622 VanDerWaalsContact SG-NE2 3.38Å
607	P	72.8	Confident	66.1	Low	105 Å²	105	118.2 Å²	118.2	68%	0.682	59%	0.591	S	S	*	*	S	Bend	trans	-69.4	-26.1	173.6	27.2	-34.6	0	0	0	113	L623	P607-L623 HydrophobicContact CG-CD2 4.25Å
608	H	70.1	Confident	68	Low	129 Å²	129	113.9 Å²	113.9	60%	0.597	56%	0.559	S	S	*	*	S	Bend	trans	-96.5	-10.8	-175	-53.2	-62.4	0	0	0	114.4	C606 H626	C606-H608 VanDerWaalsContact C-N 3.3Å; C606-H608 PolarHBondContact SG-N 3.2Å; H608-H626 HydrophobicContact CB-CB 4.27Å; H608-H626 WeakPolarHBondContact CB-ND1 3.48Å
609	C	78.1	Confident	69.7	Low	50 Å²	50	105.6 Å²	105.6	34%	0.338	52%	0.522	S	S	.	.	S	Bend	trans	-163.3	170.6	171	74.1	0	0	0	0	113	C606 Y611 H622 H626	C606-C609 WeakPolarHBondContact CB-O 3.37Å; C609-Y611 PolarHBondContact O-N 3.01Å; C609-H622 VanDerWaalsContact SG-CE1 3.58Å; C609-H622 PolarHBondContact SG-NE2 3.07Å; C609-H626 PolarHBondContact SG-NE2 3.13Å
610	N	76.8	Confident	71	Confident	168 Å²	168	100.6 Å²	100.6	90%	0.898	49%	0.493	S	S	*	.	S	Bend	trans	-68.8	18.1	-178.1	-66.2	-32.4	0	0	0	115.7
611	Y	75.9	Confident	72.7	Confident	94 Å²	94	102 Å²	102	37%	0.369	48%	0.481	S	S	.	.			trans	-72.6	133.1	175.2	-176.6	-106.3	0	0	0	111.6	K605 C606 C609 A613 H622	K605-Y611 CarbonylContact C-O 3.23Å; K605-Y611 WeakPolarHBondContact CA-O 3.27Å; C606-Y611 PolarHBondContact N-O 2.84Å; C609-Y611 PolarHBondContact O-N 3.01Å; Y611-A613 HydrophobicContact CE1-CB 3.95Å; Y611-H622 VanDerWaalsContact CB-CE1 3.46Å; Y611-H622 WeakPolarHBondContact CB-CE1 3.2Å; Y611-H622 HydrophobicContact CD1-CB 3.86Å; Y611-H622 AromaticContact CD1-CD2 3.64Å; Y611-H622 AromaticContact CD1-CE1 3.85Å; Y611-H622 AromaticContact CD1-CG 3.36Å; Y611-H622 AromaticContact CD1-ND1 3.51Å; Y611-H622 AromaticContact CD1-NE2 3.93Å; Y611-H622 HydrophobicContact CE1-CB 3.8Å; Y611-H622 AromaticContact CE1-CG 3.8Å; Y611-H622 AromaticContact CG-CE1 3.64Å; Y611-H622 AromaticContact CG-CG 3.97Å; Y611-H622 AromaticContact CG-ND1 3.64Å; Y611-H622 AromaticContact CG-NE2 3.95Å
612	I	79.9	Confident	74.2	Confident	87 Å²	87	95.3 Å²	95.3	45%	0.446	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	113.2	179.2	-52.3	-173.7	0	0	0	109.8	K603 K605	K603-I612 HydrophobicContact CB-CG2 3.66Å; K603-I612 HydrophobicContact CD-CG2 4.5Å; K603-I612 HydrophobicContact CG-CG2 4.12Å; K605-I612 HydrophobicContact CG-CG1 4.32Å
613	A	81.4	Confident	75.1	Confident	1 Å²	1	91.6 Å²	91.6	1%	0.008	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	142.7	178.8	0	0	0	0	0	111.9	L604 Y611 L619	L604-A613 HydrophobicContact CB-CB 4.39Å; L604-A613 PolarHBondContact N-O 3.2Å; L604-A613 VanDerWaalsContact N-O 3.09Å; L604-A613 WeakPolarHBondContact O-CB 3.48Å; L604-A613 PolarHBondContact O-N 3.44Å; Y611-A613 HydrophobicContact CE1-CB 3.95Å; A613-L619 HydrophobicContact CB-CB 3.74Å; A613-L619 HydrophobicContact CB-CD1 4.31Å
614	K	74.1	Confident	75.8	Confident	185 Å²	185	86.3 Å²	86.3	80%	0.804	40%	0.403	S	S	*	.	S	Bend	trans	-83.9	-12	173.5	-65.4	-174.6	179.5	-178.3	0	114
615	H	77.1	Confident	75.4	Confident	98 Å²	98	88 Å²	88	45%	0.454	41%	0.412	S	S	.	.	S	Bend	trans	-148.4	148.5	-177.7	-50.5	88.2	0	0	0	111.3	R617 T618 L619	H615-R617 VanDerWaalsContact C-N 3.27Å; H615-R617 HydrophobicContact CB-CG 3.9Å; H615-R617 PolarHBondContact O-N 3.34Å; H615-T618 PolarHBondContact N-OG1 3Å; H615-T618 VanDerWaalsContact N-OG1 3.14Å; H615-T618 PolarHBondContact O-N 2.99Å; H615-T618 PolarHBondContact O-OG1 2.98Å; H615-L619 PolarHBondContact O-N 3.37Å; H615-L619 VanDerWaalsContact O-N 3.14Å
616	R	73.5	Confident	75	Confident	134 Å²	134	84.3 Å²	84.3	51%	0.506	40%	0.397	S	S	.	.	H	α-helix	trans	-56.2	-40	178.7	-160.1	175	-175.3	-156.1	-2.9	111.9	L585 L604 T618 L619 K620	L585-R616 PolarHBondContact O-NH2 3.4Å; L604-R616 HydrophobicContact CD1-CB 3.93Å; L604-R616 HydrophobicContact CD1-CG 4.47Å; L604-R616 VanDerWaalsContact CD1-N 3.35Å; R616-T618 VanDerWaalsContact C-N 3.33Å; R616-T618 PolarHBondContact O-N 3.09Å; R616-L619 PolarHBondContact O-N 3Å; R616-L619 VanDerWaalsContact O-N 3.16Å; R616-K620 PolarHBondContact O-N 2.68Å
617	R	74.4	Confident	74.2	Confident	192 Å²	192	87.3 Å²	87.3	73%	0.725	42%	0.418	S	S	*	.	H	α-helix	trans	-59.1	-35.7	172.9	66.1	178.6	-179.6	141.1	-2.3	114.4	H615 R621	H615-R617 VanDerWaalsContact C-N 3.27Å; H615-R617 HydrophobicContact CB-CG 3.9Å; H615-R617 PolarHBondContact O-N 3.34Å; R617-R621 WeakPolarHBondContact O-CB 3.43Å; R617-R621 PolarHBondContact O-N 3.35Å
618	T	76.5	Confident	73.4	Confident	27 Å²	27	83.9 Å²	83.9	17%	0.166	40%	0.402	C	S	.	.	H	α-helix	trans	-77.5	-27.2	177.1	42	0	0	0	0	112.5	H615 R616 H622	H615-T618 PolarHBondContact N-OG1 3Å; H615-T618 VanDerWaalsContact N-OG1 3.14Å; H615-T618 PolarHBondContact O-N 2.99Å; H615-T618 PolarHBondContact O-OG1 2.98Å; R616-T618 VanDerWaalsContact C-N 3.33Å; R616-T618 PolarHBondContact O-N 3.09Å; T618-H622 WeakPolarHBondContact O-CB 3.07Å; T618-H622 PolarHBondContact O-N 3.09Å
619	L	77.8	Confident	73	Confident	23 Å²	23	81 Å²	81	12%	0.12	39%	0.393	C	S	.	.	H	α-helix	trans	-74.9	-48.1	171.7	-171.7	60.3	0	0	0	111.8	L604 K605 C606 A613 H615 R616 R621 H622 L623	L604-L619 HydrophobicContact CB-CD2 3.97Å; K605-L619 VanDerWaalsContact O-CD2 3.29Å; K605-L619 WeakPolarHBondContact O-CD2 3.41Å; C606-L619 HydrophobicContact CB-CD1 3.85Å; A613-L619 HydrophobicContact CB-CB 3.74Å; A613-L619 HydrophobicContact CB-CD1 4.31Å; H615-L619 PolarHBondContact O-N 3.37Å; H615-L619 VanDerWaalsContact O-N 3.14Å; R616-L619 PolarHBondContact O-N 3Å; R616-L619 VanDerWaalsContact O-N 3.16Å; L619-R621 VanDerWaalsContact C-N 3.28Å; L619-R621 PolarHBondContact O-N 2.7Å; L619-H622 CarbonylContact O-C 3.52Å; L619-H622 WeakPolarHBondContact O-CA 3.46Å; L619-H622 WeakPolarHBondContact O-CB 3.3Å; L619-H622 PolarHBondContact O-N 2.85Å; L619-L623 HydrophobicContact CG-CD1 4.21Å; L619-L623 HydrophobicContact CG-CG 4.42Å; L619-L623 PolarHBondContact O-N 3.14Å
620	K	75	Confident	72.2	Confident	65 Å²	65	85.2 Å²	85.2	28%	0.283	40%	0.402	S	S	.	.	H	α-helix	trans	-51.7	-46.8	175	-74.2	-158.4	177	-159.4	0	111.2	R616 H622 L623 I624	R616-K620 PolarHBondContact O-N 2.68Å; K620-H622 VanDerWaalsContact C-N 3.29Å; K620-H622 PolarHBondContact O-N 3.01Å; K620-L623 PolarHBondContact O-N 3.33Å; K620-I624 PolarHBondContact O-N 3.35Å
621	R	74.1	Confident	71.5	Confident	112 Å²	112	79.3 Å²	79.3	42%	0.423	37%	0.374	S	S	.	.	H	α-helix	trans	-66	-24	176	-171.3	-179.3	64.7	161.9	-2.7	114.6	R617 L619	R617-R621 WeakPolarHBondContact O-CB 3.43Å; R617-R621 PolarHBondContact O-N 3.35Å; L619-R621 VanDerWaalsContact C-N 3.28Å; L619-R621 PolarHBondContact O-N 2.7Å
622	H	77.8	Confident	71.3	Confident	24 Å²	24	77.1 Å²	77.1	11%	0.111	37%	0.366	C	S	.	.	H	α-helix	trans	-81.7	-36.3	175	169.9	83.3	0	0	0	111.6	C606 C609 Y611 T618 L619 K620 I624 I625 H626	C606-H622 PolarHBondContact SG-CD2 3.24Å; C606-H622 PolarHBondContact SG-NE2 2.95Å; C606-H622 VanDerWaalsContact SG-NE2 3.38Å; C609-H622 VanDerWaalsContact SG-CE1 3.58Å; C609-H622 PolarHBondContact SG-NE2 3.07Å; Y611-H622 VanDerWaalsContact CB-CE1 3.46Å; Y611-H622 WeakPolarHBondContact CB-CE1 3.2Å; Y611-H622 HydrophobicContact CD1-CB 3.86Å; Y611-H622 AromaticContact CD1-CD2 3.64Å; Y611-H622 AromaticContact CD1-CE1 3.85Å; Y611-H622 AromaticContact CD1-CG 3.36Å; Y611-H622 AromaticContact CD1-ND1 3.51Å; Y611-H622 AromaticContact CD1-NE2 3.93Å; Y611-H622 HydrophobicContact CE1-CB 3.8Å; Y611-H622 AromaticContact CE1-CG 3.8Å; Y611-H622 AromaticContact CG-CE1 3.64Å; Y611-H622 AromaticContact CG-CG 3.97Å; Y611-H622 AromaticContact CG-ND1 3.64Å; Y611-H622 AromaticContact CG-NE2 3.95Å; T618-H622 WeakPolarHBondContact O-CB 3.07Å; T618-H622 PolarHBondContact O-N 3.09Å; L619-H622 CarbonylContact O-C 3.52Å; L619-H622 WeakPolarHBondContact O-CA 3.46Å; L619-H622 WeakPolarHBondContact O-CB 3.3Å; L619-H622 PolarHBondContact O-N 2.85Å; K620-H622 VanDerWaalsContact C-N 3.29Å; K620-H622 PolarHBondContact O-N 3.01Å; H622-I624 PolarHBondContact O-N 3.4Å; H622-I625 VanDerWaalsContact O-CB 3.24Å; H622-I625 WeakPolarHBondContact O-CB 3.39Å; H622-I625 WeakPolarHBondContact O-CG1 3.36Å; H622-I625 PolarHBondContact O-N 2.95Å; H622-H626 AromaticContact CD2-CD2 3.99Å; H622-H626 AromaticContact CD2-NE2 3.86Å; H622-H626 AromaticContact CE1-NE2 3.63Å; H622-H626 AromaticContact NE2-CD2 3.59Å; H622-H626 AromaticContact NE2-NE2 3Å; H622-H626 PolarHBondContact NE2-NE2 3.48Å
623	L	73.8	Confident	70.7	Confident	48 Å²	48	76 Å²	76	25%	0.251	37%	0.366	S	S	.	.	H	α-helix	trans	-60.1	-31.3	176.8	-72.2	166.6	0	0	0	113.1	P607 L619 K620 I625 H626 S627	P607-L623 HydrophobicContact CG-CD2 4.25Å; L619-L623 HydrophobicContact CG-CD1 4.21Å; L619-L623 HydrophobicContact CG-CG 4.42Å; L619-L623 PolarHBondContact O-N 3.14Å; K620-L623 PolarHBondContact O-N 3.33Å; L623-I625 PolarHBondContact O-N 3.05Å; L623-I625 VanDerWaalsContact O-N 3.1Å; L623-H626 PolarHBondContact O-N 3.49Å; L623-S627 PolarHBondContact O-N 3.14Å; L623-S627 VanDerWaalsContact O-N 3.09Å
624	I	73.5	Confident	70.5	Confident	46 Å²	46	75.9 Å²	75.9	24%	0.236	37%	0.365	C	S	.	.	H	α-helix	trans	-57.2	-23.8	172.4	-60.3	170.9	0	0	0	112.5	K620 H622 S627 G628 T642	K620-I624 PolarHBondContact O-N 3.35Å; H622-I624 PolarHBondContact O-N 3.4Å; I624-S627 PolarHBondContact O-OG 3.07Å; I624-G628 PolarHBondContact O-N 3.27Å; I624-T642 HydrophobicContact CG2-CG2 4.34Å
625	I	67.7	Low	70.3	Confident	97 Å²	97	73.9 Å²	73.9	50%	0.497	36%	0.364	S	S	.	.	H	α-helix	trans	-72.5	-33.8	175.8	-53.3	173.5	0	0	0	110.7	H622 L623	H622-I625 VanDerWaalsContact O-CB 3.24Å; H622-I625 WeakPolarHBondContact O-CB 3.39Å; H622-I625 WeakPolarHBondContact O-CG1 3.36Å; H622-I625 PolarHBondContact O-N 2.95Å; L623-I625 PolarHBondContact O-N 3.05Å; L623-I625 VanDerWaalsContact O-N 3.1Å
626	H	66.2	Low	69.7	Low	75 Å²	75	73.9 Å²	73.9	35%	0.347	37%	0.366	S	S	.	.	H	α-helix	trans	-83.1	-34.3	-179.8	-65.1	-75.2	0	0	0	112.9	H608 C609 H622 L623 G628	H608-H626 HydrophobicContact CB-CB 4.27Å; H608-H626 WeakPolarHBondContact CB-ND1 3.48Å; C609-H626 PolarHBondContact SG-NE2 3.13Å; H622-H626 AromaticContact CD2-CD2 3.99Å; H622-H626 AromaticContact CD2-NE2 3.86Å; H622-H626 AromaticContact CE1-NE2 3.63Å; H622-H626 AromaticContact NE2-CD2 3.59Å; H622-H626 AromaticContact NE2-NE2 3Å; H622-H626 PolarHBondContact NE2-NE2 3.48Å; L623-H626 PolarHBondContact O-N 3.49Å; H626-G628 PolarHBondContact O-N 2.8Å
627	S	61.4	Low	69.6	Low	73 Å²	73	69.8 Å²	69.8	51%	0.51	36%	0.357	S	S	.	.	S	Bend	trans	-72.9	-11.9	174.5	66.4	0	0	0	0	113.7	L623 I624 V629	L623-S627 PolarHBondContact O-N 3.14Å; L623-S627 VanDerWaalsContact O-N 3.09Å; I624-S627 PolarHBondContact O-OG 3.07Å; S627-V629 PolarHBondContact O-N 3.05Å
628	G	57.3	Low	68.9	Low	34 Å²	34	63.1 Å²	63.1	35%	0.351	35%	0.348	S	S	.	.			trans	69.6	-9.6	178.6	0	0	0	0	0	115.7	I624 H626 R630	I624-G628 PolarHBondContact O-N 3.27Å; H626-G628 PolarHBondContact O-N 2.8Å; G628-R630 PolarHBondContact O-N 3.46Å; G628-R630 PolarHBondContact O-NH1 3.24Å
629	V	60.8	Low	68.5	Low	69 Å²	69	67.7 Å²	67.7	42%	0.418	37%	0.366	S	S	.	.			trans	-61.5	119.7	-176	-179.5	0	0	0	0	110.7	S627	S627-V629 PolarHBondContact O-N 3.05Å
630	R	61.7	Low	68.1	Low	138 Å²	138	71.7 Å²	71.7	52%	0.521	39%	0.387	S	S	.	.			trans	-112.3	69.4	178.7	-69.9	169.4	176.3	82.7	-13.8	110.1	G628 F632 L640 F641 T642	G628-R630 PolarHBondContact O-N 3.46Å; G628-R630 PolarHBondContact O-NH1 3.24Å; R630-F632 PolarHBondContact O-N 3.46Å; R630-L640 HydrophobicContact CB-CB 3.61Å; R630-F641 CarbonylContact C-O 3.6Å; R630-F641 VanDerWaalsContact C-O 3.23Å; R630-F641 WeakPolarHBondContact CA-O 3.5Å; R630-T642 HydrophobicContact CG-CG2 3.78Å
631	S	62.4	Low	68.2	Low	44 Å²	44	70.9 Å²	70.9	31%	0.308	38%	0.383	S	S	.	.			trans	-71.4	8.3	-172	47.7	0	0	0	0	116
632	F	70.8	Confident	68.1	Low	48 Å²	48	67.3 Å²	67.3	21%	0.211	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-126.1	99.7	179.1	-53.2	-86.8	0	0	0	110.8	R630 L640 F641 R644 V647	R630-F632 PolarHBondContact O-N 3.46Å; F632-L640 CarbonylContact O-C 3.57Å; F632-F641 PolarHBondContact N-O 3.46Å; F632-F641 PolarHBondContact O-N 3.23Å; F632-R644 HydrophobicContact CD1-CB 3.84Å; F632-R644 HydrophobicContact CD1-CG 4.36Å; F632-R644 HydrophobicContact CE1-CB 3.85Å; F632-R644 HydrophobicContact CG-CB 4.42Å; F632-R644 HydrophobicContact CZ-CB 4.44Å; F632-V647 HydrophobicContact CB-CG2 3.5Å; F632-V647 WeakPolarHBondContact O-CG2 3.4Å
633	S	67.3	Low	67.9	Low	62 Å²	62	69 Å²	69	43%	0.434	38%	0.379	S	S	.	.			trans	-69.2	166.3	169.8	50.1	0	0	0	0	112.1	K639 V647	S633-K639 CarbonylContact C-O 3.53Å; S633-V647 VanDerWaalsContact O-CG1 3.23Å; S633-V647 WeakPolarHBondContact O-CG1 3.14Å; S633-V647 VanDerWaalsContact O-CG2 3.3Å; S633-V647 WeakPolarHBondContact O-CG2 3.31Å
634	C	76.7	Confident	67.9	Low	0 Å²	0	75.5 Å²	75.5	0%	0	40%	0.4	C	S	.	.			trans	-110.9	117	167	178.6	0	0	0	0	109.7	I636 C637 G638 K639 F641 V647	C634-I636 PolarHBondContact O-N 3.02Å; C634-C637 PolarHBondContact O-N 2.94Å; C634-G638 PolarHBondContact O-N 3.36Å; C634-K639 PolarHBondContact N-O 3.41Å; C634-F641 HydrophobicContact CB-CE2 4.23Å; C634-V647 HydrophobicContact CB-CG1 4.27Å
635	D	69.7	Low	67.9	Low	143 Å²	143	77.1 Å²	77.1	77%	0.765	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-20.8	-171.7	-30.6	-50.4	0	0	0	114.7
636	I	66.4	Low	68.3	Low	97 Å²	97	75.5 Å²	75.5	50%	0.497	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-13.3	-175	-51.9	164.8	0	0	0	112.6	C634 H654	C634-I636 PolarHBondContact O-N 3.02Å; I636-H654 HydrophobicContact CB-CB 4.11Å; I636-H654 HydrophobicContact CD1-CB 3.67Å; I636-H654 HydrophobicContact CG1-CB 4.49Å; I636-H654 HydrophobicContact CG2-CB 3.69Å
637	C	69.9	Low	68.9	Low	49 Å²	49	72.7 Å²	72.7	33%	0.331	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154	11.9	-176.6	71.2	0	0	0	0	116.2	C634 K639 H650 H654	C634-C637 PolarHBondContact O-N 2.94Å; C637-K639 PolarHBondContact O-N 3.24Å; C637-H650 PolarHBondContact SG-NE2 3.25Å; C637-H654 VanDerWaalsContact SG-CE1 3.59Å; C637-H654 PolarHBondContact SG-NE2 3.35Å
638	G	59.9	Low	69.5	Low	51 Å²	51	76.9 Å²	76.9	53%	0.526	39%	0.394	S	S	.	.			trans	68.9	-15.1	178.5	0	0	0	0	0	116.5	C634 L640	C634-G638 PolarHBondContact O-N 3.36Å; G638-L640 PolarHBondContact O-N 3.47Å
639	K	69.1	Low	70.3	Confident	124 Å²	124	80 Å²	80	54%	0.539	40%	0.395	S	S	.	.			trans	-55.8	124.4	-173	-73.4	179.5	179.5	174.8	0	112.4	S633 C634 C637 F641	S633-K639 CarbonylContact C-O 3.53Å; C634-K639 PolarHBondContact N-O 3.41Å; C637-K639 PolarHBondContact O-N 3.24Å; K639-F641 HydrophobicContact CB-CE2 3.82Å; K639-F641 HydrophobicContact CB-CZ 4.27Å; K639-F641 WeakPolarHBondContact O-CD2 3.18Å; K639-F641 WeakPolarHBondContact O-CE2 3.38Å
640	L	68	Low	71.1	Confident	107 Å²	107	78.1 Å²	78.1	56%	0.56	38%	0.382	S	S	*	.			trans	-88.2	136.9	-176.3	-57.1	-179.1	0	0	0	112.2	R630 F632 G638	R630-L640 HydrophobicContact CB-CB 3.61Å; F632-L640 CarbonylContact O-C 3.57Å; G638-L640 PolarHBondContact O-N 3.47Å
641	F	77.3	Confident	71.5	Confident	48 Å²	48	73 Å²	73	21%	0.211	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-129.1	152.3	179.7	-63.7	-93.1	0	0	0	111.3	R630 F632 C634 K639 R643 H646 V647 H650	R630-F641 CarbonylContact C-O 3.6Å; R630-F641 VanDerWaalsContact C-O 3.23Å; R630-F641 WeakPolarHBondContact CA-O 3.5Å; F632-F641 PolarHBondContact N-O 3.46Å; F632-F641 PolarHBondContact O-N 3.23Å; C634-F641 HydrophobicContact CB-CE2 4.23Å; K639-F641 HydrophobicContact CB-CE2 3.82Å; K639-F641 HydrophobicContact CB-CZ 4.27Å; K639-F641 WeakPolarHBondContact O-CD2 3.18Å; K639-F641 WeakPolarHBondContact O-CE2 3.38Å; F641-R643 PolarHBondContact O-N 3.29Å; F641-H646 HydrophobicContact CB-CB 4.16Å; F641-H646 HydrophobicContact CD1-CB 3.75Å; F641-H646 HydrophobicContact CG-CB 4.19Å; F641-V647 HydrophobicContact CB-CG2 3.93Å; F641-V647 HydrophobicContact CD2-CG2 3.74Å; F641-V647 HydrophobicContact CG-CG2 4.1Å; F641-H650 HydrophobicContact CE1-CB 4.26Å; F641-H650 HydrophobicContact CE2-CB 3.99Å; F641-H650 AromaticContact CE2-CD2 3.49Å; F641-H650 VanDerWaalsContact CE2-CD2 3.49Å; F641-H650 WeakPolarHBondContact CE2-CD2 3.3Å; F641-H650 AromaticContact CE2-CG 3.89Å; F641-H650 HydrophobicContact CZ-CB 3.6Å; F641-H650 AromaticContact CZ-CD2 3.43Å; F641-H650 VanDerWaalsContact CZ-CD2 3.43Å; F641-H650 WeakPolarHBondContact CZ-CD2 3.44Å; F641-H650 AromaticContact CZ-CG 3.44Å; F641-H650 VanDerWaalsContact CZ-CG 3.44Å
642	T	72.9	Confident	71.8	Confident	37 Å²	37	75 Å²	75	23%	0.227	37%	0.374	C	S	.	.	S	Bend	trans	-75.2	-8.6	176.9	52.4	0	0	0	0	114	I624 R630	I624-T642 HydrophobicContact CG2-CG2 4.34Å; R630-T642 HydrophobicContact CG-CG2 3.78Å
643	R	72.3	Confident	71.5	Confident	59 Å²	59	75.6 Å²	75.6	22%	0.223	38%	0.381	C	S	.	.	S	Bend	trans	-155.1	146.7	-179.9	-42.7	177	-167.2	150.2	12.5	114.2	F641 E645 H646 V647	F641-R643 PolarHBondContact O-N 3.29Å; R643-E645 VanDerWaalsContact C-N 3.31Å; R643-E645 WeakPolarHBondContact CB-OE2 3.39Å; R643-E645 VanDerWaalsContact CD-CD 3.5Å; R643-E645 WeakPolarHBondContact CD-OE1 3.47Å; R643-E645 WeakPolarHBondContact CD-OE2 3.47Å; R643-E645 IonicContact CZ-OE1 2.95Å; R643-E645 IonicContact NE-OE1 2.72Å; R643-E645 IonicContact NH1-OE1 2.78Å; R643-E645 PolarHBondContact NH1-OE1 3.3Å; R643-E645 PolarHBondContact O-N 3.45Å; R643-H646 WeakPolarHBondContact O-CB 3.42Å; R643-H646 PolarHBondContact O-N 3.28Å; R643-V647 PolarHBondContact O-N 3.45Å
644	R	73.9	Confident	71.4	Confident	185 Å²	185	75.6 Å²	75.6	70%	0.698	37%	0.374	S	S	*	.	H	α-helix	trans	-57.7	-32.2	175.9	-161.8	176.9	-73.2	-179	-3	114.3	F632 H646 V647 K648	F632-R644 HydrophobicContact CD1-CB 3.84Å; F632-R644 HydrophobicContact CD1-CG 4.36Å; F632-R644 HydrophobicContact CE1-CB 3.85Å; F632-R644 HydrophobicContact CG-CB 4.42Å; F632-R644 HydrophobicContact CZ-CB 4.44Å; R644-H646 PolarHBondContact O-N 3.42Å; R644-V647 PolarHBondContact O-N 3.37Å; R644-K648 PolarHBondContact O-N 3.02Å
645	E	74.4	Confident	70.5	Confident	79 Å²	79	81.9 Å²	81.9	37%	0.369	40%	0.402	S	S	.	.	H	α-helix	trans	-72.1	-15.4	176.6	85.4	-86.6	-163.1	0	0	113.8	R643 R649	R643-E645 VanDerWaalsContact C-N 3.31Å; R643-E645 WeakPolarHBondContact CB-OE2 3.39Å; R643-E645 VanDerWaalsContact CD-CD 3.5Å; R643-E645 WeakPolarHBondContact CD-OE1 3.47Å; R643-E645 WeakPolarHBondContact CD-OE2 3.47Å; R643-E645 IonicContact CZ-OE1 2.95Å; R643-E645 IonicContact NE-OE1 2.72Å; R643-E645 IonicContact NH1-OE1 2.78Å; R643-E645 PolarHBondContact NH1-OE1 3.3Å; R643-E645 PolarHBondContact O-N 3.45Å; E645-R649 PolarHBondContact O-NH1 3.41Å
646	H	76.3	Confident	69.8	Low	64 Å²	64	84.4 Å²	84.4	30%	0.296	41%	0.406	S	S	.	.	H	α-helix	trans	-86	-38.4	172.1	-72.3	-109.2	0	0	0	111.4	F641 R643 R644 R649 H650	F641-H646 HydrophobicContact CB-CB 4.16Å; F641-H646 HydrophobicContact CD1-CB 3.75Å; F641-H646 HydrophobicContact CG-CB 4.19Å; R643-H646 WeakPolarHBondContact O-CB 3.42Å; R643-H646 PolarHBondContact O-N 3.28Å; R644-H646 PolarHBondContact O-N 3.42Å; H646-R649 PolarHBondContact ND1-NH1 3.5Å; H646-R649 PolarHBondContact O-N 3.04Å; H646-H650 WeakPolarHBondContact O-CB 3.44Å; H646-H650 PolarHBondContact O-N 3.39Å
647	V	77.7	Confident	68.9	Low	15 Å²	15	85 Å²	85	9%	0.091	41%	0.41	C	S	.	.	H	α-helix	trans	-58.2	-50.7	169.9	179.5	0	0	0	0	111.2	F632 S633 C634 F641 R643 R644 R649 H650 S651	F632-V647 HydrophobicContact CB-CG2 3.5Å; F632-V647 WeakPolarHBondContact O-CG2 3.4Å; S633-V647 VanDerWaalsContact O-CG1 3.23Å; S633-V647 WeakPolarHBondContact O-CG1 3.14Å; S633-V647 VanDerWaalsContact O-CG2 3.3Å; S633-V647 WeakPolarHBondContact O-CG2 3.31Å; C634-V647 HydrophobicContact CB-CG1 4.27Å; F641-V647 HydrophobicContact CB-CG2 3.93Å; F641-V647 HydrophobicContact CD2-CG2 3.74Å; F641-V647 HydrophobicContact CG-CG2 4.1Å; R643-V647 PolarHBondContact O-N 3.45Å; R644-V647 PolarHBondContact O-N 3.37Å; V647-R649 PolarHBondContact O-N 2.69Å; V647-R649 VanDerWaalsContact O-N 3.16Å; V647-H650 CarbonylContact O-C 3.56Å; V647-H650 WeakPolarHBondContact O-CA 3.41Å; V647-H650 PolarHBondContact O-N 2.99Å; V647-S651 PolarHBondContact O-N 2.73Å; V647-S651 PolarHBondContact O-OG 2.89Å
648	K	75.5	Confident	68.2	Low	162 Å²	162	89.7 Å²	89.7	70%	0.704	43%	0.425	S	S	*	.	H	α-helix	trans	-63.7	-22.6	179.9	-171.9	165.8	-177.3	169.7	0	113.5	R644 S651	R644-K648 PolarHBondContact O-N 3.02Å; K648-S651 PolarHBondContact O-OG 3.36Å
649	R	73.3	Confident	68.1	Low	100 Å²	100	90.9 Å²	90.9	38%	0.377	42%	0.415	S	S	.	.	H	α-helix	trans	-81.7	-28.2	170.6	-166.3	-175.9	-58.3	102.2	4.6	112.3	E645 H646 V647 L671	E645-R649 PolarHBondContact O-NH1 3.41Å; H646-R649 PolarHBondContact ND1-NH1 3.5Å; H646-R649 PolarHBondContact O-N 3.04Å; V647-R649 PolarHBondContact O-N 2.69Å; V647-R649 VanDerWaalsContact O-N 3.16Å; R649-L671 HydrophobicContact CG-CD1 3.95Å
650	H	77.6	Confident	67.7	Low	29 Å²	29	88.5 Å²	88.5	13%	0.134	40%	0.403	C	S	.	.	H	α-helix	trans	-83.9	-32.7	179.2	-174.9	47.9	0	0	0	113.2	C637 F641 H646 V647 L652 V653 H654	C637-H650 PolarHBondContact SG-NE2 3.25Å; F641-H650 HydrophobicContact CE1-CB 4.26Å; F641-H650 HydrophobicContact CE2-CB 3.99Å; F641-H650 AromaticContact CE2-CD2 3.49Å; F641-H650 VanDerWaalsContact CE2-CD2 3.49Å; F641-H650 WeakPolarHBondContact CE2-CD2 3.3Å; F641-H650 AromaticContact CE2-CG 3.89Å; F641-H650 HydrophobicContact CZ-CB 3.6Å; F641-H650 AromaticContact CZ-CD2 3.43Å; F641-H650 VanDerWaalsContact CZ-CD2 3.43Å; F641-H650 WeakPolarHBondContact CZ-CD2 3.44Å; F641-H650 AromaticContact CZ-CG 3.44Å; F641-H650 VanDerWaalsContact CZ-CG 3.44Å; H646-H650 WeakPolarHBondContact O-CB 3.44Å; H646-H650 PolarHBondContact O-N 3.39Å; V647-H650 CarbonylContact O-C 3.56Å; V647-H650 WeakPolarHBondContact O-CA 3.41Å; V647-H650 PolarHBondContact O-N 2.99Å; H650-L652 PolarHBondContact O-N 3.18Å; H650-V653 WeakPolarHBondContact O-CB 3.29Å; H650-V653 PolarHBondContact O-N 3.47Å; H650-H654 AromaticContact CD2-NE2 3.76Å; H650-H654 AromaticContact CE1-NE2 3.51Å; H650-H654 AromaticContact NE2-CE1 3.97Å; H650-H654 AromaticContact NE2-NE2 3.12Å; H650-H654 PolarHBondContact NE2-NE2 3.38Å; H650-H654 VanDerWaalsContact NE2-NE2 3.12Å
651	S	69.3	Low	67.5	Low	29 Å²	29	87.3 Å²	87.3	20%	0.203	39%	0.394	C	S	.	.	H	α-helix	trans	-63.6	-25	174.6	55.1	0	0	0	0	113.2	V647 K648 V653 H654 K655	V647-S651 PolarHBondContact O-N 2.73Å; V647-S651 PolarHBondContact O-OG 2.89Å; K648-S651 PolarHBondContact O-OG 3.36Å; S651-V653 PolarHBondContact O-N 3.44Å; S651-H654 PolarHBondContact O-N 2.71Å; S651-H654 VanDerWaalsContact O-N 3.14Å; S651-K655 PolarHBondContact O-N 3.27Å
652	L	69.7	Low	67.4	Low	88 Å²	88	85 Å²	85	46%	0.461	38%	0.384	S	S	.	.	H	α-helix	trans	-68.4	-4	168	-70.2	165.9	0	0	0	114.5	H650	H650-L652 PolarHBondContact O-N 3.18Å
653	V	63.9	Low	67.2	Low	59 Å²	59	88.2 Å²	88.2	36%	0.358	40%	0.398	S	S	.	.	H	α-helix	trans	-87.4	-28.4	169.3	176.8	0	0	0	0	111.3	H650 S651 M670	H650-V653 WeakPolarHBondContact O-CB 3.29Å; H650-V653 PolarHBondContact O-N 3.47Å; S651-V653 PolarHBondContact O-N 3.44Å; V653-M670 HydrophobicContact CB-CE 4.45Å; V653-M670 HydrophobicContact CB-SD 4.04Å; V653-M670 HydrophobicContact CG1-CE 3.91Å; V653-M670 HydrophobicContact CG1-SD 3.79Å; V653-M670 HydrophobicContact CG2-CE 4.04Å; V653-M670 HydrophobicContact CG2-SD 4.01Å
654	H	65.2	Low	66.9	Low	63 Å²	63	89.8 Å²	89.8	29%	0.292	41%	0.414	S	S	.	.	H	α-helix	trans	-91	-38	-175.3	-61.7	-65	0	0	0	112.5	I636 C637 H650 S651 K656	I636-H654 HydrophobicContact CB-CB 4.11Å; I636-H654 HydrophobicContact CD1-CB 3.67Å; I636-H654 HydrophobicContact CG1-CB 4.49Å; I636-H654 HydrophobicContact CG2-CB 3.69Å; C637-H654 VanDerWaalsContact SG-CE1 3.59Å; C637-H654 PolarHBondContact SG-NE2 3.35Å; H650-H654 AromaticContact CD2-NE2 3.76Å; H650-H654 AromaticContact CE1-NE2 3.51Å; H650-H654 AromaticContact NE2-CE1 3.97Å; H650-H654 AromaticContact NE2-NE2 3.12Å; H650-H654 PolarHBondContact NE2-NE2 3.38Å; H650-H654 VanDerWaalsContact NE2-NE2 3.12Å; S651-H654 PolarHBondContact O-N 2.71Å; S651-H654 VanDerWaalsContact O-N 3.14Å; H654-K656 PolarHBondContact O-N 3.26Å
655	K	58.5	Low	66.8	Low	132 Å²	132	83.1 Å²	83.1	57%	0.574	40%	0.395	S	S	*	.	S	Bend	trans	-66.9	124.7	162.8	-61.8	-161.6	172.5	-156.4	0	108	S651 D657	S651-K655 PolarHBondContact O-N 3.27Å; K655-D657 WeakPolarHBondContact CB-OD2 3.44Å; K655-D657 PolarHBondContact O-N 3.21Å
656	K	53.9	Low	66.4	Low	196 Å²	196	86 Å²	86	85%	0.852	41%	0.406	S	S	*	.			trans	-72.4	22.9	-175.2	-67.4	177.5	179.5	171.2	0	113.6	H654 K658	H654-K656 PolarHBondContact O-N 3.26Å; K656-K658 VanDerWaalsContact C-N 3.34Å; K656-K658 PolarHBondContact O-N 3.04Å
657	D	48.6	Very low	65.9	Low	110 Å²	110	88.1 Å²	88.1	59%	0.588	41%	0.414	S	S	*	.			trans	-73.3	78.3	-175	-60.7	-28.4	0	0	0	111.3	K655	K655-D657 WeakPolarHBondContact CB-OD2 3.44Å; K655-D657 PolarHBondContact O-N 3.21Å
658	K	55	Low	65.3	Low	146 Å²	146	91.5 Å²	91.5	64%	0.635	43%	0.431	S	S	*	.			trans	-58.7	159.8	162.3	-58.6	168.5	-175.5	167.7	0	108	K656 I668	K656-K658 VanDerWaalsContact C-N 3.34Å; K656-K658 PolarHBondContact O-N 3.04Å; K658-I668 HydrophobicContact CB-CG2 4.32Å; K658-I668 HydrophobicContact CD-CD1 4.28Å; K658-I668 HydrophobicContact CG-CG2 4.2Å
659	K	57.5	Low	64.8	Low	76 Å²	76	85.8 Å²	85.8	33%	0.33	41%	0.406	S	S	.	.			cis	-156.2	117.8	39.1	-60.3	163.8	-173.9	176.1	0	109.8	R683	K659-R683 WeakPolarHBondContact O-CA 3.08Å
660	Y	60.5	Low	64.3	Low	74 Å²	74	86.3 Å²	86.3	29%	0.29	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	102.6	151.8	-63.5	-70.4	0	0	0	108.7	F669 L671 A672 I677 R682 R683	Y660-F669 WeakPolarHBondContact CB-O 3.4Å; Y660-F669 PolarHBondContact N-O 3.1Å; Y660-F669 PolarHBondContact O-N 3.21Å; Y660-L671 VanDerWaalsContact CD2-C 3.49Å; Y660-A672 HydrophobicContact CD1-CB 4.4Å; Y660-A672 HydrophobicContact CE1-CB 3.77Å; Y660-A672 HydrophobicContact CE2-CB 4.1Å; Y660-I677 HydrophobicContact CD1-CD1 3.34Å; Y660-I677 HydrophobicContact CE1-CD1 3.66Å; Y660-I677 HydrophobicContact CG-CD1 4.27Å; Y660-R682 WeakPolarHBondContact CE1-O 3.37Å; Y660-R683 WeakPolarHBondContact CA-O 3.48Å
661	K	64.9	Low	63.5	Low	82 Å²	82	88.2 Å²	88.2	36%	0.357	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.3	-174.7	-172.4	179.1	-176.9	179.2	0	110.8	K666 K667 I668 R683 Y684 G685	K661-K666 WeakPolarHBondContact CE-O 3.33Å; K661-K666 WeakPolarHBondContact CG-O 3.34Å; K661-K667 WeakPolarHBondContact CA-O 3.48Å; K661-I668 HydrophobicContact CG-CG1 4.38Å; K661-R683 PolarHBondContact N-O 3.34Å; K661-Y684 HydrophobicContact CB-CD1 3.88Å; K661-Y684 HydrophobicContact CB-CE1 3.99Å; K661-Y684 HydrophobicContact CD-CE1 4.21Å; K661-Y684 WeakPolarHBondContact O-CA 3.33Å; K661-G685 PolarHBondContact O-N 3.46Å
662	C	73.9	Confident	63	Low	0 Å²	0	89 Å²	89	0%	0	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	131.8	170.6	-177.9	0	0	0	0	110.2	V664 C665 K666 K667 F669 G685 C687	C662-V664 VanDerWaalsContact C-N 3.35Å; C662-V664 PolarHBondContact SG-N 3.39Å; C662-V664 VanDerWaalsContact SG-N 3.43Å; C662-C665 VanDerWaalsContact CB-SG 3.56Å; C662-C665 VanDerWaalsContact SG-SG 3.61Å; C662-K666 WeakPolarHBondContact O-CA 3.05Å; C662-K666 PolarHBondContact O-N 3.3Å; C662-K667 PolarHBondContact N-O 3.03Å; C662-F669 HydrophobicContact CB-CE2 4.03Å; C662-G685 CarbonylContact C-O 3.48Å; C662-G685 VanDerWaalsContact CA-O 3.28Å; C662-G685 WeakPolarHBondContact CA-O 3.39Å; C662-C687 HydrophobicContact CB-CB 4.25Å; C662-C687 PolarHBondContact SG-N 2.9Å; C662-C687 VanDerWaalsContact SG-N 3.36Å; C662-C687 VanDerWaalsContact SG-SG 3.65Å
663	M	68.8	Low	62.6	Low	105 Å²	105	88.7 Å²	88.7	52%	0.517	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-30.6	178.6	-60	-175.9	-55	0	0	112.2	G685 V686	M663-G685 PolarHBondContact N-O 3.41Å; M663-V686 HydrophobicContact CE-CG2 4.12Å
664	V	66.8	Low	62.3	Low	92 Å²	92	88.2 Å²	88.2	56%	0.558	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-68.8	-179.4	-176.5	0	0	0	0	110.8	C662 K666 V686 C690	C662-V664 VanDerWaalsContact C-N 3.35Å; C662-V664 PolarHBondContact SG-N 3.39Å; C662-V664 VanDerWaalsContact SG-N 3.43Å; V664-K666 PolarHBondContact O-N 2.75Å; V664-V686 HydrophobicContact CG2-CG1 4.02Å; V664-V686 HydrophobicContact CG2-CG2 4.26Å; V664-C690 HydrophobicContact CB-CB 3.83Å; V664-C690 HydrophobicContact CG1-CB 3.95Å; V664-C690 HydrophobicContact CG2-CB 4.23Å
665	C	71	Confident	62	Low	45 Å²	45	85.2 Å²	85.2	30%	0.304	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	1	-175.5	66.5	0	0	0	0	115.2	C662 K667 C687 C690	C662-C665 VanDerWaalsContact CB-SG 3.56Å; C662-C665 VanDerWaalsContact SG-SG 3.61Å; C665-K667 HydrophobicContact CB-CG 4.33Å; C665-K667 PolarHBondContact O-N 3.43Å; C665-C687 PolarHBondContact SG-SG 3.34Å; C665-C690 VanDerWaalsContact CB-SG 3.57Å; C665-C690 VanDerWaalsContact SG-SG 3.68Å
666	K	67.4	Low	61.9	Low	139 Å²	139	81.1 Å²	81.1	60%	0.604	42%	0.424	S	S	*	.			trans	58.8	-1.6	178.6	-62.9	174.4	-175.9	173.6	0	116.4	K661 C662 V664	K661-K666 WeakPolarHBondContact CE-O 3.33Å; K661-K666 WeakPolarHBondContact CG-O 3.34Å; C662-K666 WeakPolarHBondContact O-CA 3.05Å; C662-K666 PolarHBondContact O-N 3.3Å; V664-K666 PolarHBondContact O-N 2.75Å
667	K	64.2	Low	61.8	Low	108 Å²	108	73.8 Å²	73.8	47%	0.47	39%	0.394	S	S	.	.			trans	-54.2	144.5	170.8	-64.6	179.9	-169.6	173.2	0	111.1	K661 C662 C665 F669 D689	K661-K667 WeakPolarHBondContact CA-O 3.48Å; C662-K667 PolarHBondContact N-O 3.03Å; C665-K667 HydrophobicContact CB-CG 4.33Å; C665-K667 PolarHBondContact O-N 3.43Å; K667-F669 HydrophobicContact CB-CD2 4.43Å; K667-F669 HydrophobicContact CB-CE2 3.65Å; K667-F669 HydrophobicContact CB-CZ 4.04Å; K667-F669 HydrophobicContact CD-CZ 4.21Å; K667-D689 IonicContact NZ-OD2 2.67Å; K667-D689 PolarHBondContact NZ-OD2 3.48Å
668	I	65.2	Low	61.7	Low	87 Å²	87	79.4 Å²	79.4	45%	0.446	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	132.3	177.3	-54.8	177	0	0	0	109.1	K658 K661	K658-I668 HydrophobicContact CB-CG2 4.32Å; K658-I668 HydrophobicContact CD-CD1 4.28Å; K658-I668 HydrophobicContact CG-CG2 4.2Å; K661-I668 HydrophobicContact CG-CG1 4.38Å
669	F	65.9	Low	60.6	Low	41 Å²	41	82.2 Å²	82.2	18%	0.18	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	155.4	179.3	-58.9	-100.8	0	0	0	110	Y660 C662 K667 V675 C687	Y660-F669 WeakPolarHBondContact CB-O 3.4Å; Y660-F669 PolarHBondContact N-O 3.1Å; Y660-F669 PolarHBondContact O-N 3.21Å; C662-F669 HydrophobicContact CB-CE2 4.03Å; K667-F669 HydrophobicContact CB-CD2 4.43Å; K667-F669 HydrophobicContact CB-CE2 3.65Å; K667-F669 HydrophobicContact CB-CZ 4.04Å; K667-F669 HydrophobicContact CD-CZ 4.21Å; F669-V675 HydrophobicContact CB-CG2 3.84Å; F669-V675 HydrophobicContact CD2-CG2 3.29Å; F669-V675 HydrophobicContact CE2-CG2 3.98Å; F669-V675 HydrophobicContact CG-CG2 3.71Å; F669-C687 HydrophobicContact CE1-CB 4.26Å; F669-C687 HydrophobicContact CE2-CB 3.67Å; F669-C687 HydrophobicContact CZ-CB 3.45Å; F669-C687 VanDerWaalsContact CZ-CB 3.45Å
670	M	61.5	Low	60.1	Low	112 Å²	112	81.9 Å²	81.9	55%	0.552	44%	0.44	S	S	*	.	S	Bend	trans	-95.1	2.3	-178.2	-61	170.7	-70.1	0	0	113.2	V653	V653-M670 HydrophobicContact CB-CE 4.45Å; V653-M670 HydrophobicContact CB-SD 4.04Å; V653-M670 HydrophobicContact CG1-CE 3.91Å; V653-M670 HydrophobicContact CG1-SD 3.79Å; V653-M670 HydrophobicContact CG2-CE 4.04Å; V653-M670 HydrophobicContact CG2-SD 4.01Å
671	L	61	Low	59.5	Low	69 Å²	69	80.6 Å²	80.6	36%	0.361	44%	0.442	S	S	.	.	S	Bend	trans	-142.4	133.5	-174.1	-171.6	65.2	0	0	0	112.9	R649 Y660 A673 S674	R649-L671 HydrophobicContact CG-CD1 3.95Å; Y660-L671 VanDerWaalsContact CD2-C 3.49Å; L671-A673 HydrophobicContact CD2-CB 4.05Å; L671-A673 HydrophobicContact CG-CB 4.07Å; L671-A673 PolarHBondContact O-N 3.12Å; L671-S674 PolarHBondContact O-N 3.46Å; L671-S674 PolarHBondContact O-OG 2.87Å
672	A	60	Low	59	Low	45 Å²	45	87.1 Å²	87.1	37%	0.372	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	4.5	176.2	0	0	0	0	0	116	Y660 V675 I677	Y660-A672 HydrophobicContact CD1-CB 4.4Å; Y660-A672 HydrophobicContact CE1-CB 3.77Å; Y660-A672 HydrophobicContact CE2-CB 4.1Å; A672-V675 CarbonylContact C-O 3.6Å; A672-V675 VanDerWaalsContact O-O 3.06Å; A672-I677 HydrophobicContact CB-CD1 4.05Å
673	A	60.5	Low	58.2	Low	82 Å²	82	91.4 Å²	91.4	68%	0.678	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.9	-20.2	-177.9	0	0	0	0	0	113.2	L671	L671-A673 HydrophobicContact CD2-CB 4.05Å; L671-A673 HydrophobicContact CG-CB 4.07Å; L671-A673 PolarHBondContact O-N 3.12Å
674	S	58.7	Low	57.6	Low	48 Å²	48	90.5 Å²	90.5	34%	0.336	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-22.1	170.4	44.7	0	0	0	0	112.3	L671 C687	L671-S674 PolarHBondContact O-N 3.46Å; L671-S674 PolarHBondContact O-OG 2.87Å; S674-C687 WeakPolarHBondContact O-CA 3.36Å; S674-C687 WeakPolarHBondContact O-CB 3.46Å
675	V	57.9	Low	57.5	Low	0 Å²	0	86.3 Å²	86.3	0%	0	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	119.6	155.7	-175.3	0	0	0	0	107.7	F669 A672 I677 G685	F669-V675 HydrophobicContact CB-CG2 3.84Å; F669-V675 HydrophobicContact CD2-CG2 3.29Å; F669-V675 HydrophobicContact CE2-CG2 3.98Å; F669-V675 HydrophobicContact CG-CG2 3.71Å; A672-V675 CarbonylContact C-O 3.6Å; A672-V675 VanDerWaalsContact O-O 3.06Å; V675-I677 HydrophobicContact CB-CG1 4.14Å; V675-I677 HydrophobicContact CG1-CG1 3.82Å; V675-I677 PolarHBondContact O-N 3.18Å; V675-G685 VanDerWaalsContact CG1-CA 3.41Å
676	G	56	Low	57.4	Low	46 Å²	46	85.8 Å²	85.8	47%	0.474	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	77.7	171.4	0	0	0	0	0	111.2	R678 V686	G676-R678 PolarHBondContact O-N 2.65Å; G676-V686 VanDerWaalsContact CA-O 3.25Å; G676-V686 WeakPolarHBondContact CA-O 3.44Å; G676-V686 PolarHBondContact N-O 2.81Å
677	I	52.3	Low	57.6	Low	43 Å²	43	79.2 Å²	79.2	22%	0.221	41%	0.414	C	S	.	.			trans	-75.7	105.2	179.8	-65.6	170.3	0	0	0	108.7	Y660 A672 V675 S681	Y660-I677 HydrophobicContact CD1-CD1 3.34Å; Y660-I677 HydrophobicContact CE1-CD1 3.66Å; Y660-I677 HydrophobicContact CG-CD1 4.27Å; A672-I677 HydrophobicContact CB-CD1 4.05Å; V675-I677 HydrophobicContact CB-CG1 4.14Å; V675-I677 HydrophobicContact CG1-CG1 3.82Å; V675-I677 PolarHBondContact O-N 3.18Å; I677-S681 WeakPolarHBondContact CG2-O 3.35Å
678	R	47.1	Very low	57.7	Low	227 Å²	227	76.7 Å²	76.7	86%	0.857	41%	0.413	S	S	*	.			trans	-67.5	136.4	165.7	-69.3	-162.1	-89.3	-136.5	0.1	108.8	G676 G680	G676-R678 PolarHBondContact O-N 2.65Å; R678-G680 PolarHBondContact O-N 3.01Å
679	H	32.3	Very low	57.6	Low	205 Å²	205	76.2 Å²	76.2	95%	0.949	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	88.2	-157.2	-165.8	-72.1	0	0	0	113.7
680	G	46	Very low	57.6	Low	70 Å²	70	75.5 Å²	75.5	72%	0.722	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-172.7	-58.6	-179	0	0	0	0	0	114.5	R678	R678-G680 PolarHBondContact O-N 3.01Å
681	S	48.9	Very low	57.8	Low	46 Å²	46	72.5 Å²	72.5	32%	0.322	41%	0.405	S	S	.	.			trans	-90.1	132.5	178.7	-176	0	0	0	0	111.7	I677	I677-S681 WeakPolarHBondContact CG2-O 3.35Å
682	R	54.3	Low	57.6	Low	219 Å²	219	75.7 Å²	75.7	83%	0.826	42%	0.422	S	S	*	.	S	Bend	trans	-86.6	-5.5	179.8	-71.7	-170.6	178.7	-137.5	3.2	114.7	Y660	Y660-R682 WeakPolarHBondContact CE1-O 3.37Å
683	R	56	Low	57.5	Low	91 Å²	91	78 Å²	78	34%	0.343	44%	0.435	S	S	.	.	S	Bend	trans	-126.4	-8.4	-176.9	-62	-159.3	-87.6	-148.2	12.5	114.8	K659 Y660 K661 D709	K659-R683 WeakPolarHBondContact O-CA 3.08Å; Y660-R683 WeakPolarHBondContact CA-O 3.48Å; K661-R683 PolarHBondContact N-O 3.34Å; R683-D709 IonicContact CZ-OD1 3.77Å; R683-D709 IonicContact NE-OD1 3.19Å; R683-D709 PolarHBondContact NE-OD1 2.96Å; R683-D709 VanDerWaalsContact NH2-CB 3.33Å; R683-D709 VanDerWaalsContact NH2-CG 3.27Å; R683-D709 PolarHBondContact NH2-O 3.35Å; R683-D709 IonicContact NH2-OD1 2.79Å; R683-D709 PolarHBondContact NH2-OD1 3.2Å
684	Y	56.8	Low	57.2	Low	86 Å²	86	82.3 Å²	82.3	34%	0.337	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	145.6	-171.5	-53.6	-74.7	0	0	0	113.7	K661	K661-Y684 HydrophobicContact CB-CD1 3.88Å; K661-Y684 HydrophobicContact CB-CE1 3.99Å; K661-Y684 HydrophobicContact CD-CE1 4.21Å; K661-Y684 WeakPolarHBondContact O-CA 3.33Å
685	G	65.8	Low	56.7	Low	4 Å²	4	89.1 Å²	89.1	4%	0.041	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.9	-161.1	177	0	0	0	0	0	113.1	K661 C662 M663 V675	K661-G685 PolarHBondContact O-N 3.46Å; C662-G685 CarbonylContact C-O 3.48Å; C662-G685 VanDerWaalsContact CA-O 3.28Å; C662-G685 WeakPolarHBondContact CA-O 3.39Å; M663-G685 PolarHBondContact N-O 3.41Å; V675-G685 VanDerWaalsContact CG1-CA 3.41Å
686	V	67.4	Low	55.3	Low	34 Å²	34	93.6 Å²	93.6	21%	0.206	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.7	178.7	-174.6	0	0	0	0	109.6	M663 V664 G676 C690 A691	M663-V686 HydrophobicContact CE-CG2 4.12Å; V664-V686 HydrophobicContact CG2-CG1 4.02Å; V664-V686 HydrophobicContact CG2-CG2 4.26Å; G676-V686 VanDerWaalsContact CA-O 3.25Å; G676-V686 WeakPolarHBondContact CA-O 3.44Å; G676-V686 PolarHBondContact N-O 2.81Å; V686-C690 HydrophobicContact CG1-CB 3.73Å; V686-A691 HydrophobicContact CG1-CB 4.4Å
687	C	72.4	Confident	54.2	Low	0 Å²	0	98.1 Å²	98.1	0%	0	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	159.8	177.1	65.2	0	0	0	0	111.6	C662 C665 F669 S674 D689 C690 A691	C662-C687 HydrophobicContact CB-CB 4.25Å; C662-C687 PolarHBondContact SG-N 2.9Å; C662-C687 VanDerWaalsContact SG-N 3.36Å; C662-C687 VanDerWaalsContact SG-SG 3.65Å; C665-C687 PolarHBondContact SG-SG 3.34Å; F669-C687 HydrophobicContact CE1-CB 4.26Å; F669-C687 HydrophobicContact CE2-CB 3.67Å; F669-C687 HydrophobicContact CZ-CB 3.45Å; F669-C687 VanDerWaalsContact CZ-CB 3.45Å; S674-C687 WeakPolarHBondContact O-CA 3.36Å; S674-C687 WeakPolarHBondContact O-CB 3.46Å; C687-D689 VanDerWaalsContact C-N 3.33Å; C687-D689 PolarHBondContact O-N 3.36Å; C687-C690 CarbonylContact O-C 3.54Å; C687-C690 PolarHBondContact O-N 2.94Å; C687-C690 VanDerWaalsContact SG-SG 3.68Å; C687-A691 PolarHBondContact O-N 3.18Å
688	A	65.6	Low	54.2	Low	55 Å²	55	104.5 Å²	104.5	46%	0.455	55%	0.552	S	S	.	*	H	α-helix	trans	-50.7	-50.8	-177.4	0	0	0	0	0	112.3	C690 A691 D692	A688-C690 PolarHBondContact O-N 3.1Å; A688-A691 WeakPolarHBondContact O-CB 3.45Å; A688-A691 PolarHBondContact O-N 3.02Å; A688-D692 PolarHBondContact O-N 2.92Å; A688-D692 VanDerWaalsContact O-N 3.14Å
689	D	63.9	Low	53.8	Low	78 Å²	78	102.6 Å²	102.6	42%	0.417	55%	0.553	S	S	.	*	H	α-helix	trans	-49.5	-33.2	177.9	-19.5	-15.3	0	0	0	113.1	K667 C687 S693	K667-D689 IonicContact NZ-OD2 2.67Å; K667-D689 PolarHBondContact NZ-OD2 3.48Å; C687-D689 VanDerWaalsContact C-N 3.33Å; C687-D689 PolarHBondContact O-N 3.36Å; D689-S693 VanDerWaalsContact O-CB 3.29Å; D689-S693 WeakPolarHBondContact O-CB 3.35Å; D689-S693 PolarHBondContact O-OG 3.02Å
690	C	65.6	Low	54	Low	25 Å²	25	96.1 Å²	96.1	17%	0.169	54%	0.542	C	S	.	.	H	α-helix	trans	-100.3	-6.5	-178.6	-64	0	0	0	0	114.2	V664 C665 V686 C687 A688	V664-C690 HydrophobicContact CB-CB 3.83Å; V664-C690 HydrophobicContact CG1-CB 3.95Å; V664-C690 HydrophobicContact CG2-CB 4.23Å; C665-C690 VanDerWaalsContact CB-SG 3.57Å; C665-C690 VanDerWaalsContact SG-SG 3.68Å; V686-C690 HydrophobicContact CG1-CB 3.73Å; C687-C690 CarbonylContact O-C 3.54Å; C687-C690 PolarHBondContact O-N 2.94Å; C687-C690 VanDerWaalsContact SG-SG 3.68Å; A688-C690 PolarHBondContact O-N 3.1Å
691	A	65.4	Low	53.7	Low	50 Å²	50	101.5 Å²	101.5	41%	0.413	55%	0.553	S	S	.	*	H	α-helix	trans	-83.8	-33.7	169	0	0	0	0	0	110.9	V686 C687 A688 H694	V686-A691 HydrophobicContact CG1-CB 4.4Å; C687-A691 PolarHBondContact O-N 3.18Å; A688-A691 WeakPolarHBondContact O-CB 3.45Å; A688-A691 PolarHBondContact O-N 3.02Å; A691-H694 PolarHBondContact O-CD2 3.14Å
692	D	57.8	Low	53.2	Low	135 Å²	135	108.7 Å²	108.7	72%	0.722	58%	0.582	S	S	*	*	H	α-helix	trans	-86.7	-29	-178.1	-56	-36.8	0	0	0	112.2	A688 H694	A688-D692 PolarHBondContact O-N 2.92Å; A688-D692 VanDerWaalsContact O-N 3.14Å; D692-H694 VanDerWaalsContact C-N 3.32Å; D692-H694 PolarHBondContact O-N 3.16Å
693	S	58.1	Low	52.5	Low	93 Å²	93	101.9 Å²	101.9	65%	0.65	58%	0.579	S	S	*	*			trans	-85.8	55.4	-177.1	-55.8	0	0	0	0	113.9	D689 Q695	D689-S693 VanDerWaalsContact O-CB 3.29Å; D689-S693 WeakPolarHBondContact O-CB 3.35Å; D689-S693 PolarHBondContact O-OG 3.02Å; S693-Q695 PolarHBondContact O-N 3.13Å
694	H	54	Low	51.4	Low	173 Å²	173	105.7 Å²	105.7	80%	0.801	60%	0.603	S	S	*	*			trans	-76.7	28.9	-173.4	-115.5	-64.5	0	0	0	115.2	A691 D692	A691-H694 PolarHBondContact O-CD2 3.14Å; D692-H694 VanDerWaalsContact C-N 3.32Å; D692-H694 PolarHBondContact O-N 3.16Å
695	Q	47.3	Very low	50.4	Low	191 Å²	191	110.4 Å²	110.4	89%	0.893	63%	0.629	S	S	*	*			trans	-132.3	63	-166.7	-160.7	165.6	9.1	0	0	114.3	S693	S693-Q695 PolarHBondContact O-N 3.13Å
696	A	27.9	Very low	48.9	Very low	94 Å²	94	119.1 Å²	119.1	78%	0.777	67%	0.665	S	S	*	*	S	Bend	trans	-140.8	150.9	153	0	0	0	0	0	108.6
697	T	33.3	Very low	47.6	Very low	141 Å²	141	122.7 Å²	122.7	87%	0.865	69%	0.689	S	S	*	*			trans	-45.9	146.1	-167	43	0	0	0	0	117
698	Q	52.5	Low	46.2	Very low	177 Å²	177	130.7 Å²	130.7	83%	0.827	72%	0.72	S	S	*	*	S	Bend	trans	-43.8	167.2	157.2	-170.1	170.7	-9.4	0	0	113.4
699	E	38.3	Very low	44.9	Very low	187 Å²	187	132.1 Å²	132.1	87%	0.874	72%	0.719	S	S	*	*			trans	81.4	125.7	-178.3	-52.6	175.7	-168.9	0	0	115
700	G	36.5	Very low	43.6	Very low	70 Å²	70	134.1 Å²	134.1	72%	0.722	73%	0.73	S	S	*	*			trans	119	-3.4	177.6	0	0	0	0	0	117.3
701	L	39.7	Very low	42.2	Very low	182 Å²	182	138.1 Å²	138.1	95%	0.953	75%	0.75	S	S	*	*	S	Bend	trans	-98.8	5.6	176.7	-76.6	174.4	0	0	0	114.9
702	E	38.7	Very low	40.8	Very low	197 Å²	197	142.9 Å²	142.9	92%	0.921	76%	0.762	S	S	*	*	S	Bend	trans	-107.5	112	166.1	-63.1	-169.9	141.6	0	0	108.3
703	G	39.2	Very low	39.7	Very low	76 Å²	76	143.2 Å²	143.2	78%	0.784	76%	0.763	S	S	*	*	S	Bend	trans	138.2	-16.3	171.2	0	0	0	0	0	117.8	E705	G703-E705 PolarHBondContact O-N 3.44Å
704	M	34.5	Very low	38.7	Very low	172 Å²	172	144.3 Å²	144.3	85%	0.847	77%	0.766	S	S	*	*			trans	-87.8	103	173.2	-78.5	-167.4	168.8	0	0	111.4
705	E	34	Very low	37.6	Very low	185 Å²	185	144.7 Å²	144.7	86%	0.864	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-62.3	154.7	164	-63.5	-167.1	119.9	0	0	111.1	G703 P707	G703-E705 PolarHBondContact O-N 3.44Å; E705-P707 WeakPolarHBondContact O-CD 3.2Å
706	F	35.1	Very low	37	Very low	186 Å²	186	143.8 Å²	143.8	82%	0.816	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-86.8	118.1	178.6	-63.7	-96.7	0	0	0	109.6
707	P	40.1	Very low	37.2	Very low	109 Å²	109	144.2 Å²	144.2	71%	0.708	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-55.8	147.1	159.9	-19.3	32.5	0	0	0	109	E705	E705-P707 WeakPolarHBondContact O-CD 3.2Å
708	R	42.8	Very low	37.4	Very low	169 Å²	169	146.8 Å²	146.8	64%	0.638	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-78.8	166.5	177.8	-63.1	-173.3	-177.8	172.8	6.9	109.3	D710 D711	R708-D710 HydrophobicContact CB-CB 4.28Å; R708-D710 WeakPolarHBondContact CB-OD2 3.47Å; R708-D710 PolarHBondContact O-N 3.15Å; R708-D710 VanDerWaalsContact O-N 3.15Å; R708-D711 PolarHBondContact N-OD2 3.42Å
709	D	38.2	Very low	36.4	Very low	84 Å²	84	141.7 Å²	141.7	45%	0.449	77%	0.765	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.4	1.3	174.6	-89.4	-54.5	0	0	0	112.4	R683	R683-D709 IonicContact CZ-OD1 3.77Å; R683-D709 IonicContact NE-OD1 3.19Å; R683-D709 PolarHBondContact NE-OD1 2.96Å; R683-D709 VanDerWaalsContact NH2-CB 3.33Å; R683-D709 VanDerWaalsContact NH2-CG 3.27Å; R683-D709 PolarHBondContact NH2-O 3.35Å; R683-D709 IonicContact NH2-OD1 2.79Å; R683-D709 PolarHBondContact NH2-OD1 3.2Å
710	D	37.6	Very low	36	Very low	120 Å²	120	141.5 Å²	141.5	64%	0.642	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-26.1	-177.2	-44.7	-54.7	0	0	0	113.1	R708 F712	R708-D710 HydrophobicContact CB-CB 4.28Å; R708-D710 WeakPolarHBondContact CB-OD2 3.47Å; R708-D710 PolarHBondContact O-N 3.15Å; R708-D710 VanDerWaalsContact O-N 3.15Å; D710-F712 PolarHBondContact O-N 3.03Å
711	D	35.3	Very low	35.8	Very low	110 Å²	110	147.5 Å²	147.5	59%	0.588	77%	0.773	S	S	*	*			trans	-79	51.1	-173.9	-52.7	-59.7	0	0	0	112.8	R708	R708-D711 PolarHBondContact N-OD2 3.42Å
712	F	35.5	Very low	35.2	Very low	149 Å²	149	142.4 Å²	142.4	65%	0.654	76%	0.764	S	S	*	*			trans	-150.9	56.4	-176.2	-133.2	-74.3	0	0	0	114.1	D710	D710-F712 PolarHBondContact O-N 3.03Å
713	D	34.9	Very low	34.8	Very low	142 Å²	142	142.4 Å²	142.4	76%	0.759	76%	0.764	S	S	*	*			trans	-54	148.9	160.2	-70.4	-58.6	0	0	0	111.1	E715	D713-E715 PolarHBondContact O-N 3.5Å
714	V	36.7	Very low	34.5	Very low	116 Å²	116	147.6 Å²	147.6	70%	0.703	77%	0.768	S	S	*	*			trans	-91.6	92.1	175.8	-176.1	0	0	0	0	107.6	E716	V714-E716 VanDerWaalsContact C-N 3.29Å; V714-E716 HydrophobicContact CG1-CG 3.81Å; V714-E716 PolarHBondContact O-N 3.21Å
715	E	31.8	Very low	34.8	Very low	182 Å²	182	144.5 Å²	144.5	85%	0.85	76%	0.761	S	S	*	*			trans	-62.7	91.7	163.1	-68.8	-89.4	139.9	0	0	108.6	D713 A717	D713-E715 PolarHBondContact O-N 3.5Å; E715-A717 PolarHBondContact O-N 2.97Å
716	E	35.6	Very low	34.5	Very low	172 Å²	172	141.2 Å²	141.2	80%	0.804	75%	0.753	S	S	*	*			trans	-75.4	104.3	165.9	-64.3	-160.3	134.2	0	0	108.2	V714 E718	V714-E716 VanDerWaalsContact C-N 3.29Å; V714-E716 HydrophobicContact CG1-CG 3.81Å; V714-E716 PolarHBondContact O-N 3.21Å; E716-E718 PolarHBondContact O-N 2.72Å
717	A	32.1	Very low	34.2	Very low	102 Å²	102	139.4 Å²	139.4	84%	0.843	75%	0.752	S	S	*	*			trans	-83.8	106.1	175.3	0	0	0	0	0	109.7	E715	E715-A717 PolarHBondContact O-N 2.97Å
718	E	36.6	Very low	33.6	Very low	196 Å²	196	140.3 Å²	140.3	92%	0.916	75%	0.751	S	S	*	*			trans	-74.9	163.2	169.5	-64.7	-167.5	156.3	0	0	112.4	E716	E716-E718 PolarHBondContact O-N 2.72Å
719	G	30.6	Very low	32.9	Very low	70 Å²	70	138.1 Å²	138.1	72%	0.722	75%	0.752	S	S	*	*			trans	125.8	128.9	177.2	0	0	0	0	0	113
720	E	31.1	Very low	32.7	Very low	182 Å²	182	141.8 Å²	141.8	85%	0.85	77%	0.767	S	S	*	*			cis	-146.7	143	-0.6	-74	175.8	138	0	0	110.9
721	E	31.2	Very low	32.3	Very low	197 Å²	197	140.6 Å²	140.6	92%	0.921	77%	0.768	S	S	*	*			trans	53.4	142.2	146.7	-59.3	-174.4	171.8	0	0	122.9
722	G	28.3	Very low	32	Very low	74 Å²	74	141.6 Å²	141.6	76%	0.763	77%	0.773	S	S	*	*			trans	177.1	32.2	-178.5	0	0	0	0	0	118.6
723	E	29.9	Very low	31.7	Very low	198 Å²	198	145 Å²	145	93%	0.925	78%	0.781	S	S	*	*			trans	55.7	115	163.3	-58	-176.2	163.2	0	0	120.5
724	E	32.9	Very low	31.4	Very low	184 Å²	184	141.4 Å²	141.4	86%	0.86	78%	0.778	S	S	*	*			trans	-89.2	164.5	154.3	-92.9	-160.9	166.9	0	0	111.4
725	P	39.9	Very low	31.1	Very low	108 Å²	108	144.3 Å²	144.3	70%	0.701	78%	0.784	S	S	*	*				-145.2	140	119.5	35.5	-20.9	0	0	0	116.8
726	T	28.9	Very low	30.9	Very low	116 Å²	116	140.2 Å²	140.2	71%	0.712	77%	0.774	S	S	*	*			trans	69.8	145.1	148.4	54.8	0	0	0	0	118.8
727	D	27.6	Very low	30.6	Very low	147 Å²	147	139 Å²	139	79%	0.786	77%	0.774	S	S	*	*			cis	-156.1	158	18.6	-136.7	-13.7	0	0	0	116.4
728	N	27.8	Very low	30.5	Very low	128 Å²	128	138.3 Å²	138.3	68%	0.684	77%	0.767	S	S	*	*			trans	67.8	75	145	-156.4	83	0	0	0	124.2
729	D	29.4	Very low	30.2	Very low	123 Å²	123	135.5 Å²	135.5	66%	0.658	76%	0.764	S	S	*	*				64.8	152.1	107.5	-152.1	19.6	0	0	0	125
730	Q	32.3	Very low	30.2	Very low	162 Å²	162	137 Å²	137	76%	0.757	77%	0.77	S	S	*	*			trans	69.1	144.8	163.1	-77	162.5	63.2	0	0	120.5
731	S	30.9	Very low	30.3	Very low	95 Å²	95	132.7 Å²	132.7	66%	0.664	77%	0.765	S	S	*	*			cis	-165.6	136.3	-8.4	59.6	0	0	0	0	115.2
732	N	27.1	Very low	31.3	Very low	130 Å²	130	128.1 Å²	128.1	70%	0.695	75%	0.752	S	S	*	*				67.1	165.2	123.3	-157.6	32.8	0	0	0	123.7
733	W	30.3	Very low	31.4	Very low	220 Å²	220	131.1 Å²	131.1	83%	0.833	75%	0.751	S	S	*	*			trans	81.1	132.2	176.1	-49.6	99.4	0	0	0	116.5
734	G	28.6	Very low	31.7	Very low	67 Å²	67	130.3 Å²	130.3	69%	0.691	75%	0.747	S	S	*	*			cis	176.3	154.3	-8	0	0	0	0	0	114.3
735	E	30.2	Very low	31.9	Very low	177 Å²	177	133.1 Å²	133.1	83%	0.827	77%	0.768	S	S	*	*			trans	-0.6	155.9	153.7	-62.5	-173.4	93.7	0	0	121.4
736	C	27.7	Very low	31.5	Very low	96 Å²	96	134.4 Å²	134.4	65%	0.649	77%	0.771	S	S	*	*			cis	-171	168.9	-10.2	-109.8	0	0	0	0	111.8
737	N	29.3	Very low	31.6	Very low	148 Å²	148	135.3 Å²	135.3	79%	0.791	77%	0.774	S	S	*	*			trans	55.2	103.1	149.5	-72.1	-19.7	0	0	0	123
738	A	29.4	Very low	31.8	Very low	86 Å²	86	134.7 Å²	134.7	71%	0.711	77%	0.774	S	S	*	*				76.9	144.7	104	0	0	0	0	0	124.1
739	T	30.7	Very low	32.1	Very low	138 Å²	138	135.1 Å²	135.1	85%	0.847	78%	0.779	S	S	*	*			trans	85.4	127.6	148.9	12	0	0	0	0	122
740	A	30.7	Very low	32.2	Very low	102 Å²	102	135.8 Å²	135.8	84%	0.843	79%	0.787	S	S	*	*			trans	74.7	149.3	152.1	0	0	0	0	0	119.9
741	A	33.9	Very low	32.2	Very low	90 Å²	90	134.1 Å²	134.1	74%	0.744	79%	0.789	S	S	*	*			trans	-124	-175.2	174.8	0	0	0	0	0	106.9
742	P	50.8	Low	32.3	Very low	101 Å²	101	136.9 Å²	136.9	66%	0.656	80%	0.797	S	S	*	*			cis	-138.1	-152.9	7.2	31.3	-4.4	0	0	0	113.5
743	D	31.4	Very low	32.7	Very low	137 Å²	137	137.4 Å²	137.4	73%	0.733	81%	0.805	S	S	*	*			trans	94.9	122.3	152.2	-54.3	-27.4	0	0	0	121.1
744	E	35.6	Very low	32.9	Very low	182 Å²	182	130.5 Å²	130.5	85%	0.85	80%	0.803	S	S	*	*			trans	41.3	112.5	147.6	-52.5	-167.1	149.3	0	0	122.3
745	D	37.3	Very low	33.3	Very low	242 Å²	242	136.3 Å²	136.3	100%	1.294	81%	0.813	S	S	*	*				-154.8	0	102.8	-112.1	-21.4	0	0	0	110.2

Retrieved 745 of 745 residues in 86.8 ms (Link to these results)

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